#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g65 s LYS 2 N 0.00 0.22 0.03 0.03 1.02 0.96 -3.98 119.74 118.02 3g65 s LYS 2 Ca 0.00 -0.27 0.08 0.00 0.02 0.00 0.00 55.97 55.80 3g65 s LYS 2 Cb 0.00 -1.07 -0.03 0.00 -0.52 0.00 0.00 37.83 36.21 3g65 s LYS 2 CO 0.00 -0.94 -0.23 0.00 -0.92 0.00 0.00 175.35 173.25 3g65 n LEU 4 N 1.82 -0.74 -4.70 0.00 7.94 -1.25 -2.82 117.00 117.25 3g65 n LEU 4 Ca -0.17 -4.25 -0.40 0.00 -1.11 0.00 0.00 56.01 50.08 3g65 n LEU 4 Cb 0.52 0.58 -0.05 0.00 0.53 0.00 0.00 43.42 45.00 3g65 n LEU 4 CO 0.24 1.88 0.45 -0.69 -1.11 0.00 0.00 177.39 178.16 3g65 s VAL 5 N 0.05 5.00 0.32 1.96 1.01 -0.85 -3.98 120.40 123.91 3g65 s VAL 5 Ca 0.33 1.48 0.03 0.00 0.00 0.00 0.00 61.98 63.82 3g65 s VAL 5 Cb 0.05 -4.06 -0.05 0.00 0.00 0.00 0.00 36.38 32.32 3g65 s VAL 5 CO -0.18 0.19 0.10 0.42 0.00 0.00 0.00 175.10 175.63 3g65 s THR 6 N 1.18 0.77 0.00 3.92 -4.23 -1.26 -1.53 115.64 114.50 3g65 s THR 6 Ca 0.37 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.88 3g65 s THR 6 Cb -0.17 -2.62 0.00 0.00 1.34 0.00 0.00 72.50 71.04 3g65 s THR 6 CO 0.17 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.86 3g65 n GLY 7 N -0.65 1.15 0.27 3.99 0.00 -1.22 -2.79 105.19 105.94 3g65 n GLY 7 Ca -0.02 -0.61 0.18 0.00 0.00 0.00 0.00 46.02 45.57 3g65 n GLY 7 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3g65 h GLY 8 N 0.00 0.00 2.00 -0.02 0.00 -1.97 -2.68 103.07 100.40 3g65 h GLY 8 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3g65 h GLY 8 CO 0.00 0.00 -0.02 3.43 0.00 0.00 0.00 176.54 179.95 3g65 h ASN 9 N 0.00 0.00 -0.25 0.19 2.35 -1.89 -1.93 115.58 114.04 3g65 h ASN 9 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 3g65 h ASN 9 Cb 0.34 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.69 3g65 h ASN 9 CO 0.00 0.02 0.11 0.58 -1.65 0.00 0.00 177.43 176.49 3g65 h VAL 10 N 0.00 1.17 -0.21 2.81 2.07 -1.55 -0.89 116.25 119.65 3g65 h VAL 10 Ca -0.00 -0.50 -0.08 0.00 0.82 0.00 0.00 66.70 66.93 3g65 h VAL 10 Cb 0.05 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 3g65 h VAL 10 CO 0.00 0.17 -0.24 0.11 0.02 0.00 0.00 177.57 177.64 3g65 h LYS 11 N 0.26 0.39 -0.67 1.57 1.57 -1.57 -1.78 116.57 116.34 3g65 h LYS 11 Ca 0.09 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 3g65 h LYS 11 Cb 0.17 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 3g65 h LYS 11 CO -0.01 0.60 0.25 0.28 -0.57 0.00 0.00 179.45 180.00 3g65 h VAL 12 N 0.35 1.24 -0.66 0.50 2.07 -1.06 0.13 116.25 118.82 3g65 h VAL 12 Ca 0.05 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 3g65 h VAL 12 Cb 0.61 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 3g65 h VAL 12 CO 0.04 0.31 0.32 0.25 0.02 0.00 0.00 177.57 178.52 3g65 h LEU 13 N 0.95 0.86 0.10 2.57 5.85 -0.82 -1.51 115.31 123.31 3g65 h LEU 13 Ca 0.22 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 3g65 h LEU 13 Cb 0.24 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.05 3g65 h LEU 13 CO -0.01 0.74 -0.05 1.23 -0.34 0.00 0.00 178.44 180.01 3g65 h GLY 14 N 0.91 -0.14 0.59 3.75 0.00 -0.81 -1.34 103.07 106.04 3g65 h GLY 14 Ca 0.23 0.05 0.12 0.00 0.00 0.00 0.00 47.33 47.72 3g65 h GLY 14 CO -0.03 -0.05 0.59 0.50 0.00 0.00 0.00 176.54 177.55 3g65 h LYS 15 N -0.16 0.83 -0.31 4.80 1.57 -0.60 -0.12 116.57 122.58 3g65 h LYS 15 Ca -0.01 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 3g65 h LYS 15 Cb 0.13 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 3g65 h LYS 15 CO 0.02 0.55 0.06 0.00 -0.57 0.00 0.00 179.45 179.52 3g65 h ALA 16 N 1.56 0.41 -0.77 3.86 0.00 -0.88 -2.09 119.26 121.36 3g65 h ALA 16 Ca 0.45 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 3g65 h ALA 16 Cb 0.52 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3g65 h ALA 16 CO -0.21 0.10 0.33 0.28 0.00 0.00 0.00 179.25 179.74 3g65 h VAL 17 N 0.34 1.25 -0.74 0.00 2.07 -0.35 -2.23 116.25 116.59 3g65 h VAL 17 Ca 0.10 -0.77 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 3g65 h VAL 17 Cb 0.32 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 3g65 h VAL 17 CO 0.00 0.32 0.46 0.45 0.02 0.00 0.00 177.57 178.82 3g65 h HIS 18 N 1.11 0.96 -0.37 1.57 -0.00 -0.86 -2.67 115.15 114.90 3g65 h HIS 18 Ca 0.26 0.01 -0.13 0.00 -0.00 0.00 0.00 60.37 60.51 3g65 h HIS 18 Cb 0.18 -0.32 -0.01 0.00 -0.00 0.00 0.00 27.41 27.26 3g65 h HIS 18 CO 0.02 0.63 -0.29 0.77 -0.00 0.00 0.00 177.93 179.06 3g65 h SER 19 N 1.02 0.81 0.65 2.45 0.02 -0.80 -2.41 113.55 115.29 3g65 h SER 19 Ca 0.27 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 3g65 h SER 19 Cb -0.06 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.25 3g65 h SER 19 CO -0.05 1.04 0.00 0.18 -1.14 0.00 0.00 176.83 176.86 3g65 n LEU 20 N -4.08 0.10 0.10 5.07 4.77 -0.95 -2.76 117.00 119.25 3g65 n LEU 20 Ca -0.01 0.52 -0.16 0.00 -0.03 0.00 0.00 56.01 56.33 3g65 n LEU 20 Cb 0.47 -0.50 -0.14 0.00 -2.33 0.00 0.00 43.42 40.93 3g65 n LEU 20 CO 0.46 -0.23 -0.04 0.28 -1.33 0.00 0.00 177.39 176.52 3g65 h SER 21 N 0.00 0.43 -0.10 -1.43 0.02 -1.11 -2.94 113.55 108.42 3g65 h SER 21 Ca 0.00 -0.46 -0.03 0.00 -0.84 0.00 0.00 61.79 60.46 3g65 h SER 21 Cb 0.33 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 3g65 h SER 21 CO 0.00 1.35 0.04 0.54 -1.14 0.00 0.00 176.83 177.62 3g65 n ARG 22 N -3.54 1.34 0.00 3.45 1.74 -1.11 -3.72 116.66 114.82 3g65 n ARG 22 Ca -0.08 -0.40 0.00 0.00 -0.77 0.00 0.00 57.85 56.60 3g65 n ARG 22 Cb 1.02 -1.38 0.00 0.00 -1.02 0.00 0.00 32.46 31.07 3g65 n ARG 22 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 3g65 n ILE 23 N 0.18 0.00 -4.21 0.55 3.06 -1.24 -4.35 119.36 113.35 3g65 n ILE 23 Ca 0.06 0.00 -0.12 0.00 -2.50 0.00 0.00 62.75 60.19 3g65 n ILE 23 Cb 0.51 0.00 -0.10 0.00 0.54 0.00 0.00 39.64 40.59 3g65 n ILE 23 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 3g65 s GLY 24 N -1.94 1.17 0.00 4.50 0.00 -1.11 -3.90 107.32 106.04 3g65 s GLY 24 Ca 0.00 -1.56 0.13 0.00 0.00 0.00 0.00 44.72 43.29 3g65 s GLY 24 CO 0.00 -1.46 0.92 1.22 0.00 0.00 0.00 173.10 173.78 3g65 n ASP 25 N -0.20 2.11 -3.82 1.64 8.00 -1.26 -4.54 116.55 118.48 3g65 n ASP 25 Ca -0.05 -1.55 -0.19 0.00 0.71 0.00 0.00 54.79 53.70 3g65 n ASP 25 Cb 0.64 -0.00 -0.17 0.00 -0.02 0.00 0.00 41.12 41.57 3g65 n ASP 25 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3g65 s GLU 26 N -1.10 0.48 -0.23 -1.24 2.02 -1.26 -0.85 118.70 116.51 3g65 s GLU 26 Ca 0.15 0.05 -0.18 0.00 0.02 0.00 0.00 54.97 55.01 3g65 s GLU 26 Cb 0.11 -0.67 -0.03 0.00 0.10 0.00 0.00 34.13 33.64 3g65 s GLU 26 CO 0.17 -0.16 0.52 -1.17 0.02 0.00 0.00 175.26 174.63 3g65 s LEU 27 N 1.23 4.10 -0.23 1.80 2.96 0.33 -4.51 118.68 124.35 3g65 s LEU 27 Ca -0.07 0.60 -0.12 0.00 -0.22 0.00 0.00 54.13 54.32 3g65 s LEU 27 Cb -0.13 -2.69 -0.05 0.00 0.50 0.00 0.00 46.19 43.82 3g65 s LEU 27 CO -0.02 -0.24 0.23 -0.31 -1.32 0.00 0.00 176.35 174.69 3g65 s TYR 28 N 2.00 3.32 0.08 5.38 2.02 -0.23 -1.37 117.35 128.55 3g65 s TYR 28 Ca 0.23 0.32 0.03 0.00 -0.37 0.00 0.00 57.07 57.28 3g65 s TYR 28 Cb -0.15 -2.35 -0.04 0.00 -0.40 0.00 0.00 41.96 39.01 3g65 s TYR 28 CO 0.09 0.02 0.06 -0.51 -1.57 0.00 0.00 175.55 173.64 3g65 s LEU 29 N 1.21 3.72 -0.31 -1.29 1.02 -0.62 -1.08 118.68 121.32 3g65 s LEU 29 Ca 0.11 -0.04 -0.02 0.00 0.02 0.00 0.00 54.13 54.19 3g65 s LEU 29 Cb -0.14 -2.39 0.19 0.00 0.02 0.00 0.00 46.19 43.87 3g65 s LEU 29 CO 0.06 0.18 0.83 -0.70 0.02 0.00 0.00 176.35 176.74 3g65 s GLU 30 N -2.32 0.38 0.28 1.70 2.12 -0.79 -1.90 118.70 118.17 3g65 s GLU 30 Ca 0.28 0.23 -0.29 0.00 0.36 0.00 0.00 54.97 55.54 3g65 s GLU 30 Cb -0.12 0.13 -0.10 0.00 0.26 0.00 0.00 34.13 34.31 3g65 s GLU 30 CO 0.20 -0.67 1.30 -2.14 -0.54 0.00 0.00 175.26 173.42 3g65 s PRO 31 N 2.67 4.39 0.29 4.30 0.02 -1.26 -1.75 135.00 143.66 3g65 s PRO 31 Ca 0.18 2.14 0.02 0.00 0.02 0.00 0.00 61.00 63.36 3g65 s PRO 31 Cb -0.05 -3.12 -0.04 0.00 0.02 0.00 0.00 34.50 31.31 3g65 s PRO 31 CO -0.21 -0.19 0.12 -0.51 -0.33 0.00 0.00 177.00 175.88 3g65 s LEU 32 N -1.09 1.71 0.00 -5.54 1.43 0.21 -4.93 118.68 110.47 3g65 s LEU 32 Ca 0.52 -1.48 0.14 0.00 -1.03 0.00 0.00 54.13 52.28 3g65 s LEU 32 Cb -0.38 0.07 0.65 0.00 0.03 0.00 0.00 46.19 46.55 3g65 s LEU 32 CO 0.46 -0.81 1.43 -0.62 0.23 0.00 0.00 176.35 177.04 3g65 n GLU 33 N -0.56 0.08 -0.00 1.70 1.02 -1.26 -2.78 120.64 118.84 3g65 n GLU 33 Ca -0.00 0.22 0.02 0.00 -0.02 0.00 0.00 57.16 57.37 3g65 n GLU 33 Cb 0.66 