#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jj1 s THR 10 N 0.00 3.59 0.45 4.28 2.01 -1.26 -3.10 115.64 121.61 2jj1 s THR 10 Ca 0.00 -0.50 0.05 0.00 0.31 0.00 0.00 61.69 61.55 2jj1 s THR 10 Cb 0.00 -2.50 -0.05 0.00 0.01 0.00 0.00 72.50 69.96 2jj1 s THR 10 CO 0.00 0.56 0.04 -0.83 -0.69 0.00 0.00 174.62 173.70 2jj1 s GLY 11 N -0.27 2.66 -0.06 4.40 0.00 0.13 -4.42 107.32 109.78 2jj1 s GLY 11 Ca 0.03 -1.58 0.01 0.00 0.00 0.00 0.00 44.72 43.19 2jj1 s GLY 11 CO 0.03 -2.11 -0.06 0.50 0.00 0.00 0.00 173.10 171.46 2jj1 s ARG 12 N -3.81 1.05 0.06 2.90 0.52 -0.17 -0.64 118.95 118.86 2jj1 s ARG 12 Ca 0.26 -0.16 -0.32 0.00 -0.52 0.00 0.00 55.73 54.99 2jj1 s ARG 12 Cb 0.06 -1.04 -0.11 0.00 0.52 0.00 0.00 34.95 34.38 2jj1 s ARG 12 CO 0.13 -0.10 1.86 -0.89 0.02 0.00 0.00 175.30 176.32 2jj1 n ILE 13 N 4.20 0.48 -0.02 1.52 5.41 -0.36 -0.93 119.36 129.65 2jj1 n ILE 13 Ca -0.21 -0.09 0.01 0.00 1.00 0.00 0.00 62.75 63.46 2jj1 n ILE 13 Cb 0.51 -2.07 -0.08 0.00 -0.71 0.00 0.00 39.64 37.29 2jj1 n ILE 13 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 2jj1 n VAL 14 N 4.89 0.30 -3.75 1.39 0.24 0.62 0.33 118.33 122.36 2jj1 n VAL 14 Ca 0.19 -0.33 -0.13 0.00 -2.04 0.00 0.00 64.34 62.04 2jj1 n VAL 14 Cb 0.36 -0.18 -0.10 0.00 -1.47 0.00 0.00 33.84 32.45 2jj1 n VAL 14 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jj1 s ALA 15 N -2.53 -0.90 -0.15 2.33 0.00 -1.05 -4.93 121.76 114.54 2jj1 s ALA 15 Ca -0.04 0.87 -0.04 0.00 0.00 0.00 0.00 51.96 52.75 2jj1 s ALA 15 Cb 0.05 -0.42 0.05 0.00 0.00 0.00 0.00 23.12 22.80 2jj1 s ALA 15 CO 0.43 -0.20 0.07 0.08 0.00 0.00 0.00 175.76 176.14 2jj1 s VAL 16 N -0.22 0.10 -0.21 0.00 1.01 -1.26 -0.89 120.40 118.93 2jj1 s VAL 16 Ca -0.04 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 61.78 2jj1 s VAL 16 Cb -0.03 -0.64 0.05 0.00 0.00 0.00 0.00 36.38 35.76 2jj1 s VAL 16 CO 0.02 -0.17 -0.06 -0.63 0.00 0.00 0.00 175.10 174.26 2jj1 s ILE 17 N 2.06 1.42 0.00 2.22 1.01 -0.50 -5.04 121.20 122.36 2jj1 s ILE 17 Ca 0.02 -1.00 0.00 0.00 0.00 0.00 0.00 60.65 59.67 2jj1 s ILE 17 Cb -0.16 -1.63 0.00 0.00 0.01 0.00 0.00 42.46 40.69 2jj1 s ILE 17 CO -0.08 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.49 2jj1 n GLY 18 N 4.74 3.11 0.13 6.18 0.00 -1.26 -1.04 105.19 117.05 2jj1 n GLY 18 Ca -0.13 0.14 0.13 0.00 0.00 0.00 0.00 46.02 46.16 2jj1 n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jj1 h ALA 19 N -0.46 0.99 -2.84 4.61 0.00 -1.95 -3.43 119.26 116.20 2jj1 h ALA 19 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.32 2jj1 h ALA 19 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.70 2jj1 h ALA 19 CO 0.00 0.00 -0.11 0.08 0.00 0.00 0.00 179.25 179.22 2jj1 s VAL 20 N -3.13 5.16 -0.08 0.00 1.01 -0.20 -1.86 120.40 121.30 2jj1 s VAL 20 Ca 0.10 0.93 0.02 0.00 0.00 0.00 0.00 61.98 63.03 2jj1 s VAL 20 Cb 0.11 -3.82 0.01 0.00 0.00 0.00 0.00 36.38 32.68 2jj1 s VAL 20 CO 0.62 0.26 -0.13 -0.69 0.00 0.00 0.00 175.10 175.16 2jj1 s VAL 21 N 1.05 1.27 -0.14 2.92 1.01 -0.63 -1.42 120.40 124.48 2jj1 s VAL 21 Ca 0.25 -0.53 -0.16 0.00 0.00 0.00 0.00 61.98 61.53 2jj1 s VAL 21 Cb -0.15 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 2jj1 s VAL 21 CO 0.10 0.39 0.39 -1.81 0.00 0.00 0.00 175.10 174.17 2jj1 s ASP 22 N 0.84 6.57 -0.03 3.32 1.01 -0.07 -0.56 116.67 127.76 2jj1 s ASP 22 Ca -0.11 0.67 0.06 0.00 0.71 0.00 0.00 52.55 53.88 2jj1 s ASP 22 Cb -0.15 -2.24 -0.01 0.00 1.01 0.00 0.00 42.92 41.53 2jj1 s ASP 22 CO 0.01 0.05 -0.20 -0.69 0.21 0.00 0.00 175.17 174.55 2jj1 s VAL 23 N 0.54 1.59 -0.13 -1.27 1.01 0.33 -0.28 120.40 122.20 2jj1 s VAL 23 Ca 0.21 -0.84 -0.01 0.00 0.00 0.00 0.00 61.98 61.34 2jj1 s VAL 23 Cb -0.14 -1.34 -0.02 0.00 0.00 0.00 0.00 36.38 34.88 2jj1 s VAL 23 CO 0.07 0.45 -0.09 -1.58 0.00 0.00 0.00 175.10 173.96 2jj1 s GLN 24 N -0.30 3.42 -0.15 2.72 0.74 -0.11 0.33 119.66 126.31 2jj1 s GLN 24 Ca 0.03 -0.61 0.02 0.00 0.05 0.00 0.00 55.36 54.86 2jj1 s GLN 24 Cb -0.09 -2.73 0.01 0.00 1.10 0.00 0.00 33.01 31.29 2jj1 s GLN 24 CO 0.00 0.28 -0.20 -0.06 -0.55 0.00 0.00 175.29 174.76 2jj1 s PHE 25 N 0.22 2.58 0.06 1.67 0.40 0.51 -1.00 117.98 122.43 2jj1 s PHE 25 Ca -0.06 -1.36 -0.16 0.00 -0.60 0.00 0.00 56.93 54.75 2jj1 s PHE 25 Cb -0.15 -1.78 -0.17 0.00 0.51 0.00 0.00 43.02 41.44 2jj1 s PHE 25 CO 0.04 -0.65 1.26 -0.44 0.70 0.00 0.00 175.22 176.13 2jj1 h ASP 26 N 7.52 0.72 0.00 1.36 3.45 -1.84 -3.45 116.42 124.19 2jj1 h ASP 26 Ca -0.36 -0.63 0.00 0.00 0.43 0.00 0.00 57.03 56.47 2jj1 h ASP 26 Cb 1.17 -0.21 0.00 0.00 -0.56 0.00 0.00 39.33 39.73 2jj1 h ASP 26 CO 0.56 1.24 0.00 -0.62 -1.57 0.00 0.00 179.24 178.85 2jj1 n GLU 27 N -4.15 0.00 -1.83 3.56 -0.58 -1.26 -4.99 120.64 111.39 2jj1 n GLU 27 Ca -0.08 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.24 2jj1 n GLU 27 Cb 0.64 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 31.48 2jj1 n GLU 27 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2jj1 s GLY 28 N 0.00 1.44 -0.27 0.62 0.00 -1.26 -4.98 107.32 102.87 2jj1 s GLY 28 Ca 0.00 1.36 -0.12 0.00 0.00 0.00 0.00 44.72 45.96 2jj1 s GLY 28 CO 0.00 2.95 0.22 -2.27 0.00 0.00 0.00 173.10 174.00 2jj1 s LEU 29 N 2.34 4.03 0.23 0.66 2.96 -1.26 -4.90 118.68 122.75 2jj1 s LEU 29 Ca 0.76 0.06 -0.30 0.00 -0.22 0.00 0.00 54.13 54.42 2jj1 s LEU 29 Cb -0.44 -2.18 -0.10 0.00 0.50 0.00 0.00 46.19 43.97 2jj1 s LEU 29 CO 0.34 -0.06 1.52 -2.16 -1.32 0.00 0.00 176.35 174.67 2jj1 s PRO 30 N 1.75 4.21 0.67 0.98 0.04 -1.26 -4.98 135.00 136.40 2jj1 s PRO 30 Ca 0.09 2.39 -0.14 0.00 0.04 0.00 0.00 61.00 63.38 2jj1 s PRO 30 Cb -0.16 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 31.28 2jj1 s PRO 30 CO 0.10 -0.53 1.09 -1.25 0.04 0.00 0.00 177.00 176.45 2jj1 s PRO 31 N 0.07 2.84 0.29 0.56 0.04 -1.26 -4.93 135.00 132.61 2jj1 s PRO 31 Ca 0.64 1.28 -0.28 0.00 0.04 0.00 0.00 61.00 62.67 2jj1 s PRO 31 Cb -0.44 -1.96 -0.14 0.00 0.04 0.00 0.00 34.50 32.00 2jj1 s PRO 31 CO 0.41 -1.20 1.11 -0.89 0.04 0.00 0.00 177.00 176.46 2jj1 n ILE 32 N -2.56 1.88 0.00 0.56 5.41 -1.26 -1.98 119.36 121.40 2jj1 n ILE 32 Ca 0.10 -0.47 0.00 0.00 1.00 0.00 0.00 62.75 63.38 2jj1 n ILE 32 Cb 0.52 -1.15 0.00 0.00 -0.71 0.00 0.00 39.64 38.30 2jj1 n ILE 32 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2jj1 n LEU 33 N 1.21 0.00 -4.77 1.39 4.77 0.52 -4.95 117.00 115.17 2jj1 n LEU 33 Ca 0.09 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.67 2jj1 n LEU 33 Cb 0.32 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.43 2jj1 n LEU 33 CO 0.61 0.00 1.05 0.20 -1.33 0.00 0.00 177.39 177.92 2jj1 s ASN 34 N -3.13 5.98 -0.10 -1.43 -0.87 -0.84 -4.13 114.94 110.42 2jj1 s ASN 34 Ca 0.00 2.88 -0.25 0.00 -1.57 0.00 0.00 52.86 53.91 2jj1 s ASN 34 Cb 0.00 -2.65 -0.02 0.00 -0.02 0.00 0.00 41.25 38.55 2jj1 s ASN 34 CO 0.00 -1.10 0.81 0.00 -2.57 0.00 0.00 177.10 174.24 2jj1 s ALA 35 N -1.21 3.39 -0.05 0.60 0.00 0.27 -0.75 121.76 124.01 2jj1 s ALA 35 Ca 0.60 0.15 0.01 0.00 0.00 0.00 0.00 51.96 52.72 2jj1 s ALA 35 Cb -0.43 -3.15 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 2jj1 s ALA 35 CO 0.55 -0.39 -0.04 -0.51 0.00 0.00 0.00 175.76 175.37 2jj1 s LEU 36 N 1.49 3.30 -0.33 0.00 1.43 0.15 -1.52 118.68 123.21 2jj1 s LEU 36 Ca 0.40 -0.01 -0.07 0.00 -1.03 0.00 0.00 54.13 53.43 2jj1 s LEU 36 Cb -0.18 -1.78 0.03 0.00 0.03 0.00 0.00 46.19 44.29 2jj1 s LEU 36 CO 0.17 0.34 0.10 -1.61 0.23 0.00 0.00 176.35 175.58 2jj1 s GLU 37 N -1.03 2.77 0.06 1.70 0.41 0.13 0.83 118.70 123.57 2jj1 s GLU 37 Ca 0.14 -1.08 -0.31 0.00 -0.41 0.00 0.00 54.97 53.32 2jj1 s GLU 37 Cb -0.11 -3.45 -0.08 0.00 -1.78 0.00 0.00 34.13 28.72 2jj1 s GLU 37 CO 0.04 -0.60 1.56 0.08 -0.49 0.00 0.00 175.26 175.85 2jj1 s VAL 38 N 1.44 3.22 0.36 2.63 1.01 0.11 -1.81 120.40 127.35 2jj1 s VAL 38 Ca -0.00 0.69 -0.17 0.00 0.00 0.00 0.00 61.98 62.50 2jj1 s VAL 38 Cb -0.19 -3.44 -0.09 0.00 0.00 0.00 0.00 36.38 32.66 2jj1 s VAL 38 CO 0.03 0.00 0.80 -1.10 0.00 0.00 0.00 175.10 174.83 2jj1 s GLN 39 N 2.38 4.06 -0.54 2.72 -1.52 0.61 -4.25 119.66 123.12 2jj1 s GLN 39 Ca 0.70 0.80 -0.03 0.00 -1.95 0.00 0.00 55.36 54.88 2jj1 s GLN 39 Cb -0.37 -2.35 0.00 0.00 -0.22 0.00 0.00 33.01 30.07 2jj1 s GLN 39 CO 0.30 0.09 0.41 0.41 -0.25 0.00 0.00 175.29 176.26 2jj1 n GLY 40 N -0.48 0.34 3.60 3.09 0.00 -1.26 -4.60 105.19 105.89 2jj1 n GLY 40 Ca 0.05 -0.34 -0.28 0.00 0.00 0.00 0.00 46.02 45.44 2jj1 n GLY 40 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jj1 s ARG 41 N -5.39 2.21 -0.02 1.61 1.81 -1.26 -5.05 118.95 112.85 2jj1 s ARG 41 Ca 0.20 -1.08 -0.23 0.00 -1.72 0.00 0.00 55.73 52.90 2jj1 s ARG 41 Cb -0.09 -2.30 -0.22 0.00 -0.45 0.00 0.00 34.95 31.89 2jj1 s ARG 41 CO 0.25 0.48 1.11 1.49 -0.68 0.00 0.00 175.30 177.95 2jj1 h GLU 42 N 3.23 0.25 -6.59 3.54 4.81 -1.97 -3.45 114.58 114.41 2jj1 h GLU 42 Ca -0.48 -0.23 -0.67 0.00 -0.13 0.00 0.00 59.36 57.85 2jj1 h GLU 42 Cb 1.18 0.06 -0.17 0.00 0.63 0.00 0.00 28.75 30.45 2jj1 h GLU 42 CO 0.55 0.91 -0.76 0.95 -0.73 0.00 0.00 179.01 179.93 2jj1 s THR 43 N -3.39 3.20 -0.19 0.32 -4.23 -1.26 -5.07 115.64 105.02 2jj1 s THR 43 Ca -0.15 -1.30 -0.37 0.00 -1.18 0.00 0.00 61.69 58.69 2jj1 s THR 43 Cb 0.02 -2.48 -0.13 0.00 1.34 0.00 0.00 72.50 71.25 2jj1 s THR 43 CO 0.76 0.14 1.85 -1.14 -0.54 0.00 0.00 174.62 175.68 2jj1 n ARG 44 N 0.82 1.65 -3.85 3.99 0.63 -1.26 -4.97 116.66 113.67 2jj1 n ARG 44 Ca -0.14 0.60 -0.36 0.00 -0.92 0.00 0.00 57.85 57.03 2jj1 n ARG 44 Cb 0.52 -2.40 -0.13 0.00 0.45 0.00 0.00 32.46 30.90 2jj1 n ARG 44 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 2jj1 s LEU 45 N 4.10 3.96 -0.12 6.15 2.96 -1.26 -4.95 118.68 129.52 2jj1 s LEU 45 Ca 0.97 -1.14 -0.09 0.00 -0.22 0.00 0.00 54.13 53.64 2jj1 s LEU 45 Cb -0.87 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.00 2jj1 s LEU 45 CO 0.58 -0.26 0.20 -0.69 -1.32 0.00 0.00 176.35 174.85 2jj1 s VAL 46 N 1.33 5.39 -0.21 1.68 1.01 -1.26 0.08 120.40 128.42 2jj1 s VAL 46 Ca -0.03 0.34 -0.04 0.00 0.00 0.00 0.00 61.98 62.26 2jj1 s VAL 46 Cb -0.19 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 32.69 2jj1 s VAL 46 CO 0.00 0.56 -0.04 -0.76 0.00 0.00 0.00 175.10 174.86 2jj1 s LEU 47 N -0.68 2.94 -0.13 3.92 1.43 0.24 -1.66 118.68 124.74 2jj1 s LEU 47 Ca 0.16 -0.36 -0.23 0.00 -1.03 0.00 0.00 54.13 52.67 2jj1 s LEU 47 Cb -0.13 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.32 2jj1 s LEU 47 CO 0.05 0.00 0.69 -0.70 0.23 0.00 0.00 176.35 176.62 2jj1 s GLU 48 N 1.34 4.33 0.00 1.70 2.12 -0.17 0.34 118.70 128.36 2jj1 s GLU 48 Ca 0.04 0.79 -0.30 0.00 0.36 0.00 0.00 54.97 55.86 2jj1 s GLU 48 Cb -0.14 -3.52 -0.06 0.00 0.26 0.00 0.00 34.13 30.67 2jj1 s GLU 48 CO -0.02 -0.11 1.50 0.08 -0.54 0.00 0.00 175.26 176.17 2jj1 s VAL 49 N 1.43 3.54 -0.24 3.70 1.01 0.07 -1.86 120.40 128.06 2jj1 s VAL 49 Ca 0.34 0.89 0.02 0.00 0.00 0.00 0.00 61.98 63.23 2jj1 s VAL 49 Cb -0.17 -3.57 -0.16 0.00 0.00 0.00 0.00 36.38 32.48 2jj1 s VAL 49 CO 0.14 -0.02 -0.21 0.00 0.00 0.00 0.00 175.10 175.01 2jj1 n ALA 50 N 5.80 1.49 -3.19 5.51 0.00 0.18 -0.36 120.51 129.94 2jj1 n ALA 50 Ca 0.15 -1.02 -0.13 0.00 0.00 0.00 0.00 53.44 52.44 2jj1 n ALA 50 Cb 0.43 -0.05 -0.09 0.00 0.00 0.00 0.00 19.45 19.74 2jj1 n ALA 50 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2jj1 s GLN 51 N -2.48 0.57 -0.44 0.00 -0.21 -0.66 -4.90 119.66 111.55 2jj1 s GLN 51 Ca -0.32 -0.18 -0.14 0.00 0.02 0.00 0.00 55.36 54.75 2jj1 s GLN 51 Cb 0.08 0.25 0.06 0.00 1.00 0.00 0.00 33.01 34.40 2jj1 s GLN 51 CO 0.55 -0.14 0.33 -1.01 -2.12 0.00 0.00 175.29 172.89 2jj1 s HIS 52 N -1.14 3.26 -0.11 0.91 3.76 -1.26 -0.74 115.29 119.96 2jj1 s HIS 52 Ca -0.12 -0.99 0.22 0.00 -0.15 0.00 0.00 55.06 54.02 2jj1 s HIS 52 Cb -0.05 -2.94 0.55 0.00 1.11 0.00 0.00 32.58 31.25 2jj1 s HIS 52 CO 0.03 -0.75 1.67 -0.07 -0.85 0.00 0.00 174.74 174.76 2jj1 h LEU 53 N 8.62 0.00 0.00 0.89 3.38 -1.78 -3.49 115.31 122.94 2jj1 h LEU 53 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2jj1 h LEU 53 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2jj1 h LEU 53 CO 0.80 0.23 0.00 0.61 0.09 0.00 0.00 178.44 180.17 2jj1 n GLY 54 N 0.73 1.50 3.91 0.83 0.00 -1.23 -5.01 105.19 105.91 2jj1 n GLY 54 Ca 0.02 -2.15 -0.25 0.00 0.00 0.00 0.00 46.02 43.64 2jj1 n GLY 54 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jj1 n GLU 55 N -0.05 -3.43 -2.83 1.61 1.02 -1.26 -1.72 120.64 113.97 2jj1 n GLU 55 Ca 0.00 0.43 -0.15 0.00 -0.02 0.00 0.00 57.16 57.43 2jj1 n GLU 55 Cb 0.00 -4.59 -0.01 0.00 -0.02 0.00 0.00 31.44 26.82 2jj1 n GLU 55 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2jj1 n SER 56 N -2.99 -3.22 -4.16 1.62 7.64 -1.26 -4.91 113.62 106.35 2jj1 n SER 56 Ca -0.30 0.01 -0.28 0.00 1.01 0.00 0.00 58.87 59.31 2jj1 n SER 56 Cb 0.68 -2.74 -0.16 0.00 -1.01 0.00 0.00 64.21 60.98 2jj1 n SER 56 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2jj1 s THR 57 N -2.62 1.60 0.07 0.44 2.01 -0.70 -0.36 115.64 116.08 2jj1 s THR 57 Ca 0.16 -0.79 0.09 0.00 0.31 0.00 0.00 61.69 61.46 2jj1 s THR 57 Cb -0.09 -1.38 -0.03 0.00 0.01 0.00 0.00 72.50 71.01 2jj1 s THR 57 CO 0.20 0.46 -0.23 0.68 -0.69 0.00 0.00 174.62 175.03 2jj1 s VAL 58 N 0.13 2.43 -0.13 3.82 -7.23 0.15 -2.06 120.40 117.51 2jj1 s VAL 58 Ca -0.07 -1.43 -0.09 0.00 -1.81 0.00 0.00 61.98 58.57 2jj1 s VAL 58 Cb -0.13 -2.02 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 2jj1 s VAL 58 CO 0.04 0.26 0.18 -0.60 -0.31 0.00 0.00 175.10 174.67 2jj1 s ARG 59 N -1.60 3.77 0.08 4.82 3.52 0.08 -0.51 118.95 129.12 2jj1 s ARG 59 Ca 0.14 -0.08 0.05 0.00 -0.13 0.00 0.00 55.73 55.71 2jj1 s ARG 59 Cb -0.10 -3.28 -0.03 0.00 -1.56 0.00 0.00 34.95 29.98 2jj1 s ARG 59 CO 0.05 0.59 -0.13 0.95 -0.81 0.00 0.00 175.30 175.94 2jj1 s THR 60 N -0.50 1.11 -0.11 4.11 -4.23 0.27 0.52 115.64 116.81 2jj1 s THR 60 Ca 0.14 -1.42 -0.05 0.00 -1.18 0.00 0.00 61.69 59.18 2jj1 s THR 60 Cb -0.12 -1.18 -0.04 0.00 1.34 0.00 0.00 72.50 72.50 2jj1 s THR 60 CO 0.03 -0.31 0.07 0.27 -0.54 0.00 0.00 174.62 174.14 2jj1 s ILE 61 N -1.59 4.91 -0.08 2.99 -4.36 -0.77 -1.60 121.20 120.69 2jj1 s ILE 61 Ca 0.01 -0.02 -0.05 0.00 -0.26 0.00 0.00 60.65 60.33 2jj1 s ILE 61 Cb -0.08 -3.12 -0.04 0.00 1.25 0.00 0.00 42.46 40.47 2jj1 s ILE 61 CO 0.02 0.60 0.13 0.00 0.24 0.00 0.00 174.94 175.93 2jj1 s ALA 62 N -0.83 3.81 -1.75 2.27 0.00 -0.78 -1.00 121.76 123.49 2jj1 s ALA 62 Ca 0.13 -0.70 0.30 0.00 0.00 0.00 0.00 51.96 51.68 2jj1 s ALA 62 Cb -0.12 -1.87 1.42 0.00 0.00 0.00 0.00 23.12 22.56 2jj1 s ALA 62 CO 0.03 0.65 1.97 -1.33 0.00 0.00 0.00 175.76 177.08 2jj1 n MET 63 N 1.70 0.78 -3.34 0.00 0.00 -0.66 -3.80 117.12 111.79 2jj1 n MET 63 Ca -0.17 -0.19 -0.10 0.00 0.00 0.00 0.00 57.70 57.23 2jj1 n MET 63 Cb 0.54 -1.50 -0.02 0.00 0.00 0.00 0.00 33.22 32.25 2jj1 n MET 63 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 2jj1 n ASP 64 N -0.94 -1.12 -4.65 7.83 -0.08 -1.26 -4.22 116.55 112.10 2jj1 n ASP 64 Ca 0.17 -2.39 -0.37 0.00 -1.51 0.00 0.00 54.79 50.68 2jj1 n ASP 64 Cb 0.24 2.05 0.06 0.00 2.34 0.00 0.00 41.12 45.81 2jj1 n ASP 64 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2jj1 n GLY 65 N -0.43 -0.06 0.33 0.27 0.00 -1.26 -4.89 105.19 99.15 2jj1 n GLY 65 Ca -0.01 -0.16 0.05 0.00 0.00 0.00 0.00 46.02 45.91 2jj1 n GLY 65 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jj1 n THR 66 N -1.87 0.00 -1.54 2.61 -2.24 -1.26 -4.99 114.28 104.99 2jj1 n THR 66 Ca 0.15 -0.43 -0.48 0.00 -2.27 0.00 0.00 64.05 61.02 2jj1 n THR 66 Cb 0.48 1.17 -0.03 0.00 -2.10 0.00 0.00 70.33 69.85 2jj1 n THR 66 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2jj1 n GLU 67 N 0.11 0.91 0.00 -0.78 0.00 -1.26 -2.23 120.64 117.39 2jj1 n GLU 67 Ca 0.05 0.32 0.00 0.00 0.00 0.00 0.00 57.16 57.53 2jj1 n GLU 67 Cb 0.25 -1.67 0.00 0.00 0.00 0.00 0.00 31.44 30.02 2jj1 n GLU 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2jj1 n GLY 68 N 1.72 2.10 3.77 -1.84 0.00 -1.26 -5.04 105.19 104.63 2jj1 n GLY 68 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 2jj1 n GLY 68 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jj1 s LEU 69 N 0.00 3.85 -0.03 0.99 1.43 -0.95 -5.04 118.68 118.93 2jj1 s LEU 69 Ca 0.00 2.35 0.02 0.00 -1.03 0.00 0.00 54.13 55.47 2jj1 s LEU 69 Cb 0.00 -4.41 0.00 0.00 0.03 0.00 0.00 46.19 41.81 2jj1 s LEU 69 CO 0.00 -1.23 -0.09 -0.69 0.23 0.00 0.00 176.35 174.57 2jj1 s VAL 70 N -1.58 0.80 0.07 -1.59 1.01 -1.26 -5.10 120.40 112.75 2jj1 s VAL 70 Ca 0.70 -0.37 -0.34 0.00 0.00 0.00 0.00 61.98 61.97 2jj1 s VAL 70 Cb -0.29 -0.72 -0.13 0.00 0.00 0.00 0.00 36.38 35.24 2jj1 s VAL 70 CO 0.34 0.25 1.68 0.54 0.00 0.00 0.00 175.10 177.91 2jj1 n ARG 71 N 3.31 2.11 0.00 2.72 1.74 -1.26 -1.51 116.66 123.76 2jj1 n ARG 71 Ca -0.18 0.77 0.00 0.00 -0.77 0.00 0.00 57.85 57.66 2jj1 n ARG 71 Cb 0.54 -2.56 0.00 0.00 -1.02 0.00 0.00 32.46 29.43 2jj1 n ARG 71 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jj1 n GLY 72 N 3.73 2.35 3.74 -0.13 0.00 0.15 -4.98 105.19 110.06 2jj1 n GLY 72 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 2jj1 n GLY 72 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jj1 s GLN 73 N -0.52 2.89 0.16 1.61 0.74 -0.57 -4.56 119.66 119.41 2jj1 s GLN 73 Ca 0.00 2.07 -0.21 0.00 0.05 0.00 0.00 55.36 57.26 2jj1 s GLN 73 Cb 0.00 -2.03 -0.08 0.00 1.10 0.00 0.00 33.01 32.00 2jj1 s GLN 73 CO 0.00 -1.33 0.69 0.15 -0.55 0.00 0.00 175.29 174.25 2jj1 s LYS 74 N -3.17 4.34 -0.08 1.67 1.02 -1.26 -1.22 119.74 121.03 2jj1 s LYS 74 Ca 0.77 0.92 0.01 0.00 0.02 0.00 0.00 55.97 57.69 2jj1 s LYS 74 Cb -0.37 -3.12 0.02 0.00 -0.52 0.00 0.00 37.83 33.84 2jj1 s LYS 74 CO 0.41 0.53 -0.09 0.08 -0.92 0.00 0.00 175.35 175.36 2jj1 s VAL 75 N -1.27 1.03 0.05 3.17 1.01 0.18 -0.29 120.40 124.28 2jj1 s VAL 75 Ca 0.36 -0.36 -0.05 0.00 0.00 0.00 0.00 61.98 61.93 2jj1 s VAL 75 Cb -0.20 -0.99 -0.05 0.00 0.00 0.00 0.00 36.38 35.14 2jj1 s VAL 75 CO 0.22 0.35 0.28 -0.76 0.00 0.00 0.00 175.10 175.19 2jj1 s LEU 76 N 1.15 4.35 -0.29 3.92 1.43 -0.75 0.22 118.68 128.70 2jj1 s LEU 76 Ca -0.06 0.51 -0.18 0.00 -1.03 0.00 0.00 54.13 53.37 2jj1 s LEU 76 Cb -0.14 -2.87 -0.02 0.00 0.03 0.00 0.00 46.19 43.19 2jj1 s LEU 76 CO -0.02 0.19 0.51 -0.62 0.23 0.00 0.00 176.35 176.64 2jj1 s ASP 77 N -2.01 6.39 0.23 2.29 2.15 -1.18 0.22 116.67 124.75 2jj1 s ASP 77 Ca 0.32 0.36 0.22 0.00 0.43 0.00 0.00 52.55 53.88 2jj1 s ASP 77 Cb -0.13 -2.27 0.94 0.00 -0.30 0.00 0.00 42.92 41.15 2jj1 s ASP 77 CO 0.20 -0.33 1.67 -1.54 -0.17 0.00 0.00 175.17 175.00 2jj1 n SER 78 N 5.59 0.58 0.00 -0.34 3.41 -0.57 -4.71 113.62 117.57 2jj1 n SER 78 Ca -0.04 0.65 0.00 0.00 -0.26 0.00 0.00 58.87 59.21 2jj1 n SER 78 Cb 0.50 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 2jj1 n SER 78 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jj1 n GLY 79 N -0.05 0.43 3.62 5.00 0.00 -1.26 -5.01 105.19 107.91 2jj1 n GLY 79 Ca 0.02 -0.90 -0.02 0.00 0.00 0.00 0.00 46.02 45.12 2jj1 n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jj1 s ALA 80 N -2.00 -2.05 1.20 4.61 0.00 -1.26 -5.05 121.76 117.21 2jj1 s ALA 80 Ca 0.00 0.98 -0.17 0.00 0.00 0.00 0.00 51.96 52.76 2jj1 s ALA 80 Cb 0.00 0.24 0.28 0.00 0.00 0.00 0.00 23.12 23.64 2jj1 s ALA 80 CO 0.00 -0.84 1.06 -2.14 0.00 0.00 0.00 175.76 173.83 2jj1 s PRO 81 N -2.63 -1.20 -0.03 0.00 0.02 -1.26 -0.56 135.00 129.34 2jj1 s PRO 81 Ca 0.11 0.23 -0.33 0.00 0.02 0.00 0.00 61.00 61.03 2jj1 s PRO 81 Cb 0.01 -1.57 -0.11 0.00 0.02 0.00 0.00 34.50 32.85 2jj1 s PRO 81 CO -0.04 -3.76 1.88 -0.89 -0.33 0.00 0.00 177.00 173.86 2jj1 n ILE 82 N -4.85 0.56 -4.57 2.83 5.41 -1.26 -4.51 119.36 112.98 2jj1 n ILE 82 Ca 0.10 -0.10 -0.33 0.00 1.00 0.00 0.00 62.75 63.41 2jj1 n ILE 82 Cb 0.58 -1.96 -0.11 0.00 -0.71 0.00 0.00 39.64 37.44 2jj1 n ILE 82 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 2jj1 s ARG 83 N 3.83 2.69 0.09 0.38 0.52 -1.26 -1.09 118.95 124.11 2jj1 s ARG 83 Ca 0.90 -0.60 0.05 0.00 -0.52 0.00 0.00 55.73 55.56 2jj1 s ARG 83 Cb -0.62 -2.56 -0.03 0.00 0.52 0.00 0.00 34.95 32.25 2jj1 s ARG 83 CO 0.48 0.64 -0.14 0.96 0.02 0.00 0.00 175.30 177.26 2jj1 s ILE 84 N -0.88 1.19 0.19 1.52 -4.36 0.31 -4.75 121.20 114.42 2jj1 s ILE 84 Ca 0.14 -1.46 -0.33 0.00 -0.26 0.00 0.00 60.65 58.75 2jj1 s ILE 84 Cb -0.11 -1.24 -0.12 0.00 1.25 0.00 0.00 42.46 42.23 2jj1 s ILE 84 CO 0.04 -0.30 1.69 -2.65 0.24 0.00 0.00 174.94 173.96 2jj1 n PRO 85 N 1.00 2.61 -4.34 0.37 -0.02 -1.26 -0.62 135.00 132.74 2jj1 n PRO 85 Ca -0.19 0.94 -0.19 0.00 -2.02 0.00 0.00 63.50 62.04 2jj1 n PRO 85 Cb 0.55 -2.77 -0.15 0.00 -0.02 0.00 0.00 33.50 31.11 2jj1 n PRO 85 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2jj1 s VAL 86 N 1.20 0.68 0.00 -1.45 -7.23 -1.20 -4.90 120.40 107.50 2jj1 s VAL 86 Ca 0.77 -0.34 0.00 0.00 -1.81 0.00 0.00 61.98 60.59 2jj1 s VAL 86 Cb -0.55 -0.59 0.00 0.00 0.56 0.00 0.00 36.38 35.80 2jj1 s VAL 86 CO 0.34 0.20 0.00 0.61 -0.31 0.00 0.00 175.10 175.94 2jj1 n GLY 87 N 3.05 2.90 0.19 2.32 0.00 -1.26 -4.59 105.19 107.80 2jj1 n GLY 87 Ca -0.15 -1.58 0.11 0.00 0.00 0.00 0.00 46.02 44.40 2jj1 n GLY 87 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2jj1 n PRO 88 N -1.75 -0.04 0.07 1.61 -0.01 -1.26 -1.14 135.00 132.47 2jj1 n PRO 88 Ca 0.00 0.83 0.06 0.00 -0.01 0.00 0.00 63.50 64.38 2jj1 n PRO 88 Cb 0.00 -1.36 0.29 0.00 -0.01 0.00 0.00 33.50 32.42 2jj1 n PRO 88 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 175.50 175.88 2jj1 n GLU 89 N -4.59 0.07 0.09 -0.52 -0.58 -1.26 -0.65 120.64 113.20 2jj1 n GLU 89 Ca 0.15 0.50 0.12 0.00 -0.42 0.00 0.00 57.16 57.52 2jj1 n GLU 89 Cb 0.51 -1.69 0.24 0.00 -0.57 0.00 0.00 31.44 29.93 2jj1 n GLU 89 CO 0.00 0.00 0.00 1.79 -0.48 0.00 0.00 177.13 178.44 2jj1 h THR 90 N 0.00 0.00 -2.81 2.62 1.35 -1.49 -3.44 112.91 109.14 2jj1 h THR 90 Ca 0.00 -0.56 -0.53 0.00 -0.55 0.00 0.00 66.41 64.77 2jj1 h THR 90 Cb 0.08 1.32 0.03 0.00 -1.73 0.00 0.00 68.15 67.84 2jj1 h THR 90 CO 0.00 0.00 0.90 -0.76 -0.25 0.00 0.00 175.52 175.41 2jj1 s LEU 91 N -4.58 4.36 0.00 3.87 1.43 0.17 -1.40 118.68 122.53 2jj1 s LEU 91 Ca 0.07 2.45 0.00 0.00 -1.03 0.00 0.00 54.13 55.63 2jj1 s LEU 91 Cb 0.12 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.76 2jj1 s LEU 91 CO 0.68 -0.81 0.00 0.61 0.23 0.00 0.00 176.35 177.06 2jj1 n GLY 92 N 3.79 1.23 3.92 -3.19 0.00 0.29 -4.85 105.19 106.38 2jj1 n GLY 92 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 2jj1 n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jj1 s ARG 93 N -0.12 3.58 -0.21 1.61 1.81 -0.49 -4.93 118.95 120.19 2jj1 s ARG 93 Ca 0.00 -0.13 -0.04 0.00 -1.72 0.00 0.00 55.73 53.84 2jj1 s ARG 93 Cb 0.00 -2.69 -0.01 0.00 -0.45 0.00 0.00 34.95 31.80 2jj1 s ARG 93 CO 0.00 0.24 -0.04 0.42 -0.68 0.00 0.00 175.30 175.24 2jj1 s ILE 94 N -2.08 3.49 0.19 1.52 1.01 -1.26 -1.47 121.20 122.59 2jj1 s ILE 94 Ca 0.42 -0.46 0.07 0.00 0.00 0.00 0.00 60.65 60.67 2jj1 s ILE 94 Cb -0.11 -2.58 -0.04 0.00 0.01 0.00 0.00 42.46 39.75 2jj1 s ILE 94 CO 0.31 0.43 0.09 -0.04 0.00 0.00 0.00 174.94 175.73 2jj1 s MET 95 N 1.31 2.68 0.00 2.79 -1.94 0.12 -0.34 119.30 123.93 2jj1 s MET 95 Ca 0.04 -1.03 0.00 0.00 -1.71 0.00 0.00 55.69 52.99 2jj1 s MET 95 Cb -0.14 -2.49 0.00 0.00 2.01 0.00 0.00 34.83 34.20 2jj1 s MET 95 CO -0.01 0.45 0.00 0.27 -0.01 0.00 0.00 175.02 175.72 2jj1 n ASN 96 N -0.45 0.50 -0.14 3.03 0.23 -0.89 0.11 115.26 117.64 2jj1 n ASN 96 Ca -0.09 -0.45 0.11 0.00 -0.53 0.00 0.00 54.58 53.62 2jj1 n ASN 96 Cb 0.56 0.00 0.45 0.00 -2.08 0.00 0.00 39.78 38.71 2jj1 n ASN 96 CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 2jj1 h VAL 97 N 0.11 0.91 -0.28 3.53 2.07 -1.90 -2.69 116.25 118.00 2jj1 h VAL 97 Ca 0.00 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 2jj1 h VAL 97 Cb 0.00 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 30.10 2jj1 h VAL 97 CO 0.00 0.10 0.00 2.30 0.02 0.00 0.00 177.57 179.99 2jj1 n ILE 98 N -4.48 2.33 -0.87 4.57 -5.35 -1.26 -4.73 119.36 109.56 2jj1 n ILE 98 Ca 0.11 -1.89 0.00 0.00 -0.27 0.00 0.00 62.75 60.70 2jj1 n ILE 98 Cb 0.37 -0.26 0.00 0.00 -1.74 0.00 0.00 39.64 38.00 2jj1 n ILE 98 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2jj1 n GLY 99 N -0.49 0.62 3.76 3.28 0.00 -1.01 -4.79 105.19 106.56 2jj1 n GLY 99 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 2jj1 n GLY 99 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jj1 s GLU 100 N -0.38 4.39 0.35 1.61 2.02 -1.26 -4.67 118.70 120.76 2jj1 s GLU 100 Ca 0.00 2.16 -0.28 0.00 0.02 0.00 0.00 54.97 56.87 2jj1 s GLU 100 Cb 0.00 -3.10 -0.10 0.00 0.10 0.00 0.00 34.13 31.03 2jj1 s GLU 100 CO 0.00 -0.16 1.32 -1.25 0.02 0.00 0.00 175.26 175.20 2jj1 s PRO 101 N -1.54 4.24 -0.09 0.39 0.04 -1.26 -2.09 135.00 134.69 2jj1 s PRO 101 Ca 0.50 2.24 0.13 0.00 0.04 0.00 0.00 61.00 63.90 2jj1 s PRO 101 Cb -0.39 -2.99 0.19 0.00 0.04 0.00 0.00 34.50 31.36 2jj1 s PRO 101 CO 0.50 -0.29 1.10 0.44 0.04 0.00 0.00 177.00 178.79 2jj1 n ILE 102 N 0.61 1.24 0.14 0.56 -5.35 0.53 -4.72 119.36 112.37 2jj1 n ILE 102 Ca 0.01 -1.51 0.10 0.00 -0.27 0.00 0.00 62.75 61.08 2jj1 n ILE 102 Cb 0.42 0.02 0.19 0.00 -1.74 0.00 0.00 39.64 38.52 2jj1 n ILE 102 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2jj1 n ASP 103 N -0.94 3.18 -3.16 7.28 5.68 -1.25 -4.97 116.55 122.36 2jj1 n ASP 103 Ca 0.11 -1.92 -0.23 0.00 -0.50 0.00 0.00 54.79 52.25 2jj1 n ASP 103 Cb 0.66 -0.24 0.03 0.00 -1.14 0.00 0.00 41.12 40.43 2jj1 n ASP 103 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2jj1 n GLU 104 N 1.17 -4.73 -0.49 0.11 1.02 -1.26 -4.90 120.64 111.56 2jj1 n GLU 104 Ca 0.16 0.79 0.05 0.00 -0.02 0.00 0.00 57.16 58.14 2jj1 n GLU 104 Cb 0.52 -5.63 0.22 0.00 -0.02 0.00 0.00 31.44 26.53 2jj1 n GLU 104 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2jj1 n ARG 105 N -4.04 2.30 0.00 3.49 1.74 -1.26 -5.11 116.66 113.79 2jj1 n ARG 105 Ca -0.08 -2.91 0.00 0.00 -0.77 0.00 0.00 57.85 54.09 2jj1 n ARG 105 Cb 0.60 -1.78 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 2jj1 n ARG 105 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jj1 n GLY 106 N -0.86 -2.15 3.37 -0.13 0.00 -1.26 -4.98 105.19 99.18 2jj1 n GLY 106 Ca 0.24 -1.54 -0.33 0.00 0.00 0.00 0.00 46.02 44.39 2jj1 n GLY 106 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2jj1 n PRO 107 N -0.17 -0.84 -3.82 1.61 -0.02 -1.26 -4.80 135.00 125.71 2jj1 n PRO 107 Ca 0.00 -0.21 -0.35 0.00 -2.02 0.00 0.00 63.50 60.92 2jj1 n PRO 107 Cb 0.00 -1.81 -0.12 0.00 -0.02 0.00 0.00 33.50 31.55 2jj1 n PRO 107 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2jj1 s ILE 108 N -2.34 3.17 -1.38 4.25 1.01 -1.26 -5.03 121.20 119.61 2jj1 s ILE 108 Ca 0.57 -2.44 -0.15 0.00 0.00 0.00 0.00 60.65 58.64 2jj1 s ILE 108 Cb -0.18 -3.17 0.07 0.00 0.01 0.00 0.00 42.46 39.19 2jj1 s ILE 108 CO 0.67 -0.73 2.02 0.29 0.00 0.00 0.00 174.94 177.18 2jj1 n LYS 109 N 4.14 3.05 -3.95 2.79 5.02 -1.26 -4.97 118.16 122.97 2jj1 n LYS 109 Ca 0.02 -2.94 -0.29 0.00 -2.02 0.00 0.00 58.31 53.07 2jj1 n LYS 109 Cb 0.40 -3.31 -0.04 0.00 -0.02 0.00 0.00 35.03 32.06 2jj1 n LYS 109 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2jj1 s THR 110 N 3.17 5.20 0.22 -0.18 -4.23 -1.26 -4.89 115.64 113.67 2jj1 s THR 110 Ca 0.48 -0.56 0.11 0.00 -1.18 0.00 0.00 61.69 60.55 2jj1 s THR 110 Cb 0.10 -3.58 -0.04 0.00 1.34 0.00 0.00 72.50 70.32 2jj1 s THR 110 CO -0.03 0.07 1.56 0.11 -0.54 0.00 0.00 174.62 175.79 2jj1 h LYS 111 N 2.83 0.00 -3.68 3.99 6.56 -1.93 -3.46 116.57 120.89 2jj1 h LYS 111 Ca -0.46 0.00 -0.13 0.00 -1.06 0.00 0.00 60.65 59.00 2jj1 h LYS 111 Cb 1.17 0.00 -0.18 0.00 -0.57 0.00 0.00 32.23 32.65 2jj1 h LYS 111 CO 0.72 0.65 -0.48 1.14 -2.06 0.00 0.00 179.45 179.42 2jj1 s GLN 112 N -3.42 0.60 0.22 3.15 0.00 -1.26 -5.16 119.66 113.79 2jj1 s GLN 112 Ca -0.01 -0.65 0.01 0.00 -0.00 0.00 0.00 55.36 54.72 2jj1 s GLN 112 Cb 0.12 0.24 0.01 0.00 0.00 0.00 0.00 33.01 33.38 2jj1 s GLN 112 CO 0.76 -0.16 0.10 1.19 0.00 0.00 0.00 175.29 177.19 2jj1 n PHE 113 N 0.88 -0.44 -3.60 9.60 3.01 -1.26 -3.22 117.46 122.42 2jj1 n PHE 113 Ca -0.20 -1.01 -0.14 0.00 1.01 0.00 0.00 57.45 57.11 2jj1 n PHE 113 Cb 0.58 -0.17 -0.07 0.00 -0.01 0.00 0.00 39.48 39.81 2jj1 n PHE 113 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2jj1 s ALA 114 N -2.35 -1.82 0.39 4.37 0.00 0.21 -4.79 121.76 117.78 2jj1 s ALA 114 Ca 0.08 1.83 -0.26 0.00 0.00 0.00 0.00 51.96 53.60 2jj1 s ALA 114 Cb -0.01 -0.94 -0.09 0.00 0.00 0.00 0.00 23.12 22.08 2jj1 s ALA 114 CO 0.05 -0.33 1.27 0.00 0.00 0.00 0.00 175.76 176.75 2jj1 s ALA 115 N -0.06 3.27 -1.07 0.00 0.00 -1.26 -0.53 121.76 122.11 2jj1 s ALA 115 Ca -0.02 1.17 0.28 0.00 0.00 0.00 0.00 51.96 53.39 2jj1 s ALA 115 Cb -0.04 -3.46 1.03 0.00 0.00 0.00 0.00 23.12 20.65 2jj1 s ALA 115 CO 0.02 -0.73 1.77 0.44 0.00 0.00 0.00 175.76 177.27 2jj1 n ILE 116 N 0.23 0.00 -3.69 0.00 -5.35 -0.25 -4.68 119.36 105.62 2jj1 n ILE 116 Ca 0.03 -0.01 -0.37 0.00 -0.27 0.00 0.00 62.75 62.14 2jj1 n ILE 116 Cb 0.44 -0.24 -0.12 0.00 -1.74 0.00 0.00 39.64 37.98 2jj1 n ILE 116 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 2jj1 s HIS 117 N -2.94 3.14 -0.01 4.28 3.76 -1.26 -4.77 115.29 117.49 2jj1 s HIS 117 Ca 0.15 -0.22 -0.18 0.00 -0.15 0.00 0.00 55.06 54.66 2jj1 s HIS 117 Cb 0.19 -2.29 0.03 0.00 1.11 0.00 0.00 32.58 31.62 2jj1 s HIS 117 CO 0.57 -0.28 0.39 0.00 -0.85 0.00 0.00 174.74 174.57 2jj1 s ALA 118 N 1.66 -0.99 0.48 -1.40 0.00 -1.26 -5.09 121.76 115.16 2jj1 s ALA 118 Ca 0.07 0.48 -0.23 0.00 0.00 0.00 0.00 51.96 52.28 2jj1 s ALA 118 Cb -0.15 0.12 -0.07 0.00 0.00 0.00 0.00 23.12 23.02 2jj1 s ALA 118 CO 0.06 -0.32 1.28 -1.21 0.00 0.00 0.00 175.76 175.57 2jj1 s GLU 119 N -1.56 3.54 0.58 0.00 0.41 -1.26 -4.99 118.70 115.42 2jj1 s GLU 119 Ca -0.11 2.06 -0.18 0.00 -0.41 0.00 0.00 54.97 56.33 2jj1 s GLU 119 Cb -0.03 -2.42 -0.04 0.00 -1.78 0.00 0.00 34.13 29.85 2jj1 s GLU 119 CO 0.04 -0.81 1.11 0.00 -0.49 0.00 0.00 175.26 175.10 2jj1 s ALA 120 N -1.38 2.64 0.28 5.21 0.00 -1.26 -4.95 121.76 122.31 2jj1 s ALA 120 Ca 0.65 0.67 -0.28 0.00 0.00 0.00 0.00 51.96 53.00 2jj1 s ALA 120 Cb -0.36 -3.32 -0.14 0.00 0.00 0.00 0.00 23.12 19.30 2jj1 s ALA 120 CO 0.44 -0.90 1.02 -2.30 0.00 0.00 0.00 175.76 174.01 2jj1 n PRO 121 N -1.72 1.35 -1.49 0.00 -0.02 -1.26 -4.98 135.00 126.88 2jj1 n PRO 121 Ca 0.11 0.47 -0.30 0.00 -2.02 0.00 0.00 63.50 61.76 2jj1 n PRO 121 Cb 0.52 -1.85 0.08 0.00 -0.02 0.00 0.00 33.50 32.22 2jj1 n PRO 121 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2jj1 s GLU 122 N -1.49 2.33 0.37 -0.52 0.41 -1.26 -4.92 118.70 113.63 2jj1 s GLU 122 Ca 0.59 0.84 0.11 0.00 -0.41 0.00 0.00 54.97 56.10 2jj1 s GLU 122 Cb -0.71 -1.93 0.89 0.00 -1.78 0.00 0.00 34.13 30.60 2jj1 s GLU 122 CO 0.59 -1.50 1.85 0.35 -0.49 0.00 0.00 175.26 176.07 2jj1 h PHE 123 N -1.00 0.77 0.00 1.61 3.57 -2.00 0.26 116.94 120.14 2jj1 h PHE 123 Ca -0.46 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.07 2jj1 h PHE 123 Cb 1.24 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.75 2jj1 h PHE 123 CO 0.53 0.24 0.00 1.33 -2.23 0.00 0.00 178.31 178.18 2jj1 n VAL 124 N -4.58 0.93 1.24 1.41 0.24 -1.26 -2.18 118.33 114.14 2jj1 n VAL 124 Ca 0.19 0.23 0.13 0.00 -2.04 0.00 0.00 64.34 62.85 2jj1 n VAL 124 Cb 0.56 -0.99 0.34 0.00 -1.47 0.00 0.00 33.84 32.27 2jj1 n VAL 124 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2jj1 n GLU 125 N -1.45 1.12 -1.56 7.34 1.02 0.08 -4.94 120.64 122.24 2jj1 n GLU 125 Ca 0.04 -0.72 -0.32 0.00 -0.02 0.00 0.00 57.16 56.14 2jj1 n GLU 125 Cb 0.15 -1.49 0.06 0.00 -0.02 0.00 0.00 31.44 30.15 2jj1 n GLU 125 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2jj1 s MET 126 N -2.38 2.74 -0.03 3.49 -1.94 -0.93 -0.92 119.30 119.33 2jj1 s MET 126 Ca 0.26 1.13 0.04 0.00 -1.71 0.00 0.00 55.69 55.41 2jj1 s MET 126 Cb 0.19 -1.96 -0.00 0.00 2.01 0.00 0.00 34.83 35.07 2jj1 s MET 126 CO 0.48 -1.26 -0.16 0.45 -0.01 0.00 0.00 175.02 174.53 2jj1 s SER 127 N -3.33 1.94 0.00 3.03 0.15 -1.26 -4.61 113.70 109.62 2jj1 s SER 127 Ca 0.61 -0.31 0.25 0.00 0.70 0.00 0.00 55.95 57.20 2jj1 s SER 127 Cb -0.16 -0.47 0.38 0.00 -1.71 0.00 0.00 66.02 64.06 2jj1 s SER 127 CO 0.51 0.15 1.36 1.33 1.20 0.00 0.00 173.24 177.79 2jj1 n VAL 128 N 3.08 0.00 -1.84 4.45 0.24 -1.26 -4.96 118.33 118.05 2jj1 n VAL 128 Ca -0.17 -0.41 -0.42 0.00 -2.04 0.00 0.00 64.34 61.30 2jj1 n VAL 128 Cb 0.53 1.23 -0.02 0.00 -1.47 0.00 0.00 33.84 34.11 2jj1 n VAL 128 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2jj1 s GLU 129 N -2.05 