#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gbr h ILE 3 N 0.00 0.87 -0.10 -1.44 1.08 -2.01 -2.46 117.51 113.44 3gbr h ILE 3 Ca 0.00 -0.08 -0.15 0.00 -0.39 0.00 0.00 64.86 64.24 3gbr h ILE 3 Cb 0.00 0.62 0.01 0.00 -3.07 0.00 0.00 36.82 34.38 3gbr h ILE 3 CO 0.00 0.04 -0.53 0.78 -0.69 0.00 0.00 178.15 177.75 3gbr h ASN 4 N 0.22 0.65 -0.07 1.72 2.35 -2.02 -2.37 115.58 116.06 3gbr h ASN 4 Ca 0.22 -0.64 -0.22 0.00 -0.55 0.00 0.00 56.30 55.11 3gbr h ASN 4 Cb 0.59 -0.19 0.01 0.00 0.05 0.00 0.00 38.32 38.78 3gbr h ASN 4 CO -0.04 1.19 -0.80 -0.33 -1.65 0.00 0.00 177.43 175.79 3gbr h GLU 5 N 0.15 0.73 -0.56 0.81 5.08 -1.94 -2.64 114.58 116.21 3gbr h GLU 5 Ca -0.04 -0.61 0.11 0.00 -1.00 0.00 0.00 59.36 57.82 3gbr h GLU 5 Cb 1.18 0.13 -0.10 0.00 0.50 0.00 0.00 28.75 30.47 3gbr h GLU 5 CO 0.11 1.22 -0.02 0.82 -1.00 0.00 0.00 179.01 180.14 3gbr h ILE 6 N 0.49 0.53 -0.24 3.13 1.08 -1.50 0.28 117.51 121.29 3gbr h ILE 6 Ca -0.06 -0.03 -0.00 0.00 -0.39 0.00 0.00 64.86 64.38 3gbr h ILE 6 Cb 1.43 0.43 -0.01 0.00 -3.07 0.00 0.00 36.82 35.59 3gbr h ILE 6 CO 0.16 0.02 0.13 0.25 -0.69 0.00 0.00 178.15 178.02 3gbr h LEU 7 N 0.09 0.29 -0.81 1.44 5.85 -1.37 0.25 115.31 121.05 3gbr h LEU 7 Ca 0.28 -0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.98 3gbr h LEU 7 Cb 0.45 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.35 3gbr h LEU 7 CO -0.49 0.29 0.50 0.11 -0.34 0.00 0.00 178.44 178.51 3gbr h LYS 8 N 0.28 0.92 -0.42 1.25 1.57 -1.07 0.35 116.57 119.45 3gbr h LYS 8 Ca 0.08 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3gbr h LYS 8 Cb 0.05 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 3gbr h LYS 8 CO -0.01 0.61 0.25 -0.22 -0.57 0.00 0.00 179.45 179.51 3gbr h LYS 9 N 0.95 0.57 -0.51 3.15 3.64 0.01 -1.22 116.57 123.16 3gbr h LYS 9 Ca 0.34 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.60 3gbr h LYS 9 Cb 0.10 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 3gbr h LYS 9 CO -0.15 0.42 0.05 -0.07 -2.27 0.00 0.00 179.45 177.43 3gbr h LEU 10 N 0.55 0.84 -1.23 5.20 3.38 0.12 -2.02 115.31 122.15 3gbr h LEU 10 Ca 0.15 -0.28 0.01 0.00 0.09 0.00 0.00 57.88 57.85 3gbr h LEU 10 Cb -0.00 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 3gbr h LEU 10 CO -0.03 0.91 0.53 0.40 0.09 0.00 0.00 178.44 180.34 3gbr h ILE 11 N 0.74 1.18 0.00 1.22 1.08 -0.17 -0.23 117.51 121.33 3gbr h ILE 11 Ca 0.15 -0.36 0.00 0.00 -0.39 0.00 0.00 64.86 64.26 3gbr h ILE 11 Cb 0.45 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.24 3gbr h ILE 11 CO 0.02 0.19 0.00 0.59 -0.69 0.00 0.00 178.15 178.26 3gbr n ASN 12 N -4.42 0.00 -1.73 1.72 3.02 -0.47 -4.90 115.26 108.48 3gbr n ASN 12 Ca 0.09 -0.85 -0.13 0.00 -0.03 0.00 0.00 54.58 53.66 3gbr n ASN 12 Cb 0.05 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.23 3gbr n ASN 12 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3gbr n LYS 13 N -0.98 -2.17 -3.33 3.52 5.02 -0.10 -5.01 118.16 115.11 3gbr n LYS 13 Ca 0.19 0.58 -0.38 0.00 -2.02 0.00 0.00 58.31 56.68 3gbr n LYS 13 Cb 0.09 -4.74 -0.07 0.00 -0.02 0.00 0.00 35.03 30.29 3gbr n LYS 13 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3gbr s SER 14 N -2.66 6.52 0.50 4.39 0.01 -0.78 -5.04 113.70 116.63 3gbr s SER 14 Ca 0.11 0.62 -0.22 0.00 1.31 0.00 0.00 55.95 57.76 3gbr s SER 14 Cb -0.05 -2.26 -0.06 0.00 0.21 0.00 0.00 66.02 63.86 3gbr s SER 14 CO 0.13 -0.10 1.24 -1.81 0.41 0.00 0.00 173.24 173.12 3gbr s ASP 15 N 1.00 5.79 0.34 2.44 1.01 -1.26 -4.35 116.67 121.64 3gbr s ASP 15 Ca 0.22 2.48 -0.17 0.00 0.71 0.00 0.00 52.55 55.79 3gbr s ASP 15 Cb -0.15 -2.61 -0.09 0.00 1.01 0.00 0.00 42.92 41.07 3gbr s ASP 15 CO 0.09 -1.19 0.78 -0.76 0.21 0.00 0.00 175.17 174.30 3gbr s LEU 16 N -3.26 4.06 0.76 1.23 1.43 -1.26 -5.06 118.68 116.58 3gbr s LEU 16 Ca 0.67 1.37 -0.11 0.00 -1.03 0.00 0.00 54.13 55.03 3gbr s LEU 16 Cb -0.33 -4.13 0.05 0.00 0.03 0.00 0.00 46.19 41.80 3gbr s LEU 16 CO 0.39 -0.22 1.10 -1.61 0.23 0.00 0.00 176.35 176.25 3gbr s GLU 17 N -2.94 2.37 0.13 1.70 0.41 -1.26 -4.28 118.70 114.83 3gbr s GLU 17 Ca 0.55 0.55 -0.19 0.00 -0.41 0.00 0.00 54.97 55.47 3gbr s GLU 17 Cb -0.10 -1.96 -0.03 0.00 -1.78 0.00 0.00 34.13 30.25 3gbr s GLU 17 CO 0.17 -1.40 1.77 0.82 -0.49 0.00 0.00 175.26 176.13 3gbr h ILE 18 N -0.92 1.02 -0.44 -1.63 2.04 -1.98 -0.07 117.51 115.53 3gbr h ILE 18 Ca -0.46 -0.10 -0.15 0.00 1.00 0.00 0.00 64.86 65.15 3gbr h ILE 18 Cb 1.27 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 3gbr h ILE 18 CO 0.61 0.05 -0.30 0.78 0.00 0.00 0.00 178.15 179.30 3gbr h ASN 19 N 0.29 1.02 -0.08 1.72 -0.26 -1.94 0.66 115.58 117.00 3gbr h ASN 19 Ca 0.10 -0.43 0.04 0.00 -0.56 0.00 0.00 56.30 55.45 3gbr h ASN 19 Cb 0.01 -0.28 -0.06 0.00 -1.06 0.00 0.00 38.32 36.92 3gbr h ASN 19 CO -0.05 1.23 -0.36 -0.33 -1.06 0.00 0.00 177.43 176.86 3gbr h GLU 20 N 0.82 -0.45 -0.99 0.81 5.08 -1.91 -1.37 114.58 116.58 3gbr h GLU 20 Ca 0.09 0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.49 3gbr h GLU 20 Cb 0.89 0.10 -0.05 0.00 0.50 0.00 0.00 28.75 30.19 3gbr h GLU 20 CO 0.08 -0.30 0.65 0.00 -1.00 0.00 0.00 179.01 178.45 3gbr h ALA 21 N 0.25 1.31 -0.26 3.43 0.00 -0.74 -0.98 119.26 122.26 3gbr h ALA 21 Ca 0.08 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 3gbr h ALA 21 Cb 0.59 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3gbr h ALA 21 CO -0.34 0.63 -0.05 1.49 0.00 0.00 0.00 179.25 180.98 3gbr h GLU 22 N 1.32 0.50 -0.44 0.00 4.81 -0.71 -0.36 114.58 119.70 3gbr h GLU 22 Ca 0.37 -0.19 -0.04 0.00 -0.13 0.00 0.00 59.36 59.38 3gbr h GLU 22 Cb -0.12 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.21 3gbr h GLU 22 CO -0.09 0.71 0.13 0.93 -0.73 0.00 0.00 179.01 179.96 3gbr h GLU 23 N 0.26 0.69 -0.13 1.92 4.39 -1.06 -0.63 114.58 120.02 3gbr h GLU 23 Ca 0.07 -0.15 0.05 0.00 0.34 0.00 0.00 59.36 59.66 3gbr h GLU 23 Cb 0.52 -0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 29.01 3gbr h GLU 23 CO 0.02 0.68 -0.28 1.25 -1.16 0.00 0.00 179.01 179.52 3gbr h LEU 24 N 0.58 -0.88 -0.78 1.33 5.85 -1.09 -0.89 115.31 119.44 3gbr h LEU 24 Ca 0.14 0.13 0.02 0.00 0.84 0.00 0.00 57.88 59.01 3gbr h LEU 24 Cb 0.28 0.38 -0.04 0.00 0.37 0.00 0.00 40.66 41.64 3gbr h LEU 24 CO -0.00 -0.33 0.51 0.00 -0.34 0.00 0.00 178.44 178.28 3gbr h ALA 25 N 0.52 1.00 -0.20 1.25 0.00 -0.87 -1.73 119.26 119.23 3gbr h ALA 25 Ca 0.10 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3gbr h ALA 25 Cb 0.51 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3gbr h ALA 25 CO -0.33 0.36 0.08 0.87 0.00 0.00 0.00 179.25 180.23 3gbr h LYS 26 N 1.02 0.31 -0.44 0.00 1.57 -0.85 0.92 116.57 119.10 3gbr h LYS 26 Ca 0.30 -0.06 0.03 0.00 -1.87 0.00 0.00 60.65 59.05 3gbr h LYS 26 Cb -0.07 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 3gbr h LYS 26 CO -0.08 0.37 0.25 0.00 -0.57 0.00 0.00 179.45 179.42 3gbr h ALA 27 N 0.92 0.56 0.28 3.86 0.00 -0.94 0.55 119.26 124.49 3gbr h ALA 27 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3gbr h ALA 27 Cb 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3gbr h ALA 27 CO -0.00 -0.09 -0.14 0.82 0.00 0.00 0.00 179.25 179.84 3gbr h ILE 28 N 0.49 0.71 -0.49 0.00 2.04 -1.18 -0.54 117.51 118.55 3gbr h ILE 28 Ca 0.18 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.99 3gbr h ILE 28 Cb 0.05 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 3gbr h ILE 28 CO -0.10 0.00 0.10 0.40 0.00 0.00 0.00 178.15 178.55 3gbr h ILE 29 N -0.39 1.22 0.00 -0.67 2.04 -0.64 -1.05 117.51 118.03 3gbr h ILE 29 Ca -0.04 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.03 3gbr h ILE 29 Cb 0.30 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 3gbr h ILE 29 CO 0.06 0.29 0.00 0.54 0.00 0.00 0.00 178.15 179.04 3gbr n ARG 30 N -4.28 0.07 -1.76 2.37 1.74 0.17 -4.54 116.66 110.44 3gbr n ARG 30 Ca 0.03 0.20 -0.03 0.00 -0.77 0.00 0.00 57.85 57.28 3gbr n ARG 30 Cb 0.23 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.16 3gbr n ARG 30 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gbr n GLY 31 N 0.13 0.36 0.02 -0.13 0.00 -0.40 -4.93 105.19 100.24 3gbr n GLY 31 Ca 0.05 -0.80 0.12 0.00 0.00 0.00 0.00 46.02 45.39 3gbr n GLY 31 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3gbr n GLU 32 N -1.84 0.06 -4.44 1.61 1.02 -0.24 -4.87 120.64 111.94 3gbr n GLU 32 Ca -0.04 -0.03 -0.34 0.00 -0.02 0.00 0.00 57.16 56.73 3gbr n GLU 32 Cb 0.40 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.19 3gbr n GLU 32 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3gbr s VAL 33 N -2.97 3.63 0.60 2.62 1.01 -1.24 -5.00 120.40 119.06 3gbr s VAL 33 Ca 0.12 -0.45 -0.19 0.00 0.00 0.00 0.00 61.98 61.46 3gbr s VAL 33 Cb 0.18 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 3gbr s VAL 33 CO 0.69 0.49 1.12 -2.65 0.00 0.00 0.00 175.10 174.76 3gbr n PRO 34 N 3.67 1.09 -0.17 2.72 -0.02 -1.26 -4.70 135.00 136.33 3gbr n PRO 34 Ca -0.18 0.42 0.04 0.00 -2.02 0.00 0.00 63.50 61.76 3gbr n PRO 34 Cb 0.52 -2.34 0.32 0.00 -0.02 0.00 0.00 33.50 31.99 3gbr n PRO 34 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3gbr h GLU 35 N 0.66 0.80 -0.82 -0.52 5.08 -1.98 -0.56 114.58 117.24 3gbr h GLU 35 Ca -0.49 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.82 3gbr h GLU 35 Cb 1.35 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 30.38 3gbr h GLU 35 CO 0.53 0.53 0.53 0.82 -1.00 0.00 0.00 179.01 180.42 3gbr h ILE 36 N 0.83 1.22 0.05 3.13 2.04 -2.00 -0.24 117.51 122.55 3gbr h ILE 36 Ca 0.28 -0.42 -0.24 0.00 1.00 0.00 0.00 64.86 65.48 3gbr h ILE 36 Cb 0.09 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.19 3gbr h ILE 36 CO -0.08 0.21 -1.06 -0.07 0.00 0.00 0.00 178.15 177.16 3gbr h LEU 37 N 1.12 0.44 -0.12 1.44 3.38 -1.60 -2.19 115.31 117.78 3gbr h LEU 37 Ca 0.30 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3gbr h LEU 37 Cb -0.10 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3gbr h LEU 37 CO -0.06 1.24 0.07 0.58 0.09 0.00 0.00 178.44 180.36 3gbr h VAL 38 N 0.15 1.02 -0.41 1.22 2.07 -0.84 0.17 116.25 119.63 3gbr h VAL 38 Ca -0.10 -0.05 0.05 0.00 0.82 0.00 0.00 66.70 67.42 3gbr h VAL 38 Cb 1.73 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 32.32 3gbr h VAL 38 CO 0.18 0.03 0.16 -1.28 0.02 0.00 0.00 177.57 176.67 3gbr h SER 39 N 0.14 0.19 -0.29 0.57 0.87 -1.07 0.47 113.55 114.43 3gbr h SER 39 Ca 0.04 0.04 0.04 0.00 -1.23 0.00 0.00 61.79 60.69 3gbr h SER 39 Cb -0.01 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 61.93 3gbr h SER 39 CO -0.02 0.14 0.04 0.00 -0.53 0.00 0.00 176.83 176.46 3gbr h ALA 40 N 1.25 0.28 -0.14 6.23 0.00 -1.08 -1.39 119.26 124.42 3gbr h ALA 40 Ca 0.19 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 3gbr h ALA 40 Cb 0.15 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3gbr h ALA 40 CO -0.18 -0.38 0.06 0.82 0.00 0.00 0.00 179.25 179.58 3gbr h ILE 41 N 0.13 1.13 -0.69 0.00 1.08 -0.22 -0.45 117.51 118.49 3gbr h ILE 41 Ca 0.13 -0.39 -0.04 0.00 -0.39 0.00 0.00 64.86 64.17 3gbr h ILE 41 Cb 0.16 1.15 -0.03 0.00 -3.07 0.00 0.00 36.82 35.02 3gbr h ILE 41 CO -0.20 0.12 0.29 -0.07 -0.69 0.00 0.00 178.15 177.61 3gbr h LEU 42 N 0.08 0.92 -0.33 1.44 3.38 -0.80 -0.39 115.31 119.61 3gbr h LEU 42 Ca 0.05 -0.12 -0.12 0.00 0.09 0.00 0.00 57.88 57.77 3gbr h LEU 42 Cb 0.14 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3gbr h LEU 42 CO -0.00 0.81 -0.27 0.58 0.09 0.00 0.00 178.44 179.65 3gbr h VAL 43 N 0.99 1.29 -0.51 1.22 2.07 -1.19 -2.81 116.25 117.32 3gbr h VAL 43 Ca 0.24 -1.43 -0.04 0.00 0.82 0.00 0.00 66.70 66.29 3gbr h VAL 43 Cb 0.17 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 3gbr h VAL 43 CO -0.02 0.47 0.18 0.00 0.02 0.00 0.00 177.57 178.21 3gbr h ALA 44 N 0.74 0.67 -0.35 1.67 0.00 -0.67 -0.54 119.26 120.77 3gbr h ALA 44 Ca 0.06 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.85 3gbr h ALA 44 Cb 0.84 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.38 3gbr h ALA 44 CO 0.07 0.30 0.06 -0.07 0.00 0.00 0.00 179.25 