#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j3h n SER 10 N 0.00 0.00 -2.48 1.61 3.41 -1.26 -3.14 113.62 111.76 1j3h n SER 10 Ca 0.00 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.36 1j3h n SER 10 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 1j3h n SER 10 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1j3h n GLU 11 N 0.00 2.51 -0.82 4.33 1.02 -1.26 -4.57 120.64 121.86 1j3h n GLU 11 Ca 0.00 -2.15 -0.16 0.00 -0.02 0.00 0.00 57.16 54.82 1j3h n GLU 11 Cb 0.00 -2.16 0.11 0.00 -0.02 0.00 0.00 31.44 29.36 1j3h n GLU 11 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1j3h n GLN 12 N 1.32 1.83 -0.01 3.49 1.13 -1.19 -3.71 117.38 120.25 1j3h n GLN 12 Ca 0.49 -1.95 0.09 0.00 -1.94 0.00 0.00 57.00 53.70 1j3h n GLN 12 Cb 0.60 -1.77 -0.15 0.00 0.11 0.00 0.00 30.24 29.04 1j3h n GLN 12 CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77 1j3h n GLU 13 N -0.50 0.58 0.00 -1.09 -0.00 -1.26 -4.27 120.64 114.09 1j3h n GLU 13 Ca 0.39 -0.17 0.02 0.00 -0.00 0.00 0.00 57.16 57.40 1j3h n GLU 13 Cb 1.18 -1.45 0.12 0.00 -0.00 0.00 0.00 31.44 31.30 1j3h n GLU 13 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 1j3h n SER 14 N -2.14 0.00 -0.12 -1.84 3.41 -1.24 -0.99 113.62 110.70 1j3h n SER 14 Ca -0.03 -0.37 -0.25 0.00 -0.26 0.00 0.00 58.87 57.96 1j3h n SER 14 Cb 0.49 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.33 1j3h n SER 14 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1j3h n VAL 15 N -0.76 1.53 0.28 -3.33 0.31 -1.26 -2.85 118.33 112.26 1j3h n VAL 15 Ca 0.03 -0.20 0.18 0.00 -0.01 0.00 0.00 64.34 64.34 1j3h n VAL 15 Cb 0.01 -1.97 0.95 0.00 -0.91 0.00 0.00 33.84 31.92 1j3h n VAL 15 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1j3h h LYS 16 N -1.00 0.00 0.00 5.55 6.56 -1.33 0.22 116.57 126.58 1j3h h LYS 16 Ca -0.51 0.00 -0.13 0.00 -1.06 0.00 0.00 60.65 58.94 1j3h h LYS 16 Cb 1.44 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 33.08 1j3h h LYS 16 CO -0.31 0.00 -1.68 -0.85 -2.06 0.00 0.00 179.45 174.55 1j3h n GLU 17 N -2.77 0.64 0.08 3.15 0.28 -1.00 -3.41 120.64 117.61 1j3h n GLU 17 Ca -0.02 0.05 -0.22 0.00 -0.16 0.00 0.00 57.16 56.81 1j3h n GLU 17 Cb 0.11 -1.68 -0.13 0.00 1.43 0.00 0.00 31.44 31.17 1j3h n GLU 17 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 177.13 177.32 1j3h h PHE 18 N 0.00 0.97 0.00 -1.84 3.57 -0.51 -3.19 116.94 115.94 1j3h h PHE 18 Ca -0.16 -0.61 -0.00 0.00 3.53 0.00 0.00 57.97 60.73 1j3h h PHE 18 Cb 1.45 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 40.11 1j3h h PHE 18 CO 0.00 1.45 -0.01 -0.07 -2.23 0.00 0.00 178.31 177.45 1j3h h LEU 19 N 0.22 0.00 0.04 0.59 -0.00 -1.08 -2.78 115.31 112.29 1j3h h LEU 19 Ca -0.18 0.00 -0.26 0.00 -0.00 0.00 0.00 57.88 57.44 1j3h h LEU 19 Cb 1.86 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 42.49 1j3h h LEU 19 CO 0.23 0.01 -1.33 0.00 -0.00 0.00 0.00 178.44 177.34 1j3h h ALA 20 N 1.99 0.43 0.09 1.53 0.00 -1.57 -3.15 119.26 118.59 1j3h h ALA 20 Ca -0.00 -1.10 -0.20 0.00 0.00 0.00 0.00 54.91 53.61 1j3h h ALA 20 Cb 0.26 0.13 0.02 0.00 0.00 0.00 0.00 17.79 18.20 1j3h h ALA 20 CO 0.00 1.30 -0.83 1.57 0.00 0.00 0.00 179.25 181.29 1j3h h LYS 21 N 0.02 0.40 -0.62 0.00 2.10 -1.54 -2.72 116.57 114.21 1j3h h LYS 21 Ca -0.15 -0.55 0.14 0.00 -2.00 0.00 0.00 60.65 58.09 1j3h h LYS 21 Cb 1.90 0.19 -0.03 0.00 -0.90 0.00 0.00 32.23 33.39 1j3h h LYS 21 CO 0.13 1.22 0.43 0.00 -2.00 0.00 0.00 179.45 179.23 1j3h h ALA 22 N 0.20 2.27 0.35 0.07 0.00 -1.64 0.50 119.26 121.01 1j3h h ALA 22 Ca -0.13 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1j3h h ALA 22 Cb 1.58 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1j3h h ALA 22 CO 0.16 -0.43 -0.17 -0.22 0.00 0.00 0.00 179.25 178.59 1j3h h LYS 23 N 0.23 -0.45 0.00 0.00 3.64 -1.54 -0.16 116.57 118.30 1j3h h LYS 23 Ca 0.30 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 1j3h h LYS 23 Cb 0.86 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.78 1j3h h LYS 23 CO -0.06 -0.15 0.00 0.39 -2.27 0.00 0.00 179.45 177.37 1j3h n GLU 24 N -5.11 0.12 0.01 1.90 1.02 -0.63 -0.37 120.64 117.58 1j3h n GLU 24 Ca -0.08 0.59 -0.05 0.00 -0.02 0.00 0.00 57.16 57.60 1j3h n GLU 24 Cb 0.26 -1.88 -0.11 0.00 -0.02 0.00 0.00 31.44 29.69 1j3h n GLU 24 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1j3h h ASP 25 N 0.00 0.00 0.00 1.62 5.19 0.18 -3.33 116.42 120.09 1j3h h ASP 25 Ca 0.00 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 1j3h h ASP 25 Cb 0.04 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.54 1j3h h ASP 25 CO 0.00 0.83 -0.17 0.15 -3.12 0.00 0.00 179.24 176.92 1j3h h PHE 26 N 0.00 0.00 -0.98 4.55 3.57 0.12 -3.28 116.94 120.93 1j3h h PHE 26 Ca -0.22 0.00 0.17 0.00 3.53 0.00 0.00 57.97 61.45 1j3h h PHE 26 Cb 1.83 0.00 -0.09 0.00 2.79 0.00 0.00 35.95 40.48 1j3h h PHE 26 CO 0.00 0.38 0.61 -0.07 -2.23 0.00 0.00 178.31 177.00 1j3h h LEU 27 N -1.00 0.73 -0.41 0.59 3.38 -1.32 0.96 115.31 118.25 1j3h h LEU 27 Ca -0.03 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.03 1j3h h LEU 27 Cb 0.44 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1j3h h LEU 27 CO -0.02 0.31 0.25 0.50 0.09 0.00 0.00 178.44 179.57 1j3h h LYS 28 N 0.74 0.49 0.00 1.13 3.64 -1.72 0.87 116.57 121.72 1j3h h LYS 28 Ca 0.53 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.77 1j3h h LYS 28 Cb 0.85 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 1j3h h LYS 28 CO -0.30 0.33 -0.52 0.87 -2.27 0.00 0.00 179.45 177.55 1j3h h LYS 29 N 0.51 0.00 0.00 1.90 1.57 -1.01 -2.84 116.57 116.71 1j3h h LYS 29 Ca 0.16 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.73 1j3h h LYS 29 Cb -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1j3h h LYS 29 CO -0.06 0.52 -0.91 2.35 -0.57 0.00 0.00 179.45 180.79 1j3h h TRP 30 N 0.00 0.42 -0.09 -1.35 2.91 0.20 -2.09 115.95 115.96 1j3h h TRP 30 Ca -0.01 -0.23 -0.19 0.00 1.13 0.00 0.00 58.89 59.60 1j3h h TRP 30 Cb 1.20 -0.05 0.01 0.00 -0.51 0.00 0.00 29.16 29.81 1j3h h TRP 30 CO 0.00 1.05 -0.67 1.49 -1.03 0.00 0.00 178.44 179.28 1j3h h GLU 31 N 0.16 0.61 -2.54 2.65 4.22 0.73 -3.38 114.58 117.02 1j3h h GLU 31 Ca -0.06 -0.54 -0.60 0.00 0.08 0.00 0.00 59.36 58.25 1j3h h GLU 31 Cb 1.54 0.12 -0.39 0.00 0.50 0.00 0.00 28.75 30.52 1j3h h GLU 31 CO 0.15 1.16 -0.85 -2.37 -2.18 0.00 0.00 179.01 174.91 1j3h n THR 32 N -4.10 -0.22 -1.99 0.32 5.66 -1.08 -5.10 114.28 107.77 1j3h n THR 32 Ca -0.09 -3.95 -0.39 0.00 -3.05 0.00 0.00 64.05 56.57 1j3h n THR 32 Cb 0.69 -1.85 0.00 0.00 -1.55 0.00 0.00 70.33 67.63 1j3h n THR 32 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1j3h s PRO 33 N -0.57 3.81 0.20 1.09 0.04 -0.78 -4.65 135.00 134.13 1j3h s PRO 33 Ca 0.31 2.18 -0.30 0.00 0.04 0.00 0.00 61.00 63.23 1j3h s PRO 33 Cb 0.03 -2.65 -0.08 0.00 0.04 0.00 0.00 34.50 31.84 1j3h s PRO 33 CO -0.18 -0.64 1.12 -1.54 0.04 0.00 0.00 177.00 175.80 1j3h s SER 34 N -0.77 7.24 0.13 6.66 1.04 -1.26 -5.05 113.70 121.69 1j3h s SER 34 Ca 0.60 2.15 0.07 0.00 0.48 0.00 0.00 55.95 59.24 1j3h s SER 34 Cb -0.39 -2.61 -0.04 0.00 0.10 0.00 0.00 66.02 63.09 1j3h s SER 34 CO 0.49 -0.23 -0.15 -1.10 0.98 0.00 0.00 173.24 173.23 1j3h s GLN 35 N -0.56 1.09 -0.80 4.02 -0.21 -1.26 -4.92 119.66 117.02 1j3h s GLN 35 Ca 0.49 -1.27 -0.04 0.00 0.02 0.00 0.00 55.36 54.56 1j3h s GLN 35 Cb -0.30 -1.03 0.01 0.00 1.00 0.00 0.00 33.01 32.68 1j3h s GLN 35 CO 0.36 0.20 0.56 0.09 -2.12 0.00 0.00 175.29 174.38 1j3h n ASN 36 N 0.51 -4.29 -0.72 5.90 3.02 0.07 -4.86 115.26 114.90 1j3h n ASN 36 Ca -0.15 -0.94 0.10 0.00 -0.03 0.00 0.00 54.58 53.56 1j3h n ASN 36 Cb 0.57 -1.45 0.30 0.00 -0.61 0.00 0.00 39.78 38.59 1j3h n ASN 36 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1j3h n THR 37 N -2.73 0.34 -3.90 3.41 -2.24 -1.07 -4.94 114.28 103.16 1j3h n THR 37 Ca -0.28 -0.47 -0.03 0.00 -2.27 0.00 0.00 64.05 61.00 1j3h n THR 37 Cb 0.62 0.48 0.02 0.00 -2.10 0.00 0.00 70.33 69.35 1j3h n THR 37 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j3h s ALA 38 N -1.66 -1.64 0.06 6.98 0.00 -1.26 -4.87 121.76 119.36 1j3h s ALA 38 Ca 0.33 -0.34 -0.07 0.00 0.00 0.00 0.00 51.96 51.87 1j3h s ALA 38 Cb 0.18 0.78 -0.01 0.00 0.00 0.00 0.00 23.12 24.07 1j3h s ALA 38 CO 0.26 -1.07 0.15 1.14 0.00 0.00 0.00 175.76 176.24 1j3h s GLN 39 N -2.12 0.71 0.19 0.00 -2.07 -1.26 -4.58 119.66 110.53 1j3h s GLN 39 Ca 0.23 -0.83 -0.21 0.00 -1.82 0.00 0.00 55.36 52.73 1j3h s GLN 39 Cb -0.03 0.29 0.12 0.00 -1.09 0.00 0.00 33.01 32.30 1j3h s GLN 39 CO 0.05 -0.20 1.58 1.25 -1.32 0.00 0.00 175.29 176.65 1j3h h LEU 40 N 3.23 -1.27 -0.82 2.60 5.85 -1.96 -1.79 115.31 121.14 1j3h h LEU 40 Ca -0.33 0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.63 1j3h h LEU 40 Cb 1.19 0.63 0.00 0.00 0.37 0.00 0.00 40.66 42.84 1j3h h LEU 40 CO 0.53 -0.31 0.00 -0.90 -0.34 0.00 0.00 178.44 177.42 1j3h n ASP 41 N -5.43 0.39 -0.00 1.25 5.75 -1.26 -2.18 116.55 115.07 1j3h n ASP 41 Ca 0.04 -0.95 0.08 0.00 -0.01 0.00 0.00 54.79 53.95 1j3h n ASP 41 Cb 0.36 -0.19 -0.10 0.00 -1.03 0.00 0.00 41.12 40.16 1j3h n ASP 41 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1j3h n GLN 42 N 0.12 1.45 -4.41 0.11 6.02 -0.67 -4.98 117.38 115.01 1j3h n GLN 42 Ca 0.00 -0.02 -0.27 0.00 -0.01 0.00 0.00 57.00 56.70 1j3h n GLN 42 Cb 0.10 -1.29 -0.12 0.00 1.02 0.00 0.00 30.24 29.95 1j3h n GLN 42 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1j3h s PHE 43 N -2.62 2.30 -0.42 1.08 0.40 -0.93 -2.05 117.98 115.75 1j3h s PHE 43 Ca 0.05 -0.36 -0.13 0.00 -0.60 0.00 0.00 56.93 55.89 1j3h s PHE 43 Cb 0.12 -1.17 0.05 0.00 0.51 0.00 0.00 43.02 42.53 1j3h s PHE 43 CO 0.68 0.46 0.29 0.16 0.70 0.00 0.00 175.22 177.50 1j3h s ASP 44 N -2.51 5.90 -0.57 1.36 1.47 0.32 -4.86 116.67 117.78 1j3h s ASP 44 Ca 0.19 -1.18 -0.26 0.00 1.18 0.00 0.00 52.55 52.48 1j3h s ASP 44 Cb -0.08 -2.08 -0.07 0.00 -0.34 0.00 0.00 42.92 40.35 1j3h s ASP 44 CO 0.09 -0.50 2.27 -0.13 0.68 0.00 0.00 175.17 177.57 1j3h s ARG 45 N 1.57 2.17 -0.03 2.11 1.81 -1.26 -1.04 118.95 124.28 1j3h s ARG 45 Ca 0.03 1.04 -0.11 0.00 -1.72 0.00 0.00 55.73 54.98 1j3h s ARG 45 Cb -0.21 -4.59 -0.06 0.00 -0.45 0.00 0.00 34.95 29.64 1j3h s ARG 45 CO 0.06 -3.31 0.53 0.82 -0.68 0.00 0.00 175.30 172.72 1j3h h ILE 46 N 7.50 0.00 -3.81 1.52 1.08 -1.48 -3.49 117.51 118.82 1j3h h ILE 46 Ca -0.20 -0.50 -0.19 0.00 -0.39 0.00 0.00 64.86 63.58 1j3h h ILE 46 Cb 1.20 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 34.89 1j3h h ILE 46 CO 1.16 0.00 -0.08 -0.54 -0.69 0.00 0.00 178.15 178.00 1j3h s LYS 47 N -2.86 1.92 -0.56 2.37 -0.14 -1.00 -4.98 119.74 114.48 1j3h s LYS 47 Ca -0.06 -1.61 -0.07 0.00 -1.36 0.00 0.00 55.97 52.88 1j3h s LYS 47 Cb 0.01 0.49 0.14 0.00 -1.68 0.00 0.00 37.83 36.79 1j3h s LYS 47 CO 0.17 -0.82 0.41 0.99 -0.76 0.00 0.00 175.35 175.34 1j3h s THR 48 N -3.05 4.11 -0.08 2.17 2.01 -1.26 -0.70 115.64 118.83 1j3h s THR 48 Ca 0.26 -2.28 0.21 0.00 0.31 0.00 0.00 61.69 60.19 1j3h s THR 48 Cb -0.01 -3.68 0.21 0.00 0.01 0.00 0.00 72.50 69.02 1j3h s THR 48 CO 0.17 -0.83 1.62 -0.07 -0.69 0.00 0.00 174.62 174.82 1j3h h LEU 49 N 7.86 0.00 0.00 4.42 3.38 -1.39 -3.46 115.31 126.12 1j3h h LEU 49 Ca -0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1j3h h LEU 49 Cb 1.