#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j5g s PRO 6 N 0.00 2.90 0.43 2.61 0.02 -1.26 -4.88 135.00 134.82 2j5g s PRO 6 Ca 0.00 2.03 0.12 0.00 0.02 0.00 0.00 61.00 63.17 2j5g s PRO 6 Cb 0.00 -2.01 0.99 0.00 0.02 0.00 0.00 34.50 33.49 2j5g s PRO 6 CO 0.00 -1.32 1.99 0.93 -0.33 0.00 0.00 177.00 178.27 2j5g h GLU 7 N 0.97 0.44 0.00 5.54 4.39 -2.05 -2.16 114.58 121.72 2j5g h GLU 7 Ca -0.51 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.17 2j5g h GLU 7 Cb 1.31 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.86 2j5g h GLU 7 CO 0.55 0.29 0.00 0.10 -1.16 0.00 0.00 179.01 178.79 2j5g h TYR 8 N 0.45 0.00 -0.13 4.33 -0.00 -2.00 -1.80 116.97 117.82 2j5g h TYR 8 Ca 0.26 0.00 0.04 0.00 -0.00 0.00 0.00 58.73 59.03 2j5g h TYR 8 Cb 0.43 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.15 2j5g h TYR 8 CO -0.00 0.00 0.14 0.74 -0.00 0.00 0.00 178.16 179.04 2j5g h PHE 9 N 0.00 0.00 -0.06 0.10 -1.00 -1.75 -2.55 116.94 111.68 2j5g h PHE 9 Ca 0.00 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.77 2j5g h PHE 9 Cb 0.31 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.87 2j5g h PHE 9 CO 0.00 0.00 -0.09 0.25 -1.61 0.00 0.00 178.31 176.86 2j5g n THR 10 N -3.84 2.05 0.19 -1.55 -2.24 -0.68 -4.41 114.28 103.80 2j5g n THR 10 Ca 0.00 -2.42 0.11 0.00 -2.27 0.00 0.00 64.05 59.48 2j5g n THR 10 Cb 0.25 -0.25 -0.04 0.00 -2.10 0.00 0.00 70.33 68.19 2j5g n THR 10 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2j5g n LYS 11 N -1.22 0.54 -4.00 -0.78 4.81 -0.96 -4.86 118.16 111.69 2j5g n LYS 11 Ca 0.18 -0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 57.29 2j5g n LYS 11 Cb 0.71 -1.68 -0.14 0.00 0.02 0.00 0.00 35.03 33.94 2j5g n LYS 11 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 2j5g s TYR 12 N -3.37 3.25 0.13 5.64 1.51 -1.26 -4.98 117.35 118.27 2j5g s TYR 12 Ca -0.02 -2.08 0.34 0.00 -1.01 0.00 0.00 57.07 54.30 2j5g s TYR 12 Cb 0.12 -2.01 1.60 0.00 -0.11 0.00 0.00 41.96 41.56 2j5g s TYR 12 CO 0.83 -0.84 2.01 1.05 -1.11 0.00 0.00 175.55 177.49 2j5g h GLU 13 N 7.88 0.00 -0.54 -0.62 4.11 -1.97 -2.04 114.58 121.40 2j5g h GLU 13 Ca -0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.22 2j5g h GLU 13 Cb 1.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.30 2j5g h GLU 13 CO 0.50 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.67 2j5g n ASN 14 N -2.83 3.91 -3.81 3.06 4.13 -1.26 -4.71 115.26 113.75 2j5g n ASN 14 Ca -0.01 -2.25 -0.19 0.00 1.68 0.00 0.00 54.58 53.81 2j5g n ASN 14 Cb 0.18 -0.45 -0.17 0.00 -1.54 0.00 0.00 39.78 37.81 2j5g n ASN 14 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2j5g s LEU 15 N -1.46 0.97 -0.14 3.41 1.43 -0.77 -1.18 118.68 120.93 2j5g s LEU 15 Ca 0.41 -0.05 -0.07 0.00 -1.03 0.00 0.00 54.13 53.39 2j5g s LEU 15 Cb 0.25 -0.31 -0.04 0.00 0.03 0.00 0.00 46.19 46.11 2j5g s LEU 15 CO 0.23 -0.13 0.10 -2.28 0.23 0.00 0.00 176.35 174.50 2j5g s HIS 16 N 1.33 3.44 -0.04 0.29 5.65 0.20 -4.65 115.29 121.51 2j5g s HIS 16 Ca -0.05 0.37 0.07 0.00 0.25 0.00 0.00 55.06 55.69 2j5g s HIS 16 Cb -0.13 -1.98 -0.01 0.00 -1.18 0.00 0.00 32.58 29.27 2j5g s HIS 16 CO -0.02 0.52 -0.25 -0.06 -0.65 0.00 0.00 174.74 174.28 2j5g s PHE 17 N -0.53 2.33 -0.03 3.88 0.08 -1.26 -0.63 117.98 121.82 2j5g s PHE 17 Ca 0.11 -0.58 -0.16 0.00 0.12 0.00 0.00 56.93 56.43 2j5g s PHE 17 Cb -0.12 -1.52 0.03 0.00 -0.57 0.00 0.00 43.02 40.84 2j5g s PHE 17 CO 0.02 -0.13 0.34 -3.38 -0.10 0.00 0.00 175.22 171.97 2j5g s HIS 18 N -0.36 -0.24 -0.01 0.36 -3.43 -0.77 -5.00 115.29 105.84 2j5g s HIS 18 Ca 0.03 0.40 0.02 0.00 -0.80 0.00 0.00 55.06 54.71 2j5g s HIS 18 Cb -0.12 0.12 -0.00 0.00 -1.43 0.00 0.00 32.58 31.16 2j5g s HIS 18 CO 0.01 -0.39 -0.08 0.50 -2.00 0.00 0.00 174.74 172.78 2j5g s ARG 19 N -1.18 0.78 0.61 -0.38 3.52 -1.26 -0.54 118.95 120.50 2j5g s ARG 19 Ca -0.12 -0.29 -0.01 0.00 -0.13 0.00 0.00 55.73 55.18 2j5g s ARG 19 Cb -0.05 -0.75 0.12 0.00 -1.56 0.00 0.00 34.95 32.72 2j5g s ARG 19 CO 0.04 0.14 0.84 -0.40 -0.81 0.00 0.00 175.30 175.11 2j5g n ASP 20 N 3.08 1.08 0.13 -2.12 5.75 -0.53 -4.95 116.55 118.99 2j5g n ASP 20 Ca -0.16 -1.92 0.12 0.00 -0.01 0.00 0.00 54.79 52.82 2j5g n ASP 20 Cb 0.56 -0.55 0.48 0.00 -1.03 0.00 0.00 41.12 40.59 2j5g n ASP 20 CO 0.00 0.00 0.00 -1.84 -0.11 0.00 0.00 177.20 175.25 2j5g n GLU 21 N -2.55 0.19 0.00 0.11 0.28 -1.26 -1.53 120.64 115.88 2j5g n GLU 21 Ca 0.14 0.41 0.14 0.00 -0.16 0.00 0.00 57.16 57.69 2j5g n GLU 21 Cb 0.49 -1.86 0.49 0.00 1.43 0.00 0.00 31.44 31.99 2j5g n GLU 21 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2j5g n ASN 22 N -2.22 1.56 -0.13 -1.84 3.02 -1.26 -4.93 115.26 109.46 2j5g n ASN 22 Ca 0.02 -1.50 -0.02 0.00 -0.03 0.00 0.00 54.58 53.05 2j5g n ASN 22 Cb 0.23 0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.40 2j5g n ASN 22 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2j5g n GLY 23 N 1.19 0.53 3.62 7.41 0.00 -0.58 -4.68 105.19 112.68 2j5g n GLY 23 Ca 0.18 -0.81 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 2j5g n GLY 23 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2j5g s ILE 24 N -2.05 4.66 -0.23 -0.61 1.01 -1.26 -0.02 121.20 122.71 2j5g s ILE 24 Ca 0.00 1.44 -0.06 0.00 0.00 0.00 0.00 60.65 62.02 2j5g s ILE 24 Cb 0.00 -4.27 -0.03 0.00 0.01 0.00 0.00 42.46 38.17 2j5g s ILE 24 CO 0.00 -0.36 0.04 -0.22 0.00 0.00 0.00 174.94 174.40 2j5g s LEU 25 N 3.27 3.38 -0.22 2.97 2.96 0.10 -1.45 118.68 129.70 2j5g s LEU 25 Ca 0.38 -0.19 -0.12 0.00 -0.22 0.00 0.00 54.13 53.98 2j5g s LEU 25 Cb -0.13 -1.89 -0.05 0.00 0.50 0.00 0.00 46.19 44.63 2j5g s LEU 25 CO 0.14 0.02 0.23 -0.70 -1.32 0.00 0.00 176.35 174.71 2j5g s GLU 26 N 1.30 4.12 -0.28 1.98 2.12 0.30 -0.29 118.70 127.96 2j5g s GLU 26 Ca 0.04 -0.12 -0.04 0.00 0.36 0.00 0.00 54.97 55.22 2j5g s GLU 26 Cb -0.15 -3.52 0.02 0.00 0.26 0.00 0.00 34.13 30.75 2j5g s GLU 26 CO 0.02 0.07 0.01 0.08 -0.54 0.00 0.00 175.26 174.90 2j5g s VAL 27 N 1.02 3.35 -0.21 3.70 1.01 0.47 -1.84 120.40 127.90 2j5g s VAL 27 Ca 0.11 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 61.14 2j5g s VAL 27 Cb -0.14 -2.74 0.01 0.00 0.00 0.00 0.00 36.38 33.51 2j5g s VAL 27 CO 0.05 0.11 -0.09 -0.60 0.00 0.00 0.00 175.10 174.56 2j5g s ARG 28 N 1.39 3.18 0.17 2.72 3.52 0.19 -1.21 118.95 128.92 2j5g s ARG 28 Ca 0.00 -0.74 -0.30 0.00 -0.13 0.00 0.00 55.73 54.57 2j5g s ARG 28 Cb -0.17 -2.87 -0.07 0.00 -1.56 0.00 0.00 34.95 30.28 2j5g s ARG 28 CO -0.01 -0.23 1.03 -1.64 -0.81 0.00 0.00 175.30 173.64 2j5g s MET 29 N 1.40 4.67 0.13 5.12 -1.94 0.05 -0.63 119.30 128.10 2j5g s MET 29 Ca 0.05 1.60 -0.20 0.00 -1.71 0.00 0.00 55.69 55.43 2j5g s MET 29 Cb -0.14 -3.31 0.05 0.00 2.01 0.00 0.00 34.83 33.44 2j5g s MET 29 CO -0.06 0.19 0.49 -3.38 -0.01 0.00 0.00 175.02 172.25 2j5g s HIS 30 N -0.35 -0.37 -0.25 -0.03 -0.00 -0.33 -2.38 115.29 111.59 2j5g s HIS 30 Ca 0.47 0.14 0.02 0.00 -0.00 0.00 0.00 55.06 55.69 2j5g s HIS 30 Cb -0.27 0.39 0.06 0.00 -0.00 0.00 0.00 32.58 32.76 2j5g s HIS 30 CO 0.33 -0.75 -0.06 0.99 -0.00 0.00 0.00 174.74 175.25 2j5g s THR 31 N -3.61 1.79 -1.51 -5.38 2.01 0.20 -4.32 115.64 104.82 2j5g s THR 31 Ca 0.01 -1.45 -0.14 0.00 0.31 0.00 0.00 61.69 60.42 2j5g s THR 31 Cb 0.00 -2.03 0.11 0.00 0.01 0.00 0.00 72.50 70.59 2j5g s THR 31 CO -0.11 -0.13 0.75 0.59 -0.69 0.00 0.00 174.62 175.04 2j5g n ASN 32 N 4.56 -3.99 0.00 3.53 3.02 -1.26 -0.89 115.26 120.23 2j5g n ASN 32 Ca -0.11 -0.72 0.00 0.00 -0.03 0.00 0.00 54.58 53.71 2j5g n ASN 32 Cb 0.43 -3.24 0.00 0.00 -0.61 0.00 0.00 39.78 36.36 2j5g n ASN 32 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2j5g n GLY 33 N -1.41 1.45 4.02 7.41 0.00 -1.26 -5.03 105.19 110.38 2j5g n GLY 33 Ca 0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.87 2j5g n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2j5g s SER 34 N -3.21 5.28 0.49 1.61 0.01 -0.06 -4.74 113.70 113.07 2j5g s SER 34 Ca 0.00 -0.65 -0.22 0.00 1.31 0.00 0.00 55.95 56.40 2j5g s SER 34 Cb 0.00 -0.10 -0.09 0.00 0.21 0.00 0.00 66.02 66.04 2j5g s SER 34 CO 0.00 -1.15 0.86 -1.20 0.41 0.00 0.00 173.24 172.16 2j5g n SER 35 N -2.13 0.48 -4.75 2.44 7.64 -1.24 -0.63 113.62 115.44 2j5g n SER 35 Ca 0.13 0.91 -0.41 0.00 1.01 0.00 0.00 58.87 60.51 2j5g n SER 35 Cb 0.61 -1.30 -0.02 0.00 -1.01 0.00 0.00 64.21 62.48 2j5g n SER 35 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2j5g s LEU 36 N -0.37 4.40 -0.33 -3.43 2.96 -1.26 -3.79 118.68 116.86 2j5g s LEU 36 Ca 0.67 2.63 -0.11 0.00 -0.22 0.00 0.00 54.13 57.11 2j5g s LEU 36 Cb -0.51 -3.63 -0.00 0.00 0.50 0.00 0.00 46.19 42.55 2j5g s LEU 36 CO 0.54 -0.64 0.19 -0.69 -1.32 0.00 0.00 176.35 174.43 2j5g s VAL 37 N -0.24 4.75 0.30 1.68 1.01 -1.26 -4.06 120.40 122.58 2j5g s