#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 5.08 -0.17 0.00 1.01 -1.26 -0.45 120.40 124.61 3g1k s VAL 3 Ca 0.00 1.23 -0.01 0.00 0.00 0.00 0.00 61.98 63.20 3g1k s VAL 3 Cb 0.00 -3.95 -0.00 0.00 0.00 0.00 0.00 36.38 32.43 3g1k s VAL 3 CO 0.00 0.23 -0.11 -0.76 0.00 0.00 0.00 175.10 174.46 3g1k s LEU 4 N 1.06 2.64 -0.23 3.92 2.01 -0.81 -4.96 118.68 122.31 3g1k s LEU 4 Ca 0.32 -0.43 -0.08 0.00 0.01 0.00 0.00 54.13 53.96 3g1k s LEU 4 Cb -0.16 -1.63 -0.03 0.00 0.01 0.00 0.00 46.19 44.38 3g1k s LEU 4 CO 0.14 0.06 0.08 -0.75 1.01 0.00 0.00 176.35 176.88 3g1k s LYS 5 N 0.98 3.76 -0.09 1.70 2.20 -1.26 -1.22 119.74 125.81 3g1k s LYS 5 Ca -0.02 -0.43 0.04 0.00 -0.36 0.00 0.00 55.97 55.21 3g1k s LYS 5 Cb -0.15 -3.31 -0.01 0.00 -1.51 0.00 0.00 37.83 32.85 3g1k s LYS 5 CO -0.01 -0.05 -0.23 0.42 -0.36 0.00 0.00 175.35 175.12 3g1k s ILE 6 N 1.27 2.22 0.09 5.43 1.01 0.93 -1.28 121.20 130.87 3g1k s ILE 6 Ca 0.05 -0.98 0.08 0.00 0.00 0.00 0.00 60.65 59.80 3g1k s ILE 6 Cb -0.15 -1.84 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 3g1k s ILE 6 CO 0.04 0.56 -0.16 -0.63 0.00 0.00 0.00 174.94 174.75 3g1k s ILE 7 N 0.12 3.00 -0.02 2.92 -1.09 -0.76 -0.46 121.20 124.90 3g1k s ILE 7 Ca -0.11 -1.35 0.00 0.00 -2.23 0.00 0.00 60.65 56.96 3g1k s ILE 7 Cb -0.16 -2.36 0.02 0.00 -1.58 0.00 0.00 42.46 38.39 3g1k s ILE 7 CO 0.06 0.16 -0.00 -0.55 -1.23 0.00 0.00 174.94 173.39 3g1k s SER 8 N -1.98 0.33 -0.19 3.58 0.15 -0.16 0.20 113.70 115.63 3g1k s SER 8 Ca 0.18 -0.02 -0.07 0.00 0.70 0.00 0.00 55.95 56.73 3g1k s SER 8 Cb -0.11 -0.15 0.08 0.00 -1.71 0.00 0.00 66.02 64.13 3g1k s SER 8 CO 0.10 -0.07 0.42 0.86 1.20 0.00 0.00 173.24 175.75 3g1k s TRP 9 N 0.75 -0.76 -0.72 3.44 -0.00 -0.52 -1.09 118.94 120.04 3g1k s TRP 9 Ca -0.07 1.48 -0.27 0.00 -0.00 0.00 0.00 56.10 57.24 3g1k s TRP 9 Cb -0.10 0.30 0.03 0.00 -0.00 0.00 0.00 33.47 33.69 3g1k s TRP 9 CO -0.01 -0.45 1.30 1.21 -0.00 0.00 0.00 176.95 178.99 3g1k s ASN 10 N 2.37 6.15 0.11 5.86 3.84 -1.26 -1.63 114.94 130.37 3g1k s ASN 10 Ca -0.03 -0.36 0.27 0.00 0.21 0.00 0.00 52.86 52.95 3g1k s ASN 10 Cb -0.11 -2.56 0.96 0.00 -0.55 0.00 0.00 41.25 38.99 3g1k s ASN 10 CO -0.13 -1.83 1.80 0.52 -2.79 0.00 0.00 177.10 174.67 3g1k n VAL 11 N 6.45 0.31 -3.66 -5.21 0.31 -0.37 -4.14 118.33 112.02 3g1k n VAL 11 Ca 0.04 -0.15 -0.27 0.00 -0.01 0.00 0.00 64.34 63.95 3g1k n VAL 11 Cb 0.49 -0.49 0.04 0.00 -0.91 0.00 0.00 33.84 32.97 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 -1.90 -4.31 -0.51 4.52 5.15 -1.24 -4.52 115.26 112.45 3g1k n ASN 12 Ca 0.06 -0.95 0.00 0.00 -0.60 0.00 0.00 54.58 53.09 3g1k n ASN 12 Cb 0.39 -3.67 0.00 0.00 -0.53 0.00 0.00 39.78 35.97 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 -1.64 -1.12 0.09 8.20 0.00 0.13 -4.74 105.19 106.11 3g1k n GLY 13 Ca -0.14 -0.79 -0.13 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.10 -0.91 0.99 5.85 -1.43 -2.24 115.31 117.46 3g1k h LEU 14 Ca 0.00 -0.15 0.26 0.00 0.84 0.00 0.00 57.88 58.83 3g1k h LEU 14 Cb 0.00 0.03 -0.15 0.00 0.37 0.00 0.00 40.66 40.91 3g1k h LEU 14 CO 0.00 0.09 0.29 0.03 -0.34 0.00 0.00 178.44 178.51 3g1k h ARG 15 N -0.29 0.20 -0.56 1.25 3.08 -1.94 0.13 114.38 116.26 3g1k h ARG 15 Ca -0.01 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 59.93 3g1k h ARG 15 Cb 0.24 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 3g1k h ARG 15 CO 0.02 0.14 -0.03 0.00 -1.07 0.00 0.00 179.97 179.03 3g1k h ALA 16 N 1.81 0.75 0.00 0.04 0.00 -1.75 -2.63 119.26 117.49 3g1k h ALA 16 Ca 0.60 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 55.15 3g1k h ALA 16 Cb 1.25 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 3g1k h ALA 16 CO -0.67 0.61 -0.21 -0.24 0.00 0.00 0.00 179.25 178.74 3g1k h VAL 17 N 0.88 0.39 -0.17 0.00 3.04 -0.68 -3.07 116.25 116.64 3g1k h VAL 17 Ca 0.15 -1.38 -0.11 0.00 -1.01 0.00 0.00 66.70 64.35 3g1k h VAL 17 Cb 0.58 2.05 -0.01 0.00 -2.01 0.00 0.00 31.29 31.89 3g1k h VAL 17 CO 0.03 0.21 -0.37 -0.74 -1.01 0.00 0.00 177.57 175.69 3g1k h HIS 18 N 0.00 0.43 0.00 3.17 6.17 -0.48 -2.20 115.15 122.24 3g1k h HIS 18 Ca -0.00 -0.11 0.00 0.00 0.71 0.00 0.00 60.37 60.97 3g1k h HIS 18 Cb 1.03 -0.10 0.00 0.00 2.52 0.00 0.00 27.41 30.86 3g1k h HIS 18 CO 0.00 0.69 0.00 0.54 0.71 0.00 0.00 177.93 179.87 3g1k n ARG 19 N -4.05 0.11 -2.22 5.26 1.74 -1.02 -3.15 116.66 113.33 3g1k n ARG 19 Ca -0.01 0.27 -0.30 0.00 -0.77 0.00 0.00 57.85 57.04 3g1k n ARG 19 Cb 0.47 -1.68 0.02 0.00 -1.02 0.00 0.00 32.46 30.24 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 -1.89 3.28 -2.44 5.56 5.02 -0.86 -4.95 118.16 121.88 3g1k n LYS 20 Ca 0.04 -4.18 -0.19 0.00 -2.02 0.00 0.00 58.31 51.96 3g1k n LYS 20 Cb 0.26 -2.26 -0.00 0.00 -0.02 0.00 0.00 35.03 33.00 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 -0.56 -0.40 0.37 0.72 0.00 -1.19 -4.78 105.19 99.35 3g1k n GLY 21 Ca 0.44 -0.08 0.10 0.00 0.00 0.00 0.00 46.02 46.48 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 -0.19 0.90 -0.36 1.61 3.57 -1.60 -2.04 116.94 118.82 3g1k h PHE 22 Ca -0.45 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 60.93 3g1k h PHE 22 Cb 1.33 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.78 3g1k h PHE 22 CO 0.49 0.35 -0.35 -0.07 -2.23 0.00 0.00 178.31 176.51 3g1k h LEU 23 N 0.78 0.93 -0.22 0.59 4.07 -1.86 0.63 115.31 120.23 3g1k h LEU 23 Ca 0.45 -0.46 0.04 0.00 0.08 0.00 0.00 57.88 57.99 3g1k h LEU 23 Cb 0.62 -0.26 -0.04 0.00 1.08 0.00 0.00 40.66 42.06 3g1k h LEU 23 CO -0.21 1.20 -0.05 0.50 -1.08 0.00 0.00 178.44 178.80 3g1k h LYS 24 N 0.68 0.00 -0.44 1.13 3.64 -1.78 -0.47 116.57 119.33 3g1k h LYS 24 Ca 0.06 -0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.30 3g1k h LYS 24 Cb 0.93 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.74 3g1k h LYS 24 CO 0.09 0.00 -0.29 2.35 -2.27 0.00 0.00 179.45 179.33 3g1k h TRP 25 N 0.00 1.12 -0.06 1.91 7.01 -1.34 -2.05 115.95 122.54 3g1k h TRP 25 Ca 0.11 -0.30 0.04 0.00 2.11 0.00 0.00 58.89 60.85 3g1k h TRP 25 Cb 0.16 -0.25 -0.05 0.00 -2.10 0.00 0.00 29.16 26.92 3g1k h TRP 25 CO -0.23 1.12 -0.22 0.35 -2.79 0.00 0.00 178.44 176.67 3g1k h PHE 26 N 0.81 -0.59 -0.25 2.65 -0.00 -0.57 -1.38 116.94 117.61 3g1k h PHE 26 Ca 0.09 0.02 -0.03 0.00 -0.00 0.00 0.00 57.97 58.05 3g1k h PHE 26 Cb 0.87 0.27 -0.01 0.00 -0.00 0.00 0.00 35.95 37.08 3g1k h PHE 26 CO 0.06 -0.31 0.03 0.52 -0.00 0.00 0.00 178.31 178.61 3g1k h MET 27 N -0.32 0.37 0.20 1.11 2.86 -0.99 -2.30 114.93 115.86 3g1k h MET 27 Ca 0.08 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 3g1k h MET 27 Cb 0.43 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.03 3g1k h MET 27 CO -0.24 0.37 -0.10 0.93 1.06 0.00 0.00 176.91 178.93 3g1k h GLU 28 N 0.36 -0.26 -0.25 1.72 5.08 -0.85 -3.35 114.58 117.03 3g1k h GLU 28 Ca 0.09 0.02 -0.18 0.00 -1.00 0.00 0.00 59.36 58.28 3g1k h GLU 28 Cb 0.20 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 3g1k h GLU 28 CO 0.00 0.09 -0.56 1.49 -1.00 0.00 0.00 179.01 179.03 3g1k h GLU 29 N -0.66 0.76 -5.39 2.33 4.57 -1.20 -3.48 114.58 111.51 3g1k h GLU 29 Ca -0.03 -0.48 -0.36 0.00 -1.18 0.00 0.00 59.36 57.31 3g1k h GLU 29 Cb 0.47 0.06 0.13 0.00 -0.16 0.00 0.00 28.75 29.25 3g1k h GLU 29 CO 0.05 1.11 -0.62 1.17 -1.18 0.00 0.00 179.01 179.53 3g1k n LYS 30 N -3.98 -7.17 -1.43 1.92 3.00 -0.87 -4.98 118.16 104.65 3g1k n LYS 30 Ca -0.04 0.75 -0.31 0.00 -0.00 0.00 0.00 58.31 58.71 3g1k n LYS 30 Cb 0.63 -5.57 0.07 0.00 0.00 0.00 0.00 35.03 30.15 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 -6.12 2.59 0.22 1.64 0.04 -1.26 -4.96 135.00 127.15 3g1k s PRO 31 Ca 0.49 1.09 0.07 0.00 0.04 0.00 0.00 61.00 62.70 3g1k s PRO 31 Cb -0.22 -1.94 0.19 0.00 0.04 0.00 0.00 34.50 32.57 3g1k s PRO 31 CO 0.66 -1.38 1.51 -0.44 0.04 0.00 0.00 177.00 177.39 3g1k h ASP 32 N -0.87 0.11 -4.02 6.66 3.32 -1.56 -3.44 116.42 116.62 3g1k h ASP 32 Ca -0.44 -0.07 -0.25 0.00 0.02 0.00 0.00 57.03 56.29 3g1k h ASP 32 Cb 1.22 -0.03 -0.27 0.00 0.22 0.00 0.00 39.33 40.47 3g1k h ASP 32 CO 0.54 0.78 -0.73 -0.63 -1.72 0.00 0.00 179.24 177.48 3g1k s ILE 33 N -3.45 0.17 -0.17 0.35 1.01 -1.11 -1.98 121.20 116.02 3g1k s ILE 33 Ca -0.02 -0.26 -0.01 0.00 0.00 0.00 0.00 60.65 60.36 3g1k s ILE 33 Cb 0.12 -0.18 0.05 0.00 0.01 0.00 0.00 42.46 42.45 