#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jer s LYS 3 N 0.00 1.74 0.15 0.00 2.20 -1.26 -5.01 119.74 117.57 2jer s LYS 3 Ca 0.00 -1.19 -0.29 0.00 -0.36 0.00 0.00 55.97 54.13 2jer s LYS 3 Cb 0.00 -2.09 -0.07 0.00 -1.51 0.00 0.00 37.83 34.16 2jer s LYS 3 CO 0.00 0.48 0.91 0.50 -0.36 0.00 0.00 175.35 176.88 2jer s ARG 4 N -2.11 4.71 -0.24 4.03 6.06 -1.26 -1.81 118.95 128.33 2jer s ARG 4 Ca 0.17 1.39 -0.16 0.00 -2.50 0.00 0.00 55.73 54.63 2jer s ARG 4 Cb -0.10 -3.33 -0.04 0.00 0.06 0.00 0.00 34.95 31.54 2jer s ARG 4 CO 0.09 0.36 0.42 0.42 -2.50 0.00 0.00 175.30 174.10 2jer s ILE 5 N -0.52 5.16 0.04 4.11 -1.09 0.80 -4.89 121.20 124.81 2jer s ILE 5 Ca 0.43 0.72 0.08 0.00 -2.23 0.00 0.00 60.65 59.64 2jer s ILE 5 Cb -0.24 -3.75 -0.03 0.00 -1.58 0.00 0.00 42.46 36.87 2jer s ILE 5 CO 0.29 0.18 -0.23 0.68 -1.23 0.00 0.00 174.94 174.63 2jer s VAL 6 N 1.79 1.87 0.00 2.92 -7.23 -1.26 -4.54 120.40 113.95 2jer s VAL 6 Ca 0.18 -1.25 0.00 0.00 -1.81 0.00 0.00 61.98 59.11 2jer s VAL 6 Cb -0.15 -1.60 0.00 0.00 0.56 0.00 0.00 36.38 35.18 2jer s VAL 6 CO 0.09 0.30 0.00 0.61 -0.31 0.00 0.00 175.10 175.79 2jer n GLY 7 N 1.90 0.57 3.48 2.32 0.00 -1.26 -5.01 105.19 107.19 2jer n GLY 7 Ca -0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.07 0.07 0.23 1.61 1.04 -1.26 -5.16 113.70 108.16 2jer s SER 8 Ca 0.00 -1.10 0.07 0.00 0.48 0.00 0.00 55.95 55.40 2jer s SER 8 Cb 0.00 0.54 -0.05 0.00 0.10 0.00 0.00 66.02 66.61 2jer s SER 8 CO 0.00 -1.08 -0.11 0.42 0.98 0.00 0.00 173.24 173.45 2jer s THR 9 N -3.96 1.67 0.22 2.02 -4.23 -1.26 -5.04 115.64 105.06 2jer s THR 9 Ca 0.27 -2.17 -0.10 0.00 -1.18 0.00 0.00 61.69 58.52 2jer s THR 9 Cb 0.01 -2.20 0.21 0.00 1.34 0.00 0.00 72.50 71.86 2jer s THR 9 CO 0.11 -0.48 1.67 -0.65 -0.54 0.00 0.00 174.62 174.73 2jer h PRO 10 N 2.46 0.14 -0.77 3.99 0.11 -1.82 -1.24 132.00 134.87 2jer h PRO 10 Ca -0.39 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.72 2jer h PRO 10 Cb 1.23 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.26 2jer h PRO 10 CO 0.64 0.10 0.51 -0.22 -0.21 0.00 0.00 178.00 178.82 2jer h LYS 11 N 0.15 1.01 -0.46 1.05 3.64 -1.25 0.09 116.57 120.80 2jer h LYS 11 Ca 0.34 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.63 2jer h LYS 11 Cb 0.56 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 2jer h LYS 11 CO -0.53 0.67 0.15 1.96 -2.27 0.00 0.00 179.45 179.44 2jer h GLN 12 N 1.05 0.67 -0.01 1.90 4.20 -1.64 -2.94 115.11 118.34 2jer h GLN 12 Ca 0.28 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.89 2jer h GLN 12 Cb -0.12 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.54 2jer h GLN 12 CO -0.06 0.58 -0.14 -0.25 -0.67 0.00 0.00 178.83 178.29 2jer n ASP 13 N -4.33 1.30 0.00 1.46 8.00 -0.54 -4.95 116.55 117.48 2jer n ASP 13 Ca 0.03 -1.20 0.00 0.00 0.71 0.00 0.00 54.79 54.34 2jer n ASP 13 Cb 0.18 0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.35 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 1.27 0.55 3.76 0.44 0.00 -0.37 -5.04 105.19 105.80 2jer n GLY 14 Ca 0.15 -0.83 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 2jer n GLY 14 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jer s PHE 15 N -2.00 3.21 0.05 1.61 0.40 -0.12 -4.33 117.98 116.80 2jer s PHE 15 Ca 0.00 0.13 0.02 0.00 -0.60 0.00 0.00 56.93 56.47 2jer s PHE 15 Cb 0.00 -1.67 -0.03 0.00 0.51 0.00 0.00 43.02 41.83 2jer s PHE 15 CO 0.00 0.52 -0.07 -0.98 0.70 0.00 0.00 175.22 175.40 2jer s ARG 16 N -2.02 0.56 -0.25 0.44 1.70 0.06 -3.80 118.95 115.65 2jer s ARG 16 Ca 0.25 -0.87 -0.29 0.00 -0.47 0.00 0.00 55.73 54.35 2jer s ARG 16 Cb -0.12 -0.20 0.01 0.00 -0.57 0.00 0.00 34.95 34.07 2jer s ARG 16 CO 0.17 0.02 1.03 1.41 -1.08 0.00 0.00 175.30 176.85 2jer s MET 17 N -2.12 4.20 0.74 3.89 -2.45 -0.70 -0.44 119.30 122.42 2jer s MET 17 Ca -0.06 1.25 -0.11 0.00 -1.25 0.00 0.00 55.69 55.53 2jer s MET 17 Cb -0.06 -3.66 0.04 0.00 1.25 0.00 0.00 34.83 32.39 2jer s MET 17 CO -0.01 -0.69 1.08 -1.25 1.05 0.00 0.00 175.02 175.19 2jer s PRO 18 N 3.28 2.53 0.72 4.11 0.04 -1.26 -4.15 135.00 140.26 2jer s PRO 18 Ca 0.44 0.94 -0.15 0.00 0.04 0.00 0.00 61.00 62.27 2jer s PRO 18 Cb -0.14 -1.94 0.03 0.00 0.04 0.00 0.00 34.50 32.49 2jer s PRO 18 CO 0.08 -1.39 1.23 0.20 0.04 0.00 0.00 177.00 177.16 2jer s GLY 19 N -3.69 2.44 0.48 0.56 0.00 -1.26 -4.71 107.32 101.13 2jer s GLY 19 Ca 0.60 0.95 0.32 0.00 0.00 0.00 0.00 44.72 46.59 2jer s GLY 19 CO 0.55 1.36 1.97 -2.09 0.00 0.00 0.00 173.10 174.90 2jer h GLU 20 N -0.18 0.00 -0.01 2.90 4.81 -1.91 -1.39 114.58 118.80 2jer h GLU 20 Ca -0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2jer h GLU 20 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 2jer h GLU 20 CO 0.50 0.00 -0.02 1.97 -0.73 0.00 0.00 179.01 180.73 2jer n PHE 21 N -2.79 0.00 -2.36 0.92 1.16 -1.26 -4.56 117.46 108.56 2jer n PHE 21 Ca -0.00 0.00 -0.31 0.00 -1.87 0.00 0.00 57.45 55.27 2jer n PHE 21 Cb 0.20 -0.01 -0.01 0.00 -1.61 0.00 0.00 39.48 38.05 2jer n PHE 21 CO 0.00 0.00 0.00 -1.21 -1.87 0.00 0.00 176.76 173.68 2jer s GLU 22 N -2.04 3.74 0.49 3.97 2.02 -0.53 -4.88 118.70 121.48 2jer s GLU 22 Ca 0.38 0.67 -0.23 0.00 0.02 0.00 0.00 54.97 55.81 2jer s GLU 22 Cb 0.21 -2.21 -0.07 0.00 0.10 0.00 0.00 34.13 32.16 2jer s GLU 22 CO 0.35 -0.31 1.33 -2.30 0.02 0.00 0.00 175.26 174.36 2jer n PRO 23 N -1.99 1.86 -5.28 0.39 -0.02 -1.26 -4.70 135.00 124.01 2jer n PRO 23 Ca 0.05 0.67 -0.31 0.00 -2.02 0.00 0.00 63.50 61.89 2jer n PRO 23 Cb 0.54 -2.52 -0.16 0.00 -0.02 0.00 0.00 33.50 31.34 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 -2.58 2.21 -0.01 -0.52 -0.21 -1.26 -0.82 119.66 116.46 2jer s GLN 24 Ca 0.66 -0.91 -0.18 0.00 0.02 0.00 0.00 55.36 54.96 2jer s GLN 24 Cb -0.45 -2.08 -0.33 0.00 1.00 0.00 0.00 33.01 31.15 2jer s GLN 24 CO 0.54 0.53 0.90 1.49 -2.12 0.00 0.00 175.29 176.64 2jer h GLU 25 N 5.58 0.43 -3.22 2.91 4.57 -0.49 -3.42 114.58 120.93 2jer h GLU 25 Ca -0.41 -0.74 -0.04 0.00 -1.18 0.00 0.00 59.36 56.99 2jer h GLU 25 Cb 1.13 0.27 -0.12 0.00 -0.16 0.00 0.00 28.75 29.87 2jer h GLU 25 CO 0.47 1.35 0.05 0.15 -1.18 0.00 0.00 179.01 179.86 2jer s LYS 26 N -2.53 1.18 0.06 1.92 1.02 -1.10 -4.16 119.74 116.14 2jer s LYS 26 Ca -0.12 -0.62 0.06 0.00 0.02 0.00 0.00 55.97 55.31 2jer s LYS 26 Cb 0.03 0.52 -0.03 0.00 -0.52 0.00 0.00 37.83 37.84 2jer s LYS 26 CO 0.89 -0.49 -0.17 0.08 -0.92 0.00 0.00 175.35 174.74 2jer s VAL 27 N -3.79 1.33 0.17 3.17 1.01 -0.29 -0.43 120.40 121.57 2jer s VAL 27 Ca 0.03 -1.25 0.11 0.00 0.00 0.00 0.00 61.98 60.86 2jer s VAL 27 Cb 0.00 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.13 2jer s VAL 27 CO -0.12 -0.06 -0.21 0.26 0.00 0.00 0.00 175.10 174.98 2jer s TRP 28 N -1.05 2.40 -0.09 5.22 0.52 -0.31 -1.11 118.94 124.52 2jer s TRP 28 Ca 0.02 -0.32 -0.24 0.00 0.02 0.00 0.00 56.10 55.59 2jer s TRP 28 Cb -0.09 -1.21 0.05 0.00 -1.15 0.00 0.00 33.47 31.07 2jer s TRP 28 CO 0.02 0.47 0.55 1.41 0.02 0.00 0.00 176.95 179.43 2jer s MET 29 N -2.58 0.85 -0.10 4.98 1.75 -0.51 -1.71 119.30 121.99 2jer s MET 29 Ca 0.21 0.28 -0.04 0.00 -1.25 0.00 0.00 55.69 54.89 2jer s MET 29 Cb -0.09 0.40 -0.04 0.00 2.84 0.00 0.00 34.83 37.95 2jer s MET 29 CO 0.11 -0.22 0.07 0.42 -0.65 0.00 0.00 175.02 174.74 2jer s ILE 30 N -0.83 4.91 -0.00 10.11 1.01 -1.26 -0.77 121.20 134.38 2jer s ILE 30 Ca -0.09 -0.02 -0.30 0.00 0.00 0.00 0.00 60.65 60.24 2jer s ILE 30 Cb -0.02 -3.11 -0.04 0.00 0.01 0.00 0.00 42.46 39.30 2jer s ILE 30 CO 0.06 0.61 1.10 0.86 0.00 0.00 0.00 174.94 177.57 2jer s TRP 31 N -0.96 3.48 0.32 3.97 -0.11 0.17 -4.80 118.94 121.01 2jer s TRP 31 Ca 0.14 1.46 -0.15 0.00 1.22 0.00 0.00 56.10 58.78 2jer s TRP 31 Cb -0.12 -3.29 -0.09 0.00 -1.50 0.00 0.00 33.47 28.48 2jer s TRP 31 CO 0.03 -0.71 0.73 -1.25 -4.62 0.00 0.00 176.95 171.13 2jer s PRO 32 N 1.36 3.99 0.00 5.86 0.04 -1.26 -4.75 135.00 140.24 2jer s PRO 32 Ca 0.55 0.65 0.00 0.00 0.04 0.00 0.00 61.00 62.24 2jer s PRO 32 Cb -0.24 -2.44 0.00 0.00 0.04 0.00 0.00 34.50 31.86 2jer s PRO 32 CO 0.26 0.16 0.00 -0.85 0.04 0.00 0.00 177.00 176.61 2jer n GLU 33 N -0.37 0.00 -1.95 4.56 0.28 -1.26 -4.75 120.64 117.15 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 -0.46 4.22 0.00 3.44 1.70 -1.26 -4.10 118.95 122.48 2jer s ARG 34 Ca 0.00 2.32 0.27 0.00 -0.47 0.00 0.00 55.73 57.85 2jer s ARG 34 Cb 0.00 -3.36 1.29 0.00 -0.57 0.00 0.00 34.95 32.30 2jer s ARG 34 CO 0.00 -0.65 1.90 -0.35 -1.08 0.00 0.00 175.30 175.12 2jer n PRO 35 N 4.71 0.25 -0.16 3.89 -0.04 -1.26 -1.02 135.00 141.37 2jer n PRO 35 Ca 0.15 0.03 0.10 0.00 -0.04 0.00 0.00 63.50 63.74 2jer n PRO 35 Cb 0.40 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.64 2jer n PRO 35 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2jer n ASP 36 N -1.36 2.33 0.00 3.54 5.75 -1.26 -0.71 116.55 124.83 2jer n ASP 36 Ca 0.11 -1.87 0.00 0.00 -0.01 0.00 0.00 54.79 53.01 2jer n ASP 36 Cb 0.25 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.13 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 0.76 0.06 -4.67 -1.12 4.05 -1.00 -4.73 115.26 108.61 2jer n ASN 37 Ca 0.17 0.00 -0.37 0.00 0.45 0.00 0.00 54.58 54.82 2jer n ASN 37 Cb 0.41 0.00 -0.08 0.00 1.23 0.00 0.00 39.78 41.34 2jer n ASN 37 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 2jer s TRP 38 N -2.00 3.35 0.73 1.20 0.52 -0.19 -4.76 118.94 117.79 2jer s TRP 38 Ca 0.00 0.46 -0.14 0.00 0.02 0.00 0.00 56.10 56.43 2jer s TRP 38 Cb 0.00 -2.42 0.04 0.00 -1.15 0.00 0.00 33.47 29.93 2jer s TRP 38 CO 0.00 0.02 1.17 -0.98 0.02 0.00 0.00 176.95 177.18 2jer s ARG 39 N 1.22 2.22 -1.46 4.98 1.70 -1.26 -3.47 118.95 122.88 2jer s ARG 39 Ca 0.14 1.63 -0.10 0.00 -0.47 0.00 0.00 55.73 56.93 2jer s ARG 39 Cb -0.14 -1.86 0.04 0.00 -0.57 0.00 0.00 34.95 32.42 2jer s ARG 39 CO 0.07 -1.74 0.94 -0.25 -1.08 0.00 0.00 175.30 173.23 2jer n ASP 40 N -2.78 -5.53 -2.40 -2.89 8.00 -0.54 -1.62 116.55 108.80 2jer n ASP 40 Ca 0.12 -0.57 -0.17 0.00 0.71 0.00 0.00 54.79 54.89 2jer n ASP 40 Cb 0.51 -4.41 -0.01 0.00 -0.02 0.00 0.00 41.12 37.19 2jer n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jer n GLY 41 N -1.72 -0.45 2.41 0.44 0.00 -1.23 -1.68 105.19 102.96 2jer n GLY 41 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2jer n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jer n GLY 42 N -0.90 0.75 0.08 -0.02 0.00 -0.64 -4.80 105.19 99.67 2jer n GLY 42 Ca -0.20 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.70 2jer n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jer h LYS 43 N 2.10 -0.10 -0.73 1.61 1.79 -1.44 0.35 116.57 120.15 2jer h LYS 43 Ca 0.00 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2jer h LYS 43 Cb 0.00 0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 30.64 2jer h LYS 43 CO 0.00 -0.05 0.46 -1.35 -1.08 0.00 0.00 179.45 177.43 2jer h PRO 44 N -0.13 0.97 -0.06 3.15 0.11 -1.83 -2.71 132.00 131.51 2jer h PRO 44 Ca -0.01 -0.08 -0.12 0.00 0.11 0.00 0.00 66.00 65.90 2jer h PRO 44 Cb 0.10 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 30.98 2jer h PRO 44 CO 0.02 0.67 -0.52 -0.24 -0.21 0.00 0.00 178.00 177.72 2jer h VAL 45 N 0.99 1.36 -0.60 3.15 3.04 -1.82 -2.47 116.25 119.91 2jer h VAL 45 Ca 0.26 -1.78 -0.03 0.00 -1.01 0.00 0.00 66.70 64.14 2jer h VAL 45 Cb -0.07 1.90 -0.03 0.00 -2.01 0.00 0.00 31.29 31.08 2jer h VAL 45 CO -0.05 0.52 0.26 1.56 -1.01 0.00 0.00 177.57 178.85 2jer h GLN 46 N 0.12 0.86 -0.62 4.17 4.20 -0.66 0.13 115.11 123.31 2jer h GLN 46 Ca 0.00 -0.12 -0.04 0.00 0.06 0.00 0.00 58.65 58.55 2jer h GLN 46 Cb 0.96 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.55 2jer h GLN 46 CO 0.08 0.69 0.25 1.49 -0.67 0.00 0.00 178.83 180.66 2jer h GLU 47 N 0.85 0.93 -0.28 1.46 4.81 -1.15 -0.30 114.58 120.90 2jer h GLU 47 Ca 0.21 -0.17 -0.04 0.00 -0.13 0.00 0.00 59.36 59.23 2jer