#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ghg s ALA 59 N 0.00 3.45 -0.25 3.14 0.00 -1.26 -4.87 121.76 121.97 3ghg s ALA 59 Ca 0.00 0.10 -0.23 0.00 0.00 0.00 0.00 51.96 51.83 3ghg s ALA 59 Cb 0.00 -3.72 -0.10 0.00 0.00 0.00 0.00 23.12 19.30 3ghg s ALA 59 CO 0.00 -1.60 0.98 -2.30 0.00 0.00 0.00 175.76 172.84 3ghg n PRO 60 N 7.07 0.00 -4.54 0.00 -0.02 -1.26 -4.96 135.00 131.30 3ghg n PRO 60 Ca 0.14 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.28 3ghg n PRO 60 Cb 0.47 -0.75 -0.11 0.00 -0.02 0.00 0.00 33.50 33.08 3ghg n PRO 60 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3ghg s ASP 61 N 2.49 4.79 0.18 2.55 1.01 -1.26 -5.13 116.67 121.30 3ghg s ASP 61 Ca 0.58 -0.01 -0.09 0.00 0.71 0.00 0.00 52.55 53.74 3ghg s ASP 61 Cb -0.75 -1.34 -0.01 0.00 1.01 0.00 0.00 42.92 41.83 3ghg s ASP 61 CO 0.36 0.33 0.29 0.00 0.21 0.00 0.00 175.17 176.36 3ghg s ALA 62 N -0.62 0.06 0.23 5.23 0.00 -1.26 -5.14 121.76 120.26 3ghg s ALA 62 Ca 0.09 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 51.11 3ghg s ALA 62 Cb -0.12 0.92 0.00 0.00 0.00 0.00 0.00 23.12 23.92 3ghg s ALA 62 CO 0.02 -0.67 0.00 0.41 0.00 0.00 0.00 175.76 175.52 3ghg n GLY 63 N -0.24 -1.87 0.00 0.00 0.00 -1.26 -4.87 105.19 96.95 3ghg n GLY 63 Ca -0.06 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.74 3ghg n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ghg n GLY 64 N -3.09 -2.29 3.26 -0.02 0.00 -1.26 -4.87 105.19 96.91 3ghg n GLY 64 Ca 0.01 -1.43 -0.15 0.00 0.00 0.00 0.00 46.02 44.45 3ghg n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ghg s LEU 66 N -3.15 4.11 -0.04 0.00 0.20 -1.26 -1.47 118.68 117.06 3ghg s LEU 66 Ca 0.17 0.60 -0.30 0.00 0.69 0.00 0.00 54.13 55.29 3ghg s LEU 66 Cb 0.02 -2.99 -0.03 0.00 -0.43 0.00 0.00 46.19 42.76 3ghg s LEU 66 CO 0.01 -0.56 1.16 -2.28 -0.29 0.00 0.00 176.35 174.40 3ghg s HIS 67 N 2.83 3.29 0.57 5.38 5.65 -1.00 -4.91 115.29 127.10 3ghg s HIS 67 Ca 0.30 1.30 0.27 0.00 0.25 0.00 0.00 55.06 57.18 3ghg s HIS 67 Cb -0.14 -3.37 1.54 0.00 -1.18 0.00 0.00 32.58 29.43 3ghg s HIS 67 CO 0.12 -1.09 2.07 0.00 -0.65 0.00 0.00 174.74 175.18 3ghg h ALA 68 N 7.29 2.01 -2.11 1.58 0.00 -1.96 -3.39 119.26 122.68 3ghg h ALA 68 Ca -0.35 -0.01 -0.57 0.00 0.00 0.00 0.00 54.91 53.98 3ghg h ALA 68 Cb 1.17 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.94 3ghg h ALA 68 CO 0.86 -0.38 0.94 0.34 0.00 0.00 0.00 179.25 181.01 3ghg s ASP 69 N -5.97 6.84 0.00 0.00 2.15 -1.26 -4.94 116.67 113.49 3ghg s ASP 69 Ca -0.05 1.62 0.24 0.00 0.43 0.00 0.00 52.55 54.79 3ghg s ASP 69 Cb 0.16 -2.54 1.21 0.00 -0.30 0.00 0.00 42.92 41.45 3ghg s ASP 69 CO 0.60 -0.86 1.80 -2.65 -0.17 0.00 0.00 175.17 173.89 3ghg n PRO 70 N 6.84 0.33 0.01 4.34 -0.02 -1.26 -3.59 135.00 141.64 3ghg n PRO 70 Ca 0.14 0.06 0.10 0.00 -2.02 0.00 0.00 63.50 61.78 3ghg n PRO 70 Cb 0.45 -1.50 0.53 0.00 -0.02 0.00 0.00 33.50 32.96 3ghg n PRO 70 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 3ghg h ASP 71 N 0.00 0.29 0.00 2.55 3.58 -1.92 -3.36 116.42 117.56 3ghg h ASP 71 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 3ghg h ASP 71 Cb 0.23 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.22 3ghg h ASP 71 CO 0.00 0.19 -0.55 0.18 -2.88 0.00 0.00 179.24 176.18 3ghg n LEU 72 N -4.47 1.37 0.00 2.28 4.77 -1.24 -5.11 117.00 114.60 3ghg n LEU 72 Ca 0.06 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 3ghg n LEU 72 Cb 0.26 -0.56 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 3ghg n LEU 72 CO 0.35 -0.44 0.00 0.61 -1.33 0.00 0.00 177.39 176.57 3ghg n GLY 73 N 2.14 1.76 2.76 -0.72 0.00 -1.24 -5.00 105.19 104.90 3ghg n GLY 73 Ca -0.08 -0.76 -0.25 0.00 0.00 0.00 0.00 46.02 44.93 3ghg n GLY 73 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ghg