#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jhn s TRP 2 N 0.00 1.55 -0.04 2.03 0.51 -0.09 -5.00 118.94 117.90 2jhn s TRP 2 Ca 0.00 -0.69 0.03 0.00 -2.12 0.00 0.00 56.10 53.32 2jhn s TRP 2 Cb 0.00 -0.78 0.00 0.00 -0.81 0.00 0.00 33.47 31.89 2jhn s TRP 2 CO 0.00 0.21 -0.12 1.03 -0.51 0.00 0.00 176.95 177.55 2jhn s ARG 3 N -3.71 1.35 -0.36 4.98 0.52 -1.26 -0.57 118.95 119.90 2jhn s ARG 3 Ca 0.22 -0.42 -0.11 0.00 -0.52 0.00 0.00 55.73 54.89 2jhn s ARG 3 Cb 0.02 -1.20 0.02 0.00 0.52 0.00 0.00 34.95 34.30 2jhn s ARG 3 CO 0.05 0.14 0.20 0.42 0.02 0.00 0.00 175.30 176.13 2jhn s ILE 4 N 0.22 4.62 -0.20 1.52 1.01 0.94 -4.97 121.20 124.34 2jhn s ILE 4 Ca -0.05 -0.75 -0.15 0.00 0.00 0.00 0.00 60.65 59.70 2jhn s ILE 4 Cb -0.11 -3.53 -0.04 0.00 0.01 0.00 0.00 42.46 38.80 2jhn s ILE 4 CO 0.02 -0.17 0.36 -1.61 0.00 0.00 0.00 174.94 173.53 2jhn s GLU 5 N 1.57 4.17 0.10 2.79 0.41 -1.26 -1.44 118.70 125.04 2jhn s GLU 5 Ca 0.03 0.13 0.03 0.00 -0.41 0.00 0.00 54.97 54.74 2jhn s GLU 5 Cb -0.19 -3.53 -0.04 0.00 -1.78 0.00 0.00 34.13 28.59 2jhn s GLU 5 CO 0.07 -0.01 0.15 -0.51 -0.49 0.00 0.00 175.26 174.47 2jhn s LEU 6 N 1.22 4.00 0.21 1.80 1.43 0.07 -5.02 118.68 122.39 2jhn s LEU 6 Ca 0.17 0.06 0.11 0.00 -1.03 0.00 0.00 54.13 53.43 2jhn s LEU 6 Cb -0.14 -2.63 0.04 0.00 0.03 0.00 0.00 46.19 43.48 2jhn s LEU 6 CO 0.07 0.14 1.42 0.50 0.23 0.00 0.00 176.35 178.71 2jhn h LYS 7 N 2.93 0.00 -6.12 1.70 3.64 -1.91 -3.47 116.57 113.35 2jhn h LYS 7 Ca -0.47 0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 58.36 2jhn h LYS 7 Cb 1.17 0.00 -0.22 0.00 -0.41 0.00 0.00 32.23 32.77 2jhn h LYS 7 CO 0.68 0.76 -0.82 -1.58 -2.27 0.00 0.00 179.45 176.21 2jhn s HIS 8 N -3.01 1.76 0.56 1.91 2.46 -1.26 -5.11 115.29 112.60 2jhn s HIS 8 Ca 0.01 -0.42 -0.21 0.00 0.47 0.00 0.00 55.06 54.92 2jhn s HIS 8 Cb 0.10 -0.97 -0.04 0.00 -0.13 0.00 0.00 32.58 31.54 2jhn s HIS 8 CO 0.78 0.19 1.26 0.00 -2.47 0.00 0.00 174.74 174.51 2jhn s ALA 9 N -1.15 2.71 -0.01 1.58 0.00 -1.26 -4.71 121.76 118.91 2jhn s ALA 9 Ca 0.06 1.14 0.06 0.00 0.00 0.00 0.00 51.96 53.22 2jhn s ALA 9 Cb -0.10 -3.49 -0.02 0.00 0.00 0.00 0.00 23.12 19.51 2jhn s ALA 9 CO 0.04 -1.19 -0.20 0.54 0.00 0.00 0.00 175.76 174.95 2jhn s VAL 10 N -1.45 1.56 -0.66 0.00 0.11 -0.56 -4.94 120.40 114.46 2jhn s VAL 10 Ca 0.73 -0.85 -0.23 0.00 -2.93 0.00 0.00 61.98 58.70 2jhn s VAL 10 Cb -0.35 -1.30 0.07 0.00 -1.53 0.00 0.00 36.38 33.27 2jhn s VAL 10 CO 0.39 0.44 0.99 0.21 -3.33 0.00 0.00 175.10 173.80 2jhn s ASN 11 N -0.47 6.17 0.26 3.54 3.84 0.52 -4.82 114.94 123.98 2jhn s ASN 11 Ca 0.08 -0.94 -0.04 0.00 0.21 0.00 0.00 52.86 52.16 2jhn s ASN 11 Cb -0.08 -2.43 0.33 0.00 -0.55 0.00 0.00 41.25 38.52 2jhn s ASN 11 CO -0.01 -1.47 1.89 -0.25 -2.79 0.00 0.00 177.10 174.47 2jhn h TRP 12 N 9.60 1.10 -0.75 0.43 2.91 -1.94 -2.12 115.95 125.18 2jhn h TRP 12 Ca -0.29 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.71 2jhn h TRP 12 Cb 1.07 -0.35 -0.04 0.00 -0.51 0.00 0.00 29.16 29.33 2jhn h TRP 12 CO 0.98 0.76 0.48 0.93 -1.03 0.00 0.00 178.44 180.57 2jhn h GLU 13 N 1.12 0.99 -0.56 2.65 3.07 -1.97 -0.08 114.58 119.81 2jhn h GLU 13 Ca 0.28 -0.07 -0.10 0.00 -0.50 0.00 0.00 59.36 58.98 2jhn h GLU 13 Cb 0.03 -0.22 -0.02 0.00 -0.84 0.00 0.00 28.75 27.70 2jhn h GLU 13 CO -0.04 0.67 -0.03 -0.07 -1.40 0.00 0.00 179.01 178.13 2jhn h LEU 14 N 1.02 0.99 -0.61 1.33 3.38 -1.87 -0.35 115.31 119.20 2jhn h LEU 14 Ca 0.27 -0.32 0.07 0.00 0.09 0.00 0.00 57.88 57.99 2jhn h LEU 14 Cb -0.10 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.33 2jhn h LEU 14 CO -0.06 1.08 0.29 0.11 0.09 0.00 0.00 178.44 179.95 2jhn h LYS 15 N 0.89 0.52 -0.02 1.13 1.79 -0.91 -2.68 116.57 117.28 2jhn h LYS 15 Ca 0.15 -0.03 -0.12 0.00 -2.18 0.00 0.00 60.65 58.47 2jhn h LYS 15 Cb 0.58 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 31.10 2jhn h LYS 15 CO 0.03 0.34 -0.56 0.52 -1.08 0.00 0.00 179.45 178.71 2jhn h MET 16 N 0.54 0.07 0.00 3.15 2.86 -0.80 -2.94 114.93 117.81 2jhn h MET 16 Ca 0.29 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.88 2jhn h MET 16 Cb 0.26 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.93 2jhn h MET 16 CO -0.23 0.61 -0.00 0.87 1.06 0.00 0.00 176.91 179.22 2jhn h LYS 17 N 0.06 0.00 0.00 1.72 1.57 -0.72 -1.90 116.57 117.30 2jhn h LYS 17 Ca -0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 2jhn h LYS 17 Cb 1.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.31 2jhn h LYS 17 CO 0.08 0.00 -0.25 0.35 -0.57 0.00 0.00 179.45 179.06 2jhn h PHE 18 N 0.00 0.00 -3.18 -1.35 3.57 -1.40 -3.42 116.94 111.17 2jhn h PHE 18 Ca -0.00 0.00 -0.53 0.00 3.53 0.00 0.00 57.97 60.97 2jhn h PHE 18 Cb 0.02 0.00 0.01 0.00 2.79 0.00 0.00 35.95 38.76 2jhn h PHE 18 CO 0.00 0.25 0.59 -0.06 -2.23 0.00 0.00 178.31 176.85 2jhn s PHE 19 N -4.32 3.41 0.00 0.41 0.08 -0.72 -4.96 117.98 111.88 2jhn s PHE 19 Ca -0.03 1.25 -0.02 0.00 0.12 0.00 0.00 56.93 58.24 2jhn s PHE 19 Cb 0.14 -3.47 -0.27 0.00 -0.57 0.00 0.00 43.02 38.85 2jhn s PHE 19 CO 0.68 -1.46 0.86 0.28 -0.10 0.00 0.00 175.22 175.47 2jhn h VAL 20 N 4.42 1.15 -2.41 -0.44 2.07 -1.87 -3.39 116.25 115.78 2jhn h VAL 20 Ca -0.42 -2.80 -0.59 0.00 0.82 0.00 0.00 66.70 63.71 2jhn h VAL 20 Cb 1.21 2.75 -0.40 0.00 -1.52 0.00 0.00 31.29 33.33 2jhn h VAL 20 CO 0.82 0.81 -0.86 0.18 0.02 0.00 0.00 177.57 178.54 2jhn n LEU 21 N -3.44 1.16 -0.10 2.57 4.77 -1.26 -5.00 117.00 115.69 2jhn n LEU 21 Ca -0.16 -4.81 0.02 0.00 -0.03 0.00 0.00 56.01 51.02 2jhn n LEU 21 Cb 1.04 0.08 0.33 0.00 -2.33 0.00 0.00 43.42 42.54 2jhn n LEU 21 CO 0.50 1.92 1.17 1.55 -1.33 0.00 0.00 177.39 181.20 2jhn h PRO 22 N 4.94 0.74 -0.11 3.23 0.13 -1.88 -2.83 132.00 136.22 2jhn h PRO 22 Ca 0.18 -0.06 -0.16 0.00 -0.87 0.00 0.00 66.00 65.10 2jhn h PRO 22 Cb 0.83 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 31.79 2jhn h PRO 22 CO 0.55 0.52 -0.61 1.05 -0.23 0.00 0.00 178.00 179.27 2jhn h GLU 23 N 0.76 0.37 -6.43 0.86 9.09 -1.89 0.20 114.58 117.54 2jhn h GLU 23 Ca 0.20 -0.25 -0.53 0.00 0.05 0.00 0.00 59.36 58.83 2jhn h GLU 23 Cb -0.04 0.04 -0.03 0.00 -1.65 0.00 0.00 28.75 27.07 2jhn h GLU 23 CO -0.04 0.87 0.27 -1.17 0.05 0.00 0.00 179.01 178.99 2jhn s LEU 24 N -8.06 4.46 -0.57 3.06 2.96 -1.07 -4.81 118.68 114.65 2jhn s LEU 24 Ca -0.05 1.62 -0.27 0.00 -0.22 0.00 0.00 54.13 55.21 2jhn s LEU 24 Cb 0.11 -3.42 -0.02 0.00 0.50 0.00 0.00 46.19 43.36 2jhn s LEU 24 CO 0.82 -0.05 1.80 -2.84 -1.32 0.00 0.00 176.35 174.76 2jhn s PRO 25 N 0.08 2.79 -0.11 0.98 0.02 -1.26 -4.56 135.00 132.95 2jhn s PRO 25 Ca 0.44 0.69 0.14 0.00 0.02 0.00 0.00 61.00 62.28 2jhn s PRO 25 Cb -0.22 -4.34 0.38 0.00 0.02 0.00 0.00 34.50 30.35 2jhn s PRO 25 CO 0.26 -2.53 1.29 0.25 -0.33 0.00 0.00 177.00 175.95 2jhn n THR 26 N 7.19 1.76 0.97 0.99 -2.24 -1.26 -4.22 114.28 117.47 2jhn n THR 26 Ca 0.20 -1.62 0.13 0.00 -2.27 0.00 0.00 64.05 60.49 2jhn n THR 26 Cb 0.51 0.02 0.45 0.00 -2.10 0.00 0.00 70.33 69.21 2jhn n THR 26 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2jhn n PRO 27 N -0.38 0.02 -2.10 -0.78 -0.04 -1.26 -4.68 135.00 125.78 2jhn n PRO 27 Ca 0.16 0.01 -0.40 0.00 -0.04 0.00 0.00 63.50 63.23 2jhn n PRO 27 Cb 0.67 -1.52 -0.01 0.00 -0.04 0.00 0.00 33.50 32.60 2jhn n PRO 27 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2jhn s ASP 28 N -3.09 6.57 -0.07 3.54 1.01 -1.26 -4.44 116.67 118.94 2jhn s ASP 28 Ca 0.12 2.66 0.04 0.00 0.71 0.00 0.00 52.55 56.09 2jhn s ASP 28 Cb 0.18 -2.64 -0.00 0.00 1.01 0.00 0.00 42.92 41.46 2jhn s ASP 28 CO 0.61 -0.67 -0.21 -0.69 0.21 0.00 0.00 175.17 174.42 2jhn s VAL 29 N -1.20 1.75 -0.18 -1.27 1.01 -0.57 -4.18 120.40 115.75 2jhn s VAL 29 Ca 0.52 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.64 2jhn s VAL 29 Cb -0.39 -1.51 0.03 0.00 0.00 0.00 0.00 36.38 34.52 2jhn s VAL 29 CO 0.51 0.49 -0.13 -0.69 0.00 0.00 0.00 175.10 175.28 2jhn s VAL 30 N 0.16 1.74 -0.07 2.92 1.01 0.06 -0.53 120.40 125.68 2jhn s VAL 30 Ca -0.10 -0.92 -0.01 0.00 0.00 0.00 0.00 61.98 60.95 2jhn s VAL 30 Cb -0.15 -1.71 0.03 0.00 0.00 0.00 0.00 36.38 34.55 2jhn s VAL 30 CO 0.05 0.32 -0.01 -1.61 0.00 0.00 0.00 175.10 173.85 2jhn s GLU 31 N 1.38 0.71 -1.48 2.72 2.02 -0.59 -4.15 118.70 119.31 2jhn s GLU 31 Ca 0.01 0.05 -0.06 0.00 0.02 0.00 0.00 54.97 54.99 2jhn s GLU 31 Cb -0.15 -0.99 0.05 0.00 0.10 0.00 0.00 34.13 33.14 2jhn s GLU 31 CO -0.10 -0.26 0.59 0.43 0.02 0.00 0.00 175.26 175.94 2jhn n SER 32 N 4.94 -1.57 -0.18 -0.19 7.64 -1.26 -1.73 113.62 121.27 2jhn n SER 32 Ca -0.11 -0.97 -0.02 0.00 1.01 0.00 0.00 58.87 58.78 2jhn n SER 32 Cb 0.50 -3.15 -0.01 0.00 -1.01 0.00 0.00 64.21 60.54 2jhn n SER 32 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jhn n GLY 33 N -1.79 0.50 3.33 0.23 0.00 -1.26 -4.99 105.19 101.21 2jhn n GLY 33 Ca -0.18 -0.17 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 2jhn n GLY 33 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jhn s VAL 34 N -1.78 3.47 0.08 1.61 1.01 -0.70 -4.71 120.40 119.38 2jhn s VAL 34 Ca 0.00 -0.46 -0.19 0.00 0.00 0.00 0.00 61.98 61.33 2jhn s VAL 34 Cb 0.00 -2.58 -0.07 0.00 0.00 0.00 0.00 36.38 33.73 2jhn s VAL 34 CO 0.00 0.42 0.56 0.86 0.00 0.00 0.00 175.10 176.95 2jhn s TRP 35 N 1.42 3.78 0.02 5.22 -0.00 -0.70 -1.55 118.94 127.14 2jhn s TRP 35 Ca 0.05 1.25 -0.19 0.00 -0.00 0.00 0.00 56.10 57.21 2jhn s TRP 35 Cb -0.14 -2.48 0.04 0.00 -0.00 0.00 0.00 33.47 30.88 2jhn s TRP 35 CO -0.02 0.57 0.43 -0.98 -0.00 0.00 0.00 176.95 176.95 2jhn s ARG 36 N -1.21 0.88 0.24 5.86 1.70 0.31 -1.07 118.95 125.66 2jhn s ARG 36 Ca 0.30 -0.24 -0.22 0.00 -0.47 0.00 0.00 55.73 55.10 2jhn s ARG 36 Cb -0.19 0.40 0.03 0.00 -0.57 0.00 0.00 34.95 34.62 2jhn s ARG 36 CO 0.19 -0.29 0.75 -0.98 -1.08 0.00 0.00 175.30 173.89 2jhn s ARG 37 N -2.04 1.64 -0.05 3.89 1.70 -0.90 -1.51 118.95 121.68 2jhn s ARG 37 Ca -0.08 -0.88 -0.15 0.00 -0.47 0.00 0.00 55.73 54.15 2jhn s ARG 37 Cb -0.02 0.58 -0.05 0.00 -0.57 0.00 0.00 34.95 34.89 2jhn s ARG 37 CO 0.01 -0.75 0.40 0.00 -1.08 0.00 0.00 175.30 173.88 2jhn s ALA 38 N -3.80 3.64 0.11 7.88 0.00 0.38 -1.82 121.76 128.15 2jhn s ALA 38 Ca 0.10 -0.25 0.10 0.00 0.00 0.00 0.00 51.96 51.91 2jhn s ALA 38 Cb -0.05 -2.43 -0.04 0.00 0.00 0.00 0.00 23.12 20.61 2jhn s ALA 38 CO 0.04 0.34 -0.26 0.96 0.00 0.00 0.00 175.76 176.84 2jhn s ILE 39 N -0.54 2.16 -0.21 0.00 -4.36 -0.15 -4.14 121.20 113.96 2jhn s ILE 39 Ca 0.23 -1.65 -0.22 0.00 -0.26 0.00 0.00 60.65 58.75 2jhn s ILE 39 Cb -0.16 -1.90 -0.02 0.00 1.25 0.00 0.00 42.46 41.63 2jhn s ILE 39 CO 0.11 0.13 0.69 -0.69 0.24 0.00 0.00 174.94 175.42 2jhn s VAL 40 N -1.01 4.96 -0.13 8.37 1.01 -1.26 -0.18 120.40 132.16 2jhn s VAL 40 Ca 0.13 1.30 -0.02 0.00 0.00 0.00 0.00 61.98 63.39 2jhn s VAL 40 Cb -0.10 -4.00 0.04 0.00 0.00 0.00 0.00 36.38 32.32 2jhn s VAL 40 CO 0.05 0.05 -0.00 -0.22 0.00 0.00 0.00 175.10 174.98 2jhn s LEU 41 N 2.20 0.99 -1.26 3.92 2.96 0.25 -4.81 118.68 122.93 2jhn s LEU 41 Ca 0.31 -0.43 -0.20 0.00 -0.22 0.00 0.00 54.13 53.59 2jhn s LEU 41 Cb -0.16 -0.60 0.01 0.00 0.50 0.00 0.00 46.19 45.94 2jhn s LEU 41 CO 0.10 -0.22 0.60 0.47 -1.32 0.00 0.00 176.35 175.98 2jhn n ASP 42 N 5.05 -3.32 -0.14 3.68 8.00 -1.26 -2.32 116.55 126.25 2jhn n ASP 42 Ca -0.09 -1.14 -0.02 0.00 0.71 0.00 0.00 54.79 54.25 2jhn n ASP 42 Cb 0.49 -2.56 -0.01 0.00 -0.02 0.00 0.00 41.12 39.02 2jhn n ASP 42 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jhn n GLY 43 N -1.97 0.45 2.94 0.44 0.00 -1.26 -4.99 105.19 100.79 2jhn n GLY 43 Ca -0.16 -0.13 -0.11 0.00 0.00 0.00 0.00 46.02 45.62 2jhn n GLY 43 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2jhn s ARG 44 N -1.23 0.21 -0.06 1.61 1.04 -0.98 -5.13 118.95 114.40 2jhn s ARG 44 Ca 0.00 -0.34 -0.25 0.00 -1.04 0.00 0.00 55.73 54.10 2jhn s ARG 44 Cb 0.00 -0.01 -0.03 0.00 -2.04 0.00 0.00 34.95 32.87 2jhn s ARG 44 CO 0.00 -0.01 0.79 0.00 -0.04 0.00 0.00 175.30 176.04 2jhn s ALA 45 N -0.75 3.31 0.18 7.88 0.00 -1.26 0.84 121.76 131.97 2jhn s ALA 45 Ca -0.08 0.23 0.10 0.00 0.00 0.00 0.00 51.96 52.21 2jhn s ALA 45 Cb -0.05 -3.09 -0.04 0.00 0.00 0.00 0.00 23.12 19.93 2jhn s ALA 45 CO -0.00 -0.21 -0.17 0.14 0.00 0.00 0.00 175.76 175.52 2jhn s VAL 46 N 1.03 2.78 -0.02 0.00 -7.23 0.75 -4.94 120.40 112.76 2jhn s VAL 46 Ca 0.41 -1.82 -0.23 0.00 -1.81 0.00 0.00 61.98 58.53 2jhn s VAL 46 Cb -0.18 -2.35 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 2jhn s VAL 46 CO 0.20 -0.10 0.70 0.00 -0.31 0.00 0.00 175.10 175.60 2jhn s ALA 47 N -1.64 3.37 -0.02 1.32 0.00 -1.26 -0.98 121.76 122.55 2jhn s ALA 47 Ca 0.22 0.16 0.02 0.00 0.00 0.00 0.00 51.96 52.37 2jhn s ALA 47 Cb -0.09 -2.93 0.00 0.00 0.00 0.00 0.00 23.12 20.10 2jhn s ALA 47 CO 0.12 -0.01 -0.08 0.08 0.00 0.00 0.00 175.76 175.87 2jhn s VAL 48 N 0.40 0.66 0.06 0.00 1.01 -0.76 -2.27 120.40 119.51 2jhn s VAL 48 Ca 0.37 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.05 2jhn s VAL 48 Cb -0.19 -0.59 -0.03 0.00 0.00 0.00 0.00 36.38 35.57 2jhn s VAL 48 CO 0.19 0.21 -0.06 0.00 0.00 0.00 0.00 175.10 175.44 2jhn s MET 49 N 0.12 0.64 -0.03 2.72 0.23 0.82 -2.11 119.30 121.68 2jhn s MET 49 Ca -0.01 -1.06 -0.16 0.00 -1.03 0.00 0.00 55.69 53.42 2jhn s MET 49 Cb -0.07 -0.10 0.03 0.00 -1.53 0.00 0.00 34.83 33.16 2jhn s MET 49 CO 0.00 -0.02 0.34 0.00 -2.03 0.00 0.00 175.02 173.31 2jhn s ALA 50 N -2.82 -0.87 -0.13 3.16 0.00 -0.23 -1.38 121.76 119.49 2jhn s ALA 50 Ca 0.01 0.49 -0.30 0.00 0.00 0.00 0.00 51.96 52.17 2jhn s ALA 50 Cb -0.00 -0.03 0.12 0.00 0.00 0.00 0.00 23.12 23.21 2jhn s ALA 50 CO -0.04 -0.25 0.96 1.52 0.00 0.00 0.00 175.76 177.94 2jhn s TYR 51 N -1.10 -0.39 0.28 0.00 -0.85 -0.68 -1.71 117.35 112.91 2jhn s TYR 51 Ca -0.11 0.62 -0.29 0.00 -0.52 0.00 0.00 57.07 56.76 2jhn s TYR 51 Cb -0.05 0.46 -0.09 0.00 0.38 0.00 0.00 41.96 42.66 2jhn s TYR 51 CO 0.04 -0.39 1.07 -1.25 -1.52 0.00 0.00 175.55 173.50 2jhn s PRO 52 N -1.38 4.63 -0.02 -3.49 0.04 -1.26 -0.42 135.00 133.10 2jhn s PRO 52 Ca -0.02 1.73 0.19 0.00 0.04 0.00 0.00 61.00 62.95 2jhn s PRO 52 Cb -0.00 -3.14 -0.29 0.00 0.04 0.00 0.00 34.50 31.10 2jhn s PRO 52 CO 0.01 0.23 0.46 -0.85 0.04 0.00 0.00 177.00 176.89 2jhn n GLU 53 N 1.12 0.61 -3.93 4.56 0.28 -0.36 -4.84 120.64 118.08 2jhn n GLU 53 Ca -0.01 -0.16 -0.10 0.00 -0.16 0.00 0.00 57.16 56.73 2jhn n GLU 53 Cb 0.46 -1.45 -0.02 0.00 1.43 0.00 0.00 31.44 31.86 2jhn n GLU 53 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 2jhn s SER 54 N -4.09 0.17 0.51 -1.84 1.04 -1.18 -4.99 113.70 103.31 2jhn s SER 54 Ca -0.06 -1.10 0.29 0.00 0.48 0.00 0.00 55.95 55.56 2jhn s SER 54 Cb 0.13 0.73 1.39 0.00 0.10 0.00 0.00 66.02 68.37 2jhn s SER 54 CO 0.80 -1.42 1.86 1.05 0.98 0.00 0.00 173.24 176.52 2jhn h GLU 55 N 2.08 0.10 -0.06 4.02 4.11 -1.97 -2.74 114.58 120.12 2jhn h GLU 55 Ca -0.28 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.15 2jhn h GLU 55 Cb 1.25 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.47 2jhn h GLU 55 CO 0.36 0.07 0.00 0.54 0.07 0.00 0.00 179.01 180.05 2jhn n ARG 56 N -4.33 2.55 -3.70 1.06 1.74 -1.26 -1.49 116.66 111.23 2jhn n ARG 56 Ca 0.20 -1.92 -0.21 0.00 -0.77 0.00 0.00 57.85 55.16 2jhn n ARG 56 Cb 0.95 -1.21 -0.18 0.00 -1.02 0.00 0.00 32.46 31.00 2jhn n ARG 56 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2jhn s THR 57 N -1.57 0.04 -0.23 0.55 2.01 -1.04 -0.75 115.64 114.65 2jhn s THR 57 Ca 0.13 0.33 -0.07 0.00 0.31 0.00 0.00 61.69 62.40 2jhn s THR 57 Cb 0.10 -0.27 -0.03 0.00 0.01 0.00 0.00 72.50 72.31 2jhn s THR 57 CO 0.03 0.20 0.05 -0.63 -0.69 0.00 0.00 174.62 173.58 2jhn s ILE 58 N 2.11 4.20 0.11 1.82 -1.09 -0.52 -1.22 121.20 126.61 2jhn s ILE 58 Ca 0.05 -0.21 -0.27 0.00 -2.23 0.00 0.00 60.65 57.99 2jhn s ILE 58 Cb -0.12 -2.94 -0.06 0.00 -1.58 0.00 0.00 42.46 37.75 2jhn s ILE 58 CO -0.04 0.37 0.83 -0.69 -1.23 0.00 0.00 174.94 174.19 2jhn s VAL 59 N 1.36 4.53 -0.09 2.92 1.01 0.44 -0.04 120.40 130.54 2jhn s VAL 59 Ca 0.05 1.79 0.03 0.00 0.00 0.00 0.00 61.98 63.85 2jhn s VAL 59 Cb -0.15 -4.19 -0.01 0.00 0.00 0.00 0.00 36.38 32.03 2jhn s VAL 59 CO 0.03 0.40 -0.19 -0.69 0.00 0.00 0.00 175.10 174.65 2jhn s VAL 60 N -0.40 2.56 0.14 2.92 1.01 0.27 -1.68 120.40 125.21 2jhn s VAL 60 Ca 0.40 -0.86 0.08 0.00 0.00 0.00 0.00 61.98 61.60 2jhn s VAL 60 Cb -0.22 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 2jhn s VAL 60 CO 0.26 0.55 -0.20 -1.61 0.00 0.00 0.00 175.10 174.11 2jhn s GLU 61 N 0.07 1.21 0.00 2.72 2.02 -0.48 -0.91 118.70 123.33 2jhn s GLU 61 Ca -0.08 -1.30 0.00 0.00 0.02 0.00 0.00 54.97 53.61 2jhn s GLU 61 Cb -0.15 -1.36 0.00 0.00 0.10 0.00 0.00 34.13 32.72 2jhn s GLU 61 CO 0.05 0.30 0.00 0.41 0.02 0.00 0.00 175.26 176.04 2jhn n GLY 62 N 0.65 -0.56 1.01 -1.39 0.00 -1.26 -0.13 105.19 103.52 2jhn n GLY 62 Ca -0.16 -1.05 0.08 0.00 0.00 0.00 0.00 46.02 44.88 2jhn n GLY 62 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2jhn n ASN 63 N 0.00 3.82 -4.73 1.61 6.94 -0.96 -4.95 115.26 116.98 2jhn n ASN 63 Ca 0.00 -2.48 -0.30 0.00 -0.02 0.00 0.00 54.58 51.78 2jhn n ASN 63 Cb 0.00 -0.44 0.13 0.00 -2.36 0.00 0.00 39.78 37.11 2jhn n ASN 63 CO 0.00 0.00 0.00 0.72 -1.03 0.00 0.00 177.26 176.95 2jhn s PHE 64 N -1.87 2.40 0.51 -2.53 -0.12 -1.26 -4.91 117.98 110.19 2jhn s PHE 64 Ca 0.38 1.22 -0.15 0.00 -0.05 0.00 0.00 56.93 58.33 2jhn s PHE 64 Cb 0.26 -3.16 -0.07 0.00 -0.63 0.00 0.00 43.02 39.41 2jhn s PHE 64 CO 0.16 -2.31 0.96 -1.21 -0.05 0.00 0.00 175.22 172.77 2jhn s GLU 65 N -4.98 3.87 0.35 1.99 0.41 -1.26 -4.97 118.70 114.11 2jhn s GLU 65 Ca 0.63 0.84 0.06 0.00 -0.41 0.00 0.00 54.97 56.09 2jhn s GLU 65 Cb -0.17 -2.17 0.72 0.00 -1.78 0.00 0.00 34.13 30.73 2jhn s GLU 65 CO 0.56 -0.28 1.92 -0.91 -0.49 0.00 0.00 175.26 176.06 2jhn h ASN 66 N 0.77 0.71 0.73 -0.19 2.35 -2.00 -0.27 115.58 117.69 2jhn h ASN 66 Ca -0.46 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 2jhn h ASN 66 Cb 1.19 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 39.42 2jhn h ASN 66 CO 0.62 0.43 0.00 -2.11 -1.65 0.00 0.00 177.43 174.71 2jhn n ARG 67 N -4.51 0.14 0.00 0.81 1.85 -1.26 -2.28 116.66 111.40 2jhn n ARG 67 Ca 0.14 0.34 0.13 0.00 -1.00 0.00 0.00 57.85 57.46 2jhn n ARG 67 Cb 0.31 -1.75 0.34 0.00 -1.05 0.00 0.00 32.46 30.31 2jhn n ARG 67 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 2jhn n GLU 68 N -2.00 0.93 -0.12 2.89 1.02 -0.12 -4.48 120.64 118.76 2jhn n GLU 68 Ca 0.03 -0.58 -0.05 0.00 -0.02 0.00 0.00 57.16 56.54 2jhn n GLU 68 Cb 0.23 -1.49 0.03 0.00 -0.02 0.00 0.00 31.44 30.19 2jhn n GLU 68 CO 0.00 0.00 0.00 2.35 1.18 0.00 0.00 177.13 180.66 2jhn h TRP 69 N 1.42 0.18 -0.81 -0.32 -0.00 -1.43 -1.59 115.95 113.39 2jhn h TRP 69 Ca 0.00 0.02 0.09 0.00 -0.00 0.00 0.00 58.89 59.00 2jhn h TRP 69 Cb 0.54 -0.02 -0.07 0.00 -0.00 0.00 0.00 29.16 29.61 2jhn h TRP 69 CO 0.00 0.05 0.46 1.49 -0.00 0.00 0.00 178.44 180.43 2jhn h GLU 70 N 0.24 0.75 -0.22 2.65 4.57 -1.81 0.28 114.58 121.04 2jhn h GLU 70 Ca 0.19 -0.05 -0.05 0.00 -1.18 0.00 0.00 59.36 58.27 2jhn h GLU 70 Cb 0.21 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.62 2jhn h GLU 70 CO -0.23 0.50 -0.08 0.00 -1.18 0.00 0.00 179.01 178.03 2jhn h ALA 71 N 1.44 0.30 -0.53 2.92 0.00 -1.77 -2.26 119.26 119.37 2jhn h ALA 71 Ca 0.39 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2jhn h ALA 71 Cb 0.35 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2jhn h ALA 71 CO -0.24 0.12 0.27 0.28 0.00 0.00 0.00 179.25 179.67 2jhn h VAL 72 N 0.16 1.19 -0.66 0.00 2.07 -0.69 -2.21 116.25 116.10 2jhn h VAL 72 Ca 0.05 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.08 2jhn h VAL 72 Cb 0.55 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 2jhn h VAL 72 CO 0.03 0.21 0.44 -0.09 0.02 0.00 0.00 177.57 178.17 2jhn h ARG 73 N 0.70 0.86 -0.52 1.57 2.43 -0.40 -0.43 114.38 118.59 2jhn h ARG 73 Ca 0.18 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 2jhn h ARG 73 Cb 0.08 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 2jhn h ARG 73 CO -0.03 0.57 0.28 -0.09 -1.51 0.00 0.00 179.97 179.19 2jhn h ARG 74 N 0.88 0.72 -0.51 0.20 2.43 -1.23 -0.89 114.38 115.99 2jhn h ARG 74 Ca 0.25 -0.09 -0.02 0.00 -0.81 0.00 0.00 59.98 59.31 2jhn h ARG 74 Cb -0.08 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 2jhn h ARG 74 CO -0.06 0.56 0.22 0.87 -1.51 0.00 0.00 179.97 180.05 2jhn h LYS 75 N 0.69 0.74 -0.19 0.20 1.57 -0.84 -2.49 116.57 116.26 2jhn h LYS 75 Ca 0.18 -0.12 -0.19 