h GLU 47 Cb 0.13 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 2jer h GLU 47 CO -0.02 0.78 0.02 0.00 -0.73 0.00 0.00 179.01 179.06 2jer h ALA 48 N 1.10 0.37 -0.78 2.92 0.00 -0.90 -1.43 119.26 120.54 2jer h ALA 48 Ca 0.21 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2jer h ALA 48 Cb 0.20 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2jer h ALA 48 CO -0.02 0.10 0.46 0.74 0.00 0.00 0.00 179.25 180.53 2jer h PHE 49 N 0.28 1.04 -0.52 0.00 -1.00 -0.70 0.08 116.94 116.12 2jer h PHE 49 Ca 0.08 -0.01 0.06 0.00 2.81 0.00 0.00 57.97 60.91 2jer h PHE 49 Cb 0.40 -0.34 -0.05 0.00 3.61 0.00 0.00 35.95 39.56 2jer h PHE 49 CO 0.03 0.71 0.23 1.15 -1.61 0.00 0.00 178.31 178.81 2jer h THR 50 N 1.08 0.88 -0.57 -1.55 2.02 -0.81 0.38 112.91 114.35 2jer h THR 50 Ca 0.28 -0.15 -0.08 0.00 0.77 0.00 0.00 66.41 67.23 2jer h THR 50 Cb -0.02 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 66.77 2jer h THR 50 CO -0.05 0.08 0.05 0.78 0.37 0.00 0.00 175.52 176.75 2jer h ASN 51 N 0.44 0.91 -0.22 4.18 2.35 -0.68 0.88 115.58 123.44 2jer h ASN 51 Ca 0.24 -0.22 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 2jer h ASN 51 Cb 0.22 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 2jer h ASN 51 CO -0.21 0.94 0.06 0.58 -1.65 0.00 0.00 177.43 177.14 2jer h VAL 52 N 0.88 1.21 -0.32 2.81 2.07 -0.59 -1.32 116.25 120.99 2jer h VAL 52 Ca 0.17 -0.67 0.02 0.00 0.82 0.00 0.00 66.70 67.04 2jer h VAL 52 Cb 0.45 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 2jer h VAL 52 CO 0.02 0.21 0.18 0.00 0.02 0.00 0.00 177.57 178.00 2jer h ALA 53 N 0.87 0.40 -0.52 1.67 0.00 -0.62 -1.14 119.26 119.91 2jer h ALA 53 Ca 0.07 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.03 2jer h ALA 53 Cb 0.27 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 2jer h ALA 53 CO 0.00 -0.19 0.25 0.87 0.00 0.00 0.00 179.25 180.18 2jer h LYS 54 N 0.36 0.46 -0.60 0.00 1.57 -0.76 -0.83 116.57 116.78 2jer h LYS 54 Ca 0.13 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2jer h LYS 54 Cb 0.02 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 2jer h LYS 54 CO -0.07 0.31 0.37 0.00 -0.57 0.00 0.00 179.45 179.48 2jer h ALA 55 N 1.30 0.76 -0.53 3.86 0.00 -0.79 -2.74 119.26 121.12 2jer h ALA 55 Ca 0.24 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2jer h ALA 55 Cb 0.18 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2jer h ALA 55 CO -0.19 0.23 0.05 0.82 0.00 0.00 0.00 179.25 180.16 2jer h ILE 56 N 0.81 1.26 -0.01 0.00 2.04 -0.95 -2.96 117.51 117.69 2jer h ILE 56 Ca 0.22 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 65.06 2jer h ILE 56 Cb -0.04 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 36.92 2jer h ILE 56 CO -0.04 0.37 0.09 0.77 0.00 0.00 0.00 178.15 179.34 2jer h SER 57 N 0.79 0.00 0.64 1.72 4.64 -0.84 0.90 113.55 121.39 2jer h SER 57 Ca 0.16 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.45 2jer h SER 57 Cb 0.46 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.55 2jer h SER 57 CO 0.02 0.00 -0.12 1.56 -0.87 0.00 0.00 176.83 177.42 2jer h GLN 58 N 0.00 0.00 0.00 4.77 1.08 -1.47 -3.32 115.11 116.17 2jer h GLN 58 Ca 0.01 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.03 2jer h GLN 58 Cb 0.19 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.59 2jer h GLN 58 CO -0.00 0.12 -1.66 1.19 -0.95 0.00 0.00 178.83 177.52 2jer n PHE 59 N -3.40 0.00 -3.70 2.96 3.72 0.20 -5.07 117.46 112.17 2jer n PHE 59 Ca -0.01 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.27 2jer n PHE 59 Cb 0.30 -0.47 -0.10 0.00 -0.94 0.00 0.00 39.48 38.27 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 -2.23 -0.01 0.21 4.37 2.01 -0.54 -4.74 115.64 114.71 2jer s THR 60 Ca -0.08 0.03 -0.32 0.00 0.31 0.00 0.00 61.69 61.63 2jer s THR 60 Cb 0.03 -0.68 -0.14 0.00 0.01 0.00 0.00 72.50 71.72 2jer s THR 60 CO 0.36 0.01 1.38 -2.65 -0.69 0.00 0.00 174.62 173.03 2jer n PRO 61 N 3.39 1.83 -4.58 4.92 -0.02 -1.26 -3.75 135.00 135.54 2jer n PRO 61 Ca -0.17 0.65 -0.30 0.00 -2.02 0.00 0.00 63.50 61.66 2jer n PRO 61 Cb 0.56 -2.29 -0.12 0.00 -0.02 0.00 0.00 33.50 31.63 2jer n PRO 61 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2jer s MET 62 N -0.19 1.99 -0.02 -0.52 1.75 -1.26 -1.14 119.30 119.91 2jer s MET 62 Ca 0.71 -1.03 -0.01 0.00 -1.25 0.00 0.00 55.69 54.11 2jer s MET 62 Cb -0.71 -2.16 0.02 0.00 2.84 0.00 0.00 34.83 34.82 2jer s MET 62 CO 0.48 0.52 0.04 -0.80 -0.65 0.00 0.00 175.02 174.62 2jer s ASN 63 N -1.60 0.01 -0.04 1.11 0.01 -0.27 -1.93 114.94 112.23 2jer s ASN 63 Ca 0.15 0.08 0.04 0.00 -0.71 0.00 0.00 52.86 52.42 2jer s ASN 63 Cb -0.10 0.01 -0.00 0.00 0.41 0.00 0.00 41.25 41.56 2jer s ASN 63 CO 0.06 -0.09 -0.16 -0.69 -1.51 0.00 0.00 177.10 174.71 2jer s VAL 64 N 0.69 1.37 0.05 1.60 1.01 -0.13 -1.42 120.40 123.56 2jer s VAL 64 Ca -0.06 -0.68 0.05 0.00 0.00 0.00 0.00 61.98 61.30 2jer s VAL 64 Cb -0.08 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 2jer s VAL 64 CO -0.02 0.40 -0.10 0.68 0.00 0.00 0.00 175.10 176.06 2jer s VAL 65 N 0.10 3.40 -0.07 2.92 -7.23 0.05 -1.29 120.40 118.29 2jer s VAL 65 Ca -0.05 -1.04 -0.21 0.00 -1.81 0.00 0.00 61.98 58.88 2jer s VAL 65 Cb -0.12 -2.51 0.04 0.00 0.56 0.00 0.00 36.38 34.35 2jer s VAL 65 CO 0.02 0.27 0.48 0.54 -0.31 0.00 0.00 175.10 176.10 2jer s VAL 66 N -1.07 0.03 0.93 1.32 0.11 0.12 -0.65 120.40 121.18 2jer s VAL 66 Ca 0.18 -0.21 -0.11 0.00 -2.93 0.00 0.00 61.98 58.92 2jer s VAL 66 Cb -0.11 -0.76 0.11 0.00 -1.53 0.00 0.00 36.38 34.09 2jer s VAL 66 CO 0.10 -0.11 0.89 -1.54 -3.33 0.00 0.00 175.10 171.11 2jer n SER 67 N 1.52 -0.50 -0.19 3.54 3.41 -1.22 -0.18 113.62 119.99 2jer n SER 67 Ca -0.19 0.38 -0.02 0.00 -0.26 0.00 0.00 58.87 58.78 2jer n SER 67 Cb 0.56 -1.38 0.04 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 -1.80 -0.05 -0.44 4.33 4.15 -1.97 -1.04 115.11 118.29 2jer h GLN 68 Ca -0.43 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 58.89 2jer h GLN 68 Cb 1.27 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.96 2jer h GLN 68 CO 0.39 -0.03 -0.13 0.37 -1.93 0.00 0.00 178.83 177.50 2jer h GLN 69 N -0.05 0.80 -0.01 1.69 -0.00 -2.01 -3.04 115.11 112.49 2jer h GLN 69 Ca 0.27 -0.28 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 2jer h GLN 69 Cb 0.47 -0.06 0.00 0.00 0.00 0.00 0.00 27.48 27.89 2jer h GLN 69 CO -0.62 0.89 -0.11 1.04 0.00 0.00 0.00 178.83 180.03 2jer n GLN 70 N -4.15 1.44 -0.03 1.69 1.13 -1.06 -4.47 117.38 111.92 2jer n GLN 70 Ca 0.01 -0.91 -0.08 0.00 -1.94 0.00 0.00 57.00 54.07 2jer n GLN 70 Cb 0.38 -1.48 -0.02 0.00 0.11 0.00 0.00 30.24 29.23 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 2.23 -0.40 -0.37 1.08 3.04 -1.07 0.93 116.94 122.38 2jer h PHE 71 Ca 0.00 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.96 2jer h PHE 71 Cb 0.57 0.21 -0.02 0.00 2.56 0.00 0.00 35.95 39.27 2jer h PHE 71 CO 0.00 -0.23 0.18 1.96 -2.02 0.00 0.00 178.31 178.20 2jer h GLN 72 N -0.17 0.53 -0.38 1.11 4.20 -1.81 -0.48 115.11 118.12 2jer h GLN 72 Ca 0.12 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2jer h GLN 72 Cb 0.34 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 2jer h GLN 72 CO -0.30 0.48 0.25 -0.97 -0.67 0.00 0.00 178.83 177.62 2jer h ASN 73 N 0.46 0.44 -0.28 1.46 -1.24 -1.79 -1.46 115.58 113.17 2jer h ASN 73 Ca 0.13 -0.02 0.02 0.00 0.71 0.00 0.00 56.30 57.14 2jer h ASN 73 Cb 0.12 -0.11 -0.02 0.00 0.73 0.00 0.00 38.32 39.04 2jer h ASN 73 CO -0.02 0.32 0.12 0.00 -1.29 0.00 0.00 177.43 176.57 2jer h ARG 75 N 0.26 0.73 -0.37 0.00 9.65 -0.96 -1.87 114.38 121.82 2jer h ARG 75 Ca 0.12 -0.10 -0.12 0.00 -1.10 0.00 0.00 59.98 58.77 2jer h ARG 75 Cb 0.05 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.49 2jer h ARG 75 CO -0.09 0.60 -0.23 -0.09 2.80 0.00 0.00 179.97 182.96 2jer h ARG 76 N 0.72 0.81 -0.30 0.20 9.65 -0.37 -3.29 114.38 121.80 2jer h ARG 76 Ca 0.18 -0.38 -0.12 0.00 -1.10 0.00 0.00 59.98 58.55 2jer h ARG 76 Cb 0.14 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.70 2jer h ARG 76 CO -0.02 1.01 -0.32 1.96 2.80 0.00 0.00 179.97 185.40 2jer h GLN 77 N 0.61 0.65 -6.33 0.20 1.08 -0.46 -3.44 115.11 107.43 2jer h GLN 77 Ca 0.08 -0.30 -0.55 0.00 -1.45 0.00 0.00 58.65 56.43 2jer h GLN 77 Cb 0.79 -0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.17 2jer h GLN 77 CO 0.06 0.89 0.07 -0.51 -0.95 0.00 0.00 178.83 178.39 2jer s LEU 78 N -8.69 4.53 0.75 1.46 1.43 -0.74 -5.06 118.68 112.36 2jer s LEU 78 Ca -0.08 1.41 -0.14 0.00 -1.03 0.00 0.00 54.13 54.29 2jer s LEU 78 Cb 0.13 -3.09 0.05 0.00 0.03 0.00 0.00 46.19 43.31 2jer s LEU 78 CO 0.83 0.19 1.20 -2.16 0.23 0.00 0.00 176.35 176.64 2jer s PRO 79 N -0.85 1.99 0.57 1.29 0.04 -1.26 -4.89 135.00 131.90 2jer s PRO 79 Ca 0.33 1.74 0.34 0.00 0.04 0.00 0.00 61.00 63.46 2jer s PRO 79 Cb -0.21 -1.82 1.73 0.00 0.04 0.00 0.00 34.50 34.24 2jer s PRO 79 CO 0.22 -1.94 2.14 -1.00 0.04 0.00 0.00 177.00 176.46 2jer h PRO 80 N -0.49 0.00 0.00 0.56 0.13 -1.97 -1.68 132.00 128.56 2jer h PRO 80 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 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 0.49 0.05 0.00 1.05 -0.23 0.00 0.00 178.00 179.36 2jer h GLU 81 N 0.00 0.00 -5.57 0.86 9.09 -1.98 -3.40 114.58 113.59 2jer h GLU 81 Ca -0.00 0.00 -0.60 0.00 0.05 0.00 0.00 59.36 58.81 2jer h GLU 81 Cb 0.28 0.00 -0.10 0.00 -1.65 0.00 0.00 28.75 27.28 2jer h GLU 81 CO 0.01 0.00 -0.03 0.42 0.05 0.00 0.00 179.01 179.46 2jer s ILE 82 N -3.49 5.10 0.16 -1.06 1.01 -0.63 -4.60 121.20 117.69 2jer s ILE 82 Ca 0.02 0.98 -0.27 0.00 0.00 0.00 0.00 60.65 61.38 2jer s ILE 82 Cb 0.09 -3.85 -0.08 0.00 0.01 0.00 0.00 42.46 38.63 2jer s ILE 82 CO 0.40 0.18 0.85 -0.89 0.00 0.00 0.00 174.94 175.48 2jer s THR 83 N 1.60 4.34 -0.11 2.92 2.01 -0.82 -4.87 115.64 120.72 2jer s THR 83 Ca 0.25 1.87 0.03 0.00 0.31 0.00 0.00 61.69 64.15 2jer s THR 83 Cb -0.15 -4.22 0.00 0.00 0.01 0.00 0.00 72.50 68.14 2jer s THR 83 CO 0.10 0.47 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.59 2jer s VAL 84 N -0.85 1.93 0.02 3.82 1.01 -1.26 -0.96 120.40 124.11 2jer s VAL 84 Ca 0.39 -0.93 0.08 0.00 0.00 0.00 0.00 61.98 61.52 2jer s VAL 84 Cb -0.24 -1.69 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 2jer s VAL 84 CO 0.28 0.53 -0.24 -0.31 0.00 0.00 0.00 175.10 175.36 2jer s TYR 85 N 0.51 2.39 0.18 5.22 1.51 -0.41 -5.00 117.35 121.75 2jer s TYR 85 Ca -0.15 -0.37 -0.30 0.00 -1.01 0.00 0.00 57.07 55.23 2jer s TYR 85 Cb -0.17 -1.44 -0.08 0.00 -0.11 0.00 0.00 41.96 40.16 2jer s TYR 85 CO 0.05 0.12 1.23 -2.00 -1.11 0.00 0.00 175.55 173.84 2jer s GLU 86 N -1.10 4.46 -0.30 -0.62 2.12 -1.26 -0.70 118.70 121.29 2jer s GLU 86 Ca 0.12 1.92 -0.12 0.00 0.36 0.00 0.00 54.97 57.25 2jer s GLU 86 Cb -0.10 -3.23 0.13 0.00 0.26 0.00 0.00 34.13 31.18 2jer s GLU 86 CO 0.02 -0.15 0.71 1.41 -0.54 0.00 0.00 175.26 176.70 2jer s MET 87 N -0.09 0.56 0.61 4.30 1.75 0.74 -4.74 119.30 122.43 2jer s MET 87 Ca 0.54 1.31 -0.19 0.00 -1.25 0.00 0.00 55.69 56.11 2jer s MET 87 Cb -0.34 0.67 -0.03 0.00 2.84 0.00 0.00 34.83 37.98 2jer s MET 87 CO 0.36 -0.18 1.27 -1.12 -0.65 0.00 0.00 175.02 174.71 2jer s SER 88 N 2.57 4.97 0.12 1.11 0.01 -1.26 -3.40 113.70 117.81 2jer s SER 88 Ca -0.06 2.56 -0.25 0.00 1.31 0.00 0.00 55.95 59.50 2jer s SER 88 Cb -0.10 -2.61 0.07 0.00 0.21 0.00 0.00 66.02 63.59 2jer s SER 88 CO -0.19 -1.76 0.79 0.54 0.41 0.00 0.00 173.24 173.03 2jer s ASN 89 N -1.39 -0.38 -0.18 2.44 2.20 -1.26 -4.58 114.94 111.78 2jer s ASN 89 Ca 0.78 -0.16 0.07 0.00 -0.94 0.00 0.00 52.86 52.62 2jer s ASN 89 Cb -0.35 0.52 -0.16 0.00 -2.00 0.00 0.00 41.25 39.26 2jer s ASN 89 CO 0.38 -0.89 -0.08 0.59 -2.94 0.00 0.00 177.10 174.17 2jer n ASN 90 N -0.36 1.80 -2.47 3.54 3.02 -1.26 -4.79 115.26 114.74 2jer n ASN 90 Ca -0.10 -0.06 -0.10 0.00 -0.03 0.00 0.00 54.58 