#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rj4 s MET 63 N 0.00 2.72 0.95 -4.13 1.75 -1.26 -5.04 119.30 114.29 2rj4 s MET 63 Ca 0.00 -1.04 -0.12 0.00 -1.25 0.00 0.00 55.69 53.28 2rj4 s MET 63 Cb 0.00 -2.85 0.16 0.00 2.84 0.00 0.00 34.83 34.99 2rj4 s MET 63 CO 0.00 -0.39 1.10 0.14 -0.65 0.00 0.00 175.02 175.21 2rj4 s VAL 64 N 1.25 2.28 0.45 10.11 -7.23 -1.26 -5.00 120.40 121.00 2rj4 s VAL 64 Ca -0.01 0.09 -0.24 0.00 -1.81 0.00 0.00 61.98 60.01 2rj4 s VAL 64 Cb -0.17 -2.62 -0.08 0.00 0.56 0.00 0.00 36.38 34.08 2rj4 s VAL 64 CO -0.07 -0.12 1.28 -0.44 -0.31 0.00 0.00 175.10 175.44 2rj4 s SER 65 N -3.53 6.08 0.60 4.85 0.01 -1.26 -5.03 113.70 115.43 2rj4 s SER 65 Ca 0.64 2.58 -0.18 0.00 1.31 0.00 0.00 55.95 60.31 2rj4 s SER 65 Cb -0.18 -2.63 -0.03 0.00 0.21 0.00 0.00 66.02 63.40 2rj4 s SER 65 CO 0.57 -1.00 1.15 -0.76 0.41 0.00 0.00 173.24 173.61 2rj4 s LEU 66 N -2.79 3.59 0.82 2.44 1.43 -1.26 -5.05 118.68 117.87 2rj4 s LEU 66 Ca 0.61 2.19 -0.12 0.00 -1.03 0.00 0.00 54.13 55.78 2rj4 s LEU 66 Cb -0.36 -4.58 0.09 0.00 0.03 0.00 0.00 46.19 41.37 2rj4 s LEU 66 CO 0.45 -1.51 1.15 -2.16 0.23 0.00 0.00 176.35 174.51 2rj4 s PRO 67 N -3.58 1.88 0.18 1.29 0.04 -1.26 -4.99 135.00 128.57 2rj4 s PRO 67 Ca 0.72 0.24 -0.33 0.00 0.04 0.00 0.00 61.00 61.68 2rj4 s PRO 67 Cb -0.25 -1.93 -0.15 0.00 0.04 0.00 0.00 34.50 32.21 2rj4 s PRO 67 CO 0.34 -1.68 1.32 -2.13 0.04 0.00 0.00 177.00 174.89 2rj4 n ARG 68 N -3.40 1.57 -3.87 4.56 0.63 -1.26 -5.00 116.66 109.88 2rj4 n ARG 68 Ca 0.07 0.56 -0.12 0.00 -0.92 0.00 0.00 57.85 57.44 2rj4 n ARG 68 Cb 0.60 -2.16 -0.14 0.00 0.45 0.00 0.00 32.46 31.20 2rj4 n ARG 68 CO 0.00 0.00 0.00 -1.64 -2.51 0.00 0.00 177.63 173.48 2rj4 s MET 69 N -0.13 0.02 -0.23 -0.14 -1.94 -1.26 -5.14 119.30 110.48 2rj4 s MET 69 Ca 0.74 0.01 -0.05 0.00 -1.71 0.00 0.00 55.69 54.67 2rj4 s MET 69 Cb -0.78 -0.04 -0.02 0.00 2.01 0.00 0.00 34.83 36.00 2rj4 s MET 69 CO 0.49 -0.01 0.00 0.08 -0.01 0.00 0.00 175.02 175.57 2rj4 s VAL 70 N 0.10 3.78 0.16 -6.03 1.01 -1.26 -5.08 120.40 113.07 2rj4 s VAL 70 Ca -0.01 -0.36 -0.18 0.00 0.00 0.00 0.00 61.98 61.43 2rj4 s VAL 70 Cb -0.01 -2.74 0.04 0.00 0.00 0.00 0.00 36.38 33.67 2rj4 s VAL 70 CO -0.00 0.39 0.50 -0.72 0.00 0.00 0.00 175.10 175.26 2rj4 s TYR 71 N 1.51 -0.24 0.30 5.22 -0.85 -1.26 -5.14 117.35 116.89 2rj4 s TYR 71 Ca 0.06 -0.06 -0.30 0.00 -0.52 0.00 0.00 57.07 56.25 2rj4 s TYR 71 Cb -0.15 0.38 -0.12 0.00 0.38 0.00 0.00 41.96 42.46 2rj4 s TYR 71 CO -0.00 -0.82 1.51 -2.30 -1.52 0.00 0.00 175.55 172.41 2rj4 n PRO 72 N -0.31 2.51 -1.94 -3.49 -0.02 -1.26 -4.93 135.00 125.56 2rj4 n PRO 72 Ca -0.14 0.89 -0.42 0.00 -2.02 0.00 0.00 63.50 61.81 2rj4 n PRO 72 Cb 0.63 -2.62 -0.03 0.00 -0.02 0.00 0.00 33.50 31.47 2rj4 n PRO 72 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 2rj4 s GLN 73 N -0.91 4.22 0.30 -0.52 0.74 -1.26 -4.97 119.66 117.26 2rj4 s GLN 73 Ca 0.62 2.37 -0.29 0.00 0.05 0.00 0.00 55.36 58.11 2rj4 s GLN 73 Cb -0.53 -3.12 -0.10 0.00 1.10 0.00 0.00 33.01 30.36 2rj4 s GLN 73 CO 0.53 -0.54 1.34 -1.25 -0.55 0.00 0.00 175.29 174.82 2rj4 s PRO 74 N 0.32 4.34 -0.31 1.67 0.04 -1.26 -4.99 135.00 134.81 2rj4 s PRO 74 Ca 0.65 2.22 -0.06 0.00 0.04 0.00 0.00 61.00 63.85 2rj4 s PRO 74 Cb -0.44 -3.09 0.03 0.00 0.04 0.00 0.00 34.50 31.04 2rj4 s PRO 74 CO 0.38 -0.25 0.06 0.15 0.04 0.00 0.00 177.00 177.39 2rj4 s LYS 75 N -1.29 2.83 0.35 4.56 -0.14 -1.26 -4.98 119.74 119.80 2rj4 s LYS 75 Ca 0.52 -1.02 0.06 0.00 -1.36 0.00 0.00 55.97 54.17 2rj4 s LYS 75 Cb -0.40 -3.34 0.74 0.00 -1.68 0.00 0.00 37.83 33.15 2rj4 s LYS 75 CO 0.49 -0.53 1.91 0.28 -0.76 0.00 0.00 175.35 176.74 2rj4 h VAL 76 N 6.06 0.95 -0.67 3.17 2.07 -2.02 -2.22 116.25 123.59 2rj4 h VAL 76 Ca -0.28 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 66.98 2rj4 h VAL 76 Cb 1.10 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2rj4 h VAL 76 CO 0.59 0.14 0.00 0.18 0.02 0.00 0.00 177.57 178.50 2rj4 n LEU 77 N -4.51 3.81 -3.35 2.57 4.77 -1.26 -4.60 117.00 114.43 2rj4 n LEU 77 Ca 0.14 -1.96 -0.26 0.00 -0.03 0.00 0.00 56.01 53.90 2rj4 n LEU 77 Cb 0.33 -0.45 -0.09 0.00 -2.33 0.00 0.00 43.42 40.88 2rj4 n LEU 77 CO 0.32 0.94 -0.25 0.41 -1.33 0.00 0.00 177.39 177.48 2rj4 n THR 78 N 1.52 -0.44 -1.33 -5.08 -1.04 -0.83 -5.13 114.28 101.94 2rj4 n THR 78 Ca 0.23 -3.95 -0.35 0.00 -2.04 0.00 0.00 64.05 57.93 2rj4 n THR 78 Cb 0.60 -1.87 0.10 0.00 -1.82 0.00 0.00 70.33 67.34 2rj4 n THR 78 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2rj4 n PRO 79 N 1.99 0.49 0.35 -2.82 -0.04 -1.26 -4.67 135.00 129.04 2rj4 n PRO 79 Ca 0.25 0.23 -0.17 0.00 -0.04 0.00 0.00 63.50 63.78 2rj4 n PRO 79 Cb 0.48 -2.33 -0.08 0.00 -0.04 0.00 0.00 33.50 31.53 2rj4 n PRO 79 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2rj4 s ARG 81 N -5.42 2.22 -0.01 0.00 1.81 -1.26 -4.99 118.95 111.31 2rj4 s ARG 81 Ca -0.16 -0.55 0.19 0.00 -1.72 0.00 0.00 55.73 53.49 2rj4 s ARG 81 Cb 0.02 -1.97 -0.23 0.00 -0.45 0.00 0.00 34.95 32.32 2rj4 s ARG 81 CO 0.55 -0.15 0.71 1.63 -0.68 0.00 0.00 175.30 177.37 2rj4 n LYS 82 N 4.48 0.67 0.06 3.54 5.02 -1.26 -4.52 118.16 126.14 2rj4 n LYS 82 Ca -0.18 -0.05 0.12 0.00 -2.02 0.00 0.00 58.31 56.18 2rj4 n LYS 82 Cb 0.51 -1.42 0.14 0.00 -0.02 0.00 0.00 35.03 34.24 2rj4 n LYS 82 CO 0.00 0.00 0.00 0.38 -0.52 0.00 0.00 177.40 177.26 2rj4 h ASP 83 N 0.00 0.00 -4.83 4.39 2.03 -2.00 -3.48 116.42 112.54 2rj4 h ASP 83 Ca 0.00 -0.23 -0.21 0.00 -0.73 0.00 0.00 57.03 55.87 2rj4 h ASP 83 Cb 0.57 0.00 -0.17 0.00 -0.83 0.00 0.00 39.33 38.90 2rj4 h ASP 83 CO 0.00 0.11 -0.70 0.68 -1.03 0.00 0.00 179.24 178.30 2rj4 s VAL 84 N -3.18 0.48 -0.03 4.15 -7.23 -1.26 -5.12 120.40 108.21 2rj4 s VAL 84 Ca 0.05 -1.59 -0.30 0.00 -1.81 0.00 0.00 61.98 58.34 2rj4 s VAL 84 Cb 0.13 -1.23 -0.05 0.00 0.56 0.00 0.00 36.38 35.79 2rj4 s VAL 84 CO 0.74 -0.74 1.47 -0.22 -0.31 0.00 0.00 175.10 176.04 2rj4 s LEU 85 N -2.49 4.30 0.00 1.32 2.96 -1.26 -4.91 118.68 118.60 2rj4 s LEU 85 Ca 0.02 2.12 0.09 0.00 -0.22 0.00 0.00 54.13 56.15 2rj4 s LEU 85 Cb 0.01 -3.55 0.08 0.00 0.50 0.00 0.00 46.19 43.22 2rj4 s LEU 85 CO -0.04 -0.80 0.80 1.33 -1.32 0.00 0.00 176.35 176.32 2rj4 n VAL 86 N 5.00 0.03 -3.77 1.68 0.24 -1.26 -4.77 118.33 115.47 2rj4 n VAL 86 Ca 0.15 -0.51 -0.13 0.00 -2.04 0.00 0.00 64.34 61.81 2rj4 n VAL 86 Cb 0.43 1.17 -0.12 0.00 -1.47 0.00 0.00 33.84 33.86 2rj4 n VAL 86 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2rj4 s VAL 87 N -0.77 -0.01 0.75 3.34 0.11 -1.26 -0.65 120.40 121.91 2rj4 s VAL 87 Ca 0.11 0.04 -0.12 0.00 -2.93 0.00 0.00 61.98 59.08 2rj4 s VAL 87 Cb 0.08 -0.36 0.04 0.00 -1.53 0.00 0.00 36.38 34.61 2rj4 s VAL 87 CO 0.12 0.02 1.12 0.42 -3.33 0.00 0.00 175.10 173.44 2rj4 s THR 88 N 0.44 2.99 -1.10 5.04 -4.23 0.55 -4.90 115.64 114.44 2rj4 s THR 88 Ca -0.03 0.32 0.07 0.00 -1.18 0.00 0.00 61.69 60.88 2rj4 s THR 88 Cb -0.04 -3.29 0.07 0.00 1.34 0.00 0.00 72.50 70.58 2rj4 s THR 88 CO -0.02 -0.42 1.19 -2.65 -0.54 0.00 0.00 174.62 172.18 2rj4 n PRO 89 N -3.15 0.02 -0.65 3.99 -0.02 -1.26 -0.59 135.00 133.35 2rj4 n PRO 89 Ca 0.07 0.34 0.08 0.00 -2.02 0.00 0.00 63.50 61.97 2rj4 n PRO 89 Cb 0.58 -1.50 0.33 0.00 -0.02 0.00 0.00 33.50 32.89 2rj4 n PRO 89 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 2rj4 n TRP 90 N -1.45 1.48 -2.48 6.00 2.14 -1.26 -4.96 117.44 116.90 2rj4 n TRP 90 Ca 0.02 -0.77 -0.12 0.00 2.07 0.00 0.00 57.50 58.69 2rj4 n TRP 90 Cb 0.08 -0.38 0.01 0.00 -0.81 0.00 0.00 31.31 30.20 2rj4 n TRP 90 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 2rj4 n LEU 91 N 0.18 -1.90 -4.73 5.67 4.77 0.25 -5.02 117.00 116.22 2rj4 n LEU 91 Ca 0.24 -0.10 -0.37 0.00 -0.03 0.00 0.00 56.01 55.76 2rj4 n LEU 91 Cb 1.01 -1.90 -0.07 0.00 -2.33 0.00 0.00 43.42 40.14 2rj4 n LEU 91 CO 0.23 0.02 0.06 0.00 -1.33 0.00 0.00 177.39 176.37 2rj4 s ALA 92 N -2.76 3.55 0.48 -1.18 0.00 -1.26 -4.85 121.76 115.74 2rj4 s ALA 92 Ca 0.10 -0.35 -0.24 0.00 0.00 0.00 0.00 51.96 51.46 2rj4 s ALA 92 Cb -0.04 -2.49 -0.07 0.00 0.00 0.00 0.00 23.12 20.52 2rj4 s ALA 92 CO 0.12 0.06 1.39 -2.30 0.00 0.00 0.00 175.76 175.03 2rj4 n PRO 93 N 3.60 2.01 -3.85 0.00 -0.02 -1.25 -0.33 135.00 135.16 2rj4 n PRO 93 Ca -0.10 0.72 -0.36 0.00 -2.02 0.00 0.00 63.50 61.74 2rj4 n PRO 93 Cb 0.52 -2.58 -0.13 0.00 -0.02 0.00 0.00 33.50 31.28 2rj4 n PRO 93 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2rj4 s ILE 94 N -1.23 4.01 -0.44 4.25 1.01 0.18 -1.14 121.20 127.85 2rj4 s ILE 94 Ca 0.65 -0.28 -0.22 0.00 0.00 0.00 0.00 60.65 60.80 2rj4 s ILE 94 Cb -0.44 -2.85 0.02 0.00 0.01 0.00 0.00 42.46 39.20 2rj4 s ILE 94 CO 0.54 0.38 0.72 -0.69 0.00 0.00 0.00 174.94 175.89 2rj4 s VAL 95 N 1.47 4.74 0.15 2.92 1.01 0.29 -4.70 120.40 126.28 2rj4 s VAL 95 Ca 0.05 0.33 0.08 0.00 0.00 0.00 0.00 61.98 62.45 2rj4 s VAL 95 Cb -0.15 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 31.93 2rj4 s VAL 95 CO 0.01 -0.64 -0.18 0.26 0.00 0.00 0.00 175.10 174.55 2rj4 s TRP 96 N 3.07 1.79 0.26 5.22 0.52 -1.26 -1.90 118.94 126.64 2rj4 s TRP 96 Ca 0.27 -0.47 -0.31 0.00 0.02 0.00 0.00 56.10 55.61 2rj4 s TRP 96 Cb -0.13 -0.91 -0.12 0.00 -1.15 0.00 0.00 33.47 31.16 2rj4 s TRP 96 CO 0.21 0.30 1.59 -1.91 0.02 0.00 0.00 176.95 177.16 2rj4 n GLU 97 N 0.41 2.57 0.00 4.98 4.07 -1.26 -1.95 120.64 129.47 2rj4 n GLU 97 Ca -0.14 0.92 0.00 0.00 -0.06 0.00 0.00 57.16 57.88 2rj4 n GLU 97 Cb 0.57 -2.70 0.00 0.00 -0.06 0.00 0.00 31.44 29.25 2rj4 n GLU 97 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2rj4 n GLY 98 N 2.65 0.03 0.06 8.31 0.00 -1.26 -4.94 105.19 110.04 2rj4 n GLY 98 Ca 0.11 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.25 2rj4 n GLY 98 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2rj4 n THR 99 N -2.00 0.29 -4.18 2.61 -2.24 -0.82 -4.74 114.28 103.21 2rj4 n THR 99 Ca 0.00 -0.33 -0.16 0.00 -2.27 0.00 0.00 64.05 61.29 2rj4 n THR 99 Cb 0.00 0.01 -0.12 0.00 -2.10 0.00 0.00 70.33 68.11 2rj4 n THR 99 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 2rj4 s