#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1k s VAL 3 N 0.00 5.04 -0.17 0.00 1.01 -1.26 -0.45 120.40 124.56 3g1k s VAL 3 Ca 0.00 1.22 -0.03 0.00 0.00 0.00 0.00 61.98 63.16 3g1k s VAL 3 Cb 0.00 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.41 3g1k s VAL 3 CO 0.00 0.15 -0.05 -0.76 0.00 0.00 0.00 175.10 174.44 3g1k s LEU 4 N 1.63 3.08 -0.23 3.92 2.01 -0.82 -4.96 118.68 123.31 3g1k s LEU 4 Ca 0.30 -0.23 -0.06 0.00 0.01 0.00 0.00 54.13 54.15 3g1k s LEU 4 Cb -0.16 -1.75 -0.02 0.00 0.01 0.00 0.00 46.19 44.27 3g1k s LEU 4 CO 0.11 0.11 0.03 -0.75 1.01 0.00 0.00 176.35 176.87 3g1k s LYS 5 N 0.68 3.57 -0.08 1.70 2.20 -1.26 -1.17 119.74 125.39 3g1k s LYS 5 Ca -0.03 -0.52 0.04 0.00 -0.36 0.00 0.00 55.97 55.10 3g1k s LYS 5 Cb -0.15 -3.19 -0.01 0.00 -1.51 0.00 0.00 37.83 32.97 3g1k s LYS 5 CO 0.02 -0.15 -0.21 0.42 -0.36 0.00 0.00 175.35 175.07 3g1k s ILE 6 N 1.45 2.41 0.09 5.43 1.01 0.90 -0.92 121.20 131.57 3g1k s ILE 6 Ca 0.05 -0.93 0.09 0.00 0.00 0.00 0.00 60.65 59.86 3g1k s ILE 6 Cb -0.15 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.36 3g1k s ILE 6 CO 0.01 0.56 -0.21 -0.63 0.00 0.00 0.00 174.94 174.68 3g1k s ILE 7 N -0.07 2.65 -0.02 2.92 -1.09 -0.72 -0.39 121.20 124.49 3g1k s ILE 7 Ca -0.05 -1.45 0.00 0.00 -2.23 0.00 0.00 60.65 56.92 3g1k s ILE 7 Cb -0.14 -2.16 0.02 0.00 -1.58 0.00 0.00 42.46 38.59 3g1k s ILE 7 CO 0.04 0.19 -0.00 -0.55 -1.23 0.00 0.00 174.94 173.39 3g1k s SER 8 N -1.84 0.32 -0.22 3.58 0.15 -0.33 0.42 113.70 115.77 3g1k s SER 8 Ca 0.16 -0.02 -0.08 0.00 0.70 0.00 0.00 55.95 56.71 3g1k s SER 8 Cb -0.10 -0.14 0.10 0.00 -1.71 0.00 0.00 66.02 64.16 3g1k s SER 8 CO 0.07 -0.07 0.48 0.86 1.20 0.00 0.00 173.24 175.78 3g1k s TRP 9 N 0.73 -0.93 -0.71 3.44 -0.00 -0.50 -1.09 118.94 119.89 3g1k s TRP 9 Ca -0.07 1.72 -0.27 0.00 -0.00 0.00 0.00 56.10 57.48 3g1k s TRP 9 Cb -0.10 0.43 0.02 0.00 -0.00 0.00 0.00 33.47 33.82 3g1k s TRP 9 CO -0.01 -0.52 1.35 1.21 -0.00 0.00 0.00 176.95 178.98 3g1k s ASN 10 N 2.63 6.06 0.02 5.86 3.84 -1.26 -1.80 114.94 130.28 3g1k s ASN 10 Ca -0.03 -0.30 0.27 0.00 0.21 0.00 0.00 52.86 53.01 3g1k s ASN 10 Cb -0.12 -2.56 0.94 0.00 -0.55 0.00 0.00 41.25 38.96 3g1k s ASN 10 CO -0.14 -1.89 1.73 0.52 -2.79 0.00 0.00 177.10 174.53 3g1k n VAL 11 N 6.52 0.05 -3.70 -5.21 0.31 -0.22 -4.14 118.33 111.95 3g1k n VAL 11 Ca 0.06 -0.03 -0.25 0.00 -0.01 0.00 0.00 64.34 64.11 3g1k n VAL 11 Cb 0.49 -0.25 0.03 0.00 -0.91 0.00 0.00 33.84 33.21 3g1k n VAL 11 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 3g1k n ASN 12 N -1.57 -2.97 -0.40 4.52 5.15 -1.24 -4.50 115.26 114.25 3g1k n ASN 12 Ca 0.06 -0.92 0.00 0.00 -0.60 0.00 0.00 54.58 53.13 3g1k n ASN 12 Cb 0.35 -3.73 0.00 0.00 -0.53 0.00 0.00 39.78 35.87 3g1k n ASN 12 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3g1k n GLY 13 N -1.66 -0.77 0.18 8.20 0.00 0.15 -4.77 105.19 106.51 3g1k n GLY 13 Ca -0.21 -0.85 -0.14 0.00 0.00 0.00 0.00 46.02 44.82 3g1k n GLY 13 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3g1k h LEU 14 N 0.00 -0.30 -0.96 0.99 5.85 -1.41 -2.37 115.31 117.11 3g1k h LEU 14 Ca 0.00 -0.11 0.29 0.00 0.84 0.00 0.00 57.88 58.90 3g1k h LEU 14 Cb 0.00 0.08 -0.17 0.00 0.37 0.00 0.00 40.66 40.94 3g1k h LEU 14 CO 0.00 -0.07 0.18 0.03 -0.34 0.00 0.00 178.44 178.24 3g1k h ARG 15 N -0.53 0.06 -0.44 1.25 3.08 -1.95 0.18 114.38 116.04 3g1k h ARG 15 Ca -0.04 -0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 3g1k h ARG 15 Cb 0.39 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 3g1k h ARG 15 CO 0.06 0.04 0.11 0.00 -1.07 0.00 0.00 179.97 179.11 3g1k h ALA 16 N 1.93 0.58 0.00 0.04 0.00 -1.78 -2.63 119.26 117.39 3g1k h ALA 16 Ca 0.63 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 55.29 3g1k h ALA 16 Cb 1.37 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 3g1k h ALA 16 CO -0.82 0.26 -0.26 -0.24 0.00 0.00 0.00 179.25 178.20 3g1k h VAL 17 N 0.58 0.51 -0.23 0.00 3.04 -0.64 -2.94 116.25 116.57 3g1k h VAL 17 Ca 0.14 -1.39 -0.09 0.00 -1.01 0.00 0.00 66.70 64.34 3g1k h VAL 17 Cb 0.31 1.99 -0.01 0.00 -2.01 0.00 0.00 31.29 31.57 3g1k h VAL 17 CO 0.00 0.25 -0.25 -0.74 -1.01 0.00 0.00 177.57 175.82 3g1k h HIS 18 N 0.00 0.49 0.00 3.17 6.17 -0.41 -2.02 115.15 122.55 3g1k h HIS 18 Ca -0.00 -0.10 0.00 0.00 0.71 0.00 0.00 60.37 60.98 3g1k h HIS 18 Cb 0.97 -0.12 0.00 0.00 2.52 0.00 0.00 27.41 30.78 3g1k h HIS 18 CO 0.00 0.65 0.00 0.54 0.71 0.00 0.00 177.93 179.83 3g1k n ARG 19 N -4.13 0.14 -2.34 5.26 1.74 -1.02 -3.23 116.66 113.09 3g1k n ARG 19 Ca -0.00 0.30 -0.30 0.00 -0.77 0.00 0.00 57.85 57.08 3g1k n ARG 19 Cb 0.40 -1.73 0.01 0.00 -1.02 0.00 0.00 32.46 30.11 3g1k n ARG 19 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3g1k n LYS 20 N -1.99 3.26 -2.69 5.56 5.02 -0.79 -4.94 118.16 121.59 3g1k n LYS 20 Ca 0.04 -4.26 -0.21 0.00 -2.02 0.00 0.00 58.31 51.85 3g1k n LYS 20 Cb 0.26 -2.26 0.01 0.00 -0.02 0.00 0.00 35.03 33.02 3g1k n LYS 20 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3g1k n GLY 21 N -0.50 -0.51 0.37 0.72 0.00 -1.20 -4.77 105.19 99.30 3g1k n GLY 21 Ca 0.43 0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.59 3g1k n GLY 21 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3g1k h PHE 22 N -0.58 0.90 -0.34 1.61 3.57 -1.60 -2.15 116.94 118.34 3g1k h PHE 22 Ca -0.49 0.02 -0.16 0.00 3.53 0.00 0.00 57.97 60.88 3g1k h PHE 22 Cb 1.35 -0.29 -0.00 0.00 2.79 0.00 0.00 35.95 39.80 3g1k h PHE 22 CO 0.57 0.39 -0.41 -0.07 -2.23 0.00 0.00 178.31 176.56 3g1k h LEU 23 N 0.81 0.95 -0.28 0.59 4.07 -1.86 0.43 115.31 120.02 3g1k h LEU 23 Ca 0.42 -0.49 0.05 0.00 0.08 0.00 0.00 57.88 57.94 3g1k h LEU 23 Cb 0.50 -0.27 -0.05 0.00 1.08 0.00 0.00 40.66 41.92 3g1k h LEU 23 CO -0.18 1.24 -0.04 0.50 -1.08 0.00 0.00 178.44 178.88 3g1k h LYS 24 N 0.67 0.04 -0.37 1.13 3.64 -1.80 -0.69 116.57 119.18 3g1k h LYS 24 Ca 0.04 -0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.30 3g1k h LYS 24 Cb 1.01 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.81 3g1k h LYS 24 CO 0.10 0.02 -0.25 2.35 -2.27 0.00 0.00 179.45 179.40 3g1k h TRP 25 N 0.04 0.96 -0.14 1.91 7.01 -1.37 -2.12 115.95 122.23 3g1k h TRP 25 Ca 0.13 -0.26 0.05 0.00 2.11 0.00 0.00 58.89 60.92 3g1k h TRP 25 Cb 0.19 -0.21 -0.06 0.00 -2.10 0.00 0.00 29.16 26.98 3g1k h TRP 25 CO -0.25 1.03 -0.34 0.35 -2.79 0.00 0.00 178.44 176.44 3g1k h PHE 26 N 0.61 -0.95 -0.28 2.65 -0.00 -0.62 -1.24 116.94 117.12 3g1k h PHE 26 Ca 0.07 0.04 -0.01 0.00 -0.00 0.00 0.00 57.97 58.07 3g1k h PHE 26 Cb 0.81 0.44 -0.01 0.00 -0.00 0.00 0.00 35.95 37.19 3g1k h PHE 26 CO 0.06 -0.41 0.12 0.52 -0.00 0.00 0.00 178.31 178.59 3g1k h MET 27 N -0.41 0.38 0.24 1.11 2.86 -1.05 -2.21 114.93 115.84 3g1k h MET 27 Ca 0.09 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 3g1k h MET 27 Cb 0.56 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.15 3g1k h MET 27 CO -0.37 0.31 -0.12 0.93 1.06 0.00 0.00 176.91 178.73 3g1k h GLU 28 N 0.38 -0.31 -0.26 1.72 5.08 -0.67 -3.35 114.58 117.17 3g1k h GLU 28 Ca 0.10 0.02 -0.17 0.00 -1.00 0.00 0.00 59.36 58.30 3g1k h GLU 28 Cb 0.07 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 3g1k h GLU 28 CO -0.01 0.02 -0.53 1.49 -1.00 0.00 0.00 179.01 178.98 3g1k h GLU 29 N -0.70 0.77 -5.31 2.33 4.57 -1.15 -3.48 114.58 111.61 3g1k h GLU 29 Ca -0.03 -0.48 -0.35 0.00 -1.18 0.00 0.00 59.36 57.32 3g1k h GLU 29 Cb 0.48 0.05 0.13 0.00 -0.16 0.00 0.00 28.75 29.25 3g1k h GLU 29 CO 0.05 1.11 -0.61 1.17 -1.18 0.00 0.00 179.01 179.55 3g1k n LYS 30 N -4.00 -7.02 -1.43 1.92 3.00 -0.84 -4.98 118.16 104.82 3g1k n LYS 30 Ca -0.04 0.74 -0.31 0.00 -0.00 0.00 0.00 58.31 58.71 3g1k n LYS 30 Cb 0.61 -5.51 0.08 0.00 0.00 0.00 0.00 35.03 30.21 3g1k n LYS 30 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 3g1k s PRO 31 N -6.09 2.37 0.18 1.64 0.04 -1.26 -4.96 135.00 126.92 3g1k s PRO 31 Ca 0.48 0.95 0.05 0.00 0.04 0.00 0.00 61.00 62.51 3g1k s PRO 31 Cb -0.21 -1.93 0.04 0.00 0.04 0.00 0.00 34.50 32.44 3g1k s PRO 31 CO 0.65 -1.50 1.41 -0.44 0.04 0.00 0.00 177.00 177.17 3g1k h ASP 32 N -1.01 0.17 -3.96 6.66 3.32 -1.41 -3.44 116.42 116.75 3g1k h ASP 32 Ca -0.45 -0.14 -0.26 0.00 0.02 0.00 0.00 57.03 56.20 3g1k h ASP 32 Cb 1.24 -0.05 -0.27 0.00 0.22 0.00 0.00 39.33 40.46 3g1k h ASP 32 CO 0.55 0.93 -0.73 -0.63 -1.72 0.00 0.00 179.24 177.64 3g1k s ILE 33 N -3.23 0.20 -0.21 0.35 1.01 -1.12 -1.85 121.20 116.36 3g1k s ILE 33 Ca -0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 60.65 60.40 3g1k s ILE 33 Cb 0.11 -0.20 0.06 0.00 0.01 0.00 0.00 42.46 42.44 3g1k s ILE 33 CO 0.81 -0.02 -0.02 -0.22 0.00 0.00 0.00 174.94 175.49 3g1k s LEU 34 N -0.26 1.90 -0.12 2.97 2.96 0.14 -1.76 118.68 124.51 3g1k s LEU 34 Ca -0.01 -0.96 -0.14 