VAL 37 Ca 0.57 -0.47 -0.29 0.00 0.00 0.00 0.00 61.98 61.78 2j5g s VAL 37 Cb -0.41 -3.48 -0.10 0.00 0.00 0.00 0.00 36.38 32.40 2j5g s VAL 37 CO 0.45 -0.02 1.22 0.12 0.00 0.00 0.00 175.10 176.86 2j5g s PHE 38 N 1.63 3.29 0.24 5.22 5.36 0.22 -4.80 117.98 129.14 2j5g s PHE 38 Ca 0.04 1.52 0.01 0.00 -0.96 0.00 0.00 56.93 57.55 2j5g s PHE 38 Cb -0.18 -3.51 -0.04 0.00 -0.34 0.00 0.00 43.02 38.96 2j5g s PHE 38 CO 0.07 -1.30 0.14 0.95 -1.46 0.00 0.00 175.22 173.62 2j5g s THR 39 N -1.05 0.21 0.35 0.12 -4.23 -1.26 -0.55 115.64 109.23 2j5g s THR 39 Ca 0.48 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 59.03 2j5g s THR 39 Cb -0.36 -2.54 0.29 0.00 1.34 0.00 0.00 72.50 71.23 2j5g s THR 39 CO 0.47 0.00 1.95 1.23 -0.54 0.00 0.00 174.62 177.73 2j5g h GLY 40 N 2.44 1.02 0.95 3.99 0.00 -1.78 -0.84 103.07 108.85 2j5g h GLY 40 Ca -0.35 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 46.65 2j5g h GLY 40 CO 0.54 0.24 0.09 1.70 0.00 0.00 0.00 176.54 179.11 2j5g h LYS 41 N 0.80 0.22 -0.31 4.80 3.64 -1.96 -1.43 116.57 122.33 2j5g h LYS 41 Ca 0.33 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.60 2j5g h LYS 41 Cb 0.25 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 2j5g h LYS 41 CO -0.11 0.22 -0.16 1.79 -2.27 0.00 0.00 179.45 178.92 2j5g h THR 42 N 0.17 1.25 -0.46 1.00 1.35 -1.83 0.15 112.91 114.53 2j5g h THR 42 Ca 0.06 -1.13 -0.03 0.00 -0.55 0.00 0.00 66.41 64.76 2j5g h THR 42 Cb 0.06 1.18 -0.02 0.00 -1.73 0.00 0.00 68.15 67.64 2j5g h THR 42 CO -0.01 0.37 0.18 -0.74 -0.25 0.00 0.00 175.52 175.07 2j5g h HIS 43 N 0.51 0.66 0.23 4.73 -0.00 -0.88 0.69 115.15 121.09 2j5g h HIS 43 Ca 0.09 -0.03 -0.32 0.00 -0.00 0.00 0.00 60.37 60.11 2j5g h HIS 43 Cb 0.57 -0.21 0.04 0.00 -0.00 0.00 0.00 27.41 27.81 2j5g h HIS 43 CO 0.02 0.52 -1.39 -0.09 -0.00 0.00 0.00 177.93 176.99 2j5g h ARG 44 N 0.66 0.54 0.09 5.26 2.43 -0.88 -3.40 114.38 119.07 2j5g h ARG 44 Ca 0.16 -0.89 -0.30 0.00 -0.81 0.00 0.00 59.98 58.14 2j5g h ARG 44 Cb 0.15 0.32 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 2j5g h ARG 44 CO -0.01 1.42 -1.60 0.93 -1.51 0.00 0.00 179.97 179.20 2j5g h GLU 45 N 0.12 0.18 -0.98 0.20 5.08 -0.54 -3.37 114.58 115.27 2j5g h GLU 45 Ca -0.24 -0.31 0.08 0.00 -1.00 0.00 0.00 59.36 57.89 2j5g h GLU 45 Cb 2.09 0.12 -0.07 0.00 0.50 0.00 0.00 28.75 31.39 2j5g h GLU 45 CO 0.26 0.99 0.62 0.74 -1.00 0.00 0.00 179.01 180.63 2j5g h PHE 46 N 0.05 1.15 -0.85 4.33 -1.00 -1.06 -0.46 116.94 119.10 2j5g h PHE 46 Ca -0.26 0.03 0.11 0.00 2.81 0.00 0.00 57.97 60.66 2j5g h PHE 46 Cb 2.00 -0.37 -0.06 0.00 3.61 0.00 0.00 35.95 41.12 2j5g h PHE 46 CO 0.05 0.57 0.55 -1.35 -1.61 0.00 0.00 178.31 176.52 2j5g h PRO 47 N 1.10 0.76 -0.24 1.51 0.10 -1.77 -0.49 132.00 132.97 2j5g h PRO 47 Ca 0.44 -0.05 -0.16 0.00 0.10 0.00 0.00 66.00 66.33 2j5g h PRO 47 Cb 0.23 -0.17 -0.01 0.00 0.10 0.00 0.00 31.00 31.16 2j5g h PRO 47 CO -0.19 0.50 -0.51 -0.44 0.10 0.00 0.00 178.00 177.46 2j5g h ASP 48 N 0.78 0.75 -0.48 -2.05 3.32 -1.33 -1.53 116.42 115.87 2j5g h ASP 48 Ca 0.40 -0.38 -0.03 0.00 0.02 0.00 0.00 57.03 57.04 2j5g h ASP 48 Cb 0.49 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 2j5g h ASP 48 CO -0.17 1.12 0.19 0.00 -1.72 0.00 0.00 179.24 178.66 2j5g h ALA 49 N 0.90 0.63 -0.49 3.45 0.00 -0.53 0.60 119.26 123.82 2j5g h ALA 49 Ca 0.02 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 2j5g h ALA 49 Cb 1.07 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2j5g h ALA 49 CO 0.10 0.25 -0.08 0.74 0.00 0.00 0.00 179.25 180.26 2j5g h PHE 50 N 0.64 0.95 -0.18 0.00 0.04 -1.05 -0.32 116.94 117.03 2j5g h PHE 50 Ca 0.16 -0.17 0.03 0.00 2.80 0.00 0.00 57.97 60.79 2j5g h PHE 50 Cb 0.21 -0.25 -0.03 0.00 2.20 0.00 0.00 35.95 38.08 2j5g h PHE 50 CO 0.01 0.91 0.01 -0.92 -0.60 0.00 0.00 178.31 177.71 2j5g h TYR 51 N 0.79 0.01 -0.69 -0.55 3.20 -1.05 -0.93 116.97 117.75 2j5g h TYR 51 Ca 0.13 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.09 2j5g h TYR 51 Cb 0.58 0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.82 2j5g h TYR 51 CO 0.03 -0.01 0.37 -0.44 -1.64 0.00 0.00 178.16 176.47 2j5g h ASP 52 N 0.07 0.53 -0.37 -2.11 3.32 -0.39 -0.41 116.42 117.04 2j5g h ASP 52 Ca 0.08 0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.20 2j5g h ASP 52 Cb 0.09 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 2j5g h ASP 52 CO -0.13 0.33 0.20 0.40 -1.72 0.00 0.00 179.24 178.32 2j5g h ILE 53 N 0.66 1.01 0.00 0.35 2.04 -0.93 -2.85 117.51 117.80 2j5g h ILE 53 Ca 0.32 -0.14 -0.06 0.00 1.00 0.00 0.00 64.86 65.98 2j5g h ILE 53 Cb 0.26 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 2j5g h ILE 53 CO -0.22 0.07 -0.28 0.77 0.00 0.00 0.00 178.15 178.50 2j5g h SER 54 N 0.41 0.00 0.93 1.72 4.64 -0.04 -2.87 113.55 118.34 2j5g h SER 54 Ca 0.15 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.37 2j5g h SER 54 Cb 0.04 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 2j5g h SER 54 CO -0.09 0.28 -0.48 -0.09 -0.87 0.00 0.00 176.83 175.57 2j5g h ARG 55 N 0.00 0.00 -5.75 4.77 2.43 -0.89 -3.43 114.38 111.51 2j5g h ARG 55 Ca -0.00 0.00 -0.62 0.00 -0.81 0.00 0.00 59.98 58.54 2j5g h ARG 55 Cb 0.53 0.00 -0.13 0.00 -0.42 0.00 0.00 29.97 29.95 2j5g h ARG 55 CO 0.04 0.48 0.45 0.34 -1.51 0.00 0.00 179.97 179.77 2j5g s ASP 56 N -6.52 6.35 0.01 -3.80 3.68 -1.09 -4.89 116.67 110.41 2j5g s ASP 56 Ca 0.01 -0.33 0.12 0.00 2.13 0.00 0.00 52.55 54.48 2j5g s ASP 56 Cb 0.11 -2.41 0.53 0.00 -1.45 0.00 0.00 42.92 39.70 2j5g s ASP 56 CO 0.72 -1.10 1.40 0.54 0.13 0.00 0.00 175.17 176.86 2j5g n ARG 57 N 7.10 0.00 0.12 4.34 1.74 -1.26 -2.02 116.66 126.69 2j5g n ARG 57 Ca 0.01 0.29 0.13 0.00 -0.77 0.00 0.00 57.85 57.51 2j5g n ARG 57 Cb 0.47 -1.51 0.44 0.00 -1.02 0.00 0.00 32.46 30.84 2j5g n ARG 57 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2j5g h ASP 58 N 0.00 0.00 -3.33 0.55 3.45 -1.94 -3.41 116.42 111.74 2j5g h ASP 58 Ca 0.00 0.00 -0.57 0.00 0.43 0.00 0.00 57.03 56.89 2j5g h ASP 58 Cb 0.21 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 38.92 2j5g h ASP 58 CO 0.00 0.00 0.85 0.20 -1.57 0.00 0.00 179.24 178.72 2j5g s ASN 59 N -4.52 6.91 -0.10 6.45 0.01 -0.85 -4.46 114.94 118.38 2j5g s ASN 59 Ca 0.08 1.02 0.12 0.00 -0.71 0.00 0.00 52.86 53.38 2j5g s ASN 59 Cb 0.11 -2.54 -0.18 0.00 0.41 0.00 0.00 41.25 39.05 2j5g s ASN 59 CO 0.53 -0.91 0.12 0.54 -1.51 0.00 0.00 177.10 175.87 2j5g n ARG 60 N 6.94 1.47 -3.82 -0.60 1.74 0.97 -4.88 116.66 118.47 2j5g n ARG 60 Ca 0.12 -0.04 -0.12 0.00 -0.77 0.00 0.00 57.85 57.04 2j5g n ARG 60 Cb 0.47 -1.34 -0.12 0.00 -1.02 0.00 0.00 32.46 30.45 2j5g n ARG 60 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2j5g s VAL 61 N -2.50 0.01 -0.06 1.55 1.01 -1.10 -4.44 120.40 114.88 2j5g s VAL 61 Ca -0.06 -0.09 0.05 0.00 0.00 0.00 0.00 61.98 61.88 2j5g s VAL 61 Cb 0.05 -0.27 -0.02 0.00 0.00 0.00 0.00 36.38 36.14 2j5g s VAL 61 CO 0.55 -0.05 -0.20 -0.69 0.00 0.00 0.00 175.10 174.71 2j5g s VAL 62 N -0.10 2.49 -0.18 2.92 1.01 -0.54 -0.72 120.40 125.28 2j5g s VAL 62 Ca -0.02 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 61.03 2j5g s VAL 62 Cb -0.02 -1.94 -0.00 0.00 0.00 0.00 0.00 36.38 34.41 2j5g s VAL 62 CO 0.00 0.57 -0.11 -0.63 0.00 0.00 0.00 175.10 174.94 2j5g s ILE 63 N -0.37 2.97 -0.17 2.22 1.01 0.60 -0.29 121.20 127.17 2j5g s ILE 63 Ca 0.03 -0.65 -0.05 0.00 0.00 0.00 0.00 60.65 59.98 2j5g s ILE 63 Cb -0.12 -2.30 -0.03 0.00 0.01 0.00 0.00 42.46 40.02 2j5g s ILE 63 CO 0.02 0.48 0.00 -0.22 0.00 0.00 0.00 174.94 175.22 2j5g s LEU 64 N 1.05 3.44 0.27 2.97 2.96 0.26 -0.39 118.68 129.23 2j5g s LEU 64 Ca -0.00 -0.07 -0.08 0.00 -0.22 0.00 0.00 54.13 53.75 2j5g s LEU 64 Cb -0.15 -1.85 -0.01 0.00 0.50 0.00 0.00 46.19 44.69 2j5g s LEU 64 CO -0.02 0.15 0.44 0.28 -1.32 0.00 0.00 176.35 175.88 2j5g s THR 65 N 0.46 0.00 0.00 3.68 -1.32 -0.35 -1.23 115.64 116.88 2j5g s THR 65 Ca -0.01 -1.53 0.00 0.00 -1.21 0.00 0.00 61.69 58.94 2j5g s THR 65 Cb -0.14 -2.38 0.00 0.00 -1.51 0.00 0.00 72.50 68.47 2j5g s THR 65 CO 0.02 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.04 2j5g n GLY 66 N -0.42 3.62 3.39 6.08 0.00 -1.26 -0.77 105.19 115.83 2j5g n GLY 66 Ca -0.01 -2.14 -0.23 0.00 0.00 0.00 0.00 46.02 43.65 2j5g n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2j5g s SER 67 N -0.74 3.05 0.87 1.61 0.01 -1.00 -4.63 113.70 112.86 2j5g s SER 67 Ca 0.00 -0.94 0.00 0.00 1.31 0.00 0.00 55.95 56.32 2j5g s SER 67 Cb 0.00 -0.21 0.00 0.00 0.21 0.00 0.00 66.02 66.02 2j5g s SER 67 CO 0.00 -0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.24 2j5g n GLY 68 N -0.12 2.42 1.06 3.44 0.00 -1.26 -3.59 105.19 107.14 2j5g n GLY 68 Ca -0.10 -0.47 0.11 0.00 0.00 0.00 0.00 46.02 45.57 2j5g n