4.16 -0.25 7.34 0.41 -1.26 -5.01 118.70 122.05 2jj1 s GLU 129 Ca 0.29 2.50 -0.07 0.00 -0.41 0.00 0.00 54.97 57.28 2jj1 s GLU 129 Cb 0.20 -3.06 0.12 0.00 -1.78 0.00 0.00 34.13 29.61 2jj1 s GLU 129 CO 0.34 -0.59 0.52 1.14 -0.49 0.00 0.00 175.26 176.17 2jj1 s GLN 130 N -0.24 0.44 0.03 1.61 -2.07 -1.26 -4.97 119.66 113.20 2jj1 s GLN 130 Ca 0.64 1.17 -0.04 0.00 -1.82 0.00 0.00 55.36 55.31 2jj1 s GLN 130 Cb -0.46 0.51 -0.02 0.00 -1.09 0.00 0.00 33.01 31.95 2jj1 s GLN 130 CO 0.45 -0.28 0.05 -1.83 -1.32 0.00 0.00 175.29 172.35 2jj1 s GLU 131 N 2.74 0.52 0.30 9.60 -1.05 -1.26 -4.99 118.70 124.55 2jj1 s GLU 131 Ca -0.01 -0.76 -0.29 0.00 -0.15 0.00 0.00 54.97 53.75 2jj1 s GLU 131 Cb -0.12 0.20 -0.11 0.00 -0.44 0.00 0.00 34.13 33.65 2jj1 s GLU 131 CO -0.16 -0.12 1.50 -1.50 0.95 0.00 0.00 175.26 175.94 2jj1 s ILE 132 N -2.44 2.30 -0.44 1.83 2.07 -1.26 -0.18 121.20 123.08 2jj1 s ILE 132 Ca -0.07 0.26 -0.11 0.00 -1.41 0.00 0.00 60.65 59.33 2jj1 s ILE 132 Cb -0.02 -3.17 0.08 0.00 0.13 0.00 0.00 42.46 39.48 2jj1 s ILE 132 CO -0.04 0.05 0.30 -0.22 -1.91 0.00 0.00 174.94 173.12 2jj1 s LEU 133 N -0.88 5.33 0.07 8.50 2.96 0.19 -4.53 118.68 130.32 2jj1 s LEU 133 Ca 0.59 -1.50 -0.28 0.00 -0.22 0.00 0.00 54.13 52.72 2jj1 s LEU 133 Cb -0.45 -2.04 -0.05 0.00 0.50 0.00 0.00 46.19 44.15 2jj1 s LEU 133 CO 0.50 -0.58 0.87 -0.69 -1.32 0.00 0.00 176.35 175.12 2jj1 s VAL 134 N 1.47 4.64 -0.04 1.68 1.01 -1.26 -3.96 120.40 123.94 2jj1 s VAL 134 Ca 0.03 1.86 0.14 0.00 0.00 0.00 0.00 61.98 64.01 2jj1 s VAL 134 Cb -0.24 -4.22 -0.21 0.00 0.00 0.00 0.00 36.38 31.71 2jj1 s VAL 134 CO 0.03 0.33 0.27 0.35 0.00 0.00 0.00 175.10 176.08 2jj1 n THR 135 N 2.87 0.13 -0.90 3.92 -2.24 -1.26 -4.98 114.28 111.82 2jj1 n THR 135 Ca 0.00 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 2jj1 n THR 135 Cb 0.50 0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 2jj1 n THR 135 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jj1 n GLY 136 N 1.76 0.54 3.27 3.38 0.00 -1.26 -4.86 105.19 108.02 2jj1 n GLY 136 Ca -0.05 -0.10 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 2jj1 n GLY 136 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jj1 s ILE 137 N -2.00 3.36 0.10 -0.61 1.01 -1.26 -1.28 121.20 120.52 2jj1 s ILE 137 Ca 0.00 -0.81 -0.30 0.00 0.00 0.00 0.00 60.65 59.54 2jj1 s ILE 137 Cb 0.00 -2.68 -0.11 0.00 0.01 0.00 0.00 42.46 39.67 2jj1 s ILE 137 CO 0.00 0.20 1.61 0.11 0.00 0.00 0.00 174.94 176.85 2jj1 h LYS 138 N 8.11 -0.64 -0.34 2.79 1.57 -1.86 -1.67 116.57 124.54 2jj1 h LYS 138 Ca -0.34 0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.47 2jj1 h LYS 138 Cb 1.12 0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.56 2jj1 h LYS 138 CO 0.59 -0.42 0.15 -0.24 -0.57 0.00 0.00 179.45 178.96 2jj1 h VAL 139 N -0.66 1.12 0.10 0.50 3.04 -1.90 -0.06 116.25 118.39 2jj1 h VAL 139 Ca 0.00 -0.37 -0.00 0.00 -1.01 0.00 0.00 66.70 65.32 2jj1 h VAL 139 Cb 0.64 0.71 0.00 0.00 -2.01 0.00 0.00 31.29 30.63 2jj1 h VAL 139 CO -0.14 0.14 -0.05 0.58 -1.01 0.00 0.00 177.57 177.10 2jj1 h VAL 140 N 0.47 0.84 -0.85 1.51 2.07 -1.80 -2.43 116.25 116.06 2jj1 h VAL 140 Ca 0.12 -1.35 0.06 0.00 0.82 0.00 0.00 66.70 66.35 2jj1 h VAL 140 Cb 0.07 1.49 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 2jj1 h VAL 140 CO -0.02 0.25 0.56 0.44 0.02 0.00 0.00 177.57 178.82 2jj1 h ASP 141 N -0.93 0.85 0.06 0.57 3.32 -1.12 -1.08 116.42 118.09 2jj1 h ASP 141 Ca -0.01 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 2jj1 h ASP 141 Cb 0.51 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2jj1 h ASP 141 CO 0.02 0.55 -0.03 0.25 -1.72 0.00 0.00 179.24 178.32 2jj1 h LEU 142 N 0.97 -0.06 0.00 1.55 5.85 -1.09 -3.37 115.31 119.15 2jj1 h LEU 142 Ca 0.36 -0.54 -0.33 0.00 0.84 0.00 0.00 57.88 58.21 2jj1 h LEU 142 Cb 0.18 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.17 2jj1 h LEU 142 CO -0.13 0.65 -2.25 0.18 -0.34 0.00 0.00 178.44 176.55 2jj1 n LEU 143 N -4.77 0.14 -2.96 2.25 4.77 -0.91 -4.60 117.00 110.92 2jj1 n LEU 143 Ca -0.07 0.07 -0.15 0.00 -0.03 0.00 0.00 56.01 55.83 2jj1 n LEU 143 Cb 0.29 0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 2jj1 n LEU 143 CO 0.24 0.45 -0.01 0.00 -1.33 0.00 0.00 177.39 176.74 2jj1 n ALA 144 N -2.69 0.48 -1.77 -1.18 0.00 -0.58 -4.62 120.51 110.15 2jj1 n ALA 144 Ca -0.29 -2.38 -0.38 0.00 0.00 0.00 0.00 53.44 50.40 2jj1 n ALA 144 Cb 1.10 -1.07 -0.04 0.00 0.00 0.00 0.00 19.45 19.44 2jj1 n ALA 144 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2jj1 s PRO 145 N -0.46 4.30 0.56 0.00 0.04 -0.51 -4.68 135.00 134.24 2jj1 s PRO 145 Ca 0.33 1.63 -0.16 0.00 0.04 0.00 0.00 61.00 62.83 2jj1 s PRO 145 Cb 0.24 -2.75 -0.05 0.00 0.04 0.00 0.00 34.50 31.97 2jj1 s PRO 145 CO -0.15 -0.05 1.03 0.71 0.04 0.00 0.00 177.00 178.59 2jj1 s TYR 146 N -1.48 3.13 0.13 0.56 4.12 -1.25 -4.74 117.35 117.81 2jj1 s TYR 146 Ca 0.54 1.50 0.06 0.00 0.02 0.00 0.00 57.07 59.19 2jj1 s TYR 146 Cb -0.26 -2.95 -0.04 0.00 -1.52 0.00 0.00 41.96 37.20 2jj1 s TYR 146 CO 0.33 -0.85 0.02 0.00 0.02 0.00 0.00 175.55 175.06 2jj1 s ALA 147 N -2.46 3.30 0.10 3.71 0.00 -1.26 0.57 121.76 125.72 2jj1 s ALA 147 Ca 0.62 -1.20 -0.31 0.00 0.00 0.00 0.00 51.96 51.07 2jj1 s ALA 147 Cb -0.14 -1.16 -0.07 0.00 0.00 0.00 0.00 23.12 21.75 2jj1 s ALA 147 CO 0.33 0.61 1.35 0.15 0.00 0.00 0.00 175.76 178.20 2jj1 s LYS 148 N -2.60 4.35 -0.48 0.00 1.02 0.74 -2.29 119.74 120.48 2jj1 s LYS 148 Ca 0.27 2.01 0.00 0.00 0.02 0.00 0.00 55.97 58.27 2jj1 s LYS 148 Cb -0.11 -3.27 0.00 0.00 -0.52 0.00 0.00 37.83 33.93 2jj1 s LYS 148 CO 0.19 -0.40 0.00 0.41 -0.92 0.00 0.00 175.35 174.63 2jj1 n GLY 149 N 3.43 0.71 3.97 -3.33 0.00 -1.26 -4.56 105.19 104.15 2jj1 n GLY 149 Ca 0.11 -0.46 -0.21 0.00 0.00 0.00 0.00 46.02 45.46 2jj1 n GLY 149 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jj1 s GLY 150 N -2.58 1.78 -0.54 -0.02 0.00 -0.97 -4.22 107.32 100.77 2jj1 s GLY 150 Ca 0.00 -1.30 -0.14 0.00 0.00 0.00 0.00 44.72 43.28 2jj1 s GLY 150 CO 0.00 -1.05 0.48 0.54 0.00 0.00 0.00 173.10 173.06 2jj1 s LYS 151 N -4.67 2.89 0.04 2.90 1.02 -1.26 -1.15 119.74 119.51 2jj1 s LYS 151 Ca 0.55 -1.77 -0.15 0.00 0.02 0.00 0.00 55.97 54.62 2jj1 s LYS 151 Cb -0.10 -4.21 -0.06 0.00 -0.52 0.00 0.00 37.83 32.94 2jj1 s LYS 151 CO 0.38 -1.29 0.45 0.42 -0.92 0.00 0.00 175.35 174.38 2jj1 s ILE 152 N 1.46 4.96 -0.05 2.17 1.09 0.27 0.04 121.20 131.13 2jj1 s ILE 152 Ca 0.05 0.86 0.05 0.00 -1.10 0.00 0.00 60.65 60.50 2jj1 s ILE 152 Cb -0.28 -3.74 -0.01 0.00 -1.06 0.00 0.00 42.46 37.37 2jj1 s ILE 152 CO 0.01 0.50 -0.22 -0.83 -0.10 0.00 0.00 174.94 174.31 2jj1 s GLY 153 N -1.25 1.13 -0.70 6.18 0.00 -0.24 -1.56 107.32 110.89 2jj1 s GLY 153 Ca 0.27 -0.89 -0.08 0.00 0.00 0.00 0.00 44.72 44.03 2jj1 s GLY 153 CO 0.16 -0.50 0.57 1.08 0.00 0.00 0.00 173.10 174.40 2jj1 s LEU 154 N -0.05 5.90 -0.02 0.66 1.43 0.66 -0.87 118.68 126.40 2jj1 s LEU 154 Ca -0.04 -2.73 -0.30 0.00 -1.03 0.00 0.00 54.13 50.03 2jj1 s LEU 154 Cb -0.13 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 2jj1 s LEU 154 CO 0.03 -0.48 1.04 -0.36 0.23 0.00 0.00 176.35 176.82 2jj1 s PHE 155 N 0.12 3.55 -0.23 0.29 0.40 0.31 -0.84 117.98 121.58 2jj1 s PHE 155 Ca 0.17 1.57 -0.26 0.00 -0.60 0.00 0.00 56.93 57.80 2jj1 s PHE 155 Cb -0.17 -3.21 0.08 0.00 0.51 0.00 0.00 43.02 40.23 2jj1 s PHE 155 CO -0.05 -0.39 0.77 0.20 0.70 0.00 0.00 175.22 176.44 2jj1 s GLY 156 N 1.08 -0.48 0.98 4.36 0.00 -0.35 0.07 107.32 112.97 2jj1 s GLY 156 Ca 0.53 2.01 -0.16 0.00 0.00 0.00 0.00 44.72 47.09 2jj1 s GLY 156 CO 0.25 1.61 0.94 0.61 0.00 0.00 0.00 173.10 176.52 2jj1 n GLY 157 N 2.27 -2.46 3.62 0.20 0.00 -1.26 -2.14 105.19 105.42 2jj1 n GLY 157 Ca -0.14 -1.53 -0.43 0.00 0.00 0.00 0.00 46.02 43.92 2jj1 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jj1 s ALA 158 N -3.21 3.11 -0.42 4.61 0.00 -1.26 -3.27 121.76 121.32 2jj1 s ALA 158 Ca 0.59 0.66 -0.01 0.00 0.00 0.00 0.00 51.96 53.20 2jj1 s ALA 158 Cb -0.05 -3.94 0.00 0.00 0.00 0.00 0.00 23.12 19.14 2jj1 s ALA 158 CO 0.45 -2.22 0.14 0.41 0.00 0.00 0.00 175.76 174.54 2jj1 n GLY 159 N 5.06 0.33 0.01 0.00 0.00 -1.26 -4.96 105.19 104.36 2jj1 n GLY 159 Ca 0.23 -0.56 0.11 0.00 0.00 0.00 0.00 46.02 45.80 2jj1 n GLY 159 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2jj1 n VAL 160 N -3.63 0.00 0.00 1.61 0.24 -1.20 -5.00 118.33 110.35 2jj1 n VAL 160 Ca -0.04 -0.42 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 2jj1 n VAL 160 Cb 0.53 0.16 0.00 0.00 -1.47 0.00 0.00 33.84 33.06 2jj1 n VAL 160 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2jj1 n GLY 161 N 1.30 1.00 0.19 7.63 0.00 -1.26 -4.51 105.19 109.53 2jj1 n GLY 161 Ca -0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 2jj1 n GLY 161 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jj1 h LYS 162 N 0.00 -0.37 0.04 1.61 1.57 -1.92 -1.79 116.57 115.70 2jj1 h LYS 162 Ca 0.00 0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.82 2jj1 h LYS 162 Cb 0.00 0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 2jj1 h LYS 162 CO 0.00 -0.04 -0.15 1.15 -0.57 0.00 0.00 179.45 179.84 2jj1 h THR 163 N -0.75 0.63 -0.57 -0.16 2.02 -1.97 0.99 112.91 113.11 2jj1 h THR 163 Ca -0.04 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.23 2jj1 h THR 163 Cb 0.50 0.63 -0.07 0.00 -1.74 0.00 0.00 68.15 67.47 2jj1 h THR 163 CO 0.06 0.00 0.20 0.58 0.37 0.00 0.00 175.52 176.73 2jj1 h VAL 164 N -0.27 0.78 -0.75 3.16 2.07 -1.99 0.23 116.25 119.48 2jj1 h VAL 164 Ca 0.04 -0.13 0.05 0.00 0.82 0.00 0.00 66.70 67.48 2jj1 h VAL 164 Cb 0.32 0.37 -0.05 0.00 -1.52 0.00 0.00 31.29 30.41 2jj1 h VAL 164 CO -0.12 0.07 0.46 0.25 0.02 0.00 0.00 177.57 178.24 2jj1 h LEU 165 N 0.37 0.73 -0.56 2.57 5.85 -0.89 -1.81 115.31 121.58 2jj1 h LEU 165 Ca 0.28 0.01 -0.16 0.00 0.84 0.00 0.00 57.88 58.86 2jj1 h LEU 165 Cb 0.34 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 2jj1 h LEU 165 CO -0.29 0.48 -0.69 -0.29 -0.34 0.00 0.00 178.44 177.31 2jj1 h ILE 166 N 0.87 1.44 -0.31 4.05 2.10 0.84 -0.65 117.51 125.83 2jj1 h ILE 166 Ca 0.32 -2.22 -0.07 0.00 1.08 0.00 0.00 64.86 63.97 2jj1 h ILE 166 Cb 0.10 2.18 -0.02 0.00 -1.09 0.00 0.00 36.82 37.99 2jj1 h ILE 166 CO -0.15 0.65 -0.10 0.24 -1.08 0.00 0.00 178.15 177.71 2jj1 h MET 167 N 0.12 0.53 -0.16 2.19 2.86 -0.46 0.13 114.93 120.14 2jj1 h MET 167 Ca -0.02 -0.15 -0.11 0.00 -2.06 0.00 0.00 59.70 57.36 2jj1 h MET 167 Cb 1.23 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.83 2jj1 h MET 167 CO 0.10 0.63 -0.34 1.49 1.06 0.00 0.00 176.91 179.86 2jj1 h GLU 168 N 0.49 0.51 -0.22 1.72 4.57 -0.94 0.94 114.58 121.64 2jj1 h GLU 168 Ca 0.09 -0.33 -0.02 0.00 -1.18 0.00 0.00 59.36 57.92 2jj1 h GLU 168 Cb 0.48 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.10 2jj1 h GLU 168 CO 0.03 0.94 0.04 -0.07 -1.18 0.00 0.00 179.01 178.77 2jj1 h LEU 169 N 0.14 0.29 -0.32 1.64 3.38 -0.93 0.74 115.31 120.24 2jj1 h LEU 169 Ca 0.00 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 2jj1 h LEU 169 Cb 0.94 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 2jj1 h LEU 169 CO 0.07 0.31 -0.07 0.40 0.09 0.00 0.00 178.44 179.24 2jj1 h ILE 170 N 0.32 1.28 0.70 1.22 2.04 -0.59 -1.81 117.51 120.67 2jj1 h ILE 170 Ca 0.08 -1.11 -0.03 0.00 1.00 0.00 0.00 64.86 64.80 2jj1 h ILE 170 Cb 0.15 1.34 0.01 0.00 -0.74 0.00 0.00 36.82 37.58 2jj1 h ILE 170 CO -0.00 0.36 -0.34 -1.13 0.00 0.00 0.00 178.15 177.04 2jj1 h ASN 171 N 0.39 -0.79 0.72 1.72 -1.24 0.10 -1.16 115.58 115.31 2jj1 h ASN 171 Ca 0.08 -0.00 -0.07 0.00 0.71 0.00 0.00 56.30 57.02 2jj1 h ASN 171 Cb 0.56 0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.80 2jj1 h ASN 171 CO 0.03 -0.48 -0.34 0.78 -1.29 0.00 0.00 177.43 176.13 2jj1 h ASN 172 N -1.09 0.00 0.00 1.15 2.35 0.35 -3.37 115.58 114.97 2jj1 h ASN 172 Ca -0.10 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.55 2jj1 h ASN 172 Cb 0.75 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.10 2jj1 h ASN 172 CO 0.16 0.34 -1.38 0.52 -1.65 0.00 0.00 177.43 175.41 2jj1 n VAL 173 N -3.61 0.38 0.02 2.81 0.31 -0.68 -4.72 118.33 112.84 2jj1 n VAL 173 Ca -0.01 -0.21 -0.06 0.00 -0.01 0.00 0.00 64.34 64.06 2jj1 n VAL 173 Cb 0.46 -0.83 -0.11 0.00 -0.91 0.00 0.00 33.84 32.45 2jj1 n VAL 173 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jj1 h ALA 174 N 0.20 0.64 0.12 3.52 0.00 -1.26 -3.31 119.26 119.17 2jj1 h ALA 174 Ca -0.15 -1.13 -0.01 0.00 0.00 0.00 0.00 54.91 53.63 2jj1 h ALA 174 Cb 1.31 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2jj1 h ALA 174 CO -0.00 1.30 -0.06 0.87 0.00 0.00 0.00 179.25 181.36 2jj1 h LYS 175 N 0.00 -0.15 -1.02 0.00 1.57 -1.71 -3.11 116.57 112.14 2jj1 h LYS 175 Ca -0.17 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 2jj1 h LYS 175 Cb 1.82 0.03 0.00 0.00 0.08 0.00 0.00 32.23 34.16 2jj1 h LYS 175 CO 0.08 0.08 0.00 0.00 -0.57 0.00 0.00 179.45 179.04 2jj1 n ALA 176 N -2.27 2.41 -2.77 3.86 0.00 -1.25 -4.83 120.51 115.66 2jj1 n ALA 176 Ca -0.08 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.01 2jj1 n ALA 176 Cb 0.17 -1.00 -0.10 0.00 0.00 0.00 0.00 19.45 18.52 2jj1 n ALA 176 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2jj1 s HIS 177 N -0.29 3.17 -0.14 0.00 5.04 -1.18 -5.02 115.29 116.88 2jj1 s HIS 177 Ca 0.00 0.09 0.16 0.00 -1.54 0.00 0.00 55.06 53.77 2jj1 s HIS 177 Cb 0.00 -1.89 -0.05 0.00 0.04 0.00 0.00 32.58 30.69 2jj1 s HIS 177 CO 0.00 0.32 1.11 0.78 -2.34 0.00 0.00 174.74 174.61 2jj1 h GLY 178 N 5.75 0.00 0.00 1.59 0.00 -1.89 -3.47 103.07 105.04 2jj1 h GLY 178 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2jj1 h GLY 178 CO 0.59 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.74 2jj1 n GLY 179 N 1.31 1.09 3.35 4.60 0.00 -1.26 -5.06 105.19 109.22 2jj1 n GLY 179 Ca -0.04 -0.93 -0.27 0.00 0.00 0.00 0.00 46.02 44.78 2jj1 n GLY 179 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jj1 s TYR 180 N 1.94 2.12 0.07 1.61 4.12 -0.97 -4.92 117.35 121.33 2jj1 s TYR 180 Ca 0.00 -0.39 0.09 0.00 0.02 0.00 0.00 57.07 56.79 2jj1 s TYR 180 Cb 0.00 -1.15 -0.03 0.00 -1.52 0.00 0.00 41.96 39.26 2jj1 s TYR 180 CO 0.00 0.29 -0.24 -1.12 0.02 0.00 0.00 175.55 174.50 2jj1 s SER 181 N -2.02 3.40 -0.08 2.29 0.01 0.11 -0.57 113.70 116.85 2jj1 s SER 181 Ca 0.11 -0.60 0.02 0.00 1.31 0.00 0.00 55.95 56.80 2jj1 s SER 181 Cb -0.10 -0.36 0.01 0.00 0.21 0.00 0.00 66.02 65.79 2jj1 s SER 181 CO 0.05 0.23 -0.14 -0.69 0.41 0.00 0.00 173.24 173.11 2jj1 s VAL 182 N -0.93 1.29 -0.23 3.43 1.01 -0.50 -0.84 120.40 123.63 2jj1 s VAL 182 Ca 0.13 -0.56 -0.03 0.00 0.00 0.00 0.00 61.98 61.53 2jj1 s VAL 182 Cb -0.10 -1.17 0.01 0.00 0.00 0.00 0.00 36.38 35.12 2jj1 s VAL 182 CO 0.04 0.39 -0.06 0.12 0.00 0.00 0.00 175.10 175.60 2jj1 s PHE 183 N 0.70 2.99 -0.25 5.22 5.36 -0.42 -0.63 117.98 130.95 2jj1 s PHE 183 Ca -0.13 -1.27 -0.09 0.00 -0.96 0.00 0.00 56.93 54.48 2jj1 s PHE 183 Cb -0.16 -2.08 -0.04 0.00 -0.34 0.00 0.00 43.02 40.41 2jj1 s PHE 183 CO 0.03 -0.65 0.11 0.00 -1.46 0.00 0.00 175.22 173.25 2jj1 s ALA 184 N 1.40 3.32 -0.54 11.12 0.00 0.28 -1.67 121.76 135.67 2jj1 s ALA 184 Ca 0.03 -1.06 -0.19 0.00 0.00 0.00 0.00 51.96 50.74 2jj1 s ALA 184 Cb -0.15 -2.19 0.07 0.00 0.00 0.00 0.00 23.12 20.85 2jj1 s ALA 184 CO -0.04 -0.40 0.67 0.20 0.00 0.00 0.00 175.76 176.18 2jj1 s GLY 185 N 1.46 1.75 -0.39 0.00 0.00 0.13 -2.44 107.32 107.83 2jj1 s GLY 185 Ca 0.06 -1.87 -0.07 0.00 0.00 0.00 0.00 44.72 42.83 2jj1 s GLY 185 CO 0.05 1.54 0.20 0.14 0.00 0.00 0.00 173.10 175.04 2jj1 s VAL 186 N 2.73 3.95 -2.12 1.40 1.01 -0.46 -0.56 120.40 126.35 2jj1 s VAL 186 Ca 0.15 -1.42 0.00 0.00 0.00 0.00 0.00 61.98 60.71 2jj1 s VAL 186 Cb -0.20 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 32.77 2jj1 s VAL 186 CO 0.10 -0.43 0.00 0.61 0.00 0.00 0.00 175.10 175.38 2jj1 n GLY 187 N 4.84 1.54 0.00 4.51 0.00 0.02 -1.56 105.19 114.54 2jj1 n GLY 187 Ca -0.10 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2jj1 n GLY 187 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jj1 n GLU 188 N -2.50 3.33 -2.62 1.61 -0.58 -1.26 -3.81 120.64 114.81 2jj1 n GLU 188 Ca -0.21 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.10 2jj1 n GLU 188 Cb 0.68 