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.55 3g65 n GLU 33 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3g65 n ASP 34 N -1.42 0.54 0.00 1.62 5.75 -1.26 -5.08 116.55 116.70 3g65 n ASP 34 Ca 0.05 -0.53 0.00 0.00 -0.01 0.00 0.00 54.79 54.29 3g65 n ASP 34 Cb 0.15 1.02 0.00 0.00 -1.03 0.00 0.00 41.12 41.25 3g65 n ASP 34 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3g65 n GLY 35 N 1.20 -1.07 3.53 6.12 0.00 -1.12 -3.84 105.19 110.01 3g65 n GLY 35 Ca 0.01 -1.21 -0.37 0.00 0.00 0.00 0.00 46.02 44.45 3g65 n GLY 35 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3g65 s LEU 36 N 0.00 3.76 -0.35 0.99 2.96 -0.73 -0.62 118.68 124.69 3g65 s LEU 36 Ca 0.00 -0.08 -0.15 0.00 -0.22 0.00 0.00 54.13 53.67 3g65 s LEU 36 Cb 0.00 -2.02 -0.01 0.00 0.50 0.00 0.00 46.19 44.66 3g65 s LEU 36 CO 0.00 -0.02 0.36 -0.55 -1.32 0.00 0.00 176.35 174.81 3g65 s SER 37 N 1.57 6.17 -0.31 3.68 0.15 -0.72 -0.58 113.70 123.66 3g65 s SER 37 Ca 0.06 -0.30 -0.08 0.00 0.70 0.00 0.00 55.95 56.34 3g65 s SER 37 Cb -0.15 -2.19 0.01 0.00 -1.71 0.00 0.00 66.02 61.98 3g65 s SER 37 CO 0.07 -0.35 0.11 -0.76 1.20 0.00 0.00 173.24 173.50 3g65 s LEU 38 N 2.00 4.05 0.38 3.45 1.02 -0.29 -1.88 118.68 127.41 3g65 s LEU 38 Ca 0.11 -0.78 0.07 0.00 0.02 0.00 0.00 54.13 53.55 3g65 s LEU 38 Cb -0.17 -1.91 -0.07 0.00 0.02 0.00 0.00 46.19 44.06 3g65 s LEU 38 CO 0.12 -0.23 -0.01 -0.13 0.02 0.00 0.00 176.35 176.11 3g65 s ARG 39 N 1.50 1.87 -0.00 1.70 0.52 -0.24 -0.21 118.95 124.08 3g65 s ARG 39 Ca 0.02 -2.03 -0.28 0.00 -0.52 0.00 0.00 55.73 52.92 3g65 s ARG 39 Cb -0.18 -1.54 0.10 0.00 0.52 0.00 0.00 34.95 33.86 3g65 s ARG 39 CO 0.03 -0.02 0.85 -0.08 0.02 0.00 0.00 175.30 176.10 3g65 s THR 40 N -2.77 0.00 0.02 0.02 -1.32 -0.84 -1.06 115.64 109.69 3g65 s THR 40 Ca 0.34 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.84 3g65 s THR 40 Cb 0.08 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 70.05 3g65 s THR 40 CO 0.17 0.00 -0.06 -0.69 -2.21 0.00 0.00 174.62 171.83 3g65 s VAL 41 N -2.85 0.45 0.72 5.08 1.01 -1.26 -2.19 120.40 121.35 3g65 s VAL 41 Ca 0.03 -0.74 -0.14 0.00 0.00 0.00 0.00 61.98 61.12 3g65 s VAL 41 Cb -0.01 -0.47 0.03 0.00 0.00 0.00 0.00 36.38 35.93 3g65 s VAL 41 CO -0.07 -0.21 1.14 0.21 0.00 0.00 0.00 175.10 176.17 3g65 s ASN 42 N -1.03 4.56 0.53 3.32 2.47 0.42 -4.37 114.94 120.84 3g65 s ASN 42 Ca -0.06 2.11 0.27 0.00 0.42 0.00 0.00 52.86 55.60 3g65 s ASN 42 Cb -0.07 -2.56 1.48 0.00 -1.45 0.00 0.00 41.25 38.65 3g65 s ASN 42 CO 0.00 -2.00 2.10 -1.28 -3.72 0.00 0.00 177.10 172.20 3g65 h SER 43 N -0.37 0.00 -0.53 -4.21 0.87 -1.91 -1.85 113.55 105.55 3g65 h SER 43 Ca -0.46 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 3g65 h SER 43 Cb 1.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 3g65 h SER 43 CO 0.51 0.10 0.00 -0.24 -0.53 0.00 0.00 176.83 176.68 3g65 n SER 44 N -3.73 3.59 -2.46 6.23 2.88 -1.26 -4.94 113.62 113.93 3g65 n SER 44 Ca -0.02 -1.98 -0.20 0.00 -1.33 0.00 0.00 58.87 55.34 3g65 n SER 44 Cb 0.21 -0.35 -0.01 0.00 -0.75 0.00 0.00 64.21 63.31 3g65 n SER 44 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3g65 n ARG 45 N 1.43 -2.02 -0.28 -1.46 5.12 -0.70 -4.76 116.66 114.00 3g65 n ARG 45 Ca 0.20 0.95 0.09 0.00 -1.93 0.00 0.00 57.85 57.16 3g65 n ARG 45 Cb 0.58 -5.62 0.19 0.00 -1.16 0.00 0.00 32.46 26.46 3g65 n ARG 45 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 3g65 n SER 46 N -2.03 2.94 -3.63 0.55 3.41 -1.26 -3.97 113.62 109.62 3g65 n SER 46 Ca -0.22 -3.13 -0.11 0.00 -0.26 0.00 0.00 58.87 55.14 3g65 n SER 46 Cb 0.67 -0.49 -0.07 0.00 -0.26 0.00 0.00 64.21 64.06 3g65 n SER 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g65 s ALA 47 N -2.90 -1.88 -0.04 7.33 0.00 -1.26 -1.64 121.76 121.38 3g65 s ALA 47 Ca 0.37 2.03 -0.06 0.00 0.00 0.00 0.00 51.96 54.30 3g65 s ALA 47 Cb 0.32 -1.31 0.01 0.00 0.00 0.00 0.00 23.12 22.13 3g65 s ALA 47 CO 0.05 -0.31 0.14 -0.47 0.00 0.00 0.00 175.76 175.17 3g65 s TYR 48 N 0.50 -0.10 0.04 0.00 5.04 0.45 -0.44 117.35 122.84 3g65 s TYR 48 Ca -0.00 0.23 -0.02 0.00 -2.44 0.00 0.00 57.07 54.83 3g65 s TYR 48 Cb -0.05 0.02 -0.02 0.00 0.35 0.00 0.00 41.96 42.26 3g65 s TYR 48 CO -0.04 -0.14 0.02 0.00 -1.34 0.00 0.00 175.55 174.05 3g65 s ALA 49 N -0.35 0.18 -0.21 3.97 0.00 -0.93 -0.00 121.76 124.42 3g65 s ALA 49 Ca -0.04 -0.78 -0.15 0.00 0.00 0.00 0.00 51.96 50.99 3g65 s ALA 49 Cb -0.03 0.23 0.06 0.00 0.00 0.00 0.00 23.12 23.38 3g65 s ALA 49 CO 0.01 -0.29 0.53 0.00 0.00 0.00 0.00 175.76 176.00 3g65 s PHE 51 N 1.00 3.17 -0.33 0.00 0.08 0.70 -1.37 117.98 121.23 3g65 s PHE 51 Ca -0.06 -2.11 -0.18 0.00 0.12 0.00 0.00 56.93 54.70 3g65 s PHE 51 Cb -0.06 -1.95 -0.01 0.00 -0.57 0.00 0.00 43.02 40.43 3g65 s PHE 51 CO -0.09 -0.85 0.53 -1.17 -0.10 0.00 0.00 175.22 173.54 3g65 s LEU 52 N 1.16 4.27 -1.07 -0.37 2.96 0.92 -1.13 118.68 125.43 3g65 s LEU 52 Ca -0.06 0.10 -0.07 0.00 -0.22 0.00 0.00 54.13 53.88 3g65 s LEU 52 Cb -0.19 -2.62 0.27 0.00 0.50 0.00 0.00 46.19 44.16 3g65 s LEU 52 CO -0.06 -0.45 1.10 0.49 -1.32 0.00 0.00 176.35 176.11 3g65 n PHE 53 N 5.74 4.70 -1.68 5.38 3.72 0.25 -1.37 117.46 134.20 3g65 n PHE 53 Ca -0.04 -3.79 -0.43 0.00 -0.05 0.00 0.00 57.45 53.14 3g65 n PHE 53 Cb 0.49 -1.53 -0.01 0.00 -0.94 0.00 0.00 39.48 37.49 3g65 n PHE 53 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3g65 n ALA 54 N 2.40 1.10 0.00 4.37 0.00 -1.25 -1.78 120.51 125.35 3g65 n ALA 54 Ca 0.24 0.35 0.00 0.00 0.00 0.00 0.00 53.44 54.03 3g65 n ALA 54 Cb 0.38 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.61 3g65 n ALA 54 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3g65 n PRO 55 N 0.53 0.00 0.00 0.00 -0.02 -1.25 -4.63 135.00 129.62 3g65 n PRO 55 Ca 0.05 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.69 3g65 n PRO 55 Cb 0.36 0.00 0.79 0.00 -0.02 0.00 0.00 33.50 34.63 3g65 n PRO 55 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3g65 n LEU 56 N 0.00 0.21 0.00 2.45 7.94 -1.26 -4.86 117.00 121.48 3g65 n LEU 56 Ca 0.00 0.05 0.00 0.00 -1.11 0.00 0.00 56.01 54.95 3g65 n LEU 56 Cb 0.00 -0.13 0.00 0.00 0.53 0.00 0.00 43.42 43.82 3g65 n LEU 56 CO 0.00 0.04 0.00 2.22 -1.11 0.00 0.00 177.39 178.54 3g65 n PHE 57 N -0.99 0.00 -3.61 1.96 1.16 -1.26 -4.84 117.46 109.88 3g65 n PHE 57 Ca 0.19 0.00 -0.29 0.00 -1.87 0.00 0.00 57.45 55.48 3g65 n PHE 57 Cb 0.20 0.00 -0.12 0.00 -1.61 0.00 0.00 39.48 37.95 3g65 n PHE 57 CO 0.00 0.00 0.00 -0.06 -1.87 0.00 0.00 176.76 174.83 3g65 s PHE 58 N 2.25 1.68 0.38 2.97 0.08 -1.26 -4.98 117.98 119.10 3g65 s PHE 58 Ca 0.00 -2.33 -0.05 0.00 0.12 0.00 0.00 56.93 54.68 3g65 s PHE 58 Cb 0.00 -1.54 -0.04 0.00 -0.57 0.00 0.00 43.02 40.86 3g65 s PHE 58 CO 0.00 -0.78 0.66 -1.14 -0.10 0.00 0.00 175.22 173.86 3g65 s GLN 59 N 0.24 3.60 -0.26 0.44 0.74 -1.25 -3.78 119.66 119.38 3g65 s GLN 59 Ca 0.22 0.06 -0.27 0.00 0.05 0.00 0.00 55.36 55.42 3g65 s GLN 59 Cb -0.15 -2.53 0.16 0.00 1.10 0.00 0.00 33.01 31.59 3g65 s GLN 59 CO -0.06 0.04 1.23 -1.14 -0.55 0.00 0.00 175.29 174.80 3g65 s GLN 60 N -4.12 0.28 0.14 1.67 0.74 -1.04 -4.96 119.66 112.38 3g65 s GLN 60 Ca 0.45 0.20 0.01 0.00 0.05 0.00 0.00 55.36 56.07 3g65 s GLN 60 Cb -0.10 0.14 -0.04 0.00 1.10 0.00 0.00 33.01 34.10 3g65 s GLN 60 CO 0.36 -0.06 -0.00 1.52 -0.55 0.00 0.00 175.29 176.55 3g65 s TYR 61 N -0.42 1.00 0.42 1.67 -0.85 -1.26 -0.02 117.35 117.88 3g65 s TYR 61 Ca 0.05 -1.05 0.00 0.00 -0.52 0.00 0.00 57.07 55.55 3g65 s TYR 61 Cb -0.03 -0.58 0.00 0.00 0.38 0.00 0.00 41.96 41.73 3g65 s TYR 61 CO -0.08 -0.28 0.00 0.94 -1.52 0.00 0.00 175.55 174.61 3g65 n GLN 62 N -0.13 -2.47 0.00 -3.49 -0.06 -1.26 -4.90 117.38 105.07 3g65 n GLN 62 Ca -0.08 1.99 0.00 0.00 -2.00 0.00 0.00 57.00 56.91 3g65 n GLN 62 Cb 0.63 -2.71 0.00 0.00 -4.06 0.00 0.00 30.24 24.10 3g65 n GLN 62 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 3g65 n ALA 63 N -3.19 0.00 0.00 1.69 0.00 -1.26 -4.84 120.51 112.91 3g65 n ALA 63 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3g65 n ALA 63 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 3g65 n ALA 63 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3g65 n LEU 71 N 0.00 0.00 -4.72 0.00 4.77 -1.26 -5.20 117.00 110.59 3g65 n LEU 71 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.63 3g65 n LEU 71 Cb 0.00 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.19 3g65 n LEU 71 CO 0.00 0.00 0.81 0.00 -1.33 0.00 0.00 177.39 