0.00 -1.87 0.00 0.00 60.65 58.65 2jhn h LYS 75 Cb 0.05 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.24 2jhn h LYS 75 CO -0.03 0.64 -0.64 -0.07 -0.57 0.00 0.00 179.45 178.78 2jhn h LEU 76 N 0.67 0.77 -0.36 2.94 3.38 -0.80 -0.81 115.31 121.11 2jhn h LEU 76 Ca 0.17 -0.45 0.01 0.00 0.09 0.00 0.00 57.88 57.70 2jhn h LEU 76 Cb 0.16 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2jhn h LEU 76 CO -0.02 1.22 0.21 0.58 0.09 0.00 0.00 178.44 180.52 2jhn h VAL 77 N 0.50 1.05 -0.27 1.22 2.07 -1.13 -0.66 116.25 119.02 2jhn h VAL 77 Ca -0.01 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 67.28 2jhn h VAL 77 Cb 1.23 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 2jhn h VAL 77 CO 0.13 0.08 -0.15 -0.08 0.02 0.00 0.00 177.57 177.57 2jhn h GLU 78 N 0.43 0.58 -0.20 1.57 4.81 -1.40 -1.12 114.58 119.25 2jhn h GLU 78 Ca 0.14 -0.26 -0.08 0.00 -0.13 0.00 0.00 59.36 59.03 2jhn h GLU 78 Cb -0.01 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.36 2jhn h GLU 78 CO -0.06 0.83 -0.18 -0.92 -0.73 0.00 0.00 179.01 177.96 2jhn h TYR 79 N 0.31 0.56 0.00 0.92 3.20 -1.03 -3.18 116.97 117.75 2jhn h TYR 79 Ca 0.06 -0.16 0.00 0.00 3.14 0.00 0.00 58.73 61.76 2jhn h TYR 79 Cb 0.67 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.82 2jhn h TYR 79 CO 0.06 0.82 -0.26 1.28 -1.64 0.00 0.00 178.16 178.42 2jhn n LEU 80 N -4.47 0.70 -1.89 2.82 4.77 -0.26 -1.35 117.00 117.31 2jhn n LEU 80 Ca -0.05 0.41 -0.05 0.00 -0.03 0.00 0.00 56.01 56.29 2jhn n LEU 80 Cb 0.39 -0.28 0.02 0.00 -2.33 0.00 0.00 43.42 41.22 2jhn n LEU 80 CO 0.41 -0.11 0.02 0.61 -1.33 0.00 0.00 177.39 176.99 2jhn n GLY 81 N 1.34 0.24 0.84 -0.72 0.00 -0.60 -4.35 105.19 101.94 2jhn n GLY 81 Ca 0.05 -0.16 0.12 0.00 0.00 0.00 0.00 46.02 46.03 2jhn n GLY 81 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jhn n LEU 82 N -1.99 2.55 -4.76 0.99 4.77 -0.52 -4.10 117.00 113.93 2jhn n LEU 82 Ca -0.05 -1.01 -0.35 0.00 -0.03 0.00 0.00 56.01 54.57 2jhn n LEU 82 Cb 0.54 -0.12 0.02 0.00 -2.33 0.00 0.00 43.42 41.53 2jhn n LEU 82 CO 0.18 0.50 0.81 -1.10 -1.33 0.00 0.00 177.39 176.46 2jhn s GLN 83 N -1.76 3.18 -0.32 3.23 1.11 -1.26 -4.87 119.66 118.96 2jhn s GLN 83 Ca 0.34 1.71 -0.37 0.00 0.01 0.00 0.00 55.36 57.05 2jhn s GLN 83 Cb 0.20 -1.97 -0.13 0.00 -1.01 0.00 0.00 33.01 30.10 2jhn s GLN 83 CO 0.30 -1.01 2.02 -1.71 0.01 0.00 0.00 175.29 174.90 2jhn n ASN 84 N -1.44 2.23 -0.83 5.90 2.85 -1.26 -4.39 115.26 118.32 2jhn n ASN 84 Ca 0.13 0.68 0.06 0.00 -0.11 0.00 0.00 54.58 55.34 2jhn n ASN 84 Cb 0.50 -1.21 0.18 0.00 1.24 0.00 0.00 39.78 40.50 2jhn n ASN 84 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2jhn n PRO 85 N 7.16 2.14 -0.08 1.20 -0.04 -1.26 -4.59 135.00 139.52 2jhn n PRO 85 Ca 0.36 -1.48 -0.07 0.00 -0.04 0.00 0.00 63.50 62.27 2jhn n PRO 85 Cb 0.18 -1.42 -0.00 0.00 -0.04 0.00 0.00 33.50 32.22 2jhn n PRO 85 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2jhn h GLU 86 N 2.29 0.21 -0.35 0.54 4.57 -1.99 0.32 114.58 120.17 2jhn h GLU 86 Ca 0.00 -0.01 -0.15 0.00 -1.18 0.00 0.00 59.36 58.02 2jhn h GLU 86 Cb 0.67 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.21 2jhn h GLU 86 CO 0.05 0.14 -0.37 1.49 -1.18 0.00 0.00 179.01 179.14 2jhn h GLU 87 N 0.22 0.87 -0.38 1.92 4.81 -2.00 -0.55 114.58 119.47 2jhn h GLU 87 Ca 0.14 -0.46 0.04 0.00 -0.13 0.00 0.00 59.36 58.94 2jhn h GLU 87 Cb 0.12 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.48 2jhn h GLU 87 CO -0.15 1.11 0.15 1.25 -0.73 0.00 0.00 179.01 180.64 2jhn h LEU 88 N 0.67 0.19 -0.51 1.64 5.85 -1.82 -1.55 115.31 119.77 2jhn h LEU 88 Ca 0.05 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.75 2jhn h LEU 88 Cb 0.96 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 2jhn h LEU 88 CO 0.09 0.15 0.09 1.88 -0.34 0.00 0.00 178.44 180.31 2jhn h TYR 89 N 0.32 0.89 -0.55 1.25 0.05 -0.56 0.45 116.97 118.83 2jhn h TYR 89 Ca 0.17 -0.12 0.08 0.00 0.05 0.00 0.00 58.73 58.91 2jhn h TYR 89 Cb 0.13 -0.25 -0.07 0.00 1.01 0.00 0.00 36.73 37.55 2jhn h TYR 89 CO -0.13 0.81 0.19 -0.09 -1.05 0.00 0.00 178.16 177.89 2jhn h ARG 90 N 0.72 0.36 -0.22 4.88 2.43 -0.96 -1.78 114.38 119.80 2jhn h ARG 90 Ca 0.16 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 2jhn h ARG 90 Cb 0.39 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 2jhn h ARG 90 CO 0.01 0.23 0.09 0.35 -1.51 0.00 0.00 179.97 179.14 2jhn h PHE 91 N 0.37 0.35 -0.29 2.20 3.57 -0.71 -2.76 116.94 119.65 2jhn h PHE 91 Ca 0.27 -0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.75 2jhn h PHE 91 Cb 0.33 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 2jhn h PHE 91 CO -0.17 0.39 0.20 0.52 -2.23 0.00 0.00 178.31 177.01 2jhn h MET 92 N 0.21 0.37 0.00 1.11 2.86 -0.69 -2.06 114.93 116.72 2jhn h MET 92 Ca 0.07 -0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.66 2jhn h MET 92 Cb 0.19 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.76 2jhn h MET 92 CO -0.01 0.24 -0.14 -0.44 1.06 0.00 0.00 176.91 177.63 2jhn h ASP 93 N 0.38 0.00 -0.00 1.22 3.32 -1.03 -2.11 116.42 118.20 2jhn h ASP 93 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2jhn h ASP 93 Cb -0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.54 2jhn h ASP 93 CO -0.02 0.14 0.00 0.61 -1.72 0.00 0.00 179.24 178.24 2jhn n GLY 94 N -0.80 -0.97 2.76 2.75 0.00 -0.78 -4.67 105.19 103.48 2jhn n GLY 94 Ca -0.02 -0.12 -0.18 0.00 0.00 0.00 0.00 46.02 45.70 2jhn n GLY 94 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jhn s ASP 95 N -1.56 0.63 0.18 1.61 -1.08 -0.92 -5.06 116.67 110.46 2jhn s ASP 95 Ca 0.27 0.01 -0.14 0.00 -0.52 0.00 0.00 52.55 52.18 2jhn s ASP 95 Cb 0.13 -0.18 0.15 0.00 -1.46 0.00 0.00 42.92 41.55 2jhn s ASP 95 CO 0.21 -0.16 1.74 -0.08 0.52 0.00 0.00 175.17 177.40 2jhn h GLU 96 N 7.68 0.29 -0.30 4.34 4.81 -1.83 0.12 114.58 129.70 2jhn h GLU 96 Ca -0.33 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 58.77 2jhn h GLU 96 Cb 1.13 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.43 2jhn h GLU 96 CO 0.37 0.19 -0.24 0.87 -0.73 0.00 0.00 179.01 179.48 2jhn h LYS 97 N 0.30 0.69 -0.81 1.92 1.79 -1.92 -2.42 116.57 116.12 2jhn h LYS 97 Ca 0.22 -0.34 -0.00 0.00 -2.18 0.00 0.00 60.65 58.35 2jhn h LYS 97 Cb 0.24 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.86 2jhn h LYS 97 CO -0.25 0.95 0.50 -0.07 -1.08 0.00 0.00 179.45 179.50 2jhn h LEU 98 N 0.44 0.97 -0.69 2.94 3.38 -1.68 -1.80 115.31 118.87 2jhn h LEU 98 Ca 0.06 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2jhn h LEU 98 Cb 0.79 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 2jhn h LEU 98 CO 0.06 0.73 0.27 -0.09 0.09 0.00 0.00 178.44 179.51 2jhn h ARG 99 N 1.12 1.03 0.33 1.13 2.43 -0.11 0.14 114.38 120.45 2jhn h ARG 99 Ca 0.29 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 2jhn h ARG 99 Cb -0.06 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.32 2jhn h ARG 99 CO -0.06 0.85 -0.18 1.98 -1.51 0.00 0.00 179.97 181.06 2jhn h MET 100 N 0.98 -0.46 -0.59 0.20 4.05 -1.20 -0.90 114.93 117.01 2jhn h MET 100 Ca 0.23 0.03 0.11 0.00 -0.28 0.00 0.00 59.70 59.79 2jhn h MET 100 Cb 0.21 0.11 -0.09 0.00 -0.80 0.00 0.00 31.60 31.03 2jhn h MET 100 CO -0.02 -0.31 0.11 -0.07 0.23 0.00 0.00 176.91 176.86 2jhn h LEU 101 N -0.48 -0.02 -0.70 3.39 3.38 -0.92 0.22 115.31 120.17 2jhn h LEU 101 Ca -0.04 0.11 0.06 0.00 0.09 0.00 0.00 57.88 58.11 2jhn h LEU 101 Cb 0.38 0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.23 2jhn h LEU 101 CO 0.06 0.00 0.40 0.50 0.09 0.00 0.00 178.44 179.48 2jhn h LYS 102 N 0.24 0.70 -0.17 1.13 3.64 -0.59 -2.03 116.57 119.51 2jhn h LYS 102 Ca 0.31 -0.04 -0.20 0.00 -1.27 0.00 0.00 60.65 59.45 2jhn h LYS 102 Cb 0.46 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 2jhn h LYS 102 CO -0.41 0.47 -0.69 -0.91 -2.27 0.00 0.00 179.45 175.64 2jhn h ASN 103 N 0.72 0.79 -0.89 4.20 2.35 0.37 -1.39 115.58 121.74 2jhn h ASN 103 Ca 0.32 -0.49 0.01 0.00 -0.55 0.00 0.00 56.30 55.59 2jhn h ASN 103 Cb 0.20 -0.23 -0.05 0.00 0.05 0.00 0.00 38.32 38.29 2jhn h ASN 103 CO -0.19 1.26 0.59 -0.09 -1.65 0.00 0.00 177.43 177.35 2jhn h ARG 104 N 0.49 1.15 -1.23 0.81 2.43 -0.45 -3.03 114.38 114.56 2jhn h ARG 104 Ca -0.03 -0.07 -0.61 0.00 -0.81 0.00 0.00 59.98 58.46 2jhn h ARG 104 Cb 1.29 -0.26 -0.39 0.00 -0.42 0.00 0.00 29.97 30.19 2jhn h ARG 104 CO 0.14 0.76 -0.33 1.19 -1.51 0.00 0.00 179.97 180.22 2jhn n PHE 105 N -4.48 3.09 -1.96 2.20 3.72 -0.78 -5.07 117.46 114.19 2jhn n PHE 105 Ca 0.10 -2.67 -0.42 0.00 -0.05 0.00 0.00 57.45 54.41 2jhn n PHE 105 Cb 0.02 -0.50 -0.03 0.00 -0.94 0.00 0.00 39.48 38.04 2jhn n PHE 105 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 2jhn s TYR 106 N -3.67 3.08 0.00 1.38 5.04 -0.53 -1.93 117.35 120.72 2jhn s TYR 106 Ca 0.52 0.69 0.00 0.00 -2.44 0.00 0.00 57.07 55.84 2jhn s TYR 106 Cb 0.42 -3.90 0.00 0.00 0.35 0.00 0.00 41.96 38.84 2jhn s TYR 106 CO -0.11 -3.27 0.00 0.41 -1.34 0.00 0.00 175.55 171.24 2jhn n GLY 107 N 3.60 0.40 0.25 8.97 0.00 -1.26 -4.81 105.19 112.34 2jhn n GLY 107 Ca 0.13 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.19 2jhn n GLY 107 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2jhn h PHE 108 N 0.00 0.18 0.00 1.61 3.57 -1.66 0.15 116.94 120.80 2jhn h PHE 108 Ca 0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 2jhn h PHE 108 Cb 0.00 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 38.68 2jhn h PHE 108 CO 0.00 0.26 0.00 0.41 -2.23 0.00 0.00 178.31 176.75 2jhn n GLY 109 N -1.10 0.08 3.87 2.40 0.00 -1.26 -4.83 105.19 104.36 2jhn n GLY 109 Ca -0.01 -0.97 -0.30 0.00 0.00 0.00 0.00 46.02 44.74 2jhn n GLY 109 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jhn s ARG 110 N 0.00 3.66 0.31 1.61 0.52 -1.26 -5.02 118.95 118.77 2jhn s ARG 110 Ca 0.00 0.63 -0.29 0.00 -0.52 0.00 0.00 55.73 55.55 2jhn s ARG 110 Cb 0.00 -2.19 -0.10 0.00 0.52 0.00 0.00 34.95 33.18 2jhn s ARG 110 CO 0.00 -0.39 1.26 0.00 0.02 0.00 0.00 175.30 176.20 2jhn s ALA 111 N -2.91 3.48 0.00 2.13 0.00 -1.26 -4.62 121.76 118.58 2jhn s ALA 111 Ca 0.53 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.66 2jhn s ALA 111 Cb -0.11 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.57 2jhn s ALA 