54.28 2jer n ASN 90 Cb 0.62 0.21 -0.02 0.00 -0.61 0.00 0.00 39.78 39.99 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 -2.88 -1.15 -2.67 6.41 2.03 -1.26 -4.83 116.55 112.20 2jer n ASP 91 Ca -0.32 -2.38 -0.33 0.00 0.52 0.00 0.00 54.79 52.29 2jer n ASP 91 Cb 0.95 2.08 0.02 0.00 -0.72 0.00 0.00 41.12 43.44 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 -1.26 5.70 -3.53 -1.67 0.00 -1.26 -4.86 120.51 113.63 2jer n ALA 92 Ca -0.11 -4.24 -0.27 0.00 0.00 0.00 0.00 53.44 48.82 2jer n ALA 92 Cb 0.44 -1.17 -0.09 0.00 0.00 0.00 0.00 19.45 18.63 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 -0.50 3.33 0.48 0.00 7.02 -1.26 -4.58 117.44 121.93 2jer n TRP 93 Ca 0.45 -4.16 0.12 0.00 -1.02 0.00 0.00 57.50 52.89 2jer n TRP 93 Cb 0.47 -0.56 0.46 0.00 -2.42 0.00 0.00 31.31 29.27 2jer n TRP 93 CO 0.00 0.00 0.00 1.55 -2.02 0.00 0.00 177.69 177.22 2jer n VAL 94 N 1.16 0.75 0.11 -0.99 3.14 -1.26 -1.14 118.33 120.10 2jer n VAL 94 Ca 0.27 0.09 0.05 0.00 -2.96 0.00 0.00 64.34 61.80 2jer n VAL 94 Cb 0.40 -0.98 0.51 0.00 -1.06 0.00 0.00 33.84 32.71 2jer n VAL 94 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 2jer h ARG 95 N 0.00 0.30 0.00 1.45 9.65 -1.74 0.08 114.38 124.12 2jer h ARG 95 Ca 0.00 -0.02 -0.33 0.00 -1.10 0.00 0.00 59.98 58.52 2jer h ARG 95 Cb 0.46 -0.07 -0.06 0.00 -1.39 0.00 0.00 29.97 28.91 2jer h ARG 95 CO 0.00 0.22 -2.26 -0.25 2.80 0.00 0.00 179.97 180.48 2jer n ASP 96 N -4.48 1.25 -0.37 -3.80 8.00 -0.30 -2.51 116.55 114.34 2jer n ASP 96 Ca 0.00 -0.05 0.08 0.00 0.71 0.00 0.00 54.79 55.54 2jer n ASP 96 Cb 0.09 0.41 -0.01 0.00 -0.02 0.00 0.00 41.12 41.59 2jer n ASP 96 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jer s GLY 98 N -2.00 1.57 0.48 0.00 0.00 0.01 -3.54 107.32 103.84 2jer s GLY 98 Ca 0.14 -0.50 -0.20 0.00 0.00 0.00 0.00 44.72 44.15 2jer s GLY 98 CO 0.44 0.15 1.04 2.56 0.00 0.00 0.00 173.10 177.28 2jer s PRO 99 N -5.09 3.83 -0.32 2.90 0.04 -1.26 -4.78 135.00 130.31 2jer s PRO 99 Ca 0.66 1.36 -0.13 0.00 0.04 0.00 0.00 61.00 62.93 2jer s PRO 99 Cb -0.17 -2.11 -0.02 0.00 0.04 0.00 0.00 34.50 32.24 2jer s PRO 99 CO 0.57 -0.41 0.27 -1.12 0.04 0.00 0.00 177.00 176.35 2jer s SER 100 N -1.97 6.10 0.28 6.66 0.01 -0.56 -4.90 113.70 119.31 2jer s SER 100 Ca 0.67 -0.23 -0.25 0.00 1.31 0.00 0.00 55.95 57.45 2jer s SER 100 Cb -0.16 -2.16 -0.09 0.00 0.21 0.00 0.00 66.02 63.82 2jer s SER 100 CO 0.20 -0.22 0.88 -0.36 0.41 0.00 0.00 173.24 174.15 2jer s PHE 101 N 1.83 3.74 0.06 2.43 0.40 -1.26 -0.42 117.98 124.76 2jer s PHE 101 Ca 0.08 1.70 0.06 0.00 -0.60 0.00 0.00 56.93 58.17 2jer s PHE 101 Cb -0.17 -2.85 -0.03 0.00 0.51 0.00 0.00 43.02 40.49 2jer s PHE 101 CO 0.11 0.30 -0.17 0.14 0.70 0.00 0.00 175.22 176.30 2jer s VAL 102 N -1.50 1.34 0.12 -0.44 -7.23 0.34 -4.42 120.40 108.61 2jer s VAL 102 Ca 0.46 -1.19 0.07 0.00 -1.81 0.00 0.00 61.98 59.50 2jer s VAL 102 Cb -0.19 -1.21 -0.04 0.00 0.56 0.00 0.00 36.38 35.50 2jer s VAL 102 CO 0.24 -0.00 -0.16 0.27 -0.31 0.00 0.00 175.10 175.14 2jer s ILE 103 N -0.97 1.43 -1.98 -0.62 -4.36 0.41 -0.63 121.20 114.48 2jer s ILE 103 Ca 0.03 -1.66 0.19 0.00 -0.26 0.00 0.00 60.65 58.95 2jer s ILE 103 Cb -0.09 -1.51 0.37 0.00 1.25 0.00 0.00 42.46 42.48 2jer s ILE 103 CO 0.02 -0.32 1.30 -0.46 0.24 0.00 0.00 174.94 175.72 2jer n ASN 104 N 0.69 3.18 -1.24 4.36 6.94 -0.95 -0.76 115.26 127.49 2jer n ASN 104 Ca -0.17 -1.92 -0.16 0.00 -0.02 0.00 0.00 54.58 52.32 2jer n ASN 104 Cb 0.56 -0.23 -0.07 0.00 -2.36 0.00 0.00 39.78 37.68 2jer n ASN 104 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2jer n ASP 105 N 1.20 -5.47 -1.09 0.53 8.00 -1.26 -4.76 116.55 113.70 2jer n ASP 105 Ca 0.16 0.40 0.05 0.00 0.71 0.00 0.00 54.79 56.11 2jer n ASP 105 Cb 0.53 -4.39 0.11 0.00 -0.02 0.00 0.00 41.12 37.35 2jer n ASP 105 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2jer n HIS 106 N -2.36 0.04 -0.21 1.24 8.25 -1.26 -4.99 115.22 115.93 2jer n HIS 106 Ca -0.16 -1.01 0.00 0.00 -0.26 0.00 0.00 57.72 56.29 2jer n HIS 106 Cb 0.62 -0.20 0.00 0.00 1.12 0.00 0.00 29.99 31.53 2jer n HIS 106 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jer n GLY 107 N -0.29 0.81 3.79 -1.41 0.00 -1.24 -5.06 105.19 101.78 2jer n GLY 107 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.66 2.85 -0.03 1.61 2.02 -1.26 -4.88 118.70 118.35 2jer s GLU 108 Ca 0.00 -0.90 -0.03 0.00 0.02 0.00 0.00 54.97 54.06 2jer s GLU 108 Cb 0.00 -2.62 0.01 0.00 0.10 0.00 0.00 34.13 31.62 2jer s GLU 108 CO 0.00 0.48 0.08 -1.50 0.02 0.00 0.00 175.26 174.34 2jer s ILE 109 N -1.76 -0.00 0.23 -1.63 2.07 -1.26 -2.23 121.20 116.62 2jer s ILE 109 Ca 0.31 0.01 0.02 0.00 -1.41 0.00 0.00 60.65 59.58 2jer s ILE 109 Cb -0.10 -0.13 -0.05 0.00 0.13 0.00 0.00 42.46 42.31 2jer s ILE 109 CO 0.23 0.01 0.04 -0.13 -1.91 0.00 0.00 174.94 173.17 2jer s ARG 110 N 0.12 1.33 0.08 3.50 0.52 0.20 -4.48 118.95 120.22 2jer s ARG 110 Ca -0.01 -1.69 0.08 0.00 -0.52 0.00 0.00 55.73 53.59 2jer s ARG 110 Cb -0.01 -0.43 -0.04 0.00 0.52 0.00 0.00 34.95 34.99 2jer s ARG 110 CO -0.00 -0.18 -0.16 0.20 0.02 0.00 0.00 175.30 175.18 2jer s GLY 111 N -3.29 1.68 -0.22 -3.53 0.00 -0.40 -0.50 107.32 101.05 2jer s GLY 111 Ca 0.31 -1.27 -0.08 0.00 0.00 0.00 0.00 44.72 43.69 2jer s GLY 111 CO 0.10 -1.21 0.08 0.14 0.00 0.00 0.00 173.10 172.21 2jer s VAL 112 N -1.08 4.68 -0.52 1.40 1.01 0.44 -0.63 120.40 125.70 2jer s VAL 112 Ca 0.17 -0.06 -0.07 0.00 0.00 0.00 0.00 61.98 62.03 2jer s VAL 112 Cb -0.11 -3.16 0.13 0.00 0.00 0.00 0.00 36.38 33.25 2jer s VAL 112 CO 0.09 0.38 0.37 -0.62 0.00 0.00 0.00 175.10 175.31 2jer s ASP 113 N 1.08 5.59 0.63 3.32 -1.08 0.12 -1.50 116.67 124.83 2jer s ASP 113 Ca 0.05 -2.20 -0.11 0.00 -0.52 0.00 0.00 52.55 49.77 2jer s ASP 113 Cb -0.14 -1.95 -0.03 0.00 -1.46 0.00 0.00 42.92 39.33 2jer s ASP 113 CO 0.03 -0.58 1.04 0.26 0.52 0.00 0.00 175.17 176.44 2jer s TRP 114 N 0.92 3.59 -0.03 -5.34 0.52 -1.26 -1.37 118.94 115.98 2jer s TRP 114 Ca 0.10 1.28 -0.30 0.00 0.02 0.00 0.00 56.10 57.19 2jer s TRP 114 Cb -0.23 -2.75 -0.04 0.00 -1.15 0.00 0.00 33.47 29.29 2jer s TRP 114 CO -0.03 -0.75 1.30 0.99 0.02 0.00 0.00 176.95 178.49 2jer s THR 115 N -3.19 3.97 -0.13 2.01 2.01 -0.66 -4.84 115.64 114.81 2jer s THR 115 Ca 0.55 1.33 -0.07 0.00 0.31 0.00 0.00 61.69 63.82 2jer s THR 115 Cb -0.11 -3.86 -0.04 0.00 0.01 0.00 0.00 72.50 68.50 2jer s THR 115 CO 0.54 -0.00 0.12 0.12 -0.69 0.00 0.00 174.62 174.71 2jer s PHE 116 N 2.28 3.50 -0.06 4.92 5.36 -1.26 -1.75 117.98 130.97 2jer s PHE 116 Ca 0.60 0.44 0.23 0.00 -0.96 0.00 0.00 56.93 57.24 2jer s PHE 116 Cb -0.28 -1.96 0.44 0.00 -0.34 0.00 0.00 43.02 40.87 2jer s PHE 116 CO 0.24 0.61 1.17 0.27 -1.46 0.00 0.00 175.22 176.06 2jer n ASN 117 N 2.30 1.23 -3.62 6.13 6.94 -1.26 -4.84 115.26 122.13 2jer n ASN 117 Ca -0.19 -2.32 -0.24 0.00 -0.02 0.00 0.00 54.58 51.81 2jer n ASN 117 Cb 0.54 -0.35 0.07 0.00 -2.36 0.00 0.00 39.78 37.68 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 0.13 -1.45 -3.31 -2.53 0.00 -1.26 -0.11 120.51 111.98 2jer n ALA 118 Ca 0.09 0.28 -0.16 0.00 0.00 0.00 0.00 53.44 53.65 2jer n ALA 118 Cb 1.05 -4.76 0.08 0.00 0.00 0.00 0.00 19.45 15.82 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 -4.80 -2.01 0.00 0.00 8.01 -1.26 -1.20 117.44 116.18 2jer n TRP 119 Ca -0.05 0.86 0.00 0.00 -1.31 0.00 0.00 57.50 57.01 2jer n TRP 119 Cb 0.58 -4.84 0.00 0.00 -2.01 0.00 0.00 31.31 25.04 2jer n TRP 119 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2jer n GLY 120 N -1.12 0.27 7.00 6.99 0.00 -1.23 -3.60 105.19 113.51 2jer n GLY 120 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2jer n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jer n GLY 121 N 0.00 2.86 0.18 -0.02 0.00 0.85 -1.73 105.19 107.34 2jer n GLY 121 Ca 0.00 -0.27 0.15 0.00 0.00 0.00 0.00 46.02 45.90 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 0.60 -0.07 0.99 4.77 -1.26 -0.79 117.00 121.24 2jer n LEU 122 Ca 0.00 -0.16 -0.08 0.00 -0.03 0.00 0.00 56.01 55.74 2jer n LEU 122 Cb 0.00 -0.04 -0.05 0.00 -2.33 0.00 0.00 43.42 40.99 2jer n LEU 122 CO 0.00 0.10 -0.07 0.58 -1.33 0.00 0.00 177.39 176.67 2jer h VAL 123 N 0.90 0.59 0.00 4.08 2.07 -1.68 -3.44 116.25 118.77 2jer h VAL 123 Ca 0.00 -1.53 -0.06 0.00 0.82 0.00 0.00 66.70 65.93 2jer h VAL 123 Cb 0.25 1.20 -0.11 0.00 -1.52 0.00 0.00 31.29 31.11 2jer h VAL 123 CO 0.00 0.20 -0.43 -0.90 0.02 0.00 0.00 177.57 176.46 2jer n ASP 124 N -4.64 0.02 -4.57 0.57 5.75 -0.77 -5.03 116.55 107.88 2jer n ASP 124 Ca -0.10 -1.72 -0.28 0.00 -0.01 0.00 0.00 54.79 52.68 2jer n ASP 124 Cb 0.29 -0.07 0.22 0.00 -1.03 0.00 0.00 41.12 40.54 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 -0.93 1.55 0.01 6.12 0.00 0.03 -4.60 107.32 109.50 2jer s GLY 125 Ca 0.07 -0.26 0.22 0.00 0.00 0.00 0.00 44.72 44.76 2jer s GLY 125 CO -0.04 0.43 0.90 1.04 0.00 0.00 0.00 173.10 175.43 2jer n LEU 126 N -4.62 0.64 -3.75 0.66 4.77 -0.34 -4.78 117.00 109.58 2jer n LEU 126 Ca 0.04 -0.21 -0.03 0.00 -0.03 0.00 0.00 56.01 55.78 2jer n LEU 126 Cb 0.56 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.58 2jer n LEU 126 CO 0.58 0.12 0.73 -0.72 -1.33 0.00 0.00 177.39 176.76 2jer s TYR 127 N -3.17 -0.13 -0.10 -1.77 -0.85 -1.24 -0.87 117.35 109.23 2jer s TYR 127 Ca 0.04 -0.17 -0.05 0.00 -0.52 0.00 0.00 57.07 56.37 2jer s TYR 127 Cb 0.15 0.64 0.05 0.00 0.38 0.00 0.00 41.96 43.17 2jer s TYR 127 CO 0.84 -0.82 0.24 0.12 -1.52 0.00 0.00 175.55 174.41 2jer s PHE 128 N -3.27 -0.31 0.65 -3.49 5.36 -1.26 -4.70 117.98 110.95 2jer s PHE 128 Ca 0.12 0.76 0.03 0.00 -0.96 0.00 0.00 56.93 56.89 2jer s PHE 128 Cb -0.01 0.03 0.10 0.00 -0.34 0.00 0.00 43.02 42.80 2jer s PHE 128 CO 0.02 -0.23 0.89 -1.25 -1.46 0.00 0.00 175.22 173.19 2jer s PRO 129 N 1.28 1.99 -0.07 10.12 0.04 -1.26 -4.99 135.00 142.11 2jer s PRO 129 Ca -0.09 -1.29 0.11 0.00 0.04 0.00 0.00 61.00 59.76 2jer s PRO 129 Cb -0.11 -2.47 0.18 0.00 0.04 0.00 0.00 34.50 32.15 2jer s PRO 129 CO -0.08 -1.15 1.09 -2.67 0.04 0.00 0.00 177.00 174.22 2jer n TRP 130 N -2.56 0.00 -0.15 0.56 2.14 -1.26 -4.87 117.44 111.30 2jer n TRP 130 Ca 0.15 -0.55 0.01 0.00 2.07 0.00 0.00 57.50 59.17 2jer n TRP 130 Cb 0.61 -0.11 0.28 0.00 -0.81 0.00 0.00 31.31 31.28 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 0.16 0.75 0.13 -0.67 2.03 -1.99 -1.42 116.42 115.42 2jer h ASP 131 Ca -0.02 -0.03 -0.27 0.00 -0.73 0.00 0.00 57.03 55.97 2jer h ASP 131 Cb 1.25 -0.19 0.03 0.00 -0.83 0.00 0.00 39.33 39.59 2jer h ASP 131 CO 0.01 0.57 -1.15 1.56 -1.03 0.00 0.00 179.24 179.20 2jer h GLN 132 N 0.88 0.55 -0.95 4.15 1.08 -1.91 -3.08 115.11 115.83 2jer h GLN 132 Ca 0.23 -0.77 0.21 0.00 -1.45 0.00 0.00 58.65 56.87 2jer h GLN 132 Cb -0.05 0.26 -0.11 0.00 -0.05 0.00 0.00 27.48 27.52 2jer h GLN 132 CO -0.05 1.34 0.53 -0.44 -0.95 0.00 0.00 178.83 179.27 2jer h ASP 133 N 0.14 0.61 0.91 1.46 3.32 -1.76 -1.07 116.42 120.02 2jer h ASP 133 Ca -0.18 0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.99 2jer h ASP 133 Cb 1.85 0.03 0.00 0.00 0.22 0.00 0.00 39.33 41.43 2jer h ASP 133 CO 0.22 0.15 0.00 -0.67 -1.72 0.00 0.00 179.24 177.22 2jer n ASP 134 N -4.88 0.50 0.01 6.45 2.03 -0.55 -2.06 116.55 118.05 2jer n ASP 134 Ca 0.23 0.59 0.12 0.00 0.52 0.00 0.00 54.79 56.25 2jer n ASP 134 Cb 0.62 -0.71 0.20 0.00 -0.72 0.00 0.00 41.12 40.51 2jer n ASP 134 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2jer n LEU 135 N -2.02 0.57 -0.26 -2.67 4.77 -0.42 -4.47 117.00 112.49 2jer n LEU 135 Ca 0.04 -0.01 -0.03 0.00 -0.03 0.00 0.00 56.01 55.97 2jer n LEU 135 Cb 0.28 -0.21 0.08 0.00 -2.33 0.00 0.00 43.42 41.24 2jer n LEU 135 CO 0.22 0.11 1.16 0.58 -1.33 0.00 0.00 177.39 178.13 2jer h VAL 136 N 0.00 1.12 -0.36 4.08 2.07 -1.31 -1.75 116.25 120.11 2jer h VAL 136 Ca 0.00 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 