#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j64 s PRO 12 N 0.00 4.23 -0.01 1.61 0.04 -1.26 -4.69 135.00 134.92 2j64 s PRO 12 Ca 0.00 2.10 0.14 0.00 0.04 0.00 0.00 61.00 63.28 2j64 s PRO 12 Cb 0.00 -2.93 -0.18 0.00 0.04 0.00 0.00 34.50 31.43 2j64 s PRO 12 CO 0.00 -0.25 0.54 0.54 0.04 0.00 0.00 177.00 177.87 2j64 n ARG 13 N 0.54 1.78 -3.32 4.56 1.74 -1.26 0.27 116.66 120.97 2j64 n ARG 13 Ca 0.02 -0.03 -0.04 0.00 -0.77 0.00 0.00 57.85 57.03 2j64 n ARG 13 Cb 0.43 -1.23 0.02 0.00 -1.02 0.00 0.00 32.46 30.67 2j64 n ARG 13 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2j64 n ASN 14 N -1.51 -1.49 0.11 0.55 0.23 -1.26 -4.87 115.26 107.01 2j64 n ASN 14 Ca 0.01 -1.86 -0.00 0.00 -0.53 0.00 0.00 54.58 52.20 2j64 n ASN 14 Cb 0.27 2.45 -0.02 0.00 -2.08 0.00 0.00 39.78 40.39 2j64 n ASN 14 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2j64 h ARG 16 N 0.00 0.53 -0.45 0.00 2.43 -1.92 -1.83 114.38 113.14 2j64 h ARG 16 Ca -0.02 -0.50 0.02 0.00 -0.81 0.00 0.00 59.98 58.66 2j64 h ARG 16 Cb 1.51 0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 31.16 2j64 h ARG 16 CO 0.08 1.13 0.27 1.49 -1.51 0.00 0.00 179.97 181.43 2j64 h GLU 17 N 0.33 0.53 -0.45 0.20 4.81 -1.92 -0.52 114.58 117.56 2j64 h GLU 17 Ca -0.07 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 2j64 h GLU 17 Cb 1.48 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.72 2j64 h GLU 17 CO 0.16 0.35 0.23 -0.07 -0.73 0.00 0.00 179.01 178.95 2j64 h LEU 18 N 0.54 0.57 -0.77 1.64 3.38 -1.35 -2.50 115.31 116.83 2j64 h LEU 18 Ca 0.18 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2j64 h LEU 18 Cb 0.00 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 2j64 h LEU 18 CO -0.08 0.52 0.42 0.25 0.09 0.00 0.00 178.44 179.64 2j64 h LEU 19 N 0.59 0.96 -1.35 1.67 5.85 -1.16 -1.55 115.31 120.30 2j64 h LEU 19 Ca 0.16 -0.10 0.09 0.00 0.84 0.00 0.00 57.88 58.87 2j64 h LEU 19 Cb 0.08 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.82 2j64 h LEU 19 CO -0.02 0.78 0.51 0.28 -0.34 0.00 0.00 178.44 179.65 2j64 h SER 20 N 1.06 0.66 -0.22 1.25 0.02 -0.84 -0.01 113.55 115.46 2j64 h SER 20 Ca 0.27 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 2j64 h SER 20 Cb 0.03 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.45 2j64 h SER 20 CO -0.04 0.40 0.00 0.00 -1.14 0.00 0.00 176.83 176.04 2j64 n GLN 21 N -4.50 1.57 -0.36 3.45 6.02 -0.73 -4.90 117.38 117.93 2j64 n GLN 21 Ca 0.13 -0.82 0.00 0.00 -0.01 0.00 0.00 57.00 56.30 2j64 n GLN 21 Cb 0.31 -1.21 0.00 0.00 1.02 0.00 0.00 30.24 30.36 2j64 n GLN 21 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2j64 n GLY 22 N 0.82 0.80 3.54 1.08 0.00 -0.02 -5.01 105.19 106.40 2j64 n GLY 22 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2j64 n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j64 s ALA 23 N -2.10 2.89 -2.05 4.61 0.00 -0.66 -4.81 121.76 119.65 2j64 s ALA 23 Ca 0.00 -2.42 0.25 0.00 0.00 0.00 0.00 51.96 49.78 2j64 s ALA 23 Cb 0.00 -4.46 0.39 0.00 0.00 0.00 0.00 23.12 19.05 2j64 s ALA 23 CO 0.00 -3.48 1.34 0.25 0.00 0.00 0.00 175.76 173.87 2j64 n THR 24 N 6.59 0.00 -4.23 0.00 -2.24 -1.26 -4.01 114.28 109.12 2j64 n THR 24 Ca 0.33 -0.23 -0.34 0.00 -2.27 0.00 0.00 64.05 61.54 2j64 n THR 24 Cb 0.50 0.88 -0.10 0.00 -2.10 0.00 0.00 70.33 69.51 2j64 n THR 24 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2j64 s LEU 25 N -2.41 3.57 0.32 3.22 1.43 -1.26 -4.75 118.68 118.79 2j64 s LEU 25 Ca 0.23 0.03 -0.29 0.00 -1.03 0.00 0.00 54.13 53.07 2j64 s LEU 25 Cb 0.19 -1.87 -0.10 0.00 0.03 0.00 0.00 46.19 44.44 2j64 s LEU 25 CO 0.51 0.23 1.28 -0.44 0.23 0.00 0.00 176.35 178.16 2j64 s SER 26 N 0.02 6.85 0.00 2.29 0.01 -1.26 -4.75 113.70 116.86 2j64 s SER 26 Ca 0.03 2.61 0.00 0.00 1.31 0.00 0.00 55.95 59.90 2j64 s SER 26 Cb -0.13 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.46 2j64 s SER 26 CO 0.02 -0.48 0.00 0.61 0.41 0.00 0.00 173.24 173.80 2j64 n GLY 27 N 0.96 -1.13 3.71 3.44 0.00 -0.80 -4.96 105.19 106.42 2j64 n GLY 27 Ca 0.00 -1.02 -0.39 0.00 0.00 0.00 0.00 46.02 44.62 2j64 n GLY 27 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2j64 s TRP 28 N -3.00 3.49 0.29 1.61 0.52 -1.26 -0.87 118.94 119.72 2j64 s TRP 28 Ca 0.00 0.95 0.03 0.00 0.02 0.00 0.00 56.10 57.10 2j64 s TRP 28 Cb 0.00 -2.64 -0.06 0.00 -1.15 0.00 0.00 33.47 29.62 2j64 s TRP 28 CO 0.00 0.08 0.07 0.71 0.02 0.00 0.00 176.95 177.83 2j64 s TYR 29 N 0.91 1.76 -0.18 -1.98 2.02 -0.09 -4.96 117.35 114.84 2j64 s TYR 29 Ca 0.28 -1.05 -0.06 0.00 -0.37 0.00 0.00 57.07 55.87 2j64 s TYR 29 Cb -0.16 -1.10 -0.04 0.00 -0.40 0.00 0.00 41.96 40.27 2j64 s TYR 29 CO 0.12 -0.14 0.03 -1.01 -1.57 0.00 0.00 175.55 172.99 2j64 s HIS 30 N -3.49 3.19 0.32 2.71 3.76 -1.26 -0.44 115.29 120.07 2j64 s HIS 30 Ca 0.36 -0.04 0.02 0.00 -0.15 0.00 0.00 55.06 55.26 2j64 s HIS 30 Cb 0.08 -2.05 -0.03 0.00 1.11 0.00 0.00 32.58 31.70 2j64 s HIS 30 CO 0.14 0.09 0.50 -0.51 -0.85 0.00 0.00 174.74 174.12 2j64 s LEU 31 N 0.38 4.07 -0.21 0.89 1.02 0.56 -4.67 118.68 120.73 2j64 s LEU 31 Ca 0.01 0.28 -0.02 0.00 0.02 0.00 0.00 54.13 54.42 2j64 s LEU 31 Cb -0.13 -3.13 -0.00 0.00 0.02 0.00 0.00 46.19 42.95 2j64 s LEU 31 CO 0.01 -0.27 -0.09 0.00 0.02 0.00 0.00 176.35 176.02 2j64 s LEU 33 N 1.42 3.82 0.39 0.00 1.43 0.20 -4.56 118.68 121.38 2j64 s LEU 33 Ca 0.05 2.04 0.19 0.00 -1.03 0.00 0.00 54.13 55.38 2j64 s LEU 33 Cb -0.14 -4.55 1.01 0.00 0.03 0.00 0.00 46.19 42.54 2j64 s LEU 33 CO -0.06 -0.96 1.51 -0.65 0.23 0.00 0.00 176.35 176.42 2j64 h PRO 34 N 1.44 0.00 -0.00 1.29 0.11 -1.91 0.46 132.00 133.39 2j64 h PRO 34 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2j64 h PRO 34 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2j64 h PRO 34 CO 0.58 0.00 -0.50 -1.91 -0.21 0.00 0.00 178.00 175.96 2j64 n GLU 35 N -2.27 0.01 -0.03 1.05 2.13 -1.26 -4.94 120.64 115.32 2j64 n GLU 35 Ca -0.01 -0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.80 2j64 n GLU 35 Cb 0.27 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.48 2j64 n GLU 35 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2j64 n GLY 36 N 1.50 1.35 3.44 8.31 0.00 0.16 -5.10 105.19 114.85 2j64 n GLY 36 Ca 0.06 -0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 2j64 n GLY 36 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2j64 s ARG 37 N -0.43 2.46 0.05 1.61 3.52 -1.24 -4.89 118.95 120.03 2j64 s ARG 37 Ca 0.00 -0.74 -0.22 0.00 -0.13 0.00 0.00 55.73 54.64 2j64 s ARG 37 Cb 0.00 -2.32 -0.06 0.00 -1.56 0.00 0.00 34.95 31.01 2j64 s ARG 37 CO 0.00 0.59 0.65 0.00 -0.81 0.00 0.00 175.30 175.73 2j64 s ALA 38 N -0.66 3.48 -0.20 6.12 0.00 -1.26 0.60 121.76 129.84 2j64 s ALA 38 Ca 0.10 0.13 -0.03 0.00 0.00 0.00 0.00 51.96 52.16 2j64 s ALA 38 Cb -0.11 -2.80 0.06 0.00 0.00 0.00 0.00 23.12 20.28 2j64 s ALA 38 CO 0.00 0.22 0.04 -1.17 0.00 0.00 0.00 175.76 174.85 2j64 s LEU 39 N -0.52 1.28 0.16 0.00 2.96 0.43 -4.92 118.68 118.07 2j64 s LEU 39 Ca 0.33 -0.90 -0.31 0.00 -0.22 0.00 0.00 54.13 53.03 2j64 s LEU 39 