111 CO 0.46 -0.53 0.00 0.41 0.00 0.00 0.00 175.76 176.11 2jhn n GLY 112 N 1.02 1.22 3.36 0.00 0.00 -1.26 -4.47 105.19 105.06 2jhn n GLY 112 Ca 0.00 -1.38 -0.19 0.00 0.00 0.00 0.00 46.02 44.46 2jhn n GLY 112 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jhn s LEU 113 N 0.00 2.38 -0.11 0.99 1.43 -0.46 -4.86 118.68 118.05 2jhn s LEU 113 Ca 0.00 -1.17 0.16 0.00 -1.03 0.00 0.00 54.13 52.10 2jhn s LEU 113 Cb 0.00 -0.47 0.60 0.00 0.03 0.00 0.00 46.19 46.36 2jhn s LEU 113 CO 0.00 -0.39 1.52 0.23 0.23 0.00 0.00 176.35 177.94 2jhn n MET 114 N -0.46 3.44 -3.62 1.70 2.81 0.20 -4.80 117.12 116.38 2jhn n MET 114 Ca -0.06 -2.72 -0.13 0.00 -1.81 0.00 0.00 57.70 52.98 2jhn n MET 114 Cb 0.63 -1.77 -0.06 0.00 -0.71 0.00 0.00 33.22 31.31 2jhn n MET 114 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 2jhn s SER 115 N -1.13 -0.35 0.12 7.83 1.04 -1.26 -4.88 113.70 115.06 2jhn s SER 115 Ca 0.44 0.08 0.24 0.00 0.48 0.00 0.00 55.95 57.18 2jhn s SER 115 Cb 0.29 0.46 0.30 0.00 0.10 0.00 0.00 66.02 67.16 2jhn s SER 115 CO 0.20 -0.69 1.28 0.24 0.98 0.00 0.00 173.24 175.24 2jhn h MET 116 N 2.90 0.00 -3.93 4.02 0.00 -1.96 -3.48 114.93 112.48 2jhn h MET 116 Ca -0.31 0.00 -0.11 0.00 0.00 0.00 0.00 59.70 59.28 2jhn h MET 116 Cb 1.21 0.00 -0.16 0.00 0.00 0.00 0.00 31.60 32.65 2jhn h MET 116 CO 0.42 0.00 -0.52 -1.54 0.00 0.00 0.00 176.91 175.27 2jhn s SER 117 N -4.28 0.25 0.15 1.22 1.04 -1.26 -5.05 113.70 105.77 2jhn s SER 117 Ca 0.06 -0.71 -0.16 0.00 0.48 0.00 0.00 55.95 55.62 2jhn s SER 117 Cb 0.13 0.26 0.01 0.00 0.10 0.00 0.00 66.02 66.52 2jhn s SER 117 CO 0.73 -0.61 1.81 0.58 0.98 0.00 0.00 173.24 176.74 2jhn h VAL 118 N 3.22 1.10 -0.44 5.02 2.07 -1.88 -1.73 116.25 123.61 2jhn h VAL 118 Ca -0.33 -0.18 0.08 0.00 0.82 0.00 0.00 66.70 67.09 2jhn h VAL 118 Cb 1.18 0.52 -0.07 0.00 -1.52 0.00 0.00 31.29 31.39 2jhn h VAL 118 CO 0.57 0.10 -0.02 0.15 0.02 0.00 0.00 177.57 178.38 2jhn h PHE 119 N 0.53 -0.07 -0.49 1.57 3.57 -1.97 -0.09 116.94 120.00 2jhn h PHE 119 Ca 0.15 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.69 2jhn h PHE 119 Cb -0.06 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.75 2jhn h PHE 119 CO -0.05 -0.11 0.32 1.49 -2.23 0.00 0.00 178.31 177.73 2jhn h GLU 120 N 0.09 0.63 -0.44 1.11 4.81 -1.83 -1.26 114.58 117.69 2jhn h GLU 120 Ca 0.22 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.42 2jhn h GLU 120 Cb 0.32 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 2jhn h GLU 120 CO -0.38 0.42 0.28 0.78 -0.73 0.00 0.00 179.01 179.38 2jhn h GLY 121 N 0.65 0.62 0.84 1.92 0.00 -0.82 -0.75 103.07 105.53 2jhn h GLY 121 Ca 0.18 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 2jhn h GLY 121 CO -0.05 0.21 0.04 -2.22 0.00 0.00 0.00 176.54 174.52 2jhn h ILE 122 N 0.57 1.17 -0.30 2.60 2.04 -0.84 -1.74 117.51 121.01 2jhn h ILE 122 Ca 0.17 -0.53 0.04 0.00 1.00 0.00 0.00 64.86 65.54 2jhn h ILE 122 Cb -0.04 1.32 -0.04 0.00 -0.74 0.00 0.00 36.82 37.32 2jhn h ILE 122 CO -0.05 0.15 0.06 0.00 0.00 0.00 0.00 178.15 178.32 2jhn h ALA 123 N 0.85 0.31 -0.36 1.87 0.00 -1.11 -1.32 119.26 119.52 2jhn h ALA 123 Ca 0.04 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 2jhn h ALA 123 Cb 0.21 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2jhn h ALA 123 CO -0.00 -0.35 -0.12 0.87 0.00 0.00 0.00 179.25 179.65 2jhn h LYS 124 N 0.17 0.62 -0.73 0.00 1.57 -1.11 -0.45 116.57 116.64 2jhn h LYS 124 Ca 0.14 -0.19 -0.04 0.00 -1.87 0.00 0.00 60.65 58.68 2jhn h LYS 124 Cb 0.15 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 2jhn h LYS 124 CO -0.18 0.73 0.28 0.00 -0.57 0.00 0.00 179.45 179.71 2jhn h ALA 125 N 1.31 1.12 -0.12 3.86 0.00 -0.69 -1.52 119.26 123.22 2jhn h ALA 125 Ca 0.10 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2jhn h ALA 125 Cb 0.54 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2jhn h ALA 125 CO 0.03 0.62 0.00 0.82 0.00 0.00 0.00 179.25 180.73 2jhn h ILE 126 N 1.06 1.25 -0.81 0.00 2.04 -0.85 -3.06 117.51 117.14 2jhn h ILE 126 Ca 0.24 -0.81 0.16 0.00 1.00 0.00 0.00 64.86 65.46 2jhn h ILE 126 Cb 0.21 1.54 -0.10 0.00 -0.74 0.00 0.00 36.82 37.73 2jhn h ILE 126 CO -0.02 0.23 0.35 0.40 0.00 0.00 0.00 178.15 179.11 2jhn h ILE 127 N -0.05 0.63 0.00 -0.67 2.04 -0.79 -1.72 117.51 116.95 2jhn h ILE 127 Ca 0.04 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2jhn h ILE 127 Cb 0.36 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.55 2jhn h ILE 127 CO 0.01 0.09 0.00 1.67 0.00 0.00 0.00 178.15 179.91 2jhn n GLN 128 N -4.99 0.18 -1.68 2.37 7.27 -0.60 -4.78 117.38 115.15 2jhn n GLN 128 Ca 0.17 0.51 -0.49 0.00 0.07 0.00 0.00 57.00 57.25 2jhn n GLN 128 Cb 0.47 -1.91 -0.05 0.00 2.41 0.00 0.00 30.24 31.16 2jhn n GLN 128 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 2jhn n GLN 129 N -2.26 2.01 -1.05 3.69 6.02 -0.65 -2.22 117.38 122.92 2jhn n GLN 129 Ca 0.01 0.74 -0.02 0.00 -0.01 0.00 0.00 57.00 57.72 2jhn n GLN 129 Cb 0.16 -2.54 -0.01 0.00 1.02 0.00 0.00 30.24 28.87 2jhn n GLN 129 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2jhn n GLN 130 N 5.64 -1.18 -4.35 -1.09 3.00 -1.26 -4.98 117.38 113.17 2jhn n GLN 130 Ca 0.22 0.39 -0.18 0.00 -0.01 0.00 0.00 57.00 57.42 2jhn n GLN 130 Cb 0.27 -4.33 -0.10 0.00 0.00 0.00 0.00 30.24 26.08 2jhn n GLN 130 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.06 178.02 2jhn s ILE 131 N -1.54 0.76 0.64 5.09 -4.36 -0.94 -5.15 121.20 115.70 2jhn s ILE 131 Ca 0.00 -2.00 -0.14 0.00 -0.26 0.00 0.00 60.65 58.25 2jhn s ILE 131 Cb 0.00 -2.63 -0.01 0.00 1.25 0.00 0.00 42.46 41.06 2jhn s ILE 131 CO 0.00 -0.05 1.06 -0.94 0.24 0.00 0.00 174.94 175.26 2jhn s SER 132 N -3.35 5.55 0.18 4.36 1.04 -1.26 -4.92 113.70 115.30 2jhn s SER 132 Ca 0.36 1.76 -0.13 0.00 0.48 0.00 0.00 55.95 58.42 2jhn s SER 132 Cb 0.08 -2.52 0.09 0.00 0.10 0.00 0.00 66.02 63.77 2jhn s SER 132 CO 0.13 -1.33 1.83 0.15 0.98 0.00 0.00 173.24 175.01 2jhn h PHE 133 N -0.05 0.78 -0.42 5.02 3.57 -1.99 -1.66 116.94 122.19 2jhn h PHE 133 Ca -0.46 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.09 2jhn h PHE 133 Cb 1.22 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 39.66 2jhn h PHE 133 CO 0.59 0.52 0.17 0.28 -2.23 0.00 0.00 178.31 177.65 2jhn h VAL 134 N 0.81 0.91 -0.86 1.41 2.07 -1.98 0.08 116.25 118.69 2jhn h VAL 134 Ca 0.22 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.59 2jhn h VAL 134 Cb -0.04 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.21 2jhn h VAL 134 CO -0.04 0.06 0.44 0.58 0.02 0.00 0.00 177.57 178.63 2jhn h VAL 135 N 0.35 1.26 -0.54 2.57 2.07 -1.92 -2.41 116.25 117.63 2jhn h VAL 135 Ca 0.19 -0.68 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 2jhn h VAL 135 Cb 0.15 0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.02 2jhn h VAL 135 CO -0.17 0.30 0.30 0.00 0.02 0.00 0.00 177.57 178.02 2jhn h ALA 136 N 1.27 0.69 -0.39 1.67 0.00 -0.72 -2.08 119.26 119.71 2jhn h ALA 136 Ca 0.30 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 2jhn h ALA 136 Cb 0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2jhn h ALA 136 CO -0.04 0.21 -0.09 0.93 0.00 0.00 0.00 179.25 180.26 2jhn h GLU 137 N 0.73 0.68 -0.63 0.00 4.39 -0.83 -0.65 114.58 118.27 2jhn h GLU 137 Ca 0.19 -0.20 -0.07 0.00 0.34 0.00 0.00 59.36 59.62 2jhn h GLU 137 Cb 0.04 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.60 2jhn h GLU 137 CO -0.03 0.75 0.12 0.87 -1.16 0.00 0.00 179.01 179.56 2jhn h LYS 138 N 0.62 1.02 -0.50 2.33 1.57 -1.24 -0.79 116.57 119.58 2jhn h LYS 138 Ca 0.11 -0.25 -0.03 0.00 -1.87 0.00 0.00 60.65 58.62 2jhn h LYS 138 Cb 0.52 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 2jhn h LYS 138 CO 0.03 0.92 0.21 -0.07 -0.57 0.00 0.00 179.45 179.98 2jhn h LEU 139 N 0.96 0.68 -0.52 2.94 3.38 -0.97 -1.99 115.31 119.79 2jhn h LEU 139 Ca 0.20 -0.16 0.06 0.00 0.09 0.00 0.00 57.88 58.07 2jhn h LEU 139 Cb 0.39 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 2jhn h LEU 139 CO 0.01 0.65 0.23 0.00 0.09 0.00 0.00 178.44 179.42 2jhn h ALA 140 N 1.06 0.65 -0.71 1.53 0.00 -0.85 -1.96 119.26 118.97 2jhn h ALA 140 Ca 0.17 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.13 2jhn h ALA 140 Cb 0.18 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2jhn h ALA 140 CO -0.02 -0.15 0.46 0.00 0.00 0.00 0.00 179.25 179.55 2jhn h ALA 141 N 1.31 1.48 -0.23 0.00 0.00 -0.87 0.56 119.26 121.52 2jhn h ALA 141 Ca 0.24 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2jhn h ALA 141 Cb 0.20 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2jhn h ALA 141 CO -0.20 0.47 0.10 0.87 0.00 0.00 0.00 179.25 180.49 2jhn h LYS 142 N 0.96 0.34 -0.43 0.00 1.79 -0.78 -0.67 116.57 117.79 2jhn h LYS 142 Ca 0.26 -0.06 -0.11 0.00 -2.18 0.00 0.00 60.65 58.56 2jhn h LYS 142 Cb -0.10 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.48 2jhn h LYS 142 CO -0.05 0.37 -0.19 0.82 -1.08 0.00 0.00 179.45 179.32 2jhn h ILE 143 N 0.23 1.27 -0.54 1.86 1.08 -0.93 -2.34 117.51 118.13 2jhn h ILE 143 Ca 0.08 -1.31 -0.07 0.00 -0.39 0.00 0.00 64.86 63.16 2jhn h ILE 143 Cb 0.15 1.14 -0.02 0.00 -3.07 0.00 0.00 36.82 35.03 2jhn h ILE 143 CO -0.01 0.45 0.06 0.58 -0.69 0.00 0.00 178.15 178.54 2jhn h VAL 144 N 0.74 1.26 -0.59 1.67 2.07 -0.81 0.03 116.25 120.61 2jhn h VAL 144 Ca 0.11 -1.01 -0.01 0.00 0.82 0.00 0.00 66.70 66.60 2jhn h VAL 144 Cb 0.72 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 2jhn h VAL 144 CO 0.06 0.36 0.31 1.23 0.02 0.00 0.00 177.57 179.55 2jhn h GLY 145 N 0.81 0.88 0.87 2.17 0.00 -0.82 -0.43 103.07 106.55 2jhn h GLY 145 Ca 0.16 -0.41 -0.32 0.00 0.00 0.00 0.00 47.33 46.76 2jhn h GLY 145 CO 0.02 0.39 -1.80 -0.09 0.00 0.00 0.00 176.54 175.06 2jhn h ARG 146 N 0.80 0.15 0.00 4.80 2.43 -1.39 -3.41 114.38 117.76 2jhn h ARG 146 Ca 0.21 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2jhn h ARG 146 Cb 0.06 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 2jhn h ARG 146 CO -0.03 0.89 -0.07 1.19 -1.51 0.00 0.00 179.97 180.45 2jhn n PHE 147 N -3.29 0.00 -1.95 2.20 3.72 -0.01 -5.05 117.46 113.07 2jhn n PHE 147 Ca -0.23 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 56.87 2jhn n PHE 147 Cb 1.05 -0.00 0.04 0.00 -0.94 0.00 0.00 