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 31.53 2jj1 n GLU 188 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2jj1 s ARG 189 N 2.72 4.35 0.28 3.49 0.52 -1.26 -1.42 118.95 127.63 2jj1 s ARG 189 Ca 0.00 1.45 0.00 0.00 -0.52 0.00 0.00 55.73 56.67 2jj1 s ARG 189 Cb 0.00 -3.59 0.52 0.00 0.52 0.00 0.00 34.95 32.39 2jj1 s ARG 189 CO 0.00 -0.46 1.86 1.15 0.02 0.00 0.00 175.30 177.87 2jj1 h THR 190 N 5.22 0.99 -0.90 0.02 2.02 -1.97 -1.13 112.91 117.16 2jj1 h THR 190 Ca -0.28 -0.36 0.21 0.00 0.77 0.00 0.00 66.41 66.75 2jj1 h THR 190 Cb 1.12 -0.15 -0.12 0.00 -1.74 0.00 0.00 68.15 67.26 2jj1 h THR 190 CO 0.91 0.19 0.43 -0.09 0.37 0.00 0.00 175.52 177.32 2jj1 h ARG 191 N 1.05 0.45 0.00 6.66 2.43 -2.00 -1.95 114.38 121.02 2jj1 h ARG 191 Ca 0.46 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.53 2jj1 h ARG 191 Cb 0.36 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 2jj1 h ARG 191 CO -0.22 0.30 -0.36 0.93 -1.51 0.00 0.00 179.97 179.11 2jj1 h GLU 192 N 0.46 0.00 0.00 0.20 5.08 -1.60 -1.59 114.58 117.14 2jj1 h GLU 192 Ca 0.55 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.84 2jj1 h GLU 192 Cb 1.01 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.27 2jj1 h GLU 192 CO -0.49 0.36 -0.30 0.78 -1.00 0.00 0.00 179.01 178.36 2jj1 h GLY 193 N 1.42 0.22 0.70 -3.84 0.00 -1.30 0.12 103.07 100.39 2jj1 h GLY 193 Ca -0.00 -0.39 0.03 0.00 0.00 0.00 0.00 47.33 46.96 2jj1 h GLY 193 CO 0.05 0.35 -0.07 -0.57 0.00 0.00 0.00 176.54 176.29 2jj1 h ASN 194 N -0.47 -0.22 -0.77 0.19 -1.24 -1.46 0.12 115.58 111.74 2jj1 h ASN 194 Ca -0.04 0.05 0.17 0.00 0.71 0.00 0.00 56.30 57.19 2jj1 h ASN 194 Cb 1.06 0.11 -0.14 0.00 0.73 0.00 0.00 38.32 40.08 2jj1 h ASN 194 CO 0.06 -0.10 -0.08 0.44 -1.29 0.00 0.00 177.43 176.46 2jj1 h ASP 195 N -0.08 -0.51 -0.16 1.15 5.19 -1.27 -2.28 116.42 118.46 2jj1 h ASP 195 Ca 0.06 0.21 -0.17 0.00 -0.62 0.00 0.00 57.03 56.52 2jj1 h ASP 195 Cb 0.17 0.41 -0.00 0.00 0.18 0.00 0.00 39.33 40.08 2jj1 h ASP 195 CO -0.14 -0.22 -0.51 0.25 -3.12 0.00 0.00 179.24 175.50 2jj1 h LEU 196 N 0.05 0.81 -0.20 1.55 5.85 0.34 -2.51 115.31 121.21 2jj1 h LEU 196 Ca 0.40 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 2jj1 h LEU 196 Cb 0.68 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 2jj1 h LEU 196 CO -0.73 1.17 0.07 0.22 -0.34 0.00 0.00 178.44 178.83 2jj1 h TYR 197 N 0.58 0.31 0.00 1.25 3.20 -0.27 -2.39 116.97 119.64 2jj1 h TYR 197 Ca 0.02 -0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.71 2jj1 h TYR 197 Cb 1.08 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 39.24 2jj1 h TYR 197 CO 0.06 0.38 -0.73 0.45 -1.64 0.00 0.00 178.16 176.68 2jj1 h HIS 198 N 0.16 0.00 0.00 -3.82 3.86 -1.47 -2.19 115.15 111.69 2jj1 h HIS 198 Ca 0.07 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.22 2jj1 h HIS 198 Cb 0.21 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.67 2jj1 h HIS 198 CO -0.00 0.73 -0.25 0.93 0.86 0.00 0.00 177.93 180.19 2jj1 h GLU 199 N 0.00 0.00 0.00 2.45 5.08 -1.39 -2.25 114.58 118.47 2jj1 h GLU 199 Ca -0.01 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.07 2jj1 h GLU 199 Cb 1.43 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.63 2jj1 h GLU 199 CO 0.09 0.25 -1.65 0.52 -1.00 0.00 0.00 179.01 177.23 2jj1 h MET 200 N 0.00 0.00 -0.31 2.33 2.86 -1.24 -2.19 114.93 116.39 2jj1 h MET 200 Ca -0.00 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.65 2jj1 h MET 200 Cb 0.64 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.28 2jj1 h MET 200 CO 0.03 0.53 0.17 0.82 1.06 0.00 0.00 176.91 179.52 2jj1 h ILE 201 N 0.00 1.01 -0.72 -1.22 2.04 -1.39 0.05 117.51 117.27 2jj1 h ILE 201 Ca -0.26 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.48 2jj1 h ILE 201 Cb 1.99 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 38.67 2jj1 h ILE 201 CO 0.08 0.06 0.47 -0.08 0.00 0.00 0.00 178.15 178.68 2jj1 h GLU 202 N 0.34 0.96 0.00 2.37 4.57 -1.47 -2.22 114.58 119.13 2jj1 h GLU 202 Ca 0.13 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.24 2jj1 h GLU 202 Cb 0.02 -0.21 0.00 0.00 -0.16 0.00 0.00 28.75 28.40 2jj1 h GLU 202 CO -0.07 0.65 0.00 0.66 -1.18 0.00 0.00 179.01 179.07 2jj1 h SER 203 N 0.98 0.00 0.00 1.04 4.64 -1.23 -3.47 113.55 115.51 2jj1 h SER 203 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 2jj1 h SER 203 Cb -0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 2jj1 h SER 203 CO -0.05 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.52 2jj1 n GLY 204 N 0.75 3.00 0.39 -0.77 0.00 -0.03 -4.92 105.19 103.61 2jj1 n GLY 204 Ca 0.04 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.27 2jj1 n GLY 204 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2jj1 h VAL 205 N 0.00 0.62 -3.23 1.61 -1.51 -1.75 -3.17 116.25 108.82 2jj1 h VAL 205 Ca 0.00 0.00 -0.62 0.00 -1.23 0.00 0.00 66.70 64.85 2jj1 h VAL 205 Cb 0.00 0.71 -0.14 0.00 -2.13 0.00 0.00 31.29 29.72 2jj1 h VAL 205 CO 0.00 0.00 -0.55 -0.63 -1.23 0.00 0.00 177.57 175.16 2jj1 s ILE 206 N -4.90 4.91 -0.08 7.19 1.01 -1.00 0.34 121.20 128.68 2jj1 s ILE 206 Ca -0.05 0.01 0.03 0.00 0.00 0.00 0.00 60.65 60.64 2jj1 s ILE 206 Cb 0.19 -3.20 0.01 0.00 0.01 0.00 0.00 42.46 39.46 2jj1 s ILE 206 CO 0.68 0.48 -0.18 0.21 0.00 0.00 0.00 174.94 176.14 2jj1 s ASN 207 N 0.14 2.43 0.04 3.58 3.84 -1.20 -3.98 114.94 119.79 2jj1 s ASN 207 Ca 0.06 -0.43 0.26 0.00 0.21 0.00 0.00 52.86 52.96 2jj1 s ASN 207 Cb -0.12 -1.11 0.78 0.00 -0.55 0.00 0.00 41.25 40.24 2jj1 s ASN 207 CO 0.00 0.09 1.62 0.18 -2.79 0.00 0.00 177.10 176.21 2jj1 n LEU 208 N 3.70 0.38 -0.00 3.21 4.77 -1.26 -4.27 117.00 123.53 2jj1 n LEU 208 Ca -0.21 0.27 0.05 0.00 -0.03 0.00 0.00 56.01 56.09 2jj1 n LEU 208 Cb 0.52 -0.34 -0.08 0.00 -2.33 0.00 0.00 43.42 41.20 2jj1 n LEU 208 CO 0.27 0.02 -0.59 0.29 -1.33 0.00 0.00 177.39 176.05 2jj1 n LYS 209 N -1.66 0.49 -2.86 3.23 4.76 -1.26 -5.05 118.16 115.80 2jj1 n LYS 209 Ca 0.06 -0.09 -0.08 0.00 -2.87 0.00 0.00 58.31 55.33 2jj1 n LYS 209 Cb 0.36 -1.23 -0.03 0.00 -1.84 0.00 0.00 35.03 32.29 2jj1 n LYS 209 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2jj1 n ASP 210 N -1.83 -0.35 -2.17 4.39 5.68 -1.26 -5.07 116.55 115.94 2jj1 n ASP 210 Ca -0.02 -1.89 -0.27 0.00 -0.50 0.00 0.00 54.79 52.11 2jj1 n ASP 210 Cb 0.27 0.77 0.13 0.00 -1.14 0.00 0.00 41.12 41.15 2jj1 n ASP 210 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2jj1 n ALA 211 N -2.04 5.79 1.12 2.12 0.00 -1.26 -4.49 120.51 121.75 2jj1 n ALA 211 Ca -0.05 -3.23 0.10 0.00 0.00 0.00 0.00 53.44 50.26 2jj1 n ALA 211 Cb 0.25 -1.47 0.34 0.00 0.00 0.00 0.00 19.45 18.58 2jj1 n ALA 211 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2jj1 n THR 212 N -1.02 0.26 -1.86 0.00 -2.24 -1.26 -4.96 114.28 103.19 2jj1 n THR 212 Ca 0.58 -0.39 -0.41 0.00 -2.27 0.00 0.00 64.05 61.56 2jj1 n THR 212 Cb 1.13 0.41 -0.01 0.00 -2.10 0.00 0.00 70.33 69.76 2jj1 n THR 212 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2jj1 s SER 213 N -1.51 6.44 0.00 3.42 0.01 -1.26 -4.82 113.70 115.98 2jj1 s SER 213 Ca 0.32 2.94 0.05 0.00 1.31 0.00 0.00 55.95 60.57 2jj1 s SER 213 Cb 0.17 -2.65 0.03 0.00 0.21 0.00 0.00 66.02 63.78 2jj1 s SER 213 CO 0.26 -0.82 0.61 0.29 0.41 0.00 0.00 173.24 173.99 2jj1 n LYS 214 N 1.05 0.55 -4.00 12.44 5.02 0.15 -4.75 118.16 128.62 2jj1 n LYS 214 Ca 0.03 -0.71 -0.20 0.00 -2.02 0.00 0.00 58.31 55.41 2jj1 n LYS 214 Cb 0.39 -1.05 -0.17 0.00 -0.02 0.00 0.00 35.03 34.19 2jj1 n LYS 214 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2jj1 s VAL 215 N -0.59 0.39 0.06 -0.18 0.11 -1.25 0.10 120.40 119.04 2jj1 s VAL 215 Ca 0.06 -0.00 -0.08 0.00 -2.93 0.00 0.00 61.98 59.02 2jj1 s VAL 215 Cb 0.04 -0.47 -0.05 0.00 -1.53 0.00 0.00 36.38 34.37 2jj1 s VAL 215 CO 0.09 0.21 0.35 0.00 -3.33 0.00 0.00 175.10 172.41 2jj1 s ALA 216 N 1.19 3.78 -0.03 1.54 0.00 -0.02 -0.55 121.76 127.67 2jj1 s ALA 216 Ca -0.07 -0.47 0.07 0.00 0.00 0.00 0.00 51.96 51.49 2jj1 s ALA 216 Cb -0.14 -2.18 -0.02 0.00 0.00 0.00 0.00 23.12 20.79 2jj1 s ALA 216 CO -0.02 0.61 -0.25 -0.51 0.00 0.00 0.00 175.76 175.59 2jj1 s LEU 217 N -1.94 2.05 -0.07 0.00 1.43 -0.54 -1.31 118.68 118.31 2jj1 s LEU 217 Ca 0.32 -0.47 -0.01 0.00 -1.03 0.00 0.00 54.13 52.94 2jj1 s LEU 217 Cb -0.13 -1.32 0.03 0.00 0.03 0.00 0.00 46.19 44.80 2jj1 s LEU 217 CO 0.18 0.29 -0.01 -0.69 0.23 0.00 0.00 176.35 176.35 2jj1 s VAL 218 N -0.46 0.44 -0.05 -1.59 1.01 -0.67 0.16 120.40 119.24 2jj1 s VAL 218 Ca 0.06 0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.12 2jj1 s VAL 218 Cb -0.11 -0.57 0.00 0.00 0.00 0.00 0.00 36.38 35.71 2jj1 s VAL 218 CO 0.00 0.26 -0.15 -0.31 0.00 0.00 0.00 175.10 174.90 2jj1 s TYR 219 N 1.74 1.58 -0.40 5.22 1.51 0.12 0.18 117.35 127.30 2jj1 s TYR 219 Ca 0.02 -0.51 0.03 0.00 -1.01 0.00 0.00 57.07 55.60 2jj1 s TYR 219 Cb -0.13 -1.10 0.16 0.00 -0.11 0.00 0.00 41.96 40.79 2jj1 s TYR 219 CO -0.04 -0.21 0.37 0.20 -1.11 0.00 0.00 175.55 174.76 2jj1 s GLY 220 N 0.29 0.50 0.78 0.71 0.00 0.27 -4.23 107.32 105.65 2jj1 s GLY 220 Ca -0.08 -1.70 -0.05 0.00 0.00 0.00 0.00 44.72 42.88 2jj1 s GLY 220 CO 0.03 2.47 1.08 1.20 0.00 0.00 0.00 173.10 177.88 2jj1 s GLN 221 N 0.72 1.45 0.00 2.90 -1.52 -1.26 -0.80 119.66 121.16 2jj1 s GLN 221 Ca 0.25 -0.85 0.11 0.00 -1.95 0.00 0.00 55.36 52.92 2jj1 s GLN 221 Cb -0.07 -2.19 0.59 0.00 -0.22 0.00 0.00 33.01 31.12 2jj1 s GLN 221 CO -0.09 -1.68 1.16 0.00 -0.25 0.00 0.00 175.29 174.43 2jj1 n MET 222 N -3.08 0.25 0.00 2.91 0.00 -0.51 -0.03 117.12 116.65 2jj1 n MET 222 Ca 0.14 0.09 0.15 0.00 0.00 0.00 0.00 57.70 58.09 2jj1 n MET 222 Cb 0.60 -1.50 0.78 0.00 0.00 0.00 0.00 33.22 33.10 2jj1 n MET 222 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 175.97 176.24 2jj1 n ASN 223 N -1.14 0.24 -4.92 3.17 6.94 -1.26 -4.88 115.26 113.40 2jj1 n ASN 223 Ca 0.07 -0.70 -0.28 0.00 -0.02 0.00 0.00 54.58 53.64 2jj1 n ASN 223 Cb 0.06 -0.10 -0.03 0.00 -2.36 0.00 0.00 39.78 37.35 2jj1 n ASN 223 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2jj1 s GLU 224 N -2.27 3.51 0.89 -3.83 0.41 0.96 -5.10 118.70 113.26 2jj1 s GLU 224 Ca 0.37 -0.36 -0.11 0.00 -0.41 0.00 0.00 54.97 54.46 2jj1 s GLU 224 Cb 0.21 -2.89 0.12 0.00 -1.78 0.00 0.00 34.13 29.79 2jj1 s GLU 224 CO 0.42 0.46 1.09 -1.25 -0.49 0.00 0.00 175.26 175.49 2jj1 s PRO 225 N -3.11 1.33 0.13 0.39 0.04 -1.26 -4.80 135.00 127.72 2jj1 s PRO 225 Ca 0.38 0.98 -0.24 0.00 0.04 0.00 0.00 61.00 62.15 2jj1 s PRO 225 Cb -0.11 -1.81 -0.02 0.00 0.04 0.00 0.00 34.50 32.60 2jj1 s PRO 225 CO 0.28 -2.23 1.64 -1.00 0.04 0.00 0.00 177.00 175.73 2jj1 h PRO 226 N -1.55 -0.31 -0.81 0.56 0.13 -1.89 -2.41 132.00 125.72 2jj1 h PRO 226 Ca -0.48 0.02 0.18 0.00 -0.87 0.00 0.00 66.00 64.85 2jj1 h PRO 226 Cb 1.27 0.07 -0.15 0.00 0.13 0.00 0.00 31.00 32.33 2jj1 h PRO 226 CO 0.52 -0.21 -0.07 0.78 -0.23 0.00 0.00 178.00 178.80 2jj1 h GLY 227 N -0.32 0.81 1.01 1.56 0.00 -1.88 0.34 103.07 104.59 2jj1 h GLY 227 Ca 0.09 0.17 0.01 0.00 0.00 0.00 0.00 47.33 47.60 2jj1 h GLY 227 CO -0.28 -0.33 0.48 0.00 0.00 0.00 0.00 176.54 176.41 2jj1 h ALA 228 N 1.79 0.91 -0.26 3.60 0.00 -1.55 -2.18 119.26 121.57 2jj1 h ALA 228 Ca 0.43 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 55.16 2jj1 h ALA 228 Cb 0.75 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2jj1 h ALA 228 CO -0.76 0.34 -0.39 0.00 0.00 0.00 0.00 179.25 178.44 2jj1 h ARG 229 N 0.98 0.59 0.00 0.00 3.08 -0.23 -2.40 114.38 116.40 2jj1 h ARG 229 Ca 0.26 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2jj1 h ARG 229 Cb -0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.94 2jj1 h ARG 229 CO -0.06 0.88 0.00 0.00 -1.07 0.00 0.00 179.97 179.72 2jj1 n ALA 230 N -2.50 2.17 -0.03 0.04 0.00 0.77 -3.79 120.51 117.16 2jj1 n ALA 230 Ca -0.02 -0.11 -0.03 0.00 0.00 0.00 0.00 53.44 53.29 2jj1 n ALA 230 Cb 0.51 -1.37 -0.04 0.00 0.00 0.00 0.00 19.45 18.54 2jj1 n ALA 230 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2jj1 n ARG 231 N -1.31 2.78 -0.05 0.00 5.12 -0.87 -4.76 116.66 117.57 2jj1 n ARG 231 Ca 0.10 0.00 0.23 0.00 -1.93 0.00 0.00 57.85 56.25 2jj1 n ARG 231 Cb 0.19 -1.14 0.71 0.00 -1.16 0.00 0.00 32.46 31.06 2jj1 n ARG 231 CO 0.00 0.00 0.00 -0.24 -1.93 0.00 0.00 177.63 175.46 2jj1 h VAL 232 N 0.00 0.63 -0.14 1.55 3.04 -1.53 0.23 116.25 120.04 2jj1 h VAL 232 Ca -0.15 0.00 -0.09 0.00 -1.01 0.00 0.00 66.70 65.45 2jj1 h VAL 232 Cb 1.33 0.67 -0.01 0.00 -2.01 0.00 0.00 31.29 31.27 2jj1 h VAL 232 CO 0.00 0.00 -0.32 0.00 -1.01 0.00 0.00 177.57 176.25 2jj1 h ALA 233 N 1.65 1.20 -0.05 3.17 0.00 -1.86 -2.05 119.26 121.32 2jj1 h ALA 233 Ca 0.30 -0.35 -0.22 0.00 0.00 0.00 0.00 54.91 54.64 2jj1 h ALA 233 Cb 1.25 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2jj1 h ALA 233 CO -0.00 0.53 -0.86 -0.07 0.00 0.00 0.00 179.25 178.84 2jj1 h LEU 234 N 0.24 0.65 -0.01 0.00 3.38 -0.88 -0.53 115.31 118.17 2jj1 h LEU 234 Ca 0.03 -0.48 0.01 0.00 0.09 0.00 0.00 57.88 57.54 2jj1 h LEU 234 Cb 0.68 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 2jj1 h LEU 234 CO 0.05 1.26 -0.07 0.74 0.09 0.00 0.00 178.44 180.51 2jj1 h THR 235 N 0.33 0.81 0.31 0.22 2.02 -1.24 0.29 112.91 115.65 2jj1 h THR 235 Ca -0.07 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 2jj1 h THR 235 Cb 1.48 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 68.69 2jj1 h THR 235 CO 0.16 0.00 -0.28 1.23 0.37 0.00 0.00 175.52 176.99 2jj1 h GLY 236 N -0.12 -0.66 -0.05 2.16 0.00 -1.39 -2.51 103.07 100.50 2jj1 h GLY 236 Ca 0.03 0.32 0.18 0.00 0.00 0.00 0.00 47.33 47.86 2jj1 h GLY 236 CO -0.08 -0.26 0.31 -2.00 0.00 0.00 0.00 176.54 174.51 2jj1 h LEU 237 N -0.62 0.24 -1.03 3.11 5.85 -0.89 -1.87 115.31 120.11 2jj1 h LEU 237 Ca -0.02 0.14 -0.06 0.00 0.84 0.00 0.00 57.88 58.78 2jj1 h LEU 237 Cb 0.55 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.69 2jj1 h LEU 237 CO -0.04 0.03 0.08 0.74 -0.34 0.00 0.00 178.44 178.91 2jj1 h THR 238 N 0.39 1.23 -0.19 1.05 2.02 -0.09 0.15 112.91 117.47 2jj1 h THR 238 Ca 0.48 -0.86 -0.02 0.00 0.77 0.00 0.00 66.41 66.77 2jj1 h THR 238 Cb 0.82 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 2jj1 h THR 238 CO -0.48 0.31 0.02 0.58 0.37 0.00 0.00 175.52 176.32 2jj1 h VAL 239 N 0.74 1.23 -0.79 3.16 2.07 -0.94 -2.06 116.25 119.66 2jj1 h VAL 239 Ca 0.16 -0.78 0.11 0.00 0.82 0.00 0.00 66.70 67.01 2jj1 h VAL 239 Cb 0.34 1.38 -0.08 0.00 -1.52 0.00 0.00 31.29 31.41 2jj1 h VAL 239 CO 0.01 0.24 0.40 0.00 0.02 0.00 0.00 177.57 178.24 2jj1 h ALA 240 N 0.81 1.13 -0.01 1.67 0.00 -0.99 -3.05 119.26 118.83 2jj1 h ALA 240 Ca 0.06 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2jj1 h ALA 240 Cb 0.34 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2jj1 h ALA 240 CO 0.01 -0.04 0.00 0.93 0.00 0.00 0.00 179.25 180.15 2jj1 h GLU 241 N 0.64 0.01 -0.86 0.00 5.08 -0.22 -1.77 114.58 117.46 2jj1 h GLU 241 Ca 0.40 -0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.91 2jj1 h GLU 241 Cb 0.48 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.63 2jj1 h GLU 241 CO -0.30 0.02 0.45 -0.92 -1.00 0.00 0.00 179.01 177.26 2jj1 h TYR 242 N -0.00 0.79 -0.15 4.33 3.20 -1.29 -1.36 116.97 122.49 2jj1 h TYR 242 Ca 0.00 0.03 -0.17 0.00 3.14 0.00 0.00 58.73 61.74 2jj1 h TYR 242 Cb 0.01 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 2jj1 h TYR 242 CO -0.07 0.19 -0.60 0.74 -1.64 0.00 0.00 178.16 176.78 2jj1 h PHE 243 N 0.64 0.64 -0.06 -3.82 0.05 -1.38 0.11 116.94 113.13 2jj1 h PHE 243 Ca 0.47 -0.24 -0.00 0.00 3.82 0.00 0.00 57.97 62.01 2jj1 h PHE 243 Cb 0.66 -0.12 -0.00 0.00 2.00 0.00 0.00 35.95 38.49 2jj1 h PHE 243 CO -0.08 0.97 0.03 -0.09 -0.18 0.00 0.00 178.31 178.96 2jj1 h ARG 244 N 0.37 0.09 0.00 1.51 2.43 -0.76 -2.88 114.38 115.15 2jj1 h ARG 244 Ca -0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2jj1 h ARG 244 Cb 1.15 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 2jj1 h ARG 244 CO 0.11 0.18 -0.31 -0.44 -1.51 0.00 0.00 179.97 177.99 2jj1 h ASP 245 N -0.02 0.00 0.00 -3.80 3.32 -1.15 -1.48 116.42 113.29 2jj1 h ASP 245 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2jj1 h ASP 245 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 2jj1 h ASP 245 CO -0.00 0.51 0.00 0.00 -1.72 0.00 0.00 179.24 178.03 2jj1 