s VAL 74 N 0.00 0.46 0.56 1.61 1.01 -1.26 -2.37 120.40 120.41 3ghg s VAL 74 Ca 0.00 -0.14 -0.14 0.00 0.00 0.00 0.00 61.98 61.70 3ghg s VAL 74 Cb 0.00 -0.74 -0.06 0.00 0.00 0.00 0.00 36.38 35.58 3ghg s VAL 74 CO 0.00 0.10 1.00 -0.76 0.00 0.00 0.00 175.10 175.44 3ghg s LEU 75 N 1.92 3.44 0.02 3.92 1.43 -0.54 -4.96 118.68 123.90 3ghg s LEU 75 Ca 0.03 1.49 0.04 0.00 -1.03 0.00 0.00 54.13 54.66 3ghg s LEU 75 Cb -0.14 -4.48 -0.01 0.00 0.03 0.00 0.00 46.19 41.58 3ghg s LEU 75 CO -0.06 -0.72 -0.11 0.00 0.23 0.00 0.00 176.35 175.68 3ghg n PRO 77 N 2.33 1.46 -1.79 0.00 -0.04 -1.26 -4.94 135.00 130.77 3ghg n PRO 77 Ca -0.16 0.53 -0.30 0.00 -0.04 0.00 0.00 63.50 63.53 3ghg n PRO 77 Cb 0.56 -2.25 0.19 0.00 -0.04 0.00 0.00 33.50 31.97 3ghg n PRO 77 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3ghg s THR 78 N -1.31 1.93 0.15 0.52 -4.23 -1.26 -4.86 115.64 106.58 3ghg s THR 78 Ca 0.67 0.00 -0.21 0.00 -1.18 0.00 0.00 61.69 60.97 3ghg s THR 78 Cb -0.49 -2.91 0.03 0.00 1.34 0.00 0.00 72.50 70.47 3ghg s THR 78 CO 0.54 0.00 1.65 1.23 -0.54 0.00 0.00 174.62 177.50 3ghg h GLY 79 N -1.80 -0.02 0.73 3.99 0.00 -2.00 -2.79 103.07 101.19 3ghg h GLY 79 Ca -0.44 0.22 -0.04 0.00 0.00 0.00 0.00 47.33 47.07 3ghg h GLY 79 CO 0.37 -0.17 -0.35 0.00 0.00 0.00 0.00 176.54 176.39 3ghg h GLN 81 N -1.07 0.20 0.25 0.00 1.08 -1.94 4.08 115.11 117.72 3ghg h GLN 81 Ca -0.10 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.07 3ghg h GLN 81 Cb 0.76 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.14 3ghg h GLN 81 CO 0.17 0.13 -0.12 -0.07 -0.95 0.00 0.00 178.83 177.99 3ghg h LEU 82 N 0.21 -0.29 -0.98 1.46 3.38 -1.21 -2.43 115.31 115.44 3ghg h LEU 82 Ca 0.70 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.57 3ghg h LEU 82 Cb 2.12 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 42.92 3ghg h LEU 82 CO -0.32 0.19 0.10 0.06 0.09 0.00 0.00 178.44 178.56 3ghg h GLN 83 N -1.07 0.84 0.52 1.13 -0.00 0.19 -2.13 115.11 114.59 3ghg h GLN 83 Ca -0.03 -0.19 -0.02 0.00 -0.00 0.00 0.00 58.65 58.41 3ghg h GLN 83 Cb 0.32 -0.12 -0.02 0.00 -0.00 0.00 0.00 27.48 27.66 3ghg h GLN 83 CO 0.06 0.77 -0.51 1.49 -0.00 0.00 0.00 178.83 180.64 3ghg h GLU 84 N 0.80 -0.99 -0.96 0.06 4.57 0.76 -1.58 114.58 117.24 3ghg h GLU 84 Ca 0.17 0.07 0.12 0.00 -1.18 0.00 0.00 59.36 58.54 3ghg h GLU 84 Cb 0.34 0.22 -0.14 0.00 -0.16 0.00 0.00 28.75 29.02 3ghg h GLU 84 CO 0.00 -0.66 -0.46 0.00 -1.18 0.00 0.00 179.01 176.71 3ghg n ALA 85 N -2.82 -0.34 -0.17 2.92 0.00 -0.91 -0.46 120.51 118.73 3ghg n ALA 85 Ca -0.12 0.89 0.00 0.00 0.00 0.00 0.00 53.44 54.21 3ghg n ALA 85 Cb 0.47 -0.30 0.25 0.00 0.00 0.00 0.00 19.45 19.87 3ghg n ALA 85 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3ghg h LEU 86 N 0.00 0.80 -0.36 0.00 3.38 -1.11 -2.12 115.31 115.90 3ghg h LEU 86 Ca 0.25 -0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.22 3ghg h LEU 86 Cb 0.49 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 3ghg h LEU 86 CO -0.93 0.63 0.11 0.25 0.09 0.00 0.00 178.44 178.59 3ghg h LEU 87 N 0.92 0.10 -0.45 1.67 6.46 0.25 0.78 115.31 125.04 3ghg h LEU 87 Ca 0.24 0.05 0.00 0.00 -0.12 0.00 0.00 57.88 58.04 3ghg h LEU 87 Cb -0.01 0.04 0.00 0.00 -0.73 0.00 0.00 40.66 39.96 3ghg h LEU 87 CO -0.04 0.09 -0.08 0.00 -0.62 0.00 0.00 178.44 177.79 3ghg n GLN 88 N -5.04 1.05 -0.06 1.25 3.00 -1.12 -2.23 117.38 114.22 3ghg n GLN 88 Ca 0.01 -0.45 -0.07 0.00 -0.01 0.00 0.00 57.00 56.49 3ghg n GLN 88 Cb 0.14 -1.49 -0.05 0.00 0.00 0.00 0.00 30.24 28.85 3ghg n GLN 88 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.06 179.02 3ghg h GLN 89 N 1.09 0.00 -0.61 -1.09 7.50 -0.56 -3.39 115.11 118.06 3ghg h GLN 89 Ca 0.00 0.00 0.09 0.00 0.50 0.00 0.00 58.65 59.24 