2jer h VAL 136 Cb 0.54 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 2jer h VAL 136 CO 0.00 0.17 0.21 0.00 0.02 0.00 0.00 177.57 177.97 2jer h ALA 137 N 1.30 0.46 -0.64 1.67 0.00 -1.77 -0.26 119.26 120.02 2jer h ALA 137 Ca 0.29 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 2jer h ALA 137 Cb -0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2jer h ALA 137 CO -0.10 -0.04 0.11 0.37 0.00 0.00 0.00 179.25 179.59 2jer h GLN 138 N 0.46 1.05 -0.53 0.00 4.15 -1.78 -1.48 115.11 116.99 2jer h GLN 138 Ca 0.13 -0.28 -0.11 0.00 0.77 0.00 0.00 58.65 59.15 2jer h GLN 138 Cb 0.02 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.57 2jer h GLN 138 CO -0.02 0.97 -0.11 0.87 -1.93 0.00 0.00 178.83 178.61 2jer h LYS 139 N 0.97 0.99 -0.54 1.69 1.57 -0.76 0.60 116.57 121.09 2jer h LYS 139 Ca 0.19 -0.36 -0.06 0.00 -1.87 0.00 0.00 60.65 58.55 2jer h LYS 139 Cb 0.43 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 2jer h LYS 139 CO 0.01 1.04 0.09 0.82 -0.57 0.00 0.00 179.45 180.85 2jer h ILE 140 N 0.88 1.25 -0.68 1.86 2.04 -0.99 -1.32 117.51 120.55 2jer h ILE 140 Ca 0.14 -0.95 0.03 0.00 1.00 0.00 0.00 64.86 65.08 2jer h ILE 140 Cb 0.67 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 37.52 2jer h ILE 140 CO 0.05 0.34 0.43 0.00 0.00 0.00 0.00 178.15 178.97 2jer h GLU 142 N 0.84 0.14 -0.84 0.00 4.39 -0.58 0.13 114.58 118.67 2jer h GLU 142 Ca 0.27 -0.01 0.13 0.00 0.34 0.00 0.00 59.36 60.09 2jer h GLU 142 Cb 0.01 -0.03 -0.09 0.00 -0.10 0.00 0.00 28.75 28.54 2jer h GLU 142 CO -0.10 0.09 0.45 0.82 -1.16 0.00 0.00 179.01 179.11 2jer h ILE 143 N 0.15 0.80 -0.03 3.13 2.04 -0.79 -0.85 117.51 121.95 2jer h ILE 143 Ca 0.12 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.74 2jer h ILE 143 Cb 0.12 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.25 2jer h ILE 143 CO -0.16 0.13 0.00 -0.62 0.00 0.00 0.00 178.15 177.49 2jer n GLU 144 N -4.82 1.33 -3.56 2.37 -0.58 -0.57 -4.91 120.64 109.90 2jer n GLU 144 Ca 0.16 -0.48 -0.25 0.00 -0.42 0.00 0.00 57.16 56.16 2jer n GLU 144 Cb 0.38 -1.44 0.05 0.00 -0.57 0.00 0.00 31.44 29.85 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 -0.38 -2.51 -4.59 -0.32 8.25 -0.21 -4.99 115.22 110.48 2jer n HIS 145 Ca 0.20 0.86 -0.33 0.00 -0.26 0.00 0.00 57.72 58.19 2jer n HIS 145 Cb 0.22 -4.55 -0.12 0.00 1.12 0.00 0.00 29.99 26.65 2jer n HIS 145 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2jer s VAL 146 N -3.27 3.58 0.53 1.59 -7.23 0.29 -4.94 120.40 110.95 2jer s VAL 146 Ca 0.55 -0.49 -0.19 0.00 -1.81 0.00 0.00 61.98 60.04 2jer s VAL 146 Cb -0.25 -2.52 -0.07 0.00 0.56 0.00 0.00 36.38 34.10 2jer s VAL 146 CO 0.67 0.54 1.07 -1.81 -0.31 0.00 0.00 175.10 175.26 2jer s ASP 147 N -0.03 6.04 0.05 4.85 1.01 -1.26 -4.43 116.67 122.91 2jer s ASP 147 Ca -0.01 1.97 0.02 0.00 0.71 0.00 0.00 52.55 55.24 2jer s ASP 147 Cb -0.14 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.21 2jer s ASP 147 CO 0.03 -0.99 -0.06 -0.94 0.21 0.00 0.00 175.17 173.42 2jer s SER 148 N -2.10 0.82 -0.23 0.27 1.04 -0.75 -1.28 113.70 111.46 2jer s SER 148 Ca 0.68 -0.70 -0.08 0.00 0.48 0.00 0.00 55.95 56.33 2jer s SER 148 Cb -0.18 0.07 -0.04 0.00 0.10 0.00 0.00 66.02 65.97 2jer s SER 148 CO 0.26 -0.32 0.09 -0.31 0.98 0.00 0.00 173.24 173.94 2jer s TYR 149 N -2.16 3.18 -0.21 5.02 1.51 0.20 -0.14 117.35 124.75 2jer s TYR 149 Ca -0.04 -0.11 -0.13 0.00 -1.01 0.00 0.00 57.07 55.78 2jer s TYR 149 Cb -0.05 -2.21 -0.05 0.00 -0.11 0.00 0.00 41.96 39.55 2jer s TYR 149 CO -0.02 -0.12 0.27 0.50 -1.11 0.00 0.00 175.55 175.07 2jer s ARG 150 N 1.17 4.16 -1.08 -0.62 6.06 -1.26 0.12 118.95 127.50 2jer s ARG 150 Ca 0.05 -0.03 -0.14 0.00 -2.50 0.00 0.00 55.73 53.11 2jer s ARG 150 Cb -0.14 -3.51 0.18 0.00 0.06 0.00 0.00 34.95 31.55 2jer s ARG 150 CO 0.04 0.08 1.22 0.95 -2.50 0.00 0.00 175.30 175.10 2jer s THR 151 N 0.97 5.18 0.19 4.11 -4.23 -0.47 -4.97 115.64 116.42 2jer s THR 151 Ca 0.13 -2.47 -0.33 0.00 -1.18 0.00 0.00 61.69 57.85 2jer s THR 151 Cb -0.14 -4.78 -0.14 0.00 1.34 0.00 0.00 72.50 68.79 2jer s THR 151 CO 0.05 -1.45 1.50 0.47 -0.54 0.00 0.00 174.62 174.65 2jer n ASP 152 N 5.20 2.92 -1.70 3.99 8.00 -1.26 -1.79 116.55 131.92 2jer n ASP 152 Ca 0.29 1.11 -0.20 0.00 0.71 0.00 0.00 54.79 56.69 2jer n ASP 152 Cb 0.44 -1.42 -0.08 0.00 -0.02 0.00 0.00 41.12 40.04 2jer n ASP 152 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2jer n ASP 153 N 2.84 -5.36 -3.91 -2.24 8.00 -1.26 -4.95 116.55 109.66 2jer n ASP 153 Ca 0.15 0.43 -0.29 0.00 0.71 0.00 0.00 54.79 55.79 2jer n ASP 153 Cb 0.30 -4.71 -0.16 0.00 -0.02 0.00 0.00 41.12 36.53 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 -2.75 1.96 -0.10 1.24 2.19 -0.74 -5.03 117.98 114.77 2jer s PHE 154 Ca 0.00 -1.32 -0.19 0.00 0.33 0.00 0.00 56.93 55.75 2jer s PHE 154 Cb 0.00 -1.43 -0.04 0.00 -1.31 0.00 0.00 43.02 40.24 2jer s PHE 154 CO 0.00 -0.68 0.50 0.08 1.83 0.00 0.00 175.22 176.95 2jer s VAL 155 N 1.54 5.14 0.00 3.12 1.01 -1.26 -1.66 120.40 128.31 2jer s VAL 155 Ca -0.01 1.01 -0.25 0.00 0.00 0.00 0.00 61.98 62.73 2jer s VAL 155 Cb -0.16 -3.84 0.06 0.00 0.00 0.00 0.00 36.38 32.44 2jer s VAL 155 CO -0.08 0.34 0.57 -0.22 0.00 0.00 0.00 175.10 175.72 2jer s LEU 156 N 0.47 -0.26 0.01 3.92 2.96 -0.72 -4.79 118.68 120.27 2jer s LEU 156 Ca 0.27 0.39 0.08 0.00 -0.22 0.00 0.00 54.13 54.65 2jer s LEU 156 Cb -0.16 2.24 -0.02 0.00 0.50 0.00 0.00 46.19 48.75 2jer s LEU 156 CO 0.12 -0.66 -0.24 -1.61 -1.32 0.00 0.00 176.35 172.64 2jer s GLU 157 N -1.85 1.82 0.48 1.98 8.01 -1.26 -4.57 118.70 123.32 2jer s GLU 157 Ca -0.08 -0.94 0.21 0.00 0.01 0.00 0.00 54.97 54.17 2jer s GLU 157 Cb -0.01 -1.85 1.24 0.00 -4.31 0.00 0.00 34.13 29.20 2jer s GLU 157 CO 0.03 0.49 1.96 0.78 0.01 0.00 0.00 175.26 178.54 2jer h GLY 158 N 5.24 0.32 2.00 -1.39 0.00 -1.61 -1.64 103.07 105.99 2jer h GLY 158 Ca -0.43 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 46.82 2jer h GLY 158 CO 0.46 0.03 0.00 0.61 0.00 0.00 0.00 176.54 177.64 2jer n GLY 159 N -1.59 -1.17 0.23 4.60 0.00 -1.22 -3.38 105.19 102.65 2jer n GLY 159 Ca 0.12 -0.05 0.14 0.00 0.00 0.00 0.00 46.02 46.23 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 -1.61 0.85 -3.83 1.61 3.41 -0.62 -2.53 113.62 110.90 2jer n SER 160 Ca 0.04 -0.88 -0.09 0.00 -0.26 0.00 0.00 58.87 57.69 2jer n SER 160 Cb 0.23 0.03 -0.07 0.00 -0.26 0.00 0.00 64.21 64.13 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 -2.38 0.11 -0.00 7.33 -0.12 -1.22 -4.19 117.98 117.51 2jer s PHE 161 Ca 0.29 -0.52 0.01 0.00 -0.05 0.00 0.00 56.93 56.67 2jer s PHE 161 Cb 0.20 -0.02 -0.00 0.00 -0.63 0.00 0.00 43.02 42.56 2jer s PHE 161 CO 0.46 -0.56 -0.05 -1.01 -0.05 0.00 0.00 175.22 174.02 2jer s HIS 162 N -3.82 0.43 0.15 3.49 3.76 -0.20 -4.88 115.29 114.22 2jer s HIS 162 Ca 0.04 -0.10 0.09 0.00 -0.15 0.00 0.00 55.06 54.95 2jer s HIS 162 Cb 0.04 -0.28 -0.04 0.00 1.11 0.00 0.00 32.58 33.41 2jer s HIS 162 CO -0.11 -0.01 -0.17 0.14 -0.85 0.00 0.00 174.74 173.74 2jer s VAL 163 N -0.18 2.82 -1.78 -0.90 -7.23 -1.26 -0.53 120.40 111.35 2jer s VAL 163 Ca 0.01 -1.64 0.24 0.00 -1.81 0.00 0.00 61.98 58.78 2jer s VAL 163 Cb -0.02 -2.33 0.10 0.00 0.56 0.00 0.00 36.38 34.69 2jer s VAL 163 CO -0.00 0.01 1.32 -0.90 -0.31 0.00 0.00 175.10 175.22 2jer n ASP 164 N 0.53 1.41 0.00 4.85 5.75 -1.04 -4.49 116.55 123.55 2jer n ASP 164 Ca -0.14 -1.12 0.00 0.00 -0.01 0.00 0.00 54.79 53.52 2jer n ASP 164 Cb 0.54 0.34 0.00 0.00 -1.03 0.00 0.00 41.12 40.97 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 1.39 0.82 1.61 6.12 0.00 -1.26 -4.31 105.19 109.56 2jer n GLY 165 Ca 0.10 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.12 2jer n GLY 165 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2jer n GLN 166 N -2.26 1.29 -0.10 1.61 6.02 -1.26 -4.81 117.38 117.87 2jer n GLN 166 Ca 0.00 -2.97 0.00 0.00 -0.01 0.00 0.00 57.00 54.02 2jer n GLN 166 Cb 0.01 -1.09 0.00 0.00 1.02 0.00 0.00 30.24 30.18 2jer n GLN 166 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2jer n GLY 167 N -0.33 0.73 3.32 1.08 0.00 -1.26 -4.57 105.19 104.16 2jer n GLY 167 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.11 2.04 0.05 2.61 2.01 -1.26 -0.70 115.64 118.28 2jer s THR 168 Ca 0.00 -1.32 0.06 0.00 0.31 0.00 0.00 61.69 60.74 2jer s THR 168 Cb 0.00 -1.74 -0.02 0.00 0.01 0.00 0.00 72.50 70.74 2jer s THR 168 CO 0.00 0.37 -0.17 0.54 -0.69 0.00 0.00 174.62 174.66 2jer s VAL 169 N -0.78 1.38 -0.09 3.82 0.11 -0.57 -2.50 120.40 121.77 2jer s VAL 169 Ca 0.11 -1.14 0.04 0.00 -2.93 0.00 0.00 61.98 58.05 2jer s VAL 169 Cb -0.10 -1.23 -0.01 0.00 -1.53 0.00 0.00 36.38 33.51 2jer s VAL 169 CO 0.02 0.06 -0.22 -0.22 -3.33 0.00 0.00 175.10 171.41 2jer s LEU 170 N -1.26 2.22 0.00 2.54 0.20 0.31 -0.27 118.68 122.43 2jer s LEU 170 Ca 0.04 -0.48 -0.02 0.00 0.69 0.00 0.00 54.13 54.36 2jer s LEU 170 Cb -0.09 -1.44 0.01 0.00 -0.43 0.00 0.00 46.19 44.24 2jer s LEU 170 CO 0.02 0.20 0.26 1.07 -0.29 0.00 0.00 176.35 177.61 2jer n THR 171 N 3.26 0.00 -5.04 3.68 5.66 -0.47 -1.04 114.28 120.34 2jer n THR 171 Ca -0.18 -0.77 -0.28 0.00 -3.05 0.00 0.00 64.05 59.77 2jer n THR 171 Cb 0.53 0.51 -0.16 0.00 -1.55 0.00 0.00 70.33 69.66 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 -2.61 1.69 0.24 1.09 -4.23 -1.26 -0.63 115.64 109.93 2jer s THR 172 Ca 0.13 -0.90 -0.06 0.00 -1.18 0.00 0.00 61.69 59.68 2jer s THR 172 Cb -0.01 -1.42 0.22 0.00 1.34 0.00 0.00 72.50 72.63 2jer s THR 172 CO 0.09 0.48 1.88 -0.33 -0.54 0.00 0.00 174.62 176.20 2jer h GLU 173 N 5.83 1.08 -0.96 3.99 5.08 -0.69 -2.33 114.58 126.59 2jer h GLU 173 Ca -0.37 -0.06 0.14 0.00 -1.00 0.00 0.00 59.36 58.07 2jer h GLU 173 Cb 1.15 -0.24 -0.08 0.00 0.50 0.00 0.00 28.75 30.08 2jer h GLU 173 CO 0.48 0.71 0.61 1.98 -1.00 0.00 0.00 179.01 181.78 2jer h MET 174 N 1.11 0.82 0.00 2.33 4.05 -1.54 -1.61 114.93 120.09 2jer h MET 174 Ca 0.36 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.73 2jer h MET 174 Cb 0.01 -0.18 0.00 0.00 -0.80 0.00 0.00 31.60 30.63 2jer h MET 174 CO -0.12 0.54 -0.11 0.00 0.23 0.00 0.00 176.91 177.44 2jer h LEU 176 N -0.82 0.00 -1.51 0.00 3.38 -1.41 -2.43 115.31 112.52 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 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2jer h LEU 176 CO 0.00 0.31 0.00 0.18 0.09 0.00 0.00 178.44 179.02 2jer n LEU 177 N -3.54 2.25 -4.82 1.67 4.32 -0.61 -4.50 117.00 111.77 2jer n LEU 177 Ca -0.00 -0.98 -0.32 0.00 -0.02 0.00 0.00 56.01 54.68 2jer n LEU 177 Cb 0.45 -0.17 -0.01 0.00 -1.62 0.00 0.00 43.42 42.07 2jer n LEU 177 CO 0.35 0.49 0.70 -0.94 -1.22 0.00 0.00 177.39 176.77 2jer s SER 178 N -1.45 6.13 0.44 -1.43 1.04 -0.92 -4.95 113.70 112.55 2jer s SER 178 Ca 0.33 1.70 0.11 0.00 0.48 0.00 0.00 55.95 58.57 2jer s SER 178 Cb 0.18 -2.52 0.99 0.00 0.10 0.00 0.00 66.02 64.77 2jer s SER 178 CO 0.27 -0.93 2.06 -0.08 0.98 0.00 0.00 173.24 175.53 2jer h GLU 179 N 0.58 0.39 -0.01 4.02 4.81 -1.92 -2.66 114.58 119.79 2jer h GLU 179 Ca -0.47 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2jer h GLU 179 Cb 1.20 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.50 2jer h GLU 179 CO 0.59 0.26 0.00 0.41 -0.73 0.00 0.00 179.01 179.54 2jer n GLY 180 N -1.50 -0.67 0.00 1.92 0.00 -1.26 -4.19 105.19 99.48 2jer n GLY 180 Ca 0.04 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.60 0.00 -3.17 1.61 5.12 -1.00 -4.10 116.66 114.52 2jer n ARG 181 Ca 0.21 0.00 -0.24 0.00 -1.93 0.00 0.00 57.85 55.89 2jer n ARG 181 Cb 0.18 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.43 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 -0.29 2.68 0.30 0.55 4.13 -1.25 -4.64 115.26 116.73 2jer n ASN 182 Ca 0.00 -3.29 0.20 0.00 1.68 0.00 0.00 54.58 53.17 2jer n ASN 182 Cb 0.00 -0.62 0.95 0.00 -1.54 0.00 0.00 39.78 38.58 