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1j3h h LEU 49 CO 0.78 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.92 1j3h n GLY 50 N -1.28 4.47 3.53 0.83 0.00 -1.09 -4.95 105.19 106.70 1j3h n GLY 50 Ca -0.01 -1.22 -0.36 0.00 0.00 0.00 0.00 46.02 44.42 1j3h n GLY 50 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1j3h s THR 51 N -2.00 4.66 0.00 2.61 -4.23 -1.26 0.27 115.64 115.69 1j3h s THR 51 Ca 0.00 -0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.45 1j3h s THR 51 Cb 0.00 -3.17 0.00 0.00 1.34 0.00 0.00 72.50 70.67 1j3h s THR 51 CO 0.00 0.35 0.00 0.61 -0.54 0.00 0.00 174.62 175.04 1j3h n GLY 52 N 4.58 1.45 0.10 3.99 0.00 -0.31 -4.93 105.19 110.08 1j3h n GLY 52 Ca -0.16 -1.76 -0.19 0.00 0.00 0.00 0.00 46.02 43.90 1j3h n GLY 52 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1j3h h SER 53 N 0.00 0.22 0.33 1.61 4.64 -1.98 -3.38 113.55 114.99 1j3h h SER 53 Ca 0.00 -0.84 -0.31 0.00 -0.47 0.00 0.00 61.79 60.18 1j3h h SER 53 Cb 0.00 -0.07 0.03 0.00 -0.31 0.00 0.00 62.40 62.04 1j3h h SER 53 CO 0.00 1.39 -1.33 -0.26 -0.87 0.00 0.00 176.83 175.76 1j3h h PHE 54 N -0.64 0.84 -1.87 4.77 0.04 -1.94 -3.49 116.94 114.64 1j3h h PHE 54 Ca -0.21 -0.58 0.22 0.00 2.80 0.00 0.00 57.97 60.20 1j3h h PHE 54 Cb 1.45 -0.05 -0.04 0.00 2.20 0.00 0.00 35.95 39.51 1j3h h PHE 54 CO 0.17 1.44 0.58 0.41 -0.60 0.00 0.00 178.31 180.31 1j3h n GLY 55 N 1.53 0.42 3.93 -1.45 0.00 -1.24 -2.84 105.19 105.54 1j3h n GLY 55 Ca -0.13 -0.99 -0.25 0.00 0.00 0.00 0.00 46.02 44.65 1j3h n GLY 55 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1j3h s ARG 56 N -2.01 2.69 -0.11 1.61 1.70 -1.16 -1.16 118.95 120.50 1j3h s ARG 56 Ca 0.19 -0.22 0.03 0.00 -0.47 0.00 0.00 55.73 55.26 1j3h s ARG 56 Cb -0.01 -2.30 -0.00 0.00 -0.57 0.00 0.00 34.95 32.07 1j3h s ARG 56 CO 0.00 -0.81 -0.21 0.08 -1.08 0.00 0.00 175.30 173.29 1j3h s VAL 57 N -2.99 2.35 -0.06 4.99 1.01 0.14 -1.25 120.40 124.59 1j3h s VAL 57 Ca 0.55 -0.91 0.04 0.00 0.00 0.00 0.00 61.98 61.66 1j3h s VAL 57 Cb -0.10 -1.93 0.00 0.00 0.00 0.00 0.00 36.38 34.35 1j3h s VAL 57 CO 0.43 0.55 -0.17 -0.04 0.00 0.00 0.00 175.10 175.87 1j3h s MET 58 N 0.35 2.06 0.04 2.72 -1.94 -0.30 -0.98 119.30 121.25 1j3h s MET 58 Ca -0.16 -0.62 -0.31 0.00 -1.71 0.00 0.00 55.69 52.89 1j3h s MET 58 Cb -0.17 -1.69 -0.06 0.00 2.01 0.00 0.00 34.83 34.91 1j3h s MET 58 CO 0.08 0.17 1.34 -1.17 -0.01 0.00 0.00 175.02 175.42 1j3h s LEU 59 N 0.28 4.34 0.17 -0.03 2.96 0.12 -1.99 118.68 124.54 1j3h s LEU 59 Ca -0.10 2.13 0.07 0.00 -0.22 0.00 0.00 54.13 56.00 1j3h s LEU 59 Cb -0.14 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 1j3h s LEU 59 CO 0.04 -0.63 -0.14 0.68 -1.32 0.00 0.00 176.35 174.98 1j3h s VAL 60 N 1.72 1.57 -0.23 1.68 -7.23 -0.47 -1.18 120.40 116.26 1j3h s VAL 60 Ca 0.62 -2.06 0.01 0.00 -1.81 0.00 0.00 61.98 58.74 1j3h s VAL 60 Cb -0.32 -1.89 0.05 0.00 0.56 0.00 0.00 36.38 34.79 1j3h s VAL 60 CO 0.28 -0.56 -0.08 -0.54 -0.31 0.00 0.00 175.10 173.89 1j3h s LYS 61 N -3.38 1.82 -0.40 4.82 -0.14 -0.21 -1.54 119.74 120.71 1j3h s LYS 61 Ca 0.18 -0.99 -0.27 0.00 -1.36 0.00 0.00 55.97 53.53 1j3h s LYS 61 Cb -0.01 -2.57 -0.06 0.00 -1.68 0.00 0.00 37.83 33.50 1j3h s LYS 61 CO 0.05 -0.54 2.36 1.58 -0.76 0.00 0.00 175.35 178.03 1j3h n HIS 62 N 4.64 1.60 -0.27 3.18 -0.00 0.50 -0.52 115.22 124.35 1j3h n HIS 62 Ca -0.13 0.04 0.01 0.00 0.46 0.00 0.00 57.72 58.10 1j3h n HIS 62 Cb 0.45 -2.67 0.05 0.00 -0.12 0.00 0.00 29.99 27.70 1j3h n HIS 62 CO 0.00 0.00 0.00 0.36 0.46 0.00 0.00 176.34 177.16 1j3h n LYS 63 N 8.92 -0.14 0.00 1.57 0.00 -0.87 0.14 118.16 127.79 1j3h n LYS 63 Ca 0.35 1.13 0.00 0.00 -0.00 0.00 0.00 58.31 59.79 1j3h n LYS 63 Cb 0.51 -1.68 0.00 0.00 -0.00 0.00 0.00 35.03 33.86 1j3h n LYS 63 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 1j3h n GLU 64 N -5.11 0.00 0.29 -1.58 -0.00 -1.26 -3.76 120.64 109.21 1j3h n GLU 64 Ca 0.09 0.26 0.17 0.00 -0.00 0.00 0.00 57.16 57.68 1j3h n GLU 64 Cb 0.32 -1.19 0.83 0.00 -0.00 0.00 0.00 31.44 31.40 1j3h n GLU 64 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1j3h h SER 65 N 0.00 0.00 -0.33 -1.84 4.64 -1.92 -3.45 113.55 110.65 1j3h h SER 65 Ca 0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 1j3h h SER 65 Cb 0.00 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.04 1j3h h SER 65 CO 0.00 0.06 -0.12 0.61 -0.87 0.00 0.00 176.83 176.51 1j3h n GLY 66 N -0.54 0.81 3.88 -0.77 0.00 0.38 -5.01 105.19 103.94 1j3h n GLY 66 Ca -0.01 -0.77 -0.30 0.00 0.00 0.00 0.00 46.02 44.94 1j3h n GLY 66 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1j3h s ASN 67 N -2.92 6.29 -0.19 1.61 0.01 -1.23 -4.75 114.94 113.76 1j3h s ASN 67 Ca 0.00 1.30 -0.05 0.00 -0.71 0.00 0.00 52.86 53.40 1j3h s ASN 67 Cb 0.00 -2.41 -0.02 0.00 0.41 0.00 0.00 41.25 39.22 1j3h s ASN 67 CO 0.00 -0.75 -0.01 -1.00 -1.51 0.00 0.00 177.10 173.83 1j3h s HIS 68 N -2.98 3.03 0.18 2.20 3.76 -1.26 -0.37 115.29 119.85 1j3h s HIS 68 Ca 0.53 -0.46 0.04 0.00 -0.15 0.00 0.00 55.06 55.03 1j3h s HIS 68 Cb -0.11 -2.06 -0.05 0.00 1.11 0.00 0.00 32.58 31.48 1j3h s HIS 68 CO 0.48 -0.22 -0.06 0.71 -0.85 0.00 0.00 174.74 174.81 1j3h s TYR 69 N 0.90 1.40 -0.68 1.40 1.51 -0.59 -3.98 117.35 117.31 1j3h s TYR 69 Ca 0.01 -0.83 -0.07 0.00 -1.01 0.00 0.00 57.07 55.16 1j3h s TYR 69 Cb -0.14 -0.76 0.18 0.00 -0.11 0.00 0.00 41.96 41.13 1j3h s TYR 69 CO 0.02 0.03 0.55 0.00 -1.11 0.00 0.00 175.55 175.03 1j3h s ALA 70 N -3.37 3.74 -0.30 3.71 0.00 -0.02 -1.37 121.76 124.15 1j3h s ALA 70 Ca 0.22 -3.23 -0.29 0.00 0.00 0.00 0.00 51.96 48.66 1j3h s ALA 70 Cb 0.04 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 20.20 1j3h s ALA 70 CO 0.04 -2.15 1.25 1.41 0.00 0.00 0.00 175.76 176.32 1j3h s MET 71 N 0.11 3.95 -0.56 0.00 1.75 -0.84 -1.56 119.30 122.15 1j3h s MET 71 Ca 0.16 1.21 -0.18 0.00 -1.25 0.00 0.00 55.69 55.64 1j3h s MET 71 Cb -0.17 -3.85 0.11 0.00 2.84 0.00 0.00 34.83 33.75 1j3h s MET 71 CO -0.05 -1.07 0.61 -1.59 -0.65 0.00 0.00 175.02 172.27 1j3h s LYS 72 N 4.06 3.03 -0.11 4.11 -2.85 -0.37 -1.15 119.74 126.45 1j3h s LYS 72 Ca 0.54 -1.41 -0.27 0.00 -1.00 0.00 0.00 55.97 53.84 1j3h s LYS 72 Cb -0.16 -4.25 -0.02 0.00 -2.06 0.00 0.00 37.83 31.34 1j3h s LYS 72 CO 0.22 -1.41 0.87 0.42 0.10 0.00 0.00 175.35 175.54 1j3h s ILE 73 N 2.26 4.89 -0.23 3.79 1.09 -0.38 -2.30 121.20 130.32 1j3h s ILE 73 Ca 0.09 1.75 -0.02 0.00 -1.10 0.00 0.00 60.65 61.37 1j3h s ILE 73 Cb -0.26 -4.18 0.07 0.00 -1.06 0.00 0.00 42.46 37.03 1j3h s ILE 73 CO 0.06 0.09 0.04 -1.48 -0.10 0.00 0.00 174.94 173.54 1j3h s LEU 74 N 1.69 1.60 -0.28 2.97 2.34 -0.58 -3.00 118.68 123.41 1j3h s LEU 74 Ca 0.42 -1.08 -0.40 0.00 0.06 0.00 0.00 54.13 53.13 1j3h s LEU 74 Cb -0.18 -0.73 -0.16 0.00 -0.56 0.00 0.00 46.19 44.56 1j3h s LEU 74 CO 0.17 -0.33 1.75 -0.67 -1.06 0.00 0.00 176.35 176.21 1j3h n ASP 75 N 4.96 2.39 0.13 1.48 -0.08 -1.13 -1.94 116.55 122.36 1j3h n ASP 75 Ca -0.08 1.08 -0.13 0.00 -1.51 0.00 0.00 54.79 54.15 1j3h n ASP 75 Cb 0.45 -1.14 -0.07 0.00 2.34 0.00 0.00 41.12 42.71 1j3h n ASP 75 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1j3h h LYS 76 N 7.22 -0.33 0.14 -0.67 1.57 -1.52 -0.22 116.57 122.76 1j3h h LYS 76 Ca -0.46 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.33 1j3h h LYS 76 Cb 1.32 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.70 1j3h h LYS 76 CO 0.96 -0.22 -0.07 1.96 -0.57 0.00 0.00 179.45 181.52 1j3h h GLN 77 N -0.34 -0.18 -0.90 3.15 4.20 -1.88 -2.67 115.11 116.49 1j3h h GLN 77 Ca -0.00 0.01 0.12 0.00 0.06 0.00 0.00 58.65 58.84 1j3h h GLN 77 Cb 0.31 0.04 -0.07 0.00 0.30 0.00 0.00 27.48 28.07 1j3h h GLN 77 CO -0.02 -0.07 0.58 0.87 -0.67 0.00 0.00 178.83 179.51 1j3h h LYS 78 N -0.24 0.76 -0.11 1.46 1.57 -1.88 -0.51 116.57 117.62 1j3h h LYS 78 Ca -0.02 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1j3h h LYS 78 Cb 0.19 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1j3h h LYS 78 CO 0.03 0.50 0.06 0.28 -0.57 0.00 0.00 179.45 179.76 1j3h h VAL 79 N 0.79 1.09 -0.62 0.50 2.07 -0.78 -0.18 116.25 119.10 1j3h h VAL 79 Ca 0.44 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.71 1j3h h VAL 79 Cb 0.59 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 1j3h h VAL 79 CO -0.20 0.08 0.33 0.58 0.02 0.00 0.00 177.57 178.38 1j3h h VAL 80 N 0.09 1.20 -0.80 2.57 2.07 -0.95 -2.24 116.25 118.19 1j3h h VAL 80 Ca 0.04 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1j3h h VAL 80 Cb 0.07 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 30.21 1j3h h VAL 80 CO -0.01 0.23 0.50 0.11 0.02 0.00 0.00 177.57 178.42 1j3h h LYS 81 N 0.85 1.08 0.00 1.57 1.57 -0.90 0.34 116.57 121.08 1j3h h LYS 81 Ca 0.22 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1j3h h LYS 81 Cb 0.06 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.14 1j3h h LYS 81 CO -0.03 0.74 0.00 1.47 -0.57 0.00 0.00 179.45 181.06 1j3h n LEU 82 N -4.49 0.00 -2.91 2.94 -0.00 -0.10 -4.88 117.00 107.56 1j3h n LEU 82 Ca 0.08 0.13 -0.14 0.00 -0.00 0.00 0.00 56.01 56.09 1j3h n LEU 82 Cb 0.04 -0.13 0.07 0.00 -0.00 0.00 0.00 43.42 43.40 1j3h n LEU 82 CO 0.37 -0.05 0.09 0.29 -0.00 0.00 0.00 177.39 178.09 1j3h n LYS 83 N -1.13 -5.29 -2.66 1.47 4.01 0.11 -5.00 118.16 109.67 1j3h n LYS 83 Ca 0.12 0.67 -0.09 0.00 -0.51 0.00 0.00 58.31 58.49 1j3h n LYS 83 Cb 0.10 -5.15 0.03 0.00 -0.51 0.00 0.00 35.03 29.51 1j3h n LYS 83 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 1j3h n GLN 84 N -3.50 1.43 -0.03 1.97 6.02 -0.88 -4.92 117.38 117.47 1j3h n GLN 84 Ca -0.21 -3.39 -0.13 0.00 -0.01 0.00 0.00 57.00 53.26 1j3h n GLN 84 Cb 0.63 -1.38 -0.08 0.00 1.02 0.00 0.00 30.24 30.43 1j3h n GLN 84 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1j3h h ILE 85 N 3.31 1.32 0.10 5.09 5.03 -1.88 -3.04 117.51 127.43 1j3h h ILE 85 Ca -0.07 -1.02 -0.00 0.00 -0.12 0.00 0.00 64.86 63.64 1j3h h ILE 85 Cb 1.18 1.86 0.00 0.00 -3.03 0.00 0.00 36.82 36.83 1j3h h ILE 85 CO 0.49 0.28 -0.05 1.05 -0.68 0.00 0.00 178.15 179.24 1j3h h GLU 86 N -0.23 -0.13 -0.90 2.37 -0.00 -1.96 -2.26 114.58 111.48 1j3h h GLU 86 Ca 0.02 0.01 0.19 0.00 -0.00 0.00 0.00 59.36 59.57 1j3h h GLU 86 Cb 0.47 0.03 -0.07 0.00 -0.00 0.00 0.00 28.75 29.18 1j3h h GLU 86 CO 0.01 0.15 0.59 1.25 -0.00 0.00 0.00 179.01 181.01 1j3h h HIS 87 N -0.40 0.62 -0.02 2.06 6.17 -1.94 0.57 115.15 122.21 1j3h h HIS 87 Ca -0.01 0.02 -0.05 0.00 0.71 0.00 0.00 60.37 61.04 1j3h h HIS 87 Cb 0.33 -0.19 0.00 0.00 2.52 0.00 0.00 27.41 30.08 1j3h h HIS 87 CO 0.01 0.18 -0.17 1.15 0.71 0.00 0.00 177.93 179.81 1j3h h THR 88 N 0.48 1.51 -0.70 6.26 2.02 -1.43 -2.64 112.91 118.42 1j3h h THR 88 Ca 0.47 -1.75 -0.01 0.00 0.77 0.00 0.00 66.41 65.89 1j3h h THR 88 Cb 1.06 2.59 -0.03 0.00 -1.74 0.00 0.00 68.15 70.03 1j3h h THR 88 CO -0.20 0.48 0.40 -0.07 0.37 0.00 0.00 175.52 176.50 1j3h h LEU 89 N -0.48 0.85 -0.38 2.58 3.38 -0.77 -2.40 115.31 118.09 1j3h h LEU 89 Ca -0.02 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 1j3h h LEU 89 Cb 0.87 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1j3h h LEU 89 CO 0.03 0.68 0.03 -1.13 0.09 0.00 0.00 178.44 178.15 1j3h h ASN 90 N 0.95 0.63 -0.12 -0.43 -0.73 -1.01 -1.15 115.58 113.72 1j3h h ASN 90 Ca 0.25 -0.28 -0.03 0.00 1.87 0.00 0.00 56.30 58.11 1j3h h ASN 90 Cb -0.00 -0.17 -0.01 0.00 0.27 0.00 0.00 38.32 38.41 1j3h h ASN 90 CO -0.04 0.75 0.01 -0.08 -0.37 0.00 0.00 177.43 177.70 1j3h h GLU 91 N 0.48 0.31 0.04 6.67 4.81 -1.26 -0.60 114.58 125.03 1j3h h GLU 91 Ca 0.11 -0.05 -0.22 0.00 -0.13 0.00 0.00 59.36 59.07 1j3h h GLU 91 Cb 0.41 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1j3h h GLU 91 CO 0.01 0.32 -1.01 -0.22 -0.73 0.00 0.00 179.01 177.38 1j3h h