179.61 3gbr h LEU 45 N 0.69 -0.02 -0.46 0.00 4.07 -1.13 -0.10 115.31 118.36 3gbr h LEU 45 Ca 0.17 0.06 -0.09 0.00 0.08 0.00 0.00 57.88 58.10 3gbr h LEU 45 Cb 0.24 0.09 -0.02 0.00 1.08 0.00 0.00 40.66 42.05 3gbr h LEU 45 CO -0.01 0.03 -0.04 -0.09 -1.08 0.00 0.00 178.44 177.24 3gbr h ARG 46 N 0.17 0.84 -0.18 1.13 2.43 -1.22 -0.66 114.38 116.90 3gbr h ARG 46 Ca 0.17 -0.29 -0.19 0.00 -0.81 0.00 0.00 59.98 58.86 3gbr h ARG 46 Cb 0.20 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 3gbr h ARG 46 CO -0.23 0.92 -0.64 0.52 -1.51 0.00 0.00 179.97 179.03 3gbr h MET 47 N 0.69 0.66 -0.65 0.20 2.86 -0.99 -2.71 114.93 115.01 3gbr h MET 47 Ca 0.12 -0.47 -0.03 0.00 -2.06 0.00 0.00 59.70 57.27 3gbr h MET 47 Cb 0.57 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.27 3gbr h MET 47 CO 0.03 1.09 0.30 -0.22 1.06 0.00 0.00 176.91 179.17 3gbr h LYS 48 N 0.49 0.92 -0.51 1.72 3.64 -1.01 -3.49 116.57 118.32 3gbr h LYS 48 Ca -0.01 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 3gbr h LYS 48 Cb 1.22 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 3gbr h LYS 48 CO 0.13 0.72 0.00 0.41 -2.27 0.00 0.00 179.45 178.44 3gbr n GLY 49 N -1.10 -0.36 3.77 5.01 0.00 -0.27 -5.02 105.19 107.21 3gbr n GLY 49 Ca 0.06 -0.96 -0.39 0.00 0.00 0.00 0.00 46.02 44.73 3gbr n GLY 49 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3gbr s GLU 50 N -2.09 3.97 0.40 1.61 1.03 -1.14 -4.94 118.70 117.53 3gbr s GLU 50 Ca 0.00 2.10 0.08 0.00 0.03 0.00 0.00 54.97 57.18 3gbr s GLU 50 Cb 0.00 -2.73 -0.01 0.00 -0.80 0.00 0.00 34.13 30.59 3gbr s GLU 50 CO 0.00 -0.48 0.46 -1.54 -1.33 0.00 0.00 175.26 172.37 3gbr s SER 51 N -0.81 5.43 0.12 0.83 1.04 -1.26 -4.99 113.70 114.07 3gbr s SER 51 Ca 0.57 -0.52 -0.21 0.00 0.48 0.00 0.00 55.95 56.28 3gbr s SER 51 Cb -0.37 -0.74 -0.05 0.00 0.10 0.00 0.00 66.02 64.97 3gbr s SER 51 CO 0.47 -0.63 1.71 0.50 0.98 0.00 0.00 173.24 176.27 3gbr h LYS 52 N 0.88 -0.00 -0.89 4.02 3.64 -1.96 -1.73 116.57 120.53 3gbr h LYS 52 Ca -0.42 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.06 3gbr h LYS 52 Cb 1.27 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 33.02 3gbr h LYS 52 CO 0.52 -0.00 0.58 -0.91 -2.27 0.00 0.00 179.45 177.36 3gbr h ASN 53 N -0.00 0.79 -0.13 4.20 2.35 -1.95 -0.32 115.58 120.51 3gbr h ASN 53 Ca 0.08 0.02 -0.17 0.00 -0.55 0.00 0.00 56.30 55.68 3gbr h ASN 53 Cb 0.12 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.35 3gbr h ASN 53 CO -0.17 0.46 -0.55 -0.33 -1.65 0.00 0.00 177.43 175.19 3gbr h GLU 54 N 0.87 0.71 -0.06 0.81 5.08 -1.64 -1.42 114.58 118.93 3gbr h GLU 54 Ca 0.42 -0.45 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 3gbr h GLU 54 Cb 0.43 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 3gbr h GLU 54 CO -0.18 1.07 0.00 0.82 -1.00 0.00 0.00 179.01 179.73 3gbr h ILE 55 N 0.55 1.24 -0.47 3.13 1.08 -0.58 -1.97 117.51 120.50 3gbr h ILE 55 Ca 0.01 -0.76 0.02 0.00 -0.39 0.00 0.00 64.86 63.75 3gbr h ILE 55 Cb 1.12 1.63 -0.03 0.00 -3.07 0.00 0.00 36.82 36.47 3gbr h ILE 55 CO 0.11 0.21 0.28 0.58 -0.69 0.00 0.00 178.15 178.64 3gbr h VAL 56 N -0.17 1.05 -0.42 1.67 2.07 -1.09 -0.25 116.25 119.11 3gbr h VAL 56 Ca 0.02 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.33 3gbr h VAL 56 Cb 0.33 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 3gbr h VAL 56 CO 0.00 0.10 0.21 1.23 0.02 0.00 0.00 177.57 179.13 3gbr h GLY 57 N 0.55 0.65 1.00 2.17 0.00 -1.26 -0.65 103.07 105.53 3gbr h GLY 57 Ca 0.19 -0.32 -0.07 0.00 0.00 0.00 0.00 47.33 47.12 3gbr h GLY 57 CO -0.09 0.31 0.01 0.74 0.00 0.00 0.00 176.54 177.51 3gbr h PHE 58 N 0.55 0.92 0.06 5.60 -1.00 -1.18 -1.56 116.94 120.32 3gbr h PHE 58 Ca 0.15 -0.16 0.02 0.00 2.81 0.00 0.00 57.97 60.79 3gbr h PHE 58 Cb 0.11 -0.24 -0.03 0.00 3.61 0.00 0.00 35.95 39.41 3gbr h PHE 58 CO -0.01 0.87 -0.17 0.00 -1.61 0.00 0.00 178.31 177.38 3gbr h ALA 59 N 0.93 -0.25 -0.42 2.45 0.00 -0.88 -1.41 119.26 119.67 3gbr h ALA 59 Ca 0.14 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3gbr h ALA 59 Cb 0.50 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 3gbr h ALA 59 CO 0.02 -0.68 0.24 0.00 0.00 0.00 0.00 179.25 178.83 3gbr h ARG 60 N -0.31 0.57 -0.32 0.00 3.08 -1.06 -0.92 114.38 115.42 3gbr h ARG 60 Ca 0.04 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 3gbr h ARG 60 Cb 0.35 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 3gbr h ARG 60 CO -0.12 0.42 0.07 0.00 -1.07 0.00 0.00 179.97 179.27 3gbr h ALA 61 N 1.68 0.43 -0.54 0.04 0.00 -0.95 -0.73 119.26 119.19 3gbr h ALA 61 Ca 0.15 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 3gbr h ALA 61 Cb 0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3gbr h ALA 61 CO -0.03 0.10 -0.12 0.52 0.00 0.00 0.00 179.25 179.72 3gbr h MET 62 N 0.36 1.03 -0.37 0.00 2.86 -0.85 -1.55 114.93 116.41 3gbr h MET 62 Ca 0.10 -0.39 -0.02 0.00 -2.06 0.00 0.00 59.70 57.34 3gbr h MET 62 Cb 0.30 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.88 3gbr h MET 62 CO 0.00 1.08 0.17 0.00 1.06 0.00 0.00 176.91 179.22 3gbr h ARG 63 N 0.92 0.54 -0.55 1.72 3.08 -1.12 -1.77 114.38 117.19 3gbr h ARG 63 Ca 0.14 -0.08 -0.08 0.00 0.07 0.00 0.00 59.98 60.02 3gbr h ARG 63 Cb 0.69 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.62 3gbr h ARG 63 CO 0.05 0.49 0.02 1.49 -1.07 0.00 0.00 179.97 180.94 3gbr h GLU 64 N 0.46 0.94 -0.00 0.04 4.81 -1.02 -2.52 114.58 117.28 3gbr h GLU 64 Ca 0.13 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 3gbr h GLU 64 Cb 0.13 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.41 3gbr h GLU 64 CO -0.01 0.92 -0.04 1.28 -0.73 0.00 0.00 179.01 180.43 3gbr n LEU 65 N -4.20 0.35 -4.85 1.64 4.77 -0.60 -4.89 117.00 109.23 3gbr n LEU 65 Ca 0.03 -0.01 -0.32 0.00 -0.03 0.00 0.00 56.01 55.68 3gbr n LEU 65 Cb 0.32 -0.11 -0.03 0.00 -2.33 0.00 0.00 43.42 41.27 3gbr n LEU 65 CO 0.43 0.06 0.66 0.00 -1.33 0.00 0.00 177.39 177.21 3gbr s ALA 66 N -2.25 3.10 -0.10 -1.18 0.00 -0.67 -4.76 121.76 115.89 3gbr s ALA 66 Ca 0.37 0.13 -0.27 0.00 0.00 0.00 0.00 51.96 52.19 3gbr s ALA 66 Cb 0.21 -3.08 -0.02 0.00 0.00 0.00 0.00 23.12 20.23 3gbr s ALA 66 CO 0.41 -0.25 0.89 0.42 0.00 0.00 0.00 175.76 177.24 3gbr s ILE 67 N -2.64 4.88 0.10 0.00 1.01 0.30 -5.02 121.20 119.82 3gbr s ILE 67 Ca 0.58 1.82 0.07 0.00 0.00 0.00 0.00 60.65 63.12 3gbr s ILE 67 Cb -0.10 -4.21 -0.04 0.00 0.01 0.00 0.00 42.46 38.12 3gbr s ILE 67 CO 0.33 0.09 -0.12 -0.54 0.00 0.00 0.00 174.94 174.70 3gbr s LYS 68 N 1.64 2.09 0.42 2.79 1.02 -1.26 -4.73 119.74 121.71 3gbr s LYS 68 Ca 0.44 -1.03 0.05 0.00 0.02 0.00 0.00 55.97 55.45 3gbr s LYS 68 Cb -0.18 -2.28 -0.06 0.00 -0.52 0.00 0.00 37.83 34.79 3gbr s LYS 68 CO 0.18 0.51 0.02 0.96 -0.92 0.00 0.00 175.35 176.10 3gbr s ILE 69 N -1.17 1.61 -0.39 2.17 -4.36 -0.73 -5.02 121.20 113.31 3gbr s ILE 69 Ca 0.20 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.61 3gbr s ILE 69 Cb -0.11 -2.73 0.12 0.00 1.25 0.00 0.00 42.46 40.99 3gbr s ILE 69 CO 0.12 0.00 0.16 -0.62 0.24 0.00 0.00 174.94 174.84 3gbr s ASP 70 N -3.72 4.09 -0.51 4.36 3.68 -1.26 -4.09 116.67 119.21 3gbr s ASP 70 Ca 0.27 -2.30 0.07 0.00 2.13 0.00 0.00 52.55 52.72 3gbr s ASP 70 Cb 0.07 -1.20 0.26 0.00 -1.45 0.00 0.00 42.92 40.61 3gbr s ASP 70 CO 0.14 -0.33 0.67 0.52 0.13 0.00 0.00 175.17 176.30 3gbr n VAL 71 N 4.01 1.00 0.29 1.11 0.31 -0.29 -4.98 118.33 119.78 3gbr n VAL 71 Ca 0.04 -4.71 0.14 0.00 -0.01 0.00 0.00 64.34 59.80 3gbr n VAL 71 Cb 0.38 -1.86 0.88 0.00 -0.91 0.00 0.00 33.84 32.33 3gbr n VAL 71 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 3gbr h PRO 72 N 3.92 0.00 -0.00 5.55 0.13 -1.70 -1.46 132.00 138.44 3gbr h PRO 72 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3gbr h PRO 72 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 3gbr h PRO 72 CO 0.66 0.01 -0.07 0.27 -0.23 0.00 0.00 178.00 178.64 3gbr n ASN 73 N -3.90 0.27 -4.73 1.44 6.94 -1.26 -1.35 115.26 112.67 3gbr n ASN 73 Ca -0.03 -0.43 -0.33 0.00 -0.02 0.00 0.00 54.58 53.78 3gbr n ASN 73 Cb 0.09 -0.15 0.10 0.00 -2.36 0.00 0.00 39.78 37.46 3gbr n ASN 73 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3gbr s ALA 74 N -2.50 2.10 0.08 -2.53 0.00 -0.55 -4.68 121.76 113.69 3gbr s ALA 74 Ca 0.29 0.62 0.05 0.00 0.00 0.00 0.00 51.96 52.93 3gbr s ALA 74 Cb 0.20 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 3gbr s ALA 74 CO 0.47 -1.88 -0.04 -1.50 0.00 0.00 0.00 175.76 172.81 3gbr s ILE 75 N -2.38 3.79 0.02 0.00 2.07 0.13 -3.19 121.20 121.64 3gbr s ILE 75 Ca 0.68 -1.04 0.06 0.00 -1.41 0.00 0.00 60.65 58.95 3gbr s ILE 75 Cb -0.23 -2.78 -0.02 0.00 0.13 0.00 0.00 42.46 39.56 3gbr s ILE 75 CO 0.49 0.15 -0.19 -0.62 -1.91 0.00 0.00 174.94 172.86 3gbr s ASP 76 N -2.16 2.24 -0.22 4.50 2.15 -0.69 -2.15 116.67 120.33 3gbr s ASP 76 Ca 0.23 -0.45 0.01 0.00 0.43 0.00 0.00 52.55 52.78 3gbr s ASP 76 Cb -0.11 -0.20 0.05 0.00 -0.30 0.00 0.00 42.92 42.36 3gbr s ASP 76 CO 0.16 0.16 -0.09 0.28 -0.17 0.00 0.00 175.17 175.51 3gbr s THR 77 N -0.68 1.69 -0.05 1.71 -1.32 -1.26 -0.72 115.64 115.01 3gbr s THR 77 Ca 0.06 -1.18 -0.26 0.00 -1.21 0.00 0.00 61.69 59.11 3gbr s THR 77 Cb -0.08 -1.83 0.06 0.00 -1.51 0.00 0.00 72.50 69.13 3gbr s THR 77 CO 0.01 0.05 0.57 0.00 -2.21 0.00 0.00 174.62 173.04 3gbr s ALA 78 N 1.35 -1.47 0.39 11.08 0.00 -0.57 -4.71 121.76 127.83 3gbr s ALA 78 Ca -0.04 1.06 0.06 0.00 0.00 0.00 0.00 51.96 53.05 3gbr s ALA 78 Cb -0.18 -0.05 -0.08 0.00 0.00 0.00 0.00 23.12 22.82 3gbr s ALA 78 CO -0.07 -0.33 0.02 0.20 0.00 0.00 0.00 175.76 175.57 3gbr s GLY 79 N -1.12 2.40 0.41 0.00 0.00 -1.26 -1.84 107.32 105.91 3gbr s GLY 79 Ca -0.11 -2.25 0.27 0.00 0.00 0.00 0.00 44.72 42.64 3gbr s GLY 79 CO 0.08 -2.04 1.77 -0.91 0.00 0.00 0.00 173.10 172.01 3gbr h THR 80 N 1.86 0.00 -1.51 0.90 1.35 -1.30 -3.42 112.91 110.79 3gbr h THR 80 Ca -0.43 -0.65 0.10 0.00 -0.55 0.00 0.00 66.41 64.88 3gbr h THR 80 Cb 1.24 1.61 -0.03 0.00 -1.73 0.00 0.00 68.15 69.24 3gbr h THR 80 CO 0.78 0.00 -0.14 0.61 -0.25 0.00 0.00 175.52 176.52 3gbr n GLY 81 N 0.64 -1.69 0.00 5.82 0.00 -1.26 -4.79 105.19 103.91 3gbr n GLY 81 Ca 0.03 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.82 3gbr n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gbr n GLY 82 N -1.29 2.11 0.26 -0.02 0.00 -1.26 -4.33 105.19 100.66 3gbr n GLY 82 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 3gbr n GLY 82 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3gbr h GLY 83 N 0.00 0.97 -0.52 -0.02 0.00 -1.88 -3.48 103.07 98.15 3gbr h GLY 83 Ca 0.00 -0.99 -0.21 0.00 0.00 0.00 0.00 47.33 46.13 3gbr h GLY 83 CO 0.00 0.89 -0.20 0.61 0.00 0.00 0.00 176.54 177.85 3gbr n GLY 84 N 0.13 1.16 0.16 4.60 0.00 -1.26 -4.90 105.19 105.09 3gbr n GLY 84 Ca -0.02 -0.55 0.13 0.00 0.00 0.00 0.00 46.02 45.58 3gbr n GLY 84 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3gbr h LEU 85 N 0.00 0.00 -0.98 0.99 3.38 -1.92 -3.47 115.31 113.31 3gbr h LEU 85 Ca -0.22 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.59 3gbr h LEU 85 Cb 0.69 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.50 3gbr h LEU 85 CO 0.31 0.00 -0.28 0.61 0.09 0.00 0.00 178.44 179.18 3gbr n GLY 86 N 0.33 0.34 3.93 0.83 0.00 -1.26 -4.87 105.19 104.49 3gbr n GLY 86 Ca 0.03 -0.30 -0.25 0.00 0.00 0.00 0.00 46.02 45.50 3gbr n GLY 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gbr s THR 87 N -3.13 3.65 0.57 2.61 -4.23 -1.26 -0.69 115.64 113.16 3gbr s THR 87 Ca 0.23 -0.20 -0.19 0.00 -1.18 0.00 0.00 61.69 60.35 3gbr s THR 87 Cb -0.10 -3.42 -0.06 0.00 1.34 0.00 0.00 72.50 70.26 3gbr s THR 87 CO 0.29 -0.38 0.89 0.55 -0.54 0.00 0.00 174.62 175.43 3gbr n VAL 88 N -2.43 3.28 -2.29 2.29 3.14 0.14 -4.69 118.33 117.77 3gbr n VAL 88 Ca 0.04 -0.50 -0.34 0.00 -2.96 0.00 0.00 64.34 60.57 3gbr n VAL 88 Cb 0.58 -1.06 -0.04 0.00 -1.06 0.00 0.00 33.84 32.26 3gbr n VAL 88 CO 0.00 0.00 0.00 0.20 -6.46 0.00 0.00 176.83 170.57 3gbr s ASN 89 N -1.17 5.81 0.07 6.55 -0.87 -1.26 -4.79 114.94 119.28 3gbr s ASN 