176.87 3g65 s ARG 72 N 0.00 2.08 0.24 3.23 1.70 -1.26 -4.75 118.95 120.19 3g65 s ARG 72 Ca 0.00 1.83 -0.09 0.00 -0.47 0.00 0.00 55.73 57.00 3g65 s ARG 72 Cb 0.00 -1.82 0.04 0.00 -0.57 0.00 0.00 34.95 32.60 3g65 s ARG 72 CO 0.00 -1.90 0.49 0.00 -1.08 0.00 0.00 175.30 172.81 3g65 s LYS 74 N -2.05 0.48 0.35 0.00 2.20 -1.13 -1.59 119.74 117.99 3g65 s LYS 74 Ca 0.10 1.10 0.09 0.00 -0.36 0.00 0.00 55.97 56.89 3g65 s LYS 74 Cb -0.03 0.30 -0.07 0.00 -1.51 0.00 0.00 37.83 36.52 3g65 s LYS 74 CO 0.07 -0.19 -0.07 0.42 -0.36 0.00 0.00 175.35 175.22 3g65 s ILE 75 N 2.12 2.15 -0.18 5.43 1.01 -0.47 -0.61 121.20 130.65 3g65 s ILE 75 Ca -0.07 -2.16 -0.29 0.00 0.00 0.00 0.00 60.65 58.13 3g65 s ILE 75 Cb -0.09 -2.70 -0.03 0.00 0.01 0.00 0.00 42.46 39.64 3g65 s ILE 75 CO -0.16 -0.17 1.60 -0.22 0.00 0.00 0.00 174.94 176.00 3g65 s LEU 76 N -3.62 3.99 0.33 2.97 2.96 -1.26 -0.51 118.68 123.54 3g65 s LEU 76 Ca 0.33 1.75 0.13 0.00 -0.22 0.00 0.00 54.13 56.11 3g65 s LEU 76 Cb 0.04 -3.53 1.01 0.00 0.50 0.00 0.00 46.19 44.21 3g65 s LEU 76 CO 0.17 -1.16 1.69 -0.03 -1.32 0.00 0.00 176.35 175.69 3g65 h MET 77 N 10.35 0.41 0.00 1.98 1.85 -1.27 0.12 114.93 128.37 3g65 h MET 77 Ca -0.34 -0.02 -0.07 0.00 -0.61 0.00 0.00 59.70 58.65 3g65 h MET 77 Cb 1.15 -0.09 -0.01 0.00 0.43 0.00 0.00 31.60 33.08 3g65 h MET 77 CO 0.99 0.27 -0.32 0.87 -0.40 0.00 0.00 176.91 178.32 3g65 h LYS 78 N 0.42 0.00 -0.09 0.39 1.57 -1.90 -1.54 116.57 115.43 3g65 h LYS 78 Ca 0.70 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 59.34 3g65 h LYS 78 Cb 1.50 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.82 3g65 h LYS 78 CO -0.56 0.32 -0.50 0.77 -0.57 0.00 0.00 179.45 178.91 3g65 h SER 79 N 0.00 0.59 1.17 0.86 0.02 -1.14 -2.75 113.55 112.29 3g65 h SER 79 Ca -0.00 -0.66 -0.01 0.00 -0.84 0.00 0.00 61.79 60.28 3g65 h SER 79 Cb 0.92 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.28 3g65 h SER 79 CO 0.04 1.16 -0.03 0.15 -1.14 0.00 0.00 176.83 177.01 3g65 h PHE 80 N 0.07 0.00 0.00 3.45 3.57 -1.39 -3.09 116.94 119.55 3g65 h PHE 80 Ca -0.04 0.00 -0.26 0.00 3.53 0.00 0.00 57.97 61.20 3g65 h PHE 80 Cb 1.16 0.00 0.02 0.00 2.79 0.00 0.00 35.95 39.91 3g65 h PHE 80 CO 0.12 0.03 -1.03 1.25 -2.23 0.00 0.00 178.31 176.45 3g65 h LEU 81 N 0.00 0.83 -2.71 0.59 5.85 -1.22 -3.21 115.31 115.44 3g65 h LEU 81 Ca -0.00 -0.67 0.00 0.00 0.84 0.00 0.00 57.88 58.06 3g65 h LEU 81 Cb 0.62 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.40 3g65 h LEU 81 CO 0.00 1.47 0.05 0.77 -0.34 0.00 0.00 178.44 180.39 3g65 h SER 82 N 0.36 0.00 1.25 1.25 4.64 -1.40 0.19 113.55 119.84 3g65 h SER 82 Ca -0.12 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.13 3g65 h SER 82 Cb 1.68 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.76 3g65 h SER 82 CO 0.20 0.00 -0.34 0.58 -0.87 0.00 0.00 176.83 176.39 3g65 h VAL 83 N 0.00 0.68 -0.00 0.95 2.07 -1.67 -3.30 116.25 114.98 3g65 h VAL 83 Ca 0.01 -1.63 0.00 0.00 0.82 0.00 0.00 66.70 65.90 3g65 h VAL 83 Cb 0.11 2.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 3g65 h VAL 83 CO -0.00 0.34 -0.24 0.49 0.02 0.00 0.00 177.57 178.17 3g65 n PHE 84 N -3.31 0.00 -0.11 1.57 3.72 0.25 -4.08 117.46 115.50 3g65 n PHE 84 Ca 0.01 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.36 3g65 n PHE 84 Cb 0.58 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.13 3g65 n PHE 84 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3g65 h ARG 85 N 0.35 -0.07 0.00 -1.08 3.08 -0.84 -3.40 114.38 112.43 3g65 h ARG 85 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3g65 h ARG 85 Cb 0.20 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.26 3g65 h ARG 85 CO 0.00 -0.05 0.00 0.43 -1.07 0.00 0.00 179.97 179.28 3g65 n SER 86 N -5.34 0.00 0.20 7.04 7.64 -1.26 -4.89 113.62 117.01 3g65 n SER 86 Ca 0.02 -0.32 0.03 0.00 1.01 0.00 0.00 58.87 59.61 3g65 n SER 86 Cb 0.25 0.00 0.40 0.00 -1.01 0.00 0.00 64.21 63.85 3g65 n SER 86 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 3g65 h LEU 87 N 0.00 0.00 -3.47 -3.43 3.38 -1.77 -2.77 115.31 107.25 3g65 h LEU 87 Ca 0.00 -0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.60 3g65 h LEU 87 Cb 0.16 -0.00 -0.17 0.00 0.09 0.00 0.00 40.66 40.74 3g65 h LEU 87 CO 0.00 0.32 0.48 0.00 0.09 0.00 0.00 178.44 179.32 3g65 n ALA 88 N -2.48 5.09 -0.78 1.53 0.00 -1.26 -4.60 120.51 118.02 3g65 n ALA 88 Ca -0.02 -1.93 0.08 0.00 0.00 0.00 0.00 53.44 51.57 3g65 n ALA 88 Cb 0.36 -1.40 0.39 0.00 0.00 0.00 0.00 19.45 18.79 3g65 n ALA 88 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 3g65 n MET 89 N -0.05 4.37 0.00 0.00 0.00 -1.05 -4.86 117.12 115.53 3g65 n MET 89 Ca 0.36 -3.05 0.00 0.00 0.00 0.00 0.00 57.70 55.01 3g65 n MET 89 Cb 0.74 -2.10 0.00 0.00 0.00 0.00 0.00 33.22 31.87 3g65 n MET 89 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 3g65 n VAL 94 N 0.88 0.00 -0.01 1.12 0.31 -1.26 -5.14 118.33 114.23 3g65 n VAL 94 Ca 0.27 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.61 3g65 n VAL 94 Cb 1.06 0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 33.95 3g65 n VAL 94 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 3g65 n GLU 95 N 2.82 1.42 -4.10 5.55 0.28 -1.11 -4.88 120.64 120.62 3g65 n GLU 95 Ca 0.00 -0.03 -0.10 0.00 -0.16 0.00 0.00 57.16 56.87 3g65 n GLU 95 Cb 0.00 -1.14 -0.10 0.00 1.43 0.00 0.00 31.44 31.62 3g65 n GLU 95 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 3g65 s LYS 96 N -2.30 0.64 -0.22 3.44 1.02 -1.18 -3.41 119.74 117.74 3g65 s LYS 96 Ca -0.02 -1.10 -0.03 0.00 0.02 0.00 0.00 55.97 54.83 3g65 s LYS 96 Cb 0.03 -0.05 0.11 0.00 -0.52 0.00 0.00 37.83 37.40 3g65 s LYS 96 CO 0.24 -0.04 0.32 0.00 -0.92 0.00 0.00 175.35 174.95 3g65 s ILE 99 N 1.60 3.40 0.07 0.00 1.01 -1.13 -0.36 121.20 125.78 3g65 s ILE 99 Ca 0.06 -1.35 0.01 0.00 0.00 0.00 0.00 60.65 59.37 3g65 s ILE 99 Cb -0.15 -2.99 -0.00 0.00 0.01 0.00 0.00 42.46 39.33 3g65 s ILE 99 CO 0.04 -0.21 0.02 -1.54 0.00 0.00 0.00 174.94 173.25 3g65 n SER 100 N 4.71 1.07 -3.96 3.58 3.41 -0.44 -2.39 113.62 119.60 3g65 n SER 100 Ca -0.12 -1.37 -0.22 0.00 -0.26 0.00 0.00 58.87 56.90 3g65 n SER 100 Cb 0.44 0.17 -0.16 0.00 -0.26 0.00 0.00 64.21 64.39 3g65 n SER 100 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3g65 s LEU 101 N 0.00 1.50 0.20 1.04 2.96 -1.26 -1.90 118.68 121.22 3g65 s LEU 101 Ca 0.03 -0.22 0.10 0.00 -0.22 0.00 0.00 54.13 53.82 3g65 s LEU 101 Cb 0.00 -0.65 -0.04 0.00 0.50 0.00 0.00 46.19 46.00 3g65 s LEU 101 CO 0.02 -0.01 -0.19 0.20 -1.32 0.00 0.00 176.35 175.05 3g65 s ASN 102 N 0.78 3.04 0.00 3.68 0.01 -1.26 -4.93 114.94 116.26 3g65 s ASN 102 Ca -0.13 -0.92 0.00 0.00 -0.71 0.00 0.00 52.86 51.10 3g65 s ASN 102 Cb -0.15 -0.21 0.00 0.00 0.41 0.00 0.00 41.25 41.30 3g65 s ASN 102 CO 0.02 -0.00 0.00 0.61 -1.51 0.00 0.00 177.10 176.22 3g65 n GLY 103 N -0.01 2.02 1.05 0.66 0.00 -1.26 -4.87 105.19 102.78 3g65 n GLY 103 Ca -0.10 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3g65 n GLY 103 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g65 n ARG 107 N 0.00 0.00 -2.56 1.61 5.12 -1.26 -5.28 116.66 114.29 3g65 n ARG 107 Ca 0.00 0.35 -0.43 0.00 -1.93 0.00 0.00 57.85 55.84 3g65 n ARG 107 Cb 0.00 -0.70 -0.02 0.00 -1.16 0.00 0.00 32.46 30.58 3g65 n ARG 107 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 3g65 s LEU 108 N 0.00 3.87 -0.37 0.55 2.96 0.37 -4.68 118.68 121.39 3g65 s LEU 108 Ca 0.00 1.02 -0.17 0.00 -0.22 0.00 0.00 54.13 54.76 3g65 s LEU 108 Cb 0.00 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 43.15 3g65 s LEU 108 CO 0.00 -1.00 0.44 -0.69 -1.32 0.00 0.00 176.35 173.79 3g65 s VAL 109 N 4.00 5.08 -0.49 1.68 1.01 -0.80 -1.49 120.40 129.39 3g65 s VAL 109 Ca 0.49 0.07 -0.04 0.00 0.00 0.00 0.00 61.98 62.50 3g65 s VAL 109 Cb -0.13 -3.93 0.13 0.00 0.00 0.00 0.00 36.38 32.45 3g65 s VAL 109 CO 0.20 -0.23 0.31 -0.69 0.00 0.00 0.00 175.10 174.69 3g65 s VAL 110 N 2.21 3.60 -0.08 2.92 1.01 0.03 -1.32 120.40 128.76 3g65 s VAL 110 Ca 0.15 -2.31 -0.14 0.00 0.00 0.00 0.00 61.98 59.67 3g65 s VAL 110 Cb -0.16 -3.41 -0.05 0.00 0.00 0.00 0.00 36.38 32.76 3g65 s VAL 110 CO 0.13 -0.77 0.36 -1.58 0.00 0.00 0.00 175.10 173.24 3g65 s GLN 111 N 0.77 4.04 -0.25 2.72 0.74 0.51 -1.10 119.66 127.10 3g65 s GLN 111 Ca 0.11 0.27 -0.01 0.00 0.05 0.00 0.00 55.36 55.78 3g65 s GLN 111 Cb -0.22 -3.32 0.03 0.00 1.10 0.00 0.00 33.01 30.60 3g65 s GLN 111 CO -0.04 0.47 -0.07 -0.51 -0.55 0.00 0.00 175.29 174.60 3g65 s LEU 112 N -0.32 3.21 -1.22 3.68 1.43 0.72 -0.53 118.68 125.65 3g65 s LEU 112 Ca 0.21 -0.94 -0.16 0.00 -1.03 0.00 0.00 54.13 52.21 3g65 s LEU 112 Cb -0.15 -1.65 0.13 0.00 0.03 0.00 0.00 46.19 44.55 3g65 s LEU 112 CO 0.09 -0.14 1.53 -1.00 0.23 0.00 0.00 176.35 177.06 3g65 s HIS 113 N 1.30 3.19 0.58 0.29 3.76 -0.73 -1.23 115.29 122.44 3g65 s HIS 113 Ca -0.01 -1.87 -0.10 0.00 -0.15 0.00 0.00 55.06 52.93 3g65 s HIS 113 Cb -0.17 -4.49 0.14 0.00 1.11 0.00 0.00 32.58 29.18 3g65 s HIS 113 CO -0.05 -1.57 0.55 0.00 -0.85 0.00 0.00 174.74 172.83 3g65 s LYS 115 N -4.24 2.41 0.00 0.00 1.02 -1.26 -4.02 119.74 113.65 3g65 s LYS 115 Ca 0.35 -0.21 0.00 0.00 0.02 0.00 0.00 55.97 56.12 3g65 s LYS 115 Cb -0.03 -2.21 0.00 0.00 -0.52 0.00 0.00 37.83 35.07 3g65 s LYS 115 CO 0.26 -1.07 0.00 1.19 -0.92 0.00 0.00 175.35 174.82 3g65 n PHE 116 N -2.80 0.00 0.00 3.18 3.72 -1.26 -2.43 117.46 117.86 3g65 n PHE 116 Ca 0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.47 3g65 n PHE 116 Cb 0.60 -0.63 0.00 0.00 -0.94 0.00 0.00 39.48 38.51 3g65 n PHE 116 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3g65 n GLY 117 N -2.00 2.16 3.68 1.37 0.00 -1.26 -5.06 105.19 104.08 3g65 n GLY 117 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 3g65 n GLY 117 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3g65 n VAL 118 N -1.15 0.27 -4.96 1.61 0.31 -1.02 -4.86 118.33 108.52 3g65 n VAL 118 Ca 0.00 -0.05 -0.32 0.00 -0.01 0.00 0.00 64.34 63.96 3g65 n VAL 118 Cb 0.00 -1.88 -0.14 0.00 -0.91 0.00 0.00 33.84 30.91 3g65 n VAL 118 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3g65 s ARG 119 N 2.31 2.53 -0.37 5.55 1.81 -1.26 -1.89 118.95 127.63 3g65 s ARG 119 Ca 0.83 -0.74 0.04 0.00 -1.72 0.00 0.00 55.73 54.13 3g65 s ARG 119 Cb -0.59 -2.34 0.11 0.00 -0.45 0.00 0.00 34.95 31.68 3g65 s ARG 119 CO 0.40 0.56 0.10 0.15 -0.68 0.00 0.00 175.30 175.83 3g65 s LYS 120 N -0.58 1.51 0.03 3.54 1.02 -0.37 -4.96 119.74 119.94 3g65 s LYS 120 Ca 0.08 -1.96 -0.18 0.00 0.02 0.00 0.00 55.97 53.93 3g65 s LYS 120 Cb -0.11 -3.12 -0.06 0.00 -0.52 0.00 0.00 37.83 34.01 3g65 s LYS 120 CO 0.01 -0.98 0.52 0.99 -0.92 0.00 0.00 175.35 174.97 3g65 s THR 121 N 0.72 4.88 -0.21 2.17 2.01 -1.26 -0.20 115.64 123.74 3g65 s THR 121 Ca 0.12 1.09 0.01 0.00 0.31 0.00 0.00 61.69 63.23 3g65 s THR 121 Cb -0.20 -3.84 0.04 0.00 0.01 0.00 0.00 72.50 68.51 3g65 s THR 121 CO -0.08 0.53 -0.12 -1.00 -0.69 0.00 0.00 174.62 173.26 3g65 s HIS 122 N -0.87 2.72 -0.72 4.92 3.76 -0.26 -4.95 115.29 119.90 3g65 s HIS 122 Ca 0.27 -1.81 -0.16 0.00 -0.15 0.00 0.00 55.06 53.22 3g65 s HIS 122 Cb -0.18 -1.78 0.17 0.00 1.11 0.00 0.00 32.58 31.90 3g65 s HIS 122 CO 0.16 -0.79 0.71 -0.80 -0.85 0.00 0.00 174.74 173.17 3g65 s ASN 123 N 1.29 6.50 -0.29 1.40 -0.87 -1.26 -0.79 114.94 120.92 3g65 s ASN 123 Ca -0.02 -2.19 -0.10 0.00 -1.57 0.00 0.00 52.86 48.98 3g65 s ASN 123 Cb -0.17 -2.24 -0.03 0.00 -0.02 0.00 0.00 41.25 38.80 3g65 s ASN 123 CO -0.08 -0.78 0.16 -0.76 -2.57 0.00 0.00 177.10 173.07 3g65 s LEU 124 N 1.16 3.99 0.68 0.60 1.43 -0.56 -4.92 118.68 121.07 3g65 s LEU 124 Ca 0.14 -0.26 -0.14 0.00 -1.03 0.00 0.00 54.13 52.84 3g65 s LEU 124 Cb -0.18 -2.05 0.01 0.00 0.03 0.00 0.00 46.19 44.01 3g65 s LEU 124 CO -0.03 -0.12 1.10 -0.94 0.23 0.00 0.00 176.35 176.59 3g65 s SER 125 N 1.68 5.04 0.03 2.29 1.04 -1.26 -0.48 113.70 122.05 3g65 s SER 125 Ca 0.06 1.92 -0.01 0.00 0.48 0.00 0.00 55.95 58.40 3g65 s SER 125 Cb -0.16 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.42 3g65 s SER 125 CO 0.08 -1.67 0.06 2.22 0.98 0.00 0.00 173.24 174.90 3g65 n PHE 126 N -2.68 -0.73 -3.70 5.02 1.16 -1.26 -4.76 117.46 110.51 3g65 n PHE 126 Ca 0.10 -0.21 -0.29 0.00 -1.87 0.00 0.00 57.45 55.18 3g65 n PHE 126 Cb 0.52 0.06 -0.15 0.00 -1.61 0.00 0.00 39.48 38.31 3g65 n PHE 126 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 3g65 s GLN 127 N -2.05 0.61 -0.02 3.97 -0.21 0.22 -4.98 119.66 117.20 3g65 s GLN 127 Ca 0.02 -0.87 -0.30 0.00 0.02 0.00 0.00 55.36 54.24 3g65 s GLN 127 Cb -0.00 -1.85 -0.08 0.00 1.00 0.00 0.00 33.01 32.08 3g65 s GLN 127 CO 0.02 -0.94 1.96 0.34 -2.12 0.00 0.00 175.29 174.55 3g65 s ASP 128 N 1.75 6.33 0.00 5.90 -1.08 -1.26 -2.85 116.67 125.45 3g65 s ASP 128 Ca 0.08 2.48 0.00 0.00 -0.52 0.00 0.00 52.55 54.59 3g65 s ASP 128 Cb -0.17 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.76 3g65 s ASP 128 CO -0.25 -1.18 0.00 0.00 0.52 0.00 0.00 175.17 174.27 3g65 s GLU 130 N 1.80 2.29 0.76 0.00 2.12 -1.26 -4.69 118.70 119.71 3g65 s GLU 130 Ca 0.00 -1.83 -0.11 0.00 0.36 0.00 0.00 54.97 53.40 3g65 s GLU 130 Cb 0.00 -2.37 0.06 0.00 0.26 0.00 0.00 34.13 32.08 3g65 s GLU 130 CO 0.00 -0.73 1.12 -1.12 -0.54 0.00 0.00 175.26 173.99 3g65 s SER 131 N -4.47 4.80 -0.58 -1.70 0.01 -1.26 -4.90 113.70 105.60 3g65 s SER 131 Ca 0.48 0.78 -0.06 0.00 1.31 0.00 0.00 55.95 58.47 3g65 s SER 131 Cb -0.04 -1.39 0.15 0.00 0.21 0.00 0.00 66.02 64.95 3g65 s SER 131 CO 0.30 -1.70 0.42 -0.76 0.41 0.00 0.00 173.24 171.92 3g65 s LEU 132 N -5.44 5.53 0.37 2.44 1.43 -1.26 -5.08 118.68 116.67 3g65 s LEU 132 Ca 0.60 -2.50 -0.05 0.00 -1.03 0.00 0.00 54.13 51.16 3g65 s LEU 132 Cb -0.11 -1.93 -0.05 0.00 0.03 0.00 0.00 46.19 44.14 3g65 s LEU 132 CO 0.49 -0.49 0.66 -1.10 0.23 0.00 0.00 176.35 176.13 3g65 s GLN 133 N 0.47 3.62 -0.24 1.70 -0.21 -1.26 -5.07 119.66 118.67 3g65 s GLN 133 Ca 0.13 0.10 -0.26 0.00 0.02 0.00 0.00 55.36 55.36 3g65 s GLN 133 Cb -0.21 -2.52 0.07 0.00 1.00 0.00 0.00 33.01 31.35 3g65 s GLN 133 CO -0.04 0.04 0.71 0.00 -2.12 0.00 0.00 175.29 173.89 3g65 s ALA 134 N -2.35 -1.78 -0.57 6.09 0.00 -1.26 -5.12 121.76 116.77 3g65 s ALA 134 Ca 0.46 1.93 -0.28 0.00 0.00 0.00 0.00 51.96 54.06 3g65 s ALA 134 Cb -0.10 -1.02 0.03 0.00 0.00 0.00 0.00 23.12 22.03 3g65 s ALA 134 CO 0.35 -0.34 1.22 0.08 0.00 0.00 0.00 175.76 177.07 3g65 s VAL 135 N 0.16 3.99 0.48 0.00 1.01 -1.26 -5.00 120.40 119.78 3g65 s VAL 135 Ca -0.02 0.89 0.04 0.00 0.00 0.00 0.00 61.98 62.89 3g65 s VAL 135 Cb -0.04 -4.69 -0.03 0.00 0.00 0.00 0.00 36.38 31.62 3g65 s VAL 135 CO 0.02 -1.31 0.08 -0.36 0.00 0.00 0.00 175.10 173.53 3g65 s PHE 136 N 5.07 2.07 0.00 5.22 0.08 -1.26 -5.08 117.98 124.08 3g65 s PHE 136 Ca 0.44 -0.83 0.00 0.00 0.12 0.00 0.00 56.93 56.66 3g65 s PHE 136 Cb -0.08 -1.73 0.00 0.00 -0.57 0.00 0.00 43.02 40.64 3g65 s PHE 136 CO 0.26 0.18 0.00 -3.47 -0.10 0.00 0.00 175.22 172.08 3g65 n ASP 137 N -1.26 0.00 -0.08 1.36 -0.08 -1.26 -5.04 116.55 110.19 3g65 n ASP 137 Ca -0.12 0.00 0.03 0.00 -1.51 0.00 0.00 54.79 53.19 3g65 n ASP 137 Cb 0.66 0.00 0.36 0.00 2.34 0.00 0.00 41.12 44.48 3g65 n ASP 137 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3g65 h PRO 138 N 0.00 0.70 0.00 -0.67 0.11 -1.95 -1.09 132.00 129.10 3g65 h PRO 138 Ca 0.00 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.03 3g65 h PRO 138 Cb 0.00 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 30.95 3g65 h PRO 138 CO 0.00 0.47 -0.17 0.00 -0.21 0.00 0.00 178.00 178.09 3g65 h ALA 139 N 1.66 1.14 -0.01 -0.75 0.00 -2.00 -1.72 119.26 117.58 3g65 h ALA 139 Ca 0.19 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3g65 h ALA 139 Cb -0.07 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3g65 h ALA 139 CO -0.04 0.21 -0.29 0.45 0.00 0.00 0.00 179.25 179.59 3g65 n SER 140 N -3.50 1.60 -4.62 0.00 2.88 -0.49 -4.87 113.62 104.63 3g65 n SER 140 Ca -0.01 -1.27 -0.43 0.00 -1.33 0.00 0.00 58.87 55.83 3g65 n SER 140 Cb 0.33 0.23 -0.02 0.00 -0.75 0.00 0.00 64.21 64.00 3g65 n SER 140 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3g65 h PRO 142 N 9.18 -0.48 -7.00 0.00 0.11 -1.87 -3.43 132.00 128.52 3g65 h PRO 142 Ca -0.24 0.03 -0.48 0.00 0.11 0.00 0.00 66.00 65.43 3g65 h PRO 142 Cb 1.07 0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3g65 h PRO 142 CO 1.08 -0.32 0.24 -1.01 -0.21 0.00 0.00 178.00 177.78 3g65 s HIS 143 N -5.17 3.44 -0.06 0.65 3.76 -0.77 -4.89 115.29 112.24 3g65 s HIS 143 Ca -0.12 1.29 -0.30 0.00 -0.15 0.00 0.00 55.06 55.78 3g65 s HIS 143 Cb 0.05 -2.64 0.07 0.00 1.11 0.00 0.00 32.58 31.18 3g65 s HIS 143 CO 0.49 -0.19 0.68 1.41 -0.85 0.00 0.00 174.74 176.27 3g65 s MET 144 N -3.78 1.04 -0.08 1.40 1.75 0.41 -2.85 119.30 117.19 3g65 s MET 144 Ca 0.56 0.31 -0.26 0.00 -1.25 0.00 0.00 55.69 55.04 3g65 s MET 144 Cb -0.10 0.49 0.06 0.00 2.84 0.00 0.00 34.83 38.12 3g65 s