3ghg h GLN 89 Cb 0.36 0.00 -0.11 0.00 0.05 0.00 0.00 27.48 27.78 3ghg h GLN 89 CO 0.00 0.33 -0.42 1.49 -1.50 0.00 0.00 178.83 178.74 3ghg h GLU 90 N -1.00 -0.19 0.02 1.46 4.22 0.56 0.12 114.58 119.77 3ghg h GLU 90 Ca -0.04 0.01 -0.00 0.00 0.08 0.00 0.00 59.36 59.41 3ghg h GLU 90 Cb 0.48 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.77 3ghg h GLU 90 CO -0.02 -0.13 -0.01 -0.09 -2.18 0.00 0.00 179.01 176.58 3ghg h ARG 91 N -0.20 -0.03 -0.22 1.92 2.43 -1.68 0.51 114.38 117.11 3ghg h ARG 91 Ca 0.20 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.31 3ghg h ARG 91 Cb 0.56 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 3ghg h ARG 91 CO -0.71 0.05 -0.11 -1.35 -1.51 0.00 0.00 179.97 176.34 3ghg h PRO 92 N -0.09 0.36 0.00 0.20 0.11 -1.73 -2.41 132.00 128.44 3ghg h PRO 92 Ca -0.00 -0.09 0.00 0.00 0.11 0.00 0.00 66.00 66.02 3ghg h PRO 92 Cb 0.09 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.15 3ghg h PRO 92 CO 0.00 0.48 0.00 0.82 -0.21 0.00 0.00 178.00 179.09 3ghg h ILE 93 N 0.34 0.00 0.00 4.15 2.04 -0.09 -3.15 117.51 120.80 3ghg h ILE 93 Ca 0.07 -0.69 -0.26 0.00 1.00 0.00 0.00 64.86 64.98 3ghg h ILE 93 Cb 0.41 1.66 -0.04 0.00 -0.74 0.00 0.00 36.82 38.11 3ghg h ILE 93 CO 0.02 0.00 -1.39 0.54 0.00 0.00 0.00 178.15 177.32 3ghg n ARG 94 N -2.76 0.57 0.06 2.37 1.74 0.17 -4.06 116.66 114.75 3ghg n ARG 94 Ca 0.04 0.54 0.10 0.00 -0.77 0.00 0.00 57.85 57.76 3ghg n ARG 94 Cb 0.43 -1.72 0.41 0.00 -1.02 0.00 0.00 32.46 30.56 3ghg n ARG 94 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3ghg n ASN 95 N -4.39 0.31 0.15 0.55 4.13 -0.92 -1.59 115.26 113.49 3ghg n ASN 95 Ca -0.34 0.57 0.12 0.00 1.68 0.00 0.00 54.58 56.61 3ghg n ASN 95 Cb 0.71 -0.64 0.20 0.00 -1.54 0.00 0.00 39.78 38.52 3ghg n ASN 95 CO 0.00 0.00 0.00 -1.28 0.28 0.00 0.00 177.26 176.26 3ghg h SER 96 N 0.00 0.00 0.30 6.41 0.87 -1.74 -3.21 113.55 116.18 3ghg h SER 96 Ca 0.00 -0.03 -0.33 0.00 -1.23 0.00 0.00 61.79 60.20 3ghg h SER 96 Cb 0.34 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.28 3ghg h SER 96 CO 0.00 0.01 -1.83 1.62 -0.53 0.00 0.00 176.83 176.10 3ghg h VAL 97 N 0.00 0.77 0.00 2.23 3.04 -1.44 -2.94 116.25 117.91 3ghg h VAL 97 Ca 0.00 -2.53 -0.08 0.00 -1.01 0.00 0.00 66.70 63.08 3ghg h VAL 97 Cb 0.90 2.51 -0.01 0.00 -2.01 0.00 0.00 31.29 32.67 3ghg h VAL 97 CO 0.00 0.74 -0.37 -2.24 -1.01 0.00 0.00 177.57 174.68 3ghg h ASP 98 N 0.05 0.00 0.51 3.17 -0.00 -1.64 0.32 116.42 118.83 3ghg h ASP 98 Ca -0.35 0.00 -0.24 0.00 -0.00 0.00 0.00 57.03 56.44 3ghg h ASP 98 Cb 2.03 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 41.36 3ghg h ASP 98 CO 0.10 0.37 -1.06 1.05 -0.00 0.00 0.00 179.24 179.70 3ghg h GLU 99 N 0.00 0.31 -0.21 4.15 -0.00 -1.69 -1.30 114.58 115.84 3ghg h GLU 99 Ca -0.00 -0.41 -0.03 0.00 -0.00 0.00 0.00 59.36 58.92 3ghg h GLU 99 Cb 1.00 0.13 -0.01 0.00 -0.00 0.00 0.00 28.75 29.88 3ghg h GLU 99 CO 0.05 1.13 -0.01 -0.07 -0.00 0.00 0.00 179.01 180.11 3ghg h LEU 100 N 0.14 0.36 0.76 3.06 3.38 -1.30 -2.90 115.31 118.81 3ghg h LEU 100 Ca -0.10 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.52 3ghg h LEU 100 Cb 1.73 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 42.39 3ghg h LEU 100 CO 0.17 0.59 -0.37 0.78 0.09 0.00 0.00 178.44 179.71 3ghg h ASN 101 N 0.12 -0.86 0.17 -0.43 4.21 -0.42 0.73 115.58 119.10 3ghg h ASN 101 Ca 0.06 0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.58 3ghg h ASN 101 Cb 0.41 0.22 0.00 0.00 -1.12 0.00 0.00 38.32 37.83 3ghg h ASN 101 CO 0.01 -0.53 0.00 -0.46 -1.29 0.00 0.00 177.43 175.16 3ghg n ASN 102 N -5.48 0.00 -0.07 5.81 6.94 -0.49 -1.59 115.26 120.38 3ghg n ASN 102 Ca -0.14 0.17 -0.06 0.00 -0.02 0.00 0.00 54.58 54.53 3ghg n ASN 102 Cb 0.41 -0.29 -0.02 0.00 -2.36 