0.00 -0.22 0.00 0.00 54.13 52.80 3g1k s LEU 34 Cb -0.02 -0.92 -0.05 0.00 0.50 0.00 0.00 46.19 45.70 3g1k s LEU 34 CO -0.00 -0.25 0.34 0.00 -1.32 0.00 0.00 176.35 175.11 3g1k s LEU 36 N 0.11 2.05 0.12 0.00 1.43 0.71 -1.41 118.68 121.69 3g1k s LEU 36 Ca 0.19 -0.39 0.10 0.00 -1.03 0.00 0.00 54.13 53.01 3g1k s LEU 36 Cb -0.14 -1.08 -0.04 0.00 0.03 0.00 0.00 46.19 44.96 3g1k s LEU 36 CO 0.07 0.26 -0.25 -1.10 0.23 0.00 0.00 176.35 175.56 3g1k s GLN 37 N -0.52 1.29 -0.89 1.70 1.11 -0.75 -1.69 119.66 119.92 3g1k s GLN 37 Ca 0.08 -1.28 -0.05 0.00 0.01 0.00 0.00 55.36 54.12 3g1k s GLN 37 Cb -0.08 -1.70 -0.06 0.00 -1.01 0.00 0.00 33.01 30.16 3g1k s GLN 37 CO -0.01 0.40 0.78 0.39 0.01 0.00 0.00 175.29 176.86 3g1k n GLU 38 N 0.97 -1.90 0.14 2.91 1.02 -0.62 -1.05 120.64 122.11 3g1k n GLU 38 Ca -0.19 0.73 -0.00 0.00 -0.02 0.00 0.00 57.16 57.69 3g1k n GLU 38 Cb 0.53 -5.16 0.17 0.00 -0.02 0.00 0.00 31.44 26.97 3g1k n GLU 38 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 3g1k h ILE 39 N -0.91 1.31 0.00 -3.67 3.07 0.06 0.43 117.51 117.80 3g1k h ILE 39 Ca -0.51 -2.12 0.00 0.00 1.55 0.00 0.00 64.86 63.78 3g1k h ILE 39 Cb 1.26 2.18 0.00 0.00 -0.27 0.00 0.00 36.82 39.99 3g1k h ILE 39 CO 0.37 0.58 0.00 0.29 -1.05 0.00 0.00 178.15 178.34 3g1k n LYS 40 N -3.66 0.00 -3.11 0.16 5.02 0.16 -1.57 118.16 115.17 3g1k n LYS 40 Ca -0.01 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.94 3g1k n LYS 40 Cb 0.63 -0.30 -0.06 0.00 -0.02 0.00 0.00 35.03 35.28 3g1k n LYS 40 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3g1k s ALA 41 N 0.00 3.34 0.10 7.82 0.00 -1.26 -2.05 121.76 129.71 3g1k s ALA 41 Ca 0.00 0.11 -0.31 0.00 0.00 0.00 0.00 51.96 51.76 3g1k s ALA 41 Cb 0.00 -2.81 -0.08 0.00 0.00 0.00 0.00 23.12 20.23 3g1k s ALA 41 CO 0.00 0.32 1.40 0.00 0.00 0.00 0.00 175.76 177.48 3g1k s ALA 42 N -1.81 3.59 0.40 0.00 0.00 -1.26 -4.93 121.76 117.75 3g1k s ALA 42 Ca 0.50 1.09 0.14 0.00 0.00 0.00 0.00 51.96 53.69 3g1k s ALA 42 Cb -0.13 -3.55 0.98 0.00 0.00 0.00 0.00 23.12 20.42 3g1k s ALA 42 CO 0.19 -0.67 1.87 -1.35 0.00 0.00 0.00 175.76 175.80 3g1k h PRO 43 N 6.99 0.50 -0.57 0.00 0.11 -1.98 -0.23 132.00 136.82 3g1k h PRO 43 Ca -0.42 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3g1k h PRO 43 Cb 1.21 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3g1k h PRO 43 CO 0.87 0.33 0.00 0.39 -0.21 0.00 0.00 178.00 179.38 3g1k n GLU 44 N -4.53 0.85 0.00 1.05 4.71 -1.26 -2.58 120.64 118.88 3g1k n GLU 44 Ca 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.33 3g1k n GLU 44 Cb 0.58 -1.28 0.00 0.00 -1.01 0.00 0.00 31.44 29.73 3g1k n GLU 44 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 3g1k n GLN 45 N -0.12 3.28 -1.84 3.49 1.13 -0.10 -5.09 117.38 118.14 3g1k n GLN 45 Ca 0.00 0.00 -0.38 0.00 -1.94 0.00 0.00 57.00 54.68 3g1k n GLN 45 Cb 0.14 -0.59 0.04 0.00 0.11 0.00 0.00 30.24 29.93 3g1k n GLN 45 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3g1k s LEU 46 N -1.68 3.86 0.26 1.08 1.43 -1.06 -4.94 118.68 117.62 3g1k s LEU 46 Ca 0.00 2.70 -0.30 0.00 -1.03 0.00 0.00 54.13 55.50 3g1k s LEU 46 Cb 0.00 -4.29 -0.13 0.00 0.03 0.00 0.00 46.19 41.80 3g1k s LEU 46 CO 0.00 -1.51 1.34 -2.65 0.23 0.00 0.00 176.35 173.76 3g1k n PRO 47 N -1.00 1.96 -0.01 1.29 -0.02 -1.26 -4.86 135.00 131.09 3g1k n PRO 47 Ca 0.10 0.69 0.09 0.00 -2.02 0.00 0.00 63.50 62.36 3g1k n PRO 47 Cb 0.45 -2.31 0.50 0.00 -0.02 0.00 0.00 33.50 32.13 3g1k n PRO 47 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g1k h ARG 48 N 3.67 0.39 0.00 -0.52 3.08 -1.98 0.01 114.38 119.03 3g1k h ARG 48 Ca -0.45 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.58 3g1k h ARG 48 Cb 1.29 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.25 3g1k h ARG 48 CO 0.72 0.25 0.00 1.63 -1.07 0.00 0.00 179.97 181.50 3g1k n LYS 49 N -4.48 0.16 0.01 0.04 5.02 -1.26 -0.98 118.16 116.67 3g1k n LYS 49 Ca 0.06 0.49 -0.22 0.00 -2.02 0.00 0.00 58.31 56.62 3g1k n LYS 49 Cb 0.23 -1.88 -0.14 0.00 -0.02 0.00 0.00 35.03 33.23 3g1k n LYS 49 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3g1k h LEU 50 N 0.00 0.39 -0.44 -0.35 3.38 -1.34 -3.38 115.31 113.56 3g1k h LEU 50 Ca 0.00 -0.86 -0.11 0.00 0.09 0.00 0.00 57.88 57.00 3g1k h LEU 50 Cb 0.23 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 3g1k h LEU 50 CO 0.00 1.71 -0.53 0.08 0.09 0.00 0.00 178.44 179.79 3g1k h ARG 51 N -0.20 0.00 -2.90 1.13 0.11 -1.40 -3.38 114.38 107.74 3g1k h ARG 51 Ca -0.35 0.00 -0.63 0.00 0.10 0.00 0.00 59.98 59.10 3g1k h ARG 51 Cb 1.85 0.00 -0.41 0.00 1.11 0.00 0.00 29.97 32.52 3g1k h ARG 51 CO 0.06 0.53 -0.48 0.72 0.10 0.00 0.00 179.97 180.90 3g1k n HIS 52 N -3.41 3.48 -3.17 4.08 8.25 -0.15 -4.65 115.22 119.65 3g1k n HIS 52 Ca 0.01 -4.22 -0.39 0.00 -0.26 0.00 0.00 57.72 52.86 3g1k n HIS 52 Cb 0.66 -0.70 -0.05 0.00 1.12 0.00 0.00 29.99 31.02 3g1k n HIS 52 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3g1k s VAL 53 N -1.73 5.10 -0.01 1.59 1.01 -1.26 -4.72 120.40 120.37 3g1k s VAL 53 Ca 0.29 1.22 -0.30 0.00 0.00 0.00 0.00 61.98 63.19 3g1k s VAL 53 Cb 0.00 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.39 3g1k s VAL 53 CO -0.12 0.29 1.40 -0.70 0.00 0.00 0.00 175.10 175.98 3g1k s GLU 54 N 0.66 4.28 0.00 2.72 2.12 -1.26 -2.22 118.70 125.00 3g1k s GLU 54 Ca 0.32 1.96 0.00 0.00 0.36 0.00 0.00 54.97 57.61 3g1k s GLU 54 Cb -0.17 -3.60 0.00 0.00 0.26 0.00 0.00 34.13 30.62 3g1k s GLU 54 CO 0.15 -0.59 0.00 0.41 -0.54 0.00 0.00 175.26 174.68 3g1k n GLY 55 N 3.66 0.43 2.95 -1.50 0.00 -1.26 -5.05 105.19 104.43 3g1k n GLY 55 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 3g1k n GLY 55 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g1k s TYR 56 N -2.16 1.49 0.32 1.61 2.02 -0.94 -4.14 117.35 115.55 3g1k s TYR 56 Ca 0.00 -0.68 -0.28 0.00 -0.37 0.00 0.00 57.07 55.74 3g1k s TYR 56 Cb 0.00 -1.18 -0.09 0.00 -0.40 0.00 0.00 41.96 40.29 3g1k s TYR 56 CO 0.00 -0.43 1.06 1.03 -1.57 0.00 0.00 175.55 175.64 3g1k s ARG 57 N 1.31 4.51 -0.04 -0.62 0.52 -0.35 -4.37 118.95 119.90 3g1k s ARG 57 Ca -0.02 1.66 0.07 0.00 -0.52 0.00 0.00 55.73 56.91 3g1k s ARG 57 Cb -0.14 -2.97 -0.01 0.00 0.52 0.00 0.00 34.95 32.35 3g1k s ARG 57 CO -0.04 0.13 -0.25 -1.54 0.02 0.00 0.00 175.30 173.62 3g1k s SER 58 N -1.16 3.03 -0.13 0.23 1.04 -1.26 -1.15 113.70 114.30 3g1k s SER 58 Ca 0.49 -0.49 0.01 0.00 0.48 0.00 0.00 55.95 56.44 3g1k s SER 58 Cb -0.28 -0.62 0.02 0.00 0.10 0.00 0.00 66.02 65.24 3g1k s SER 58 CO 0.35 0.27 -0.14 -0.36 0.98 0.00 0.00 173.24 174.34 3g1k s PHE 59 N -0.35 2.05 -0.08 5.02 0.40 0.88 -4.98 117.98 120.92 3g1k s PHE 59 Ca 0.02 -1.07 0.03 0.00 -0.60 0.00 0.00 56.93 55.31 3g1k s PHE 59 Cb -0.12 -1.50 -0.02 0.00 0.51 0.00 0.00 43.02 41.89 3g1k s PHE 59 CO 0.02 -0.58 -0.18 -0.06 0.70 0.00 0.00 175.22 175.12 3g1k s PHE 60 N 1.29 2.64 -0.50 0.36 0.40 -1.26 -0.36 117.98 120.55 3g1k s PHE 60 Ca 0.00 -0.54 0.04 0.00 -0.60 0.00 0.00 56.93 55.83 3g1k s PHE 60 Cb -0.14 -1.69 0.16 0.00 0.51 0.00 0.00 43.02 41.86 3g1k s PHE 60 CO -0.07 -0.10 0.35 0.99 0.70 0.00 0.00 175.22 177.09 3g1k s THR 61 N -0.15 1.36 0.64 0.64 2.01 -0.02 -5.02 115.64 115.09 3g1k s THR 61 Ca -0.02 -3.04 -0.12 0.00 0.31 0.00 0.00 61.69 58.82 3g1k s THR 61 Cb -0.14 -1.92 -0.02 0.00 0.01 0.00 0.00 72.50 70.43 3g1k s THR 61 CO 0.04 -1.06 1.05 -2.16 -0.69 0.00 0.00 174.62 171.79 3g1k s PRO 62 N -0.24 3.25 0.85 4.92 0.04 -1.26 -2.02 135.00 140.54 3g1k s PRO 62 Ca 0.26 0.97 -0.12 0.00 0.04 0.00 0.00 61.00 62.14 3g1k s PRO 62 Cb -0.08 -2.03 0.13 0.00 0.04 0.00 0.00 34.50 32.56 3g1k s PRO 62 CO -0.12 -0.85 1.20 0.00 0.04 0.00 0.00 177.00 177.27 3g1k s ALA 63 N -2.91 2.64 -0.08 8.56 0.00 -1.26 -3.73 121.76 124.98 3g1k s ALA 63 Ca 0.59 -1.00 -0.24 0.00 0.00 0.00 0.00 51.96 51.31 3g1k s ALA 63 Cb -0.13 -2.76 -0.20 0.00 0.00 0.00 0.00 23.12 20.03 3g1k s ALA 63 CO 0.49 -1.91 0.89 0.93 0.00 0.00 0.00 175.76 176.16 3g1k h GLU 64 N -1.18 -0.06 -6.57 0.00 5.08 -1.85 -3.44 114.58 106.55 3g1k h GLU 64 Ca -0.44 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.33 3g1k h GLU 64 Cb 1.28 0.01 0.08 0.00 0.50 0.00 0.00 28.75 30.63 3g1k h GLU 64 CO 0.52 0.58 0.58 0.54 -1.00 0.00 0.00 179.01 180.23 3g1k n ARG 65 N -4.77 1.96 -2.92 2.33 1.74 -1.26 -4.98 116.66 108.75 3g1k n ARG 65 Ca -0.08 0.70 -0.34 0.00 -0.77 0.00 0.00 57.85 57.35 3g1k n ARG 65 Cb 0.33 -2.34 -0.07 0.00 -1.02 0.00 0.00 32.46 29.36 3g1k n ARG 65 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3g1k s LYS 66 N -0.47 4.25 0.00 5.56 3.01 -1.26 -3.75 119.74 127.08 3g1k s LYS 66 Ca 0.68 1.02 0.00 0.00 -1.01 0.00 0.00 55.97 56.66 3g1k s LYS 66 Cb -0.66 -2.46 0.00 0.00 -1.01 0.00 0.00 37.83 33.70 3g1k s LYS 66 CO 0.50 0.13 0.00 0.41 0.51 0.00 