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 3.47 0.00 0.00 3.52 0.13 -1.77 -0.76 132.00 136.59 2jer h PRO 183 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2jer h PRO 183 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 2jer h PRO 183 CO 0.69 0.00 0.00 -0.56 -0.23 0.00 0.00 178.00 177.90 2jer h GLN 184 N 0.00 0.00 -5.88 0.86 -0.00 -1.93 -3.45 115.11 104.71 2jer h GLN 184 Ca 0.00 0.00 -0.63 0.00 -0.00 0.00 0.00 58.65 58.02 2jer h GLN 184 Cb 0.23 0.00 -0.06 0.00 -0.00 0.00 0.00 27.48 27.65 2jer h GLN 184 CO 0.00 0.00 -0.31 -0.51 -0.00 0.00 0.00 178.83 178.01 2jer s LEU 185 N -6.10 4.44 0.80 0.06 1.43 -0.29 -5.10 118.68 113.91 2jer s LEU 185 Ca 0.05 0.77 -0.11 0.00 -1.03 0.00 0.00 54.13 53.80 2jer s LEU 185 Cb 0.07 -2.43 0.07 0.00 0.03 0.00 0.00 46.19 43.93 2jer s LEU 185 CO 0.61 0.35 1.09 -0.94 0.23 0.00 0.00 176.35 177.69 2jer s SER 186 N -1.12 4.42 0.25 2.29 1.04 -1.26 -4.88 113.70 114.44 2jer s SER 186 Ca 0.21 1.53 -0.03 0.00 0.48 0.00 0.00 55.95 58.14 2jer s SER 186 Cb -0.15 -2.28 0.44 0.00 0.10 0.00 0.00 66.02 64.14 2jer s SER 186 CO 0.10 -2.05 1.79 0.50 0.98 0.00 0.00 173.24 174.57 2jer h LYS 187 N -1.14 0.71 -0.66 4.02 3.64 -1.97 -1.37 116.57 119.79 2jer h LYS 187 Ca -0.46 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 58.81 2jer h LYS 187 Cb 1.25 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.88 2jer h LYS 187 CO 0.56 0.47 0.14 0.93 -2.27 0.00 0.00 179.45 179.28 2jer h GLU 188 N 0.73 1.06 -0.62 1.90 3.07 -1.99 0.08 114.58 118.81 2jer h GLU 188 Ca 0.42 -0.25 -0.06 0.00 -0.50 0.00 0.00 59.36 58.97 2jer h GLU 188 Cb 0.46 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 28.21 2jer h GLU 188 CO -0.29 0.95 0.15 0.00 -1.40 0.00 0.00 179.01 178.42 2jer h ALA 189 N 1.15 1.11 -0.31 3.43 0.00 -1.74 -0.98 119.26 121.91 2jer h ALA 189 Ca 0.21 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2jer h ALA 189 Cb 0.38 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2jer h ALA 189 CO 0.00 0.60 -0.08 0.82 0.00 0.00 0.00 179.25 180.60 2jer h ILE 190 N 0.92 1.28 -0.66 0.00 2.04 -0.92 -1.76 117.51 118.42 2jer h ILE 190 Ca 0.20 -1.12 0.13 0.00 1.00 0.00 0.00 64.86 65.07 2jer h ILE 190 Cb 0.33 1.36 -0.10 0.00 -0.74 0.00 0.00 36.82 37.67 2jer h ILE 190 CO -0.00 0.36 0.14 -0.33 0.00 0.00 0.00 178.15 178.32 2jer h GLU 191 N 0.38 0.25 -0.36 2.37 5.08 -0.69 -1.54 114.58 120.08 2jer h GLU 191 Ca 0.08 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.36 2jer h GLU 191 Cb 0.56 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 2jer h GLU 191 CO 0.03 0.17 -0.03 0.37 -1.00 0.00 0.00 179.01 178.55 2jer h GLN 192 N 0.26 0.58 -0.44 2.33 5.75 -0.81 -0.01 115.11 122.77 2jer h GLN 192 Ca 0.36 -0.14 -0.06 0.00 -0.15 0.00 0.00 58.65 58.66 2jer h GLN 192 Cb 0.57 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.03 2jer h GLN 192 CO -0.45 0.63 0.04 0.87 -2.65 0.00 0.00 178.83 177.26 2jer h LYS 193 N 0.54 0.74 -0.52 1.69 1.79 -0.53 0.25 116.57 120.54 2jer h LYS 193 Ca 0.11 -0.22 -0.01 0.00 -2.18 0.00 0.00 60.65 58.35 2jer h LYS 193 Cb 0.40 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.95 2jer h LYS 193 CO 0.02 0.79 0.28 -0.07 -1.08 0.00 0.00 179.45 179.39 2jer h LEU 194 N 0.59 0.65 -0.46 2.94 3.38 -0.77 -0.92 115.31 120.72 2jer h LEU 194 Ca 0.13 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2jer h LEU 194 Cb 0.43 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2jer h LEU 194 CO 0.01 0.55 0.30 0.00 0.09 0.00 0.00 178.44 179.40 2jer h ASP 196 N 0.62 0.91 0.44 0.00 3.32 -0.64 -0.77 116.42 120.30 2jer h ASP 196 Ca 0.17 -0.35 -0.19 0.00 0.02 0.00 0.00 57.03 56.69 2jer h ASP 196 Cb -0.05 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.22 2jer h ASP 196 CO -0.03 1.04 -1.72 -1.22 -1.72 0.00 0.00 179.24 175.59 2jer n TYR 197 N -4.26 0.62 0.24 4.55 4.02 -0.38 -1.20 117.16 120.76 2jer n TYR 197 Ca 0.00 0.21 0.11 0.00 -0.01 0.00 0.00 57.90 58.21 2jer n TYR 197 Cb 0.37 -0.98 -0.04 0.00 -0.02 0.00 0.00 39.34 38.67 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 -2.76 0.54 -2.93 7.72 7.99 -0.35 -4.70 117.00 122.52 2jer n LEU 198 Ca -0.14 0.12 -0.07 0.00 -0.01 0.00 0.00 56.01 55.91 2jer n LEU 198 Cb 0.87 -0.06 0.03 0.00 -0.11 0.00 0.00 43.42 44.15 2jer n LEU 198 CO 0.43 -0.05 0.16 -3.20 -1.51 0.00 0.00 177.39 173.21 2jer n ASN 199 N -2.31 -6.47 -4.44 -1.43 4.05 -0.34 -1.73 115.26 102.60 2jer n ASN 199 Ca -0.00 -0.35 -0.22 0.00 0.45 0.00 0.00 54.58 54.46 2jer n ASN 199 Cb 0.51 -4.63 -0.10 0.00 1.23 0.00 0.00 39.78 36.79 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 -3.18 1.61 0.00 3.44 -7.23 -0.92 -4.41 120.40 109.71 2jer s VAL 200 Ca 0.21 -2.10 0.00 0.00 -1.81 0.00 0.00 61.98 58.28 2jer s VAL 200 Cb -0.03 -2.52 0.00 0.00 0.56 0.00 0.00 36.38 34.39 2jer s VAL 200 CO 0.64 -0.25 0.00 -1.84 -0.31 0.00 0.00 175.10 173.34 2jer n GLU 201 N -0.62 3.81 -4.20 4.82 0.28 0.12 -4.47 120.64 120.39 2jer n GLU 201 Ca -0.05 0.00 -0.23 0.00 -0.16 0.00 0.00 57.16 56.72 2jer n GLU 201 Cb 0.64 -0.56 -0.17 0.00 1.43 0.00 0.00 31.44 32.78 2jer n GLU 201 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 2jer s LYS 202 N -1.02 1.22 -0.25 3.44 2.20 -0.89 -5.06 119.74 119.38 2jer s LYS 202 Ca 0.00 -0.21 -0.08 0.00 -0.36 0.00 0.00 55.97 55.32 2jer s LYS 202 Cb 0.00 -1.19 -0.03 0.00 -1.51 0.00 0.00 37.83 35.10 2jer s LYS 202 CO 0.00 -0.11 0.08 0.08 -0.36 0.00 0.00 175.35 175.04 2jer s VAL 203 N 1.12 4.42 -0.32 4.02 1.01 -1.26 -1.51 120.40 127.87 2jer s VAL 203 Ca -0.07 -0.14 -0.12 0.00 0.00 0.00 0.00 61.98 61.65 2jer s VAL 203 Cb -0.14 -3.07 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 2jer s VAL 203 CO -0.01 0.33 0.22 -0.76 0.00 0.00 0.00 175.10 174.88 2jer s LEU 204 N 1.59 4.33 -0.38 3.92 1.43 0.63 -5.00 118.68 125.20 2jer s LEU 204 Ca 0.06 -0.27 -0.13 0.00 -1.03 0.00 0.00 54.13 52.76 2jer s LEU 204 Cb -0.15 -2.13 0.01 0.00 0.03 0.00 0.00 46.19 43.95 2jer s LEU 204 CO 0.04 -0.17 0.25 0.26 0.23 0.00 0.00 176.35 176.97 2jer s TRP 205 N 1.73 3.23 0.76 0.29 0.52 -1.26 -1.36 118.94 122.85 2jer s TRP 205 Ca 0.06 -0.54 -0.12 0.00 0.02 0.00 0.00 56.10 55.52 2jer s TRP 205 Cb -0.17 -2.51 0.05 0.00 -1.15 0.00 0.00 33.47 29.69 2jer s TRP 205 CO 0.11 -0.52 1.13 -0.51 0.02 0.00 0.00 176.95 177.18 2jer s LEU 206 N 1.66 2.70 0.00 2.99 1.43 0.20 -4.91 118.68 122.75 2jer s LEU 206 Ca 0.05 0.98 0.00 0.00 -1.03 0.00 0.00 54.13 54.13 2jer s LEU 206 Cb -0.18 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.41 2jer s LEU 206 CO 0.09 -1.64 0.00 0.61 0.23 0.00 0.00 176.35 175.65 2jer n GLY 207 N -3.09 0.41 3.78 -3.19 0.00 -1.26 -0.71 105.19 101.12 2jer n GLY 207 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 2jer n GLY 207 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jer s ASP 208 N -1.00 7.24 0.24 1.61 -0.00 -1.26 -1.56 116.67 121.94 2jer s ASP 208 Ca 0.00 1.94 0.00 0.00 -0.00 0.00 0.00 52.55 54.49 2jer s ASP 208 Cb 0.00 -2.59 0.00 0.00 -0.00 0.00 0.00 42.92 40.33 2jer s ASP 208 CO 0.00 -0.14 0.00 0.61 -0.00 0.00 0.00 175.17 175.64 2jer n GLY 209 N 0.68 1.05 0.27 0.21 0.00 -1.25 -4.90 105.19 101.26 2jer n GLY 209 Ca 0.02 -1.98 0.06 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 -1.05 0.00 -3.22 -0.61 -5.35 -1.26 -4.69 119.36 103.17 2jer n ILE 210 Ca 0.00 -0.39 -0.25 0.00 -0.27 0.00 0.00 62.75 61.85 2jer n ILE 210 Cb 0.00 1.14 -0.06 0.00 -1.74 0.00 0.00 39.64 38.98 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 -0.17 2.41 0.00 7.28 3.85 -1.26 -4.91 116.55 123.74 2jer n ASP 211 Ca 0.05 -3.21 0.10 0.00 -0.71 0.00 0.00 54.79 51.03 2jer n ASP 211 Cb 0.25 -0.63 0.53 0.00 -1.35 0.00 0.00 41.12 39.92 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 0.31 0.00 0.11 0.13 -1.88 -2.08 132.00 132.30 2jer h PRO 212 Ca 0.13 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 65.22 2jer h PRO 212 Cb 0.74 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 31.80 2jer h PRO 212 CO 0.67 0.21 -0.51 0.93 -0.23 0.00 0.00 178.00 179.07 2jer h GLU 213 N 0.32 0.00 0.00 0.86 4.39 -1.95 -3.24 114.58 114.96 2jer h GLU 213 Ca 0.20 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.90 2jer h GLU 213 Cb 0.37 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 2jer h GLU 213 CO -0.04 0.06 0.00 -1.91 -1.16 0.00 0.00 179.01 175.96 2jer n GLU 214 N -2.94 0.00 -0.04 2.33 4.07 -0.83 -4.73 120.64 118.50 2jer n GLU 214 Ca 0.01 0.00 0.12 0.00 -0.06 0.00 0.00 57.16 57.24 2jer n GLU 214 Cb 0.58 -0.07 0.36 0.00 -0.06 0.00 0.00 31.44 32.24 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 -0.59 0.12 -2.81 6.31 -2.24 -1.17 -4.88 114.28 109.02 2jer n THR 215 Ca 0.00 -0.39 -0.13 0.00 -2.27 0.00 0.00 64.05 61.26 2jer n THR 215 Cb 0.00 0.72 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 0.61 -4.27 -0.54 3.42 3.02 -0.89 -4.29 115.26 112.33 2jer n ASN 216 Ca 0.17 -0.20 0.00 0.00 -0.03 0.00 0.00 54.58 54.52 2jer n ASN 216 Cb 0.43 -3.06 0.00 0.00 -0.61 0.00 0.00 39.78 36.53 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 -1.24 0.74 3.64 7.41 0.00 -0.92 -1.76 105.19 113.06 2jer n GLY 217 Ca -0.05 -0.44 -0.46 0.00 0.00 0.00 0.00 46.02 45.07 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 -1.36 1.86 0.20 1.61 8.25 -1.26 -3.97 115.22 120.55 2jer n HIS 218 Ca 0.00 0.51 0.15 0.00 -0.26 0.00 0.00 57.72 58.11 2jer n HIS 218 Cb 0.37 -2.40 0.77 0.00 1.12 0.00 0.00 29.99 29.85 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 2.98 0.68 0.00 1.59 3.04 -1.73 -2.88 116.25 119.93 2jer h VAL 219 Ca -0.45 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.24 2jer h VAL 219 Cb 1.30 0.90 0.00 0.00 -2.01 0.00 0.00 31.29 31.48 2jer h VAL 219 CO 0.75 0.00 0.00 -0.90 -1.01 0.00 0.00 177.57 176.41 2jer n ASP 220 N -4.13 0.00 -0.11 3.17 5.75 -1.05 -0.44 116.55 119.74 2jer n ASP 220 Ca 0.01 -0.12 0.11 0.00 -0.01 0.00 0.00 54.79 54.77 2jer n ASP 220 Cb 0.26 -0.23 0.09 0.00 -1.03 0.00 0.00 41.12 40.20 2jer n ASP 220 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2jer n ASP 221 N -1.23 1.00 -0.06 -1.12 8.00 -1.09 -3.57 116.55 118.48 2jer n ASP 221 Ca 0.11 -0.82 -0.14 0.00 0.71 0.00 0.00 54.79 54.65 2jer n ASP 221 Cb 0.14 0.55 -0.05 0.00 -0.02 0.00 0.00 41.12 41.75 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 -1.15 0.78 -3.56 2.53 0.31 0.41 -4.60 118.33 113.04 2jer n VAL 222 Ca 0.06 -0.16 -0.15 0.00 -0.01 0.00 0.00 64.34 64.09 2jer n VAL 222 Cb 0.36 -1.70 -0.06 0.00 -0.91 0.00 0.00 33.84 31.53 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 -2.26 -1.44 0.24 3.52 0.00 -0.45 -0.90 121.76 120.47 2jer s ALA 223 Ca -0.19 0.80 -0.12 0.00 0.00 0.00 0.00 51.96 52.46 2jer s ALA 223 Cb 0.07 0.26 -0.01 0.00 0.00 0.00 0.00 23.12 23.44 2jer s ALA 223 CO 0.24 -0.45 0.46 0.00 0.00 0.00 0.00 175.76 176.00 2jer s PHE 225 N -4.03 3.56 -0.11 0.00 0.08 -1.26 -1.31 117.98 114.92 2jer s PHE 225 Ca 0.23 1.13 0.16 0.00 0.12 0.00 0.00 56.93 58.57 2jer s PHE 225 Cb -0.00 -2.71 -0.19 0.00 -0.57 0.00 0.00 43.02 39.55 2jer s PHE 225 CO 0.09 0.13 0.64 0.44 -0.10 0.00 0.00 175.22 176.42 2jer n ILE 226 N 3.69 1.25 -3.65 0.64 -5.35 0.04 -4.87 119.36 111.10 2jer n ILE 226 Ca -0.03 -0.73 -0.04 0.00 -0.27 0.00 0.00 62.75 61.67 2jer n ILE 226 Cb 0.51 -0.72 -0.01 0.00 -1.74 0.00 0.00 39.64 37.68 2jer n ILE 226 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jer s ALA 227 N -2.81 -1.83 0.22 -1.28 0.00 -1.17 -4.88 121.76 110.00 2jer s ALA 227 Ca -0.05 0.57 -0.32 0.00 0.00 0.00 0.00 51.96 52.16 2jer s ALA 227 Cb 0.08 0.48 -0.13 0.00 0.00 0.00 0.00 23.12 23.55 2jer s ALA 227 CO 0.82 -0.91 1.56 -2.30 0.00 0.00 0.00 175.76 174.93 2jer n PRO 228 N -0.38 2.34 -0.96 0.00 -0.02 -1.26 -1.68 135.00 133.04 2jer n PRO 228 Ca -0.07 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 2jer n PRO 228 Cb 0.61 