0.00 0.00 39.78 37.52 3ghg n ASN 102 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 3ghg n ASN 103 N -1.29 1.49 -0.32 0.53 3.02 -1.10 -3.98 115.26 113.62 3ghg n ASN 103 Ca 0.04 0.36 0.11 0.00 -0.03 0.00 0.00 54.58 55.06 3ghg n ASN 103 Cb 0.07 -0.73 0.23 0.00 -0.61 0.00 0.00 39.78 38.75 3ghg n ASN 103 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3ghg h VAL 104 N -0.79 0.13 0.00 2.41 2.07 0.91 0.76 116.25 121.74 3ghg h VAL 104 Ca 0.00 -0.02 -0.18 0.00 0.82 0.00 0.00 66.70 67.32 3ghg h VAL 104 Cb 0.66 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 3ghg h VAL 104 CO 0.00 0.01 -2.06 -0.62 0.02 0.00 0.00 177.57 174.92 3ghg n GLU 105 N -5.45 0.88 0.19 1.57 4.71 -0.62 -1.96 120.64 119.95 3ghg n GLU 105 Ca 0.19 -0.08 0.09 0.00 -0.01 0.00 0.00 57.16 57.35 3ghg n GLU 105 Cb 0.64 -1.45 0.11 0.00 -1.01 0.00 0.00 31.44 29.73 3ghg n GLU 105 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3ghg h ALA 106 N 1.25 0.87 0.00 0.62 0.00 -1.59 -2.86 119.26 117.54 3ghg h ALA 106 Ca -0.27 -0.16 -0.43 0.00 0.00 0.00 0.00 54.91 54.06 3ghg h ALA 106 Cb 1.55 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 19.26 3ghg h ALA 106 CO 0.01 0.21 -2.43 0.28 0.00 0.00 0.00 179.25 177.32 3ghg n VAL 107 N -3.11 1.41 1.73 0.00 0.31 0.26 -4.45 118.33 114.47 3ghg n VAL 107 Ca 0.03 -0.38 0.07 0.00 -0.01 0.00 0.00 64.34 64.05 3ghg n VAL 107 Cb 0.60 -1.79 0.41 0.00 -0.91 0.00 0.00 33.84 32.15 3ghg n VAL 107 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 3ghg n SER 108 N -4.04 0.00 0.11 4.52 2.88 -0.83 -1.71 113.62 114.55 3ghg n SER 108 Ca -0.50 -1.30 -0.03 0.00 -1.33 0.00 0.00 58.87 55.71 3ghg n SER 108 Cb 0.87 0.00 0.13 0.00 -0.75 0.00 0.00 64.21 64.46 3ghg n SER 108 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 3ghg h GLN 109 N 0.00 0.07 -0.11 -1.46 -0.00 -1.68 0.38 115.11 112.32 3ghg h GLN 109 Ca 0.00 -0.06 -0.17 0.00 -0.00 0.00 0.00 58.65 58.43 3ghg h GLN 109 Cb 0.00 0.01 0.01 0.00 0.00 0.00 0.00 27.48 27.50 3ghg h GLN 109 CO 0.00 0.71 -0.58 1.79 0.00 0.00 0.00 178.83 180.75 3ghg h THR 110 N 0.05 1.34 -0.48 2.39 1.35 -1.58 1.02 112.91 117.01 3ghg h THR 110 Ca -0.01 -1.87 0.03 0.00 -0.55 0.00 0.00 66.41 64.02 3ghg h THR 110 Cb 1.17 2.15 -0.04 0.00 -1.73 0.00 0.00 68.15 69.71 3ghg h THR 110 CO 0.09 0.57 0.26 -1.28 -0.25 0.00 0.00 175.52 174.91 3ghg h SER 111 N 0.22 0.39 -0.45 5.36 0.87 -1.60 -2.34 113.55 116.00 3ghg h SER 111 Ca -0.04 0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.48 3ghg h SER 111 Cb 1.22 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 63.10 3ghg h SER 111 CO 0.12 0.27 0.09 0.28 -0.53 0.00 0.00 176.83 177.06 3ghg h SER 112 N 0.51 0.75 0.61 6.23 0.02 -0.06 -2.03 113.55 119.59 3ghg h SER 112 Ca 0.21 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 3ghg h SER 112 Cb 0.09 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.43 3ghg h SER 112 CO -0.13 0.76 -0.06 -1.28 -1.14 0.00 0.00 176.83 174.98 3ghg h SER 113 N 0.77 0.00 -0.01 3.07 0.87 0.14 -2.80 113.55 115.58 3ghg h SER 113 Ca 0.16 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 3ghg h SER 113 Cb 0.33 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 3ghg h SER 113 CO 0.00 0.06 -0.40 -1.20 -0.53 0.00 0.00 176.83 174.76 3ghg n SER 114 N -3.28 1.66 0.12 6.23 7.64 -0.91 -4.20 113.62 120.88 3ghg n SER 114 Ca -0.01 -1.33 0.04 0.00 1.01 0.00 0.00 58.87 58.58 3ghg n SER 114 Cb 0.25 0.51 0.46 0.00 -1.01 0.00 0.00 64.21 64.43 3ghg n SER 114 CO 0.00 0.00 0.00 -0.26 -3.01 0.00 0.00 175.04 171.77 3ghg h PHE 115 N 1.81 0.25 -0.02 1.43 0.04 -1.09 -2.99 116.94 116.37 3ghg h PHE 115 Ca 0.00 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.76 3ghg h PHE 115 Cb 0.59 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 