0.00 175.35 176.91 3g1k n GLY 67 N -0.15 0.79 3.14 -3.33 0.00 -0.88 -5.00 105.19 99.77 3g1k n GLY 67 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.80 3g1k n GLY 67 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3g1k s TYR 68 N -3.27 1.67 0.00 1.61 5.04 -0.87 -4.67 117.35 116.86 3g1k s TYR 68 Ca 0.00 -0.44 0.00 0.00 -2.44 0.00 0.00 57.07 54.19 3g1k s TYR 68 Cb 0.00 -1.12 0.00 0.00 0.35 0.00 0.00 41.96 41.19 3g1k s TYR 68 CO 0.00 -0.13 0.00 0.45 -1.34 0.00 0.00 175.55 174.53 3g1k n SER 69 N 3.02 0.00 0.00 4.32 2.88 -1.26 -4.29 113.62 118.29 3g1k n SER 69 Ca -0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 3g1k n SER 69 Cb 0.53 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 3g1k n SER 69 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3g1k n GLY 70 N 0.00 -1.92 3.37 0.46 0.00 -0.93 0.40 105.19 106.57 3g1k n GLY 70 Ca 0.00 -1.24 -0.23 0.00 0.00 0.00 0.00 46.02 44.55 3g1k n GLY 70 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3g1k s VAL 71 N -1.72 2.02 0.03 1.61 -7.23 -0.82 -1.55 120.40 112.73 3g1k s VAL 71 Ca 0.00 -2.04 -0.04 0.00 -1.81 0.00 0.00 61.98 58.09 3g1k s VAL 71 Cb 0.00 -1.99 -0.01 0.00 0.56 0.00 0.00 36.38 34.94 3g1k s VAL 71 CO 0.00 -0.31 0.07 0.00 -0.31 0.00 0.00 175.10 174.55 3g1k s ALA 72 N -2.13 -0.04 -0.04 1.32 0.00 -0.68 -0.84 121.76 119.35 3g1k s ALA 72 Ca 0.19 -0.52 -0.00 0.00 0.00 0.00 0.00 51.96 51.63 3g1k s ALA 72 Cb -0.06 0.20 0.03 0.00 0.00 0.00 0.00 23.12 23.29 3g1k s ALA 72 CO 0.08 -0.27 0.01 1.41 0.00 0.00 0.00 175.76 177.00 3g1k s MET 73 N -2.20 0.27 -0.15 0.00 1.75 0.51 -0.21 119.30 119.27 3g1k s MET 73 Ca -0.09 0.14 -0.04 0.00 -1.25 0.00 0.00 55.69 54.46 3g1k s MET 73 Cb -0.04 -0.55 -0.03 0.00 2.84 0.00 0.00 34.83 37.06 3g1k s MET 73 CO -0.03 -0.19 -0.04 0.71 -0.65 0.00 0.00 175.02 174.82 3g1k s TYR 74 N 1.36 3.02 -0.07 4.11 1.51 -0.58 -0.09 117.35 126.60 3g1k s TYR 74 Ca -0.05 -0.31 -0.05 0.00 -1.01 0.00 0.00 57.07 55.64 3g1k s TYR 74 Cb -0.13 -1.95 0.03 0.00 -0.11 0.00 0.00 41.96 39.80 3g1k s TYR 74 CO -0.03 -0.04 0.18 -0.08 -1.11 0.00 0.00 175.55 174.48 3g1k s THR 75 N 0.36 -0.02 0.08 -0.71 -1.32 -0.30 0.23 115.64 113.96 3g1k s THR 75 Ca -0.04 0.08 -0.21 0.00 -1.21 0.00 0.00 61.69 60.30 3g1k s THR 75 Cb -0.14 -0.28 -0.11 0.00 -1.51 0.00 0.00 72.50 70.46 3g1k s THR 75 CO 0.03 0.03 1.59 0.11 -2.21 0.00 0.00 174.62 174.17 3g1k h LYS 76 N 6.50 0.23 -5.10 7.08 1.57 -1.52 -0.93 116.57 124.39 3g1k h LYS 76 Ca -0.33 -0.05 -0.64 0.00 -1.87 0.00 0.00 60.65 57.77 3g1k h LYS 76 Cb 1.17 -0.03 -0.20 0.00 0.08 0.00 0.00 32.23 33.25 3g1k h LYS 76 CO 0.40 0.35 -0.60 0.08 -0.57 0.00 0.00 179.45 179.11 3g1k s VAL 77 N -5.42 4.50 0.72 0.50 1.01 -1.26 -4.59 120.40 115.85 3g1k s VAL 77 Ca -0.14 -0.12 -0.15 0.00 0.00 0.00 0.00 61.98 61.57 3g1k s VAL 77 Cb 0.06 -3.07 0.03 0.00 0.00 0.00 0.00 36.38 33.41 3g1k s VAL 77 CO 0.70 0.39 1.17 -2.16 0.00 0.00 0.00 175.10 175.21 3g1k s PRO 78 N 1.06 2.29 0.47 2.72 0.04 -1.26 -5.02 135.00 135.30 3g1k s PRO 78 Ca 0.04 1.64 -0.10 0.00 0.04 0.00 0.00 61.00 62.62 3g1k s PRO 78 Cb -0.14 -1.86 -0.06 0.00 0.04 0.00 0.00 34.50 32.48 3g1k s PRO 78 CO 0.03 -1.69 0.84 -1.25 0.04 0.00 0.00 177.00 174.97 3g1k s PRO 79 N -4.00 3.72 0.19 0.56 0.04 -1.26 -4.98 135.00 129.26 3g1k s PRO 79 Ca 0.72 0.51 -0.23 0.00 0.04 0.00 0.00 61.00 62.04 3g1k s PRO 79 Cb -0.26 -2.31 0.10 0.00 0.04 0.00 0.00 34.50 32.07 3g1k s PRO 79 CO 0.45 -0.19 1.57 0.77 0.04 0.00 0.00 177.00 179.64 3g1k h SER 80 N 0.73 -1.41 -5.48 6.66 0.02 -1.27 -3.45 113.55 109.34 3g1k h SER 80 Ca -0.47 0.26 -0.21 0.00 -0.84 0.00 0.00 61.79 60.54 3g1k h SER 80 Cb 1.19 0.68 -0.11 0.00 0.14 0.00 0.00 62.40 64.30 3g1k h SER 80 CO 0.63 -0.31 -0.34 -0.94 -1.14 0.00 0.00 176.83 174.73 3g1k s SER 81 N -5.23 0.38 -0.05 3.07 1.04 -1.25 -5.02 113.70 106.64 3g1k s SER 81 Ca -0.14 -1.29 -0.02 0.00 0.48 0.00 0.00 55.95 54.98 3g1k s SER 81 Cb 0.16 0.53 0.04 0.00 0.10 0.00 0.00 66.02 66.84 3g1k s SER 81 CO 0.68 -1.07 0.10 -0.22 0.98 0.00 0.00 173.24 173.70 3g1k s LEU 82 N -3.15 0.18 -0.06 2.42 2.96 -1.26 -1.38 118.68 118.39 3g1k s LEU 82 Ca 0.32 0.17 -0.04 0.00 -0.22 0.00 0.00 54.13 54.36 3g1k s LEU 82 Cb 0.02 0.03 -0.04 0.00 0.50 0.00 0.00 46.19 46.71 3g1k s LEU 82 CO 0.14 -0.23 0.12 -0.13 -1.32 0.00 0.00 176.35 174.93 3g1k s ARG 83 N 2.06 3.29 -0.27 1.98 0.52 0.67 -4.95 118.95 122.26 3g1k s ARG 83 Ca 0.02 -0.31 0.10 0.00 -0.52 0.00 0.00 55.73 55.02 3g1k s ARG 83 Cb -0.12 -3.03 0.46 0.00 0.52 0.00 0.00 34.95 32.77 3g1k s ARG 83 CO -0.04 0.71 1.19 0.39 0.02 0.00 0.00 175.30 177.56 3g1k n GLU 84 N 1.50 3.01 0.00 3.54 1.02 -1.26 -0.61 120.64 127.84 3g1k n GLU 84 Ca -0.15 -3.91 0.00 0.00 -0.02 0.00 0.00 57.16 53.08 3g1k n GLU 84 Cb 0.54 -2.05 0.00 0.00 -0.02 0.00 0.00 31.44 29.90 3g1k n GLU 84 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3g1k n GLY 85 N -0.74 1.06 0.10 0.62 0.00 -1.26 -4.73 105.19 100.24 3g1k n GLY 85 Ca 0.35 -0.72 0.11 0.00 0.00 0.00 0.00 46.02 45.76 3g1k n GLY 85 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3g1k n PHE 86 N -0.20 0.86 0.00 1.61 0.99 -1.26 -4.97 117.46 114.48 3g1k n PHE 86 Ca 0.00 0.25 0.00 0.00 -0.00 0.00 0.00 57.45 57.70 3g1k n PHE 86 Cb 0.00 -0.91 0.00 0.00 -1.00 0.00 0.00 39.48 37.57 3g1k n PHE 86 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3g1k n GLY 87 N 1.19 0.59 3.66 1.37 0.00 -1.26 -4.99 105.19 105.76 3g1k n GLY 87 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 3g1k n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1k s VAL 88 N -2.00 4.83 0.07 1.61 1.01 -1.26 -5.04 120.40 119.61 3g1k s VAL 88 Ca 0.00 -0.02 -0.28 0.00 0.00 0.00 0.00 61.98 61.68 3g1k s VAL 88 Cb 0.00 -3.16 -0.17 0.00 0.00 0.00 0.00 36.38 33.05 3g1k s VAL 88 CO 0.00 0.48 1.62 -0.08 0.00 0.00 0.00 175.10 177.13 3g1k h GLU 89 N 6.44 -0.45 0.00 2.72 4.81 -2.00 -2.99 114.58 123.12 3g1k h GLU 89 Ca -0.39 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 3g1k h GLU 89 Cb 1.17 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.65 3g1k h GLU 89 CO 0.69 -0.27 0.00 2.89 -0.73 0.00 0.00 179.01 181.59 3g1k n ARG 90 N -5.27 0.08 -0.06 1.92 1.85 -1.26 -1.72 116.66 112.19 3g1k n ARG 90 Ca -0.10 0.26 -0.02 0.00 -1.00 0.00 0.00 57.85 56.99 3g1k n ARG 90 Cb 0.22 -1.50 -0.15 0.00 -1.05 0.00 0.00 32.46 29.98 3g1k n ARG 90 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3g1k n PHE 91 N -1.37 0.00 0.63 2.89 0.99 -1.16 -4.60 117.46 114.85 3g1k n PHE 91 Ca 0.03 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.61 3g1k n PHE 91 Cb 0.08 -0.74 0.26 0.00 -1.00 0.00 0.00 39.48 38.08 3g1k n PHE 91 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 3g1k n ASP 92 N -2.50 0.70 -1.07 4.37 10.43 -0.70 -4.03 116.55 123.74 3g1k n ASP 92 Ca -0.20 0.24 0.10 0.00 2.57 0.00 0.00 54.79 57.50 3g1k n ASP 92 Cb 0.88 -0.13 0.26 0.00 1.84 0.00 0.00 41.12 43.98 3g1k n ASP 92 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 3g1k n THR 93 N -2.10 0.73 -0.99 -3.53 -2.24 -1.19 -4.17 114.28 100.79 3g1k n THR 93 Ca 0.04 -0.76 0.09 0.00 -2.27 0.00 0.00 64.05 61.15 3g1k n THR 93 Cb 0.43 0.46 0.23 0.00 -2.10 0.00 0.00 70.33 69.35 3g1k n THR 93 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3g1k n GLU 94 N 1.22 2.55 -3.77 -0.78 1.02 -1.26 -2.74 120.64 116.88 3g1k n GLU 94 Ca 0.20 -2.76 -0.29 0.00 -0.02 0.00 0.00 57.16 54.29 3g1k n GLU 94 Cb 0.50 -1.75 0.02 0.00 -0.02 0.00 0.00 31.44 30.20 3g1k n GLU 94 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3g1k n GLY 95 N -0.70 -0.67 0.00 0.62 0.00 -1.24 -3.87 105.19 99.33 3g1k n GLY 95 Ca 0.20 0.32 0.02 0.00 0.00 0.00 0.00 46.02 46.55 3g1k n GLY 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g1k n ARG 96 N -4.27 3.28 -4.27 1.61 1.74 -1.26 -1.94 116.66 111.55 3g1k n ARG 96 Ca -0.19 -0.01 -0.33 0.00 -0.77 0.00 0.00 57.85 56.55 3g1k n ARG 96 Cb 0.63 -0.84 -0.16 0.00 -1.02 0.00 0.00 32.46 31.07 3g1k n ARG 96 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3g1k s ILE 97 N -1.72 2.28 -0.14 0.55 1.01 -1.26 -1.45 121.20 120.47 3g1k s ILE 97 Ca 0.00 -0.88 -0.01 0.00 0.00 0.00 0.00 60.65 59.77 3g1k s ILE 97 Cb 0.02 -1.96 0.03 0.00 0.01 0.00 0.00 42.46 40.57 3g1k s ILE 97 CO 0.13 0.53 -0.06 -1.10 0.00 0.00 0.00 174.94 174.44 3g1k s GLN 98 N 1.15 1.43 -0.35 2.79 -0.21 -0.49 -4.22 119.66 119.75 3g1k s GLN 98 Ca 0.01 -0.39 0.01 0.00 0.02 0.00 0.00 55.36 55.01 3g1k s GLN 98 Cb -0.14 -1.81 0.09 0.00 1.00 0.00 0.00 33.01 32.15 3g1k s GLN 98 CO -0.08 -0.37 0.08 0.42 -2.12 0.00 0.00 175.29 173.22 3g1k s ILE 99 N 1.68 2.73 -0.17 1.08 1.01 0.22 0.15 121.20 127.91 3g1k s ILE 99 Ca 0.03 -2.02 -0.05 0.00 0.00 0.00 0.00 60.65 58.61 3g1k s ILE 99 Cb -0.14 -2.85 -0.03 0.00 0.01 