n GLN 246 N -3.94 0.64 0.00 3.56 1.13 0.39 -2.34 117.38 116.82 2jj1 n GLN 246 Ca -0.04 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.02 2jj1 n GLN 246 Cb 0.16 -1.35 0.00 0.00 0.11 0.00 0.00 30.24 29.17 2jj1 n GLN 246 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2jj1 n GLU 247 N -0.85 2.37 -0.26 -1.09 1.02 -1.24 -5.01 120.64 115.57 2jj1 n GLU 247 Ca 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 2jj1 n GLU 247 Cb 0.05 -0.61 0.00 0.00 -0.02 0.00 0.00 31.44 30.86 2jj1 n GLU 247 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jj1 n GLY 248 N 0.84 1.27 3.77 0.62 0.00 -0.56 -5.03 105.19 106.10 2jj1 n GLY 248 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2jj1 n GLY 248 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jj1 s GLN 249 N -0.44 0.17 -0.39 1.61 1.11 -1.13 -4.08 119.66 116.51 2jj1 s GLN 249 Ca 0.00 -0.08 -0.29 0.00 0.01 0.00 0.00 55.36 55.00 2jj1 s GLN 249 Cb 0.00 -1.76 0.01 0.00 -1.01 0.00 0.00 33.01 30.25 2jj1 s GLN 249 CO 0.00 -2.78 1.39 -0.51 0.01 0.00 0.00 175.29 173.40 2jj1 s ASP 250 N -4.30 6.41 -0.16 5.90 1.11 -1.26 -3.58 116.67 120.80 2jj1 s ASP 250 Ca 0.70 0.91 -0.05 0.00 0.18 0.00 0.00 52.55 54.28 2jj1 s ASP 250 Cb -0.09 -2.54 -0.04 0.00 1.07 0.00 0.00 42.92 41.32 2jj1 s ASP 250 CO 0.54 -1.36 0.03 -0.69 1.18 0.00 0.00 175.17 174.87 2jj1 s VAL 251 N 5.20 4.48 0.07 -1.27 1.01 0.07 -2.30 120.40 127.67 2jj1 s VAL 251 Ca 0.60 -0.15 -0.08 0.00 0.00 0.00 0.00 61.98 62.35 2jj1 s VAL 251 Cb -0.14 -2.98 -0.05 0.00 0.00 0.00 0.00 36.38 33.20 2jj1 s VAL 251 CO 0.31 0.50 0.36 -0.76 0.00 0.00 0.00 175.10 175.51 2jj1 s LEU 252 N 0.10 4.34 -0.06 3.92 1.43 0.27 -0.03 118.68 128.65 2jj1 s LEU 252 Ca 0.03 0.71 -0.01 0.00 -1.03 0.00 0.00 54.13 53.83 2jj1 s LEU 252 Cb -0.13 -2.95 0.03 0.00 0.03 0.00 0.00 46.19 43.17 2jj1 s LEU 252 CO 0.01 0.18 0.00 -0.22 0.23 0.00 0.00 176.35 176.55 2jj1 s LEU 253 N -1.97 0.67 -0.14 1.79 2.96 0.67 -1.41 118.68 121.24 2jj1 s LEU 253 Ca 0.33 -0.08 0.00 0.00 -0.22 0.00 0.00 54.13 54.16 2jj1 s LEU 253 Cb -0.13 -0.41 -0.01 0.00 0.50 0.00 0.00 46.19 46.14 2jj1 s LEU 253 CO 0.18 -0.18 -0.15 -0.36 -1.32 0.00 0.00 176.35 174.53 2jj1 s PHE 254 N 1.82 2.78 -0.22 5.38 0.40 0.19 -0.38 117.98 127.96 2jj1 s PHE 254 Ca 0.03 -0.86 -0.00 0.00 -0.60 0.00 0.00 56.93 55.50 2jj1 s PHE 254 Cb -0.12 -1.86 0.06 0.00 0.51 0.00 0.00 43.02 41.60 2jj1 s PHE 254 CO -0.04 -0.35 -0.04 0.42 0.70 0.00 0.00 175.22 175.90 2jj1 s ILE 255 N 0.59 1.30 -0.23 0.64 1.01 -0.66 -0.56 121.20 123.30 2jj1 s ILE 255 Ca -0.09 -1.01 0.01 0.00 0.00 0.00 0.00 60.65 59.57 2jj1 s ILE 255 Cb -0.16 -1.59 0.05 0.00 0.01 0.00 0.00 42.46 40.78 2jj1 s ILE 255 CO 0.03 -0.07 -0.09 -0.62 0.00 0.00 0.00 174.94 174.19 2jj1 s ASP 256 N 1.51 3.84 -0.06 3.58 2.15 -1.02 -0.49 116.67 126.18 2jj1 s ASP 256 Ca -0.04 -1.12 0.03 0.00 0.43 0.00 0.00 52.55 51.85 2jj1 s ASP 256 Cb -0.18 -1.32 0.01 0.00 -0.30 0.00 0.00 42.92 41.13 2jj1 s ASP 256 CO -0.07 -0.18 -0.13 0.21 -0.17 0.00 0.00 175.17 174.83 2jj1 s ASN 257 N 1.30 1.85 0.40 -0.34 3.84 -0.60 -1.36 114.94 120.03 2jj1 s ASN 257 Ca -0.05 -0.31 0.09 0.00 0.21 0.00 0.00 52.86 52.81 2jj1 s ASN 257 Cb -0.18 -0.73 0.82 0.00 -0.55 0.00 0.00 41.25 40.61 2jj1 s ASN 257 CO -0.07 0.07 1.96 -0.29 -2.79 0.00 0.00 177.10 175.98 2jj1 h ILE 258 N 5.72 1.15 -0.86 -5.21 6.09 -1.05 -2.44 117.51 120.91 2jj1 h ILE 258 Ca -0.31 -0.59 0.21 0.00 -1.37 0.00 0.00 64.86 62.81 2jj1 h ILE 258 Cb 1.18 1.02 -0.15 0.00 0.47 0.00 0.00 36.82 39.34 2jj1 h ILE 258 CO 0.48 0.19 0.04 0.15 -3.07 0.00 0.00 178.15 175.95 2jj1 h PHE 259 N 0.30 0.01 -0.23 2.19 3.57 -1.89 -1.18 116.94 119.71 2jj1 h PHE 259 Ca 0.07 0.06 0.07 0.00 3.53 0.00 0.00 57.97 61.70 2jj1 h PHE 259 Cb 0.25 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 2jj1 h PHE 259 CO 0.00 -0.30 0.38 0.00 -2.23 0.00 0.00 178.31 176.16 2jj1 h ARG 260 N 0.09 0.00 -0.49 1.11 2.47 -1.70 0.57 114.38 116.43 2jj1 h ARG 260 Ca 0.50 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 59.17 2jj1 h ARG 260 Cb 0.95 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.25 2jj1 h ARG 260 CO -0.76 0.00 0.12 0.35 0.56 0.00 0.00 179.97 180.24 2jj1 h PHE 261 N 0.00 0.83 -0.05 3.04 3.57 -1.40 -1.68 116.94 121.25 2jj1 h PHE 261 Ca 0.11 -0.10 -0.06 0.00 3.53 0.00 0.00 57.97 61.45 2jj1 h PHE 261 Cb 0.86 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.37 2jj1 h PHE 261 CO 0.00 0.74 -0.20 1.15 -2.23 0.00 0.00 178.31 177.78 2jj1 h THR 262 N 0.67 1.45 -0.37 4.41 2.02 -0.01 -3.06 112.91 118.02 2jj1 h THR 262 Ca 0.15 -1.63 0.06 0.00 0.77 0.00 0.00 66.41 65.76 2jj1 h THR 262 Cb 0.34 2.37 -0.05 0.00 -1.74 0.00 0.00 68.15 69.07 2jj1 h THR 262 CO 0.00 0.45 0.07 -0.61 0.37 0.00 0.00 175.52 175.81 2jj1 h GLN 263 N -0.31 0.19 -0.55 6.66 4.15 -1.39 -1.70 115.11 122.17 2jj1 h GLN 263 Ca -0.01 -0.01 0.10 0.00 0.77 0.00 0.00 58.65 59.50 2jj1 h GLN 263 Cb 0.84 -0.04 -0.08 0.00 0.21 0.00 0.00 27.48 28.40 2jj1 h GLN 263 CO 0.04 0.13 0.07 0.00 -1.93 0.00 0.00 178.83 177.14 2jj1 h ALA 264 N 1.28 0.60 -0.48 3.38 0.00 -1.37 -1.42 119.26 121.25 2jj1 h ALA 264 Ca 0.18 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 2jj1 h ALA 264 Cb 0.21 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2jj1 h ALA 264 CO -0.23 -0.34 0.15 0.78 0.00 0.00 0.00 179.25 179.61 2jj1 h GLY 265 N 0.20 0.76 2.00 0.00 0.00 -1.25 -0.88 103.07 103.91 2jj1 h GLY 265 Ca 0.28 -0.40 -0.07 0.00 0.00 0.00 0.00 47.33 47.14 2jj1 h GLY 265 CO -0.40 0.38 -0.35 1.48 0.00 0.00 0.00 176.54 177.65 2jj1 h SER 266 N 0.70 0.00 0.32 0.19 4.64 -0.58 -2.37 113.55 116.45 2jj1 h SER 266 Ca 0.16 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.43 2jj1 h SER 266 Cb 0.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2jj1 h SER 266 CO -0.01 0.35 -0.26 -0.33 -0.87 0.00 0.00 176.83 175.72 2jj1 h GLU 267 N 0.00 0.00 -0.01 4.77 5.08 -0.12 -2.82 114.58 121.49 2jj1 h GLU 267 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2jj1 h GLU 267 Cb 0.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.96 2jj1 h GLU 267 CO 0.05 0.26 -0.45 1.33 -1.00 0.00 0.00 179.01 179.19 2jj1 n VAL 268 N -4.08 0.00 -0.25 3.13 0.24 -1.18 -4.73 118.33 111.46 2jj1 n VAL 268 Ca -0.02 -0.28 -0.06 0.00 -2.04 0.00 0.00 64.34 61.94 2jj1 n VAL 268 Cb 0.32 1.14 0.05 0.00 -1.47 0.00 0.00 33.84 33.87 2jj1 n VAL 268 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 2jj1 h SER 269 N 1.28 0.89 0.34 -1.34 0.87 -1.15 -0.98 113.55 113.46 2jj1 h SER 269 Ca 0.00 -0.11 -0.09 0.00 -1.23 0.00 0.00 61.79 60.36 2jj1 h SER 269 Cb 0.49 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.22 2jj1 h SER 269 CO 0.00 0.75 -0.39 0.00 -0.53 0.00 0.00 176.83 176.67 2jj1 h ALA 270 N 1.17 1.31 0.00 6.23 0.00 -1.82 -2.52 119.26 123.64 2jj1 h ALA 270 Ca 0.24 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 2jj1 h ALA 270 Cb 0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2jj1 h ALA 270 CO -0.03 0.51 -0.30 -0.07 0.00 0.00 0.00 179.25 179.36 2jj1 h LEU 271 N 0.05 0.00 0.00 0.00 3.38 -1.71 -1.80 115.31 115.24 2jj1 h LEU 271 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2jj1 h LEU 271 Cb 0.71 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.46 2jj1 h LEU 271 CO 0.05 0.30 0.00 0.18 0.09 0.00 0.00 178.44 179.06 2jj1 n LEU 272 N -3.26 0.00 0.00 1.67 4.77 -0.43 -4.92 117.00 114.82 2jj1 n LEU 272 Ca 0.02 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 2jj1 n LEU 272 Cb 0.57 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 2jj1 n LEU 272 CO 0.36 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 2jj1 n GLY 273 N 0.92 0.66 3.82 -0.72 0.00 -0.67 -5.07 105.19 104.13 2jj1 n GLY 273 Ca 0.12 -0.66 -0.35 0.00 0.00 0.00 0.00 46.02 45.14 2jj1 n GLY 273 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jj1 s ARG 274 N -1.36 4.21 0.15 1.61 3.00 -0.97 -5.02 118.95 120.56 2jj1 s ARG 274 Ca 0.00 0.84 -0.30 0.00 0.00 0.00 0.00 55.73 56.27 2jj1 s ARG 274 Cb 0.00 -2.78 -0.07 0.00 0.00 0.00 0.00 34.95 32.10 2jj1 s ARG 274 CO 0.00 0.34 1.18 0.42 0.00 0.00 0.00 175.30 177.24 2jj1 s ILE 275 N -1.62 3.76 0.39 1.52 1.01 -1.26 -4.61 121.20 120.39 2jj1 s ILE 275 Ca 0.46 1.42 -0.25 0.00 0.00 0.00 0.00 60.65 62.28 2jj1 s ILE 275 Cb -0.15 -3.91 -0.09 0.00 0.01 0.00 0.00 42.46 38.32 2jj1 s ILE 275 CO 0.20 0.20 1.08 -2.16 0.00 0.00 0.00 174.94 174.26 2jj1 s PRO 276 N 0.12 4.16 0.03 2.79 0.04 -1.26 -4.35 135.00 136.53 2jj1 s PRO 276 Ca 0.54 1.62 -0.00 0.00 0.04 0.00 0.00 61.00 63.19 2jj1 s PRO 276 Cb -0.31 -2.62 0.01 0.00 0.04 0.00 0.00 34.50 31.62 2jj1 s PRO 276 CO 0.34 -0.17 0.05 0.45 0.04 0.00 0.00 177.00 177.70 2jj1 n SER 277 N 0.04 0.01 -4.71 6.66 2.88 -0.11 -4.93 113.62 113.47 2jj1 n SER 277 Ca 0.04 -1.02 -0.34 0.00 -1.33 0.00 0.00 58.87 56.22 2jj1 n SER 277 Cb 0.48 -0.03 0.11 0.00 -0.75 0.00 0.00 64.21 64.02 2jj1 n SER 277 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jj1 s ALA 278 N -3.75 1.95 -1.36 -1.46 0.00 -1.26 -2.94 121.76 112.95 2jj1 s ALA 278 Ca 0.03 0.89 0.00 0.00 0.00 0.00 0.00 51.96 52.87 2jj1 s ALA 278 Cb -0.00 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.63 2jj1 s ALA 278 CO 0.02 -2.14 0.00 0.28 0.00 0.00 0.00 175.76 173.92 2jj1 n VAL 279 N -3.05 -0.58 -1.66 0.00 0.31 -1.26 -2.55 118.33 109.53 2jj1 n VAL 279 Ca 0.14 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.36 2jj1 n VAL 279 Cb 0.50 -2.03 -0.03 0.00 -0.91 0.00 0.00 33.84 31.38 2jj1 n VAL 279 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jj1 n GLY 280 N -0.76 0.68 3.97 2.92 0.00 -1.15 -5.02 105.19 105.83 2jj1 n GLY 280 Ca -0.17 -0.51 -0.21 0.00 0.00 0.00 0.00 46.02 45.12 2jj1 n GLY 280 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jj1 s TYR 281 N -2.44 3.24 0.51 1.61 1.51 -1.06 -4.89 117.35 115.83 2jj1 s TYR 281 Ca 0.00 0.00 -0.22 0.00 -1.01 0.00 0.00 57.07 55.84 2jj1 s TYR 281 Cb 0.00 -2.01 -0.06 0.00 -0.11 0.00 0.00 41.96 39.78 2jj1 s TYR 281 CO 0.00 -0.03 1.27 1.14 -1.11 0.00 0.00 175.55 176.82 2jj1 s GLN 282 N -4.27 3.38 0.60 -0.62 0.00 -1.26 -0.93 119.66 116.57 2jj1 s GLN 282 Ca 0.44 2.02 0.38 0.00 -0.00 0.00 0.00 55.36 58.20 2jj1 s GLN 282 Cb -0.10 -2.30 1.86 0.00 0.00 0.00 0.00 33.01 32.48 2jj1 s GLN 282 CO 0.33 -0.93 2.17 -1.00 0.00 0.00 0.00 175.29 175.87 2jj1 h PRO 283 N 1.67 0.00 -0.80 9.60 0.13 -1.92 -3.08 132.00 137.61 2jj1 h PRO 283 Ca -0.50 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.43 2jj1 h PRO 283 Cb 1.28 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.29 2jj1 h PRO 283 CO 0.58 0.01 0.25 0.25 -0.23 0.00 0.00 178.00 178.86 2jj1 n THR 284 N -3.14 2.62 -0.03 1.56 -2.24 -1.26 -4.66 114.28 107.13 2jj1 n THR 284 Ca -0.01 -1.40 -0.09 0.00 -2.27 0.00 0.00 64.05 60.28 2jj1 n THR 284 Cb 0.19 -0.41 -0.03 0.00 -2.10 0.00 0.00 70.33 67.98 2jj1 n THR 284 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2jj1 h LEU 285 N 2.40 -0.18 -0.42 3.22 6.46 -1.92 -0.80 115.31 124.06 2jj1 h LEU 285 Ca 0.24 0.06 -0.17 0.00 -0.12 0.00 0.00 57.88 57.89 2jj1 h LEU 285 Cb 2.15 0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 42.19 2jj1 h LEU 285 CO 0.66 -0.06 -0.48 0.00 -0.62 0.00 0.00 178.44 177.93 2jj1 h ALA 286 N 1.18 0.60 -0.00 1.25 0.00 -1.89 -0.45 119.26 119.95 2jj1 h ALA 286 Ca 0.09 -0.49 -0.15 0.00 0.00 0.00 0.00 54.91 54.36 2jj1 h ALA 286 Cb 0.14 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.85 2jj1 h ALA 286 CO -0.19 0.68 -0.60 1.79 0.00 0.00 0.00 179.25 180.92 2jj1 h THR 287 N 0.62 1.43 -0.69 0.00 1.35 -1.89 0.49 112.91 114.21 2jj1 h THR 287 Ca 0.03 -2.08 0.13 0.00 -0.55 0.00 0.00 66.41 63.94 2jj1 h THR 287 Cb 1.06 2.60 -0.09 0.00 -1.73 0.00 0.00 68.15 69.99 2jj1 h THR 287 CO 0.10 0.61 0.23 0.44 -0.25 0.00 0.00 175.52 176.65 2jj1 h ASP 288 N -0.11 0.15 -0.38 5.36 5.19 -1.18 0.16 116.42 125.62 2jj1 h ASP 288 Ca -0.08 0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.45 2jj1 h ASP 288 Cb 1.32 0.12 -0.02 0.00 0.18 0.00 0.00 39.33 40.93 2jj1 h ASP 288 CO 0.12 0.06 0.24 -0.03 -3.12 0.00 0.00 179.24 176.50 2jj1 h MET 289 N 0.36 0.50 0.40 3.56 4.05 -0.94 -2.88 114.93 119.99 2jj1 h MET 289 Ca 0.38 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.75 2jj1 h MET 289 Cb 0.57 -0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 31.24 2jj1 h MET 289 CO -0.41 0.36 -0.39 0.78 0.23 0.00 0.00 176.91 177.48 2jj1 h GLY 290 N 0.50 -0.93 2.00 1.39 0.00 0.19 0.71 103.07 106.93 2jj1 h GLY 290 Ca 0.14 0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.91 2jj1 h GLY 290 CO -0.03 -0.32 0.00 -0.91 0.00 0.00 0.00 176.54 175.28 2jj1 h THR 291 N -0.81 0.00 0.00 4.70 1.35 -0.82 -1.94 112.91 115.40 2jj1 h THR 291 Ca -0.03 -0.29 -0.14 0.00 -0.55 0.00 0.00 66.41 65.39 2jj1 h THR 291 Cb 0.72 1.17 -0.02 0.00 -1.73 0.00 0.00 68.15 68.28 2jj1 h THR 291 CO -0.06 0.00 -0.96 -0.03 -0.25 0.00 0.00 175.52 174.22 2jj1 h MET 292 N 0.00 0.00 -0.29 4.72 -1.53 -1.22 -3.39 114.93 113.22 2jj1 h MET 292 Ca 0.00 0.00 -0.00 0.00 -3.44 0.00 0.00 59.70 56.26 2jj1 h MET 292 Cb 0.32 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.36 2jj1 h MET 292 CO 0.00 0.64 0.16 1.96 0.14 0.00 0.00 176.91 179.81 2jj1 h GLN 293 N -1.00 0.38 0.00 0.39 1.08 0.57 -2.44 115.11 114.09 2jj1 h GLN 293 Ca -0.22 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 56.95 2jj1 h GLN 293 Cb 1.00 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 28.35 2jj1 h GLN 293 CO -0.13 0.28 0.00 0.93 -0.95 0.00 0.00 178.83 178.96 2jj1 h GLU 294 N 0.39 0.00 0.01 1.46 4.39 -1.56 -1.94 114.58 117.33 2jj1 h GLU 294 Ca 0.10 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.61 2jj1 h GLU 294 Cb 0.00 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 2jj1 h GLU 294 CO -0.02 0.00 -0.89 0.00 -1.16 0.00 0.00 179.01 176.94 2jj1 h ARG 295 N 0.00 0.09 -6.16 2.33 3.08 -1.63 -3.39 114.38 108.70 2jj1 h ARG 295 Ca 0.00 -0.11 -0.52 0.00 0.07 0.00 0.00 59.98 59.43 2jj1 h ARG 295 Cb 0.49 0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.51 2jj1 h ARG 295 CO 0.00 0.92 1.19 0.42 -1.07 0.00 0.00 179.97 181.43 2jj1 s ILE 296 N -3.06 3.57 -0.11 2.04 1.01 -0.73 -4.89 121.20 119.02 2jj1 s ILE 296 Ca -0.01 0.23 -0.32 0.00 0.00 0.00 0.00 60.65 60.55 2jj1 s ILE 296 Cb 0.10 -4.49 0.12 0.00 0.01 0.00 0.00 42.46 38.21 2jj1 s ILE 296 CO 0.82 -1.44 1.06 0.28 0.00 0.00 0.00 174.94 175.66 2jj1 s THR 297 N 7.26 0.00 0.39 2.92 -1.32 -1.26 -4.99 115.64 118.63 2jj1 s THR 297 Ca 0.50 0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.75 2jj1 s THR 297 Cb -0.09 -1.00 -0.10 0.00 -1.51 0.00 0.00 72.50 69.80 2jj1 s THR 297 CO 0.15 0.00 0.99 -0.89 -2.21 0.00 0.00 174.62 172.66 2jj1 s THR 298 N -2.58 4.06 0.36 5.08 2.01 -1.26 -4.15 115.64 119.15 2jj1 s THR 298 Ca 0.07 1.51 0.06 0.00 0.31 0.00 0.00 61.69 63.64 2jj1 s THR 298 Cb -0.01 -3.75 -0.02 0.00 0.01 0.00 0.00 72.50 68.73 2jj1 s THR 298 CO -0.06 -0.06 0.22 0.35 -0.69 0.00 0.00 174.62 174.38 2jj1 n THR 299 N -0.09 0.00 0.13 -0.82 -2.24 0.11 -4.55 114.28 106.82 2jj1 n THR 299 Ca 0.05 -2.37 0.03 0.00 -2.27 0.00 0.00 64.05 59.49 2jj1 n THR 299 Cb 0.51 1.05 0.41 0.00 -2.10 0.00 0.00 70.33 70.20 2jj1 n THR 299 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2jj1 h LYS 300 N 0.00 0.20 0.00 -0.78 1.57 -1.29 -2.94 116.57 113.34 2jj1 h LYS 300 Ca -0.26 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.38 2jj1 h LYS 300 Cb 1.18 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 2jj1 h LYS 300 CO 0.40 0.34 -0.46 0.87 -0.57 0.00 0.00 179.45 180.03 2jj1 h LYS 301 N 0.19 0.00 -1.45 3.15 1.57 -1.91 -3.48 116.57 114.64 2jj1 h LYS 301 Ca 0.04 0.00 0.24 0.00 -1.87 0.00 0.00 60.65 59.06 2jj1 h LYS 301 Cb 0.35 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 32.46 2jj1 h LYS 301 CO 0.02 0.46 0.80 0.20 -0.57 0.00 0.00 179.45 180.37 2jj1 s GLY 302 N -4.39 -0.26 -0.19 3.86 0.00 -1.11 -4.45 107.32 100.78 2jj1 s GLY 302 Ca -0.00 1.74 -0.07 0.00 0.00 0.00 0.00 44.72 46.39 2jj1 s GLY 302 CO 0.71 0.62 0.05 -0.45 0.00 0.00 0.00 173.10 174.04 2jj1 s SER 303 N -2.00 5.45 -0.24 1.64 0.15 -1.23 -0.71 113.70 116.76 2jj1 s SER 303 Ca 0.09 0.00 -0.03 0.00 0.70 0.00 0.00 55.95 56.71 2jj1 s SER 303 Cb -0.01 -1.94 0.01 0.00 -1.71 0.00 0.00 