#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j4r s ILE 8 N 0.00 3.02 0.02 4.25 1.01 -1.26 -4.95 121.20 123.29 2j4r s ILE 8 Ca 0.00 0.87 0.00 0.00 0.00 0.00 0.00 60.65 61.52 2j4r s ILE 8 Cb 0.00 -3.55 -0.02 0.00 0.01 0.00 0.00 42.46 38.90 2j4r s ILE 8 CO 0.00 0.14 -0.04 -0.32 0.00 0.00 0.00 174.94 174.73 2j4r s MET 9 N -0.42 0.33 -0.09 2.79 1.75 -1.20 -5.00 119.30 117.46 2j4r s MET 9 Ca 0.56 -0.59 0.01 0.00 -1.25 0.00 0.00 55.69 54.42 2j4r s MET 9 Cb -0.38 0.03 -0.02 0.00 2.84 0.00 0.00 34.83 37.29 2j4r s MET 9 CO 0.41 -0.03 -0.12 1.03 -0.65 0.00 0.00 175.02 175.66 2j4r s ARG 10 N -1.37 2.95 -0.07 4.11 0.52 -1.26 -0.39 118.95 123.44 2j4r s ARG 10 Ca -0.14 -0.66 0.04 0.00 -0.52 0.00 0.00 55.73 54.45 2j4r s ARG 10 Cb -0.09 -2.54 -0.00 0.00 0.52 0.00 0.00 34.95 32.84 2j4r s ARG 10 CO -0.01 0.44 -0.20 0.14 0.02 0.00 0.00 175.30 175.69 2j4r s VAL 11 N -0.25 1.73 0.06 3.52 -7.23 -0.07 -2.81 120.40 115.35 2j4r s VAL 11 Ca 0.02 -0.85 0.01 0.00 -1.81 0.00 0.00 61.98 59.35 2j4r s VAL 11 Cb -0.13 -1.49 -0.04 0.00 0.56 0.00 0.00 36.38 35.28 2j4r s VAL 11 CO 0.03 0.49 0.13 0.00 -0.31 0.00 0.00 175.10 175.43 2j4r s ALA 12 N 0.23 3.74 -0.01 1.32 0.00 -0.44 -1.24 121.76 125.36 2j4r s ALA 12 Ca -0.11 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 50.92 2j4r s ALA 12 Cb -0.15 -1.61 0.01 0.00 0.00 0.00 0.00 23.12 21.38 2j4r s ALA 12 CO 0.05 0.77 0.01 0.45 0.00 0.00 0.00 175.76 177.04 2j4r s SER 13 N -2.34 0.10 -0.05 0.00 0.15 0.17 -1.68 113.70 110.05 2j4r s SER 13 Ca 0.30 0.01 -0.04 0.00 0.70 0.00 0.00 55.95 56.92 2j4r s SER 13 Cb -0.12 -0.05 0.02 0.00 -1.71 0.00 0.00 66.02 64.15 2j4r s SER 13 CO 0.23 -0.06 0.13 -0.51 1.20 0.00 0.00 173.24 174.23 2j4r s ILE 14 N 0.53 -0.01 -0.03 6.45 1.10 -0.73 0.23 121.20 128.74 2j4r s ILE 14 Ca -0.04 0.04 0.01 0.00 -0.51 0.00 0.00 60.65 60.15 2j4r s ILE 14 Cb -0.07 -0.20 0.01 0.00 0.15 0.00 0.00 42.46 42.36 2j4r s ILE 14 CO -0.01 0.02 -0.05 1.51 -2.11 0.00 0.00 174.94 174.30 2j4r s ASP 15 N 0.33 0.81 -0.53 4.50 -4.77 -1.00 -0.82 116.67 115.18 2j4r s ASP 15 Ca -0.02 -0.11 -0.21 0.00 -3.30 0.00 0.00 52.55 48.91 2j4r s ASP 15 Cb -0.03 -0.31 0.06 0.00 -1.09 0.00 0.00 42.92 41.54 2j4r s ASP 15 CO -0.01 -0.02 0.74 -0.63 0.70 0.00 0.00 175.17 175.95 2j4r s ILE 16 N 0.59 4.70 0.62 2.11 1.09 0.10 -2.78 121.20 127.64 2j4r s ILE 16 Ca -0.07 -0.28 0.05 0.00 -1.10 0.00 0.00 60.65 59.24 2j4r s ILE 16 Cb -0.11 -4.40 0.09 0.00 -1.06 0.00 0.00 42.46 36.99 2j4r s ILE 16 CO -0.00 -0.94 0.86 -0.83 -0.10 0.00 0.00 174.94 173.92 2j4r s GLY 17 N 2.82 1.77 0.36 6.18 0.00 -0.11 -2.87 107.32 115.47 2j4r s GLY 17 Ca 0.20 -1.87 0.27 0.00 0.00 0.00 0.00 44.72 43.31 2j4r s GLY 17 CO 0.14 -1.40 1.77 1.48 0.00 0.00 0.00 173.10 175.08 2j4r h SER 18 N -0.08 0.00 0.00 1.64 4.64 -1.82 -3.38 113.55 114.55 2j4r h SER 18 Ca -0.34 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.92 2j4r h SER 18 Cb 1.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.36 2j4r h SER 18 CO 0.42 0.00 -0.79 -3.20 -0.87 0.00 0.00 176.83 172.39 2j4r n ASN 19 N -2.66 1.25 -4.52 4.97 4.05 -1.26 -2.28 115.26 114.81 2j4r n ASN 19 Ca 0.03 0.19 -0.27 0.00 0.45 0.00 0.00 54.58 54.99 2j4r n ASN 19 Cb 0.38 -0.45 -0.10 0.00 1.23 0.00 0.00 39.78 40.84 2j4r n ASN 19 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 2j4r s SER 20 N -5.98 3.29 -0.22 1.20 1.04 -1.26 -1.60 113.70 110.17 2j4r s SER 20 Ca -0.13 -1.48 -0.00 0.00 0.48 0.00 0.00 55.95 54.82 2j4r s SER 20 Cb 0.03 0.03 0.06 0.00 0.10 0.00 0.00 66.02 66.24 2j4r s SER 20 CO 0.18 -0.66 -0.03 -0.69 0.98 0.00 0.00 173.24 173.02 2j4r s VAL 21 N -3.01 1.21 0.16 5.02 1.01 -0.53 -0.94 120.40 123.31 2j4r s VAL 21 Ca 0.28 -0.98 0.05 0.00 0.00 0.00 0.00 61.98 61.32 2j4r s VAL 21 Cb 0.07 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 2j4r s VAL 21 CO 0.14 -0.11 0.13 -0.13 0.00 0.00 0.00 175.10 175.12 2j4r s ARG 22 N 1.55 2.89 -0.04 2.72 0.52 -1.12 -2.34 118.95 123.13 2j4r s ARG 22 Ca -0.04 -0.86 0.03 0.00 -0.52 0.00 0.00 55.73 54.34 2j4r s ARG 22 Cb -0.18 -2.64 0.00 0.00 0.52 0.00 0.00 34.95 32.65 2j4r s ARG 22 CO -0.07 0.49 -0.13 -1.17 0.02 0.00 0.00 175.30 174.44 2j4r s LEU 23 N -3.04 1.83 -0.05 2.53 2.96 0.11 -2.38 118.68 120.64 2j4r s LEU 23 Ca 0.31 -0.28 -0.00 0.00 -0.22 0.00 0.00 54.13 53.94 2j4r s LEU 23 Cb -0.10 -0.78 0.03 0.00 0.50 0.00 0.00 46.19 45.83 2j4r s LEU 23 CO 0.23 0.10 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.47 2j4r s THR 24 N 0.17 0.33 -0.16 3.68 2.01 0.14 -1.79 115.64 120.02 2j4r s THR 24 Ca -0.05 0.06 0.02 0.00 0.31 0.00 0.00 61.69 62.03 2j4r s THR 24 Cb -0.11 -0.44 0.01 0.00 0.01 0.00 0.00 72.50 71.98 2j4r s THR 24 CO 0.02 0.21 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.32 2j4r s ILE 25 N 1.39 2.14 0.31 1.82 1.01 -1.06 0.44 121.20 127.25 2j4r s ILE 25 Ca -0.04 -0.94 0.11 0.00 0.00 0.00 0.00 60.65 59.78 2j4r s ILE 25 Cb -0.13 -1.88 -0.06 0.00 0.01 0.00 0.00 42.46 40.41 2j4r s ILE 25 CO -0.02 0.54 -0.16 0.00 0.00 0.00 0.00 174.94 175.30 2j4r s ALA 26 N 0.97 2.83 -0.10 9.38 0.00 -0.37 -1.44 121.76 133.03 2j4r s ALA 26 Ca -0.03 -1.96 0.03 0.00 0.00 0.00 0.00 51.96 50.00 2j4r s ALA 26 Cb -0.15 -0.17 0.01 0.00 0.00 0.00 0.00 23.12 22.81 2j4r s ALA 26 CO -0.05 0.20 -0.20 -1.14 0.00 0.00 0.00 175.76 174.57 2j4r s GLN 27 N -3.55 2.66 -0.44 0.00 0.74 0.42 -0.89 119.66 118.60 2j4r s GLN 27 Ca 0.31 -0.74 -0.12 0.00 0.05 0.00 0.00 55.36 54.87 2j4r s GLN 27 Cb -0.02 -2.09 0.08 0.00 1.10 0.00 0.00 33.01 32.07 2j4r s GLN 27 CO 0.16 0.07 0.32 -1.50 -0.55 0.00 0.00 175.29 173.79 2j4r s ILE 28 N 0.61 4.65 -0.24 -2.34 1.10 0.48 -1.18 121.20 124.27 2j4r s ILE 28 Ca -0.14 -1.28 0.02 0.00 -0.51 0.00 0.00 60.65 58.74 2j4r s ILE 28 Cb -0.17 -3.82 0.04 0.00 0.15 0.00 0.00 42.46 38.67 2j4r s ILE 28 CO 0.04 -0.55 -0.12 -0.75 -2.11 0.00 0.00 174.94 171.45 2j4r s LYS 29 N 1.51 2.53 -0.17 3.50 2.20 0.44 -3.23 119.74 126.52 2j4r s LYS 29 Ca 0.03 -1.16 -0.15 0.00 -0.36 0.00 0.00 55.97 54.34 2j4r s LYS 29 Cb -0.24 -2.82 0.02 0.00 -1.51 0.00 0.00 37.83 33.28 2j4r s LYS 29 CO 0.04 -0.45 0.26 -0.40 -0.36 0.00 0.00 175.35 174.43 2j4r n ASP 30 N 4.52 -4.75 0.00 1.43 5.75 -1.26 -0.94 116.55 121.31 2j4r n ASP 30 Ca -0.16 0.10 0.00 0.00 -0.01 0.00 0.00 54.79 54.72 2j4r n ASP 30 Cb 0.45 -1.24 0.00 0.00 -1.03 0.00 0.00 41.12 39.30 2j4r n ASP 30 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2j4r n GLY 31 N 0.51 0.00 3.42 6.12 0.00 -1.26 -4.90 105.19 109.08 2j4r n GLY 31 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 2j4r n GLY 31 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2j4r s LYS 32 N -0.86 3.55 -0.21 1.61 2.47 -0.11 -5.08 119.74 121.10 2j4r s LYS 32 Ca 0.00 -0.56 -0.05 0.00 -1.56 0.00 0.00 55.97 53.80 2j4r s LYS 32 Cb 0.00 -2.97 -0.02 0.00 -1.46 0.00 0.00 37.83 33.39 2j4r s LYS 32 CO 0.00 0.05 -0.01 -1.17 0.16 0.00 0.00 175.35 174.38 2j4r s LEU 33 N 0.86 3.14 -0.05 5.43 2.96 -1.26 -0.42 118.68 129.34 2j4r s LEU 33 Ca -0.01 -0.27 0.02 0.00 -0.22 0.00 0.00 54.13 53.65 2j4r s LEU 33 Cb -0.15 -1.80 0.02 0.00 0.50 0.00 0.00 46.19 44.76 2j4r s LEU 33 CO 0.02 0.02 -0.08 -0.94 -1.32 0.00 0.00 176.35 174.05 2j4r s SER 34 N 1.23 1.26 -0.08 3.68 1.04 -0.33 -4.95 113.70 115.56 2j4r s SER 34 Ca 0.03 -0.20 -0.30 0.00 0.48 0.00 0.00 55.95 55.97 2j4r s SER 34 Cb -0.15 -0.56 -0.03 0.00 0.10 0.00 0.00 66.02 65.39 2j4r s SER 34 CO 0.01 -0.00 1.26 -0.63 0.98 0.00 0.00 173.24 174.85 2j4r s ILE 35 N 0.69 4.17 -0.18 -1.02 -1.09 -1.26 -0.43 121.20 122.07 2j4r s ILE 35 Ca -0.11 1.48 0.14 0.00 -2.23 0.00 0.00 60.65 59.92 2j4r s ILE 35 Cb -0.14 -3.95 -0.20 0.00 -1.58 0.00 0.00 42.46 36.59 2j4r s ILE 35 CO 0.02 -0.05 0.38 2.30 -1.23 0.00 0.00 174.94 176.35 2j4r n ILE 36 N 4.89 0.00 -3.83 2.92 -5.35 -0.52 -4.96 119.36 112.51 2j4r n ILE 36 Ca 0.12 -0.28 -0.12 0.00 -0.27 0.00 0.00 62.75 62.20 2j4r n ILE 36 Cb 0.45 0.40 -0.10 0.00 -1.74 0.00 0.00 39.64 38.65 2j4r n ILE 36 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 2j4r s LEU 37 N -3.60 1.34 -0.25 7.28 2.96 -1.14 -5.03 118.68 120.23 2j4r s LEU 37 Ca -0.02 0.01 -0.12 0.00 -0.22 0.00 0.00 54.13 53.78 2j4r s LEU 37 Cb 0.09 0.79 0.09 0.00 0.50 0.00 0.00 46.19 47.66 2j4r s LEU 37 CO 0.57 -0.30 0.59 -0.70 -1.32 0.00 0.00 176.35 175.18 2j4r s GLU 38 N -0.98 0.56 -0.01 1.98 2.12 -1.26 -2.56 118.70 118.55 2j4r s GLU 38 Ca -0.11 1.17 -0.17 0.00 0.36 0.00 0.00 54.97 56.23 2j4r s GLU 38 Cb -0.06 0.31 0.03 0.00 0.26 0.00 0.00 34.13 34.68 2j4r s GLU 38 CO 0.02 -0.18 0.36 1.03 -0.54 0.00 0.00 175.26 175.95 2j4r s ARG 39 N 2.03 0.74 -0.03 4.30 0.52 -0.74 -5.01 118.95 120.77 2j4r s ARG 39 Ca -0.08 -0.18 -0.14 0.00 -0.52 0.00 0.00 55.73 54.81 2j4r s ARG 39 Cb -0.08 0.33 0.02 0.00 0.52 0.00 0.00 34.95 35.74 2j4r s ARG 39 CO -0.17 -0.22 0.31 0.20 0.02 0.00 0.00 175.30 175.44 2j4r s GLY 40 N -1.42 -0.16 -0.02 -3.53 0.00 -1.26 0.05 107.32 100.98 2j4r s GLY 40 Ca -0.12 0.40 -0.02 0.00 0.00 0.00 0.00 44.72 44.98 2j4r s GLY 40 CO 0.04 0.21 0.06 0.50 0.00 0.00 0.00 173.10 173.91 2j4r s ARG 41 N -1.10 0.08 -0.50 2.90 1.81 -0.99 -4.96 118.95 116.19 2j4r s ARG 41 Ca -0.12 0.06 -0.22 0.00 -1.72 0.00 0.00 55.73 53.74 2j4r s ARG 41 Cb -0.05 0.04 0.04 0.00 -0.45 0.00 0.00 34.95 34.53 2j4r s ARG 41 CO 0.04 -0.01 0.77 0.42 -0.68 0.00 0.00 175.30 175.84 2j4r s ILE 42 N -0.01 4.65 -0.48 1.52 1.01 -1.26 -1.46 121.20 125.16 2j4r s ILE 42 Ca -0.00 0.09 0.14 0.00 0.00 0.00 0.00 60.65 60.88 2j4r s ILE 42 Cb -0.01 -4.37 -0.17 0.00 0.01 0.00 0.00 42.46 37.92 2j4r s ILE 42 CO 0.00 -0.85 0.52 0.35 0.00 0.00 0.00 174.94 174.95 2j4r n THR 43 N 5.98 0.00 -3.73 2.92 -2.24 -1.01 -5.00 114.28 111.21 2j4r n THR 43 Ca -0.01 -0.22 -0.33 0.00 -2.27 0.00 0.00 64.05 61.23 2j4r n THR 43 Cb 0.47 0.76 0.04 0.00 -2.10 0.00 0.00 70.33 69.50 2j4r n THR 43 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2j4r n SER 44 N -1.53 -5.23 -4.53 3.42 7.64 -0.63 -4.70 113.62 108.07 2j4r n SER 44 Ca 0.01 -1.03 -0.42 0.00 1.01 0.00 0.00 58.87 58.44 2j4r n SER 44 Cb 0.27 -3.11 -0.03 0.00 -1.01 0.00 0.00 64.21 60.32 2j4r n SER 44 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2j4r s LEU 45 N -6.48 3.76 0.00 -3.43 1.02 -0.97 -4.73 118.68 107.86 2j4r s LEU 45 Ca 0.45 -0.39 0.00 0.00 0.02 0.00 0.00 54.13 54.21 2j4r s LEU 45 Cb -0.17 -2.76 0.00 0.00 0.02 0.00 0.00 46.19 43.27 2j4r s LEU 45 CO 