PHE 100 N -3.24 0.91 -0.42 4.78 -0.12 -1.26 -5.04 117.98 113.59 2rj4 s PHE 100 Ca 0.03 -0.40 -0.17 0.00 -0.05 0.00 0.00 56.93 56.34 2rj4 s PHE 100 Cb 0.13 -0.54 0.02 0.00 -0.63 0.00 0.00 43.02 42.01 2rj4 s PHE 100 CO 0.79 -0.01 0.39 1.21 -0.05 0.00 0.00 175.22 177.55 2rj4 s ASN 101 N -1.31 6.17 0.48 1.98 3.04 -1.26 -4.97 114.94 119.06 2rj4 s ASN 101 Ca -0.04 -0.77 0.27 0.00 0.04 0.00 0.00 52.86 52.36 2rj4 s ASN 101 Cb -0.08 -2.20 1.11 0.00 -1.54 0.00 0.00 41.25 38.53 2rj4 s ASN 101 CO 0.01 -0.55 1.90 -0.29 -3.04 0.00 0.00 177.10 175.13 2rj4 h ILE 102 N 5.70 0.40 -0.34 -5.21 6.09 -1.99 -2.66 117.51 119.50 2rj4 h ILE 102 Ca -0.27 -0.88 -0.09 0.00 -1.37 0.00 0.00 64.86 62.25 2rj4 h ILE 102 Cb 1.11 1.64 -0.01 0.00 0.47 0.00 0.00 36.82 40.04 2rj4 h ILE 102 CO 0.78 0.15 -0.15 0.44 -3.07 0.00 0.00 178.15 176.30 2rj4 h ASP 103 N 0.00 0.73 -0.22 2.19 3.45 -1.99 0.26 116.42 120.84 2rj4 h ASP 103 Ca -0.00 -0.40 -0.02 0.00 0.43 0.00 0.00 57.03 57.04 2rj4 h ASP 103 Cb 0.63 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 39.19 2rj4 h ASP 103 CO 0.02 0.96 0.05 0.40 -1.57 0.00 0.00 179.24 179.11 2rj4 h ILE 104 N 0.49 1.21 -0.54 0.35 2.04 -1.93 -2.04 117.51 117.08 2rj4 h ILE 104 Ca 0.08 -0.67 -0.03 0.00 1.00 0.00 0.00 64.86 65.24 2rj4 h ILE 104 Cb 0.68 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.97 2rj4 h ILE 104 CO 0.05 0.21 0.21 -0.07 0.00 0.00 0.00 178.15 178.55 2rj4 h LEU 105 N 0.17 0.76 -0.87 1.44 3.38 -1.38 -1.47 115.31 117.34 2rj4 h LEU 105 Ca 0.07 -0.18 0.06 0.00 0.09 0.00 0.00 57.88 57.92 2rj4 h LEU 105 Cb 0.27 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.77 2rj4 h LEU 105 CO 0.00 0.73 0.54 0.78 0.09 0.00 0.00 178.44 180.58 2rj4 h ASN 106 N 0.74 0.86 -0.19 -0.43 2.35 -0.42 -1.10 115.58 117.39 2rj4 h ASN 106 Ca 0.18 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 2rj4 h ASN 106 Cb 0.21 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 2rj4 h ASN 106 CO -0.01 0.55 0.12 -0.33 -1.65 0.00 0.00 177.43 176.11 2rj4 h GLU 107 N 0.99 0.25 -0.56 0.81 4.39 -0.99 0.69 114.58 120.17 2rj4 h GLU 107 Ca 0.37 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 60.07 2rj4 h GLU 107 Cb 0.15 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.71 2rj4 h GLU 107 CO -0.17 0.19 0.35 1.96 -1.16 0.00 0.00 179.01 180.19 2rj4 h GLN 108 N 0.24 0.69 0.08 2.33 4.20 -0.62 -1.42 115.11 120.62 2rj4 h GLN 108 Ca 0.07 -0.04 -0.25 0.00 0.06 0.00 0.00 58.65 58.49 2rj4 h GLN 108 Cb 0.00 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.63 2rj4 h GLN 108 CO -0.01 0.46 -1.13 0.74 -0.67 0.00 0.00 178.83 178.21 2rj4 h PHE 109 N 0.71 0.45 -0.42 2.96 -1.00 -1.10 -3.23 116.94 115.32 2rj4 h PHE 109 Ca 0.21 -0.30 -0.10 0.00 2.81 0.00 0.00 57.97 60.59 2rj4 h PHE 109 Cb -0.04 -0.03 -0.02 0.00 3.61 0.00 0.00 35.95 39.48 2rj4 h PHE 109 CO -0.05 1.20 -0.16 0.00 -1.61 0.00 0.00 178.31 177.70 2rj4 h ARG 110 N 0.10 0.78 0.00 1.51 2.47 -0.76 -2.30 114.38 116.17 2rj4 h ARG 110 Ca -0.10 -0.28 0.00 0.00 -1.26 0.00 0.00 59.98 58.34 2rj4 h ARG 110 Cb 1.83 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 30.10 2rj4 h ARG 110 CO 0.18 0.88 0.00 -0.07 0.56 0.00 0.00 179.97 181.53 2rj4 h LEU 111 N 0.69 0.00 -1.91 3.04 3.38 -1.28 0.15 115.31 119.39 2rj4 h LEU 111 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2rj4 h LEU 111 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2rj4 h LEU 111 CO 0.05 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.58 2rj4 n GLN 112 N -2.94 2.27 -3.85 1.13 1.13 -0.89 -4.87 117.38 109.35 2rj4 n GLN 112 Ca -0.02 -1.89 -0.24 0.00 -1.94 0.00 0.00 57.00 52.91 2rj4 n GLN 112 Cb 0.12 -1.48 -0.00 0.00 0.11 0.00 0.00 30.24 28.99 2rj4 n GLN 112 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2rj4 n ASN 113 N 1.15 -0.85 -4.73 1.08 4.05 0.53 -4.87 115.26 111.63 2rj4 n ASN 113 Ca 0.17 -0.95 -0.42 0.00 0.45 0.00 0.00 54.58 53.84 2rj4 n ASN 113 Cb 0.54 -3.40 -0.03 0.00 1.23 0.00 0.00 39.78 38.12 2rj4 n ASN 113 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 2rj4 s THR 114 N -3.84 2.92 -0.16 -0.44 2.01 -1.05 -4.96 115.64 110.11 2rj4 s THR 114 Ca 0.03 0.70 -0.02 0.00 0.31 0.00 0.00 61.69 62.71 2rj4 s THR 114 Cb -0.01 -3.45 -0.02 0.00 0.01 0.00 0.00 72.50 69.03 2rj4 s THR 114 CO 0.86 0.08 -0.08 -0.89 -0.69 0.00 0.00 174.62 173.91 2rj4 s THR 115 N 0.62 3.40 -0.18 -0.82 2.01 -1.26 -3.26 115.64 116.14 2rj4 s THR 115 Ca 0.63 -0.52 -0.05 0.00 0.31 0.00 0.00 61.69 62.06 2rj4 s THR 115 Cb -0.40 -2.48 -0.03 0.00 0.01 0.00 0.00 72.50 69.60 2rj4 s THR 115 CO 0.36 0.49 -0.01 -0.63 -0.69 0.00 0.00 174.62 174.13 2rj4 s ILE 116 N 0.67 3.94 -0.01 1.82 1.09 -0.13 -0.53 121.20 128.05 2rj4 s ILE 116 Ca -0.04 -0.33 -0.11 0.00 -1.10 0.00 0.00 60.65 59.07 2rj4 s ILE 116 Cb -0.15 -2.76 -0.05 0.00 -1.06 0.00 0.00 42.46 38.44 2rj4 s ILE 116 CO 0.02 0.46 0.33 -0.83 -0.10 0.00 0.00 174.94 174.82 2rj4 s GLY 117 N 0.72 2.36 -0.19 6.18 0.00 0.30 -1.04 107.32 115.66 2rj4 s GLY 117 Ca -0.01 -0.38 0.00 0.00 0.00 0.00 0.00 44.72 44.34 2rj4 s GLY 117 CO 0.02 -0.09 -0.09 -2.27 0.00 0.00 0.00 173.10 170.67 2rj4 s LEU 118 N -1.31 2.05 -0.01 0.66 2.96 -0.30 -0.45 118.68 122.27 2rj4 s LEU 118 Ca 0.24 -0.79 -0.11 0.00 -0.22 0.00 0.00 54.13 53.25 2rj4 s LEU 118 Cb -0.15 -1.14 -0.05 0.00 0.50 0.00 0.00 46.19 45.35 2rj4 s LEU 118 CO 0.13 -0.15 0.33 0.42 -1.32 0.00 0.00 176.35 175.75 2rj4 s THR 119 N 1.47 5.19 -0.16 3.68 -4.23 -0.04 -0.30 115.64 121.25 2rj4 s THR 119 Ca -0.00 0.54 -0.12 0.00 -1.18 0.00 0.00 61.69 60.92 2rj4 s THR 119 Cb -0.16 -3.61 0.05 0.00 1.34 0.00 0.00 72.50 70.12 2rj4 s THR 119 CO -0.08 0.51 0.40 0.54 -0.54 0.00 0.00 174.62 175.45 2rj4 s VAL 120 N -1.15 -0.01 -0.16 2.29 0.11 -0.66 -2.43 120.40 118.38 2rj4 s VAL 120 Ca 0.24 0.03 -0.06 0.00 -2.93 0.00 0.00 61.98 59.26 2rj4 s VAL 120 Cb -0.15 -0.58 -0.04 0.00 -1.53 0.00 0.00 36.38 34.09 2rj4 s VAL 120 CO 0.12 0.01 0.05 -0.36 -3.33 0.00 0.00 175.10 171.59 2rj4 s PHE 121 N 0.64 3.23 -0.44 1.54 0.40 -1.26 -1.04 117.98 121.06 2rj4 s PHE 121 Ca -0.03 0.07 0.03 0.00 -0.60 0.00 0.00 56.93 56.39 2rj4 s PHE 121 Cb -0.05 -2.02 0.15 0.00 0.51 0.00 0.00 43.02 41.61 2rj4 s PHE 121 CO -0.04 0.20 0.30 0.00 0.70 0.00 0.00 175.22 176.38 2rj4 s ALA 122 N 0.14 1.79 -0.12 5.36 0.00 0.36 -4.44 121.76 124.85 2rj4 s ALA 122 Ca 0.04 -2.52 -0.03 0.00 0.00 0.00 0.00 51.96 49.45 2rj4 s ALA 122 Cb -0.12 -1.75 -0.03 0.00 0.00 0.00 0.00 23.12 21.22 2rj4 s ALA 122 CO 0.01 -2.05 -0.00 0.42 0.00 0.00 0.00 175.76 174.14 2rj4 s ILE 123 N 0.20 4.26 0.00 0.00 -1.09 -1.26 -3.95 121.20 119.35 2rj4 s ILE 123 Ca 0.24 -0.25 0.00 0.00 -2.23 0.00 0.00 60.65 58.41 2rj4 s ILE 123 Cb -0.12 -2.83 0.00 0.00 -1.58 0.00 0.00 42.46 37.94 2rj4 s ILE 123 CO -0.09 0.55 0.00 0.29 -1.23 0.00 0.00 174.94 174.47 2rj4 n LYS 124 N 2.72 0.00 0.20 2.79 5.02 -1.26 -2.16 118.16 125.47 2rj4 n LYS 124 Ca -0.18 0.00 0.15 0.00 -2.02 0.00 0.00 58.31 56.26 2rj4 n LYS 124 Cb 0.53 0.00 0.65 0.00 -0.02 0.00 0.00 35.03 36.19 2rj4 n LYS 124 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2rj4 h LYS 125 N 0.00 0.00 0.00 1.97 1.57 -1.94 -2.98 116.57 115.19 2rj4 h LYS 125 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2rj4 h LYS 125 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2rj4 h LYS 125 CO 0.00 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.54 2rj4 n TYR 126 N -2.60 0.00 0.29 -1.35 4.01 -0.92 -2.00 117.16 114.59 2rj4 n TYR 126 Ca 0.01 0.00 0.16 0.00 -0.16 0.00 0.00 57.90 57.91 2rj4 n TYR 126 Cb 0.21 -0.39 0.92 0.00 -0.31 0.00 0.00 39.34 39.78 2rj4 n TYR 126 CO 0.00 0.00 0.00 -0.39 -0.46 0.00 0.00 176.86 176.01 2rj4 h VAL 127 N 0.00 0.47 -0.15 -0.72 -1.51 -1.72 -1.95 116.25 110.67 2rj4 h VAL 127 Ca 0.00 0.00 0.04 0.00 -1.23 0.00 0.00 66.70 65.51 2rj4 h VAL 127 Cb 0.22 0.97 -0.01 0.00 -2.13 0.00 0.00 31.29 30.34 2rj4 h VAL 127 CO 0.00 0.00 0.18 0.00 -1.23 0.00 0.00 177.57 176.52 2rj4 h ALA 128 N 1.95 1.72 0.00 5.19 0.00 -1.68 -2.30 119.26 124.14 2rj4 h ALA 128 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2rj4 h ALA 128 Cb 0.09 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2rj4 h ALA 128 CO -0.00 -0.26 -0.43 1.19 0.00 0.00 0.00 179.25 179.75 2rj4 n PHE 129 N -3.72 0.09 -0.17 0.00 3.01 -0.73 -4.36 117.46 111.58 2rj4 n PHE 129 Ca 0.01 0.03 -0.08 0.00 1.01 0.00 0.00 57.45 58.42 2rj4 n PHE 129 Cb 0.30 -0.36 0.07 0.00 -0.01 0.00 0.00 39.48 39.47 2rj4 n PHE 129 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 2rj4 h LEU 130 N 0.00 0.96 0.36 4.37 3.38 -1.56 -2.41 115.31 120.40 2rj4 h LEU 130 Ca 0.00 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 2rj4 h LEU 130 Cb 0.54 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2rj4 h LEU 130 CO 0.00 1.03 -0.18 0.50 0.09 0.00 0.00 178.44 179.88 2rj4 h LYS 131 N 0.89 -0.47 -0.59 1.13 3.64 -1.79 0.81 116.57 120.18 2rj4 h LYS 131 Ca 0.16 0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.49 2rj4 h LYS 131 Cb 0.56 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.47 2rj4 h LYS 131 CO 0.03 -0.30 0.05 1.25 -2.27 0.00 0.00 179.45 178.21 2rj4 h LEU 132 N -0.51 0.96 0.08 5.20 5.85 -1.86 -0.58 115.31 124.45 2rj4 h LEU 132 Ca -0.05 -0.24 0.01 0.00 0.84 0.00 0.00 57.88 58.44 2rj4 h LEU 132 Cb 0.39 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2rj4 h LEU 132 CO 0.08 0.98 -0.13 0.15 -0.34 0.00 0.00 178.44 179.19 2rj4 h PHE 133 N 0.93 -0.32 -0.27 1.25 3.57 -1.13 -1.47 116.94 119.49 2rj4 h PHE 133 Ca 0.18 0.00 -0.18 0.00 3.53 0.00 0.00 57.97 61.51 2rj4 h PHE 133 Cb 0.46 0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.34 2rj4 h PHE 133 CO 0.03 -0.19 -0.53 -0.07 -2.23 0.00 0.00 178.31 175.32 2rj4 h LEU 134 N -0.26 0.93 -0.76 0.59 3.38 -0.71 -0.68 115.31 117.80 2rj4 h LEU 134 Ca 0.02 -0.54 -0.03 0.00 0.09 0.00 0.00 57.88 57.41 2rj4 h LEU 134 Cb 0.27 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2rj4 h LEU 134 CO -0.06 1.29 0.34 -0.33 0.09 0.00 0.00 178.44 179.77 2rj4 h GLU 135 N 0.59 1.10 -0.00 