3g1k s ILE 33 CO 0.79 -0.06 -0.03 -0.22 0.00 0.00 0.00 174.94 175.42 3g1k s LEU 34 N -0.34 1.55 -0.16 2.97 2.96 0.13 -1.83 118.68 123.97 3g1k s LEU 34 Ca -0.02 -0.72 -0.10 0.00 -0.22 0.00 0.00 54.13 53.07 3g1k s LEU 34 Cb -0.03 -0.84 -0.05 0.00 0.50 0.00 0.00 46.19 45.78 3g1k s LEU 34 CO -0.00 -0.22 0.19 0.00 -1.32 0.00 0.00 176.35 175.00 3g1k s LEU 36 N -0.11 2.05 0.14 0.00 1.43 0.65 -1.44 118.68 121.40 3g1k s LEU 36 Ca 0.13 -0.35 0.10 0.00 -1.03 0.00 0.00 54.13 52.99 3g1k s LEU 36 Cb -0.12 -0.92 -0.04 0.00 0.03 0.00 0.00 46.19 45.14 3g1k s LEU 36 CO 0.02 0.21 -0.25 -1.10 0.23 0.00 0.00 176.35 175.46 3g1k s GLN 37 N -0.51 1.37 -0.93 1.70 1.11 -0.65 -1.72 119.66 120.04 3g1k s GLN 37 Ca 0.07 -1.36 -0.05 0.00 0.01 0.00 0.00 55.36 54.03 3g1k s GLN 37 Cb -0.07 -1.76 -0.06 0.00 -1.01 0.00 0.00 33.01 30.11 3g1k s GLN 37 CO -0.00 0.40 0.81 0.39 0.01 0.00 0.00 175.29 176.91 3g1k n GLU 38 N 0.77 -1.97 0.15 2.91 1.02 -0.55 -1.24 120.64 121.73 3g1k n GLU 38 Ca -0.17 0.81 0.02 0.00 -0.02 0.00 0.00 57.16 57.80 3g1k n GLU 38 Cb 0.54 -5.39 0.20 0.00 -0.02 0.00 0.00 31.44 26.77 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 -0.90 1.17 0.00 -3.67 3.07 -0.12 0.36 117.51 117.43 3g1k h ILE 39 Ca -0.52 -1.99 0.00 0.00 1.55 0.00 0.00 64.86 63.90 3g1k h ILE 39 Cb 1.26 2.14 0.00 0.00 -0.27 0.00 0.00 36.82 39.96 3g1k h ILE 39 CO 0.39 0.53 0.00 0.29 -1.05 0.00 0.00 178.15 178.30 3g1k n LYS 40 N -3.58 0.00 -3.06 0.16 5.02 0.18 -1.63 118.16 115.24 3g1k n LYS 40 Ca -0.00 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.96 3g1k n LYS 40 Cb 0.61 -0.34 -0.06 0.00 -0.02 0.00 0.00 35.03 35.22 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 3.27 0.08 7.82 0.00 -1.26 -1.99 121.76 129.67 3g1k s ALA 41 Ca 0.00 0.13 -0.31 0.00 0.00 0.00 0.00 51.96 51.79 3g1k s ALA 41 Cb 0.00 -2.86 -0.07 0.00 0.00 0.00 0.00 23.12 20.19 3g1k s ALA 41 CO 0.00 0.29 1.32 0.00 0.00 0.00 0.00 175.76 177.37 3g1k s ALA 42 N -1.99 3.52 0.36 0.00 0.00 -1.26 -4.92 121.76 117.47 3g1k s ALA 42 Ca 0.55 1.00 0.10 0.00 0.00 0.00 0.00 51.96 53.60 3g1k s ALA 42 Cb -0.11 -3.51 0.85 0.00 0.00 0.00 0.00 23.12 20.35 3g1k s ALA 42 CO 0.17 -0.58 1.86 -1.35 0.00 0.00 0.00 175.76 175.85 3g1k h PRO 43 N 6.91 0.64 -0.55 0.00 0.11 -1.98 0.16 132.00 137.29 3g1k h PRO 43 Ca -0.41 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3g1k h PRO 43 Cb 1.21 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3g1k h PRO 43 CO 0.85 0.42 0.00 0.39 -0.21 0.00 0.00 178.00 179.45 3g1k n GLU 44 N -4.58 0.79 0.00 1.05 4.71 -1.26 -2.47 120.64 118.88 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 0.51 -1.27 0.00 0.00 -1.01 0.00 0.00 31.44 29.67 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 -0.08 3.70 -1.94 3.49 1.13 0.04 -5.09 117.38 118.63 3g1k n GLN 45 Ca 0.00 0.00 -0.39 0.00 -1.94 0.00 0.00 57.00 54.67 3g1k n GLN 45 Cb 0.14 -0.53 0.02 0.00 0.11 0.00 0.00 30.24 29.97 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 -1.63 4.01 0.30 1.08 1.43 -1.03 -4.95 118.68 117.90 3g1k s LEU 46 Ca 0.00 2.68 -0.29 0.00 -1.03 0.00 0.00 54.13 55.49 3g1k s LEU 46 Cb 0.00 -4.12 -0.13 0.00 0.03 0.00 0.00 46.19 41.97 3g1k s LEU 46 CO 0.00 -1.20 1.21 -2.65 0.23 0.00 0.00 176.35 173.93 3g1k n PRO 47 N -0.50 1.82 -0.02 1.29 -0.02 -1.26 -4.85 135.00 131.46 3g1k n PRO 47 Ca 0.07 0.64 0.04 0.00 -2.02 0.00 0.00 63.50 62.23 3g1k n PRO 47 Cb 0.45 -2.16 0.41 0.00 -0.02 0.00 0.00 33.50 32.18 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 2.63 0.58 0.00 -0.52 3.08 -1.98 -0.92 114.38 117.24 3g1k h ARG 48 Ca -0.44 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.58 3g1k h ARG 48 Cb 1.30 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.22 3g1k h ARG 48 CO 0.64 0.38 0.00 1.63 -1.07 0.00 0.00 179.97 181.55 3g1k n LYS 49 N -4.47 0.14 -0.03 0.04 5.02 -1.26 -0.74 118.16 116.86 3g1k n LYS 49 Ca 0.04 0.47 -0.21 0.00 -2.02 0.00 0.00 58.31 56.58 3g1k n LYS 49 Cb 0.06 -1.82 -0.13 0.00 -0.02 0.00 0.00 35.03 33.12 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 0.26 -0.82 -0.35 3.38 -1.52 -3.38 115.31 112.89 3g1k h LEU 50 Ca 0.00 -0.79 -0.09 0.00 0.09 0.00 0.00 57.88 57.09 3g1k h LEU 50 Cb 0.22 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 3g1k h LEU 50 CO 0.00 1.58 -0.44 0.08 0.09 0.00 0.00 178.44 179.75 3g1k h ARG 51 N -0.48 0.00 -2.76 1.13 0.11 -1.38 -3.37 114.38 107.63 3g1k h ARG 51 Ca -0.31 0.00 -0.62 0.00 0.10 0.00 0.00 59.98 59.14 3g1k h ARG 51 Cb 1.63 0.00 -0.41 0.00 1.11 0.00 0.00 29.97 32.30 3g1k h ARG 51 CO -0.01 0.44 -0.51 0.72 0.10 0.00 0.00 179.97 180.71 3g1k n HIS 52 N -3.56 3.47 -3.17 4.08 8.25 0.08 -4.66 115.22 119.71 3g1k n HIS 52 Ca -0.00 -4.21 -0.39 0.00 -0.26 0.00 0.00 57.72 52.86 3g1k n HIS 52 Cb 0.55 -0.66 -0.05 0.00 1.12 0.00 0.00 29.99 30.95 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 -1.88 5.11 0.03 1.59 1.01 -1.26 -4.73 120.40 120.27 3g1k s VAL 53 Ca 0.31 1.21 -0.30 0.00 0.00 0.00 0.00 61.98 63.20 3g1k s VAL 53 Cb 0.03 -3.94 -0.06 0.00 0.00 0.00 0.00 36.38 32.41 3g1k s VAL 53 CO -0.10 0.28 1.42 -0.70 0.00 0.00 0.00 175.10 176.00 3g1k s GLU 54 N 0.76 4.29 0.00 2.72 2.12 -1.26 -2.20 118.70 125.13 3g1k s GLU 54 Ca 0.32 2.02 0.00 0.00 0.36 0.00 0.00 54.97 57.67 3g1k s GLU 54 Cb -0.16 -3.50 0.00 0.00 0.26 0.00 0.00 34.13 30.73 3g1k s GLU 54 CO 0.14 -0.55 0.00 0.41 -0.54 0.00 0.00 175.26 174.72 3g1k n GLY 55 N 3.63 0.57 2.98 -1.50 0.00 -1.26 -5.04 105.19 104.57 3g1k n GLY 55 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.21 1.64 0.34 1.61 2.02 -0.93 -4.15 117.35 115.66 3g1k s TYR 56 Ca 0.00 -0.76 -0.27 0.00 -0.37 0.00 0.00 57.07 55.67 3g1k s TYR 56 Cb 0.00 -1.26 -0.09 0.00 -0.40 0.00 0.00 41.96 40.21 3g1k s TYR 56 CO 0.00 -0.45 1.07 1.03 -1.57 0.00 0.00 175.55 175.63 3g1k s ARG 57 N 1.22 4.41 -0.04 -0.62 0.52 -0.57 -4.36 118.95 119.51 3g1k s ARG 57 Ca -0.03 1.65 0.06 0.00 -0.52 0.00 0.00 55.73 56.89 3g1k s ARG 57 Cb -0.14 -2.88 -0.01 0.00 0.52 0.00 0.00 34.95 32.44 3g1k s ARG 57 CO -0.03 0.05 -0.23 -1.54 0.02 0.00 0.00 175.30 173.57 3g1k s SER 58 N -1.23 2.74 -0.13 0.23 1.04 -1.26 -1.10 113.70 114.00 3g1k s SER 58 Ca 0.51 -0.44 0.01 0.00 0.48 0.00 0.00 55.95 56.50 3g1k s SER 58 Cb -0.27 -0.59 0.02 0.00 0.10 0.00 0.00 66.02 65.28 3g1k s SER 58 CO 0.34 0.24 -0.14 -0.36 0.98 0.00 0.00 173.24 174.30 3g1k s PHE 59 N -0.26 2.03 -0.07 5.02 0.40 0.12 -4.98 117.98 120.24 3g1k s PHE 59 Ca 0.01 -1.06 0.03 0.00 -0.60 0.00 0.00 56.93 55.32 3g1k s PHE 59 Cb -0.11 -1.49 -0.02 0.00 0.51 0.00 0.00 43.02 41.90 3g1k s PHE 59 CO 0.02 -0.57 -0.16 -0.06 0.70 0.00 0.00 175.22 175.14 3g1k s PHE 60 N 1.29 2.68 -0.48 0.36 0.40 -1.26 -0.29 117.98 120.67 3g1k s PHE 60 Ca -0.00 -0.35 0.04 0.00 -0.60 0.00 0.00 56.93 56.01 3g1k s PHE 60 Cb -0.14 -1.67 0.16 0.00 0.51 0.00 0.00 43.02 41.88 3g1k s PHE 60 CO -0.07 0.03 0.35 0.99 0.70 0.00 0.00 175.22 177.23 3g1k s THR 61 N -0.40 1.09 0.65 0.64 2.01 -0.10 -5.02 115.64 114.51 3g1k s THR 61 Ca 0.04 -2.93 -0.12 0.00 0.31 0.00 0.00 61.69 59.00 3g1k s THR 61 Cb -0.12 -1.75 -0.02 0.00 0.01 0.00 0.00 72.50 70.62 3g1k s THR 61 CO 0.02 -1.10 1.05 -2.16 -0.69 0.00 0.00 174.62 171.73 3g1k s PRO 62 N -0.15 3.24 0.85 4.92 0.04 -1.26 -2.10 135.00 140.54 3g1k s PRO 62 Ca 0.27 0.93 -0.11 0.00 0.04 0.00 0.00 61.00 62.13 3g1k s PRO 62 Cb -0.05 -2.03 0.14 0.00 0.04 0.00 0.00 34.50 32.60 3g1k s PRO 62 CO -0.14 -0.86 1.19 0.00 0.04 0.00 0.00 177.00 177.24 3g1k s ALA 63 N -2.97 2.69 -0.08 8.56 0.00 -1.26 -3.69 121.76 125.00 3g1k s ALA 63 Ca 0.58 -1.13 -0.22 0.00 0.00 0.00 0.00 51.96 51.19 3g1k s ALA 63 Cb -0.13 -2.67 -0.18 0.00 0.00 0.00 0.00 23.12 20.14 3g1k s ALA 63 CO 0.51 -1.95 0.81 0.93 0.00 0.00 0.00 175.76 176.05 3g1k h GLU 64 N -1.19 -0.08 -6.61 0.00 5.08 -1.85 -3.45 114.58 106.49 3g1k h GLU 64 Ca -0.44 0.01 -0.58 0.00 -1.00 0.00 0.00 59.36 57.35 3g1k h GLU 64 Cb 1.27 0.02 0.10 0.00 0.50 0.00 0.00 28.75 30.63 3g1k h GLU 64 CO 0.48 0.52 0.49 0.54 -1.00 0.00 0.00 179.01 180.03 3g1k n ARG 65 N -4.79 1.92 -2.98 2.33 1.74 -1.26 -4.97 116.66 108.66 3g1k n ARG 65 Ca -0.08 0.68 -0.36 0.00 -0.77 0.00 0.00 57.85 57.32 3g1k n ARG 65 Cb 0.31 -2.26 -0.06 0.00 -1.02 0.00 0.00 32.46 29.42 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 -1.07 4.35 