0.88 -1.48 0.00 0.61 0.02 0.00 0.00 176.35 176.37 2j4r n GLY 46 N 5.21 0.00 1.95 -3.19 0.00 -1.26 -4.55 105.19 103.35 2j4r n GLY 46 Ca 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.04 2j4r n GLY 46 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2j4r n THR 47 N -0.26 0.53 -0.02 2.61 5.66 -1.26 -3.84 114.28 117.70 2j4r n THR 47 Ca 0.00 -0.16 -0.20 0.00 -3.05 0.00 0.00 64.05 60.64 2j4r n THR 47 Cb 0.00 -1.20 -0.13 0.00 -1.55 0.00 0.00 70.33 67.45 2j4r n THR 47 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 2j4r h LYS 48 N 3.55 0.16 -1.00 1.09 6.56 -1.83 -3.29 116.57 121.81 2j4r h LYS 48 Ca 0.01 -0.27 0.15 0.00 -1.06 0.00 0.00 60.65 59.48 2j4r h LYS 48 Cb 0.26 0.10 -0.09 0.00 -0.57 0.00 0.00 32.23 31.93 2j4r h LYS 48 CO 0.06 1.13 0.62 -0.24 -2.06 0.00 0.00 179.45 178.97 2j4r h VAL 49 N -0.57 0.82 0.00 0.50 3.04 -1.88 -3.22 116.25 114.95 2j4r h VAL 49 Ca -0.24 -0.30 0.00 0.00 -1.01 0.00 0.00 66.70 65.15 2j4r h VAL 49 Cb 1.52 -0.13 0.00 0.00 -2.01 0.00 0.00 31.29 30.67 2j4r h VAL 49 CO 0.01 0.16 0.00 0.29 -1.01 0.00 0.00 177.57 177.02 2j4r n LYS 50 N -4.67 2.60 -1.54 4.17 4.76 -1.24 -4.46 118.16 117.78 2j4r n LYS 50 Ca 0.21 0.00 -0.39 0.00 -2.87 0.00 0.00 58.31 55.26 2j4r n LYS 50 Cb 0.46 0.00 -0.05 0.00 -1.84 0.00 0.00 35.03 33.60 2j4r n LYS 50 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 2j4r n GLU 51 N 0.00 1.06 0.00 1.97 4.07 -1.25 -4.69 120.64 121.80 2j4r n GLU 51 Ca 0.00 0.10 0.00 0.00 -0.06 0.00 0.00 57.16 57.20 2j4r n GLU 51 Cb 0.00 -3.10 0.00 0.00 -0.06 0.00 0.00 31.44 28.28 2j4r n GLU 51 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 2j4r n THR 52 N 7.84 0.00 0.00 6.31 -2.24 -1.22 -4.01 114.28 120.97 2j4r n THR 52 Ca 0.40 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.18 2j4r n THR 52 Cb 0.44 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 2j4r n THR 52 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j4r n GLY 53 N -0.70 0.00 0.00 3.38 0.00 -1.26 -4.58 105.19 102.03 2j4r n GLY 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2j4r n GLY 53 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2j4r n ARG 54 N 0.00 0.00 -1.62 1.61 1.85 -1.26 -3.22 116.66 114.02 2j4r n ARG 54 Ca 0.00 0.00 -0.50 0.00 -1.00 0.00 0.00 57.85 56.35 2j4r n ARG 54 Cb 0.00 0.00 -0.05 0.00 -1.05 0.00 0.00 32.46 31.36 2j4r n ARG 54 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2j4r n LEU 55 N 0.00 2.19 -4.75 2.89 7.99 -1.26 -4.58 117.00 119.48 2j4r n LEU 55 Ca 0.00 1.10 -0.40 0.00 -0.01 0.00 0.00 56.01 56.70 2j4r n LEU 55 Cb 0.00 -1.27 -0.05 0.00 -0.11 0.00 0.00 43.42 41.98 2j4r n LEU 55 CO 0.00 -0.76 0.51 -1.10 -1.51 0.00 0.00 177.39 174.53 2j4r s GLN 56 N 0.73 4.55 0.21 3.23 1.11 -1.26 -4.90 119.66 123.33 2j4r s GLN 56 Ca 0.83 1.15 -0.09 0.00 0.01 0.00 0.00 55.36 57.26 2j4r s GLN 56 Cb -0.86 -3.34 0.31 0.00 -1.01 0.00 0.00 33.01 28.11 2j4r s GLN 56 CO 0.44 0.33 1.71 1.49 0.01 0.00 0.00 175.29 179.28 2j4r h GLU 57 N 5.36 0.29 -0.74 2.91 4.57 -1.98 1.00 114.58 125.98 2j4r h GLU 57 Ca -0.44 -0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 57.68 2j4r h GLU 57 Cb 1.21 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.70 2j4r h GLU 57 CO 0.70 0.19 0.31 0.38 -1.18 0.00 0.00 179.01 179.41 2j4r h ASP 58 N 0.30 1.00 -0.29 1.04 2.03 -1.99 0.81 116.42 119.30 2j4r h ASP 58 Ca 0.32 -0.14 -0.18 0.00 -0.73 0.00 0.00 57.03 56.30 2j4r h ASP 58 Cb 0.47 -0.26 0.00 0.00 -0.83 0.00 0.00 39.33 38.71 2j4r h ASP 58 CO -0.39 0.87 -0.52 0.03 -1.03 0.00 0.00 179.24 178.20 2j4r h ARG 59 N 1.07 0.87 0.34 4.15 2.47 -1.47 -2.46 114.38 119.35 2j4r h ARG 59 Ca 0.25 -0.55 -0.01 0.00 -1.26 0.00 0.00 59.98 58.41 2j4r h ARG 59 Cb 0.17 0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.56 2j4r h ARG 59 CO -0.02 1.18 -0.18 0.82 0.56 0.00 0.00 179.97 182.33 2j4r h ILE 60 N 0.66 0.63 0.02 2.04 2.04 0.15 -2.14 117.51 120.91 2j4r h ILE 60 Ca 0.02 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.90 2j4r h ILE 60 Cb 1.13 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 37.81 2j4r h ILE 60 CO 0.12 0.00 -0.21 -0.08 0.00 0.00 0.00 178.15 177.98 2j4r h GLU 61 N -0.48 -0.33 -0.78 2.37 4.57 -0.88 -0.27 114.58 118.78 2j4r h GLU 61 Ca -0.04 0.02 0.15 0.00 -1.18 0.00 0.00 59.36 58.31 2j4r h GLU 61 Cb 0.38 0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 28.99 2j4r h GLU 61 CO 0.06 -0.22 0.52 1.49 -1.18 0.00 0.00 179.01 179.68 2j4r h GLU 62 N -0.34 0.42 -0.23 1.92 4.81 -1.41 -1.82 114.58 117.93 2j4r h GLU 62 Ca 0.05 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.16 2j4r h GLU 62 Cb 0.41 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 2j4r h GLU 62 CO -0.18 0.28 -0.23 1.15 -0.73 0.00 0.00 179.01 179.31 2j4r h THR 63 N 0.44 1.32 -0.69 0.32 2.02 -0.40 -2.49 112.91 113.42 2j4r h THR 63 Ca 0.39 -1.39 -0.05 0.00 0.77 0.00 0.00 66.41 66.13 2j4r h THR 63 Cb 0.87 1.70 -0.03 0.00 -1.74 0.00 0.00 68.15 68.96 2j4r h THR 63 CO -0.13 0.43 0.25 0.16 0.37 0.00 0.00 175.52 176.60 2j4r h ILE 64 N 0.25 1.24 0.10 3.11 -0.00 -0.40 0.38 117.51 122.20 2j4r h ILE 64 Ca 0.04 -0.80 0.00 0.00 -0.00 0.00 0.00 64.86 64.10 2j4r h ILE 64 Cb 0.78 0.44 -0.01 0.00 -0.00 0.00 0.00 36.82 38.03 2j4r h ILE 64 CO 0.06 0.32 -0.11 1.56 -0.00 0.00 0.00 178.15 179.97 2j4r h GLN 65 N 1.01 -0.23 -0.63 0.16 1.08 -1.41 0.90 115.11 115.99 2j4r h GLN 65 Ca 0.23 0.02 0.09 0.00 -1.45 0.00 0.00 58.65 57.53 2j4r h GLN 65 Cb 0.23 0.05 -0.07 0.00 -0.05 0.00 0.00 27.48 27.65 2j4r h GLN 65 CO -0.02 -0.15 0.28 0.28 -0.95 0.00 0.00 178.83 178.27 2j4r h VAL 66 N -0.24 0.83 -0.90 -0.54 2.07 -1.12 0.18 116.25 116.53 2j4r h VAL 66 Ca 0.01 -0.17 0.01 0.00 0.82 0.00 0.00 66.70 67.37 2j4r h VAL 66 Cb 0.23 0.29 -0.05 0.00 -1.52 0.00 0.00 31.29 30.24 2j4r h VAL 66 CO -0.04 0.09 0.60 -0.07 0.02 0.00 0.00 177.57 178.18 2j4r h LEU 67 N 0.50 1.04 0.05 2.57 4.07 0.19 -1.31 115.31 122.42 2j4r h LEU 67 Ca 0.31 -0.03 0.02 0.00 0.08 0.00 0.00 57.88 58.27 2j4r h LEU 67 Cb 0.33 -0.26 -0.04 0.00 1.08 0.00 0.00 40.66 41.78 2j4r h LEU 67 CO -0.27 0.75 -0.24 0.11 -1.08 0.00 0.00 178.44 177.72 2j4r h LYS 68 N 1.22 -0.38 -0.14 1.13 1.79 0.28 -1.24 116.57 119.23 2j4r h LYS 68 Ca 0.33 0.03 0.03 0.00 -2.18 0.00 0.00 60.65 58.86 2j4r h LYS 68 Cb -0.14 0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 30.57 2j4r h LYS 68 CO -0.07 -0.26 -0.08 1.49 -1.08 0.00 0.00 179.45 179.46 2j4r h GLU 69 N -0.40 -0.06 -0.80 3.15 4.57 -0.68 -1.64 114.58 118.72 2j4r h GLU 69 Ca 0.05 0.00 0.11 0.00 -1.18 0.00 0.00 59.36 58.34 2j4r h GLU 69 Cb 0.45 0.01 -0.08 0.00 -0.16 0.00 0.00 28.75 28.98 2j4r h GLU 69 CO -0.18 -0.04 0.42 1.88 -1.18 0.00 0.00 179.01 179.91 2j4r h TYR 70 N -0.07 0.76 -0.08 0.92 0.05 -0.95 -0.09 116.97 117.51 2j4r h TYR 70 Ca 0.08 0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.93 2j4r h TYR 70 Cb 0.19 -0.22 -0.05 0.00 1.01 0.00 0.00 36.73 37.66 2j4r h TYR 70 CO -0.21 0.26 -0.20 -0.22 -1.05 0.00 0.00 178.16 176.74 2j4r h LYS 71 N 0.68 -0.27 -0.40 4.88 1.63 -0.60 0.18 116.57 122.67 2j4r h LYS 71 Ca 0.41 0.02 0.08 0.00 -0.85 0.00 0.00 60.65 60.30 2j4r h LYS 71 Cb 0.46 0.06 -0.07 0.00 -0.60 0.00 0.00 32.23 32.08 2j4r h LYS 71 CO -0.29 -0.18 -0.03 -0.22 -3.45 0.00 0.00 179.45 175.28 2j4r h LYS 72 N -0.28 0.07 -0.51 1.90 3.64 -0.25 -1.35 116.57 119.79 2j4r h LYS 72 Ca 0.08 -0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.48 2j4r h LYS 72 Cb 0.40 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.17 2j4r h LYS 72 CO -0.24 0.04 0.31 -0.07 -2.27 0.00 0.00 179.45 177.22 2j4r h LEU 73 N 0.07 0.51 -0.44 5.20 -0.00 -0.34 -0.03 115.31 120.28 2j4r h LEU 73 Ca 0.20 0.00 0.08 0.00 -0.00 0.00 0.00 57.88 58.15 2j4r h LEU 73 Cb 0.29 -0.11 -0.07 0.00 -0.00 0.00 0.00 40.66 40.78 2j4r h LEU 73 CO -0.36 0.36 0.05 0.40 -0.00 0.00 0.00 178.44 178.89 2j4r h ILE 74 N 0.62 0.72 -0.01 1.22 2.04 0.38 -1.60 117.51 120.87 2j4r h ILE 74 Ca 0.20 -0.06 -0.00 0.00 1.00 0.00 0.00 64.86 66.00 2j4r h ILE 74 Cb 0.00 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 36.62 2j4r h ILE 74 CO -0.08 0.03 -0.01 0.44 0.00 0.00 0.00 178.15 178.53 2j4r h ASP 75 N 0.17 0.03 -1.32 1.72 3.32 -1.00 -1.38 116.42 117.96 2j4r h ASP 75 Ca 0.22 -0.47 0.38 0.00 0.02 0.00 0.00 57.03 57.18 2j4r h ASP 75 Cb 0.30 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 39.78 2j4r h ASP 75 CO -0.32 0.50 1.01 -0.08 -1.72 0.00 0.00 179.24 178.63 2j4r h GLU 76 N -0.44 0.00 0.00 3.56 4.81 -0.73 2.10 114.58 123.88 2j4r h GLU 76 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2j4r h GLU 76 Cb 0.49 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.87 2j4r h GLU 76 CO 0.00 0.00 -0.88 1.19 -0.73 0.00 0.00 179.01 178.60 2j4r n PHE 77 N -3.98 0.12 -3.31 0.92 3.01 -0.63 -5.00 117.46 108.59 2j4r n PHE 77 Ca 0.29 0.04 -0.16 0.00 1.01 0.00 0.00 57.45 58.62 2j4r n PHE 77 Cb 1.43 -0.28 0.05 0.00 -0.01 0.00 0.00 39.48 40.68 2j4r n PHE 77 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2j4r n LYS 78 N -1.72 -1.93 -3.15 -1.08 5.02 0.71 -4.93 118.16 111.08 2j4r n LYS 78 Ca 0.03 0.88 -0.40 0.00 -2.02 0.00 0.00 58.31 56.81 2j4r n LYS 78 Cb 0.38 -5.46 -0.06 0.00 -0.02 0.00 0.00 35.03 29.87 2j4r n LYS 78 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2j4r s VAL 79 N -3.34 5.06 0.08 -0.18 -7.23 -1.07 -4.81 120.40 108.91 2j4r s VAL 79 Ca 0.39 1.16 -0.33 0.00 -1.81 0.00 0.00 61.98 61.39 2j4r s VAL 79 Cb -0.07 -3.93 -0.17 0.00 0.56 0.00 0.00 36.38 32.78 2j4r s VAL 79 CO 0.77 0.18 1.60 -0.33 -0.31 0.00 0.00 175.10 177.01 2j4r h GLU 80 N 7.22 -0.88 -5.65 4.82 3.07 -1.88 -3.43 114.58 117.85 2j4r h GLU 80 Ca -0.35 0.06 -0.68 0.00 -0.50 0.00 0.00 59.36 57.89 2j4r h GLU 80 Cb 1.16 0.20 -0.32 0.00 -0.84 0.00 0.00 28.75 28.95 2j4r h GLU 80 CO 0.76 -0.59 -0.88 1.03 -1.40 0.00 0.00 179.01 177.93 2j4r s ARG 81 N -5.99 2.73 -0.03 2.33 0.52 -1.25 -5.07 118.95 112.19 2j4r s ARG 81 Ca -0.18 -0.87 0.03 0.00 -0.52 0.00 0.00 55.73 54.19 2j4r s ARG 81 Cb 0.04 -2.19 -0.00 0.00 0.52 0.00 0.00 34.95 33.33 2j4r s ARG 81 CO 0.62 0.28 -0.13 0.54 0.02 0.00 0.00 175.30 176.63 2j4r s VAL 82 N 0.09 1.08 -0.08 3.52 0.11 -1.26 -1.33 120.40 122.53 2j4r s VAL 82 Ca -0.11 -0.53 0.03 0.00 -2.93 0.00 0.00 61.98 58.45 2j4r s VAL 82 Cb -0.16 -0.94 0.00 0.00 -1.53 0.00 0.00 36.38 33.76 2j4r s VAL 82 CO 0.06 0.32 -0.19 -0.75 -3.33 0.00 0.00 175.10 171.21 