1.13 5.08 -1.06 -1.03 114.58 120.40 2rj4 h GLU 135 Ca 0.01 -0.17 -0.19 0.00 -1.00 0.00 0.00 59.36 58.00 2rj4 h GLU 135 Cb 1.14 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 2rj4 h GLU 135 CO 0.12 0.87 -0.86 1.79 -1.00 0.00 0.00 179.01 179.93 2rj4 h THR 136 N 1.07 1.50 -0.67 1.13 1.35 -1.24 -2.83 112.91 113.22 2rj4 h THR 136 Ca 0.26 -2.60 0.02 0.00 -0.55 0.00 0.00 66.41 63.54 2rj4 h THR 136 Cb 0.15 2.44 -0.04 0.00 -1.73 0.00 0.00 68.15 68.98 2rj4 h THR 136 CO -0.03 0.76 0.44 0.00 -0.25 0.00 0.00 175.52 176.44 2rj4 h ALA 137 N 1.00 1.57 -0.17 6.62 0.00 -0.76 -1.53 119.26 125.99 2rj4 h ALA 137 Ca -0.04 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2rj4 h ALA 137 Cb 1.48 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2rj4 h ALA 137 CO 0.13 0.38 -0.03 0.93 0.00 0.00 0.00 179.25 180.66 2rj4 h GLU 138 N 0.86 0.25 0.00 0.00 4.39 -0.95 0.39 114.58 119.53 2rj4 h GLU 138 Ca 0.26 -0.04 -0.19 0.00 0.34 0.00 0.00 59.36 59.73 2rj4 h GLU 138 Cb -0.02 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.56 2rj4 h GLU 138 CO -0.06 0.31 -0.99 0.87 -1.16 0.00 0.00 179.01 177.97 2rj4 h LYS 139 N 0.25 0.00 0.00 2.33 1.57 -1.20 -3.43 116.57 116.10 2rj4 h LYS 139 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2rj4 h LYS 139 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 2rj4 h LYS 139 CO 0.01 0.72 -0.40 0.72 -0.57 0.00 0.00 179.45 179.92 2rj4 n HIS 140 N -3.23 0.00 -3.59 -1.35 8.25 -0.73 -4.92 115.22 109.66 2rj4 n HIS 140 Ca -0.03 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.03 2rj4 n HIS 140 Cb 0.89 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.89 2rj4 n HIS 140 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 2rj4 s PHE 141 N -0.99 3.23 -1.49 4.41 5.36 0.10 -1.12 117.98 127.48 2rj4 s PHE 141 Ca 0.00 -0.78 -0.03 0.00 -0.96 0.00 0.00 56.93 55.17 2rj4 s PHE 141 Cb 0.00 -2.44 0.01 0.00 -0.34 0.00 0.00 43.02 40.25 2rj4 s PHE 141 CO 0.00 -0.58 0.24 -1.33 -1.46 0.00 0.00 175.22 172.09 2rj4 n MET 142 N 5.02 -2.99 -1.76 10.12 2.81 -0.07 -4.84 117.12 125.42 2rj4 n MET 142 Ca -0.12 0.82 -0.42 0.00 -1.81 0.00 0.00 57.70 56.17 2rj4 n MET 142 Cb 0.47 -5.54 -0.03 0.00 -0.71 0.00 0.00 33.22 27.41 2rj4 n MET 142 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2rj4 s VAL 143 N -2.97 2.15 0.00 2.03 1.01 -1.26 -1.20 120.40 120.15 2rj4 s VAL 143 Ca 0.14 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.21 2rj4 s VAL 143 Cb -0.07 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.26 2rj4 s VAL 143 CO 0.17 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.89 2rj4 n GLY 144 N 3.96 2.05 3.84 4.51 0.00 -1.26 -5.06 105.19 113.22 2rj4 n GLY 144 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.96 2rj4 n GLY 144 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2rj4 s HIS 145 N -2.50 2.86 0.05 1.61 4.02 -0.34 -5.06 115.29 115.93 2rj4 s HIS 145 Ca 0.00 -0.33 -0.30 0.00 1.02 0.00 0.00 55.06 55.44 2rj4 s HIS 145 Cb 0.00 -1.81 -0.05 0.00 -1.02 0.00 0.00 32.58 29.70 2rj4 s HIS 145 CO 0.00 0.18 1.09 1.03 1.02 0.00 0.00 174.74 178.06 2rj4 s ARG 146 N -3.99 4.51 -0.02 1.40 0.52 -1.20 -4.82 118.95 115.35 2rj4 s ARG 146 Ca 0.41 1.61 0.04 0.00 -0.52 0.00 0.00 55.73 57.27 2rj4 s ARG 146 Cb -0.05 -3.39 -0.00 0.00 0.52 0.00 0.00 34.95 32.03 2rj4 s ARG 146 CO 0.26 -0.12 -0.13 0.08 0.02 0.00 0.00 175.30 175.42 2rj4 s VAL 147 N 0.85 1.06 -0.21 3.52 1.01 -0.91 -0.96 120.40 124.74 2rj4 s VAL 147 Ca 0.54 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 62.00 2rj4 s VAL 147 Cb -0.26 -0.91 0.05 0.00 0.00 0.00 0.00 36.38 35.27 2rj4 s VAL 147 CO 0.29 0.31 -0.06 -2.28 0.00 0.00 0.00 175.10 173.36 2rj4 s HIS 148 N -0.03 2.19 0.14 5.22 2.46 -0.21 -1.24 115.29 123.83 2rj4 s HIS 148 Ca -0.00 -1.54 -0.25 0.00 0.47 0.00 0.00 55.06 53.73 2rj4 s HIS 148 Cb -0.08 -1.51 -0.07 0.00 -0.13 0.00 0.00 32.58 30.78 2rj4 s HIS 148 CO 0.01 -0.73 0.77 0.71 -2.47 0.00 0.00 174.74 173.03 2rj4 s TYR 149 N 1.47 3.87 -0.27 3.88 1.51 0.62 -1.15 117.35 127.28 2rj4 s TYR 149 Ca -0.03 1.60 0.03 0.00 -1.01 0.00 0.00 57.07 57.66 2rj4 s TYR 149 Cb -0.18 -2.77 0.07 0.00 -0.11 0.00 0.00 41.96 38.97 2rj4 s TYR 149 CO -0.07 0.47 -0.08 0.71 -1.11 0.00 0.00 175.55 175.47 2rj4 s TYR 150 N -0.93 3.29 -0.40 2.71 1.51 0.59 -1.01 117.35 123.11 2rj4 s TYR 150 Ca 0.36 -2.41 -0.15 0.00 -1.01 0.00 0.00 57.07 53.86 2rj4 s TYR 150 Cb -0.23 -2.09 0.01 0.00 -0.11 0.00 0.00 41.96 39.55 2rj4 s TYR 150 CO 0.26 -0.89 0.31 0.08 -1.11 0.00 0.00 175.55 174.20 2rj4 s VAL 151 N 1.09 5.24 -0.21 0.71 1.01 -0.26 -1.66 120.40 126.32 2rj4 s VAL 151 Ca -0.05 -0.52 -0.19 0.00 0.00 0.00 0.00 61.98 61.22 2rj4 s VAL 151 Cb -0.20 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 2rj4 s VAL 151 CO -0.06 -0.27 0.53 -0.36 0.00 0.00 0.00 175.10 174.94 2rj4 s PHE 152 N 1.76 3.35 0.04 5.22 0.08 -0.21 -0.36 117.98 127.86 2rj4 s PHE 152 Ca 0.06 0.76 -0.16 0.00 0.12 0.00 0.00 56.93 57.71 2rj4 s PHE 152 Cb -0.18 -2.70 0.03 0.00 -0.57 0.00 0.00 43.02 39.60 2rj4 s PHE 152 CO 0.11 -0.15 0.35 -0.08 -0.10 0.00 0.00 175.22 175.35 2rj4 s THR 153 N 1.83 0.07 -1.54 0.64 -1.32 -0.39 -0.49 115.64 114.43 2rj4 s THR 153 Ca 0.24 -0.58 0.27 0.00 -1.21 0.00 0.00 61.69 60.41 2rj4 s THR 153 Cb -0.15 -0.94 0.24 0.00 -1.51 0.00 0.00 72.50 70.14 2rj4 s THR 153 CO 0.09 -0.32 1.59 -0.90 -2.21 0.00 0.00 174.62 172.88 2rj4 n ASP 154 N 0.55 0.78 -3.44 8.08 5.75 -1.25 -1.25 116.55 125.77 2rj4 n ASP 154 Ca -0.19 -0.65 -0.26 0.00 -0.01 0.00 0.00 54.79 53.69 2rj4 n ASP 154 Cb 0.60 0.10 -0.09 0.00 -1.03 0.00 0.00 41.12 40.70 2rj4 n ASP 154 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2rj4 n GLN 155 N -0.92 1.20 -0.24 0.11 6.02 -1.26 -4.93 117.38 117.36 2rj4 n GLN 155 Ca 0.11 -3.78 0.23 0.00 -0.01 0.00 0.00 57.00 53.55 2rj4 n GLN 155 Cb 0.33 -1.78 0.59 0.00 1.02 0.00 0.00 30.24 30.40 2rj4 n GLN 155 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 2rj4 h PRO 156 N 4.75 0.24 0.00 -1.09 0.11 -1.96 0.29 132.00 134.35 2rj4 h PRO 156 Ca 0.17 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2rj4 h PRO 156 Cb 0.81 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.87 2rj4 h PRO 156 CO 0.57 0.16 0.00 0.00 -0.21 0.00 0.00 178.00 178.52 2rj4 n ALA 157 N -2.59 2.04 1.15 -0.75 0.00 -1.26 -2.77 120.51 116.33 2rj4 n ALA 157 Ca 0.20 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.70 2rj4 n ALA 157 Cb 0.84 -1.37 0.22 0.00 0.00 0.00 0.00 19.45 19.13 2rj4 n ALA 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rj4 n ALA 158 N -1.53 3.19 -2.24 0.00 0.00 0.09 -4.89 120.51 115.12 2rj4 n ALA 158 Ca 0.05 -0.53 -0.42 0.00 0.00 0.00 0.00 53.44 52.54 2rj4 n ALA 158 Cb 0.27 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 2rj4 n ALA 158 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2rj4 s VAL 159 N -2.41 3.89 0.54 0.00 1.01 -1.12 -4.93 120.40 117.39 2rj4 s VAL 159 Ca 0.23 1.16 -0.20 0.00 0.00 0.00 0.00 61.98 63.17 2rj4 s VAL 159 Cb 0.19 -3.75 -0.05 0.00 0.00 0.00 0.00 36.38 32.77 2rj4 s VAL 159 CO 0.51 -0.06 1.20 -2.16 0.00 0.00 0.00 175.10 174.59 2rj4 s PRO 160 N 3.20 3.29 -0.70 2.72 0.04 -1.26 -4.94 135.00 137.35 2rj4 s PRO 160 Ca 0.63 1.83 -0.24 0.00 0.04 0.00 0.00 61.00 63.26 2rj4 s PRO 160 Cb -0.28 -2.12 0.05 0.00 0.04 0.00 0.00 34.50 32.19 2rj4 s PRO 160 CO 0.23 -0.96 1.10 1.03 0.04 0.00 0.00 177.00 178.45 2rj4 s ARG 161 N -3.08 3.16 -0.13 4.56 0.52 -1.26 -5.00 118.95 117.71 2rj4 s ARG 161 Ca 0.72 -0.61 -0.05 0.00 -0.52 0.00 0.00 55.73 55.26 2rj4 s ARG 161 Cb -0.30 -4.24 -0.04 0.00 0.52 0.00 0.00 34.95 30.89 2rj4 s ARG 161 CO 0.34 -1.96 0.06 0.08 0.02 0.00 0.00 175.30 173.84 2rj4 s VAL 162 N 4.74 4.79 -0.08 3.52 1.01 -1.26 -5.07 120.40 128.05 2rj4 s VAL 162 Ca 0.28 -0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.91 2rj4 s VAL 162 Cb -0.13 -3.09 -0.02 0.00 0.00 0.00 0.00 36.38 33.14 2rj4 s VAL 162 CO 0.11 0.55 1.07 -0.89 0.00 0.00 0.00 175.10 175.95 2rj4 s THR 163 N -0.41 4.60 -0.04 3.92 2.01 -1.26 -5.03 115.64 119.43 2rj4 s THR 163 Ca 0.09 1.88 0.01 0.00 0.31 0.00 0.00 61.69 63.99 2rj4 s THR 163 Cb -0.12 -4.21 -0.03 0.00 0.01 0.00 0.00 72.50 68.15 2rj4 s THR 163 CO 0.02 0.01 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.18 2rj4 s LEU 164 N 1.99 3.42 0.98 4.42 1.43 -1.26 -5.01 118.68 124.65 2rj4 s LEU 164 Ca 0.51 0.01 -0.12 0.00 -1.03 0.00 0.00 54.13 53.51 2rj4 s LEU 164 Cb -0.21 -1.87 0.18 0.00 0.03 0.00 0.00 46.19 44.32 2rj4 s LEU 164 CO 0.20 0.32 1.08 -0.83 0.23 0.00 0.00 176.35 177.36 2rj4 s GLY 165 N -1.21 1.60 0.50 -3.19 0.00 -1.26 -4.94 107.32 98.81 2rj4 s GLY 165 Ca 0.16 -0.10 -0.23 0.00 0.00 0.00 0.00 44.72 44.55 2rj4 s GLY 165 CO 0.06 0.46 1.34 -1.08 0.00 0.00 0.00 173.10 173.88 2rj4 s THR 166 N -2.82 2.28 -0.09 0.90 -1.32 -1.26 -2.67 115.64 110.66 2rj4 s THR 166 Ca 0.65 0.22 0.00 0.00 -1.21 0.00 0.00 61.69 61.35 2rj4 s THR 166 Cb -0.20 -3.12 0.00 0.00 -1.51 0.00 0.00 72.50 67.67 2rj4 s THR 166 CO 0.59 0.01 0.00 0.61 -2.21 0.00 0.00 174.62 173.62 2rj4 n GLY 167 N 0.65 0.49 3.09 6.08 0.00 -1.26 -4.96 105.19 109.28 2rj4 n GLY 167 Ca 0.08 -0.43 -0.24 0.00 0.00 0.00 0.00 46.02 45.43 2rj4 n GLY 167 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rj4 s ARG 168 N -1.04 1.48 0.06 1.61 0.52 -1.09 -2.15 118.95 118.33 2rj4 s ARG 168 Ca 0.00 -0.51 -0.01 0.00 -0.52 0.00 0.00 55.73 54.70 2rj4 s ARG 168 Cb 0.00 -1.32 -0.04 0.00 0.52 0.00 0.00 34.95 34.11 2rj4 s ARG 168 CO 0.00 0.21 -0.03 1.14 0.02 0.00 0.00 175.30 176.64 2rj4 s GLN 169 N 0.06 0.64 -0.03 3.54 -2.07 -0.37 -4.79 119.66 116.64 2rj4 s GLN 169 Ca -0.03 -1.24 0.01 0.00 -1.82 0.00 0.00 55.36 52.29 2rj4 s GLN 169 Cb -0.10 0.19 0.01 0.00 -1.09 0.00 0.00 33.01 32.02 2rj4 s GLN 169 CO 0.01 -0.12 -0.05 -1.17 -1.32 0.00 0.00 175.29 172.65 2rj4 s LEU 170 N -2.93 1.58 -0.05 2.60 0.20 -1.26 -0.27 118.68 118.54 2rj4 s LEU 170 Ca 0.08 -0.12 0.05 0.00 0.69 0.00 0.00 54.13 54.84 2rj4 s LEU 170 Cb 0.08 -0.39 -0.02 0.00 -0.43 0.00 0.00 46.19 45.43 2rj4 s LEU 170 CO -0.09 -0.01 -0.20 -0.44 -0.29 0.00 0.00 176.35 175.32 2rj4 s SER 171 N 0.51 3.50 -0.25 3.68 0.01 -0.18 -4.96 113.70 116.02 2rj4 s SER 171 Ca -0.06 -0.37 -0.10 0.00 1.31 0.00 0.00 55.95 56.73 2rj4 s SER 171 Cb -0.10 -0.82 -0.04 0.00 0.21 0.00 0.00 66.02 65.27 2rj4 s SER 171 CO -0.00 0.29 0.14 -0.69 0.41 0.00 0.00 173.24 173.38 2rj4 s VAL 172 N -0.40 5.04 -0.22 3.43 1.01 -1.26 -1.10 120.40 126.90 2rj4 s VAL 172 Ca 0.04 0.07 -0.03 0.00 0.00 0.00 0.00 61.98 62.06 2rj4 s VAL 172 Cb -0.12 -3.36 0.00 0.00 0.00 0.00 0.00 36.38 32.90 2rj4 s VAL 172 CO 0.02 0.33 -0.07 -0.76 0.00 0.00 0.00 175.10 174.62 2rj4 s LEU 173 N 1.32 2.86 -0.03 3.92 2.01 0.51 -4.96 118.68 124.30 2rj4 s LEU 173 Ca 0.06 -0.56 -0.27 0.00 0.01 0.00 0.00 54.13 53.37 2rj4 s LEU 173 Cb -0.15 -1.68 -0.03 0.00 0.01 0.00 0.00 46.19 44.34 2rj4 s LEU 173 CO 0.06 -0.05 0.88 -0.70 1.01 0.00 0.00 176.35 177.55 2rj4 s GLU 174 N 1.41 4.50 0.21 1.70 2.12 -1.26 -1.27 118.70 126.12 2rj4 s GLU 174 Ca 0.04 1.21 0.02 0.00 0.36 0.00 0.00 54.97 56.61 2rj4 s GLU 174 Cb -0.15 -3.46 -0.05 0.00 0.26 0.00 0.00 34.13 30.73 2rj4 s GLU 174 CO -0.05 -0.03 0.02 0.14 -0.54 0.00 0.00 175.26 174.80 2rj4 s VAL 175 N 1.01 0.81 0.43 3.70 -7.23 -0.38 -4.90 120.40 113.84 2rj4 s VAL 175 Ca 0.46 -2.01 -0.22 0.00 -1.81 0.00 0.00 61.98 58.40 2rj4 s VAL 175 Cb -0.20 -2.30 -0.09 0.00 0.56 0.00 0.00 36.38 34.35 2rj4 s VAL 175 CO 0.24 -0.33 1.01 0.00 -0.31 0.00 0.00 175.10 175.70 2rj4 s ARG 176 N -3.91 4.10 -0.27 4.82 1.70 -1.26 -3.87 118.95 120.25 2rj4 s ARG 176 Ca 0.28 1.34 -0.14 0.00 -0.47 0.00 0.00 55.73 56.74 2rj4 s ARG 176 Cb 0.06 -2.32 -0.04 0.00 -0.57 0.00 0.00 34.95 32.08 2rj4 s ARG 176 CO 0.08 -0.17 0.35 0.00 -1.08 0.00 0.00 175.30 174.47 2rj4 s ALA 177 N -1.90 3.56 0.48 7.88 0.00 -1.26 -4.88 121.76 125.64 2rj4 s ALA 177 Ca 0.61 -0.84 -0.18 0.00 0.00 0.00 0.00 51.96 51.55 2rj4 s ALA 177 Cb -0.16 -2.67 -0.09 0.00 0.00 0.00 0.00 23.12 20.19 2rj4 s ALA 177 CO 0.21 -0.63 0.98 0.71 0.00 0.00 0.00 175.76 177.03 2rj4 s TYR 178 N 2.00 3.36 0.03 0.00 1.51 -1.26 -5.01 117.35 117.98 2rj4 s TYR 178 Ca 0.14 1.53 -0.26 0.00 -1.01 0.00 0.00 57.07 57.47 2rj4 s TYR 178 Cb -0.16 -2.83 -0.17 0.00 -0.11 0.00 0.00 41.96 38.69 2rj4 s TYR 178 CO 0.10 -0.30 1.38 -0.22 -1.11 0.00 0.00 175.55 175.39 2rj4 h LYS 179 N 1.33 -0.35 -6.55 -0.62 3.64 -1.98 -3.44 116.57 108.60 2rj4 h LYS 179 Ca -0.48 0.02 -0.52 0.00 -1.27 0.00 0.00 60.65 58.41 2rj4 h LYS 179 Cb 1.18 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.06 2rj4 h LYS 179 CO 0.61 -0.07 0.32 1.03 -2.27 0.00 0.00 179.45 179.08 2rj4 s ARG 180 N -5.06 4.69 0.41 1.90 0.52 -1.26 -4.95 118.95 115.20 2rj4 s ARG 180 Ca -0.15 1.39 0.07 0.00 -0.52 0.00 0.00 55.73 56.53 2rj4 s ARG 180 Cb 0.03 -3.36 0.85 0.00 0.52 0.00 0.00 34.95 32.99 2rj4 s ARG 180 CO 0.59 0.28 2.06 0.11 0.02 0.00 0.00 175.30 178.35 2rj4 h TRP 181 N 5.36 0.51 -0.79 -0.53 5.08 -1.87 -1.25 115.95 122.47 2rj4 h TRP 181 Ca -0.43 0.01 0.02 0.00 1.08 0.00 0.00 58.89 59.56 2rj4 h TRP 181 Cb 1.21 -0.17 -0.04 0.00 -3.00 0.00 0.00 29.16 27.15 2rj4 h TRP 181 CO 0.64 0.33 0.52 1.96 -1.28 0.00 0.00 178.44 180.61 2rj4 h GLN 182 N 0.55 1.01 -0.29 0.12 7.50 -1.97 0.28 115.11 122.30 2rj4 h GLN 182 Ca 0.15 -0.06 -0.13 0.00 0.50 0.00 0.00 58.65 59.11 2rj4 h GLN 182 Cb -0.05 -0.23 -0.00 0.00 0.05 0.00 0.00 27.48 27.25 2rj4 h GLN 182 CO -0.03 0.67 -0.33 -0.44 -1.50 0.00 0.00 178.83 177.19 2rj4 h ASP 183 N 1.04 0.80 -0.43 1.46 3.32 -1.74 0.17 116.42 121.04 2rj4 h ASP 183 Ca 0.30 -0.48 0.06 0.00 0.02 0.00 0.00 57.03 56.92 2rj4 h ASP 183 Cb -0.08 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 39.19 2rj4 h ASP 183 CO -0.08 1.12 0.13 0.58 -1.72 0.00 0.00 179.24 179.27 2rj4 h VAL 184 N 0.49 0.82 -0.04 -1.35 2.07 -0.98 0.18 116.25 117.45 2rj4 h VAL 184 Ca 0.04 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 2rj4 h VAL 184 Cb 0.92 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 31.21 2rj4 h VAL 184 CO 0.08 0.05 0.00 -1.28 0.02 0.00 0.00 177.57 176.44 2rj4 h SER 185 N 0.28 0.07 -0.43 0.57 0.87 -0.86 -3.29 113.55 110.77 2rj4 h SER 185 Ca 0.21 -0.29 -0.04 0.00 -1.23 0.00 0.00 61.79 60.44 2rj4 h SER 185 Cb 0.23 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.15 2rj4 h SER 185 CO -0.24 0.34 0.11 0.24 -0.53 0.00 0.00 176.83 176.76 2rj4 h MET 186 N -0.21 0.68 0.00 2.24 2.07 -0.81 -3.08 114.93 115.83 2rj4 h MET 186 Ca 0.01 -0.16 0.00 0.00 -2.07 0.00 0.00 59.70 57.48 2rj4 h MET 186 Cb 0.30 -0.09 0.00 0.00 -1.87 0.00 0.00 31.60 29.94 2rj4 h MET 186 CO 0.00 0.68 0.00 0.54 1.07 0.00 0.00 176.91 179.21 2rj4 n ARG 187 N -4.54 0.23 -0.28 1.72 5.12 0.04 -1.74 116.66 117.21 2rj4 n ARG 187 Ca 0.00 0.12 0.08 0.00 -1.93 0.00 0.00 57.85 56.12 2rj4 n ARG 187 Cb 0.20 -1.50 0.31 0.00 -1.16 0.00 0.00 32.46 30.32 2rj4 n ARG 187 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2rj4 h ARG 188 N 0.00 0.82 -0.03 5.56 3.08 -1.60 -1.14 114.38 121.07 2rj4 h ARG 188 Ca 0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.00 2rj4 h ARG 188 Cb 0.07 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 29.94 2rj4 h ARG 188 CO 0.00 0.55 0.02 0.52 -1.07 0.00 0.00 179.97 179.98 2rj4 h MET 189 N 0.85 0.03 -0.31 0.04 2.86 -1.58 0.12 114.93 116.94 2rj4 h MET 189 Ca 0.41 -0.00 0.02 0.00 -2.06 0.00 0.00 59.70 58.07 2rj4 h MET 189 Cb 0.45 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.08 2rj4 h MET 189 CO -0.18 0.03 0.17 1.49 1.06 0.00 0.00 176.91 179.48 2rj4 h GLU 190 N 0.03 0.34 -0.43 1.72 4.81 -1.69 -1.69 114.58 117.67 2rj4 h GLU 190 Ca 0.01 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.13 2rj4 h GLU 190 Cb 0.00 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 2rj4 h GLU 190 CO -0.00 0.23 -0.09 0.52 -0.73 0.00 0.00 179.01 178.93 2rj4 h MET 191 N 0.35 0.75 -0.19 1.92 2.86 -0.84 -2.80 114.93 116.99 2rj4 h MET 191 Ca 0.13 -0.24 -0.17 0.00 -2.06 0.00 0.00 59.70 57.35 2rj4 h MET 191 Cb 0.02 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 2rj4 h MET 191 CO -0.07 0.83 -0.60 0.82 1.06 0.00 0.00 176.91 178.95 2rj4 h ILE 192 N 0.69 1.32 0.00 -1.22 2.04 -0.68 -3.32 117.51 116.33 2rj4 h ILE 192 Ca 0.12 -1.85 0.00 0.00 1.00 0.00 0.00 64.86 64.13 2rj4 h ILE 192 Cb 0.56 1.81 0.00 0.00 -0.74 0.00 0.00 36.82 38.45 2rj4 h ILE 192 CO 0.03 0.58 0.00 -1.54 0.00 0.00 0.00 178.15 177.22 2rj4 n SER 193 N -3.95 0.00 -4.18 1.72 3.41 -0.65 -4.40 113.62 105.58 2rj4 n SER 193 Ca -0.04 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.25 2rj4 n SER 193 Cb 0.64 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.42 2rj4 n SER 193 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2rj4 s PHE 195 N 0.00 2.68 0.00 7.33 0.40 -1.26 -1.73 117.98 125.39 2rj4 s PHE 195 Ca 0.00 -1.32 0.00 0.00 -0.60 0.00 0.00 56.93 55.01 2rj4 s PHE 195 Cb 0.00 -1.82 0.00 0.00 0.51 0.00 0.00 43.02 41.71 2rj4 s PHE 195 CO 0.00 -0.60 0.00 0.00 0.70 0.00 0.00 175.22 175.32 2rj4 s GLU 197 N -1.79 3.72 0.00 0.00 0.41 -0.70 -4.95 118.70 115.39 2rj4 s GLU 197 Ca 0.00 -0.46 0.01 0.00 -0.41 0.00 0.00 54.97 54.11 2rj4 s GLU 197 Cb 0.00 -3.20 -0.01 0.00 -1.78 0.00 0.00 34.13 29.14 2rj4 s GLU 197 CO 0.00 0.00 0.18 0.54 -0.49 0.00 0.00 175.26 175.50 2rj4 n ARG 198 N 4.33 4.61 0.18 1.61 5.12 -1.26 -4.65 116.66 126.60 2rj4 n ARG 198 Ca -0.17 -0.16 0.05 0.00 -1.93 0.00 0.00 57.85 55.65 2rj4 n ARG 198 Cb 0.52 -0.68 0.33 0.00 -1.16 0.00 0.00 32.46 31.46 2rj4 n ARG 198 CO 0.00 0.00 0.00 0.07 -1.93 0.00 0.00 177.63 175.77 2rj4 h ARG 199 N 0.07 0.00 -0.59 5.56 0.11 -1.99 -3.34 114.38 114.20 2rj4 h ARG 199 Ca 0.00 0.00 0.06 0.00 0.10 0.00 0.00 59.98 60.14 2rj4 h ARG 199 Cb 0.04 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.06 2rj4 h ARG 199 CO 0.00 0.39 0.30 0.74 0.10 0.00 0.00 179.97 181.51 2rj4 h PHE 200 N 0.00 0.56 -0.63 4.08 0.04 -1.95 -1.34 116.94 117.70 2rj4 h PHE 200 Ca -0.00 0.02 0.09 0.00 2.80 0.00 0.00 57.97 60.88 2rj4 h PHE 200 Cb 0.89 -0.16 -0.04 0.00 2.20 0.00 0.00 35.95 38.84 2rj4 h PHE 200 CO 0.00 0.26 0.42 -0.07 -0.60 0.00 0.00 178.31 178.32 2rj4 h LEU 201 N 0.57 0.46 0.00 1.54 3.38 -1.83 -1.18 115.31 118.25 2rj4 h LEU 201 Ca 0.27 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2rj4 h LEU 201 Cb 0.19 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2rj4 h LEU 201 CO -0.19 0.28 -0.83 0.77 0.09 0.00 0.00 178.44 178.57 2rj4 h SER 202 N 0.51 0.00 0.00 -0.43 4.64 -1.50 -3.41 113.55 113.36 2rj4 h SER 202 Ca 0.29 -0.13 -0.21 0.00 -0.47 0.00 0.00 61.79 61.27 2rj4 h SER 202 Cb 0.45 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.50 2rj4 h SER 202 CO -0.09 0.07 -1.86 -0.62 -0.87 0.00 0.00 176.83 173.46 2rj4 n GLU 203 N -2.37 1.73 -4.14 4.77 1.02 -0.62 -5.05 120.64 115.97 2rj4 n GLU 203 Ca 0.02 -0.02 -0.09 0.00 -0.02 0.00 0.00 57.16 57.04 2rj4 n GLU 203 Cb 0.49 -1.33 -0.10 0.00 -0.02 0.00 0.00 31.44 30.48 2rj4 n GLU 203 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2rj4 s VAL 204 N -2.39 0.34 -0.16 2.62 -7.23 -0.53 -4.94 120.40 108.12 2rj4 s VAL 204 Ca -0.06 -1.88 0.07 0.00 -1.81 0.00 0.00 61.98 58.30 2rj4 s VAL 204 Cb 0.04 -1.77 -0.23 0.00 0.56 0.00 0.00 36.38 34.99 2rj4 s VAL 204 CO 0.54 -0.76 0.20 0.47 -0.31 0.00 0.00 175.10 175.23 2rj4 n ASP 205 N -0.02 1.16 -4.22 4.85 8.00 0.31 -4.65 116.55 121.98 2rj4 n ASP 205 Ca -0.10 0.11 -0.19 0.00 0.71 0.00 0.00 54.79 55.31 2rj4 n ASP 205 Cb 0.62 -0.01 -0.12 0.00 -0.02 0.00 0.00 41.12 41.59 2rj4 n ASP 205 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2rj4 s TYR 206 N -2.54 1.39 -0.07 1.24 2.02 -1.09 -2.83 117.35 115.48 2rj4 s TYR 206 Ca -0.18 -0.48 0.06 0.00 -0.37 0.00 0.00 57.07 56.10 2rj4 s TYR 206 Cb 0.07 -0.76 -0.01 0.00 -0.40 0.00 0.00 41.96 40.86 2rj4 s TYR 206 CO 0.76 0.12 -0.24 -0.51 -1.57 0.00 0.00 175.55 174.10 2rj4 s LEU 207 N -1.98 2.11 -0.11 -1.29 1.43 0.24 -0.54 118.68 118.54 2rj4 s LEU 207 Ca 0.03 -0.50 0.03 0.00 -1.03 0.00 0.00 54.13 52.66 2rj4 s LEU 207 Cb -0.09 -1.39 0.01 0.00 0.03 0.00 0.00 46.19 44.75 2rj4 s LEU 207 