39.48 39.62 2jhn n PHE 147 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2jhn s GLY 148 N -1.11 1.63 0.57 1.37 0.00 -0.17 -4.50 107.32 105.11 2jhn s GLY 148 Ca 0.00 -0.33 -0.18 0.00 0.00 0.00 0.00 44.72 44.21 2jhn s GLY 148 CO 0.03 0.01 1.13 0.99 0.00 0.00 0.00 173.10 175.26 2jhn s ASP 149 N -4.31 5.56 -0.05 1.64 1.01 -1.22 -4.85 116.67 114.46 2jhn s ASP 149 Ca 0.57 2.15 0.01 0.00 0.71 0.00 0.00 52.55 55.99 2jhn s ASP 149 Cb -0.11 -2.58 0.02 0.00 1.01 0.00 0.00 42.92 41.27 2jhn s ASP 149 CO 0.51 -1.33 -0.05 -0.70 0.21 0.00 0.00 175.17 173.82 2jhn s GLU 150 N -3.45 0.92 -0.10 8.23 2.12 -1.26 -1.29 118.70 123.87 2jhn s GLU 150 Ca 0.72 -0.12 0.03 0.00 0.36 0.00 0.00 54.97 55.95 2jhn s GLU 150 Cb -0.24 -0.94 0.01 0.00 0.26 0.00 0.00 34.13 33.23 2jhn s GLU 150 CO 0.30 -0.10 -0.19 0.08 -0.54 0.00 0.00 175.26 174.82 2jhn s VAL 151 N 1.01 1.69 -0.22 3.70 1.01 0.04 -4.98 120.40 122.65 2jhn s VAL 151 Ca -0.10 -0.79 -0.09 0.00 0.00 0.00 0.00 61.98 61.01 2jhn s VAL 151 Cb -0.14 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 2jhn s VAL 151 CO -0.00 0.48 0.12 -0.70 0.00 0.00 0.00 175.10 174.99 2jhn s GLU 152 N 0.64 3.97 -0.16 2.72 2.12 -1.26 0.14 118.70 126.87 2jhn s GLU 152 Ca -0.13 -0.33 -0.18 0.00 0.36 0.00 0.00 54.97 54.69 2jhn s GLU 152 Cb -0.16 -3.41 0.05 0.00 0.26 0.00 0.00 34.13 30.87 2jhn s GLU 152 CO 0.04 0.08 0.50 -0.46 -0.54 0.00 0.00 175.26 174.88 2jhn s TRP 153 N 0.95 -0.52 0.00 5.30 -0.00 -0.82 -4.99 118.94 118.87 2jhn s TRP 153 Ca 0.06 1.20 0.00 0.00 -0.00 0.00 0.00 56.10 57.36 2jhn s TRP 153 Cb -0.13 0.20 0.00 0.00 -0.00 0.00 0.00 33.47 33.53 2jhn s TRP 153 CO 0.03 -0.31 0.00 0.09 -0.00 0.00 0.00 176.95 176.76 2jhn n ASN 154 N 2.46 0.00 -1.55 5.86 4.13 -1.26 -1.25 115.26 123.65 2jhn n ASN 154 Ca -0.15 0.00 0.08 0.00 1.68 0.00 0.00 54.58 56.20 2jhn n ASN 154 Cb 0.56 0.00 0.35 0.00 -1.54 0.00 0.00 39.78 39.16 2jhn n ASN 154 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2jhn n GLY 155 N 0.00 2.99 3.46 7.41 0.00 -1.26 -5.01 105.19 112.77 2jhn n GLY 155 Ca 0.00 -0.88 -0.30 0.00 0.00 0.00 0.00 46.02 44.84 2jhn n GLY 155 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jhn s LEU 156 N -2.20 2.61 -0.14 0.99 1.43 -0.38 -5.11 118.68 115.87 2jhn s LEU 156 Ca 0.50 -0.46 -0.14 0.00 -1.03 0.00 0.00 54.13 52.99 2jhn s LEU 156 Cb 0.35 -1.51 -0.05 0.00 0.03 0.00 0.00 46.19 45.01 2jhn s LEU 156 CO 0.20 0.24 0.32 -0.54 0.23 0.00 0.00 176.35 176.80 2jhn s LYS 157 N -1.58 4.22 -0.14 1.70 1.02 -1.26 -1.94 119.74 121.77 2jhn s LYS 157 Ca 0.15 0.16 0.00 0.00 0.02 0.00 0.00 55.97 56.31 2jhn s LYS 157 Cb -0.10 -3.41 -0.01 0.00 -0.52 0.00 0.00 37.83 33.79 2jhn s LYS 157 CO 0.06 0.27 -0.14 -0.06 -0.92 0.00 0.00 175.35 174.56 2jhn s PHE 158 N 0.34 2.79 -0.03 3.18 0.08 0.12 -4.98 117.98 119.48 2jhn s PHE 158 Ca 0.18 -0.78 0.02 0.00 0.12 0.00 0.00 56.93 56.47 2jhn s PHE 158 Cb -0.13 -1.85 -0.03 0.00 -0.57 0.00 0.00 43.02 40.43 2jhn s PHE 158 CO 0.05 -0.31 -0.06 0.71 -0.10 0.00 0.00 175.22 175.52 2jhn s TYR 159 N 0.50 2.94 0.23 0.36 2.02 -1.26 -0.78 117.35 121.36 2jhn s TYR 159 Ca -0.10 0.01 0.11 0.00 -0.37 0.00 0.00 57.07 56.73 2jhn s TYR 159 Cb -0.16 -1.67 -0.05 0.00 -0.40 0.00 0.00 41.96 39.69 2jhn s TYR 159 CO 0.04 0.37 -0.19 0.20 -1.57 0.00 0.00 175.55 174.40 2jhn s GLY 160 N -1.15 1.77 0.31 0.71 0.00 -0.41 -0.47 107.32 108.07 2jhn s GLY 160 Ca 0.15 -1.70 -0.29 0.00 0.00 0.00 0.00 44.72 42.88 2jhn s GLY 160 CO 0.05 -1.75 1.18 -0.12 0.00 0.00 0.00 173.10 172.46 2jhn s PHE 161 N -2.01 3.35 0.20 1.90 5.36 -1.26 -3.37 117.98 122.15 2jhn s PHE 161 Ca 0.25 1.58 -0.31 0.00 -0.96 0.00 0.00 56.93 57.49 2jhn s PHE 161 Cb -0.07 -3.45 -0.15 0.00 -0.34 0.00 0.00 43.02 39.01 2jhn s PHE 161 CO 0.13 -1.10 1.13 -2.30 -1.46 0.00 0.00 175.22 171.62 2jhn n PRO 162 N 0.99 1.23 -1.21 10.12 -0.02 -1.26 -4.56 135.00 140.28 2jhn n PRO 162 Ca -0.00 0.44 -0.30 0.00 -2.02 0.00 0.00 63.50 61.61 2jhn n PRO 162 Cb 0.44 -1.90 0.13 0.00 -0.02 0.00 0.00 33.50 32.14 2jhn n PRO 162 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2jhn s THR 163 N -0.40 2.84 0.27 3.45 -4.23 -1.26 -4.86 115.64 111.45 2jhn s THR 163 Ca 0.69 0.27 -0.02 0.00 -1.18 0.00 0.00 61.69 61.46 2jhn s THR 163 Cb -0.81 -2.75 0.27 0.00 1.34 0.00 0.00 72.50 70.55 2jhn s THR 163 CO 0.54 -0.36 1.87 1.56 -0.54 0.00 0.00 174.62 177.70 2jhn h GLN 164 N -1.43 1.11 -0.59 3.99 4.20 -1.93 -2.29 115.11 118.16 2jhn h GLN 164 Ca -0.48 -0.07 0.05 0.00 0.06 0.00 0.00 58.65 58.21 2jhn h GLN 164 Cb 1.27 -0.25 -0.05 0.00 0.30 0.00 0.00 27.48 28.75 2jhn h GLN 164 CO 0.53 0.74 0.33 0.93 -0.67 0.00 0.00 178.83 180.69 2jhn h GLU 165 N 1.15 0.61 -0.64 1.46 3.07 -1.92 -1.56 114.58 116.74 2jhn h GLU 165 Ca 0.44 -0.04 -0.07 0.00 -0.50 0.00 0.00 59.36 59.20 2jhn h GLU 165 Cb 0.21 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 27.95 2jhn h GLU 165 CO -0.19 0.40 0.14 0.00 -1.40 0.00 0.00 179.01 177.97 2jhn h ALA 166 N 1.30 1.04 -0.45 3.43 0.00 -1.79 -2.19 119.26 120.59 2jhn h ALA 166 Ca 0.26 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 2jhn h ALA 166 Cb 0.13 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2jhn h ALA 166 CO -0.15 0.63 0.03 0.82 0.00 0.00 0.00 179.25 180.58 2jhn h ILE 167 N 0.97 1.26 -0.88 0.00 1.08 -1.12 -0.11 117.51 118.70 2jhn h ILE 167 Ca 0.20 -0.99 -0.00 0.00 -0.39 0.00 0.00 64.86 63.69 2jhn h ILE 167 Cb 0.36 1.01 -0.04 0.00 -3.07 0.00 0.00 36.82 35.08 2jhn h ILE 167 CO 0.00 0.34 0.55 -0.07 -0.69 0.00 0.00 178.15 178.28 2jhn h LEU 168 N 0.63 1.05 -0.32 1.44 3.38 -1.11 0.12 115.31 120.50 2jhn h LEU 168 Ca 0.13 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 2jhn h LEU 168 Cb 0.45 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2jhn h LEU 168 CO 0.02 0.79 0.05 0.50 0.09 0.00 0.00 178.44 179.89 2jhn h LYS 169 N 1.21 0.52 -0.90 1.13 1.63 -1.28 -2.87 116.57 116.02 2jhn h LYS 169 Ca 0.32 -0.14 0.10 0.00 -0.85 0.00 0.00 60.65 60.08 2jhn h LYS 169 Cb -0.08 -0.06 -0.08 0.00 -0.60 0.00 0.00 32.23 31.42 2jhn h LYS 169 CO -0.06 0.62 0.54 0.00 -3.45 0.00 0.00 179.45 177.09 2jhn h ALA 170 N 0.88 1.30 -2.04 5.00 0.00 -0.61 -3.48 119.26 120.31 2jhn h ALA 170 Ca 0.10 0.02 0.24 0.00 0.00 0.00 0.00 54.91 55.27 2jhn h ALA 170 Cb 0.35 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 2jhn h ALA 170 CO 0.01 0.17 -0.43 0.41 0.00 0.00 0.00 179.25 179.41 2jhn n GLY 171 N -1.33 -1.98 0.16 0.00 0.00 -0.00 -2.00 105.19 100.04 2jhn n GLY 171 Ca 0.15 -1.28 -0.05 0.00 0.00 0.00 0.00 46.02 44.85 2jhn n GLY 171 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2jhn h VAL 172 N -0.84 0.69 -0.31 1.61 2.07 -1.86 -2.70 116.25 114.90 2jhn h VAL 172 Ca -0.01 -0.03 -0.08 0.00 0.82 0.00 0.00 66.70 67.40 2jhn h VAL 172 Cb 0.83 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 2jhn h VAL 172 CO 0.02 0.02 -0.13 -0.33 0.02 0.00 0.00 177.57 177.17 2jhn h GLU 173 N 0.08 0.54 -0.58 1.57 4.39 -1.97 -1.20 114.58 117.41 2jhn h GLU 173 Ca 0.19 -0.16 -0.08 0.00 0.34 0.00 0.00 59.36 59.65 2jhn h GLU 173 Cb 0.27 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 2jhn h GLU 173 CO -0.33 0.66 0.05 0.78 -1.16 0.00 0.00 179.01 179.00 2jhn h GLY 174 N 0.94 1.08 1.02 -3.84 0.00 -1.21 -0.68 103.07 100.38 2jhn h GLY 174 Ca 0.09 -0.75 -0.07 0.00 0.00 0.00 0.00 47.33 46.59 2jhn h GLY 174 CO 0.03 0.70 0.05 1.41 0.00 0.00 0.00 176.54 178.73 2jhn h LEU 175 N 0.89 0.91 -0.95 3.11 3.38 -1.26 -2.86 115.31 118.53 2jhn h LEU 175 Ca 0.17 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2jhn h LEU 175 Cb 0.48 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 2jhn h LEU 175 CO 0.02 0.96 0.43 0.03 0.09 0.00 0.00 178.44 179.98 2jhn h ARG 176 N 0.82 1.18 -0.59 1.13 3.08 -0.99 -2.09 114.38 116.92 2jhn h ARG 176 Ca 0.16 -0.15 0.04 0.00 0.07 0.00 0.00 59.98 60.11 2jhn h ARG 176 Cb 0.47 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 2jhn h ARG 176 CO 0.02 0.88 0.39 0.93 -1.07 0.00 0.00 179.97 181.11 2jhn h GLU 177 N 1.17 0.62 0.00 0.04 5.08 -0.99 -1.26 114.58 119.25 2jhn h GLU 177 Ca 0.29 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2jhn h GLU 177 Cb 0.06 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.17 2jhn h GLU 177 CO -0.04 0.41 0.00 0.00 -1.00 0.00 0.00 179.01 178.38 2jhn n GLY 179 N 1.27 1.20 3.75 0.00 0.00 -0.47 -4.86 105.19 106.07 2jhn n GLY 179 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2jhn n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jhn s LEU 180 N 0.00 4.48 0.74 0.99 1.02 -1.01 -4.98 118.68 119.92 2jhn s LEU 180 Ca 0.00 2.26 -0.15 0.00 0.02 0.00 0.00 54.13 56.26 2jhn s LEU 180 Cb 0.00 -3.62 0.01 0.00 0.02 0.00 0.00 46.19 42.61 2jhn s LEU 180 CO 0.00 -0.30 0.94 -1.54 0.02 0.00 0.00 176.35 175.46 2jhn n SER 181 N 2.00 0.30 -0.21 2.29 3.41 -1.26 -4.04 113.62 116.12 2jhn n SER 181 Ca 0.02 0.63 -0.02 0.00 -0.26 0.00 0.00 58.87 59.25 2jhn n SER 181 Cb 0.45 -1.40 0.09 0.00 -0.26 0.00 0.00 64.21 63.09 2jhn n SER 181 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2jhn h ARG 182 N -0.42 0.57 -0.04 4.33 2.43 -1.95 -1.96 114.38 117.34 2jhn h ARG 182 Ca -0.47 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 58.52 2jhn h ARG 182 Cb 1.33 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 2jhn h ARG 182 CO 0.46 0.38 -0.63 -0.09 -1.51 0.00 0.00 179.97 178.58 2jhn h ARG 183 N 0.59 0.15 0.28 0.20 1.12 -1.98 0.43 114.38 115.17 2jhn h ARG 183 Ca 0.28 -0.10 -0.01 0.00 -1.11 0.00 0.00 59.98 59.03 2jhn h ARG 183 Cb 0.20 0.02 0.00 0.00 -0.01 0.00 0.00 29.97 30.18 2jhn h ARG 183 CO -0.19 0.72 -0.14 0.87 -3.11 0.00 0.00 179.97 178.12 2jhn h LYS 184 N 0.11 -0.37 -0.65 0.20 1.57 -1.90 -0.41 116.57 115.12 2jhn h LYS 184 Ca -0.01 0.02 0.12 0.00 -1.87 0.00 0.00 60.65 58.91 2jhn h LYS 184 Cb 1.13 0.08 -0.08 0.00 0.08 0.00 0.00 32.23 33.43 2jhn h LYS 184 CO 0.09 -0.15 0.22 0.00 -0.57 0.00 0.00 179.45 179.04 2jhn h ALA 185 N 0.15 0.85 -0.62 3.86 0.00 -1.24 0.11 119.26 122.37 2jhn h ALA 185 Ca -0.04 0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.99 2jhn h ALA 185 Cb 0.39 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2jhn h ALA 185 CO 0.06 -0.24 0.40 0.93 0.00 0.00 0.00 179.25 180.41 2jhn