GLY 68 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2j5g n ASP 69 N 0.83 3.28 -4.02 1.61 5.68 -1.26 -4.84 116.55 117.82 2j5g n ASP 69 Ca 0.00 -1.97 -0.16 0.00 -0.50 0.00 0.00 54.79 52.16 2j5g n ASP 69 Cb 0.00 -0.18 -0.14 0.00 -1.14 0.00 0.00 41.12 39.66 2j5g n ASP 69 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2j5g s ALA 70 N -1.56 0.60 -0.09 2.12 0.00 -1.24 -3.83 121.76 117.76 2j5g s ALA 70 Ca 0.35 -0.46 -0.22 0.00 0.00 0.00 0.00 51.96 51.63 2j5g s ALA 70 Cb 0.21 -0.09 -0.18 0.00 0.00 0.00 0.00 23.12 23.06 2j5g s ALA 70 CO 0.30 0.10 0.76 2.35 0.00 0.00 0.00 175.76 179.27 2j5g h TRP 71 N 5.50 -0.07 -1.01 0.00 7.01 -0.96 -3.34 115.95 123.07 2j5g h TRP 71 Ca -0.31 -0.00 0.09 0.00 2.11 0.00 0.00 58.89 60.77 2j5g h TRP 71 Cb 1.19 0.02 -0.21 0.00 -2.10 0.00 0.00 29.16 28.06 2j5g h TRP 71 CO 0.48 0.52 -0.27 1.41 -2.79 0.00 0.00 178.44 177.79 2j5g s MET 72 N -2.80 0.57 0.00 2.65 1.75 -0.41 -4.49 119.30 116.57 2j5g s MET 72 Ca -0.14 1.00 0.00 0.00 -1.25 0.00 0.00 55.69 55.31 2j5g s MET 72 Cb -0.01 0.55 0.00 0.00 2.84 0.00 0.00 34.83 38.21 2j5g s MET 72 CO 0.51 -0.62 0.33 0.00 -0.65 0.00 0.00 175.02 174.59 2j5g n ALA 73 N 5.43 0.93 -2.71 4.11 0.00 -1.26 -0.93 120.51 126.07 2j5g n ALA 73 Ca -0.01 -0.33 -0.18 0.00 0.00 0.00 0.00 53.44 52.92 2j5g n ALA 73 Cb 0.51 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.83 2j5g n ALA 73 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2j5g s GLU 74 N -0.11 0.78 0.02 0.00 2.02 -1.26 -4.96 118.70 115.20 2j5g s GLU 74 Ca 0.00 -0.77 -0.00 0.00 0.02 0.00 0.00 54.97 54.22 2j5g s GLU 74 Cb 0.00 -0.74 -0.02 0.00 0.10 0.00 0.00 34.13 33.47 2j5g s GLU 74 CO 0.00 0.17 -0.02 -1.50 0.02 0.00 0.00 175.26 173.93 2j5g s ILE 75 N -1.01 0.09 -0.70 -1.63 2.07 -1.26 -0.61 121.20 118.15 2j5g s ILE 75 Ca -0.02 -0.74 -0.11 0.00 -1.41 0.00 0.00 60.65 58.38 2j5g s ILE 75 Cb -0.08 -0.21 0.18 0.00 0.13 0.00 0.00 42.46 42.47 2j5g s ILE 75 CO 0.01 -0.40 0.60 -0.62 -1.91 0.00 0.00 174.94 172.62 2j5g s ASP 76 N -1.18 6.19 0.12 4.50 -1.08 0.29 -4.85 116.67 120.66 2j5g s ASP 76 Ca -0.13 -2.51 -0.20 0.00 -0.52 0.00 0.00 52.55 49.19 2j5g s ASP 76 Cb -0.08 -2.10 -0.05 0.00 -1.46 0.00 0.00 42.92 39.23 2j5g s ASP 76 CO -0.01 -0.58 1.73 -0.26 0.52 0.00 0.00 175.17 176.57 2j5g h PHE 77 N 7.84 0.02 -0.91 -5.34 -1.00 -1.99 -2.34 116.94 113.22 2j5g h PHE 77 Ca -0.02 0.01 0.15 0.00 2.81 0.00 0.00 57.97 60.92 2j5g h PHE 77 Cb 1.03 0.01 -0.07 0.00 3.61 0.00 0.00 35.95 40.53 2j5g h PHE 77 CO 0.87 -0.00 0.59 -1.35 -1.61 0.00 0.00 178.31 176.80 2j5g h PRO 78 N 0.08 0.70 0.00 1.51 0.11 -1.94 -1.44 132.00 131.02 2j5g h PRO 78 Ca 0.08 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.15 2j5g h PRO 78 Cb 0.08 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.03 2j5g h PRO 78 CO -0.12 0.46 0.00 -1.13 -0.21 0.00 0.00 178.00 177.01 2j5g n SER 79 N -4.58 0.54 0.06 -2.05 3.41 -0.88 -1.70 113.62 108.41 2j5g n SER 79 Ca 0.18 0.69 0.11 0.00 -0.26 0.00 0.00 58.87 59.59 2j5g n SER 79 Cb 0.47 -0.78 0.45 0.00 -0.26 0.00 0.00 64.21 64.09 2j5g n SER 79 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2j5g n LEU 80 N -2.15 0.35 0.00 1.04 4.77 -0.54 -2.90 117.00 117.57 2j5g n LEU 80 Ca 0.00 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 2j5g n LEU 80 Cb 0.12 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 2j5g n LEU 80 CO 0.13 -0.27 0.00 0.61 -1.33 0.00 0.00 177.39 176.53 2j5g n GLY 81 N 0.58 -0.38 3.57 -0.72 0.00 -0.69 -4.71 105.19 102.84 2j5g n GLY 81 Ca 0.04 -1.78 -0.39 0.00 0.00 0.00 0.00 46.02 43.89 2j5g n GLY 81 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2j5g s ASP 82 N -1.84 6.30 0.63 1.61 3.68 -1.26 -4.80 116.67 120.99 2j5g s ASP 82 Ca 0.00 -1.76 0.33 0.00 2.13 0.00 0.00 52.55 53.26 2j5g s ASP 82 Cb 0.00 -2.57 1.85 0.00 -1.45 0.00 0.00 42.92 40.74 2j5g s ASP 82 CO 0.00 -1.71 2.11 -0.37 0.13 0.00 0.00 175.17 175.33 2j5g h VAL 83 N 6.32 0.20 0.00 1.11 -1.51 -1.92 -1.20 116.25 119.25 2j5g h VAL 83 Ca 0.28 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.75 2j5g h VAL 83 Cb 0.95 0.82 0.00 0.00 -2.13 0.00 0.00 31.29 30.93 2j5g h VAL 83 CO 1.39 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 178.08 2j5g n THR 84 N -3.33 0.17 -3.51 7.19 -2.24 -1.26 -4.28 114.28 107.02 2j5g n THR 84 Ca -0.00 0.04 -0.40 0.00 -2.27 0.00 0.00 64.05 61.42 2j5g n THR 84 Cb 0.29 -0.59 -0.10 0.00 -2.10 0.00 0.00 70.33 67.83 2j5g n THR 84 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2j5g s ASN 85 N -2.89 6.09 0.60 3.42 3.84 -0.45 -4.16 114.94 121.39 2j5g s ASN 85 Ca 0.16 -0.24 0.31 0.00 0.21 0.00 0.00 52.86 53.29 2j5g s ASN 85 Cb 0.18 -2.15 1.84 0.00 -0.55 0.00 0.00 41.25 40.57 2j5g s ASN 85 CO 0.46 -0.21 2.23 1.55 -2.79 0.00 0.00 177.10 178.35 2j5g h PRO 86 N 8.44 0.00 0.00 0.43 0.13 -1.86 0.26 132.00 139.39 2j5g h PRO 86 Ca -0.32 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.73 2j5g h PRO 86 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 2j5g h PRO 86 CO 0.63 0.00 -0.37 0.00 -0.23 0.00 0.00 178.00 178.02 2j5g h ARG 87 N 0.00 0.00 0.14 0.86 3.08 -1.93 -1.18 114.38 115.35 2j5g h ARG 87 Ca 0.02 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.74 2j5g h ARG 87 Cb 0.10 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 2j5g h ARG 87 CO -0.00 0.37 -1.67 0.93 -1.07 0.00 0.00 179.97 178.53 2j5g h GLU 88 N 0.00 0.29 -0.70 0.04 4.39 -1.18 -3.35 114.58 114.07 2j5g h GLU 88 Ca -0.00 -0.50 0.12 0.00 0.34 0.00 0.00 59.36 59.31 2j5g h GLU 88 Cb 0.98 0.19 -0.05 0.00 -0.10 0.00 0.00 28.75 29.77 2j5g h GLU 88 CO 0.05 1.24 0.47 2.35 -1.16 0.00 0.00 179.01 181.96 2j5g h TRP 89 N -0.10 0.52 -0.47 4.33 2.91 -0.55 -1.48 115.95 121.12 2j5g h TRP 89 Ca -0.35 0.01 0.09 0.00 1.13 0.00 0.00 58.89 59.78 2j5g h TRP 89 Cb 1.93 -0.17 -0.02 0.00 -0.51 0.00 0.00 29.16 30.39 2j5g h TRP 89 CO 0.10 0.22 0.32 0.22 -1.03 0.00 0.00 178.44 178.28 2j5g h ASP 90 N 0.47 0.20 -0.32 2.65 3.58 -1.34 0.25 116.42 121.91 2j5g h ASP 90 Ca 0.34 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.75 2j5g h ASP 90 Cb 0.67 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.67 2j5g h ASP 90 CO -0.11 0.12 0.04 0.11 -2.88 0.00 0.00 179.24 176.52 2j5g h LYS 91 N 0.23 0.53 -0.44 0.28 1.57 -1.46 -0.62 116.57 116.66 2j5g h LYS 91 Ca 0.22 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 2j5g h LYS 91 Cb 0.55 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 2j5g h LYS 91 CO -0.04 0.64 0.24 1.15 -0.57 0.00 0.00 179.45 180.87 2j5g h THR 92 N 0.35 1.16 -0.04 -0.16 2.02 -0.97 -0.87 112.91 114.39 2j5g h THR 92 Ca 0.09 -0.41 0.03 0.00 0.77 0.00 0.00 66.41 66.89 2j5g h THR 92 Cb 0.37 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 2j5g h THR 92 CO 0.01 0.17 -0.13 0.22 0.37 0.00 0.00 175.52 176.16 2j5g h TYR 93 N 0.58 -0.32 -0.57 3.16 3.20 -0.51 0.32 116.97 122.83 2j5g h TYR 93 Ca 0.16 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.01 2j5g h TYR 93 Cb 0.05 0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.45 2j5g h TYR 93 CO -0.02 -0.19 0.24 2.35 -1.64 0.00 0.00 178.16 178.90 2j5g h TRP 94 N -0.19 0.86 -0.04 -3.82 7.01 -0.92 -1.56 115.95 117.28 2j5g h TRP 94 Ca 0.06 -0.06 -0.10 0.00 2.11 0.00 0.00 58.89 60.90 2j5g h TRP 94 Cb 0.28 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 27.06 2j5g h TRP 94 CO -0.21 0.68 -0.44 0.93 -2.79 0.00 0.00 178.44 176.62 2j5g h GLU 95 N 0.78 0.09 -0.12 2.65 5.08 -1.05 -1.37 114.58 120.64 2j5g h GLU 95 Ca 0.19 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.36 2j5g h GLU 95 Cb 0.18 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2j5g h GLU 95 CO -0.02 0.51 -0.56 0.78 -1.00 0.00 0.00 179.01 178.72 2j5g h GLY 96 N 1.30 0.42 0.72 -3.84 0.00 0.08 -0.47 103.07 101.28 2j5g h GLY 96 Ca 0.00 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 46.76 2j5g h GLY 96 CO 0.06 0.44 -0.26 0.50 0.00 0.00 0.00 176.54 177.28 2j5g h LYS 97 N 0.29 0.36 -0.34 4.80 1.57 -1.09 -3.30 116.57 118.86 2j5g h LYS 97 Ca 0.00 -0.25 -0.07 0.00 -1.87 0.00 0.00 60.65 58.47 2j5g h LYS 97 Cb 1.07 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.40 2j5g h LYS 97 CO 0.10 0.85 -0.07 0.87 -0.57 0.00 0.00 179.45 180.63 2j5g h LYS 98 N -0.08 0.56 -0.62 3.15 1.79 -1.16 -2.46 116.57 117.75 2j5g h LYS 98 Ca -0.00 -0.15 -0.09 0.00 -2.18 0.00 0.00 60.65 58.23 2j5g h LYS 98 Cb 0.86 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.42 2j5g h LYS 98 CO 0.06 0.63 0.02 -0.24 -1.08 0.00 0.00 179.45 178.83 2j5g h VAL 99 N 0.52 1.26 -0.01 0.50 3.04 -1.15 0.40 116.25 120.81 2j5g h VAL 99 Ca 0.10 -1.14 -0.25 0.00 -1.01 0.00 0.00 66.70 64.40 2j5g h VAL 99 Cb 0.44 0.77 0.02 0.00 -2.01 0.00 0.00 31.29 30.50 2j5g h VAL 