0.00 5.56 3.01 -1.26 -3.83 119.74 126.50 3g1k s LYS 66 Ca 0.63 1.03 0.00 0.00 -1.01 0.00 0.00 55.97 56.62 3g1k s LYS 66 Cb -0.64 -2.79 0.00 0.00 -1.01 0.00 0.00 37.83 33.39 3g1k s LYS 66 CO 0.56 0.32 0.00 0.41 0.51 0.00 0.00 175.35 177.14 3g1k n GLY 67 N 0.53 1.01 3.16 -3.33 0.00 -0.84 -5.01 105.19 100.72 3g1k n GLY 67 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.72 1.85 0.00 1.61 5.04 -0.90 -4.64 117.35 116.59 3g1k s TYR 68 Ca 0.00 -0.52 0.00 0.00 -2.44 0.00 0.00 57.07 54.11 3g1k s TYR 68 Cb 0.00 -1.24 0.00 0.00 0.35 0.00 0.00 41.96 41.07 3g1k s TYR 68 CO 0.00 -0.16 0.00 0.45 -1.34 0.00 0.00 175.55 174.50 3g1k n SER 69 N 3.06 0.00 0.00 4.32 2.88 -1.26 -4.31 113.62 118.32 3g1k n SER 69 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 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 -1.99 3.36 0.46 0.00 -0.97 0.47 105.19 106.52 3g1k n GLY 70 Ca 0.00 -1.26 -0.22 0.00 0.00 0.00 0.00 46.02 44.54 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 -2.00 1.93 0.04 1.61 -7.23 -0.77 -1.48 120.40 112.49 3g1k s VAL 71 Ca 0.00 -2.03 -0.06 0.00 -1.81 0.00 0.00 61.98 58.07 3g1k s VAL 71 Cb 0.00 -1.96 -0.01 0.00 0.56 0.00 0.00 36.38 34.98 3g1k s VAL 71 CO 0.00 -0.36 0.11 0.00 -0.31 0.00 0.00 175.10 174.54 3g1k s ALA 72 N -2.23 -0.11 -0.04 1.32 0.00 -0.70 -0.93 121.76 119.08 3g1k s ALA 72 Ca 0.19 -0.51 -0.02 0.00 0.00 0.00 0.00 51.96 51.62 3g1k s ALA 72 Cb -0.05 0.26 0.03 0.00 0.00 0.00 0.00 23.12 23.36 3g1k s ALA 72 CO 0.08 -0.33 0.08 1.41 0.00 0.00 0.00 175.76 177.00 3g1k s MET 73 N -2.61 -0.01 -0.16 0.00 1.75 0.60 -0.25 119.30 118.61 3g1k s MET 73 Ca -0.05 0.33 -0.04 0.00 -1.25 0.00 0.00 55.69 54.68 3g1k s MET 73 Cb -0.01 -0.30 -0.03 0.00 2.84 0.00 0.00 34.83 37.33 3g1k s MET 73 CO -0.05 -0.23 -0.03 0.71 -0.65 0.00 0.00 175.02 174.78 3g1k s TYR 74 N 1.53 3.02 -0.07 4.11 1.51 -0.55 0.10 117.35 127.00 3g1k s TYR 74 Ca -0.04 -0.35 -0.04 0.00 -1.01 0.00 0.00 57.07 55.63 3g1k s TYR 74 Cb -0.12 -1.98 0.03 0.00 -0.11 0.00 0.00 41.96 39.78 3g1k s TYR 74 CO -0.04 -0.09 0.16 -0.08 -1.11 0.00 0.00 175.55 174.39 3g1k s THR 75 N 0.49 -0.03 0.07 -0.71 -1.32 -0.26 0.18 115.64 114.07 3g1k s THR 75 Ca -0.03 0.10 -0.25 0.00 -1.21 0.00 0.00 61.69 60.30 3g1k s THR 75 Cb -0.14 -0.25 -0.16 0.00 -1.51 0.00 0.00 72.50 70.43 3g1k s THR 75 CO 0.03 0.04 1.63 0.11 -2.21 0.00 0.00 174.62 174.22 3g1k h LYS 76 N 6.68 -0.16 -5.10 7.08 1.57 -1.56 -1.52 116.57 123.57 3g1k h LYS 76 Ca -0.35 0.01 -0.62 0.00 -1.87 0.00 0.00 60.65 57.81 3g1k h LYS 76 Cb 1.17 0.04 -0.16 0.00 0.08 0.00 0.00 32.23 33.35 3g1k h LYS 76 CO 0.41 -0.03 -0.54 0.08 -0.57 0.00 0.00 179.45 178.80 3g1k s VAL 77 N -5.84 5.07 0.70 0.50 1.01 -1.26 -4.56 120.40 116.02 3g1k s VAL 77 Ca -0.14 0.08 -0.15 0.00 0.00 0.00 0.00 61.98 61.76 3g1k s VAL 77 Cb 0.05 -3.35 0.02 0.00 0.00 0.00 0.00 36.38 33.10 3g1k s VAL 77 CO 0.65 0.37 1.17 -2.16 0.00 0.00 0.00 175.10 175.13 3g1k s PRO 78 N 1.02 2.40 0.52 2.72 0.04 -1.26 -5.03 135.00 135.41 3g1k s PRO 78 Ca 0.06 1.64 -0.11 0.00 0.04 0.00 0.00 61.00 62.63 3g1k s PRO 78 Cb -0.14 -1.88 -0.05 0.00 0.04 0.00 0.00 34.50 32.47 3g1k s PRO 78 CO 0.04 -1.61 0.91 -1.25 0.04 0.00 0.00 177.00 175.13 3g1k s PRO 79 N -3.94 3.70 0.17 0.56 0.04 -1.26 -4.98 135.00 129.28 3g1k s PRO 79 Ca 0.72 0.61 -0.25 0.00 0.04 0.00 0.00 61.00 62.12 3g1k s PRO 79 Cb -0.26 -2.22 0.05 0.00 0.04 0.00 0.00 34.50 32.10 3g1k s PRO 79 CO 0.43 -0.32 1.57 0.77 0.04 0.00 0.00 177.00 179.50 3g1k h SER 80 N 0.39 -1.39 -5.48 6.66 0.02 -1.16 -3.45 113.55 109.13 3g1k h SER 80 Ca -0.46 0.23 -0.19 0.00 -0.84 0.00 0.00 61.79 60.53 3g1k h SER 80 Cb 1.19 0.64 -0.12 0.00 0.14 0.00 0.00 62.40 64.25 3g1k h SER 80 CO 0.62 -0.34 -0.38 -0.94 -1.14 0.00 0.00 176.83 174.66 3g1k s SER 81 N -5.13 0.27 -0.04 3.07 1.04 -1.25 -5.02 113.70 106.63 3g1k s SER 81 Ca -0.14 -1.26 -0.01 0.00 0.48 0.00 0.00 55.95 55.01 3g1k s SER 81 Cb 0.13 0.50 0.03 0.00 0.10 0.00 0.00 66.02 66.79 3g1k s SER 81 CO 0.67 -1.02 0.04 -0.22 0.98 0.00 0.00 173.24 173.68 3g1k s LEU 82 N -3.13 0.44 -0.05 2.42 2.96 -1.26 -1.16 118.68 118.89 3g1k s LEU 82 Ca 0.32 0.03 -0.04 0.00 -0.22 0.00 0.00 54.13 54.22 3g1k s LEU 82 Cb 0.03 -0.21 -0.04 0.00 0.50 0.00 0.00 46.19 46.47 3g1k s LEU 82 CO 0.13 -0.21 0.15 -0.13 -1.32 0.00 0.00 176.35 174.97 3g1k s ARG 83 N 1.90 3.38 -0.27 1.98 0.52 0.67 -4.95 118.95 122.18 3g1k s ARG 83 Ca 0.02 -0.28 0.10 0.00 -0.52 0.00 0.00 55.73 55.05 3g1k s ARG 83 Cb -0.12 -3.09 0.46 0.00 0.52 0.00 0.00 34.95 32.71 3g1k s ARG 83 CO -0.03 0.71 1.18 0.39 0.02 0.00 0.00 175.30 177.57 3g1k n GLU 84 N 1.37 3.04 0.00 3.54 1.02 -1.26 -0.72 120.64 127.63 3g1k n GLU 84 Ca -0.14 -3.93 0.00 0.00 -0.02 0.00 0.00 57.16 53.07 3g1k n GLU 84 Cb 0.53 -2.06 0.00 0.00 -0.02 0.00 0.00 31.44 29.89 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 -0.72 1.02 0.11 0.62 0.00 -1.26 -4.73 105.19 100.22 3g1k n GLY 85 Ca 0.35 -0.70 0.10 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.17 0.94 0.00 1.61 0.99 -1.26 -4.97 117.46 114.60 3g1k n PHE 86 Ca 0.00 0.28 0.00 0.00 -0.00 0.00 0.00 57.45 57.73 3g1k n PHE 86 Cb 0.00 -0.96 0.00 0.00 -1.00 0.00 0.00 39.48 37.52 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 1.22 0.61 3.64 1.37 0.00 -1.26 -4.99 105.19 105.78 3g1k n GLY 87 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 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 4.74 0.06 1.61 1.01 -1.26 -5.05 120.40 119.51 3g1k s VAL 88 Ca 0.00 -0.06 -0.28 0.00 0.00 0.00 0.00 61.98 61.64 3g1k s VAL 88 Cb 0.00 -3.12 -0.17 0.00 0.00 0.00 0.00 36.38 33.09 3g1k s VAL 88 CO 0.00 0.48 1.57 -0.08 0.00 0.00 0.00 175.10 177.07 3g1k h GLU 89 N 6.51 -0.50 0.00 2.72 4.81 -2.00 -2.94 114.58 123.18 3g1k h GLU 89 Ca -0.38 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 3g1k h GLU 89 Cb 1.17 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.67 3g1k h GLU 89 CO 0.69 -0.29 0.00 2.89 -0.73 0.00 0.00 179.01 181.57 3g1k n ARG 90 N -5.28 0.03 -0.07 1.92 1.85 -1.26 -1.55 116.66 112.30 3g1k n ARG 90 Ca -0.11 0.34 -0.04 0.00 -1.00 0.00 0.00 57.85 57.04 3g1k n ARG 90 Cb 0.25 -1.50 -0.15 0.00 -1.05 0.00 0.00 32.46 30.00 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 -1.42 0.00 0.64 2.89 0.99 -1.12 -4.58 117.46 114.86 3g1k n PHE 91 Ca 0.02 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.59 3g1k n PHE 91 Cb 0.06 -0.80 0.26 0.00 -1.00 0.00 0.00 39.48 37.99 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 -2.56 0.68 -0.96 4.37 10.43 -0.59 -3.99 116.55 123.92 3g1k n ASP 92 Ca -0.23 0.22 0.09 0.00 2.57 0.00 0.00 54.79 57.45 3g1k n ASP 92 Cb 0.95 -0.10 0.25 0.00 1.84 0.00 0.00 41.12 44.06 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 -2.07 0.63 -0.92 -3.53 -2.24 -1.18 -4.18 114.28 100.80 3g1k n THR 93 Ca 0.04 -0.68 0.08 0.00 -2.27 0.00 0.00 64.05 61.23 3g1k n THR 93 Cb 0.42 0.44 0.23 0.00 -2.10 0.00 0.00 70.33 69.33 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 1.04 2.71 -3.84 -0.78 1.02 -1.26 -2.77 120.64 116.76 3g1k n GLU 94 Ca 0.18 -2.72 -0.30 0.00 -0.02 0.00 0.00 57.16 54.31 3g1k n GLU 94 Cb 0.46 -1.74 0.01 0.00 -0.02 0.00 0.00 31.44 30.15 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 -0.54 -0.59 0.00 0.62 0.00 -1.24 -3.86 105.19 99.58 3g1k n GLY 95 Ca 0.19 0.29 0.02 0.00 0.00 0.00 0.00 46.02 46.53 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 -4.36 3.34 -4.34 1.61 1.74 -1.26 -1.85 116.66 111.54 3g1k n ARG 96 Ca -0.20 -0.02 -0.33 0.00 -0.77 0.00 0.00 57.85 56.53 3g1k n ARG 96 Cb 0.64 -0.87 -0.16 0.00 -1.02 0.00 0.00 32.46 31.05 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 -1.78 2.11 -0.15 0.55 1.01 -1.26 -1.36 121.20 120.32 3g1k s ILE 97 Ca 0.00 -0.94 -0.01 0.00 0.00 0.00 0.00 60.65 59.70 3g1k s ILE 97 Cb 0.03 -1.87 0.04 0.00 0.01 0.00 0.00 42.46 40.67 3g1k s ILE 97 CO 0.18 0.54 -0.04 -1.10 0.00 0.00 0.00 174.94 174.52 3g1k s GLN 98 N 1.10 1.27 -0.36 2.79 -0.21 -0.56 -4.22 119.66 119.45 3g1k s GLN 98 Ca 0.00 -0.41 0.00 0.00 0.02 0.00 0.00 55.36 54.97 3g1k s GLN 98 Cb -0.14 -1.86 0.10 0.00 1.00 0.00 0.00 33.01 32.10 3g1k s GLN 98 CO -0.08 -0.42 0.11 0.42 -2.12 0.00 0.00 175.29 173.19 3g1k s ILE 99 N 1.70 2.81 -0.16 1.08 1.01 0.10 0.22 121.20 127.96 3g1k s ILE 99 Ca 0.01 -2.08 -0.05 0.00 0.00 0.00 0.00 60.65 58.53 3g1k s ILE 99 Cb -0.15 -2.93 -0.03 0.00 0.01 0.00 0.00 42.46 39.36 3g1k s ILE 99 CO -0.07 -0.56 0.01 0.00 0.00 0.00 0.00 174.94 174.31 3g1k s ALA 100 N 1.06 3.19 -0.39 9.38 0.00 -0.46 -0.24 121.76 134.29 3g1k s ALA 100 Ca 0.07 -0.78 -0.19 0.00 0.00 0.00 0.00 51.96 51.06 3g1k s ALA 100 Cb -0.21 -1.71 0.01 0.00 0.00 0.00 0.00 23.12 21.22 3g1k s ALA 100 CO -0.05 0.22 0.54 0.34 0.00 0.00 0.00 175.76 176.81 3g1k s ASP 101 N 0.29 6.30 -0.32 0.00 -1.08 -0.31 -0.61 116.67 120.92 3g1k s ASP 101 Ca -0.00 -0.26 0.09 0.00 -0.52 0.00 0.00 52.55 51.86 3g1k s ASP 101 Cb -0.13 -2.28 0.63 0.00 -1.46 0.00 0.00 42.92 39.68 3g1k s ASP 101 CO 0.02 -0.60 1.68 0.49 0.52 0.00 0.00 175.17 177.28 3g1k n PHE 102 N 5.89 2.00 0.00 -5.34 3.01 -0.15 -0.50 117.46 122.38 3g1k n PHE 102 Ca -0.04 -1.43 0.00 0.00 1.01 0.00 0.00 57.45 56.99 3g1k n PHE 102 Cb 0.48 -0.64 0.00 0.00 -0.01 0.00 0.00 39.48 39.31 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 -0.73 0.00 0.14 4.37 8.00 -1.26 -4.08 116.55 122.99 3g1k n ASP 103 Ca 0.41 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.91 3g1k n ASP 103 Cb 1.29 0.00 0.14 0.00 -0.02 0.00 0.00 41.12 42.52 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 -5.06 -2.24 3.32 -1.96 -3.47 116.42 107.01 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 0.60 0.09 0.72 -1.72 0.00 0.00 179.24 178.93 3g1k s PHE 105 N -3.29 -0.22 -0.10 4.55 -0.71 -1.26 -4.48 117.98 112.47 3g1k s PHE 105 Ca 0.01 -0.11 -0.05 0.00 -1.04 0.00 0.00 56.93 55.73 3g1k s PHE 105 Cb 0.11 0.46 -0.04 0.00 -1.21 0.00 0.00 43.02 42.34 3g1k s PHE 105 CO 0.75 -0.94 0.11 -0.51 -1.34 0.00 0.00 175.22 173.29 3g1k s LEU 106 N -2.85 4.20 -0.26 -1.99 1.43 0.85 -0.98 118.68 119.08 3g1k s LEU 106 Ca 0.07 0.38 -0.01 0.00 -1.03 0.00 0.00 54.13 53.54 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 -0.04 0.38 -0.06 -0.22 0.23 0.00 0.00 176.35 176.65 3g1k s LEU 107 N -1.13 3.37 -0.36 1.79 2.96 0.22 -0.46 118.68 125.07 3g1k s LEU 107 Ca 0.16 -1.04 -0.19 0.00 -0.22 0.00 0.00 54.13 52.84 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 0.06 -0.17 0.56 -0.31 -1.32 0.00 0.00 176.35 175.17 3g1k s TYR 108 N 1.27 3.16 -0.45 5.38 1.51 0.17 -1.36 117.35 127.04 3g1k s TYR 108 Ca -0.02 0.19 -0.11 0.00 -1.01 0.00 0.00 57.07 56.11 3g1k s TYR 108 Cb -0.18 -3.04 0.09 0.00 -0.11 0.00 0.00 41.96 38.72 3g1k s TYR 108 CO -0.04 -0.61 0.33 1.21 -1.11 0.00 0.00 175.55 175.33 3g1k s ASN 109 N 1.80 5.83 -0.04 2.29 2.47 0.13 -0.75 114.94 126.67 3g1k s ASN 109 Ca 0.21 -1.53 0.07 0.00 0.42 0.00 0.00 52.86 52.03 3g1k s ASN 109 Cb -0.15 -2.06 -0.01 0.00 -1.45 0.00 0.00 41.25 37.57 3g1k s ASN 109 CO 0.14 -0.61 -0.24 -0.63 -3.72 0.00 0.00 177.10 172.04 3g1k s ILE 110 N 1.49 1.91 -0.59 -5.21 -1.09 -0.61 -1.50 121.20 115.60 3g1k s ILE 110 Ca 0.04 -1.01 -0.01 0.00 -2.23 0.00 0.00 60.65 57.44 3g1k s ILE 110 Cb -0.24 -1.60 0.15 0.00 -1.58 0.00 0.00 42.46 39.19 3g1k s ILE 110 CO 0.03 0.54 0.39 -0.47 -1.23 0.00 0.00 174.94 174.19 3g1k s TYR 111 N -0.35 3.34 0.72 3.97 5.04 -0.46 -2.55 117.35 127.05 3g1k s TYR 111 Ca 0.03 -2.86 -0.15 0.00 -2.44 0.00 0.00 57.07 51.64 3g1k s TYR 111 Cb -0.11 -3.08 0.03 0.00 0.35 0.00 0.00 41.96 39.15 3g1k s TYR 111 CO 0.01 -0.81 1.21 -0.06 -1.34 0.00 0.00 175.55 174.56 3g1k s PHE 112 N -0.15 2.08 0.62 4.97 0.40 -0.09 -4.77 117.98 121.04 3g1k s PHE 112 Ca 0.17 1.59 -0.10 0.00 -0.60 0.00 0.00 56.93 57.98 3g1k s PHE 112 Cb -0.22 -3.48 0.14 0.00 0.51 0.00 0.00 43.02 39.98 3g1k s PHE 112 CO -0.02 -2.59 0.79 -2.30 0.70 0.00 0.00 175.22 171.80 3g1k n PRO 113 N -2.60 -1.00 -4.19 0.24 -0.02 -1.26 -4.75 135.00 121.42 3g1k n PRO 113 Ca 0.13 -1.23 -0.17 0.00 -2.02 0.00 0.00 63.50 60.21 3g1k n PRO 113 Cb 0.50 -0.86 -0.15 0.00 -0.02 0.00 0.00 33.50 32.97 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 -3.88 0.76 -0.85 2.55 6.03 -1.26 -4.69 114.94 113.60 3g1k s ASN 114 Ca 0.46 -0.11 -0.03 0.00 -1.03 0.00 0.00 52.86 52.14 3g1k s ASN 114 Cb -0.02 -0.17 0.20 0.00 -3.03 0.00 0.00 41.25 38.24 3g1k s ASN 114 CO 0.32 0.04 2.31 0.61 -2.03 0.00 0.00 177.10 178.36 3g1k n GLY 115 N 3.23 5.19 3.68 0.45 0.00 -1.26 -4.62 105.19 111.86 3g1k n GLY 115 Ca -0.16 -2.22 -0.28 0.00 0.00 0.00 0.00 46.02 43.36 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 -2.74 2.50 0.00 1.61 1.02 -1.26 -4.17 119.74 116.70 3g1k s LYS 116 Ca 0.52 -0.97 0.00 0.00 0.02 0.00 0.00 55.97 55.54 3g1k s LYS 116 Cb 0.32 -2.46 0.00 0.00 -0.52 0.00 0.00 37.83 35.17 3g1k s LYS 116 CO -0.23 0.49 0.00 -1.33 -0.92 0.00 0.00 175.35 173.36 3g1k n MET 117 N 0.15 0.00 -3.83 1.68 2.81 -1.26 -4.82 117.12 111.86 3g1k n MET 117 Ca -0.10 0.00 -0.07 0.00 -1.81 0.00 0.00 57.70 55.72 3g1k n MET 117 Cb 0.54 -0.39 0.02 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 -0.48 -0.02 0.02 7.83 1.04 -1.26 -5.05 113.70 115.78 3g1k s SER 118 Ca 0.00 -0.97 0.09 0.00 0.48 0.00 0.00 55.95 55.55 3g1k s SER 118 Cb 0.00 0.75 -0.23 0.00 0.10 0.00 0.00 66.02 66.64 3g1k s SER 118 CO 0.00 -1.47 0.89 -0.33 0.98 0.00 0.00 173.24 173.31 3g1k h GLU 119 N 2.00 0.02 -0.33 4.02 4.39 -1.92 -3.23 114.58 119.53 3g1k h GLU 119 Ca -0.30 -0.03 -0.08 0.00 0.34 0.00 0.00 59.36 59.29 3g1k h GLU 119 Cb 1.24 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.89 3g1k h GLU 119 CO 0.38 0.72 -0.12 0.93 -1.16 0.00 0.00 179.01 179.76 3g1k h GLU 120 N 0.00 0.66 -0.66 2.33 4.39 -1.96 0.26 114.58 119.59 3g1k h GLU 120 Ca -0.19 -0.27 0.09 0.00 0.34 0.00 0.00 59.36 59.34 3g1k h GLU 120 Cb 1.93 -0.03 -0.07 0.00 -0.10 0.00 0.00 28.75 30.48 3g1k h GLU 120 CO 0.10 0.85 0.30 0.00 -1.16 0.00 0.00 179.01 179.10 3g1k h ARG 121 N 0.43 0.50 -0.34 2.33 2.47 -1.88 0.81 114.38 118.71 3g1k h ARG 121 Ca 0.08 -0.03 -0.03 0.00 -1.26 0.00 0.00 59.98 58.74 3g1k h ARG 121 Cb 0.63 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.82 3g1k h ARG 121 CO 0.04 0.33 0.11 1.25 0.56 0.00 0.00 179.97 182.26 3g1k h LEU 122 N 0.52 0.49 -0.44 3.04 6.46 -1.49 -2.24 115.31 121.64 3g1k h LEU 122 Ca 0.33 -0.20 0.05 0.00 -0.12 0.00 0.00 57.88 57.94 3g1k h LEU 122 Cb 0.37 -0.13 -0.04 0.00 -0.73 0.00 0.00 40.66 40.13 3g1k h LEU 122 CO -0.28 0.56 0.19 0.50 -0.62 0.00 0.00 178.44 178.79 3g1k h LYS 123 N 0.39 0.38 -0.77 1.25 3.64 0.27 -1.03 116.57 120.69 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 0.24 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.94 3g1k h LYS 123 CO -0.00 0.25 0.45 -0.92 -2.27 0.00 0.00 179.45 176.96 3g1k h TYR 124 N 0.39 1.03 -0.14 1.91 3.20 -0.83 0.97 116.97 123.50 3g1k h TYR 124 Ca 0.20 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.08 3g1k h TYR 124 Cb 0.15 -0.34 -0.02 0.00 1.54 0.00 0.00 36.73 38.06 3g1k h TYR 124 CO -0.12 0.70 -0.00 -0.22 -1.64 0.00 0.00 178.16 176.88 3g1k h LYS 125 N 1.06 0.04 -0.35 1.82 3.64 -0.76 0.21 116.57 122.24 3g1k h LYS 125 Ca 0.27 -0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.51 3g1k h LYS 125 Cb -0.01 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 3g1k h LYS 125 CO -0.05 0.03 -0.34 -0.07 -2.27 0.00 0.00 179.45 176.75 3g1k h LEU 126 N 0.05 0.84 -0.75 5.20 4.07 -0.85 0.14 115.31 124.00 3g1k h LEU 126 Ca 0.07 -0.36 -0.10 0.00 0.08 0.00 0.00 57.88 57.56 3g1k h LEU 126 Cb 0.08 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.57 3g1k h LEU 126 CO -0.11 1.10 -0.16 -0.33 -1.08 0.00 0.00 178.44 177.86 3g1k h GLU 127 N 0.67 0.78 -0.11 1.13 5.08 -0.79 -1.35 114.58 119.99 3g1k h GLU 127 Ca 0.07 -0.28 0.01 0.00 -1.00 0.00 0.00 59.36 58.15 3g1k h GLU 127 Cb 0.89 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 3g1k h GLU 127 CO 0.08 0.89 0.06 0.35 -1.00 0.00 0.00 179.01 179.39 3g1k h PHE 128 N 0.70 0.11 -0.49 4.33 3.57 -0.47 0.07 116.94 124.76 3g1k h PHE 128 Ca 0.11 0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.71 3g1k h PHE 128 Cb 0.66 -0.03 -0.09 0.00 2.79 0.00 0.00 35.95 39.27 3g1k h PHE 128 CO 0.03 0.06 -0.11 1.88 -2.23 0.00 0.00 178.31 177.95 3g1k h TYR 129 N 0.13 -0.24 0.08 0.41 0.99 -0.54 -0.89 116.97 116.91 3g1k h TYR 129 Ca 0.04 0.04 0.01 0.00 2.00 0.00 0.00 58.73 60.82 3g1k h TYR 129 Cb 0.00 0.18 -0.01 0.00 1.00 0.00 0.00 36.73 37.90 3g1k h TYR 129 CO -0.09 -0.20 -0.10 -0.44 -0.00 0.00 0.00 178.16 177.33 3g1k h ASP 130 N 0.01 -0.27 -0.77 3.88 3.32 -0.69 -0.62 116.42 121.28 3g1k h ASP 130 Ca 0.24 0.03 0.07 0.00 0.02 0.00 0.00 57.03 57.38 3g1k h ASP 130 Cb 0.36 0.10 -0.05 0.00 0.22 0.00 0.00 39.33 39.96 3g1k h ASP 130 CO -0.49 -0.16 0.51 0.00 -1.72 0.00 0.00 179.24 177.38 3g1k h ALA 131 N 0.68 1.67 -0.37 3.45 0.00 -0.56 -0.87 119.26 123.26 3g1k h ALA 131 Ca 0.01 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 3g1k h ALA 131 Cb 0.22 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3g1k h ALA 131 CO -0.04 0.20 -0.10 0.35 0.00 0.00 0.00 179.25 179.65 3g1k h PHE 132 N 0.81 0.82 -0.26 0.00 3.57 -0.80 -2.05 116.94 119.03 3g1k h PHE 132 Ca 0.34 -0.18 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 3g1k h PHE 132 Cb 0.28 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 3g1k h PHE 132 CO -0.00 0.88 0.10 1.25 -2.23 0.00 0.00 178.31 178.31 3g1k h LEU 133 N 0.53 0.36 -1.14 0.59 7.12 -0.04 -1.08 115.31 121.65 3g1k h LEU 133 Ca 0.09 -0.18 0.01 0.00 0.13 0.00 0.00 57.88 57.93 3g1k h LEU 133 Cb 0.62 -0.09 -0.04 0.00 -0.53 0.00 0.00 40.66 40.61 3g1k h LEU 133 CO 0.04 0.44 0.56 -0.08 -0.13 0.00 0.00 178.44 179.27 3g1k h GLU 134 N 0.26 1.14 -0.26 1.25 4.81 -1.23 -1.62 114.58 118.93 3g1k h GLU 134 Ca 0.09 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.19 3g1k h GLU 134 Cb 0.20 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 3g1k h GLU 134 CO -0.01 0.76 -0.04 0.22 -0.73 0.00 0.00 179.01 179.21 3g1k h ASP 135 N 1.17 0.48 0.25 1.04 3.58 -0.95 -2.63 116.42 119.36 3g1k h ASP 135 Ca 0.31 -0.35 -0.11 0.00 0.42 0.00 0.00 57.03 57.31 3g1k h ASP 135 Cb -0.12 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 40.79 3g1k h ASP 135 CO -0.07 0.71 -0.42 1.62 -2.88 0.00 0.00 179.24 178.21 3g1k h VAL 136 N 0.24 1.31 -0.13 2.25 3.04 -1.00 -2.94 116.25 119.02 3g1k h VAL 136 Ca 0.07 -1.54 -0.03 0.00 -1.01 0.00 0.00 66.70 64.18 3g1k h VAL 136 Cb 0.49 1.71 -0.00 0.00 -2.01 0.00 0.00 31.29 31.47 3g1k h VAL 136 CO 0.02 0.46 -0.05 0.78 -1.01 0.00 0.00 177.57 177.77 3g1k h ASN 137 N 0.19 0.26 -0.98 3.17 2.35 -1.26 -0.55 115.58 118.77 3g1k h ASN 137 Ca 0.02 -0.40 0.14 0.00 -0.55 0.00 0.00 56.30 55.51 3g1k h ASN 137 Cb 0.83 -0.07 -0.09 0.00 0.05 0.00 0.00 38.32 39.04 3g1k h ASN 137 CO 0.06 0.60 0.61 -0.09 -1.65 0.00 0.00 177.43 176.97 3g1k h ARG 138 N -0.07 0.83 -0.08 0.81 2.43 -1.44 0.48 114.38 117.34 3g1k h ARG 138 Ca 0.03 -0.05 -0.16 0.00 -0.81 0.00 0.00 59.98 58.99 3g1k h ARG 138 Cb 0.50 -0.19 0.01 0.00 -0.42 0.00 0.00 29.97 29.87 3g1k h ARG 138 CO 0.02 0.55 -0.56 0.93 -1.51 0.00 0.00 179.97 179.39 3g1k h GLU 139 N 0.86 0.52 -0.43 0.20 4.39 -1.39 -3.02 114.58 115.71 3g1k h GLU 139 Ca 0.50 -0.45 -0.05 0.00 0.34 0.00 0.00 59.36 59.70 3g1k h GLU 139 Cb 0.65 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.39 3g1k h GLU 139 CO -0.27 1.09 0.09 -0.09 -1.16 0.00 0.00 179.01 178.66 3g1k h ARG 140 N 0.10 0.70 0.00 2.33 1.12 -0.58 -2.88 114.38 115.17 3g1k h ARG 140 Ca -0.05 -0.18 -0.00 0.00 -1.11 0.00 0.00 59.98 58.64 3g1k h ARG 140 Cb 1.22 -0.09 -0.00 0.00 -0.01 0.00 0.00 29.97 31.10 3g1k h ARG 140 CO 0.11 0.72 -0.02 -0.44 -3.11 0.00 0.00 179.97 177.23 3g1k h ASP 141 N 0.57 0.00 -0.05 -3.80 3.32 -0.11 0.25 116.42 116.59 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 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 3g1k h ASP 141 CO 0.00 0.02 0.00 -1.54 -1.72 0.00 0.00 179.24 176.01 3g1k n SER 142 N -3.92 0.51 0.00 6.45 3.41 -1.12 -4.89 113.62 114.06 3g1k n SER 142 Ca -0.03 -1.50 0.00 0.00 -0.26 0.00 0.00 58.87 57.08 3g1k n SER 142 Cb 0.11 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 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 0.90 0.66 3.88 5.00 0.00 0.07 -5.07 105.19 110.63 3g1k n GLY 143 Ca 0.15 -0.63 -0.31 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.20 3.77 -0.14 1.61 1.81 -1.10 -5.04 118.95 118.64 3g1k s ARG 144 Ca 0.00 0.22 -0.12 0.00 -1.72 0.00 0.00 55.73 54.11 3g1k s ARG 144 Cb 0.00 -2.65 -0.05 0.00 -0.45 0.00 0.00 34.95 31.81 3g1k s ARG 144 CO 0.00 0.30 0.26 -0.80 -0.68 0.00 0.00 175.30 174.37 3g1k s ASN 145 N -2.51 6.43 0.05 0.23 0.01 -1.26 -4.35 114.94 113.53 3g1k s ASN 145 Ca 0.47 0.51 0.05 0.00 -0.71 0.00 0.00 52.86 53.18 3g1k s ASN 145 Cb -0.11 -2.16 -0.04 0.00 0.41 0.00 0.00 41.25 39.35 3g1k s ASN 145 CO 0.23 0.18 -0.09 0.68 -1.51 0.00 0.00 177.10 176.60 3g1k s VAL 146 N 0.05 3.47 -0.15 1.60 -7.23 -1.26 -0.10 120.40 116.78 3g1k s VAL 146 Ca 0.16 -1.00 -0.01 0.00 -1.81 0.00 0.00 61.98 59.32 3g1k s VAL 146 Cb -0.13 -2.55 0.04 0.00 0.56 0.00 0.00 36.38 34.30 3g1k s VAL 146 CO 0.04 0.28 -0.05 -0.63 -0.31 0.00 0.00 175.10 174.43 3g1k s ILE 147 N -1.08 1.00 -0.21 -0.62 1.01 0.39 -3.45 121.20 118.24 3g1k s ILE 147 Ca 0.19 -0.48 -0.05 0.00 0.00 0.00 0.00 60.65 60.31 3g1k s ILE 147 Cb -0.11 -1.15 -0.02 0.00 0.01 0.00 0.00 42.46 41.19 3g1k s ILE 147 CO 0.10 0.18 -0.00 -0.63 0.00 0.00 0.00 174.94 174.59 3g1k s ILE 148 N 1.69 3.88 0.20 2.92 1.09 0.15 0.47 121.20 131.59 3g1k s ILE 148 Ca 0.02 -0.33 0.05 0.00 -1.10 0.00 0.00 60.65 59.28 3g1k s ILE 148 Cb -0.14 -2.76 -0.05 0.00 -1.06 0.00 0.00 42.46 38.45 3g1k s ILE 148 CO -0.08 0.42 -0.06 0.00 -0.10 0.00 0.00 174.94 175.12 3g1k n GLY 150 N -0.33 0.80 3.58 0.00 0.00 -1.08 -1.57 105.19 106.58 3g1k n GLY 150 Ca -0.07 -2.01 -0.43 0.00 0.00 0.00 0.00 46.02 43.50 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 6.54 0.10 1.61 2.15 -1.06 -2.56 116.67 119.45 3g1k s ASP 151 Ca 0.00 0.21 0.26 0.00 0.43 0.00 0.00 52.55 53.45 3g1k s ASP 151 Cb 0.00 -2.49 0.62 0.00 -0.30 0.00 0.00 42.92 40.76 3g1k s ASP 151 CO 0.00 -1.14 1.54 0.49 -0.17 0.00 0.00 175.17 175.88 3g1k n PHE 152 N 7.46 0.44 -1.89 -5.34 3.01 -0.11 -0.91 117.46 120.12 3g1k n PHE 152 Ca 0.08 0.13 -0.19 0.00 1.01 0.00 0.00 57.45 58.48 3g1k n PHE 152 Cb 0.49 -0.61 -0.05 0.00 -0.01 0.00 0.00 39.48 39.29 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 -1.92 -5.15 -3.69 4.37 3.02 -1.25 -4.81 115.26 105.83 3g1k n ASN 153 Ca 0.05 0.30 -0.11 0.00 -0.03 0.00 0.00 54.58 54.79 3g1k n ASN 153 Cb 0.40 -4.48 -0.11 0.00 -0.61 0.00 0.00 39.78 34.98 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 -2.73 -0.23 -0.01 3.41 2.01 -1.26 -4.31 115.64 112.52 3g1k s THR 154 Ca 0.00 0.15 -0.29 0.00 0.31 0.00 0.00 61.69 61.86 3g1k s THR 154 Cb 0.00 -0.55 -0.03 0.00 0.01 0.00 0.00 72.50 71.93 3g1k s THR 154 CO 0.00 0.06 0.95 0.00 -0.69 0.00 0.00 174.62 174.94 3g1k s ALA 155 N 1.81 3.18 0.00 7.40 0.00 -0.79 -4.62 121.76 128.74 3g1k s ALA 155 Ca -0.06 0.49 -0.13 0.00 0.00 0.00 0.00 51.96 52.26 3g1k s ALA 155 Cb -0.10 -3.29 -0.07 0.00 0.00 0.00 0.00 23.12 19.65 3g1k s ALA 155 CO -0.11 -0.22 0.82 1.25 0.00 0.00 0.00 175.76 177.49 3g1k h HIS 156 N 6.80 -0.42 -0.83 0.00 2.76 -1.89 -3.45 115.15 118.12 3g1k h HIS 156 Ca -0.41 -0.01 -0.63 0.00 -2.20 0.00 0.00 60.37 57.12 3g1k h HIS 156 Cb 1.22 0.14 -0.10 0.00 1.55 0.00 0.00 27.41 30.21 3g1k h HIS 156 CO 0.68 -0.26 -0.48 1.03 -1.30 0.00 0.00 177.93 177.60 3g1k s ARG 157 N -3.35 2.18 0.37 5.26 0.52 -1.26 -4.76 118.95 117.91 3g1k s ARG 157 Ca -0.07 -2.17 0.06 0.00 -0.52 0.00 0.00 55.73 53.04 3g1k s ARG 157 Cb 0.01 -1.76 0.77 0.00 0.52 0.00 0.00 34.95 34.48 3g1k s ARG 157 CO 0.20 -0.33 1.97 0.93 0.02 0.00 0.00 175.30 178.09 3g1k h GLU 158 N 1.29 0.70 0.00 3.54 5.08 -1.95 -0.73 114.58 122.51 3g1k h GLU 158 Ca -0.42 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 3g1k h GLU 158 Cb 1.29 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.38 3g1k h GLU 158 CO 0.71 0.46 0.00 1.51 -1.00 0.00 0.00 179.01 180.69 3g1k n ILE 159 N -4.48 0.65 -0.54 3.13 3.06 -1.26 -2.79 119.36 117.14 3g1k n ILE 159 Ca 0.10 0.16 0.10 0.00 -2.50 0.00 0.00 62.75 60.61 3g1k n ILE 159 Cb 0.21 -1.03 0.33 0.00 0.54 0.00 0.00 39.64 39.69 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 -1.22 4.35 -3.53 9.51 8.00 -0.28 -4.22 116.55 129.16 3g1k n ASP 160 Ca 0.04 -2.32 -0.16 0.00 0.71 0.00 0.00 54.79 53.07 3g1k n ASP 160 Cb 0.06 -0.52 -0.05 0.00 -0.02 0.00 0.00 41.12 40.58 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 -1.60 -0.58 0.08 0.64 2.34 -1.12 -1.13 118.68 117.31 3g1k s LEU 161 Ca 0.48 0.58 -0.34 0.00 0.06 0.00 0.00 54.13 54.90 3g1k s LEU 161 Cb 0.29 2.38 -0.17 0.00 -0.56 0.00 0.00 46.19 