h GLU 186 N 0.37 0.79 -0.30 0.00 5.08 -0.78 -1.83 114.58 117.91 2jhn h GLU 186 Ca 0.34 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.54 2jhn h GLU 186 Cb 0.49 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2jhn h GLU 186 CO -0.37 0.53 -0.27 1.25 -1.00 0.00 0.00 179.01 179.14 2jhn h LEU 187 N 0.82 0.77 -0.50 1.33 5.85 -0.20 -1.83 115.31 121.54 2jhn h LEU 187 Ca 0.23 -0.46 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 2jhn h LEU 187 Cb -0.07 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 2jhn h LEU 187 CO -0.06 1.07 0.30 0.40 -0.34 0.00 0.00 178.44 179.80 2jhn h ILE 188 N 0.48 1.16 -0.74 4.05 2.04 -0.94 -0.48 117.51 123.08 2jhn h ILE 188 Ca 0.05 -0.37 0.01 0.00 1.00 0.00 0.00 64.86 65.55 2jhn h ILE 188 Cb 0.84 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 37.38 2jhn h ILE 188 CO 0.07 0.17 0.49 0.58 0.00 0.00 0.00 178.15 179.45 2jhn h VAL 189 N 0.67 1.19 -0.34 1.67 2.07 -1.29 -0.36 116.25 119.86 2jhn h VAL 189 Ca 0.18 -0.34 0.06 0.00 0.82 0.00 0.00 66.70 67.42 2jhn h VAL 189 Cb 0.01 0.10 -0.06 0.00 -1.52 0.00 0.00 31.29 29.82 2jhn h VAL 189 CO -0.03 0.18 -0.03 -0.08 0.02 0.00 0.00 177.57 177.63 2jhn h GLU 190 N 1.00 0.06 -0.69 1.57 4.81 -0.69 -1.85 114.58 118.79 2jhn h GLU 190 Ca 0.27 -0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.46 2jhn h GLU 190 Cb -0.11 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.22 2jhn h GLU 190 CO -0.06 0.04 0.28 0.82 -0.73 0.00 0.00 179.01 179.36 2jhn h ILE 191 N 0.06 1.23 -0.10 2.32 1.08 -0.71 -2.79 117.51 118.61 2jhn h ILE 191 Ca 0.16 -0.73 0.03 0.00 -0.39 0.00 0.00 64.86 63.93 2jhn h ILE 191 Cb 0.23 0.41 -0.00 0.00 -3.07 0.00 0.00 36.82 34.39 2jhn h ILE 191 CO -0.30 0.29 0.07 0.00 -0.69 0.00 0.00 178.15 177.53 2jhn h ALA 192 N 1.32 2.01 0.00 1.87 0.00 -0.22 -1.34 119.26 122.89 2jhn h ALA 192 Ca 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2jhn h ALA 192 Cb 0.18 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2jhn h ALA 192 CO -0.02 -0.12 0.00 0.87 0.00 0.00 0.00 179.25 179.97 2jhn h LYS 193 N 0.00 0.00 -6.57 0.00 1.57 -1.22 -3.45 116.57 106.89 2jhn h LYS 193 Ca 0.05 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.30 2jhn h LYS 193 Cb 0.19 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.51 2jhn h LYS 193 CO -0.00 0.00 0.53 -1.21 -0.57 0.00 0.00 179.45 178.20 2jhn s GLU 194 N -3.38 4.50 0.39 3.15 0.41 -0.51 -5.03 118.70 118.23 2jhn s GLU 194 Ca 0.03 1.77 -0.07 0.00 -0.41 0.00 0.00 54.97 56.30 2jhn s GLU 194 Cb 0.09 -3.30 -0.05 0.00 -1.78 0.00 0.00 34.13 29.08 2jhn s GLU 194 CO 0.38 -0.12 0.70 -1.21 -0.49 0.00 0.00 175.26 174.52 2jhn s GLU 195 N 0.35 3.65 -1.67 1.61 0.41 -1.26 -4.38 118.70 117.40 2jhn s GLU 195 Ca 0.54 0.20 0.00 0.00 -0.41 0.00 0.00 54.97 55.30 2jhn s GLU 195 Cb -0.30 -2.48 0.00 0.00 -1.78 0.00 0.00 34.13 29.57 2jhn s GLU 195 CO 0.32 -0.00 0.00 0.09 -0.49 0.00 0.00 175.26 175.18 2jhn n ASN 196 N -1.52 -5.30 0.08 -0.19 3.02 -1.26 -4.88 115.26 105.21 2jhn n ASN 196 Ca 0.00 0.12 0.04 0.00 -0.03 0.00 0.00 54.58 54.71 2jhn n ASN 196 Cb 0.54 -4.49 0.43 0.00 -0.61 0.00 0.00 39.78 35.66 2jhn n ASN 196 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2jhn h LEU 197 N 0.00 0.32 -2.44 3.41 5.85 -1.99 -1.69 115.31 118.77 2jhn h LEU 197 Ca -0.43 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.25 2jhn h LEU 197 Cb 1.31 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 42.25 2jhn h LEU 197 CO 0.53 0.33 -0.01 -0.08 -0.34 0.00 0.00 178.44 178.86 2jhn h GLU 198 N 0.35 0.00 0.00 1.25 4.57 -1.96 -1.07 114.58 117.73 2jhn h GLU 198 Ca 0.09 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.27 2jhn h GLU 198 Cb 0.14 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.73 2jhn h GLU 198 CO -0.00 0.01 0.00 0.93 -1.18 0.00 0.00 179.01 178.77 2jhn h GLU 199 N 0.00 0.00 -0.32 1.92 5.08 -1.69 -2.94 114.58 116.63 2jhn h GLU 199 Ca -0.00 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.44 2jhn h GLU 199 Cb 0.04 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2jhn h GLU 199 CO 0.00 0.00 0.23 1.25 -1.00 0.00 0.00 179.01 179.49 2jhn h LEU 200 N 0.00 0.08 -1.77 1.33 5.85 -1.35 -0.58 115.31 118.87 2jhn h LEU 200 Ca 0.00 0.00 0.17 0.00 0.84 0.00 0.00 57.88 58.89 2jhn h LEU 200 Cb 0.16 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 2jhn h LEU 200 CO 0.00 0.05 0.49 0.11 -0.34 0.00 0.00 178.44 178.75 2jhn h LYS 201 N 0.09 0.21 -0.02 1.25 1.57 -1.74 -2.39 116.57 115.54 2jhn h LYS 201 Ca 0.15 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2jhn h LYS 201 Cb 0.49 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2jhn h LYS 201 CO -0.01 0.14 -0.13 0.39 -0.57 0.00 0.00 179.45 179.27 2jhn n GLU 202 N -4.42 1.81 -1.61 3.15 -0.58 -0.23 -4.94 120.64 113.83 2jhn n GLU 202 Ca 0.14 -1.39 -0.31 0.00 -0.42 0.00 0.00 57.16 55.17 2jhn n GLU 202 Cb 0.63 -1.47 0.05 0.00 -0.57 0.00 0.00 31.44 30.08 2jhn n GLU 202 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 2jhn s TRP 203 N -2.15 3.08 0.73 -0.32 0.52 -0.90 -5.05 118.94 114.85 2jhn s TRP 203 Ca 0.28 1.44 -0.12 0.00 0.02 0.00 0.00 56.10 57.71 2jhn s TRP 203 Cb 0.20 -2.90 0.04 0.00 -1.15 0.00 0.00 33.47 29.65 2jhn s TRP 203 CO 0.39 -1.24 1.10 0.20 0.02 0.00 0.00 176.95 177.41 2jhn s GLY 204 N -3.67 1.87 0.14 0.98 0.00 -1.26 -4.84 107.32 100.55 2jhn s GLY 204 Ca 0.59 0.39 -0.23 0.00 0.00 0.00 0.00 44.72 45.48 2jhn s GLY 204 CO 0.53 0.74 1.64 0.83 0.00 0.00 0.00 173.10 176.84 2jhn h GLU 205 N -0.69 -0.24 -0.44 2.90 5.08 -1.96 -0.37 114.58 118.86 2jhn h GLU 205 Ca -0.45 0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 57.83 2jhn h GLU 205 Cb 1.24 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 2jhn h GLU 205 CO 0.52 -0.16 -0.10 0.93 -1.00 0.00 0.00 179.01 179.20 2jhn h GLU 206 N -0.25 0.85 -0.50 2.33 5.08 -1.99 0.96 114.58 121.06 2jhn h GLU 206 Ca 0.12 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.15 2jhn h GLU 206 Cb 0.43 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 2jhn h GLU 206 CO -0.34 0.96 0.26 0.93 -1.00 0.00 0.00 179.01 179.81 2jhn h GLU 207 N 0.68 0.71 -0.57 2.33 3.07 -1.93 -1.22 114.58 117.64 2jhn h GLU 207 Ca 0.11 -0.09 -0.07 0.00 -0.50 0.00 0.00 59.36 58.81 2jhn h GLU 207 Cb 0.64 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 28.39 2jhn h GLU 207 CO 0.04 0.57 0.10 0.00 -1.40 0.00 0.00 179.01 178.32 2jhn h ALA 208 N 1.10 0.76 -0.40 3.43 0.00 -0.91 -1.53 119.26 121.71 2jhn h ALA 208 Ca 0.17 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.86 2jhn h ALA 208 Cb 0.08 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2jhn h ALA 208 CO -0.03 0.51 0.22 -0.92 0.00 0.00 0.00 179.25 179.03 2jhn h TYR 209 N 0.85 0.40 -0.12 0.00 3.20 -0.64 -0.72 116.97 119.94 2jhn h TYR 209 Ca 0.17 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.09 2jhn h TYR 209 Cb 0.41 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.52 2jhn h TYR 209 CO 0.03 0.22 -0.11 1.49 -1.64 0.00 0.00 178.16 178.16 2jhn h GLU 210 N 0.44 -0.12 0.06 1.82 4.81 -1.10 -1.48 114.58 119.00 2jhn h GLU 210 Ca 0.16 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.40 2jhn h GLU 210 Cb 0.05 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.45 2jhn h GLU 210 CO -0.10 -0.08 -0.03 -0.92 -0.73 0.00 0.00 179.01 177.15 2jhn h TYR 211 N -0.12 -0.08 -0.30 0.92 3.20 -0.94 -0.84 116.97 118.80 2jhn h TYR 211 Ca 0.08 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2jhn h TYR 211 Cb 0.24 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 2jhn h TYR 211 CO -0.22 -0.04 0.20 -0.07 -1.64 0.00 0.00 178.16 176.38 2jhn h LEU 212 N -0.09 0.35 -0.14 2.82 3.38 -1.01 -2.41 115.31 118.20 2jhn h LEU 212 Ca -0.01 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2jhn h LEU 212 Cb 0.07 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2jhn h LEU 212 CO 0.01 0.26 0.00 0.35 0.09 0.00 0.00 178.44 179.15 2jhn n THR 213 N -4.87 0.55 0.32 0.22 -2.24 -0.57 -2.38 114.28 105.30 2jhn n THR 213 Ca -0.01 0.02 0.15 0.00 -2.27 0.00 0.00 64.05 61.94 2jhn n THR 213 Cb 0.03 -0.77 0.67 0.00 -2.10 0.00 0.00 70.33 68.16 2jhn n THR 213 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2jhn h SER 214 N 0.00 0.00 -3.45 3.42 4.64 -0.62 -3.43 113.55 114.12 2jhn h SER 214 Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 2jhn h SER 214 Cb 0.48 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.54 2jhn h SER 214 CO 0.00 0.00 0.22 -0.36 -0.87 0.00 0.00 176.83 175.82 2jhn s PHE 215 N -3.58 3.72 -0.21 4.77 0.08 -1.00 -5.01 117.98 116.75 2jhn s PHE 215 Ca 0.01 1.55 -0.29 0.00 0.12 0.00 0.00 56.93 58.32 2jhn s PHE 215 Cb 0.09 -2.91 -0.02 0.00 -0.57 0.00 0.00 43.02 39.61 2jhn s PHE 215 CO 0.42 0.20 1.52 -1.59 -0.10 0.00 0.00 175.22 175.68 2jhn s LYS 216 N 0.19 3.91 0.00 0.44 -2.85 -1.26 -2.24 119.74 117.93 2jhn s LYS 216 Ca 0.42 1.65 0.00 0.00 -1.00 0.00 0.00 55.97 57.04 2jhn s LYS 216 Cb -0.21 -3.97 0.00 0.00 -2.06 0.00 0.00 37.83 31.59 2jhn s LYS 216 CO 0.24 -1.14 0.00 0.41 0.10 0.00 0.00 175.35 174.96 2jhn n GLY 217 N 4.41 1.13 3.34 0.59 0.00 -1.26 -4.98 105.19 108.41 2jhn n GLY 217 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 2jhn n GLY 217 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jhn s ILE 218 N -2.00 4.13 0.00 -0.61 1.01 -0.95 -5.04 121.20 117.74 2jhn s ILE 218 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 60.65 59.78 2jhn s ILE 218 Cb 0.00 -3.25 0.00 0.00 0.01 0.00 0.00 42.46 39.22 2jhn s ILE 218 CO 0.00 -0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.45 2jhn n GLY 219 N 4.89 4.76 0.12 6.18 0.00 -1.26 -4.37 105.19 115.51 2jhn n GLY 219 Ca -0.13 -2.04 -0.09 0.00 0.00 0.00 0.00 46.02 43.75 2jhn n GLY 219 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2jhn h ARG 220 N 0.00 0.30 0.23 1.61 2.43 -1.98 -0.99 114.38 115.97 2jhn h ARG 220 Ca 0.00 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 2jhn h ARG 220 Cb 0.00 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 2jhn h ARG 220 CO 0.00 0.20 -0.11 2.35 -1.51 0.00 0.00 179.97 180.90 2jhn h TRP 221 N 0.31 -0.29 -0.91 2.20 7.01 -1.97 0.24 115.95 122.53 2jhn h TRP 221 Ca 0.09 -0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.12 