CO 0.03 0.23 -0.21 -0.69 0.23 0.00 0.00 176.35 175.94 2rj4 s VAL 208 N -0.09 1.90 -0.22 -1.59 1.01 0.41 -1.28 120.40 120.55 2rj4 s VAL 208 Ca -0.06 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.04 2rj4 s VAL 208 Cb -0.14 -1.67 0.04 0.00 0.00 0.00 0.00 36.38 34.60 2rj4 s VAL 208 CO 0.04 0.52 -0.16 0.00 0.00 0.00 0.00 175.10 175.51 2rj4 s VAL 210 N 1.21 1.02 0.62 0.00 -7.23 -1.02 -2.03 120.40 112.97 2rj4 s VAL 210 Ca -0.01 -1.98 -0.16 0.00 -1.81 0.00 0.00 61.98 58.02 2rj4 s VAL 210 Cb -0.16 -1.75 -0.02 0.00 0.56 0.00 0.00 36.38 35.01 2rj4 s VAL 210 CO -0.09 -0.76 1.10 -1.81 -0.31 0.00 0.00 175.10 173.22 2rj4 s ASP 211 N -3.05 5.40 0.08 4.85 1.11 -0.83 -4.39 116.67 119.84 2rj4 s ASP 211 Ca 0.14 1.96 0.19 0.00 0.18 0.00 0.00 52.55 55.02 2rj4 s ASP 211 Cb 0.03 -2.55 -0.12 0.00 1.07 0.00 0.00 42.92 41.34 2rj4 s ASP 211 CO -0.01 -1.43 0.80 0.55 1.18 0.00 0.00 175.17 176.27 2rj4 n VAL 212 N -2.15 0.91 -1.21 -1.27 3.14 -1.26 -4.52 118.33 111.98 2rj4 n VAL 212 Ca 0.10 -0.64 -0.32 0.00 -2.96 0.00 0.00 64.34 60.51 2rj4 n VAL 212 Cb 0.52 -0.53 -0.06 0.00 -1.06 0.00 0.00 33.84 32.72 2rj4 n VAL 212 CO 0.00 0.00 0.00 -0.90 -6.46 0.00 0.00 176.83 169.47 2rj4 n ASP 213 N -2.75 7.80 -3.78 6.55 5.75 -1.26 -4.71 116.55 124.15 2rj4 n ASP 213 Ca -0.08 -2.53 -0.10 0.00 -0.01 0.00 0.00 54.79 52.08 2rj4 n ASP 213 Cb 0.75 -1.49 -0.06 0.00 -1.03 0.00 0.00 41.12 39.28 2rj4 n ASP 213 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 2rj4 s MET 214 N 2.03 1.01 0.00 0.11 -1.94 -1.26 -1.57 119.30 117.68 2rj4 s MET 214 Ca 0.67 -0.89 -0.02 0.00 -1.71 0.00 0.00 55.69 53.74 2rj4 s MET 214 Cb 0.20 0.41 -0.01 0.00 2.01 0.00 0.00 34.83 37.44 2rj4 s MET 214 CO -0.05 -0.37 0.03 -1.83 -0.01 0.00 0.00 175.02 172.80 2rj4 s GLU 215 N -3.86 0.24 0.09 2.03 -1.05 -0.12 -4.06 118.70 111.97 2rj4 s GLU 215 Ca 0.06 -0.30 -0.27 0.00 -0.15 0.00 0.00 54.97 54.32 2rj4 s GLU 215 Cb 0.03 0.09 -0.06 0.00 -0.44 0.00 0.00 34.13 33.75 2rj4 s GLU 215 CO -0.09 -0.04 0.83 -0.06 0.95 0.00 0.00 175.26 176.85 2rj4 s PHE 216 N -0.85 3.79 -0.00 4.83 0.40 -1.26 -1.03 117.98 123.86 2rj4 s PHE 216 Ca -0.09 1.61 0.00 0.00 -0.60 0.00 0.00 56.93 57.85 2rj4 s PHE 216 Cb -0.06 -2.89 -0.00 0.00 0.51 0.00 0.00 43.02 40.58 2rj4 s PHE 216 CO -0.00 0.29 0.01 0.54 0.70 0.00 0.00 175.22 176.76 2rj4 n ARG 217 N 2.58 4.67 -3.89 0.44 1.74 0.90 -4.83 116.66 118.27 2rj4 n ARG 217 Ca -0.01 -0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.96 2rj4 n ARG 217 Cb 0.50 -0.67 0.00 0.00 -1.02 0.00 0.00 32.46 31.27 2rj4 n ARG 217 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2rj4 s ASP 218 N -1.34 0.23 0.03 0.55 3.68 -1.03 -4.92 116.67 113.87 2rj4 s ASP 218 Ca 0.00 -1.20 -0.35 0.00 2.13 0.00 0.00 52.55 53.13 2rj4 s ASP 218 Cb 0.00 0.79 -0.14 0.00 -1.45 0.00 0.00 42.92 42.12 2rj4 s ASP 218 CO 0.01 -1.56 1.64 1.57 0.13 0.00 0.00 175.17 176.96 2rj4 n HIS 219 N -0.53 2.14 -3.85 -5.34 -0.00 -1.26 -4.77 115.22 101.60 2rj4 n HIS 219 Ca -0.06 0.28 -0.29 0.00 -0.00 0.00 0.00 57.72 57.65 2rj4 n HIS 219 Cb 0.60 -2.53 -0.16 0.00 -0.00 0.00 0.00 29.99 27.90 2rj4 n HIS 219 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 2rj4 s VAL 220 N 2.04 1.10 0.00 3.57 1.01 -0.28 -4.89 120.40 122.95 2rj4 s VAL 220 Ca 0.86 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.86 2rj4 s VAL 220 Cb -0.77 -1.49 0.00 0.00 0.00 0.00 0.00 36.38 34.12 2rj4 s VAL 220 CO 0.46 -0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.99 2rj4 n GLY 221 N 4.83 5.86 0.00 4.51 0.00 -1.26 -0.89 105.19 118.24 2rj4 n GLY 221 Ca -0.10 -1.55 0.06 0.00 0.00 0.00 0.00 46.02 44.43 2rj4 n GLY 221 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2rj4 n VAL 222 N 0.00 1.11 0.27 1.61 0.24 -1.26 -1.86 118.33 118.44 2rj4 n VAL 222 Ca 0.00 0.28 0.18 0.00 -2.04 0.00 0.00 64.34 62.76 2rj4 n VAL 222 Cb 0.00 -1.06 0.93 0.00 -1.47 0.00 0.00 33.84 32.24 2rj4 n VAL 222 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 2rj4 h GLU 223 N 0.00 0.00 0.00 7.34 9.09 -1.95 -0.96 114.58 128.10 2rj4 h GLU 223 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2rj4 h GLU 223 Cb 0.21 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.31 2rj4 h GLU 223 CO 0.00 0.00 -0.38 -0.84 0.05 0.00 0.00 179.01 177.84 2rj4 h ILE 224 N 0.00 0.00 -3.75 -1.06 3.07 -1.79 -3.47 117.51 110.51 2rj4 h ILE 224 Ca 0.04 -0.52 -0.49 0.00 1.55 0.00 0.00 64.86 65.44 2rj4 h ILE 224 Cb 0.42 1.27 -0.02 0.00 -0.27 0.00 0.00 36.82 38.23 2rj4 h ILE 224 CO -0.00 0.00 0.36 -0.76 -1.05 0.00 0.00 178.15 176.70 2rj4 s LEU 225 N -4.45 4.64 -0.22 0.16 1.43 -0.37 -4.88 118.68 115.00 2rj4 s LEU 225 Ca 0.08 1.96 -0.37 0.00 -1.03 0.00 0.00 54.13 54.77 2rj4 s LEU 225 Cb 0.13 -3.61 0.15 0.00 0.03 0.00 0.00 46.19 42.89 2rj4 s LEU 225 CO 0.67 0.14 1.40 0.28 0.23 0.00 0.00 176.35 179.07 2rj4 s THR 226 N -1.14 0.00 0.29 5.49 -1.32 -1.26 -5.04 115.64 112.66 2rj4 s THR 226 Ca 0.41 -0.01 0.04 0.00 -1.21 0.00 0.00 61.69 60.92 2rj4 s THR 226 Cb -0.26 -1.34 0.29 0.00 -1.51 0.00 0.00 72.50 69.68 2rj4 s THR 226 CO 0.32 0.00 1.80 -0.65 -2.21 0.00 0.00 174.62 173.89 2rj4 h PRO 227 N 2.00 0.84 -2.50 7.08 0.11 -1.94 -3.10 132.00 134.49 2rj4 h PRO 227 Ca -0.13 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 65.85 2rj4 h PRO 227 Cb 1.15 -0.19 -0.26 0.00 0.11 0.00 0.00 31.00 31.81 2rj4 h PRO 227 CO 0.22 0.56 -0.30 -1.17 -0.21 0.00 0.00 178.00 177.10 2rj4 s LEU 228 N -10.27 -0.46 0.06 2.35 2.96 -1.26 -0.69 118.68 111.36 2rj4 s LEU 228 Ca -0.12 1.02 0.03 0.00 -0.22 0.00 0.00 54.13 54.85 2rj4 s LEU 228 Cb 0.24 1.47 -0.03 0.00 0.50 0.00 0.00 46.19 48.37 2rj4 s LEU 228 CO 0.80 -0.22 -0.10 0.72 -1.32 0.00 0.00 176.35 176.24 2rj4 s PHE 229 N 2.04 0.90 0.39 5.38 -0.12 0.29 0.17 117.98 127.04 2rj4 s PHE 229 Ca -0.06 -0.50 0.04 0.00 -0.05 0.00 0.00 56.93 56.36 2rj4 s PHE 229 Cb -0.10 -0.52 -0.06 0.00 -0.63 0.00 0.00 43.02 41.71 2rj4 s PHE 229 CO -0.14 -0.03 0.04 0.20 -0.05 0.00 0.00 175.22 175.25 2rj4 s GLY 230 N -1.72 2.45 -0.05 1.99 0.00 -1.21 -2.23 107.32 106.55 2rj4 s GLY 230 Ca -0.06 -1.76 0.05 0.00 0.00 0.00 0.00 44.72 42.95 2rj4 s GLY 230 CO 0.01 -1.98 -0.19 -1.59 0.00 0.00 0.00 173.10 169.35 2rj4 s THR 231 N -3.02 1.62 0.03 0.90 2.01 -1.23 -0.56 115.64 115.40 2rj4 s THR 231 Ca 0.29 -0.82 -0.30 0.00 0.31 0.00 0.00 61.69 61.17 2rj4 s THR 231 Cb 0.07 -1.39 -0.07 0.00 0.01 0.00 0.00 72.50 71.12 2rj4 s THR 231 CO 0.14 0.46 1.56 -0.76 -0.69 0.00 0.00 174.62 175.33 2rj4 s LEU 232 N 0.04 4.34 0.21 4.42 1.43 -0.01 -0.98 118.68 128.13 2rj4 s LEU 232 Ca -0.05 2.32 -0.32 0.00 -1.03 0.00 0.00 54.13 55.05 2rj4 s LEU 232 Cb -0.13 -3.56 -0.12 0.00 0.03 0.00 0.00 46.19 42.42 2rj4 s LEU 232 CO 0.03 -0.83 1.69 -2.28 0.23 0.00 0.00 176.35 175.20 2rj4 s HIS 233 N 2.67 2.92 0.32 0.29 5.65 -0.43 -4.22 115.29 122.48 2rj4 s HIS 233 Ca 0.70 0.41 0.38 0.00 0.25 0.00 0.00 55.06 56.80 2rj4 s HIS 233 Cb -0.36 -4.11 1.83 0.00 -1.18 0.00 0.00 32.58 28.77 2rj4 s HIS 233 CO 0.30 -4.15 2.14 -1.00 -0.65 0.00 0.00 174.74 171.37 2rj4 h PRO 234 N 6.66 0.00 -0.00 2.88 0.13 -1.91 -2.26 132.00 137.49 2rj4 h PRO 234 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2rj4 h PRO 234 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2rj4 h PRO 234 CO 0.94 0.00 -0.30 0.43 -0.23 0.00 0.00 178.00 178.85 2rj4 n SER 235 N -3.01 0.47 0.00 1.44 7.64 -1.26 -4.40 113.62 114.51 2rj4 n SER 235 Ca -0.01 -0.25 0.00 0.00 1.01 0.00 0.00 58.87 59.62 2rj4 n SER 235 Cb 0.18 0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 2rj4 n SER 235 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2rj4 n PHE 236 N -1.28 0.00 0.26 1.43 3.01 -0.87 -4.82 117.46 115.19 2rj4 n PHE 236 Ca 0.08 -0.02 0.11 0.00 1.01 0.00 0.00 57.45 58.63 2rj4 n PHE 236 Cb 0.33 -0.00 0.68 0.00 -0.01 0.00 0.00 39.48 40.48 2rj4 n PHE 236 CO 0.00 0.00 0.00 0.10 1.01 0.00 0.00 176.76 177.87 2rj4 h TYR 237 N 0.00 0.00 -0.65 1.38 -0.00 -1.72 -0.81 116.97 115.16 2rj4 h TYR 237 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 2rj4 h TYR 237 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.05 2rj4 h TYR 237 CO 0.00 0.13 0.00 0.41 -0.00 0.00 0.00 178.16 178.70 2rj4 n GLY 238 N -0.79 2.59 3.90 0.10 0.00 -1.26 -5.01 105.19 104.72 2rj4 n GLY 238 Ca -0.02 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 2rj4 n GLY 238 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rj4 s SER 239 N -1.00 6.49 0.53 1.61 0.01 -0.31 -5.08 113.70 115.94 2rj4 s SER 239 Ca 0.44 0.68 -0.18 0.00 1.31 0.00 0.00 55.95 58.20 2rj4 s SER 239 Cb 0.24 -2.13 -0.06 0.00 0.21 0.00 0.00 66.02 64.28 2rj4 s SER 239 CO 0.29 -0.07 1.04 -0.94 0.41 0.00 0.00 173.24 173.97 2rj4 s SER 240 N -2.76 6.13 0.55 2.44 1.04 -1.26 -4.95 113.70 114.88 2rj4 s SER 240 Ca 0.43 1.86 0.22 0.00 0.48 0.00 0.00 55.95 58.94 2rj4 s SER 240 Cb -0.11 -2.55 1.49 0.00 0.10 0.00 0.00 66.02 64.96 2rj4 s SER 240 CO 0.26 -0.93 2.19 0.08 0.98 0.00 0.00 173.24 175.82 2rj4 h ARG 241 N 1.06 0.00 0.00 4.02 0.11 -1.92 -0.73 114.38 116.92 2rj4 h ARG 241 Ca -0.48 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.57 2rj4 h ARG 241 Cb 1.22 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.29 2rj4 h ARG 241 CO 0.58 0.00 -0.15 1.05 0.10 0.00 0.00 179.97 181.56 2rj4 h GLU 242 N 0.00 0.00 0.00 0.08 9.09 -1.92 -2.43 114.58 119.39 2rj4 h GLU 242 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2rj4 h GLU 242 Cb 0.