2j4r s LYS 83 N 0.10 2.42 -0.09 1.54 2.47 -0.68 -4.97 119.74 120.54 2j4r s LYS 83 Ca -0.03 -0.69 0.04 0.00 -1.56 0.00 0.00 55.97 53.73 2j4r s LYS 83 Cb -0.10 -1.90 0.00 0.00 -1.46 0.00 0.00 37.83 34.37 2j4r s LYS 83 CO 0.01 0.14 -0.21 0.00 0.16 0.00 0.00 175.35 175.45 2j4r s ALA 84 N 0.41 1.94 0.21 3.13 0.00 -1.26 -1.77 121.76 124.42 2j4r s ALA 84 Ca -0.15 -0.85 0.05 0.00 0.00 0.00 0.00 51.96 51.01 2j4r s ALA 84 Cb -0.16 -0.73 -0.05 0.00 0.00 0.00 0.00 23.12 22.18 2j4r s ALA 84 CO 0.06 0.26 -0.07 0.14 0.00 0.00 0.00 175.76 176.16 2j4r s VAL 85 N 0.34 1.32 -0.01 0.00 -7.23 -0.00 -1.48 120.40 113.34 2j4r s VAL 85 Ca -0.16 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 57.92 2j4r s VAL 85 Cb -0.17 -2.16 0.01 0.00 0.56 0.00 0.00 36.38 34.62 2j4r s VAL 85 CO 0.07 -0.50 -0.01 0.00 -0.31 0.00 0.00 175.10 174.36 2j4r s ALA 86 N -3.23 0.15 0.00 1.32 0.00 -1.02 0.03 121.76 119.02 2j4r s ALA 86 Ca 0.24 0.02 0.08 0.00 0.00 0.00 0.00 51.96 52.29 2j4r s ALA 86 Cb 0.03 -0.10 -0.03 0.00 0.00 0.00 0.00 23.12 23.02 2j4r s ALA 86 CO 0.07 -0.00 -0.24 0.95 0.00 0.00 0.00 175.76 176.54 2j4r s THR 87 N 0.26 2.31 0.00 0.00 -4.23 -1.14 -2.10 115.64 110.75 2j4r s THR 87 Ca -0.02 -1.16 0.00 0.00 -1.18 0.00 0.00 61.69 59.33 2j4r s THR 87 Cb -0.04 -1.87 0.00 0.00 1.34 0.00 0.00 72.50 71.93 2j4r s THR 87 CO -0.01 0.48 0.00 -0.62 -0.54 0.00 0.00 174.62 173.94 2j4r n GLU 88 N 2.09 0.00 0.00 3.99 -0.58 -1.26 -3.61 120.64 121.27 2j4r n GLU 88 Ca -0.16 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.58 2j4r n GLU 88 Cb 0.52 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.39 2j4r n GLU 88 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2j4r n ALA 89 N 0.00 0.00 -0.06 0.62 0.00 -1.26 -4.86 120.51 114.94 2j4r n ALA 89 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 2j4r n ALA 89 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 2j4r n ALA 89 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2j4r n ILE 90 N 0.00 1.58 0.36 0.00 5.41 -1.24 -3.49 119.36 121.98 2j4r n ILE 90 Ca 0.00 -0.70 0.14 0.00 1.00 0.00 0.00 62.75 63.19 2j4r n ILE 90 Cb 0.00 -1.25 0.56 0.00 -0.71 0.00 0.00 39.64 38.24 2j4r n ILE 90 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 176.55 176.63 2j4r h ARG 91 N 0.02 0.00 0.00 0.38 0.11 -1.89 -1.58 114.38 111.42 2j4r h ARG 91 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.61 2j4r h ARG 91 Cb 2.03 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.11 2j4r h ARG 91 CO 0.02 0.00 -0.78 0.54 0.10 0.00 0.00 179.97 179.85 2j4r n ARG 92 N -2.61 0.00 -2.53 0.08 1.74 -1.26 -4.92 116.66 107.17 2j4r n ARG 92 Ca 0.02 -0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.68 2j4r n ARG 92 Cb 0.28 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.18 2j4r n ARG 92 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2j4r s ALA 93 N -3.00 3.33 0.35 7.54 0.00 -0.59 -4.95 121.76 124.44 2j4r s ALA 93 Ca 0.09 0.76 0.04 0.00 0.00 0.00 0.00 51.96 52.85 2j4r s ALA 93 Cb 0.17 -3.38 0.68 0.00 0.00 0.00 0.00 23.12 20.59 2j4r s ALA 93 CO 0.79 -0.30 1.97 -0.22 0.00 0.00 0.00 175.76 178.01 2j4r h LYS 94 N 6.19 0.80 -0.59 0.00 3.64 -1.79 -2.57 116.57 122.24 2j4r h LYS 94 Ca -0.42 -0.05 -0.18 0.00 -1.27 0.00 0.00 60.65 58.73 2j4r h LYS 94 Cb 1.21 -0.18 -0.11 0.00 -0.41 0.00 0.00 32.23 32.75 2j4r h LYS 94 CO 0.77 0.53 0.17 0.27 -2.27 0.00 0.00 179.45 178.92 2j4r n ASN 95 N -4.47 4.22 -0.40 4.20 0.23 -1.26 -4.72 115.26 113.07 2j4r n ASN 95 Ca 0.10 -3.29 -0.07 0.00 -0.53 0.00 0.00 54.58 50.79 2j4r n ASN 95 Cb 0.17 -0.69 -0.04 0.00 -2.08 0.00 0.00 39.78 37.13 2j4r n ASN 95 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2j4r n ALA 96 N -0.43 -0.43 -0.05 -2.53 0.00 -0.97 -0.79 120.51 115.31 2j4r n ALA 96 Ca 0.37 0.89 -0.09 0.00 0.00 0.00 0.00 53.44 54.60 2j4r n ALA 96 Cb 1.24 -0.25 -0.03 0.00 0.00 0.00 0.00 19.45 20.41 2j4r n ALA 96 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2j4r h GLU 97 N 0.00 -0.32 -0.86 0.00 4.81 -1.86 0.17 114.58 116.52 2j4r h GLU 97 Ca 0.23 0.02 0.16 0.00 -0.13 0.00 0.00 59.36 59.64 2j4r h GLU 97 Cb 0.47 0.07 -0.10 0.00 0.63 0.00 0.00 28.75 29.83 2j4r h GLU 97 CO -0.94 -0.21 0.44 1.49 -0.73 0.00 0.00 179.01 179.05 2j4r h GLU 98 N -0.33 0.57 -0.11 1.92 4.57 -1.32 -0.17 114.58 119.71 2j4r h GLU 98 Ca 0.13 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.27 2j4r h GLU 98 Cb 0.54 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 29.00 2j4r h GLU 98 CO -0.43 0.38 0.05 0.35 -1.18 0.00 0.00 179.01 178.18 2j4r h PHE 99 N 0.59 0.16 -0.55 0.92 3.57 0.87 -2.71 116.94 119.79 2j4r h PHE 99 Ca 0.48 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.90 2j4r h PHE 99 Cb 0.73 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.40 2j4r h PHE 99 CO -0.10 0.23 0.05 -0.07 -2.23 0.00 0.00 178.31 176.19 2j4r h LEU 100 N 0.04 0.92 -1.89 0.59 -0.00 0.37 -1.85 115.31 113.49 2j4r h LEU 100 Ca 0.04 -0.28 0.02 0.00 -0.00 0.00 0.00 57.88 57.66 2j4r h LEU 100 Cb 0.13 -0.24 -0.01 0.00 -0.00 0.00 0.00 40.66 40.54 2j4r h LEU 100 CO -0.00 0.97 0.12 -0.08 -0.00 0.00 0.00 178.44 179.45 2j4r h GLU 101 N 0.83 0.14 0.04 1.13 4.57 -1.08 0.23 114.58 120.44 2j4r h GLU 101 Ca 0.16 -0.01 -0.23 0.00 -1.18 0.00 0.00 59.36 58.11 2j4r h GLU 101 Cb 0.48 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.02 2j4r h GLU 101 CO 0.02 0.10 -1.04 -0.09 -1.18 0.00 0.00 179.01 176.81 2j4r h ARG 102 N 0.15 0.14 0.21 1.92 2.43 -1.10 -3.25 114.38 114.87 2j4r h ARG 102 Ca 0.08 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.02 2j4r h ARG 102 Cb 0.12 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 2j4r h ARG 102 CO -0.01 1.06 -0.10 0.28 -1.51 0.00 0.00 179.97 179.68 2j4r h VAL 103 N 0.05 0.84 -4.00 0.20 2.07 -0.48 -3.36 116.25 111.57 2j4r h VAL 103 Ca -0.06 -0.85 -0.55 0.00 0.82 0.00 0.00 66.70 66.06 2j4r h VAL 103 Cb 1.76 1.30 0.13 0.00 -1.52 0.00 0.00 31.29 32.95 2j4r h VAL 103 CO 0.16 0.17 0.70 -0.75 0.02 0.00 0.00 177.57 177.87 2j4r s LYS 104 N -4.17 3.61 -0.34 1.57 2.47 0.71 -1.86 119.74 121.73 2j4r s LYS 104 Ca -0.14 2.44 -0.19 0.00 -1.56 0.00 0.00 55.97 56.52 2j4r s LYS 104 Cb 0.02 -2.61 0.03 0.00 -1.46 0.00 0.00 37.83 33.80 2j4r s LYS 104 CO 0.54 -0.89 0.41 2.89 0.16 0.00 0.00 175.35 178.46 2j4r n ARG 105 N -0.30 -2.01 0.00 4.03 1.85 -1.26 -4.59 116.66 114.37 2j4r n ARG 105 Ca 0.06 1.74 0.00 0.00 -1.00 0.00 0.00 57.85 58.64 2j4r n ARG 105 Cb 0.42 -3.47 0.00 0.00 -1.05 0.00 0.00 32.46 28.36 2j4r n ARG 105 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 2j4r n GLU 106 N 0.21 0.00 0.00 2.89 2.13 -1.24 -4.74 120.64 119.89 2j4r n GLU 106 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2j4r n GLU 106 Cb 0.47 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.18 2j4r n GLU 106 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2j4r n VAL 107 N 0.00 0.00 -2.10 6.31 0.31 -0.78 -4.97 118.33 117.11 2j4r n VAL 107 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2j4r n VAL 107 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2j4r n VAL 107 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2j4r n GLY 108 N 0.88 0.95 2.97 2.92 0.00 -0.99 -5.00 105.19 106.91 2j4r n GLY 108 Ca 0.00 -0.58 -0.24 0.00 0.00 0.00 0.00 46.02 45.20 2j4r n GLY 108 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2j4r s LEU 109 N -0.81 1.46 -0.15 0.99 2.96 -1.24 -4.86 118.68 117.02 2j4r s LEU 109 Ca 0.00 -0.26 -0.16 0.00 -0.22 0.00 0.00 54.13 53.49 2j4r s LEU 109 Cb 0.00 -0.74 -0.04 0.00 0.50 0.00 0.00 46.19 45.91 2j4r s LEU 109 CO 0.00 -0.02 0.39 0.68 -1.32 0.00 0.00 176.35 176.08 2j4r s VAL 110 N 0.97 5.24 -0.19 1.68 -7.23 -1.26 -2.53 120.40 117.08 2j4r s VAL 110 Ca -0.09 0.74 -0.03 0.00 -1.81 0.00 0.00 61.98 60.79 2j4r s VAL 110 Cb -0.15 -3.73 -0.01 0.00 0.56 0.00 0.00 36.38 33.05 2j4r s VAL 110 CO 0.00 0.34 -0.06 -0.69 -0.31 0.00 0.00 175.10 174.38 2j4r s VAL 111 N 0.68 3.44 -0.23 1.32 1.01 -1.26 -4.30 120.40 121.05 2j4r s VAL 111 Ca 0.21 -0.49 -0.16 0.00 0.00 0.00 0.00 61.98 61.53 2j4r s VAL 111 Cb -0.14 -2.53 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 2j4r s VAL 111 CO 0.07 0.46 0.43 -0.70 0.00 0.00 0.00 175.10 175.36 2j4r s GLU 112 N 0.99 4.11 0.16 2.72 2.12 -0.55 -4.92 118.70 123.32 2j4r s GLU 112 Ca -0.00 0.20 -0.30 0.00 0.36 0.00 0.00 54.97 55.23 2j4r s GLU 112 Cb -0.15 -3.60 -0.07 0.00 0.26 0.00 0.00 34.13 30.58 2j4r s GLU 112 CO 0.00 -0.18 1.06 0.08 -0.54 0.00 0.00 175.26 175.67 2j4r s VAL 113 N 1.77 4.06 0.19 3.70 1.01 -1.26 -2.42 120.40 127.45 2j4r s VAL 113 Ca 0.19 1.76 0.11 0.00 0.00 0.00 0.00 61.98 64.04 2j4r s VAL 113 Cb -0.15 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.06 2j4r s VAL 113 CO 0.09 0.29 -0.21 0.27 0.00 0.00 0.00 175.10 175.54 2j4r s ILE 114 N -0.17 2.52 0.57 2.22 -4.36 -0.89 -4.92 121.20 116.16 2j4r s ILE 114 Ca 0.49 -1.96 -0.09 0.00 -0.26 0.00 0.00 60.65 58.82 2j4r s ILE 114 Cb -0.27 -2.22 -0.04 0.00 1.25 0.00 0.00 42.46 41.17 2j4r s ILE 114 CO 0.33 -0.12 0.95 0.42 0.24 0.00 0.00 174.94 176.76 2j4r s THR 115 N -1.69 4.77 0.47 8.37 -4.23 -1.26 -4.36 115.64 117.71 2j4r s THR 115 Ca 0.22 0.68 0.18 0.00 -1.18 0.00 0.00 61.69 61.58 2j4r s THR 115 Cb -0.08 -3.86 0.23 0.00 1.34 0.00 0.00 72.50 70.13 2j4r s THR 115 CO 0.11 -1.02 2.05 1.55 -0.54 0.00 0.00 174.62 176.77 2j4r h PRO 116 N -0.06 0.00 -0.41 3.99 0.13 -1.99 -1.47 132.00 132.19 2j4r h PRO 116 Ca -0.45 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.71 2j4r h PRO 116 Cb 1.19 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 2j4r h PRO 116 CO 0.62 0.13 0.20 0.93 -0.23 0.00 0.00 178.00 179.64 2j4r h GLU 117 N 0.00 0.39 -0.70 0.86 3.07 -1.96 -1.49 114.58 114.76 2j4r h GLU 117 Ca -0.00 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 58.81 2j4r h GLU 117 Cb 0.24 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.03 2j4r h GLU 117 CO 0.02 0.26 0.33 1.96 -1.40 0.00 0.00 179.01 180.17 2j4r h GLN 118 N 0.40 1.00 -0.85 2.33 4.20 -1.66 -1.90 115.11 118.63 2j4r h GLN 118 Ca 0.17 -0.14 0.07 0.00 0.06 0.00 0.00 58.65 58.81 2j4r h GLN 118 Cb 0.08 -0.18 -0.06 0.00 0.30 0.00 0.00 27.48 27.63 2j4r h GLN 118 CO -0.12 0.78 0.55 0.93 -0.67 0.00 0.00 178.83 180.30 2j4r h GLU 119 N 0.99 0.90 -0.23 1.46 5.08 -0.72 -1.60 114.58 120.46 2j4r h GLU 119 Ca 0.24 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.51 