LYS 92 N 0.30 0.18 -0.45 1.92 3.11 -1.26 -2.51 116.57 117.86 1j3h h LYS 92 Ca 0.07 -0.25 -0.13 0.00 -2.81 0.00 0.00 60.65 57.53 1j3h h LYS 92 Cb 0.19 0.08 -0.01 0.00 -1.00 0.00 0.00 32.23 31.49 1j3h h LYS 92 CO 0.00 1.05 -0.24 -0.09 -2.81 0.00 0.00 179.45 177.36 1j3h h ARG 93 N 0.08 0.94 0.30 1.90 2.43 -0.44 -2.39 114.38 117.18 1j3h h ARG 93 Ca -0.06 -0.40 -0.01 0.00 -0.81 0.00 0.00 59.98 58.69 1j3h h ARG 93 Cb 1.70 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 31.23 1j3h h ARG 93 CO 0.15 1.07 -0.14 0.82 -1.51 0.00 0.00 179.97 180.36 1j3h h ILE 94 N 0.80 0.64 -0.94 1.20 2.04 -1.17 -3.09 117.51 116.99 1j3h h ILE 94 Ca 0.10 -0.74 0.22 0.00 1.00 0.00 0.00 64.86 65.44 1j3h h ILE 94 Cb 0.80 0.98 -0.07 0.00 -0.74 0.00 0.00 36.82 37.80 1j3h h ILE 94 CO 0.07 0.13 0.62 -0.07 0.00 0.00 0.00 178.15 178.90 1j3h h LEU 95 N -0.85 0.39 -0.57 1.44 3.38 -1.46 -0.38 115.31 117.26 1j3h h LEU 95 Ca -0.04 0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.82 1j3h h LEU 95 Cb 0.52 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1j3h h LEU 95 CO 0.07 0.14 -0.65 -0.61 0.09 0.00 0.00 178.44 177.48 1j3h h GLN 96 N 0.38 0.28 0.00 1.13 -0.00 -1.46 -3.31 115.11 112.13 1j3h h GLN 96 Ca 0.49 -0.21 -0.21 0.00 -0.00 0.00 0.00 58.65 58.73 1j3h h GLN 96 Cb 1.28 0.04 -0.04 0.00 0.00 0.00 0.00 27.48 28.76 1j3h h GLN 96 CO -0.19 0.83 -1.46 0.00 0.00 0.00 0.00 178.83 178.02 1j3h h ALA 97 N 1.12 0.69 -2.39 3.38 0.00 -1.02 -3.48 119.26 117.56 1j3h h ALA 97 Ca -0.01 -1.05 -0.49 0.00 0.00 0.00 0.00 54.91 53.36 1j3h h ALA 97 Cb 1.17 0.32 0.07 0.00 0.00 0.00 0.00 17.79 19.35 1j3h h ALA 97 CO 0.10 1.15 0.38 0.54 0.00 0.00 0.00 179.25 181.42 1j3h s VAL 98 N -2.80 3.64 -0.29 0.00 0.11 -0.71 -4.41 120.40 115.92 1j3h s VAL 98 Ca -0.03 0.82 -0.01 0.00 -2.93 0.00 0.00 61.98 59.83 1j3h s VAL 98 Cb 0.08 -3.33 0.19 0.00 -1.53 0.00 0.00 36.38 31.80 1j3h s VAL 98 CO 0.81 -0.41 0.74 0.21 -3.33 0.00 0.00 175.10 173.12 1j3h s ASN 99 N -2.55 -1.20 -0.26 3.54 3.04 -1.26 -4.97 114.94 111.29 1j3h s ASN 99 Ca 0.66 0.33 -0.23 0.00 0.04 0.00 0.00 52.86 53.65 1j3h s ASN 99 Cb -0.18 1.83 0.07 0.00 -1.54 0.00 0.00 41.25 41.44 1j3h s ASN 99 CO 0.35 -0.22 0.69 0.12 -3.04 0.00 0.00 177.10 175.00 1j3h s PHE 100 N 2.88 -0.81 0.42 0.43 5.36 -1.26 -5.07 117.98 119.93 1j3h s PHE 100 Ca 0.15 1.90 0.29 0.00 -0.96 0.00 0.00 56.93 58.31 1j3h s PHE 100 Cb -0.09 0.32 1.43 0.00 -0.34 0.00 0.00 43.02 44.33 1j3h s PHE 100 CO -0.23 -0.39 1.53 -0.35 -1.46 0.00 0.00 175.22 174.33 1j3h n PRO 101 N 2.95 -0.04 -1.00 10.12 -0.04 -1.26 -0.99 135.00 144.74 1j3h n PRO 101 Ca -0.15 1.26 -0.10 0.00 -0.04 0.00 0.00 63.50 64.47 1j3h n PRO 101 Cb 0.56 -2.43 0.25 0.00 -0.04 0.00 0.00 33.50 31.84 1j3h n PRO 101 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1j3h n PHE 102 N -4.79 2.29 -4.92 0.54 0.99 -1.26 -4.90 117.46 105.41 1j3h n PHE 102 Ca 0.39 -1.45 -0.27 0.00 -0.00 0.00 0.00 57.45 56.12 1j3h n PHE 102 Cb 1.48 -0.71 -0.16 0.00 -1.00 0.00 0.00 39.48 39.09 1j3h n PHE 102 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 1j3h s LEU 103 N -3.12 1.94 0.33 4.37 1.43 -0.16 -0.15 118.68 123.32 1j3h s LEU 103 Ca 0.53 -0.39 -0.29 0.00 -1.03 0.00 0.00 54.13 52.95 1j3h s LEU 103 Cb 0.44 -1.06 -0.12 0.00 0.03 0.00 0.00 46.19 45.49 1j3h s LEU 103 CO 0.10 0.17 1.51 1.33 0.23 0.00 0.00 176.35 179.69 1j3h n VAL 104 N 3.15 1.51 -3.14 -1.59 0.24 -1.12 -4.74 118.33 112.63 1j3h n VAL 104 Ca -0.18 -0.38 -0.39 0.00 -2.04 0.00 0.00 64.34 61.35 1j3h n VAL 104 Cb 0.53 -1.91 -0.05 0.00 -1.47 0.00 0.00 33.84 30.94 1j3h n VAL 104 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1j3h s LYS 105 N -1.28 4.38 -0.87 7.34 3.01 -1.26 -4.97 119.74 126.09 1j3h s LYS 105 Ca 0.59 0.77 -0.16 0.00 -1.01 0.00 0.00 55.97 56.16 1j3h s LYS 105 Cb -0.50 -3.40 0.18 0.00 -1.01 0.00 0.00 37.83 33.10 1j3h s LYS 105 CO 0.56 0.21 0.91 -1.17 0.51 0.00 0.00 175.35 176.37 1j3h s LEU 106 N 0.34 6.10 0.15 3.17 2.96 -1.26 -2.11 118.68 128.03 1j3h s LEU 106 Ca 0.33 -2.44 -0.17 0.00 -0.22 0.00 0.00 54.13 51.64 1j3h s LEU 106 Cb -0.18 -2.28 0.00 0.00 0.50 0.00 0.00 46.19 44.23 1j3h s LEU 106 CO 0.17 -0.76 1.80 -0.33 -1.32 0.00 0.00 176.35 175.90 1j3h h GLU 107 N 8.19 0.51 -3.85 1.98 4.39 -1.54 -3.46 114.58 120.81 1j3h h GLU 107 Ca 0.12 -0.04 -0.14 0.00 0.34 0.00 0.00 59.36 59.65 1j3h h GLU 107 Cb 1.03 -0.11 -0.18 0.00 -0.10 0.00 0.00 28.75 29.39 1j3h h GLU 107 CO 0.89 0.35 -0.57 -0.06 -1.16 0.00 0.00 179.01 178.47 1j3h s PHE 108 N -6.11 0.23 -0.22 4.33 0.40 -1.15 -5.02 117.98 110.45 1j3h s PHE 108 Ca -0.13 -0.53 -0.05 0.00 -0.60 0.00 0.00 56.93 55.63 1j3h s PHE 108 Cb 0.10 -0.17 0.11 0.00 0.51 0.00 0.00 43.02 43.58 1j3h s PHE 108 CO 0.72 -0.33 0.39 0.45 0.70 0.00 0.00 175.22 177.16 1j3h s SER 109 N -2.00 0.01 0.32 1.36 0.15 -1.26 -0.87 113.70 111.40 1j3h s SER 109 Ca -0.07 0.59 0.02 0.00 0.70 0.00 0.00 55.95 57.19 1j3h s SER 109 Cb -0.03 1.21 -0.01 0.00 -1.71 0.00 0.00 66.02 65.48 1j3h s SER 109 CO -0.04 -0.27 0.37 2.22 1.20 0.00 0.00 173.24 176.73 1j3h n PHE 110 N 5.38 -1.11 -3.96 3.44 1.16 -1.06 -0.75 117.46 120.55 1j3h n PHE 110 Ca -0.06 -2.37 -0.12 0.00 -1.87 0.00 0.00 57.45 53.04 1j3h n PHE 110 Cb 0.50 0.41 -0.01 0.00 -1.61 0.00 0.00 39.48 38.77 1j3h n PHE 110 CO 0.00 0.00 0.00 -1.59 -1.87 0.00 0.00 176.76 173.30 1j3h s LYS 111 N -2.96 2.03 0.00 3.97 -2.85 -1.26 -1.00 119.74 117.68 1j3h s LYS 111 Ca 0.31 -1.59 0.00 0.00 -1.00 0.00 0.00 55.97 53.69 1j3h s LYS 111 Cb 0.00 0.52 0.00 0.00 -2.06 0.00 0.00 37.83 36.30 1j3h s LYS 111 CO 0.22 -0.89 0.00 -0.40 0.10 0.00 0.00 175.35 174.38 1j3h n ASP 112 N -1.35 0.89 0.04 0.03 3.85 -1.16 -4.99 116.55 113.86 1j3h n ASP 112 Ca -0.03 0.00 -0.06 0.00 -0.71 0.00 0.00 54.79 53.98 1j3h n ASP 112 Cb 0.61 0.00 -0.11 0.00 -1.35 0.00 0.00 41.12 40.26 1j3h n ASP 112 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.20 176.97 1j3h h ASN 113 N 0.00 0.00 0.00 -1.12 2.35 -1.92 -3.40 115.58 111.48 1j3h h ASN 113 Ca 0.00 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.49 1j3h h ASN 113 Cb 0.00 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.32 1j3h h ASN 113 CO 0.00 0.94 -1.99 -0.24 -1.65 0.00 0.00 177.43 174.49 1j3h n SER 114 N -3.23 1.63 -3.81 5.81 2.88 -1.26 -0.53 113.62 115.11 1j3h n SER 114 Ca -0.05 -0.01 -0.10 0.00 -1.33 0.00 0.00 58.87 57.38 1j3h n SER 114 Cb 0.95 0.68 -0.05 0.00 -0.75 0.00 0.00 64.21 65.05 1j3h n SER 114 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1j3h s ASN 115 N -4.92 -0.17 0.06 -3.46 2.20 -1.26 -1.29 114.94 106.10 1j3h s ASN 115 Ca -0.10 -0.60 -0.03 0.00 -0.94 0.00 0.00 52.86 51.19 1j3h s ASN 115 Cb 0.05 0.54 -0.05 0.00 -2.00 0.00 0.00 41.25 39.79 1j3h s ASN 115 CO 0.56 -1.01 0.26 -0.76 -2.94 0.00 0.00 177.10 173.22 1j3h s LEU 116 N -2.90 4.34 0.01 3.54 1.43 -0.82 -2.97 118.68 121.31 1j3h s LEU 116 Ca 0.11 0.43 0.05 0.00 -1.03 0.00 0.00 54.13 53.69 1j3h s LEU 116 Cb 0.00 -2.92 -0.02 0.00 0.03 0.00 0.00 46.19 43.29 1j3h s LEU 116 CO -0.02 0.18 -0.15 -0.31 0.23 0.00 0.00 176.35 176.27 1j3h s TYR 117 N -1.47 1.37 -0.27 0.29 1.51 -0.17 -1.53 117.35 117.08 1j3h s TYR 117 Ca 0.33 -0.29 -0.02 0.00 -1.01 0.00 0.00 57.07 56.08 1j3h s TYR 117 Cb -0.13 -0.86 0.09 0.00 -0.11 0.00 0.00 41.96 40.96 1j3h s TYR 117 CO 0.23 0.00 0.09 -1.64 -1.11 0.00 0.00 175.55 173.12 1j3h s MET 118 N -0.64 0.56 -0.34 -0.62 -1.94 -0.97 -2.56 119.30 112.78 1j3h s MET 118 Ca 0.05 -0.75 -0.26 0.00 -1.71 0.00 0.00 55.69 53.02 1j3h s MET 118 Cb -0.07 -1.82 0.01 0.00 2.01 0.00 0.00 34.83 34.97 1j3h s MET 118 CO 0.00 -0.90 0.92 0.54 -0.01 0.00 0.00 175.02 175.58 1j3h s VAL 119 N 1.81 4.62 0.35 -6.03 0.11 -0.05 -1.23 120.40 119.97 1j3h s VAL 119 Ca 0.07 1.30 0.07 0.00 -2.93 0.00 0.00 61.98 60.48 1j3h s VAL 119 Cb -0.17 -4.30 -0.01 0.00 -1.53 0.00 0.00 36.38 30.37 1j3h s VAL 119 CO -0.23 -0.45 0.45 -0.04 -3.33 0.00 0.00 175.10 171.49 1j3h s MET 120 N 3.38 3.00 -0.01 1.54 -1.94 -0.60 -1.35 119.30 123.32 1j3h s MET 120 Ca 0.38 -1.10 -0.30 0.00 -1.71 0.00 0.00 55.69 52.96 1j3h s MET 120 Cb -0.13 -2.74 -0.04 0.00 2.01 0.00 0.00 34.83 33.93 1j3h s MET 120 CO 0.16 0.03 1.14 -2.00 -0.01 0.00 0.00 175.02 174.34 1j3h s GLU 121 N -4.16 4.43 -0.01 2.03 2.12 -0.89 -0.84 118.70 121.37 1j3h s GLU 121 Ca 0.45 1.63 -0.28 0.00 0.36 0.00 0.00 54.97 57.13 1j3h s GLU 121 Cb -0.09 -3.46 -0.03 0.00 0.26 0.00 0.00 34.13 30.81 1j3h s GLU 121 CO 0.30 -0.28 0.91 -0.47 -0.54 0.00 0.00 175.26 175.18 1j3h s TYR 122 N 1.52 3.64 -0.05 5.30 5.04 -1.26 -4.67 117.35 126.88 1j3h s TYR 122 Ca 0.55 1.60 0.04 0.00 -2.44 0.00 0.00 57.07 56.82 1j3h s TYR 122 Cb -0.25 -3.04 0.00 0.00 0.35 0.00 0.00 41.96 39.01 1j3h s TYR 122 CO 0.26 0.02 -0.17 0.14 -1.34 0.00 0.00 175.55 174.46 1j3h s VAL 123 N 0.93 1.42 -0.32 3.14 -7.23 -1.26 -5.01 120.40 112.07 1j3h s VAL 123 Ca 0.49 -0.69 0.23 0.00 -1.81 0.00 0.00 61.98 60.19 1j3h s VAL 123 Cb -0.20 -1.23 -0.13 0.00 0.56 0.00 0.00 36.38 35.38 1j3h s VAL 123 CO 0.26 0.41 0.90 0.00 -0.31 0.00 0.00 175.10 176.36 1j3h n ALA 124 N 3.30 2.92 -0.30 1.32 0.00 -1.26 -4.72 120.51 121.77 1j3h n ALA 124 Ca -0.19 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 52.88 1j3h n ALA 124 Cb 0.53 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 19.01 1j3h n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j3h n GLY 125 N 1.27 -2.99 0.00 0.00 0.00 -0.88 -5.01 105.19 97.58 1j3h n GLY 125 Ca -0.00 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.61 1j3h n GLY 125 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j3h n GLY 126 N -0.98 3.27 3.77 -0.02 0.00 -1.25 -4.82 105.19 105.15 1j3h n GLY 126 Ca 0.00 -1.92 -0.39 0.00 0.00 0.00 0.00 46.02 43.71 1j3h n GLY 126 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j3h s GLU 127 N -2.64 4.19 0.37 1.61 2.02 -1.26 -2.04 118.70 120.95 1j3h s GLU 127 Ca 0.00 1.92 0.07 0.00 0.02 0.00 0.00 54.97 56.98 1j3h s GLU 127 Cb 0.00 -2.83 0.77 0.00 0.10 0.00 0.00 34.13 32.17 1j3h s GLU 127 CO 0.00 -0.22 1.96 1.98 0.02 0.00 0.00 175.26 179.00 1j3h h MET 128 N 2.95 0.70 -0.45 1.61 4.05 -0.47 -1.81 114.93 121.50 1j3h h MET 128 Ca -0.48 -0.04 0.09 0.00 -0.28 0.00 0.00 59.70 58.98 1j3h h MET 128 Cb 1.23 -0.16 -0.08 0.00 -0.80 0.00 0.00 31.60 31.79 1j3h h MET 128 CO 0.64 0.46 -0.08 0.35 0.23 0.00 0.00 176.91 178.51 1j3h h PHE 129 N 0.72 -0.17 0.92 1.39 3.57 -1.81 0.35 116.94 121.91 1j3h h PHE 129 Ca 0.31 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.80 1j3h h PHE 129 Cb 0.27 0.15 0.01 0.00 2.79 0.00 0.00 35.95 39.17 1j3h h PHE 129 CO -0.00 -0.17 -0.44 0.77 -2.23 0.00 0.00 178.31 176.24 1j3h h SER 130 N 0.03 -1.05 -0.85 0.41 0.02 -1.69 -1.71 113.55 108.72 1j3h h SER 130 Ca 0.22 0.03 0.17 0.00 -0.84 0.00 0.00 61.79 61.37 1j3h h SER 130 Cb 0.34 0.27 -0.06 0.00 0.14 0.00 0.00 62.40 63.09 1j3h h SER 130 CO -0.44 -0.72 0.56 0.45 -1.14 0.00 0.00 176.83 175.54 1j3h h HIS 131 N -1.30 0.61 -0.45 3.45 3.86 -1.17 -1.01 115.15 119.14 1j3h h HIS 131 Ca -0.13 0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 59.03 1j3h h HIS 131 Cb 0.95 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 29.21 1j3h h HIS 131 CO -0.00 0.20 0.01 1.25 0.86 0.00 0.00 177.93 180.25 1j3h h LEU 132 N 0.50 0.77 -1.01 2.43 5.85 0.04 -0.10 115.31 123.79 1j3h h LEU 132 Ca 0.43 -0.30 -0.10 0.00 0.84 0.00 0.00 57.88 58.75 1j3h h LEU 132 Cb 0.92 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 1j3h h LEU 132 CO -0.17 0.88 -0.33 0.03 -0.34 0.00 0.00 178.44 178.51 1j3h h ARG 133 N 0.64 0.29 0.36 1.25 3.08 -0.30 0.16 114.38 119.87 1j3h h ARG 133 Ca 0.13 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 1j3h h ARG 133 Cb 0.48 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.52 1j3h h ARG 133 CO 0.02 0.60 -0.17 -0.09 -1.07 0.00 0.00 179.97 179.25 1j3h h ARG 134 N 0.25 -0.47 0.00 0.04 2.43 -0.98 -3.33 114.38 112.33 1j3h h ARG 134 Ca 0.03 0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.17 1j3h h ARG 134 Cb 0.71 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.36 1j3h h ARG 134 CO 0.05 -0.28 -0.30 0.82 -1.51 0.00 0.00 179.97 178.76 1j3h h ILE 135 N -1.11 0.83 0.00 1.20 5.03 -1.08 -3.48 117.51 118.90 1j3h h ILE 135 Ca -0.05 -1.20 0.00 0.00 -0.12 0.00 0.00 64.86 63.49 1j3h h ILE 135 Cb 0.41 1.73 0.00 0.00 -3.03 0.00 0.00 36.82 35.93 1j3h h ILE 135 CO 0.08 0.29 0.00 0.61 -0.68 0.00 0.00 178.15 178.45 1j3h n GLY 136 N -0.11 1.81 3.16 5.37 0.00 0.57 -4.88 105.19 111.12 1j3h n GLY 136 Ca -0.01 -0.50 -0.11 0.00 0.00 0.00 0.00 46.02 45.41 1j3h n GLY 136 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1j3h s ARG 137 N 0.00 0.81 0.17 1.61 1.70 -1.26 -4.36 118.95 117.61 1j3h s ARG 137 Ca 0.00 -1.29 0.05 0.00 -0.47 0.00 0.00 55.73 54.03 1j3h s ARG 137 Cb 0.00 -0.20 -0.04 0.00 -0.57 0.00 0.00 34.95 34.14 1j3h s ARG 137 CO 0.00 -0.01 0.11 -0.06 -1.08 0.00 0.00 175.30 174.26 1j3h s PHE 138 N -3.46 3.09 0.42 5.89 2.99 0.36 -5.02 117.98 122.26 1j3h s PHE 138 Ca 0.10 -0.04 -0.25 0.00 0.00 0.00 0.00 56.93 56.74 1j3h s PHE 138 Cb 0.04 -1.49 -0.08 0.00 0.00 0.00 0.00 43.02 41.49 1j3h s PHE 138 CO -0.04 0.52 1.26 -1.12 -0.00 0.00 0.00 175.22 175.83 1j3h s SER 139 N -3.08 6.25 0.23 1.36 0.01 -1.26 -4.43 113.70 112.77 1j3h s SER 139 Ca 0.30 2.54 -0.07 0.00 1.31 0.00 0.00 55.95 60.04 1j3h s SER 139 Cb -0.10 -2.63 0.39 0.00 0.21 0.00 0.00 66.02 63.89 1j3h s SER 139 CO 0.23 -0.88 1.71 -0.33 0.41 0.00 0.00 173.24 174.38 1j3h h GLU 140 N 2.48 0.33 0.00 12.44 5.08 -1.97 0.32 114.58 133.26 1j3h h GLU 140 Ca -0.49 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1j3h h GLU 140 Cb 1.25 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1j3h h GLU 140 CO 0.62 0.22 0.00 -1.00 -1.00 0.00 0.00 179.01 177.84 1j3h h PRO 141 N 0.34 0.00 0.03 2.33 0.13 -1.99 -0.30 132.00 132.54 1j3h h PRO 141 Ca 0.37 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.41 1j3h h PRO 141 Cb 0.57 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.69 1j3h h PRO 141 CO -0.42 0.00 -0.46 0.45 -0.23 0.00 0.00 178.00 177.34 1j3h h HIS 142 N 0.00 0.10 -0.86 1.56 3.86 -0.80 -3.07 115.15 115.93 1j3h h HIS 142 Ca 0.00 -0.07 -0.02 0.00 -1.16 0.00 0.00 60.37 59.12 1j3h h HIS 142 Cb 0.26 -0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.69 1j3h h HIS 142 CO 0.00 1.18 0.46 0.00 0.86 0.00 0.00 177.93 180.43 1j3h h ALA 143 N -0.10 1.18 -0.94 2.45 0.00 -0.94 -1.84 119.26 119.08 1j3h h ALA 143 Ca -0.11 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 54.75 1j3h h ALA 143 Cb 1.20 -0.35 -0.07 0.00 0.00 0.00 0.00 17.79 18.57 1j3h h ALA 143 CO -0.02 0.65 0.60 -0.09 0.00 0.00 0.00 179.25 180.39 1j3h h ARG 144 N 1.21 0.96 -0.45 0.00 2.43 -1.17 0.49 114.38 117.85 1j3h h ARG 144 Ca 0.30 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.41 1j3h h ARG 144 Cb 0.04 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 1j3h h ARG 144 CO -0.05 0.63 0.26 0.35 -1.51 0.00 0.00 179.97 179.66 1j3h h PHE 145 N 0.98 0.59 -0.04 2.20 3.57 -1.24 -0.55 116.94 122.46 1j3h h PHE 145 Ca 0.43 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.89 1j3h h PHE 145 Cb 0.34 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.89 1j3h h PHE 145 CO -0.00 0.42 -0.10 1.88 -2.23 0.00 0.00 178.31 178.28 1j3h h TYR 146 N 0.59 0.19 -0.92 0.41 0.99 -0.86 -3.17 116.97 114.20 1j3h h TYR 146 Ca 0.16 -0.07 0.13 0.00 2.00 0.00 0.00 58.73 60.94 1j3h h TYR 146 Cb 0.01 -0.03 -0.07 0.00 1.00 0.00 0.00 36.73 37.63 1j3h h TYR 146 CO -0.03 0.70 0.59 0.00 -0.00 0.00 0.00 178.16 179.43 1j3h h ALA 147 N 0.45 1.69 -0.31 3.88 0.00 0.00 0.07 119.26 125.05 1j3h h ALA 147 Ca -0.00 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1j3h h ALA 147 Cb 0.70 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 1j3h h ALA 147 CO 0.02 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.35 1j3h h ALA 148 N 1.57 0.28 -0.60 0.00 0.00 -1.08 0.21 119.26 119.64 1j3h h ALA 148 Ca 0.46 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 55.40 1j3h h ALA 148 Cb 0.58 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 1j3h h ALA 148 CO -0.22 -0.40 0.16 1.96 0.00 0.00 0.00 179.25 180.75 1j3h h GLN 149 N 0.09 0.91 -0.48 0.00 4.20 -1.00 -1.14 115.11 117.70 1j3h h GLN 149 Ca 0.15 -0.18 -0.07 0.00 0.06 0.00 0.00 58.65 58.60 1j3h h GLN 149 Cb 0.19 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 1j3h h GLN 149 CO -0.25 0.80 0.02 0.82 -0.67 0.00 0.00 178.83 179.55 1j3h h ILE 150 N 0.88 1.26 -0.38 2.54 1.08 -0.31 -1.96 117.51 120.61 1j3h h ILE 150 Ca 0.19 -1.04 0.01 0.00 -0.39 0.00 0.00 64.86 63.64 1j3h h ILE 150 Cb 0.29 0.98 -0.02 0.00 -3.07 0.00 0.00 36.82 34.99 1j3h h ILE 150 CO -0.00 0.36 0.24 0.58 -0.69 0.00 0.00 178.15 178.63 1j3h h VAL 151 N 0.70 1.07 0.68 1.67 2.07 -0.18 -1.46 116.25 120.79 1j3h h VAL 151 Ca 0.14 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.46 1j3h h VAL 151 Cb 0.49 0.54 0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1j3h h VAL 151 CO 0.02 0.09 -0.32 -0.07 0.02 0.00 0.00 177.57 177.30 1j3h h LEU 152 N 0.48 -0.77 -1.66 2.57 3.38 -1.06 -2.03 115.31 116.23 1j3h h LEU 152 Ca 0.15 0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.20 1j3h h LEU 152 Cb -0.02 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1j3h h LEU 152 CO -0.05 -0.54 0.34 0.71 0.09 0.00 0.00 178.44 178.99 1j3h h THR 153 N -0.92 0.95 0.00 0.22 1.35 -1.25 0.84 112.91 114.10 1j3h h THR 153 Ca -0.09 -0.14 -0.10 0.00 -0.55 0.00 0.00 66.41 65.52 1j3h h THR 153 Cb 0.70 0.50 -0.01 0.00 -1.73 0.00 0.00 68.15 67.61 1j3h h THR 153 CO 0.15 0.08 -0.49 -0.26 -0.25 0.00 0.00 175.52 174.75 1j3h h PHE 154 N 0.42 0.00 -0.30 4.73 0.05 -1.14 0.50 116.94 121.19 1j3h h PHE 154 Ca 0.23 0.00 -0.10 0.00 3.82 0.00 0.00 57.97 61.91 1j3h h PHE 154 Cb 0.36 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.30 1j3h h PHE 154 CO -0.00 0.49 -0.22 1.49 -0.18 0.00 0.00 178.31 179.89 1j3h h GLU 155 N 0.00 0.67 0.49 1.51 4.81 -0.16 0.95 114.58 122.85 1j3h h GLU 155 Ca -0.00 -0.33 -0.02 0.00 -0.13 0.00 0.00 59.36 58.87 1j3h h GLU 155 Cb 0.90 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.28 1j3h h GLU 155 CO 0.06 0.93 -0.24 -0.92 -0.73 0.00 0.00 179.01 178.12 1j3h h TYR 156 N 0.42 -0.61 0.48 0.92 3.20 -0.37 -1.78 116.97 119.22 1j3h h TYR 156 Ca 0.06 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 1j3h h TYR 156 Cb 0.77 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 39.22 1j3h h TYR 156 CO 0.07 -0.34 -0.48 -0.07 -1.64 0.00 0.00 178.16 175.70 1j3h h LEU 157 N -0.75 -1.32 -1.73 2.82 3.38 -0.02 -2.65 115.31 115.05 1j3h h LEU 157 Ca -0.07 0.11 0.18 0.00 0.09 0.00 0.00 57.88 58.19 1j3h h LEU 157 Cb 0.55 0.44 -0.05 0.00 0.09 0.00 0.00 40.66 41.69 1j3h h LEU 157 CO 0.11 -0.64 0.52 0.45 0.09 0.00 0.00 178.44 178.97 1j3h h HIS 158 N -0.97 0.31 -0.21 1.13 3.86 -0.82 0.45 115.15 118.91 1j3h h HIS 158 Ca -0.06 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.17 1j3h h HIS 158 Cb 0.85 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.21 1j3h h HIS 158 CO -0.25 0.10 0.14 0.66 0.86 0.00 0.00 177.93 179.44 1j3h h SER 159 N 0.25 0.24 -0.15 2.45 4.64 -0.95 -0.31 113.55 119.71 1j3h h SER 159 Ca 0.38 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1j3h h SER 159 Cb 1.10 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1j3h h SER 159 CO -0.09 0.17 0.00 0.18 -0.87 0.00 0.00 176.83 176.22 1j3h n LEU 160 N -4.51 1.52 -1.61 5.97 4.77 0.16 -4.91 117.00 118.39 1j3h n LEU 160 Ca 0.00 -0.64 -0.12 0.00 -0.03 0.00 0.00 56.01 55.22 1j3h n LEU 160 Cb 0.07 -0.10 0.01 0.00 -2.33 0.00 0.00 43.42 41.08 1j3h n LEU 160 CO 0.35 0.32 -0.07 0.47 -1.33 0.00 0.00 177.39 177.12 1j3h n ASP 161 N 0.23 -4.01 -4.50 -1.43 8.00 -0.13 -4.90 116.55 109.82 1j3h n ASP 161 Ca 0.16 -0.09 -0.35 0.00 0.71 0.00 0.00 54.79 55.22 1j3h n ASP 161 Cb 0.31 -3.05 -0.12 0.00 -0.02 0.00 0.00 41.12 38.23 1j3h n ASP 161 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1j3h s LEU 162 N -3.76 3.39 -0.34 0.64 1.43 -1.13 -0.37 118.68 118.54 1j3h s LEU 162 Ca 0.09 -0.13 -0.12 0.00 -1.03 0.00 0.00 54.13 52.94 1j3h s LEU 162 Cb -0.04 -1.86 -0.01 0.00 0.03 0.00 0.00 46.19 44.31 1j3h s LEU 162 CO 0.11 0.10 0.23 -0.63 0.23 0.00 0.00 176.35 176.39 1j3h s ILE 163 N 0.81 5.10 0.06 -0.59 1.01 0.32 -3.79 121.20 124.12 1j3h s ILE 163 Ca 0.01 -0.35 -0.21 0.00 0.00 0.00 0.00 60.65 60.10 1j3h s ILE 163 Cb -0.14 -3.66 -0.13 0.00 0.01 0.00 0.00 42.46 38.54 1j3h s ILE 163 CO 0.02 -0.05 1.50 0.22 0.00 0.00 0.00 174.94 176.63 1j3h h TYR 164 N 8.48 0.26 -7.04 3.97 3.20 -1.90 -2.31 116.97 121.62 1j3h h TYR 164 Ca -0.31 -0.04 -0.61 0.00 3.14 0.00 0.00 58.73 60.91 1j3h h TYR 164 Cb 1.15 -0.07 -0.23 0.00 1.54 0.00 0.00 36.73 39.12 1j3h h TYR 164 CO 0.64 0.45 -0.95 2.89 -1.64 0.00 0.00 178.16 179.56 1j3h n ARG 165 N -4.78 -1.20 -0.93 1.82 1.85 -1.26 -3.94 116.66 108.21 1j3h n ARG 165 Ca -0.05 0.14 -0.05 0.00 -1.00 0.00 0.00 57.85 56.89 1j3h n ARG 165 Cb 0.20 -3.92 -0.04 0.00 -1.05 0.00 0.00 32.46 27.65 1j3h n ARG 165 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1j3h n ASP 166 N -2.82 -0.71 -4.71 2.89 2.03 -1.26 -4.70 116.55 107.27 1j3h n ASP 166 Ca -0.24 -1.42 -0.42 0.00 0.52 0.00 0.00 54.79 53.24 1j3h n ASP 166 Cb 0.65 0.22 -0.03 0.00 -0.72 0.00 0.00 41.12 41.24 1j3h n ASP 166 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1j3h s LEU 167 N -0.17 4.35 -0.20 -2.67 2.96 -1.26 -4.83 118.68 116.86 1j3h s LEU 167 Ca 0.00 2.08 -0.30 0.00 -0.22 0.00 0.00 54.13 55.69 1j3h s LEU 167 Cb 0.02 -3.58 0.15 0.00 0.50 0.00 0.00 46.19 43.28 1j3h s LEU 167 CO -0.01 -0.56 1.14 -1.59 -1.32 0.00 0.00 176.35 174.02 1j3h s LYS 168 N 1.38 0.38 0.49 1.98 -2.85 -1.26 -4.89 119.74 114.97 1j3h s LYS 168 Ca 0.61 0.07 0.32 0.00 -1.00 0.00 0.00 55.97 55.97 1j3h s LYS 168 Cb -0.31 0.18 1.44 0.00 -2.06 0.00 0.00 37.83 37.08 1j3h s LYS 168 CO 0.28 -0.12 1.74 -1.00 0.10 0.00 0.00 175.35 176.35 1j3h h PRO 169 N 2.32 0.11 -0.16 1.78 0.13 -1.94 -0.91 132.00 133.34 1j3h h PRO 169 Ca -0.14 -0.01 -0.09 0.00 -0.87 0.00 0.00 66.00 64.90 1j3h h PRO 169 Cb 1.17 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1j3h h PRO 169 CO 0.27 0.08 -0.28 0.93 -0.23 0.00 0.00 178.00 178.76 1j3h h GLU 170 N 0.12 0.30 -0.03 0.86 3.07 -1.94 -2.57 114.58 114.38 1j3h h GLU 170 Ca 0.65 -0.11 0.00 0.00 -0.50 0.00 0.00 59.36 59.40 1j3h h GLU 170 Cb 2.28 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 30.17 1j3h h GLU 170 CO -0.15 0.56 0.00 0.09 -1.40 0.00 0.00 179.01 178.11 1j3h n ASN 171 N -4.13 0.30 -4.24 1.42 3.02 -0.35 -4.72 115.26 106.56 1j3h n ASN 171 Ca -0.01 -1.50 -0.35 0.00 -0.03 0.00 0.00 54.58 52.69 1j3h n ASN 171 Cb 0.39 -0.02 -0.14 0.00 -0.61 0.00 0.00 39.78 39.41 1j3h n ASN 171 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1j3h s LEU 172 N -1.55 3.49 0.24 3.41 1.43 -1.00 -0.64 118.68 124.06 1j3h s LEU 172 Ca 0.27 -0.87 0.06 0.00 -1.03 0.00 0.00 54.13 52.56 1j3h s LEU 