99 CO 0.02 0.42 -1.00 -0.07 -1.01 0.00 0.00 177.57 175.93 2j5g h LEU 100 N 0.98 0.82 -0.51 3.16 3.38 -1.64 -1.53 115.31 119.97 2j5g h LEU 100 Ca 0.18 -0.65 0.05 0.00 0.09 0.00 0.00 57.88 57.55 2j5g h LEU 100 Cb 0.54 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 2j5g h LEU 100 CO 0.03 1.45 0.25 -0.61 0.09 0.00 0.00 178.44 179.64 2j5g h GLN 101 N 0.37 0.46 -0.10 1.13 4.15 -1.26 -0.51 115.11 119.34 2j5g h GLN 101 Ca -0.11 -0.03 -0.23 0.00 0.77 0.00 0.00 58.65 59.05 2j5g h GLN 101 Cb 1.65 -0.10 0.01 0.00 0.21 0.00 0.00 27.48 29.24 2j5g h GLN 101 CO 0.19 0.31 -0.84 -0.91 -1.93 0.00 0.00 178.83 175.65 2j5g h ASN 102 N 0.48 0.84 -0.20 -0.69 2.35 -0.90 -1.57 115.58 115.90 2j5g h ASN 102 Ca 0.23 -0.59 -0.00 0.00 -0.55 0.00 0.00 56.30 55.39 2j5g h ASN 102 Cb 0.17 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 2j5g h ASN 102 CO -0.18 1.38 0.12 0.25 -1.65 0.00 0.00 177.43 177.35 2j5g h LEU 103 N 0.45 0.24 -1.54 1.61 6.46 -1.20 -2.74 115.31 118.59 2j5g h LEU 103 Ca -0.07 -0.06 -0.03 0.00 -0.12 0.00 0.00 57.88 57.61 2j5g h LEU 103 Cb 1.47 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 41.32 2j5g h LEU 103 CO 0.17 0.23 0.01 -0.07 -0.62 0.00 0.00 178.44 178.15 2j5g h LEU 104 N 0.23 0.27 -0.15 2.25 3.38 -1.03 -2.66 115.31 117.61 2j5g h LEU 104 Ca 0.07 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2j5g h LEU 104 Cb 0.04 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2j5g h LEU 104 CO -0.01 0.32 0.00 0.47 0.09 0.00 0.00 178.44 179.31 2j5g n ASP 105 N -4.37 0.22 -4.68 -0.43 10.43 -0.60 -4.70 116.55 112.42 2j5g n ASP 105 Ca 0.00 -1.23 -0.46 0.00 2.57 0.00 0.00 54.79 55.67 2j5g n ASP 105 Cb 0.18 -0.01 -0.04 0.00 1.84 0.00 0.00 41.12 43.10 2j5g n ASP 105 CO 0.00 0.00 0.00 -0.38 -1.07 0.00 0.00 177.20 175.75 2j5g n ILE 106 N -0.75 0.26 -1.47 0.53 5.41 -1.00 -4.84 119.36 117.50 2j5g n ILE 106 Ca 0.20 -0.05 -0.24 0.00 1.00 0.00 0.00 62.75 63.66 2j5g n ILE 106 Cb 0.13 -1.80 0.11 0.00 -0.71 0.00 0.00 39.64 37.37 2j5g n ILE 106 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 2j5g n GLU 107 N 4.93 2.60 -4.05 0.38 4.07 -1.26 -4.91 120.64 122.41 2j5g n GLU 107 Ca 0.19 -3.38 -0.09 0.00 -0.06 0.00 0.00 57.16 53.81 2j5g n GLU 107 Cb 0.31 -2.17 -0.09 0.00 -0.06 0.00 0.00 31.44 29.44 2j5g n GLU 107 CO 0.00 0.00 0.00 0.14 -0.06 0.00 0.00 177.13 177.21 2j5g s VAL 108 N -4.15 0.09 0.40 6.31 -7.23 -1.26 -4.05 120.40 110.52 2j5g s VAL 108 Ca 0.56 -1.64 -0.27 0.00 -1.81 0.00 0.00 61.98 58.83 2j5g s VAL 108 Cb 0.46 -1.89 -0.10 0.00 0.56 0.00 0.00 36.38 35.41 2j5g s VAL 108 CO 0.02 -0.43 1.44 -2.65 -0.31 0.00 0.00 175.10 173.17 2j5g n PRO 109 N -0.13 2.45 -4.45 4.82 -0.02 -1.26 -4.79 135.00 131.62 2j5g n PRO 109 Ca -0.07 0.86 -0.33 0.00 -2.02 0.00 0.00 63.50 61.94 2j5g n PRO 109 Cb 0.63 -2.60 -0.16 0.00 -0.02 0.00 0.00 33.50 31.35 2j5g n PRO 109 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2j5g s VAL 110 N -1.14 2.30 -0.24 -1.45 1.01 -1.26 -1.46 120.40 118.16 2j5g s VAL 110 Ca 0.56 -0.88 -0.10 0.00 0.00 0.00 0.00 61.98 61.56 2j5g s VAL 110 Cb -0.48 -1.95 -0.05 0.00 0.00 0.00 0.00 36.38 33.90 2j5g s VAL 110 CO 0.62 0.53 0.14 -0.63 0.00 0.00 0.00 175.10 175.76 2j5g s ILE 111 N 0.97 5.16 -0.11 2.22 1.01 0.60 -0.20 121.20 130.86 2j5g s ILE 111 Ca -0.03 0.11 -0.22 0.00 0.00 0.00 0.00 60.65 60.51 2j5g s ILE 111 Cb -0.15 -3.41 -0.03 0.00 0.01 0.00 0.00 42.46 38.88 2j5g s ILE 111 CO -0.04 0.35 0.67 -0.44 0.00 0.00 0.00 174.94 175.48 2j5g s SER 112 N 1.13 6.88 -0.56 3.58 0.01 0.24 -0.58 113.70 124.41 2j5g s SER 112 Ca 0.07 1.07 -0.06 0.00 1.31 0.00 0.00 55.95 58.33 2j5g s SER 112 Cb -0.14 -2.39 0.15 0.00 0.21 0.00 0.00 66.02 63.85 2j5g s SER 112 CO 0.05 -0.17 0.41 0.00 0.41 0.00 0.00 173.24 173.94 2j5g s ALA 113 N 1.17 3.50 -0.55 1.44 0.00 -0.36 -0.78 121.76 126.18 2j5g s ALA 113 Ca 0.34 -2.90 -0.25 0.00 0.00 0.00 0.00 51.96 49.16 2j5g s ALA 113 Cb -0.17 -2.78 0.04 0.00 0.00 0.00 0.00 23.12 20.21 2j5g s ALA 113 CO 0.15 -2.01 0.97 0.08 0.00 0.00 0.00 175.76 174.95 2j5g s VAL 114 N 0.65 4.36 -1.20 0.00 1.01 0.67 -4.16 120.40 121.74 2j5g s VAL 114 Ca 0.12 0.37 0.11 0.00 0.00 0.00 0.00 61.98 62.58 2j5g s VAL 114 Cb -0.21 -4.55 0.47 0.00 0.00 0.00 0.00 36.38 32.09 2j5g s VAL 114 CO -0.03 -1.12 1.31 -0.46 0.00 0.00 0.00 175.10 174.80 2j5g n ASN 115 N 7.54 3.31 0.00 3.32 0.23 -1.26 -0.96 115.26 127.44 2j5g n ASN 115 Ca 0.03 -2.32 0.00 0.00 -0.53 0.00 0.00 54.58 51.76 2j5g n ASN 115 Cb 0.48 -0.48 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 2j5g n ASN 115 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2j5g n GLY 116 N 0.78 0.05 3.64 4.83 0.00 -1.26 -4.03 105.19 109.20 2j5g n GLY 116 Ca 0.17 -1.39 -0.46 0.00 0.00 0.00 0.00 46.02 44.33 2j5g n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j5g n ALA 117 N -0.37 0.55 -3.83 4.61 0.00 -1.25 -3.45 120.51 116.78 2j5g n ALA 117 Ca 0.00 0.44 -0.29 0.00 0.00 0.00 0.00 53.44 53.58 2j5g n ALA 117 Cb 0.00 -2.21 -0.13 0.00 0.00 0.00 0.00 19.45 17.11 2j5g n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2j5g s ALA 118 N 0.09 2.92 -0.77 0.00 0.00 0.19 -0.74 121.76 123.45 2j5g s ALA 118 Ca 0.72 -3.11 0.16 0.00 0.00 0.00 0.00 51.96 49.73 2j5g s ALA 118 Cb -0.72 -2.04 -0.18 0.00 0.00 0.00 0.00 23.12 20.18 2j5g s ALA 118 CO 0.48 -2.05 0.70 1.28 0.00 0.00 0.00 175.76 176.17 2j5g n LEU 119 N 3.03 0.77 -3.82 0.00 4.77 -0.11 -1.74 117.00 119.90 2j5g n LEU 119 Ca 0.10 -0.49 -0.11 0.00 -0.03 0.00 0.00 56.01 55.48 2j5g n LEU 119 Cb 0.34 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.35 2j5g n LEU 119 CO 0.28 0.19 -0.06 -1.48 -1.33 0.00 0.00 177.39 174.99 2j5g s LEU 120 N -2.80 1.23 -1.75 2.23 2.34 -1.22 -1.28 118.68 117.44 2j5g s LEU 120 Ca 0.06 -0.31 0.00 0.00 0.06 0.00 0.00 54.13 53.94 2j5g s LEU 120 Cb 0.12 1.06 0.00 0.00 -0.56 0.00 0.00 46.19 46.82 2j5g s LEU 120 CO 0.68 -0.57 0.00 1.41 -1.06 0.00 0.00 176.35 176.81 2j5g n HIS 121 N 0.67 -0.83 0.30 3.48 8.25 -1.26 -4.78 115.22 121.06 2j5g n HIS 121 Ca -0.19 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.42 2j5g n HIS 121 Cb 0.59 -3.64 0.68 0.00 1.12 0.00 0.00 29.99 28.75 2j5g n HIS 121 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2j5g h SER 122 N 0.00 0.00 -0.36 0.41 4.64 -1.89 -1.56 113.55 114.78 2j5g h SER 122 Ca -0.44 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 60.98 2j5g h SER 122 Cb 1.32 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.39 2j5g h SER 122 CO 0.55 0.00 0.33 1.05 -0.87 0.00 0.00 176.83 177.89 2j5g h GLU 123 N 0.00 0.00 -0.54 4.77 9.09 -1.93 -0.74 114.58 125.23 2j5g h GLU 123 Ca 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.41 2j5g h GLU 123 Cb 0.24 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.32 2j5g h GLU 123 CO 0.00 0.00 0.32 1.88 0.05 0.00 0.00 179.01 181.26 2j5g h TYR 124 N 0.00 0.72 -0.56 2.06 0.05 -1.68 -2.38 116.97 115.18 2j5g h TYR 124 Ca 0.17 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.95 2j5g h TYR 124 Cb 0.84 -0.24 -0.03 0.00 1.01 0.00 0.00 36.73 38.31 2j5g h TYR 124 CO 0.00 0.50 0.35 0.82 -1.05 0.00 0.00 178.16 178.79 2j5g h ILE 125 N 0.73 1.15 -0.02 -2.88 2.04 -1.33 -2.13 117.51 115.07 2j5g h ILE 125 Ca 0.19 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.74 2j5g h ILE 125 Cb -0.00 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 36.42 2j5g h ILE 125 CO -0.04 0.15 0.00 0.18 0.00 0.00 0.00 178.15 178.45 2j5g n LEU 126 N -4.43 0.12 0.00 1.44 4.77 -0.91 -1.42 117.00 116.56 2j5g n LEU 126 Ca 0.05 -0.06 0.11 0.00 -0.03 0.00 0.00 56.01 56.08 2j5g n LEU 126 Cb 0.06 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.11 2j5g n LEU 126 CO 0.36 0.03 0.02 0.35 -1.33 0.00 0.00 177.39 176.82 2j5g n THR 127 N -0.46 0.02 -3.11 -5.08 -2.24 -0.80 -5.03 114.28 97.58 2j5g n THR 127 Ca 0.02 -0.06 -0.23 0.00 -2.27 0.00 0.00 64.05 61.50 2j5g n THR 127 Cb 0.02 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 68.92 2j5g n THR 127 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2j5g s THR 128 N -3.06 4.34 -0.03 4.28 -4.23 -0.51 -4.91 115.64 111.52 2j5g s THR 128 Ca 0.07 -0.49 0.11 0.00 -1.18 0.00 0.00 61.69 60.20 2j5g s THR 128 Cb 0.16 -3.59 -0.23 0.00 1.34 0.00 0.00 72.50 70.18 2j5g s THR 128 CO 0.83 -0.40 0.70 0.44 -0.54 0.00 0.00 174.62 175.64 2j5g h ASP 129 N 0.52 0.02 -3.34 3.99 5.19 -0.89 -3.46 116.42 118.45 2j5g h ASP 129 Ca -0.47 -0.04 -0.42 0.00 -0.62 0.00 0.00 57.03 55.48 2j5g h ASP 129 Cb 1.24 -0.01 -0.36 0.00 0.18 0.00 0.00 39.33 40.38 2j5g h ASP 129 CO 0.58 1.04 -0.77 -0.63 -3.12 0.00 0.00 179.24 176.35 2j5g s ILE 130 N -2.60 0.38 -0.24 0.35 1.01 -1.10 -5.04 121.20 113.97 2j5g s ILE 130 Ca -0.05 0.06 -0.00 0.00 0.00 0.00 