MET 144 CO 0.28 -0.31 0.61 -0.48 -0.65 0.00 0.00 175.02 174.47 3g65 s LEU 145 N -1.08 -0.36 -0.03 4.11 0.05 -0.44 -0.47 118.68 120.46 3g65 s LEU 145 Ca -0.10 0.73 0.00 0.00 0.05 0.00 0.00 54.13 54.81 3g65 s LEU 145 Cb -0.00 2.25 0.03 0.00 -2.05 0.00 0.00 46.19 46.42 3g65 s LEU 145 CO 0.09 -0.50 0.02 -0.60 -0.55 0.00 0.00 176.35 174.81 3g65 s ARG 146 N -0.89 0.12 0.07 1.48 3.52 -0.63 -0.26 118.95 122.36 3g65 s ARG 146 Ca -0.09 0.15 -0.23 0.00 -0.13 0.00 0.00 55.73 55.43 3g65 s ARG 146 Cb -0.02 -0.38 0.06 0.00 -1.56 0.00 0.00 34.95 33.04 3g65 s ARG 146 CO 0.07 -0.17 0.54 0.00 -0.81 0.00 0.00 175.30 174.93 3g65 s ALA 147 N 1.14 -1.38 0.29 6.12 0.00 -0.63 -0.82 121.76 126.48 3g65 s ALA 147 Ca -0.08 0.58 -0.30 0.00 0.00 0.00 0.00 51.96 52.16 3g65 s ALA 147 Cb -0.13 0.47 -0.13 0.00 0.00 0.00 0.00 23.12 23.34 3g65 s ALA 147 CO -0.02 -0.56 1.36 -2.30 0.00 0.00 0.00 175.76 174.24 3g65 n PRO 148 N 0.24 2.11 -0.37 0.00 -0.02 -1.26 -0.93 135.00 134.77 3g65 n PRO 148 Ca -0.18 0.75 0.03 0.00 -2.02 0.00 0.00 63.50 62.08 3g65 n PRO 148 Cb 0.61 -2.37 0.19 0.00 -0.02 0.00 0.00 33.50 31.91 3g65 n PRO 148 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g65 h ALA 149 N 3.47 1.41 -0.97 3.55 0.00 -1.55 -1.03 119.26 124.15 3g65 h ALA 149 Ca -0.45 -0.01 0.16 0.00 0.00 0.00 0.00 54.91 54.60 3g65 h ALA 149 Cb 1.28 -0.28 -0.09 0.00 0.00 0.00 0.00 17.79 18.69 3g65 h ALA 149 CO 0.70 0.39 0.61 0.00 0.00 0.00 0.00 179.25 180.95 3g65 h ARG 150 N 1.13 0.75 -0.08 0.00 2.47 -1.87 0.73 114.38 117.51 3g65 h ARG 150 Ca 0.45 -0.05 -0.02 0.00 -1.26 0.00 0.00 59.98 59.10 3g65 h ARG 150 Cb 0.24 -0.17 -0.00 0.00 -1.65 0.00 0.00 29.97 28.39 3g65 h ARG 150 CO -0.19 0.50 -0.01 0.28 0.56 0.00 0.00 179.97 181.10 3g65 h VAL 151 N 0.77 1.28 -0.42 2.04 2.07 -1.55 -2.61 116.25 117.83 3g65 h VAL 151 Ca 0.52 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 67.10 3g65 h VAL 151 Cb 0.78 1.72 -0.02 0.00 -1.52 0.00 0.00 31.29 32.25 3g65 h VAL 151 CO -0.29 0.25 0.11 -0.07 0.02 0.00 0.00 177.57 177.59 3g65 h LEU 152 N -0.17 0.57 -1.40 2.57 3.38 -1.13 -1.63 115.31 117.50 3g65 h LEU 152 Ca 0.02 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 3g65 h LEU 152 Cb 0.40 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3g65 h LEU 152 CO 0.01 0.57 0.07 1.23 0.09 0.00 0.00 178.44 180.41 3g65 h GLY 153 N 0.83 0.50 2.00 0.83 0.00 -0.79 -1.48 103.07 104.96 3g65 h GLY 153 Ca 0.14 -0.25 -0.11 0.00 0.00 0.00 0.00 47.33 47.11 3g65 h GLY 153 CO -0.00 0.24 -0.51 0.83 0.00 0.00 0.00 176.54 177.10 3g65 h GLU 154 N 0.46 0.00 0.00 4.80 5.08 -0.96 -3.16 114.58 120.80 3g65 h GLU 154 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 3g65 h GLU 154 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 3g65 h GLU 154 CO -0.00 0.51 0.00 0.00 -1.00 0.00 0.00 179.01 178.51 3g65 h ALA 155 N 1.49 1.00 -0.01 3.43 0.00 -0.38 -3.13 119.26 121.66 3g65 h ALA 155 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3g65 h ALA 155 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3g65 h ALA 155 CO 0.07 0.00 -0.69 1.33 0.00 0.00 0.00 179.25 179.96 3g65 n VAL 156 N -3.06 0.00 -0.16 0.00 0.24 -1.03 -4.54 118.33 109.77 3g65 n VAL 156 Ca 0.02 -0.16 -0.04 0.00 -2.04 0.00 0.00 64.34 62.13 3g65 n VAL 156 Cb 0.40 1.08 0.06 0.00 -1.47 0.00 0.00 33.84 33.91 3g65 n VAL 156 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 3g65 h LEU 157 N 0.79 0.23 -2.12 1.34 3.38 -1.51 -1.82 115.31 115.61 3g65 h LEU 157 Ca 0.00 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3g65 h LEU 157 Cb 0.51 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3g65 h LEU 157 CO 0.00 0.17 0.13 -0.65 0.09 0.00 0.00 178.44 178.18 3g65 h PRO 158 N 0.39 0.00 -6.67 1.13 0.11 -1.80 -3.42 132.00 121.74 3g65 h PRO 158 Ca 0.23 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.84 3g65 h PRO 158 Cb 0.21 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.29 3g65 h PRO 158 CO -0.21 0.00 0.14 -0.06 -0.21 0.00 0.00 178.00 177.66 3g65 s PHE 159 N -3.90 3.56 0.49 0.65 0.08 -0.68 -5.00 117.98 113.17 3g65 s PHE 159 Ca -0.04 1.39 -0.23 0.00 0.12 0.00 0.00 56.93 58.18 3g65 s PHE 159 Cb 0.09 -2.64 -0.06 0.00 -0.57 0.00 0.00 43.02 39.84 3g65 s PHE 159 CO 0.29 0.23 1.31 0.45 -0.10 0.00 0.00 175.22 177.41 3g65 s SER 160 N -1.84 5.72 0.59 1.36 0.15 -1.26 -4.89 113.70 113.51 3g65 s SER 160 Ca 0.48 2.66 0.33 0.00 0.70 0.00 0.00 55.95 60.11 3g65 s SER 160 Cb -0.15 -2.63 1.84 0.00 -1.71 0.00 0.00 66.02 63.37 3g65 s SER 160 CO 0.20 -1.26 2.22 -0.65 1.20 0.00 0.00 173.24 174.95 3g65 h PRO 161 N 1.89 0.00 -0.01 5.44 0.11 -1.94 -1.76 132.00 135.73 3g65 h PRO 161 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3g65 h PRO 161 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3g65 h PRO 161 CO 0.59 0.04 -0.20 0.00 -0.21 0.00 0.00 178.00 178.22 3g65 n ALA 162 N -2.24 2.97 -1.68 -0.75 0.00 -1.26 -4.90 120.51 112.64 3g65 n ALA 162 Ca -0.02 -0.43 -0.42 0.00 0.00 0.00 0.00 53.44 52.57 3g65 n ALA 162 Cb 0.14 -1.12 -0.03 0.00 0.00 0.00 0.00 19.45 18.43 3g65 n ALA 162 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3g65 n LEU 163 N -0.39 4.11 -0.08 0.00 7.94 -0.66 -4.91 117.00 123.01 3g65 n LEU 163 Ca 0.14 0.96 -0.12 0.00 -1.11 0.00 0.00 56.01 55.88 3g65 n LEU 163 Cb 0.36 -1.54 -0.08 0.00 0.53 0.00 0.00 43.42 42.69 3g65 n LEU 163 CO 0.24 0.20 -0.10 0.00 -1.11 0.00 0.00 177.39 176.61 3g65 h ALA 164 N 9.20 0.08 -4.52 1.96 0.00 -1.90 -3.36 119.26 120.72 3g65 h ALA 164 Ca -0.47 -0.61 -0.70 0.00 0.00 0.00 0.00 54.91 53.13 3g65 h ALA 164 Cb 1.23 0.32 -0.29 0.00 0.00 0.00 0.00 17.79 19.04 3g65 h ALA 164 CO 0.95 0.30 -0.87 -1.21 0.00 0.00 0.00 179.25 178.42 3g65 s GLU 165 N -2.13 2.16 0.00 0.00 2.02 -1.26 -0.01 118.70 119.48 3g65 s GLU 165 Ca -0.17 -0.90 0.02 0.00 0.02 0.00 0.00 54.97 53.94 3g65 s GLU 165 Cb 0.01 -2.09 -0.01 0.00 0.10 0.00 0.00 34.13 32.15 3g65 s GLU 165 CO 0.43 0.57 -0.07 0.54 0.02 0.00 0.00 175.26 176.75 3g65 s VAL 166 N -0.63 0.51 -0.23 2.63 0.11 -0.72 -1.84 120.40 120.23 3g65 s VAL 166 Ca 0.10 -0.39 -0.09 0.00 -2.93 0.00 0.00 61.98 58.67 3g65 s VAL 166 Cb -0.10 -0.46 -0.04 0.00 -1.53 0.00 0.00 36.38 34.25 3g65 s VAL 166 CO -0.01 0.07 0.12 0.42 -3.33 0.00 0.00 175.10 172.38 3g65 s THR 167 N -0.32 5.07 -0.33 5.04 -4.23 0.25 -2.19 115.64 118.94 3g65 s THR 167 Ca 0.01 0.08 -0.14 0.00 -1.18 0.00 0.00 61.69 60.45 3g65 s THR 167 Cb -0.03 -3.35 -0.02 0.00 1.34 0.00 0.00 72.50 70.44 3g65 s THR 167 CO -0.00 0.37 0.32 -0.22 -0.54 0.00 0.00 174.62 174.55 3g65 s LEU 168 N 0.99 4.36 0.30 4.79 2.96 0.26 -1.51 118.68 130.84 3g65 s LEU 168 Ca 0.06 -0.18 0.03 0.00 -0.22 0.00 0.00 54.13 53.82 3g65 s LEU 168 Cb -0.14 -2.29 -0.06 0.00 0.50 0.00 0.00 46.19 44.21 3g65 s LEU 168 CO 0.04 -0.27 0.08 -0.83 -1.32 0.00 0.00 176.35 174.04 3g65 s GLY 169 N 1.72 1.95 -0.31 7.98 0.00 -0.77 -1.55 107.32 116.35 3g65 s GLY 169 Ca 0.11 -1.96 0.03 0.00 0.00 0.00 0.00 44.72 42.90 3g65 s GLY 169 CO 0.11 -1.72 0.00 -0.42 0.00 0.00 0.00 173.10 171.07 3g65 s ILE 170 N -3.49 2.16 0.62 0.90 -1.09 -0.88 -1.62 121.20 117.81 3g65 s ILE 170 Ca 0.37 -2.05 -0.12 0.00 -2.23 0.00 0.00 60.65 56.62 3g65 s ILE 170 Cb 0.08 -2.49 -0.03 0.00 -1.58 0.00 0.00 42.46 38.44 3g65 s ILE 170 CO 0.15 -0.41 1.03 -0.83 -1.23 0.00 0.00 174.94 173.65 3g65 s GLY 171 N 1.01 1.72 0.01 6.18 0.00 -0.96 -0.44 107.32 114.84 3g65 s GLY 171 Ca 0.04 -0.01 -0.30 0.00 0.00 0.00 0.00 44.72 44.46 3g65 s GLY 171 CO -0.08 0.27 1.79 -1.60 0.00 0.00 0.00 173.10 173.49 3g65 s ARG 172 N -5.00 4.16 0.00 2.90 3.52 -1.26 -3.09 118.95 120.18 3g65 s ARG 172 Ca 0.56 2.40 0.00 0.00 -0.13 0.00 0.00 55.73 58.57 3g65 s ARG 172 Cb -0.12 -4.00 0.00 0.00 -1.56 0.00 0.00 34.95 29.28 3g65 s ARG 172 CO 0.51 -0.88 0.00 0.41 -0.81 0.00 0.00 175.30 174.53 3g65 n GLY 173 N 4.29 1.36 3.60 8.12 0.00 -1.26 -4.83 105.19 116.47 3g65 n GLY 173 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 3g65 n GLY 173 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g65 n ARG 174 N 0.00 -1.29 -3.75 1.61 1.74 -1.18 -4.87 116.66 108.92 3g65 n ARG 174 Ca 0.00 0.65 -0.12 0.00 -0.77 0.00 0.00 57.85 57.61 3g65 n ARG 174 Cb 0.00 -4.14 -0.12 0.00 -1.02 0.00 0.00 32.46 27.18 3g65 n ARG 174 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 3g65 s ARG 175 N -5.39 0.24 0.40 5.56 1.70 -1.24 -3.57 118.95 116.65 3g65 s ARG 175 Ca 0.35 0.47 -0.23 0.00 -0.47 0.00 0.00 55.73 