48.13 3g1k s LEU 161 CO 0.25 -0.58 1.59 0.00 -1.06 0.00 0.00 176.35 176.56 3g1k h ALA 162 N 2.81 -1.04 -3.18 1.48 0.00 -1.56 -3.36 119.26 114.42 3g1k h ALA 162 Ca -0.25 -0.19 -0.69 0.00 0.00 0.00 0.00 54.91 53.77 3g1k h ALA 162 Cb 1.16 0.55 -0.36 0.00 0.00 0.00 0.00 17.79 19.14 3g1k h ALA 162 CO 0.37 -1.11 -0.37 1.03 0.00 0.00 0.00 179.25 179.17 3g1k s ARG 163 N -5.97 2.55 0.11 0.00 0.52 -1.26 -4.92 118.95 109.98 3g1k s ARG 163 Ca -0.18 -2.56 -0.13 0.00 -0.52 0.00 0.00 55.73 52.34 3g1k s ARG 163 Cb 0.04 -3.71 -0.12 0.00 0.52 0.00 0.00 34.95 31.68 3g1k s ARG 163 CO 0.61 -1.17 1.36 -1.00 0.02 0.00 0.00 175.30 175.12 3g1k h PRO 164 N 6.96 0.83 -0.53 3.54 0.13 -1.86 -3.33 132.00 137.74 3g1k h PRO 164 Ca -0.01 -0.58 -0.05 0.00 -0.87 0.00 0.00 66.00 64.49 3g1k h PRO 164 Cb 0.94 0.09 -0.02 0.00 0.13 0.00 0.00 31.00 32.14 3g1k h PRO 164 CO 0.71 1.20 0.13 0.87 -0.23 0.00 0.00 178.00 180.69 3g1k h LYS 165 N 0.59 0.85 -0.01 0.86 1.57 -1.96 -2.23 116.57 116.25 3g1k h LYS 165 Ca -0.01 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 3g1k h LYS 165 Cb 1.23 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.43 3g1k h LYS 165 CO 0.13 0.81 -0.03 -0.85 -0.57 0.00 0.00 179.45 178.93 3g1k n GLU 166 N -4.43 1.07 -0.00 3.15 0.00 -1.26 -4.02 120.64 115.15 3g1k n GLU 166 Ca 0.02 -0.33 0.05 0.00 0.00 0.00 0.00 57.16 56.90 3g1k n GLU 166 Cb 0.23 -1.49 -0.07 0.00 0.00 0.00 0.00 31.44 30.11 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 -0.67 0.88 0.00 -1.84 3.02 -0.89 -4.64 115.26 111.11 3g1k n ASN 167 Ca 0.19 -0.61 0.05 0.00 -0.03 0.00 0.00 54.58 54.19 3g1k n ASN 167 Cb 0.23 1.10 0.26 0.00 -0.61 0.00 0.00 39.78 40.76 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 -1.37 0.00 -0.79 6.41 3.41 -0.90 0.07 113.62 120.45 3g1k n SER 168 Ca 0.01 0.20 0.08 0.00 -0.26 0.00 0.00 58.87 58.90 3g1k n SER 168 Cb 0.19 -0.33 0.16 0.00 -0.26 0.00 0.00 64.21 63.97 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 -1.33 2.93 -4.77 4.04 0.23 -1.26 -4.29 115.26 110.81 3g1k n ASN 169 Ca 0.05 -1.87 -0.35 0.00 -0.53 0.00 0.00 54.58 51.87 3g1k n ASN 169 Cb 0.09 -0.21 -0.08 0.00 -2.08 0.00 0.00 39.78 37.51 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 -1.10 4.77 0.17 3.53 1.01 0.11 -4.98 120.40 123.91 3g1k s VAL 170 Ca 0.27 -0.16 -0.32 0.00 0.00 0.00 0.00 61.98 61.77 3g1k s VAL 170 Cb 0.15 -3.08 -0.12 0.00 0.00 0.00 0.00 36.38 33.34 3g1k s VAL 170 CO 0.21 0.54 1.75 -0.24 0.00 0.00 0.00 175.10 177.36 3g1k n SER 171 N 1.84 3.90 0.00 3.32 2.88 -1.26 -2.40 113.62 121.89 3g1k n SER 171 Ca -0.18 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 62.45 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 4.00 1.03 0.45 0.46 0.00 -1.26 -4.89 105.19 104.99 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 -1.88 1.61 7.35 -1.01 -1.89 117.46 121.64 3g1k n PHE 173 Ca 0.00 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.28 3g1k n PHE 173 Cb 0.00 0.00 -0.01 0.00 0.35 0.00 0.00 39.48 39.82 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 4.35 0.36 -2.13 1.43 -1.18 -4.47 118.68 117.04 3g1k s LEU 174 Ca 0.00 2.96 0.12 0.00 -1.03 0.00 0.00 54.13 56.17 3g1k s LEU 174 Cb 0.00 -3.66 0.91 0.00 0.03 0.00 0.00 46.19 43.46 3g1k s LEU 174 CO 0.00 -0.79 1.83 -0.65 0.23 0.00 0.00 176.35 176.97 3g1k h PRO 175 N 3.14 0.58 -0.54 1.29 0.11 -1.95 -0.33 132.00 134.29 3g1k h PRO 175 Ca -0.50 -0.03 0.08 0.00 0.11 0.00 0.00 66.00 65.66 3g1k h PRO 175 Cb 1.24 -0.13 -0.07 0.00 0.11 0.00 0.00 31.00 32.15 3g1k h PRO 175 CO 0.65 0.38 0.18 0.28 -0.21 0.00 0.00 178.00 179.28 3g1k h VAL 176 N 0.60 0.77 -0.21 3.15 2.07 -1.96 0.83 116.25 121.50 3g1k h VAL 176 Ca 0.51 -0.12 -0.17 0.00 0.82 0.00 0.00 66.70 67.74 3g1k h VAL 176 Cb 1.00 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 31.17 3g1k h VAL 176 CO -0.26 0.06 -0.58 -0.33 0.02 0.00 0.00 177.57 176.48 3g1k h GLU 177 N 0.34 0.66 -0.35 1.57 5.08 -1.49 -2.00 114.58 118.38 3g1k h GLU 177 Ca 0.27 -0.43 -0.15 0.00 -1.00 0.00 0.00 59.36 58.05 3g1k h GLU 177 Cb 0.33 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 3g1k h GLU 177 CO -0.30 1.05 -0.37 0.00 -1.00 0.00 0.00 179.01 178.40 3g1k h ARG 178 N 0.50 0.82 -0.84 2.33 3.08 -0.56 -3.10 114.38 116.60 3g1k h ARG 178 Ca 0.00 -0.42 0.02 0.00 0.07 0.00 0.00 59.98 59.65 3g1k h ARG 178 Cb 1.15 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 31.16 3g1k h ARG 178 CO 0.12 1.05 0.56 0.00 -1.07 0.00 0.00 179.97 180.63 3g1k h ALA 179 N 0.90 1.43 -0.37 0.04 0.00 0.88 -2.67 119.26 119.46 3g1k h ALA 179 Ca 0.06 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3g1k h ALA 179 Cb 0.93 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3g1k h ALA 179 CO 0.09 0.52 0.19 2.35 0.00 0.00 0.00 179.25 182.39 3g1k h TRP 180 N 1.11 0.53 -0.21 0.00 7.01 -1.30 -1.91 115.95 121.19 3g1k h TRP 180 Ca 0.32 -0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.28 3g1k h TRP 180 Cb -0.08 -0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 26.81 3g1k h TRP 180 CO -0.00 0.43 0.05 0.82 -2.79 0.00 0.00 178.44 176.96 3g1k h ILE 181 N 0.47 1.10 0.69 2.65 2.04 -1.48 0.24 117.51 123.22 3g1k h ILE 181 Ca 0.13 -0.35 -0.03 0.00 1.00 0.00 0.00 64.86 65.61 3g1k h ILE 181 Cb 0.10 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 3g1k h ILE 181 CO -0.02 0.13 -0.43 0.44 0.00 0.00 0.00 178.15 178.26 3g1k h ASP 182 N 0.29 -1.10 -0.21 1.72 3.32 -1.14 -1.68 116.42 117.63 3g1k h ASP 182 Ca 0.07 0.06 0.06 0.00 0.02 0.00 0.00 57.03 57.24 3g1k h ASP 182 Cb 0.11 0.32 -0.07 0.00 0.22 0.00 0.00 39.33 39.91 3g1k h ASP 182 CO -0.00 -0.67 -0.34 0.50 -1.72 0.00 0.00 179.24 177.01 3g1k h LYS 183 N -1.06 -0.35 -0.71 3.56 3.64 -0.50 -0.83 116.57 120.32 3g1k h LYS 183 Ca -0.09 0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.45 3g1k h LYS 183 Cb 0.86 0.08 -0.13 0.00 -0.41 0.00 0.00 32.23 32.63 3g1k h LYS 183 CO 0.08 -0.24 -0.27 0.35 -2.27 0.00 0.00 179.45 177.11 3g1k h PHE 184 N -0.37 -0.68 -0.18 1.91 3.57 -0.51 -1.01 116.94 119.67 3g1k h PHE 184 Ca 0.11 0.07 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 3g1k h PHE 184 Cb 0.55 0.40 -0.01 0.00 2.79 0.00 0.00 35.95 39.69 3g1k h PHE 184 CO -0.45 -0.36 0.07 0.82 -2.23 0.00 0.00 178.31 176.16 3g1k h ILE 185 N -0.07 1.17 0.00 1.41 2.04 -0.78 -2.65 117.51 118.63 3g1k h ILE 185 Ca 0.31 -0.53 0.00 0.00 1.00 0.00 0.00 64.86 65.64 3g1k h ILE 185 Cb 0.55 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.82 3g1k h ILE 185 CO -0.75 0.17 0.00 -0.62 0.00 0.00 0.00 178.15 176.94 3g1k n GLU 186 N -4.83 0.00 0.00 2.37 1.02 -0.36 0.22 120.64 119.05 3g1k n GLU 186 Ca -0.04 0.47 0.13 0.00 -0.02 0.00 0.00 57.16 57.70 3g1k n GLU 186 Cb 0.13 -1.50 0.37 0.00 -0.02 0.00 0.00 31.44 30.42 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 -1.50 1.12 0.00 1.62 5.03 -0.57 -4.93 115.26 116.03 3g1k n ASN 187 Ca 0.00 -0.97 0.00 0.00 0.87 0.00 0.00 54.58 54.48 3g1k n ASN 187 Cb 0.02 0.14 0.00 0.00 -1.02 0.00 0.00 39.78 38.92 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 1.33 0.98 3.12 7.41 0.00 0.13 -5.04 105.19 113.13 3g1k n GLY 188 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.81 0.82 -0.08 1.61 1.51 -0.90 -0.44 117.35 118.07 3g1k s TYR 189 Ca 0.00 -0.68 0.02 0.00 -1.01 0.00 0.00 57.07 55.40 3g1k s TYR 189 Cb 0.00 -0.48 0.01 0.00 -0.11 0.00 0.00 41.96 41.38 3g1k s TYR 189 CO 0.00 -0.09 -0.14 0.08 -1.11 0.00 0.00 175.55 174.29 3g1k s VAL 190 N -2.40 1.30 -0.75 0.71 1.01 0.64 -4.53 120.40 116.39 3g1k s VAL 190 Ca 0.01 -0.56 -0.26 0.00 0.00 0.00 0.00 61.98 61.17 3g1k s VAL 190 Cb -0.03 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.13 3g1k s VAL 190 CO -0.02 0.40 1.92 -0.62 0.00 0.00 0.00 175.10 176.78 3g1k s ASP 191 N 0.76 5.17 0.32 3.32 -1.08 -1.26 -2.70 116.67 121.20 3g1k s ASP 191 Ca -0.12 -0.12 0.05 0.00 -0.52 0.00 0.00 52.55 51.83 3g1k s ASP 191 Cb -0.16 -2.54 0.67 0.00 -1.46 0.00 0.00 42.92 39.43 3g1k s ASP 191 CO 0.03 -2.58 1.88 0.71 0.52 0.00 0.00 175.17 175.73 3g1k h THR 192 N 7.09 0.94 -0.76 1.71 1.35 -1.55 -2.17 112.91 119.51 3g1k h THR 192 Ca -0.09 -0.30 -0.01 0.00 -0.55 0.00 0.00 66.41 65.47 3g1k h THR 192 Cb 1.09 0.00 -0.04 0.00 -1.73 0.00 0.00 68.15 67.48 3g1k h THR 192 CO 1.21 0.16 0.45 0.15 -0.25 0.00 0.00 