172 Cb 0.13 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.58 1j3h s LEU 172 CO 0.21 -0.16 0.23 -0.76 0.23 0.00 0.00 176.35 176.10 1j3h s LEU 173 N 1.37 3.94 -0.14 1.79 1.43 -0.67 -0.50 118.68 125.90 1j3h s LEU 173 Ca 0.00 -0.16 -0.03 0.00 -1.03 0.00 0.00 54.13 52.92 1j3h s LEU 173 Cb -0.17 -2.48 -0.02 0.00 0.03 0.00 0.00 46.19 43.54 1j3h s LEU 173 CO -0.02 -0.03 -0.06 -0.63 0.23 0.00 0.00 176.35 175.84 1j3h s ILE 174 N -2.05 3.70 0.93 -0.59 -1.09 -0.86 -1.12 121.20 120.11 1j3h s ILE 174 Ca 0.33 -0.43 -0.11 0.00 -2.23 0.00 0.00 60.65 58.21 1j3h s ILE 174 Cb -0.08 -2.60 0.15 0.00 -1.58 0.00 0.00 42.46 38.35 1j3h s ILE 174 CO 0.26 0.51 1.09 -1.81 -1.23 0.00 0.00 174.94 173.76 1j3h s ASP 175 N 0.25 3.05 -0.00 3.58 1.01 0.27 -2.08 116.67 122.74 1j3h s ASP 175 Ca -0.04 1.70 0.02 0.00 0.71 0.00 0.00 52.55 54.94 1j3h s ASP 175 Cb -0.14 -2.34 0.06 0.00 1.01 0.00 0.00 42.92 41.51 1j3h s ASP 175 CO 0.03 -2.94 1.02 0.00 0.21 0.00 0.00 175.17 173.49 1j3h n GLN 176 N -4.10 1.17 0.00 8.23 1.13 -1.26 -0.93 117.38 121.62 1j3h n GLN 176 Ca 0.08 -0.25 0.00 0.00 -1.94 0.00 0.00 57.00 54.89 1j3h n GLN 176 Cb 0.54 -1.09 0.00 0.00 0.11 0.00 0.00 30.24 29.80 1j3h n GLN 176 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 1j3h n GLN 177 N -0.27 1.70 -0.02 -1.09 7.27 -1.26 -4.92 117.38 118.79 1j3h n GLN 177 Ca 0.02 -0.32 0.00 0.00 0.07 0.00 0.00 57.00 56.77 1j3h n GLN 177 Cb 0.08 -0.82 0.00 0.00 2.41 0.00 0.00 30.24 31.91 1j3h n GLN 177 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1j3h n GLY 178 N 0.33 1.55 3.92 1.69 0.00 -0.11 -4.57 105.19 108.00 1j3h n GLY 178 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1j3h n GLY 178 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1j3h s TYR 179 N -2.55 3.00 0.56 1.61 1.51 -1.26 -4.55 117.35 115.68 1j3h s TYR 179 Ca 0.00 0.59 -0.12 0.00 -1.01 0.00 0.00 57.07 56.53 1j3h s TYR 179 Cb 0.00 -3.20 -0.05 0.00 -0.11 0.00 0.00 41.96 38.60 1j3h s TYR 179 CO 0.00 -1.40 0.98 0.42 -1.11 0.00 0.00 175.55 174.44 1j3h s ILE 180 N -3.30 4.67 -0.29 2.71 1.01 -1.26 0.96 121.20 125.70 1j3h s ILE 180 Ca 0.60 0.93 0.01 0.00 0.00 0.00 0.00 60.65 62.19 1j3h s ILE 180 Cb -0.11 -3.81 0.16 0.00 0.01 0.00 0.00 42.46 38.71 1j3h s ILE 180 CO 0.46 -0.93 0.39 -1.58 0.00 0.00 0.00 174.94 173.28 1j3h s GLN 181 N -4.68 0.40 0.10 2.79 2.00 -0.28 -4.56 119.66 115.43 1j3h s GLN 181 Ca 0.56 0.08 -0.31 0.00 -2.00 0.00 0.00 55.36 53.69 1j3h s GLN 181 Cb -0.11 -0.38 -0.07 0.00 0.80 0.00 0.00 33.01 33.26 1j3h s GLN 181 CO 0.44 -1.03 1.24 0.08 -0.50 0.00 0.00 175.29 175.53 1j3h s VAL 182 N 2.51 3.76 0.27 1.34 1.01 0.79 -1.67 120.40 128.40 1j3h s VAL 182 Ca 0.10 1.30 0.05 0.00 0.00 0.00 0.00 61.98 63.43 1j3h s VAL 182 Cb -0.13 -3.83 -0.06 0.00 0.00 0.00 0.00 36.38 32.36 1j3h s VAL 182 CO -0.31 0.12 -0.02 0.28 0.00 0.00 0.00 175.10 175.18 1j3h s THR 183 N 0.83 1.35 -0.21 3.92 -1.32 0.18 -2.80 115.64 117.59 1j3h s THR 183 Ca 0.59 -2.07 -0.00 0.00 -1.21 0.00 0.00 61.69 59.00 1j3h s THR 183 Cb -0.32 -2.46 0.00 0.00 -1.51 0.00 0.00 72.50 68.21 1j3h s THR 183 CO 0.31 -0.27 0.01 -0.67 -2.21 0.00 0.00 174.62 171.79 1j3h n ASP 184 N -0.54 -6.04 -2.18 8.08 -0.08 -1.26 -4.75 116.55 109.78 1j3h n ASP 184 Ca -0.05 1.00 -0.23 0.00 -1.51 0.00 0.00 54.79 54.01 1j3h n ASP 184 Cb 0.64 -4.02 0.18 0.00 2.34 0.00 0.00 41.12 40.26 1j3h n ASP 184 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1j3h n PHE 185 N 0.51 2.98 0.12 -0.67 3.01 -1.26 -4.76 117.46 117.40 1j3h n PHE 185 Ca -0.01 -1.82 -0.12 0.00 1.01 0.00 0.00 57.45 56.51 1j3h n PHE 185 Cb 0.01 -0.92 -0.07 0.00 -0.01 0.00 0.00 39.48 38.49 1j3h n PHE 185 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1j3h h GLY 186 N 1.05 -1.15 0.07 1.37 0.00 -1.92 -2.93 103.07 99.56 1j3h h GLY 186 Ca 0.61 0.57 0.00 0.00 0.00 0.00 0.00 47.33 48.51 1j3h h GLY 186 CO 1.07 -0.34 0.00 0.69 0.00 0.00 0.00 176.54 177.96 1j3h n PHE 187 N -4.48 0.00 -2.33 5.60 0.99 -1.26 -4.71 117.46 111.27 1j3h n PHE 187 Ca -0.07 0.00 -0.40 0.00 -0.00 0.00 0.00 57.45 56.98 1j3h n PHE 187 Cb 0.29 0.00 -0.03 0.00 -1.00 0.00 0.00 39.48 38.74 1j3h n PHE 187 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1j3h s ALA 188 N -2.00 3.42 0.03 4.37 0.00 -1.11 -4.76 121.76 121.72 1j3h s ALA 188 Ca 0.03 1.03 0.02 0.00 0.00 0.00 0.00 51.96 53.04 1j3h s ALA 188 Cb 0.01 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.73 1j3h s ALA 188 CO 0.02 -0.36 -0.07 0.21 0.00 0.00 0.00 175.76 175.56 1j3h s LYS 189 N -1.63 0.51 -0.41 0.00 2.20 -0.87 -4.95 119.74 114.59 1j3h s LYS 189 Ca 0.47 -0.65 -0.18 0.00 -0.36 0.00 0.00 55.97 55.24 1j3h s LYS 189 Cb -0.35 -0.31 0.02 0.00 -1.51 0.00 0.00 37.83 35.68 1j3h s LYS 189 CO 0.45 0.06 0.48 0.50 -0.36 0.00 0.00 175.35 176.49 1j3h s ARG 190 N -1.32 3.24 -0.07 4.03 6.06 -1.26 -0.52 118.95 129.11 1j3h s ARG 190 Ca -0.08 -0.58 -0.05 0.00 -2.50 0.00 0.00 55.73 52.52 1j3h s ARG 190 Cb -0.09 -3.93 0.02 0.00 0.06 0.00 0.00 34.95 31.02 1j3h s ARG 190 CO 0.00 -0.83 0.18 0.14 -2.50 0.00 0.00 175.30 172.29 1j3h s VAL 191 N 2.30 -0.01 -0.13 7.11 -7.23 0.50 -5.01 120.40 117.94 1j3h s VAL 191 Ca 0.15 0.05 -0.10 0.00 -1.81 0.00 0.00 61.98 60.27 1j3h s VAL 191 Cb -0.16 -0.26 -0.08 0.00 0.56 0.00 0.00 36.38 36.43 1j3h s VAL 191 CO 0.15 0.02 0.16 0.11 -0.31 0.00 0.00 175.10 175.22 1j3h h LYS 192 N 6.28 0.00 0.00 4.82 1.79 -1.97 -3.42 116.57 124.07 1j3h h LYS 192 Ca -0.30 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.17 1j3h h LYS 192 Cb 1.18 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.83 1j3h h LYS 192 CO 0.40 0.31 0.00 0.41 -1.08 0.00 0.00 179.45 179.49 1j3h n GLY 193 N 1.68 0.64 3.65 3.86 0.00 -1.26 -5.00 105.19 108.76 1j3h n GLY 193 Ca -0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 1j3h n GLY 193 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1j3h s ARG 194 N 1.62 2.32 0.28 1.61 0.52 -1.26 -4.72 118.95 119.32 1j3h s ARG 194 Ca 0.00 -1.27 0.02 0.00 -0.52 0.00 0.00 55.73 53.96 1j3h s ARG 194 Cb 0.00 -2.25 -0.04 0.00 0.52 0.00 0.00 34.95 33.18 1j3h s ARG 194 CO 0.00 0.41 0.13 0.99 0.02 0.00 0.00 175.30 176.85 1j3h s THR 195 N -2.01 0.37 -0.28 0.02 2.01 -0.40 -4.94 115.64 110.41 1j3h s THR 195 Ca 0.29 -2.00 0.01 0.00 0.31 0.00 0.00 61.69 60.30 1j3h s THR 195 Cb -0.08 -2.56 0.08 0.00 0.01 0.00 0.00 72.50 69.96 1j3h s THR 195 CO 0.19 0.00 0.02 0.26 -0.69 0.00 0.00 174.62 174.40 1j3h s TRP 196 N -3.72 2.50 -0.05 4.92 0.51 -1.26 -1.86 118.94 119.98 1j3h s TRP 196 Ca 0.37 -2.05 -0.05 0.00 -2.12 0.00 0.00 56.10 52.25 1j3h s TRP 196 Cb 0.06 -1.96 0.01 0.00 -0.81 0.00 0.00 33.47 30.77 1j3h s TRP 196 CO 0.16 -0.85 0.14 -0.51 -0.51 0.00 0.00 176.95 175.37 1j3h s LEU 198 N 1.35 1.49 0.00 2.99 2.01 -1.26 -4.98 118.68 120.28 1j3h s LEU 198 Ca 0.04 0.25 0.00 0.00 0.01 0.00 0.00 54.13 54.42 1j3h s LEU 198 Cb -0.18 0.48 0.00 0.00 0.01 0.00 0.00 46.19 46.49 1j3h s LEU 198 CO -0.13 -0.07 0.00 0.61 1.01 0.00 0.00 176.35 177.78 1j3h n GLY 200 N 2.92 -1.10 3.67 -3.19 0.00 -1.26 -5.24 105.19 100.98 1j3h n GLY 200 Ca -0.13 -1.60 -0.42 0.00 0.00 0.00 0.00 46.02 43.87 1j3h n GLY 200 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j3h s THR 201 N -2.87 3.85 0.25 2.61 2.01 -1.26 -4.93 115.64 115.30 1j3h s THR 201 Ca 0.00 1.10 0.05 0.00 0.31 0.00 0.00 61.69 63.15 1j3h s THR 201 Cb 0.00 -3.71 0.31 0.00 0.01 0.00 0.00 72.50 69.11 1j3h s THR 201 CO 0.00 -0.07 1.20 -0.81 -0.69 0.00 0.00 174.62 174.25 1j3h n PRO 202 N 6.46 -0.06 0.13 4.92 -0.04 -1.26 -1.68 135.00 143.47 1j3h n PRO 202 Ca 0.15 1.13 0.10 0.00 -0.04 0.00 0.00 63.50 64.84 1j3h n PRO 202 Cb 0.44 -1.84 0.48 0.00 -0.04 0.00 0.00 33.50 32.54 1j3h n PRO 202 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1j3h n GLU 203 N -4.99 0.14 0.00 0.54 0.00 -1.26 -2.02 120.64 113.05 1j3h n GLU 203 Ca 0.21 0.53 0.05 0.00 0.00 0.00 0.00 57.16 57.95 1j3h n GLU 203 Cb 0.68 -1.86 -0.03 0.00 0.00 0.00 0.00 31.44 30.23 1j3h n GLU 203 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1j3h n TYR 204 N -2.13 0.00 -2.12 -1.84 4.02 -0.67 -4.79 117.16 109.63 1j3h n TYR 204 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.48 1j3h n TYR 204 Cb 0.11 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.40 1j3h n TYR 204 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1j3h s LEU 205 N -2.14 4.39 0.44 7.72 1.43 -0.86 -4.27 118.68 125.38 1j3h s LEU 205 Ca 0.07 2.47 -0.10 0.00 -1.03 0.00 0.00 54.13 55.54 1j3h s LEU 205 Cb 0.09 -3.60 -0.06 0.00 0.03 0.00 0.00 46.19 42.65 1j3h s LEU 205 CO 0.38 -0.65 0.80 0.00 0.23 0.00 0.00 176.35 177.11 1j3h s ALA 206 N 0.50 3.33 0.31 4.21 0.00 -1.26 -4.92 121.76 123.93 1j3h s ALA 206 Ca 0.61 -0.24 0.04 0.00 0.00 0.00 0.00 51.96 52.38 1j3h s ALA 206 Cb -0.39 -2.72 0.81 0.00 0.00 0.00 0.00 23.12 20.82 1j3h s ALA 206 CO 0.36 -0.12 1.61 -1.00 0.00 0.00 0.00 175.76 176.61 1j3h h PRO 207 N 0.95 0.12 -0.27 0.00 0.13 -1.94 -1.16 132.00 129.82 1j3h h PRO 207 Ca -0.47 -0.01 0.07 0.00 -0.87 0.00 0.00 66.00 64.72 1j3h h PRO 207 Cb 1.19 -0.03 -0.07 0.00 0.13 0.00 0.00 31.00 32.22 1j3h h PRO 207 CO 0.63 0.08 -0.26 0.93 -0.23 0.00 0.00 178.00 179.15 1j3h h GLU 208 N 0.12 -0.24 -0.28 0.86 3.07 -1.93 0.14 114.58 116.32 1j3h h GLU 208 Ca 0.61 0.02 -0.00 0.00 -0.50 0.00 0.00 59.36 59.48 1j3h h GLU 208 Cb 1.30 0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 29.25 1j3h h GLU 208 CO -0.75 -0.16 0.17 0.82 -1.40 0.00 0.00 179.01 177.69 1j3h h ILE 209 N -0.25 1.10 0.14 3.13 2.04 -1.50 -2.91 117.51 119.25 1j3h h ILE 209 Ca 0.15 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 1j3h h ILE 209 Cb 0.48 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1j3h h ILE 209 CO -0.42 0.09 -0.07 0.40 0.00 0.00 0.00 178.15 178.16 1j3h h ILE 210 N 0.36 0.86 0.00 -0.67 5.03 -1.09 -2.69 117.51 119.32 1j3h h ILE 210 Ca 0.10 -0.01 0.00 0.00 -0.12 0.00 0.00 64.86 64.84 1j3h h ILE 210 Cb 0.00 0.87 0.00 0.00 -3.03 0.00 0.00 36.82 34.66 1j3h h ILE 210 CO -0.02 0.00 0.00 0.18 -0.68 0.00 0.00 178.15 177.63 1j3h n LEU 211 N -5.17 2.55 -1.23 1.44 4.77 0.45 -4.78 117.00 115.03 1j3h n LEU 211 Ca -0.08 -1.19 -0.02 0.00 -0.03 0.00 0.00 56.01 54.69 1j3h n LEU 211 Cb 0.10 -0.50 -0.00 0.00 -2.33 0.00 0.00 43.42 40.69 1j3h n LEU 211 CO 0.34 0.46 -0.01 -1.20 -1.33 0.00 0.00 177.39 175.66 1j3h n SER 212 N 1.24 -0.13 -4.07 -1.43 7.64 -1.01 -4.85 113.62 111.01 1j3h n SER 212 Ca 0.00 -0.03 -0.15 0.00 1.01 0.00 0.00 58.87 59.70 1j3h n SER 212 Cb 0.30 -0.12 0.06 0.00 -1.01 0.00 0.00 64.21 63.44 1j3h n SER 212 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1j3h n LYS 213 N -0.52 0.57 -2.66 1.43 5.02 -1.11 -5.07 118.16 115.82 1j3h n LYS 213 Ca 0.01 -2.21 -0.41 0.00 -2.02 0.00 0.00 58.31 53.68 1j3h n LYS 213 Cb 0.04 -0.24 -0.04 0.00 -0.02 0.00 0.00 35.03 34.77 1j3h n LYS 213 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1j3h s GLY 214 N -4.01 2.91 0.30 0.72 0.00 -1.26 -4.70 107.32 101.28 1j3h s GLY 214 Ca 0.45 0.64 0.07 0.00 0.00 0.00 0.00 44.72 45.89 1j3h s GLY 214 CO 0.29 1.58 -0.07 -2.52 0.00 0.00 0.00 173.10 172.38 1j3h s TYR 215 N 0.19 2.07 0.00 1.90 -0.85 -0.78 -4.94 117.35 114.94 1j3h s TYR 215 Ca 0.49 -0.65 0.00 0.00 -0.52 0.00 0.00 57.07 56.39 1j3h s TYR 215 Cb -0.25 -1.19 0.00 0.00 0.38 0.00 0.00 41.96 40.91 1j3h s TYR 215 CO 0.31 0.36 0.00 0.27 -1.52 0.00 0.00 175.55 174.96 1j3h n ASN 216 N -0.64 0.18 0.28 -0.18 6.94 -1.26 -1.27 115.26 119.31 1j3h n ASN 216 Ca -0.05 -0.49 0.12 