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 2jer n PRO 228 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jer n GLY 229 N 2.94 0.85 2.82 -1.23 0.00 -1.26 -5.02 105.19 104.30 2jer n GLY 229 Ca 0.14 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.95 2jer n GLY 229 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jer s GLU 230 N -0.04 0.59 0.23 1.61 2.02 -0.67 -1.14 118.70 121.30 2jer s GLU 230 Ca 0.00 0.03 0.09 0.00 0.02 0.00 0.00 54.97 55.11 2jer s GLU 230 Cb 0.00 -0.79 -0.05 0.00 0.10 0.00 0.00 34.13 33.39 2jer s GLU 230 CO 0.00 -0.18 -0.16 0.14 0.02 0.00 0.00 175.26 175.08 2jer s VAL 231 N 1.36 1.98 0.04 2.63 -7.23 0.25 -0.78 120.40 118.65 2jer s VAL 231 Ca -0.05 -2.28 0.06 0.00 -1.81 0.00 0.00 61.98 57.91 2jer s VAL 231 Cb -0.13 -2.13 -0.03 0.00 0.56 0.00 0.00 36.38 34.64 2jer s VAL 231 CO -0.02 -0.53 -0.14 0.00 -0.31 0.00 0.00 175.10 174.10 2jer s ALA 232 N -2.82 2.76 -0.02 1.32 0.00 -0.43 -1.30 121.76 121.28 2jer s ALA 232 Ca 0.25 -1.15 0.02 0.00 0.00 0.00 0.00 51.96 51.08 2jer s ALA 232 Cb -0.02 -0.87 0.01 0.00 0.00 0.00 0.00 23.12 22.23 2jer s ALA 232 CO 0.10 0.59 -0.05 0.00 0.00 0.00 0.00 175.76 176.40 2jer n ILE 234 N 3.32 3.93 -3.75 0.00 -5.35 -0.08 -0.58 119.36 116.85 2jer n ILE 234 Ca -0.18 -0.50 -0.13 0.00 -0.27 0.00 0.00 62.75 61.67 2jer n ILE 234 Cb 0.55 -1.63 -0.11 0.00 -1.74 0.00 0.00 39.64 36.72 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 -1.30 -0.37 -0.11 4.28 5.04 0.48 -4.74 117.35 120.62 2jer s TYR 235 Ca 0.73 0.90 -0.12 0.00 -2.44 0.00 0.00 57.07 56.14 2jer s TYR 235 Cb -0.42 0.13 0.03 0.00 0.35 0.00 0.00 41.96 42.06 2jer s TYR 235 CO 0.48 -0.19 0.34 -0.08 -1.34 0.00 0.00 175.55 174.76 2jer s THR 236 N 0.13 0.01 -2.84 4.34 -1.32 -1.26 -3.74 115.64 110.95 2jer s THR 236 Ca -0.00 -0.07 0.25 0.00 -1.21 0.00 0.00 61.69 60.65 2jer s THR 236 Cb -0.03 -0.50 0.26 0.00 -1.51 0.00 0.00 72.50 70.72 2jer s THR 236 CO 0.01 -0.04 1.36 -0.62 -2.21 0.00 0.00 174.62 173.11 2jer n GLU 237 N 2.66 2.13 -2.57 7.08 1.02 -1.26 -4.86 120.64 124.84 2jer n GLU 237 Ca -0.14 -1.68 -0.42 0.00 -0.02 0.00 0.00 57.16 54.90 2jer n GLU 237 Cb 0.57 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.50 2jer n GLU 237 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2jer s ASP 238 N -2.03 6.33 0.20 1.62 -1.08 -1.26 -4.88 116.67 115.58 2jer s ASP 238 Ca 0.30 -0.12 0.17 0.00 -0.52 0.00 0.00 52.55 52.38 2jer s ASP 238 Cb 0.20 -2.55 0.82 0.00 -1.46 0.00 0.00 42.92 39.93 2jer s ASP 238 CO 0.32 -1.62 1.53 0.00 0.52 0.00 0.00 175.17 175.92 2jer n GLN 239 N 8.80 0.11 0.00 4.34 6.02 -1.26 -1.22 117.38 134.18 2jer n GLN 239 Ca 0.06 0.49 0.13 0.00 -0.01 0.00 0.00 57.00 57.67 2jer n GLN 239 Cb 0.49 -1.78 0.37 0.00 1.02 0.00 0.00 30.24 30.34 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 -2.01 0.34 -4.77 1.08 3.02 -1.26 -4.89 115.26 106.77 2jer n ASN 240 Ca 0.01 0.02 -0.41 0.00 -0.03 0.00 0.00 54.58 54.17 2jer n ASN 240 Cb 0.11 -0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.26 2jer n ASN 240 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2jer s SER 241 N -3.06 6.47 0.35 6.41 0.15 -0.35 -4.88 113.70 118.78 2jer s SER 241 Ca 0.12 2.92 0.26 0.00 0.70 0.00 0.00 55.95 59.94 2jer s SER 241 Cb 0.18 -2.65 1.21 0.00 -1.71 0.00 0.00 66.02 63.04 2jer s SER 241 CO 0.64 -0.80 1.79 1.55 1.20 0.00 0.00 173.24 177.62 2jer h PRO 242 N 3.71 0.00 -0.00 5.44 0.13 -1.90 -2.64 132.00 136.74 2jer h PRO 242 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2jer h PRO 242 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2jer h PRO 242 CO 0.69 0.00 -0.44 1.19 -0.23 0.00 0.00 178.00 179.21 2jer n PHE 243 N -2.43 0.00 0.11 1.56 3.72 -1.26 -4.69 117.46 114.47 2jer n PHE 243 Ca 0.00 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.25 2jer n PHE 243 Cb 0.17 -0.26 -0.09 0.00 -0.94 0.00 0.00 39.48 38.36 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 0.09 -1.46 -0.38 1.38 3.20 -1.73 -0.56 116.97 117.51 2jer h TYR 244 Ca 0.00 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 2jer h TYR 244 Cb 0.50 0.62 -0.02 0.00 1.54 0.00 0.00 36.73 39.38 2jer h TYR 244 CO 0.00 -0.58 0.11 0.93 -1.64 0.00 0.00 178.16 176.98 2jer h GLU 245 N -0.73 0.60 -0.64 1.82 4.39 -1.84 -1.42 114.58 116.75 2jer h GLU 245 Ca 0.00 -0.13 -0.00 0.00 0.34 0.00 0.00 59.36 59.57 2jer h GLU 245 Cb 0.74 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.28 2jer h GLU 245 CO -0.29 0.61 0.38 0.00 -1.16 0.00 0.00 179.01 178.56 2jer h ALA 246 N 0.96 0.82 -0.31 3.43 0.00 -1.82 -0.66 119.26 121.69 2jer h ALA 246 Ca 0.12 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2jer h ALA 246 Cb 0.27 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2jer h ALA 246 CO -0.00 0.30 0.13 0.00 0.00 0.00 0.00 179.25 179.68 2jer h ALA 247 N 1.20 0.40 -0.43 0.00 0.00 -0.92 -1.05 119.26 118.45 2jer h ALA 247 Ca 0.23 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2jer h ALA 247 Cb -0.02 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2jer h ALA 247 CO -0.04 -0.02 0.26 1.96 0.00 0.00 0.00 179.25 181.41 2jer h GLN 248 N 0.35 0.51 -0.28 0.00 1.08 -1.01 -1.58 115.11 114.19 2jer h GLN 248 Ca 0.10 -0.03 -0.18 0.00 -1.45 0.00 0.00 58.65 57.09 2jer h GLN 248 Cb 0.16 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 27.47 2jer h GLN 248 CO -0.01 0.34 -0.55 0.22 -0.95 0.00 0.00 178.83 177.88 2jer h ASP 249 N 0.53 0.93 -0.25 1.46 3.58 -0.97 -2.32 116.42 119.38 2jer h ASP 249 Ca 0.17 -0.50 -0.00 0.00 0.42 0.00 0.00 57.03 57.11 2jer h ASP 249 Cb -0.01 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 40.76 2jer h ASP 249 CO -0.07 1.29 0.15 0.00 -2.88 0.00 0.00 179.24 177.73 2jer h ALA 250 N 0.73 0.32 -0.04 -0.78 0.00 -1.07 0.60 119.26 119.01 2jer h ALA 250 Ca 0.01 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.90 2jer h ALA 250 Cb 1.15 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2jer h ALA 250 CO 0.12 -0.17 -0.07 -0.92 0.00 0.00 0.00 179.25 178.20 2jer h TYR 251 N 0.31 -0.18 -0.82 0.00 3.20 -1.24 -0.34 116.97 117.90 2jer h TYR 251 Ca 0.09 0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.99 2jer h TYR 251 Cb 0.03 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.34 2jer h TYR 251 CO -0.04 -0.11 0.53 0.37 -1.64 0.00 0.00 178.16 177.26 2jer h GLN 252 N -0.11 1.01 -0.34 1.82 4.15 -1.20 -2.01 115.11 118.44 2jer h GLN 252 Ca 0.05 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.38 2jer h GLN 252 Cb 0.17 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.62 2jer h GLN 252 CO -0.11 0.67 0.10 0.00 -1.93 0.00 0.00 178.83 177.56 2jer h ARG 253 N 1.04 0.52 -0.59 1.69 3.08 -0.57 -3.08 114.38 116.48 2jer h ARG 253 Ca 0.32 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 60.25 2jer h ARG 253 Cb -0.03 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 29.92 2jer h ARG 253 CO -0.10 0.56 0.35 -0.07 -1.07 0.00 0.00 179.97 179.63 2jer h LEU 254 N 0.39 0.70 -0.94 3.04 -0.00 -0.71 -1.45 115.31 116.34 2jer h LEU 254 Ca 0.11 -0.04 0.00 0.00 -0.00 0.00 0.00 57.88 57.95 2jer h LEU 254 Cb 0.25 -0.18 0.00 0.00 -0.00 0.00 0.00 40.66 40.74 2jer h LEU 254 CO -0.00 0.54 0.00 0.18 -0.00 0.00 0.00 178.44 179.16 2jer n LEU 255 N -4.41 0.50 -0.50 1.67 4.77 -0.79 -1.95 117.00 116.29 2jer n LEU 255 Ca 0.06 0.69 0.06 0.00 -0.03 0.00 0.00 56.01 56.78 2jer n LEU 255 Cb 0.08 -0.69 0.08 0.00 -2.33 0.00 0.00 43.42 40.55 2jer n LEU 255 CO 0.36 -0.73 0.49 0.29 -1.33 0.00 0.00 177.39 176.47 2jer n LYS 256 N -2.12 1.23 -3.85 3.23 5.02 -0.56 -4.96 118.16 116.14 2jer n LYS 256 Ca 0.00 -1.42 -0.34 0.00 -2.02 0.00 0.00 58.31 54.53 2jer n LYS 256 Cb 0.11 -1.23 -0.05 0.00 -0.02 0.00 0.00 35.03 33.83 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 -0.95 3.48 0.12 1.97 -1.94 -0.82 -5.05 119.30 116.11 2jer s MET 257 Ca 0.16 -0.21 0.09 0.00 -1.71 0.00 0.00 55.69 54.02 2jer s MET 257 Cb 0.10 -3.11 -0.04 0.00 2.01 0.00 0.00 34.83 33.79 2jer s MET 257 CO 0.14 0.68 -0.18 0.95 -0.01 0.00 0.00 175.02 176.60 2jer s THR 258 N -1.27 2.81 0.58 2.05 -4.23 -1.26 -2.12 115.64 112.20 2jer s THR 258 Ca 0.25 -1.53 -0.08 0.00 -1.18 0.00 0.00 61.69 59.15 2jer s THR 258 Cb -0.13 -2.29 0.13 0.00 1.34 0.00 0.00 72.50 71.55 2jer s THR 258 CO 0.15 0.09 0.79 -0.90 -0.54 0.00 0.00 174.62 174.21 2jer n ASP 259 N 0.77 0.25 0.27 3.99 5.68 -0.51 -4.88 116.55 122.11 2jer n ASP 259 Ca -0.15 -1.40 0.11 0.00 -0.50 0.00 0.00 54.79 52.84 2jer n ASP 259 Cb 0.53 -0.59 0.73 0.00 -1.14 0.00 0.00 41.12 40.65 2jer n ASP 259 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2jer h ALA 260 N -1.55 1.72 -0.12 2.12 0.00 -1.83 -0.33 119.26 119.26 2jer h ALA 260 Ca -0.26 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2jer h ALA 260 Cb 0.75 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2jer h ALA 260 CO 0.20 0.05 0.00 1.63 0.00 0.00 0.00 179.25 181.13 2jer n LYS 261 N -4.17 1.55 -0.84 0.00 5.02 -1.26 -4.92 118.16 113.54 2jer n LYS 261 Ca -0.03 -0.83 0.00 0.00 -2.02 0.00 0.00 58.31 55.44 2jer n LYS 261 Cb 0.12 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 33.76 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 1.05 0.57 3.71 0.72 0.00 -0.13 -5.03 105.19 106.07 2jer n GLY 262 Ca 0.16 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.36 4.52 0.06 1.61 0.52 -1.26 -4.76 118.95 119.28 2jer s ARG 263 Ca 0.00 1.27 -0.31 0.00 -0.52 0.00 0.00 55.73 56.18 2jer s ARG 263 Cb 0.00 -3.46 -0.08 0.00 0.52 0.00 0.00 34.95 31.93 2jer s ARG 263 CO 0.00 -0.03 1.67 -1.14 0.02 0.00 0.00 175.30 175.82 2jer s GLN 264 N 0.98 4.19 0.22 3.54 2.00 -1.26 -1.43 119.66 127.90 2jer s GLN 264 Ca 0.48 2.34 -0.31 0.00 -2.00 0.00 0.00 55.36 55.87 2jer s GLN 264 Cb -0.20 -3.63 -0.10 0.00 0.80 0.00 0.00 33.01 29.87 2jer s GLN 264 CO 0.25 -0.75 1.54 -0.51 -0.50 0.00 0.00 175.29 175.32 2jer s LEU 265 N 2.77 4.37 -0.04 3.68 1.43 -0.90 -4.91 118.68 125.08 2jer s LEU 265 Ca 0.75 2.71 -0.29 0.00 -1.03 0.00 0.00 54.13 56.26 2jer s LEU 265 Cb -0.40 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.19 2jer s LEU 265 CO 0.33 -0.81 0.95 -0.54 0.23 0.00 0.00 176.35 176.50 2jer s LYS 266 N 0.40 4.50 -0.23 1.70 1.02 -0.29 -4.87 119.74 121.97 2jer s LYS 266 Ca 0.66 1.33 0.02 0.00 0.02 0.00 0.00 55.97 58.00 2jer s LYS 266 Cb -0.44 -3.48 0.05 0.00 -0.52 0.00 0.00 37.83 33.43 2jer s LYS 266 CO 0.38 -0.11 -0.13 0.08 -0.92 0.00 0.00 175.35 174.65 2jer s VAL 267 N 1.26 2.01 -0.09 3.17 1.01 -1.26 -0.58 120.40 125.92 2jer s VAL 267 Ca 0.49 -1.31 -0.09 0.00 0.00 0.00 0.00 61.98 61.07 2jer s VAL 267 Cb -0.20 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 2jer s VAL 267 CO 0.24 0.16 0.21 -1.00 0.00 0.00 0.00 175.10 174.71 2jer s HIS 268 N 1.22 3.63 0.11 5.22 3.76 -0.42 -4.97 115.29 123.84 2jer s HIS 268 Ca -0.04 0.64 -0.21 0.00 -0.15 0.00 0.00 55.06 55.31 2jer s HIS 268 Cb -0.17 -2.04 -0.07 0.00 1.11 0.00 0.00 32.58 31.41 2jer s HIS 268 CO -0.08 0.70 0.63 0.15 -0.85 0.00 0.00 174.74 175.29 2jer s LYS 269 N -0.99 4.30 -0.06 1.40 1.02 -1.26 -0.18 119.74 123.96 2jer s LYS 269 Ca 0.17 0.85 0.06 0.00 0.02 0.00 0.00 55.97 57.07 2jer s LYS 269 Cb -0.13 -3.21 -0.01 0.00 -0.52 0.00 0.00 37.83 33.95 2jer s LYS 269 CO 0.06 0.60 -0.24 -1.17 -0.92 0.00 0.00 175.35 173.69 2jer s LEU 270 N -1.20 2.14 1.10 3.17 2.96 0.25 -4.87 118.68 122.24 2jer s LEU 270 Ca 0.32 -0.48 -0.13 0.00 -0.22 0.00 0.00 54.13 53.62 2jer s LEU 270 Cb -0.20 -1.40 0.25 0.00 0.50 0.00 0.00 46.19 45.34 2jer s LEU 270 CO 0.21 0.25 1.05 0.00 -1.32 0.00 0.00 176.35 176.54 2jer n PRO 273 N 0.39 2.25 -0.06 0.00 -0.02 -1.26 -4.88 135.00 131.41 2jer n PRO 273 Ca -0.14 0.80 -0.10 0.00 -2.02 0.00 0.00 63.50 62.04 2jer n PRO 273 Cb 0.56 -2.45 -0.03 0.00 -0.02 0.00 0.00 33.50 31.56 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 2.90 1.12 -2.93 -1.45 