89 Ca 0.73 -1.79 -0.10 0.00 -1.57 0.00 0.00 52.86 50.13 3gbr s ASN 89 Cb -0.44 -2.58 -0.27 0.00 -0.02 0.00 0.00 41.25 37.94 3gbr s ASN 89 CO 0.50 -2.23 1.13 1.62 -2.57 0.00 0.00 177.10 175.55 3gbr h VAL 90 N 6.17 1.37 -0.38 1.60 3.04 -1.99 -2.96 116.25 123.10 3gbr h VAL 90 Ca 0.28 -2.68 -0.04 0.00 -1.01 0.00 0.00 66.70 63.25 3gbr h VAL 90 Cb 0.93 2.79 -0.02 0.00 -2.01 0.00 0.00 31.29 32.98 3gbr h VAL 90 CO 1.32 0.80 0.08 0.28 -1.01 0.00 0.00 177.57 179.05 3gbr h SER 91 N 0.18 0.52 -0.07 3.17 0.02 -1.87 0.42 113.55 115.91 3gbr h SER 91 Ca -0.17 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.70 3gbr h SER 91 Cb 1.93 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 64.33 3gbr h SER 91 CO 0.22 0.54 0.02 0.74 -1.14 0.00 0.00 176.83 177.21 3gbr h THR 92 N 0.56 1.18 -0.81 -2.27 2.02 -1.83 0.43 112.91 112.20 3gbr h THR 92 Ca 0.13 -0.56 0.05 0.00 0.77 0.00 0.00 66.41 66.80 3gbr h THR 92 Cb 0.23 1.42 -0.05 0.00 -1.74 0.00 0.00 68.15 68.01 3gbr h THR 92 CO -0.00 0.16 0.50 0.00 0.37 0.00 0.00 175.52 176.55 3gbr h ALA 93 N 0.81 1.08 -0.54 6.16 0.00 -1.37 -2.89 119.26 122.52 3gbr h ALA 93 Ca 0.02 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3gbr h ALA 93 Cb 0.23 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3gbr h ALA 93 CO -0.00 0.28 0.05 1.03 0.00 0.00 0.00 179.25 180.61 3gbr h SER 94 N 0.95 0.84 -0.82 0.00 0.87 -0.69 -2.38 113.55 112.33 3gbr h SER 94 Ca 0.34 -0.19 0.09 0.00 -1.23 0.00 0.00 61.79 60.80 3gbr h SER 94 Cb 0.08 -0.22 -0.06 0.00 -0.44 0.00 0.00 62.40 61.77 3gbr h SER 94 CO -0.14 0.87 0.53 0.00 -0.53 0.00 0.00 176.83 177.56 3gbr h ALA 95 N 1.23 1.72 -0.47 6.23 0.00 -0.70 -1.02 119.26 126.24 3gbr h ALA 95 Ca 0.17 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 3gbr h ALA 95 Cb 0.42 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3gbr h ALA 95 CO 0.01 0.12 -0.03 0.82 0.00 0.00 0.00 179.25 180.18 3gbr h ILE 96 N 0.78 1.27 -0.57 0.00 2.04 -1.32 -0.46 117.51 119.25 3gbr h ILE 96 Ca 0.37 -1.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.11 3gbr h ILE 96 Cb 0.41 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 3gbr h ILE 96 CO -0.15 0.38 0.26 -0.07 0.00 0.00 0.00 178.15 178.58 3gbr h LEU 97 N 0.69 0.75 -1.02 1.44 3.38 -1.24 -3.11 115.31 116.20 3gbr h LEU 97 Ca 0.13 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 3gbr h LEU 97 Cb 0.54 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3gbr h LEU 97 CO 0.03 0.68 -0.41 -0.07 0.09 0.00 0.00 178.44 178.76 3gbr h LEU 98 N 0.77 0.17 -2.32 1.67 3.38 -0.96 -2.74 115.31 115.28 3gbr h LEU 98 Ca 0.19 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3gbr h LEU 98 Cb 0.14 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3gbr h LEU 98 CO -0.02 0.57 0.00 0.77 0.09 0.00 0.00 178.44 179.84 3gbr h SER 99 N 0.14 0.00 0.29 -0.43 4.64 -1.01 -0.62 113.55 116.56 3gbr h SER 99 Ca 0.01 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.30 3gbr h SER 99 Cb 0.78 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.87 3gbr h SER 99 CO 0.06 0.00 -0.15 -0.07 -0.87 0.00 0.00 176.83 175.80 3gbr h LEU 100 N 0.00 0.00 -0.88 5.97 -0.00 -1.56 -3.32 115.31 115.51 3gbr h LEU 100 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 3gbr h LEU 100 Cb 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.88 3gbr h LEU 100 CO 0.00 0.15 0.00 1.33 -0.00 0.00 0.00 178.44 179.92 3gbr n VAL 101 N -3.89 0.12 -3.60 1.22 0.24 -0.82 -5.08 118.33 106.53 3gbr n VAL 101 Ca -0.02 -0.32 -0.12 0.00 -2.04 0.00 0.00 64.34 61.84 3gbr n VAL 101 Cb 0.24 1.30 -0.06 0.00 -1.47 0.00 0.00 33.84 33.85 3gbr n VAL 101 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3gbr s ASN 102 N -0.12 -0.52 0.26 -1.34 3.84 -0.30 -5.13 114.94 111.62 3gbr s ASN 102 Ca 0.00 0.80 -0.31 0.00 0.21 0.00 0.00 52.86 53.56 3gbr s ASN 102 Cb 0.00 0.74 -0.13 0.00 -0.55 0.00 0.00 41.25 41.31 3gbr s ASN 102 CO 0.00 -0.31 1.47 -0.81 -2.79 0.00 0.00 177.10 174.65 3gbr n PRO 103 N 1.59 2.26 -5.22 0.43 -0.04 -1.26 -3.72 135.00 129.04 3gbr n PRO 103 Ca -0.13 0.81 -0.31 0.00 -0.04 0.00 0.00 63.50 63.82 3gbr n PRO 103 Cb 0.57 -2.50 -0.16 0.00 -0.04 0.00 0.00 33.50 31.36 3gbr n PRO 103 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3gbr s VAL 104 N -0.08 1.99 -0.25 0.52 1.01 0.94 -0.69 120.40 123.84 3gbr s VAL 104 Ca 0.66 -1.03 -0.01 0.00 0.00 0.00 0.00 61.98 61.60 3gbr s VAL 104 Cb -0.59 -1.68 0.08 0.00 0.00 0.00 0.00 36.38 34.18 3gbr s VAL 104 CO 0.50 0.55 0.04 0.00 0.00 0.00 0.00 175.10 176.19 3gbr s ALA 105 N -0.14 1.45 0.32 5.51 0.00 -0.91 -2.17 121.76 125.82 3gbr s ALA 105 Ca -0.04 -1.26 0.03 0.00 0.00 0.00 0.00 51.96 50.70 3gbr s ALA 105 Cb -0.14 -1.42 -0.02 0.00 0.00 0.00 0.00 23.12 21.54 3gbr s ALA 105 CO 0.04 -1.38 0.48 0.15 0.00 0.00 0.00 175.76 175.04 3gbr s LYS 106 N 1.65 3.34 0.08 0.00 1.02 -0.73 -4.43 119.74 120.66 3gbr s LYS 106 Ca 0.02 -0.65 -0.10 0.00 0.02 0.00 0.00 55.97 55.27 3gbr s LYS 106 Cb -0.18 -2.77 0.00 0.00 -0.52 0.00 0.00 37.83 34.37 3gbr s LYS 106 CO -0.14 0.18 0.22 -3.38 -0.92 0.00 0.00 175.35 171.31 3gbr s HIS 107 N -2.19 0.08 -4.76 3.18 -3.43 -1.26 -0.40 115.29 106.52 3gbr s HIS 107 Ca 0.40 -0.44 0.00 0.00 -0.80 0.00 0.00 55.06 54.22 3gbr s HIS 107 Cb -0.09 -0.02 0.00 0.00 -1.43 0.00 0.00 32.58 31.04 3gbr s HIS 107 CO 0.33 -0.53 0.00 0.41 -2.00 0.00 0.00 174.74 172.95 3gbr n GLY 108 N 0.13 -0.74 3.43 -1.38 0.00 -1.03 -4.93 105.19 100.67 3gbr n GLY 108 Ca -0.16 -1.13 -0.26 0.00 0.00 0.00 0.00 46.02 44.47 3gbr n GLY 108 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3gbr s ASN 109 N -4.00 3.45 0.39 1.61 0.01 -1.26 -0.49 114.94 114.65 3gbr s ASN 109 Ca 0.00 -0.89 -0.26 0.00 -0.71 0.00 0.00 52.86 51.00 3gbr s ASN 109 Cb 0.00 -0.26 -0.11 0.00 0.41 0.00 0.00 41.25 41.29 3gbr s ASN 109 CO 0.00 0.11 1.23 0.54 -1.51 0.00 0.00 177.10 177.47 3gbr n ARG 110 N 0.13 1.89 -1.44 -0.60 1.74 -1.26 -4.35 116.66 112.76 3gbr n ARG 110 Ca -0.11 0.67 -0.30 0.00 -0.77 0.00 0.00 57.85 57.34 3gbr n ARG 110 Cb 0.57 -2.30 0.10 0.00 -1.02 0.00 0.00 32.46 29.81 3gbr n ARG 110 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3gbr s ALA 111 N -1.17 2.09 0.72 7.54 0.00 -1.26 -4.99 121.76 124.69 3gbr s ALA 111 Ca 0.59 -0.12 -0.14 0.00 0.00 0.00 0.00 51.96 52.30 3gbr s ALA 111 Cb -0.54 -3.14 0.03 0.00 0.00 0.00 0.00 23.12 19.47 3gbr s ALA 111 CO 0.59 -1.86 1.13 0.14 0.00 0.00 0.00 175.76 175.76 3gbr s VAL 112 N -3.07 2.93 0.25 0.00 -7.23 -1.26 -4.84 120.40 107.17 3gbr s VAL 112 Ca 0.61 0.40 -0.30 0.00 -1.81 0.00 0.00 61.98 60.89 3gbr s VAL 112 Cb -0.15 -2.88 -0.09 0.00 0.56 0.00 0.00 36.38 33.81 3gbr s VAL 112 CO 0.55 -0.30 1.19 -0.94 -0.31 0.00 0.00 175.10 175.29 3gbr s SER 113 N -2.60 7.08 -0.63 4.85 1.04 -1.26 -0.79 113.70 121.40 3gbr s SER 113 Ca 0.68 2.34 0.04 0.00 0.48 0.00 0.00 55.95 59.49 3gbr s SER 113 Cb -0.22 -2.62 0.36 0.00 0.10 0.00 0.00 66.02 63.63 3gbr s SER 113 CO 0.46 -0.33 1.19 0.61 0.98 0.00 0.00 173.24 176.16 3gbr n GLY 114 N 1.58 5.79 3.95 7.32 0.00 -1.26 -5.13 105.19 117.44 3gbr n GLY 114 Ca 0.02 -2.73 -0.25 0.00 0.00 0.00 0.00 46.02 43.05 3gbr n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gbr s LYS 115 N -3.66 1.95 -0.29 1.61 -0.14 0.03 -4.80 119.74 114.44 3gbr s LYS 115 Ca 0.47 -0.52 0.03 0.00 -1.36 0.00 0.00 55.97 54.60 3gbr s LYS 115 Cb 0.31 -2.20 0.08 0.00 -1.68 0.00 0.00 37.83 34.33 3gbr s LYS 115 CO -0.17 -1.35 -0.01 0.45 -0.76 0.00 0.00 175.35 173.50 3gbr s SER 116 N -4.59 4.42 0.69 2.83 0.15 -1.26 -4.72 113.70 111.22 3gbr s SER 116 Ca 0.63 -1.69 -0.01 0.00 0.70 0.00 0.00 55.95 55.57 3gbr s SER 116 Cb -0.09 -1.44 0.11 0.00 -1.71 0.00 0.00 66.02 62.88 3gbr s SER 116 CO 0.45 -0.30 0.96 -0.83 1.20 0.00 0.00 173.24 174.72 3gbr s GLY 117 N 1.13 1.77 0.22 9.45 0.00 -1.26 -4.89 107.32 113.73 3gbr s GLY 117 Ca 0.02 -1.57 -0.08 0.00 0.00 0.00 0.00 44.72 43.09 3gbr s GLY 117 CO -0.08 -1.06 1.81 0.23 0.00 0.00 0.00 173.10 173.99 3gbr h SER 118 N -0.45 0.57 -0.77 1.64 0.87 -1.98 -2.21 113.55 111.22 3gbr h SER 118 Ca -0.38 0.03 0.03 0.00 -1.23 0.00 0.00 61.79 60.24 3gbr h SER 118 Cb 1.28 -0.08 -0.05 0.00 -0.44 0.00 0.00 62.40 63.11 3gbr h SER 118 CO 0.44 0.36 0.49 0.00 -0.53 0.00 0.00 176.83 177.59 3gbr h ALA 119 N 1.37 1.01 -0.40 6.23 0.00 -1.93 -1.64 119.26 123.89 3gbr h ALA 119 Ca 0.32 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 55.05 3gbr h ALA 119 Cb 0.22 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3gbr h ALA 119 CO -0.20 0.29 -0.33 -0.44 0.00 0.00 0.00 179.25 178.58 3gbr h ASP 120 N 0.95 0.98 -0.36 0.00 3.32 -1.75 -0.39 116.42 119.17 3gbr h ASP 120 Ca 0.31 -0.45 -0.16 0.00 0.02 0.00 0.00 57.03 56.75 3gbr h ASP 120 Cb 0.01 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 3gbr h ASP 120 CO -0.11 1.22 -0.37 1.62 -1.72 0.00 0.00 179.24 179.87 3gbr h VAL 121 N 0.75 1.27 -0.62 -1.35 3.04 -1.30 -0.82 116.25 117.22 3gbr h VAL 121 Ca 0.07 -1.55 0.04 0.00 -1.01 0.00 0.00 66.70 64.25 3gbr h VAL 121 Cb 0.91 1.37 -0.04 0.00 -2.01 0.00 0.00 31.29 31.52 3gbr h VAL 121 CO 0.08 0.52 0.37 -0.07 -1.01 0.00 0.00 177.57 177.46 3gbr h LEU 122 N 0.75 0.58 -0.74 3.16 3.38 -1.15 -1.64 115.31 119.65 3gbr h LEU 122 Ca 0.06 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 3gbr h LEU 122 Cb 0.96 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 3gbr h LEU 122 CO 0.09 0.39 0.21 -0.33 0.09 0.00 0.00 178.44 178.89 3gbr h GLU 123 N 0.71 1.16 -0.62 1.13 5.08 -0.84 -0.52 114.58 120.68 3gbr h GLU 123 Ca 0.26 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3gbr h GLU 123 Cb 0.08 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 3gbr h GLU 123 CO -0.13 1.00 0.38 0.00 -1.00 0.00 0.00 179.01 179.26 3gbr h ALA 124 N 1.11 1.50 0.00 3.43 0.00 -0.86 -2.11 119.26 122.32 3gbr h ALA 124 Ca 0.23 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3gbr h ALA 124 Cb 0.34 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3gbr h ALA 124 CO -0.00 0.44 0.00 -0.07 0.00 0.00 0.00 179.25 179.61 3gbr h LEU 125 N 0.84 0.00 0.00 0.00 -0.00 -0.71 -3.41 115.31 112.03 3gbr h LEU 125 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.10 3gbr h LEU 125 Cb -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.62 3gbr h LEU 125 CO -0.04 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.01 3gbr n GLY 126 N 0.41 0.98 3.76 0.83 0.00 -0.79 -2.25 105.19 108.13 3gbr n GLY 126 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 3gbr n GLY 126 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3gbr s TYR 127 N -2.00 3.43 -0.44 1.61 5.04 -0.27 -0.17 117.35 124.55 3gbr s TYR 127 Ca 0.00 1.63 -0.19 0.00 -2.44 0.00 0.00 57.07 56.08 3gbr s TYR 127 Cb 0.00 -3.36 0.03 0.00 0.35 0.00 0.00 41.96 38.98 3gbr s TYR 127 CO 0.00 -0.86 0.54 1.21 -1.34 0.00 0.00 175.55 175.11 3gbr s ASN 128 N -0.85 6.25 0.00 4.32 2.47 -0.75 -4.29 114.94 122.09 3gbr s ASN 128 Ca 0.47 -0.59 0.29 0.00 0.42 0.00 0.00 52.86 53.45 3gbr s ASN 128 Cb -0.33 -2.27 1.49 0.00 -1.45 0.00 0.00 41.25 38.70 3gbr s ASN 128 CO 0.43 -0.70 1.99 2.30 -3.72 0.00 0.00 177.10 177.39 3gbr n ILE 129 N 5.62 0.01 -2.86 -5.21 -5.35 -1.26 -4.46 119.36 105.84 3gbr n ILE 129 Ca -0.05 -0.11 -0.43 0.00 -0.27 0.00 0.00 62.75 61.89 3gbr n ILE 129 Cb 0.47 -0.08 -0.03 0.00 -1.74 0.00 0.00 39.64 38.26 3gbr n ILE 129 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3gbr s ILE 130 N -1.99 4.54 -0.37 7.28 1.01 -1.26 -4.35 121.20 126.06 3gbr s ILE 130 Ca 0.42 -1.21 0.02 0.00 0.00 0.00 0.00 60.65 59.88 3gbr s ILE 130 Cb 0.21 -4.80 0.11 0.00 0.01 0.00 0.00 42.46 37.99 3gbr s ILE 130 CO 0.34 -1.55 0.13 -0.69 0.00 0.00 0.00 174.94 173.17 3gbr s VAL 131 N 3.28 1.53 0.67 2.92 1.01 -1.26 -5.10 120.40 123.44 3gbr s VAL 131 Ca 0.32 -2.09 -0.18 0.00 0.00 0.00 0.00 61.98 60.03 3gbr s VAL 131 Cb -0.07 -2.12 -0.00 0.00 0.00 0.00 0.00 36.38 34.19 3gbr s VAL 131 CO -0.05 -0.72 1.29 -2.84 0.00 0.00 0.00 175.10 172.78 3gbr s PRO 132 N 0.97 2.44 0.23 2.72 0.02 -1.26 -4.66 135.00 