0.00 0.00 42.46 39.45 3g1k s ILE 99 CO -0.08 -0.49 -0.01 0.00 0.00 0.00 0.00 174.94 174.36 3g1k s ALA 100 N 1.06 3.11 -0.40 9.38 0.00 -0.42 -0.24 121.76 134.25 3g1k s ALA 100 Ca 0.05 -0.83 -0.19 0.00 0.00 0.00 0.00 51.96 50.99 3g1k s ALA 100 Cb -0.21 -1.68 0.01 0.00 0.00 0.00 0.00 23.12 21.24 3g1k s ALA 100 CO -0.05 0.14 0.57 0.34 0.00 0.00 0.00 175.76 176.76 3g1k s ASP 101 N 0.47 6.31 -0.33 0.00 -1.08 -0.48 -0.66 116.67 120.90 3g1k s ASP 101 Ca -0.01 -0.27 0.09 0.00 -0.52 0.00 0.00 52.55 51.84 3g1k s ASP 101 Cb -0.14 -2.29 0.65 0.00 -1.46 0.00 0.00 42.92 39.68 3g1k s ASP 101 CO 0.02 -0.65 1.71 0.49 0.52 0.00 0.00 175.17 177.26 3g1k n PHE 102 N 5.99 2.10 0.00 -5.34 3.01 -0.15 -0.67 117.46 122.41 3g1k n PHE 102 Ca -0.03 -1.41 0.00 0.00 1.01 0.00 0.00 57.45 57.02 3g1k n PHE 102 Cb 0.48 -0.66 0.00 0.00 -0.01 0.00 0.00 39.48 39.29 3g1k n PHE 102 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 3g1k n ASP 103 N -0.66 0.00 0.15 4.37 8.00 -1.26 -4.09 116.55 123.05 3g1k n ASP 103 Ca 0.41 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.93 3g1k n ASP 103 Cb 1.32 0.00 0.17 0.00 -0.02 0.00 0.00 41.12 42.58 3g1k n ASP 103 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 3g1k h ASP 104 N 0.00 0.00 -5.07 -2.24 3.32 -1.96 -3.47 116.42 107.00 3g1k h ASP 104 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 3g1k h ASP 104 Cb 0.00 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 39.45 3g1k h ASP 104 CO 0.00 0.55 0.08 0.72 -1.72 0.00 0.00 179.24 178.87 3g1k s PHE 105 N -3.33 -0.17 -0.08 4.55 -0.71 -1.26 -4.52 117.98 112.46 3g1k s PHE 105 Ca 0.01 -0.17 -0.04 0.00 -1.04 0.00 0.00 56.93 55.69 3g1k s PHE 105 Cb 0.10 0.46 -0.04 0.00 -1.21 0.00 0.00 43.02 42.33 3g1k s PHE 105 CO 0.73 -0.96 0.09 -0.51 -1.34 0.00 0.00 175.22 173.24 3g1k s LEU 106 N -2.87 4.08 -0.26 -1.99 1.43 0.78 -0.98 118.68 118.87 3g1k s LEU 106 Ca 0.09 0.31 -0.01 0.00 -1.03 0.00 0.00 54.13 53.49 3g1k s LEU 106 Cb -0.02 -2.08 0.04 0.00 0.03 0.00 0.00 46.19 44.16 3g1k s LEU 106 CO -0.02 0.36 -0.06 -0.22 0.23 0.00 0.00 176.35 176.64 3g1k s LEU 107 N -1.19 3.41 -0.35 1.79 2.96 0.17 -0.46 118.68 125.00 3g1k s LEU 107 Ca 0.17 -1.08 -0.19 0.00 -0.22 0.00 0.00 54.13 52.81 3g1k s LEU 107 Cb -0.12 -1.65 -0.00 0.00 0.50 0.00 0.00 46.19 44.92 3g1k s LEU 107 CO 0.07 -0.17 0.54 -0.31 -1.32 0.00 0.00 176.35 175.15 3g1k s TYR 108 N 1.26 3.17 -0.45 5.38 1.51 0.21 -1.30 117.35 127.14 3g1k s TYR 108 Ca -0.03 0.19 -0.12 0.00 -1.01 0.00 0.00 57.07 56.11 3g1k s TYR 108 Cb -0.18 -2.98 0.09 0.00 -0.11 0.00 0.00 41.96 38.78 3g1k s TYR 108 CO -0.04 -0.57 0.33 1.21 -1.11 0.00 0.00 175.55 175.37 3g1k s ASN 109 N 1.77 5.84 -0.02 2.29 2.47 0.12 -0.79 114.94 126.63 3g1k s ASN 109 Ca 0.20 -1.54 0.07 0.00 0.42 0.00 0.00 52.86 52.01 3g1k s ASN 109 Cb -0.15 -2.07 -0.02 0.00 -1.45 0.00 0.00 41.25 37.56 3g1k s ASN 109 CO 0.14 -0.62 -0.24 -0.63 -3.72 0.00 0.00 177.10 172.03 3g1k s ILE 110 N 1.49 1.88 -0.57 -5.21 -1.09 -0.68 -1.40 121.20 115.62 3g1k s ILE 110 Ca 0.04 -1.01 0.01 0.00 -2.23 0.00 0.00 60.65 57.46 3g1k s ILE 110 Cb -0.24 -1.56 0.15 0.00 -1.58 0.00 0.00 42.46 39.22 3g1k s ILE 110 CO 0.03 0.53 0.35 -0.47 -1.23 0.00 0.00 174.94 174.15 3g1k s TYR 111 N -0.52 3.28 0.72 3.97 5.04 -0.53 -2.61 117.35 126.70 3g1k s TYR 111 Ca 0.08 -3.01 -0.16 0.00 -2.44 0.00 0.00 57.07 51.55 3g1k s TYR 111 Cb -0.09 -2.97 0.03 0.00 0.35 0.00 0.00 41.96 39.27 3g1k s TYR 111 CO -0.01 -0.77 1.22 -0.06 -1.34 0.00 0.00 175.55 174.59 3g1k s PHE 112 N -0.27 2.05 0.80 4.97 0.40 -0.17 -4.78 117.98 120.98 3g1k s PHE 112 Ca 0.17 1.58 -0.14 0.00 -0.60 0.00 0.00 56.93 57.95 3g1k s PHE 112 Cb -0.23 -3.52 0.19 0.00 0.51 0.00 0.00 43.02 39.97 3g1k s PHE 112 CO -0.02 -2.68 0.98 -2.30 0.70 0.00 0.00 175.22 171.90 3g1k n PRO 113 N -2.57 -1.40 -4.32 0.24 -0.02 -1.26 -4.75 135.00 120.92 3g1k n PRO 113 Ca 0.14 -1.52 -0.18 0.00 -2.02 0.00 0.00 63.50 59.92 3g1k n PRO 113 Cb 0.50 -1.10 -0.15 0.00 -0.02 0.00 0.00 33.50 32.73 3g1k n PRO 113 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3g1k s ASN 114 N -4.49 0.96 -0.82 2.55 6.03 -1.26 -4.70 114.94 113.20 3g1k s ASN 114 Ca 0.57 -0.15 -0.03 0.00 -1.03 0.00 0.00 52.86 52.23 3g1k s ASN 114 Cb -0.02 -0.13 0.24 0.00 -3.03 0.00 0.00 41.25 38.31 3g1k s ASN 114 CO 0.41 0.09 2.23 0.61 -2.03 0.00 0.00 177.10 178.41 3g1k n GLY 115 N 2.94 5.29 3.73 0.45 0.00 -1.26 -4.60 105.19 111.75 3g1k n GLY 115 Ca -0.14 -2.30 -0.27 0.00 0.00 0.00 0.00 46.02 43.31 3g1k n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g1k s LYS 116 N -3.20 2.66 0.00 1.61 1.02 -1.26 -4.14 119.74 116.43 3g1k s LYS 116 Ca 0.52 -0.96 0.00 0.00 0.02 0.00 0.00 55.97 55.55 3g1k s LYS 116 Cb 0.35 -2.52 0.00 0.00 -0.52 0.00 0.00 37.83 35.15 3g1k s LYS 116 CO -0.28 0.48 0.00 -1.33 -0.92 0.00 0.00 175.35 173.30 3g1k n MET 117 N -0.13 0.00 -3.83 1.68 2.81 -1.26 -4.81 117.12 111.57 3g1k n MET 117 Ca -0.09 0.00 -0.06 0.00 -1.81 0.00 0.00 57.70 55.74 3g1k n MET 117 Cb 0.54 -0.38 0.01 0.00 -0.71 0.00 0.00 33.22 32.68 3g1k n MET 117 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3g1k s SER 118 N -0.43 -0.05 0.03 7.83 1.04 -1.26 -5.05 113.70 115.81 3g1k s SER 118 Ca 0.00 -0.82 0.05 0.00 0.48 0.00 0.00 55.95 55.66 3g1k s SER 118 Cb 0.00 0.67 -0.24 0.00 0.10 0.00 0.00 66.02 66.55 3g1k s SER 118 CO 0.00 -1.30 0.94 -0.33 0.98 0.00 0.00 173.24 173.53 3g1k h GLU 119 N 2.00 0.08 -0.37 4.02 4.39 -1.92 -3.23 114.58 119.56 3g1k h GLU 119 Ca -0.28 -0.14 -0.06 0.00 0.34 0.00 0.00 59.36 59.22 3g1k h GLU 119 Cb 1.24 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.93 3g1k h GLU 119 CO 0.35 0.88 0.01 0.93 -1.16 0.00 0.00 179.01 180.02 3g1k h GLU 120 N 0.02 0.65 -0.64 2.33 4.39 -1.96 0.31 114.58 119.68 3g1k h GLU 120 Ca -0.18 -0.20 0.08 0.00 0.34 0.00 0.00 59.36 59.40 3g1k h GLU 120 Cb 1.93 -0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 30.45 3g1k h GLU 120 CO 0.12 0.74 0.31 0.00 -1.16 0.00 0.00 179.01 179.02 3g1k h ARG 121 N 0.47 0.53 -0.32 2.33 2.47 -1.88 0.58 114.38 118.56 3g1k h ARG 121 Ca 0.11 -0.03 -0.02 0.00 -1.26 0.00 0.00 59.98 58.78 3g1k h ARG 121 Cb 0.44 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.63 3g1k h ARG 121 CO 0.02 0.35 0.14 1.25 0.56 0.00 0.00 179.97 182.29 3g1k h LEU 122 N 0.55 0.43 -0.45 3.04 6.46 -1.48 -2.17 115.31 121.69 3g1k h LEU 122 Ca 0.31 -0.15 0.05 0.00 -0.12 0.00 0.00 57.88 57.97 3g1k h LEU 122 Cb 0.30 -0.11 -0.05 0.00 -0.73 0.00 0.00 40.66 40.07 3g1k h LEU 122 CO -0.24 0.46 0.18 0.50 -0.62 0.00 0.00 178.44 178.72 3g1k h LYS 123 N 0.37 0.36 -0.82 1.25 3.64 0.33 -1.19 116.57 120.51 3g1k h LYS 123 Ca 0.11 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.46 3g1k h LYS 123 Cb 0.16 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.86 3g1k h LYS 123 CO -0.01 0.24 0.48 -0.92 -2.27 0.00 0.00 179.45 176.96 3g1k h TYR 124 N 0.37 1.10 -0.01 1.91 3.20 -0.88 0.83 116.97 123.49 3g1k h TYR 124 Ca 0.21 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.09 3g1k h TYR 124 Cb 0.18 -0.36 -0.03 0.00 1.54 0.00 0.00 36.73 38.07 3g1k h TYR 124 CO -0.14 0.74 -0.11 -0.22 -1.64 0.00 0.00 178.16 176.79 3g1k h LYS 125 N 1.13 -0.18 -0.41 1.82 3.64 -0.70 0.19 116.57 122.06 3g1k h LYS 125 Ca 0.29 0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.57 3g1k h LYS 125 Cb -0.02 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 3g1k h LYS 125 CO -0.05 -0.12 -0.21 -0.07 -2.27 0.00 0.00 179.45 176.72 3g1k h LEU 126 N -0.19 0.83 -0.67 5.20 4.07 -0.94 0.19 115.31 123.81 3g1k h LEU 126 Ca 0.05 -0.30 -0.11 0.00 0.08 0.00 0.00 57.88 57.60 3g1k h LEU 126 Cb 0.25 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.74 3g1k h LEU 126 CO -0.12 1.02 -0.15 -0.33 -1.08 0.00 0.00 178.44 177.79 3g1k h GLU 127 N 0.72 0.89 -0.08 1.13 5.08 -0.80 -1.38 114.58 120.13 3g1k h GLU 127 Ca 0.10 -0.33 0.01 0.00 -1.00 0.00 0.00 59.36 58.14 3g1k h GLU 127 Cb 0.74 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 3g1k h GLU 127 CO 0.06 0.97 0.02 0.35 -1.00 0.00 0.00 179.01 179.41 3g1k h PHE 128 N 0.79 0.03 -0.53 4.33 3.57 -0.47 0.23 116.94 124.90 3g1k h PHE 128 Ca 0.12 0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.73 3g1k h PHE 128 Cb 0.67 -0.00 -0.10 0.00 2.79 0.00 0.00 35.95 39.31 3g1k h PHE 128 CO 0.04 0.01 -0.19 1.88 -2.23 0.00 0.00 178.31 177.82 3g1k h TYR 129 N 0.05 -0.46 0.22 0.41 0.99 -0.44 -1.02 116.97 116.72 3g1k h TYR 129 Ca 0.04 0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.82 3g1k h TYR 129 Cb 0.03 0.28 -0.01 0.00 1.00 0.00 0.00 36.73 38.03 3g1k h TYR 129 CO -0.10 -0.28 -0.19 -0.44 -0.00 0.00 0.00 178.16 177.15 3g1k h ASP 130 N -0.07 -0.49 -0.92 3.88 3.32 -0.73 -0.44 116.42 120.97 3g1k h ASP 130 Ca 0.25 0.04 0.14 