Cb -0.20 -0.63 -0.10 0.00 0.50 0.00 0.00 46.19 45.76 2j64 s LEU 39 CO 0.20 -0.31 1.69 -2.84 -1.32 0.00 0.00 176.35 173.77 2j64 s PRO 40 N 1.83 4.17 0.09 0.98 0.02 -1.26 -0.32 135.00 140.50 2j64 s PRO 40 Ca -0.00 2.49 0.02 0.00 0.02 0.00 0.00 61.00 63.53 2j64 s PRO 40 Cb -0.17 -3.29 -0.04 0.00 0.02 0.00 0.00 34.50 31.02 2j64 s PRO 40 CO -0.10 -0.72 -0.07 0.14 -0.33 0.00 0.00 177.00 175.92 2j64 s VAL 41 N 1.72 0.70 -0.22 3.83 -7.23 0.42 -4.93 120.40 114.68 2j64 s VAL 41 Ca 0.75 -1.71 -0.18 0.00 -1.81 0.00 0.00 61.98 59.02 2j64 s VAL 41 Cb -0.46 -1.41 -0.03 0.00 0.56 0.00 0.00 36.38 35.04 2j64 s VAL 41 CO 0.33 -0.72 0.51 0.12 -0.31 0.00 0.00 175.10 175.02 2j64 s PHE 42 N -2.98 3.33 -0.24 2.82 5.36 -1.26 -0.91 117.98 124.10 2j64 s PHE 42 Ca 0.06 0.71 -0.08 0.00 -0.96 0.00 0.00 56.93 56.66 2j64 s PHE 42 Cb 0.01 -2.67 -0.03 0.00 -0.34 0.00 0.00 43.02 39.98 2j64 s PHE 42 CO -0.03 -0.16 0.08 0.00 -1.46 0.00 0.00 175.22 173.66 2j64 s ASP 44 N 1.35 6.41 0.00 0.00 -1.08 0.20 -1.89 116.67 121.65 2j64 s ASP 44 Ca 0.05 -0.15 0.21 0.00 -0.52 0.00 0.00 52.55 52.14 2j64 s ASP 44 Cb -0.15 -2.42 0.53 0.00 -1.46 0.00 0.00 42.92 39.42 2j64 s ASP 44 CO 0.04 -1.07 1.45 0.23 0.52 0.00 0.00 175.17 176.34 2j64 n MET 45 N 7.10 2.32 0.00 4.34 2.81 -1.26 -0.44 117.12 131.99 2j64 n MET 45 Ca 0.03 -2.02 0.00 0.00 -1.81 0.00 0.00 57.70 53.90 2j64 n MET 45 Cb 0.48 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.52 2j64 n MET 45 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2j64 n ASP 46 N 1.19 2.48 -4.70 7.83 -0.08 -1.26 -4.18 116.55 117.83 2j64 n ASP 46 Ca 0.19 0.00 -0.53 0.00 -1.51 0.00 0.00 54.79 52.94 2j64 n ASP 46 Cb 0.52 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.92 2j64 n ASP 46 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2j64 n THR 47 N -2.63 0.42 -3.58 5.18 -1.04 -1.26 -2.26 114.28 109.12 2j64 n THR 47 Ca 0.00 -0.08 -0.26 0.00 -2.04 0.00 0.00 64.05 61.67 2j64 n THR 47 Cb 0.47 -1.51 0.03 0.00 -1.82 0.00 0.00 70.33 67.50 2j64 n THR 47 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2j64 n GLU 48 N 5.89 -5.24 0.00 -2.82 -0.58 -1.26 -0.46 120.64 116.16 2j64 n GLU 48 Ca 0.25 0.66 0.00 0.00 -0.42 0.00 0.00 57.16 57.65 2j64 n GLU 48 Cb 0.20 -5.53 0.00 0.00 -0.57 0.00 0.00 31.44 25.54 2j64 n GLU 48 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2j64 n GLY 49 N -1.59 2.34 0.00 0.62 0.00 -0.96 -5.00 105.19 100.61 2j64 n GLY 49 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2j64 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j64 n GLY 50 N -1.87 -1.49 0.00 -0.02 0.00 0.39 -4.75 105.19 97.44 2j64 n GLY 50 Ca 0.00 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.46 2j64 n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j64 n GLY 51 N -1.78 1.02 3.68 -0.02 0.00 0.41 -4.89 105.19 103.62 2j64 n GLY 51 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2j64 n GLY 51 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2j64 s TRP 52 N -2.00 3.44 -0.50 1.61 0.52 -0.47 -3.65 118.94 117.89 2j64 s TRP 52 Ca 0.00 1.04 -0.23 0.00 0.02 0.00 0.00 56.10 56.94 2j64 s TRP 52 Cb 0.00 -2.81 0.04 0.00 -1.15 0.00 0.00 33.47 29.55 2j64 s TRP 52 CO 0.00 -0.10 0.81 -1.17 0.02 0.00 0.00 176.95 176.51 2j64 s LEU 53 N 1.60 4.33 -0.38 2.99 0.20 0.21 0.60 118.68 128.24 2j64 s LEU 53 Ca 0.32 -0.36 -0.28 0.00 0.69 0.00 0.00 54.13 54.49 2j64 s LEU 53 Cb -0.16 -2.81 0.02 0.00 -0.43 0.00 0.00 46.19 42.81 2j64 s LEU 53 CO 0.12 -1.03 1.06 -0.69 -0.29 0.00 0.00 176.35 175.52 2j64 s VAL 54 N 3.41 4.44 -1.38 1.68 1.01 -0.18 -0.46 120.40 128.91 2j64 s VAL 54 Ca 0.27 1.45 0.16 0.00 0.00 0.00 0.00 61.98 63.86 2j64 s VAL 54 Cb -0.14 -4.45 -0.01 0.00 0.00 0.00 0.00 36.38 31.78 2j64 s VAL 54 CO 0.19 -0.65 0.82 2.22 0.00 0.00 0.00 175.10 177.68 2j64 n PHE 55 N 7.14 0.00 -3.76 5.22 1.16 -0.17 -4.20 117.46 122.84 2j64 n PHE 55 Ca 0.11 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.56 2j64 n PHE 55 Cb 0.48 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.24 2j64 n PHE 55 CO 0.00 0.00 0.00 -1.14 -1.87 0.00 0.00 176.76 173.75 2j64 s GLN 56 N -1.87 0.36 -0.11 3.97 -0.44 -1.15 -1.66 119.66 118.75 2j64 s GLN 56 Ca 0.12 0.44 -0.08 0.00 -2.50 0.00 0.00 55.36 53.35 2j64 s GLN 56 Cb 0.12 0.16 0.04 0.00 -1.64 0.00 0.00 33.01 31.70 2j64 s GLN 56 CO 0.40 -0.05 0.27 0.50 0.50 0.00 0.00 175.29 176.92 2j64 s ARG 57 N 0.22 0.28 -0.04 1.67 3.52 -1.06 -1.34 118.95 122.20 2j64 s ARG 57 Ca -0.00 0.48 0.02 0.00 -0.13 0.00 0.00 55.73 56.10 2j64 s ARG 57 Cb -0.02 0.03 0.01 0.00 -1.56 0.00 0.00 34.95 33.40 2j64 s ARG 57 CO -0.00 -0.10 -0.10 1.03 -0.81 0.00 0.00 175.30 175.32 2j64 s ARG 58 N 0.72 1.23 0.00 5.12 1.81 0.61 -2.80 118.95 125.64 2j64 s ARG 58 Ca -0.05 -0.34 0.00 0.00 -1.72 0.00 0.00 55.73 53.62 2j64 s ARG 58 Cb -0.06 -1.10 0.00 0.00 -0.45 0.00 0.00 34.95 33.35 2j64 s ARG 58 CO -0.05 0.08 0.00 0.00 -0.68 0.00 0.00 175.30 174.66 2j64 n GLN 59 N 3.50 1.12 0.00 3.54 10.64 -1.26 -0.32 117.38 134.60 2j64 n GLN 59 Ca -0.20 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 54.97 2j64 n GLN 59 Cb 0.53 -0.09 0.00 0.00 -0.86 0.00 0.00 30.24 29.82 2j64 n GLN 59 CO 0.00 0.00 0.00 -0.40 -1.83 0.00 0.00 177.06 174.83 2j64 n ASP 60 N 0.00 0.00 -0.35 2.61 3.85 -1.26 -4.80 116.55 116.60 2j64 n ASP 60 Ca 0.00 -1.00 -0.05 0.00 -0.71 0.00 0.00 54.79 53.03 2j64 n ASP 60 Cb 0.00 0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 39.75 2j64 n ASP 60 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2j64 n GLY 61 N 0.00 0.65 0.21 6.12 0.00 -1.26 -4.89 105.19 106.02 2j64 n GLY 61 Ca 0.00 -0.20 0.10 0.00 0.00 0.00 0.00 46.02 45.91 2j64 n GLY 61 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2j64 h SER 62 N 0.00 0.00 -3.41 1.61 4.64 -1.99 -3.44 113.55 110.96 2j64 h SER 62 Ca -0.09 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 60.56 2j64 h SER 62 Cb 0.62 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 62.53 2j64 h SER 62 CO 0.14 0.21 -0.66 -0.69 -0.87 0.00 0.00 176.83 174.96 2j64 s VAL 63 N -3.46 3.99 -0.09 0.95 1.01 -1.26 -5.08 120.40 116.47 2j64 s VAL 63 Ca 0.02 -0.35 -0.30 0.00 0.00 0.00 0.00 61.98 61.36 2j64 s VAL 63 Cb 0.09 -2.70 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 2j64 s VAL 63 CO 0.65 0.56 1.07 -0.62 0.00 0.00 0.00 175.10 176.75 2j64 s ASP 64 N -0.34 7.18 0.00 3.32 -1.08 -1.26 -4.91 116.67 119.58 2j64 s ASP 64 Ca 0.06 1.62 0.13 0.00 -0.52 0.00 0.00 52.55 53.84 2j64 s ASP 64 Cb -0.12 -2.56 0.08 0.00 -1.46 0.00 0.00 42.92 38.85 2j64 s ASP 64 CO 0.02 -0.49 0.86 0.49 0.52 0.00 0.00 175.17 176.57 2j64 n PHE 65 N 5.06 0.00 -2.75 -5.34 3.01 -1.26 -4.77 117.46 111.40 2j64 n PHE 65 Ca 0.09 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.12 2j64 n PHE 65 Cb 0.48 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.94 2j64 n PHE 65 CO 0.00 0.00 0.00 0.12 1.01 0.00 0.00 176.76 177.89 2j64 s PHE 66 N -1.20 3.07 0.28 1.38 5.36 -1.26 -4.56 117.98 121.05 2j64 s PHE 66 Ca 0.14 -1.71 0.08 0.00 -0.96 0.00 