175.52 177.24 3g1k h PHE 193 N 0.86 1.01 0.00 4.73 3.57 -1.82 -1.69 116.94 123.61 3g1k h PHE 193 Ca 0.43 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.92 3g1k h PHE 193 Cb 0.47 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 38.88 3g1k h PHE 193 CO -0.00 0.69 0.00 0.54 -2.23 0.00 0.00 178.31 177.31 3g1k n ARG 194 N -4.48 0.68 0.17 1.11 5.12 -0.82 -1.54 116.66 116.89 3g1k n ARG 194 Ca 0.07 0.01 0.04 0.00 -1.93 0.00 0.00 57.85 56.04 3g1k n ARG 194 Cb 0.06 -1.50 0.22 0.00 -1.16 0.00 0.00 32.46 30.09 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 -1.31 -3.38 114.93 118.66 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 0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.68 3g1k h MET 195 CO 0.00 0.45 -0.74 1.19 1.06 0.00 0.00 176.91 178.87 3g1k n PHE 196 N -3.44 0.00 -4.19 -0.22 3.72 -0.83 -5.02 117.46 107.48 3g1k n PHE 196 Ca 0.00 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.15 3g1k n PHE 196 Cb 0.60 0.00 -0.17 0.00 -0.94 0.00 0.00 39.48 38.97 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 -1.59 1.95 0.00 4.37 2.47 -0.59 -5.00 114.94 116.55 3g1k s ASN 197 Ca 0.00 -0.29 0.04 0.00 0.42 0.00 0.00 52.86 53.03 3g1k s ASN 197 Cb 0.00 -0.82 0.01 0.00 -1.45 0.00 0.00 41.25 38.99 3g1k s ASN 197 CO 0.00 -0.05 0.48 -1.20 -3.72 0.00 0.00 177.10 172.60 3g1k n SER 198 N 4.44 0.97 -4.76 -4.21 7.64 -1.26 -4.32 113.62 112.11 3g1k n SER 198 Ca -0.17 -0.98 -0.32 0.00 1.01 0.00 0.00 58.87 58.40 3g1k n SER 198 Cb 0.51 0.35 0.07 0.00 -1.01 0.00 0.00 64.21 64.13 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 -0.73 4.75 0.78 6.43 1.11 -1.26 -5.08 116.67 122.67 3g1k s ASP 199 Ca 0.04 1.96 -0.03 0.00 0.18 0.00 0.00 52.55 54.70 3g1k s ASP 199 Cb 0.04 -2.54 0.06 0.00 1.07 0.00 0.00 42.92 41.54 3g1k s ASP 199 CO 0.09 -1.87 0.38 -0.81 1.18 0.00 0.00 175.17 174.15 3g1k n PRO 200 N -2.91 -0.06 -2.95 8.23 -0.04 -1.26 -4.66 135.00 131.35 3g1k n PRO 200 Ca 0.10 -0.76 -0.22 0.00 -0.04 0.00 0.00 63.50 62.58 3g1k n PRO 200 Cb 0.52 -0.34 0.03 0.00 -0.04 0.00 0.00 33.50 33.67 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 2.33 -0.49 3.22 0.55 0.00 -1.26 -4.99 105.19 104.55 3g1k n GLY 201 Ca 0.05 0.10 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 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 -5.62 2.53 0.20 1.61 1.11 -1.26 -5.10 119.66 113.15 3g1k s GLN 202 Ca 0.27 -1.21 0.08 0.00 0.01 0.00 0.00 55.36 54.51 3g1k s GLN 202 Cb -0.12 -3.30 -0.05 0.00 -1.01 0.00 0.00 33.01 28.54 3g1k s GLN 202 CO 0.34 -0.63 -0.15 0.71 0.01 0.00 0.00 175.29 175.56 3g1k s TYR 203 N 1.32 1.77 0.00 0.91 1.51 -1.26 -4.41 117.35 117.19 3g1k s TYR 203 Ca -0.03 -0.54 0.00 0.00 -1.01 0.00 0.00 57.07 55.49 3g1k s TYR 203 Cb -0.20 -0.82 0.00 0.00 -0.11 0.00 0.00 41.96 40.83 3g1k s TYR 203 CO 0.01 0.38 0.11 0.25 -1.11 0.00 0.00 175.55 175.18 3g1k n THR 204 N -0.31 0.00 -3.82 -0.71 -2.24 0.47 -4.90 114.28 102.77 3g1k n THR 204 Ca -0.08 -0.40 -0.12 0.00 -2.27 0.00 0.00 64.05 61.17 3g1k n THR 204 Cb 0.60 1.05 -0.13 0.00 -2.10 0.00 0.00 70.33 69.75 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 -0.60 -0.15 -0.01 4.78 -0.00 -0.20 -1.63 118.94 121.14 3g1k s TRP 205 Ca 0.00 0.38 0.00 0.00 -0.00 0.00 0.00 56.10 56.48 3g1k s TRP 205 Cb 0.00 0.04 0.01 0.00 -0.00 0.00 0.00 33.47 33.52 3g1k s TRP 205 CO 0.00 -0.08 0.00 -1.58 -0.00 0.00 0.00 176.95 175.29 3g1k s TRP 206 N 0.18 0.08 -0.01 5.86 0.51 -0.81 -0.48 118.94 124.25 3g1k s TRP 206 Ca -0.01 0.02 -0.34 0.00 -2.12 0.00 0.00 56.10 53.66 3g1k s TRP 206 Cb -0.02 -0.12 -0.12 0.00 -0.81 0.00 0.00 33.47 32.40 3g1k s TRP 206 CO -0.00 -0.03 1.81 0.45 -0.51 0.00 0.00 176.95 178.66 3g1k n SER 207 N 3.41 3.42 0.13 2.95 2.88 -1.26 -4.79 113.62 120.36 3g1k n SER 207 Ca -0.17 1.00 0.14 0.00 -1.33 0.00 0.00 58.87 58.51 3g1k n SER 207 Cb 0.57 -1.40 0.67 0.00 -0.75 0.00 0.00 64.21 63.30 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 8.43 0.00 0.00 0.66 0.99 -1.98 -2.86 116.97 122.21 3g1k h TYR 208 Ca -0.48 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.25 3g1k h TYR 208 Cb 1.26 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.99 3g1k h TYR 208 CO 0.82 0.00 0.00 0.00 -0.00 0.00 0.00 178.16 178.98 3g1k h ARG 209 N 0.00 0.00 0.00 4.88 2.47 -2.04 -2.93 114.38 116.76 3g1k h ARG 209 Ca 0.12 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.84 3g1k h ARG 209 Cb 0.50 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.82 3g1k h ARG 209 CO -0.00 0.00 -0.18 0.25 0.56 0.00 0.00 179.97 180.59 3g1k n THR 210 N -2.85 0.89 -3.86 2.04 -2.24 -1.24 -4.98 114.28 102.03 3g1k n THR 210 Ca 0.00 -1.04 -0.24 0.00 -2.27 0.00 0.00 64.05 60.50 3g1k n THR 210 Cb 0.24 0.25 -0.00 0.00 -2.10 0.00 0.00 70.33 68.72 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 -0.64 -3.88 0.19 -0.78 1.74 -1.11 -4.87 116.66 107.30 3g1k n ARG 211 Ca 0.07 0.48 0.05 0.00 -0.77 0.00 0.00 57.85 57.68 3g1k n ARG 211 Cb 0.60 -4.77 0.39 0.00 -1.02 0.00 0.00 32.46 27.66 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 0.85 1.18 -0.60 7.54 0.00 -1.77 -3.20 119.26 123.27 3g1k h ALA 212 Ca -0.62 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 53.86 3g1k h ALA 212 Cb 1.37 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 3g1k h ALA 212 CO 0.60 0.45 0.01 -0.09 0.00 0.00 0.00 179.25 180.22 3g1k h ARG 213 N 0.00 1.04 0.00 0.00 2.43 -1.86 -0.87 114.38 115.13 3g1k h ARG 213 Ca -0.00 -0.32 0.00 0.00 -0.81 0.00 0.00 59.98 58.84 3g1k h ARG 213 Cb 0.74 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.19 3g1k h ARG 213 CO 0.05 1.01 0.00 1.05 -1.51 0.00 0.00 179.97 180.57 3g1k h GLU 214 N 0.95 0.00 0.00 0.20 4.11 -1.95 -0.90 114.58 117.00 3g1k h GLU 214 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.60 3g1k h GLU 214 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 3g1k h GLU 214 CO 0.03 0.00 -1.62 0.54 0.07 0.00 0.00 179.01 178.03 3g1k n ARG 215 N -2.45 0.41 -2.91 1.06 1.74 -1.02 -5.01 116.66 108.47 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 0.20 -1.51 0.03 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 -1.97 -5.41 -4.47 0.55 5.15 -0.34 -4.96 115.26 103.80 3g1k n ASN 216 Ca -0.01 -0.25 -0.44 0.00 -0.60 0.00 0.00 54.58 53.28 3g1k n ASN 216 Cb 0.48 -4.24 -0.00 0.00 -0.53 0.00 0.00 39.78 35.48 3g1k n ASN 216 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3g1k s VAL 217 N -3.08 4.96 0.25 3.44 1.01 -0.80 -4.87 120.40 121.30 3g1k s VAL 217 Ca 0.26 -2.53 0.03 0.00 0.00 0.00 0.00 61.98 59.74 3g1k s VAL 217 Cb -0.12 -4.92 -0.01 0.00 0.00 0.00 0.00 36.38 31.33 3g1k s VAL 217 CO 0.33 -1.64 0.11 0.61 0.00 0.00 0.00 175.10 174.50 3g1k n GLY 218 N 4.27 3.52 3.29 4.51 0.00 -1.26 -4.60 105.19 114.91 3g1k n GLY 218 Ca 0.37 -2.00 -0.21 0.00 0.00 0.00 0.00 46.02 44.18 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 -2.57 1.69 -0.42 1.61 0.52 0.36 -1.45 118.94 118.69 3g1k s TRP 219 Ca 0.15 -0.48 -0.13 0.00 0.02 0.00 0.00 56.10 55.67 3g1k s TRP 219 Cb 0.01 -0.88 0.05 0.00 -1.15 0.00 0.00 33.47 31.50 3g1k s TRP 219 CO 0.11 0.25 0.29 0.50 0.02 0.00 0.00 176.95 178.11 3g1k s ARG 220 N -2.51 2.86 -0.00 4.98 3.52 -0.29 -0.39 118.95 127.11 3g1k s ARG 220 Ca 0.11 -1.20 0.04 0.00 -0.13 0.00 0.00 55.73 54.55 3g1k s ARG 220 Cb -0.07 -3.90 -0.05 0.00 -1.56 0.00 0.00 34.95 29.37 3g1k s ARG 220 CO 0.05 -0.84 0.12 1.28 -0.81 0.00 0.00 175.30 175.10 3g1k n LEU 221 N 5.08 0.09 -4.66 -0.88 4.77 -1.26 -3.78 117.00 116.35 3g1k n LEU 221 Ca -0.11 -0.25 -0.35 0.00 -0.03 0.00 0.00 56.01 55.27 3g1k n LEU 221 Cb 0.45 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.45 3g1k n LEU 221 CO 0.41 0.02 -0.23 -1.81 -1.33 0.00 0.00 177.39 174.45 3g1k s ASP 222 N -1.90 5.79 0.07 -1.43 1.01 -1.26 -0.94 116.67 118.01 3g1k s ASP 222 Ca -0.00 0.12 0.03 0.00 0.71 0.00 0.00 52.55 53.40 3g1k s ASP 222 Cb 0.03 -2.00 -0.03 0.00 1.01 0.00 0.00 42.92 41.92 3g1k s ASP 222 CO 0.16 0.17 -0.08 -0.31 0.21 0.00 0.00 175.17 175.31 3g1k s TYR 223 N 0.42 0.83 -0.19 4.23 1.51 -1.06 -4.97 117.35 118.12 3g1k s TYR 223 Ca 0.05 -0.63 -0.01 0.00 -1.01 0.00 0.00 57.07 55.46 3g1k s TYR 223 Cb -0.12 -0.48 0.00 0.00 -0.11 0.00 0.00 41.96 41.25 3g1k s TYR 223 CO -0.00 -0.08 -0.12 -0.06 -1.11 0.00 0.00 175.55 174.18 3g1k s PHE 224 