55.84 3g65 s ARG 175 Cb -0.12 -0.02 -0.10 0.00 -0.57 0.00 0.00 34.95 34.14 3g65 s ARG 175 CO 0.85 -0.12 0.97 0.14 -1.08 0.00 0.00 175.30 176.07 3g65 s VAL 176 N 0.85 4.16 -0.06 4.99 -7.23 -0.96 -2.27 120.40 119.87 3g65 s VAL 176 Ca -0.06 1.53 -0.02 0.00 -1.81 0.00 0.00 61.98 61.62 3g65 s VAL 176 Cb -0.07 -3.73 0.03 0.00 0.56 0.00 0.00 36.38 33.17 3g65 s VAL 176 CO -0.05 -0.11 0.05 -0.63 -0.31 0.00 0.00 175.10 174.05 3g65 s ILE 177 N -1.89 -0.00 -0.25 -0.62 1.01 -0.64 -0.96 121.20 117.85 3g65 s ILE 177 Ca 0.58 0.28 -0.15 0.00 0.00 0.00 0.00 60.65 61.36 3g65 s ILE 177 Cb -0.15 -0.29 -0.04 0.00 0.01 0.00 0.00 42.46 41.99 3g65 s ILE 177 CO 0.20 0.13 0.37 -0.76 0.00 0.00 0.00 174.94 174.88 3g65 s LEU 178 N 2.12 4.08 -0.04 2.97 1.43 0.31 -1.84 118.68 127.72 3g65 s LEU 178 Ca 0.04 0.35 0.06 0.00 -1.03 0.00 0.00 54.13 53.56 3g65 s LEU 178 Cb -0.13 -2.44 -0.01 0.00 0.03 0.00 0.00 46.19 43.64 3g65 s LEU 178 CO -0.04 -0.14 -0.21 -0.60 0.23 0.00 0.00 176.35 175.58 3g65 s ARG 179 N 1.80 1.97 0.34 1.70 3.52 -0.57 -0.29 118.95 127.42 3g65 s ARG 179 Ca 0.16 -0.75 -0.29 0.00 -0.13 0.00 0.00 55.73 54.72 3g65 s ARG 179 Cb -0.15 -1.77 -0.11 0.00 -1.56 0.00 0.00 34.95 31.36 3g65 s ARG 179 CO 0.09 0.37 1.37 -1.12 -0.81 0.00 0.00 175.30 175.20 3g65 s SER 180 N -0.24 6.63 -0.07 -2.12 0.01 0.19 -0.58 113.70 117.53 3g65 s SER 180 Ca 0.01 2.80 0.01 0.00 1.31 0.00 0.00 55.95 60.09 3g65 s SER 180 Cb -0.11 -2.65 -0.03 0.00 0.21 0.00 0.00 66.02 63.44 3g65 s SER 180 CO 0.01 -0.65 -0.09 -0.47 0.41 0.00 0.00 173.24 172.46 3g65 s TYR 181 N -1.09 2.89 0.00 2.43 6.14 -0.77 -4.81 117.35 122.15 3g65 s TYR 181 Ca 0.51 -0.04 -0.04 0.00 0.64 0.00 0.00 57.07 58.13 3g65 s TYR 181 Cb -0.42 -1.70 -0.01 0.00 0.42 0.00 0.00 41.96 40.25 3g65 s TYR 181 CO 0.56 0.28 0.07 -1.01 0.64 0.00 0.00 175.55 176.08 3g65 s HIS 182 N -0.73 0.11 -1.25 4.97 3.76 -1.26 -4.55 115.29 116.33 3g65 s HIS 182 Ca 0.11 -0.24 0.21 0.00 -0.15 0.00 0.00 55.06 55.00 3g65 s HIS 182 Cb -0.11 -0.09 -0.17 0.00 1.11 0.00 0.00 32.58 33.32 3g65 s HIS 182 CO 0.01 -0.22 0.93 0.39 -0.85 0.00 0.00 174.74 175.01 3g65 n GLU 183 N 1.71 0.44 -0.66 1.40 1.02 -1.26 -5.20 120.64 118.10 3g65 n GLU 183 Ca -0.22 -0.27 -0.06 0.00 -0.02 0.00 0.00 57.16 56.59 3g65 n GLU 183 Cb 0.56 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.51 3g65 n GLU 183 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3g65 n THR 189 N -1.09 2.30 -1.84 2.62 -2.24 -1.26 -5.13 114.28 107.64 3g65 n THR 189 Ca 0.05 -0.94 -0.42 0.00 -2.27 0.00 0.00 64.05 60.47 3g65 n THR 189 Cb 0.36 -1.47 0.00 0.00 -2.10 0.00 0.00 70.33 67.12 3g65 n THR 189 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3g65 n ALA 190 N 1.17 5.40 -1.75 6.98 0.00 -1.26 -4.97 120.51 126.09 3g65 n ALA 190 Ca 0.12 -3.92 -0.38 0.00 0.00 0.00 0.00 53.44 49.26 3g65 n ALA 190 Cb 0.54 -3.49 0.04 0.00 0.00 0.00 0.00 19.45 16.54 3g65 n ALA 190 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3g65 n LYS 191 N 6.05 1.70 -4.04 0.00 4.76 -1.26 -5.02 118.16 120.35 3g65 n LYS 191 Ca 0.51 0.63 -0.25 0.00 -2.87 0.00 0.00 58.31 56.33 3g65 n LYS 191 Cb 0.39 -2.59 -0.04 0.00 -1.84 0.00 0.00 35.03 30.95 3g65 n LYS 191 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3g65 s ALA 192 N -1.29 3.71 0.00 7.82 0.00 -1.26 -5.08 121.76 125.66 3g65 s ALA 192 Ca 0.72 -1.22 -0.30 0.00 0.00 0.00 0.00 51.96 51.16 3g65 s ALA 192 Cb -0.41 -1.49 -0.04 0.00 0.00 0.00 0.00 23.12 21.17 3g65 s ALA 192 CO 0.49 0.43 1.11 1.41 0.00 0.00 0.00 175.76 179.20 3g65 s MET 193 N -3.39 4.45 -0.41 0.00 1.75 -1.26 -5.01 119.30 115.43 3g65 s MET 193 Ca 0.33 1.60 -0.14 0.00 -1.25 0.00 0.00 55.69 56.22 3g65 s MET 193 Cb -0.10 -3.45 0.03 0.00 2.84 0.00 0.00 34.83 34.16 3g65 s MET 193 CO 0.26 -0.24 0.30 0.08 -0.65 0.00 0.00 175.02 174.76 3g65 s VAL 194 N 1.39 5.11 0.03 10.11 1.01 -1.26 -5.00 120.40 131.79 3g65 s VAL 194 Ca 0.55 -0.77 -0.20 0.00 0.00 0.00 0.00 61.98 61.57 3g65 s VAL 194 Cb -0.25 -3.88 -0.06 0.00 0.00 0.00 0.00 36.38 32.19 3g65 s VAL 194 CO 0.26 -0.34 0.57 -0.89 0.00 0.00 0.00 175.10 174.70 3g65 s THR 195 N 1.65 4.83 -0.14 3.92 2.01 -1.26 -4.90 115.64 121.74 3g65 s THR 195 Ca 0.04 1.20 -0.04 0.00 0.31 0.00 0.00 61.69 63.21 3g65 s THR 195 Cb -0.20 -3.90 0.05 0.00 0.01 0.00 0.00 72.50 68.46 3g65 s THR 195 CO 0.09 0.50 0.06 -0.70 -0.69 0.00 0.00 174.62 173.88 3g65 s GLU 196 N -0.70 0.24 -0.14 4.92 2.12 -1.26 -0.64 118.70 123.24 3g65 s GLU 196 Ca 0.29 -0.06 -0.11 0.00 0.36 0.00 0.00 54.97 55.46 3g65 s GLU 196 Cb -0.19 -1.56 -0.05 0.00 0.26 0.00 0.00 34.13 32.60 3g65 s GLU 196 CO 0.18 -0.56 0.23 1.41 -0.54 0.00 0.00 175.26 175.97 3g65 s MET 197 N 2.06 3.98 -0.13 4.30 -2.45 0.60 -4.95 119.30 122.70 3g65 s MET 197 Ca 0.02 -0.00 0.02 0.00 -1.25 0.00 0.00 55.69 54.48 3g65 s MET 197 Cb -0.15 -3.33 0.01 0.00 1.25 0.00 0.00 34.83 32.61 3g65 s MET 197 CO -0.07 0.46 -0.20 0.00 1.05 0.00 0.00 175.02 176.25 3g65 s LEU 199 N 0.83 2.55 0.73 0.00 1.43 -0.14 -5.03 118.68 119.07 3g65 s LEU 199 Ca -0.07 -0.42 -0.12 0.00 -1.03 0.00 0.00 54.13 52.49 3g65 s LEU 199 Cb -0.15 -1.49 0.03 0.00 0.03 0.00 0.00 46.19 44.60 3g65 s LEU 199 CO -0.01 0.27 1.11 -0.83 0.23 0.00 0.00 176.35 177.11 3g65 s GLY 200 N -1.30 1.62 0.44 -3.19 0.00 -1.26 -2.27 107.32 101.36 3g65 s GLY 200 Ca 0.14 -0.35 0.20 0.00 0.00 0.00 0.00 44.72 44.71 3g65 s GLY 200 CO 0.04 0.04 1.91 -2.09 0.00 0.00 0.00 173.10 173.00 3g65 h GLU 201 N -0.78 0.00 0.00 2.90 4.81 -1.90 -2.71 114.58 116.91 3g65 h GLU 201 Ca -0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 3g65 h GLU 201 Cb 1.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 3g65 h GLU 201 CO 0.63 0.26 0.00 0.93 -0.73 0.00 0.00 179.01 180.10 3g65 h GLU 202 N 0.00 0.00 0.00 1.92 5.08 -1.93 -2.16 114.58 117.50 3g65 h GLU 202 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3g65 h GLU 202 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 3g65 h GLU 202 CO 0.03 0.00 0.00 -0.25 -1.00 0.00 0.00 179.01 177.79 3g65 n ASP 203 N -2.78 0.32 -4.70 1.42 8.00 -1.02 -4.83 116.55 112.96 3g65 n ASP 203 Ca 0.01 0.54 -0.31 0.00 0.71 0.00 0.00 54.79 55.74 3g65 n ASP 203 Cb 0.27 -0.62 -0.08 0.00 -0.02 0.00 0.00 41.12 40.66 3g65 n ASP 203 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3g65 s PHE 204 N -3.06 3.05 -0.90 1.24 0.08 -0.81 -4.71 117.98 112.86 3g65 s PHE 204 Ca 0.11 0.02 0.26 0.00 0.12 0.00 0.00 56.93 57.44 3g65 s PHE 204 Cb 0.15 -1.59 0.64 0.00 -0.57 0.00 0.00 43.02 41.65 3g65 s PHE 204 CO 0.51 0.48 1.52 1.04 -0.10 0.00 0.00 175.22 178.67 3g65 n GLN 205 N 0.80 0.08 -3.64 0.44 6.02 0.00 -4.87 117.38 116.21 3g65 n GLN 205 Ca -0.12 0.03 -0.07 0.00 -0.01 0.00 0.00 57.00 56.84 3g65 n GLN 205 Cb 0.52 -1.56 -0.07 0.00 1.02 0.00 0.00 30.24 30.15 3g65 n GLN 205 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 3g65 s GLN 206 N -3.04 0.47 -0.35 -1.09 0.74 -0.91 -4.92 119.66 110.56 3g65 s GLN 206 Ca 0.11 0.65 0.01 0.00 0.05 0.00 0.00 55.36 56.17 3g65 s GLN 206 Cb 0.17 0.18 0.14 0.00 1.10 0.00 0.00 33.01 34.60 3g65 s GLN 206 CO 0.66 -0.07 0.28 -1.17 -0.55 0.00 0.00 175.29 174.44 3g65 s LEU 207 N 0.68 0.43 -0.80 3.68 2.96 -1.26 -1.60 118.68 122.77 3g65 s LEU 207 Ca -0.02 -1.77 0.02 0.00 -0.22 0.00 0.00 54.13 52.14 3g65 s LEU 207 Cb -0.05 0.07 0.22 0.00 0.50 0.00 0.00 46.19 46.93 3g65 s LEU 207 CO -0.10 -0.30 0.76 0.00 -1.32 0.00 0.00 176.35 175.38 3g65 n GLN 208 N 4.31 2.55 -3.94 1.98 6.02 0.38 -5.02 117.38 123.66 3g65 n GLN 208 Ca 0.09 -4.54 -0.10 0.00 -0.01 0.00 0.00 57.00 52.44 3g65 n GLN 208 Cb 0.41 -2.35 -0.12 0.00 1.02 0.00 0.00 30.24 29.21 3g65 n GLN 208 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3g65 s ALA 209 N -1.82 0.06 0.13 -1.58 0.00 -1.26 -0.45 121.76 116.84 3g65 s ALA 209 Ca 0.30 -0.37 -0.30 0.00 0.00 0.00 0.00 51.96 51.59 3g65 s ALA 209 Cb 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 23.12 23.16 3g65 s ALA 209 CO -0.09 -0.11 0.99 -0.65 0.00 0.00 0.00 175.76 175.90 3g65 s GLN 210 N -0.97 4.68 0.22 0.00 -1.52 -1.26 -5.00 119.66 115.81 3g65 s GLN 210 Ca -0.11 1.51 -0.31 0.00 -1.95 0.00 0.00 55.36 54.50 3g65 s GLN 210 Cb -0.07 -3.36 -0.10 0.00 -0.22 0.00 0.00 33.01 29.27 3g65 s GLN 210 CO -0.01 0.19 1.52 -1.21 -0.25 0.00 0.00 175.29 175.53 3g65 s GLU 211 N -0.08 4.23 0.00 2.91 2.02 -1.26 -2.73 118.70 123.79 3g65 s GLU 211 Ca 0.47 2.36 0.00 0.00 0.02 0.00 0.00 54.97 57.83 3g65 s GLU 211 Cb -0.25 -3.12 0.00 0.00 0.10 0.00 0.00 34.13 30.87 3g65 s GLU 211 CO 0.31 -0.53 0.00 0.41 0.02 0.00 0.00 175.26 175.47 3g65 n GLY 212 N 2.87 2.41 3.73 -1.39 0.00 0.42 -5.01 105.19 108.22 3g65 n GLY 212 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3g65 n GLY 212 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g65 s VAL 213 N -2.43 3.78 -0.17 1.61 1.01 -1.10 -4.81 120.40 118.29 3g65 s VAL 213 Ca 0.00 1.45 -0.14 0.00 0.00 0.00 0.00 61.98 63.29 3g65 s VAL 213 Cb 0.00 -3.93 0.05 0.00 0.00 0.00 0.00 36.38 32.50 3g65 s VAL 213 CO 0.00 0.21 0.44 0.00 0.00 0.00 0.00 175.10 175.75 3g65 s ALA 214 N 0.15 -1.09 0.30 5.51 0.00 -1.26 -2.06 121.76 123.29 3g65 s ALA 214 Ca 0.53 1.33 0.10 0.00 0.00 0.00 0.00 51.96 53.92 3g65 s ALA 214 Cb -0.31 -0.78 -0.06 0.00 0.00 0.00 0.00 23.12 21.98 3g65 s ALA 214 CO 0.34 -0.22 -0.14 0.96 0.00 0.00 0.00 175.76 176.70 3g65 s ILE 215 N 0.53 2.23 -0.08 0.00 -4.36 -0.60 -4.57 121.20 114.35 3g65 s ILE 215 Ca -0.02 -2.29 0.02 0.00 -0.26 0.00 0.00 60.65 58.09 3g65 s ILE 215 Cb -0.04 -2.41 0.02 0.00 1.25 0.00 0.00 42.46 41.27 3g65 s ILE 215 CO -0.03 -0.34 -0.12 -0.89 0.24 0.00 0.00 174.94 173.81 3g65 s THR 216 N -2.65 1.16 0.24 8.37 2.01 -1.26 -0.57 115.64 122.94 3g65 s THR 216 Ca 0.30 -0.46 0.05 0.00 0.31 0.00 0.00 61.69 61.89 3g65 s THR 216 Cb -0.01 -1.09 -0.02 0.00 0.01 0.00 0.00 72.50 71.39 3g65 s THR 216 CO 0.14 0.37 0.19 2.22 -0.69 0.00 0.00 174.62 176.85 3g65 n PHE 217 N 4.15 -0.49 -2.76 4.92 1.16 -0.93 -2.44 117.46 121.07 3g65 n PHE 217 Ca -0.20 -1.95 -0.42 0.00 -1.87 0.00 0.00 57.45 53.02 3g65 n PHE 217 Cb 0.51 0.18 -0.03 0.00 -1.61 0.00 0.00 39.48 38.53 3g65 n PHE 217 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3g65 h LEU 219 N 7.36 0.39 -1.76 0.00 6.46 -0.67 -2.96 115.31 124.12 3g65 h LEU 219 Ca -0.36 -0.90 0.13 0.00 -0.12 0.00 0.00 57.88 56.63 3g65 h LEU 219 Cb 1.18 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 40.95 3g65 h LEU 219 CO 0.79 1.46 0.42 0.11 -0.62 0.00 0.00 178.44 180.61 3g65 h LYS 220 N -0.41 0.24 0.19 1.25 1.57 -1.71 0.98 116.57 118.68 3g65 h LYS 220 Ca -0.21 -0.01 -0.29 0.00 -1.87 0.00 0.00 60.65 58.27 3g65 h LYS 220 Cb 1.64 -0.05 0.03 0.00 0.08 0.00 0.00 32.23 33.93 3g65 h LYS 220 CO 0.09 0.16 -1.26 0.93 -0.57 0.00 0.00 179.45 178.80 3g65 h GLU 221 N 0.25 0.52 -0.53 3.15 5.08 -1.76 -3.24 114.58 118.04 3g65 h GLU 221 Ca 0.29 -0.81 0.02 0.00 -1.00 0.00 0.00 59.36 57.86 3g65 h GLU 221 Cb 0.81 0.29 -0.03 0.00 0.50 0.00 0.00 28.75 30.32 3g65 h GLU 221 CO -0.06 1.38 0.35 0.35 -1.00 0.00 0.00 179.01 180.03 3g65 h PHE 222 N 0.07 0.63 -0.53 4.33 3.57 -0.94 -1.31 116.94 122.76 3g65 h PHE 222 Ca -0.21 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.26 3g65 h PHE 222 Cb 1.97 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 40.47 3g65 h PHE 222 CO 0.14 0.39 0.15 0.00 -2.23 0.00 0.00 178.31 176.76 3g65 h ARG 223 N 0.67 0.80 -0.72 1.11 3.08 -0.95 -2.09 114.38 116.28 3g65 h ARG 223 Ca 0.20 -0.15 0.12 0.00 0.07 0.00 0.00 59.98 60.22 3g65 h ARG 223 Cb -0.00 -0.13 -0.08 0.00 0.08 0.00 0.00 29.97 29.83 3g65 h ARG 223 CO -0.05 0.71 0.31 0.78 -1.07 0.00 0.00 179.97 180.65 3g65 h GLY 224 N 0.95 1.08 1.04 0.04 0.00 -1.26 0.13 103.07 105.05 3g65 h GLY 224 Ca 0.18 -0.17 -0.23 0.00 0.00 0.00 0.00 47.33 47.11 3g65 h GLY 224 CO -0.01 -0.04 -0.93 -2.00 0.00 0.00 0.00 176.54 173.56 3g65 h LEU 225 N 0.49 0.75 -1.25 3.11 5.85 -1.54 -3.29 115.31 119.43 3g65 h LEU 225 Ca 0.38 -0.78 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 3g65 h LEU 225 Cb 0.52 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 3g65 h LEU 225 CO -0.35 1.44 0.32 0.25 -0.34 0.00 0.00 178.44 179.76 3g65 h LEU 226 N 0.15 0.75 -1.18 2.25 6.46 -0.70 -0.94 115.31 122.09 3g65 h LEU 226 Ca -0.13 -0.06 -0.09 0.00 -0.12 0.00 0.00 57.88 57.49 3g65 h LEU 226 Cb 1.62 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 41.35 3g65 h LEU 226 CO 0.18 0.61 -0.38 0.77 -0.62 0.00 0.00 178.44 179.00 3g65 h SER 227 N 0.84 0.05 0.70 1.25 4.64 -0.87 -1.75 113.55 118.42 3g65 h SER 227 Ca 0.21 -0.02 -0.26 0.00 -0.47 0.00 0.00 61.79 61.25 3g65 h SER 227 Cb 0.04 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 3g65 h SER 227 CO -0.03 0.43 -1.23 0.15 -0.87 0.00 0.00 176.83 175.28 3g65 h PHE 228 N 0.04 0.34 0.00 4.77 3.57 -1.39 -3.17 116.94 121.10 3g65 h PHE 228 Ca 0.00 -0.25 -0.09 0.00 3.53 0.00 0.00 57.97 61.17 3g65 h PHE 228 Cb 0.70 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.42 3g65 h PHE 228 CO 0.00 1.21 -0.41 0.00 -2.23 0.00 0.00 178.31 176.88 3g65 h ALA 229 N 0.70 0.84 0.02 2.41 0.00 -1.01 -3.18 119.26 119.04 3g65 h ALA 229 Ca -0.12 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 3g65 h ALA 229 Cb 1.92 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.65 3g65 h ALA 229 CO 0.17 0.51 -0.01 0.93 0.00 0.00 0.00 179.25 180.86 3g65 h GLU 230 N 0.00 -0.02 0.00 0.00 5.08 -1.40 -1.38 114.58 116.86 3g65 h GLU 230 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3g65 h GLU 230 Cb 1.11 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 3g65 h GLU 230 CO 0.05 0.70 -0.00 0.66 -1.00 0.00 0.00 179.01 179.42 3g65 h SER 231 N -0.79 0.00 0.02 1.42 4.64 -1.62 0.17 113.55 117.39 3g65 h SER 231 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3g65 h SER 231 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 3g65 h SER 231 CO 0.00 0.00 -0.30 0.00 -0.87 0.00 0.00 176.83 175.66 3g65 n ALA 232 N -2.18 3.17 -3.54 5.18 0.00 -1.20 -5.00 120.51 116.94 3g65 n ALA 232 Ca -0.03 -0.60 -0.26 0.00 0.00 0.00 0.00 53.44 52.55 3g65 n ALA 232 Cb 0.08 -0.88 0.05 0.00 0.00 0.00 0.00 19.45 18.70 3g65 n ALA 232 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3g65 n ASN 233 N 0.19 -5.70 -4.49 0.00 2.85 0.58 -5.01 115.26 103.68 3g65 n ASN 233 Ca 0.11 -0.92 -0.23 0.00 -0.11 0.00 0.00 54.58 53.43 3g65 n ASN 233 Cb 0.47 -3.97 -0.11 0.00 1.24 0.00 0.00 39.78 37.41 3g65 n ASN 233 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 3g65 s LEU 234 N -6.13 2.53 -0.06 1.20 1.43 -0.55 -5.03 118.68 112.07 3g65 s LEU 234 Ca 0.47 -1.27 -0.13 0.00 -1.03 0.00 0.00 54.13 52.16 3g65 s LEU 234 Cb -0.13 -0.69 -0.05 0.00 0.03 0.00 0.00 46.19 45.35 3g65 s LEU 234 CO 0.82 -0.41 0.33 0.20 0.23 0.00 0.00 176.35 177.53 3g65 s ASN 235 N -3.54 6.64 -0.10 2.29 0.01 -1.26 -1.46 114.94 117.53 3g65 s ASN 235 Ca 0.33 0.76 0.01 0.00 -0.71 0.00 0.00 52.86 53.25 3g65 s ASN 235 Cb 0.06 -2.20 -0.02 0.00 0.41 0.00 0.00 41.25 39.50 3g65 s ASN 235 CO 0.15 0.28 -0.12 -0.22 -1.51 0.00 0.00 177.10 175.68 3g65 s LEU 236 N -0.67 2.82 -0.08 0.60 0.20 -0.11 -4.40 118.68 117.04 3g65 s LEU 236 Ca 0.21 -0.23 0.05 0.00 0.69 0.00 0.00 54.13 54.84 3g65 s LEU 236 Cb -0.15 -1.62 -0.00 0.00 -0.43 0.00 0.00 46.19 43.99 3g65 s LEU 236 CO 0.09 0.25 -0.24 -0.94 -0.29 0.00 0.00 176.35 175.22 3g65 s SER 237 N -0.14 3.04 -0.12 3.68 1.04 -0.42 -1.61 113.70 119.17 3g65 s SER 237 Ca -0.00 -0.53 -0.02 0.00 0.48 0.00 0.00 55.95 55.88 3g65 s SER 237 Cb -0.13 -1.13 -0.03 0.00 0.10 0.00 0.00 66.02 64.83 3g65 s SER 237 CO 0.03 0.20 -0.05 -0.63 0.98 0.00 0.00 173.24 173.77 3g65 s ILE 238 N 0.11 3.82 -0.25 -1.02 1.01 0.64 -0.82 121.20 124.70 3g65 s ILE 238 Ca -0.12 -0.40 0.02 0.00 0.00 0.00 0.00 60.65 60.15 3g65 s ILE 238 Cb -0.16 -2.63 0.06 0.00 0.01 0.00 0.00 42.46 39.74 3g65 s ILE 238 CO 0.06 0.54 -0.07 -1.00 0.00 0.00 0.00 174.94 174.47 3g65 s HIS 239 N -0.16 2.77 0.26 3.97 3.76 0.14 -1.33 115.29 124.69 3g65 s HIS 239 Ca 0.03 -2.01 0.08 0.00 -0.15 0.00 0.00 55.06 53.01 3g65 s HIS 239 Cb -0.13 -1.74 -0.05 0.00 1.11 0.00 0.00 32.58 31.76 3g65 s HIS 239 CO 0.03 -0.82 -0.10 -0.59 -0.85 0.00 0.00 174.74 172.40 3g65 s PHE 240 N 1.27 1.96 0.00 1.40 -0.71 -1.13 -0.62 117.98 120.14 3g65 s PHE 240 Ca -0.07 -0.60 0.00 0.00 -1.04 0.00 0.00 56.93 55.22 3g65 s PHE 240 Cb -0.19 -1.02 0.00 0.00 -1.21 0.00 0.00 43.02 40.59 3g65 s PHE 240 CO -0.06 0.38 0.00 -3.47 -1.34 0.00 0.00 175.22 170.73 3g65 n ASP 241 N -0.54 0.00 -4.79 1.98 -0.08 -1.26 -1.85 116.55 110.00 3g65 n ASP 241 Ca -0.06 0.00 -0.28 0.00 -1.51 0.00 0.00 54.79 52.94 3g65 n ASP 241 Cb 0.62 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 44.02 3g65 n ASP 241 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3g65 s ALA 242 N -2.00 3.57 -0.48 -1.67 0.00 -1.26 -4.87 121.76 115.05 3g65 s ALA 242 Ca 0.00 -1.12 -0.33 0.00 0.00 0.00 0.00 51.96 