0.00 0.02 0.00 0.00 57.03 57.48 3g1k h ASP 130 Cb 0.45 0.16 -0.07 0.00 0.22 0.00 0.00 39.33 40.09 3g1k h ASP 130 CO -0.58 -0.29 0.59 0.00 -1.72 0.00 0.00 179.24 177.24 3g1k h ALA 131 N 0.31 1.75 -0.35 3.45 0.00 -0.58 -0.48 119.26 123.37 3g1k h ALA 131 Ca -0.01 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 3g1k h ALA 131 Cb 0.38 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3g1k h ALA 131 CO -0.03 0.00 -0.17 0.35 0.00 0.00 0.00 179.25 179.41 3g1k h PHE 132 N 0.77 0.84 -0.44 0.00 3.57 -0.73 -2.01 116.94 118.93 3g1k h PHE 132 Ca 0.46 -0.21 -0.04 0.00 3.53 0.00 0.00 57.97 61.71 3g1k h PHE 132 Cb 0.66 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.19 3g1k h PHE 132 CO -0.00 0.93 0.13 1.25 -2.23 0.00 0.00 178.31 178.39 3g1k h LEU 133 N 0.51 0.64 -1.17 0.59 7.12 0.20 -0.96 115.31 122.24 3g1k h LEU 133 Ca 0.08 -0.21 -0.02 0.00 0.13 0.00 0.00 57.88 57.86 3g1k h LEU 133 Cb 0.71 -0.17 -0.03 0.00 -0.53 0.00 0.00 40.66 40.64 3g1k h LEU 133 CO 0.05 0.68 0.32 -0.08 -0.13 0.00 0.00 178.44 179.28 3g1k h GLU 134 N 0.57 0.90 -0.22 1.25 4.81 -1.13 -1.88 114.58 118.88 3g1k h GLU 134 Ca 0.14 -0.11 -0.08 0.00 -0.13 0.00 0.00 59.36 59.18 3g1k h GLU 134 Cb 0.27 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.47 3g1k h GLU 134 CO -0.00 0.69 -0.19 0.22 -0.73 0.00 0.00 179.01 179.00 3g1k h ASP 135 N 0.90 0.54 0.18 1.04 3.58 -0.91 -2.79 116.42 118.96 3g1k h ASP 135 Ca 0.22 -0.46 -0.11 0.00 0.42 0.00 0.00 57.03 57.11 3g1k h ASP 135 Cb 0.08 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 40.96 3g1k h ASP 135 CO -0.03 0.89 -0.39 1.62 -2.88 0.00 0.00 179.24 178.45 3g1k h VAL 136 N 0.20 1.30 -0.15 2.25 3.04 -1.04 -2.96 116.25 118.88 3g1k h VAL 136 Ca 0.04 -1.47 -0.04 0.00 -1.01 0.00 0.00 66.70 64.22 3g1k h VAL 136 Cb 0.73 1.63 -0.00 0.00 -2.01 0.00 0.00 31.29 31.63 3g1k h VAL 136 CO 0.05 0.44 -0.07 0.78 -1.01 0.00 0.00 177.57 177.76 3g1k h ASN 137 N 0.24 0.32 -0.93 3.17 2.35 -1.35 -0.59 115.58 118.78 3g1k h ASN 137 Ca 0.02 -0.41 0.14 0.00 -0.55 0.00 0.00 56.30 55.50 3g1k h ASN 137 Cb 0.79 -0.09 -0.09 0.00 0.05 0.00 0.00 38.32 38.98 3g1k h ASN 137 CO 0.06 0.66 0.54 -0.09 -1.65 0.00 0.00 177.43 176.95 3g1k h ARG 138 N -0.02 0.79 -0.16 0.81 2.43 -1.48 0.51 114.38 117.26 3g1k h ARG 138 Ca 0.03 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 59.01 3g1k h ARG 138 Cb 0.53 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 3g1k h ARG 138 CO 0.02 0.52 -0.46 0.93 -1.51 0.00 0.00 179.97 179.47 3g1k h GLU 139 N 0.81 0.59 -0.41 0.20 4.39 -1.41 -2.95 114.58 115.79 3g1k h GLU 139 Ca 0.48 -0.43 -0.05 0.00 0.34 0.00 0.00 59.36 59.71 3g1k h GLU 139 Cb 0.59 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.29 3g1k h GLU 139 CO -0.31 1.05 0.08 -0.09 -1.16 0.00 0.00 179.01 178.57 3g1k h ARG 140 N 0.24 0.68 0.00 2.33 1.12 -0.60 -2.84 114.38 115.31 3g1k h ARG 140 Ca -0.01 -0.18 -0.00 0.00 -1.11 0.00 0.00 59.98 58.68 3g1k h ARG 140 Cb 1.08 -0.08 -0.00 0.00 -0.01 0.00 0.00 29.97 30.96 3g1k h ARG 140 CO 0.10 0.71 -0.00 -0.44 -3.11 0.00 0.00 179.97 177.23 3g1k h ASP 141 N 0.53 0.00 -0.05 -3.80 3.32 -0.02 -0.15 116.42 116.25 3g1k h ASP 141 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 3g1k h ASP 141 Cb 0.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.91 3g1k h ASP 141 CO 0.01 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 175.99 3g1k n SER 142 N -3.96 0.57 0.00 6.45 3.41 -1.12 -4.89 113.62 114.09 3g1k n SER 142 Ca -0.03 -1.47 0.00 0.00 -0.26 0.00 0.00 58.87 57.11 3g1k n SER 142 Cb 0.09 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 3g1k n SER 142 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g1k n GLY 143 N 0.93 0.70 3.88 5.00 0.00 -0.07 -5.07 105.19 110.56 3g1k n GLY 143 Ca 0.16 -0.48 -0.31 0.00 0.00 0.00 0.00 46.02 45.38 3g1k n GLY 143 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g1k s ARG 144 N -0.93 3.78 -0.19 1.61 1.81 -1.09 -5.05 118.95 118.90 3g1k s ARG 144 Ca 0.00 0.26 -0.10 0.00 -1.72 0.00 0.00 55.73 54.16 3g1k s ARG 144 Cb 0.00 -2.62 -0.05 0.00 -0.45 0.00 0.00 34.95 31.83 3g1k s ARG 144 CO 0.00 0.27 0.15 -0.80 -0.68 0.00 0.00 175.30 174.24 3g1k s ASN 145 N -2.53 6.24 -0.00 0.23 0.01 -1.26 -4.35 114.94 113.27 3g1k s ASN 145 Ca 0.47 0.26 0.03 0.00 -0.71 0.00 0.00 52.86 52.92 3g1k s ASN 145 Cb -0.11 -2.10 -0.03 0.00 0.41 0.00 0.00 41.25 39.42 3g1k s ASN 145 CO 0.23 0.17 -0.07 0.68 -1.51 0.00 0.00 177.10 176.61 3g1k s VAL 146 N 0.35 3.67 -0.14 1.60 -7.23 -1.26 -0.15 120.40 117.23 3g1k s VAL 146 Ca 0.09 -0.74 0.00 0.00 -1.81 0.00 0.00 61.98 59.52 3g1k s VAL 146 Cb -0.11 -2.59 0.03 0.00 0.56 0.00 0.00 36.38 34.27 3g1k s VAL 146 CO -0.01 0.42 -0.11 -0.63 -0.31 0.00 0.00 175.10 174.45 3g1k s ILE 147 N -0.98 1.38 -0.20 -0.62 1.01 0.39 -3.37 121.20 118.81 3g1k s ILE 147 Ca 0.17 -0.56 -0.04 0.00 0.00 0.00 0.00 60.65 60.22 3g1k s ILE 147 Cb -0.11 -1.35 -0.01 0.00 0.01 0.00 0.00 42.46 40.99 3g1k s ILE 147 CO 0.07 0.39 -0.05 -0.63 0.00 0.00 0.00 174.94 174.72 3g1k s ILE 148 N 1.56 3.50 0.20 2.92 1.09 0.20 0.68 121.20 131.34 3g1k s ILE 148 Ca 0.04 -0.46 0.05 0.00 -1.10 0.00 0.00 60.65 59.18 3g1k s ILE 148 Cb -0.13 -2.57 -0.05 0.00 -1.06 0.00 0.00 42.46 38.65 3g1k s ILE 148 CO -0.10 0.44 -0.07 0.00 -0.10 0.00 0.00 174.94 175.12 3g1k n GLY 150 N -0.35 0.81 3.56 0.00 0.00 -1.06 -1.69 105.19 106.47 3g1k n GLY 150 Ca -0.08 -2.01 -0.43 0.00 0.00 0.00 0.00 46.02 43.51 3g1k n GLY 150 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3g1k s ASP 151 N -4.00 6.49 0.07 1.61 2.15 -1.07 -2.42 116.67 119.50 3g1k s ASP 151 Ca 0.00 0.11 0.25 0.00 0.43 0.00 0.00 52.55 53.34 3g1k s ASP 151 Cb 0.00 -2.43 0.57 0.00 -0.30 0.00 0.00 42.92 40.75 3g1k s ASP 151 CO 0.00 -0.98 1.48 0.49 -0.17 0.00 0.00 175.17 175.99 3g1k n PHE 152 N 6.98 0.32 -1.77 -5.34 3.01 -0.08 -0.99 117.46 119.59 3g1k n PHE 152 Ca 0.05 0.09 -0.20 0.00 1.01 0.00 0.00 57.45 58.41 3g1k n PHE 152 Cb 0.48 -0.52 -0.07 0.00 -0.01 0.00 0.00 39.48 39.36 3g1k n PHE 152 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 3g1k n ASN 153 N -1.83 -5.27 -3.70 4.37 3.02 -1.25 -4.81 115.26 105.79 3g1k n ASN 153 Ca 0.05 0.37 -0.11 0.00 -0.03 0.00 0.00 54.58 54.86 3g1k n ASN 153 Cb 0.39 -4.61 -0.12 0.00 -0.61 0.00 0.00 39.78 34.83 3g1k n ASN 153 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3g1k s THR 154 N -2.74 -0.19 -0.01 3.41 2.01 -1.26 -4.30 115.64 112.56 3g1k s THR 154 Ca 0.00 0.16 -0.29 0.00 0.31 0.00 0.00 61.69 61.87 3g1k s THR 154 Cb 0.00 -0.50 -0.03 0.00 0.01 0.00 0.00 72.50 71.98 3g1k s THR 154 CO 0.00 0.07 0.92 0.00 -0.69 0.00 0.00 174.62 174.92 3g1k s ALA 155 N 1.70 3.20 -0.00 7.40 0.00 -0.81 -4.62 121.76 128.64 3g1k s ALA 155 Ca -0.06 0.45 -0.18 0.00 0.00 0.00 0.00 51.96 52.17 3g1k s ALA 155 Cb -0.10 -3.26 -0.10 0.00 0.00 0.00 0.00 23.12 19.66 3g1k s ALA 155 CO -0.10 -0.21 0.88 1.25 0.00 0.00 0.00 175.76 177.58 3g1k h HIS 156 N 6.79 -0.59 -0.61 0.00 2.76 -1.89 -3.45 115.15 118.17 3g1k h HIS 156 Ca -0.41 -0.01 -0.65 0.00 -2.20 0.00 0.00 60.37 57.10 3g1k h HIS 156 Cb 1.21 0.20 -0.11 0.00 1.55 0.00 0.00 27.41 30.26 3g1k h HIS 156 CO 0.67 -0.37 -0.48 1.03 -1.30 0.00 0.00 177.93 177.49 3g1k s ARG 157 N -3.79 2.19 0.41 5.26 0.52 -1.26 -4.77 118.95 117.52 3g1k s ARG 157 Ca -0.09 -2.26 0.07 0.00 -0.52 0.00 0.00 55.73 52.93 3g1k s ARG 157 Cb 0.01 -1.69 0.87 0.00 0.52 0.00 0.00 34.95 34.66 3g1k s ARG 157 CO 0.28 -0.37 2.06 0.93 0.02 0.00 0.00 175.30 178.23 3g1k h GLU 158 N 1.27 0.52 0.00 3.54 5.08 -1.95 -1.48 114.58 121.57 3g1k h GLU 158 Ca -0.42 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 3g1k h GLU 158 Cb 1.30 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.43 3g1k h GLU 158 CO 0.71 0.35 0.00 1.51 -1.00 0.00 0.00 179.01 180.58 3g1k n ILE 159 N -4.48 0.45 -0.54 3.13 3.06 -1.26 -2.96 119.36 116.77 3g1k n ILE 159 Ca 0.03 0.11 0.10 0.00 -2.50 0.00 0.00 62.75 60.49 3g1k n ILE 159 Cb 0.06 -0.90 0.33 0.00 0.54 0.00 0.00 39.64 39.67 3g1k n ILE 159 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 3g1k n ASP 160 N -1.19 4.41 -3.52 9.51 8.00 -0.56 -4.21 116.55 128.99 3g1k n ASP 160 Ca 0.07 -2.31 -0.16 0.00 0.71 0.00 0.00 54.79 53.10 3g1k n ASP 160 Cb 0.08 -0.53 -0.06 0.00 -0.02 0.00 0.00 41.12 40.60 3g1k n ASP 160 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 3g1k s LEU 161 N -1.58 -0.60 0.08 0.64 2.34 -1.16 -1.08 118.68 117.33 3g1k s LEU 161 Ca 0.49 0.61 -0.35 0.00 0.06 0.00 0.00 54.13 54.93 3g1k s LEU 161 Cb 0.30 2.42 -0.18 0.00 -0.56 0.00 0.00 46.19 48.17 3g1k s LEU 161 CO 0.26 -0.59 1.58 0.00 -1.06 0.00 0.00 176.35 176.54 3g1k h ALA 162 N 2.84 -1.11 -3.17 1.48 0.00 -1.52 -3.36 119.26 114.43 3g1k h ALA 162 Ca -0.26 -0.21 -0.70 0.00 0.00 0.00 