N -2.14 2.86 -0.07 2.71 0.40 -1.26 -2.65 117.98 117.84 3g1k s PHE 224 Ca -0.01 -1.19 0.03 0.00 -0.60 0.00 0.00 56.93 55.16 3g1k s PHE 224 Cb -0.05 -1.99 -0.02 0.00 0.51 0.00 0.00 43.02 41.47 3g1k s PHE 224 CO -0.01 -0.61 -0.16 -0.06 0.70 0.00 0.00 175.22 175.08 3g1k s PHE 225 N 1.26 2.68 0.23 0.36 0.40 0.27 -1.23 117.98 121.95 3g1k s PHE 225 Ca 0.03 -0.36 0.10 0.00 -0.60 0.00 0.00 56.93 56.11 3g1k s PHE 225 Cb -0.14 -1.67 -0.05 0.00 0.51 0.00 0.00 43.02 41.67 3g1k s PHE 225 CO -0.06 0.03 -0.19 0.14 0.70 0.00 0.00 175.22 175.84 3g1k s VAL 226 N -0.40 2.20 0.17 -0.44 -7.23 -1.10 0.34 120.40 113.95 3g1k s VAL 226 Ca 0.04 -2.23 -0.30 0.00 -1.81 0.00 0.00 61.98 57.68 3g1k s VAL 226 Cb -0.12 -2.15 -0.07 0.00 0.56 0.00 0.00 36.38 34.60 3g1k s VAL 226 CO 0.02 -0.38 1.00 0.54 -0.31 0.00 0.00 175.10 175.97 3g1k s ASN 227 N -3.20 7.46 0.37 4.85 4.22 -1.22 -0.26 114.94 127.16 3g1k s ASN 227 Ca 0.25 1.94 0.20 0.00 -2.14 0.00 0.00 52.86 53.11 3g1k s ASN 227 Cb -0.05 -2.60 1.25 0.00 1.28 0.00 0.00 41.25 41.13 3g1k s ASN 227 CO 0.11 -0.05 1.63 1.05 -2.04 0.00 0.00 177.10 177.80 3g1k h GLU 228 N 4.96 0.16 0.00 3.55 4.11 -1.07 0.76 114.58 127.05 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 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3g1k h GLU 228 CO 0.71 0.11 0.00 0.39 0.07 0.00 0.00 179.01 180.28 3g1k n GLU 229 N -5.03 0.01 0.00 1.06 4.71 -1.26 -2.27 120.64 117.86 3g1k n GLU 229 Ca 0.35 0.39 0.01 0.00 -0.01 0.00 0.00 57.16 57.90 3g1k n GLU 229 Cb 1.18 -1.50 -0.00 0.00 -1.01 0.00 0.00 31.44 30.11 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 0.26 -4.70 117.46 118.84 3g1k n PHE 230 Ca 0.01 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.83 3g1k n PHE 230 Cb 0.06 0.00 0.74 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 0.20 0.00 0.00 -4.13 2.10 -1.45 -2.01 116.57 111.28 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 0.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.40 3g1k h LYS 231 CO 0.00 0.10 0.00 0.78 -2.00 0.00 0.00 179.45 178.33 3g1k h GLY 232 N 0.65 0.00 -0.12 0.07 0.00 -1.84 -2.71 103.07 99.13 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 -0.87 0.28 0.00 0.00 0.00 176.54 175.96 3g1k n LYS 233 N -2.89 0.56 -2.76 4.80 5.02 -0.76 -4.84 118.16 117.30 3g1k n LYS 233 Ca -0.03 -0.12 -0.43 0.00 -2.02 0.00 0.00 58.31 55.72 3g1k n LYS 233 Cb 0.07 -1.43 -0.03 0.00 -0.02 0.00 0.00 35.03 33.61 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 -2.81 4.63 -0.19 -0.18 0.11 -1.02 -0.18 120.40 120.75 3g1k s VAL 234 Ca 0.09 1.54 -0.20 0.00 -2.93 0.00 0.00 61.98 60.47 3g1k s VAL 234 Cb 0.15 -4.31 -0.18 0.00 -1.53 0.00 0.00 36.38 30.52 3g1k s VAL 234 CO 0.78 -0.38 0.21 0.50 -3.33 0.00 0.00 175.10 172.88 3g1k h LYS 235 N 8.07 0.00 -5.83 1.54 3.64 -0.79 -3.49 116.57 119.71 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 0.87 -0.79 1.03 -2.27 0.00 0.00 179.45 179.27 3g1k s ARG 236 N -2.33 1.13 -0.25 1.90 0.52 -0.95 -5.00 118.95 113.98 3g1k s ARG 236 Ca -0.26 -1.26 -0.02 0.00 -0.52 0.00 0.00 55.73 53.67 3g1k s ARG 236 Cb 0.05 -1.21 0.14 0.00 0.52 0.00 0.00 34.95 34.44 3g1k s ARG 236 CO 0.55 0.26 0.38 0.45 0.02 0.00 0.00 175.30 176.95 3g1k s SER 237 N -2.31 0.29 0.40 0.23 0.15 -1.26 -1.35 113.70 109.85 3g1k s SER 237 Ca 0.10 0.15 0.05 0.00 0.70 0.00 0.00 55.95 56.95 3g1k s SER 237 Cb -0.07 1.10 -0.02 0.00 -1.71 0.00 0.00 66.02 65.31 3g1k s SER 237 CO 0.05 -0.31 0.19 -1.66 1.20 0.00 0.00 173.24 172.71 3g1k s TRP 238 N 2.54 1.78 -0.20 3.44 -2.14 -0.62 -4.63 118.94 119.11 3g1k s TRP 238 Ca 0.12 -1.45 0.01 0.00 2.66 0.00 0.00 56.10 57.45 3g1k s TRP 238 Cb -0.15 -1.01 0.03 0.00 -3.10 0.00 0.00 33.47 29.24 3g1k s TRP 238 CO -0.17 -0.52 -0.18 0.42 -2.66 0.00 0.00 176.95 173.84 3g1k s ILE 239 N -3.26 2.09 -1.51 0.66 1.01 -1.26 -1.65 121.20 117.28 3g1k s ILE 239 Ca 0.28 -1.10 -0.12 0.00 0.00 0.00 0.00 60.65 59.70 3g1k s ILE 239 Cb 0.02 -1.96 -0.00 0.00 0.01 0.00 0.00 42.46 40.52 3g1k s ILE 239 CO 0.19 0.40 2.49 0.18 0.00 0.00 0.00 174.94 178.20 3g1k n LEU 240 N 4.58 7.56 0.00 2.97 4.32 -0.80 -4.74 117.00 130.88 3g1k n LEU 240 Ca -0.19 -4.25 0.13 0.00 -0.02 0.00 0.00 56.01 51.68 3g1k n LEU 240 Cb 0.48 -1.62 0.67 0.00 -1.62 0.00 0.00 43.42 41.34 3g1k n LEU 240 CO 0.25 1.48 0.94 -1.54 -1.22 0.00 0.00 177.39 177.29 3g1k n SER 241 N 5.08 0.00 0.10 -1.43 3.41 -1.26 -2.37 113.62 117.15 3g1k n SER 241 Ca 0.61 -0.19 0.04 0.00 -0.26 0.00 0.00 58.87 59.07 3g1k n SER 241 Cb 0.33 -0.24 -0.00 0.00 -0.26 0.00 0.00 64.21 64.03 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 -2.77 4.04 -0.00 -1.96 -3.46 116.42 112.27 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 0.21 0.00 -0.03 0.00 -0.00 0.00 0.00 39.33 39.51 3g1k h ASP 242 CO 0.00 0.42 1.14 -0.69 -0.00 0.00 0.00 179.24 180.11 3g1k s VAL 243 N -3.02 3.68 0.66 4.15 1.01 -1.00 -5.01 120.40 120.87 3g1k s VAL 243 Ca 0.01 0.76 -0.00 0.00 0.00 0.00 0.00 61.98 62.75 3g1k s VAL 243 Cb 0.08 -3.71 0.09 0.00 0.00 0.00 0.00 36.38 32.83 3g1k s VAL 243 CO 0.77 -0.32 0.91 -0.04 0.00 0.00 0.00 175.10 176.42 3g1k s MET 244 N 4.77 2.03 0.00 2.72 -1.94 -1.26 -4.65 119.30 120.97 3g1k s MET 244 Ca 0.72 -0.96 0.00 0.00 -1.71 0.00 0.00 55.69 53.74 3g1k s MET 244 Cb -0.24 -2.39 0.00 0.00 2.01 0.00 0.00 34.83 34.21 3g1k s MET 244 CO 0.30 -1.16 0.00 0.41 -0.01 0.00 0.00 175.02 174.56 3g1k n GLY 245 N -2.65 1.88 3.19 -0.03 0.00 -1.26 -4.99 105.19 101.33 3g1k n GLY 245 Ca 0.12 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.47 0.23 0.39 1.61 0.15 -1.26 -4.50 113.70 108.85 3g1k s SER 246 Ca 0.00 -1.22 0.28 0.00 0.70 0.00 0.00 55.95 55.71 3g1k s SER 246 Cb 0.00 0.34 1.05 0.00 -1.71 0.00 0.00 66.02 65.70 3g1k s SER 246 CO 0.00 -0.78 1.82 -2.24 1.20 0.00 0.00 173.24 173.24 3g1k h ASP 247 N 2.76 0.00 -2.56 5.45 2.03 -1.87 -3.42 116.42 118.81 3g1k h ASP 247 Ca -0.35 0.00 -0.55 0.00 -0.73 0.00 0.00 57.03 55.41 3g1k h ASP 247 Cb 1.22 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 39.67 3g1k h ASP 247 CO 0.56 0.00 -0.52 -1.00 -1.03 0.00 0.00 179.24 177.25 3g1k s HIS 248 N -3.42 3.28 0.32 4.15 3.76 -1.26 -1.93 115.29 120.19 3g1k s HIS 248 Ca 0.04 0.02 0.07 0.00 -0.15 0.00 0.00 55.06 55.04 3g1k s HIS 248 Cb 0.09 -1.56 -0.03 0.00 1.11 0.00 0.00 32.58 32.20 3g1k s HIS 248 CO 0.50 0.51 0.28 0.00 -0.85 0.00 0.00 174.74 175.19 3g1k s PRO 250 N -3.97 3.02 0.10 0.00 0.04 -1.26 -4.61 135.00 128.32 3g1k s PRO 250 Ca 0.39 1.15 0.07 0.00 0.04 0.00 0.00 61.00 62.65 3g1k s PRO 250 Cb -0.06 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 3g1k s PRO 250 CO 0.26 -1.04 -0.17 0.96 0.04 0.00 0.00 177.00 177.05 3g1k s ILE 251 N -2.66 1.42 0.04 0.56 -4.36 -0.25 -1.91 121.20 114.04 3g1k s ILE 251 Ca 0.62 -1.56 0.05 0.00 -0.26 0.00 0.00 60.65 59.50 3g1k s ILE 251 Cb -0.16 -1.43 -0.02 0.00 1.25 0.00 0.00 42.46 42.10 3g1k s ILE 251 CO 0.45 -0.24 -0.14 -0.83 0.24 0.00 0.00 174.94 174.42 3g1k s GLY 252 N -2.09 0.78 0.05 6.27 0.00 -0.66 -0.99 107.32 110.68 3g1k s GLY 252 Ca 0.05 -0.81 0.09 0.00 0.00 0.00 0.00 44.72 44.05 3g1k s GLY 252 CO 0.03 -0.78 -0.25 -2.27 0.00 0.00 0.00 173.10 169.83 3g1k s LEU 253 N -1.10 2.18 -0.07 0.66 2.96 0.39 -1.58 118.68 122.12 3g1k s LEU 253 Ca 0.02 -0.60 0.00 0.00 -0.22 0.00 0.00 54.13 53.33 3g1k s LEU 253 Cb -0.08 -1.22 0.02 0.00 0.50 0.00 0.00 46.19 45.41 3g1k s LEU 253 CO 0.01 0.23 -0.06 -0.70 -1.32 0.00 0.00 176.35 174.52 3g1k s GLU 254 N -1.32 1.10 0.37 1.98 2.12 -0.45 -0.05 118.70 122.45 3g1k s GLU 254 Ca 0.11 -0.15 0.04 0.00 0.36 0.00 0.00 54.97 55.34 3g1k s GLU 254 Cb -0.10 -1.14 -0.06 0.00 0.26 0.00 0.00 34.13 33.09 3g1k s GLU 254 CO 0.02 -0.15 0.06 0.96 -0.54 0.00 0.00 175.26 175.61 3g1k s ILE 255 N 1.29 1.24 -0.15 -3.70 -4.36 -0.36 -0.07 121.20 115.09 3g1k s ILE 255 Ca -0.04 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.36 3g1k s ILE 255 Cb -0.14 -2.70 0.02 0.00 1.25 0.00 0.00 42.46 40.89 3g1k s ILE 255 CO -0.02 0.00 -0.17 -1.61 0.24 0.00 0.00 174.94 173.37 3g1k s GLU 256 N -3.83 2.62 0.00 0.37 0.41 0.74 -1.93 118.70 117.08 3g1k s GLU 256 Ca 0.31 -0.69 0.00 0.00 -0.41 0.00 0.00 54.97 54.18 3g1k s GLU 256 Cb 0.07 -2.27 0.00 0.00 -1.78 0.00 0.00 34.13 30.16 3g1k s GLU 256 CO 0.15 -0.16 0.00 1.28 -0.49 0.00 0.00 175.26 176.04