135.46 3gbr s PRO 132 Ca 0.13 2.04 -0.16 0.00 0.02 0.00 0.00 61.00 63.03 3gbr s PRO 132 Cb -0.20 -1.83 0.26 0.00 0.02 0.00 0.00 34.50 32.74 3gbr s PRO 132 CO -0.12 -1.68 1.58 -1.35 -0.33 0.00 0.00 177.00 175.09 3gbr h PRO 133 N 0.38 -0.05 -0.57 5.54 0.11 -1.99 0.33 132.00 135.75 3gbr h PRO 133 Ca -0.50 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.57 3gbr h PRO 133 Cb 1.33 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.43 3gbr h PRO 133 CO 0.52 -0.03 0.22 0.93 -0.21 0.00 0.00 178.00 179.43 3gbr h GLU 134 N -0.05 0.86 -0.70 1.05 4.39 -1.97 -1.20 114.58 116.96 3gbr h GLU 134 Ca 0.34 -0.16 0.03 0.00 0.34 0.00 0.00 59.36 59.91 3gbr h GLU 134 Cb 0.59 -0.14 -0.05 0.00 -0.10 0.00 0.00 28.75 29.06 3gbr h GLU 134 CO -0.86 0.75 0.43 -0.09 -1.16 0.00 0.00 179.01 178.09 3gbr h ARG 135 N 0.79 0.82 -0.16 2.33 9.65 -1.66 -2.11 114.38 124.04 3gbr h ARG 135 Ca 0.19 -0.05 0.04 0.00 -1.10 0.00 0.00 59.98 59.06 3gbr h ARG 135 Cb 0.21 -0.18 -0.04 0.00 -1.39 0.00 0.00 29.97 28.57 3gbr h ARG 135 CO -0.01 0.54 -0.09 0.00 2.80 0.00 0.00 179.97 183.20 3gbr h ALA 136 N 1.31 0.04 -0.46 2.80 0.00 -0.10 0.17 119.26 123.02 3gbr h ALA 136 Ca 0.29 0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.35 3gbr h ALA 136 Cb 0.04 0.21 -0.09 0.00 0.00 0.00 0.00 17.79 17.95 3gbr h ALA 136 CO -0.12 -0.53 -0.19 0.87 0.00 0.00 0.00 179.25 179.28 3gbr h LYS 137 N -0.09 -0.09 -0.19 0.00 1.57 -1.07 -1.16 116.57 115.54 3gbr h LYS 137 Ca 0.09 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.89 3gbr h LYS 137 Cb 0.22 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 3gbr h LYS 137 CO -0.21 -0.06 0.09 0.93 -0.57 0.00 0.00 179.45 179.63 3gbr h GLU 138 N -0.09 0.20 -0.83 3.15 5.08 -0.66 -2.13 114.58 119.30 3gbr h GLU 138 Ca 0.22 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.59 3gbr h GLU 138 Cb 0.43 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 3gbr h GLU 138 CO -0.52 0.13 0.55 -0.07 -1.00 0.00 0.00 179.01 178.10 3gbr h LEU 139 N 0.20 0.92 -0.27 1.33 3.38 -0.26 -1.28 115.31 119.34 3gbr h LEU 139 Ca 0.08 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.87 3gbr h LEU 139 Cb 0.01 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 3gbr h LEU 139 CO -0.05 0.65 -0.46 0.58 0.09 0.00 0.00 178.44 179.24 3gbr h VAL 140 N 1.07 1.29 -0.31 1.22 2.07 -1.07 -1.11 116.25 119.42 3gbr h VAL 140 Ca 0.32 -1.66 0.02 0.00 0.82 0.00 0.00 66.70 66.20 3gbr h VAL 140 Cb -0.04 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 3gbr h VAL 140 CO -0.08 0.53 0.16 0.78 0.02 0.00 0.00 177.57 178.98 3gbr h ASN 141 N 0.54 0.25 0.54 0.57 2.35 -1.01 0.10 115.58 118.93 3gbr h ASN 141 Ca 0.02 0.01 -0.29 0.00 -0.55 0.00 0.00 56.30 55.49 3gbr h ASN 141 Cb 1.06 -0.04 0.01 0.00 0.05 0.00 0.00 38.32 39.41 3gbr h ASN 141 CO 0.10 0.19 -1.30 0.11 -1.65 0.00 0.00 177.43 174.88 3gbr h LYS 142 N 0.34 0.34 0.00 0.81 1.57 -1.24 -3.39 116.57 115.00 3gbr h LYS 142 Ca 0.12 -0.58 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 3gbr h LYS 142 Cb 0.03 0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.55 3gbr h LYS 142 CO -0.08 1.28 0.00 0.25 -0.57 0.00 0.00 179.45 180.33 3gbr n THR 143 N -3.58 0.02 -1.37 -0.16 -2.24 -0.42 -5.02 114.28 101.51 3gbr n THR 143 Ca -0.10 -0.35 -0.13 0.00 -2.27 0.00 0.00 64.05 61.20 3gbr n THR 143 Cb 1.04 1.31 -0.05 0.00 -2.10 0.00 0.00 70.33 70.53 3gbr n THR 143 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3gbr n ASN 144 N -0.01 -5.28 -3.81 3.42 5.03 0.36 -4.92 115.26 110.06 3gbr n ASN 144 Ca 0.00 0.31 -0.12 0.00 0.87 0.00 0.00 54.58 55.64 3gbr n ASN 144 Cb 0.09 -3.89 -0.12 0.00 -1.02 0.00 0.00 39.78 34.84 3gbr n ASN 144 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 3gbr s PHE 145 N -2.22 -0.20 -0.09 3.10 5.36 -1.25 -0.04 117.98 122.63 3gbr s PHE 145 Ca 0.00 0.48 -0.20 0.00 -0.96 0.00 0.00 56.93 56.26 3gbr s PHE 145 Cb 0.00 0.07 0.04 0.00 -0.34 0.00 0.00 43.02 42.79 3gbr s PHE 145 CO 0.00 -0.13 0.47 0.54 -1.46 0.00 0.00 175.22 174.64 3gbr s VAL 146 N -0.05 0.02 -0.17 3.12 0.11 -0.92 -3.96 120.40 118.54 3gbr s VAL 146 Ca -0.02 -0.18 -0.03 0.00 -2.93 0.00 0.00 61.98 58.83 3gbr s VAL 146 Cb -0.02 -0.73 -0.02 0.00 -1.53 0.00 0.00 36.38 34.08 3gbr s VAL 146 CO 0.00 -0.10 -0.07 0.12 -3.33 0.00 0.00 175.10 171.73 3gbr s PHE 147 N -0.69 2.94 -0.42 1.54 5.36 -1.26 -1.78 117.98 123.67 3gbr s PHE 147 Ca -0.08 -0.63 -0.07 0.00 -0.96 0.00 0.00 56.93 55.19 3gbr s PHE 147 Cb -0.03 -1.98 0.09 0.00 -0.34 0.00 0.00 43.02 40.76 3gbr s PHE 147 CO 0.04 -0.28 0.24 -0.51 -1.46 0.00 0.00 175.22 173.26 3gbr s LEU 148 N 0.78 5.18 0.15 6.12 1.43 0.47 -4.80 118.68 128.01 3gbr s LEU 148 Ca -0.03 -1.70 -0.31 0.00 -1.03 0.00 0.00 54.13 51.06 3gbr s LEU 148 Cb -0.15 -1.93 -0.10 0.00 0.03 0.00 0.00 46.19 44.05 3gbr s LEU 148 CO 0.02 -0.55 1.56 -0.55 0.23 0.00 0.00 176.35 177.06 3gbr s SER 149 N 2.09 6.61 0.49 2.29 0.15 -1.26 -2.45 113.70 121.61 3gbr s SER 149 Ca 0.04 2.57 0.18 0.00 0.70 0.00 0.00 55.95 59.44 3gbr s SER 149 Cb -0.23 -2.59 1.21 0.00 -1.71 0.00 0.00 66.02 62.70 3gbr s SER 149 CO -0.00 -0.82 2.04 0.00 1.20 0.00 0.00 173.24 175.66 3gbr h ALA 150 N 7.01 2.15 -0.95 5.45 0.00 -1.16 -1.09 119.26 130.68 3gbr h ALA 150 Ca -0.43 -0.01 0.20 0.00 0.00 0.00 0.00 54.91 54.67 3gbr h ALA 150 Cb 1.20 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.89 3gbr h ALA 150 CO 0.91 -0.24 0.61 0.37 0.00 0.00 0.00 179.25 180.90 3gbr h GLN 151 N 0.16 0.54 0.01 0.00 4.15 -1.82 0.28 115.11 118.42 3gbr h GLN 151 Ca 0.18 -0.03 -0.37 0.00 0.77 0.00 0.00 58.65 59.19 3gbr h GLN 151 Cb 0.50 -0.12 -0.07 0.00 0.21 0.00 0.00 27.48 28.00 3gbr h GLN 151 CO -0.03 0.35 -2.37 0.66 -1.93 0.00 0.00 178.83 175.52 3gbr n TYR 152 N -4.60 0.12 -0.02 3.99 4.01 -0.51 -3.92 117.16 116.23 3gbr n TYR 152 Ca 0.21 0.03 0.07 0.00 -0.16 0.00 0.00 57.90 58.05 3gbr n TYR 152 Cb 0.65 -1.02 -0.15 0.00 -0.31 0.00 0.00 39.34 38.51 3gbr n TYR 152 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3gbr n TYR 153 N -3.00 0.13 -2.88 -0.72 4.02 -0.63 -4.27 117.16 109.81 3gbr n TYR 153 Ca -0.37 0.04 -0.25 0.00 -0.01 0.00 0.00 57.90 57.31 3gbr n TYR 153 Cb 1.08 -0.66 -0.03 0.00 -0.02 0.00 0.00 39.34 39.71 3gbr n TYR 153 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 3gbr n HIS 154 N -2.42 3.28 0.25 -0.72 8.25 0.96 -0.54 115.22 124.28 3gbr n HIS 154 Ca -0.09 -3.77 0.13 0.00 -0.26 0.00 0.00 57.72 53.72 3gbr n HIS 154 Cb 0.69 -0.40 0.64 0.00 1.12 0.00 0.00 29.99 32.05 3gbr n HIS 154 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3gbr h PRO 155 N 2.91 0.00 0.00 -0.41 0.13 -1.66 -2.53 132.00 130.44 3gbr h PRO 155 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 3gbr h PRO 155 Cb 0.67 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.80 3gbr h PRO 155 CO 0.77 0.14 0.00 0.00 -0.23 0.00 0.00 178.00 178.67 3gbr h ALA 156 N 1.86 1.00 0.00 -0.56 0.00 -1.87 -3.09 119.26 116.60 3gbr h ALA 156 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3gbr h ALA 156 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3gbr h ALA 156 CO 0.02 0.00 0.00 0.52 0.00 0.00 0.00 179.25 179.79 3gbr h MET 157 N 0.00 0.00 -0.24 0.00 2.86 -1.69 -1.39 114.93 114.46 3gbr h MET 157 Ca 0.00 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.71 3gbr h MET 157 Cb 0.54 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 3gbr h MET 157 CO 0.00 0.00 0.24 1.57 1.06 0.00 0.00 176.91 179.78 3gbr h LYS 158 N 0.00 0.00 0.00 1.72 2.10 -1.76 -2.41 116.57 116.22 3gbr h LYS 158 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3gbr h LYS 158 Cb 0.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.40 3gbr h LYS 158 CO 0.00 0.00 0.00 -0.91 -2.00 0.00 0.00 179.45 176.54 3gbr h ASN 159 N 0.00 0.00 -0.05 7.07 2.35 -1.48 -3.02 115.58 120.45 3gbr h ASN 159 Ca 0.12 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 3gbr h ASN 159 Cb 0.60 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.97 3gbr h ASN 159 CO -0.00 0.00 0.00 1.33 -1.65 0.00 0.00 177.43 177.11 3gbr n VAL 160 N -2.51 0.06 -0.14 2.81 0.24 -0.92 -4.77 118.33 113.10 3gbr n VAL 160 Ca 0.04 -0.53 -0.07 0.00 -2.04 0.00 0.00 64.34 61.73 3gbr n VAL 160 Cb 0.37 1.25 0.01 0.00 -1.47 0.00 0.00 33.84 34.00 3gbr n VAL 160 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3gbr h ALA 161 N 2.80 0.56 -0.33 2.33 0.00 -1.40 -2.22 119.26 121.00 3gbr h ALA 161 Ca 0.00 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 3gbr h ALA 161 Cb 0.61 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3gbr h ALA 161 CO 0.00 -0.00 -0.31 -0.97 0.00 0.00 0.00 179.25 177.96 3gbr h ASN 162 N 0.58 0.85 -0.10 0.00 -0.00 -1.86 -0.09 115.58 114.97 3gbr h ASN 162 Ca 0.17 -0.46 -0.00 0.00 -0.00 0.00 0.00 56.30 56.00 3gbr h ASN 162 Cb -0.05 -0.24 -0.00 0.00 -0.00 0.00 0.00 38.32 38.02 3gbr h ASN 162 CO -0.05 1.14 0.05 0.58 -0.00 0.00 0.00 177.43 179.15 3gbr h VAL 163 N 0.58 1.11 -0.69 2.57 2.07 -1.88 -0.04 116.25 119.97 3gbr h VAL 163 Ca 0.05 -0.33 0.06 0.00 0.82 0.00 0.00 66.70 67.31 3gbr h VAL 163 Cb 0.89 1.15 -0.06 0.00 -1.52 0.00 0.00 31.29 31.76 3gbr h VAL 163 CO 0.08 0.10 0.39 0.03 0.02 0.00 0.00 177.57 178.19 3gbr h ARG 164 N 0.04 0.69 -0.22 1.57 3.08 -1.30 0.73 114.38 118.97 3gbr h ARG 164 Ca 0.03 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 59.94 3gbr h ARG 164 Cb 0.12 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 3gbr h ARG 164 CO -0.00 0.45 -0.27 -0.22 -1.07 0.00 0.00 179.97 178.86 3gbr h LYS 165 N 0.71 0.57 -0.32 0.04 3.64 -0.90 -2.91 116.57 117.40 3gbr h LYS 165 Ca 0.31 -0.32 -0.12 0.00 -1.27 0.00 0.00 60.65 59.25 3gbr h LYS 165 Cb 0.20 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 3gbr h LYS 165 CO -0.19 0.92 -0.29 1.15 -2.27 0.00 0.00 179.45 178.77 3gbr h THR 166 N 0.26 1.28 -0.62 1.00 2.02 -0.72 -2.95 112.91 113.17 3gbr h THR 166 Ca 0.03 -1.40 -0.04 0.00 0.77 0.00 0.00 66.41 65.77 3gbr h THR 166 Cb 0.83 1.34 -0.03 0.00 -1.74 0.00 0.00 68.15 68.56 3gbr h THR 166 CO 0.06 0.46 0.22 -0.07 0.37 0.00 0.00 175.52 176.56 3gbr h LEU 167 N 0.57 0.85 0.00 2.58 3.38 -0.88 -3.47 115.31 118.35 3gbr h LEU 167 Ca 0.07 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3gbr h LEU 167 Cb 0.78 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3gbr h LEU 167 CO 0.06 0.78 0.00 0.61 0.09 0.00 0.00 178.44 179.98 3gbr n GLY 168 N -0.95 1.56 3.58 0.83 0.00 -1.10 -4.96 105.19 104.14 3gbr n GLY 168 Ca 0.05 -0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 3gbr n GLY 168 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3gbr s ILE 169 N 0.00 2.10 0.24 -0.61 -4.36 -1.26 -5.01 121.20 112.30 3gbr s ILE 169 Ca 0.00 0.03 -0.21 0.00 -0.26 0.00 0.00 60.65 60.21 3gbr s ILE 169 Cb 0.00 -2.11 -0.09 0.00 1.25 0.00 0.00 42.46 41.51 3gbr s ILE 169 CO 0.00 -0.04 0.77 -0.13 0.24 0.00 0.00 174.94 175.77 3gbr s ARG 170 N -4.57 4.32 0.42 0.37 0.52 -1.26 -5.01 118.95 113.73 3gbr s ARG 170 Ca 0.67 0.96 0.04 0.00 -0.52 0.00 0.00 55.73 56.88 3gbr s ARG 170 Cb -0.24 -2.86 -0.02 0.00 0.52 0.00 0.00 34.95 32.35 3gbr s ARG 170 CO 0.61 0.37 0.16 0.95 0.02 0.00 0.00 175.30 177.41 3gbr s THR 171 N -1.54 0.46 0.38 0.02 -4.23 -1.26 -4.99 115.64 104.48 3gbr s THR 171 Ca 0.44 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 59.13 3gbr s THR 171 Cb -0.17 -2.28 0.38 0.00 1.34 0.00 0.00 72.50 71.77 3gbr s THR 171 CO 0.21 0.00 1.74 -0.29 -0.54 0.00 0.00 174.62 175.75 3gbr h ILE 172 N 1.74 0.48 0.00 2.99 2.10 -1.97 -1.26 117.51 121.58 3gbr h ILE 172 Ca -0.33 -0.14 -0.01 0.00 1.08 0.00 0.00 64.86 65.47 3gbr h ILE 172 Cb 1.27 0.05 -0.00 0.00 -1.09 0.00 0.00 36.82 37.05 3gbr h ILE 172 CO 0.52 0.07 -0.03 -0.26 -1.08 0.00 0.00 178.15 177.37 3gbr h PHE 173 N 0.39 0.00 0.00 2.19 -1.00 -1.99 -2.45 116.94 114.09 3gbr h PHE 173 Ca 0.63 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.41 3gbr h PHE 173 Cb 1.57 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.13 3gbr h PHE 173 CO -0.00 0.03 0.00 0.09 -1.61 0.00 0.00 