50.51 3g65 s ALA 242 Cb 0.00 -1.40 -0.12 0.00 0.00 0.00 0.00 23.12 21.60 3g65 s ALA 242 CO 0.00 0.61 2.31 -2.30 0.00 0.00 0.00 175.76 176.38 3g65 n PRO 243 N 0.01 0.87 0.00 0.00 -0.02 -1.26 -2.21 135.00 132.38 3g65 n PRO 243 Ca -0.08 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 3g65 n PRO 243 Cb 0.53 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 3g65 n PRO 243 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g65 n GLY 244 N 6.47 3.47 3.75 -1.23 0.00 -0.64 -4.64 105.19 112.38 3g65 n GLY 244 Ca 0.45 -0.55 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 3g65 n GLY 244 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g65 s ARG 245 N 0.00 4.68 0.69 1.61 0.52 -0.94 -4.03 118.95 121.48 3g65 s ARG 245 Ca 0.00 1.69 -0.17 0.00 -0.52 0.00 0.00 55.73 56.73 3g65 s ARG 245 Cb 0.00 -3.25 -0.04 0.00 0.52 0.00 0.00 34.95 32.18 3g65 s ARG 245 CO 0.00 0.25 0.62 -2.30 0.02 0.00 0.00 175.30 173.88 3g65 n PRO 246 N 1.68 0.41 -3.84 3.54 -0.02 -1.26 -4.42 135.00 131.09 3g65 n PRO 246 Ca -0.00 0.18 -0.36 0.00 -2.02 0.00 0.00 63.50 61.30 3g65 n PRO 246 Cb 0.46 -1.88 -0.06 0.00 -0.02 0.00 0.00 33.50 32.00 3g65 n PRO 246 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g65 s ALA 247 N -1.83 3.88 -0.24 3.55 0.00 0.54 -4.64 121.76 123.02 3g65 s ALA 247 Ca 0.68 -0.62 -0.03 0.00 0.00 0.00 0.00 51.96 51.99 3g65 s ALA 247 Cb -0.37 -2.00 0.01 0.00 0.00 0.00 0.00 23.12 20.76 3g65 s ALA 247 CO 0.55 0.64 -0.05 0.42 0.00 0.00 0.00 175.76 177.32 3g65 s ILE 248 N -1.13 3.14 -0.10 0.00 1.01 0.21 -1.69 121.20 122.65 3g65 s ILE 248 Ca 0.20 -0.77 -0.03 0.00 0.00 0.00 0.00 60.65 60.05 3g65 s ILE 248 Cb -0.13 -2.52 -0.03 0.00 0.01 0.00 0.00 42.46 39.79 3g65 s ILE 248 CO 0.09 0.30 0.02 -0.36 0.00 0.00 0.00 174.94 174.99 3g65 s PHE 249 N 1.40 3.23 -0.00 3.97 0.40 0.45 0.25 117.98 127.68 3g65 s PHE 249 Ca 0.03 0.23 0.01 0.00 -0.60 0.00 0.00 56.93 56.60 3g65 s PHE 249 Cb -0.15 -1.83 0.00 0.00 0.51 0.00 0.00 43.02 41.55 3g65 s PHE 249 CO -0.04 0.49 -0.02 0.99 0.70 0.00 0.00 175.22 177.34 3g65 s THR 250 N -0.83 0.19 -0.01 0.64 2.01 0.00 -0.60 115.64 117.04 3g65 s THR 250 Ca 0.13 -0.08 -0.01 0.00 0.31 0.00 0.00 61.69 62.04 3g65 s THR 250 Cb -0.12 -0.17 0.01 0.00 0.01 0.00 0.00 72.50 72.23 3g65 s THR 250 CO 0.02 0.06 0.03 -0.51 -0.69 0.00 0.00 174.62 173.53 3g65 s ILE 251 N 0.04 -0.01 -0.02 1.82 2.07 -0.82 -1.31 121.20 122.98 3g65 s ILE 251 Ca -0.00 0.04 0.01 0.00 -1.41 0.00 0.00 60.65 59.29 3g65 s ILE 251 Cb -0.02 -0.05 0.01 0.00 0.13 0.00 0.00 42.46 42.53 3g65 s ILE 251 CO -0.00 0.02 -0.03 -0.54 -1.91 0.00 0.00 174.94 172.48 3g65 s LYS 252 N 0.21 0.43 0.45 3.50 1.02 -1.26 -2.32 119.74 121.78 3g65 s LYS 252 Ca -0.02 -0.06 0.05 0.00 0.02 0.00 0.00 55.97 55.96 3g65 s LYS 252 Cb -0.02 -0.49 -0.05 0.00 -0.52 0.00 0.00 37.83 36.75 3g65 s LYS 252 CO -0.01 -0.02 0.05 0.34 -0.92 0.00 0.00 175.35 174.79 3g65 s ASP 253 N 0.49 4.07 0.20 2.83 2.15 0.12 -4.82 116.67 121.72 3g65 s ASP 253 Ca -0.05 -1.42 -0.10 0.00 0.43 0.00 0.00 52.55 51.41 3g65 s ASP 253 Cb -0.09 -0.07 0.24 0.00 -0.30 0.00 0.00 42.92 42.70 3g65 s ASP 253 CO -0.01 -0.63 1.75 0.77 -0.17 0.00 0.00 175.17 176.89 3g65 h SER 254 N 1.54 0.26 0.00 -0.34 4.64 -2.02 -3.15 113.55 114.47 3g65 h SER 254 Ca -0.43 0.07 -0.08 0.00 -0.47 0.00 0.00 61.79 60.87 3g65 h SER 254 Cb 1.27 0.03 -0.18 0.00 -0.31 0.00 0.00 62.40 63.21 3g65 h SER 254 CO 0.76 0.16 -0.73 0.18 -0.87 0.00 0.00 176.83 176.33 3g65 n LEU 255 N -4.97 1.79 -3.84 5.97 4.77 -1.26 -5.05 117.00 114.41 3g65 n LEU 255 Ca 0.07 -2.87 -0.12 0.00 -0.03 0.00 0.00 56.01 53.06 3g65 n LEU 255 Cb 0.24 -0.26 -0.11 0.00 -2.33 0.00 0.00 43.42 40.96 3g65 n LEU 255 CO 0.24 0.91 -0.18 -0.22 -1.33 0.00 0.00 177.39 176.81 3g65 s LEU 256 N -1.59 1.45 0.01 2.23 2.96 -1.19 -4.16 118.68 118.39 3g65 s LEU 256 Ca 0.34 0.10 0.00 0.00 -0.22 0.00 0.00 54.13 54.36 3g65 s LEU 256 Cb 0.36 0.61 -0.01 0.00 0.50 0.00 0.00 46.19 47.65 3g65 s LEU 256 CO -0.11 -0.19 -0.01 -0.62 -1.32 0.00 0.00 176.35 174.10 3g65 s ASP 257 N -0.53 0.08 -0.07 3.68 2.15 -0.47 0.15 116.67 121.65 3g65 s ASP 257 Ca -0.06 -0.14 -0.30 0.00 0.43 0.00 0.00 52.55 52.48 3g65 s ASP 257 Cb -0.04 0.03 0.09 0.00 -0.30 0.00 0.00 42.92 42.70 3g65 s ASP 257 CO 0.01 -0.08 0.81 -0.83 -0.17 0.00 0.00 175.17 174.91 3g65 s GLY 258 N -0.39 -0.45 -0.24 2.66 0.00 -0.98 -0.05 107.32 107.86 3g65 s GLY 258 Ca -0.04 1.51 -0.18 0.00 0.00 0.00 0.00 44.72 46.00 3g65 s GLY 258 CO -0.00 0.88 0.62 -2.38 0.00 0.00 0.00 173.10 172.21 3g65 s HIS 259 N -1.51 -0.80 0.14 1.90 -3.43 -0.47 -1.94 115.29 109.18 3g65 s HIS 259 Ca -0.05 1.78 0.07 0.00 -0.80 0.00 0.00 55.06 56.06 3g65 s HIS 259 Cb -0.00 0.37 -0.04 0.00 -1.43 0.00 0.00 32.58 31.47 3g65 s HIS 259 CO 0.04 -0.40 -0.04 -0.06 -2.00 0.00 0.00 174.74 172.28 3g65 s PHE 260 N 0.87 2.81 -0.10 0.38 0.08 0.23 -1.89 117.98 120.37 3g65 s PHE 260 Ca -0.04 -0.13 -0.03 0.00 0.12 0.00 0.00 56.93 56.84 3g65 s PHE 260 Cb -0.05 -1.41 0.05 0.00 -0.57 0.00 0.00 43.02 41.04 3g65 s PHE 260 CO -0.07 0.48 0.14 0.08 -0.10 0.00 0.00 175.22 175.75 3g65 s VAL 261 N -1.50 -0.21 0.22 -0.44 1.01 0.99 -0.41 120.40 120.06 3g65 s VAL 261 Ca 0.25 0.26 0.10 0.00 0.00 0.00 0.00 61.98 62.59 3g65 s VAL 261 Cb -0.10 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.89 3g65 s VAL 261 CO 0.17 0.06 -0.15 -0.76 0.00 0.00 0.00 175.10 174.42 3g65 s LEU 262 N 2.25 2.77 0.53 3.92 1.43 -0.69 -0.41 118.68 128.48 3g65 s LEU 262 Ca 0.04 -0.76 -0.15 0.00 -1.03 0.00 0.00 54.13 52.22 3g65 s LEU 262 Cb -0.13 -1.41 -0.07 0.00 0.03 0.00 0.00 46.19 44.61 3g65 s LEU 262 CO -0.06 0.08 0.99 0.00 0.23 0.00 0.00 176.35 177.59 3g65 s ALA 263 N -1.95 3.08 -0.03 4.21 0.00 -0.65 -0.34 121.76 126.08 3g65 s ALA 263 Ca 0.26 0.12 0.06 0.00 0.00 0.00 0.00 51.96 52.40 3g65 s ALA 263 Cb -0.07 -3.10 -0.01 0.00 0.00 0.00 0.00 23.12 19.93 3g65 s ALA 263 CO 0.14 -0.31 -0.22 0.99 0.00 0.00 0.00 175.76 176.36 3g65 s THR 264 N -2.72 1.75 1.06 0.00 2.01 -1.26 -4.52 115.64 111.97 3g65 s THR 264 Ca 0.58 -0.93 -0.12 0.00 0.31 0.00 0.00 61.69 61.53 3g65 s THR 264 Cb -0.10 -1.47 0.23 0.00 0.01 0.00 0.00 72.50 71.17 3g65 s THR 264 CO 0.35 0.49 1.07 -0.76 -0.69 0.00 0.00 174.62 175.09 3g65 s LEU 265 N -0.33 1.52 0.00 4.42 1.43 -1.02 -3.56 118.68 121.14 3g65 s LEU 265 Ca 0.03 1.65 0.00 0.00 -1.03 0.00 0.00 54.13 54.78 3g65 s LEU 265 Cb -0.10 -3.75 0.00 0.00 0.03 0.00 0.00 46.19 42.37 3g65 s LEU 265 CO 0.01 -3.70 0.00 -1.54 0.23 0.00 0.00 176.35 171.35 3g65 n SER 266 N -4.59 0.08 -0.00 2.29 3.41 -1.26 -1.61 113.62 111.93 3g65 n SER 266 Ca 0.06 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.67 3g65 n SER 266 Cb 0.54 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.49 3g65 n SER 266 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3g65 n ASP 267 N 0.00 0.01 0.02 4.04 9.92 -1.26 -4.84 116.55 124.44 3g65 n ASP 267 Ca 0.00 0.04 -0.22 0.00 -0.53 0.00 0.00 54.79 54.08 3g65 n ASP 267 Cb 0.00 -0.50 -0.14 0.00 -0.64 0.00 0.00 41.12 39.84 3g65 n ASP 267 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 3g65 h THR 268 N -0.00 0.72 -3.40 -3.53 2.02 -2.02 -3.48 112.91 103.22 3g65 h THR 268 Ca 0.00 -2.38 -0.44 0.00 0.77 0.00 0.00 66.41 64.36 3g65 h THR 268 Cb 0.00 2.57 0.20 0.00 -1.74 0.00 0.00 68.15 69.18 3g65 h THR 268 CO 0.00 0.87 0.05 -1.81 0.37 0.00 0.00 175.52 175.01 3g65 s ASP 269 N -7.10 1.28 -0.28 4.18 1.11 -1.26 -4.98 116.67 109.62 3g65 s ASP 269 Ca -0.21 1.35 0.08 0.00 0.18 0.00 0.00 52.55 53.95 3g65 s ASP 269 Cb 0.06 -2.10 0.46 0.00 1.07 0.00 0.00 42.92 42.41 3g65 s ASP 269 CO 0.79 -3.99 1.19 -1.54 1.18 0.00 0.00 175.17 172.80 3g65 n SER 270 N -4.76 4.50 -2.29 0.27 3.41 -1.26 -4.46 113.62 109.03 3g65 n SER 270 Ca 0.03 -3.72 -0.03 0.00 -0.26 0.00 0.00 58.87 54.90 3g65 n SER 270 Cb 0.56 -0.36 0.01 0.00 -0.26 0.00 0.00 64.21 64.15 3g65 n SER 270 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g65 n GLY 271 N -0.75 -0.51 3.04 5.00 0.00 -1.26 -5.01 105.19 105.70 3g65 n GLY 271 Ca 0.40 0.13 -0.25 0.00 0.00 0.00 0.00 46.02 46.30 3g65 n GLY 271 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3g65 s THR 272 N -3.07 1.23 0.00 2.61 -4.23 -1.26 -4.85 115.64 106.07 3g65 s THR 272 Ca 0.08 -0.53 0.00 0.00 -1.18 0.00 0.00 61.69 60.06 3g65 s THR 272 Cb -0.01 -1.12 0.00 0.00 1.34 0.00 0.00 72.50 72.71 3g65 s THR 272 CO 0.36 0.38 0.00 0.35 -0.54 0.00 0.00 174.62 175.17