2j4r h GLU 119 Cb 0.11 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2j4r h GLU 119 CO -0.03 0.60 -0.02 0.78 -1.00 0.00 0.00 179.01 179.34 2j4r h GLY 120 N 0.93 0.45 0.95 -3.84 0.00 -0.68 -0.43 103.07 100.45 2j4r h GLY 120 Ca 0.37 -0.35 0.02 0.00 0.00 0.00 0.00 47.33 47.37 2j4r h GLY 120 CO -0.14 0.32 0.55 3.21 0.00 0.00 0.00 176.54 180.48 2j4r h ARG 121 N 0.18 1.06 0.50 4.80 3.08 -0.92 0.51 114.38 123.58 2j4r h ARG 121 Ca 0.06 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 2j4r h ARG 121 Cb 0.44 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.26 2j4r h ARG 121 CO 0.02 0.70 -0.24 1.88 -1.07 0.00 0.00 179.97 181.26 2j4r h TYR 122 N 1.09 -0.62 -1.04 3.04 0.05 -1.28 -2.53 116.97 115.70 2j4r h TYR 122 Ca 0.32 -0.01 0.28 0.00 0.05 0.00 0.00 58.73 59.36 2j4r h TYR 122 Cb -0.07 0.20 -0.12 0.00 1.01 0.00 0.00 36.73 37.76 2j4r h TYR 122 CO -0.02 -0.29 0.64 0.00 -1.05 0.00 0.00 178.16 177.44 2j4r h ALA 123 N -0.66 2.03 -0.54 3.88 0.00 -0.78 0.43 119.26 123.63 2j4r h ALA 123 Ca -0.07 0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 2j4r h ALA 123 Cb 0.60 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2j4r h ALA 123 CO 0.11 -0.52 0.02 -0.92 0.00 0.00 0.00 179.25 177.95 2j4r h TYR 124 N 0.45 0.97 -0.51 0.00 5.03 -0.80 -2.32 116.97 119.78 2j4r h TYR 124 Ca 0.65 -0.14 -0.00 0.00 2.58 0.00 0.00 58.73 61.82 2j4r h TYR 124 Cb 1.48 -0.26 -0.02 0.00 1.55 0.00 0.00 36.73 39.48 2j4r h TYR 124 CO -0.01 0.86 0.30 -0.07 -1.32 0.00 0.00 178.16 177.93 2j4r h LEU 125 N 0.84 0.62 -1.55 2.82 4.07 0.28 0.64 115.31 123.03 2j4r h LEU 125 Ca 0.16 -0.07 0.05 0.00 0.08 0.00 0.00 57.88 58.11 2j4r h LEU 125 Cb 0.47 -0.16 -0.03 0.00 1.08 0.00 0.00 40.66 42.02 2j4r h LEU 125 CO 0.02 0.51 0.37 0.00 -1.08 0.00 0.00 178.44 178.26 2j4r h ALA 126 N 1.14 1.81 0.10 1.53 0.00 -0.87 -1.23 119.26 121.73 2j4r h ALA 126 Ca 0.18 -0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.80 2j4r h ALA 126 Cb 0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2j4r h ALA 126 CO -0.03 0.11 -1.32 0.28 0.00 0.00 0.00 179.25 178.29 2j4r h VAL 127 N 0.56 1.40 -0.55 0.00 2.07 -0.84 -2.53 116.25 116.37 2j4r h VAL 127 Ca 0.23 -3.02 0.02 0.00 0.82 0.00 0.00 66.70 64.76 2j4r h VAL 127 Cb 0.22 2.86 -0.03 0.00 -1.52 0.00 0.00 31.29 32.81 2j4r h VAL 127 CO -0.07 0.87 0.33 0.00 0.02 0.00 0.00 177.57 178.72 2j4r h ALA 128 N 0.62 0.70 0.20 1.67 0.00 -0.14 -1.48 119.26 120.82 2j4r h ALA 128 Ca -0.16 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2j4r h ALA 128 Cb 1.96 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.59 2j4r h ALA 128 CO 0.18 0.05 -0.10 -0.92 0.00 0.00 0.00 179.25 178.47 2j4r h TYR 129 N 0.66 -0.25 -0.31 0.00 3.20 -1.33 -2.83 116.97 116.12 2j4r h TYR 129 Ca 0.22 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.08 2j4r h TYR 129 Cb 0.01 0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.36 2j4r h TYR 129 CO -0.06 0.16 0.00 -1.13 -1.64 0.00 0.00 178.16 175.49 2j4r n SER 130 N -4.99 1.98 0.00 -2.11 3.41 -0.95 -4.35 113.62 106.61 2j4r n SER 130 Ca -0.08 -1.90 0.00 0.00 -0.26 0.00 0.00 58.87 56.62 2j4r n SER 130 Cb 0.26 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 2j4r n SER 130 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2j4r n LEU 131 N 0.56 0.00 -3.98 1.04 4.77 -0.59 -5.01 117.00 113.80 2j4r n LEU 131 Ca 0.14 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.83 2j4r n LEU 131 Cb 0.34 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.38 2j4r n LEU 131 CO 0.10 0.00 -0.29 0.29 -1.33 0.00 0.00 177.39 176.16 2j4r n LYS 132 N 0.00 -0.74 -1.53 3.23 5.02 -1.05 -4.89 118.16 118.20 2j4r n LYS 132 Ca 0.00 0.02 -0.35 0.00 -2.02 0.00 0.00 58.31 55.96 2j4r n LYS 132 Cb 0.00 -2.45 0.08 0.00 -0.02 0.00 0.00 35.03 32.64 2j4r n LYS 132 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2j4r s PRO 133 N -6.69 2.27 0.26 1.97 0.04 -1.26 -5.01 135.00 126.58 2j4r s PRO 133 Ca 0.14 1.84 -0.16 0.00 0.04 0.00 0.00 61.00 62.87 2j4r s PRO 133 Cb -0.08 -1.84 -0.08 0.00 0.04 0.00 0.00 34.50 32.54 2j4r s PRO 133 CO 0.79 -1.76 0.69 -1.21 0.04 0.00 0.00 177.00 175.55 2j4r s GLU 134 N -3.75 4.06 3.89 4.56 0.41 -1.26 -4.68 118.70 121.93 2j4r s GLU 134 Ca 0.77 0.67 0.00 0.00 -0.41 0.00 0.00 54.97 56.00 2j4r s GLU 134 Cb -0.31 -2.65 0.00 0.00 -1.78 0.00 0.00 34.13 29.38 2j4r s GLU 134 CO 0.43 0.29 0.00 0.41 -0.49 0.00 0.00 175.26 175.90 2j4r n GLY 135 N 0.14 1.22 3.61 -1.39 0.00 -1.26 -4.00 105.19 103.51 2j4r n GLY 135 Ca 0.00 -0.57 -0.43 0.00 0.00 0.00 0.00 46.02 45.02 2j4r n GLY 135 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2j4r s GLU 136 N 0.00 3.43 -0.12 1.61 2.56 -1.26 -4.45 118.70 120.47 2j4r s GLU 136 Ca 0.00 1.82 -0.06 0.00 0.00 0.00 0.00 54.97 56.73 2j4r s GLU 136 Cb 0.00 -4.23 -0.04 0.00 2.00 0.00 0.00 34.13 31.86 2j4r s GLU 136 CO 0.00 -1.75 0.10 0.08 -0.56 0.00 0.00 175.26 173.13 2j4r s VAL 137 N 6.84 5.18 -0.25 3.70 1.01 0.89 -0.49 120.40 137.29 2j4r s VAL 137 Ca 0.87 0.09 0.01 0.00 0.00 0.00 0.00 61.98 62.94 2j4r s VAL 137 Cb -0.29 -3.25 0.07 0.00 0.00 0.00 0.00 36.38 32.91 2j4r s VAL 137 CO 0.34 0.60 -0.03 0.00 0.00 0.00 0.00 175.10 176.02 2j4r s VAL 139 N 1.40 5.13 -0.40 0.00 1.01 -0.26 -0.87 120.40 126.40 2j4r s VAL 139 Ca -0.03 0.98 -0.07 0.00 0.00 0.00 0.00 61.98 62.85 2j4r s VAL 139 Cb -0.19 -3.84 0.08 0.00 0.00 0.00 0.00 36.38 32.43 2j4r s VAL 139 CO -0.08 0.22 0.22 -0.69 0.00 0.00 0.00 175.10 174.77 2j4r s VAL 140 N 1.32 3.93 -0.89 2.92 1.01 0.89 -1.43 120.40 128.15 2j4r s VAL 140 Ca 0.25 -1.50 -0.15 0.00 0.00 0.00 0.00 61.98 60.58 2j4r s VAL 140 Cb -0.15 -3.44 0.20 0.00 0.00 0.00 0.00 36.38 32.99 2j4r s VAL 140 CO 0.10 -0.49 0.92 -0.62 0.00 0.00 0.00 175.10 175.01 2j4r s ASP 141 N 1.97 6.78 -0.39 3.32 3.68 0.09 -2.02 116.67 130.10 2j4r s ASP 141 Ca 0.03 -2.60 -0.19 0.00 2.13 0.00 0.00 52.55 51.92 2j4r s ASP 141 Cb -0.23 -2.27 0.01 0.00 -1.45 0.00 0.00 42.92 38.99 2j4r s ASP 141 CO 0.01 -0.69 0.56 -1.58 0.13 0.00 0.00 175.17 173.59 2j4r s GLN 142 N 0.80 3.42 -0.30 4.34 -0.44 -1.15 -1.70 119.66 124.63 2j4r s GLN 142 Ca 0.24 -0.32 -0.14 0.00 -2.50 0.00 0.00 55.36 52.64 2j4r s GLN 142 Cb -0.08 -3.88 0.17 0.00 -1.64 0.00 0.00 33.01 27.57 2j4r s GLN 142 CO -0.09 -0.81 1.00 0.20 0.50 0.00 0.00 175.29 176.09 2j4r s GLY 143 N 1.86 -0.22 0.00 2.59 0.00 -0.92 -4.38 107.32 106.24 2j4r s GLY 143 Ca 0.19 2.99 0.00 0.00 0.00 0.00 0.00 44.72 47.90 2j4r s GLY 143 CO 0.15 3.35 0.00 0.61 0.00 0.00 0.00 173.10 177.21 2j4r n GLY 144 N 5.05 0.96 0.92 0.20 0.00 -1.26 -4.07 105.19 106.99 2j4r n GLY 144 Ca -0.08 -1.30 0.09 0.00 0.00 0.00 0.00 46.02 44.73 2j4r n GLY 144 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j4r n GLY 145 N 0.00 1.84 3.13 -0.02 0.00 -1.26 -3.65 105.19 105.23 2j4r n GLY 145 Ca 0.00 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.36 2j4r n GLY 145 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2j4r s SER 146 N -1.17 0.17 -0.11 1.61 1.04 -1.26 -2.49 113.70 111.50 2j4r s SER 146 Ca 0.32 -0.55 0.01 0.00 0.48 0.00 0.00 55.95 56.20 2j4r s SER 146 Cb 0.18 0.25 0.02 0.00 0.10 0.00 0.00 66.02 66.56 2j4r s SER 146 CO 0.24 -0.55 -0.10 -0.89 0.98 0.00 0.00 173.24 172.92 2j4r s THR 147 N -2.83 1.17 -0.03 2.02 2.01 -0.70 -2.17 115.64 115.11 2j4r s THR 147 Ca -0.03 -0.42 0.02 0.00 0.31 0.00 0.00 61.69 61.57 2j4r s THR 147 Cb 0.00 -1.13 -0.03 0.00 0.01 0.00 0.00 72.50 71.35 2j4r s THR 147 CO -0.06 0.38 -0.07 -1.83 -0.69 0.00 0.00 174.62 172.36 2j4r s GLU 148 N 1.35 2.65 -0.15 4.92 1.03 -0.69 0.06 118.70 127.87 2j4r s GLU 148 Ca -0.01 -0.63 -0.02 0.00 0.03 0.00 0.00 54.97 54.33 2j4r s GLU 148 Cb -0.14 -2.55 -0.02 0.00 -0.80 0.00 0.00 34.13 30.62 2j4r s GLU 148 CO -0.05 0.63 -0.07 0.71 -1.33 0.00 0.00 175.26 175.15 2j4r s TYR 149 N -0.91 2.94 -0.14 4.83 1.51 0.74 -0.73 117.35 125.58 2j4r s TYR 149 Ca 0.15 -0.47 -0.00 0.00 -1.01 0.00 0.00 57.07 55.73 2j4r s TYR 149 Cb -0.11 -1.93 0.03 0.00 -0.11 0.00 0.00 41.96 39.85 2j4r s TYR 149 CO 0.05 -0.14 -0.07 0.08 -1.11 0.00 0.00 175.55 174.36 2j4r s VAL 150 N 0.44 1.09 0.30 0.71 1.01 -0.51 -0.70 120.40 122.74 2j4r s VAL 150 Ca -0.06 -0.49 0.08 0.00 0.00 0.00 0.00 61.98 61.51 2j4r s VAL 150 Cb -0.15 -1.19 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 2j4r s VAL 150 CO 0.04 0.24 0.22 -0.36 0.00 0.00 0.00 175.10 175.23 2j4r s PHE 151 N 1.66 2.94 -4.32 5.22 0.40 0.33 -1.11 117.98 123.10 2j4r s PHE 151 Ca 0.03 -0.24 0.00 0.00 -0.60 0.00 0.00 56.93 56.12 2j4r s PHE 151 Cb -0.14 -1.58 0.00 0.00 0.51 0.00 0.00 43.02 41.81 2j4r s PHE 151 CO -0.08 0.36 0.00 0.41 0.70 0.00 0.00 175.22 176.61 2j4r n GLY 152 N -1.24 -1.41 2.75 4.36 0.00 -0.88 -0.49 105.19 108.28 2j4r n GLY 152 Ca -0.04 -1.17 -0.18 0.00 0.00 0.00 0.00 46.02 44.62 2j4r n GLY 152 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2j4r s LYS 153 N -1.73 0.11 6.39 1.61 2.36 -0.79 -0.07 119.74 127.60 2j4r s LYS 153 Ca 0.00 0.21 0.00 0.00 -2.55 0.00 0.00 55.97 53.63 2j4r s LYS 153 Cb 0.00 -0.46 0.00 0.00 -1.05 0.00 0.00 37.83 36.32 2j4r s LYS 153 CO 0.00 -0.22 0.00 0.41 1.55 0.00 0.00 175.35 177.09 2j4r n GLY 154 N 4.60 2.87 0.00 5.54 0.00 -1.26 -2.13 105.19 114.81 2j4r n GLY 154 Ca -0.18 -0.35 0.14 0.00 0.00 0.00 0.00 46.02 45.64 2j4r n GLY 154 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2j4r n TYR 155 N 13.77 0.00 -3.29 1.61 4.01 -1.26 -4.82 117.16 127.18 2j4r n TYR 155 Ca 0.00 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.35 2j4r n TYR 155 Cb 0.00 -0.38 -0.07 0.00 -0.31 0.00 0.00 39.34 38.58 2j4r n TYR 155 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 2j4r s LYS 156 N -2.76 4.20 -0.22 -0.72 2.36 -0.91 -4.94 119.74 116.75 2j4r s LYS 156 Ca 0.22 0.37 -0.23 0.00 -2.55 0.00 0.00 55.97 53.78 2j4r s LYS 156 Cb 0.20 -3.54 -0.01 0.00 -1.05 0.00 0.00 37.83 33.42 2j4r s LYS 156 CO 0.49 -0.09 0.74 0.08 1.55 0.00 0.00 175.35 178.12 2j4r s VAL 157 N 1.46 4.92 -0.15 4.02 1.01 -1.26 -1.89 120.40 128.51 2j4r s VAL 157 Ca 0.23 1.39 -0.25 0.00 0.00 0.00 0.00 61.98 63.35 2j4r s VAL 157 Cb -0.15 -4.04 -0.25 0.00 0.00 0.00 0.00 36.38 31.94 2j4r s VAL 157 CO 0.09 0.01 0.59 -0.09 0.00 0.00 0.00 175.10 175.71 2j4r h ARG 158 N 7.63 0.06 -3.35 2.72 2.43 -1.13 -3.48 114.38 119.25 2j4r h ARG 158 Ca -0.27 -0.10 -0.11 0.00 -0.81 0.00 0.00 59.98 58.69 2j4r h ARG 158 Cb 1.12 0.04 -0.18 