0.00 54.91 53.75 3g1k h ALA 162 Cb 1.16 0.60 -0.36 0.00 0.00 0.00 0.00 17.79 19.19 3g1k h ALA 162 CO 0.37 -1.15 -0.35 1.03 0.00 0.00 0.00 179.25 179.15 3g1k s ARG 163 N -5.95 2.60 0.12 0.00 0.52 -1.26 -4.92 118.95 110.06 3g1k s ARG 163 Ca -0.18 -2.60 -0.13 0.00 -0.52 0.00 0.00 55.73 52.30 3g1k s ARG 163 Cb 0.04 -3.74 -0.09 0.00 0.52 0.00 0.00 34.95 31.68 3g1k s ARG 163 CO 0.61 -1.18 1.40 -1.00 0.02 0.00 0.00 175.30 175.15 3g1k h PRO 164 N 6.92 0.84 -0.49 3.54 0.13 -1.85 -3.32 132.00 137.77 3g1k h PRO 164 Ca -0.00 -0.51 -0.05 0.00 -0.87 0.00 0.00 66.00 64.57 3g1k h PRO 164 Cb 0.94 0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.10 3g1k h PRO 164 CO 0.72 1.15 0.13 0.87 -0.23 0.00 0.00 178.00 180.63 3g1k h LYS 165 N 0.61 0.78 -0.00 0.86 1.57 -1.96 -2.12 116.57 116.30 3g1k h LYS 165 Ca 0.02 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 3g1k h LYS 165 Cb 1.09 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.29 3g1k h LYS 165 CO 0.11 0.75 -0.05 -0.85 -0.57 0.00 0.00 179.45 178.84 3g1k n GLU 166 N -4.48 0.87 -0.00 3.15 0.00 -1.26 -3.96 120.64 114.95 3g1k n GLU 166 Ca 0.01 -0.23 0.06 0.00 0.00 0.00 0.00 57.16 56.99 3g1k n GLU 166 Cb 0.21 -1.50 -0.07 0.00 0.00 0.00 0.00 31.44 30.09 3g1k n GLU 166 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3g1k n ASN 167 N -0.86 1.10 0.00 -1.84 3.02 -0.89 -4.63 115.26 111.16 3g1k n ASN 167 Ca 0.18 -0.52 0.04 0.00 -0.03 0.00 0.00 54.58 54.24 3g1k n ASN 167 Cb 0.24 1.17 0.19 0.00 -0.61 0.00 0.00 39.78 40.77 3g1k n ASN 167 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3g1k n SER 168 N -1.47 0.00 -0.70 6.41 3.41 -0.85 0.31 113.62 120.73 3g1k n SER 168 Ca 0.01 0.22 0.07 0.00 -0.26 0.00 0.00 58.87 58.90 3g1k n SER 168 Cb 0.22 -0.31 0.13 0.00 -0.26 0.00 0.00 64.21 63.99 3g1k n SER 168 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3g1k n ASN 169 N -1.31 2.69 -4.77 4.04 0.23 -1.26 -4.29 115.26 110.60 3g1k n ASN 169 Ca 0.03 -1.80 -0.35 0.00 -0.53 0.00 0.00 54.58 51.93 3g1k n ASN 169 Cb 0.07 -0.15 -0.08 0.00 -2.08 0.00 0.00 39.78 37.54 3g1k n ASN 169 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 3g1k s VAL 170 N -1.09 4.80 0.17 3.53 1.01 0.15 -4.98 120.40 123.99 3g1k s VAL 170 Ca 0.23 -0.10 -0.32 0.00 0.00 0.00 0.00 61.98 61.80 3g1k s VAL 170 Cb 0.14 -3.07 -0.12 0.00 0.00 0.00 0.00 36.38 33.33 3g1k s VAL 170 CO 0.19 0.58 1.74 -0.24 0.00 0.00 0.00 175.10 177.37 3g1k n SER 171 N 1.98 3.88 0.00 3.32 2.88 -1.26 -2.39 113.62 122.03 3g1k n SER 171 Ca -0.19 1.04 0.00 0.00 -1.33 0.00 0.00 58.87 58.40 3g1k n SER 171 Cb 0.54 -1.54 0.00 0.00 -0.75 0.00 0.00 64.21 62.46 3g1k n SER 171 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3g1k n GLY 172 N 3.98 0.96 0.45 0.46 0.00 -1.26 -4.88 105.19 104.89 3g1k n GLY 172 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3g1k n GLY 172 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3g1k n PHE 173 N 0.00 0.00 -1.82 1.61 7.35 -1.01 -1.92 117.46 121.67 3g1k n PHE 173 Ca 0.00 0.00 -0.40 0.00 -0.76 0.00 0.00 57.45 56.29 3g1k n PHE 173 Cb 0.00 0.01 0.02 0.00 0.35 0.00 0.00 39.48 39.85 3g1k n PHE 173 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 3g1k s LEU 174 N 0.00 4.11 0.40 -2.13 1.43 -1.19 -4.49 118.68 116.81 3g1k s LEU 174 Ca 0.00 2.89 0.12 0.00 -1.03 0.00 0.00 54.13 56.11 3g1k s LEU 174 Cb 0.00 -3.95 0.94 0.00 0.03 0.00 0.00 46.19 43.21 3g1k s LEU 174 CO 0.00 -1.17 1.93 -0.65 0.23 0.00 0.00 176.35 176.69 3g1k h PRO 175 N 2.31 0.52 -0.38 1.29 0.11 -1.95 -0.82 132.00 133.08 3g1k h PRO 175 Ca -0.51 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 65.63 3g1k h PRO 175 Cb 1.27 -0.12 -0.05 0.00 0.11 0.00 0.00 31.00 32.21 3g1k h PRO 175 CO 0.61 0.35 0.09 0.28 -0.21 0.00 0.00 178.00 179.12 3g1k h VAL 176 N 0.54 0.82 -0.33 3.15 2.07 -1.96 0.60 116.25 121.14 3g1k h VAL 176 Ca 0.35 -0.08 -0.15 0.00 0.82 0.00 0.00 66.70 67.65 3g1k h VAL 176 Cb 0.63 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 3g1k h VAL 176 CO -0.12 0.04 -0.38 -0.33 0.02 0.00 0.00 177.57 176.80 3g1k h GLU 177 N 0.22 0.78 -0.26 1.57 5.08 -1.68 -1.93 114.58 118.35 3g1k h GLU 177 Ca 0.18 -0.40 -0.15 0.00 -1.00 0.00 0.00 59.36 58.00 3g1k h GLU 177 Cb 0.21 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 3g1k h GLU 177 CO -0.23 1.02 -0.44 0.00 -1.00 0.00 0.00 179.01 178.37 3g1k h ARG 178 N 0.64 0.64 -0.98 2.33 3.08 -0.81 -3.10 114.38 116.19 3g1k h ARG 178 Ca 0.06 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 59.76 3g1k h ARG 178 Cb 0.93 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.95 3g1k h ARG 178 CO 0.09 0.95 0.61 0.00 -1.07 0.00 0.00 179.97 180.55 3g1k h ALA 179 N 1.00 1.24 -0.47 0.04 0.00 0.47 -2.76 119.26 118.77 3g1k h ALA 179 Ca 0.04 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 3g1k h ALA 179 Cb 0.97 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 3g1k h ALA 179 CO 0.09 0.67 0.29 2.35 0.00 0.00 0.00 179.25 182.65 3g1k h TRP 180 N 1.34 0.62 -0.10 0.00 7.01 -1.28 -1.50 115.95 122.04 3g1k h TRP 180 Ca 0.35 0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.33 3g1k h TRP 180 Cb -0.10 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 26.75 3g1k h TRP 180 CO 0.00 0.43 -0.07 0.82 -2.79 0.00 0.00 178.44 176.83 3g1k h ILE 181 N 0.63 1.11 0.71 2.65 2.04 -1.48 0.21 117.51 123.39 3g1k h ILE 181 Ca 0.17 -0.49 -0.03 0.00 1.00 0.00 0.00 64.86 65.51 3g1k h ILE 181 Cb -0.01 1.12 -0.00 0.00 -0.74 0.00 0.00 36.82 37.19 3g1k h ILE 181 CO -0.03 0.15 -0.40 0.44 0.00 0.00 0.00 178.15 178.31 3g1k h ASP 182 N 0.14 -0.99 -0.23 1.72 3.32 -1.17 -1.51 116.42 117.70 3g1k h ASP 182 Ca 0.03 0.05 0.06 0.00 0.02 0.00 0.00 57.03 57.19 3g1k h ASP 182 Cb 0.22 0.28 -0.07 0.00 0.22 0.00 0.00 39.33 39.98 3g1k h ASP 182 CO 0.01 -0.64 -0.30 0.50 -1.72 0.00 0.00 179.24 177.09 3g1k h LYS 183 N -1.04 -0.31 -0.52 3.56 3.64 -0.35 -0.89 116.57 120.66 3g1k h LYS 183 Ca -0.09 0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.41 3g1k h LYS 183 Cb 0.82 0.07 -0.11 0.00 -0.41 0.00 0.00 32.23 32.61 3g1k h LYS 183 CO 0.12 -0.20 -0.28 0.35 -2.27 0.00 0.00 179.45 177.17 3g1k h PHE 184 N -0.32 -0.73 -0.03 1.91 3.57 -0.59 -1.22 116.94 119.53 3g1k h PHE 184 Ca 0.13 0.06 0.01 0.00 3.53 0.00 0.00 57.97 61.69 3g1k h PHE 184 Cb 0.52 0.40 -0.01 0.00 2.79 0.00 0.00 35.95 39.65 3g1k h PHE 184 CO -0.43 -0.35 -0.01 0.82 -2.23 0.00 0.00 178.31 176.11 3g1k h ILE 185 N -0.15 0.96 0.00 1.41 2.04 -0.92 -2.56 117.51 118.29 3g1k h ILE 185 Ca 0.23 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.09 3g1k h ILE 185 Cb 0.52 0.96 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3g1k h ILE 185 CO -0.60 0.00 0.00 -0.62 0.00 0.00 0.00 178.15 176.93 3g1k n GLU 186 N -5.11 0.01 0.00 2.37 1.02 -0.37 0.14 120.64 118.69 3g1k n GLU 186 Ca -0.06 0.39 0.13 0.00 -0.02 0.00 0.00 57.16 57.60 3g1k n GLU 186 Cb 0.05 -1.50 0.38 0.00 -0.02 0.00 0.00 31.44 30.35 3g1k n GLU 186 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3g1k n ASN 187 N -1.42 1.24 0.00 1.62 5.03 -0.61 -4.94 115.26 116.19 3g1k n ASN 187 Ca 0.01 -1.10 0.00 0.00 0.87 0.00 0.00 54.58 54.36 3g1k n ASN 187 Cb 0.02 0.12 0.00 0.00 -1.02 0.00 0.00 39.78 38.90 3g1k n ASN 187 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3g1k n GLY 188 N 1.30 0.98 3.12 7.41 0.00 0.12 -5.04 105.19 113.08 3g1k n GLY 188 Ca 0.14 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.04 3g1k n GLY 188 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g1k s TYR 189 N -1.80 0.78 -0.07 1.61 1.51 -0.91 -0.67 117.35 117.80 3g1k s TYR 189 Ca 0.00 -0.72 0.02 0.00 -1.01 0.00 0.00 57.07 55.36 3g1k s TYR 189 Cb 0.00 -0.46 0.01 0.00 -0.11 0.00 0.00 41.96 41.40 3g1k s TYR 189 CO 0.00 -0.12 -0.11 0.08 -1.11 0.00 0.00 175.55 174.28 3g1k s VAL 190 N -2.57 1.11 -0.73 0.71 1.01 0.25 -4.53 120.40 115.65 3g1k s VAL 190 Ca 0.01 -0.45 -0.26 0.00 0.00 0.00 0.00 61.98 61.29 3g1k s VAL 190 Cb -0.02 -1.03 -0.03 0.00 0.00 0.00 0.00 36.38 35.31 3g1k s VAL 190 CO -0.02 0.35 1.86 -0.62 0.00 0.00 0.00 175.10 176.67 3g1k s ASP 191 N 0.80 5.28 0.32 3.32 -1.08 -1.26 -2.76 116.67 121.28 3g1k s ASP 191 Ca -0.12 -0.08 0.03 0.00 -0.52 0.00 0.00 52.55 51.85 3g1k s ASP 191 Cb -0.15 -2.54 0.61 0.00 -1.46 0.00 0.00 42.92 39.37 3g1k s ASP 191 CO 0.02 -2.47 1.90 0.71 0.52 0.00 0.00 175.17 175.85 3g1k h THR 192 N 6.99 1.00 -0.85 1.71 1.35 -1.51 -2.05 112.91 119.54 3g1k h THR 192 Ca -0.13 -0.32 0.01 0.00 -0.55 0.00 0.00 66.41 65.42 3g1k h THR 192 Cb 1.10 -0.01 -0.04 0.00 -1.73 0.00 0.00 68.15 67.46 3g1k h THR 192 CO 1.22 0.17 0.55 0.15 -0.25 0.00 0.00 175.52 177.36 3g1k h PHE 193 N 0.93 1.07 0.00 4.73 3.57 -1.82 -1.76 116.94 123.66 3g1k h PHE 193 Ca 0.41 