0.00 -0.02 0.00 0.00 54.58 54.13 1j3h n ASN 216 Cb 0.63 0.00 0.64 0.00 -2.36 0.00 0.00 39.78 38.70 1j3h n ASN 216 CO 0.00 0.00 0.00 0.07 -1.03 0.00 0.00 177.26 176.30 1j3h h LYS 217 N 0.00 0.00 0.00 -3.83 2.10 -1.95 -1.31 116.57 111.58 1j3h h LYS 217 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1j3h h LYS 217 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1j3h h LYS 217 CO 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.45 1j3h h ALA 218 N 1.25 1.00 -0.52 0.07 0.00 -1.95 -2.28 119.26 116.82 1j3h h ALA 218 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1j3h h ALA 218 Cb 0.69 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1j3h h ALA 218 CO 0.00 0.00 0.32 0.28 0.00 0.00 0.00 179.25 179.85 1j3h h VAL 219 N 0.00 1.15 -0.09 0.00 2.07 -1.65 -1.95 116.25 115.78 1j3h h VAL 219 Ca 0.00 -0.33 -0.12 0.00 0.82 0.00 0.00 66.70 67.08 1j3h h VAL 219 Cb 0.22 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 1j3h h VAL 219 CO 0.00 0.15 -0.46 0.44 0.02 0.00 0.00 177.57 177.72 1j3h h ASP 220 N 0.72 0.24 -0.11 0.57 3.32 -1.64 -1.62 116.42 117.90 1j3h h ASP 220 Ca 0.19 -0.11 -0.22 0.00 0.02 0.00 0.00 57.03 56.91 1j3h h ASP 220 Cb -0.03 -0.07 0.01 0.00 0.22 0.00 0.00 39.33 39.46 1j3h h ASP 220 CO -0.04 0.67 -0.75 -0.50 -1.72 0.00 0.00 179.24 176.91 1j3h h TRP 221 N 0.18 1.01 0.33 4.55 -0.00 -1.53 -1.06 115.95 119.44 1j3h h TRP 221 Ca 0.01 -0.44 -0.01 0.00 -0.00 0.00 0.00 58.89 58.46 1j3h h TRP 221 Cb 0.89 -0.16 -0.01 0.00 -0.00 0.00 0.00 29.16 29.89 1j3h h TRP 221 CO 0.02 1.26 -0.22 2.35 -0.00 0.00 0.00 178.44 181.85 1j3h h TRP 222 N 0.52 -0.57 -0.99 0.49 2.91 -1.22 -2.22 115.95 114.87 1j3h h TRP 222 Ca -0.04 -0.00 0.14 0.00 1.13 0.00 0.00 58.89 60.11 1j3h h TRP 222 Cb 1.37 0.21 -0.09 0.00 -0.51 0.00 0.00 29.16 30.14 1j3h h TRP 222 CO 0.08 -0.34 0.62 0.00 -1.03 0.00 0.00 178.44 177.78 1j3h h ALA 223 N 0.10 1.60 -0.71 2.65 0.00 -1.22 0.35 119.26 122.03 1j3h h ALA 223 Ca -0.03 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.00 1j3h h ALA 223 Cb 0.45 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 1j3h h ALA 223 CO 0.02 0.12 0.47 1.25 0.00 0.00 0.00 179.25 181.11 1j3h h LEU 224 N 0.90 0.58 0.64 0.00 6.46 -0.64 0.27 115.31 123.51 1j3h h LEU 224 Ca 0.51 0.01 -0.03 0.00 -0.12 0.00 0.00 57.88 58.25 1j3h h LEU 224 Cb 0.62 -0.11 0.01 0.00 -0.73 0.00 0.00 40.66 40.45 1j3h h LEU 224 CO -0.29 0.36 -0.31 1.23 -0.62 0.00 0.00 178.44 178.81 1j3h h GLY 225 N 0.65 -0.90 -0.04 3.75 0.00 0.26 0.91 103.07 107.70 1j3h h GLY 225 Ca 0.32 0.33 0.21 0.00 0.00 0.00 0.00 47.33 48.19 1j3h h GLY 225 CO -0.11 -0.33 0.53 -2.08 0.00 0.00 0.00 176.54 174.55 1j3h h VAL 226 N -1.05 0.59 -0.17 4.60 2.07 -0.83 0.95 116.25 122.41 1j3h h VAL 226 Ca -0.09 -0.20 -0.04 0.00 0.82 0.00 0.00 66.70 67.19 1j3h h VAL 226 Cb 0.70 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1j3h h VAL 226 CO 0.14 0.11 -0.05 0.25 0.02 0.00 0.00 177.57 178.04 1j3h h LEU 227 N 0.59 0.35 -1.02 2.57 5.85 -0.21 -1.49 115.31 121.95 1j3h h LEU 227 Ca 0.58 -0.38 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 1j3h h LEU 227 Cb 1.02 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.92 1j3h h LEU 227 CO -0.45 0.65 0.39 0.40 -0.34 0.00 0.00 178.44 179.09 1j3h h ILE 228 N 0.04 1.24 0.51 4.05 5.03 0.41 -1.19 117.51 127.59 1j3h h ILE 228 Ca 0.04 -0.63 -0.02 0.00 -0.12 0.00 0.00 64.86 64.13 1j3h h ILE 228 Cb 0.50 0.22 0.00 0.00 -3.03 0.00 0.00 36.82 34.52 1j3h h ILE 228 CO 0.02 0.27 -0.24 0.22 -0.68 0.00 0.00 178.15 177.74 1j3h h TYR 229 N 1.09 -0.63 -1.00 1.37 3.20 -0.80 -2.82 116.97 117.37 1j3h h TYR 229 Ca 0.27 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.26 1j3h h TYR 229 Cb 0.07 0.21 -0.09 0.00 1.54 0.00 0.00 36.73 38.46 1j3h h TYR 229 CO 0.01 -0.32 0.62 1.49 -1.64 0.00 0.00 178.16 178.32 1j3h h GLU 230 N -0.86 0.89 -0.10 1.82 4.81 -0.94 0.11 114.58 120.31 1j3h h GLU 230 Ca -0.07 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1j3h h GLU 230 Cb 0.59 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.77 1j3h h GLU 230 CO 0.11 0.59 0.05 0.52 -0.73 0.00 0.00 179.01 179.55 1j3h h MET 231 N 0.92 0.15 -0.03 1.92 2.86 -1.16 0.21 114.93 119.79 1j3h h MET 231 Ca 0.52 -0.02 -0.21 0.00 -2.06 0.00 0.00 59.70 57.92 1j3h h MET 231 Cb 0.61 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.25 1j3h h MET 231 CO -0.29 0.22 -0.87 0.00 1.06 0.00 0.00 176.91 177.03 1j3h h ALA 232 N 0.91 0.42 0.08 6.32 0.00 -1.15 0.10 119.26 125.95 1j3h h ALA 232 Ca 0.03 -0.67 -0.14 0.00 0.00 0.00 0.00 54.91 54.13 1j3h h ALA 232 Cb 0.13 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1j3h h ALA 232 CO -0.00 0.79 -0.65 0.00 0.00 0.00 0.00 179.25 179.39 1j3h h ALA 233 N 0.78 -0.01 0.00 0.00 0.00 -0.82 -3.38 119.26 115.83 1j3h h ALA 233 Ca -0.06 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.14 1j3h h ALA 233 Cb 1.49 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.43 1j3h h ALA 233 CO 0.15 0.33 0.00 0.41 0.00 0.00 0.00 179.25 180.14 1j3h n GLY 234 N 1.65 0.73 3.50 0.00 0.00 0.74 -4.76 105.19 107.04 1j3h n GLY 234 Ca -0.15 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.71 1j3h n GLY 234 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1j3h s TYR 235 N -2.00 -0.61 0.57 1.61 -0.85 -1.18 -4.91 117.35 109.98 1j3h s TYR 235 Ca 0.00 1.16 -0.20 0.00 -0.52 0.00 0.00 57.07 57.51 1j3h s TYR 235 Cb 0.00 0.34 -0.04 0.00 0.38 0.00 0.00 41.96 42.64 1j3h s TYR 235 CO 0.00 -0.53 1.30 -1.25 -1.52 0.00 0.00 175.55 173.55 1j3h s PRO 236 N -0.88 3.01 0.50 -3.49 0.04 -1.26 -4.02 135.00 128.90 1j3h s PRO 236 Ca -0.09 2.09 0.25 0.00 0.04 0.00 0.00 61.00 63.28 1j3h s PRO 236 Cb -0.02 -2.11 1.30 0.00 0.04 0.00 0.00 34.50 33.72 1j3h s PRO 236 CO 0.07 -1.25 2.02 -1.00 0.04 0.00 0.00 177.00 176.89 1j3h h PRO 237 N 1.18 0.00 -3.39 0.56 0.13 -1.92 -3.36 132.00 125.19 1j3h h PRO 237 Ca -0.51 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.00 1j3h h PRO 237 Cb 1.31 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 32.03 1j3h h PRO 237 CO 0.56 0.15 -0.71 -0.06 -0.23 0.00 0.00 178.00 177.71 1j3h s PHE 238 N -4.19 2.43 -0.03 1.56 2.99 -1.26 -4.85 117.98 114.63 1j3h s PHE 238 Ca -0.03 -2.55 0.05 0.00 0.00 0.00 0.00 56.93 54.40 1j3h s PHE 238 Cb 0.13 -2.20 -0.01 0.00 0.00 0.00 0.00 43.02 40.94 1j3h s PHE 238 CO 0.61 -0.81 -0.18 -0.06 -0.00 0.00 0.00 175.22 174.78 1j3h s PHE 239 N 0.50 1.69 0.00 0.36 0.08 -1.26 -4.75 117.98 114.60 1j3h s PHE 239 Ca 0.15 -0.41 0.00 0.00 0.12 0.00 0.00 56.93 56.79 1j3h s PHE 239 Cb -0.23 -1.12 0.00 0.00 -0.57 0.00 0.00 43.02 41.10 1j3h s PHE 239 CO -0.05 -0.10 0.00 0.00 -0.10 0.00 0.00 175.22 174.97 1j3h n ALA 240 N 2.91 0.00 0.00 5.36 0.00 -1.26 -4.95 120.51 122.56 1j3h n ALA 240 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1j3h n ALA 240 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1j3h n ALA 240 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1j3h n ASP 241 N 0.00 1.31 -4.63 0.00 8.00 -1.26 -5.05 116.55 114.93 1j3h n ASP 241 Ca 0.00 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.16 1j3h n ASP 241 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.00 1j3h n ASP 241 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1j3h s GLN 242 N -1.85 3.03 0.28 -1.24 -1.52 -1.26 -5.04 119.66 112.06 1j3h s GLN 242 Ca 0.00 -0.46 -0.01 0.00 -1.95 0.00 0.00 55.36 52.94 1j3h s GLN 242 Cb 0.00 -2.76 0.64 0.00 -0.22 0.00 0.00 33.01 30.67 1j3h s GLN 242 CO 0.00 0.62 1.64 -1.00 -0.25 0.00 0.00 175.29 176.30 1j3h h PRO 243 N 5.42 0.16 -0.99 2.91 0.13 -2.01 -2.50 132.00 135.13 1j3h h PRO 243 Ca -0.47 -0.01 0.21 0.00 -0.87 0.00 0.00 66.00 64.86 1j3h h PRO 243 Cb 1.19 -0.04 -0.09 0.00 0.13 0.00 0.00 31.00 32.19 1j3h h PRO 243 CO 0.55 0.10 0.62 0.82 -0.23 0.00 0.00 178.00 179.87 1j3h h ILE 244 N 0.16 0.65 0.00 -3.56 5.03 -2.00 -0.76 117.51 117.03 1j3h h ILE 244 Ca 0.52 -0.20 -0.16 0.00 -0.12 0.00 0.00 64.86 64.89 1j3h h ILE 244 Cb 1.01 0.01 -0.02 0.00 -3.03 0.00 0.00 36.82 34.79 1j3h h ILE 244 CO -0.68 0.11 -0.78 1.56 -0.68 0.00 0.00 178.15 177.68 1j3h h GLN 245 N 0.58 0.00 -0.03 2.37 7.50 -1.88 -2.78 115.11 120.87 1j3h h GLN 245 Ca 0.56 0.00 -0.00 0.00 0.50 0.00 0.00 58.65 59.71 1j3h h GLN 245 Cb 1.12 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.65 1j3h h GLN 245 CO -0.32 0.78 -0.00 0.82 -1.50 0.00 0.00 178.83 178.61 1j3h h ILE 246 N 0.00 1.25 -0.40 2.54 5.03 -1.19 -1.49 117.51 123.25 1j3h h ILE 246 Ca -0.01 -0.76 0.08 0.00 -0.12 0.00 0.00 64.86 64.06 1j3h h ILE 246 Cb 1.58 1.72 -0.08 0.00 -3.03 0.00 0.00 36.82 37.01 1j3h h ILE 246 CO 0.10 0.20 -0.13 1.88 -0.68 0.00 0.00 178.15 179.52 1j3h h TYR 247 N -0.26 -0.30 -0.06 1.37 -1.99 -1.40 0.63 116.97 114.96 1j3h h TYR 247 Ca 0.01 0.04 0.03 0.00 2.00 0.00 0.00 58.73 60.81 1j3h h TYR 247 Cb 0.33 0.19 -0.06 0.00 2.00 0.00 0.00 36.73 39.19 1j3h h TYR 247 CO 0.03 -0.21 -0.44 0.93 -0.00 0.00 0.00 178.16 178.48 1j3h h GLU 248 N -0.04 -0.53 -0.27 4.88 5.08 -1.32 -0.59 114.58 121.79 1j3h h GLU 248 Ca 0.19 0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.55 1j3h h GLU 248 Cb 0.34 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1j3h h GLU 248 CO -0.43 -0.35 -0.00 0.87 -1.00 0.00 0.00 179.01 178.09 1j3h h LYS 249 N -0.55 0.40 0.00 2.33 1.57 -0.36 -1.15 116.57 118.81 1j3h h LYS 249 Ca 0.06 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1j3h h LYS 249 Cb 0.65 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.90 1j3h h LYS 249 CO -0.36 0.43 -0.07 -0.84 -0.57 0.00 0.00 179.45 178.04 1j3h h ILE 250 N 0.39 0.19 0.02 1.86 -2.65 0.13 -3.08 117.51 114.38 1j3h h ILE 250 Ca 0.09 -0.70 -0.34 0.00 1.03 0.00 0.00 64.86 64.94 1j3h h ILE 250 Cb 0.27 1.59 -0.05 0.00 -2.05 0.00 0.00 36.82 36.57 1j3h h ILE 250 CO 0.01 0.07 -2.03 0.52 0.03 0.00 0.00 178.15 176.75 1j3h n VAL 251 N -3.21 1.57 -0.30 0.16 0.31 -0.33 -4.20 118.33 112.33 1j3h n VAL 251 Ca 0.00 -0.76 0.02 0.00 -0.01 0.00 0.00 64.34 63.59 1j3h n VAL 251 Cb 0.34 -1.06 0.16 0.00 -0.91 0.00 0.00 33.84 32.37 1j3h n VAL 251 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1j3h h SER 252 N 0.01 0.74 -3.99 4.52 0.02 -1.15 -3.47 113.55 110.24 1j3h h SER 252 Ca -0.41 0.03 -0.16 0.00 -0.84 0.00 0.00 61.79 60.41 1j3h h SER 252 Cb 2.07 -0.11 0.09 0.00 0.14 0.00 0.00 62.40 64.59 1j3h h SER 252 CO 0.05 0.45 -0.41 0.61 -1.14 0.00 0.00 176.83 176.39 1j3h n GLY 253 N -1.32 -0.02 2.80 -3.77 0.00 -1.18 -5.03 105.19 96.67 1j3h n GLY 253 Ca 0.13 -0.08 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1j3h n GLY 253 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j3h s LYS 254 N -4.43 0.98 -0.15 1.61 0.00 -1.26 -4.97 119.74 111.52 1j3h s LYS 254 Ca 0.07 -0.85 -0.08 0.00 0.00 0.00 0.00 55.97 55.11 1j3h s LYS 254 Cb -0.01 -2.26 -0.04 0.00 0.00 0.00 0.00 37.83 35.52 1j3h s LYS 254 CO 0.38 -0.75 0.11 0.08 0.00 0.00 0.00 175.35 175.17 1j3h s VAL 255 N 1.61 5.27 -0.26 1.79 1.01 -1.26 -5.05 120.40 123.51 1j3h s VAL 255 Ca 0.02 0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.13 1j3h s VAL 255 Cb -0.18 -3.33 0.05 0.00 0.00 0.00 0.00 36.38 32.92 1j3h s VAL 255 CO -0.13 0.54 -0.08 0.00 0.00 0.00 0.00 175.10 175.43 1j3h s ARG 256 N -0.40 2.47 0.14 2.72 3.03 -1.26 -5.11 118.95 120.54 1j3h s ARG 256 Ca 0.11 -1.21 -0.26 0.00 2.03 0.00 0.00 55.73 56.40 1j3h s ARG 256 Cb -0.12 -2.95 -0.07 0.00 -1.03 0.00 0.00 34.95 30.78 1j3h s ARG 256 CO 0.01 -0.52 0.80 -0.06 -1.13 