0.00 -0.42 0.00 0.00 29.97 30.52 2j4r h ARG 158 CO 0.82 1.05 -0.33 -2.00 -1.51 0.00 0.00 179.97 178.00 2j4r s GLU 159 N -2.31 0.70 -0.02 0.20 2.12 -1.12 -5.01 118.70 113.27 2j4r s GLU 159 Ca -0.21 -0.47 0.00 0.00 0.36 0.00 0.00 54.97 54.65 2j4r s GLU 159 Cb 0.01 0.30 0.02 0.00 0.26 0.00 0.00 34.13 34.72 2j4r s GLU 159 CO 0.68 -0.21 0.01 0.54 -0.54 0.00 0.00 175.26 175.74 2j4r s VAL 160 N -2.16 0.07 -0.02 3.70 0.11 -1.26 -0.51 120.40 120.32 2j4r s VAL 160 Ca -0.08 0.09 0.01 0.00 -2.93 0.00 0.00 61.98 59.07 2j4r s VAL 160 Cb -0.03 -0.15 0.01 0.00 -1.53 0.00 0.00 36.38 34.69 2j4r s VAL 160 CO -0.01 0.09 -0.01 -0.63 -3.33 0.00 0.00 175.10 171.20 2j4r s ILE 161 N 0.71 0.21 -0.28 7.04 1.01 0.13 -4.99 121.20 125.02 2j4r s ILE 161 Ca -0.06 -0.01 -0.08 0.00 0.00 0.00 0.00 60.65 60.50 2j4r s ILE 161 Cb -0.09 -0.25 -0.02 0.00 0.01 0.00 0.00 42.46 42.11 2j4r s ILE 161 CO -0.02 0.11 0.11 -0.55 0.00 0.00 0.00 174.94 174.60 2j4r s SER 162 N 0.56 5.34 -0.24 3.58 0.15 -1.26 -0.19 113.70 121.64 2j4r s SER 162 Ca -0.06 -0.38 -0.14 0.00 0.70 0.00 0.00 55.95 56.07 2j4r s SER 162 Cb -0.09 -1.96 -0.04 0.00 -1.71 0.00 0.00 66.02 62.23 2j4r s SER 162 CO -0.01 -0.12 0.35 -0.76 1.20 0.00 0.00 173.24 173.90 2j4r s LEU 163 N 1.61 4.09 0.00 3.45 1.02 0.11 -4.95 118.68 124.00 2j4r s LEU 163 Ca 0.05 0.33 0.00 0.00 0.02 0.00 0.00 54.13 54.54 2j4r s LEU 163 Cb -0.16 -2.40 0.00 0.00 0.02 0.00 0.00 46.19 43.65 2j4r s LEU 163 CO 0.05 -0.11 0.11 -0.81 0.02 0.00 0.00 176.35 175.61 2j4r n PRO 164 N 4.88 0.14 -3.26 1.29 -0.04 -1.26 -1.73 135.00 135.02 2j4r n PRO 164 Ca -0.09 0.00 -0.46 0.00 -0.04 0.00 0.00 63.50 62.91 2j4r n PRO 164 Cb 0.51 -1.27 -0.05 0.00 -0.04 0.00 0.00 33.50 32.65 2j4r n PRO 164 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2j4r s ILE 165 N 0.05 5.15 -0.03 0.52 -4.36 -1.25 -4.84 121.20 116.43 2j4r s ILE 165 Ca 0.00 -1.48 -0.03 0.00 -0.26 0.00 0.00 60.65 58.88 2j4r s ILE 165 Cb 0.00 -4.40 -0.04 0.00 1.25 0.00 0.00 42.46 39.27 2j4r s ILE 165 CO 0.00 -0.96 0.15 -0.83 0.24 0.00 0.00 174.94 173.54 2j4r s GLY 166 N 3.47 2.14 0.00 6.27 0.00 -1.04 -3.76 107.32 114.40 2j4r s GLY 166 Ca 0.07 -0.76 0.00 0.00 0.00 0.00 0.00 44.72 44.03 2j4r s GLY 166 CO 0.02 -0.61 0.98 0.29 0.00 0.00 0.00 173.10 173.78 2j4r n ILE 167 N 1.21 1.92 -0.11 0.90 -5.35 -1.24 -0.94 119.36 115.75 2j4r n ILE 167 Ca -0.13 0.50 -0.19 0.00 -0.27 0.00 0.00 62.75 62.66 2j4r n ILE 167 Cb 0.53 -1.50 -0.07 0.00 -1.74 0.00 0.00 39.64 36.87 2j4r n ILE 167 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 2j4r n VAL 168 N -1.48 1.51 0.01 7.28 0.24 -1.26 -3.28 118.33 121.34 2j4r n VAL 168 Ca 0.00 -0.09 0.01 0.00 -2.04 0.00 0.00 64.34 62.22 2j4r n VAL 168 Cb 0.02 -2.13 0.33 0.00 -1.47 0.00 0.00 33.84 30.60 2j4r n VAL 168 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2j4r h ASN 169 N -1.00 0.47 -0.63 -1.34 -1.07 -1.91 0.60 115.58 110.71 2j4r h ASN 169 Ca -0.33 -0.07 -0.06 0.00 0.07 0.00 0.00 56.30 55.91 2j4r h ASN 169 Cb 1.25 -0.12 -0.03 0.00 -2.07 0.00 0.00 38.32 37.35 2j4r h ASN 169 CO -0.20 0.50 0.16 0.25 0.07 0.00 0.00 177.43 178.20 2j4r h LEU 170 N 0.50 0.95 0.07 6.14 5.85 -1.24 0.22 115.31 127.79 2j4r h LEU 170 Ca 0.11 -0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.60 2j4r h LEU 170 Cb 0.24 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.02 2j4r h LEU 170 CO 0.00 0.93 -0.03 0.74 -0.34 0.00 0.00 178.44 179.74 2j4r h THR 171 N 0.92 1.18 -0.35 1.05 2.02 -1.14 -1.60 112.91 114.99 2j4r h THR 171 Ca 0.20 -0.91 0.07 0.00 0.77 0.00 0.00 66.41 66.54 2j4r h THR 171 Cb 0.35 1.76 -0.06 0.00 -1.74 0.00 0.00 68.15 68.45 2j4r h THR 171 CO 0.00 0.22 -0.06 -0.33 0.37 0.00 0.00 175.52 175.72 2j4r h GLU 172 N -0.51 0.03 0.73 6.66 5.08 0.31 0.31 114.58 127.18 2j4r h GLU 172 Ca -0.01 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 2j4r h GLU 172 Cb 0.44 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.69 2j4r h GLU 172 CO 0.02 0.02 -0.36 1.15 -1.00 0.00 0.00 179.01 178.84 2j4r h THR 173 N 0.03 0.27 0.00 1.13 2.02 -0.56 -3.37 112.91 112.43 2j4r h THR 173 Ca 0.17 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.25 2j4r h THR 173 Cb 0.25 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 2j4r h THR 173 CO -0.34 0.00 -1.45 0.49 0.37 0.00 0.00 175.52 174.59 2j4r n PHE 174 N -5.52 0.75 -3.61 3.16 3.72 -0.60 -4.73 117.46 110.63 2j4r n PHE 174 Ca -0.14 0.24 -0.38 0.00 -0.05 0.00 0.00 57.45 57.11 2j4r n PHE 174 Cb 0.40 -0.95 -0.07 0.00 -0.94 0.00 0.00 39.48 37.92 2j4r n PHE 174 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2j4r s PHE 175 N -3.13 3.69 0.19 1.38 0.08 0.11 -4.72 117.98 115.57 2j4r s PHE 175 Ca -0.03 -2.73 0.07 0.00 0.12 0.00 0.00 56.93 54.35 2j4r s PHE 175 Cb 0.10 -3.34 0.06 0.00 -0.57 0.00 0.00 43.02 39.27 2j4r s PHE 175 CO 0.82 -0.83 1.43 0.87 -0.10 0.00 0.00 175.22 177.42 2j4r h LYS 176 N 6.73 0.07 -6.20 0.44 1.79 -1.81 -3.44 116.57 114.15 2j4r h LYS 176 Ca 0.08 -0.08 -0.60 0.00 -2.18 0.00 0.00 60.65 57.87 2j4r h LYS 176 Cb 0.91 0.02 -0.08 0.00 -1.58 0.00 0.00 32.23 31.50 2j4r h LYS 176 CO 0.79 0.85 -0.59 -0.65 -1.08 0.00 0.00 179.45 178.77 2j4r s GLN 177 N -3.21 2.86 -0.30 3.15 1.11 -1.26 -5.05 119.66 116.95 2j4r s GLN 177 Ca -0.01 -0.80 0.03 0.00 0.01 0.00 0.00 55.36 54.59 2j4r s GLN 177 Cb 0.11 -2.66 0.08 0.00 -1.01 0.00 0.00 33.01 29.53 2j4r s GLN 177 CO 0.80 0.52 -0.01 0.34 0.01 0.00 0.00 175.29 176.95 2j4r s ASP 178 N -2.76 4.58 1.00 5.90 2.15 -1.26 -1.77 116.67 124.50 2j4r s ASP 178 Ca 0.30 -1.81 -0.16 0.00 0.43 0.00 0.00 52.55 51.31 2j4r s ASP 178 Cb -0.11 -1.55 0.20 0.00 -0.30 0.00 0.00 42.92 41.16 2j4r s ASP 178 CO 0.22 -0.30 1.24 -2.16 -0.17 0.00 0.00 175.17 174.00 2j4r s PRO 179 N 1.03 0.39 0.54 4.34 0.04 -1.26 -4.68 135.00 135.39 2j4r s PRO 179 Ca 0.03 -0.20 -0.16 0.00 0.04 0.00 0.00 61.00 60.71 2j4r s PRO 179 Cb -0.19 -1.80 -0.07 0.00 0.04 0.00 0.00 34.50 32.48 2j4r s PRO 179 CO -0.07 -2.62 1.01 -1.25 0.04 0.00 0.00 177.00 174.11 2j4r s PRO 180 N -5.68 3.78 0.82 0.56 0.04 -0.73 -4.98 135.00 128.81 2j4r s PRO 180 Ca 0.71 1.02 -0.12 0.00 0.04 0.00 0.00 61.00 62.65 2j4r s PRO 180 Cb -0.07 -2.11 0.08 0.00 0.04 0.00 0.00 34.50 32.44 2j4r s PRO 180 CO 0.53 -0.42 1.11 0.95 0.04 0.00 0.00 177.00 179.21 2j4r s THR 181 N -2.59 2.80 0.23 1.26 -4.23 -1.26 -4.81 115.64 107.04 2j4r s THR 181 Ca 0.60 0.26 -0.08 0.00 -1.18 0.00 0.00 61.69 61.30 2j4r s THR 181 Cb -0.12 -3.03 0.21 0.00 1.34 0.00 0.00 72.50 70.90 2j4r s THR 181 CO 0.33 -0.34 1.88 -0.33 -0.54 0.00 0.00 174.62 175.62 2j4r h GLU 182 N -1.16 1.20 -0.20 3.99 5.08 -1.99 -0.66 114.58 120.85 2j4r h GLU 182 Ca -0.48 -0.10 0.02 0.00 -1.00 0.00 0.00 59.36 57.81 2j4r h GLU 182 Cb 1.28 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 2j4r h GLU 182 CO 0.60 0.83 0.05 1.49 -1.00 0.00 0.00 179.01 180.98 2j4r h GLU 183 N 1.22 0.13 -0.08 2.33 4.81 -1.99 0.28 114.58 121.28 2j4r h GLU 183 Ca 0.32 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.58 2j4r h GLU 183 Cb -0.07 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.24 2j4r h GLU 183 CO -0.06 0.08 -0.16 0.93 -0.73 0.00 0.00 179.01 179.07 2j4r h GLU 184 N 0.13 -0.22 -0.57 1.92 5.08 -1.72 -1.19 114.58 118.00 2j4r h GLU 184 Ca 0.09 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.52 2j4r h GLU 184 Cb 0.08 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.33 2j4r h GLU 184 CO -0.11 -0.15 0.28 0.28 -1.00 0.00 0.00 179.01 178.31 2j4r h VAL 185 N -0.23 0.92 -0.65 3.13 2.07 -0.60 -0.17 116.25 120.73 2j4r h VAL 185 Ca 0.08 -0.18 0.04 0.00 0.82 0.00 0.00 66.70 67.46 2j4r h VAL 185 Cb 0.34 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.40 2j4r h VAL 185 CO -0.22 0.10 0.38 0.50 0.02 0.00 0.00 177.57 178.35 2j4r h LYS 186 N 0.54 0.70 -0.13 1.57 3.64 0.02 -1.33 116.57 121.57 2j4r h LYS 186 Ca 0.26 -0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 59.45 2j4r h LYS 186 Cb 0.20 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 2j4r h LYS 186 CO -0.19 0.46 -0.56 0.00 -2.27 0.00 0.00 179.45 176.89 2j4r h ARG 187 N 0.72 0.40 0.71 1.90 3.08 -0.77 -1.95 114.38 118.47 2j4r h ARG 187 Ca 0.28 -0.25 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 2j4r h ARG 187 Cb 0.11 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2j4r h ARG 187 CO -0.15 0.85 -0.38 0.35 -1.07 0.00 0.00 179.97 179.58 2j4r h PHE 188 N 0.30 -0.99 -0.66 3.04 3.57 -0.48 -1.50 116.94 120.23 2j4r h PHE 188 Ca 0.00 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.50 2j4r h PHE 188 Cb 1.07 0.34 -0.03 0.00 2.79 0.00 0.00 35.95 40.12 2j4r h PHE 188 CO 0.03 -0.59 0.44 0.74 -2.23 0.00 0.00 178.31 176.70 2j4r h PHE 189 N -1.01 0.81 -0.22 0.41 0.04 -1.26 -1.83 116.94 113.89 2j4r h PHE 189 Ca -0.09 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.70 2j4r h PHE 189 Cb 0.79 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 38.65 2j4r h PHE 189 CO -0.05 0.50 0.14 0.93 -0.60 0.00 0.00 178.31 179.22 2j4r h GLU 190 N 0.86 0.28 -0.89 1.51 5.08 -1.13 -1.18 114.58 119.11 2j4r h GLU 190 Ca 0.25 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.61 2j4r h GLU 190 Cb -0.04 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.10 2j4r h GLU 190 CO -0.06 0.18 0.59 0.35 -1.00 0.00 0.00 179.01 179.07 2j4r h PHE 191 N 0.28 1.11 -0.60 4.33 3.57 -0.73 -2.13 116.94 122.77 2j4r h PHE 191 Ca 0.08 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.55 2j4r h PHE 191 Cb -0.02 -0.38 -0.03 0.00 2.79 0.00 0.00 35.95 38.31 2j4r h PHE 191 CO -0.07 0.69 0.16 -0.07 -2.23 0.00 0.00 178.31 176.79 2j4r h LEU 192 N 1.19 0.87 -1.02 0.59 4.07 -0.71 -1.92 115.31 118.38 2j4r h LEU 192 Ca 0.33 -0.16 -0.10 0.00 0.08 0.00 0.00 57.88 58.03 2j4r h LEU 192 Cb -0.12 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.38 2j4r h LEU 192 CO -0.07 0.84 -0.38 -0.08 -1.08 0.00 0.00 178.44 177.66 2j4r h GLU 193 N 0.90 0.20 -0.07 1.13 4.81 -0.60 -0.17 114.58 120.77 2j4r h GLU 193 Ca 0.20 -0.09 -0.03 0.00 -0.13 0.00 0.00 59.36 59.31 2j4r h GLU 193 Cb 0.30 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 2j4r h GLU 193 CO -0.00 0.56 -0.07 -0.22 -0.73 0.00 0.00 179.01 178.55 2j4r h LYS 194 N 0.17 0.17 -0.01 1.92 3.64 -1.01 -3.01 116.57 118.45 2j4r h LYS 194 Ca 0.02 -0.09 -0.12 0.00 -1.27 0.00 0.00 60.65 59.19 2j4r h LYS 194 Cb 0.76 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.57 