0.00 56.93 54.47 2j64 s PHE 66 Cb 0.11 -4.53 -0.06 0.00 -0.34 0.00 0.00 43.02 38.20 2j64 s PHE 66 CO 0.20 -1.63 -0.08 1.03 -1.46 0.00 0.00 175.22 173.27 2j64 s ARG 67 N 3.13 1.59 0.92 10.12 1.81 -1.26 -5.05 118.95 130.20 2j64 s ARG 67 Ca 0.47 -1.79 -0.12 0.00 -1.72 0.00 0.00 55.73 52.56 2j64 s ARG 67 Cb 0.00 -1.30 0.14 0.00 -0.45 0.00 0.00 34.95 33.34 2j64 s ARG 67 CO 0.01 0.09 1.11 -1.54 -0.68 0.00 0.00 175.30 174.29 2j64 s SER 68 N -3.47 3.37 0.23 0.23 1.04 -1.26 -4.31 113.70 109.53 2j64 s SER 68 Ca 0.29 1.21 -0.08 0.00 0.48 0.00 0.00 55.95 57.86 2j64 s SER 68 Cb 0.02 -1.87 0.37 0.00 0.10 0.00 0.00 66.02 64.65 2j64 s SER 68 CO 0.12 -2.67 1.67 -0.25 0.98 0.00 0.00 173.24 173.10 2j64 h TRP 69 N -1.57 0.12 -0.59 5.02 2.91 -1.92 -1.88 115.95 118.04 2j64 h TRP 69 Ca -0.51 0.04 -0.01 0.00 1.13 0.00 0.00 58.89 59.54 2j64 h TRP 69 Cb 1.31 0.05 -0.03 0.00 -0.51 0.00 0.00 29.16 29.98 2j64 h TRP 69 CO 0.35 -0.12 0.32 0.77 -1.03 0.00 0.00 178.44 178.73 2j64 h SER 70 N 0.19 0.73 -0.24 2.65 0.02 -1.99 0.03 113.55 114.95 2j64 h SER 70 Ca 0.37 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.22 2j64 h SER 70 Cb 0.61 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 2j64 h SER 70 CO -0.52 0.62 0.12 0.28 -1.14 0.00 0.00 176.83 176.20 2j64 h SER 71 N 0.79 0.31 0.34 3.07 0.02 -1.79 -1.63 113.55 114.67 2j64 h SER 71 Ca 0.21 -0.11 -0.09 0.00 -0.84 0.00 0.00 61.79 60.97 2j64 h SER 71 Cb 0.05 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 2j64 h SER 71 CO -0.03 0.33 -0.38 1.88 -1.14 0.00 0.00 176.83 177.48 2j64 h TYR 72 N 0.27 0.07 -0.24 3.45 0.05 -1.17 0.43 116.97 119.82 2j64 h TYR 72 Ca 0.08 -0.02 -0.05 0.00 0.05 0.00 0.00 58.73 58.79 2j64 h TYR 72 Cb 0.09 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 37.81 2j64 h TYR 72 CO -0.03 0.44 -0.06 -0.09 -1.05 0.00 0.00 178.16 177.37 2j64 h ARG 73 N 0.05 0.47 0.00 4.88 2.43 -0.70 0.15 114.38 121.67 2j64 h ARG 73 Ca 0.00 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 2j64 h ARG 73 Cb 0.70 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2j64 h ARG 73 CO 0.05 0.70 -0.72 0.00 -1.51 0.00 0.00 179.97 178.49 2j64 h ALA 74 N 0.76 0.58 0.00 2.80 0.00 -1.08 -1.45 119.26 120.87 2j64 h ALA 74 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2j64 h ALA 74 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2j64 h ALA 74 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 2j64 n GLY 75 N 1.25 0.04 3.55 0.00 0.00 0.15 -4.56 105.19 105.62 2j64 n GLY 75 Ca 0.02 -1.72 -0.07 0.00 0.00 0.00 0.00 46.02 44.24 2j64 n GLY 75 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2j64 s PHE 76 N -2.71 -0.31 -0.47 1.61 -0.12 0.42 -4.79 117.98 111.62 2j64 s PHE 76 Ca 0.00 0.14 0.00 0.00 -0.05 0.00 0.00 56.93 57.02 2j64 s PHE 76 Cb 0.00 0.56 0.00 0.00 -0.63 0.00 0.00 43.02 42.95 2j64 s PHE 76 CO 0.00 -0.60 0.00 0.41 -0.05 0.00 0.00 175.22 174.98 2j64 n GLY 77 N -0.29 0.37 2.79 1.99 0.00 -1.26 -0.72 105.19 108.06 2j64 n GLY 77 Ca -0.08 -2.07 -0.18 0.00 0.00 0.00 0.00 46.02 43.68 2j64 n GLY 77 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2j64 s ASN 78 N -4.00 0.90 0.55 1.61 3.84 0.41 -4.96 114.94 113.28 2j64 s ASN 78 Ca 0.00 0.24 0.25 0.00 0.21 0.00 0.00 52.86 53.55 2j64 s ASN 78 Cb 0.00 0.15 1.45 0.00 -0.55 0.00 0.00 41.25 42.30 2j64 s ASN 78 CO 0.00 -0.25 2.05 1.56 -2.79 0.00 0.00 177.10 177.67 2j64 h GLN 79 N 8.39 0.00 0.00 0.43 4.20 -1.97 0.13 115.11 126.29 2j64 h GLN 79 Ca -0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.58 2j64 h GLN 79 Cb 1.12 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.90 2j64 h GLN 79 CO 0.15 0.00 0.00 0.39 -0.67 0.00 0.00 178.83 178.70 2j64 n GLU 80 N -4.22 0.19 0.00 1.46 1.02 -1.26 -4.87 120.64 112.95 2j64 n GLU 80 Ca 0.05 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 2j64 n GLU 80 Cb 0.43 -1.73 0.00 0.00 -0.02 0.00 0.00 31.44 30.12 2j64 n GLU 80 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2j64 n SER 81 N -2.06 0.00 -4.13 1.62 3.41 0.44 -5.15 113.62 107.74 2j64 n SER 81 Ca 0.06 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.47 2j64 n SER 81 Cb 0.39 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.21 2j64 n SER 81 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2j64 s GLU 82 N 0.00 0.89 0.19 4.33 2.02 -1.09 -4.70 118.70 120.34 2j64 s GLU 82 Ca 0.00 -0.73 -0.23 0.00 0.02 0.00 0.00 54.97 54.03 2j64 s GLU 82 Cb 0.00 -0.89 0.05 0.00 0.10 0.00 0.00 34.13 33.40 2j64 s GLU 82 CO 0.00 0.22 0.67 -0.59 0.02 0.00 0.00 175.26 175.58 2j64 s PHE 83 N -0.85 -0.40 -0.13 1.61 -0.12 -1.12 -0.45 117.98 116.53 2j64 s PHE 83 Ca 0.01 0.10 0.01 0.00 -0.05 0.00 0.00 56.93 57.01 2j64 s PHE 83 Cb -0.08 0.61 0.02 0.00 -0.63 0.00 0.00 43.02 42.94 2j64 s PHE 83 CO 0.01 -0.96 -0.16 -0.46 -0.05 0.00 0.00 175.22 173.60 2j64 s TRP 84 N -3.75 2.13 0.35 3.49 -0.11 0.10 -2.56 118.94 118.58 2j64 s TRP 84 Ca 0.05 -1.08 0.14 0.00 1.22 0.00 0.00 56.10 56.43 2j64 s TRP 84 Cb -0.03 -1.54 0.74 0.00 -1.50 0.00 0.00 33.47 31.14 2j64 s TRP 84 CO -0.06 -0.56 1.82 1.25 -4.62 0.00 0.00 176.95 174.78 2j64 h LEU 85 N 7.62 0.00 0.00 5.86 5.85 -1.58 0.12 115.31 133.18 2j64 h LEU 85 Ca -0.34 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.38 2j64 h LEU 85 Cb 1.16 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.19 2j64 h LEU 85 CO 0.51 0.38 0.00 0.61 -0.34 0.00 0.00 178.44 179.60 2j64 n GLY 86 N -0.35 3.81 0.36 3.75 0.00 -1.26 -4.13 105.19 107.37 2j64 n GLY 86 Ca -0.02 -1.38 -0.02 0.00 0.00 0.00 0.00 46.02 44.60 2j64 n GLY 86 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2j64 h ASN 87 N 0.00 1.06 -0.28 1.61 2.35 -0.34 -1.26 115.58 118.73 2j64 h ASN 87 Ca 0.00 -0.05 -0.05 0.00 -0.55 0.00 0.00 56.30 55.65 2j64 h ASN 87 Cb 0.00 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.09 2j64 h ASN 87 CO 0.00 0.80 -0.03 -0.08 -1.65 0.00 0.00 177.43 176.47 2j64 h GLU 88 N 1.24 0.51 -0.29 0.81 4.57 -1.52 -0.37 114.58 119.52 2j64 h GLU 88 Ca 0.33 -0.18 0.07 0.00 -1.18 0.00 0.00 59.36 58.40 2j64 h GLU 88 Cb -0.09 -0.04 -0.07 0.00 -0.16 0.00 0.00 28.75 28.39 2j64 h GLU 88 CO -0.06 0.69 -0.19 -0.91 -1.18 0.00 0.00 179.01 177.36 2j64 h ASN 89 N 0.28 -0.62 -0.71 1.04 -0.26 -1.73 -0.34 115.58 113.24 2j64 h ASN 89 Ca 0.07 0.13 -0.02 0.00 -0.56 0.00 0.00 56.30 55.93 2j64 h ASN 89 Cb 0.48 0.32 -0.03 0.00 -1.06 0.00 0.00 38.32 38.02 2j64 h ASN 89 CO 0.02 -0.22 0.38 -0.07 -1.06 0.00 0.00 177.43 176.48 2j64 h LEU 90 N -0.16 0.91 -0.48 1.61 3.38 -1.10 -0.75 115.31 118.72 2j64 h LEU 90 Ca 0.15 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2j64 h LEU 90 Cb 0.40 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2j64 h LEU 90 CO -0.39 0.75 0.23 -0.74 0.09 0.00 0.00 178.44 178.38 2j64 h HIS 91 N 1.02 0.69 -0.23 1.13 2.76 -0.63 -1.60 115.15 118.30 2j64 h HIS 91 Ca 0.26 -0.03 -0.10 0.00 -2.20 0.00 0.00 60.37 58.30 2j64 h HIS 91 Cb 0.06 -0.22 -0.00 0.00 1.55 0.00 0.00 27.41 28.80 2j64 h HIS 91 CO 0.01 0.55 -0.23 1.96 -1.30 0.00 0.00 