0.00 60.65 60.66 2j5g s ILE 130 Cb 0.08 -0.50 0.03 0.00 0.01 0.00 0.00 42.46 42.08 2j5g s ILE 130 CO 0.82 0.23 -0.09 -0.63 0.00 0.00 0.00 174.94 175.27 2j5g s ILE 131 N 1.57 2.58 -0.05 2.92 1.01 -1.26 -0.59 121.20 127.38 2j5g s ILE 131 Ca -0.01 -1.16 0.02 0.00 0.00 0.00 0.00 60.65 59.50 2j5g s ILE 131 Cb -0.13 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 39.98 2j5g s ILE 131 CO -0.03 0.19 -0.09 -0.76 0.00 0.00 0.00 174.94 174.24 2j5g s LEU 132 N 1.27 3.02 0.02 2.97 1.43 0.04 0.00 118.68 127.42 2j5g s LEU 132 Ca -0.01 -0.10 0.02 0.00 -1.03 0.00 0.00 54.13 53.01 2j5g s LEU 132 Cb -0.17 -1.66 -0.01 0.00 0.03 0.00 0.00 46.19 44.38 2j5g s LEU 132 CO -0.06 0.34 -0.07 0.00 0.23 0.00 0.00 176.35 176.79 2j5g s ALA 133 N -0.82 0.56 0.63 4.21 0.00 -0.73 -0.24 121.76 125.37 2j5g s ALA 133 Ca 0.13 -0.47 -0.13 0.00 0.00 0.00 0.00 51.96 51.49 2j5g s ALA 133 Cb -0.11 -0.07 -0.03 0.00 0.00 0.00 0.00 23.12 22.92 2j5g s ALA 133 CO 0.02 0.08 1.04 -1.54 0.00 0.00 0.00 175.76 175.36 2j5g s SER 134 N -0.71 5.82 0.51 0.00 1.04 -0.13 -0.87 113.70 119.36 2j5g s SER 134 Ca -0.02 1.65 0.22 0.00 0.48 0.00 0.00 55.95 58.27 2j5g s SER 134 Cb -0.05 -2.51 1.32 0.00 0.10 0.00 0.00 66.02 64.88 2j5g s SER 134 CO 0.00 -1.15 2.02 -0.33 0.98 0.00 0.00 173.24 174.76 2j5g h GLU 135 N -0.05 0.06 0.00 4.02 5.08 -1.33 -1.32 114.58 121.05 2j5g h GLU 135 Ca -0.45 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 2j5g h GLU 135 Cb 1.21 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.44 2j5g h GLU 135 CO 0.58 0.04 0.00 0.27 -1.00 0.00 0.00 179.01 178.91 2j5g n ASN 136 N -4.42 0.00 -4.77 1.42 2.04 -1.26 -4.54 115.26 103.73 2j5g n ASN 136 Ca 0.08 0.36 -0.40 0.00 -0.44 0.00 0.00 54.58 54.18 2j5g n ASN 136 Cb 0.49 -0.45 -0.02 0.00 -2.53 0.00 0.00 39.78 37.28 2j5g n ASN 136 CO 0.00 0.00 0.00 -0.89 -0.44 0.00 0.00 177.26 175.93 2j5g s THR 137 N -2.90 2.79 0.01 5.53 2.01 -0.50 -4.46 115.64 118.12 2j5g s THR 137 Ca 0.15 0.75 0.03 0.00 0.31 0.00 0.00 61.69 62.92 2j5g s THR 137 Cb 0.17 -3.45 -0.01 0.00 0.01 0.00 0.00 72.50 69.21 2j5g s THR 137 CO 0.44 0.14 -0.09 0.68 -0.69 0.00 0.00 174.62 175.11 2j5g s VAL 138 N -1.22 0.68 -0.07 3.82 -7.23 -1.26 -1.18 120.40 113.93 2j5g s VAL 138 Ca 0.53 -0.51 0.01 0.00 -1.81 0.00 0.00 61.98 60.19 2j5g s VAL 138 Cb -0.37 -0.60 -0.03 0.00 0.56 0.00 0.00 36.38 35.94 2j5g s VAL 138 CO 0.49 0.09 -0.09 -0.36 -0.31 0.00 0.00 175.10 174.91 2j5g s PHE 139 N -0.42 2.87 -0.07 2.82 0.40 0.90 -0.64 117.98 123.85 2j5g s PHE 139 Ca 0.01 -0.08 -0.30 0.00 -0.60 0.00 0.00 56.93 55.96 2j5g s PHE 139 Cb -0.05 -1.71 0.07 0.00 0.51 0.00 0.00 43.02 41.84 2j5g s PHE 139 CO -0.00 0.24 0.68 -1.14 0.70 0.00 0.00 175.22 175.70 2j5g s GLN 140 N -0.66 1.03 -1.02 0.44 0.74 -0.71 -0.77 119.66 118.71 2j5g s GLN 140 Ca 0.10 0.31 -0.15 0.00 0.05 0.00 0.00 55.36 55.67 2j5g s GLN 140 Cb -0.11 0.49 0.19 0.00 1.10 0.00 0.00 33.01 34.67 2j5g s GLN 140 CO 0.01 -0.31 1.13 0.34 -0.55 0.00 0.00 175.29 175.91 2j5g s ASP 141 N -1.07 6.91 -0.07 6.67 2.15 -1.26 -4.01 116.67 125.98 2j5g s ASP 141 Ca -0.10 -2.73 -0.27 0.00 0.43 0.00 0.00 52.55 49.88 2j5g s ASP 141 Cb -0.01 -2.32 -0.23 0.00 -0.30 0.00 0.00 42.92 40.06 2j5g s ASP 141 CO 0.09 -0.72 1.03 -0.03 -0.17 0.00 0.00 175.17 175.37 2j5g h MET 142 N 7.74 0.05 0.00 4.34 1.85 -1.55 -3.41 114.93 123.94 2j5g h MET 142 Ca 0.19 -0.04 -0.12 0.00 -0.61 0.00 0.00 59.70 59.12 2j5g h MET 142 Cb 0.96 0.01 -0.02 0.00 0.43 0.00 0.00 31.60 32.98 2j5g h MET 142 CO 1.05 0.78 -0.59 -1.00 -0.40 0.00 0.00 176.91 176.75 2j5g h PRO 143 N -0.67 0.00 0.18 0.39 0.13 -1.91 -3.26 132.00 126.85 2j5g h PRO 143 Ca -0.01 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 2j5g h PRO 143 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 2j5g h PRO 143 CO 0.01 0.59 -0.09 0.45 -0.23 0.00 0.00 178.00 178.74 2j5g h HIS 144 N 0.00 -0.22 0.00 1.56 3.86 -1.84 -1.42 115.15 117.09 2j5g h HIS 144 Ca -0.01 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 2j5g h HIS 144 Cb 1.38 0.07 0.00 0.00 1.06 0.00 0.00 27.41 29.92 2j5g h HIS 144 CO 0.00 0.15 0.00 -0.07 0.86 0.00 0.00 177.93 178.87 2j5g h LEU 145 N -0.65 0.00 -0.94 2.43 4.07 -1.73 0.82 115.31 119.31 2j5g h LEU 145 Ca -0.02 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.84 2j5g h LEU 145 Cb 0.47 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.20 2j5g h LEU 145 CO 0.04 0.00 -0.29 0.78 -1.08 0.00 0.00 178.44 177.89 2j5g h ASN 146 N 0.00 0.43 0.80 -0.43 4.21 -1.57 -3.15 115.58 115.88 2j5g h ASN 146 Ca 0.00 -0.15 0.00 0.00 1.21 0.00 0.00 56.30 57.36 2j5g h ASN 146 Cb 0.67 -0.12 0.00 0.00 -1.12 0.00 0.00 38.32 37.76 2j5g h ASN 146 CO 0.00 0.71 -0.78 0.00 -1.29 0.00 0.00 177.43 176.07 2j5g h ALA 147 N 1.33 0.51 0.00 -0.83 0.00 -0.55 -3.48 119.26 116.23 2j5g h ALA 147 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2j5g h ALA 147 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2j5g h ALA 147 CO 0.05 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.71 2j5g n GLY 148 N 1.31 0.54 3.39 0.00 0.00 0.16 -5.07 105.19 105.53 2j5g n GLY 148 Ca 0.02 -0.83 -0.20 0.00 0.00 0.00 0.00 46.02 45.01 2j5g n GLY 148 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2j5g s ILE 149 N -2.00 1.81 0.26 -0.61 -4.36 -0.46 -4.84 121.20 111.00 2j5g s ILE 149 Ca 0.00 -2.20 -0.30 0.00 -0.26 0.00 0.00 60.65 57.89 2j5g s ILE 149 Cb 0.00 -2.24 -0.10 0.00 1.25 0.00 0.00 42.46 41.38 2j5g s ILE 149 CO 0.00 -0.46 1.34 -0.69 0.24 0.00 0.00 174.94 175.37 2j5g s VAL 150 N -2.92 2.89 -1.13 8.37 1.01 -1.26 -4.14 120.40 123.22 2j5g s VAL 150 Ca 0.26 0.79 -0.19 0.00 0.00 0.00 0.00 61.98 62.84 2j5g s VAL 150 Cb 0.00 -3.50 -0.05 0.00 0.00 0.00 0.00 36.38 32.83 2j5g s VAL 150 CO 0.10 0.15 2.01 -0.81 0.00 0.00 0.00 175.10 176.55 2j5g n PRO 151 N 1.86 2.21 -0.20 2.72 -0.04 -1.26 -4.64 135.00 135.65 2j5g n PRO 151 Ca 0.04 -2.37 0.07 0.00 -0.04 0.00 0.00 63.50 61.20 2j5g n PRO 151 Cb 0.42 -3.22 0.16 0.00 -0.04 0.00 0.00 33.50 30.81 2j5g n PRO 151 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2j5g n GLY 152 N 4.64 3.84 1.66 0.55 0.00 -1.26 -3.16 105.19 111.45 2j5g n GLY 152 Ca 0.50 -0.74 0.07 0.00 0.00 0.00 0.00 46.02 45.85 2j5g n GLY 152 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2j5g n ASP 153 N -0.58 4.94 0.00 1.61 5.68 -1.26 -1.91 116.55 125.03 2j5g n ASP 153 Ca 0.14 -2.65 0.00 0.00 -0.50 0.00 0.00 54.79 51.77 2j5g n ASP 153 Cb 0.61 -0.62 0.00 0.00 -1.14 0.00 0.00 41.12 39.97 2j5g n ASP 153 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2j5g n GLY 154 N 0.80 0.88 0.28 6.12 0.00 -1.26 -4.94 105.19 107.07 2j5g n GLY 154 Ca 0.25 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.38 2j5g n GLY 154 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2j5g h VAL 155 N 0.00 0.85 0.00 1.61 -1.51 -1.89 -0.21 116.25 115.11 2j5g h VAL 155 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.46 2j5g h VAL 155 Cb 0.00 0.97 -0.00 0.00 -2.13 0.00 0.00 31.29 30.13 2j5g h VAL 155 CO 0.00 0.00 -0.07 1.12 -1.23 0.00 0.00 177.57 177.39 2j5g h HIS 156 N 0.00 0.00 0.01 5.19 2.07 -1.89 -1.71 115.15 118.81 2j5g h HIS 156 Ca 0.03 0.00 -0.39 0.00 -2.85 0.00 0.00 60.37 57.15 2j5g h HIS 156 Cb 0.11 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 30.03 2j5g h HIS 156 CO 0.00 0.07 -2.18 -0.89 -3.07 0.00 0.00 177.93 171.85 2j5g n ILE 157 N -3.22 1.54 0.08 6.12 5.41 -0.73 -4.51 119.36 124.05 2j5g n ILE 157 Ca -0.00 -0.32 -0.14 0.00 1.00 0.00 0.00 62.75 63.28 2j5g n ILE 157 Cb 0.31 -1.87 -0.14 0.00 -0.71 0.00 0.00 39.64 37.23 2j5g n ILE 157 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2j5g h LEU 158 N -0.86 0.33 -0.45 1.39 3.38 -1.05 -2.17 115.31 115.89 2j5g h LEU 158 Ca -0.59 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 56.92 2j5g h LEU 158 Cb 1.58 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 42.21 2j5g h LEU 158 CO -0.32 1.30 -0.03 -0.50 0.09 0.00 0.00 178.44 178.98 2j5g h TRP 159 N 0.06 0.89 0.00 1.13 4.06 -1.52 -0.15 115.95 120.42 2j5g h TRP 159 Ca -0.14 -0.17 -0.04 0.00 2.06 0.00 0.00 58.89 60.60 2j5g h TRP 159 Cb 1.95 -0.23 -0.01 0.00 -1.00 0.00 0.00 29.16 29.87 2j5g h TRP 159 CO 0.05 0.88 -0.20 -1.35 -3.56 0.00 0.00 178.44 174.25 2j5g h PRO 160 N 0.65 0.00 -0.02 0.49 0.11 -1.74 0.19 132.00 131.69 2j5g h PRO 160 Ca 0.12 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.23 2j5g h PRO 160 Cb 0.54 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.65 2j5g h PRO 160 CO 0.03 0.20 0.00 -0.07 -0.21 0.00 0.00 178.00 177.96 2j5g h LEU 161 N 0.00 0.02 -0.38 2.35 3.38 -1.11 0.20 115.31 119.78 2j5g h LEU 161 Ca -0.00 -0.23 -0.05 0.00 0.09 0.00 0.00 57.88 57.70 2j5g h LEU 161 Cb 0.46 