0.00 0.00 175.30 174.41 1j3h s PHE 257 N 1.20 3.86 0.29 5.89 0.40 -1.26 -5.01 117.98 123.34 1j3h s PHE 257 Ca -0.05 1.63 -0.29 0.00 -0.60 0.00 0.00 56.93 57.61 1j3h s PHE 257 Cb -0.19 -2.82 -0.10 0.00 0.51 0.00 0.00 43.02 40.42 1j3h s PHE 257 CO -0.05 0.42 1.39 -1.25 0.70 0.00 0.00 175.22 176.44 1j3h s PRO 258 N -0.77 4.29 0.54 0.24 0.04 -1.26 -4.87 135.00 133.21 1j3h s PRO 258 Ca 0.38 2.28 0.49 0.00 0.04 0.00 0.00 61.00 64.19 1j3h s PRO 258 Cb -0.23 -3.09 1.70 0.00 0.04 0.00 0.00 34.50 32.92 1j3h s PRO 258 CO 0.26 -0.34 1.53 -1.13 0.04 0.00 0.00 177.00 177.37 1j3h n SER 259 N 1.62 0.01 -0.00 6.66 3.41 -1.26 -1.12 113.62 122.93 1j3h n SER 259 Ca 0.04 0.99 0.14 0.00 -0.26 0.00 0.00 58.87 59.78 1j3h n SER 259 Cb 0.41 -0.50 0.63 0.00 -0.26 0.00 0.00 64.21 64.49 1j3h n SER 259 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1j3h n HIS 260 N -3.92 0.00 -1.71 7.33 1.44 -1.26 -4.85 115.22 112.24 1j3h n HIS 260 Ca 0.44 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.73 1j3h n HIS 260 Cb 1.97 -0.43 -0.03 0.00 0.12 0.00 0.00 29.99 31.62 1j3h n HIS 260 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 1j3h s PHE 261 N -2.88 2.74 0.94 -1.40 0.40 -0.28 -4.96 117.98 112.54 1j3h s PHE 261 Ca 0.18 0.25 -0.11 0.00 -0.60 0.00 0.00 56.93 56.65 1j3h s PHE 261 Cb 0.19 -4.16 0.16 0.00 0.51 0.00 0.00 43.02 39.72 1j3h s PHE 261 CO 0.52 -4.49 1.10 -1.54 0.70 0.00 0.00 175.22 171.52 1j3h s SER 262 N 1.51 2.86 0.32 1.36 1.04 -1.26 -4.84 113.70 114.68 1j3h s SER 262 Ca 0.76 1.87 0.05 0.00 0.48 0.00 0.00 55.95 59.12 1j3h s SER 262 Cb -0.49 -2.44 0.54 0.00 0.10 0.00 0.00 66.02 63.73 1j3h s SER 262 CO 0.33 -3.09 1.78 0.28 0.98 0.00 0.00 173.24 173.53 1j3h h SER 263 N -1.86 0.36 -0.31 7.02 0.02 -1.98 -2.35 113.55 114.45 1j3h h SER 263 Ca -0.48 -0.11 -0.14 0.00 -0.84 0.00 0.00 61.79 60.22 1j3h h SER 263 Cb 1.28 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.72 1j3h h SER 263 CO 0.47 0.60 -0.37 0.44 -1.14 0.00 0.00 176.83 176.84 1j3h h ASP 264 N 0.33 0.87 -0.17 3.07 3.32 -1.99 -2.65 116.42 119.19 1j3h h ASP 264 Ca 0.05 -0.49 -0.01 0.00 0.02 0.00 0.00 57.03 56.61 1j3h h ASP 264 Cb 0.59 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1j3h h ASP 264 CO 0.04 1.18 0.06 0.25 -1.72 0.00 0.00 179.24 179.05 1j3h h LEU 265 N 0.58 0.25 -0.72 1.55 6.46 -1.88 -2.32 115.31 119.22 1j3h h LEU 265 Ca 0.04 -0.19 0.12 0.00 -0.12 0.00 0.00 57.88 57.73 1j3h h LEU 265 Cb 0.96 -0.06 -0.08 0.00 -0.73 0.00 0.00 40.66 40.74 1j3h h LEU 265 CO 0.09 0.37 0.30 0.11 -0.62 0.00 0.00 178.44 178.69 1j3h h LYS 266 N 0.11 0.46 0.16 1.25 1.57 -1.43 -0.04 116.57 118.65 1j3h h LYS 266 Ca 0.06 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1j3h h LYS 266 Cb 0.21 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1j3h h LYS 266 CO -0.00 0.31 -0.08 0.22 -0.57 0.00 0.00 179.45 179.33 1j3h h ASP 267 N 0.48 -0.18 -0.47 0.86 3.58 -1.30 -0.12 116.42 119.26 1j3h h ASP 267 Ca 0.38 -0.08 0.03 0.00 0.42 0.00 0.00 57.03 57.78 1j3h h ASP 267 Cb 0.51 0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.58 1j3h h ASP 267 CO -0.35 -0.04 0.26 0.25 -2.88 0.00 0.00 179.24 176.49 1j3h h LEU 268 N -0.32 0.41 -0.88 2.28 5.85 -0.96 -1.91 115.31 119.79 1j3h h LEU 268 Ca -0.02 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.65 1j3h h LEU 268 Cb 0.25 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 1j3h h LEU 268 CO 0.04 0.29 0.11 -0.07 -0.34 0.00 0.00 178.44 178.47 1j3h h LEU 269 N 0.53 0.89 -0.91 2.25 3.38 -0.91 -1.50 115.31 119.03 1j3h h LEU 269 Ca 0.19 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1j3h h LEU 269 Cb 0.05 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 1j3h h LEU 269 CO -0.11 0.89 0.18 0.03 0.09 0.00 0.00 178.44 179.52 1j3h h ARG 270 N 0.89 0.98 -0.22 1.13 2.47 -0.56 0.50 114.38 119.58 1j3h h ARG 270 Ca 0.19 -0.20 -0.20 0.00 -1.26 0.00 0.00 59.98 58.50 1j3h h ARG 270 Cb 0.37 -0.15 0.01 0.00 -1.65 0.00 0.00 29.97 28.55 1j3h h ARG 270 CO 0.01 0.85 -0.64 -2.95 0.56 0.00 0.00 179.97 177.80 1j3h h ASN 271 N 0.94 0.94 -0.15 7.04 7.08 -1.05 -3.28 115.58 127.11 1j3h h ASN 271 Ca 0.21 -0.58 -0.07 0.00 -3.08 0.00 0.00 56.30 52.77 1j3h h ASN 271 Cb 0.30 -0.27 -0.00 0.00 -2.08 0.00 0.00 38.32 36.26 1j3h h ASN 271 CO -0.01 1.35 -0.19 -0.07 -2.08 0.00 0.00 177.43 176.44 1j3h h LEU 272 N 0.57 0.43 -5.73 6.14 3.38 -1.05 -2.69 115.31 116.35 1j3h h LEU 272 Ca -0.02 -0.51 -0.73 0.00 0.09 0.00 0.00 57.88 56.71 1j3h h LEU 272 Cb 1.26 -0.12 -0.10 0.00 0.09 0.00 0.00 40.66 41.79 1j3h h LEU 272 CO 0.14 0.85 2.58 0.18 0.09 0.00 0.00 178.44 182.27 1j3h n LEU 273 N -4.50 7.82 -4.18 1.67 4.77 0.17 -4.40 117.00 118.35 1j3h n LEU 273 Ca -0.06 -4.73 -0.34 0.00 -0.03 0.00 0.00 56.01 50.85 1j3h n LEU 273 Cb 0.40 -1.43 -0.15 0.00 -2.33 0.00 0.00 43.42 39.90 1j3h n LEU 273 CO 0.40 1.88 -0.49 -1.58 -1.33 0.00 0.00 177.39 176.27 1j3h s GLN 274 N -0.16 3.10 0.59 3.23 0.74 -1.24 -4.80 119.66 121.11 1j3h s GLN 274 Ca 0.53 -0.77 0.28 0.00 0.05 0.00 0.00 55.36 55.45 1j3h s GLN 274 Cb 0.16 -2.68 1.70 0.00 1.10 0.00 0.00 33.01 33.29 1j3h s GLN 274 CO -0.07 -0.19 2.16 -0.24 -0.55 0.00 0.00 175.29 176.40 1j3h h VAL 275 N 5.86 0.52 -2.46 1.34 3.04 -1.92 -3.39 116.25 119.24 1j3h h VAL 275 Ca -0.44 0.00 -0.56 0.00 -1.01 0.00 0.00 66.70 64.69 1j3h h VAL 275 Cb 1.15 0.90 -0.09 0.00 -2.01 0.00 0.00 31.29 31.24 1j3h h VAL 275 CO 0.62 0.00 0.96 -0.62 -1.01 0.00 0.00 177.57 177.52 1j3h s ASP 276 N -5.99 6.18 0.00 3.17 3.68 -1.26 -4.86 116.67 117.58 1j3h s ASP 276 Ca -0.05 -0.52 0.00 0.00 2.13 0.00 0.00 52.55 54.11 1j3h s ASP 276 Cb 0.15 -2.53 0.00 0.00 -1.45 0.00 0.00 42.92 39.09 1j3h s ASP 276 CO 0.56 -1.75 0.75 0.00 0.13 0.00 0.00 175.17 174.86 1j3h n LEU 277 N 9.02 0.00 -0.67 -1.34 -0.00 -1.26 -0.02 117.00 122.74 1j3h n LEU 277 Ca 0.02 0.27 0.08 0.00 -0.00 0.00 0.00 56.01 56.38 1j3h n LEU 277 Cb 0.48 -0.27 0.08 0.00 -0.00 0.00 0.00 43.42 43.72 1j3h n LEU 277 CO 0.70 -0.27 0.52 0.35 -0.00 0.00 0.00 177.39 178.69 1j3h n THR 278 N -1.25 0.11 -0.26 1.47 -2.24 -1.26 -4.38 114.28 106.46 1j3h n THR 278 Ca 0.00 -0.55 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 1j3h n THR 278 Cb 0.02 1.24 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 1j3h n THR 278 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1j3h n LYS 279 N 0.90 0.21 -2.41 -0.78 5.02 0.97 -5.01 118.16 117.07 1j3h n LYS 279 Ca 0.10 -0.29 -0.42 0.00 -2.02 0.00 0.00 58.31 55.68 1j3h n LYS 279 Cb 0.41 -0.76 -0.03 0.00 -0.02 0.00 0.00 35.03 34.63 1j3h n LYS 279 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1j3h s ARG 280 N -0.11 4.40 0.11 1.97 3.52 -0.77 -4.93 118.95 123.14 1j3h s ARG 280 Ca 0.00 1.77 -0.31 0.00 -0.13 0.00 0.00 55.73 57.06 1j3h s ARG 280 Cb 0.00 -3.41 -0.10 0.00 -1.56 0.00 0.00 34.95 29.88 1j3h s ARG 280 CO 0.00 -0.33 1.73 -0.06 -0.81 0.00 0.00 175.30 175.83 1j3h s PHE 281 N 1.43 2.40 0.00 5.12 2.99 -1.01 -2.17 117.98 126.74 1j3h s PHE 281 Ca 0.59 0.20 0.00 0.00 0.00 0.00 0.00 56.93 57.71 1j3h s PHE 281 Cb -0.29 -4.07 0.00 0.00 0.00 0.00 0.00 43.02 38.66 1j3h s PHE 281 CO 0.27 -4.31 0.00 0.41 -0.00 0.00 0.00 175.22 171.59 1j3h n GLY 282 N 4.08 1.30 2.32 4.36 0.00 -1.24 -4.79 105.19 111.23 1j3h n GLY 282 Ca 0.16 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1j3h n GLY 282 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1j3h n ASN 283 N 0.03 6.48 -3.94 1.61 5.15 -0.92 -4.44 115.26 119.23 1j3h n ASN 283 Ca 0.00 -3.78 -0.26 0.00 -0.60 0.00 0.00 54.58 49.95 1j3h n ASN 283 Cb 0.00 -0.73 -0.07 0.00 -0.53 0.00 0.00 39.78 38.45 1j3h n ASN 283 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1j3h n LEU 284 N -0.76 0.00 -0.02 1.20 4.77 -1.26 -4.81 117.00 116.13 1j3h n LEU 284 Ca 0.53 -2.95 -0.09 0.00 -0.03 0.00 0.00 56.01 53.48 1j3h n LEU 284 Cb 0.70 0.79 -0.03 0.00 -2.33 0.00 0.00 43.42 42.56 1j3h n LEU 284 CO 0.58 -0.44 0.79 0.07 -1.33 0.00 0.00 177.39 177.06 1j3h h LYS 285 N 0.00 -0.10 -0.07 3.23 2.10 -1.96 0.10 116.57 119.86 1j3h h LYS 285 Ca -0.33 0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 1j3h h LYS 285 Cb 1.16 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 1j3h h LYS 285 CO 0.52 -0.07 0.00 -1.71 -2.00 0.00 0.00 179.45 176.19 1j3h n ASN 286 N -5.25 0.38 0.00 7.07 4.05 -1.26 -4.97 115.26 115.28 1j3h n ASN 286 Ca -0.03 -1.98 0.00 0.00 0.45 0.00 0.00 54.58 53.03 1j3h n ASN 286 Cb 0.17 -0.05 0.00 0.00 1.23 0.00 0.00 39.78 41.14 1j3h n ASN 286 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1j3h n GLY 287 N 0.62 2.64 0.25 8.20 0.00 0.02 -1.59 105.19 115.33 1j3h n GLY 287 Ca 0.03 0.11 0.07 0.00 0.00 0.00 0.00 46.02 46.23 1j3h n GLY 287 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1j3h h VAL 288 N 0.00 1.05 0.00 1.61 2.07 -1.88 -3.03 116.25 116.08 1j3h h VAL 288 Ca 0.00 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 1j3h h VAL 288 Cb 0.00 1.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1j3h h VAL 288 CO 0.00 0.07 -0.03 0.78 0.02 0.00 0.00 177.57 178.41 1j3h h ASN 289 N 0.06 0.00 0.03 0.57 2.35 -1.71 0.57 115.58 117.46 1j3h h ASN 289 Ca 0.01 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1j3h h ASN 289 Cb 0.10 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.47 1j3h h ASN 289 CO 0.01 0.03 -0.01 0.44 -1.65 0.00 0.00 177.43 176.24 1j3h h ASP 290 N 0.00 0.00 0.04 5.81 3.32 -1.60 -0.44 116.42 123.55 1j3h h ASP 290 Ca -0.00 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.78 1j3h h ASP 290 Cb 0.06 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 1j3h h ASP 290 CO 0.00 0.01 -1.49 -0.38 -1.72 0.00 0.00 179.24 175.67 1j3h n ILE 291 N -3.83 1.61 0.21 0.35 -0.00 0.11 -3.08 119.36 114.73 1j3h n ILE 291 Ca -0.03 -0.21 0.07 0.00 -0.00 0.00 0.00 62.75 62.58 1j3h n ILE 291 Cb 0.10 -1.96 0.47 0.00 -0.00 0.00 0.00 39.64 38.25 1j3h n ILE 291 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 176.55 176.66 1j3h h LYS 292 N -0.70 0.00 0.01 0.38 1.57 -1.13 -3.15 116.57 113.54 1j3h h LYS 292 Ca -0.38 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.11 1j3h h LYS 292 Cb 1.51 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.78 1j3h h LYS 292 CO -0.13 0.28 -1.65 -0.91 -0.57 0.00 0.00 179.45 176.47 1j3h h ASN 293 N 0.00 0.04 -0.96 0.86 2.35 -1.26 -3.44 115.58 113.17 1j3h h ASN 293 Ca -0.00 -0.08 -0.68 0.00 -0.55 0.00 0.00 56.30 54.99 1j3h h ASN 293 Cb 0.62 -0.01 0.08 0.00 0.05 0.00 0.00 38.32 39.06 1j3h h ASN 293 CO 0.04 1.07 -0.31 1.57 -1.65 0.00 0.00 177.43 178.15 1j3h n HIS 294 N -3.12 -0.08 -0.40 1.19 -0.00 -1.18 -4.57 115.22 107.07 1j3h n HIS 294 Ca -0.16 0.96 0.33 0.00 0.46 0.00 0.00 57.72 59.31 1j3h n HIS 294 Cb 1.04 -1.92 0.63 0.00 -0.12 0.00 0.00 29.99 29.62 1j3h n HIS 294 CO 0.00 0.00 0.00 1.57 0.46 0.00 0.00 176.34 178.37 1j3h h LYS 295 N 1.64 0.17 -0.86 1.57 -0.00 -1.92 -1.06 116.57 116.11 1j3h h LYS 295 Ca -0.35 -0.01 0.07 0.00 -0.00 0.00 0.00 60.65 60.36 1j3h h LYS 295 Cb 1.38 -0.04 -0.06 0.00 -0.00 0.00 0.00 32.23 33.51 1j3h h LYS 295 CO 0.57 0.11 0.56 2.35 -0.00 0.00 0.00 179.45 183.04 1j3h h TRP 296 N 0.17 0.95 -0.23 0.07 7.01 -1.87 -0.35 115.95 121.71 1j3h h TRP 296 Ca 0.70 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.72 1j3h h TRP 296 Cb 2.22 -0.31 0.00 0.00 -2.10 0.00 0.00 29.16 28.97 1j3h h TRP 296 CO -0.00 0.49 0.00 1.19 -2.79 0.00 0.00 178.44 177.32 1j3h n PHE 297 N -4.49 0.30 -0.13 2.65 3.01 -0.42 -4.39 117.46 113.98 1j3h n PHE 297 