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.11 2rj4 h GLU 242 CO 0.00 0.15 -0.46 0.00 0.05 0.00 0.00 179.01 178.75 2rj4 h ALA 243 N 1.85 0.75 -2.36 1.06 0.00 -1.51 -3.47 119.26 115.58 2rj4 h ALA 243 Ca -0.00 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.33 2rj4 h ALA 243 Cb 0.41 0.00 0.09 0.00 0.00 0.00 0.00 17.79 18.29 2rj4 h ALA 243 CO 0.02 0.00 0.53 1.19 0.00 0.00 0.00 179.25 180.99 2rj4 n PHE 244 N -2.67 2.12 -1.07 0.00 0.99 -0.92 -4.86 117.46 111.05 2rj4 n PHE 244 Ca 0.03 0.50 -0.16 0.00 -0.00 0.00 0.00 57.45 57.82 2rj4 n PHE 244 Cb 0.51 -2.42 -0.08 0.00 -1.00 0.00 0.00 39.48 36.49 2rj4 n PHE 244 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 2rj4 n THR 245 N 1.22 2.92 -0.75 4.37 -2.24 -1.26 -4.93 114.28 113.60 2rj4 n THR 245 Ca 0.09 -1.86 -0.31 0.00 -2.27 0.00 0.00 64.05 59.70 2rj4 n THR 245 Cb 0.33 -1.69 0.16 0.00 -2.10 0.00 0.00 70.33 67.03 2rj4 n THR 245 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2rj4 s TYR 246 N -0.48 1.70 0.01 4.78 4.12 -1.26 -4.76 117.35 121.46 2rj4 s TYR 246 Ca 0.49 1.74 -0.30 0.00 0.02 0.00 0.00 57.07 59.01 2rj4 s TYR 246 Cb 0.28 -3.30 -0.07 0.00 -1.52 0.00 0.00 41.96 37.36 2rj4 s TYR 246 CO -0.07 -2.76 1.58 -2.00 0.02 0.00 0.00 175.55 172.31 2rj4 s GLU 247 N -4.67 4.21 0.00 -0.62 2.56 -1.26 -4.90 118.70 114.02 2rj4 s GLU 247 Ca 0.66 2.18 0.17 0.00 0.00 0.00 0.00 54.97 57.98 2rj4 s GLU 247 Cb -0.22 -3.73 0.03 0.00 2.00 0.00 0.00 34.13 32.21 2rj4 s GLU 247 CO 0.58 -0.73 0.92 0.54 -0.56 0.00 0.00 175.26 176.01 2rj4 n ARG 248 N 6.08 1.59 -3.04 4.30 5.12 -1.26 -1.23 116.66 128.21 2rj4 n ARG 248 Ca 0.16 -1.01 -0.41 0.00 -1.93 0.00 0.00 57.85 54.66 2rj4 n ARG 248 Cb 0.42 -1.30 -0.06 0.00 -1.16 0.00 0.00 32.46 30.37 2rj4 n ARG 248 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2rj4 s ARG 249 N -1.81 4.14 0.43 5.56 0.52 -1.26 -4.87 118.95 121.66 2rj4 s ARG 249 Ca 0.15 0.68 0.28 0.00 -0.52 0.00 0.00 55.73 56.32 2rj4 s ARG 249 Cb 0.14 -3.64 1.53 0.00 0.52 0.00 0.00 34.95 33.49 2rj4 s ARG 249 CO 0.36 -0.42 1.86 -1.35 0.02 0.00 0.00 175.30 175.77 2rj4 h PRO 250 N 7.78 0.00 0.00 3.54 0.11 -1.97 -1.84 132.00 139.62 2rj4 h PRO 250 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2rj4 h PRO 250 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2rj4 h PRO 250 CO 0.80 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.63 2rj4 n GLN 251 N -2.50 0.07 -3.77 1.05 3.00 -1.26 -4.78 117.38 109.19 2rj4 n GLN 251 Ca -0.02 0.16 -0.36 0.00 -0.01 0.00 0.00 57.00 56.77 2rj4 n GLN 251 Cb 0.06 -1.60 -0.06 0.00 0.00 0.00 0.00 30.24 28.65 2rj4 n GLN 251 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2rj4 s SER 252 N -3.44 6.49 0.63 1.08 0.15 -0.69 -4.96 113.70 112.95 2rj4 s SER 252 Ca 0.10 0.57 0.41 0.00 0.70 0.00 0.00 55.95 57.73 2rj4 s SER 252 Cb 0.14 -2.10 2.10 0.00 -1.71 0.00 0.00 66.02 64.46 2rj4 s SER 252 CO 0.46 0.30 2.26 1.56 1.20 0.00 0.00 173.24 179.02 2rj4 h GLN 253 N 4.32 0.00 -0.02 5.44 1.08 -1.86 -1.93 115.11 122.14 2rj4 h GLN 253 Ca -0.51 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.69 2rj4 h GLN 253 Cb 1.21 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.64 2rj4 h GLN 253 CO 0.64 0.01 0.00 0.00 -0.95 0.00 0.00 178.83 178.52 2rj4 n ALA 254 N -2.10 2.61 -1.67 3.87 0.00 -1.26 -4.96 120.51 116.99 2rj4 n ALA 254 Ca -0.02 -0.34 -0.46 0.00 0.00 0.00 0.00 53.44 52.62 2rj4 n ALA 254 Cb 0.14 -1.30 -0.04 0.00 0.00 0.00 0.00 19.45 18.25 2rj4 n ALA 254 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2rj4 n TYR 255 N -0.29 2.28 -3.79 0.00 9.36 -0.73 -4.33 117.16 119.67 2rj4 n TYR 255 Ca 0.20 0.27 -0.23 0.00 3.32 0.00 0.00 57.90 61.47 2rj4 n TYR 255 Cb 0.25 -2.54 -0.17 0.00 -0.63 0.00 0.00 39.34 36.24 2rj4 n TYR 255 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 2rj4 s ILE 256 N 0.85 0.42 0.92 2.97 1.01 -0.37 -5.01 121.20 121.99 2rj4 s ILE 256 Ca 0.78 0.09 -0.12 0.00 0.00 0.00 0.00 60.65 61.41 2rj4 s ILE 256 Cb -0.67 -0.56 0.14 0.00 0.01 0.00 0.00 42.46 41.38 2rj4 s ILE 256 CO 0.38 0.27 1.10 -2.16 0.00 0.00 0.00 174.94 174.53 2rj4 s PRO 257 N 1.94 1.09 0.36 2.79 0.04 -1.26 -4.59 135.00 135.37 2rj4 s PRO 257 Ca 0.05 0.62 0.27 0.00 0.04 0.00 0.00 61.00 61.98 2rj4 s PRO 257 Cb -0.12 -1.81 1.18 0.00 0.04 0.00 0.00 34.50 33.79 2rj4 s PRO 257 CO -0.05 -2.30 1.81 0.87 0.04 0.00 0.00 177.00 177.36 2rj4 h LYS 258 N -1.59 0.00 -0.41 4.56 1.79 -1.97 -2.09 116.57 116.87 2rj4 h LYS 258 Ca -0.51 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.96 2rj4 h LYS 258 Cb 1.30 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.95 2rj4 h LYS 258 CO 0.57 0.00 0.00 -0.40 -1.08 0.00 0.00 179.45 178.54 2rj4 n ASP 259 N -2.49 3.08 -4.50 0.86 5.75 -1.26 -4.37 116.55 113.63 2rj4 n ASP 259 Ca 0.01 -1.94 -0.24 0.00 -0.01 0.00 0.00 54.79 52.61 2rj4 n ASP 259 Cb 0.21 -0.27 -0.10 0.00 -1.03 0.00 0.00 41.12 39.94 2rj4 n ASP 259 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2rj4 s GLU 260 N -1.47 1.79 0.00 0.11 2.02 -0.79 -5.10 118.70 115.26 2rj4 s GLU 260 Ca 0.38 -1.70 0.00 0.00 0.02 0.00 0.00 54.97 53.67 2rj4 s GLU 260 Cb 0.21 -1.84 0.00 0.00 0.10 0.00 0.00 34.13 32.60 2rj4 s GLU 260 CO 0.30 0.34 0.00 0.41 0.02 0.00 0.00 175.26 176.32 2rj4 n GLY 261 N -0.66 4.00 0.10 -1.39 0.00 -1.26 -4.80 105.19 101.18 2rj4 n GLY 261 Ca -0.05 -1.22 -0.14 0.00 0.00 0.00 0.00 46.02 44.61 2rj4 n GLY 261 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2rj4 n ASP 262 N 0.00 1.88 -4.12 1.61 8.00 -1.26 -4.94 116.55 117.73 2rj4 n ASP 262 Ca 0.00 0.46 -0.09 0.00 0.71 0.00 0.00 54.79 55.86 2rj4 n ASP 262 Cb 0.00 -0.85 -0.10 0.00 -0.02 0.00 0.00 41.12 40.16 2rj4 n ASP 262 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2rj4 s PHE 263 N -2.50 0.75 -0.37 1.24 0.40 -1.26 -4.99 117.98 111.25 2rj4 s PHE 263 Ca -0.26 -1.15 -0.12 0.00 -0.60 0.00 0.00 56.93 54.80 2rj4 s PHE 263 Cb 0.06 -0.42 0.02 0.00 0.51 0.00 0.00 43.02 43.18 2rj4 s PHE 263 CO 0.40 -0.51 0.23 -0.47 0.70 0.00 0.00 175.22 175.57 2rj4 s TYR 264 N -4.02 3.23 0.15 0.36 5.04 -1.26 -5.02 117.35 115.83 2rj4 s TYR 264 Ca 0.20 -0.72 -0.08 0.00 -2.44 0.00 0.00 57.07 54.03 2rj4 s TYR 264 Cb 0.07 -2.47 -0.06 0.00 0.35 0.00 0.00 41.96 39.84 2rj4 s TYR 264 CO -0.01 -0.57 0.45 0.71 -1.34 0.00 0.00 175.55 174.79 2rj4 s TYR 265 N 1.62 3.50 -0.08 4.97 1.51 -1.26 -1.32 117.35 126.29 2rj4 s TYR 265 Ca 0.04 0.76 -0.24 0.00 -1.01 0.00 0.00 57.07 56.62 2rj4 s TYR 265 Cb -0.19 -2.16 -0.03 0.00 -0.11 0.00 0.00 41.96 39.47 2rj4 s TYR 265 CO 0.08 0.40 0.74 1.41 -1.11 0.00 0.00 175.55 177.08 2rj4 s MET 266 N -2.45 4.43 0.50 -0.62 1.75 -0.15 -4.73 119.30 118.03 2rj4 s MET 266 Ca 0.41 0.95 0.34 0.00 -1.25 0.00 0.00 55.69 56.13 2rj4 s MET 266 Cb -0.13 -3.47 1.74 0.00 2.84 0.00 0.00 34.83 35.82 2rj4 s MET 266 CO 0.21 -0.01 2.03 0.78 -0.65 0.00 0.00 175.02 177.39 2rj4 h GLY 267 N 7.00 0.00 1.00 2.11 0.00 -1.91 -3.16 103.07 108.11 2rj4 h GLY 267 Ca -0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.94 2rj4 h GLY 267 CO 0.76 0.00 -0.06 0.00 0.00 0.00 0.00 176.54 177.25 2rj4 n ALA 268 N -1.96 2.67 -3.15 3.60 0.00 -1.26 -4.66 120.51 115.75 2rj4 n ALA 268 Ca -0.01 -0.23 0.04 0.00 0.00 0.00 0.00 53.44 53.23 2rj4 n ALA 268 Cb 0.11 -1.40 -0.00 0.00 0.00 0.00 0.00 19.45 18.16 2rj4 n ALA 268 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2rj4 s PHE 269 N -2.38 -1.63 0.23 0.00 5.99 -1.20 -1.96 117.98 117.04 2rj4 s PHE 269 Ca 0.33 0.86 -0.02 0.00 0.00 0.00 0.00 56.93 58.09 2rj4 s PHE 269 Cb 0.21 0.28 -0.03 0.00 0.00 0.00 0.00 43.02 43.48 2rj4 s PHE 269 CO 0.44 -0.97 0.23 -0.59 -0.00 0.00 0.00 175.22 174.34 2rj4 s PHE 270 N 2.71 1.07 -1.73 10.12 -0.12 -0.86 -3.49 117.98 125.68 2rj4 s PHE 270 Ca 0.13 -1.28 0.00 0.00 -0.05 0.00 0.00 56.93 55.73 2rj4 s PHE 270 Cb -0.08 -0.41 0.00 0.00 -0.63 0.00 0.00 43.02 41.90 2rj4 s PHE 270 CO -0.23 -0.76 0.00 0.41 -0.05 0.00 0.00 175.22 174.58 2rj4 n GLY 271 N -0.35 -0.82 0.00 1.99 0.00 -0.95 -0.41 105.19 104.65 2rj4 n GLY 271 Ca 0.02 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.20 2rj4 n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rj4 n GLY 272 N 0.00 0.13 3.74 -0.02 0.00 -0.40 -0.55 105.19 108.09 2rj4 n GLY 272 Ca 0.00 -1.48 -0.31 0.00 0.00 0.00 0.00 46.02 44.22 2rj4 n GLY 272 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2rj4 s SER 273 N -4.00 4.09 0.19 1.61 1.04 0.13 -0.59 113.70 116.17 2rj4 s SER 273 Ca 0.00 1.96 -0.11 0.00 0.48 0.00 0.00 55.95 58.28 2rj4 s SER 273 Cb 0.00 -2.54 0.20 0.00 0.10 0.00 0.00 66.02 63.78 2rj4 s SER 273 CO 0.00 -2.32 1.78 0.58 0.98 0.00 0.00 173.24 174.26 2rj4 h VAL 274 N -1.23 0.90 -0.35 5.02 2.07 -1.84 -0.05 116.25 120.77 2rj4 h VAL 274 Ca -0.44 -0.18 0.04 0.00 0.82 0.00 0.00 66.70 66.94 2rj4 h VAL 274 Cb 1.24 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 31.32 2rj4 h VAL 274 CO 0.49 0.09 0.14 -0.61 0.02 0.00 0.00 177.57 177.70 2rj4 h GLN 275 N 0.51 0.28 -0.10 1.57 4.15 -1.91 0.20 115.11 119.82 2rj4 h GLN 275 Ca 0.27 -0.02 -0.15 0.00 0.77 0.00 0.00 58.65 59.52 2rj4 h GLN 275 Cb 0.22 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.84 2rj4 h GLN 275 CO -0.21 0.19 -0.60 0.93 -1.93 0.00 0.00 178.83 177.21 2rj4 h GLU 276 N 0.29 0.34 -0.33 1.69 4.39 -1.68 -1.35 114.58 117.92 2rj4 h GLU 276 Ca 0.16 -0.23 -0.17 0.00 0.34 0.00 0.00 59.36 59.45 2rj4 h GLU 276 Cb 0.12 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.80 2rj4 h GLU 276 CO -0.15 0.84 -0.47 0.28 -1.16 0.00 0.00 179.01 178.35 2rj4 h VAL 277 N 0.25 1.27 -0.19 3.13 2.07 -0.78 -1.19 116.25 120.82 2rj4 h VAL 277 Ca -0.01 -1.65 -0.09 0.00 0.82 0.00 0.00 66.70 65.77 2rj4 h VAL 277 Cb 1.12 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 32.38 2rj4 h VAL 277 CO 0.10 0.54 -0.28 1.56 0.02 0.00 0.00 177.57 179.51 2rj4 h GLN 278 N 0.71 0.37 -0.36 1.57 4.20 -0.88 0.06 115.11 120.78 2rj4 h GLN 278 Ca 0.04 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 58.59 2rj4 h GLN 278 Cb 1.07 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.81 2rj4 h GLN 278 CO 0.11 0.63 0.16 0.00 -0.67 0.00 0.00 178.83 179.06 2rj4 h ARG 279 N 0.33 0.53 -0.24 1.46 3.08 -1.09 -0.98 114.38 117.46 2rj4 h ARG 279 Ca 0.05 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 2rj4 h ARG 279 Cb 0.67 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.62 2rj4 h ARG 279 CO 0.05 0.49 0.06 1.25 -1.07 0.00 0.00 179.97 180.75 2rj4 h LEU 280 N 0.44 0.37 -0.67 3.04 6.46 -0.95 -1.12 115.31 122.88 2rj4 h LEU 280 Ca 0.12 -0.23 -0.13 0.00 -0.12 0.00 0.00 57.88 57.52 2rj4 h LEU 280 Cb 0.14 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 