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.92 3g1k h PHE 193 Cb 0.34 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 38.72 3g1k h PHE 193 CO -0.00 0.69 0.00 0.54 -2.23 0.00 0.00 178.31 177.30 3g1k n ARG 194 N -4.48 0.77 0.15 1.11 5.12 -0.77 -1.55 116.66 117.00 3g1k n ARG 194 Ca 0.09 0.00 0.02 0.00 -1.93 0.00 0.00 57.85 56.03 3g1k n ARG 194 Cb 0.02 -1.50 0.18 0.00 -1.16 0.00 0.00 32.46 30.00 3g1k n ARG 194 CO 0.00 0.00 0.00 0.52 -1.93 0.00 0.00 177.63 176.22 3g1k h MET 195 N 0.00 0.00 0.00 5.56 2.86 -1.32 -3.38 114.93 118.65 3g1k h MET 195 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3g1k h MET 195 Cb 0.01 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.67 3g1k h MET 195 CO 0.00 0.54 -0.75 1.19 1.06 0.00 0.00 176.91 178.96 3g1k n PHE 196 N -3.53 0.00 -4.05 -0.22 3.72 -0.80 -5.02 117.46 107.56 3g1k n PHE 196 Ca -0.00 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.14 3g1k n PHE 196 Cb 0.63 0.00 -0.17 0.00 -0.94 0.00 0.00 39.48 39.00 3g1k n PHE 196 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3g1k s ASN 197 N -1.68 2.03 0.00 4.37 2.47 -0.60 -5.00 114.94 116.54 3g1k s ASN 197 Ca 0.00 -0.29 0.07 0.00 0.42 0.00 0.00 52.86 53.06 3g1k s ASN 197 Cb 0.00 -0.81 -0.00 0.00 -1.45 0.00 0.00 41.25 38.98 3g1k s ASN 197 CO 0.00 -0.09 0.52 -1.20 -3.72 0.00 0.00 177.10 172.62 3g1k n SER 198 N 4.68 1.01 -4.76 -4.21 7.64 -1.26 -4.35 113.62 112.36 3g1k n SER 198 Ca -0.15 -1.01 -0.32 0.00 1.01 0.00 0.00 58.87 58.40 3g1k n SER 198 Cb 0.50 0.47 0.07 0.00 -1.01 0.00 0.00 64.21 64.24 3g1k n SER 198 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3g1k s ASP 199 N -1.09 4.75 0.79 6.43 1.11 -1.26 -5.08 116.67 122.33 3g1k s ASP 199 Ca 0.06 2.00 -0.04 0.00 0.18 0.00 0.00 52.55 54.74 3g1k s ASP 199 Cb 0.06 -2.55 0.08 0.00 1.07 0.00 0.00 42.92 41.58 3g1k s ASP 199 CO 0.18 -1.87 0.53 -0.81 1.18 0.00 0.00 175.17 174.37 3g1k n PRO 200 N -2.83 -0.19 -2.49 8.23 -0.04 -1.26 -4.65 135.00 131.78 3g1k n PRO 200 Ca 0.10 -1.06 -0.17 0.00 -0.04 0.00 0.00 63.50 62.33 3g1k n PRO 200 Cb 0.52 -0.47 0.00 0.00 -0.04 0.00 0.00 33.50 33.51 3g1k n PRO 200 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3g1k n GLY 201 N 1.30 -0.33 3.25 0.55 0.00 -1.26 -4.99 105.19 103.71 3g1k n GLY 201 Ca 0.07 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.59 3g1k n GLY 201 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3g1k s GLN 202 N -5.04 2.56 0.25 1.61 1.11 -1.26 -5.09 119.66 113.81 3g1k s GLN 202 Ca 0.07 -1.24 0.09 0.00 0.01 0.00 0.00 55.36 54.29 3g1k s GLN 202 Cb -0.03 -3.44 -0.05 0.00 -1.01 0.00 0.00 33.01 28.48 3g1k s GLN 202 CO 0.09 -0.69 -0.14 0.71 0.01 0.00 0.00 175.29 175.26 3g1k s TYR 203 N 1.37 1.98 0.00 0.91 1.51 -1.26 -4.42 117.35 117.43 3g1k s TYR 203 Ca -0.02 -0.52 0.00 0.00 -1.01 0.00 0.00 57.07 55.53 3g1k s TYR 203 Cb -0.20 -0.96 0.00 0.00 -0.11 0.00 0.00 41.96 40.70 3g1k s TYR 203 CO 0.02 0.47 0.05 0.25 -1.11 0.00 0.00 175.55 175.23 3g1k n THR 204 N -0.52 0.00 -3.84 -0.71 -2.24 0.99 -4.91 114.28 103.05 3g1k n THR 204 Ca -0.06 -0.37 -0.12 0.00 -2.27 0.00 0.00 64.05 61.22 3g1k n THR 204 Cb 0.61 1.04 -0.13 0.00 -2.10 0.00 0.00 70.33 69.74 3g1k n THR 204 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 3g1k s TRP 205 N -0.64 -0.09 -0.01 4.78 -0.00 -0.35 -1.57 118.94 121.07 3g1k s TRP 205 Ca 0.00 0.21 -0.01 0.00 -0.00 0.00 0.00 56.10 56.30 3g1k s TRP 205 Cb 0.00 0.03 0.01 0.00 -0.00 0.00 0.00 33.47 33.50 3g1k s TRP 205 CO 0.00 -0.04 0.02 -1.58 -0.00 0.00 0.00 176.95 175.35 3g1k s TRP 206 N 0.05 -0.02 0.08 5.86 0.51 -0.81 -0.62 118.94 124.00 3g1k s TRP 206 Ca -0.00 0.07 -0.32 0.00 -2.12 0.00 0.00 56.10 53.72 3g1k s TRP 206 Cb -0.01 -0.03 -0.11 0.00 -0.81 0.00 0.00 33.47 32.51 3g1k s TRP 206 CO 0.00 -0.02 1.81 0.45 -0.51 0.00 0.00 176.95 178.68 3g1k n SER 207 N 3.23 3.78 0.27 2.95 2.88 -1.26 -4.78 113.62 120.70 3g1k n SER 207 Ca -0.14 0.99 0.12 0.00 -1.33 0.00 0.00 58.87 58.51 3g1k n SER 207 Cb 0.58 -1.49 0.78 0.00 -0.75 0.00 0.00 64.21 63.33 3g1k n SER 207 CO 0.00 0.00 0.00 1.88 -1.23 0.00 0.00 175.04 175.69 3g1k h TYR 208 N 8.37 0.00 0.00 0.66 0.99 -1.99 -2.88 116.97 122.13 3g1k h TYR 208 Ca -0.47 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.26 3g1k h TYR 208 Cb 1.24 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.97 3g1k h TYR 208 CO 0.79 0.00 -0.01 0.00 -0.00 0.00 0.00 178.16 178.94 3g1k h ARG 209 N 0.00 0.00 0.00 4.88 2.47 -2.04 -3.08 114.38 116.61 3g1k h ARG 209 Ca 0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 3g1k h ARG 209 Cb 0.02 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.34 3g1k h ARG 209 CO -0.00 0.01 -0.13 0.25 0.56 0.00 0.00 179.97 180.66 3g1k n THR 210 N -3.11 1.00 -3.86 2.04 -2.24 -1.24 -4.98 114.28 101.89 3g1k n THR 210 Ca 0.00 -1.16 -0.25 0.00 -2.27 0.00 0.00 64.05 60.37 3g1k n THR 210 Cb 0.29 0.25 0.01 0.00 -2.10 0.00 0.00 70.33 68.77 3g1k n THR 210 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3g1k n ARG 211 N -0.71 -4.28 0.21 -0.78 1.74 -1.16 -4.87 116.66 106.81 3g1k n ARG 211 Ca 0.07 0.52 0.06 0.00 -0.77 0.00 0.00 57.85 57.73 3g1k n ARG 211 Cb 0.56 -4.97 0.48 0.00 -1.02 0.00 0.00 32.46 27.51 3g1k n ARG 211 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3g1k h ALA 212 N 0.87 1.36 -0.46 7.54 0.00 -1.78 -3.19 119.26 123.60 3g1k h ALA 212 Ca -0.61 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 53.93 3g1k h ALA 212 Cb 1.37 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 3g1k h ALA 212 CO 0.62 0.34 -0.20 -0.09 0.00 0.00 0.00 179.25 179.92 3g1k h ARG 213 N 0.00 0.91 0.00 0.00 2.43 -1.86 -1.02 114.38 114.83 3g1k h ARG 213 Ca -0.00 -0.37 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 3g1k h ARG 213 Cb 0.54 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 3g1k h ARG 213 CO 0.03 1.02 0.00 1.05 -1.51 0.00 0.00 179.97 180.57 3g1k h GLU 214 N 0.79 0.00 0.00 0.20 4.11 -1.95 -0.95 114.58 116.79 3g1k h GLU 214 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.54 3g1k h GLU 214 Cb 0.75 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 3g1k h GLU 214 CO 0.06 0.00 -1.61 0.54 0.07 0.00 0.00 179.01 178.07 3g1k n ARG 215 N -2.50 0.45 -3.09 1.06 1.74 -1.04 -5.01 116.66 108.27 3g1k n ARG 215 Ca 0.01 -0.12 -0.19 0.00 -0.77 0.00 0.00 57.85 56.78 3g1k n ARG 215 Cb 0.21 -1.53 0.04 0.00 -1.02 0.00 0.00 32.46 30.16 3g1k n ARG 215 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3g1k n ASN 216 N -2.04 -5.50 -4.42 0.55 5.15 -0.36 -4.96 115.26 103.68 3g1k n ASN 216 Ca -0.01 -0.32 -0.44 0.00 -0.60 0.00 0.00 54.58 53.21 3g1k n ASN 216 Cb 0.49 -4.25 0.00 0.00 -0.53 0.00 0.00 39.78 35.50 3g1k n ASN 216 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 3g1k n VAL 217 N -4.42 4.29 -4.30 3.44 0.31 -0.83 -4.87 118.33 111.96 3g1k n VAL 217 Ca -0.06 -4.77 -0.15 0.00 -0.01 0.00 0.00 64.34 59.36 3g1k n VAL 217 Cb 0.58 -2.47 -0.04 0.00 -0.91 0.00 0.00 33.84 31.00 3g1k n VAL 217 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3g1k n GLY 218 N 3.88 3.63 3.34 2.92 0.00 -1.26 -4.61 105.19 113.09 3g1k n GLY 218 Ca 0.36 -2.06 -0.22 0.00 0.00 0.00 0.00 46.02 44.10 3g1k n GLY 218 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3g1k s TRP 219 N -2.38 1.87 -0.41 1.61 0.52 0.21 -1.35 118.94 119.02 3g1k s TRP 219 Ca 0.11 -0.46 -0.12 0.00 0.02 0.00 0.00 56.10 55.65 3g1k s TRP 219 Cb 0.01 -0.93 0.04 0.00 -1.15 0.00 0.00 33.47 31.44 3g1k s TRP 219 CO 0.08 0.35 0.26 0.50 0.02 0.00 0.00 176.95 178.16 3g1k s ARG 220 N -2.80 2.82 -0.00 4.98 3.52 -0.24 -0.00 118.95 127.22 3g1k s ARG 220 Ca 0.16 -1.20 0.04 0.00 -0.13 0.00 0.00 55.73 54.61 3g1k s ARG 220 Cb -0.06 -3.85 -0.06 0.00 -1.56 0.00 0.00 34.95 29.43 3g1k s ARG 220 CO 0.07 -0.82 0.12 1.28 -0.81 0.00 0.00 175.30 175.14 3g1k n LEU 221 N 5.04 0.07 -4.71 -0.88 4.77 -1.26 -3.73 117.00 116.30 3g1k n LEU 221 Ca -0.11 -0.18 -0.35 0.00 -0.03 0.00 0.00 56.01 55.33 3g1k n LEU 221 Cb 0.45 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.46 3g1k n LEU 221 CO 0.40 0.02 -0.18 -1.81 -1.33 0.00 0.00 177.39 174.48 3g1k s ASP 222 N -2.09 6.16 0.09 -1.43 1.01 -1.26 -0.90 116.67 118.25 3g1k s ASP 222 Ca -0.00 0.19 0.03 0.00 0.71 0.00 0.00 52.55 53.48 3g1k s ASP 222 Cb 0.03 -2.09 -0.04 0.00 1.01 0.00 0.00 42.92 41.83 3g1k s ASP 222 CO 0.17 0.15 -0.10 -0.31 0.21 0.00 0.00 175.17 175.29 3g1k s TYR 223 N 0.55 1.02 -0.20 4.23 1.51 -1.01 -4.98 117.35 118.47 3g1k s TYR 223 Ca 0.08 -0.66 -0.01 0.00 -1.01 0.00 0.00 57.07 55.47 3g1k s TYR 223 Cb -0.12 -0.56 0.01 0.00 -0.11 0.00 0.00 41.96 41.18 3g1k s TYR 223 CO -0.00 -0.02 -0.13 -0.06 -1.11 0.00 0.00 175.55 174.23 3g1k s PHE 224 N -2.41 2.87 -0.09 2.71 0.40 -1.26 -2.56 117.98 117.65 3g1k s PHE 224 Ca 0.04 -1.42 