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2j5g h LEU 161 CO 0.03 0.24 0.06 0.00 0.09 0.00 0.00 178.44 178.86 2j5g h ALA 162 N 0.78 0.50 -0.04 1.53 0.00 -0.56 -3.23 119.26 118.24 2j5g h ALA 162 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2j5g h ALA 162 Cb 0.23 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2j5g h ALA 162 CO 0.00 0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.74 2j5g n LEU 163 N -4.54 2.73 0.00 0.00 4.77 0.61 -4.80 117.00 115.77 2j5g n LEU 163 Ca -0.01 -1.03 0.00 0.00 -0.03 0.00 0.00 56.01 54.94 2j5g n LEU 163 Cb 0.23 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 2j5g n LEU 163 CO 0.39 0.48 0.00 0.61 -1.33 0.00 0.00 177.39 177.54 2j5g n GLY 164 N 1.15 -1.88 0.14 -0.72 0.00 0.05 -3.95 105.19 99.98 2j5g n GLY 164 Ca 0.12 -1.52 0.05 0.00 0.00 0.00 0.00 46.02 44.67 2j5g n GLY 164 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2j5g n LEU 165 N -2.01 0.40 -0.01 0.99 4.77 -1.18 -0.47 117.00 119.50 2j5g n LEU 165 Ca 0.00 -0.19 -0.02 0.00 -0.03 0.00 0.00 56.01 55.78 2j5g n LEU 165 Cb 0.00 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.04 2j5g n LEU 165 CO 0.00 0.09 -0.12 -1.22 -1.33 0.00 0.00 177.39 174.81 2j5g n TYR 166 N -0.38 0.00 -0.01 -1.77 4.02 -1.26 -4.34 117.16 113.41 2j5g n TYR 166 Ca 0.07 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 58.03 2j5g n TYR 166 Cb 0.09 -0.09 0.46 0.00 -0.02 0.00 0.00 39.34 39.78 2j5g n TYR 166 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 2j5g h ARG 167 N -0.18 0.46 -0.61 -0.72 9.65 -1.71 -1.63 114.38 119.64 2j5g h ARG 167 Ca 0.00 -0.03 -0.07 0.00 -1.10 0.00 0.00 59.98 58.78 2j5g h ARG 167 Cb 0.18 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.63 2j5g h ARG 167 CO 0.00 0.30 0.09 0.78 2.80 0.00 0.00 179.97 183.94 2j5g h GLY 168 N 0.47 1.07 1.39 2.80 0.00 -0.90 0.12 103.07 108.01 2j5g h GLY 168 Ca 0.18 -0.69 -0.18 0.00 0.00 0.00 0.00 47.33 46.64 2j5g h GLY 168 CO -0.05 0.64 -0.63 3.21 0.00 0.00 0.00 176.54 179.71 2j5g h ARG 169 N 0.93 0.63 -0.60 4.80 3.08 -1.56 -2.38 114.38 119.29 2j5g h ARG 169 Ca 0.19 -0.44 0.02 0.00 0.07 0.00 0.00 59.98 59.81 2j5g h ARG 169 Cb 0.41 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.50 2j5g h ARG 169 CO 0.01 1.06 0.38 -0.92 -1.07 0.00 0.00 179.97 179.43 2j5g h TYR 170 N 0.46 0.72 -0.54 3.04 3.20 -1.02 0.09 116.97 122.91 2j5g h TYR 170 Ca -0.01 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 2j5g h TYR 170 Cb 1.21 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 39.22 2j5g h TYR 170 CO 0.06 0.43 0.28 0.35 -1.64 0.00 0.00 178.16 177.64 2j5g h PHE 171 N 0.76 0.77 -0.04 -3.82 3.57 -0.67 -1.33 116.94 116.19 2j5g h PHE 171 Ca 0.23 -0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.64 2j5g h PHE 171 Cb -0.04 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 38.46 2j5g h PHE 171 CO -0.04 0.58 -0.21 -0.07 -2.23 0.00 0.00 178.31 176.33 2j5g h LEU 172 N 0.73 0.25 -1.33 0.59 3.38 -1.27 -1.69 115.31 115.98 2j5g h LEU 172 Ca 0.19 -0.68 -0.07 0.00 0.09 0.00 0.00 57.88 57.41 2j5g h LEU 172 Cb 0.09 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2j5g h LEU 172 CO -0.03 0.89 -0.33 -0.26 0.09 0.00 0.00 178.44 178.80 2j5g h PHE 173 N -0.37 0.00 -0.37 1.13 -1.00 -0.87 -2.93 116.94 112.54 2j5g h PHE 173 Ca -0.02 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.76 2j5g h PHE 173 Cb 0.89 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.45 2j5g h PHE 173 CO 0.15 0.33 0.00 0.25 -1.61 0.00 0.00 178.31 177.43 2j5g n THR 174 N -4.02 0.62 -4.01 -1.55 -2.24 -0.51 -4.97 114.28 97.60 2j5g n THR 174 Ca -0.02 -0.81 -0.30 0.00 -2.27 0.00 0.00 64.05 60.65 2j5g n THR 174 Cb 0.38 0.84 -0.00 0.00 -2.10 0.00 0.00 70.33 69.45 2j5g n THR 174 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2j5g n GLN 175 N 1.15 -4.05 -1.77 -0.78 6.02 -0.90 -4.89 117.38 112.16 2j5g n GLN 175 Ca 0.16 0.47 -0.40 0.00 -0.01 0.00 0.00 57.00 57.22 2j5g n GLN 175 Cb 0.52 -5.06 0.01 0.00 1.02 0.00 0.00 30.24 26.73 2j5g n GLN 175 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 2j5g n GLU 176 N -4.46 2.41 -3.96 -1.09 2.13 -0.69 -4.84 120.64 110.14 2j5g n GLU 176 Ca -0.08 0.85 -0.35 0.00 0.66 0.00 0.00 57.16 58.24 2j5g n GLU 176 Cb 0.57 -2.65 -0.09 0.00 0.27 0.00 0.00 31.44 29.55 2j5g n GLU 176 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2j5g s LYS 177 N -2.32 3.84 -0.15 5.31 2.20 -1.26 -4.38 119.74 122.97 2j5g s LYS 177 Ca 0.58 -0.29 -0.02 0.00 -0.36 0.00 0.00 55.97 55.89 2j5g s LYS 177 Cb -0.46 -3.21 -0.02 0.00 -1.51 0.00 0.00 37.83 32.63 2j5g s LYS 177 CO 0.60 0.41 -0.09 -0.51 -0.36 0.00 0.00 175.35 175.40 2j5g s LEU 178 N 0.01 2.93 0.97 5.43 1.43 0.05 -4.94 118.68 124.54 2j5g s LEU 178 Ca 0.07 -0.27 -0.12 0.00 -1.03 0.00 0.00 54.13 52.78 2j5g s LEU 178 Cb -0.12 -1.69 0.17 0.00 0.03 0.00 0.00 46.19 44.58 2j5g s LEU 178 CO 0.00 0.14 1.09 0.42 0.23 0.00 0.00 176.35 178.24 2j5g s THR 179 N 0.51 2.29 0.23 5.49 -4.23 -1.26 -0.07 115.64 118.59 2j5g s THR 179 Ca -0.06 0.09 -0.07 0.00 -1.18 0.00 0.00 61.69 60.47 2j5g s THR 179 Cb -0.15 -2.57 0.18 0.00 1.34 0.00 0.00 72.50 71.30 2j5g s THR 179 CO 0.03 -0.12 1.77 0.00 -0.54 0.00 0.00 174.62 175.77 2j5g h ALA 180 N -1.79 0.97 -0.52 3.99 0.00 -1.39 -0.39 119.26 120.13 2j5g h ALA 180 Ca -0.53 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.39 2j5g h ALA 180 Cb 1.31 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 2j5g h ALA 180 CO 0.56 -0.06 0.12 0.37 0.00 0.00 0.00 179.25 180.23 2j5g h GLN 181 N 0.58 0.84 -0.46 0.00 5.75 -1.87 0.51 115.11 120.46 2j5g h GLN 181 Ca 0.35 -0.21 -0.01 0.00 -0.15 0.00 0.00 58.65 58.63 2j5g h GLN 181 Cb 0.38 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.80 2j5g h GLN 181 CO -0.28 0.81 0.24 1.96 -2.65 0.00 0.00 178.83 178.91 2j5g h GLN 182 N 0.73 0.65 -0.42 1.69 4.20 -1.81 -1.33 115.11 118.82 2j5g h GLN 182 Ca 0.16 -0.08 -0.04 0.00 0.06 0.00 0.00 58.65 58.75 2j5g h GLN 182 Cb 0.35 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 2j5g h GLN 182 CO 0.00 0.52 0.10 0.00 -0.67 0.00 0.00 178.83 178.78 2j5g h ALA 183 N 1.09 1.39 -0.25 3.87 0.00 -0.80 -0.97 119.26 123.58 2j5g h ALA 183 Ca 0.16 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2j5g h ALA 183 Cb 0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2j5g h ALA 183 CO -0.02 0.44 0.10 -0.92 0.00 0.00 0.00 179.25 178.85 2j5g h TYR 184 N 0.61 0.38 0.00 0.00 3.20 -0.57 -1.22 116.97 119.37 2j5g h TYR 184 Ca 0.14 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 2j5g h TYR 184 Cb 0.24 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.39 2j5g h TYR 184 CO 0.01 0.39 -0.06 0.93 -1.64 0.00 0.00 178.16 177.79 2j5g h GLU 185 N 0.26 0.00 -0.11 1.82 5.08 -0.78 -1.27 114.58 119.57 2j5g h GLU 185 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2j5g h GLU 185 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2j5g h GLU 185 CO -0.01 0.06 0.00 1.28 -1.00 0.00 0.00 179.01 179.34 2j5g n LEU 186 N -4.43 1.35 -0.07 1.33 4.77 -0.41 -4.93 117.00 114.62 2j5g n LEU 186 Ca -0.03 -0.55 -0.01 0.00 -0.03 0.00 0.00 56.01 55.40 2j5g n LEU 186 Cb 0.14 -0.07 -0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2j5g n LEU 186 CO 0.34 0.27 -0.01 0.59 -1.33 0.00 0.00 177.39 177.26 2j5g n ASN 187 N 0.10 -4.11 -0.05 -1.43 3.02 -0.48 -4.86 115.26 107.45 2j5g n ASN 187 Ca 0.16 0.02 -0.15 0.00 -0.03 0.00 0.00 54.58 54.59 2j5g n ASN 187 Cb 0.29 -1.69 -0.13 0.00 -0.61 0.00 0.00 39.78 37.64 2j5g n ASN 187 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 2j5g h VAL 188 N 0.00 1.75 -3.11 2.41 2.07 -1.47 -3.44 116.25 114.46 2j5g h VAL 188 Ca -0.02 -2.35 -0.60 0.00 0.82 0.00 0.00 66.70 64.56 2j5g h VAL 188 Cb 0.39 3.34 -0.06 0.00 -1.52 0.00 0.00 31.29 33.44 2j5g h VAL 188 CO 0.03 0.62 -0.17 -0.69 0.02 0.00 0.00 177.57 177.38 2j5g s VAL 189 N -2.30 5.01 -0.13 2.57 1.01 -0.92 -4.62 120.40 121.03 2j5g s VAL 189 Ca -0.18 0.91 0.19 0.00 0.00 0.00 0.00 61.98 62.90 2j5g s VAL 189 Cb -0.02 -3.76 -0.28 0.00 0.00 0.00 0.00 36.38 32.32 2j5g s VAL 189 CO 0.71 0.53 0.23 1.41 0.00 0.00 0.00 175.10 177.98 2j5g n HIS 190 N 2.17 0.00 -3.77 5.22 -0.00 0.10 -4.07 115.22 114.87 2j5g n HIS 190 Ca -0.12 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.47 2j5g n HIS 190 Cb 0.52 -0.77 -0.12 0.00 -0.00 0.00 0.00 29.99 29.62 2j5g n HIS 190 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 2j5g s GLU 191 N -2.88 0.31 -0.20 -0.41 2.02 -1.21 -5.05 118.70 111.27 2j5g s GLU 191 Ca -0.09 0.39 -0.06 0.00 0.02 0.00 0.00 54.97 55.23 2j5g s GLU 191 Cb 0.09 0.13 -0.03 0.00 0.10 0.00 0.00 34.13 34.42 2j5g s GLU 191 CO 0.83 -0.05 0.03 0.08 0.02 0.00 0.00 175.26 176.17 2j5g s VAL 192 N 0.25 