66.02 62.37 2jj1 s SER 303 CO -0.05 0.13 -0.04 -0.63 1.20 0.00 0.00 173.24 173.86 2jj1 s ILE 304 N 0.62 3.23 -0.16 6.45 1.01 -1.26 -0.75 121.20 130.35 2jj1 s ILE 304 Ca 0.03 -0.71 -0.21 0.00 0.00 0.00 0.00 60.65 59.75 2jj1 s ILE 304 Cb -0.13 -2.55 -0.03 0.00 0.01 0.00 0.00 42.46 39.76 2jj1 s ILE 304 CO 0.02 0.31 0.63 -0.89 0.00 0.00 0.00 174.94 175.01 2jj1 s THR 305 N 1.42 5.04 -0.11 2.92 2.01 0.96 -3.96 115.64 123.93 2jj1 s THR 305 Ca 0.03 1.23 0.01 0.00 0.31 0.00 0.00 61.69 63.28 2jj1 s THR 305 Cb -0.15 -3.96 0.02 0.00 0.01 0.00 0.00 72.50 68.42 2jj1 s THR 305 CO -0.03 0.16 -0.13 -0.94 -0.69 0.00 0.00 174.62 172.99 2jj1 s SER 306 N 1.04 2.29 -0.15 3.53 1.04 -0.30 -0.24 113.70 120.91 2jj1 s SER 306 Ca 0.31 -0.39 0.01 0.00 0.48 0.00 0.00 55.95 56.35 2jj1 s SER 306 Cb -0.16 -1.00 0.00 0.00 0.10 0.00 0.00 66.02 64.95 2jj1 s SER 306 CO 0.12 -0.01 -0.16 -0.69 0.98 0.00 0.00 173.24 173.47 2jj1 s VAL 307 N 1.11 2.55 -0.17 5.02 1.01 0.48 0.94 120.40 131.35 2jj1 s VAL 307 Ca -0.05 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.13 2jj1 s VAL 307 Cb -0.14 -2.07 0.03 0.00 0.00 0.00 0.00 36.38 34.19 2jj1 s VAL 307 CO -0.03 0.52 -0.15 -1.10 0.00 0.00 0.00 175.10 174.34 2jj1 s GLN 308 N 0.84 2.50 0.11 2.72 -0.21 -0.60 -1.65 119.66 123.36 2jj1 s GLN 308 Ca -0.05 -0.74 -0.31 0.00 0.02 0.00 0.00 55.36 54.28 2jj1 s GLN 308 Cb -0.15 -2.36 -0.08 0.00 1.00 0.00 0.00 33.01 31.42 2jj1 s GLN 308 CO -0.01 -0.28 1.42 0.00 -2.12 0.00 0.00 175.29 174.31 2jj1 s ALA 309 N 1.38 3.61 -0.22 6.09 0.00 0.36 -0.24 121.76 132.74 2jj1 s ALA 309 Ca 0.03 1.12 -0.00 0.00 0.00 0.00 0.00 51.96 53.11 2jj1 s ALA 309 Cb -0.14 -3.56 0.06 0.00 0.00 0.00 0.00 23.12 19.48 2jj1 s ALA 309 CO -0.11 -0.68 -0.03 0.42 0.00 0.00 0.00 175.76 175.36 2jj1 s ILE 310 N 1.31 1.22 0.32 0.00 1.01 -0.02 -0.66 121.20 124.38 2jj1 s ILE 310 Ca 0.65 -1.01 -0.26 0.00 0.00 0.00 0.00 60.65 60.03 2jj1 s ILE 310 Cb -0.37 -1.56 -0.10 0.00 0.01 0.00 0.00 42.46 40.45 2jj1 s ILE 310 CO 0.30 -0.13 0.97 -0.47 0.00 0.00 0.00 174.94 175.61 2jj1 s TYR 311 N 1.54 3.64 -0.48 3.97 5.04 -1.26 -1.22 117.35 128.58 2jj1 s TYR 311 Ca -0.04 1.77 0.04 0.00 -2.44 0.00 0.00 57.07 56.39 2jj1 s TYR 311 Cb -0.18 -2.99 0.12 0.00 0.35 0.00 0.00 41.96 39.26 2jj1 s TYR 311 CO -0.07 0.04 0.22 0.08 -1.34 0.00 0.00 175.55 174.48 2jj1 s VAL 312 N -1.55 2.55 0.50 3.14 1.01 -0.91 -4.46 120.40 120.68 2jj1 s VAL 312 Ca 0.50 -3.11 -0.20 0.00 0.00 0.00 0.00 61.98 59.17 2jj1 s VAL 312 Cb -0.21 -2.79 -0.10 0.00 0.00 0.00 0.00 36.38 33.28 2jj1 s VAL 312 CO 0.26 -0.76 0.61 -2.65 0.00 0.00 0.00 175.10 172.57 2jj1 n PRO 313 N 3.36 0.66 -2.48 2.72 -0.02 -1.26 -1.23 135.00 136.75 2jj1 n PRO 313 Ca 0.05 0.25 -0.10 0.00 -2.02 0.00 0.00 63.50 61.67 2jj1 n PRO 313 Cb 0.34 -1.70 -0.02 0.00 -0.02 0.00 0.00 33.50 32.10 2jj1 n PRO 313 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jj1 n ALA 314 N -1.27 -0.74 -1.09 3.55 0.00 -1.26 -0.87 120.51 118.84 2jj1 n ALA 314 Ca 0.11 -0.05 -0.03 0.00 0.00 0.00 0.00 53.44 53.47 2jj1 n ALA 314 Cb 0.44 -0.83 -0.01 0.00 0.00 0.00 0.00 19.45 19.05 2jj1 n ALA 314 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2jj1 n ASP 315 N -1.18 -5.90 -4.47 0.00 9.92 -0.37 -4.93 116.55 109.63 2jj1 n ASP 315 Ca 0.03 0.07 -0.43 0.00 -0.53 0.00 0.00 54.79 53.94 2jj1 n ASP 315 Cb 0.33 -3.66 -0.10 0.00 -0.64 0.00 0.00 41.12 37.05 2jj1 n ASP 315 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2jj1 s ASP 316 N -2.11 6.09 0.01 -2.24 2.15 -0.05 -4.93 116.67 115.59 2jj1 s ASP 316 Ca 0.00 -0.84 0.16 0.00 0.43 0.00 0.00 52.55 52.31 2jj1 s ASP 316 Cb 0.00 -2.15 0.70 0.00 -0.30 0.00 0.00 42.92 41.17 2jj1 s ASP 316 CO 0.00 -0.42 1.53 0.18 -0.17 0.00 0.00 175.17 176.29 2jj1 n LEU 317 N 5.15 0.02 -0.10 -1.34 4.77 -1.26 -1.67 117.00 122.56 2jj1 n LEU 317 Ca -0.11 0.50 0.14 0.00 -0.03 0.00 0.00 56.01 56.51 2jj1 n LEU 317 Cb 0.47 -0.50 0.59 0.00 -2.33 0.00 0.00 43.42 41.65 2jj1 n LEU 317 CO 0.40 -0.23 0.85 0.35 -1.33 0.00 0.00 177.39 177.44 2jj1 n THR 318 N -1.52 0.00 -1.68 -5.08 -2.24 -1.26 -3.43 114.28 99.07 2jj1 n THR 318 Ca 0.04 -0.05 -0.45 0.00 -2.27 0.00 0.00 64.05 61.32 2jj1 n THR 318 Cb 0.19 -0.11 -0.04 0.00 -2.10 0.00 0.00 70.33 68.28 2jj1 n THR 318 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2jj1 n ASP 319 N -1.02 3.67 -0.06 3.42 -0.08 -0.67 -4.67 116.55 117.13 2jj1 n ASP 319 Ca 0.13 0.99 -0.01 0.00 -1.51 0.00 0.00 54.79 54.40 2jj1 n ASP 319 Cb 0.28 -1.46 -0.00 0.00 2.34 0.00 0.00 41.12 42.28 2jj1 n ASP 319 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 2jj1 n PRO 320 N 5.73 -0.05 0.09 -0.67 -0.02 -1.26 -0.95 135.00 137.87 2jj1 n PRO 320 Ca 0.20 0.24 -0.04 0.00 -2.02 0.00 0.00 63.50 61.88 2jj1 n PRO 320 Cb 0.33 -0.36 -0.02 0.00 -0.02 0.00 0.00 33.50 33.44 2jj1 n PRO 320 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jj1 h ALA 321 N 0.16 -0.93 -0.51 3.55 0.00 -1.95 0.98 119.26 120.56 2jj1 h ALA 321 Ca 0.04 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.94 2jj1 h ALA 321 Cb 0.08 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 2jj1 h ALA 321 CO -0.15 -0.92 0.34 -1.00 0.00 0.00 0.00 179.25 177.52 2jj1 h PRO 322 N -0.26 0.53 -0.51 0.00 0.13 -1.63 -2.24 132.00 128.02 2jj1 h PRO 322 Ca -0.02 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.07 2jj1 h PRO 322 Cb 0.18 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.16 2jj1 h PRO 322 CO 0.04 0.35 0.29 0.00 -0.23 0.00 0.00 178.00 178.45 2jj1 h ALA 323 N 1.71 0.65 0.00 -0.56 0.00 -1.00 -2.05 119.26 118.02 2jj1 h ALA 323 Ca 0.21 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2jj1 h ALA 323 Cb 0.15 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2jj1 h ALA 323 CO -0.05 0.16 0.00 2.41 0.00 0.00 0.00 179.25 181.76 2jj1 n THR 324 N -4.66 0.76 0.04 0.00 -1.04 0.33 -3.36 114.28 106.35 2jj1 n THR 324 Ca 0.02 0.19 -0.02 0.00 -2.04 0.00 0.00 64.05 62.20 2jj1 n THR 324 Cb 0.07 -0.92 -0.08 0.00 -1.82 0.00 0.00 70.33 67.58 2jj1 n THR 324 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 2jj1 h THR 325 N 0.00 0.71 -0.96 12.58 2.02 -1.05 -3.39 112.91 122.81 2jj1 h THR 325 Ca 0.00 -2.27 0.05 0.00 0.77 0.00 0.00 66.41 64.96 2jj1 h THR 325 Cb 0.22 2.23 -0.06 0.00 -1.74 0.00 0.00 68.15 68.79 2jj1 h THR 325 CO 0.00 0.41 0.63 -0.26 0.37 0.00 0.00 175.52 176.66 2jj1 h PHE 326 N 0.00 1.15 0.00 3.16 -1.00 -1.58 -0.42 116.94 118.24 2jj1 h PHE 326 Ca -0.15 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.66 2jj1 h PHE 326 Cb 1.65 -0.38 0.00 0.00 3.61 0.00 0.00 35.95 40.83 2jj1 h PHE 326 CO 0.00 0.63 0.00 0.00 -1.61 0.00 0.00 178.31 177.33 2jj1 n ALA 327 N -2.38 1.84 0.51 2.45 0.00 -1.26 -2.08 120.51 119.58 2jj1 n ALA 327 Ca 0.14 0.03 0.04 0.00 0.00 0.00 0.00 53.44 53.66 2jj1 n ALA 327 Cb 0.15 -1.39 0.17 0.00 0.00 0.00 0.00 19.45 18.38 2jj1 n ALA 327 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2jj1 n HIS 328 N -2.11 0.72 -4.40 0.00 8.25 -0.17 -4.92 115.22 112.60 2jj1 n HIS 328 Ca 0.03 -0.28 -0.27 0.00 -0.26 0.00 0.00 57.72 56.95 2jj1 n HIS 328 Cb 0.27 -0.15 -0.12 0.00 1.12 0.00 0.00 29.99 31.11 2jj1 n HIS 328 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2jj1 s LEU 329 N -1.14 2.40 -0.12 2.41 1.43 -0.88 -4.89 118.68 117.89 2jj1 s LEU 329 Ca 0.24 -0.83 0.16 0.00 -1.03 0.00 0.00 54.13 52.68 2jj1 s LEU 329 Cb 0.16 -1.12 -0.24 0.00 0.03 0.00 0.00 46.19 45.02 2jj1 s LEU 329 CO 0.11 0.11 0.18 0.47 0.23 0.00 0.00 176.35 177.46 2jj1 n ASP 330 N 0.47 0.79 -3.89 2.29 8.00 0.11 -4.97 116.55 119.35 2jj1 n ASP 330 Ca -0.14 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.24 2jj1 n ASP 330 Cb 0.55 1.25 -0.13 0.00 -0.02 0.00 0.00 41.12 42.77 2jj1 n ASP 330 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jj1 s ALA 331 N -2.72 0.02 -0.10 2.24 0.00 -1.01 -0.74 121.76 119.45 2jj1 s ALA 331 Ca -0.08 -0.11 0.03 0.00 0.00 0.00 0.00 51.96 51.80 2jj1 s ALA 331 Cb 0.07 0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.23 2jj1 s ALA 331 CO 0.72 -0.03 -0.19 0.95 0.00 0.00 0.00 175.76 177.21 2jj1 s THR 332 N -0.29 1.71 -0.36 0.00 -4.23 0.05 -1.08 115.64 111.45 2jj1 s THR 332 Ca -0.03 -0.80 0.00 0.00 -1.18 0.00 0.00 61.69 59.68 2jj1 s THR 332 Cb -0.02 -1.51 0.10 0.00 1.34 0.00 0.00 72.50 72.40 2jj1 s THR 332 CO -0.00 0.48 0.10 -0.89 -0.54 0.00 0.00 174.62 173.77 2jj1 s THR 333 N 0.60 2.80 -0.24 3.99 2.01 -0.05 -1.56 115.64 123.19 2jj1 s THR 333 Ca -0.14 -2.05 -0.17 0.00 0.31 0.00 0.00 61.69 59.64 2jj1 s THR 333 Cb -0.17 -2.91 -0.03 0.00 0.01 0.00 0.00 72.50 69.40 2jj1 s THR 333 CO 0.04 -0.54 0.47 -0.69 -0.69 0.00 0.00 174.62 173.21 2jj1 s VAL 334 N 1.06 5.12 0.33 3.82 1.01 -1.26 -0.53 120.40 129.95 2jj1 s VAL 334 Ca 0.06 0.81 0.01 0.00 0.00 0.00 0.00 61.98 62.86 2jj1 s VAL 334 Cb -0.21 -3.79 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 2jj1 s VAL 334 CO -0.05 0.15 0.53 -0.76 0.00 0.00 0.00 175.10 174.96 2jj1 s LEU 335 N 1.96 4.05 -0.01 3.92 1.02 0.11 -0.40 118.68 129.32 2jj1 s LEU 335 Ca 0.20 0.43 -0.01 0.00 0.02 0.00 0.00 54.13 54.77 2jj1 s LEU 335 Cb -0.15 -3.28 0.01 0.00 0.02 0.00 0.00 46.19 42.78 2jj1 s LEU 335 CO 0.09 -0.27 0.03 -0.55 0.02 0.00 0.00 176.35 175.68 2jj1 s SER 336 N -3.97 -0.02 0.26 2.29 0.15 -0.39 -4.63 113.70 107.39 2jj1 s SER 336 Ca 0.40 0.06 0.03 0.00 0.70 0.00 0.00 55.95 57.14 2jj1 s SER 336 Cb -0.10 0.05 0.33 0.00 -1.71 0.00 0.00 66.02 64.59 2jj1 s SER 336 CO 0.35 -0.02 1.63 -0.09 1.20 0.00 0.00 173.24 176.31 2jj1 h ARG 337 N 6.23 0.35 -0.59 5.44 2.43 -1.96 -0.41 114.38 125.86 2jj1 h ARG 337 Ca -0.26 -0.18 -0.04 0.00 -0.81 0.00 0.00 59.98 58.69 2jj1 h ARG 337 Cb 1.20 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.73 2jj1 h ARG 337 CO 0.49 0.73 0.22 0.00 -1.51 0.00 0.00 179.97 179.91 2jj1 h ALA 338 N 1.24 1.29 0.01 2.80 0.00 -1.96 0.31 119.26 122.94 2jj1 h ALA 338 Ca 0.02 -0.16 -0.25 0.00 0.00 0.00 0.00 54.91 54.52 2jj1 h ALA 338 Cb 0.91 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.47 2jj1 h ALA 338 CO 0.08 0.52 -1.01 0.82 0.00 0.00 0.00 179.25 179.66 2jj1 h ILE 339 N 0.85 1.35 -0.16 0.00 2.04 -1.77 -3.22 117.51 116.59 2jj1 h ILE 339 Ca 0.20 -2.39 -0.11 0.00 1.00 0.00 0.00 64.86 63.56 2jj1 h ILE 339 Cb 0.18 2.44 -0.01 0.00 -0.74 0.00 0.00 36.82 38.69 2jj1 h ILE 339 CO -0.02 0.72 -0.39 0.00 0.00 0.00 0.00 178.15 178.47 2jj1 h ALA 340 N 0.58 1.03 0.00 1.87 0.00 -0.65 -2.73 119.26 119.36 2jj1 h ALA 340 Ca -0.11 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2jj1 h ALA 340 Cb 1.66 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2jj1 h ALA 340 CO 0.19 0.60 0.00 -1.91 0.00 0.00 0.00 179.25 178.13 2jj1 n GLU 341 N -4.04 0.16 0.00 0.00 2.13 0.10 -1.70 120.64 117.30 2jj1 n GLU 341 Ca -0.01 0.59 0.11 0.00 0.66 0.00 0.00 57.16 58.50 2jj1 n GLU 341 Cb 0.48 -1.95 0.04 0.00 0.27 0.00 0.00 31.44 30.28 2jj1 n GLU 341 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2jj1 n LEU 342 N -2.28 1.80 0.00 4.31 7.99 -1.04 -4.92 117.00 122.86 2jj1 n LEU 342 Ca -0.01 -0.66 0.00 0.00 -0.01 0.00 0.00 56.01 55.33 2jj1 n LEU 342 Cb 0.09 -0.02 0.00 0.00 -0.11 0.00 0.00 43.42 43.38 2jj1 n LEU 342 CO 0.13 0.34 0.00 0.61 -1.51 0.00 0.00 177.39 176.96 2jj1 n GLY 343 N 1.42 0.44 3.56 -0.72 0.00 -0.69 -5.01 105.19 104.18 2jj1 n GLY 343 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2jj1 n GLY 343 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jj1 s ILE 344 N -2.11 3.77 0.02 -0.61 -1.09 -1.13 -4.97 121.20 115.08 2jj1 s ILE 344 Ca 0.00 0.50 0.08 0.00 -2.23 0.00 0.00 60.65 59.00 2jj1 s ILE 344 Cb 0.00 -4.87 -0.02 0.00 -1.58 0.00 0.00 42.46 35.99 2jj1 s ILE 344 CO 0.00 -1.75 -0.24 -0.31 -1.23 0.00 0.00 174.94 171.41 2jj1 s TYR 345 N 5.65 2.08 0.31 3.97 1.51 -1.26 -2.59 117.35 127.02 2jj1 s TYR 345 Ca 0.37 -0.39 -0.29 0.00 -1.01 0.00 0.00 57.07 55.75 2jj1 s TYR 345 Cb -0.08 -1.28 -0.11 0.00 -0.11 0.00 0.00 41.96 40.38 2jj1 s TYR 345 CO 0.17 0.05 1.43 -1.25 -1.11 0.00 0.00 175.55 174.84 2jj1 s PRO 346 N -0.93 4.24 0.00 -1.71 0.04 -1.26 -1.50 135.00 133.87 2jj1 s PRO 346 Ca 0.09 2.38 -0.00 0.00 0.04 0.00 0.00 61.00 63.51 2jj1 s PRO 346 Cb -0.09 -3.05 -0.02 0.00 0.04 0.00 0.00 34.50 31.38 2jj1 s PRO 346 CO 0.01 -0.40 1.44 0.00 0.04 0.00 0.00 177.00 178.09 2jj1 n ALA 347 N 1.32 3.29 -1.99 8.56 0.00 -1.07 -4.80 120.51 125.82 2jj1 n ALA 347 Ca 0.03 -0.11 -0.42 0.00 0.00 0.00 0.00 53.44 52.94 2jj1 n ALA 347 Cb 0.40 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.40 2jj1 n ALA 347 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2jj1 s VAL 348 N 0.77 2.88 -0.43 0.00 1.01 -1.26 -1.26 120.40 122.10 2jj1 s VAL 348 Ca 0.04 0.67 -0.24 0.00 0.00 0.00 0.00 61.98 62.45 2jj1 s VAL 348 Cb 0.02 -3.43 0.02 0.00 0.00 0.00 0.00 36.38 32.99 2jj1 s VAL 348 CO 0.00 0.08 0.85 -0.62 0.00 0.00 0.00 175.10 175.40 2jj1 s ASP 349 N 0.79 6.49 0.12 3.32 -1.08 0.46 -4.89 116.67 121.89 2jj1 s ASP 349 Ca 0.64 0.13 0.24 0.00 -0.52 0.00 0.00 52.55 53.04 2jj1 s ASP 349 Cb -0.40 -2.42 0.94 0.00 -1.46 0.00 0.00 42.92 39.58 2jj1 s ASP 349 CO 0.35 -0.92 1.75 -0.81 0.52 0.00 0.00 175.17 176.07 2jj1 n PRO 350 N 6.82 0.13 -0.79 4.34 -0.04 -1.26 -2.51 135.00 141.68 2jj1 n PRO 350 Ca 0.04 0.20 0.02 0.00 -0.04 0.00 0.00 63.50 63.72 2jj1 n PRO 350 Cb 0.48 -1.68 0.30 0.00 -0.04 0.00 0.00 33.50 32.57 2jj1 n PRO 350 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2jj1 n LEU 351 N -1.90 5.13 -0.31 1.53 4.77 -1.26 -4.44 117.00 120.52 2jj1 n LEU 351 Ca 0.05 -3.15 0.00 0.00 -0.03 0.00 0.00 56.01 52.88 2jj1 n LEU 351 Cb 0.32 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 2jj1 n LEU 351 CO 0.24 0.77 0.15 -0.67 -1.33 0.00 0.00 177.39 176.56 2jj1 n ASP 352 N -0.20 0.00 -4.42 -1.43 2.03 -1.15 -5.10 116.55 106.28 2jj1 n ASP 352 Ca 0.31 -1.00 -0.33 0.00 0.52 0.00 0.00 54.79 54.29 2jj1 n ASP 352 Cb 1.16 -0.00 -0.14 0.00 -0.72 0.00 0.00 41.12 41.42 2jj1 n ASP 352 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2jj1 s SER 353 N -0.00 4.07 0.24 1.67 0.01 -1.05 -4.38 113.70 114.27 2jj1 s SER 353 Ca 0.00 -0.27 0.05 0.00 1.31 0.00 0.00 55.95 57.04 2jj1 s SER 353 Cb 0.00 -1.36 -0.05 0.00 0.21 0.00 0.00 66.02 64.82 2jj1 s SER 353 CO 0.00 0.23 -0.03 0.42 0.41 0.00 0.00 173.24 174.27 2jj1 s THR 354 N -0.04 1.27 -0.10 1.44 -4.23 -0.60 -4.73 115.64 108.65 2jj1 s THR 354 Ca -0.03 -2.07 -0.08 0.00 -1.18 0.00 0.00 61.69 58.34 2jj1 s THR 354 Cb -0.14 -2.36 0.03 0.00 1.34 0.00 0.00 72.50 71.37 2jj1 s THR 354 CO 0.04 -0.34 0.26 -0.55 -0.54 0.00 0.00 174.62 173.49 2jj1 s SER 355 N -3.35 -0.28 0.53 3.99 0.15 -1.26 -0.77 113.70 112.71 2jj1 s SER 355 Ca 0.28 0.53 0.17 0.00 0.70 0.00 0.00 55.95 57.64 2jj1 s SER 355 Cb 0.05 0.50 1.32 0.00 -1.71 0.00 0.00 66.02 66.18 2jj1 s SER 355 CO 0.09 -0.12 2.16 -0.09 1.20 0.00 0.00 173.24 176.48 2jj1 h ARG 356 N 6.23 0.00 -0.16 5.44 2.43 -1.24 -1.42 114.38 125.66 2jj1 h ARG 356 Ca -0.31 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.86 2jj1 h ARG 356 Cb 1.18 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 2jj1 h ARG 356 CO 0.35 0.00 0.00 0.44 -1.51 0.00 0.00 179.97 179.25 2jj1 n ILE 357 N -4.47 0.20 -2.56 1.20 -5.35 -1.26 -4.70 119.36 102.41 2jj1 n ILE 357 Ca -0.03 -0.37 -0.41 0.00 -0.27 0.00 0.00 62.75 61.67 2jj1 n ILE 357 Cb 0.10 0.47 -0.03 0.00 -1.74 0.00 0.00 39.64 38.44 2jj1 n ILE 357 CO 0.00 0.00 0.00 -0.32 -1.76 0.00 0.00 176.55 174.47 2jj1 s MET 358 N -1.80 3.64 -0.28 6.28 1.75 -0.54 -4.19 119.30 124.16 2jj1 s MET 358 Ca 0.34 -1.25 -0.21 0.00 -1.25 0.00 0.00 55.69 53.32 2jj1 s MET 358 Cb 0.18 -5.39 0.11 0.00 2.84 0.00 0.00 34.83 32.58 2jj1 s MET 358 CO 0.28 -2.24 0.87 0.34 -0.65 0.00 0.00 175.02 173.63 2jj1 s ASP 359 N 4.90 -0.64 0.31 1.11 3.68 -1.26 -4.98 116.67 119.78 2jj1 s ASP 359 Ca 0.48 1.13 0.02 0.00 2.13 0.00 0.00 52.55 56.30 2jj1 s ASP 359 Cb 0.01 1.20 0.51 0.00 -1.45 0.00 0.00 42.92 43.18 2jj1 s ASP 359 CO -0.07 -0.19 1.83 1.55 0.13 0.00 0.00 175.17 178.43 2jj1 h PRO 360 N 5.50 0.62 0.00 4.34 0.13 -1.88 0.67 132.00 141.38 2jj1 h PRO 360 Ca -0.29 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2jj1 h PRO 360 Cb 1.19 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2jj1 h PRO 360 CO 0.13 0.64 0.00 -0.91 -0.23 0.00 