178.31 176.82 3gbr n ASN 174 N -3.85 0.00 -0.14 2.17 3.02 -0.48 -2.99 115.26 112.98 3gbr n ASN 174 Ca -0.03 -0.19 0.06 0.00 -0.03 0.00 0.00 54.58 54.39 3gbr n ASN 174 Cb 0.12 -0.26 0.10 0.00 -0.61 0.00 0.00 39.78 39.13 3gbr n ASN 174 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 3gbr n ILE 175 N -1.26 1.57 0.21 2.41 -5.35 -0.92 -4.69 119.36 111.33 3gbr n ILE 175 Ca 0.14 -1.73 0.09 0.00 -0.27 0.00 0.00 62.75 60.98 3gbr n ILE 175 Cb 0.22 0.06 -0.13 0.00 -1.74 0.00 0.00 39.64 38.05 3gbr n ILE 175 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3gbr n LEU 176 N -0.93 0.22 -0.25 7.28 4.77 -1.16 -4.77 117.00 122.15 3gbr n LEU 176 Ca 0.11 -0.13 -0.10 0.00 -0.03 0.00 0.00 56.01 55.86 3gbr n LEU 176 Cb 0.51 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.52 3gbr n LEU 176 CO 0.02 0.05 0.49 1.23 -1.33 0.00 0.00 177.39 177.86 3gbr h GLY 177 N 3.46 -1.22 2.00 -0.72 0.00 -1.84 -0.53 103.07 104.22 3gbr h GLY 177 Ca 0.00 0.83 0.00 0.00 0.00 0.00 0.00 47.33 48.16 3gbr h GLY 177 CO 0.00 -0.20 0.00 -1.05 0.00 0.00 0.00 176.54 175.29 3gbr n PRO 178 N -4.80 0.03 -0.10 4.80 -0.02 -1.26 -2.25 135.00 131.39 3gbr n PRO 178 Ca -0.00 0.36 0.12 0.00 -2.02 0.00 0.00 63.50 61.96 3gbr n PRO 178 Cb 0.23 -1.56 0.22 0.00 -0.02 0.00 0.00 33.50 32.37 3gbr n PRO 178 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3gbr n LEU 179 N -1.61 2.97 -2.13 2.45 4.77 -0.22 -4.45 117.00 118.78 3gbr n LEU 179 Ca 0.02 -1.16 -0.08 0.00 -0.03 0.00 0.00 56.01 54.75 3gbr n LEU 179 Cb 0.12 -0.13 0.05 0.00 -2.33 0.00 0.00 43.42 41.13 3gbr n LEU 179 CO 0.10 0.58 0.11 0.35 -1.33 0.00 0.00 177.39 177.20 3gbr n THR 180 N 1.22 1.72 -1.69 -5.08 -2.24 -0.95 -4.93 114.28 102.32 3gbr n THR 180 Ca 0.17 -3.25 -0.42 0.00 -2.27 0.00 0.00 64.05 58.29 3gbr n THR 180 Cb 0.56 0.16 -0.03 0.00 -2.10 0.00 0.00 70.33 68.92 3gbr n THR 180 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3gbr s ASN 181 N -3.47 6.45 0.00 3.42 2.47 -1.26 -4.89 114.94 117.66 3gbr s ASN 181 Ca 0.38 2.68 0.31 0.00 0.42 0.00 0.00 52.86 56.65 3gbr s ASN 181 Cb 0.37 -2.54 1.70 0.00 -1.45 0.00 0.00 41.25 39.33 3gbr s ASN 181 CO -0.03 -1.04 2.13 -0.81 -3.72 0.00 0.00 177.10 173.64 3gbr n PRO 182 N 7.19 0.72 0.00 0.43 -0.04 -1.26 -2.44 135.00 139.60 3gbr n PRO 182 Ca 0.19 -0.01 0.14 0.00 -0.04 0.00 0.00 63.50 63.78 3gbr n PRO 182 Cb 0.41 -1.50 0.48 0.00 -0.04 0.00 0.00 33.50 32.84 3gbr n PRO 182 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3gbr n ALA 183 N -1.13 2.80 -3.22 0.55 0.00 -1.26 -1.77 120.51 116.49 3gbr n ALA 183 Ca 0.19 -0.41 -0.20 0.00 0.00 0.00 0.00 53.44 53.01 3gbr n ALA 183 Cb 0.18 -1.17 0.05 0.00 0.00 0.00 0.00 19.45 18.51 3gbr n ALA 183 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3gbr n ASN 184 N -0.27 -5.74 -4.65 0.00 5.15 -1.02 -1.13 115.26 107.59 3gbr n ASN 184 Ca 0.16 -0.37 -0.42 0.00 -0.60 0.00 0.00 54.58 53.35 3gbr n ASN 184 Cb 0.34 -4.45 -0.03 0.00 -0.53 0.00 0.00 39.78 35.11 3gbr n ASN 184 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3gbr s ALA 185 N -3.20 3.45 -0.91 5.20 0.00 -1.26 -4.04 121.76 121.01 3gbr s ALA 185 Ca 0.40 1.19 0.27 0.00 0.00 0.00 0.00 51.96 53.82 3gbr s ALA 185 Cb -0.18 -3.87 0.92 0.00 0.00 0.00 0.00 23.12 19.99 3gbr s ALA 185 CO 0.50 -1.74 1.74 1.63 0.00 0.00 0.00 175.76 177.88 3gbr n LYS 186 N 7.68 0.08 -4.94 0.00 4.76 -0.45 -4.71 118.16 120.59 3gbr n LYS 186 Ca 0.21 0.05 -0.33 0.00 -2.87 0.00 0.00 58.31 55.38 3gbr n LYS 186 Cb 0.42 -1.58 -0.14 0.00 -1.84 0.00 0.00 35.03 31.89 3gbr n LYS 186 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 3gbr s TYR 187 N -3.04 2.68 -0.19 2.13 1.51 -1.19 -0.91 117.35 118.33 3gbr s TYR 187 Ca 0.12 -0.42 -0.09 0.00 -1.01 0.00 0.00 57.07 55.66 3gbr s TYR 187 Cb 0.17 -1.69 0.07 0.00 -0.11 0.00 0.00 41.96 40.40 3gbr s TYR 187 CO 0.60 -0.02 0.45 -1.14 -1.11 0.00 0.00 175.55 174.33 3gbr s GLN 188 N -0.28 0.41 -0.33 -0.62 2.00 -0.85 -1.71 119.66 118.28 3gbr s GLN 188 Ca 0.02 0.91 -0.13 0.00 -2.00 0.00 0.00 55.36 54.16 3gbr s GLN 188 Cb -0.13 0.10 -0.02 0.00 0.80 0.00 0.00 33.01 33.76 3gbr s GLN 188 CO 0.03 -0.18 0.24 -1.17 -0.50 0.00 0.00 175.29 173.70 3gbr s LEU 189 N 1.76 4.42 -0.27 3.68 2.96 0.11 -1.01 118.68 130.33 3gbr s LEU 189 Ca -0.08 -0.33 -0.03 0.00 -0.22 0.00 0.00 54.13 53.47 3gbr s LEU 189 Cb -0.09 -2.14 0.02 0.00 0.50 0.00 0.00 46.19 44.48 3gbr s LEU 189 CO -0.14 -0.20 -0.01 -0.32 -1.32 0.00 0.00 176.35 174.36 3gbr s MET 190 N 1.74 2.84 0.08 1.98 -2.45 0.13 -1.51 119.30 122.12 3gbr s MET 190 Ca 0.07 -0.99 -0.23 0.00 -1.25 0.00 0.00 55.69 53.29 3gbr s MET 190 Cb -0.17 -3.13 -0.07 0.00 1.25 0.00 0.00 34.83 32.71 3gbr s MET 190 CO 0.11 -0.45 0.69 0.20 1.05 0.00 0.00 175.02 176.62 3gbr s GLY 191 N 1.37 2.77 -0.04 2.11 0.00 -0.77 -0.11 107.32 112.65 3gbr s GLY 191 Ca 0.00 0.20 0.03 0.00 0.00 0.00 0.00 44.72 44.95 3gbr s GLY 191 CO -0.02 0.81 -0.12 -1.34 0.00 0.00 0.00 173.10 172.44 3gbr s VAL 192 N -0.67 1.01 -0.47 1.40 -7.23 0.05 -0.86 120.40 113.64 3gbr s VAL 192 Ca 0.34 -0.46 0.23 0.00 -1.81 0.00 0.00 61.98 60.28 3gbr s VAL 192 Cb -0.21 -0.91 0.33 0.00 0.56 0.00 0.00 36.38 36.16 3gbr s VAL 192 CO 0.22 0.31 1.63 2.19 -0.31 0.00 0.00 175.10 179.15 3gbr h PHE 193 N 6.56 0.00 -3.93 2.82 -5.15 -1.81 -3.34 116.94 112.09 3gbr h PHE 193 Ca -0.33 0.00 -0.61 0.00 -0.20 0.00 0.00 57.97 56.83 3gbr h PHE 193 Cb 1.17 0.00 -0.31 0.00 0.22 0.00 0.00 35.95 37.03 3gbr h PHE 193 CO 0.46 0.00 -0.86 -1.54 -2.00 0.00 0.00 178.31 174.37 3gbr s SER 194 N -6.01 2.53 0.46 -0.68 1.04 -1.26 -4.27 113.70 105.50 3gbr s SER 194 Ca 0.07 -0.42 0.16 0.00 0.48 0.00 0.00 55.95 56.24 3gbr s SER 194 Cb 0.06 -0.71 1.07 0.00 0.10 0.00 0.00 66.02 66.53 3gbr s SER 194 CO 0.66 0.19 2.01 0.50 0.98 0.00 0.00 173.24 177.57 3gbr h LYS 195 N 6.20 0.00 0.00 4.02 3.64 -1.97 -2.14 116.57 126.32 3gbr h LYS 195 Ca -0.32 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 3gbr h LYS 195 Cb 1.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 3gbr h LYS 195 CO 0.47 0.17 0.00 -0.44 -2.27 0.00 0.00 179.45 177.39 3gbr h ASP 196 N 0.00 0.00 0.24 4.20 3.32 -1.99 -3.09 116.42 119.10 3gbr h ASP 196 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3gbr h ASP 196 Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 3gbr h ASP 196 CO 0.02 0.00 -0.72 1.41 -1.72 0.00 0.00 179.24 178.23 3gbr n HIS 197 N -2.78 0.00 -0.16 4.55 8.25 -0.80 -4.31 115.22 119.97 3gbr n HIS 197 Ca 0.02 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.46 3gbr n HIS 197 Cb 0.33 -0.12 0.06 0.00 1.12 0.00 0.00 29.99 31.38 3gbr n HIS 197 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3gbr h LEU 198 N 0.14 -0.04 0.00 2.41 3.38 -1.56 -1.42 115.31 118.21 3gbr h LEU 198 Ca 0.00 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 3gbr h LEU 198 Cb 0.51 0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3gbr h LEU 198 CO 0.00 0.01 -0.00 -0.78 0.09 0.00 0.00 178.44 177.76 3gbr h ASP 199 N 0.21 -0.00 -0.17 -0.43 1.82 -1.78 -0.89 116.42 115.18 3gbr h ASP 199 Ca 0.25 -0.34 0.04 0.00 -0.39 0.00 0.00 57.03 56.59 3gbr h ASP 199 Cb 0.35 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 40.32 3gbr h ASP 199 CO -0.34 0.34 -0.07 0.25 -1.61 0.00 0.00 179.24 177.80 3gbr h LEU 200 N -0.34 -0.24 -0.34 2.28 5.85 -1.77 -2.33 115.31 118.43 3gbr h LEU 200 Ca -0.00 0.06 -0.18 0.00 0.84 0.00 0.00 57.88 58.60 3gbr h LEU 200 Cb 0.34 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 3gbr h LEU 200 CO 0.00 -0.09 -0.84 -0.07 -0.34 0.00 0.00 178.44 177.10 3gbr h LEU 201 N -0.04 0.09 -0.14 2.25 3.38 -1.25 -0.70 115.31 118.90 3gbr h LEU 201 Ca 0.09 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 3gbr h LEU 201 Cb 0.18 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 3gbr h LEU 201 CO -0.20 0.89 -0.08 0.77 0.09 0.00 0.00 178.44 179.91 3gbr h SER 202 N 0.04 0.31 -0.77 -0.43 4.64 -1.12 0.18 113.55 116.40 3gbr h SER 202 Ca -0.02 -0.42 -0.01 0.00 -0.47 0.00 0.00 61.79 60.87 3gbr h SER 202 Cb 1.47 -0.08 -0.04 0.00 -0.31 0.00 0.00 62.40 63.43 3gbr h SER 202 CO 0.12 0.66 0.45 0.11 -0.87 0.00 0.00 176.83 177.30 3gbr h LYS 203 N -0.05 1.06 0.09 4.77 1.57 -1.38 -0.93 116.57 121.70 3gbr h LYS 203 Ca 0.03 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3gbr h LYS 203 Cb 0.55 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.64 3gbr h LYS 203 CO 0.02 0.75 -0.04 0.77 -0.57 0.00 0.00 179.45 180.38 3gbr h SER 204 N 1.08 -0.10 -1.01 0.86 0.02 -1.01 -3.19 113.55 110.20 3gbr h SER 204 Ca 0.28 -0.23 0.17 0.00 -0.84 0.00 0.00 61.79 61.17 3gbr h SER 204 Cb -0.02 0.03 -0.10 0.00 0.14 0.00 0.00 62.40 62.44 3gbr h SER 204 CO -0.05 0.17 0.62 0.00 -1.14 0.00 0.00 176.83 176.43 3gbr h ALA 205 N 0.50 1.63 -0.28 3.77 0.00 -0.27 -0.92 119.26 123.70 3gbr h ALA 205 Ca -0.01 0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.04 3gbr h ALA 205 Cb 0.32 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3gbr h ALA 205 CO 0.02 0.03 0.25 -0.92 0.00 0.00 0.00 179.25 178.62 3gbr h TYR 206 N 0.83 0.00 -0.52 0.00 3.20 -1.16 -0.39 116.97 118.93 3gbr h TYR 206 Ca 0.56 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.43 3gbr h TYR 206 Cb 0.78 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.05 3gbr h TYR 206 CO -0.00 0.00 0.00 0.39 -1.64 0.00 0.00 178.16 176.91 3gbr n GLU 207 N -4.09 2.58 -0.14 1.82 1.02 -0.36 -4.36 120.64 117.12 3gbr n GLU 207 Ca 0.04 -2.38 0.10 0.00 -0.02 0.00 0.00 57.16 54.90 3gbr n GLU 207 Cb 0.40 -1.49 0.17 0.00 -0.02 0.00 0.00 31.44 30.50 3gbr n GLU 207 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3gbr n LEU 208 N 1.38 3.13 -0.73 -4.62 4.77 -0.16 -5.01 117.00 115.75 3gbr n LEU 208 Ca 0.20 -1.42 -0.01 0.00 -0.03 0.00 0.00 56.01 54.74 3gbr n LEU 208 Cb 0.57 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 3gbr n LEU 208 CO 0.15 0.66 0.01 -0.67 -1.33 0.00 0.00 177.39 176.21 3gbr n ASP 209 N 1.24 -2.22 -4.87 -1.43 2.03 -1.24 -5.06 116.55 105.00 3gbr n ASP 209 Ca 0.16 -0.03 -0.31 0.00 0.52 0.00 0.00 54.79 55.13 3gbr n ASP 209 Cb 0.54 -0.76 -0.04 0.00 -0.72 0.00 0.00 41.12 40.14 3gbr n ASP 209 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 3gbr s PHE 210 N -3.02 3.46 -0.02 -0.67 0.40 -1.26 -4.96 117.98 111.90 3gbr s PHE 210 Ca 0.03 1.11 -0.25 0.00 -0.60 0.00 0.00 56.93 57.22 3gbr s PHE 210 Cb -0.01 -2.49 -0.20 0.00 0.51 0.00 0.00 43.02 40.83 3gbr s PHE 210 CO 0.04 -0.11 1.20 -0.91 0.70 0.00 0.00 175.22 176.15 3gbr h ASN 211 N 1.35 0.12 -2.97 1.36 4.21 -1.39 -3.42 115.58 114.83 3gbr h ASN 211 Ca -0.47 -0.57 -0.09 0.00 1.21 0.00 0.00 56.30 56.38 3gbr h ASN 211 Cb 1.19 -0.03 -0.26 0.00 -1.12 0.00 0.00 38.32 38.09 3gbr h ASN 211 CO 0.64 0.67 -0.27 -0.75 -1.29 0.00 0.00 177.43 176.42 3gbr s LYS 212 N -3.92 0.42 -0.08 0.81 2.20 -1.06 -4.43 119.74 113.68 3gbr s LYS 212 Ca -0.16 0.93 0.01 0.00 -0.36 0.00 0.00 55.97 56.38 3gbr s LYS 212 Cb 0.02 0.12 0.02 0.00 -1.51 0.00 0.00 37.83 36.48 3gbr s LYS 212 CO 0.70 -0.18 -0.08 -1.50 -0.36 0.00 0.00 175.35 173.94 3gbr s ILE 213 N 1.79 0.90 -0.24 5.43 2.07 -0.83 -2.02 121.20 128.30 3gbr s ILE 213 Ca -0.07 -0.27 -0.07 0.00 -1.41 0.00 0.00 60.65 58.83 3gbr s ILE 213 Cb -0.09 -0.90 -0.03 0.00 0.13 0.00 0.00 42.46 41.57 3gbr s ILE 213 CO -0.14 0.33 0.05 -0.63 -1.91 0.00 0.00 174.94 172.64 3gbr s ILE 214 N 1.29 4.23 -0.17 2.00 1.01 -0.18 -1.15 121.20 128.22 3gbr s ILE 214 Ca -0.04 -0.20 -0.14 0.00 0.00 0.00 0.00 60.65 60.27 3gbr s ILE 214 Cb -0.14 -2.96 -0.04 0.00 0.01 0.00 0.00 42.46 39.32 3gbr s ILE 214 CO -0.03 0.36 0.31 -0.76 0.00 0.00 0.00 174.94 174.82 3gbr s LEU 215 N 1.49 4.22 -0.04 2.97 1.02 -0.43 0.21 118.68 128.11 3gbr s LEU 215 Ca 0.06 0.49 0.05 0.00 0.02 0.00 0.00 54.13 54.75 3gbr s LEU 215 Cb -0.15 -2.40 -0.01 0.00 0.02 0.00 0.00 46.19 43.66 3gbr s LEU 215 CO 0.03 0.06 -0.19 0.68 0.02 0.00 0.00 176.35 176.94 3gbr s VAL 216 N 0.69 1.57 -0.10 -1.59 -7.23 0.84 -1.76 120.40 112.82 3gbr s VAL 216 Ca 0.17 -0.80 0.04 0.00 -1.81 0.00 