38.66 3ghg h PHE 115 CO 0.00 0.26 -0.07 0.00 -0.60 0.00 0.00 178.31 177.91 3ghg n GLN 116 N -4.39 1.74 0.30 1.51 -0.00 -1.25 -4.06 117.38 111.24 3ghg n GLN 116 Ca -0.00 -1.22 0.20 0.00 -0.00 0.00 0.00 57.00 55.97 3ghg n GLN 116 Cb 0.17 -1.47 0.93 0.00 -0.00 0.00 0.00 30.24 29.86 3ghg n GLN 116 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.06 178.94 3ghg h TYR 117 N 2.98 0.00 0.45 2.61 -1.99 -1.71 -3.10 116.97 116.21 3ghg h TYR 117 Ca 0.00 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 3ghg h TYR 117 Cb 0.68 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.42 3ghg h TYR 117 CO 0.00 0.01 -0.21 0.52 -0.00 0.00 0.00 178.16 178.47 3ghg h MET 118 N 0.00 -0.58 -1.00 4.88 2.86 -1.78 -1.59 114.93 117.73 3ghg h MET 118 Ca -0.00 0.04 0.25 0.00 -2.06 0.00 0.00 59.70 57.93 3ghg h MET 118 Cb 0.28 0.13 -0.13 0.00 0.06 0.00 0.00 31.60 31.94 3ghg h MET 118 CO 0.00 -0.34 0.58 1.88 1.06 0.00 0.00 176.91 180.09 3ghg h TYR 119 N -0.69 0.98 0.00 -0.22 0.05 -1.84 4.47 116.97 119.72 3ghg h TYR 119 Ca -0.06 0.04 -0.12 0.00 0.05 0.00 0.00 58.73 58.63 3ghg h TYR 119 Cb 0.51 -0.27 -0.02 0.00 1.01 0.00 0.00 36.73 37.95 3ghg h TYR 119 CO -0.03 0.02 -1.20 1.37 -1.05 0.00 0.00 178.16 177.28 3ghg h LEU 120 N 0.53 0.00 0.00 3.88 8.10 -1.70 -3.31 115.31 122.81 3ghg h LEU 120 Ca 0.65 0.00 -0.11 0.00 0.11 0.00 0.00 57.88 58.53 3ghg h LEU 120 Cb 1.28 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 41.47 3ghg h LEU 120 CO -0.50 0.43 -2.08 0.18 -4.11 0.00 0.00 178.44 172.36 3ghg n LEU 121 N -2.88 0.00 0.29 0.17 4.77 -0.16 -3.82 117.00 115.37 3ghg n LEU 121 Ca -0.06 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.76 3ghg n LEU 121 Cb 0.76 0.15 -0.08 0.00 -2.33 0.00 0.00 43.42 41.92 3ghg n LEU 121 CO 0.42 0.15 0.56 0.50 -1.33 0.00 0.00 177.39 177.69 3ghg h LYS 122 N 0.00 -0.71 -0.65 3.23 3.64 0.85 -2.00 116.57 120.93 3ghg h LYS 122 Ca -0.17 0.05 0.13 0.00 -1.27 0.00 0.00 60.65 59.39 3ghg h LYS 122 Cb 1.36 0.16 -0.12 0.00 -0.41 0.00 0.00 32.23 33.23 3ghg h LYS 122 CO 0.01 -0.41 -0.09 -0.44 -2.27 0.00 0.00 179.45 176.24 3ghg h ASP 123 N -0.92 -0.47 -0.59 4.20 5.19 -1.69 0.95 116.42 123.08 3ghg h ASP 123 Ca -0.08 0.18 0.01 0.00 -0.62 0.00 0.00 57.03 56.53 3ghg h ASP 123 Cb 0.63 0.35 -0.03 0.00 0.18 0.00 0.00 39.33 40.46 3ghg h ASP 123 CO 0.12 -0.18 0.39 0.25 -3.12 0.00 0.00 179.24 176.71 3ghg h LEU 124 N 0.04 0.67 -0.24 1.55 6.46 -1.65 2.44 115.31 124.58 3ghg h LEU 124 Ca 0.33 -0.02 -0.18 0.00 -0.12 0.00 0.00 57.88 57.89 3ghg h LEU 124 Cb 0.52 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 40.29 3ghg h LEU 124 CO -0.62 0.48 -0.56 -0.25 -0.62 0.00 0.00 178.44 176.86 3ghg h TRP 125 N 0.79 1.03 -0.00 1.25 2.91 -0.13 -1.39 115.95 120.41 3ghg h TRP 125 Ca 0.22 -0.39 0.00 0.00 1.13 0.00 0.00 58.89 59.85 3ghg h TRP 125 Cb -0.06 -0.19 0.00 0.00 -0.51 0.00 0.00 29.16 28.40 3ghg h TRP 125 CO -0.00 1.21 -0.00 1.04 -1.03 0.00 0.00 178.44 179.66 3ghg n GLN 126 N -4.05 1.04 -0.03 2.65 1.13 0.31 -3.18 117.38 115.25 3ghg n GLN 126 Ca -0.05 -0.08 -0.04 0.00 -1.94 0.00 0.00 57.00 54.89 3ghg n GLN 126 Cb 0.63 -1.50 -0.01 0.00 0.11 0.00 0.00 30.24 29.47 3ghg n GLN 126 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3ghg n LYS 127 N -0.91 0.24 -0.04 -1.09 5.02 0.81 -4.35 118.16 117.84 3ghg n LYS 127 Ca 0.23 0.09 -0.08 0.00 -2.02 0.00 0.00 58.31 56.54 3ghg n LYS 127 Cb 0.13 -0.86 0.10 0.00 -0.02 0.00 0.00 35.03 34.38 3ghg n LYS 127 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ghg h ARG 128 N -0.45 0.65 0.00 1.97 3.08 -1.42 0.86 114.38 119.07 3ghg h ARG 128 Ca 0.00 -0.31 -0.05 0.00 0.07 0.00 0.00 59.98 59.69 3ghg h ARG 128 Cb 0.45 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 3ghg h ARG 128 