177.93 178.92 2j64 h GLN 92 N 0.63 0.56 -0.90 5.26 1.08 -0.78 -2.08 115.11 118.88 2j64 h GLN 92 Ca 0.17 -0.30 0.07 0.00 -1.45 0.00 0.00 58.65 57.14 2j64 h GLN 92 Cb 0.12 0.01 -0.07 0.00 -0.05 0.00 0.00 27.48 27.49 2j64 h GLN 92 CO -0.02 0.89 0.56 -0.07 -0.95 0.00 0.00 178.83 179.24 2j64 h LEU 93 N 0.26 0.87 -1.82 1.46 4.07 -1.13 -3.21 115.31 115.81 2j64 h LEU 93 Ca 0.04 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.02 2j64 h LEU 93 Cb 0.78 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.36 2j64 h LEU 93 CO 0.06 0.54 0.00 0.35 -1.08 0.00 0.00 178.44 178.31 2j64 n THR 94 N -4.61 0.10 -0.22 0.22 -2.24 -0.60 -4.32 114.28 102.61 2j64 n THR 94 Ca 0.14 -0.50 0.01 0.00 -2.27 0.00 0.00 64.05 61.43 2j64 n THR 94 Cb 0.21 1.21 0.10 0.00 -2.10 0.00 0.00 70.33 69.76 2j64 n THR 94 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2j64 h LEU 95 N 4.21 -0.35 -9.60 3.22 3.38 -1.38 -3.43 115.31 111.35 2j64 h LEU 95 Ca 0.00 0.17 -0.62 0.00 0.09 0.00 0.00 57.88 57.52 2j64 h LEU 95 Cb 0.90 0.31 -0.13 0.00 0.09 0.00 0.00 40.66 41.83 2j64 h LEU 95 CO 0.00 -0.15 -0.61 -1.10 0.09 0.00 0.00 178.44 176.67 2j64 s GLN 96 N -6.16 1.92 0.07 1.13 1.11 -1.26 -5.07 119.66 111.40 2j64 s GLN 96 Ca -0.14 -2.07 0.00 0.00 0.01 0.00 0.00 55.36 53.16 2j64 s GLN 96 Cb 0.20 -1.60 0.00 0.00 -1.01 0.00 0.00 33.01 30.60 2j64 s GLN 96 CO 0.74 -0.03 0.00 0.41 0.01 0.00 0.00 175.29 176.42 2j64 n GLY 97 N -0.93 -2.08 2.90 3.09 0.00 -1.26 -4.87 105.19 102.04 2j64 n GLY 97 Ca -0.05 -1.44 -0.29 0.00 0.00 0.00 0.00 46.02 44.24 2j64 n GLY 97 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j64 s ASN 98 N -5.27 3.33 -0.21 1.61 6.03 -1.26 -5.02 114.94 114.15 2j64 s ASN 98 Ca 0.00 -0.92 -0.12 0.00 -1.03 0.00 0.00 52.86 50.79 2j64 s ASN 98 Cb 0.00 -1.01 -0.05 0.00 -3.03 0.00 0.00 41.25 37.16 2j64 s ASN 98 CO 0.00 -0.22 0.22 0.26 -2.03 0.00 0.00 177.10 175.34 2j64 s TRP 99 N 1.54 3.38 0.41 1.54 0.52 -1.26 -4.95 118.94 120.12 2j64 s TRP 99 Ca -0.02 0.40 -0.23 0.00 0.02 0.00 0.00 56.10 56.27 2j64 s TRP 99 Cb -0.17 -2.31 -0.10 0.00 -1.15 0.00 0.00 33.47 29.75 2j64 s TRP 99 CO -0.07 0.14 1.00 -2.00 0.02 0.00 0.00 176.95 176.03 2j64 s GLU 100 N 0.82 4.18 -0.11 4.98 2.12 -1.24 -0.88 118.70 128.57 2j64 s GLU 100 Ca 0.12 1.33 0.00 0.00 0.36 0.00 0.00 54.97 56.77 2j64 s GLU 100 Cb -0.13 -2.38 -0.02 0.00 0.26 0.00 0.00 34.13 31.86 2j64 s GLU 100 CO 0.03 -0.09 -0.12 -1.17 -0.54 0.00 0.00 175.26 173.37 2j64 s LEU 101 N -2.88 2.81 -0.08 2.70 2.96 -0.66 -1.22 118.68 122.31 2j64 s LEU 101 Ca 0.60 -0.26 0.04 0.00 -0.22 0.00 0.00 54.13 54.28 2j64 s LEU 101 Cb -0.16 -1.63 0.00 0.00 0.50 0.00 0.00 46.19 44.90 2j64 s LEU 101 CO 0.21 0.21 -0.20 -0.60 -1.32 0.00 0.00 176.35 174.65 2j64 s ARG 102 N 0.09 2.44 -0.14 1.98 3.52 0.08 -1.06 118.95 125.85 2j64 s ARG 102 Ca -0.05 -0.71 -0.02 0.00 -0.13 0.00 0.00 55.73 54.82 2j64 s ARG 102 Cb -0.14 -1.93 -0.02 0.00 -1.56 0.00 0.00 34.95 31.30 2j64 s ARG 102 CO 0.04 0.17 -0.08 0.08 -0.81 0.00 0.00 175.30 174.70 2j64 s VAL 103 N 0.33 3.46 -0.04 7.11 1.01 0.20 -0.71 120.40 131.76 2j64 s VAL 103 Ca -0.14 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.37 2j64 s VAL 103 Cb -0.16 -2.49 -0.02 0.00 0.00 0.00 0.00 36.38 33.70 2j64 s VAL 103 CO 0.06 0.51 -0.16 -1.61 0.00 0.00 0.00 175.10 173.89 2j64 s GLU 104 N 0.37 2.44 -0.03 2.72 2.02 -0.04 -1.50 118.70 124.68 2j64 s GLU 104 Ca -0.07 -0.74 0.01 0.00 0.02 0.00 0.00 54.97 54.19 2j64 s GLU 104 Cb -0.15 -2.32 0.02 0.00 0.10 0.00 0.00 34.13 31.78 2j64 s GLU 104 CO 0.04 0.61 -0.04 -0.51 0.02 0.00 0.00 175.26 175.38 2j64 s LEU 105 N -0.70 1.44 -0.09 1.80 1.02 0.04 -1.78 118.68 120.40 2j64 s LEU 105 Ca 0.11 -0.11 0.00 0.00 0.02 0.00 0.00 54.13 54.16 2j64 s LEU 105 Cb -0.11 -0.38 0.02 0.00 0.02 0.00 0.00 46.19 45.75 2j64 s LEU 105 CO 0.00 -0.04 -0.09 -0.70 0.02 0.00 0.00 176.35 175.55 2j64 s GLU 106 N 0.71 1.51 0.85 1.70 2.12 0.35 -1.01 118.70 124.92 2j64 s GLU 106 Ca -0.09 -0.28 -0.08 0.00 0.36 0.00 0.00 54.97 54.88 2j64 s GLU 106 Cb -0.12 -1.46 0.17 0.00 0.26 0.00 0.00 34.13 32.99 2j64 s GLU 106 CO -0.00 -0.16 1.16 0.16 -0.54 0.00 0.00 175.26 175.88 2j64 s ASP 107 N 1.33 3.65 0.37 -1.70 1.47 -0.74 -0.60 116.67 120.45 2j64 s ASP 107 Ca -0.02 -0.17 0.27 0.00 1.18 0.00 0.00 52.55 53.81 2j64 s ASP 107 Cb -0.14 0.01 1.19 0.00 -0.34 0.00 0.00 42.92 43.64 2j64 s ASP 107 CO -0.04 -2.35 1.82 -0.26 0.68 0.00 0.00 175.17 175.02 2j64 h PHE 108 N -1.09 0.00 0.00 2.11 0.04 -1.91 -1.72 116.94 114.37 2j64 h PHE 108 Ca -0.39 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.23 2j64 h PHE 108 Cb 1.24 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.37 2j64 h PHE 108 CO -0.75 0.00 -0.88 -0.91 -0.60 0.00 0.00 178.31 175.17 2j64 h ASN 109 N 0.00 0.00 0.00 2.17 2.35 -2.00 -3.48 115.58 114.62 2j64 h ASN 109 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2j64 h ASN 109 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 2j64 h ASN 109 CO 0.00 0.67 0.00 0.61 -1.65 0.00 0.00 177.43 177.06 2j64 n GLY 110 N 1.31 0.88 3.75 2.83 0.00 -0.64 -5.10 105.19 108.21 2j64 n GLY 110 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2j64 n GLY 110 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2j64 s ASN 111 N -1.44 7.11 -0.10 1.61 -0.87 -1.26 -4.76 114.94 115.23 2j64 s ASN 111 Ca 0.00 2.28 0.00 0.00 -1.57 0.00 0.00 52.86 53.57 2j64 s ASN 111 Cb 0.00 -2.62 -0.02 0.00 -0.02 0.00 0.00 41.25 38.59 2j64 s ASN 111 CO 0.00 -0.32 -0.10 -0.13 -2.57 0.00 0.00 177.10 173.99 2j64 s ARG 112 N -0.71 3.07 0.25 -0.60 0.52 -1.26 -1.78 118.95 118.44 2j64 s ARG 112 Ca 0.50 -0.61 0.02 0.00 -0.52 0.00 0.00 55.73 55.12 2j64 s ARG 112 Cb -0.33 -2.62 -0.05 0.00 0.52 0.00 0.00 34.95 32.46 2j64 s ARG 112 CO 0.39 0.44 0.06 0.95 0.02 0.00 0.00 175.30 177.16 2j64 s THR 113 N -0.22 0.73 0.10 0.02 -4.23 -0.18 -4.98 115.64 106.88 2j64 s THR 113 Ca 0.02 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.35 2j64 s THR 113 Cb -0.13 -2.54 0.04 0.00 1.34 0.00 0.00 72.50 71.21 2j64 s THR 113 CO 0.03 -0.12 0.44 -0.36 -0.54 0.00 0.00 174.62 174.06 2j64 s PHE 114 N -3.63 -0.28 -0.06 3.99 0.08 -1.26 -0.78 117.98 116.04 2j64 s PHE 114 Ca 0.34 0.08 -0.06 0.00 0.12 0.00 0.00 56.93 57.41 2j64 s PHE 114 Cb 0.07 0.29 0.02 0.00 -0.57 0.00 0.00 43.02 42.83 2j64 s PHE 114 CO 0.12 -0.68 0.18 0.00 -0.10 0.00 0.00 175.22 174.74 2j64 s ALA 115 N -3.32 -0.44 -0.04 5.36 0.00 -0.56 -0.98 121.76 121.78 2j64 s ALA 115 Ca -0.00 0.46 0.03 0.00 0.00 0.00 0.00 51.96 52.44 2j64 s ALA 115 Cb 0.01 -0.26 0.01 0.00 0.00 0.00 0.00 23.12 22.87 2j64 s ALA 115 CO -0.09 -0.10 -0.11 -1.01 0.00 0.00 0.00 175.76 174.45 2j64 s HIS 116 N -0.04 1.24 0.03 0.00 0.09 -0.70 -0.63 115.29 115.28 2j64 s HIS 116 Ca -0.01 -0.37 0.07 0.00 -0.00 0.00 0.00 55.06 54.75 2j64 s HIS 116 Cb -0.02 -0.89 -0.02 0.00 -0.00 0.00 0.00 32.58 31.65 2j64 s HIS 116 CO 0.00 -0.17 -0.20 0.71 -0.00 0.00 0.00 174.74 175.08 2j64 s TYR 117 N 0.33 1.80 0.15 1.40 2.02 -0.23 -1.09 117.35 121.74 2j64 s TYR 