0.00 61.98 59.57 3gbr s VAL 216 Cb -0.13 -1.34 0.00 0.00 0.56 0.00 0.00 36.38 35.47 3gbr s VAL 216 CO 0.05 0.45 -0.24 -0.47 -0.31 0.00 0.00 175.10 174.58 3gbr s TYR 217 N -0.05 2.56 -0.07 2.82 5.04 0.04 -0.77 117.35 126.92 3gbr s TYR 217 Ca -0.03 -1.08 0.04 0.00 -2.44 0.00 0.00 57.07 53.56 3gbr s TYR 217 Cb -0.12 -1.72 -0.02 0.00 0.35 0.00 0.00 41.96 40.46 3gbr s TYR 217 CO 0.02 -0.44 -0.20 0.20 -1.34 0.00 0.00 175.55 173.79 3gbr s GLY 218 N 0.41 1.41 0.55 8.97 0.00 -0.53 -0.16 107.32 117.97 3gbr s GLY 218 Ca -0.17 -1.00 -0.21 0.00 0.00 0.00 0.00 44.72 43.34 3gbr s GLY 218 CO 0.07 -0.58 1.31 -0.54 0.00 0.00 0.00 173.10 173.37 3gbr s GLU 219 N -0.20 3.17 0.00 2.90 2.02 -0.81 0.32 118.70 126.10 3gbr s GLU 219 Ca -0.01 2.12 0.31 0.00 0.02 0.00 0.00 54.97 57.41 3gbr s GLU 219 Cb -0.13 -2.22 1.60 0.00 0.10 0.00 0.00 34.13 33.48 3gbr s GLU 219 CO 0.03 -1.13 2.06 -0.35 0.02 0.00 0.00 175.26 175.89 3gbr n PRO 220 N -1.06 1.09 0.00 0.39 -0.04 -1.26 -4.41 135.00 129.71 3gbr n PRO 220 Ca 0.11 -0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 3gbr n PRO 220 Cb 0.46 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 3gbr n PRO 220 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3gbr n GLY 221 N 1.09 -0.91 3.14 0.55 0.00 -0.57 -5.17 105.19 103.32 3gbr n GLY 221 Ca 0.21 0.17 -0.14 0.00 0.00 0.00 0.00 46.02 46.26 3gbr n GLY 221 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3gbr s ILE 222 N 0.00 0.82 -0.64 -0.61 -4.36 0.15 -4.55 121.20 112.01 3gbr s ILE 222 Ca 0.00 -1.47 -0.06 0.00 -0.26 0.00 0.00 60.65 58.87 3gbr s ILE 222 Cb 0.00 -1.14 -0.07 0.00 1.25 0.00 0.00 42.46 42.50 3gbr s ILE 222 CO 0.00 -0.50 3.04 -0.90 0.24 0.00 0.00 174.94 176.83 3gbr n ASP 223 N 0.85 6.71 -3.78 4.36 5.75 -1.25 -1.45 116.55 127.74 3gbr n ASP 223 Ca -0.18 -2.83 -0.08 0.00 -0.01 0.00 0.00 54.79 51.68 3gbr n ASP 223 Cb 0.57 -1.38 -0.03 0.00 -1.03 0.00 0.00 41.12 39.25 3gbr n ASP 223 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 3gbr s GLU 224 N 0.01 1.76 0.20 0.11 0.41 -1.26 -4.32 118.70 115.60 3gbr s GLU 224 Ca 0.63 -1.18 -0.31 0.00 -0.41 0.00 0.00 54.97 53.70 3gbr s GLU 224 Cb 0.29 0.55 -0.10 0.00 -1.78 0.00 0.00 34.13 33.10 3gbr s GLU 224 CO -0.10 -0.78 1.48 0.08 -0.49 0.00 0.00 175.26 175.46 3gbr s VAL 225 N -3.73 2.75 0.06 2.63 1.01 -1.26 -2.40 120.40 119.45 3gbr s VAL 225 Ca 0.17 0.57 -0.31 0.00 0.00 0.00 0.00 61.98 62.41 3gbr s VAL 225 Cb -0.04 -3.37 -0.07 0.00 0.00 0.00 0.00 36.38 32.91 3gbr s VAL 225 CO 0.09 0.07 1.42 -0.55 0.00 0.00 0.00 175.10 176.13 3gbr s SER 226 N 0.78 6.81 0.00 3.32 0.15 -1.26 -4.91 113.70 118.60 3gbr s SER 226 Ca 0.64 2.24 0.27 0.00 0.70 0.00 0.00 55.95 59.81 3gbr s SER 226 Cb -0.42 -2.57 0.88 0.00 -1.71 0.00 0.00 66.02 62.20 3gbr s SER 226 CO 0.36 -0.71 1.65 -0.81 1.20 0.00 0.00 173.24 174.93 3gbr n PRO 227 N 4.77 0.71 -0.04 5.44 -0.04 -1.26 -4.32 135.00 140.27 3gbr n PRO 227 Ca 0.13 -0.37 -0.01 0.00 -0.04 0.00 0.00 63.50 63.20 3gbr n PRO 227 Cb 0.43 -1.49 -0.09 0.00 -0.04 0.00 0.00 33.50 32.30 3gbr n PRO 227 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 3gbr n ILE 228 N -0.82 0.50 0.00 0.52 -5.35 -1.26 0.40 119.36 113.35 3gbr n ILE 228 Ca 0.12 -0.41 0.00 0.00 -0.27 0.00 0.00 62.75 62.19 3gbr n ILE 228 Cb 0.33 -0.37 0.00 0.00 -1.74 0.00 0.00 39.64 37.86 3gbr n ILE 228 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3gbr n GLY 229 N 2.12 2.04 3.77 3.28 0.00 -1.26 -4.78 105.19 110.36 3gbr n GLY 229 Ca -0.13 0.12 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 3gbr n GLY 229 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3gbr s ASN 230 N 2.00 7.31 -0.15 1.61 0.01 -1.26 -1.94 114.94 122.52 3gbr s ASN 230 Ca 0.00 1.94 -0.01 0.00 -0.71 0.00 0.00 52.86 54.08 3gbr s ASN 230 Cb 0.00 -2.59 -0.01 0.00 0.41 0.00 0.00 41.25 39.06 3gbr s ASN 230 CO 0.00 -0.09 -0.11 -0.89 -1.51 0.00 0.00 177.10 174.50 3gbr s THR 231 N -1.48 3.12 -0.26 1.60 2.01 0.28 -1.93 115.64 118.98 3gbr s THR 231 Ca 0.49 -0.62 -0.10 0.00 0.31 0.00 0.00 61.69 61.77 3gbr s THR 231 Cb -0.22 -2.34 -0.05 0.00 0.01 0.00 0.00 72.50 69.90 3gbr s THR 231 CO 0.28 0.50 0.15 -0.36 -0.69 0.00 0.00 174.62 174.50 3gbr s PHE 232 N 0.66 3.22 0.07 4.92 0.40 0.78 -1.38 117.98 126.65 3gbr s PHE 232 Ca -0.06 0.04 0.02 0.00 -0.60 0.00 0.00 56.93 56.33 3gbr s PHE 232 Cb -0.15 -2.31 -0.03 0.00 0.51 0.00 0.00 43.02 41.03 3gbr s PHE 232 CO 0.02 -0.13 -0.08 0.00 0.70 0.00 0.00 175.22 175.74 3gbr s MET 233 N 1.50 0.70 -0.09 0.44 0.23 -0.17 -0.78 119.30 121.14 3gbr s MET 233 Ca 0.07 -1.05 0.03 0.00 -1.03 0.00 0.00 55.69 53.71 3gbr s MET 233 Cb -0.15 -0.29 0.01 0.00 -1.53 0.00 0.00 34.83 32.86 3gbr s MET 233 CO 0.08 0.03 -0.18 0.15 -2.03 0.00 0.00 175.02 173.07 3gbr s LYS 234 N -2.66 2.34 -0.36 3.16 -0.14 -0.72 -1.16 119.74 120.20 3gbr s LYS 234 Ca 0.01 -0.63 -0.11 0.00 -1.36 0.00 0.00 55.97 53.88 3gbr s LYS 234 Cb -0.03 -1.85 0.02 0.00 -1.68 0.00 0.00 37.83 34.29 3gbr s LYS 234 CO -0.02 0.07 0.20 0.42 -0.76 0.00 0.00 175.35 175.26 3gbr s ILE 235 N 0.58 4.61 -0.18 2.17 1.01 0.48 -1.31 121.20 128.57 3gbr s ILE 235 Ca -0.15 -0.74 -0.08 0.00 0.00 0.00 0.00 60.65 59.68 3gbr s ILE 235 Cb -0.17 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 3gbr s ILE 235 CO 0.05 -0.16 0.08 -0.69 0.00 0.00 0.00 174.94 174.21 3gbr s VAL 236 N 1.57 4.94 0.21 2.92 1.01 -0.30 -0.37 120.40 130.39 3gbr s VAL 236 Ca 0.03 0.02 -0.02 0.00 0.00 0.00 0.00 61.98 62.01 3gbr s VAL 236 Cb -0.19 -3.22 0.01 0.00 0.00 0.00 0.00 36.38 32.98 3gbr s VAL 236 CO 0.07 0.48 0.31 -1.54 0.00 0.00 0.00 175.10 174.41 3gbr n SER 237 N 3.34 -0.87 0.24 3.32 3.41 0.16 -1.97 113.62 121.26 3gbr n SER 237 Ca -0.17 -2.12 0.08 0.00 -0.26 0.00 0.00 58.87 56.41 3gbr n SER 237 Cb 0.52 1.59 0.60 0.00 -0.26 0.00 0.00 64.21 66.67 3gbr n SER 237 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3gbr h LYS 238 N 0.00 0.00 0.00 4.33 1.57 -1.82 -1.89 116.57 118.76 3gbr h LYS 238 Ca -0.17 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.54 3gbr h LYS 238 Cb 0.71 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 3gbr h LYS 238 CO 0.22 0.16 -0.37 0.00 -0.57 0.00 0.00 179.45 178.90 3gbr h ARG 239 N 0.00 0.00 0.00 3.15 3.08 -1.95 -3.49 114.38 115.16 3gbr h ARG 239 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3gbr h ARG 239 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3gbr h ARG 239 CO 0.02 0.37 0.00 0.41 -1.07 0.00 0.00 179.97 179.70 3gbr n GLY 240 N -0.36 0.70 3.13 0.04 0.00 -0.71 -5.07 105.19 102.92 3gbr n GLY 240 Ca -0.02 -1.59 -0.33 0.00 0.00 0.00 0.00 46.02 44.09 3gbr n GLY 240 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gbr s ILE 241 N -3.85 2.19 -0.22 -0.61 1.01 -1.26 -0.67 121.20 117.80 3gbr s ILE 241 Ca 0.00 -0.99 -0.07 0.00 0.00 0.00 0.00 60.65 59.59 3gbr s ILE 241 Cb 0.00 -1.97 -0.03 0.00 0.01 0.00 0.00 42.46 40.47 3gbr s ILE 241 CO 0.00 0.46 0.06 -0.70 0.00 0.00 0.00 174.94 174.75 3gbr s GLU 242 N 1.28 3.77 0.22 2.79 2.12 0.50 -4.90 118.70 124.49 3gbr s GLU 242 Ca 0.03 -0.44 -0.30 0.00 0.36 0.00 0.00 54.97 54.63 3gbr s GLU 242 Cb -0.14 -3.24 -0.08 0.00 0.26 0.00 0.00 34.13 30.93 3gbr s GLU 242 CO -0.11 0.02 1.05 -1.21 -0.54 0.00 0.00 175.26 174.46 3gbr s GLU 243 N 1.04 4.68 -0.11 4.30 0.41 -1.26 -0.39 118.70 127.37 3gbr s GLU 243 Ca 0.04 1.66 -0.08 0.00 -0.41 0.00 0.00 54.97 56.18 3gbr s GLU 243 Cb -0.14 -3.26 0.04 0.00 -1.78 0.00 0.00 34.13 28.99 3gbr s GLU 243 CO 0.03 0.24 0.29 0.08 -0.49 0.00 0.00 175.26 175.40 3gbr s VAL 244 N -0.72 -0.02 -0.07 2.63 1.01 -0.31 -4.95 120.40 117.97 3gbr s VAL 244 Ca 0.46 0.07 0.05 0.00 0.00 0.00 0.00 61.98 62.55 3gbr s VAL 244 Cb -0.29 -0.42 -0.00 0.00 0.00 0.00 0.00 36.38 35.67 3gbr s VAL 244 CO 0.35 0.03 -0.22 -0.75 0.00 0.00 0.00 175.10 174.52 3gbr s LYS 245 N 0.78 2.51 -0.01 2.72 2.20 -1.26 -1.00 119.74 125.68 3gbr s LYS 245 Ca -0.05 -0.79 0.02 0.00 -0.36 0.00 0.00 55.97 54.79 3gbr s LYS 245 Cb -0.06 -2.02 -0.00 0.00 -1.51 0.00 0.00 37.83 34.23 3gbr s LYS 245 CO -0.05 0.24 -0.05 -1.17 -0.36 0.00 0.00 175.35 173.96 3gbr s LEU 246 N 0.16 1.98 0.22 5.43 2.96 -0.48 -4.99 118.68 123.96 3gbr s LEU 246 Ca -0.11 -0.10 0.06 0.00 -0.22 0.00 0.00 54.13 53.76 3gbr s LEU 246 Cb -0.15 -0.28 -0.04 0.00 0.50 0.00 0.00 46.19 46.22 3gbr s LEU 246 CO 0.05 0.06 0.22 0.21 -1.32 0.00 0.00 176.35 175.58 3gbr s ASN 247 N -0.08 5.74 0.45 3.68 2.47 -1.26 0.98 114.94 126.92 3gbr s ASN 247 Ca 0.01 -0.13 0.11 0.00 0.42 0.00 0.00 52.86 53.28 3gbr s ASN 247 Cb -0.03 -1.54 1.01 0.00 -1.45 0.00 0.00 41.25 39.24 3gbr s ASN 247 CO -0.00 -0.01 2.07 1.62 -3.72 0.00 0.00 177.10 177.05 3gbr h VAL 248 N 1.56 1.03 0.00 -5.21 3.04 -1.62 -1.57 116.25 113.49 3gbr h VAL 248 Ca -0.49 -0.13 -0.01 0.00 -1.01 0.00 0.00 66.70 65.06 3gbr h VAL 248 Cb 1.23 0.63 -0.00 0.00 -2.01 0.00 0.00 31.29 31.13 3gbr h VAL 248 CO 0.62 0.07 -0.07 0.71 -1.01 0.00 0.00 177.57 177.89 3gbr h THR 249 N 0.38 0.50 0.00 3.17 1.35 -1.88 -1.82 112.91 114.60 3gbr h THR 249 Ca 0.13 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 3gbr h THR 249 Cb 0.08 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 67.71 3gbr h THR 249 CO -0.03 0.07 0.00 0.47 -0.25 0.00 0.00 175.52 175.78 3gbr n ASP 250 N -3.65 0.00 -0.28 5.36 8.00 -0.59 -1.35 116.55 124.04 3gbr n ASP 250 Ca -0.02 0.17 0.13 0.00 0.71 0.00 0.00 54.79 55.78 3gbr n ASP 250 Cb 0.18 -0.34 0.38 0.00 -0.02 0.00 0.00 41.12 41.32 3gbr n ASP 250 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3gbr n PHE 251 N -1.34 0.00 -0.45 1.24 3.72 -0.68 -4.48 117.46 115.47 3gbr n PHE 251 Ca 0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.47 3gbr n PHE 251 Cb 0.14 -0.11 0.00 0.00 -0.94 0.00 0.00 39.48 38.57 3gbr n PHE 251 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3gbr n GLY 252 N 1.33 0.75 3.29 1.37 0.00 -0.46 -4.93 105.19 106.54 3gbr n GLY 252 Ca 0.13 -0.26 -0.16 0.00 0.00 0.00 0.00 46.02 45.72 3gbr n GLY 252 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3gbr s ILE 253 N -2.00 1.34 0.62 -0.61 -4.36 -1.26 -5.08 121.20 109.86 3gbr s ILE 253 Ca 0.00 -2.11 -0.12 0.00 -0.26 0.00 0.00 60.65 58.16 3gbr s ILE 253 Cb 0.00 -1.99 -0.03 0.00 1.25 0.00 0.00 42.46 41.69 3gbr s ILE 253 CO 0.00 -0.64 1.03 -0.44 0.24 0.00 0.00 174.94 175.14 3gbr s SER 254 N -3.24 6.00 0.27 4.36 0.01 -1.26 -3.69 113.70 116.16 3gbr s SER 254 Ca 0.20 1.54 -0.30 0.00 1.31 0.00 0.00 55.95 58.70 3gbr s SER 254 Cb 0.02 -2.49 -0.13 0.00 0.21 0.00 0.00 66.02 63.63 3gbr s SER 254 CO 0.04 -1.02 1.47 -2.65 0.41 0.00 0.00 173.24 171.49 3gbr n PRO 255 N -2.60 2.32 -3.29 12.44 -0.02 -1.26 -4.91 135.00 137.66 3gbr n PRO 255 Ca 0.07 0.82 -0.38 0.00 -2.02 0.00 0.00 63.50 61.99 3gbr n PRO 255 Cb 0.54 -2.52 -0.06 0.00 -0.02 0.00 0.00 33.50 31.44 3gbr n PRO 255 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3gbr s ILE 256 N -0.16 5.06 0.08 4.25 1.01 0.16 -4.98 121.20 126.62 3gbr s ILE 256 Ca 0.65 1.06 -0.31 0.00 0.00 0.00 0.00 60.65 62.05 3gbr s ILE 256 Cb -0.58 -3.85 -0.06 0.00 0.01 0.00 0.00 42.46 37.98 3gbr s ILE 256 CO 0.51 0.39 1.25 -2.16 0.00 0.00 0.00 174.94 174.93 3gbr s PRO 257 N 0.09 4.40 0.52 2.79 0.04 -1.26 -4.21 135.00 137.38 3gbr s PRO 257 Ca 0.28 1.86 0.18 0.00 0.04 0.00 0.00 61.00 63.35 3gbr s PRO 257 Cb -0.17 -3.32 1.31 0.00 0.04 0.00 0.00 34.50 32.36 3gbr s PRO 257 CO 0.13 -0.31 2.13 0.97 0.04 0.00 0.00 177.00 179.96 3gbr h ILE 258 N 4.44 0.94 -0.98 0.56 2.10 -1.96 -0.89 117.51 121.72 3gbr h ILE 258 Ca -0.42 0.00 0.28 0.00 1.08 0.00 0.00 64.86 65.80 3gbr h ILE 258 Cb 1.21 0.96 -0.14 0.00 -1.09 0.00 0.00 36.82 37.76 3gbr h ILE 258 CO 0.83 0.00 0.53 -0.33 -1.08 0.00 0.00 178.15 178.10 3gbr h GLU 259 N 0.00 0.40 0.00 2.19 3.07 -1.97 -0.06 114.58 118.20 3gbr h GLU 259 Ca 0.04 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 3gbr h GLU 259 Cb 0.17 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 3gbr h GLU 259 CO -0.00 0.26 0.00 0.87 -1.40 0.00 0.00 179.01 178.74 3gbr h