CO 0.00 0.90 -0.25 0.37 -1.07 0.00 0.00 179.97 179.92 3ghg h GLN 129 N 0.55 0.00 0.00 0.04 -0.00 -1.71 -2.76 115.11 111.22 3ghg h GLN 129 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.71 3ghg h GLN 129 Cb 0.85 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.33 3ghg h GLN 129 CO 0.07 0.25 -1.20 1.63 0.00 0.00 0.00 178.83 179.58 3ghg n LYS 130 N -3.90 0.28 0.10 1.69 5.02 -0.69 -3.43 118.16 117.23 3ghg n LYS 130 Ca -0.02 -0.04 -0.16 0.00 -2.02 0.00 0.00 58.31 56.07 3ghg n LYS 130 Cb 0.34 -1.55 -0.11 0.00 -0.02 0.00 0.00 35.03 33.68 3ghg n LYS 130 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 3ghg h GLN 131 N 0.00 0.36 0.00 1.97 -0.00 0.77 -3.34 115.11 114.87 3ghg h GLN 131 Ca 0.00 -0.53 0.00 0.00 -0.00 0.00 0.00 58.65 58.12 3ghg h GLN 131 Cb 0.72 0.18 0.00 0.00 0.00 0.00 0.00 27.48 28.38 3ghg h GLN 131 CO 0.00 1.22 -0.40 -0.39 0.00 0.00 0.00 178.83 179.26 3ghg h VAL 132 N 0.14 0.00 0.00 2.39 -1.51 -1.63 -1.74 116.25 113.90 3ghg h VAL 132 Ca -0.13 -0.71 -0.08 0.00 -1.23 0.00 0.00 66.70 64.55 3ghg h VAL 132 Cb 1.87 1.47 -0.01 0.00 -2.13 0.00 0.00 31.29 32.49 3ghg h VAL 132 CO 0.20 0.00 -0.70 0.07 -1.23 0.00 0.00 177.57 175.92 3ghg h LYS 133 N 0.00 0.00 0.05 5.19 2.10 -1.70 -2.32 116.57 119.90 3ghg h LYS 133 Ca 0.00 0.00 -0.35 0.00 -2.00 0.00 0.00 60.65 58.30 3ghg h LYS 133 Cb 0.85 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.14 3ghg h LYS 133 CO 0.00 0.26 -2.03 -3.47 -2.00 0.00 0.00 179.45 172.22 3ghg n ASP 134 N -3.03 1.43 -0.24 7.07 2.03 -1.25 -3.75 116.55 118.81 3ghg n ASP 134 Ca -0.01 0.20 0.24 0.00 0.52 0.00 0.00 54.79 55.75 3ghg n ASP 134 Cb 0.68 -0.30 0.61 0.00 -0.72 0.00 0.00 41.12 41.39 3ghg n ASP 134 CO 0.00 0.00 0.00 -1.13 -1.92 0.00 0.00 177.20 174.15 3ghg h ASN 135 N 0.03 0.24 0.15 1.67 -0.73 -1.40 1.41 115.58 116.94 3ghg h ASN 135 Ca -0.42 0.03 -0.01 0.00 1.87 0.00 0.00 56.30 57.78 3ghg h ASN 135 Cb 2.04 -0.01 0.00 0.00 0.27 0.00 0.00 38.32 40.62 3ghg h ASN 135 CO 0.05 0.08 -0.08 -0.08 -0.37 0.00 0.00 177.43 177.03 3ghg h GLU 136 N 0.23 -0.21 0.00 6.67 4.81 -1.53 0.20 114.58 124.75 3ghg h GLU 136 Ca 0.48 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.72 3ghg h GLU 136 Cb 1.51 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.93 3ghg h GLU 136 CO -0.13 -0.14 -0.02 -0.91 -0.73 0.00 0.00 179.01 177.09 3ghg h ASN 137 N -0.21 0.00 0.00 1.04 4.21 -1.40 -2.82 115.58 116.40 3ghg h ASN 137 Ca -0.02 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.49 3ghg h ASN 137 Cb 0.17 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.37 3ghg h ASN 137 CO 0.03 0.02 -0.75 0.55 -1.29 0.00 0.00 177.43 175.99 3ghg n VAL 138 N -3.11 1.41 0.21 2.81 3.14 0.47 -4.57 118.33 118.70 3ghg n VAL 138 Ca 0.03 0.21 0.09 0.00 -2.96 0.00 0.00 64.34 61.70 3ghg n VAL 138 Cb 0.45 -2.15 0.43 0.00 -1.06 0.00 0.00 33.84 31.50 3ghg n VAL 138 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 3ghg h VAL 139 N -0.75 0.62 -3.55 1.55 2.07 -1.47 -3.37 116.25 111.35 3ghg h VAL 139 Ca 0.00 -1.21 -0.69 0.00 0.82 0.00 0.00 66.70 65.62 3ghg h VAL 139 Cb 0.75 1.80 -0.34 0.00 -1.52 0.00 0.00 31.29 31.98 3ghg h VAL 139 CO 0.00 0.25 -0.58 0.21 0.02 0.00 0.00 177.57 177.47 3ghg s ASN 140 N -6.25 5.19 0.00 0.57 2.47 0.66 -4.75 114.94 112.83 3ghg s ASN 140 Ca 0.00 -1.83 0.00 0.00 0.42 0.00 0.00 52.86 51.45 3ghg s ASN 140 Cb 0.10 -1.81 0.00 0.00 -1.45 0.00 0.00 41.25 38.09 3ghg s ASN 140 CO 0.65 -0.48 0.01 1.21 -3.72 0.00 0.00 177.10 174.77 3ghg n GLU 141 N 4.61 0.00 0.03 0.43 4.07 -1.26 -4.08 120.64 124.44 3ghg n GLU 141 Ca -0.05 -0.01 -0.14 0.00 -0.06 0.00 0.00 57.16 56.90 3ghg n GLU 141 Cb 0.42 -0.02 -0.03 0.00 -0.06 0.00 0.00 31.44 31.76 3ghg n GLU 141 CO 0.00 0.00 0.00 0.10 -0.06 0.00 0.00 