2.07 -1.97 -3.44 116.25 112.54 2jer h VAL 274 Ca -0.46 -0.32 -0.66 0.00 0.82 0.00 0.00 66.70 66.07 2jer h VAL 274 Cb 1.27 0.92 -0.09 0.00 -1.52 0.00 0.00 31.29 31.87 2jer h VAL 274 CO 0.70 0.12 -0.54 -0.54 0.02 0.00 0.00 177.57 177.33 2jer s LYS 275 N -5.83 3.25 0.24 1.57 1.02 -1.26 -5.06 119.74 113.66 2jer s LYS 275 Ca -0.13 -0.32 -0.30 0.00 0.02 0.00 0.00 55.97 55.24 2jer s LYS 275 Cb 0.08 -3.00 -0.10 0.00 -0.52 0.00 0.00 37.83 34.28 2jer s LYS 275 CO 0.70 0.71 1.49 -0.80 -0.92 0.00 0.00 175.35 176.54 2jer s ASN 276 N -1.36 6.60 -0.01 2.83 0.01 -1.26 -5.01 114.94 116.74 2jer s ASN 276 Ca 0.19 2.70 -0.27 0.00 -0.71 0.00 0.00 52.86 54.77 2jer s ASN 276 Cb -0.12 -2.62 -0.04 0.00 0.41 0.00 0.00 41.25 38.88 2jer s ASN 276 CO 0.09 -0.76 0.84 -0.69 -1.51 0.00 0.00 177.10 175.07 2jer s VAL 277 N 0.24 4.89 0.09 1.60 1.01 -1.26 -5.02 120.40 121.95 2jer s VAL 277 Ca 0.62 1.77 0.05 0.00 0.00 0.00 0.00 61.98 64.42 2jer s VAL 277 Cb -0.43 -4.19 -0.03 0.00 0.00 0.00 0.00 36.38 31.73 2jer s VAL 277 CO 0.41 0.24 -0.13 0.42 0.00 0.00 0.00 175.10 176.04 2jer s THR 278 N 0.70 1.11 0.18 3.92 -4.23 -1.26 -0.36 115.64 115.69 2jer s THR 278 Ca 0.44 -1.44 -0.31 0.00 -1.18 0.00 0.00 61.69 59.20 2jer s THR 278 Cb -0.20 -1.20 -0.10 0.00 1.34 0.00 0.00 72.50 72.34 2jer s THR 278 CO 0.24 -0.33 1.52 -0.63 -0.54 0.00 0.00 174.62 174.88 2jer s ILE 279 N -1.66 2.69 0.18 2.99 -1.09 -0.45 -4.91 121.20 118.95 2jer s ILE 279 Ca 0.01 0.51 -0.09 0.00 -2.23 0.00 0.00 60.65 58.86 2jer s ILE 279 Cb -0.08 -3.33 -0.07 0.00 -1.58 0.00 0.00 42.46 37.41 2jer s ILE 279 CO 0.02 0.05 0.49 -0.54 -1.23 0.00 0.00 174.94 173.73 2jer s LYS 280 N 0.79 3.76 0.31 2.79 1.02 -1.26 -0.88 119.74 126.26 2jer s LYS 280 Ca 0.67 0.18 0.02 0.00 0.02 0.00 0.00 55.97 56.86 2jer s LYS 280 Cb -0.43 -2.76 0.50 0.00 -0.52 0.00 0.00 37.83 34.62 2jer s LYS 280 CO 0.34 0.39 1.83 0.78 -0.92 0.00 0.00 175.35 177.77 2jer h GLY 281 N 2.81 0.67 2.00 -3.33 0.00 -1.93 -1.86 103.07 101.43 2jer h GLY 281 Ca -0.47 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.44 2jer h GLY 281 CO 0.70 0.39 0.00 1.48 0.00 0.00 0.00 176.54 179.11 2jer h SER 282 N 0.59 0.00 -3.40 0.19 4.64 -2.02 -3.45 113.55 110.11 2jer h SER 282 Ca 0.12 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.91 2jer h SER 282 Cb 0.38 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.55 2jer h SER 282 CO 0.01 0.00 0.87 -0.36 -0.87 0.00 0.00 176.83 176.48 2jer s PHE 283 N -3.60 2.75 -0.92 4.77 2.99 -0.70 -4.93 117.98 118.34 2jer s PHE 283 Ca -0.00 0.84 -0.13 0.00 0.00 0.00 0.00 56.93 57.64 2jer s PHE 283 Cb 0.09 -4.05 0.24 0.00 0.00 0.00 0.00 43.02 39.29 2jer s PHE 283 CO 0.36 -3.48 0.88 0.15 -0.00 0.00 0.00 175.22 173.12 2jer s LYS 284 N -0.68 3.78 -0.07 0.44 -0.14 -1.26 -4.99 119.74 116.81 2jer s LYS 284 Ca 0.62 -2.68 0.03 0.00 -1.36 0.00 0.00 55.97 52.58 2jer s LYS 284 Cb -0.47 -4.48 0.01 0.00 -1.68 0.00 0.00 37.83 31.20 2jer s LYS 284 CO 0.49 -1.29 -0.17 0.42 -0.76 0.00 0.00 175.35 174.05 2jer s ILE 285 N -0.20 1.47 0.39 2.17 1.01 -1.26 -1.46 121.20 123.31 2jer s ILE 285 Ca 0.22 -0.68 -0.26 0.00 0.00 0.00 0.00 60.65 59.93 2jer s ILE 285 Cb -0.10 -1.30 -0.09 0.00 0.01 0.00 0.00 42.46 40.98 2jer s ILE 285 CO -0.09 0.43 1.18 -1.81 0.00 0.00 0.00 174.94 174.65 2jer s ASP 286 N 0.50 6.56 -0.18 3.58 1.11 0.11 -4.97 116.67 123.37 2jer s ASP 286 Ca -0.15 2.37 -0.11 0.00 0.18 0.00 0.00 52.55 54.83 2jer s ASP 286 Cb -0.16 -2.62 -0.05 0.00 1.07 0.00 0.00 42.92 41.16 2jer s ASP 286 CO 0.05 -0.65 0.20 0.12 1.18 0.00 0.00 175.17 176.07 2jer s PHE 287 N -1.39 3.44 -0.05 4.23 5.36 -1.26 -4.34 117.98 123.98 2jer s PHE 287 Ca 0.56 0.46 -0.01 0.00 -0.96 0.00 0.00 56.93 56.98 2jer s PHE 287 Cb -0.31 -2.22 0.03 0.00 -0.34 0.00 0.00 43.02 40.17 2jer s PHE 287 CO 0.40 0.30 0.01 0.08 -1.46 0.00 0.00 175.22 174.54 2jer s VAL 288 N 0.31 0.19 0.15 3.12 1.01 -1.26 -5.09 120.40 118.83 2jer s VAL 288 Ca 0.12 0.16 -0.33 0.00 0.00 0.00 0.00 61.98 61.93 2jer s VAL 288 Cb -0.12 -0.34 -0.12 0.00 0.00 0.00 0.00 36.38 35.80 2jer s VAL 288 CO 0.01 0.19 1.70 1.21 0.00 0.00 0.00 175.10 178.21 2jer n GLU 289 N 4.69 2.49 0.00 2.72 4.07 -1.26 -1.01 120.64 132.34 2jer n GLU 289 Ca -0.15 0.90 0.00 0.00 -0.06 0.00 0.00 57.16 57.85 2jer n GLU 289 Cb 0.50 -2.73 0.00 0.00 -0.06 0.00 0.00 31.44 29.15 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 3.84 3.39 3.76 8.31 0.00 -1.26 -4.99 105.19 118.25 2jer n GLY 290 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 2jer n GLY 290 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jer s THR 291 N -2.92 5.37 -0.35 2.61 2.01 -0.18 -3.62 115.64 118.57 2jer s THR 291 Ca 0.00 0.35 -0.40 0.00 0.31 0.00 0.00 61.69 61.95 2jer s THR 291 Cb 0.00 -3.52 -0.15 0.00 0.01 0.00 0.00 72.50 68.83 2jer s THR 291 CO 0.00 0.47 1.92 0.80 -0.69 0.00 0.00 174.62 177.11 2jer n MET 292 N 3.14 0.87 -1.96 4.92 1.56 -0.04 -4.65 117.12 120.96 2jer n MET 292 Ca -0.15 0.29 -0.38 0.00 -0.27 0.00 0.00 57.70 57.18 2jer n MET 292 Cb 0.53 -2.06 0.02 0.00 2.15 0.00 0.00 33.22 33.85 2jer n MET 292 CO 0.00 0.00 0.00 -2.14 -0.73 0.00 0.00 175.97 173.10 2jer s PRO 293 N 4.62 3.52 -0.52 2.12 0.02 -1.26 -4.91 135.00 138.59 2jer s PRO 293 Ca 1.05 2.12 -0.03 0.00 0.02 0.00 0.00 61.00 64.16 2jer s PRO 293 Cb -1.11 -2.44 0.14 0.00 0.02 0.00 0.00 34.50 31.11 2jer s PRO 293 CO 0.63 -0.85 0.33 1.03 -0.33 0.00 0.00 177.00 177.80 2jer s ARG 294 N -2.67 2.30 0.12 5.54 1.81 -1.26 -5.09 118.95 119.69 2jer s ARG 294 Ca 0.65 -2.17 0.05 0.00 -1.72 0.00 0.00 55.73 52.55 2jer s ARG 294 Cb -0.37 -3.68 -0.04 0.00 -0.45 0.00 0.00 34.95 30.41 2jer s ARG 294 CO 0.46 -1.13 0.03 -1.21 -0.68 0.00 0.00 175.30 172.77 2jer s GLU 295 N 0.56 2.61 0.05 3.54 2.02 -1.26 -4.98 118.70 121.24 2jer s GLU 295 Ca 0.12 -0.88 -0.37 0.00 0.02 0.00 0.00 54.97 53.86 2jer s GLU 295 Cb -0.22 -2.54 -0.17 0.00 0.10 0.00 0.00 34.13 31.30 2jer s GLU 295 CO -0.04 0.52 1.32 -3.47 0.02 0.00 0.00 175.26 173.61 2jer n ASP 296 N 0.27 1.40 0.00 -0.19 2.03 -1.26 -1.31 116.55 117.49 2jer n ASP 296 Ca -0.10 1.12 0.00 0.00 0.52 0.00 0.00 54.79 56.34 2jer n ASP 296 Cb 0.53 -1.14 0.00 0.00 -0.72 0.00 0.00 41.12 39.79 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 2.44 1.71 3.67 0.27 0.00 -0.06 -4.98 105.19 108.23 2jer n GLY 297 Ca 0.19 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.75 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 3.20 -4.67 1.61 8.00 -0.43 -4.74 116.55 119.52 2jer n ASP 298 Ca 0.00 1.08 -0.42 0.00 0.71 0.00 0.00 54.79 56.15 2jer n ASP 298 Cb 0.00 -1.44 -0.03 0.00 -0.02 0.00 0.00 41.12 39.63 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 1.03 4.76 0.14 0.53 1.01 -1.26 -1.35 121.20 126.06 2jer s ILE 299 Ca 0.79 1.95 -0.18 0.00 0.00 0.00 0.00 60.65 63.21 2jer s ILE 299 Cb -0.66 -4.28 -0.07 0.00 0.01 0.00 0.00 42.46 37.46 2jer s ILE 299 CO 0.38 -0.07 0.60 0.00 0.00 0.00 0.00 174.94 175.85 2jer s ILE 301 N -1.34 3.88 -0.57 0.00 -1.09 -1.26 -4.51 121.20 116.31 2jer s ILE 301 Ca 0.36 -1.35 -0.16 0.00 -2.23 0.00 0.00 60.65 57.27 2jer s ILE 301 Cb -0.17 -4.92 0.13 0.00 -1.58 0.00 0.00 42.46 35.92 2jer s ILE 301 CO 0.20 -1.66 0.55 0.00 -1.23 0.00 0.00 174.94 172.80 2jer s ALA 302 N 6.60 3.65 -0.09 9.38 0.00 -1.26 -4.75 121.76 135.30 2jer s ALA 302 Ca 0.58 -2.57 0.03 0.00 0.00 0.00 0.00 51.96 50.00 2jer s ALA 302 Cb 0.01 -3.32 -0.02 0.00 0.00 0.00 0.00 23.12 19.79 2jer s ALA 302 CO 0.06 -2.08 -0.17 0.45 0.00 0.00 0.00 175.76 174.02 2jer s SER 303 N 3.50 3.75 0.27 0.00 0.15 -1.26 -4.39 113.70 115.71 2jer s SER 303 Ca 0.05 -0.34 0.24 0.00 0.70 0.00 0.00 55.95 56.60 2jer s SER 303 Cb -0.28 -1.19 1.00 0.00 -1.71 0.00 0.00 66.02 63.84 2jer s SER 303 CO 0.02 0.24 1.72 -1.22 1.20 0.00 0.00 173.24 175.20 2jer n TYR 304 N 3.01 0.83 0.31 3.44 4.02 -1.26 -3.06 117.16 124.45 2jer n TYR 304 Ca -0.18 0.33 0.17 0.00 -0.01 0.00 0.00 57.90 58.21 2jer n TYR 304 Cb 0.52 -1.03 0.72 0.00 -0.02 0.00 0.00 39.34 39.53 2jer n TYR 304 CO 0.00 0.00 0.00 1.98 -1.01 0.00 0.00 176.86 177.83 2jer h MET 305 N 0.00 0.00 -2.48 -0.72 4.05 -1.85 -3.34 114.93 110.59 2jer h MET 305 Ca 0.00 0.00 -0.51 0.00 -0.28 0.00 0.00 59.70 58.91 2jer h MET 305 Cb 0.35 0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 31.09 2jer h MET 305 CO 0.00 0.00 1.79 -1.71 0.23 0.00 0.00 176.91 177.22 2jer n ASN 306 N -2.86 7.23 -4.84 1.39 2.85 -1.17 -4.81 115.26 113.04 2jer n ASN 306 Ca 0.00 -2.74 -0.22 0.00 -0.11 0.00 0.00 54.58 51.52 2jer n ASN 306 Cb 0.24 -1.43 -0.04 0.00 1.24 0.00 0.00 39.78 39.79 2jer n ASN 306 CO 0.00 0.00 0.00 0.72 -2.11 0.00 0.00 177.26 175.87 2jer s PHE 307 N 0.66 3.09 -0.19 1.20 -0.12 -1.25 -1.14 117.98 120.22 2jer s PHE 307 Ca 0.65 -0.14 -0.04 0.00 -0.05 0.00 0.00 56.93 57.35 2jer s PHE 307 Cb 0.25 -1.49 -0.02 0.00 -0.63 0.00 0.00 43.02 41.14 2jer s PHE 307 CO -0.07 0.45 -0.04 -1.17 -0.05 0.00 0.00 175.22 174.34 2jer s LEU 308 N -3.88 3.03 -0.17 -1.99 0.20 -0.59 -4.41 118.68 110.87 2jer s LEU 308 Ca 0.34 -0.28 -0.23 0.00 0.69 0.00 0.00 54.13 54.65 2jer s LEU 308 Cb -0.08 -1.75 -0.02 0.00 -0.43 0.00 0.00 46.19 43.91 2jer s LEU 308 CO 0.25 0.07 0.73 -0.63 -0.29 0.00 0.00 176.35 176.49 2jer s ILE 309 N 0.97 4.95 -0.29 6.68 1.01 -1.26 -1.01 121.20 132.26 2jer s ILE 309 Ca 0.00 1.43 -0.02 0.00 0.00 0.00 0.00 60.65 62.05 2jer s ILE 309 Cb -0.15 -4.05 0.12 0.00 0.01 0.00 0.00 42.46 38.39 2jer s ILE 309 CO 0.01 0.08 0.20 0.28 0.00 0.00 0.00 174.94 175.51 2jer s THR 310 N 1.92 -0.20 0.00 2.92 -1.32 -0.05 -4.74 115.64 114.17 2jer s THR 310 Ca 0.34 -0.67 0.00 0.00 -1.21 0.00 0.00 61.69 60.15 2jer s THR 310 Cb -0.16 -0.98 0.00 0.00 -1.51 0.00 0.00 72.50 69.84 2jer s THR 310 CO 0.12 -0.63 0.00 0.59 -2.21 0.00 0.00 174.62 172.49 2jer n ASN 311 N 5.25 0.00 -0.15 8.08 5.03 -1.26 -1.42 115.26 130.79 2jer n ASN 311 Ca -0.04 0.00 0.07 0.00 0.87 0.00 0.00 54.58 55.48 2jer n ASN 311 Cb 0.44 0.00 0.38 0.00 -1.02 0.00 0.00 39.78 39.58 2jer n ASN 311 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 2jer n ASP 312 N 5.55 0.45 -4.33 6.41 8.00 -1.26 -4.86 116.55 126.51 2jer n ASP 312 Ca 0.00 -1.63 -0.20 0.00 0.71 0.00 0.00 54.79 53.68 2jer n ASP 312 Cb 0.00 -0.04 -0.11 0.00 -0.02 0.00 0.00 41.12 40.96 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 -1.43 1.38 -0.07 0.44 0.00 -0.50 -0.78 107.32 106.36 2jer s GLY 313 Ca 0.23 -1.55 0.01 0.00 0.00 0.00 0.00 44.72 43.41 2jer s GLY 313 CO 0.18 -1.62 -0.06 0.14 0.00 0.00 0.00 173.10 171.74 2jer s VAL 314 N -2.47 0.75 -0.34 1.40 1.01 -0.29 -0.87 120.40 119.59 2jer s VAL 314 Ca 0.18 -0.19 -0.10 0.00 0.00 0.00 0.00 61.98 61.86 2jer s VAL 314 Cb -0.03 -0.77 0.00 0.00 0.00 0.00 0.00 36.38 35.58 2jer s VAL 314 CO 0.06 0.29 0.18 -0.63 0.00 0.00 0.00 175.10 175.01 2jer s ILE 315 N 1.24 4.66 -0.10 2.22 -1.09 -0.18 -0.70 121.20 127.26 2jer s ILE 315 Ca -0.05 -0.55 0.02 0.00 -2.23 0.00 0.00 60.65 57.84 2jer s ILE 315 Cb -0.14 -3.45 -0.02 0.00 -1.58 0.00 0.00 42.46 37.27 2jer s ILE 315 CO -0.02 -0.04 -0.14 -0.69 -1.23 0.00 0.00 174.94 172.81 2jer s VAL 316 N 1.60 2.97 0.46 2.92 1.01 -0.13 -1.54 120.40 127.69 2jer s VAL 316 Ca 0.04 -0.72 -0.24 0.00 0.00 0.00 0.00 61.98 61.06 2jer s VAL 316 Cb -0.18 -2.21 -0.09 0.00 0.00 0.00 0.00 36.38 33.91 2jer s VAL 316 CO 0.07 0.55 1.22 -2.65 0.00 0.00 0.00 175.10 174.29 2jer n PRO 317 N 3.04 1.72 -4.11 2.72 -0.02 -1.26 -1.84 135.00 135.25 2jer n PRO 317 Ca -0.18 0.62 -0.24 0.00 -2.02 0.00 0.00 63.50 61.68 2jer n PRO 317 Cb 0.52 -2.35 -0.17 0.00 -0.02 0.00 0.00 33.50 31.49 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 -2.34 1.29 0.00 -0.52 -1.52 -0.38 -4.76 119.66 111.44 2jer s GLN 318 Ca 0.64 -0.21 0.16 0.00 -1.95 0.00 0.00 55.36 54.00 2jer s GLN 318 Cb -0.49 -1.30 0.10 0.00 -0.22 0.00 0.00 33.01 31.10 2jer s GLN 318 CO 