Ca 0.13 -0.15 0.26 0.00 1.01 0.00 0.00 57.45 58.70 1j3h n PHE 297 Cb 0.23 0.00 0.70 0.00 -0.01 0.00 0.00 39.48 40.40 1j3h n PHE 297 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1j3h h ALA 298 N 4.18 2.71 -0.00 4.37 0.00 -0.85 0.46 119.26 130.13 1j3h h ALA 298 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1j3h h ALA 298 Cb 0.63 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1j3h h ALA 298 CO 0.00 -0.94 -0.12 0.25 0.00 0.00 0.00 179.25 178.44 1j3h n THR 299 N -4.31 0.00 -3.63 0.00 -2.24 -1.26 -4.88 114.28 97.95 1j3h n THR 299 Ca 0.16 -0.06 -0.37 0.00 -2.27 0.00 0.00 64.05 61.51 1j3h n THR 299 Cb 0.85 -0.07 -0.07 0.00 -2.10 0.00 0.00 70.33 68.93 1j3h n THR 299 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1j3h s THR 300 N -2.49 5.31 -0.66 4.28 -4.23 0.15 -5.04 115.64 112.97 1j3h s THR 300 Ca 0.28 0.48 -0.17 0.00 -1.18 0.00 0.00 61.69 61.10 1j3h s THR 300 Cb 0.20 -3.58 0.13 0.00 1.34 0.00 0.00 72.50 70.60 1j3h s THR 300 CO 0.48 0.48 0.72 -0.62 -0.54 0.00 0.00 174.62 175.13 1j3h s ASP 301 N -0.13 6.34 0.30 3.99 2.15 -1.26 -4.95 116.67 123.11 1j3h s ASP 301 Ca 0.16 -1.81 0.05 0.00 0.43 0.00 0.00 52.55 51.38 1j3h s ASP 301 Cb -0.13 -2.27 0.68 0.00 -0.30 0.00 0.00 42.92 40.90 1j3h s ASP 301 CO 0.05 -0.96 1.80 -0.50 -0.17 0.00 0.00 175.17 175.40 1j3h h TRP 302 N 8.83 1.08 0.00 -5.34 4.06 -1.96 -0.52 115.95 122.10 1j3h h TRP 302 Ca -0.18 0.03 -0.15 0.00 2.06 0.00 0.00 58.89 60.66 1j3h h TRP 302 Cb 1.07 -0.33 -0.02 0.00 -1.00 0.00 0.00 29.16 28.88 1j3h h TRP 302 CO 0.88 0.32 -0.72 0.82 -3.56 0.00 0.00 178.44 176.18 1j3h h ILE 303 N 0.84 1.52 -0.28 1.49 5.03 -1.99 -1.87 117.51 122.25 1j3h h ILE 303 Ca 0.54 -2.48 -0.14 0.00 -0.12 0.00 0.00 64.86 62.67 1j3h h ILE 303 Cb 0.75 2.34 -0.00 0.00 -3.03 0.00 0.00 36.82 36.87 1j3h h ILE 303 CO -0.33 0.71 -0.36 0.00 -0.68 0.00 0.00 178.15 177.49 1j3h h ALA 304 N 1.28 0.42 0.23 1.87 0.00 -1.59 -0.14 119.26 121.33 1j3h h ALA 304 Ca -0.01 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 1j3h h ALA 304 Cb 1.28 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1j3h h ALA 304 CO 0.09 0.49 -0.13 0.82 0.00 0.00 0.00 179.25 180.53 1j3h h ILE 305 N 0.49 0.73 -0.83 0.00 1.08 -1.07 0.29 117.51 118.19 1j3h h ILE 305 Ca 0.04 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.61 1j3h h ILE 305 Cb 0.94 0.73 -0.08 0.00 -3.07 0.00 0.00 36.82 35.34 1j3h h ILE 305 CO 0.08 0.00 0.47 0.22 -0.69 0.00 0.00 178.15 178.23 1j3h h TYR 306 N -0.34 0.85 -0.00 1.37 3.20 -1.24 -0.37 116.97 120.44 1j3h h TYR 306 Ca -0.03 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1j3h h TYR 306 Cb 0.28 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.29 1j3h h TYR 306 CO -0.08 0.32 -0.02 1.04 -1.64 0.00 0.00 178.16 177.78 1j3h n GLN 307 N -4.76 0.18 -2.63 1.82 6.02 -0.07 -4.89 117.38 113.04 1j3h n GLN 307 Ca 0.14 -0.01 -0.11 0.00 -0.01 0.00 0.00 57.00 57.01 1j3h n GLN 307 Cb 0.31 -1.50 0.02 0.00 1.02 0.00 0.00 30.24 30.09 1j3h n GLN 307 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1j3h n ARG 308 N -1.40 -2.42 0.07 -1.09 1.74 0.26 -4.96 116.66 108.87 1j3h n ARG 308 Ca 0.10 0.45 -0.23 0.00 -0.77 0.00 0.00 57.85 57.40 1j3h n ARG 308 Cb 0.30 -4.36 -0.15 0.00 -1.02 0.00 0.00 32.46 27.23 1j3h n ARG 308 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1j3h h LYS 309 N -0.68 0.39 -6.90 5.56 1.79 -0.79 -3.47 116.57 112.46 1j3h h LYS 309 Ca -0.26 -0.67 -0.57 0.00 -2.18 0.00 0.00 60.65 56.97 1j3h h LYS 309 Cb 1.18 0.25 0.16 0.00 -1.58 0.00 0.00 32.23 32.24 1j3h h LYS 309 CO 0.28 1.32 0.28 0.28 -1.08 0.00 0.00 179.45 180.53 1j3h n VAL 310 N -3.71 3.87 -2.62 0.50 0.31 -1.24 -4.95 118.33 110.49 1j3h n VAL 310 Ca -0.23 -0.50 -0.41 0.00 -0.01 0.00 0.00 64.34 63.20 1j3h n VAL 310 Cb 1.03 -1.30 -0.04 0.00 -0.91 0.00 0.00 33.84 32.62 1j3h n VAL 310 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1j3h s GLU 311 N -2.84 4.68 0.37 5.55 1.03 -1.26 -5.02 118.70 121.21 1j3h s GLU 311 Ca 0.76 1.60 -0.26 0.00 0.03 0.00 0.00 54.97 57.09 1j3h s GLU 311 Cb -0.42 -3.30 -0.09 0.00 -0.80 0.00 0.00 34.13 29.52 1j3h s GLU 311 CO 0.47 0.21 1.20 0.00 -1.33 0.00 0.00 175.26 175.81 1j3h s ALA 312 N -0.41 3.26 0.52 -0.84 0.00 -1.26 -4.91 121.76 118.12 1j3h s ALA 312 Ca 0.47 1.05 0.34 0.00 0.00 0.00 0.00 51.96 53.82 1j3h s ALA 312 Cb -0.27 -3.41 1.88 0.00 0.00 0.00 0.00 23.12 21.32 1j3h s ALA 312 CO 0.33 -0.54 2.22 -1.00 0.00 0.00 0.00 175.76 176.77 1j3h h PRO 313 N 2.93 0.00 0.00 0.00 0.13 -1.93 -3.44 132.00 129.69 1j3h h PRO 313 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1j3h h PRO 313 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1j3h h PRO 313 CO 0.64 0.03 0.00 1.97 -0.23 0.00 0.00 178.00 180.41 1j3h n PHE 314 N -3.48 0.00 -4.20 1.56 1.16 -1.26 -5.15 117.46 106.09 1j3h n PHE 314 Ca -0.02 0.00 -0.30 0.00 -1.87 0.00 0.00 57.45 55.26 1j3h n PHE 314 Cb 0.14 0.00 -0.16 0.00 -1.61 0.00 0.00 39.48 37.85 1j3h n PHE 314 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 1j3h s ILE 315 N -2.00 1.64 0.43 1.97 1.09 -1.26 -4.35 121.20 118.73 1j3h s ILE 315 Ca 0.00 -0.70 -0.24 0.00 -1.10 0.00 0.00 60.65 58.61 1j3h s ILE 315 Cb 0.00 -1.52 -0.08 0.00 -1.06 0.00 0.00 42.46 39.81 1j3h s ILE 315 CO 0.00 0.47 1.20 -2.16 -0.10 0.00 0.00 174.94 174.35 1j3h s PRO 316 N 1.28 3.87 0.22 2.79 0.04 -1.26 -4.95 135.00 136.99 1j3h s PRO 316 Ca 0.01 1.89 -0.32 0.00 0.04 0.00 0.00 61.00 62.62 1j3h s PRO 316 Cb -0.14 -2.56 -0.14 0.00 0.04 0.00 0.00 34.50 31.71 1j3h s PRO 316 CO -0.08 -0.49 1.34 0.36 0.04 0.00 0.00 177.00 178.17 1j3h n LYS 317 N -0.20 1.81 0.00 4.56 0.00 -1.26 -4.91 118.16 118.15 1j3h n LYS 317 Ca 0.06 0.64 0.00 0.00 -0.00 0.00 0.00 58.31 59.01 1j3h n LYS 317 Cb 0.46 -2.26 0.00 0.00 -0.00 0.00 0.00 35.03 33.24 1j3h n LYS 317 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1j3h n PHE 318 N 1.76 0.00 -3.58 5.58 0.99 -1.26 -4.88 117.46 116.07 1j3h n PHE 318 Ca 0.12 0.00 -0.20 0.00 -0.00 0.00 0.00 57.45 57.38 1j3h n PHE 318 Cb 0.30 0.00 0.06 0.00 -1.00 0.00 0.00 39.48 38.83 1j3h n PHE 318 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.76 176.36 1j3h n ASP 329 N 0.00 -1.73 -4.51 4.37 3.85 -1.26 -5.15 116.55 112.12 1j3h n ASP 329 Ca 0.00 -0.74 -0.39 0.00 -0.71 0.00 0.00 54.79 52.95 1j3h n ASP 329 Cb 0.00 -4.50 -0.11 0.00 -1.35 0.00 0.00 41.12 35.16 1j3h n ASP 329 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 1j3h s TYR 330 N -3.54 3.20 0.00 2.11 1.51 -1.26 -5.09 117.35 114.28 1j3h s TYR 330 Ca 0.02 -0.24 0.00 0.00 -1.01 0.00 0.00 57.07 55.84 1j3h s TYR 330 Cb -0.00 -2.40 0.00 0.00 -0.11 0.00 0.00 41.96 39.44 1j3h s TYR 330 CO 0.78 -0.34 0.00 0.39 -1.11 0.00 0.00 175.55 175.27 1j3h n GLU 331 N 5.05 1.13 -3.90 -0.62 1.02 -1.26 -5.11 120.64 116.94 1j3h n GLU 331 Ca -0.14 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 56.91 1j3h n GLU 331 Cb 0.50 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.92 1j3h n GLU 331 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 1j3h s GLU 332 N 0.00 2.02 0.07 3.49 4.04 -1.26 -5.12 118.70 121.94 1j3h s GLU 332 Ca 0.00 -1.43 -0.26 0.00 0.04 0.00 0.00 54.97 53.32 1j3h s GLU 332 Cb 0.00 0.56 0.09 0.00 0.02 0.00 0.00 34.13 34.80 1j3h s GLU 332 CO 0.00 -0.91 0.74 -1.21 -1.84 0.00 0.00 175.26 172.04 1j3h s GLU 333 N -2.91 1.05 0.36 -4.83 2.02 -1.26 -5.06 118.70 108.07 1j3h s GLU 333 Ca 0.19 -0.33 0.06 0.00 0.02 0.00 0.00 54.97 54.91 1j3h s GLU 333 Cb -0.04 0.49 -0.01 0.00 0.10 0.00 0.00 34.13 34.67 1j3h s GLU 333 CO 0.13 -0.45 0.51 -1.21 0.02 0.00 0.00 175.26 174.26 1j3h s GLU 334 N -3.24 3.06 -0.41 1.61 8.01 -1.26 -5.09 118.70 121.38 1j3h s GLU 334 Ca 0.02 -0.98 0.04 0.00 0.01 0.00 0.00 54.97 54.06 1j3h s GLU 334 Cb -0.01 -2.78 0.17 0.00 -4.31 0.00 0.00 34.13 27.20 1j3h s GLU 334 CO -0.09 -0.03 0.35 0.96 0.01 0.00 0.00 175.26 176.45 1j3h s ILE 335 N -2.25 0.23 -0.84 -1.63 -0.00 -1.26 -5.09 121.20 110.36 1j3h s ILE 335 Ca 0.47 -2.46 -0.25 0.00 -0.00 0.00 0.00 60.65 58.41 1j3h s ILE 335 Cb -0.10 -1.17 -0.04 0.00 -0.00 0.00 0.00 42.46 41.16 1j3h s ILE 335 CO 0.32 -1.14 1.90 -0.13 -0.00 0.00 0.00 174.94 175.89 1j3h s ARG 336 N 0.21 2.61 -0.45 0.37 0.52 -1.26 -5.21 118.95 115.75 1j3h s ARG 336 Ca 0.31 -0.11 -0.13 0.00 -0.52 0.00 0.00 55.73 55.28 1j3h s ARG 336 Cb 0.01 -4.91 0.08 0.00 0.52 0.00 0.00 34.95 30.65 1j3h s ARG 336 CO -0.17 -3.18 0.35 0.14 0.02 0.00 0.00 175.30 172.46 1j3h s VAL 337 N 9.63 4.86 -0.26 3.52 -7.23 -1.26 -4.78 120.40 124.88 1j3h s VAL 337 Ca 0.68 -1.20 -0.12 0.00 -1.81 0.00 0.00 61.98 59.53 1j3h s VAL 337 Cb -0.08 -3.93 -0.14 0.00 0.56 0.00 0.00 36.38 32.78 1j3h s VAL 337 CO 0.04 -0.56 -0.22 -0.38 -0.31 0.00 0.00 175.10 173.67 1j3h n ILE 339 N 5.10 1.53 -4.79 -0.62 5.41 -1.26 -4.92 119.36 119.80 1j3h n ILE 339 Ca -0.12 -0.37 -0.32 0.00 1.00 0.00 0.00 62.75 62.94 1j3h n ILE 339 Cb 0.43 -1.83 -0.13 0.00 -0.71 0.00 0.00 39.64 37.41 1j3h n ILE 339 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1j3h s ASN 340 N -7.23 3.99 -0.22 4.38 6.03 -1.26 -5.04 114.94 115.59 1j3h s ASN 340 Ca -0.36 -0.27 -0.29 0.00 -1.03 0.00 0.00 52.86 50.91 1j3h s ASN 340 Cb 0.12 -0.78 -0.06 0.00 -3.03 0.00 0.00 41.25 37.50 1j3h s ASN 340 CO 0.53 0.31 2.20 -1.84 -2.03 0.00 0.00 177.10 176.28 1j3h n GLU 341 N 2.01 1.92 -3.16 3.55 0.28 -1.26 -4.81 120.64 119.17 1j3h n GLU 341 Ca -0.17 0.54 -0.39 0.00 -0.16 0.00 0.00 57.16 56.99 1j3h n GLU 341 Cb 0.52 -3.14 -0.06 0.00 1.43 0.00 0.00 31.44 30.20 1j3h n GLU 341 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1j3h s LYS 342 N 6.21 4.34 -1.76 3.44 -0.14 0.31 -4.22 119.74 127.93 1j3h s LYS 342 Ca 1.01 0.87 -0.17 0.00 -1.36 0.00 0.00 55.97 56.32 1j3h s LYS 342 Cb -0.40 -3.28 0.16 0.00 -1.68 0.00 0.00 37.83 32.63 1j3h s LYS 342 CO 0.37 0.53 0.51 0.00 -0.76 0.00 0.00 175.35 176.01 1j3h h GLY 344 N -1.24 0.72 1.49 0.00 0.00 -1.90 -3.12 103.07 99.03 1j3h h GLY 344 Ca -0.61 -0.66 -0.00 0.00 0.00 0.00 0.00 47.33 46.06 1j3h h GLY 344 CO 0.82 0.60 0.29 1.70 0.00 0.00 0.00 176.54 179.95 1j3h h LYS 345 N 0.57 0.67 -0.43 4.80 3.11 -1.93 -3.10 116.57 120.26 1j3h h LYS 345 Ca 0.07 -0.06 -0.08 0.00 -2.81 0.00 0.00 60.65 57.77 1j3h h LYS 345 Cb 0.80 -0.14 -0.02 0.00 -1.00 0.00 0.00 32.23 31.86 1j3h h LYS 345 CO 0.07 0.48 -0.07 0.93 -2.81 0.00 0.00 179.45 178.04 1j3h h GLU 346 N 0.69 0.73 -1.82 1.90 3.07 -1.94 -3.28 114.58 113.93 1j3h h GLU 346 Ca 0.18 -0.22 -0.69 0.00 -0.50 0.00 0.00 59.36 58.13 1j3h h GLU 346 Cb -0.02 -0.07 -0.34 0.00 -0.84 0.00 0.00 28.75 27.48 1j3h h GLU 346 CO -0.03 0.80 0.26 1.19 -1.40 0.00 0.00 179.01 179.82 1j3h n PHE 347 N -4.19 3.19 0.04 4.33 3.01 -1.17 -4.72 117.46 117.96 1j3h n PHE 347 Ca 0.02 -2.73 -0.09 0.00 1.01 0.00 0.00 57.45 55.66 1j3h n PHE 347 Cb 0.33 -0.70 0.06 0.00 -0.01 0.00 0.00 39.48 39.16 1j3h n PHE 347 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1j3h h THR 348 N 2.29 1.36 -0.03 4.37 2.02 -1.66 -3.22 112.91 118.04 1j3h h THR 348 Ca 0.44 -1.96 -0.14 0.00 0.77 0.00 0.00 66.41 65.52 1j3h h THR 348 Cb 0.43 1.95 -0.02 0.00 -1.74 0.00 0.00 68.15 68.77 1j3h h THR 348 CO 1.16 0.59 -0.64 -0.33 0.37 0.00 0.00 175.52 176.67 1j3h h GLU 349 N 0.31 0.11 0.00 6.66 5.08 -1.90 -3.53 114.58 121.31 1j3h h GLU 349 Ca -0.01 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1j3h h GLU 349 Cb 1.17 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1j3h h GLU 349 CO 0.11 0.71 0.00 0.34 -1.00 0.00 0.00 179.01 179.17