39.96 2rj4 h LEU 280 CO -0.01 0.51 -0.38 0.71 -0.62 0.00 0.00 178.44 178.65 2rj4 h THR 281 N 0.22 1.29 -0.38 1.05 1.35 -0.96 -0.31 112.91 115.17 2rj4 h THR 281 Ca 0.08 -1.53 -0.03 0.00 -0.55 0.00 0.00 66.41 64.38 2rj4 h THR 281 Cb 0.28 1.49 -0.02 0.00 -1.73 0.00 0.00 68.15 68.18 2rj4 h THR 281 CO 0.00 0.49 0.13 -0.09 -0.25 0.00 0.00 175.52 175.80 2rj4 h ARG 282 N 0.51 0.58 -0.54 4.72 2.43 -1.12 -0.82 114.38 120.15 2rj4 h ARG 282 Ca 0.05 -0.12 -0.11 0.00 -0.81 0.00 0.00 59.98 58.99 2rj4 h ARG 282 Cb 0.88 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.33 2rj4 h ARG 282 CO 0.08 0.58 -0.10 0.00 -1.51 0.00 0.00 179.97 179.02 2rj4 h ALA 283 N 0.97 0.79 -0.45 2.80 0.00 -0.92 -0.72 119.26 121.73 2rj4 h ALA 283 Ca 0.12 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.56 2rj4 h ALA 283 Cb 0.23 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2rj4 h ALA 283 CO -0.01 0.67 -0.23 0.00 0.00 0.00 0.00 179.25 179.69 2rj4 h HIS 285 N 0.80 0.25 -0.86 0.00 6.17 -0.92 -0.31 115.15 120.29 2rj4 h HIS 285 Ca 0.10 -0.02 -0.02 0.00 0.71 0.00 0.00 60.37 61.15 2rj4 h HIS 285 Cb 0.79 -0.08 -0.04 0.00 2.52 0.00 0.00 27.41 30.60 2rj4 h HIS 285 CO 0.05 0.30 0.47 1.96 0.71 0.00 0.00 177.93 181.42 2rj4 h GLN 286 N 0.13 1.19 -0.86 5.26 4.20 -1.05 -1.06 115.11 122.92 2rj4 h GLN 286 Ca 0.06 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 2rj4 h GLN 286 Cb 0.15 -0.23 -0.04 0.00 0.30 0.00 0.00 27.48 27.66 2rj4 h GLN 286 CO -0.01 0.87 0.46 0.00 -0.67 0.00 0.00 178.83 179.49 2rj4 h ALA 287 N 1.25 1.10 -0.40 3.87 0.00 -1.04 -1.56 119.26 122.49 2rj4 h ALA 287 Ca 0.30 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2rj4 h ALA 287 Cb 0.03 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 2rj4 h ALA 287 CO -0.05 0.63 0.03 0.52 0.00 0.00 0.00 179.25 180.37 2rj4 h MET 288 N 1.21 0.62 -0.39 0.00 2.86 -0.50 -1.01 114.93 117.73 2rj4 h MET 288 Ca 0.30 -0.14 -0.10 0.00 -2.06 0.00 0.00 59.70 57.71 2rj4 h MET 288 Cb 0.05 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 2rj4 h MET 288 CO -0.05 0.63 -0.14 0.52 1.06 0.00 0.00 176.91 178.93 2rj4 h MET 289 N 0.60 0.78 -0.18 1.72 2.07 -0.67 -0.69 114.93 118.55 2rj4 h MET 289 Ca 0.13 -0.32 0.02 0.00 -2.07 0.00 0.00 59.70 57.46 2rj4 h MET 289 Cb 0.34 -0.03 -0.02 0.00 -1.87 0.00 0.00 31.60 30.02 2rj4 h MET 289 CO 0.01 0.93 0.06 0.28 1.07 0.00 0.00 176.91 179.27 2rj4 h VAL 290 N 0.58 0.96 -0.58 -2.22 2.07 -1.08 -1.21 116.25 114.76 2rj4 h VAL 290 Ca 0.09 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.62 2rj4 h VAL 290 Cb 0.68 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 31.19 2rj4 h VAL 290 CO 0.05 0.03 0.30 0.44 0.02 0.00 0.00 177.57 178.40 2rj4 h ASP 291 N 0.15 0.42 -0.36 0.57 3.45 -1.04 -1.44 116.42 118.17 2rj4 h ASP 291 Ca 0.08 0.04 -0.00 0.00 0.43 0.00 0.00 57.03 57.57 2rj4 h ASP 291 Cb 0.05 -0.04 -0.02 0.00 -0.56 0.00 0.00 39.33 38.76 2rj4 h ASP 291 CO -0.08 0.28 0.21 -0.61 -1.57 0.00 0.00 179.24 177.47 2rj4 h GLN 292 N 0.56 0.50 -0.54 3.56 4.15 -0.79 -0.96 115.11 121.58 2rj4 h GLN 292 Ca 0.26 -0.05 0.05 0.00 0.77 0.00 0.00 58.65 59.69 2rj4 h GLN 292 Cb 0.19 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 27.74 2rj4 h GLN 292 CO -0.19 0.39 0.36 0.00 -1.93 0.00 0.00 178.83 177.47 2rj4 h ALA 293 N 1.08 1.84 -0.16 3.38 0.00 -0.84 -1.03 119.26 123.53 2rj4 h ALA 293 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2rj4 h ALA 293 Cb 0.03 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2rj4 h ALA 293 CO -0.02 0.08 0.00 0.09 0.00 0.00 0.00 179.25 179.40 2rj4 n ASN 294 N -4.47 1.22 -2.58 0.00 5.03 -0.58 -4.94 115.26 108.94 2rj4 n ASN 294 Ca 0.07 -1.73 -0.17 0.00 0.87 0.00 0.00 54.58 53.62 2rj4 n ASN 294 Cb 0.22 -0.10 0.04 0.00 -1.02 0.00 0.00 39.78 38.92 2rj4 n ASN 294 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2rj4 n GLY 295 N 0.99 -0.19 3.00 7.41 0.00 -0.39 -5.03 105.19 110.98 2rj4 n GLY 295 Ca 0.13 -0.03 -0.18 0.00 0.00 0.00 0.00 46.02 45.94 2rj4 n GLY 295 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2rj4 s ILE 296 N -3.14 0.62 -0.14 -0.61 2.07 -0.47 -5.03 121.20 114.50 2rj4 s ILE 296 Ca 0.34 -0.33 0.02 0.00 -1.41 0.00 0.00 60.65 59.27 2rj4 s ILE 296 Cb -0.15 -0.53 0.02 0.00 0.13 0.00 0.00 42.46 41.93 2rj4 s ILE 296 CO 0.42 0.18 -0.19 -0.70 -1.91 0.00 0.00 174.94 172.75 2rj4 s GLU 297 N -0.12 2.71 0.55 3.50 2.12 -1.26 -3.68 118.70 122.52 2rj4 s GLU 297 Ca 0.02 -0.73 -0.22 0.00 0.36 0.00 0.00 54.97 54.40 2rj4 s GLU 297 Cb -0.04 -2.29 -0.05 0.00 0.26 0.00 0.00 34.13 32.01 2rj4 s GLU 297 CO -0.00 -0.11 1.31 0.00 -0.54 0.00 0.00 175.26 175.91 2rj4 n ALA 298 N 4.36 1.40 -0.32 6.30 0.00 -1.26 -4.88 120.51 126.11 2rj4 n ALA 298 Ca -0.19 0.12 0.08 0.00 0.00 0.00 0.00 53.44 53.44 2rj4 n ALA 298 Cb 0.51 -2.32 0.28 0.00 0.00 0.00 0.00 19.45 17.91 2rj4 n ALA 298 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 2rj4 h VAL 299 N 1.35 0.94 -0.09 0.00 3.04 -1.93 -1.23 116.25 118.32 2rj4 h VAL 299 Ca -0.50 -0.32 -0.07 0.00 -1.01 0.00 0.00 66.70 64.80 2rj4 h VAL 299 Cb 1.31 -0.07 -0.05 0.00 -2.01 0.00 0.00 31.29 30.47 2rj4 h VAL 299 CO 0.56 0.17 -0.54 0.79 -1.01 0.00 0.00 177.57 177.54 2rj4 n TRP 300 N -4.57 0.32 -0.78 3.17 7.02 -1.26 -5.05 117.44 116.29 2rj4 n TRP 300 Ca 0.17 -1.58 0.00 0.00 -1.02 0.00 0.00 57.50 55.07 2rj4 n TRP 300 Cb 0.34 -0.26 0.00 0.00 -2.42 0.00 0.00 31.31 28.97 2rj4 n TRP 300 CO 0.00 0.00 0.00 0.72 -2.02 0.00 0.00 177.69 176.39 2rj4 n HIS 301 N -1.06 0.00 -0.08 -5.99 8.25 -0.47 -1.45 115.22 114.42 2rj4 n HIS 301 Ca 0.22 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.74 2rj4 n HIS 301 Cb 0.73 0.01 0.41 0.00 1.12 0.00 0.00 29.99 32.25 2rj4 n HIS 301 CO 0.00 0.00 0.00 0.38 0.64 0.00 0.00 176.34 177.36 2rj4 h ASP 302 N 1.57 0.53 -0.36 0.41 3.04 -1.89 -2.01 116.42 117.70 2rj4 h ASP 302 Ca 0.00 -0.00 -0.05 0.00 -3.24 0.00 0.00 57.03 53.73 2rj4 h ASP 302 Cb 0.00 -0.12 -0.02 0.00 -1.04 0.00 0.00 39.33 38.15 2rj4 h ASP 302 CO 0.00 0.36 0.06 -0.08 -2.04 0.00 0.00 179.24 177.54 2rj4 h GLU 303 N 0.61 0.69 -0.51 4.15 4.81 -1.62 0.88 114.58 123.59 2rj4 h GLU 303 Ca 0.23 -0.14 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 2rj4 h GLU 303 Cb 0.15 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 2rj4 h GLU 303 CO -0.06 0.66 0.08 0.77 -0.73 0.00 0.00 179.01 179.73 2rj4 h SER 304 N 0.66 0.80 -0.48 1.04 0.02 -1.16 -1.04 113.55 113.39 2rj4 h SER 304 Ca 0.14 -0.26 -0.12 0.00 -0.84 0.00 0.00 61.79 60.71 2rj4 h SER 304 Cb 0.32 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 2rj4 h SER 304 CO 0.00 0.86 -0.18 0.45 -1.14 0.00 0.00 176.83 176.83 2rj4 h HIS 305 N 0.72 1.10 -0.57 3.45 3.86 -1.37 -2.22 115.15 120.12 2rj4 h HIS 305 Ca 0.15 -0.26 0.06 0.00 -1.16 0.00 0.00 60.37 59.16 2rj4 h HIS 305 Cb 0.40 -0.26 -0.05 0.00 1.06 0.00 0.00 27.41 28.55 2rj4 h HIS 305 CO 0.03 1.07 0.29 1.25 0.86 0.00 0.00 177.93 181.42 2rj4 h LEU 306 N 0.82 0.41 -0.77 2.43 5.85 -0.68 -0.00 115.31 123.37 2rj4 h LEU 306 Ca 0.11 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.88 2rj4 h LEU 306 Cb 0.75 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 2rj4 h LEU 306 CO 0.06 0.27 0.51 0.78 -0.34 0.00 0.00 178.44 179.72 2rj4 h ASN 307 N 0.54 0.87 -0.47 1.25 2.35 -1.03 -0.40 115.58 118.69 2rj4 h ASN 307 Ca 0.26 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.97 2rj4 h ASN 307 Cb 0.18 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 2rj4 h ASN 307 CO -0.18 0.62 0.22 0.50 -1.65 0.00 0.00 177.43 176.94 2rj4 h LYS 308 N 1.03 0.69 -0.46 0.81 1.63 -0.91 -1.53 116.57 117.82 2rj4 h LYS 308 Ca 0.29 -0.11 -0.02 0.00 -0.85 0.00 0.00 60.65 59.96 2rj4 h LYS 308 Cb -0.10 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.39 2rj4 h LYS 308 CO -0.07 0.59 0.22 -0.92 -3.45 0.00 0.00 179.45 175.82 2rj4 h TYR 309 N 0.62 0.66 0.00 1.91 3.20 -0.60 -2.59 116.97 120.17 2rj4 h TYR 309 Ca 0.16 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.00 2rj4 h TYR 309 Cb 0.14 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.20 2rj4 h TYR 309 CO -0.01 0.53 0.00 -0.07 -1.64 0.00 0.00 178.16 176.98 2rj4 h LEU 310 N 0.60 0.00 -0.28 2.82 3.38 -1.00 0.14 115.31 120.97 2rj4 h LEU 310 Ca 0.16 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.00 2rj4 h LEU 310 Cb 0.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 2rj4 h LEU 310 CO -0.02 0.00 -0.32 0.25 0.09 0.00 0.00 178.44 178.44 2rj4 h LEU 311 N 0.00 0.76 0.00 1.67 5.85 -0.91 -3.32 115.31 119.36 2rj4 h LEU 311 Ca 0.00 -0.48 0.00 0.00 0.84 0.00 0.00 57.88 58.24 2rj4 h LEU 311 Cb 0.64 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.46 2rj4 h LEU 311 CO 0.00 1.09 -0.89 0.54 -0.34 0.00 0.00 178.44 178.85 2rj4 n ARG 312 N -4.24 0.40 -3.76 1.25 5.12 -0.96 -4.53 116.66 109.94 2rj4 n ARG 312 Ca -0.04 0.07 -0.30 0.00 -1.93 0.00 0.00 57.85 55.65 2rj4 n ARG 312 Cb 0.49 -1.70 -0.14 0.00 -1.16 0.00 0.00 32.46 29.95 2rj4 n ARG 312 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 2rj4 s HIS 313 N -3.25 2.12 0.21 -1.55 3.76 0.44 -5.10 115.29 111.92 2rj4 s HIS 313 Ca 0.03 -2.27 -0.30 0.00 -0.15 0.00 0.00 55.06 52.37 2rj4 s HIS 313 Cb 0.12 -1.97 -0.10 0.00 1.11 0.00 0.00 32.58 31.74 2rj4 s HIS 313 CO 0.77 -0.83 1.43 0.15 -0.85 0.00 0.00 174.74 175.41 2rj4 s LYS 314 N 0.85 4.29 0.60 1.40 -0.14 -1.25 -4.30 119.74 121.19 2rj4 s LYS 314 Ca 0.14 2.24 -0.17 0.00 -1.36 0.00 0.00 55.97 56.82 2rj4 s LYS 314 Cb -0.21 -3.15 -0.03 0.00 -1.68 0.00 0.00 37.83 32.76 2rj4 s LYS 314 CO -0.10 -0.43 1.12 -1.25 -0.76 0.00 0.00 175.35 173.94 2rj4 s PRO 315 N 0.13 3.05 0.10 -1.68 0.04 -1.26 -4.95 135.00 130.43 2rj4 s PRO 315 Ca 0.61 1.51 0.24 0.00 0.04 0.00 0.00 61.00 63.41 2rj4 s PRO 315 Cb -0.41 -1.97 0.38 0.00 0.04 0.00 0.00 34.50 32.54 2rj4 s PRO 315 CO 0.39 -1.07 1.34 0.25 0.04 0.00 0.00 177.00 177.94 2rj4 n THR 316 N -1.88 0.30 -3.96 1.26 -2.24 0.13 -4.76 114.28 103.13 2rj4 n THR 316 Ca 0.11 -0.23 -0.09 0.00 -2.27 0.00 0.00 64.05 61.57 2rj4 n THR 316 Cb 0.51 -0.09 -0.09 