117 Ca -0.07 -0.37 -0.15 0.00 -0.37 0.00 0.00 57.07 56.12 2j64 s TYR 117 Cb -0.12 -1.09 0.03 0.00 -0.40 0.00 0.00 41.96 40.38 2j64 s TYR 117 CO 0.02 0.06 1.72 0.00 -1.57 0.00 0.00 175.55 175.78 2j64 h ALA 118 N 5.05 0.61 -2.33 3.71 0.00 -1.33 -1.76 119.26 123.20 2j64 h ALA 118 Ca -0.42 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.23 2j64 h ALA 118 Cb 1.16 -0.18 -0.16 0.00 0.00 0.00 0.00 17.79 18.60 2j64 h ALA 118 CO 0.45 0.18 -0.68 0.95 0.00 0.00 0.00 179.25 180.15 2j64 s THR 119 N -5.65 0.27 -0.08 0.00 -4.23 -1.25 -3.66 115.64 101.04 2j64 s THR 119 Ca -0.13 -1.72 -0.03 0.00 -1.18 0.00 0.00 61.69 58.63 2j64 s THR 119 Cb 0.11 -1.40 0.04 0.00 1.34 0.00 0.00 72.50 72.60 2j64 s THR 119 CO 0.76 -0.92 0.16 0.12 -0.54 0.00 0.00 174.62 174.20 2j64 s PHE 120 N -3.59 -0.19 -0.13 3.99 5.36 -0.06 -0.03 117.98 123.33 2j64 s PHE 120 Ca 0.05 0.56 -0.16 0.00 -0.96 0.00 0.00 56.93 56.42 2j64 s PHE 120 Cb 0.06 -0.10 0.04 0.00 -0.34 0.00 0.00 43.02 42.68 2j64 s PHE 120 CO -0.08 -0.20 0.42 0.50 -1.46 0.00 0.00 175.22 174.40 2j64 s ARG 121 N 1.42 0.55 -0.13 10.12 3.52 -0.39 -4.38 118.95 129.66 2j64 s ARG 121 Ca -0.07 0.45 -0.02 0.00 -0.13 0.00 0.00 55.73 55.96 2j64 s ARG 121 Cb -0.12 0.26 -0.03 0.00 -1.56 0.00 0.00 34.95 33.51 2j64 s ARG 121 CO -0.06 -0.09 -0.04 -0.51 -0.81 0.00 0.00 175.30 173.78 2j64 s LEU 122 N -0.10 3.24 1.07 -0.88 1.43 -1.26 -0.31 118.68 121.86 2j64 s LEU 122 Ca -0.03 -0.09 -0.15 0.00 -1.03 0.00 0.00 54.13 52.83 2j64 s LEU 122 Cb -0.03 -1.76 0.22 0.00 0.03 0.00 0.00 46.19 44.65 2j64 s LEU 122 CO 0.02 0.23 1.11 -0.76 0.23 0.00 0.00 176.35 177.18 2j64 s LEU 123 N -0.01 1.32 1.04 1.79 1.02 -0.53 -4.50 118.68 118.82 2j64 s LEU 123 Ca 0.01 0.92 -0.15 0.00 0.02 0.00 0.00 54.13 54.92 2j64 s LEU 123 Cb -0.13 -2.94 0.21 0.00 0.02 0.00 0.00 46.19 43.35 2j64 s LEU 123 CO 0.03 -3.44 1.13 -0.83 0.02 0.00 0.00 176.35 173.26 2j64 s GLY 124 N -3.73 1.59 0.47 -3.19 0.00 -1.26 -3.79 107.32 97.42 2j64 s GLY 124 Ca 0.68 -0.70 0.14 0.00 0.00 0.00 0.00 44.72 44.84 2j64 s GLY 124 CO 0.56 0.01 2.08 -2.09 0.00 0.00 0.00 173.10 173.67 2j64 h GLU 125 N -2.01 0.22 -0.31 2.90 4.81 -1.95 -0.46 114.58 117.78 2j64 h GLU 125 Ca -0.49 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2j64 h GLU 125 Cb 1.31 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.62 2j64 h GLU 125 CO 0.49 0.15 0.21 -0.24 -0.73 0.00 0.00 179.01 178.88 2j64 h VAL 126 N 0.23 1.08 -0.56 0.32 3.04 -2.04 -0.01 116.25 118.31 2j64 h VAL 126 Ca 0.12 -0.14 0.00 0.00 -1.01 0.00 0.00 66.70 65.66 2j64 h VAL 126 Cb 0.18 0.62 0.00 0.00 -2.01 0.00 0.00 31.29 30.08 2j64 h VAL 126 CO -0.02 0.08 0.00 0.47 -1.01 0.00 0.00 177.57 177.08 2j64 n ASP 127 N -4.49 4.74 -2.08 3.17 8.00 -0.61 -4.95 116.55 120.33 2j64 n ASP 127 Ca 0.02 -2.58 -0.19 0.00 0.71 0.00 0.00 54.79 52.75 2j64 n ASP 127 Cb 0.07 -0.60 -0.02 0.00 -0.02 0.00 0.00 41.12 40.55 2j64 n ASP 127 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2j64 n HIS 128 N 0.84 -0.80 -3.43 1.24 8.25 -0.02 -2.62 115.22 118.69 2j64 n HIS 128 Ca 0.24 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.45 2j64 n HIS 128 Cb 0.94 -3.65 0.04 0.00 1.12 0.00 0.00 29.99 28.43 2j64 n HIS 128 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2j64 n TYR 129 N -3.84 -2.24 -1.61 4.41 4.01 -0.28 -0.48 117.16 117.14 2j64 n TYR 129 Ca -0.22 0.72 -0.47 0.00 -0.16 0.00 0.00 57.90 57.77 2j64 n TYR 129 Cb 0.67 -4.23 -0.03 0.00 -0.31 0.00 0.00 39.34 35.44 2j64 n TYR 129 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 2j64 n GLN 130 N -4.37 1.45 -2.54 -0.72 7.27 -1.08 -4.19 117.38 113.20 2j64 n GLN 130 Ca -0.03 0.51 -0.42 0.00 0.07 0.00 0.00 57.00 57.13 2j64 n GLN 130 Cb 0.57 -2.03 -0.03 0.00 2.41 0.00 0.00 30.24 31.16 2j64 n GLN 130 CO 0.00 0.00 0.00 -1.17 0.07 0.00 0.00 177.06 175.96 2j64 s LEU 131 N 0.44 4.36 -0.28 1.69 2.96 -0.32 -1.45 118.68 126.08 2j64 s LEU 131 Ca 0.69 1.85 -0.00 0.00 -0.22 0.00 0.00 54.13 56.44 2j64 s LEU 131 Cb -0.76 -3.57 0.05 0.00 0.50 0.00 0.00 46.19 42.40 2j64 s LEU 131 CO 0.53 -0.40 -0.05 0.00 -1.32 0.00 0.00 176.35 175.11 2j64 s ALA 132 N 1.18 2.71 -0.08 5.97 0.00 0.57 0.21 121.76 132.32 2j64 s ALA 132 Ca 0.56 -1.70 0.05 0.00 0.00 0.00 0.00 51.96 50.87 2j64 s ALA 132 Cb -0.25 -1.77 -0.01 0.00 0.00 0.00 0.00 23.12 21.09 2j64 s ALA 132 CO 0.28 -1.15 -0.25 -1.17 0.00 0.00 0.00 175.76 173.47 2j64 s LEU 133 N 1.22 2.08 0.99 0.00 2.96 -1.26 -1.26 118.68 123.40 2j64 s LEU 133 Ca -0.05 -0.53 -0.15 0.00 -0.22 0.00 0.00 54.13 53.17 2j64 s LEU 133 Cb -0.19 -1.39 0.19 0.00 0.50 0.00 0.00 46.19 45.30 2j64 s LEU 133 CO -0.03 0.21 1.21 -0.83 -1.32 0.00 0.00 176.35 175.59 2j64 s GLY 134 N 0.06 1.66 0.54 7.98 0.00 0.96 -4.90 107.32 113.62 2j64 s GLY 134 Ca -0.10 -0.92 -0.20 0.00 0.00 0.00 0.00 44.72 43.50 2j64 s GLY 134 CO 0.06 -0.20 1.13 0.54 0.00 0.00 0.00 173.10 174.63 2j64 s LYS 135 N -5.60 3.35 0.22 2.90 3.01 -1.26 -4.23 119.74 118.14 2j64 s LYS 135 Ca 0.69 1.63 -0.31 0.00 -1.01 0.00 0.00 55.97 56.97 2j64 s LYS 135 Cb -0.09 -2.01 -0.11 0.00 -1.01 0.00 0.00 37.83 34.62 2j64 s LYS 135 CO 0.53 -0.85 1.55 0.12 0.51 0.00 0.00 175.35 177.21 2j64 s PHE 136 N -1.76 2.96 -0.18 3.18 5.36 -1.26 -1.20 117.98 125.08 2j64 s PHE 136 Ca 0.73 0.75 0.03 0.00 -0.96 0.00 0.00 56.93 57.47 2j64 s PHE 136 Cb -0.24 -3.95 -0.13 0.00 -0.34 0.00 0.00 43.02 38.36 2j64 s PHE 136 CO 0.27 -3.34 -0.14 -1.13 -1.46 0.00 0.00 175.22 169.42 2j64 n SER 137 N 3.08 2.41 0.00 6.13 3.41 -0.25 -4.94 113.62 123.47 2j64 n SER 137 Ca 0.11 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 2j64 n SER 137 Cb 0.38 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.16 2j64 n SER 137 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2j64 n GLU 138 N -3.00 0.00 0.00 4.33 2.13 -1.25 -5.05 120.64 117.80 2j64 n GLU 138 Ca -0.32 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.50 2j64 n GLU 138 Cb 0.87 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.58 2j64 n GLU 138 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2j64 n GLY 139 N -0.00 3.67 0.11 8.31 0.00 -1.26 -1.73 105.19 114.28 2j64 n GLY 139 Ca 0.00 -0.16 0.12 0.00 0.00 0.00 0.00 46.02 45.97 2j64 n GLY 139 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2j64 n THR 140 N -0.47 0.78 0.19 2.61 -2.24 -0.70 -1.80 114.28 112.64 2j64 n THR 140 Ca 0.00 0.13 0.09 0.00 -2.27 0.00 0.00 64.05 62.00 2j64 n THR 140 Cb 0.00 -1.02 0.12 0.00 -2.10 0.00 0.00 70.33 67.33 2j64 n THR 140 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2j64 h ALA 141 N 2.36 0.89 0.00 6.98 0.00 -1.37 -3.44 119.26 124.67 2j64 h ALA 141 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2j64 h ALA 141 Cb 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2j64 h ALA 141 CO 0.00 0.21 0.00 0.41 0.00 0.00 0.00 179.25 179.87 2j64 n GLY 142 N 1.14 -3.05 3.38 0.00 0.00 -0.74 -2.58 105.19 103.34 2j64 n GLY 142 Ca 0.03 -1.79 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 2j64 n GLY 142 