177.13 177.17 3ghg h TYR 142 N 0.00 0.75 -0.74 4.31 -0.00 -1.91 -1.41 116.97 117.97 3ghg h TYR 142 Ca 0.00 -0.36 0.08 0.00 -0.00 0.00 0.00 58.73 58.45 3ghg h TYR 142 Cb 0.85 -0.11 -0.07 0.00 -0.00 0.00 0.00 36.73 37.41 3ghg h TYR 142 CO 0.00 1.15 0.41 0.66 -0.00 0.00 0.00 178.16 180.39 3ghg h SER 143 N 0.35 0.59 -0.34 0.10 4.64 -1.95 0.47 113.55 117.40 3ghg h SER 143 Ca -0.06 0.04 -0.08 0.00 -0.47 0.00 0.00 61.79 61.22 3ghg h SER 143 Cb 1.43 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 63.44 3ghg h SER 143 CO 0.15 0.36 -0.11 0.77 -0.87 0.00 0.00 176.83 177.13 3ghg h SER 144 N 0.72 0.69 0.33 4.97 4.64 -1.92 -2.83 113.55 120.14 3ghg h SER 144 Ca 0.35 -0.38 -0.04 0.00 -0.47 0.00 0.00 61.79 61.25 3ghg h SER 144 Cb 0.29 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 3ghg h SER 144 CO -0.22 0.91 -0.19 -0.08 -0.87 0.00 0.00 176.83 176.38 3ghg h GLU 145 N 0.46 0.00 -0.17 4.77 4.22 -0.80 -2.80 114.58 120.26 3ghg h GLU 145 Ca 0.08 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.52 3ghg h GLU 145 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 3ghg h GLU 145 CO 0.04 0.19 0.00 1.28 -2.18 0.00 0.00 179.01 178.34 3ghg n LEU 146 N -3.92 1.01 -0.05 1.64 4.77 0.16 -2.97 117.00 117.65 3ghg n LEU 146 Ca -0.02 -0.48 -0.21 0.00 -0.03 0.00 0.00 56.01 55.27 3ghg n LEU 146 Cb 0.28 -0.11 -0.13 0.00 -2.33 0.00 0.00 43.42 41.13 3ghg n LEU 146 CO 0.34 0.24 -0.95 1.21 -1.33 0.00 0.00 177.39 176.90 3ghg n GLU 147 N -0.00 0.70 0.21 3.23 2.13 -1.05 -3.06 120.64 122.80 3ghg n GLU 147 Ca 0.09 0.27 0.09 0.00 0.66 0.00 0.00 57.16 58.27 3ghg n GLU 147 Cb 0.18 -1.65 0.40 0.00 0.27 0.00 0.00 31.44 30.63 3ghg n GLU 147 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 3ghg h LYS 148 N -0.11 0.00 -0.53 5.31 6.56 -1.71 -3.03 116.57 123.05 3ghg h LYS 148 Ca -0.47 0.00 -0.08 0.00 -1.06 0.00 0.00 60.65 59.04 3ghg h LYS 148 Cb 1.91 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 33.55 3ghg h LYS 148 CO -0.01 0.24 0.01 1.25 -2.06 0.00 0.00 179.45 178.87 3ghg h HIS 149 N 0.00 1.02 -0.18 -1.35 -0.00 -1.69 -3.08 115.15 109.87 3ghg h HIS 149 Ca -0.00 -0.17 -0.03 0.00 -0.00 0.00 0.00 60.37 60.16 3ghg h HIS 149 Cb 0.83 -0.27 -0.01 0.00 -0.00 0.00 0.00 27.41 27.97 3ghg h HIS 149 CO 0.00 0.93 -0.02 0.37 -0.00 0.00 0.00 177.93 179.21 3ghg h GLN 150 N 0.81 0.26 0.00 5.26 4.15 -1.45 -3.05 115.11 121.09 3ghg h GLN 150 Ca 0.15 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.53 3ghg h GLN 150 Cb 0.52 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.17 3ghg h GLN 150 CO 0.03 0.31 0.00 1.28 -1.93 0.00 0.00 178.83 178.51 3ghg n LEU 151 N -4.36 0.45 -0.09 -2.39 4.77 -1.16 0.25 117.00 114.46 3ghg n LEU 151 Ca -0.00 0.70 -0.10 0.00 -0.03 0.00 0.00 56.01 56.57 3ghg n LEU 151 Cb 0.19 -0.74 -0.03 0.00 -2.33 0.00 0.00 43.42 40.52 3ghg n LEU 151 CO 0.37 -0.81 0.85 1.88 -1.33 0.00 0.00 177.39 178.34 3ghg h TYR 152 N 0.00 0.48 -0.43 -1.77 0.99 -1.67 -3.01 116.97 111.55 3ghg h TYR 152 Ca 0.00 -0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.68 3ghg h TYR 152 Cb 0.04 -0.14 0.00 0.00 1.00 0.00 0.00 36.73 37.64 3ghg h TYR 152 CO 0.00 0.51 0.00 -0.89 -0.00 0.00 0.00 178.16 177.78 3ghg n ILE 153 N -4.69 1.33 0.03 -2.88 2.08 0.70 -2.60 119.36 113.32 3ghg n ILE 153 Ca -0.02 -0.81 -0.01 0.00 0.56 0.00 0.00 62.75 62.46 3ghg n ILE 153 Cb 0.17 -0.05 -0.00 0.00 -0.75 0.00 0.00 39.64 39.01 3ghg n ILE 153 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 3ghg n ASP 154 N 0.65 1.17 0.24 4.38 4.64 -0.61 -4.50 116.55 122.52 3ghg n ASP 154 Ca 0.18 0.16 0.11 0.00 -1.38 0.00 0.00 54.79 53.85 3ghg n ASP 154 Cb 0.68 -0.38 0.60 0.00 -1.04 0.00 0.00 41.12 40.98 3ghg n ASP 154 CO 0.00 0.00 0.00 -0.33 -0.82 0.00 0.00 177.20 176.05 3ghg