0.02 0.00 -0.60 0.00 0.00 56.93 54.98 3g1k s PHE 224 Cb -0.03 -1.99 -0.02 0.00 0.51 0.00 0.00 43.02 41.49 3g1k s PHE 224 CO -0.00 -0.72 -0.15 -0.06 0.70 0.00 0.00 175.22 174.99 3g1k s PHE 225 N 1.35 2.72 0.24 0.36 0.40 0.30 -1.13 117.98 122.23 3g1k s PHE 225 Ca 0.05 -0.45 0.11 0.00 -0.60 0.00 0.00 56.93 56.04 3g1k s PHE 225 Cb -0.14 -1.73 -0.05 0.00 0.51 0.00 0.00 43.02 41.62 3g1k s PHE 225 CO -0.09 -0.04 -0.19 0.14 0.70 0.00 0.00 175.22 175.74 3g1k s VAL 226 N -0.17 2.57 0.19 -0.44 -7.23 -1.11 0.59 120.40 114.80 3g1k s VAL 226 Ca -0.01 -2.19 -0.30 0.00 -1.81 0.00 0.00 61.98 57.68 3g1k s VAL 226 Cb -0.13 -2.30 -0.08 0.00 0.56 0.00 0.00 36.38 34.42 3g1k s VAL 226 CO 0.03 -0.28 1.02 0.54 -0.31 0.00 0.00 175.10 176.10 3g1k s ASN 227 N -3.18 7.43 0.38 4.85 4.22 -1.22 -0.59 114.94 126.84 3g1k s ASN 227 Ca 0.27 2.00 0.22 0.00 -2.14 0.00 0.00 52.86 53.20 3g1k s ASN 227 Cb -0.06 -2.60 1.28 0.00 1.28 0.00 0.00 41.25 41.14 3g1k s ASN 227 CO 0.14 -0.07 1.63 1.05 -2.04 0.00 0.00 177.10 177.80 3g1k h GLU 228 N 4.80 0.14 0.00 3.55 4.11 -1.21 0.81 114.58 126.79 3g1k h GLU 228 Ca -0.44 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.98 3g1k h GLU 228 Cb 1.21 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.43 3g1k h GLU 228 CO 0.70 0.09 0.00 0.39 0.07 0.00 0.00 179.01 180.27 3g1k n GLU 229 N -4.99 0.01 0.00 1.06 4.71 -1.26 -2.32 120.64 117.84 3g1k n GLU 229 Ca 0.35 0.37 0.02 0.00 -0.01 0.00 0.00 57.16 57.89 3g1k n GLU 229 Cb 1.22 -1.50 -0.01 0.00 -1.01 0.00 0.00 31.44 30.14 3g1k n GLU 229 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 3g1k n PHE 230 N -1.48 0.00 0.26 -0.32 7.35 0.28 -4.70 117.46 118.85 3g1k n PHE 230 Ca 0.02 0.00 0.11 0.00 -0.76 0.00 0.00 57.45 56.82 3g1k n PHE 230 Cb 0.08 0.00 0.72 0.00 0.35 0.00 0.00 39.48 40.63 3g1k n PHE 230 CO 0.00 0.00 0.00 1.57 -0.76 0.00 0.00 176.76 177.57 3g1k h LYS 231 N 0.23 0.00 0.00 -4.13 2.10 -1.43 -2.06 116.57 111.28 3g1k h LYS 231 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3g1k h LYS 231 Cb 0.10 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.43 3g1k h LYS 231 CO 0.00 0.10 0.06 0.78 -2.00 0.00 0.00 179.45 178.39 3g1k h GLY 232 N 0.51 0.00 -0.33 0.07 0.00 -1.84 -2.68 103.07 98.80 3g1k h GLY 232 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3g1k h GLY 232 CO 0.01 0.00 -0.72 0.28 0.00 0.00 0.00 176.54 176.12 3g1k n LYS 233 N -3.04 1.01 -2.77 4.80 5.02 -0.77 -4.84 118.16 117.57 3g1k n LYS 233 Ca -0.03 -0.34 -0.43 0.00 -2.02 0.00 0.00 58.31 55.49 3g1k n LYS 233 Cb 0.13 -1.39 -0.03 0.00 -0.02 0.00 0.00 35.03 33.71 3g1k n LYS 233 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3g1k s VAL 234 N -2.58 4.63 -0.19 -0.18 0.11 -1.01 -0.03 120.40 121.14 3g1k s VAL 234 Ca 0.11 1.50 -0.19 0.00 -2.93 0.00 0.00 61.98 60.47 3g1k s VAL 234 Cb 0.15 -4.31 -0.16 0.00 -1.53 0.00 0.00 36.38 30.53 3g1k s VAL 234 CO 0.67 -0.38 0.15 0.50 -3.33 0.00 0.00 175.10 172.71 3g1k h LYS 235 N 8.10 0.00 -5.85 1.54 3.64 -0.71 -3.49 116.57 119.80 3g1k h LYS 235 Ca -0.22 0.00 -0.50 0.00 -1.27 0.00 0.00 60.65 58.66 3g1k h LYS 235 Cb 1.07 0.00 -0.19 0.00 -0.41 0.00 0.00 32.23 32.70 3g1k h LYS 235 CO 0.97 0.80 -0.79 1.03 -2.27 0.00 0.00 179.45 179.19 3g1k s ARG 236 N -2.33 1.16 -0.27 1.90 0.52 -0.90 -5.00 118.95 114.05 3g1k s ARG 236 Ca -0.26 -1.29 -0.01 0.00 -0.52 0.00 0.00 55.73 53.65 3g1k s ARG 236 Cb 0.05 -1.23 0.15 0.00 0.52 0.00 0.00 34.95 34.44 3g1k s ARG 236 CO 0.52 0.26 0.44 0.45 0.02 0.00 0.00 175.30 176.99 3g1k s SER 237 N -2.40 -0.20 0.37 0.23 0.15 -1.26 -1.40 113.70 109.18 3g1k s SER 237 Ca 0.11 0.29 0.05 0.00 0.70 0.00 0.00 55.95 57.10 3g1k s SER 237 Cb -0.07 1.40 -0.03 0.00 -1.71 0.00 0.00 66.02 65.62 3g1k s SER 237 CO 0.05 -0.30 0.19 -1.66 1.20 0.00 0.00 173.24 172.72 3g1k s TRP 238 N 2.63 1.75 -0.22 3.44 -2.14 -0.66 -4.62 118.94 119.11 3g1k s TRP 238 Ca 0.14 -1.44 0.01 0.00 2.66 0.00 0.00 56.10 57.47 3g1k s TRP 238 Cb -0.15 -0.95 0.03 0.00 -3.10 0.00 0.00 33.47 29.30 3g1k s TRP 238 CO -0.20 -0.55 -0.15 0.42 -2.66 0.00 0.00 176.95 173.82 3g1k s ILE 239 N -3.35 2.24 -1.44 0.66 1.01 -1.26 -1.53 121.20 117.54 3g1k s ILE 239 Ca 0.31 -1.16 -0.13 0.00 0.00 0.00 0.00 60.65 59.68 3g1k s ILE 239 Cb 0.03 -2.09 -0.02 0.00 0.01 0.00 0.00 42.46 40.38 3g1k s ILE 239 CO 0.20 0.31 2.45 0.18 0.00 0.00 0.00 174.94 178.08 3g1k n LEU 240 N 4.57 7.20 0.00 2.97 4.32 -0.78 -4.74 117.00 130.55 3g1k n LEU 240 Ca -0.18 -4.06 0.11 0.00 -0.02 0.00 0.00 56.01 51.86 3g1k n LEU 240 Cb 0.47 -1.56 0.51 0.00 -1.62 0.00 0.00 43.42 41.22 3g1k n LEU 240 CO 0.25 1.30 0.86 -1.54 -1.22 0.00 0.00 177.39 177.03 3g1k n SER 241 N 5.26 0.00 0.13 -1.43 3.41 -1.26 -2.39 113.62 117.35 3g1k n SER 241 Ca 0.60 0.34 0.04 0.00 -0.26 0.00 0.00 58.87 59.59 3g1k n SER 241 Cb 0.32 -0.44 0.03 0.00 -0.26 0.00 0.00 64.21 63.87 3g1k n SER 241 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 3g1k h ASP 242 N 0.00 0.00 -2.78 4.04 -0.00 -1.96 -3.46 116.42 112.26 3g1k h ASP 242 Ca 0.00 0.00 -0.57 0.00 -0.00 0.00 0.00 57.03 56.46 3g1k h ASP 242 Cb 0.33 0.00 -0.03 0.00 -0.00 0.00 0.00 39.33 39.64 3g1k h ASP 242 CO 0.00 0.41 1.14 -0.69 -0.00 0.00 0.00 179.24 180.10 3g1k s VAL 243 N -3.02 3.69 0.64 4.15 1.01 -1.01 -5.01 120.40 120.85 3g1k s VAL 243 Ca 0.03 0.76 0.01 0.00 0.00 0.00 0.00 61.98 62.79 3g1k s VAL 243 Cb 0.07 -3.73 0.08 0.00 0.00 0.00 0.00 36.38 32.81 3g1k s VAL 243 CO 0.75 -0.33 0.88 -0.04 0.00 0.00 0.00 175.10 176.36 3g1k s MET 244 N 4.78 2.10 0.00 2.72 -1.94 -1.26 -4.66 119.30 121.05 3g1k s MET 244 Ca 0.72 -1.02 0.00 0.00 -1.71 0.00 0.00 55.69 53.68 3g1k s MET 244 Cb -0.24 -2.42 0.00 0.00 2.01 0.00 0.00 34.83 34.18 3g1k s MET 244 CO 0.30 -1.09 0.00 0.41 -0.01 0.00 0.00 175.02 174.63 3g1k n GLY 245 N -2.57 1.85 3.17 -0.03 0.00 -1.26 -4.99 105.19 101.35 3g1k n GLY 245 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 3g1k n GLY 245 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3g1k s SER 246 N -1.53 0.29 0.55 1.61 0.15 -1.26 -4.50 113.70 109.00 3g1k s SER 246 Ca 0.00 -1.15 0.34 0.00 0.70 0.00 0.00 55.95 55.84 3g1k s SER 246 Cb 0.00 0.31 1.38 0.00 -1.71 0.00 0.00 66.02 65.99 3g1k s SER 246 CO 0.00 -0.74 1.99 -2.24 1.20 0.00 0.00 173.24 173.45 3g1k h ASP 247 N 2.85 0.00 -2.45 5.45 2.03 -1.87 -3.41 116.42 119.02 3g1k h ASP 247 Ca -0.35 0.00 -0.52 0.00 -0.73 0.00 0.00 57.03 55.44 3g1k h ASP 247 Cb 1.20 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.68 3g1k h ASP 247 CO 0.58 0.00 -0.45 -1.00 -1.03 0.00 0.00 179.24 177.34 3g1k s HIS 248 N -3.67 3.47 0.30 4.15 3.76 -1.26 -1.93 115.29 120.12 3g1k s HIS 248 Ca 0.01 0.08 0.08 0.00 -0.15 0.00 0.00 55.06 55.07 3g1k s HIS 248 Cb 0.09 -1.64 -0.03 0.00 1.11 0.00 0.00 32.58 32.11 3g1k s HIS 248 CO 0.54 0.49 0.21 0.00 -0.85 0.00 0.00 174.74 175.13 3g1k s PRO 250 N -3.89 3.24 0.13 0.00 0.04 -1.26 -4.63 135.00 128.63 3g1k s PRO 250 Ca 0.37 1.13 0.08 0.00 0.04 0.00 0.00 61.00 62.62 3g1k s PRO 250 Cb -0.06 -2.03 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 3g1k s PRO 250 CO 0.25 -0.87 -0.19 0.96 0.04 0.00 0.00 177.00 177.19 3g1k s ILE 251 N -2.61 1.72 0.03 0.56 -4.36 -0.25 -1.87 121.20 114.43 3g1k s ILE 251 Ca 0.62 -1.69 0.05 0.00 -0.26 0.00 0.00 60.65 59.37 3g1k s ILE 251 Cb -0.15 -1.66 -0.02 0.00 1.25 0.00 0.00 42.46 41.88 3g1k s ILE 251 CO 0.41 -0.18 -0.14 -0.83 0.24 0.00 0.00 174.94 174.44 3g1k s GLY 252 N -2.22 0.79 0.03 6.27 0.00 -0.58 -1.18 107.32 110.42 3g1k s GLY 252 Ca 0.10 -0.81 0.08 0.00 0.00 0.00 0.00 44.72 44.09 3g1k s GLY 252 CO 0.05 -0.78 -0.24 -2.27 0.00 0.00 0.00 173.10 169.86 3g1k s LEU 253 N -1.06 2.13 -0.09 0.66 2.96 0.48 -1.66 118.68 122.11 3g1k s LEU 253 Ca 0.02 -0.53 0.00 0.00 -0.22 0.00 0.00 54.13 53.41 3g1k s LEU 253 Cb -0.08 -1.21 0.02 0.00 0.50 0.00 0.00 46.19 45.43 3g1k s LEU 253 CO 0.01 0.25 -0.08 -0.70 -1.32 0.00 0.00 176.35 174.51 3g1k s GLU 254 N -1.02 1.41 0.38 1.98 2.12 -0.50 -0.07 118.70 123.00 3g1k s GLU 254 Ca 0.10 -0.24 0.05 0.00 0.36 0.00 0.00 54.97 55.23 3g1k s GLU 254 Cb -0.10 -1.40 -0.06 0.00 0.26 0.00 0.00 34.13 32.83 3g1k s GLU 254 CO 0.01 -0.18 0.04 0.96 -0.54 0.00 0.00 175.26 175.56 3g1k s ILE 255 N 1.38 1.39 -0.15 -3.70 -4.36 -0.31 0.03 121.20 115.48 3g1k s ILE 255 Ca -0.02 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.38 3g1k s ILE 255 Cb -0.14 -2.75 0.02 0.00 1.25 0.00 0.00 42.46 40.84 3g1k s ILE 255 CO -0.04 0.00 -0.17 -1.61 0.24 0.00 0.00 174.94 173.36 3g1k s GLU 256 N -3.81 2.59 0.00 0.37 0.41 0.95 -1.94 118.70 117.26 3g1k s GLU 256 Ca 0.32 -0.68 0.00 0.00 -0.41 0.00 0.00 54.97 54.20 3g1k s GLU 256 Cb 0.08 -2.26 0.00 0.00 -1.78 0.00 0.00 34.13 30.17 3g1k s GLU 256 CO 0.15 -0.18 0.00 1.28 -0.49 0.00 0.00 175.26 176.02