4.24 0.15 2.63 1.01 -1.26 -1.78 120.40 125.64 2j5g s VAL 192 Ca -0.01 -0.22 0.10 0.00 0.00 0.00 0.00 61.98 61.86 2j5g s VAL 192 Cb -0.03 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 2j5g s VAL 192 CO -0.01 0.42 -0.24 -0.76 0.00 0.00 0.00 175.10 174.51 2j5g s LEU 193 N 0.91 2.36 0.52 3.92 2.01 -0.05 -4.93 118.68 123.42 2j5g s LEU 193 Ca 0.02 -0.79 -0.22 0.00 0.01 0.00 0.00 54.13 53.15 2j5g s LEU 193 Cb -0.14 -1.11 -0.06 0.00 0.01 0.00 0.00 46.19 44.89 2j5g s LEU 193 CO 0.02 0.12 1.22 -2.65 1.01 0.00 0.00 176.35 176.07 2j5g n PRO 194 N 0.68 1.54 -0.28 1.29 -0.02 -1.26 -0.90 135.00 136.06 2j5g n PRO 194 Ca -0.16 0.57 0.06 0.00 -2.02 0.00 0.00 63.50 61.95 2j5g n PRO 194 Cb 0.54 -2.39 0.16 0.00 -0.02 0.00 0.00 33.50 31.79 2j5g n PRO 194 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2j5g h GLN 195 N 1.39 0.05 0.00 -0.52 4.15 -1.94 0.60 115.11 118.84 2j5g h GLN 195 Ca -0.49 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.93 2j5g h GLN 195 Cb 1.32 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 29.00 2j5g h GLN 195 CO 0.56 0.03 0.00 -1.13 -1.93 0.00 0.00 178.83 176.37 2j5g n SER 196 N -5.43 0.00 -0.05 -0.69 3.41 -1.26 -3.00 113.62 106.60 2j5g n SER 196 Ca 0.15 -0.23 0.02 0.00 -0.26 0.00 0.00 58.87 58.55 2j5g n SER 196 Cb 0.51 -0.20 -0.01 0.00 -0.26 0.00 0.00 64.21 64.24 2j5g n SER 196 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2j5g n LYS 197 N -1.20 4.02 0.21 4.33 4.76 0.14 -4.80 118.16 125.62 2j5g n LYS 197 Ca 0.13 -0.21 -0.15 0.00 -2.87 0.00 0.00 58.31 55.21 2j5g n LYS 197 Cb 0.15 -0.81 -0.07 0.00 -1.84 0.00 0.00 35.03 32.46 2j5g n LYS 197 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 2j5g h LEU 198 N 0.25 -0.57 -0.76 -0.35 5.85 -1.28 -2.28 115.31 116.18 2j5g h LEU 198 Ca 0.00 0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 2j5g h LEU 198 Cb 0.13 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 2j5g h LEU 198 CO 0.00 -0.35 -0.12 0.24 -0.34 0.00 0.00 178.44 177.87 2j5g h MET 199 N -0.54 0.82 -0.74 1.25 2.86 -1.87 -1.08 114.93 115.63 2j5g h MET 199 Ca -0.03 -0.28 0.03 0.00 -2.06 0.00 0.00 59.70 57.36 2j5g h MET 199 Cb 0.46 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 32.01 2j5g h MET 199 CO 0.02 0.90 0.46 1.49 1.06 0.00 0.00 176.91 180.84 2j5g h GLU 200 N 0.74 0.87 -0.58 1.72 4.81 -1.86 -1.52 114.58 118.75 2j5g h GLU 200 Ca 0.12 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.20 2j5g h GLU 200 Cb 0.62 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 2j5g h GLU 200 CO 0.04 0.57 -0.01 -0.09 -0.73 0.00 0.00 179.01 178.79 2j5g h ARG 201 N 0.89 1.03 -0.43 1.92 9.65 -0.93 -0.56 114.38 125.96 2j5g h ARG 201 Ca 0.30 -0.34 0.05 0.00 -1.10 0.00 0.00 59.98 58.89 2j5g h ARG 201 Cb 0.04 -0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 28.48 2j5g h ARG 201 CO -0.12 1.03 0.17 0.00 2.80 0.00 0.00 179.97 183.85 2j5g h ALA 202 N 0.97 0.52 -0.34 2.80 0.00 -0.93 -1.33 119.26 120.95 2j5g h ALA 202 Ca 0.16 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.03 2j5g h ALA 202 Cb 0.57 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2j5g h ALA 202 CO 0.03 -0.21 -0.16 -1.49 0.00 0.00 0.00 179.25 177.43 2j5g h TRP 203 N 0.36 0.66 -0.23 0.00 4.06 -1.08 -0.65 115.95 119.07 2j5g h TRP 203 Ca 0.20 -0.12 -0.00 0.00 2.06 0.00 0.00 58.89 61.02 2j5g h TRP 203 Cb 0.16 -0.17 -0.01 0.00 -1.00 0.00 0.00 29.16 28.14 2j5g h TRP 203 CO -0.13 0.73 0.13 1.49 -3.56 0.00 0.00 178.44 177.10 2j5g h GLU 204 N 0.55 0.31 -0.53 0.49 4.81 -0.56 0.11 114.58 119.75 2j5g h GLU 204 Ca 0.09 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.24 2j5g h GLU 204 Cb 0.58 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.88 2j5g h GLU 204 CO 0.04 0.25 0.12 0.82 -0.73 0.00 0.00 179.01 179.51 2j5g h ILE 205 N 0.28 1.25 -0.98 2.32 2.04 -1.08 -2.20 117.51 119.14 2j5g h ILE 205 Ca 0.08 -0.90 0.02 0.00 1.00 0.00 0.00 64.86 65.06 2j5g h ILE 205 Cb 0.03 0.80 -0.05 0.00 -0.74 0.00 0.00 36.82 36.86 2j5g h ILE 205 CO -0.01 0.33 0.64 0.00 0.00 0.00 0.00 178.15 179.11 2j5g h ALA 206 N 1.00 1.26 -0.27 1.87 0.00 -0.88 -1.28 119.26 120.96 2j5g h ALA 206 Ca 0.17 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 2j5g h ALA 206 Cb 0.36 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2j5g h ALA 206 CO 0.00 0.59 -0.35 0.00 0.00 0.00 0.00 179.25 179.50 2j5g h ARG 207 N 1.29 0.59 -0.42 0.00 3.08 -0.52 0.21 114.38 118.62 2j5g h ARG 207 Ca 0.37 -0.28 -0.04 0.00 0.07 0.00 0.00 59.98 60.10 2j5g h ARG 207 Cb -0.10 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 2j5g h ARG 207 CO -0.09 0.86 0.10 1.15 -1.07 0.00 0.00 179.97 180.91 2j5g h THR 208 N 0.50 1.23 -0.74 2.04 2.02 -1.05 -2.95 112.91 113.95 2j5g h THR 208 Ca 0.05 -0.80 0.02 0.00 0.77 0.00 0.00 66.41 66.44 2j5g h THR 208 Cb 0.84 0.96 -0.04 0.00 -1.74 0.00 0.00 68.15 68.17 2j5g h THR 208 CO 0.07 0.28 0.49 -0.07 0.37 0.00 0.00 175.52 176.66 2j5g h LEU 209 N 0.54 0.83 -1.02 2.58 3.38 -0.86 -2.94 115.31 117.82 2j5g h LEU 209 Ca 0.13 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2j5g h LEU 209 Cb 0.32 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2j5g h LEU 209 CO 0.00 0.59 0.00 0.00 0.09 0.00 0.00 178.44 179.12 2j5g n ALA 210 N -2.31 1.29 0.54 1.53 0.00 0.72 -1.17 120.51 121.11 2j5g n ALA 210 Ca 0.08 0.14 0.12 0.00 0.00 0.00 0.00 53.44 53.77 2j5g n ALA 210 Cb 0.04 -1.32 0.45 0.00 0.00 0.00 0.00 19.45 18.63 2j5g n ALA 210 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2j5g n LYS 211 N -2.18 0.19 -1.78 0.00 5.02 -1.11 -4.80 118.16 113.51 2j5g n LYS 211 Ca 0.00 0.29 -0.34 0.00 -2.02 0.00 0.00 58.31 56.25 2j5g n LYS 211 Cb 0.11 -1.79 0.05 0.00 -0.02 0.00 0.00 35.03 33.38 2j5g n LYS 211 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2j5g s GLN 212 N -3.18 2.77 0.53 1.97 -1.52 -0.32 -5.00 119.66 114.91 2j5g s GLN 212 Ca 0.08 1.50 -0.22 0.00 -1.95 0.00 0.00 55.36 54.77 2j5g s GLN 212 Cb 0.11 -1.94 -0.06 0.00 -0.22 0.00 0.00 33.01 30.91 2j5g s GLN 212 CO 0.48 -1.30 1.20 -2.30 -0.25 0.00 0.00 175.29 173.12 2j5g n PRO 213 N -2.29 1.46 0.02 2.91 -0.02 -1.26 -4.84 135.00 130.98 2j5g n PRO 213 Ca 0.11 0.54 -0.10 0.00 -2.02 0.00 0.00 63.50 62.03 2j5g n PRO 213 Cb 0.51 -2.38 -0.05 0.00 -0.02 0.00 0.00 33.50 31.56 2j5g n PRO 213 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2j5g h THR 214 N 1.26 0.81 -0.24 3.45 2.02 -1.94 -2.00 112.91 116.27 2j5g h THR 214 Ca -0.49 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 66.66 2j5g h THR 214 Cb 1.32 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 68.53 2j5g h THR 214 CO 0.56 0.00 0.04 -0.07 0.37 0.00 0.00 175.52 176.42 2j5g h LEU 215 N -0.09 0.32 -0.65 2.58 3.38 -1.99 -1.26 115.31 117.59 2j5g h LEU 215 Ca 0.05 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2j5g h LEU 215 Cb 0.15 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2j5g h LEU 215 CO -0.11 0.34 0.24 -1.13 0.09 0.00 0.00 178.44 177.87 2j5g h ASN 216 N 0.35 0.92 -0.82 -0.43 -1.24 -1.81 0.79 115.58 113.33 2j5g h ASN 216 Ca 0.08 -0.19 0.00 0.00 0.71 0.00 0.00 56.30 56.91 2j5g h ASN 216 Cb 0.17 -0.24 -0.04 0.00 0.73 0.00 0.00 38.32 38.94 2j5g h ASN 216 CO -0.00 0.86 0.52 -0.07 -1.29 0.00 0.00 177.43 177.45 2j5g h LEU 217 N 0.93 0.97 -0.15 0.34 3.38 -0.62 -0.51 115.31 119.65 2j5g h LEU 217 Ca 0.22 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 2j5g h LEU 217 Cb 0.24 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2j5g h LEU 217 CO -0.01 0.73 -0.31 0.03 0.09 0.00 0.00 178.44 178.97 2j5g h ARG 218 N 1.13 0.47 0.00 1.13 3.08 -0.94 -2.65 114.38 116.60 2j5g h ARG 218 Ca 0.30 -0.31 -0.10 0.00 0.07 0.00 0.00 59.98 59.94 2j5g h ARG 218 Cb -0.08 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 2j5g h ARG 218 CO -0.06 0.92 -0.49 1.88 -1.07 0.00 0.00 179.97 181.15 2j5g h TYR 219 N 0.09 0.00 -0.28 3.04 0.99 -0.80 -1.13 116.97 118.88 2j5g h TYR 219 Ca 0.00 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.67 2j5g h TYR 219 Cb 0.91 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 38.63 2j5g h TYR 219 CO 0.10 0.49 -0.08 1.15 -0.00 0.00 0.00 178.16 179.81 2j5g h THR 220 N 0.00 1.29 -0.50 -2.88 2.02 -1.13 -0.24 112.91 111.45 2j5g h THR 220 Ca -0.00 -1.12 0.09 0.00 0.77 0.00 0.00 66.41 66.14 2j5g h THR 220 Cb 1.32 1.44 -0.07 0.00 -1.74 0.00 0.00 68.15 69.10 2j5g h THR 220 CO 0.06 0.36 0.09 -0.09 0.37 0.00 0.00 175.52 176.31 2j5g h ARG 221 N 0.30 0.21 -0.18 6.66 9.65 -1.24 -1.25 114.38 128.53 2j5g h ARG 221 Ca 0.07 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.94 2j5g h ARG 221 Cb 0.57 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.09 2j5g h ARG 221 CO 0.03 0.14 0.11 0.28 2.80 0.00 0.00 179.97 