0.00 -2.10 0.00 0.00 70.33 68.56 2rj4 n THR 316 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2rj4 s LYS 317 N -3.14 0.60 -0.07 -0.78 1.02 -1.13 -3.97 119.74 112.26 2rj4 s LYS 317 Ca 0.07 -0.86 0.03 0.00 0.02 0.00 0.00 55.97 55.23 2rj4 s LYS 317 Cb 0.14 0.23 0.01 0.00 -0.52 0.00 0.00 37.83 37.68 2rj4 s LYS 317 CO 0.72 -0.14 -0.16 0.08 -0.92 0.00 0.00 175.35 174.92 2rj4 s VAL 318 N -2.92 1.43 0.04 3.17 1.01 -0.29 -3.29 120.40 119.55 2rj4 s VAL 318 Ca -0.02 -0.67 -0.19 0.00 0.00 0.00 0.00 61.98 61.09 2rj4 s VAL 318 Cb 0.01 -1.26 -0.06 0.00 0.00 0.00 0.00 36.38 35.06 2rj4 s VAL 318 CO -0.06 0.42 0.56 -0.76 0.00 0.00 0.00 175.10 175.25 2rj4 s LEU 319 N 0.41 4.49 0.94 3.92 1.43 0.28 -0.54 118.68 129.60 2rj4 s LEU 319 Ca -0.12 1.20 -0.12 0.00 -1.03 0.00 0.00 54.13 54.05 2rj4 s LEU 319 Cb -0.15 -2.86 0.16 0.00 0.03 0.00 0.00 46.19 43.36 2rj4 s LEU 319 CO 0.04 0.24 1.10 -0.94 0.23 0.00 0.00 176.35 177.02 2rj4 s SER 320 N -0.86 3.12 0.00 2.29 1.04 -0.80 -0.83 113.70 117.66 2rj4 s SER 320 Ca 0.29 1.24 0.08 0.00 0.48 0.00 0.00 55.95 58.03 2rj4 s SER 320 Cb -0.19 -1.90 0.39 0.00 0.10 0.00 0.00 66.02 64.42 2rj4 s SER 320 CO 0.18 -2.83 1.09 -2.65 0.98 0.00 0.00 173.24 170.01 2rj4 n PRO 321 N -3.98 0.12 -0.15 4.02 -0.02 -1.26 -1.52 135.00 132.21 2rj4 n PRO 321 Ca 0.06 0.20 0.21 0.00 -2.02 0.00 0.00 63.50 61.95 2rj4 n PRO 321 Cb 0.57 -1.50 0.61 0.00 -0.02 0.00 0.00 33.50 33.16 2rj4 n PRO 321 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2rj4 h GLU 322 N 0.00 0.20 -0.00 -0.52 5.08 -1.90 -2.22 114.58 115.22 2rj4 h GLU 322 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2rj4 h GLU 322 Cb 0.07 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2rj4 h GLU 322 CO 0.00 0.13 -0.27 0.66 -1.00 0.00 0.00 179.01 178.54 2rj4 n TYR 323 N -4.41 0.00 -3.25 4.33 4.02 -0.57 -0.99 117.16 116.28 2rj4 n TYR 323 Ca 0.16 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 58.01 2rj4 n TYR 323 Cb 0.71 -0.24 -0.03 0.00 -0.02 0.00 0.00 39.34 39.75 2rj4 n TYR 323 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 2rj4 s LEU 324 N -2.76 -1.10 0.18 7.72 0.20 -0.84 -4.43 118.68 117.65 2rj4 s LEU 324 Ca 0.19 -0.47 0.09 0.00 0.69 0.00 0.00 54.13 54.63 2rj4 s LEU 324 Cb 0.19 1.49 -0.04 0.00 -0.43 0.00 0.00 46.19 47.40 2rj4 s LEU 324 CO 0.58 -0.28 -0.18 0.86 -0.29 0.00 0.00 176.35 177.03 2rj4 s TRP 325 N 2.32 1.86 -0.32 5.38 -0.11 -0.48 -4.13 118.94 123.46 2rj4 s TRP 325 Ca 0.12 -0.47 0.00 0.00 1.22 0.00 0.00 56.10 56.97 2rj4 s TRP 325 Cb -0.10 -0.91 0.10 0.00 -1.50 0.00 0.00 33.47 31.06 2rj4 s TRP 325 CO -0.20 0.37 0.09 0.34 -4.62 0.00 0.00 176.95 172.93 2rj4 s ASP 326 N -2.83 4.17 0.23 5.86 -1.08 -1.26 -1.19 116.67 120.58 2rj4 s ASP 326 Ca 0.18 -1.77 0.01 0.00 -0.52 0.00 0.00 52.55 50.45 2rj4 s ASP 326 Cb -0.05 -1.02 0.25 0.00 -1.46 0.00 0.00 42.92 40.63 2rj4 s ASP 326 CO 0.07 -0.40 1.58 -0.61 0.52 0.00 0.00 175.17 176.33 2rj4 h GLN 327 N 7.96 0.42 -0.40 4.34 4.15 -1.87 0.23 115.11 129.93 2rj4 h GLN 327 Ca -0.11 -0.24 -0.02 0.00 0.77 0.00 0.00 58.65 59.05 2rj4 h GLN 327 Cb 1.01 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.70 2rj4 h GLN 327 CO 0.48 0.82 0.19 0.37 -1.93 0.00 0.00 178.83 178.76 2rj4 h GLN 328 N 0.33 0.58 0.09 1.69 4.15 -1.92 0.91 115.11 120.95 2rj4 h GLN 328 Ca 0.02 -0.09 -0.26 0.00 0.77 0.00 0.00 58.65 59.08 2rj4 h GLN 328 Cb 0.98 -0.10 0.01 0.00 0.21 0.00 0.00 27.48 28.58 2rj4 h GLN 328 CO 0.09 0.52 -1.15 1.25 -1.93 0.00 0.00 178.83 177.61 2rj4 h LEU 329 N 0.51 0.56 -0.60 -2.39 5.85 -1.97 -3.40 115.31 113.87 2rj4 h LEU 329 Ca 0.14 -0.53 0.00 0.00 0.84 0.00 0.00 57.88 58.33 2rj4 h LEU 329 Cb 0.13 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.98 2rj4 h LEU 329 CO -0.02 1.37 0.00 0.18 -0.34 0.00 0.00 178.44 179.63 2rj4 n LEU 330 N -3.67 0.60 0.00 2.25 4.77 0.06 -5.11 117.00 115.91 2rj4 n LEU 330 Ca -0.09 -0.69 0.00 0.00 -0.03 0.00 0.00 56.01 55.20 2rj4 n LEU 330 Cb 0.95 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.04 2rj4 n LEU 330 CO 0.54 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 2rj4 n GLY 331 N 0.17 0.97 2.52 -0.72 0.00 0.31 -4.53 105.19 103.92 2rj4 n GLY 331 Ca 0.00 -0.79 -0.20 0.00 0.00 0.00 0.00 46.02 45.03 2rj4 n GLY 331 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2rj4 s TRP 332 N 0.00 0.22 0.74 1.61 -0.11 -1.26 -4.45 118.94 115.68 2rj4 s TRP 332 Ca 0.00 -1.70 -0.13 0.00 1.22 0.00 0.00 56.10 55.49 2rj4 s TRP 332 Cb 0.00 -0.53 0.04 0.00 -1.50 0.00 0.00 33.47 31.48 2rj4 s TRP 332 CO 0.00 -0.97 1.12 -1.25 -4.62 0.00 0.00 176.95 171.23 2rj4 s PRO 333 N 0.42 2.30 0.52 5.86 0.04 -1.26 -4.91 135.00 137.97 2rj4 s PRO 333 Ca 0.30 1.37 0.24 0.00 0.04 0.00 0.00 61.00 62.95 2rj4 s PRO 333 Cb 0.01 -1.89 1.43 0.00 0.04 0.00 0.00 34.50 34.09 2rj4 s PRO 333 CO -0.14 -1.63 2.11 0.00 0.04 0.00 0.00 177.00 177.38 2rj4 h ALA 334 N -0.67 1.50 0.00 8.56 0.00 -2.01 -1.90 119.26 124.74 2rj4 h ALA 334 Ca -0.45 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2rj4 h ALA 334 Cb 1.25 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2rj4 h ALA 334 CO 0.51 0.12 0.00 -0.24 0.00 0.00 0.00 179.25 179.64 2rj4 h VAL 335 N 0.00 0.00 -3.43 0.00 3.04 -2.01 -3.39 116.25 110.46 2rj4 h VAL 335 Ca -0.00 -0.26 -0.73 0.00 -1.01 0.00 0.00 66.70 64.70 2rj4 h VAL 335 Cb 0.22 1.11 -0.23 0.00 -2.01 0.00 0.00 31.29 30.37 2rj4 h VAL 335 CO 0.01 0.00 -0.41 -0.76 -1.01 0.00 0.00 177.57 175.40 2rj4 s LEU 336 N -5.42 5.26 0.32 3.16 1.43 -0.72 -4.93 118.68 117.79 2rj4 s LEU 336 Ca 0.00 -1.15 0.17 0.00 -1.03 0.00 0.00 54.13 52.12 2rj4 s LEU 336 Cb 0.09 -2.13 0.22 0.00 0.03 0.00 0.00 46.19 44.40 2rj4 s LEU 336 CO 0.42 -0.53 1.52 0.03 0.23 0.00 0.00 176.35 178.02 2rj4 h ARG 337 N 8.62 0.00 -4.37 1.70 3.08 -1.85 -3.45 114.38 118.10 2rj4 h ARG 337 Ca -0.27 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.52 2rj4 h ARG 337 Cb 1.11 0.00 -0.23 0.00 0.08 0.00 0.00 29.97 30.93 2rj4 h ARG 337 CO 0.78 0.41 -0.73 0.15 -1.07 0.00 0.00 179.97 179.51 2rj4 s LYS 338 N -3.09 0.44 -0.31 0.04 1.02 -1.26 -5.12 119.74 111.47 2rj4 s LYS 338 Ca 0.04 -0.61 -0.04 0.00 0.02 0.00 0.00 55.97 55.38 2rj4 s LYS 338 Cb 0.08 -0.22 0.04 0.00 -0.52 0.00 0.00 37.83 37.21 2rj4 s LYS 338 CO 0.72 0.04 0.04 -0.51 -0.92 0.00 0.00 175.35 174.72 2rj4 s LEU 339 N -1.27 4.01 -0.20 3.17 1.43 -1.26 -4.61 118.68 119.95 2rj4 s LEU 339 Ca -0.09 -1.18 -0.02 0.00 -1.03 0.00 0.00 54.13 51.82 2rj4 s LEU 339 Cb -0.08 -1.78 -0.21 0.00 0.03 0.00 0.00 46.19 44.15 2rj4 s LEU 339 CO 0.00 -0.27 0.01 0.54 0.23 0.00 0.00 176.35 176.85 2rj4 n ARG 340 N 4.71 0.69 -3.56 1.70 1.74 -0.17 -3.81 116.66 117.97 2rj4 n ARG 340 Ca -0.13 0.20 -0.16 0.00 -0.77 0.00 0.00 57.85 56.99 2rj4 n ARG 340 Cb 0.44 -1.60 -0.13 0.00 -1.02 0.00 0.00 32.46 30.16 2rj4 n ARG 340 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 2rj4 s PHE 341 N -2.53 -0.36 0.07 -1.55 5.99 -1.21 -0.07 117.98 118.32 2rj4 s PHE 341 Ca -0.30 0.58 0.05 0.00 0.00 0.00 0.00 56.93 57.25 2rj4 s PHE 341 Cb 0.08 -0.21 -0.03 0.00 0.00 0.00 0.00 43.02 42.87 2rj4 s PHE 341 CO 0.67 -0.49 -0.13 0.95 -0.00 0.00 0.00 175.22 176.22 2rj4 s THR 342 N 2.37 1.00 0.32 0.12 -4.23 -0.20 -1.38 115.64 113.65 2rj4 s THR 342 Ca 0.05 -1.28 -0.29 0.00 -1.18 0.00 0.00 61.69 58.99 2rj4 s THR 342 Cb -0.14 -1.00 -0.10 0.00 1.34 0.00 0.00 72.50 72.59 2rj4 s THR 342 CO -0.10 -0.27 1.40 0.00 -0.54 0.00 0.00 174.62 175.11 2rj4 s ALA 343 N -1.35 3.56 -0.23 3.99 0.00 -0.33 -0.94 121.76 126.45 2rj4 s ALA 343 Ca -0.03 1.38 -0.14 0.00 0.00 0.00 0.00 51.96 53.16 2rj4 s ALA 343 Cb -0.10 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.44 2rj4 s ALA 343 CO 0.02 -0.80 0.34 0.08 0.00 0.00 0.00 175.76 175.41 2rj4 s VAL 344 N -0.82 5.22 0.26 0.00 1.01 -0.61 -4.80 120.40 120.65 2rj4 s VAL 344 Ca 0.53 0.56 -0.30 0.00 0.00 0.00 0.00 61.98 62.77 2rj4 s VAL 344 Cb -0.42 -3.67 -0.14 0.00 0.00 0.00 0.00 36.38 32.14 2rj4 s VAL 344 CO 0.53 0.23 1.11 -2.65 0.00 0.00 0.00 175.10 174.33 2rj4 n PRO 345 N 4.77 1.43 -3.76 2.72 -0.02 -1.26 -4.82 135.00 134.06 2rj4 n PRO 345 Ca -0.10 0.51 -0.10 0.00 -2.02 0.00 0.00 63.50 61.79 2rj4 n PRO 345 Cb 0.51 -1.95 -0.07 0.00 -0.02 0.00 0.00 33.50 31.97 2rj4 n PRO 345 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2rj4 s LYS 346 N -1.14 0.89 -0.58 -0.52 -2.85 -1.26 -5.12 119.74 109.17 2rj4 s LYS 346 Ca 0.63 -0.73 -0.20 0.00 -1.00 0.00 0.00 55.97 54.68 2rj4 s LYS 346 Cb -0.72 0.38 0.09 0.00 -2.06 0.00 0.00 37.83 35.51 2rj4 s LYS 346 CO 0.57 -0.31 0.73 1.21 0.10 0.00 0.00 175.35 177.65 2rj4 s ASN 347 N -2.56 6.19 0.24 0.03 3.84 -1.26 -4.96 114.94 116.47 2rj4 s ASN 347 Ca 0.01 -1.24 -0.06 0.00 0.21 0.00 0.00 52.86 51.78 2rj4 s ASN 347 Cb 0.02 -2.32 0.44 0.00 -0.55 0.00 0.00 41.25 38.84 2rj4 s ASN 347 CO -0.09 -1.12 1.69 0.45 -2.79 0.00 0.00 177.10 175.24 2rj4 h HIS 348 N 9.20 0.25 -0.42 0.43 3.86 -1.99 -0.20 115.15 126.28 2rj4 h HIS 348 Ca -0.29 0.04 -0.10 0.00 -1.16 0.00 0.00 60.37 58.86 2rj4 h HIS 348 Cb 1.09 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.54 2rj4 h HIS 348 CO 0.84 -0.09 -0.13 0.37 0.86 0.00 0.00 177.93 179.78 2rj4 h GLN 349 N 0.26 0.83 -0.01 2.45 5.75 -1.99 -2.90 115.11 119.50 2rj4 h GLN 349 Ca 0.40 -0.33 -0.02 0.00 -0.15 0.00 0.00 58.65 58.55 2rj4 h GLN 349 Cb 0.68 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.19 2rj4 h GLN 349 CO -0.51 0.96 -0.07 0.00 -2.65 0.00 0.00 178.83 176.57 2rj4 h ALA 350 N 0.84 0.02 0.00 3.38 0.00 -1.84 -3.32 119.26 118.35 2rj4 h ALA 350 Ca 0.10 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 2rj4 h ALA 350 Cb 0.68 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 2rj4 h ALA 350 CO 0.05 -0.08 -0.11 -0.24 0.00 0.00 0.00 179.25 178.86 2rj4 h VAL 351 N -0.59 0.30 -0.02 0.00 3.04 -1.15 -3.51 116.25 114.32 2rj4 h VAL 351 Ca -0.01 -0.78 0.00 0.00 -1.01 0.00 0.00 66.70 64.90 2rj4 h VAL 351 Cb 0.76 1.61 0.00 0.00 -2.01 0.00 0.00 31.29 31.64 2rj4 h VAL 351 CO 0.01 0.11 0.00 0.54 -1.01 0.00 0.00 177.57 177.23