2j4r h LYS 194 CO 0.06 0.60 -0.55 1.49 -2.27 0.00 0.00 179.45 178.78 2j4r h GLU 195 N -0.25 0.02 -0.15 1.90 4.57 -1.30 -3.27 114.58 116.09 2j4r h GLU 195 Ca 0.01 -0.01 -0.17 0.00 -1.18 0.00 0.00 59.36 58.01 2j4r h GLU 195 Cb 0.57 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.15 2j4r h GLU 195 CO 0.02 0.56 -0.61 -0.07 -1.18 0.00 0.00 179.01 177.73 2j4r h LEU 196 N 0.01 0.60 -2.19 1.64 4.07 -1.04 -2.77 115.31 115.63 2j4r h LEU 196 Ca -0.01 -0.34 0.00 0.00 0.08 0.00 0.00 57.88 57.61 2j4r h LEU 196 Cb 0.98 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 42.54 2j4r h LEU 196 CO 0.07 1.06 0.23 0.77 -1.08 0.00 0.00 178.44 179.49 2j4r h SER 197 N 0.39 0.00 0.62 -0.43 4.64 -1.57 1.16 113.55 118.36 2j4r h SER 197 Ca -0.01 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2j4r h SER 197 Cb 1.17 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2j4r h SER 197 CO 0.11 0.00 -0.08 0.11 -0.87 0.00 0.00 176.83 176.10 2j4r h LYS 198 N 0.00 0.00 -0.00 4.77 1.57 -1.65 -3.12 116.57 118.13 2j4r h LYS 198 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2j4r h LYS 198 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2j4r h LYS 198 CO 0.00 0.08 -0.01 1.33 -0.57 0.00 0.00 179.45 180.29 2j4r n VAL 199 N -3.33 0.00 -1.54 0.50 0.24 0.38 -5.06 118.33 109.51 2j4r n VAL 199 Ca -0.01 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.34 61.38 2j4r n VAL 199 Cb 0.27 1.00 0.01 0.00 -1.47 0.00 0.00 33.84 33.65 2j4r n VAL 199 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2j4r n LYS 200 N -0.67 0.97 0.00 7.34 4.81 0.22 -4.98 118.16 125.85 2j4r n LYS 200 Ca 0.00 0.35 0.00 0.00 -0.87 0.00 0.00 58.31 57.79 2j4r n LYS 200 Cb 0.00 -1.82 0.00 0.00 0.02 0.00 0.00 35.03 33.23 2j4r n LYS 200 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 2j4r n LYS 201 N 0.23 0.00 -2.31 1.64 2.85 -1.26 -5.02 118.16 114.29 2j4r n LYS 201 Ca 0.11 0.00 -0.41 0.00 -1.05 0.00 0.00 58.31 56.96 2j4r n LYS 201 Cb 0.40 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 34.75 2j4r n LYS 201 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 2j4r s PRO 202 N -2.00 4.47 0.05 -1.58 0.04 -1.26 -4.91 135.00 129.81 2j4r s PRO 202 Ca 0.00 1.96 -0.07 0.00 0.04 0.00 0.00 61.00 62.94 2j4r s PRO 202 Cb 0.00 -3.19 -0.01 0.00 0.04 0.00 0.00 34.50 31.34 2j4r s PRO 202 CO 0.00 -0.10 0.13 0.14 0.04 0.00 0.00 177.00 177.21 2j4r s VAL 203 N -0.37 0.14 -0.17 -0.36 -7.23 -1.26 -4.98 120.40 106.18 2j4r s VAL 203 Ca 0.52 -1.17 -0.11 0.00 -1.81 0.00 0.00 61.98 59.41 2j4r s VAL 203 Cb -0.35 -1.10 -0.22 0.00 0.56 0.00 0.00 36.38 35.27 2j4r s VAL 203 CO 0.40 -0.64 0.23 0.47 -0.31 0.00 0.00 175.10 175.25 2j4r n ASP 204 N 0.44 2.02 -3.84 4.85 8.00 0.35 -4.95 116.55 123.42 2j4r n ASP 204 Ca -0.17 0.26 -0.19 0.00 0.71 0.00 0.00 54.79 55.40 2j4r n ASP 204 Cb 0.60 -0.86 -0.16 0.00 -0.02 0.00 0.00 41.12 40.67 2j4r n ASP 204 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2j4r s THR 205 N -2.49 0.35 -0.02 -3.53 2.01 -1.03 -5.03 115.64 105.91 2j4r s THR 205 Ca -0.26 0.01 0.01 0.00 0.31 0.00 0.00 61.69 61.75 2j4r s THR 205 Cb 0.07 -0.43 -0.03 0.00 0.01 0.00 0.00 72.50 72.11 2j4r s THR 205 CO 0.68 0.20 -0.01 -0.63 -0.69 0.00 0.00 174.62 174.17 2j4r s ILE 206 N 1.13 4.14 -0.07 1.82 1.01 -1.26 -0.08 121.20 127.88 2j4r s ILE 206 Ca -0.08 -0.54 -0.00 0.00 0.00 0.00 0.00 60.65 60.02 2j4r s ILE 206 Cb -0.14 -2.82 0.02 0.00 0.01 0.00 0.00 42.46 39.54 2j4r s ILE 206 CO -0.01 0.43 -0.04 -0.69 0.00 0.00 0.00 174.94 174.62 2j4r s VAL 207 N -1.04 0.64 -0.02 2.92 1.01 -0.05 -2.27 120.40 121.61 2j4r s VAL 207 Ca 0.18 -0.10 -0.00 0.00 0.00 0.00 0.00 61.98 62.06 2j4r s VAL 207 Cb -0.11 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.53 2j4r s VAL 207 CO 0.08 0.28 0.04 -0.83 0.00 0.00 0.00 175.10 174.68 2j4r s GLY 208 N 1.46 1.95 0.12 4.51 0.00 0.74 -0.08 107.32 116.02 2j4r s GLY 208 Ca -0.02 -0.89 -0.08 0.00 0.00 0.00 0.00 44.72 43.73 2j4r s GLY 208 CO -0.03 -0.75 0.21 0.48 0.00 0.00 0.00 173.10 173.01 2j4r s LEU 209 N -1.56 1.30 0.00 0.66 0.05 -0.86 -2.11 118.68 116.16 2j4r s LEU 209 Ca 0.20 -0.75 0.00 0.00 0.05 0.00 0.00 54.13 53.63 2j4r s LEU 209 Cb -0.12 1.05 0.00 0.00 -2.05 0.00 0.00 46.19 45.07 2j4r s LEU 209 CO 0.11 -0.78 0.00 0.61 -0.55 0.00 0.00 176.35 175.74 2j4r n GLY 210 N -0.11 2.69 0.32 -3.48 0.00 -1.26 -2.92 105.19 100.43 2j4r n GLY 210 Ca -0.12 -2.10 -0.08 0.00 0.00 0.00 0.00 46.02 43.71 2j4r n GLY 210 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2j4r h GLY 211 N 0.00 -0.26 0.45 -0.02 0.00 -1.99 -1.80 103.07 99.44 2j4r h GLY 211 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.71 2j4r h GLY 211 CO 0.00 -0.21 -0.42 -0.84 0.00 0.00 0.00 176.54 175.07 2j4r h THR 212 N -0.28 0.16 -0.80 4.70 2.02 -1.91 -0.58 112.91 116.23 2j4r h THR 212 Ca 0.15 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.38 2j4r h THR 212 Cb 0.52 0.16 -0.05 0.00 -1.74 0.00 0.00 68.15 67.04 2j4r h THR 212 CO -0.45 0.00 0.52 -0.29 0.37 0.00 0.00 175.52 175.67 2j4r h ILE 213 N -0.76 1.07 0.00 3.11 6.09 -1.81 0.74 117.51 125.95 2j4r h ILE 213 Ca -0.01 -0.31 -0.09 0.00 -1.37 0.00 0.00 64.86 63.08 2j4r h ILE 213 Cb 0.72 0.09 -0.01 0.00 0.47 0.00 0.00 36.82 38.09 2j4r h ILE 213 CO -0.14 0.16 -0.42 0.71 -3.07 0.00 0.00 178.15 175.39 2j4r h THR 214 N 0.90 0.82 -0.04 2.19 1.35 -1.08 -2.23 112.91 114.82 2j4r h THR 214 Ca 0.33 -1.82 -0.23 0.00 -0.55 0.00 0.00 66.41 64.14 2j4r h THR 214 Cb 0.17 2.16 0.02 0.00 -1.73 0.00 0.00 68.15 68.77 2j4r h THR 214 CO -0.11 0.41 -0.87 0.74 -0.25 0.00 0.00 175.52 175.44 2j4r h THR 215 N 0.00 1.31 -0.99 6.82 2.02 -0.00 -2.88 112.91 119.19 2j4r h THR 215 Ca -0.00 -2.12 0.04 0.00 0.77 0.00 0.00 66.41 65.09 2j4r h THR 215 Cb 1.13 2.32 -0.06 0.00 -1.74 0.00 0.00 68.15 69.80 2j4r h THR 215 CO 0.05 0.65 0.64 0.25 0.37 0.00 0.00 175.52 177.49 2j4r h LEU 216 N 0.31 1.07 -1.29 2.58 5.85 -0.78 -0.52 115.31 122.54 2j4r h LEU 216 Ca -0.10 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.55 2j4r h LEU 216 Cb 1.53 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 2j4r h LEU 216 CO 0.17 0.73 -0.32 0.00 -0.34 0.00 0.00 178.44 178.68 2j4r h ALA 217 N 1.41 1.23 0.00 1.25 0.00 -1.39 -1.92 119.26 119.83 2j4r h ALA 217 Ca 0.39 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 2j4r h ALA 217 Cb 0.01 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.76 2j4r h ALA 217 CO -0.13 0.40 -0.35 0.00 0.00 0.00 0.00 179.25 179.18 2j4r h ALA 218 N 1.68 0.04 0.07 0.00 0.00 -1.02 -2.17 119.26 117.86 2j4r h ALA 218 Ca -0.00 -0.50 0.03 0.00 0.00 0.00 0.00 54.91 54.43 2j4r h ALA 218 Cb 0.67 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 2j4r h ALA 218 CO 0.04 0.16 -0.38 -0.07 0.00 0.00 0.00 179.25 179.00 2j4r h LEU 219 N -0.40 -1.14 -0.70 0.00 4.07 -1.03 0.35 115.31 116.48 2j4r h LEU 219 Ca -0.04 0.13 0.06 0.00 0.08 0.00 0.00 57.88 58.11 2j4r h LEU 219 Cb 1.10 0.44 -0.06 0.00 1.08 0.00 0.00 40.66 43.22 2j4r h LEU 219 CO 0.07 -0.45 0.39 -0.08 -1.08 0.00 0.00 178.44 177.29 2j4r h GLU 220 N -0.58 0.68 -0.54 1.13 4.57 -1.43 -2.93 114.58 115.48 2j4r h GLU 220 Ca 0.04 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2j4r h GLU 220 Cb 0.63 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.07 2j4r h GLU 220 CO -0.26 0.45 0.00 0.66 -1.18 0.00 0.00 179.01 178.68 2j4r n TYR 221 N -4.78 1.65 -3.96 0.92 4.01 -0.81 -4.99 117.16 109.19 2j4r n TYR 221 Ca 0.09 -0.71 -0.40 0.00 -0.16 0.00 0.00 57.90 56.72 2j4r n TYR 221 Cb 0.19 -0.38 0.02 0.00 -0.31 0.00 0.00 39.34 38.86 2j4r n TYR 221 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2j4r n ASN 222 N 0.58 -4.47 -4.13 7.72 4.13 0.12 -4.94 115.26 114.27 2j4r n ASN 222 Ca 0.26 -1.19 -0.37 0.00 1.68 0.00 0.00 54.58 54.96 2j4r n ASN 222 Cb 1.03 -1.88 -0.10 0.00 -1.54 0.00 0.00 39.78 37.28 2j4r n ASN 222 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2j4r s VAL 223 N -3.40 3.59 0.00 2.41 1.01 -0.85 -5.00 120.40 118.17 2j4r s VAL 223 Ca 0.38 -2.26 0.00 0.00 0.00 0.00 0.00 61.98 60.10 2j4r s VAL 223 Cb -0.20 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.77 2j4r s VAL 223 CO 0.94 -0.76 0.00 0.00 0.00 0.00 0.00 175.10 175.28 2j4r n TYR 224 N 4.34 0.00 -1.60 5.22 9.36 -1.26 -4.45 117.16 128.78 2j4r n TYR 224 Ca -0.00 0.00 -0.41 0.00 3.32 0.00 0.00 57.90 60.80 2j4r n TYR 224 Cb 0.40 -0.32 -0.03 0.00 -0.63 0.00 0.00 39.34 38.76 2j4r n TYR 224 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 2j4r s PRO 225 N -0.77 2.88 -0.11 2.98 0.04 -1.26 -4.76 135.00 134.01 2j4r s PRO 225 Ca 0.00 1.88 -0.36 0.00 0.04 0.00 0.00 61.00 62.56 2j4r s PRO 225 Cb 0.00 -4.42 -0.13 0.00 0.04 0.00 0.00 34.50 29.98 2j4r s PRO 225 CO 0.00 -2.39 1.79 0.98 0.04 0.00 0.00 177.00 177.42 2j4r n TYR 226 N 12.69 2.21 -4.15 0.56 9.36 -1.26 -4.98 117.16 131.59 2j4r n TYR 226 Ca 0.31 0.20 -0.28 0.00 3.32 0.00 0.00 57.90 61.46 2j4r n TYR 226 Cb 0.47 -2.58 -0.17 0.00 -0.63 0.00 0.00 39.34 36.44 2j4r n TYR 226 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2j4r s ASP 227 N 3.42 2.34 0.29 2.98 -1.08 -1.26 -5.03 116.67 118.33 2j4r s ASP 227 Ca 0.92 -0.38 0.00 0.00 -0.52 0.00 0.00 52.55 52.57 2j4r s ASP 227 Cb -0.81 -1.00 0.52 0.00 -1.46 0.00 0.00 42.92 40.18 2j4r s ASP 227 CO 0.54 -0.05 1.89 -0.65 0.52 0.00 0.00 175.17 177.42 2j4r h PRO 228 N 7.82 1.01 0.00 4.34 0.11 -1.99 -2.38 132.00 140.90 2j4r h PRO 228 Ca -0.33 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2j4r h PRO 228 Cb 1.15 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.03 2j4r h PRO 228 CO 0.47 0.67 0.00 1.04 -0.21 0.00 0.00 178.00 179.97 2j4r n GLN 229 N -4.51 0.17 -0.31 1.05 6.02 -1.26 0.03 117.38 118.58 2j4r n GLN 229 Ca 0.15 0.39 0.11 0.00 -0.01 0.00 0.00 57.00 57.64 2j4r n GLN 229 Cb 0.23 -1.82 0.28 0.00 1.02 0.00 0.00 30.24 29.94 2j4r n GLN 229 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2j4r n LYS 230 N -2.15 2.67 0.00 -1.09 5.02 -0.90 -4.53 118.16 117.18 2j4r n LYS 230 Ca 0.02 -2.49 0.00 0.00 -2.02 0.00 0.00 58.31 53.82 2j4r n LYS 230 Cb 0.23 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 33.73 2j4r n LYS 230 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2j4r n VAL 231 N 1.45 0.00 -2.05 -0.18 0.31 -0.71 -4.96 118.33 112.19 2j4r n VAL 231 Ca 0.22 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 64.13 2j4r n VAL 231 Cb 0.59 -0.56 -0.03 0.00 -0.91 0.00 0.00 33.84 32.93 2j4r n VAL 231 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 2j4r s HIS 232 N -1.72 3.14 0.00 3.52 5.65 0.10 -2.36 115.29 123.63 2j4r s HIS 232 Ca 0.00 0.86 0.00 0.00 0.25 0.00 0.00 55.06 56.17 2j4r s HIS 232 Cb 0.00 -3.80 0.00 0.00 -1.18 0.00 0.00 32.58 27.60 2j4r s HIS 232 CO 0.00 -2.80 0.00 0.41 -0.65 0.00 0.00 174.74 171.70 2j4r n GLY 233 N 3.30 0.70 3.91 1.59 0.00 -0.48 -4.90 105.19 109.31 2j4r n GLY 233 Ca 0.11 -0.01 -0.27 0.00 0.00 0.00 0.00 46.02 45.85 2j4r n GLY 233 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j4r s LYS 234 N -0.41 3.58 0.29 1.61 -0.14 -0.99 -4.88 119.74 118.80 2j4r s LYS 234 Ca 0.00 0.05 0.07 0.00 -1.36 0.00 0.00 55.97 54.73 2j4r s LYS 234 Cb 0.00 -2.52 -0.03 0.00 -1.68 0.00 0.00 37.83 33.60 2j4r s LYS 234 CO 0.00 0.02 0.30 0.08 -0.76 0.00 0.00 175.35 174.99 2j4r s VAL 235 N -2.41 4.19 -0.23 3.17 1.01 -1.26 -1.26 120.40 123.60 2j4r s VAL 235 Ca 0.45 -1.26 -0.04 0.00 0.00 0.00 0.00 61.98 61.13 2j4r s VAL 235 Cb -0.10 -3.40 0.12 0.00 0.00 0.00 0.00 36.38 33.00 2j4r s VAL 235 CO 0.37 -0.25 0.40 -0.22 0.00 0.00 0.00 175.10 175.40 2j4r s LEU 236 N -3.97 -0.68 0.58 3.92 2.96 -0.73 -4.91 118.68 115.84 2j4r s LEU 236 Ca 0.38 0.51 -0.05 0.00 -0.22 0.00 0.00 54.13 54.75 2j4r s LEU 236 Cb -0.08 1.25 0.01 0.00 0.50 0.00 0.00 46.19 47.88 2j4r s LEU 236 CO 0.27 -0.28 0.88 0.42 -1.32 0.00 0.00 176.35 176.33 2j4r s THR 237 N 2.59 3.53 0.13 3.68 -4.23 -1.26 -1.88 115.64 118.20 2j4r s THR 237 Ca 0.09 -0.10 -0.19 0.00 -1.18 0.00 0.00 61.69 60.31 2j4r s THR 237 Cb -0.14 -3.40 -0.02 0.00 1.34 0.00 0.00 72.50 70.28 2j4r s THR 237 CO -0.15 -0.39 1.71 0.22 -0.54 0.00 0.00 174.62 175.47 2j4r h TYR 238 N -0.15 -0.05 -0.45 3.99 3.20 -1.53 -1.44 116.97 120.54 2j4r h TYR 238 Ca -0.45 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.48 2j4r h TYR 238 Cb 1.26 0.06 -0.04 0.00 1.54 0.00 0.00 36.73 39.55 2j4r h TYR 238 CO 0.45 -0.06 0.20 0.78 -1.64 0.00 0.00 178.16 177.89 2j4r h GLY 239 N 0.04 0.61 0.97 1.82 0.00 -1.95 0.62 103.07 105.18 2j4r h GLY 239 Ca 0.11 -0.13 0.01 0.00 0.00 0.00 0.00 47.33 47.32 2j4r h GLY 239 CO -0.20 0.07 0.37 1.46 0.00 0.00 0.00 176.54 178.24 2j4r h GLN 240 N 0.39 0.73 -0.26 4.80 4.20 -1.87 0.96 115.11 124.07 2j4r h GLN 240 Ca 0.20 -0.04 -0.13 0.00 0.06 0.00 0.00 58.65 58.74 2j4r h GLN 240 Cb 0.15 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 2j4r h GLN 240 CO -0.17 0.48 -0.35 0.82 -0.67 0.00 0.00 178.83 178.94 2j4r h ILE 241 N 0.75 1.31 -0.58 2.54 2.04 -0.77 -2.84 117.51 119.97 2j4r h ILE 241 Ca 0.21 -1.54 0.04 0.00 1.00 0.00 0.00 64.86 64.57 2j4r h ILE 241 Cb -0.06 1.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.66 2j4r h ILE 241 CO -0.06 0.49 0.33 0.50 0.00 0.00 0.00 178.15 179.41 2j4r h LYS 242 N 0.42 0.63 -0.12 2.37 3.64 0.57 -1.72 116.57 122.35 2j4r h LYS 242 Ca 0.03 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2j4r h LYS 242 Cb 0.94 -0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.56 2j4r h LYS 242 CO 0.08 0.42 -0.42 -0.22 -2.27 0.00 0.00 179.45 177.04 2j4r h LYS 243 N 0.65 -0.41 0.00 1.90 3.64 -0.71 0.78 116.57 122.41 2j4r h LYS 243 Ca 0.24 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.64 2j4r h LYS 243 Cb 0.08 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.99 2j4r h LYS 243 CO -0.13 -0.28 -0.06 -1.49 -2.27 0.00 0.00 179.45 175.22 2j4r h TRP 244 N -0.43 0.00 0.15 1.91 4.06 -1.36 -0.77 115.95 119.52 2j4r h TRP 244 Ca 0.03 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.97 2j4r h TRP 244 Cb 0.51 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.67 2j4r h TRP 244 CO -0.57 0.06 -0.07 0.35 -3.56 0.00 0.00 178.44 174.65 2j4r h PHE 245 N 0.00 -0.19 -0.73 0.49 3.57 -0.27 -0.64 116.94 119.17 2j4r h PHE 245 Ca -0.00 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.55 2j4r h PHE 245 Cb 0.15 0.06 -0.06 0.00 2.79 0.00 0.00 35.95 38.90 2j4r h PHE 245 CO 0.00 0.18 0.43 -0.44 -2.23 0.00 0.00 178.31 176.25 2j4r h ASP 246 N -0.60 0.65 0.60 0.41 3.32 -0.34 0.16 116.42 120.62 2j4r h ASP 246 Ca -0.02 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2j4r h ASP 246 Cb 0.45 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 2j4r h ASP 246 CO 0.03 0.42 -0.46 0.74 -1.72 0.00 0.00 179.24 178.26 2j4r h THR 247 N 0.78 0.09 0.00 0.35 2.02 -1.09 -2.81 112.91 112.25 2j4r h THR 247 Ca 0.32 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.49 2j4r h THR 247 Cb 0.18 0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 66.68 2j4r h THR 247 CO -0.18 0.00 -0.06 -0.26 0.37 0.00 0.00 175.52 175.39 2j4r h PHE 248 N -1.02 0.00 0.00 3.16 -1.00 -0.79 -2.59 116.94 114.70 2j4r h PHE 248 Ca -0.07 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.71 2j4r h PHE 248 Cb 0.86 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.42 2j4r h PHE 248 CO -0.17 0.06 -0.04 1.57 -1.61 0.00 0.00 178.31 178.12 2j4r h LYS 249 N 0.00 0.00 0.04 1.51 2.10 -0.84 -3.29 116.57 116.10 2j4r h LYS 249 Ca -0.00 0.00 -0.24 0.00 -2.00 0.00 0.00 60.65 58.41 2j4r h LYS 249 Cb 0.41 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.74 2j4r h LYS 249 CO 0.01 0.00 -1.03 0.93 -2.00 0.00 0.00 179.45 177.36 2j4r h GLU 250 N 0.00 0.36 -6.18 0.07 5.08 -1.20 -3.43 114.58 109.27 2j4r h GLU 250 Ca 0.00 -0.44 -0.51 0.00 -1.00 0.00 0.00 59.36 57.40 2j4r h GLU 250 Cb 0.97 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 30.31 2j4r h GLU 250 CO 0.00 1.13 -0.52 0.96 -1.00 0.00 0.00 179.01 179.59 2j4r s ILE 251 N -3.09 3.79 0.89 3.13 -4.36 -1.23 -4.89 121.20 115.44 2j4r s ILE 251 Ca -0.05 -1.50 -0.12 0.00 -0.26 0.00 0.00 60.65 58.72 2j4r s ILE 251 Cb 0.08 -3.19 0.13 0.00 1.25 0.00 0.00 42.46 40.73 2j4r s ILE 251 CO 0.87 -0.27 1.12 -2.84 0.24 0.00 0.00 174.94 174.06 2j4r s PRO 252 N -3.87 1.29 0.23 0.37 0.02 -1.26 -4.41 135.00 127.36 2j4r s PRO 252 Ca 0.36 0.45 -0.08 0.00 0.02 0.00 0.00 61.00 61.75 2j4r s PRO 252 Cb -0.06 -1.84 0.21 0.00 0.02 0.00 0.00 34.50 32.82 2j4r s PRO 252 CO 0.24 -2.13 1.90 0.77 -0.33 0.00 0.00 177.00 177.46 2j4r h SER 253 N -1.46 1.00 -0.67 2.53 0.02 -1.86 -2.21 113.55 110.91 2j4r h SER 253 Ca -0.50 -0.02 0.13 0.00 -0.84 0.00 0.00 61.79 60.56 2j4r h SER 253 Cb 1.31 -0.25 -0.13 0.00 0.14 0.00 0.00 62.40 63.48 2j4r h SER 253 CO 0.60 0.72 -0.16 -0.33 -1.14 0.00 0.00 176.83 176.52 2j4r h GLU 254 N 1.18 0.00 -0.17 3.45 4.39 -1.92 0.65 114.58 122.17 2j4r h GLU 254 Ca 0.32 -0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.85 2j4r h GLU 254 Cb -0.13 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.52 2j4r h GLU 254 CO -0.07 0.00 -0.61 0.93 -1.16 0.00 0.00 179.01 178.10 2j4r h GLU 255 N 0.00 0.57 0.34 2.33 5.08 -1.84 -2.55 114.58 118.52 2j4r h GLU 255 Ca 0.32 -0.39 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2j4r h GLU 255 Cb 0.49 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.77 2j4r h GLU 255 CO -0.69 1.00 -0.44 0.00 -1.00 0.00 0.00 179.01 177.89 2j4r h ARG 256 N 0.42 -0.78 -0.50 2.33 3.08 -0.30 1.14 114.38 119.76 2j4r h ARG 256 Ca -0.01 0.05 -0.07 0.00 0.07 0.00 0.00 59.98 60.03 2j4r h ARG 256 Cb 1.17 0.18 -0.02 0.00 0.08 0.00 0.00 29.97 31.38 2j4r h ARG 256 CO 0.11 -0.52 0.03 0.66 -1.07 0.00 0.00 179.97 179.19 2j4r h SER 257 N -0.81 0.78 0.88 7.04 4.64 -1.41 -1.73 113.55 122.94 2j4r h SER 257 Ca -0.04 -0.18 -0.04 0.00 -0.47 0.00 0.00 61.79 61.06 2j4r h SER 257 Cb 0.73 -0.21 0.01 0.00 -0.31 0.00 0.00 62.40 62.62 2j4r h SER 257 CO -0.11 0.83 -0.42 0.50 -0.87 0.00 0.00 176.83 176.76 2j4r h LYS 258 N 0.77 -1.13 -0.01 4.77 3.64 -1.07 -3.19 116.57 120.35 2j4r h LYS 258 Ca 0.15 0.08 -0.02 0.00 -1.27 0.00 0.00 60.65 59.59 2j4r h LYS 258 Cb 0.42 0.26 -0.00 0.00 -0.41 0.00 0.00 32.23 32.49 2j4r h LYS 258 CO 0.01 -0.76 -0.09 -0.09 -2.27 0.00 0.00 179.45 176.26 2j4r h ARG 259 N -1.32 0.01 -5.72 1.90 9.65 0.13 -3.42 114.38 115.62 2j4r h ARG 259 Ca -0.12 -0.00 -0.67 0.00 -1.10 0.00 0.00 59.98 58.09 2j4r h ARG 259 Cb 0.90 -0.00 -0.27 0.00 -1.39 0.00 0.00 29.97 29.21 2j4r h ARG 259 CO 0.20 0.11 -0.79 -0.06 2.80 0.00 0.00 179.97 182.23 2j4r s PHE 260 N -4.85 2.71 0.03 2.20 0.40 -0.65 -5.02 117.98 112.80 2j4r s PHE 260 Ca -0.04 -0.53 -0.22 0.00 -0.60 0.00 0.00 56.93 55.54 2j4r s PHE 260 Cb 0.16 -1.74 -0.15 0.00 0.51 0.00 0.00 43.02 41.81 2j4r s PHE 260 CO 0.69 -0.10 1.38 0.00 0.70 0.00 0.00 175.22 177.88 2j4r h ARG 261 N 6.20 0.25 0.00 0.44 3.08 -1.83 -3.10 114.38 119.42 2j4r h ARG 261 Ca -0.32 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.61 2j4r h ARG 261 Cb 1.19 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.24 2j4r h ARG 261 CO 0.52 0.60 0.00 0.00 -1.07 0.00 0.00 179.97 180.03 2j4r n GLN 262 N -4.69 0.62 -3.47 0.04 0.00 -1.26 -4.50 117.38 104.13 2j4r n GLN 262 Ca -0.06 0.00 -0.43 0.00 0.00 0.00 0.00 57.00 56.51 2j4r n GLN 262 Cb 0.29 -1.39 -0.07 0.00 0.00 0.00 0.00 30.24 29.06 2j4r n GLN 262 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 2j4r s VAL 263 N -2.00 4.63 0.00 -0.39 1.01 -1.17 -4.99 120.40 117.49 2j4r s VAL 263 Ca 0.23 -1.57 0.00 0.00 0.00 0.00 0.00 61.98 60.64 2j4r s VAL 263 Cb 0.11 -3.97 0.00 0.00 0.00 0.00 0.00 36.38 32.52 2j4r s VAL 263 CO 0.18 -0.75 0.00 1.21 0.00 0.00 0.00 175.10 175.74 2j4r n GLU 264 N 5.05 0.85 -0.00 2.72 4.07 -1.26 -4.43 120.64 127.63 2j4r n GLU 264 Ca -0.11 0.00 0.02 0.00 -0.06 0.00 0.00 57.16 57.02 2j4r n GLU 264 Cb 0.41 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.76 2j4r n GLU 264 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2j4r n ASP 265 N -0.57 2.43 0.03 4.31 9.92 -1.26 -3.93 116.55 127.48 2j4r n ASP 265 Ca 0.00 -0.24 -0.19 0.00 -0.53 0.00 0.00 54.79 53.82 2j4r n ASP 265 Cb 0.00 1.13 -0.14 0.00 -0.64 0.00 0.00 41.12 41.47 2j4r n ASP 265 CO 0.00 0.00 0.00 -0.09 0.13 0.00 0.00 177.20 177.24 2j4r h ARG 266 N 0.00 0.26 0.00 -1.24 2.43 -2.03 -3.25 114.38 110.56 2j4r h ARG 266 Ca 0.00 -0.45 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2j4r h ARG 266 Cb 0.17 0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 2j4r h ARG 266 CO 0.00 1.21 0.00 0.00 -1.51 0.00 0.00 179.97 179.67 2j4r h ARG 267 N -0.45 0.00 -0.94 0.20 3.08 -1.97 -3.35 114.38 110.95 2j4r h ARG 267 Ca -0.13 0.00 0.23 0.00 0.07 0.00 0.00 59.98 60.16 2j4r h ARG 267 Cb 1.57 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 31.44 2j4r h ARG 267 CO 0.13 0.00 -0.07 0.00 -1.07 0.00 0.00 179.97 178.96 2j4r n ALA 268 N -1.98 0.39 -0.08 0.04 0.00 -1.23 0.14 120.51 117.80 2j4r n ALA 268 Ca 0.03 1.02 -0.16 0.00 0.00 0.00 0.00 53.44 54.34 2j4r n ALA 268 Cb 0.42 -0.70 -0.11 0.00 0.00 0.00 0.00 19.45 19.06 2j4r n ALA 268 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2j4r h LYS 269 N 0.00 0.00 0.00 0.00 3.64 -1.78 -3.36 116.57 115.08 2j4r h LYS 269 Ca 0.53 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.91 2j4r h LYS 269 Cb 1.