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2j64 s ASP 143 N -1.53 5.85 -0.10 1.61 2.15 -1.26 -4.73 116.67 118.66 2j64 s ASP 143 Ca 0.00 -1.06 0.14 0.00 0.43 0.00 0.00 52.55 52.07 2j64 s ASP 143 Cb 0.00 -2.07 0.22 0.00 -0.30 0.00 0.00 42.92 40.78 2j64 s ASP 143 CO 0.00 -0.44 1.12 -1.20 -0.17 0.00 0.00 175.17 174.47 2j64 n SER 144 N 5.05 1.76 -0.01 -0.34 7.64 -1.26 -4.70 113.62 121.76 2j64 n SER 144 Ca -0.11 -2.84 0.01 0.00 1.01 0.00 0.00 58.87 56.94 2j64 n SER 144 Cb 0.46 -0.38 -0.03 0.00 -1.01 0.00 0.00 64.21 63.25 2j64 n SER 144 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2j64 n LEU 145 N -1.07 0.00 -0.27 -3.43 7.94 -1.26 -2.81 117.00 116.09 2j64 n LEU 145 Ca 0.12 0.00 0.06 0.00 -1.11 0.00 0.00 56.01 55.09 2j64 n LEU 145 Cb 0.66 0.03 0.20 0.00 0.53 0.00 0.00 43.42 44.84 2j64 n LEU 145 CO 0.01 0.03 1.03 0.28 -1.11 0.00 0.00 177.39 177.62 2j64 h SER 146 N 0.00 0.30 -0.89 1.96 0.02 -1.95 0.11 113.55 113.11 2j64 h SER 146 Ca -0.03 0.11 0.22 0.00 -0.84 0.00 0.00 61.79 61.26 2j64 h SER 146 Cb 0.49 0.09 -0.06 0.00 0.14 0.00 0.00 62.40 63.06 2j64 h SER 146 CO 0.00 0.10 0.61 0.25 -1.14 0.00 0.00 176.83 176.65 2j64 h LEU 147 N 0.45 0.25 0.00 5.07 5.85 -1.94 -0.95 115.31 124.04 2j64 h LEU 147 Ca 0.44 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.18 2j64 h LEU 147 Cb 0.68 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.69 2j64 h LEU 147 CO -0.42 0.09 -0.34 1.41 -0.34 0.00 0.00 178.44 178.84 2j64 n HIS 148 N -4.43 0.43 -1.79 1.25 8.25 0.39 -4.86 115.22 114.47 2j64 n HIS 148 Ca 0.19 0.13 -0.41 0.00 -0.26 0.00 0.00 57.72 57.36 2j64 n HIS 148 Cb 0.80 -0.61 -0.01 0.00 1.12 0.00 0.00 29.99 31.28 2j64 n HIS 148 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2j64 s SER 149 N -3.83 6.36 0.00 0.41 0.15 -0.36 -2.10 113.70 114.32 2j64 s SER 149 Ca 0.10 2.99 0.00 0.00 0.70 0.00 0.00 55.95 59.73 2j64 s SER 149 Cb 0.15 -2.65 0.00 0.00 -1.71 0.00 0.00 66.02 61.81 2j64 s SER 149 CO 0.65 -0.90 0.00 0.61 1.20 0.00 0.00 173.24 174.80 2j64 n GLY 150 N 1.58 0.70 3.69 9.45 0.00 0.13 -4.99 105.19 115.75 2j64 n GLY 150 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 2j64 n GLY 150 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2j64 s ARG 151 N -0.28 2.78 0.86 1.61 0.52 -0.89 -4.84 118.95 118.71 2j64 s ARG 151 Ca 0.00 -0.63 -0.11 0.00 -0.52 0.00 0.00 55.73 54.47 2j64 s ARG 151 Cb 0.00 -2.67 0.11 0.00 0.52 0.00 0.00 34.95 32.91 2j64 s ARG 151 CO 0.00 0.61 1.11 -1.25 0.02 0.00 0.00 175.30 175.79 2j64 s PRO 152 N -1.70 1.49 0.32 3.54 0.04 -1.26 -1.17 135.00 136.26 2j64 s PRO 152 Ca 0.21 1.22 -0.19 0.00 0.04 0.00 0.00 61.00 62.28 2j64 s PRO 152 Cb -0.12 -1.81 -0.09 0.00 0.04 0.00 0.00 34.50 32.52 2j64 s PRO 152 CO 0.12 -2.19 0.82 0.12 0.04 0.00 0.00 177.00 175.90 2j64 s PHE 153 N -2.80 3.48 -0.03 0.56 5.36 0.36 -3.86 117.98 121.05 2j64 s PHE 153 Ca 0.64 1.44 0.01 0.00 -0.96 0.00 0.00 56.93 58.06 2j64 s PHE 153 Cb -0.20 -2.69 0.01 0.00 -0.34 0.00 0.00 43.02 39.81 2j64 s PHE 153 CO 0.57 0.13 -0.05 0.99 -1.46 0.00 0.00 175.22 175.40 2j64 s THR 154 N -1.86 0.49 0.42 0.12 2.01 0.48 -4.53 115.64 112.77 2j64 s THR 154 Ca 0.53 -0.15 0.03 0.00 0.31 0.00 0.00 61.69 62.41 2j64 s THR 154 Cb -0.13 -0.49 -0.04 0.00 0.01 0.00 0.00 72.50 71.86 2j64 s THR 154 CO 0.18 0.19 0.06 0.42 -0.69 0.00 0.00 174.62 174.78 2j64 s THR 155 N 0.56 1.06 0.54 -0.82 -4.23 -0.94 -2.27 115.64 109.54 2j64 s THR 155 Ca -0.07 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 58.64 2j64 s THR 155 Cb -0.11 -2.47 0.29 0.00 1.34 0.00 0.00 72.50 71.55 2j64 s THR 155 CO -0.00 0.00 2.18 0.10 -0.54 0.00 0.00 174.62 176.36 2j64 h TYR 156 N 1.74 0.00 -0.45 3.99 -0.00 -1.80 -2.20 116.97 118.24 2j64 h TYR 156 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.33 2j64 h TYR 156 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.00 2j64 h TYR 156 CO 1.21 0.00 0.00 -0.40 -0.00 0.00 0.00 178.16 178.97 2j64 n ASP 157 N -4.35 3.33 -3.35 0.10 5.75 -1.26 -4.78 116.55 111.99 2j64 n ASP 157 Ca -0.03 -1.95 -0.14 0.00 -0.01 0.00 0.00 54.79 52.66 2j64 n ASP 157 Cb 0.09 -0.30 -0.07 0.00 -1.03 0.00 0.00 41.12 39.81 2j64 n ASP 157 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2j64 s ALA 158 N -1.14 -0.75 -0.34 2.12 0.00 -0.83 -4.93 121.76 115.89 2j64 s ALA 158 Ca 0.35 -0.45 -0.18 0.00 0.00 0.00 0.00 51.96 51.68 2j64 s ALA 158 Cb 0.19 -2.04 -0.01 0.00 0.00 0.00 0.00 23.12 21.27 2j64 s ALA 158 CO 0.26 -1.94 0.51 0.34 0.00 0.00 0.00 175.76 174.92 2j64 s ASP 159 N 1.96 6.32 -0.06 0.00 -1.08 -1.26 -2.22 116.67 120.34 2j64 s ASP 159 Ca 0.13 0.01 0.09 0.00 -0.52 0.00 0.00 52.55 52.25 2j64 s ASP 159 Cb -0.14 -2.27 0.13 0.00 -1.46 0.00 0.00 42.92 39.19 2j64 s ASP 159 CO -0.18 -0.46 1.01 1.41 0.52 0.00 0.00 175.17 177.48 2j64 n HIS 160 N 5.72 0.00 -1.95 -5.34 8.25 -1.26 -5.06 115.22 115.57 2j64 n HIS 160 Ca -0.05 -0.57 -0.14 0.00 -0.26 0.00 0.00 57.72 56.71 2j64 n HIS 160 Cb 0.49 -0.09 0.09 0.00 1.12 0.00 0.00 29.99 31.60 2j64 n HIS 160 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 2j64 n ASP 161 N -0.77 0.38 -1.73 0.41 5.68 -1.26 -4.72 116.55 114.54 2j64 n ASP 161 Ca 0.07 -1.42 0.08 0.00 -0.50 0.00 0.00 54.79 53.02 2j64 n ASP 161 Cb 0.54 -0.44 0.38 0.00 -1.14 0.00 0.00 41.12 40.47 2j64 n ASP 161 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2j64 n SER 162 N -3.21 5.30 -4.90 -1.12 3.41 -0.67 -4.94 113.62 107.49 2j64 n SER 162 Ca 0.09 -2.74 -0.30 0.00 -0.26 0.00 0.00 58.87 55.65 2j64 n SER 162 Cb 0.31 -0.64 -0.04 0.00 -0.26 0.00 0.00 64.21 63.58 2j64 n SER 162 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2j64 s SER 163 N -0.89 6.23 0.49 4.04 0.15 -1.19 -4.78 113.70 117.74 2j64 s SER 163 Ca 0.53 0.22 0.22 0.00 0.70 0.00 0.00 55.95 57.61 2j64 s SER 163 Cb 0.38 -1.88 1.24 0.00 -1.71 0.00 0.00 66.02 64.05 2j64 s SER 163 CO 0.19 0.16 2.03 -1.13 1.20 0.00 0.00 173.24 175.69 2j64 h ASN 164 N 3.02 0.00 -4.65 5.45 -1.24 -1.95 -3.44 115.58 112.78 2j64 h ASN 164 Ca -0.46 0.00 -0.19 0.00 0.71 0.00 0.00 56.30 56.36 2j64 h ASN 164 Cb 1.16 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 40.21 2j64 h ASN 164 CO 0.74 0.16 -0.06 -1.20 -1.29 0.00 0.00 177.43 175.77 2j64 n SER 165 N -3.91 1.21 -4.42 1.15 7.64 -1.26 -5.08 113.62 108.96 2j64 n SER 165 Ca -0.02 -1.63 -0.44 0.00 1.01 0.00 0.00 58.87 57.79 2j64 n SER 165 Cb 0.25 -0.08 -0.08 0.00 -1.01 0.00 0.00 64.21 63.29 2j64 n SER 165 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2j64 s ASN 166 N -2.25 6.17 0.36 6.43 3.84 -1.26 -4.91 114.94 123.32 2j64 s ASN 166 Ca 0.17 -1.13 0.09 0.00 0.21 0.00 0.00 52.86 52.20 2j64 s ASN 166 Cb -0.01 -2.21 0.83 0.00 -0.55 0.00 0.00 41.25 39.30 2j64 s ASN 166 CO 0.11 -0.69 1.88 0.00 -2.79 0.00 0.00 177.10 175.61 2j64 h ALA 168 N 1.60 1.28 -0.02 0.00 0.00 -1.86 0.49 119.26 120.76 2j64 h ALA 168 Ca 0.43 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 2j64 h ALA 168 Cb 0.70 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2j64 h ALA 168 CO -0.19 0.52 -0.11 0.28 0.00 