2jhn h TRP 221 Cb -0.02 0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 27.08 2jhn h TRP 221 CO -0.07 -0.09 0.59 1.15 -2.79 0.00 0.00 178.44 177.23 2jhn h THR 222 N -0.43 1.16 -0.21 2.65 2.02 -1.93 0.28 112.91 116.45 2jhn h THR 222 Ca -0.03 -0.40 -0.06 0.00 0.77 0.00 0.00 66.41 66.69 2jhn h THR 222 Cb 0.32 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.63 2jhn h THR 222 CO 0.05 0.21 -0.09 0.00 0.37 0.00 0.00 175.52 176.06 2jhn h ALA 223 N 1.37 0.30 -0.48 6.16 0.00 -0.92 -0.92 119.26 124.77 2jhn h ALA 223 Ca 0.36 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2jhn h ALA 223 Cb -0.01 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2jhn h ALA 223 CO -0.12 0.13 -0.10 0.93 0.00 0.00 0.00 179.25 180.09 2jhn h GLU 224 N 0.14 0.87 -0.25 0.00 5.08 -0.74 0.06 114.58 119.74 2jhn h GLU 224 Ca 0.05 -0.30 -0.00 0.00 -1.00 0.00 0.00 59.36 58.11 2jhn h GLU 224 Cb 0.58 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 2jhn h GLU 224 CO 0.03 0.93 0.15 1.25 -1.00 0.00 0.00 179.01 180.37 2jhn h LEU 225 N 0.78 0.30 -0.16 1.33 5.85 -0.87 -2.06 115.31 120.49 2jhn h LEU 225 Ca 0.13 -0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.82 2jhn h LEU 225 Cb 0.61 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 2jhn h LEU 225 CO 0.04 0.27 -0.00 0.58 -0.34 0.00 0.00 178.44 178.99 2jhn h VAL 226 N 0.30 0.89 -0.71 1.05 2.07 -0.90 0.14 116.25 119.10 2jhn h VAL 226 Ca 0.09 -0.02 0.11 0.00 0.82 0.00 0.00 66.70 67.70 2jhn h VAL 226 Cb 0.03 0.83 -0.08 0.00 -1.52 0.00 0.00 31.29 30.55 2jhn h VAL 226 CO -0.02 0.01 0.31 -0.07 0.02 0.00 0.00 177.57 177.82 2jhn h LEU 227 N 0.05 0.34 0.00 2.57 3.38 -0.84 0.28 115.31 121.10 2jhn h LEU 227 Ca 0.07 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 2jhn h LEU 227 Cb 0.09 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 2jhn h LEU 227 CO -0.12 0.17 -0.20 0.77 0.09 0.00 0.00 178.44 179.15 2jhn h SER 228 N 0.50 0.00 1.43 -0.43 4.64 -1.05 -0.62 113.55 118.02 2jhn h SER 228 Ca 0.37 -0.69 -0.04 0.00 -0.47 0.00 0.00 61.79 60.96 2jhn h SER 228 Cb 0.48 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 2jhn h SER 228 CO -0.33 0.96 -0.58 0.16 -0.87 0.00 0.00 176.83 176.17 2jhn h ILE 229 N -1.00 0.19 0.00 0.95 3.07 -0.71 -3.15 117.51 116.86 2jhn h ILE 229 Ca -0.05 -1.30 -0.19 0.00 1.55 0.00 0.00 64.86 64.87 2jhn h ILE 229 Cb 0.83 1.90 -0.03 0.00 -0.27 0.00 0.00 36.82 39.24 2jhn h ILE 229 CO -0.03 0.11 -1.72 0.00 -1.05 0.00 0.00 178.15 175.45 2jhn n ALA 230 N -2.18 1.73 0.83 0.16 0.00 -0.02 -0.63 120.51 120.41 2jhn n ALA 230 Ca 0.01 -0.58 0.11 0.00 0.00 0.00 0.00 53.44 52.98 2jhn n ALA 230 Cb 0.60 0.16 -0.01 0.00 0.00 0.00 0.00 19.45 20.20 2jhn n ALA 230 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2jhn n LEU 231 N -2.75 0.74 -0.91 0.00 4.77 -0.57 -4.82 117.00 113.45 2jhn n LEU 231 Ca -0.21 -0.25 -0.11 0.00 -0.03 0.00 0.00 56.01 55.40 2jhn n LEU 231 Cb 0.76 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.74 2jhn n LEU 231 CO 0.15 0.16 -0.11 0.61 -1.33 0.00 0.00 177.39 176.87 2jhn n GLY 232 N 1.45 1.00 3.88 -0.72 0.00 -0.97 -4.89 105.19 104.95 2jhn n GLY 232 Ca 0.03 -0.51 -0.32 0.00 0.00 0.00 0.00 46.02 45.22 2jhn n GLY 232 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jhn s LYS 233 N -3.20 3.71 -1.48 1.61 -0.14 -0.28 -4.99 119.74 114.97 2jhn s LYS 233 Ca 0.00 0.09 -0.12 0.00 -1.36 0.00 0.00 55.97 54.58 2jhn s LYS 233 Cb 0.00 -2.79 0.02 0.00 -1.68 0.00 0.00 37.83 33.38 2jhn s LYS 233 CO 0.00 0.42 2.40 -1.71 -0.76 0.00 0.00 175.35 175.70 2jhn n ASN 234 N 0.11 5.62 -4.26 2.83 5.15 -1.26 -3.95 115.26 119.50 2jhn n ASN 234 Ca -0.02 -2.82 -0.33 0.00 -0.60 0.00 0.00 54.58 50.82 2jhn n ASN 234 Cb 0.52 -1.59 -0.16 0.00 -0.53 0.00 0.00 39.78 38.02 2jhn n ASN 234 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2jhn s VAL 235 N 2.31 2.45 -0.32 3.44 1.01 -1.26 -4.92 120.40 123.12 2jhn s VAL 235 Ca 0.53 -0.86 -0.09 0.00 0.00 0.00 0.00 61.98 61.56 2jhn s VAL 235 Cb 0.15 -2.00 0.00 0.00 0.00 0.00 0.00 36.38 34.54 2jhn s VAL 235 CO -0.07 0.54 0.14 0.12 0.00 0.00 0.00 175.10 175.83 2jhn s PHE 236 N 0.57 3.18 -1.32 5.22 5.36 -1.26 -4.44 117.98 125.29 2jhn s PHE 236 Ca -0.11 -0.77 -0.18 0.00 -0.96 0.00 0.00 56.93 54.92 2jhn s PHE 236 Cb -0.16 -2.34 0.06 0.00 -0.34 0.00 0.00 43.02 40.24 2jhn s PHE 236 CO 0.04 -0.53 1.81 -0.35 -1.46 0.00 0.00 175.22 174.73 2jhn n PRO 237 N 4.95 3.10 0.25 10.12 -0.04 -1.26 -4.82 135.00 147.30 2jhn n PRO 237 Ca -0.14 -3.16 0.14 0.00 -0.04 0.00 0.00 63.50 60.30 2jhn n PRO 237 Cb 0.48 -3.48 0.57 0.00 -0.04 0.00 0.00 33.50 31.04 2jhn n PRO 237 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jhn h ALA 238 N 7.43 1.02 0.00 0.55 0.00 -1.94 -2.19 119.26 124.12 2jhn h ALA 238 Ca 0.46 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.28 2jhn h ALA 238 Cb 0.84 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2jhn h ALA 238 CO 1.51 0.12 0.00 -0.44 0.00 0.00 0.00 179.25 180.45 2jhn h ASP 239 N 0.00 0.00 -2.59 0.00 3.32 -1.87 -3.41 116.42 111.87 2jhn h ASP 239 Ca -0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 2jhn h ASP 239 Cb 0.62 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.21 2jhn h ASP 239 CO 0.01 0.00 1.07 -0.62 -1.72 0.00 0.00 179.24 177.99 2jhn s ASP 240 N -4.56 6.48 0.25 6.45 2.15 -0.83 -4.89 116.67 121.73 2jhn s ASP 240 Ca 0.04 2.68 -0.04 0.00 0.43 0.00 0.00 52.55 55.66 2jhn s ASP 240 Cb 0.09 -2.57 0.30 0.00 -0.30 0.00 0.00 42.92 40.45 2jhn s ASP 240 CO 0.44 -0.97 1.81 -0.07 -0.17 0.00 0.00 175.17 176.21 2jhn h LEU 241 N 8.53 0.91 -0.84 -1.34 4.07 -1.90 -0.82 115.31 123.92 2jhn h LEU 241 Ca -0.45 -0.15 -0.00 0.00 0.08 0.00 0.00 57.88 57.36 2jhn h LEU 241 Cb 1.21 -0.24 -0.04 0.00 1.08 0.00 0.00 40.66 42.67 2jhn h LEU 241 CO 0.94 0.85 0.52 1.23 -1.08 0.00 0.00 178.44 180.90 2jhn h GLY 242 N 1.04 1.22 0.91 0.83 0.00 -1.97 -1.59 103.07 103.51 2jhn h GLY 242 Ca 0.21 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 2jhn h GLY 242 CO -0.01 0.48 0.11 -2.08 0.00 0.00 0.00 176.54 175.04 2jhn h VAL 243 N 1.16 1.17 -0.38 4.60 2.07 -1.76 -1.66 116.25 121.44 2jhn h VAL 243 Ca 0.30 -0.52 0.01 0.00 0.82 0.00 0.00 66.70 67.32 2jhn h VAL 243 Cb -0.07 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 2jhn h VAL 243 CO -0.06 0.18 0.24 0.03 0.02 0.00 0.00 177.57 177.97 2jhn h ARG 244 N 0.29 0.47 -0.21 1.57 3.08 -1.02 -1.01 114.38 117.55 2jhn h ARG 244 Ca 0.09 -0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.16 2jhn h ARG 244 Cb 0.17 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.08 2jhn h ARG 244 CO -0.01 0.31 -0.06 0.00 -1.07 0.00 0.00 179.97 179.14 2jhn h ARG 245 N 0.48 -0.01 -0.31 0.04 3.08 -1.24 -0.75 114.38 115.68 2jhn h ARG 245 Ca 0.15 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 2jhn h ARG 245 Cb -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 2jhn h ARG 245 CO -0.06 -0.01 0.14 0.00 -1.07 0.00 0.00 179.97 178.98 2jhn h ALA 246 N 1.20 0.40 -0.41 0.04 0.00 -1.03 -1.14 119.26 118.32 2jhn h ALA 246 Ca 0.10 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 2jhn h ALA 246 Cb 0.16 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2jhn h ALA 246 CO -0.22 -0.02 -0.12 0.28 0.00 0.00 0.00 179.25 179.17 2jhn h VAL 247 N 0.36 1.26 -0.37 0.00 2.07 -1.10 -1.39 116.25 117.08 2jhn h VAL 247 Ca 0.11 -1.17 -0.06 0.00 0.82 0.00 0.00 66.70 66.40 2jhn h VAL 247 Cb 0.15 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2jhn h VAL 247 CO -0.01 0.40 -0.01 0.28 0.02 0.00 0.00 177.57 178.24 2jhn h SER 248 N 0.67 0.65 -0.73 0.57 0.02 -0.99 -1.80 113.55 111.93 2jhn h SER 248 Ca 0.11 -0.31 -0.05 0.00 -0.84 0.00 0.00 61.79 60.70 2jhn h SER 248 Cb 0.59 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 2jhn h SER 248 CO 0.04 0.81 0.27 -0.09 -1.14 0.00 0.00 176.83 176.72 2jhn h ARG 249 N 0.48 1.12 -0.20 3.45 2.43 -1.04 0.15 114.38 120.77 2jhn h ARG 249 Ca 0.10 -0.21 -0.10 0.00 -0.81 0.00 0.00 59.98 58.96 2jhn h ARG 249 Cb 0.48 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.85 2jhn h ARG 249 CO 0.02 0.92 -0.27 -0.07 -1.51 0.00 0.00 179.97 179.07 2jhn h LEU 250 N 1.09 0.57 0.00 3.80 3.38 -1.21 -3.36 115.31 119.58 2jhn h LEU 250 Ca 0.25 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2jhn h LEU 250 Cb 0.24 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2jhn h LEU 250 CO -0.02 0.97 -0.65 -1.22 0.09 0.00 0.00 178.44 177.61 2jhn n TYR 251 N -4.38 0.00 -1.69 1.13 4.01 -0.68 -4.69 117.16 110.86 2jhn n TYR 251 Ca -0.06 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.74 2jhn n TYR 251 Cb 0.45 -0.04 0.09 0.00 -0.31 0.00 0.00 39.34 39.53 2jhn n TYR 251 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2jhn n PHE 252 N -1.35 0.00 -4.23 -0.72 3.72 0.44 -5.00 117.46 110.32 2jhn n PHE 252 Ca 0.00 -0.71 -0.37 0.00 -0.05 0.00 0.00 57.45 56.32 2jhn n PHE 252 Cb 0.09 -0.14 -0.03 0.00 -0.94 0.00 0.00 39.48 38.46 2jhn n PHE 252 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2jhn n ASN 253 N -0.62 -3.34 0.00 4.37 5.15 -1.03 -1.50 115.26 118.29 2jhn n ASN 253 Ca 0.10 -1.01 0.00 0.00 -0.60 0.00 0.00 54.58 53.07 2jhn n ASN 253 Cb 0.75 -2.73 0.00 0.00 -0.53 0.00 0.00 39.78 37.27 2jhn n ASN 253 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2jhn n GLY 254 N -1.37 1.32 3.59 8.20 0.00 -0.75 -4.94 105.19 111.22 2jhn n GLY 254 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2jhn n GLY 254 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jhn s GLU 255 N -0.22 3.46 -0.07 1.61 0.41 -0.56 -4.80 118.70 118.52 2jhn s GLU 255 Ca 0.00 0.63 -0.36 0.00 -0.41 0.00 0.00 54.97 54.83 2jhn s GLU 255 Cb 0.00 -4.06 -0.14 0.00 -1.78 0.00 0.00 34.13 28.16 2jhn s GLU 255 CO 0.00 -1.72 1.72 1.51 -0.49 0.00 0.00 175.26 176.28 2jhn n ILE 256 N 6.94 0.33 -4.05 -1.63 0.13 -1.26 -4.82 119.36 114.99 2jhn n ILE 256 Ca 0.14 -0.06 -0.22 0.00 -1.10 0.00 0.00 62.75 61.51 2jhn n ILE 256 Cb 0.49 -1.50 -0.03 0.00 -0.84 0.00 0.00 39.64 37.75 2jhn n ILE 256 CO 0.00 0.00 0.00 -1.10 2.80 0.00 0.00 176.55 178.25 2jhn s GLN 257 N 2.91 3.15 0.69 9.51 -1.52 -1.26 -5.11 119.66 128.03 2jhn s GLN 257 Ca 0.91 -0.93 -0.11 0.00 -1.95 0.00 0.00 55.36 53.28 2jhn s GLN 257 Cb -0.83 -2.71 0.01 0.00 -0.22 0.00 0.00 33.01 29.26 2jhn s GLN 257 CO 0.52 0.41 1.06 -1.54 -0.25 0.00 0.00 175.29 175.50 2jhn s SER 258 N -3.90 5.37 0.31 5.90 1.04 -1.26 -4.90 113.70 116.25 2jhn s SER 258 Ca 0.33 1.66 0.02 0.00 0.48 0.00 0.00 55.95 58.44 2jhn s SER 258 Cb -0.08 -2.50 0.57 0.00 0.10 0.00 0.00 66.02 64.11 2jhn s SER 258 CO 0.27 -1.45 1.91 0.00 0.98 0.00 0.00 173.24 174.95 2jhn h ALA 259 N -0.61 1.55 -0.62 5.32 0.00 -1.96 -1.81 119.26 121.13 2jhn h ALA 259 Ca -0.44 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 2jhn h ALA 259 Cb 1.21 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 2jhn h ALA 259 CO 0.56 0.30 0.20 1.05 0.00 0.00 0.00 179.25 181.36 2jhn h GLU 260 N 0.98 0.93 -0.33 0.00 4.11 -1.93 0.58 114.58 118.91 2jhn h GLU 260 Ca 0.39 -0.18 -0.14 0.00 0.07 0.00 0.00 59.36 59.50 2jhn h GLU 260 Cb 0.25 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 2jhn h GLU 260 CO -0.15 0.80 -0.35 -0.22 0.07 0.00 0.00 179.01 179.15 2jhn h LYS 261 N 0.90 0.82 -0.49 1.06 1.63 -1.84 -2.09 116.57 116.57 2jhn h LYS 261 Ca 0.20 -0.44 -0.01 0.00 -0.85 0.00 0.00 60.65 59.55 2jhn h LYS 261 Cb 0.25 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.88 2jhn h LYS 261 CO -0.01 1.08 0.28 0.28 -3.45 0.00 0.00 179.45 177.63 2jhn h VAL 262 N 0.60 1.16 -0.98 2.00 2.07 -1.06 -0.91 116.25 119.13 2jhn h VAL 262 Ca 0.05 -0.40 0.12 0.00 0.82 0.00 0.00 66.70 67.29 2jhn h VAL 262 Cb 0.94 0.55 -0.08 0.00 -1.52 0.00 0.00 31.29 31.18 2jhn h VAL 262 CO 0.09 0.17 0.62 0.03 0.02 0.00 0.00 177.57 178.50 2jhn h ARG 263 N 0.64 0.94 -0.12 1.57 3.08 -0.82 -0.85 114.38 118.83 2jhn h ARG 263 Ca 0.17 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 2jhn h ARG 263 Cb 0.03 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 29.87 2jhn h ARG 263 CO -0.03 0.62 0.01 1.49 -1.07 0.00 0.00 179.97 180.99 2jhn h GLU 264 N 0.96 0.20 -0.31 0.04 4.81 -0.82 -1.60 114.58 117.86 2jhn h GLU 264 Ca 0.48 -0.06 0.06 0.00 -0.13 0.00 0.00 59.36 59.71 2jhn h GLU 264 Cb 0.49 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.79 2jhn h GLU 264 CO -0.25 0.43 -0.09 0.82 -0.73 0.00 0.00 179.01 179.19 2jhn h ILE 265 N -0.05 0.66 -0.76 2.32 1.08 -0.90 -1.13 117.51 118.73 2jhn h ILE 265 Ca 0.03 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.54 2jhn h ILE 265 Cb 0.33 0.66 -0.05 0.00 -3.07 0.00 0.00 36.82 34.69 2jhn h ILE 265 CO 0.00 0.00 0.47 0.00 -0.69 0.00 0.00 178.15 177.94 2jhn h ALA 266 N 1.28 1.00 -0.40 1.87 0.00 -1.08 0.32 119.26 122.25 2jhn h ALA 266 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2jhn h ALA 266 Cb 0.25 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2jhn h ALA 266 CO -0.33 0.25 0.27 0.00 0.00 0.00 0.00 179.25 179.44 2jhn h ARG 267 N 0.91 0.53 -0.09 0.00 3.08 -0.98 -0.07 114.38 117.76 2jhn h ARG 267 Ca 0.31 -0.03 -0.22 0.00 0.07 0.00 0.00 59.98 60.11 2jhn h ARG 267 Cb 0.05 -0.12 0.01 0.00 0.08 0.00 0.00 29.97 29.99 2jhn h ARG 267 CO -0.13 0.35 -0.82 0.93 -1.07 0.00 0.00 179.97 179.23 2jhn h GLU 268 N 0.54 0.63 0.00 0.04 5.08 -0.68 -3.37 114.58 116.82 2jhn h GLU 268 Ca 0.15 -0.55 -0.04 0.00 -1.00 0.00 0.00 59.36 57.92 2jhn h GLU 268 Cb -0.06 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2jhn h GLU 268 CO -0.03 1.17 -1.40 0.54 -1.00 0.00 0.00 179.01 178.28 2jhn n ARG 269 N -3.87 1.06 -0.10 2.33 1.74 0.11 -4.79 116.66 113.14 2jhn n ARG 269 Ca -0.07 -0.05 -0.11 0.00 -0.77 0.00 0.00 57.85 56.85 2jhn n ARG 269 Cb 0.76 -1.18 -0.14 0.00 -1.02 0.00 0.00 32.46 30.88 2jhn n ARG 269 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2jhn n PHE 270 N -1.93 0.00 -0.39 -1.55 3.72 -0.07 -5.03 117.46 112.20 2jhn n PHE 270 Ca -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 2jhn n PHE 270 Cb 0.37 -0.92 0.00 0.00 -0.94 0.00 0.00 39.48 38.00 2jhn n PHE 270 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2jhn n GLY 271 N 1.97 2.68 0.09 1.37 0.00 -0.99 -1.49 105.19 108.82 2jhn n GLY 271 Ca -0.33 -0.09 0.10 0.00 0.00 0.00 0.00 46.02 45.70 2jhn n GLY 271 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2jhn n ARG 272 N 14.00 0.13 -0.44 1.61 1.85 -1.26 -2.10 116.66 130.44 2jhn n ARG 272 Ca 0.00 0.41 0.10 0.00 -1.00 0.00 0.00 57.85 57.36 2jhn n ARG 272 Cb 0.00 -1.77 0.31 0.00 -1.05 0.00 0.00 32.46 29.95 2jhn n ARG 272 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2jhn n PHE 273 N -2.01 1.10 -0.33 2.89 3.72 -0.56 -4.64 117.46 117.63 2jhn n PHE 273 Ca 0.02 -0.56 0.03 0.00 -0.05 0.00 0.00 57.45 56.89 2jhn n PHE 273 Cb 0.17 -0.11 0.18 0.00 -0.94 0.00 0.00 39.48 38.78 2jhn n PHE 273 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2jhn h ALA 274 N 3.79 1.31 -0.61 4.37 0.00 -1.25 -0.62 119.26 126.25 2jhn h ALA 274 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 2jhn h ALA 274 Cb 1.15 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 2jhn h ALA 274 CO 0.10 0.27 0.19 -0.09 0.00 0.00 0.00 179.25 179.71 2jhn h ARG 275 N 0.99 0.91 -0.12 0.00 2.43 -1.86 0.89 114.38 117.62 2jhn h ARG 275 Ca 0.42 -0.17 -0.06 0.00 -0.81 0.00 0.00 59.98 59.36 2jhn h ARG 275 Cb 0.29 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 2jhn h ARG 275 CO -0.21 0.79 -0.16 -0.44 -1.51 0.00 0.00 179.97 178.43 2jhn h ASP 276 N 0.89 0.36 -0.42 -3.80 3.32 -1.74 -3.17 116.42 111.86 2jhn h ASP 276 Ca 0.20 -0.51 0.00 0.00 0.02 0.00 0.00 57.03 56.74 2jhn h ASP 276 Cb 0.25 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 2jhn h ASP 276 CO -0.01 0.80 0.27 0.40 -1.72 0.00 0.00 179.24 178.98 2jhn h ILE 277 N -0.08 1.12 -0.81 0.35 2.04 -0.96 -2.05 117.51 117.12 2jhn h ILE 277 Ca 0.01 -0.24 0.12 0.00 1.00 0.00 0.00 64.86 65.76 2jhn h ILE 277 Cb 0.71 0.51 -0.08 0.00 -0.74 0.00 0.00 36.82 37.22 2jhn h ILE 277 CO 0.04 0.12 0.42 0.25 0.00 0.00 0.00 178.15 178.98 2jhn h LEU 278 N 0.58 0.54 -0.75 1.44 5.85 -0.79 0.09 115.31 122.26 2jhn h LEU 278 Ca 0.15 0.08 -0.08 0.00 0.84 0.00 0.00 57.88 58.87 2jhn h LEU 278 Cb -0.04 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 2jhn h LEU 278 CO -0.03 0.26 0.04 -0.26 -0.34 0.00 0.00 178.44 178.11 2jhn h PHE 279 N 0.65 1.06 -0.78 1.25 -1.00 -1.41 -0.88 116.94 115.83 2jhn h PHE 279 Ca 0.42 -0.16 -0.01 0.00 2.81 0.00 0.00 57.97 61.04 2jhn h PHE 279 Cb 0.53 -0.29 -0.04 0.00 3.61 0.00 0.00 35.95 39.76 2jhn h PHE 279 CO -0.09 0.93 0.46 1.88 -1.61 0.00 0.00 178.31 179.87 2jhn h TYR 280 N 0.92 1.04 -0.44 -0.55 -1.99 -1.28 -1.90 116.97 112.76 2jhn h TYR 280 Ca 0.17 -0.01 -0.11 0.00 2.00 0.00 0.00 58.73 60.78 2jhn h TYR 280 Cb 0.48 -0.34 -0.02 0.00 2.00 0.00 0.00 36.73 38.86 2jhn h TYR 280 CO 0.03 0.70 -0.18 -0.07 -0.00 0.00 0.00 178.16 178.64 2jhn h LEU 281 N 1.08 0.86 -0.35 3.88 3.38 -0.48 -0.96 115.31 122.72 2jhn h LEU 281 Ca 0.28 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2jhn h LEU 281 Cb -0.02 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 2jhn h LEU 281 CO -0.05 1.03 0.20 -0.26 0.09 0.00 0.00 178.44 179.45 2jhn h PHE 282 N 0.75 0.48 -0.58 1.13 0.04 -0.93 0.66 116.94 118.50 2jhn h PHE 282 Ca 0.11 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.88 2jhn h PHE 282 Cb 0.71 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.67 2jhn h PHE 282 CO 0.04 0.37 0.38 -0.07 -0.60 0.00 0.00 178.31 178.42 2jhn h LEU 283 N 0.45 0.67 -0.24 1.54 3.38 -1.16 -0.75 115.31 119.20 2jhn h LEU 283 Ca 0.13 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 2jhn h LEU 283 Cb 0.04 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2jhn h LEU 283 CO -0.02 0.49 0.14 0.22 0.09 0.00 0.00 178.44 179.36 2jhn h TYR 284 N 0.78 0.32 -0.77 1.13 3.20 -0.93 0.35 116.97 121.06 2jhn h TYR 284 Ca 0.21 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.04 2jhn h TYR 284 Cb -0.08 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.05 2jhn h TYR 284 CO -0.03 0.25 0.33 0.22 -1.64 0.00 0.00 178.16 177.29 2jhn h ASP 285 N 0.30 1.03 0.11 -2.11 3.58 -0.72 0.11 116.42 118.73 2jhn h ASP 285 Ca 0.09 -0.14 -0.25 0.00 0.42 0.00 0.00 57.03 57.14 2jhn h ASP 285 Cb 0.03 -0.27 0.01 0.00 1.72 0.00 0.00 39.33 40.83 2jhn h ASP 285 CO -0.02 0.90 -1.01 0.03 -2.88 0.00 0.00 179.24 176.26 2jhn h ARG 286 N 1.10 0.61 -0.01 0.28 3.08 -0.81 0.88 114.38 119.51 2jhn h ARG 286 Ca 0.26 -0.65 0.00 0.00 0.07 0.00 0.00 59.98 59.66 2jhn h ARG 286 Cb 0.17 0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.41 2jhn h ARG 286 CO -0.03 1.25 -0.23 1.19 -1.07 0.00 0.00 179.97 181.09 2jhn n PHE 287 N -3.82 0.00 -2.70 3.04 3.72 0.12 -4.21 117.46 113.61 2jhn n PHE 287 Ca -0.10 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.22 2jhn n PHE 287 Cb 0.87 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.46 2jhn n PHE 287 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2jhn n PHE 288 N -0.45 -0.16 0.00 1.38 7.35 0.38 -4.96 117.46 121.00 2jhn n PHE 288 Ca 0.03 -2.54 0.00 0.00 -0.76 0.00 0.00 57.45 54.18 2jhn n PHE 288 Cb 0.18 0.31 0.00 0.00 0.35 0.00 0.00 39.48 40.32 2jhn n PHE 288 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 2jhn n SER 289 N -0.21 0.00 0.00 -2.13 3.41 -1.23 -4.76 113.62 108.70 2jhn n SER 289 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 2jhn n SER 289 Cb 0.82 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.77 2jhn n SER 289 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2jhn n LYS 290 N 0.00 0.00 -3.84 4.33 5.02 0.30 -5.03 118.16 118.95 2jhn n LYS 290 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2jhn n LYS 290 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2jhn n LYS 290 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2jhn n GLU 293 N 0.00 -0.57 -2.51 1.97 1.02 -1.26 -4.90 120.64 114.39 2jhn n GLU 293 Ca 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2jhn n GLU 293 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2jhn n GLU 293 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2jhn n LEU 294 N 0.00 -2.54 -0.94 -4.62 4.77 -1.26 -5.44 117.00 106.98 2jhn n LEU 294 Ca 0.00 1.10 0.12 0.00 -0.03 0.00 0.00 56.01 57.20 2jhn n LEU 294 Cb 0.00 -1.65 0.10 0.00 -2.33 0.00 0.00 43.42 39.54 2jhn n LEU 294 CO 0.00 -2.23 0.62 0.55 -1.33 0.00 0.00 177.39 175.00