0.55 -0.16 0.96 0.66 -0.25 0.00 0.00 175.29 177.06 2jer n TYR 319 N 4.50 0.00 -1.29 0.91 4.02 -1.26 -1.18 117.16 122.86 2jer n TYR 319 Ca -0.17 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.70 2jer n TYR 319 Cb 0.51 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.82 2jer n TYR 319 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2jer n GLY 320 N 0.95 0.50 3.93 2.72 0.00 -1.26 -4.75 105.19 107.28 2jer n GLY 320 Ca 0.09 -0.93 -0.27 0.00 0.00 0.00 0.00 46.02 44.91 2jer n GLY 320 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jer s ASP 321 N -2.96 6.39 0.56 1.61 2.15 -1.26 -4.99 116.67 118.17 2jer s ASP 321 Ca 0.00 0.46 0.27 0.00 0.43 0.00 0.00 52.55 53.72 2jer s ASP 321 Cb 0.00 -2.04 1.48 0.00 -0.30 0.00 0.00 42.92 42.07 2jer s ASP 321 CO 0.00 -0.11 1.98 1.05 -0.17 0.00 0.00 175.17 177.92 2jer h GLU 322 N 1.74 0.00 -0.22 4.34 4.11 -1.98 -1.33 114.58 121.25 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 -4.04 1.47 -0.05 3.06 5.03 -1.26 -4.38 115.26 115.09 2jer n ASN 323 Ca 0.08 -1.84 -0.08 0.00 0.87 0.00 0.00 54.58 53.60 2jer n ASN 323 Cb 0.58 -0.14 -0.02 0.00 -1.02 0.00 0.00 39.78 39.17 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 1.76 0.03 -0.60 6.41 3.32 -1.63 -1.14 116.42 124.57 2jer h ASP 324 Ca 0.00 0.03 -0.09 0.00 0.02 0.00 0.00 57.03 56.99 2jer h ASP 324 Cb 0.39 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 2jer h ASP 324 CO 0.00 0.05 0.03 -0.09 -1.72 0.00 0.00 179.24 177.50 2jer h ARG 325 N 0.14 1.04 -0.73 3.56 2.43 -1.83 -2.79 114.38 116.21 2jer h ARG 325 Ca 0.10 -0.32 0.05 0.00 -0.81 0.00 0.00 59.98 59.01 2jer h ARG 325 Cb 0.09 -0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 29.49 2jer h ARG 325 CO -0.13 1.01 0.43 1.25 -1.51 0.00 0.00 179.97 181.02 2jer h LEU 326 N 0.93 0.67 -0.53 3.80 5.85 -1.77 -1.12 115.31 123.14 2jer h LEU 326 Ca 0.17 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.95 2jer h LEU 326 Cb 0.52 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 2jer h LEU 326 CO 0.03 0.44 0.30 0.00 -0.34 0.00 0.00 178.44 178.86 2jer h ALA 327 N 1.35 0.69 -0.78 1.25 0.00 -1.04 0.17 119.26 120.89 2jer h ALA 327 Ca 0.32 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 2jer h ALA 327 Cb 0.14 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2jer h ALA 327 CO -0.16 -0.02 0.31 -0.07 0.00 0.00 0.00 179.25 179.30 2jer h LEU 328 N 0.58 1.08 -0.26 0.00 3.38 -1.11 -0.99 115.31 117.99 2jer h LEU 328 Ca 0.23 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 58.03 2jer h LEU 328 Cb 0.08 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2jer h LEU 328 CO -0.13 0.96 0.16 -0.33 0.09 0.00 0.00 178.44 179.19 2jer h GLU 329 N 1.14 0.33 -0.52 1.13 5.08 -0.68 -0.87 114.58 120.19 2jer h GLU 329 Ca 0.26 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.54 2jer h GLU 329 Cb 0.22 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 2jer h GLU 329 CO -0.02 0.22 0.10 1.96 -1.00 0.00 0.00 179.01 180.27 2jer h GLN 330 N 0.34 0.85 -0.57 2.33 4.20 -0.72 -2.08 115.11 119.46 2jer h GLN 330 Ca 0.10 -0.22 -0.10 0.00 0.06 0.00 0.00 58.65 58.49 2jer h GLN 330 Cb -0.02 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.63 2jer h GLN 330 CO -0.03 0.83 -0.05 0.28 -0.67 0.00 0.00 178.83 179.19 2jer h VAL 331 N 0.74 1.26 -0.98 -0.54 2.07 -1.12 -2.48 116.25 115.20 2jer h VAL 331 Ca 0.16 -1.19 0.09 0.00 0.82 0.00 0.00 66.70 66.58 2jer h VAL 331 Cb 0.38 0.88 -0.07 0.00 -1.52 0.00 0.00 31.29 30.95 2jer h VAL 331 CO 0.01 0.43 0.62 -0.61 0.02 0.00 0.00 177.57 178.03 2jer h GLN 332 N 0.92 1.03 0.00 1.57 5.75 -0.83 -1.51 115.11 122.04 2jer h GLN 332 Ca 0.16 -0.06 -0.09 0.00 -0.15 0.00 0.00 58.65 58.50 2jer h GLN 332 Cb 0.60 -0.23 -0.01 0.00 1.07 0.00 0.00 27.48 28.90 2jer h GLN 332 CO 0.04 0.68 -0.45 1.79 -2.65 0.00 0.00 178.83 178.24 2jer h THR 333 N 1.06 1.17 -0.09 2.39 1.35 -1.04 -2.35 112.91 115.40 2jer h THR 333 Ca 0.45 -1.61 -0.11 0.00 -0.55 0.00 0.00 66.41 64.59 2jer h THR 333 Cb 0.30 1.90 -0.01 0.00 -1.73 0.00 0.00 68.15 68.61 2jer h THR 333 CO -0.21 0.44 -0.43 0.24 -0.25 0.00 0.00 175.52 175.30 2jer h MET 334 N 0.00 0.21 -2.26 4.72 2.86 -0.87 -3.35 114.93 116.24 2jer h MET 334 Ca -0.00 -0.10 -0.59 0.00 -2.06 0.00 0.00 59.70 56.94 2jer h MET 334 Cb 0.87 -0.00 -0.40 0.00 0.06 0.00 0.00 31.60 32.12 2jer h MET 334 CO 0.06 0.61 -0.82 1.19 1.06 0.00 0.00 176.91 179.01 2jer n PHE 335 N -4.01 1.66 0.29 -0.22 3.01 -0.70 -4.97 117.46 112.51 2jer n PHE 335 Ca -0.02 -3.87 0.15 0.00 1.01 0.00 0.00 57.45 54.72 2jer n PHE 335 Cb 0.49 -0.40 0.86 0.00 -0.01 0.00 0.00 39.48 40.42 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 4.44 0.00 -0.48 -1.08 0.13 -1.58 -2.01 132.00 131.42 2jer h PRO 336 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2jer h PRO 336 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 2jer h PRO 336 CO 0.64 0.05 0.00 -0.25 -0.23 0.00 0.00 178.00 178.21 2jer n ASP 337 N -3.64 3.59 -4.86 1.44 10.43 -1.26 -4.95 116.55 117.29 2jer n ASP 337 Ca -0.02 -2.00 -0.23 0.00 2.57 0.00 0.00 54.79 55.11 2jer n ASP 337 Cb 0.16 -0.31 -0.04 0.00 1.84 0.00 0.00 41.12 42.77 2jer n ASP 337 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 2jer s LYS 338 N -1.38 3.08 -0.20 -1.24 1.02 -0.76 -5.00 119.74 115.27 2jer s LYS 338 Ca 0.42 -0.92 -0.21 0.00 0.02 0.00 0.00 55.97 55.27 2jer s LYS 338 Cb 0.24 -2.68 -0.02 0.00 -0.52 0.00 0.00 37.83 34.84 2jer s LYS 338 CO 0.32 0.43 0.65 0.21 -0.92 0.00 0.00 175.35 176.04 2jer s LYS 339 N -3.72 4.22 -0.25 1.68 2.20 0.04 -4.96 119.74 118.95 2jer s LYS 339 Ca 0.33 0.65 -0.11 0.00 -0.36 0.00 0.00 55.97 56.48 2jer s LYS 339 Cb -0.09 -3.58 -0.05 0.00 -1.51 0.00 0.00 37.83 32.60 2jer s LYS 339 CO 0.26 -0.26 0.17 0.42 -0.36 0.00 0.00 175.35 175.58 2jer s ILE 340 N 1.96 5.35 -0.18 5.43 -1.09 -1.26 -1.14 121.20 130.26 2jer s ILE 340 Ca 0.29 0.19 0.01 0.00 -2.23 0.00 0.00 60.65 58.91 2jer s ILE 340 Cb -0.16 -3.51 0.03 0.00 -1.58 0.00 0.00 42.46 37.24 2jer s ILE 340 CO 0.10 0.33 -0.14 -0.69 -1.23 0.00 0.00 174.94 173.32 2jer s VAL 341 N 1.18 1.73 0.20 2.92 1.01 0.12 -4.96 120.40 122.60 2jer s VAL 341 Ca 0.08 -0.90 -0.22 0.00 0.00 0.00 0.00 61.98 60.94 2jer s VAL 341 Cb -0.14 -1.69 -0.08 0.00 0.00 0.00 0.00 36.38 34.47 2jer s VAL 341 CO 0.06 0.33 0.75 -0.83 0.00 0.00 0.00 175.10 175.41 2jer s GLY 342 N 1.39 2.73 -0.03 4.51 0.00 -1.26 -0.96 107.32 113.70 2jer s GLY 342 Ca 0.02 0.24 0.03 0.00 0.00 0.00 0.00 44.72 45.01 2jer s GLY 342 CO -0.10 0.66 -0.11 0.14 0.00 0.00 0.00 173.10 173.69 2jer s VAL 343 N -1.39 0.96 -0.39 1.40 1.01 -0.77 -4.92 120.40 116.30 2jer s VAL 343 Ca 0.40 -0.46 -0.28 0.00 0.00 0.00 0.00 61.98 61.64 2jer s VAL 343 Cb -0.19 -0.84 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 2jer s VAL 343 CO 0.23 0.29 1.79 0.20 0.00 0.00 0.00 175.10 177.61 2jer s ASN 344 N 0.12 5.78 -0.09 3.32 0.01 -1.26 -1.25 114.94 121.58 2jer s ASN 344 Ca -0.03 1.08 0.13 0.00 -0.71 0.00 0.00 52.86 53.33 2jer s ASN 344 Cb -0.09 -2.53 0.20 0.00 0.41 0.00 0.00 41.25 39.25 2jer s ASN 344 CO 0.01 -1.83 1.10 0.35 -1.51 0.00 0.00 177.10 175.22 2jer n THR 345 N 7.36 1.25 -0.11 1.60 -2.24 -0.32 -4.74 114.28 117.07 2jer n THR 345 Ca 0.22 -1.55 0.12 0.00 -2.27 0.00 0.00 64.05 60.58 2jer n THR 345 Cb 0.48 0.03 0.49 0.00 -2.10 0.00 0.00 70.33 69.23 2jer n THR 345 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 2jer h VAL 346 N 2.48 0.88 0.00 2.28 3.04 -1.85 -0.65 116.25 122.43 2jer h VAL 346 Ca -0.01 -0.15 -0.03 0.00 -1.01 0.00 0.00 66.70 65.51 2jer h VAL 346 Cb 1.15 0.40 -0.00 0.00 -2.01 0.00 0.00 31.29 30.83 2jer h VAL 346 CO 0.00 0.08 -0.13 -0.33 -1.01 0.00 0.00 177.57 176.18 2jer h GLU 347 N 0.44 0.00 -0.02 4.17 4.39 -1.93 -1.98 114.58 119.65 2jer h GLU 347 Ca 0.30 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.75 2jer h GLU 347 Cb 0.60 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.26 2jer h GLU 347 CO -0.09 0.13 -0.99 0.28 -1.16 0.00 0.00 179.01 177.18 2jer h VAL 348 N 0.00 1.29 0.00 3.13 2.07 -1.43 -3.31 116.25 118.00 2jer h VAL 348 Ca -0.00 -2.22 -0.07 0.00 0.82 0.00 0.00 66.70 65.23 2jer h VAL 348 Cb 0.26 2.32 -0.01 0.00 -1.52 0.00 0.00 31.29 32.34 2jer h VAL 348 CO 0.02 0.69 -0.33 1.62 0.02 0.00 0.00 177.57 179.58 2jer h VAL 349 N 0.40 1.17 -0.19 2.57 3.04 -0.85 -1.02 116.25 121.37 2jer h VAL 349 Ca -0.11 -1.17 0.06 0.00 -1.01 0.00 0.00 66.70 64.47 2jer h VAL 349 Cb 1.64 1.64 -0.01 0.00 -2.01 0.00 0.00 31.29 32.55 2jer h VAL 349 CO 0.19 0.33 0.17 1.88 -1.01 0.00 0.00 177.57 179.13 2jer h TYR 350 N 0.00 0.00 -0.24 3.17 0.99 -1.56 -1.64 116.97 117.69 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 0.61 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.34 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 -1.47 0.85 0.00 3.88 0.00 -0.39 -4.95 105.19 103.10 2jer n GLY 351 Ca 0.02 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 1.28 1.10 0.00 -0.02 0.00 -0.62 -5.06 105.19 101.88 2jer n GLY 352 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2jer n GLY 352 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jer n GLY 353 N -0.92 1.75 0.00 -0.02 0.00 -1.25 -4.86 105.19 99.89 2jer n GLY 353 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 -0.03 0.00 -0.18 1.61 5.15 -1.26 -2.84 115.26 117.70 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 0.79 0.00 -1.44 2.04 -1.90 -1.91 117.51 115.09 2jer h ILE 355 Ca 0.00 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2jer h ILE 355 Cb 0.00 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 2jer h ILE 355 CO 0.00 0.07 0.00 1.57 0.00 0.00 0.00 178.15 179.79 2jer n HIS 356 N -5.00 0.00 0.00 1.37 -0.00 -0.30 -3.16 115.22 108.13 2jer n HIS 356 Ca 0.07 -0.06 0.00 0.00 0.46 0.00 0.00 57.72 58.19 2jer n HIS 356 Cb 0.24 -0.12 0.00 0.00 -0.12 0.00 0.00 29.99 29.99 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 0.95 0.00 -4.28 3.57 -5.35 -0.72 -4.56 119.36 108.96 2jer n ILE 358 Ca 0.00 0.00 -0.18 0.00 -0.27 0.00 0.00 62.75 62.30 2jer n ILE 358 Cb 0.06 0.00 -0.11 0.00 -1.74 0.00 0.00 39.64 37.85 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 1.47 -0.06 7.28 -4.23 -1.19 -4.28 115.64 114.63 2jer s THR 359 Ca 0.00 -1.91 -0.03 0.00 -1.18 0.00 0.00 61.69 58.57 2jer s THR 359 Cb 0.00 -1.75 0.04 0.00 1.34 0.00 0.00 72.50 72.13 2jer s THR 359 CO 0.00 -0.49 0.11 -1.58 -0.54 0.00 0.00 174.62 172.12 2jer s GLN 360 N -3.08 -0.02 0.51 3.99 2.00 -0.69 -2.57 119.66 119.80 2jer s GLN 360 Ca 0.14 0.46 -0.13 0.00 -2.00 0.00 0.00 55.36 53.83 2jer s GLN 360 Cb -0.03 -0.38 -0.06 0.00 0.80 0.00 0.00 33.01 33.33 2jer s GLN 360 CO 0.04 -0.31 0.94 1.14 -0.50 0.00 0.00 175.29 176.60 2jer s GLN 361 N 2.17 3.82 -0.21 1.67 0.00 -1.26 -1.16 119.66 124.68 2jer s GLN 361 Ca 0.03 0.77 0.01 0.00 -0.00 0.00 0.00 55.36 56.17 2jer s GLN 361 Cb -0.12 -2.19 0.05 0.00 0.00 0.00 0.00 33.01 30.75 2jer s GLN 361 CO -0.04 -0.29 -0.09 -2.00 0.00 0.00 0.00 175.29 172.87 2jer s GLU 362 N -4.31 1.95 0.64 9.60 2.12 0.43 -4.69 118.70 124.44 2jer s GLU 362 Ca 0.56 -0.92 -0.15 0.00 0.36 0.00 0.00 54.97 54.82 2jer s GLU 362 Cb -0.10 -2.50 -0.01 0.00 0.26 0.00 0.00 34.13 31.78 2jer s GLU 362 CO 0.37 -0.48 1.09 -1.25 -0.54 0.00 0.00 175.26 174.45 2jer s PRO 363 N 1.37 2.95 0.34 4.30 0.04 -1.26 0.11 135.00 142.85 2jer s PRO 363 Ca -0.03 1.33 -0.28 0.00 0.04 0.00 0.00 61.00 62.06 2jer s PRO 363 Cb -0.17 -1.97 -0.10 0.00 0.04 0.00 0.00 34.50 32.29 2jer s PRO 363 CO -0.07 -1.12 1.32 0.15 0.04 0.00 0.00 177.00 177.32 2jer s LYS 364 N -4.11 4.29 0.00 4.56 1.02 -0.00 -4.17 119.74 121.33 2jer s LYS 364 Ca 0.66 2.24 0.10 0.00 0.02 0.00 0.00 55.97 58.98 2jer s LYS 364 Cb -0.19 -3.03 0.57 0.00 -0.52 0.00 0.00 37.83 34.66 2jer s LYS 364 CO 0.40 -0.25 1.02 0.54 -0.92 0.00 0.00 175.35 176.14