0.00 0.00 179.25 179.75 2j64 h VAL 169 N 0.82 1.50 -0.46 0.00 2.07 -1.58 0.29 116.25 118.89 2j64 h VAL 169 Ca 0.19 -1.63 0.06 0.00 0.82 0.00 0.00 66.70 66.14 2j64 h VAL 169 Cb 0.20 2.53 -0.05 0.00 -1.52 0.00 0.00 31.29 32.45 2j64 h VAL 169 CO -0.01 0.44 0.18 0.40 0.02 0.00 0.00 177.57 178.59 2j64 h ILE 170 N -0.51 0.87 -0.02 4.57 2.04 -0.61 -3.04 117.51 120.80 2j64 h ILE 170 Ca -0.01 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2j64 h ILE 170 Cb 0.77 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 2j64 h ILE 170 CO 0.02 0.07 -0.26 1.33 0.00 0.00 0.00 178.15 179.31 2j64 n VAL 171 N -4.99 0.00 -3.19 1.67 0.24 0.17 -4.97 118.33 107.26 2j64 n VAL 171 Ca 0.04 -0.37 -0.13 0.00 -2.04 0.00 0.00 64.34 61.84 2j64 n VAL 171 Cb 0.17 1.37 0.06 0.00 -1.47 0.00 0.00 33.84 33.97 2j64 n VAL 171 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 2j64 n HIS 172 N 0.60 -2.47 -2.36 6.34 -0.00 0.89 -4.62 115.22 113.59 2j64 n HIS 172 Ca 0.11 0.87 0.00 0.00 0.46 0.00 0.00 57.72 59.16 2j64 n HIS 172 Cb 0.53 -4.09 0.00 0.00 -0.12 0.00 0.00 29.99 26.31 2j64 n HIS 172 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2j64 n GLY 173 N -1.29 2.49 3.19 1.57 0.00 -0.39 -3.45 105.19 107.31 2j64 n GLY 173 Ca -0.06 -0.79 -0.13 0.00 0.00 0.00 0.00 46.02 45.04 2j64 n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j64 s ALA 174 N -1.00 -0.78 -0.02 4.61 0.00 -1.26 -4.55 121.76 118.76 2j64 s ALA 174 Ca 0.00 0.96 -0.29 0.00 0.00 0.00 0.00 51.96 52.63 2j64 s ALA 174 Cb 0.00 -0.57 0.10 0.00 0.00 0.00 0.00 23.12 22.65 2j64 s ALA 174 CO 0.00 -0.17 1.29 -0.46 0.00 0.00 0.00 175.76 176.42 2j64 s TRP 175 N 0.42 0.01 -1.42 0.00 -0.11 -0.96 -4.52 118.94 112.36 2j64 s TRP 175 Ca -0.02 -0.12 -0.09 0.00 1.22 0.00 0.00 56.10 57.09 2j64 s TRP 175 Cb -0.04 0.56 0.06 0.00 -1.50 0.00 0.00 33.47 32.55 2j64 s TRP 175 CO -0.02 -0.26 2.42 0.91 -4.62 0.00 0.00 176.95 175.38 2j64 n TRP 176 N -0.80 2.75 -2.14 5.86 8.01 -1.26 -0.39 117.44 129.47 2j64 n TRP 176 Ca 0.01 -2.92 -0.38 0.00 -1.31 0.00 0.00 57.50 52.90 2j64 n TRP 176 Cb 0.60 -2.15 -0.00 0.00 -2.01 0.00 0.00 31.31 27.74 2j64 n TRP 176 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.69 177.39 2j64 s TYR 177 N 0.75 2.78 0.00 -5.99 2.02 -1.25 -4.74 117.35 110.93 2j64 s TYR 177 Ca 0.55 1.49 0.00 0.00 -0.37 0.00 0.00 57.07 58.73 2j64 s TYR 177 Cb 0.16 -3.51 0.00 0.00 -0.40 0.00 0.00 41.96 38.21 2j64 s TYR 177 CO -0.06 -1.84 0.00 0.00 -1.57 0.00 0.00 175.55 172.08 2j64 n ALA 178 N -0.41 0.01 -2.84 3.71 0.00 -1.26 -4.15 120.51 115.57 2j64 n ALA 178 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.40 2j64 n ALA 178 Cb 0.46 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.97 2j64 n ALA 178 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2j64 n SER 179 N 0.00 -1.68 -0.01 0.00 2.88 -1.26 -1.66 113.62 111.88 2j64 n SER 179 Ca 0.00 -3.51 -0.03 0.00 -1.33 0.00 0.00 58.87 54.00 2j64 n SER 179 Cb 0.00 1.35 -0.01 0.00 -0.75 0.00 0.00 64.21 64.79 2j64 n SER 179 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2j64 s TYR 181 N -2.05 -0.43 -0.07 0.00 -0.85 -1.26 -4.59 117.35 108.10 2j64 s TYR 181 Ca -0.04 0.29 0.18 0.00 -0.52 0.00 0.00 57.07 56.97 2j64 s TYR 181 Cb 0.01 0.42 -0.27 0.00 0.38 0.00 0.00 41.96 42.50 2j64 s TYR 181 CO 0.05 -0.75 0.31 0.54 -1.52 0.00 0.00 175.55 174.18 2j64 n ARG 182 N -0.07 0.74 -4.11 -3.49 5.12 -1.26 -4.98 116.66 108.61 2j64 n ARG 182 Ca -0.17 -0.12 -0.13 0.00 -1.93 0.00 0.00 57.85 55.49 2j64 n ARG 182 Cb 0.63 -1.44 -0.11 0.00 -1.16 0.00 0.00 32.46 30.38 2j64 n ARG 182 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2j64 s SER 183 N -4.41 1.06 -0.39 0.55 1.04 -1.13 -0.25 113.70 110.17 2j64 s SER 183 Ca -0.07 -0.67 0.11 0.00 0.48 0.00 0.00 55.95 55.79 2j64 s SER 183 Cb 0.10 0.04 0.37 0.00 0.10 0.00 0.00 66.02 66.62 2j64 s SER 183 CO 0.75 -0.25 1.01 -3.20 0.98 0.00 0.00 173.24 172.53 2j64 n ASN 184 N 1.06 -0.54 0.04 7.02 5.15 -0.33 -4.97 115.26 122.69 2j64 n ASN 184 Ca -0.20 -3.06 0.11 0.00 -0.60 0.00 0.00 54.58 50.83 2j64 n ASN 184 Cb 0.56 0.49 0.47 0.00 -0.53 0.00 0.00 39.78 40.76 2j64 n ASN 184 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2j64 n LEU 185 N 0.07 0.29 -1.63 1.20 4.77 -1.26 -1.29 117.00 119.15 2j64 n LEU 185 Ca 0.11 0.55 0.07 0.00 -0.03 0.00 0.00 56.01 56.70 2j64 n LEU 185 Cb 0.74 -0.48 0.35 0.00 -2.33 0.00 0.00 43.42 41.70 2j64 n LEU 185 CO 0.12 -0.21 0.79 0.59 -1.33 0.00 0.00 177.39 177.35 2j64 n ASN 186 N -1.79 4.86 -2.92 -1.43 3.02 -1.26 -4.91 115.26 110.83 2j64 n ASN 186 Ca 0.05 -2.65 -0.14 0.00 -0.03 0.00 0.00 54.58 51.81 2j64 n ASN 186 Cb 0.29 -0.62 0.10 0.00 -0.61 0.00 0.00 39.78 38.94 2j64 n ASN 186 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2j64 n GLY 187 N 0.76 -1.83 3.71 7.41 0.00 -0.41 -4.21 105.19 110.63 2j64 n GLY 187 Ca 0.24 -1.60 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 2j64 n GLY 187 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2j64 s ARG 188 N -4.26 4.47 0.45 1.61 3.52 -1.22 -4.67 118.95 118.85 2j64 s ARG 188 Ca 0.34 1.61 -0.24 0.00 -0.13 0.00 0.00 55.73 57.31 2j64 s ARG 188 Cb -0.02 -3.42 -0.08 0.00 -1.56 0.00 0.00 34.95 29.87 2j64 s ARG 188 CO 0.25 -0.21 1.28 -0.47 -0.81 0.00 0.00 175.30 175.33 2j64 s TYR 189 N 1.24 2.73 -0.02 5.12 5.04 -1.26 -3.88 117.35 126.31 2j64 s TYR 189 Ca 0.55 1.44 0.01 0.00 -2.44 0.00 0.00 57.07 56.64 2j64 s TYR 189 Cb -0.25 -3.61 0.01 0.00 0.35 0.00 0.00 41.96 38.45 2j64 s TYR 189 CO 0.27 -2.09 -0.05 0.00 -1.34 0.00 0.00 175.55 172.35 2j64 s ALA 190 N -1.35 0.53 -0.56 3.97 0.00 -1.26 -4.94 121.76 118.16 2j64 s ALA 190 Ca 0.62 -0.12 0.25 0.00 0.00 0.00 0.00 51.96 52.71 2j64 s ALA 190 Cb -0.36 -0.26 0.67 0.00 0.00 0.00 0.00 23.12 23.18 2j64 s ALA 190 CO 0.45 0.05 1.72 -0.39 0.00 0.00 0.00 175.76 177.59 2j64 h VAL 191 N 5.60 0.00 -2.18 0.00 -1.51 -1.95 -3.45 116.25 112.76 2j64 h VAL 191 Ca -0.34 -0.66 -0.01 0.00 -1.23 0.00 0.00 66.70 64.46 2j64 h VAL 191 Cb 1.17 1.64 0.00 0.00 -2.13 0.00 0.00 31.29 31.97 2j64 h VAL 191 CO 0.49 0.00 0.05 -1.54 -1.23 0.00 0.00 177.57 175.34 2j64 n SER 192 N -2.63 -0.40 -0.44 4.19 3.41 -1.26 -4.99 113.62 111.50 2j64 n SER 192 Ca 0.04 -1.28 0.06 0.00 -0.26 0.00 0.00 58.87 57.43 2j64 n SER 192 Cb 0.45 0.68 0.04 0.00 -0.26 0.00 0.00 64.21 65.12 2j64 n SER 192 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2j64 n GLU 193 N -0.10 0.71 0.03 4.33 2.13 -1.26 -1.91 120.64 124.57 2j64 n GLU 193 Ca -0.02 -1.13 0.09 0.00 0.66 0.00 0.00 57.16 56.76 2j64 n GLU 193 Cb 0.11 -1.21 0.53 0.00 0.27 0.00 0.00 31.44 31.13 2j64 n GLU 193 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2j64 h ALA 194 N 2.20 1.96 -0.06 4.31 0.00 -2.01 -2.46 119.26 123.21 2j64 h ALA 194 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2j64 h ALA 194 Cb 0.47 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2j64 h ALA 194 CO 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.23 2j64 n ALA 195 N -2.52 2.54 -1.73 0.00 0.00 -0.80 -4.99 120.51 