LYS 260 N 0.41 0.00 0.00 2.33 1.79 -1.54 -3.22 116.57 116.33 3gbr h LYS 260 Ca 0.67 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.14 3gbr h LYS 260 Cb 1.42 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.07 3gbr h LYS 260 CO -0.56 0.00 -1.09 1.28 -1.08 0.00 0.00 179.45 178.00 3gbr n LEU 261 N -3.02 0.69 -4.76 2.94 4.77 -0.06 -4.76 117.00 112.80 3gbr n LEU 261 Ca 0.02 -0.24 -0.40 0.00 -0.03 0.00 0.00 56.01 55.36 3gbr n LEU 261 Cb 0.36 -0.06 -0.05 0.00 -2.33 0.00 0.00 43.42 41.34 3gbr n LEU 261 CO 0.28 0.14 0.70 -0.63 -1.33 0.00 0.00 177.39 176.56 3gbr s ILE 262 N -3.13 3.88 0.13 -0.08 1.01 -1.05 0.26 121.20 122.22 3gbr s ILE 262 Ca 0.05 1.84 0.06 0.00 0.00 0.00 0.00 60.65 62.60 3gbr s ILE 262 Cb 0.15 -4.15 -0.04 0.00 0.01 0.00 0.00 42.46 38.44 3gbr s ILE 262 CO 0.84 0.40 -0.14 -0.69 0.00 0.00 0.00 174.94 175.34 3gbr s VAL 263 N -1.23 1.41 -0.60 2.92 1.01 0.13 -4.83 120.40 119.21 3gbr s VAL 263 Ca 0.44 -1.80 0.05 0.00 0.00 0.00 0.00 61.98 60.67 3gbr s VAL 263 Cb -0.27 -1.63 0.06 0.00 0.00 0.00 0.00 36.38 34.54 3gbr s VAL 263 CO 0.34 -0.43 0.76 -0.46 0.00 0.00 0.00 175.10 175.31 3gbr n ASN 264 N 0.40 1.64 -3.53 3.32 0.23 -1.26 -4.78 115.26 111.28 3gbr n ASN 264 Ca -0.14 -1.38 -0.04 0.00 -0.53 0.00 0.00 54.58 52.49 3gbr n ASN 264 Cb 0.57 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 38.25 3gbr n ASN 264 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 3gbr s SER 265 N -0.55 -0.09 0.10 0.53 1.04 -1.26 -4.98 113.70 108.49 3gbr s SER 265 Ca 0.07 -0.58 -0.18 0.00 0.48 0.00 0.00 55.95 55.75 3gbr s SER 265 Cb 0.05 0.52 -0.06 0.00 0.10 0.00 0.00 66.02 66.63 3gbr s SER 265 CO 0.07 -1.00 1.60 0.00 0.98 0.00 0.00 173.24 174.88 3gbr h ALA 266 N 2.00 0.39 -0.44 5.32 0.00 -1.90 -1.41 119.26 123.22 3gbr h ALA 266 Ca -0.26 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.53 3gbr h ALA 266 Cb 1.23 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.86 3gbr h ALA 266 CO 0.31 0.05 0.17 1.49 0.00 0.00 0.00 179.25 181.26 3gbr h GLU 267 N 0.31 0.34 -0.89 0.00 4.81 -1.93 0.23 114.58 117.44 3gbr h GLU 267 Ca 0.09 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 3gbr h GLU 267 Cb 0.29 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.55 3gbr h GLU 267 CO 0.00 0.22 0.54 0.22 -0.73 0.00 0.00 179.01 179.26 3gbr h ASP 268 N 0.35 1.08 -0.49 1.04 3.58 -1.92 0.38 116.42 120.44 3gbr h ASP 268 Ca 0.20 -0.07 -0.00 0.00 0.42 0.00 0.00 57.03 57.58 3gbr h ASP 268 Cb 0.18 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 40.94 3gbr h ASP 268 CO -0.20 0.83 0.29 -1.28 -2.88 0.00 0.00 179.24 176.00 3gbr h SER 269 N 1.23 0.59 -0.19 2.28 0.87 -0.72 -0.82 113.55 116.78 3gbr h SER 269 Ca 0.32 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.82 3gbr h SER 269 Cb -0.05 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 3gbr h SER 269 CO -0.06 0.48 0.13 0.00 -0.53 0.00 0.00 176.83 176.85 3gbr h ALA 270 N 1.13 0.25 -0.29 6.23 0.00 0.49 -1.31 119.26 125.76 3gbr h ALA 270 Ca 0.17 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.09 3gbr h ALA 270 Cb 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3gbr h ALA 270 CO -0.03 -0.27 0.15 0.82 0.00 0.00 0.00 179.25 179.92 3gbr h ILE 271 N 0.26 1.00 -0.42 0.00 2.04 -0.16 -1.11 117.51 119.11 3gbr h ILE 271 Ca 0.07 -0.11 0.06 0.00 1.00 0.00 0.00 64.86 65.88 3gbr h ILE 271 Cb -0.03 0.65 -0.05 0.00 -0.74 0.00 0.00 36.82 36.65 3gbr h ILE 271 CO -0.02 0.06 0.12 0.11 0.00 0.00 0.00 178.15 178.43 3gbr h LYS 272 N 0.32 0.26 -0.12 2.37 1.79 -0.97 0.69 116.57 120.90 3gbr h LYS 272 Ca 0.12 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.57 3gbr h LYS 272 Cb 0.03 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.61 3gbr h LYS 272 CO -0.07 0.17 0.07 0.82 -1.08 0.00 0.00 179.45 179.36 3gbr h ILE 273 N 0.27 1.07 -0.48 1.86 2.04 -1.04 -1.63 117.51 119.60 3gbr h ILE 273 Ca 0.20 -0.18 -0.04 0.00 1.00 0.00 0.00 64.86 65.84 3gbr h ILE 273 Cb 0.22 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 3gbr h ILE 273 CO -0.23 0.06 0.14 0.58 0.00 0.00 0.00 178.15 178.70 3gbr h VAL 274 N 0.13 1.23 -0.93 1.67 2.07 -0.97 -1.26 116.25 118.18 3gbr h VAL 274 Ca 0.04 -0.78 0.05 0.00 0.82 0.00 0.00 66.70 66.84 3gbr h VAL 274 Cb 0.04 0.83 -0.06 0.00 -1.52 0.00 0.00 31.29 30.58 3gbr h VAL 274 CO -0.01 0.28 0.60 0.03 0.02 0.00 0.00 177.57 178.49 3gbr h ARG 275 N 0.64 1.09 -0.80 1.57 3.08 -0.82 0.11 114.38 119.25 3gbr h ARG 275 Ca 0.15 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.14 3gbr h ARG 275 Cb 0.29 -0.25 -0.04 0.00 0.08 0.00 0.00 29.97 30.05 3gbr h ARG 275 CO -0.00 0.72 0.50 0.00 -1.07 0.00 0.00 179.97 180.12 3gbr h ALA 276 N 1.41 1.37 0.00 0.04 0.00 -0.93 0.42 119.26 121.57 3gbr h ALA 276 Ca 0.39 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.13 3gbr h ALA 276 Cb 0.08 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3gbr h ALA 276 CO -0.15 0.55 -0.41 0.74 0.00 0.00 0.00 179.25 179.99 3gbr h PHE 277 N 1.09 0.00 -0.00 0.00 0.05 -0.13 -2.86 116.94 115.09 3gbr h PHE 277 Ca 0.29 0.00 0.00 0.00 3.82 0.00 0.00 57.97 62.08 3gbr h PHE 277 Cb -0.07 0.00 0.00 0.00 2.00 0.00 0.00 35.95 37.88 3gbr h PHE 277 CO 0.00 0.41 -0.08 1.28 -0.18 0.00 0.00 178.31 179.74 3gbr n LEU 278 N -3.74 0.47 -0.23 1.54 4.77 0.28 -4.73 117.00 115.37 3gbr n LEU 278 Ca -0.01 -0.02 -0.03 0.00 -0.03 0.00 0.00 56.01 55.92 3gbr n LEU 278 Cb 0.49 -0.15 -0.01 0.00 -2.33 0.00 0.00 43.42 41.42 3gbr n LEU 278 CO 0.38 0.08 -0.03 0.61 -1.33 0.00 0.00 177.39 177.11 3gbr n GLY 279 N 1.24 0.56 0.56 -0.72 0.00 -0.81 -4.94 105.19 101.08 3gbr n GLY 279 Ca 0.16 -0.93 0.07 0.00 0.00 0.00 0.00 46.02 45.31 3gbr n GLY 279 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gbr n LYS 280 N -2.74 1.15 -3.35 1.61 5.02 0.14 -4.77 118.16 115.23 3gbr n LYS 280 Ca -0.03 -1.42 -0.21 0.00 -2.02 0.00 0.00 58.31 54.62 3gbr n LYS 280 Cb 0.14 -1.26 -0.09 0.00 -0.02 0.00 0.00 35.03 33.80 3gbr n LYS 280 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3gbr s ASP 281 N -1.08 1.46 0.33 4.39 3.68 -1.07 -4.82 116.67 119.56 3gbr s ASP 281 Ca 0.17 -2.10 0.16 0.00 2.13 0.00 0.00 52.55 52.92 3gbr s ASP 281 Cb 0.12 0.20 0.53 0.00 -1.45 0.00 0.00 42.92 42.31 3gbr s ASP 281 CO 0.17 -0.23 1.67 -0.33 0.13 0.00 0.00 175.17 176.57 3gbr h GLU 282 N 6.55 0.00 -0.22 4.34 4.39 -1.90 -1.55 114.58 126.19 3gbr h GLU 282 Ca 0.11 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.79 3gbr h GLU 282 Cb 1.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.65 3gbr h GLU 282 CO 0.24 0.46 0.06 0.45 -1.16 0.00 0.00 179.01 179.06 3gbr h HIS 283 N 0.00 0.36 -0.36 4.33 3.86 -1.95 0.83 115.15 122.21 3gbr h HIS 283 Ca -0.00 -0.04 -0.06 0.00 -1.16 0.00 0.00 60.37 59.10 3gbr h HIS 283 Cb 1.01 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.36 3gbr h HIS 283 CO 0.00 0.44 -0.02 0.28 0.86 0.00 0.00 177.93 179.49 3gbr h VAL 284 N 0.17 1.26 -0.60 2.45 2.07 -1.84 -1.96 116.25 117.81 3gbr h VAL 284 Ca 0.07 -1.02 0.10 0.00 0.82 0.00 0.00 66.70 66.66 3gbr h VAL 284 Cb 0.26 1.20 -0.07 0.00 -1.52 0.00 0.00 31.29 31.16 3gbr h VAL 284 CO -0.00 0.34 0.19 0.00 0.02 0.00 0.00 177.57 178.12 3gbr h ALA 285 N 0.86 0.75 -0.67 1.67 0.00 -1.23 0.22 119.26 120.86 3gbr h ALA 285 Ca 0.10 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 3gbr h ALA 285 Cb 0.49 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3gbr h ALA 285 CO 0.02 -0.23 0.24 0.93 0.00 0.00 0.00 179.25 180.21 3gbr h GLU 286 N 0.36 1.01 -0.02 0.00 5.08 -0.72 0.19 114.58 120.48 3gbr h GLU 286 Ca 0.30 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 3gbr h GLU 286 Cb 0.40 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 3gbr h GLU 286 CO -0.33 0.85 0.00 0.35 -1.00 0.00 0.00 179.01 178.88 3gbr h PHE 287 N 0.98 0.04 -0.60 4.33 3.57 -0.61 -1.00 116.94 123.66 3gbr h PHE 287 Ca 0.22 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.81 3gbr h PHE 287 Cb 0.24 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 38.90 3gbr h PHE 287 CO 0.02 0.30 0.23 0.82 -2.23 0.00 0.00 178.31 177.44 3gbr h ILE 288 N -0.22 0.78 -0.37 1.41 2.04 -0.43 -2.82 117.51 117.89 3gbr h ILE 288 Ca 0.01 -0.14 -0.16 0.00 1.00 0.00 0.00 64.86 65.56 3gbr h ILE 288 Cb 0.28 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 3gbr h ILE 288 CO 0.00 0.07 -0.41 0.11 0.00 0.00 0.00 178.15 177.93 3gbr h LYS 289 N 0.41 0.93 -0.25 2.37 1.57 -0.37 -0.92 116.57 120.31 3gbr h LYS 289 Ca 0.30 -0.50 -0.07 0.00 -1.87 0.00 0.00 60.65 58.51 3gbr h LYS 289 Cb 0.37 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 3gbr h LYS 289 CO -0.30 1.15 -0.14 -0.84 -0.57 0.00 0.00 179.45 178.75 3gbr h ILE 290 N 0.75 1.22 -0.12 1.86 3.07 -1.16 0.13 117.51 123.26 3gbr h ILE 290 Ca 0.06 -1.00 -0.22 0.00 1.55 0.00 0.00 64.86 65.25 3gbr h ILE 290 Cb 1.00 1.20 0.01 0.00 -0.27 0.00 0.00 36.82 38.76 3gbr h ILE 290 CO 0.10 0.32 -0.80 0.78 -1.05 0.00 0.00 178.15 177.50 3gbr h ASN 291 N 0.39 0.85 -0.78 2.16 2.35 -1.26 -3.09 115.58 116.20 3gbr h ASN 291 Ca 0.07 -0.57 -0.04 0.00 -0.55 0.00 0.00 56.30 55.21 3gbr h ASN 291 Cb 0.49 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.57 3gbr h ASN 291 CO 0.03 1.36 0.32 0.74 -1.65 0.00 0.00 177.43 178.23 3gbr h THR 292 N 0.48 1.26 -0.76 2.81 2.02 -1.01 -2.74 112.91 114.96 3gbr h THR 292 Ca -0.06 -0.80 0.08 0.00 0.77 0.00 0.00 66.41 66.40 3gbr h THR 292 Cb 1.42 0.32 -0.07 0.00 -1.74 0.00 0.00 68.15 68.08 3gbr h THR 292 CO 0.16 0.33 0.43 0.00 0.37 0.00 0.00 175.52 176.81 3gbr h ALA 293 N 1.21 1.06 -0.25 6.16 0.00 -0.89 0.24 119.26 126.79 3gbr h ALA 293 Ca 0.26 0.03 -0.19 0.00 0.00 0.00 0.00 54.91 55.01 3gbr h ALA 293 Cb 0.20 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3gbr h ALA 293 CO -0.02 0.08 -0.58 0.28 0.00 0.00 0.00 179.25 179.01 3gbr h VAL 294 N 0.75 1.29 -0.63 0.00 2.07 -1.50 -2.29 116.25 115.94 3gbr h VAL 294 Ca 0.36 -1.79 0.02 0.00 0.82 0.00 0.00 66.70 66.11 3gbr h VAL 294 Cb 0.28 1.72 -0.04 0.00 -1.52 0.00 0.00 31.29 31.73 3gbr h VAL 294 CO -0.22 0.57 0.40 0.00 0.02 0.00 0.00 177.57 178.34 3gbr h ALA 295 N 0.74 0.81 -0.77 1.67 0.00 -0.96 -1.18 119.26 119.57 3gbr h ALA 295 Ca 0.00 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.94 3gbr h ALA 295 Cb 1.18 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.70 3gbr h ALA 295 CO 0.12 0.17 0.46 -0.07 0.00 0.00 0.00 179.25 179.94 3gbr h LEU 296 N 0.80 0.72 -0.64 0.00 4.07 -0.51 -1.67 115.31 118.08 3gbr h LEU 296 Ca 0.24 0.02 -0.03 0.00 0.08 0.00 0.00 57.88 58.19 3gbr h LEU 296 Cb -0.02 -0.13 -0.03 0.00 1.08 0.00 0.00 40.66 41.56 3gbr h LEU 296 CO -0.08 0.47 0.26 0.15 -1.08 0.00 0.00 178.44 178.16 3gbr h PHE 297 N 0.86 0.97 -0.23 1.13 3.57 -0.99 -1.92 116.94 120.33 3gbr h PHE 297 Ca 0.34 -0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.75 3gbr h PHE 297 Cb 0.16 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 3gbr h PHE 297 CO -0.05 0.76 0.05 0.00 -2.23 0.00 0.00 178.31 176.84 3gbr h ALA 298 N 1.11 1.66 0.00 2.41 0.00 -0.65 -0.72 119.26 123.07 3gbr h ALA 298 Ca 0.21 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3gbr h ALA 298 Cb 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3gbr h ALA 298 CO -0.02 0.27 0.00 1.28 0.00 0.00 0.00 179.25 180.78 3gbr n LEU 299 N -4.40 0.00 -3.09 0.00 4.77 -0.68 -4.77 117.00 108.83 3gbr n LEU 299 Ca 0.00 0.44 -0.20 0.00 -0.03 0.00 0.00 56.01 56.22 3gbr n LEU 299 Cb 0.16 -0.44 0.07 0.00 -2.33 0.00 0.00 43.42 40.87 3gbr n LEU 299 CO 0.36 -0.10 0.20 0.47 -1.33 0.00 0.00 177.39 177.00 3gbr n ASP 300 N -1.44 -5.70 0.02 -1.43 8.00 -0.28 -4.94 116.55 110.78 3gbr n ASP 300 Ca 0.07 -0.44 0.11 0.00 0.71 0.00 0.00 54.79 55.23 3gbr n ASP 300 Cb 0.24 -4.33 -0.13 0.00 -0.02 0.00 0.00 41.12 36.89 3gbr n ASP 300 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3gbr n ARG 301 N -4.27 0.65 -4.28 -1.24 5.12 -0.76 -4.96 116.66 106.91 3gbr n ARG 301 Ca 0.00 -0.12 -0.15 0.00 -1.93 0.00 0.00 57.85 55.65 3gbr n ARG 301 Cb 0.55 -1.59 -0.10 