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 2j4r h LYS 269 CO -0.92 0.88 0.00 1.33 -2.27 0.00 0.00 179.45 178.47 2j4r n VAL 270 N -4.55 0.67 -0.03 2.00 0.24 -0.97 -3.52 118.33 112.17 2j4r n VAL 270 Ca -0.18 0.17 0.17 0.00 -2.04 0.00 0.00 64.34 62.46 2j4r n VAL 270 Cb 0.52 -0.87 0.62 0.00 -1.47 0.00 0.00 33.84 32.64 2j4r n VAL 270 CO 0.00 0.00 0.00 -0.29 -2.14 0.00 0.00 176.83 174.40 2j4r h ILE 271 N 0.00 0.78 -0.17 1.34 6.09 0.11 -2.74 117.51 122.93 2j4r h ILE 271 Ca 0.00 -0.05 -0.04 0.00 -1.37 0.00 0.00 64.86 63.40 2j4r h ILE 271 Cb 0.25 0.63 -0.00 0.00 0.47 0.00 0.00 36.82 38.17 2j4r h ILE 271 CO 0.00 0.03 -0.06 0.25 -3.07 0.00 0.00 178.15 175.30 2j4r h LEU 272 N 0.14 0.34 -0.28 2.19 5.85 -1.82 -2.80 115.31 118.93 2j4r h LEU 272 Ca 0.26 -0.39 0.03 0.00 0.84 0.00 0.00 57.88 58.63 2j4r h LEU 272 Cb 0.86 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.77 2j4r h LEU 272 CO -0.04 0.65 0.09 0.00 -0.34 0.00 0.00 178.44 178.80 2j4r h ALA 273 N 0.70 0.31 -0.71 1.25 0.00 -1.75 0.15 119.26 119.21 2j4r h ALA 273 Ca 0.04 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.04 2j4r h ALA 273 Cb 0.51 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 2j4r h ALA 273 CO 0.02 -0.32 0.42 0.78 0.00 0.00 0.00 179.25 180.14 2j4r h GLY 274 N 0.21 1.05 0.99 0.00 0.00 -1.59 0.16 103.07 103.88 2j4r h GLY 274 Ca 0.12 -0.30 -0.05 0.00 0.00 0.00 0.00 47.33 47.11 2j4r h GLY 274 CO -0.14 0.20 0.15 -2.22 0.00 0.00 0.00 176.54 174.54 2j4r h ILE 275 N 0.77 1.24 -0.93 2.60 2.04 -1.15 -2.45 117.51 119.63 2j4r h ILE 275 Ca 0.31 -0.82 0.05 0.00 1.00 0.00 0.00 64.86 65.40 2j4r h ILE 275 Cb 0.15 0.75 -0.06 0.00 -0.74 0.00 0.00 36.82 36.93 2j4r h ILE 275 CO -0.17 0.30 0.60 1.23 0.00 0.00 0.00 178.15 180.11 2j4r h GLY 276 N 0.74 1.39 0.51 5.37 0.00 0.64 -2.40 103.07 109.32 2j4r h GLY 276 Ca 0.17 -0.45 0.01 0.00 0.00 0.00 0.00 47.33 47.06 2j4r h GLY 276 CO -0.00 0.35 -0.36 -2.22 0.00 0.00 0.00 176.54 174.30 2j4r h ILE 277 N 1.12 0.25 -0.10 2.60 2.04 -0.27 -1.46 117.51 121.70 2j4r h ILE 277 Ca 0.39 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.28 2j4r h ILE 277 Cb 0.09 0.25 -0.00 0.00 -0.74 0.00 0.00 36.82 36.42 2j4r h ILE 277 CO -0.15 0.00 0.13 -0.26 0.00 0.00 0.00 178.15 177.88 2j4r h PHE 278 N -0.68 0.00 -0.02 1.37 0.04 -1.11 -0.54 116.94 116.01 2j4r h PHE 278 Ca -0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.74 2j4r h PHE 278 Cb 0.65 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.80 2j4r h PHE 278 CO -0.26 0.00 -0.08 1.25 -0.60 0.00 0.00 178.31 178.62 2j4r h LEU 279 N 0.00 0.10 -0.32 1.54 5.85 -0.89 -2.77 115.31 118.82 2j4r h LEU 279 Ca 0.05 -0.67 -0.01 0.00 0.84 0.00 0.00 57.88 58.08 2j4r h LEU 279 Cb 0.31 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 2j4r h LEU 279 CO -0.00 0.76 0.15 0.11 -0.34 0.00 0.00 178.44 179.12 2j4r h LYS 280 N -0.55 0.46 -0.45 1.25 1.79 -0.41 -2.08 116.57 116.58 2j4r h LYS 280 Ca -0.01 -0.07 0.09 0.00 -2.18 0.00 0.00 60.65 58.49 2j4r h LYS 280 Cb 0.76 -0.08 -0.09 0.00 -1.58 0.00 0.00 32.23 31.23 2j4r h LYS 280 CO 0.02 0.42 -0.18 1.15 -1.08 0.00 0.00 179.45 179.78 2j4r h THR 281 N 0.38 0.43 -0.32 -0.16 2.02 -1.18 -0.52 112.91 113.54 2j4r h THR 281 Ca 0.11 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.29 2j4r h THR 281 Cb 0.12 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 2j4r h THR 281 CO -0.01 0.00 0.21 -0.07 0.37 0.00 0.00 175.52 176.02 2j4r h LEU 282 N -0.08 0.37 0.16 2.58 4.07 -1.32 -1.06 115.31 120.03 2j4r h LEU 282 Ca 0.22 -0.01 0.01 0.00 0.08 0.00 0.00 57.88 58.17 2j4r h LEU 282 Cb 0.42 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 42.04 2j4r h LEU 282 CO -0.51 0.27 -0.22 -0.08 -1.08 0.00 0.00 178.44 176.83 2j4r h GLU 283 N 0.44 -0.43 -0.00 1.13 4.81 -0.61 -0.08 114.58 119.84 2j4r h GLU 283 Ca 0.12 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 2j4r h GLU 283 Cb -0.05 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.43 2j4r h GLU 283 CO -0.03 -0.28 -0.14 0.44 -0.73 0.00 0.00 179.01 178.27 2j4r n ILE 284 N -5.35 0.00 1.07 2.32 -6.64 -0.29 -2.20 119.36 108.28 2j4r n ILE 284 Ca -0.07 -0.03 0.12 0.00 -1.77 0.00 0.00 62.75 61.00 2j4r n ILE 284 Cb 0.26 -0.17 0.11 0.00 -1.44 0.00 0.00 39.64 38.40 2j4r n ILE 284 CO 0.00 0.00 0.00 0.49 -1.77 0.00 0.00 176.55 175.27 2j4r n PHE 285 N -1.22 0.00 -3.56 4.28 3.01 -0.40 -4.76 117.46 114.80 2j4r n PHE 285 Ca 0.11 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.32 2j4r n PHE 285 Cb 0.30 -0.03 0.05 0.00 -0.01 0.00 0.00 39.48 39.79 2j4r n PHE 285 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2j4r n GLU 286 N -0.03 -2.10 -4.31 -1.08 1.02 -0.20 -4.78 120.64 109.16 2j4r n GLU 286 Ca 0.11 0.60 -0.18 0.00 -0.02 0.00 0.00 57.16 57.67 2j4r n GLU 286 Cb 0.45 -4.78 -0.14 0.00 -0.02 0.00 0.00 31.44 26.95 2j4r n GLU 286 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2j4r s LYS 287 N -5.53 0.67 0.14 3.49 -0.14 -0.26 -5.04 119.74 113.07 2j4r s LYS 287 Ca 0.39 -0.33 0.25 0.00 -1.36 0.00 0.00 55.97 54.93 2j4r s LYS 287 Cb -0.11 -0.64 0.60 0.00 -1.68 0.00 0.00 37.83 36.00 2j4r s LYS 287 CO 0.82 0.17 1.55 -0.25 -0.76 0.00 0.00 175.35 176.88 2j4r n ASP 288 N 2.78 0.70 -3.76 2.83 8.00 -1.26 -4.49 116.55 121.34 2j4r n ASP 288 Ca -0.14 0.31 -0.04 0.00 0.71 0.00 0.00 54.79 55.63 2j4r n ASP 288 Cb 0.57 -0.27 -0.02 0.00 -0.02 0.00 0.00 41.12 41.38 2j4r n ASP 288 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j4r s LEU 290 N -2.92 1.45 -0.01 0.00 0.05 -0.79 -4.66 118.68 111.81 2j4r s LEU 290 Ca 0.12 -1.52 0.03 0.00 0.05 0.00 0.00 54.13 52.81 2j4r s LEU 290 Cb -0.02 0.35 -0.03 0.00 -2.05 0.00 0.00 46.19 44.44 2j4r s LEU 290 CO 0.03 -0.90 -0.09 -0.63 -0.55 0.00 0.00 176.35 174.21 2j4r s ILE 291 N -3.83 3.45 -0.16 1.48 1.01 -0.96 -1.78 121.20 120.41 2j4r s ILE 291 Ca 0.39 -0.78 -0.15 0.00 0.00 0.00 0.00 60.65 60.11 2j4r s ILE 291 Cb 0.05 -2.46 -0.04 0.00 0.01 0.00 0.00 42.46 40.02 2j4r s ILE 291 CO 0.17 0.44 0.33 -0.69 0.00 0.00 0.00 174.94 175.19 2j4r s VAL 292 N -0.92 5.28 -0.04 2.92 1.01 -0.39 -0.19 120.40 128.08 2j4r s VAL 292 Ca 0.15 0.61 0.03 0.00 0.00 0.00 0.00 61.98 62.77 2j4r s VAL 292 Cb -0.11 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 2j4r s VAL 292 CO 0.05 0.36 -0.10 -0.55 0.00 0.00 0.00 175.10 174.86 2j4r s SER 293 N 0.58 4.36 0.01 3.32 0.15 -0.90 -1.38 113.70 119.85 2j4r s SER 293 Ca 0.18 -0.14 0.22 0.00 0.70 0.00 0.00 55.95 56.91 2j4r s SER 293 Cb -0.13 -1.00 -0.27 0.00 -1.71 0.00 0.00 66.02 62.91 2j4r s SER 293 CO 0.05 0.33 0.59 -0.67 1.20 0.00 0.00 173.24 174.74 2j4r n ASP 294 N 2.06 0.17 -4.79 5.45 2.03 -1.26 -4.49 116.55 115.72 2j4r n ASP 294 Ca -0.17 0.07 -0.36 0.00 0.52 0.00 0.00 54.79 54.85 2j4r n ASP 294 Cb 0.53 1.68 -0.04 0.00 -0.72 0.00 0.00 41.12 42.56 2j4r n ASP 294 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 2j4r s TRP 295 N -3.47 3.27 0.00 -0.67 0.52 -1.26 -4.97 118.94 112.36 2j4r s TRP 295 Ca -0.07 1.64 0.00 0.00 0.02 0.00 0.00 56.10 57.70 2j4r s TRP 295 Cb 0.13 -3.07 0.00 0.00 -1.15 0.00 0.00 33.47 29.38 2j4r s TRP 295 CO 0.89 -0.52 0.00 0.41 0.02 0.00 0.00 176.95 177.75 2j4r n GLY 296 N 0.17 4.29 0.27 0.98 0.00 -1.26 -4.85 105.19 104.79 2j4r n GLY 296 Ca 0.06 -0.37 -0.08 0.00 0.00 0.00 0.00 46.02 45.62 2j4r n GLY 296 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2j4r h LEU 297 N 0.00 -0.75 -0.79 0.99 5.85 -1.87 -0.55 115.31 118.19 2j4r h LEU 297 Ca 0.00 0.14 0.19 0.00 0.84 0.00 0.00 57.88 59.05 2j4r h LEU 297 Cb 0.00 0.36 -0.13 0.00 0.37 0.00 0.00 40.66 41.25 2j4r h LEU 297 CO 0.00 -0.27 0.08 0.03 -0.34 0.00 0.00 178.44 177.93 2j4r h ARG 298 N -0.24 0.14 0.21 1.25 3.08 -1.96 -0.37 114.38 116.49 2j4r h ARG 298 Ca 0.14 -0.01 -0.35 0.00 0.07 0.00 0.00 59.98 59.83 2j4r h ARG 298 Cb 0.45 -0.03 0.02 0.00 0.08 0.00 0.00 29.97 30.49 2j4r h ARG 298 CO -0.38 0.09 -1.65 0.93 -1.07 0.00 0.00 179.97 177.88 2j4r h GLU 299 N 0.14 0.45 -0.97 0.04 3.07 -1.91 -3.26 114.58 112.14 2j4r h GLU 299 Ca 0.45 -0.76 0.21 0.00 -0.50 0.00 0.00 59.36 58.76 2j4r h GLU 299 Cb 0.83 0.28 -0.09 0.00 -0.84 0.00 0.00 28.75 28.94 2j4r h GLU 299 CO -0.66 1.36 0.62 0.78 -1.40 0.00 0.00 179.01 179.71 2j4r h GLY 300 N 0.52 1.27 1.04 -3.84 0.00 -0.41 0.94 103.07 102.58 2j4r h GLY 300 Ca -0.31 -0.26 -0.08 0.00 0.00 0.00 0.00 47.33 46.69 2j4r h GLY 300 CO 0.21 -0.05 0.08 -2.08 0.00 0.00 0.00 176.54 174.70 2j4r h VAL 301 N 0.54 1.26 -0.43 4.60 2.07 -1.16 0.91 116.25 124.04 2j4r h VAL 301 Ca 0.53 -1.02 -0.09 0.00 0.82 0.00 0.00 66.70 66.94 2j4r h VAL 301 Cb 1.13 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 2j4r h VAL 301 CO -0.27 0.37 -0.09 -0.07 0.02 0.00 0.00 177.57 177.53 2j4r h LEU 302 N 0.89 0.83 0.08 2.57 -0.00 -0.39 -2.87 115.31 116.43 2j4r h LEU 302 Ca 0.18 -0.36 0.01 0.00 -0.00 0.00 0.00 57.88 57.71 2j4r h LEU 302 Cb 0.45 -0.23 -0.02 0.00 -0.00 0.00 0.00 40.66 40.86 2j4r h LEU 302 CO 0.02 0.99 -0.16 0.58 -0.00 0.00 0.00 178.44 179.87 2j4r h VAL 303 N 0.66 0.64 0.00 1.22 2.07 0.12 -3.41 116.25 117.55 2j4r h VAL 303 Ca 0.11 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.63 2j4r h VAL 303 Cb 0.62 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2j4r h VAL 303 CO 0.04 0.00 0.58 -0.24 0.02 0.00 0.00 177.57 177.97 2j4r n SER 304 N -5.28 -1.17 0.00 0.57 2.88 0.31 -2.92 113.62 108.02 2j4r n SER 304 Ca -0.06 -0.75 0.00 0.00 -1.33 0.00 0.00 58.87 56.72 2j4r n SER 304 Cb 0.20 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.41 2j4r n SER 304 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2j4r n GLU 305 N 3.06 0.00 0.00 -1.46 4.07 -1.26 -5.01 120.64 120.04 2j4r n GLU 305 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2j4r n GLU 305 Cb 0.29 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.67 2j4r n GLU 305 CO 0.00 0.00 0.00 1.33 -0.06 0.00 0.00 177.13 178.40