113.01 2j64 n ALA 195 Ca 0.05 -0.53 -0.42 0.00 0.00 0.00 0.00 53.44 52.53 2j64 n ALA 195 Cb 0.23 -1.08 -0.02 0.00 0.00 0.00 0.00 19.45 18.58 2j64 n ALA 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2j64 n ALA 196 N 0.47 2.07 -2.14 0.00 0.00 -0.93 -4.81 120.51 115.17 2j64 n ALA 196 Ca 0.18 0.38 -0.26 0.00 0.00 0.00 0.00 53.44 53.73 2j64 n ALA 196 Cb 0.40 -2.40 0.02 0.00 0.00 0.00 0.00 19.45 17.48 2j64 n ALA 196 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2j64 s HIS 197 N -0.23 3.31 0.24 0.00 3.76 -1.26 -4.98 115.29 116.14 2j64 s HIS 197 Ca 0.63 0.65 -0.06 0.00 -0.15 0.00 0.00 55.06 56.13 2j64 s HIS 197 Cb -0.54 -2.62 0.25 0.00 1.11 0.00 0.00 32.58 30.79 2j64 s HIS 197 CO 0.52 -0.68 1.88 0.87 -0.85 0.00 0.00 174.74 176.48 2j64 h LYS 198 N -0.05 1.24 -5.03 1.40 1.79 -1.95 -3.37 116.57 110.61 2j64 h LYS 198 Ca -0.46 -0.13 -0.67 0.00 -2.18 0.00 0.00 60.65 57.22 2j64 h LYS 198 Cb 1.25 -0.25 -0.35 0.00 -1.58 0.00 0.00 32.23 31.29 2j64 h LYS 198 CO 0.61 0.89 -0.85 0.71 -1.08 0.00 0.00 179.45 179.73 2j64 s TYR 199 N -5.88 2.86 0.00 -1.35 2.02 -1.26 -3.44 117.35 110.30 2j64 s TYR 199 Ca -0.13 -1.75 0.00 0.00 -0.37 0.00 0.00 57.07 54.83 2j64 s TYR 199 Cb 0.17 -1.93 0.00 0.00 -0.40 0.00 0.00 41.96 39.81 2j64 s TYR 199 CO 0.82 -0.82 0.00 0.41 -1.57 0.00 0.00 175.55 174.40 2j64 n GLY 200 N 4.59 5.59 3.57 0.71 0.00 -1.26 -4.47 105.19 113.92 2j64 n GLY 200 Ca -0.20 -1.46 -0.32 0.00 0.00 0.00 0.00 46.02 44.05 2j64 n GLY 200 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2j64 s ILE 201 N -0.10 3.65 0.06 -0.61 1.01 -1.25 -4.56 121.20 119.40 2j64 s ILE 201 Ca 0.00 -0.78 0.09 0.00 0.00 0.00 0.00 60.65 59.96 2j64 s ILE 201 Cb 0.00 -4.52 -0.03 0.00 0.01 0.00 0.00 42.46 37.92 2j64 s ILE 201 CO 0.00 -1.30 -0.25 -1.81 0.00 0.00 0.00 174.94 171.58 2j64 s ASP 202 N 6.54 3.30 -0.25 3.58 1.01 -1.23 -2.12 116.67 127.49 2j64 s ASP 202 Ca 0.63 -0.60 -0.00 0.00 0.71 0.00 0.00 52.55 53.28 2j64 s ASP 202 Cb -0.02 -0.32 0.08 0.00 1.01 0.00 0.00 42.92 43.66 2j64 s ASP 202 CO 0.02 0.24 0.03 0.86 0.21 0.00 0.00 175.17 176.53 2j64 s TRP 203 N -0.88 1.91 0.23 4.23 -0.11 -1.26 -1.19 118.94 121.87 2j64 s TRP 203 Ca 0.13 -1.59 -0.06 0.00 1.22 0.00 0.00 56.10 55.79 2j64 s TRP 203 Cb -0.10 -1.57 0.34 0.00 -1.50 0.00 0.00 33.47 30.64 2j64 s TRP 203 CO 0.03 -0.77 1.82 0.00 -4.62 0.00 0.00 176.95 173.41 2j64 h ALA 204 N 8.05 1.09 0.00 5.86 0.00 -0.89 -0.87 119.26 132.51 2j64 h ALA 204 Ca -0.15 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2j64 h ALA 204 Cb 1.06 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2j64 h ALA 204 CO 0.42 0.12 0.00 -1.13 0.00 0.00 0.00 179.25 178.65 2j64 n SER 205 N -4.73 0.00 0.00 0.00 3.41 -1.26 -3.00 113.62 108.03 2j64 n SER 205 Ca 0.12 -0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 2j64 n SER 205 Cb 0.23 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 2j64 n SER 205 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2j64 n GLY 206 N 1.04 -0.14 0.00 5.00 0.00 -0.36 -4.57 105.19 106.17 2j64 n GLY 206 Ca 0.14 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.27 2j64 n GLY 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j64 n ARG 207 N 0.00 0.01 0.00 1.61 1.74 -1.15 -5.08 116.66 113.79 2j64 n ARG 207 Ca 0.00 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 2j64 n ARG 207 Cb 0.00 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 29.94 2j64 n ARG 207 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2j64 n GLY 208 N 1.50 0.97 3.64 -0.13 0.00 -1.01 -4.57 105.19 105.59 2j64 n GLY 208 Ca 0.05 -1.77 -0.48 0.00 0.00 0.00 0.00 46.02 43.82 2j64 n GLY 208 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2j64 n VAL 209 N 0.97 0.00 -0.55 1.61 0.31 -1.26 -2.50 118.33 116.92 2j64 n VAL 209 Ca 0.00 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2j64 n VAL 209 Cb 0.00 -1.28 0.00 0.00 -0.91 0.00 0.00 33.84 31.65 2j64 n VAL 209 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2j64 n GLY 210 N 3.09 0.81 2.89 2.92 0.00 -1.22 -4.99 105.19 108.69 2j64 n GLY 210 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2j64 n GLY 210 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2j64 s HIS 211 N -3.11 2.89 0.78 1.61 4.02 -1.04 -4.77 115.29 115.67 2j64 s HIS 211 Ca 0.00 -2.57 -0.06 0.00 1.02 0.00 0.00 55.06 53.45 2j64 s HIS 211 Cb 0.00 -2.44 0.13 0.00 -1.02 0.00 0.00 32.58 29.25 2j64 s HIS 211 CO 0.00 -0.89 1.08 -1.25 1.02 0.00 0.00 174.74 174.70 2j64 s PRO 212 N 0.95 1.51 0.11 8.40 0.04 -1.26 -4.44 135.00 140.31 2j64 s PRO 212 Ca 0.12 -0.73 0.06 0.00 0.04 0.00 0.00 61.00 60.49 2j64 s PRO 212 Cb -0.20 -2.17 -0.04 0.00 0.04 0.00 0.00 34.50 32.14 2j64 s PRO 212 CO -0.12 -1.66 -0.05 0.71 0.04 0.00 0.00 177.00 175.93 2j64 s TYR 213 N -3.36 2.85 0.06 0.56 2.02 -0.90 -4.71 117.35 113.86 2j64 s TYR 213 Ca 0.67 -0.11 -0.07 0.00 -0.37 0.00 0.00 57.07 57.20 2j64 s TYR 213 Cb -0.06 -1.46 -0.30 0.00 -0.40 0.00 0.00 41.96 39.74 2j64 s TYR 213 CO 0.47 0.46 1.09 -0.09 -1.57 0.00 0.00 175.55 175.91 2j64 h ARG 214 N 3.37 0.33 -4.20 -0.62 2.43 -1.08 -3.45 114.38 111.16 2j64 h ARG 214 Ca -0.48 -0.57 -0.29 0.00 -0.81 0.00 0.00 59.98 57.83 2j64 h ARG 214 Cb 1.17 0.21 -0.27 0.00 -0.42 0.00 0.00 29.97 30.66 2j64 h ARG 214 CO 0.56 1.26 -0.74 1.03 -1.51 0.00 0.00 179.97 180.57 2j64 s ARG 215 N -2.64 0.34 -0.07 0.20 0.52 -0.96 -4.09 118.95 112.25 2j64 s ARG 215 Ca -0.06 -0.24 -0.07 0.00 -0.52 0.00 0.00 55.73 54.84 2j64 s ARG 215 Cb 0.06 -0.27 0.02 0.00 0.52 0.00 0.00 34.95 35.28 2j64 s ARG 215 CO 0.90 0.07 0.20 0.08 0.02 0.00 0.00 175.30 176.57 2j64 s VAL 216 N -0.34 0.00 0.03 3.52 1.01 0.56 -0.50 120.40 124.68 2j64 s VAL 216 Ca -0.01 -0.04 0.02 0.00 0.00 0.00 0.00 61.98 61.95 2j64 s VAL 216 Cb -0.03 -0.30 -0.02 0.00 0.00 0.00 0.00 36.38 36.03 2j64 s VAL 216 CO -0.00 -0.02 -0.08 -0.13 0.00 0.00 0.00 175.10 174.87 2j64 s ARG 217 N 0.02 0.54 -0.11 2.72 0.52 -0.74 -0.28 118.95 121.62 2j64 s ARG 217 Ca -0.01 -0.57 0.03 0.00 -0.52 0.00 0.00 55.73 54.66 2j64 s ARG 217 Cb -0.02 -0.41 -0.01 0.00 0.52 0.00 0.00 34.95 35.04 2j64 s ARG 217 CO 0.00 0.09 -0.21 -1.64 0.02 0.00 0.00 175.30 173.57 2j64 s MET 218 N -1.04 3.11 -0.00 3.54 -1.94 -0.45 -0.86 119.30 121.66 2j64 s MET 218 Ca -0.05 -0.82 0.02 0.00 -1.71 0.00 0.00 55.69 53.13 2j64 s MET 218 Cb -0.07 -2.39 -0.00 0.00 2.01 0.00 0.00 34.83 34.38 2j64 s MET 218 CO 0.00 0.21 -0.05 -1.64 -0.01 0.00 0.00 175.02 173.53 2j64 s MET 219 N 0.30 0.40 0.19 2.03 1.00 0.11 -1.00 119.30 122.33 2j64 s MET 219 Ca -0.15 -0.20 0.10 0.00 0.00 0.00 0.00 55.69 55.44 2j64 s MET 219 Cb -0.17 -0.37 -0.04 0.00 0.00 0.00 0.00 34.83 34.24 2j64 s MET 219 CO 0.08 0.10 -0.15 -0.51 0.00 0.00 0.00 175.02 174.54 2j64 s LEU 220 N -0.18 2.77 0.00 -0.03 1.43 0.39 -0.74 118.68 122.31 2j64 s LEU 220 Ca 0.01 -0.71 0.00 0.00 -1.03 0.00 0.00 54.13 52.41 2j64 s LEU 220 Cb -0.02 -1.46 0.00 0.00 0.03 0.00 0.00 46.19 44.74 2j64 s LEU 220 CO -0.00 0.10 0.00 -2.11 0.23 0.00 0.00 176.35 174.57