0.00 178.00 177.63 2jj1 h ASN 361 N 0.59 0.00 0.00 1.44 2.35 -1.95 0.16 115.58 118.17 2jj1 h ASN 361 Ca 0.12 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.76 2jj1 h ASN 361 Cb 0.37 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.72 2jj1 h ASN 361 CO 0.01 0.00 -1.14 -0.38 -1.65 0.00 0.00 177.43 174.27 2jj1 n ILE 362 N -2.37 0.95 1.23 2.81 5.41 -0.53 -4.74 119.36 122.11 2jj1 n ILE 362 Ca -0.01 0.03 0.13 0.00 1.00 0.00 0.00 62.75 63.90 2jj1 n ILE 362 Cb 0.08 -1.77 0.29 0.00 -0.71 0.00 0.00 39.64 37.53 2jj1 n ILE 362 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 2jj1 n VAL 363 N -3.69 0.00 0.00 1.39 0.24 0.12 -4.99 118.33 111.39 2jj1 n VAL 363 Ca -0.16 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 2jj1 n VAL 363 Cb 0.48 0.90 0.00 0.00 -1.47 0.00 0.00 33.84 33.74 2jj1 n VAL 363 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2jj1 n GLY 364 N 1.30 -0.76 0.23 7.63 0.00 0.56 -4.30 105.19 109.84 2jj1 n GLY 364 Ca 0.15 -1.65 -0.07 0.00 0.00 0.00 0.00 46.02 44.44 2jj1 n GLY 364 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jj1 h SER 365 N 0.00 0.60 -0.23 1.61 4.64 -1.92 -2.58 113.55 115.66 2jj1 h SER 365 Ca 0.00 -0.26 -0.09 0.00 -0.47 0.00 0.00 61.79 60.97 2jj1 h SER 365 Cb 0.00 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 61.92 2jj1 h SER 365 CO 0.00 0.93 -0.20 -0.08 -0.87 0.00 0.00 176.83 176.61 2jj1 h GLU 366 N 0.47 0.55 0.10 4.77 4.81 -1.94 -1.58 114.58 121.75 2jj1 h GLU 366 Ca 0.04 -0.28 -0.00 0.00 -0.13 0.00 0.00 59.36 58.99 2jj1 h GLU 366 Cb 0.89 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.28 2jj1 h GLU 366 CO 0.08 0.86 -0.05 1.25 -0.73 0.00 0.00 179.01 180.42 2jj1 h HIS 367 N 0.25 -0.12 0.06 0.92 2.76 -1.75 -2.77 115.15 114.51 2jj1 h HIS 367 Ca 0.04 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.23 2jj1 h HIS 367 Cb 0.74 0.04 -0.05 0.00 1.55 0.00 0.00 27.41 29.70 2jj1 h HIS 367 CO 0.07 0.15 -0.36 -0.92 -1.30 0.00 0.00 177.93 175.58 2jj1 h TYR 368 N -0.39 -0.99 -0.87 5.26 3.20 -1.48 -2.15 116.97 119.56 2jj1 h TYR 368 Ca -0.01 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.90 2jj1 h TYR 368 Cb 0.32 0.43 -0.04 0.00 1.54 0.00 0.00 36.73 38.97 2jj1 h TYR 368 CO 0.01 -0.45 0.57 -0.44 -1.64 0.00 0.00 178.16 176.21 2jj1 h ASP 369 N -0.55 0.98 0.44 -2.11 3.32 -1.33 -0.90 116.42 116.27 2jj1 h ASP 369 Ca 0.04 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 2jj1 h ASP 369 Cb 0.61 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.92 2jj1 h ASP 369 CO -0.24 0.70 -0.21 0.58 -1.72 0.00 0.00 179.24 178.35 2jj1 h VAL 370 N 1.16 0.57 -0.14 -1.35 2.07 -1.36 -0.67 116.25 116.53 2jj1 h VAL 370 Ca 0.32 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.82 2jj1 h VAL 370 Cb -0.11 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 2jj1 h VAL 370 CO -0.08 0.01 -0.16 0.00 0.02 0.00 0.00 177.57 177.35 2jj1 h ALA 371 N -0.05 -0.41 -0.88 1.67 0.00 -1.09 0.16 119.26 118.66 2jj1 h ALA 371 Ca -0.06 0.00 0.23 0.00 0.00 0.00 0.00 54.91 55.08 2jj1 h ALA 371 Cb 0.46 0.86 -0.05 0.00 0.00 0.00 0.00 17.79 19.06 2jj1 h ALA 371 CO 0.10 -0.49 0.60 0.00 0.00 0.00 0.00 179.25 179.46 2jj1 h ARG 372 N -0.11 0.19 -0.04 0.00 2.47 -1.12 0.33 114.38 116.10 2jj1 h ARG 372 Ca 0.02 -0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 58.73 2jj1 h ARG 372 Cb 0.17 -0.04 -0.00 0.00 -1.65 0.00 0.00 29.97 28.44 2jj1 h ARG 372 CO -0.18 0.13 0.00 0.78 0.56 0.00 0.00 179.97 181.26 2jj1 h GLY 373 N 0.20 0.08 0.42 0.04 0.00 -0.23 0.74 103.07 104.31 2jj1 h GLY 373 Ca 0.44 -0.05 0.10 0.00 0.00 0.00 0.00 47.33 47.81 2jj1 h GLY 373 CO -0.09 0.05 0.30 -2.08 0.00 0.00 0.00 176.54 174.71 2jj1 h VAL 374 N -0.21 0.80 -0.40 4.60 2.07 0.25 -1.32 116.25 122.03 2jj1 h VAL 374 Ca 0.01 -0.18 -0.12 0.00 0.82 0.00 0.00 66.70 67.23 2jj1 h VAL 374 Cb 0.31 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2jj1 h VAL 374 CO 0.00 0.09 -0.24 1.56 0.02 0.00 0.00 177.57 179.01 2jj1 h GLN 375 N 0.51 0.82 0.76 1.57 4.20 -1.05 -2.32 115.11 119.61 2jj1 h GLN 375 Ca 0.34 -0.34 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 2jj1 h GLN 375 Cb 0.39 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.14 2jj1 h GLN 375 CO -0.29 0.97 -0.40 -0.22 -0.67 0.00 0.00 178.83 178.21 2jj1 h LYS 376 N 0.71 -1.03 0.00 1.46 3.64 -0.02 -0.41 116.57 120.91 2jj1 h LYS 376 Ca 0.09 0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 2jj1 h LYS 376 Cb 0.77 0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.82 2jj1 h LYS 376 CO 0.06 -0.69 -0.17 0.97 -2.27 0.00 0.00 179.45 177.36 2jj1 h ILE 377 N -1.07 0.83 -0.07 2.00 2.10 -1.31 -0.23 117.51 119.76 2jj1 h ILE 377 Ca -0.10 -0.64 -0.14 0.00 1.08 0.00 0.00 64.86 65.06 2jj1 h ILE 377 Cb 0.84 1.38 0.01 0.00 -1.09 0.00 0.00 36.82 37.95 2jj1 h ILE 377 CO 0.14 0.16 -0.49 -0.07 -1.08 0.00 0.00 178.15 176.82 2jj1 h LEU 378 N 0.00 0.55 -0.61 2.19 3.38 -1.30 -2.29 115.31 117.22 2jj1 h LEU 378 Ca -0.00 -0.67 -0.14 0.00 0.09 0.00 0.00 57.88 57.15 2jj1 h LEU 378 Cb 0.36 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2jj1 h LEU 378 CO 0.02 1.14 -0.48 -0.61 0.09 0.00 0.00 178.44 178.60 2jj1 h GLN 379 N 0.00 0.53 -0.28 1.13 5.75 -0.67 -1.42 115.11 120.14 2jj1 h GLN 379 Ca -0.04 -0.30 -0.01 0.00 -0.15 0.00 0.00 58.65 58.15 2jj1 h GLN 379 Cb 1.15 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.71 2jj1 h GLN 379 CO 0.10 0.89 0.15 -0.44 -2.65 0.00 0.00 178.83 176.88 2jj1 h ASP 380 N 0.42 0.35 -0.46 -0.69 3.32 -1.11 -2.60 116.42 115.64 2jj1 h ASP 380 Ca 0.02 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 2jj1 h ASP 380 Cb 1.00 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.44 2jj1 h ASP 380 CO 0.09 0.34 0.27 0.22 -1.72 0.00 0.00 179.24 178.45 2jj1 h TYR 381 N 0.33 0.61 -0.85 4.55 3.20 -1.21 -2.49 116.97 121.11 2jj1 h TYR 381 Ca 0.10 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.06 2jj1 h TYR 381 Cb 0.07 -0.20 -0.08 0.00 1.54 0.00 0.00 36.73 38.07 2jj1 h TYR 381 CO -0.03 0.43 0.49 -0.22 -1.64 0.00 0.00 178.16 177.19 2jj1 h LYS 382 N 0.61 0.79 0.00 1.82 3.64 -1.15 0.22 116.57 122.50 2jj1 h LYS 382 Ca 0.16 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2jj1 h LYS 382 Cb 0.00 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.65 2jj1 h LYS 382 CO -0.03 0.52 0.00 0.77 -2.27 0.00 0.00 179.45 178.44 2jj1 h SER 383 N 0.81 0.00 0.89 4.20 0.02 -1.08 -2.83 113.55 115.56 2jj1 h SER 383 Ca 0.41 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.34 2jj1 h SER 383 Cb 0.39 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.93 2jj1 h SER 383 CO -0.25 0.00 -1.12 0.18 -1.14 0.00 0.00 176.83 174.49 2jj1 n LEU 384 N -2.64 0.80 0.00 5.07 4.77 -0.10 -4.57 117.00 120.33 2jj1 n LEU 384 Ca 0.03 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 2jj1 n LEU 384 Cb 0.34 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 2jj1 n LEU 384 CO 0.26 -0.13 0.34 0.00 -1.33 0.00 0.00 177.39 176.53 2jj1 n GLN 385 N -2.68 0.00 -0.05 3.23 6.02 -0.24 -0.67 117.38 122.99 2jj1 n GLN 385 Ca -0.02 0.47 0.25 0.00 -0.01 0.00 0.00 57.00 57.70 2jj1 n GLN 385 Cb 0.59 -1.17 0.69 0.00 1.02 0.00 0.00 30.24 31.37 2jj1 n GLN 385 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 2jj1 h ASP 386 N 0.00 0.00 0.02 1.08 3.32 -1.84 -1.47 116.42 117.54 2jj1 h ASP 386 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2jj1 h ASP 386 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2jj1 h ASP 386 CO 0.00 0.00 -0.01 0.40 -1.72 0.00 0.00 179.24 177.91 2jj1 h ILE 387 N 0.00 1.18 0.00 0.35 2.04 -1.66 -3.34 117.51 116.07 2jj1 h ILE 387 Ca 0.33 -1.77 0.00 0.00 1.00 0.00 0.00 64.86 64.41 2jj1 h ILE 387 Cb 1.66 2.19 0.00 0.00 -0.74 0.00 0.00 36.82 39.93 2jj1 h ILE 387 CO -0.00 0.38 -0.06 2.30 0.00 0.00 0.00 178.15 180.77 2jj1 n ILE 388 N -4.71 0.28 0.23 -0.67 -5.35 0.16 -1.84 119.36 107.45 2jj1 n ILE 388 Ca -0.07 -0.14 0.06 0.00 -0.27 0.00 0.00 62.75 62.33 2jj1 n ILE 388 Cb 0.32 -0.48 0.54 0.00 -1.74 0.00 0.00 39.64 38.28 2jj1 n ILE 388 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jj1 h ALA 389 N 2.77 1.79 0.00 -1.28 0.00 -1.40 -2.64 119.26 118.50 2jj1 h ALA 389 Ca 0.00 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.65 2jj1 h ALA 389 Cb 0.62 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2jj1 h ALA 389 CO 0.00 0.16 -1.55 -0.89 0.00 0.00 0.00 179.25 176.97 2jj1 n ILE 390 N -4.39 0.55 1.45 0.00 5.41 -1.21 -4.67 119.36 116.50 2jj1 n ILE 390 Ca -0.03 -0.24 0.05 0.00 1.00 0.00 0.00 62.75 63.53 2jj1 n ILE 390 Cb 0.20 -0.83 0.18 0.00 -0.71 0.00 0.00 39.64 38.48 2jj1 n ILE 390 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2jj1 n LEU 391 N -2.66 0.97 -0.15 1.39 4.77 -0.77 -5.02 117.00 115.53 2jj1 n LEU 391 Ca -0.16 -0.47 0.00 0.00 -0.03 0.00 0.00 56.01 55.35 2jj1 n LEU 391 Cb 0.70 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 2jj1 n LEU 391 CO 0.11 0.23 -0.05 0.61 -1.33 0.00 0.00 177.39 176.97 2jj1 n GLY 392 N 0.84 -2.99 0.22 -0.72 0.00 -0.99 -4.72 105.19 96.83 2jj1 n GLY 392 Ca 0.09 -1.21 -0.14 0.00 0.00 0.00 0.00 46.02 44.75 2jj1 n GLY 392 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2jj1 h MET 393 N 0.07 0.73 0.00 1.61 4.05 -1.96 -3.35 114.93 116.08 2jj1 h MET 393 Ca 0.00 -0.53 0.00 0.00 -0.28 0.00 0.00 59.70 58.89 2jj1 h MET 393 Cb 0.06 0.09 0.00 0.00 -0.80 0.00 0.00 31.60 30.95 2jj1 h MET 393 CO 0.00 1.15 0.00 -0.44 0.23 0.00 0.00 176.91 177.85 2jj1 h ASP 394 N 0.53 0.00 0.52 1.39 5.19 -1.95 -2.90 116.42 119.20 2jj1 h ASP 394 Ca -0.02 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 2jj1 h ASP 394 Cb 1.27 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.78 2jj1 h ASP 394 CO 0.13 0.00 0.00 -0.62 -3.12 0.00 0.00 179.24 175.63 2jj1 n GLU 395 N -2.76 0.07 -2.71 3.56 -0.58 -1.26 -4.86 120.64 112.10 2jj1 n GLU 395 Ca 0.01 0.18 -0.33 0.00 -0.42 0.00 0.00 57.16 56.60 2jj1 n GLU 395 Cb 0.27 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.58 2jj1 n GLU 395 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2jj1 s LEU 396 N -2.88 3.88 0.39 -4.62 1.43 -1.10 -5.03 118.68 110.75 2jj1 s LEU 396 Ca 0.11 1.72 -0.27 0.00 -1.03 0.00 0.00 54.13 54.65 2jj1 s LEU 396 Cb 0.11 -4.54 -0.10 0.00 0.03 0.00 0.00 46.19 41.70 2jj1 s LEU 396 CO 0.30 -0.47 1.39 -0.55 0.23 0.00 0.00 176.35 177.24 2jj1 s SER 397 N -2.27 6.30 0.07 2.29 0.15 -1.26 -4.84 113.70 114.14 2jj1 s SER 397 Ca 0.63 2.84 0.09 0.00 0.70 0.00 0.00 55.95 60.21 2jj1 s SER 397 Cb -0.10 -2.65 0.42 0.00 -1.71 0.00 0.00 66.02 61.97 2jj1 s SER 397 CO 0.17 -0.88 1.28 -0.62 1.20 0.00 0.00 173.24 174.39 2jj1 n GLU 398 N 0.27 0.04 -0.04 5.44 -0.58 -1.26 -0.70 120.64 123.80 2jj1 n GLU 398 Ca 0.03 0.44 -0.13 0.00 -0.42 0.00 0.00 57.16 57.07 2jj1 n GLU 398 Cb 0.42 -1.59 -0.14 0.00 -0.57 0.00 0.00 31.44 29.55 2jj1 n GLU 398 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2jj1 n GLU 399 N -1.67 0.68 -0.00 3.49 1.02 -1.26 -3.72 120.64 119.18 2jj1 n GLU 399 Ca 0.01 0.22 -0.14 0.00 -0.02 0.00 0.00 57.16 57.23 2jj1 n GLU 399 Cb 0.07 -1.69 -0.02 0.00 -0.02 0.00 0.00 31.44 29.78 2jj1 n GLU 399 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2jj1 h ASP 400 N 0.02 0.77 0.60 1.62 5.19 -1.54 -2.96 116.42 120.12 2jj1 h ASP 400 Ca -0.40 -0.49 0.00 0.00 -0.62 0.00 0.00 57.03 55.52 2jj1 h ASP 400 Cb 2.05 -0.23 0.00 0.00 0.18 0.00 0.00 39.33 41.33 2jj1 h ASP 400 CO 0.05 1.26 0.00 2.29 -3.12 0.00 0.00 179.24 179.72 2jj1 n LYS 401 N -3.91 0.36 0.02 3.56 2.85 0.12 -2.04 118.16 119.12 2jj1 n LYS 401 Ca -0.06 0.01 -0.19 0.00 -1.05 0.00 0.00 58.31 57.02 2jj1 n LYS 401 Cb 0.71 -1.50 -0.14 0.00 -0.65 0.00 0.00 35.03 33.45 2jj1 n LYS 401 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 2jj1 h LEU 402 N 0.00 0.37 -2.45 -5.58 5.85 -1.63 -3.15 115.31 108.72 2jj1 h LEU 402 Ca 0.00 -0.93 -0.00 0.00 0.84 0.00 0.00 57.88 57.78 2jj1 h LEU 402 Cb 0.30 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 2jj1 h LEU 402 CO 0.00 1.37 -0.02 0.71 -0.34 0.00 0.00 178.44 180.17 2jj1 h THR 403 N -0.47 0.13 0.08 1.05 1.35 -1.29 0.12 112.91 113.87 2jj1 h THR 403 Ca -0.15 -0.19 -0.00 0.00 -0.55 0.00 0.00 66.41 65.51 2jj1 h THR 403 Cb 1.56 1.16 0.00 0.00 -1.73 0.00 0.00 68.15 69.14 2jj1 h THR 403 CO 0.11 0.02 -0.04 0.58 -0.25 0.00 0.00 175.52 175.93 2jj1 h VAL 404 N 0.00 1.19 0.00 6.82 2.07 -1.52 -2.38 116.25 122.43 2jj1 h VAL 404 Ca -0.00 -1.13 -0.09 0.00 0.82 0.00 0.00 66.70 66.29 2jj1 h VAL 404 Cb 0.16 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 2jj1 h VAL 404 CO 0.00 0.27 -0.45 0.77 0.02 0.00 0.00 177.57 178.19 2jj1 h SER 405 N -0.64 0.00 0.04 0.57 4.64 -1.30 -2.60 113.55 114.26 2jj1 h SER 405 Ca -0.01 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.04 2jj1 h SER 405 Cb 0.53 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.64 2jj1 h SER 405 CO 0.02 0.45 -1.08 0.03 -0.87 0.00 0.00 176.83 175.37 2jj1 h ARG 406 N 0.00 0.68 -0.58 4.77 3.08 -0.88 -2.95 114.38 118.51 2jj1 h ARG 406 Ca -0.00 -0.76 -0.10 0.00 0.07 0.00 0.00 59.98 59.19 2jj1 h ARG 406 Cb 0.84 0.22 -0.02 0.00 0.08 0.00 0.00 29.97 31.09 2jj1 h ARG 406 CO 0.06 1.33 -0.02 0.00 -1.07 0.00 0.00 179.97 180.27 2jj1 h ALA 407 N 0.40 0.78 0.00 0.04 0.00 -1.44 -1.53 119.26 117.51 2jj1 h ALA 407 Ca -0.14 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 2jj1 h ALA 407 Cb 1.73 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 19.31 2jj1 h ALA 407 CO 0.21 0.63 -0.07 0.00 0.00 0.00 0.00 179.25 180.02 2jj1 h ARG 408 N 0.92 0.00 0.15 0.00 3.08 -1.52 -0.40 114.38 116.61 2jj1 h ARG 408 Ca 0.16 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.89 2jj1 h ARG 408 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.62 2jj1 h ARG 408 CO 0.03 0.07 -1.61 0.87 -1.07 0.00 0.00 179.97 178.27 2jj1 h LYS 409 N 0.00 0.31 -0.58 0.04 1.57 -1.35 -3.31 116.57 113.26 2jj1 h LYS 409 Ca -0.00 -0.54 -0.00 0.00 -1.87 0.00 0.00 60.65 58.24 2jj1 h LYS 409 Cb 0.43 0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.91 2jj1 h LYS 409 CO 0.01 1.26 0.34 0.82 -0.57 0.00 0.00 179.45 181.31 2jj1 h ILE 410 N -0.09 1.17 -0.68 1.86 2.04 -1.01 0.27 117.51 121.07 2jj1 h ILE 410 Ca -0.33 -0.38 0.06 0.00 1.00 0.00 0.00 64.86 65.22 2jj1 h ILE 410 Cb 1.93 0.36 -0.06 0.00 -0.74 0.00 0.00 36.82 38.31 2jj1 h ILE 410 CO 0.11 0.18 0.37 1.56 0.00 0.00 0.00 178.15 180.37 2jj1 h GLN 411 N 0.80 0.66 0.00 2.37 4.20 -1.23 -1.40 115.11 120.52 2jj1 h GLN 411 Ca 0.21 -0.04 -0.25 0.00 0.06 0.00 0.00 58.65 58.63 2jj1 h GLN 411 Cb -0.02 -0.15 0.01 0.00 0.30 0.00 0.00 27.48 27.62 2jj1 h GLN 411 CO -0.04 0.44 -1.00 0.00 -0.67 0.00 0.00 178.83 177.56 2jj1 h ARG 412 N 0.68 0.58 0.00 1.46 3.08 -1.42 -2.59 114.38 116.17 2jj1 h ARG 412 Ca 0.31 -0.62 0.00 0.00 0.07 0.00 0.00 59.98 59.73 2jj1 h ARG 412 Cb 0.21 0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.43 2jj1 h ARG 412 CO -0.19 1.24 0.00 0.34 -1.07 0.00 0.00 179.97 180.28 2jj1 n PHE 413 N -3.81 0.00 0.07 3.04 7.35 0.00 -1.37 117.46 122.75 2jj1 n PHE 413 Ca -0.09 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.50 2jj1 n PHE 413 Cb 0.86 -0.47 -0.13 0.00 0.35 0.00 0.00 39.48 40.10 2jj1 n PHE 413 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2jj1 h LEU 414 N 0.00 0.14-10.21 -2.13 3.38 -0.85 -3.45 115.31 102.20 2jj1 h LEU 414 Ca 0.00 -0.16 -0.52 0.00 0.09 0.00 0.00 57.88 57.29 2jj1 h LEU 414 Cb 0.22 -0.05 0.14 0.00 0.09 0.00 0.00 40.66 41.07 2jj1 h LEU 414 CO 0.00 1.12 0.36 -0.94 0.09 0.00 0.00 178.44 179.07 2jj1 s SER 415 N -6.84 4.35 -0.28 -0.43 1.04 -0.47 -4.33 113.70 106.74 2jj1 s SER 415 Ca -0.01 2.17 -0.18 0.00 0.48 0.00 0.00 55.95 58.41 2jj1 s SER 415 Cb 0.09 -2.57 0.12 0.00 0.10 0.00 0.00 66.02 63.76 2jj1 s SER 415 CO 0.84 -2.15 0.88 -1.58 0.98 0.00 0.00 173.24 172.22 2jj1 s GLN 416 N -4.15 0.53 0.20 4.02 0.74 -0.56 -4.44 119.66 116.00 2jj1 s GLN 416 Ca 0.70 0.84 -0.30 0.00 0.05 0.00 0.00 55.36 56.64 2jj1 s GLN 416 Cb -0.24 0.15 -0.09 0.00 1.10 0.00 0.00 33.01 33.92 2jj1 s GLN 416 CO 0.47 -0.10 1.40 -1.25 -0.55 0.00 0.00 175.29 175.26 2jj1 s PRO 417 N 1.16 4.31 -0.07 1.67 0.04 -1.26 -4.24 135.00 136.62 2jj1 s PRO 417 Ca -0.07 2.19 -0.07 0.00 0.04 0.00 0.00 61.00 63.10 2jj1 s PRO 417 Cb -0.04 -3.16 -0.04 0.00 0.04 0.00 0.00 34.50 31.29 2jj1 s PRO 417 CO -0.14 -0.38 0.19 -0.06 0.04 0.00 0.00 177.00 176.65 2jj1 s PHE 418 N 0.31 3.59 0.32 0.56 2.99 -1.26 -2.55 117.98 121.94 2jj1 s PHE 418 Ca 0.60 0.53 0.03 0.00 0.00 0.00 0.00 56.93 58.10 2jj1 s PHE 418 Cb -0.40 -1.95 0.63 0.00 0.00 0.00 0.00 43.02 41.30 2jj1 s PHE 418 CO 0.38 0.69 1.92 0.37 -0.00 0.00 0.00 175.22 178.58 2jj1 h GLN 419 N 4.54 0.88 -0.00 0.44 4.15 -1.88 -1.96 115.11 121.28 2jj1 h GLN 419 Ca -0.53 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 58.84 2jj1 h GLN 419 Cb 1.21 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 28.71 2jj1 h GLN 419 CO 0.62 0.58 -0.02 1.33 -1.93 0.00 0.00 178.83 179.42 2jj1 n VAL 420 N -4.50 0.00 -1.32 2.39 0.24 -1.26 -3.58 118.33 110.30 2jj1 n VAL 420 Ca 0.14 -0.00 0.03 0.00 -2.04 0.00 0.00 64.34 62.46 2jj1 n VAL 420 Cb 0.25 -0.47 0.20 0.00 -1.47 0.00 0.00 33.84 32.35 2jj1 n VAL 420 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jj1 n ALA 421 N -1.46 3.57 0.01 2.33 0.00 -0.74 -4.66 120.51 119.55 2jj1 n ALA 421 Ca 0.08 -2.91 0.03 0.00 0.00 0.00 0.00 53.44 50.64 2jj1 n ALA 421 Cb 0.32 -0.60 0.41 0.00 0.00 0.00 0.00 19.45 19.58 2jj1 n ALA 421 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2jj1 h GLU 422 N 1.00 0.53 0.00 0.00 5.08 -1.59 -1.68 114.58 117.91 2jj1 h GLU 422 Ca 0.10 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2jj1 h GLU 422 Cb 1.38 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2jj1 h GLU 422 CO 0.22 0.38 0.00 1.33 -1.00 0.00 0.00 179.01 179.94 2jj1 n VAL 423 N -4.44 0.63 -0.02 3.13 0.24 -1.26 -2.57 118.33 114.02 2jj1 n VAL 423 Ca 0.03 0.16 0.00 0.00 -2.04 0.00 0.00 64.34 62.49 2jj1 n VAL 423 Cb 0.09 -0.88 -0.07 0.00 -1.47 0.00 0.00 33.84 31.51 2jj1 n VAL 423 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 2jj1 n PHE 424 N -1.35 0.00 -0.09 6.34 0.99 -0.67 -4.81 117.46 117.86 2jj1 n PHE 424 Ca 0.07 0.00 -0.13 0.00 -0.00 0.00 0.00 57.45 57.39 2jj1 n PHE 424 Cb 0.15 -0.33 -0.09 0.00 -1.00 0.00 0.00 39.48 38.21 2jj1 n PHE 424 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 2jj1 n THR 425 N -2.09 1.10 -0.01 4.37 -2.24 -0.94 -4.97 114.28 109.50 2jj1 n THR 425 Ca -0.08 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 2jj1 n THR 425 Cb 0.52 -1.13 0.00 0.00 -2.10 0.00 0.00 70.33 67.62 2jj1 n THR 425 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jj1 n GLY 426 N 2.54 2.26 3.88 3.38 0.00 -1.06 -5.03 105.19 111.16 2jj1 n GLY 426 Ca -0.33 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.36 2jj1 n GLY 426 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2jj1 s HIS 427 N -2.76 3.51 0.27 1.61 3.76 -1.26 -5.08 115.29 115.33 2jj1 s HIS 427 Ca 0.00 0.71 -0.29 0.00 -0.15 0.00 0.00 55.06 55.33 2jj1 s HIS 427 Cb 0.00 -2.12 -0.09 0.00 1.11 0.00 0.00 32.58 31.48 2jj1 s HIS 427 CO 0.00 0.43 1.13 -1.17 -0.85 0.00 0.00 174.74 174.28 2jj1 s LEU 428 N -2.41 4.53 0.33 0.89 2.96 -1.26 -4.59 118.68 119.13 2jj1 s LEU 428 Ca 0.39 2.30 -0.29 0.00 -0.22 0.00 0.00 54.13 56.31 2jj1 s LEU 428 Cb -0.13 -3.63 -0.11 0.00 0.50 0.00 0.00 46.19 42.82 2jj1 s LEU 428 CO 0.21 -0.21 1.55 0.61 -1.32 0.00 0.00 176.35 177.20 2jj1 n GLY 429 N 1.29 1.28 3.04 7.98 0.00 -1.26 -4.78 105.19 112.74 2jj1 n GLY 429 Ca -0.00 0.41 -0.23 0.00 0.00 0.00 0.00 46.02 46.20 2jj1 n GLY 429 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jj1 s LYS 430 N -1.11 1.30 -0.21 1.61 -0.14 -1.06 -4.82 119.74 115.32 2jj1 s LYS 430 Ca 0.60 -0.40 -0.03 0.00 -1.36 0.00 0.00 55.97 54.78 2jj1 s LYS 430 Cb -0.49 -1.16 -0.00 0.00 -1.68 0.00 0.00 37.83 34.50 2jj1 s LYS 430 CO 0.54 0.13 -0.08 -1.17 -0.76 0.00 0.00 175.35 174.02 2jj1 s LEU 431 N 0.24 2.76 -0.34 3.17 0.20 -1.26 -4.78 118.68 118.66 2jj1 s LEU 431 Ca -0.05 -0.43 -0.11 0.00 0.69 0.00 0.00 54.13 54.24 2jj1 s LEU 431 Cb -0.11 -1.69 0.00 0.00 -0.43 0.00 0.00 46.19 43.97 2jj1 s LEU 431 CO 0.01 0.00 0.19 -0.69 -0.29 0.00 0.00 176.35 175.57 2jj1 s VAL 432 N 1.35 4.72 0.79 1.68 1.01 -0.41 -4.93 120.40 124.61 2jj1 s VAL 432 Ca 0.04 -0.52 -0.15 0.00 0.00 0.00 0.00 61.98 61.35 2jj1 s VAL 432 Cb -0.14 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 2jj1 s VAL 432 CO -0.04 -0.04 0.58 -2.65 0.00 0.00 0.00 175.10 172.94 2jj1 n PRO 433 N 5.01 0.16 -0.03 2.72 -0.02 -1.26 -4.15 135.00 137.43 2jj1 n PRO 433 Ca -0.13 0.10 -0.11 0.00 -2.02 0.00 0.00 63.50 61.34 2jj1 n PRO 433 Cb 0.48 -1.91 -0.06 0.00 -0.02 0.00 0.00 33.50 32.00 2jj1 n PRO 433 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2jj1 h LEU 434 N -0.71 0.19 -0.93 2.45 5.85 -1.98 -2.55 115.31 117.63 2jj1 h LEU 434 Ca -0.45 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.09 2jj1 h LEU 434 Cb 1.33 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 42.25 2jj1 h LEU 434 CO 0.41 0.35 0.61 0.11 -0.34 0.00 0.00 178.44 179.58 2jj1 h LYS 435 N 0.03 1.16 0.00 1.25 1.79 -2.00 -1.51 116.57 117.29 2jj1 h LYS 435 Ca 0.04 -0.07 -0.04 0.00 -2.18 0.00 0.00 60.65 58.40 2jj1 h LYS 435 Cb 0.23 -0.26 -0.01 0.00 -1.58 0.00 0.00 32.23 30.61 2jj1 h LYS 435 CO -0.00 0.77 -0.20 1.49 -1.08 0.00 0.00 179.45 180.43 2jj1 h GLU 436 N 1.20 0.00 -0.10 3.15 4.57 -1.90 -0.88 114.58 120.62 2jj1 h GLU 436 Ca 0.36 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.42 2jj1 h GLU 436 Cb -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.56 2jj1 h GLU 436 CO -0.11 0.20 -0.41 1.15 -1.18 0.00 0.00 179.01 178.66 2jj1 h THR 437 N 0.00 1.38 -0.23 0.32 2.02 -0.87 -2.03 112.91 113.50 2jj1 h THR 437 Ca -0.00 -1.75 0.00 0.00 0.77 0.00 0.00 66.41 65.43 2jj1 h THR 437 Cb 0.47 2.20 -0.01 0.00 -1.74 0.00 0.00 68.15 69.07 2jj1 h THR 437 CO 0.03 0.52 0.15 0.40 0.37 0.00 0.00 175.52 176.98 2jj1 h ILE 438 N 0.03 1.05 -0.43 3.11 2.04 -1.02 -2.57 117.51 119.72 2jj1 h ILE 438 Ca -0.02 -0.10 -0.05 0.00 1.00 0.00 0.00 64.86 65.69 2jj1 h ILE 438 Cb 1.05 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 2jj1 h ILE 438 CO 0.09 0.05 0.09 0.50 0.00 0.00 0.00 178.15 178.88 2jj1 h LYS 439 N 0.30 0.70 -0.09 2.37 3.64 -1.24 -0.02 116.57 122.23 2jj1 h LYS 439 Ca 0.08 -0.18 0.04 0.00 -1.27 0.00 0.00 60.65 59.32 2jj1 h LYS 439 Cb -0.03 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 31.65 2jj1 h LYS 439 CO -0.02 0.72 -0.23 0.78 -2.27 0.00 0.00 179.45 178.44 2jj1 h GLY 440 N 0.57 -0.25 1.01 5.01 0.00 -1.26 -0.95 103.07 107.19 2jj1 h GLY 440 Ca 0.13 0.27 -0.11 0.00 0.00 0.00 0.00 47.33 47.62 2jj1 h GLY 440 CO 0.01 -0.19 -0.21 0.74 0.00 0.00 0.00 176.54 176.88 2jj1 h PHE 441 N -0.31 0.93 -0.75 5.60 -1.00 -1.39 -2.37 116.94 117.66 2jj1 h PHE 441 Ca 0.09 -0.24 0.17 0.00 2.81 0.00 0.00 57.97 60.80 2jj1 h PHE 441 Cb 0.43 -0.21 -0.12 0.00 3.61 0.00 0.00 35.95 39.66 2jj1 h PHE 441 CO -0.31 1.00 0.07 0.37 -1.61 0.00 0.00 178.31 177.82 2jj1 h GLN 442 N 0.60 0.15 -0.36 1.51 4.15 -0.87 -1.04 115.11 119.25 2jj1 h GLN 442 Ca 0.08 -0.01 -0.15 0.00 0.77 0.00 0.00 58.65 59.34 2jj1 h GLN 442 Cb 0.77 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.42 2jj1 h GLN 442 CO 0.06 0.10 -0.37 1.96 -1.93 0.00 0.00 178.83 178.65 2jj1 h GLN 443 N 0.15 0.83 -0.45 1.69 4.20 -0.90 -1.73 115.11 118.91 2jj1 h GLN 443 Ca 0.42 -0.42 -0.14 0.00 0.06 0.00 0.00 58.65 58.57 2jj1 h GLN 443 Cb 0.74 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.51 2jj1 h GLN 443 CO -0.61 1.06 -0.27 0.82 -0.67 0.00 0.00 178.83 179.16 2jj1 h ILE 444 N 0.69 1.27 -0.49 2.54 2.04 -0.93 -2.46 117.51 120.16 2jj1 h ILE 444 Ca 0.06 -1.43 -0.08 0.00 1.00 0.00 0.00 64.86 64.42 2jj1 h ILE 444 Cb 0.93 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 38.19 2jj1 h ILE 444 CO 0.09 0.49 0.00 -0.07 0.00 0.00 0.00 178.15 178.65 2jj1 h LEU 445 N 0.81 0.79 -0.99 1.44 3.38 -1.10 -2.66 115.31 116.98 2jj1 h LEU 445 Ca 0.09 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2jj1 h LEU 445 Cb 0.84 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2jj1 h LEU 445 CO 0.07 0.86 0.00 0.00 0.09 0.00 0.00 178.44 179.46 2jj1 h ALA 446 N 1.23 1.00 0.00 1.53 0.00 -1.18 -3.47 119.26 118.38 2jj1 h ALA 446 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2jj1 h ALA 446 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2jj1 h ALA 446 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 2jj1 n GLY 447 N 0.03 0.73 0.00 0.00 0.00 -1.00 -4.97 105.19 99.97 2jj1 n GLY 447 Ca 0.02 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.05 2jj1 n GLY 447 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jj1 n GLU 448 N -2.04 0.03 -0.30 1.61 1.02 -0.95 -2.75 120.64 117.26 2jj1 n GLU 448 Ca 0.00 0.30 0.03 0.00 -0.02 0.00 0.00 57.16 57.46 2jj1 n GLU 448 Cb 0.00 -1.50 0.04 0.00 -0.02 0.00 0.00 31.44 29.96 2jj1 n GLU 448 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2jj1 n TYR 449 N -1.33 0.00 0.24 -0.32 4.02 -1.26 -4.80 117.16 113.71 2jj1 n TYR 449 Ca 0.01 -0.28 0.08 0.00 -0.01 0.00 0.00 57.90 57.70 2jj1 n TYR 449 Cb 0.03 -0.07 0.38 0.00 -0.02 0.00 0.00 39.34 39.66 2jj1 n TYR 449 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2jj1 n ASP 450 N -0.40 0.37 0.05 7.72 8.00 -1.11 -1.03 116.55 130.15 2jj1 n ASP 450 Ca 0.04 0.64 -0.02 0.00 0.71 0.00 0.00 54.79 56.16 2jj1 n ASP 450 Cb 0.63 -0.70 -0.07 0.00 -0.02 0.00 0.00 41.12 40.96 2jj1 n ASP 450 CO 0.00 0.00 0.00 1.12 -0.39 0.00 0.00 177.20 177.93 2jj1 h HIS 451 N 0.00 0.00 -4.05 1.24 2.07 -1.87 -3.47 115.15 109.07 2jj1 h HIS 451 Ca 0.00 0.00 -0.52 0.00 -2.85 0.00 0.00 60.37 57.00 2jj1 h HIS 451 Cb 0.13 0.00 0.09 0.00 2.57 0.00 0.00 27.41 30.20 2jj1 h HIS 451 CO 0.00 0.67 0.48 -0.51 -3.07 0.00 0.00 177.93 175.50 2jj1 s LEU 452 N -6.05 3.85 0.37 6.12 1.43 -0.19 -5.01 118.68 119.20 2jj1 s LEU 452 Ca -0.01 2.35 -0.25 0.00 -1.03 0.00 0.00 54.13 55.19 2jj1 s LEU 452 Cb 0.08 -4.41 -0.09 0.00 0.03 0.00 0.00 46.19 41.80 2jj1 s LEU 452 CO 0.80 -1.22 1.01 -2.16 0.23 0.00 0.00 176.35 175.01 2jj1 s PRO 453 N -3.02 4.32 0.19 1.29 0.04 -1.26 -4.95 135.00 131.61 2jj1 s PRO 453 Ca 0.70 1.42 -0.23 0.00 0.04 0.00 0.00 61.00 62.94 2jj1 s PRO 453 Cb -0.29 -2.61 0.11 0.00 0.04 0.00 0.00 34.50 31.75 2jj1 s PRO 453 CO 0.34 0.01 1.57 1.49 0.04 0.00 0.00 177.00 180.45 2jj1 h GLU 454 N 2.69 -0.12 0.00 4.56 4.81 -1.95 -1.87 114.58 122.70 2jj1 h GLU 454 Ca -0.48 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 2jj1 h GLU 454 Cb 1.20 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.61 2jj1 h GLU 454 CO 0.63 -0.08 0.00 1.04 -0.73 0.00 0.00 179.01 179.87 2jj1 n GLN 455 N -5.42 0.09 0.15 1.92 1.13 -1.26 -1.39 117.38 112.61 2jj1 n GLN 455 Ca 0.05 0.22 0.08 0.00 -1.94 0.00 0.00 57.00 55.40 2jj1 n GLN 455 Cb 0.36 -1.50 0.07 0.00 0.11 0.00 0.00 30.24 29.28 2jj1 n GLN 455 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2jj1 h ALA 456 N 2.29 0.77 -0.00 -1.58 0.00 -1.65 -3.23 119.26 115.87 2jj1 h ALA 456 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2jj1 h ALA 456 Cb 0.05 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2jj1 h ALA 456 CO 0.00 0.27 -0.35 1.19 0.00 0.00 0.00 179.25 180.36 2jj1 n PHE 457 N -3.03 0.00 -2.65 0.00 3.01 -0.48 -4.19 117.46 110.11 2jj1 n PHE 457 Ca 0.01 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.06 2jj1 n PHE 457 Cb 0.62 -0.26 -0.04 0.00 -0.01 0.00 0.00 39.48 39.79 2jj1 n PHE 457 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 2jj1 s TYR 458 N -2.88 3.70 -1.14 1.38 5.04 -1.22 -2.79 117.35 119.44 2jj1 s TYR 458 Ca 0.15 1.69 -0.25 0.00 -2.44 0.00 0.00 57.07 56.22 2jj1 s TYR 458 Cb 0.18 -3.15 0.01 0.00 0.35 0.00 0.00 41.96 39.36 2jj1 s TYR 458 CO 0.63 -0.14 0.74 -0.12 -1.34 0.00 0.00 175.55 175.32 2jj1 n MET 459 N 3.05 -0.84 -4.27 4.97 1.56 -1.26 -5.01 117.12 115.31 2jj1 n MET 459 Ca 0.04 0.35 -0.15 0.00 -0.27 0.00 0.00 57.70 57.66 2jj1 n MET 459 Cb 0.49 -3.39 -0.10 0.00 2.15 0.00 0.00 33.22 32.37 2jj1 n MET 459 CO 0.00 0.00 0.00 0.14 -0.73 0.00 0.00 175.97 175.38 2jj1 s VAL 460 N -3.44 0.28 0.00 1.12 -7.23 -1.26 -4.73 120.40 105.13 2jj1 s VAL 460 Ca 0.44 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.61 2jj1 s VAL 460 Cb -0.20 -2.56 0.00 0.00 0.56 0.00 0.00 36.38 34.19 2jj1 s VAL 460 CO 0.91 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 176.31 2jj1 n GLY 461 N -0.42 1.39 3.77 2.32 0.00 -1.26 -4.45 105.19 106.54 2jj1 n GLY 461 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2jj1 n GLY 461 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jj1 s PRO 462 N 0.54 2.29 0.43 1.61 0.04 -1.26 -4.90 135.00 133.76 2jj1 s PRO 462 Ca 0.00 1.16 0.19 0.00 0.04 0.00 0.00 61.00 62.39 2jj1 s PRO 462 Cb 0.00 -1.90 1.14 0.00 0.04 0.00 0.00 34.50 33.78 2jj1 s PRO 462 CO 0.00 -1.62 1.86 0.97 0.04 0.00 0.00 177.00 178.25 2jj1 h ILE 463 N -1.11 0.66 -0.57 0.56 6.09 -1.95 -0.67 117.51 120.52 2jj1 h ILE 463 Ca -0.44 -0.12 0.12 0.00 -1.37 0.00 0.00 64.86 63.05 2jj1 h ILE 463 Cb 1.23 0.28 -0.10 0.00 0.47 0.00 0.00 36.82 38.70 2jj1 h ILE 463 CO 0.52 0.06 -0.08 -0.33 -3.07 0.00 0.00 178.15 175.25 2jj1 h GLU 464 N 0.35 0.05 0.00 2.19 3.07 -1.98 -1.87 114.58 116.39 2jj1 h GLU 464 Ca 0.46 -0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 59.27 2jj1 h GLU 464 Cb 1.23 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 29.12 2jj1 h GLU 464 CO -0.15 0.03 -0.21 0.93 -1.40 0.00 0.00 179.01 178.21 2jj1 h GLU 465 N 0.05 0.00 -0.59 2.33 5.08 -1.46 0.25 114.58 120.24 2jj1 h GLU 465 Ca 0.29 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.55 2jj1 h GLU 465 Cb 0.45 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 2jj1 h GLU 465 CO -0.54 0.21 -0.00 0.00 -1.00 0.00 0.00 179.01 177.67 2jj1 h ALA 466 N 1.79 0.89 -0.30 3.43 0.00 -1.40 0.23 119.26 123.90 2jj1 h ALA 466 Ca -0.00 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 2jj1 h ALA 466 Cb 0.44 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2jj1 h ALA 466 CO 0.03 0.66 -0.07 0.28 0.00 0.00 0.00 179.25 180.15 2jj1 h VAL 467 N 0.94 1.28 0.43 0.00 2.07 -0.22 -1.58 116.25 119.16 2jj1 h VAL 467 Ca 0.17 -1.09 -0.02 0.00 0.82 0.00 0.00 66.70 66.57 2jj1 h VAL 467 Cb 0.54 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.69 2jj1 h VAL 467 CO 0.03 0.35 -0.21 0.00 0.02 0.00 0.00 177.57 177.76 2jj1 h ALA 468 N 0.80 -0.58 -0.40 1.67 0.00 -0.72 -2.46 119.26 117.57 2jj1 h ALA 468 Ca 0.08 -0.14 0.12 0.00 0.00 0.00 0.00 54.91 54.97 2jj1 h ALA 468 Cb 0.55 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 2jj1 h ALA 468 CO 0.03 -0.81 0.37 -0.22 0.00 0.00 0.00 179.25 178.62 2jj1 h LYS 469 N -0.61 0.00 -0.31 0.00 3.64 -0.49 -0.96 116.57 117.84 2jj1 h LYS 469 Ca -0.06 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 2jj1 h LYS 469 Cb 0.46 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 2jj1 h LYS 469 CO 0.10 0.00 -0.23 0.00 -2.27 0.00 0.00 179.45 177.05 2jj1 h ALA 470 N 1.64 1.03 -0.14 5.00 0.00 -0.79 -2.76 119.26 123.24 2jj1 h ALA 470 Ca 0.19 -0.35 -0.18 0.00 0.00 0.00 0.00 54.91 54.57 2jj1 h ALA 470 Cb 0.92 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.59 2jj1 h ALA 470 CO -0.00 0.58 -0.62 -0.44 0.00 0.00 0.00 179.25 178.78 2jj1 h ASP 471 N 0.52 0.79 -0.23 0.00 3.45 -1.13 -2.56 116.42 117.26 2jj1 h ASP 471 Ca 0.08 -0.62 0.07 0.00 0.43 0.00 0.00 57.03 56.98 2jj1 h ASP 471 Cb 0.68 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 39.21 2jj1 h ASP 471 CO 0.05 1.28 0.17 0.50 -1.57 0.00 0.00 179.24 179.67 2jj1 h LYS 472 N 0.34 0.00 0.00 3.56 3.64 -1.47 0.65 116.57 123.29 2jj1 h LYS 472 Ca -0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2jj1 h LYS 472 Cb 1.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 2jj1 h LYS 472 CO 0.13 0.00 -0.42 1.28 -2.27 0.00 0.00 179.45 178.17 2jj1 n LEU 473 N -4.45 0.55 0.26 5.20 4.77 -1.05 -3.09 117.00 119.19 2jj1 n LEU 473 Ca 0.02 0.24 0.16 0.00 -0.03 0.00 0.00 56.01 56.41 2jj1 n LEU 473 Cb 0.31 -0.27 0.63 0.00 -2.33 0.00 0.00 43.42 41.77 2jj1 n LEU 473 CO 0.35 -0.01 0.97 0.00 -1.33 0.00 0.00 177.39 177.37 2jj1 h ALA 474 N 2.73 1.00 0.00 -1.18 0.00 -0.44 -3.51 119.26 117.87 2jj1 h ALA 474 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jj1 h ALA 474 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2jj1 h ALA 474 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 179.25 177.34