183.33 2j5g h VAL 222 N 0.22 1.07 -0.47 0.20 2.07 -1.03 -2.15 116.25 116.17 2j5g h VAL 222 Ca 0.25 -0.18 -0.04 0.00 0.82 0.00 0.00 66.70 67.56 2j5g h VAL 222 Cb 0.35 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2j5g h VAL 222 CO -0.35 0.07 0.13 0.00 0.02 0.00 0.00 177.57 177.45 2j5g h ALA 223 N 1.03 1.35 -0.01 1.67 0.00 -0.77 -2.43 119.26 120.11 2j5g h ALA 223 Ca 0.07 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2j5g h ALA 223 Cb 0.02 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2j5g h ALA 223 CO -0.01 0.47 -0.12 1.28 0.00 0.00 0.00 179.25 180.86 2j5g n LEU 224 N -4.31 0.78 -0.15 0.00 4.32 -0.49 -3.77 117.00 113.38 2j5g n LEU 224 Ca 0.03 -0.16 0.02 0.00 -0.02 0.00 0.00 56.01 55.88 2j5g n LEU 224 Cb 0.20 -0.12 0.01 0.00 -1.62 0.00 0.00 43.42 41.89 2j5g n LEU 224 CO 0.39 0.14 0.29 0.35 -1.22 0.00 0.00 177.39 177.33 2j5g n THR 225 N -0.66 0.00 0.12 -5.08 -2.24 -0.83 -4.73 114.28 100.86 2j5g n THR 225 Ca 0.15 -0.49 -0.13 0.00 -2.27 0.00 0.00 64.05 61.31 2j5g n THR 225 Cb 0.30 1.08 -0.07 0.00 -2.10 0.00 0.00 70.33 69.54 2j5g n THR 225 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2j5g h GLN 226 N 0.74 -0.26 -0.56 -0.78 4.15 -1.59 -0.07 115.11 116.73 2j5g h GLN 226 Ca 0.00 0.02 -0.05 0.00 0.77 0.00 0.00 58.65 59.39 2j5g h GLN 226 Cb 0.16 0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.89 2j5g h GLN 226 CO 0.00 -0.17 0.17 -0.09 -1.93 0.00 0.00 178.83 176.80 2j5g h ARG 227 N -0.27 0.88 -0.56 1.69 2.43 -1.86 -1.95 114.38 114.74 2j5g h ARG 227 Ca -0.01 -0.20 0.03 0.00 -0.81 0.00 0.00 59.98 59.00 2j5g h ARG 227 Cb 0.24 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.63 2j5g h ARG 227 CO -0.01 0.80 0.33 1.25 -1.51 0.00 0.00 179.97 180.83 2j5g h LEU 228 N 0.79 0.52 -0.56 3.80 5.85 -1.80 -0.69 115.31 123.22 2j5g h LEU 228 Ca 0.18 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 2j5g h LEU 228 Cb 0.30 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.20 2j5g h LEU 228 CO -0.00 0.36 0.28 0.11 -0.34 0.00 0.00 178.44 178.85 2j5g h LYS 229 N 0.64 0.79 -0.45 1.25 1.57 -0.85 -0.48 116.57 119.05 2j5g h LYS 229 Ca 0.23 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2j5g h LYS 229 Cb 0.05 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 2j5g h LYS 229 CO -0.11 0.64 0.28 -0.09 -0.57 0.00 0.00 179.45 179.59 2j5g h ARG 230 N 0.75 0.61 -0.79 3.15 2.43 -0.72 -0.50 114.38 119.31 2j5g h ARG 230 Ca 0.19 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.26 2j5g h ARG 230 Cb 0.09 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 2j5g h ARG 230 CO -0.03 0.44 0.31 -0.07 -1.51 0.00 0.00 179.97 179.12 2j5g h LEU 231 N 0.60 1.09 -0.20 3.80 3.38 -0.78 -1.00 115.31 122.21 2j5g h LEU 231 Ca 0.16 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 2j5g h LEU 231 Cb -0.02 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 2j5g h LEU 231 CO -0.03 0.97 0.01 0.58 0.09 0.00 0.00 178.44 180.06 2j5g h VAL 232 N 1.15 1.25 -1.00 1.22 2.07 -0.90 -2.86 116.25 117.18 2j5g h VAL 232 Ca 0.26 -0.84 0.12 0.00 0.82 0.00 0.00 66.70 67.07 2j5g h VAL 232 Cb 0.22 1.41 -0.08 0.00 -1.52 0.00 0.00 31.29 31.31 2j5g h VAL 232 CO -0.02 0.26 0.63 0.78 0.02 0.00 0.00 177.57 179.24 2j5g h ASN 233 N 0.12 0.93 -0.51 0.57 2.35 -0.81 -0.85 115.58 117.38 2j5g h ASN 233 Ca 0.06 0.05 0.04 0.00 -0.55 0.00 0.00 56.30 55.89 2j5g h ASN 233 Cb 0.37 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 38.57 2j5g h ASN 233 CO 0.01 0.49 0.28 -0.08 -1.65 0.00 0.00 177.43 176.48 2j5g h GLU 234 N 0.99 0.53 -0.00 0.81 4.81 -0.95 -3.33 114.58 117.44 2j5g h GLU 234 Ca 0.50 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.70 2j5g h GLU 234 Cb 0.49 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.75 2j5g h GLU 234 CO -0.27 0.35 -0.18 0.41 -0.73 0.00 0.00 179.01 178.59 2j5g n GLY 235 N -1.25 -0.10 0.12 1.92 0.00 -0.96 -4.75 105.19 100.17 2j5g n GLY 235 Ca 0.04 -0.21 -0.14 0.00 0.00 0.00 0.00 46.02 45.72 2j5g n GLY 235 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2j5g h ILE 236 N 0.66 1.40 -0.37 -0.61 6.09 -1.27 -1.19 117.51 122.22 2j5g h ILE 236 Ca 0.00 -1.51 -0.02 0.00 -1.37 0.00 0.00 64.86 61.97 2j5g h ILE 236 Cb 0.23 2.16 -0.02 0.00 0.47 0.00 0.00 36.82 39.66 2j5g h ILE 236 CO 0.00 0.43 0.17 1.23 -3.07 0.00 0.00 178.15 176.91 2j5g h GLY 237 N -0.16 0.58 0.95 8.18 0.00 -1.84 -1.55 103.07 109.23 2j5g h GLY 237 Ca 0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 2j5g h GLY 237 CO 0.04 0.28 0.18 -1.82 0.00 0.00 0.00 176.54 175.22 2j5g h TYR 238 N 0.46 0.50 -0.59 5.60 3.20 -1.84 -0.34 116.97 123.95 2j5g h TYR 238 Ca 0.13 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.05 2j5g h TYR 238 Cb 0.14 -0.16 -0.06 0.00 1.54 0.00 0.00 36.73 38.19 2j5g h TYR 238 CO -0.01 0.42 0.26 0.78 -1.64 0.00 0.00 178.16 177.97 2j5g h GLY 239 N 0.43 0.84 1.66 1.82 0.00 -1.05 -0.99 103.07 105.80 2j5g h GLY 239 Ca 0.12 -0.16 -0.12 0.00 0.00 0.00 0.00 47.33 47.17 2j5g h GLY 239 CO -0.02 0.05 -0.44 1.41 0.00 0.00 0.00 176.54 177.54 2j5g h LEU 240 N 0.48 0.39 -0.30 3.11 3.38 -0.57 -0.24 115.31 121.56 2j5g h LEU 240 Ca 0.28 -0.18 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 2j5g h LEU 240 Cb 0.28 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2j5g h LEU 240 CO -0.24 0.78 -0.17 0.00 0.09 0.00 0.00 178.44 178.90 2j5g h ALA 241 N 1.23 0.43 -0.72 1.53 0.00 -0.69 -0.81 119.26 120.22 2j5g h ALA 241 Ca 0.02 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 2j5g h ALA 241 Cb 0.90 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 2j5g h ALA 241 CO 0.07 0.35 0.32 -0.07 0.00 0.00 0.00 179.25 179.92 2j5g h LEU 242 N 0.40 0.97 -0.56 0.00 3.38 -1.04 -1.48 115.31 116.98 2j5g h LEU 242 Ca 0.06 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 2j5g h LEU 242 Cb 0.70 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 2j5g h LEU 242 CO 0.05 0.85 0.34 -0.08 0.09 0.00 0.00 178.44 179.69 2j5g h GLU 243 N 1.02 0.75 -0.91 1.13 4.81 -0.95 -1.74 114.58 118.69 2j5g h GLU 243 Ca 0.24 -0.07 0.04 0.00 -0.13 0.00 0.00 59.36 59.45 2j5g h GLU 243 Cb 0.16 -0.16 -0.06 0.00 0.63 0.00 0.00 28.75 29.33 2j5g h GLU 243 CO -0.03 0.54 0.59 0.78 -0.73 0.00 0.00 179.01 180.16 2j5g h GLY 244 N 0.75 1.34 1.11 1.92 0.00 -0.42 -0.31 103.07 107.46 2j5g h GLY 244 Ca 0.20 -0.44 -0.07 0.00 0.00 0.00 0.00 47.33 47.01 2j5g h GLY 244 CO -0.04 0.36 0.12 -2.22 0.00 0.00 0.00 176.54 174.77 2j5g h ILE 245 N 1.12 1.26 0.00 2.60 2.04 -0.69 -0.08 117.51 123.76 2j5g h ILE 245 Ca 0.37 -1.01 -0.09 0.00 1.00 0.00 0.00 64.86 65.13 2j5g h ILE 245 Cb 0.04 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 2j5g h ILE 245 CO -0.13 0.38 -0.43 0.71 0.00 0.00 0.00 178.15 178.68 2j5g h THR 246 N 1.03 1.27 -0.26 -0.27 1.35 -0.65 -1.03 112.91 114.35 2j5g h THR 246 Ca 0.21 -1.48 -0.07 0.00 -0.55 0.00 0.00 66.41 64.52 2j5g h THR 246 Cb 0.42 1.80 -0.01 0.00 -1.73 0.00 0.00 68.15 68.63 2j5g h THR 246 CO 0.01 0.42 -0.12 0.00 -0.25 0.00 0.00 175.52 175.58 2j5g h ALA 247 N 1.57 0.36 -0.99 6.62 0.00 -0.31 -2.81 119.26 123.71 2j5g h ALA 247 Ca -0.00 -0.31 0.10 0.00 0.00 0.00 0.00 54.91 54.70 2j5g h ALA 247 Cb 0.77 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.39 2j5g h ALA 247 CO 0.06 0.23 0.63 1.15 0.00 0.00 0.00 179.25 181.31 2j5g h THR 248 N 0.27 0.97 0.00 0.00 2.02 -0.65 -2.06 112.91 113.46 2j5g h THR 248 Ca 0.06 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.88 2j5g h THR 248 Cb 0.62 -0.16 0.00 0.00 -1.74 0.00 0.00 68.15 66.88 2j5g h THR 248 CO 0.04 0.19 0.00 -0.67 0.37 0.00 0.00 175.52 175.45 2j5g n ASP 249 N -4.59 0.52 0.11 4.18 -0.08 -0.42 -1.47 116.55 114.80 2j5g n ASP 249 Ca 0.17 0.67 0.11 0.00 -1.51 0.00 0.00 54.79 54.23 2j5g n ASP 249 Cb 0.29 -0.76 0.47 0.00 2.34 0.00 0.00 41.12 43.46 2j5g n ASP 249 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2j5g n LEU 250 N -2.12 0.55 -0.11 -2.67 4.77 -0.77 -0.83 117.00 115.81 2j5g n LEU 250 Ca 0.01 0.65 0.15 0.00 -0.03 0.00 0.00 56.01 56.78 2j5g n LEU 250 Cb 0.14 -0.59 0.68 0.00 -2.33 0.00 0.00 43.42 41.32 2j5g n LEU 250 CO 0.14 -0.56 0.93 0.54 -1.33 0.00 0.00 177.39 177.12 2j5g n ARG 251 N -2.12 0.80 -3.68 3.23 1.74 -0.54 -4.90 116.66 111.18 2j5g n ARG 251 Ca 0.02 -0.23 -0.22 0.00 -0.77 0.00 0.00 57.85 56.65 2j5g n ARG 251 Cb 0.20 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.12 2j5g n ARG 251 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2j5g s ASN 252 N -2.36 6.30 0.00 0.55 0.01 -0.01 -5.21 114.94 114.22 2j5g s ASN 252 Ca 0.33 0.25 0.00 0.00 -0.71 0.00 0.00 52.86 52.73 2j5g s ASN 252 Cb 0.20 -1.93 0.00 0.00 0.41 0.00 0.00 41.25 39.94 2j5g s ASN 252 CO 0.44 -0.19 0.00 0.35 -1.51 0.00 0.00 177.10 176.20