0.00 -1.16 0.00 0.00 32.46 30.16 3gbr n ARG 301 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 3gbr s VAL 302 N -3.47 1.19 -0.59 1.55 -7.23 -1.25 -5.03 120.40 105.57 3gbr s VAL 302 Ca -0.06 -2.07 0.24 0.00 -1.81 0.00 0.00 61.98 58.27 3gbr s VAL 302 Cb 0.13 -1.98 -0.01 0.00 0.56 0.00 0.00 36.38 35.07 3gbr s VAL 302 CO 0.88 -0.63 1.19 0.61 -0.31 0.00 0.00 175.10 176.84 3gbr n GLY 303 N -0.27 -1.35 3.76 2.32 0.00 -1.26 -4.74 105.19 103.66 3gbr n GLY 303 Ca -0.09 -0.30 -0.09 0.00 0.00 0.00 0.00 46.02 45.54 3gbr n GLY 303 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3gbr s ASP 304 N -4.24 0.04 0.28 1.61 3.84 -1.26 -5.07 116.67 111.87 3gbr s ASP 304 Ca 0.05 -1.03 0.13 0.00 -0.00 0.00 0.00 52.55 51.70 3gbr s ASP 304 Cb 0.13 0.78 0.33 0.00 -1.38 0.00 0.00 42.92 42.78 3gbr s ASP 304 CO 0.75 -1.51 1.58 -0.26 -0.00 0.00 0.00 175.17 175.73 3gbr h PHE 305 N 2.03 0.00 -0.25 2.11 -1.00 -1.93 -2.48 116.94 115.43 3gbr h PHE 305 Ca -0.28 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.40 3gbr h PHE 305 Cb 1.25 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.81 3gbr h PHE 305 CO 1.06 0.59 -0.25 0.00 -1.61 0.00 0.00 178.31 178.10 3gbr h ARG 306 N 0.00 0.61 -0.69 1.51 3.08 -1.92 -1.19 114.38 115.78 3gbr h ARG 306 Ca -0.01 -0.32 -0.04 0.00 0.07 0.00 0.00 59.98 59.68 3gbr h ARG 306 Cb 1.18 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 31.21 3gbr h ARG 306 CO 0.08 0.92 0.27 1.49 -1.07 0.00 0.00 179.97 181.65 3gbr h GLU 307 N 0.32 1.03 -0.75 0.04 4.81 -1.95 -0.76 114.58 117.32 3gbr h GLU 307 Ca 0.04 -0.19 0.06 0.00 -0.13 0.00 0.00 59.36 59.14 3gbr h GLU 307 Cb 0.81 -0.16 -0.06 0.00 0.63 0.00 0.00 28.75 29.97 3gbr h GLU 307 CO 0.06 0.86 0.44 0.78 -0.73 0.00 0.00 179.01 180.43 3gbr h GLY 308 N 0.98 1.12 0.92 1.92 0.00 -1.35 0.24 103.07 106.90 3gbr h GLY 308 Ca 0.23 -0.32 -0.04 0.00 0.00 0.00 0.00 47.33 47.20 3gbr h GLY 308 CO -0.02 0.21 0.06 -1.82 0.00 0.00 0.00 176.54 174.97 3gbr h TYR 309 N 0.81 0.65 -0.32 5.60 3.20 -0.76 0.14 116.97 126.30 3gbr h TYR 309 Ca 0.33 -0.09 -0.00 0.00 3.14 0.00 0.00 58.73 62.11 3gbr h TYR 309 Cb 0.18 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 3gbr h TYR 309 CO -0.06 0.66 0.18 0.93 -1.64 0.00 0.00 178.16 178.24 3gbr h GLU 310 N 0.45 0.44 -0.65 1.82 5.08 -0.79 -2.51 114.58 118.42 3gbr h GLU 310 Ca 0.11 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.36 3gbr h GLU 310 Cb 0.36 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 3gbr h GLU 310 CO 0.01 0.36 0.15 -0.92 -1.00 0.00 0.00 179.01 177.61 3gbr h TYR 311 N 0.40 1.08 -0.38 4.33 3.20 -0.34 -1.63 116.97 123.64 3gbr h TYR 311 Ca 0.11 -0.12 0.04 0.00 3.14 0.00 0.00 58.73 61.90 3gbr h TYR 311 Cb 0.04 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 37.98 3gbr h TYR 311 CO -0.03 0.89 0.25 0.00 -1.64 0.00 0.00 178.16 177.63 3gbr h ALA 312 N 1.18 1.91 -0.95 1.82 0.00 -0.59 -2.18 119.26 120.44 3gbr h ALA 312 Ca 0.21 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.12 3gbr h ALA 312 Cb 0.36 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 3gbr h ALA 312 CO 0.00 0.04 0.63 0.22 0.00 0.00 0.00 179.25 180.13 3gbr h ASP 313 N 0.36 1.07 0.25 0.00 3.58 -0.84 0.16 116.42 120.99 3gbr h ASP 313 Ca 0.16 -0.02 -0.11 0.00 0.42 0.00 0.00 57.03 57.47 3gbr h ASP 313 Cb 0.19 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 40.97 3gbr h ASP 313 CO -0.04 0.76 -0.44 0.45 -2.88 0.00 0.00 179.24 177.09 3gbr h HIS 314 N 1.26 0.29 -0.12 0.28 3.86 -1.38 -3.17 115.15 116.17 3gbr h HIS 314 Ca 0.36 -0.08 -0.23 0.00 -1.16 0.00 0.00 60.37 59.26 3gbr h HIS 314 Cb -0.09 -0.06 0.01 0.00 1.06 0.00 0.00 27.41 28.33 3gbr h HIS 314 CO -0.01 0.65 -0.82 -0.07 0.86 0.00 0.00 177.93 178.55 3gbr h LEU 315 N 0.20 0.87 -1.24 2.43 3.38 -1.06 -3.30 115.31 116.60 3gbr h LEU 315 Ca 0.01 -0.59 -0.03 0.00 0.09 0.00 0.00 57.88 57.36 3gbr h LEU 315 Cb 0.86 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 3gbr h LEU 315 CO 0.07 1.39 0.19 -0.29 0.09 0.00 0.00 178.44 179.89 3gbr h ILE 316 N 0.48 1.19 0.00 1.22 2.10 -0.96 -1.94 117.51 119.61 3gbr h ILE 316 Ca -0.06 -0.59 -0.02 0.00 1.08 0.00 0.00 64.86 65.27 3gbr h ILE 316 Cb 1.44 0.60 -0.00 0.00 -1.09 0.00 0.00 36.82 37.77 3gbr h ILE 316 CO 0.16 0.23 -0.08 -0.33 -1.08 0.00 0.00 178.15 177.06 3gbr h GLU 317 N 0.71 0.00 -0.16 2.19 5.08 -1.63 -2.50 114.58 118.27 3gbr h GLU 317 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 3gbr h GLU 317 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 3gbr h GLU 317 CO -0.02 0.08 0.00 1.63 -1.00 0.00 0.00 179.01 179.70 3gbr n LYS 318 N -3.44 2.13 0.09 2.33 5.02 -0.76 -4.70 118.16 118.83 3gbr n LYS 318 Ca -0.02 -1.94 -0.13 0.00 -2.02 0.00 0.00 58.31 54.20 3gbr n LYS 318 Cb 0.23 -1.43 -0.08 0.00 -0.02 0.00 0.00 35.03 33.72 3gbr n LYS 318 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 3gbr h SER 319 N 4.12 0.41 -0.56 4.39 0.02 -1.04 -2.60 113.55 118.30 3gbr h SER 319 Ca 0.00 -0.38 -0.05 0.00 -0.84 0.00 0.00 61.79 60.53 3gbr h SER 319 Cb 0.90 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.29 3gbr h SER 319 CO 0.00 1.23 0.17 0.25 -1.14 0.00 0.00 176.83 177.33 3gbr h LEU 320 N 0.13 0.82 -0.77 5.07 5.85 -1.84 0.34 115.31 124.90 3gbr h LEU 320 Ca -0.09 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.41 3gbr h LEU 320 Cb 1.73 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 42.51 3gbr h LEU 320 CO 0.17 0.81 0.44 0.44 -0.34 0.00 0.00 178.44 179.96 3gbr h ASP 321 N 0.78 0.95 -0.57 1.25 3.32 -1.89 -0.20 116.42 120.07 3gbr h ASP 321 Ca 0.18 -0.09 -0.09 0.00 0.02 0.00 0.00 57.03 57.05 3gbr h ASP 321 Cb 0.29 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 3gbr h ASP 321 CO -0.00 0.76 0.00 0.50 -1.72 0.00 0.00 179.24 178.78 3gbr h LYS 322 N 1.07 1.02 -0.34 3.56 1.63 -1.10 -2.27 116.57 120.14 3gbr h LYS 322 Ca 0.27 -0.31 -0.01 0.00 -0.85 0.00 0.00 60.65 59.75 3gbr h LYS 322 Cb 0.01 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 31.52 3gbr h LYS 322 CO -0.05 1.00 0.19 1.25 -3.45 0.00 0.00 179.45 178.39 3gbr h LEU 323 N 0.94 0.43 -0.75 5.20 5.85 0.00 -1.26 115.31 125.71 3gbr h LEU 323 Ca 0.17 -0.09 0.11 0.00 0.84 0.00 0.00 57.88 58.91 3gbr h LEU 323 Cb 0.54 -0.11 -0.08 0.00 0.37 0.00 0.00 40.66 41.38 3gbr h LEU 323 CO 0.03 0.39 0.38 -1.13 -0.34 0.00 0.00 178.44 177.77 3gbr h ASN 324 N 0.43 0.49 0.44 1.25 -0.73 -0.94 -0.32 115.58 116.20 3gbr h ASN 324 Ca 0.12 0.07 -0.11 0.00 1.87 0.00 0.00 56.30 58.24 3gbr h ASN 324 Cb 0.06 -0.01 -0.01 0.00 0.27 0.00 0.00 38.32 38.62 3gbr h ASN 324 CO -0.02 0.26 -0.51 1.05 -0.37 0.00 0.00 177.43 177.84 3gbr h GLU 325 N 0.62 0.08 -0.07 6.67 4.11 -1.01 -0.44 114.58 124.55 3gbr h GLU 325 Ca 0.38 -0.05 -0.03 0.00 0.07 0.00 0.00 59.36 59.74 3gbr h GLU 325 Cb 0.44 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 3gbr h GLU 325 CO -0.29 0.58 -0.06 0.82 0.07 0.00 0.00 179.01 180.12 3gbr h ILE 326 N 0.07 1.36 -0.12 -1.06 2.04 -0.48 -2.65 117.51 116.67 3gbr h ILE 326 Ca -0.00 -1.17 -0.15 0.00 1.00 0.00 0.00 64.86 64.53 3gbr h ILE 326 Cb 0.92 1.99 -0.01 0.00 -0.74 0.00 0.00 36.82 38.99 3gbr h ILE 326 CO 0.07 0.32 -0.57 0.40 0.00 0.00 0.00 178.15 178.37 3gbr h ILE 327 N -0.26 1.35 -0.25 -0.67 2.04 -1.06 -1.77 117.51 116.89 3gbr h ILE 327 Ca 0.01 -1.88 -0.07 0.00 1.00 0.00 0.00 64.86 63.92 3gbr h ILE 327 Cb 0.55 1.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.50 3gbr h ILE 327 CO 0.01 0.57 -0.17 0.77 0.00 0.00 0.00 178.15 179.33 3gbr h SER 328 N 0.29 0.42 0.83 1.72 4.64 -1.12 -0.92 113.55 119.41 3gbr h SER 328 Ca 0.00 -0.11 -0.21 0.00 -0.47 0.00 0.00 61.79 61.00 3gbr h SER 328 Cb 1.09 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 63.05 3gbr h SER 328 CO 0.10 0.61 -0.97 -0.03 -0.87 0.00 0.00 176.83 175.67 3gbr h MET 329 N 0.39 0.07 -1.85 4.77 1.85 -1.30 -3.41 114.93 115.45 3gbr h MET 329 Ca 0.07 -0.10 -0.53 0.00 -0.61 0.00 0.00 59.70 58.53 3gbr h MET 329 Cb 0.53 0.04 -0.37 0.00 0.43 0.00 0.00 31.60 32.22 3gbr h MET 329 CO 0.03 0.98 -1.04 -1.71 -0.40 0.00 0.00 176.91 174.77 3gbr n ASN 330 N -3.48 -0.17 0.00 1.39 5.15 -0.68 -5.11 115.26 112.36 3gbr n ASN 330 Ca -0.02 -2.72 0.00 0.00 -0.60 0.00 0.00 54.58 51.24 3gbr n ASN 330 Cb 0.89 -0.41 0.00 0.00 -0.53 0.00 0.00 39.78 39.73 3gbr n ASN 330 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3gbr n GLY 331 N 1.56 -0.73 3.07 8.20 0.00 -0.36 -1.80 105.19 115.12 3gbr n GLY 331 Ca 0.21 -1.23 -0.34 0.00 0.00 0.00 0.00 46.02 44.66 3gbr n GLY 331 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3gbr s ASP 332 N -4.00 5.02 0.58 1.61 3.68 0.76 -4.72 116.67 119.60 3gbr s ASP 332 Ca 0.00 -2.22 0.28 0.00 2.13 0.00 0.00 52.55 52.73 3gbr s ASP 332 Cb 0.00 -1.75 1.55 0.00 -1.45 0.00 0.00 42.92 41.27 3gbr s ASP 332 CO 0.00 -0.45 2.03 -0.37 0.13 0.00 0.00 175.17 176.51 3gbr h VAL 333 N 6.28 0.52 0.00 1.11 -1.51 -1.85 -1.61 116.25 119.19 3gbr h VAL 333 Ca -0.08 0.00 -0.03 0.00 -1.23 0.00 0.00 66.70 65.36 3gbr h VAL 333 Cb 1.02 0.77 -0.00 0.00 -2.13 0.00 0.00 31.29 30.95 3gbr h VAL 333 CO 0.64 0.00 -0.13 0.71 -1.23 0.00 0.00 177.57 177.56 3gbr h THR 334 N 0.00 0.41 0.10 7.19 1.35 -1.93 -1.55 112.91 118.48 3gbr h THR 334 Ca 0.14 -0.70 -0.29 0.00 -0.55 0.00 0.00 66.41 65.01 3gbr h THR 334 Cb 0.73 1.50 0.03 0.00 -1.73 0.00 0.00 68.15 68.68 3gbr h THR 334 CO -0.00 0.12 -1.22 0.11 -0.25 0.00 0.00 175.52 174.28 3gbr h LYS 335 N 0.00 0.63 -0.85 4.72 1.57 -1.56 -2.87 116.57 118.22 3gbr h LYS 335 Ca -0.00 -0.81 0.02 0.00 -1.87 0.00 0.00 60.65 57.98 3gbr h LYS 335 Cb 0.49 0.26 -0.04 0.00 0.08 0.00 0.00 32.23 33.02 3gbr h LYS 335 CO 0.02 1.37 0.56 1.25 -0.57 0.00 0.00 179.45 182.07 3gbr h LEU 336 N 0.29 0.95 -0.94 2.94 5.85 -0.99 -2.42 115.31 120.99 3gbr h LEU 336 Ca -0.18 -0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.43 3gbr h LEU 336 Cb 1.89 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.67 3gbr h LEU 336 CO 0.23 0.67 -0.25 0.50 -0.34 0.00 0.00 178.44 179.26 3gbr h LYS 337 N 1.12 0.48 -0.52 1.25 3.11 -1.32 -0.67 116.57 120.02 3gbr h LYS 337 Ca 0.32 -0.18 -0.05 0.00 -2.81 0.00 0.00 60.65 57.93 3gbr h LYS 337 Cb -0.08 -0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.10 3gbr h LYS 337 CO -0.08 0.70 0.14 1.15 -2.81 0.00 0.00 179.45 178.54 3gbr h THR 338 N 0.43 1.24 -0.80 1.00 2.02 -1.36 -0.43 112.91 115.00 3gbr h THR 338 Ca 0.06 -0.84 -0.05 0.00 0.77 0.00 0.00 66.41 66.36 3gbr h THR 338 Cb 0.66 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 3gbr h THR 338 CO 0.05 0.30 0.31 0.40 0.37 0.00 0.00 175.52 176.95 3gbr h ILE 339 N 0.72 1.26 -0.33 3.11 1.08 -1.07 -1.69 117.51 120.60 3gbr h ILE 339 Ca 0.16 -0.84 -0.02 0.00 -0.39 0.00 0.00 64.86 63.78 3gbr h ILE 339 Cb 0.32 0.32 -0.01 0.00 -3.07 0.00 0.00 36.82 34.37 3gbr h ILE 339 CO -0.00 0.34 0.14 0.58 -0.69 0.00 0.00 178.15 178.53 3gbr h VAL 340 N 1.16 1.17 -0.56 1.67 2.07 -0.91 0.14 116.25 121.00 3gbr h VAL 340 Ca 0.26 -0.52 0.06 0.00 0.82 0.00 0.00 66.70 67.33 3gbr h VAL 340 Cb 0.23 0.91 -0.05 0.00 -1.52 0.00 0.00 31.29 30.85 3gbr h VAL 340 CO -0.02 0.18 0.28 0.58 0.02 0.00 0.00 177.57 178.61 3gbr h VAL 341 N 0.39 0.92 0.00 2.57 2.07 -0.95 -1.20 116.25 120.05 3gbr h VAL 341 Ca 0.11 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.45 3gbr h VAL 341 Cb 0.16 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 3gbr h VAL 341 CO -0.01 0.10 0.00 0.11 0.02 0.00 0.00 177.57 177.78 3gbr h LYS 342 N 0.53 0.00 -0.00 1.57 1.57 -1.05 -2.75 116.57 116.43 3gbr h LYS 342 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 3gbr h LYS 342 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3gbr h LYS 342 CO -0.19 0.00 -0.49 0.43 -0.57 0.00 0.00 179.45 178.63 3gbr n SER 343 N -3.01 0.54 -0.86 0.86 7.64 0.46 -5.07 113.62 114.18 3gbr n SER 343 Ca 0.00 -0.31 0.11 0.00 1.01 0.00 0.00 58.87 59.69 3gbr n SER 343 Cb 0.28 0.25 0.09 0.00 -1.01 0.00 0.00 64.21 63.83 3gbr n SER 343 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83