h GLU 155 N -0.14 0.00 -0.03 -0.67 4.39 -1.68 0.97 114.58 117.43 3ghg h GLU 155 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3ghg h GLU 155 Cb 0.20 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 3ghg h GLU 155 CO -0.00 0.19 -0.07 1.15 -1.16 0.00 0.00 179.01 179.11 3ghg h THR 156 N 0.00 0.00 0.00 1.13 2.02 -1.71 -0.76 112.91 113.59 3ghg h THR 156 Ca -0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.13 3ghg h THR 156 Cb 0.51 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.91 3ghg h THR 156 CO 0.02 0.00 -0.21 0.58 0.37 0.00 0.00 175.52 176.28 3ghg h VAL 157 N -0.07 0.50 -0.01 3.16 2.07 -0.82 -0.27 116.25 120.81 3ghg h VAL 157 Ca 0.01 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.39 3ghg h VAL 157 Cb 0.08 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 3ghg h VAL 157 CO -0.06 0.21 -0.46 -3.20 0.02 0.00 0.00 177.57 174.08 3ghg n ASN 158 N -3.34 1.81 0.14 0.57 4.05 0.30 -4.64 115.26 114.16 3ghg n ASN 158 Ca 0.00 -1.41 0.00 0.00 0.45 0.00 0.00 54.58 53.63 3ghg n ASN 158 Cb 0.45 0.51 0.00 0.00 1.23 0.00 0.00 39.78 41.97 3ghg n ASN 158 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 177.26 173.97 3ghg n SER 159 N -0.15 -1.06 0.06 1.20 2.88 -0.41 -4.94 113.62 111.20 3ghg n SER 159 Ca 0.08 0.50 -0.02 0.00 -1.33 0.00 0.00 58.87 58.10 3ghg n SER 159 Cb 0.41 1.15 -0.01 0.00 -0.75 0.00 0.00 64.21 65.01 3ghg n SER 159 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 3ghg h ASN 160 N 0.00 -0.12 -0.81 -3.46 -0.26 0.13 0.68 115.58 111.74 3ghg h ASN 160 Ca 0.00 0.00 0.20 0.00 -0.56 0.00 0.00 56.30 55.94 3ghg h ASN 160 Cb 0.00 0.03 -0.13 0.00 -1.06 0.00 0.00 38.32 37.16 3ghg h ASN 160 CO 0.00 -0.09 0.17 0.40 -1.06 0.00 0.00 177.43 176.85 3ghg h ILE 161 N -0.15 0.38 -0.49 2.81 1.08 -1.67 2.21 117.51 121.69 3ghg h ILE 161 Ca -0.01 -0.07 -0.05 0.00 -0.39 0.00 0.00 64.86 64.33 3ghg h ILE 161 Cb 0.11 0.15 -0.02 0.00 -3.07 0.00 0.00 36.82 34.00 3ghg h ILE 161 CO 0.02 0.04 0.11 1.55 -0.69 0.00 0.00 178.15 179.18 3ghg h PRO 162 N 0.21 0.78 -0.49 2.37 0.13 -1.76 0.88 132.00 134.12 3ghg h PRO 162 Ca 0.48 -0.19 0.02 0.00 -0.87 0.00 0.00 66.00 65.44 3ghg h PRO 162 Cb 0.90 -0.10 -0.03 0.00 0.13 0.00 0.00 31.00 31.90 3ghg h PRO 162 CO -0.62 0.77 0.29 1.79 -0.23 0.00 0.00 178.00 180.00 3ghg h THR 163 N 0.67 1.05 -0.06 1.56 1.35 0.39 0.31 112.91 118.17 3ghg h THR 163 Ca 0.15 -0.20 -0.00 0.00 -0.55 0.00 0.00 66.41 65.81 3ghg h THR 163 Cb 0.34 0.41 -0.00 0.00 -1.73 0.00 0.00 68.15 67.17 3ghg h THR 163 CO 0.00 0.11 0.03 -1.13 -0.25 0.00 0.00 175.52 174.28 3ghg h ASN 164 N 0.58 0.08 0.35 5.36 -0.00 0.36 -0.66 115.58 121.65 3ghg h ASN 164 Ca 0.20 -0.10 -0.09 0.00 -0.00 0.00 0.00 56.30 56.31 3ghg h ASN 164 Cb 0.02 -0.02 -0.01 0.00 -0.00 0.00 0.00 38.32 38.31 3ghg h ASN 164 CO -0.09 0.16 -0.38 -0.07 -0.00 0.00 0.00 177.43 177.04 3ghg h LEU 165 N -0.01 0.06 0.66 0.34 3.38 -0.57 0.22 115.31 119.39 3ghg h LEU 165 Ca 0.02 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3ghg h LEU 165 Cb 0.10 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3ghg h LEU 165 CO -0.00 0.44 -0.51 -0.09 0.09 0.00 0.00 178.44 178.37 3ghg h ARG 166 N 0.05 -1.08 0.00 1.13 2.43 0.04 -1.00 114.38 115.94 3ghg h ARG 166 Ca 0.00 0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 3ghg h ARG 166 Cb 0.70 0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 30.50 3ghg h ARG 166 CO 0.05 -0.72 -0.10 -0.24 -1.51 0.00 0.00 179.97 177.45 3ghg h VAL 167 N -1.13 0.21 0.08 0.20 3.04 -0.79 -2.77 116.25 115.11 3ghg h VAL 167 Ca -0.09 -0.96 -0.00 0.00 -1.01 0.00 0.00 66.70 64.64 3ghg h VAL 167 Cb 0.94 1.80 0.00 0.00 -2.01 0.00 0.00 31.29 32.02 3ghg h VAL 167 CO 0.02 0.10 -0.04 0.25 -1.01 0.00 0.00 177.57 176.89 3ghg h LEU 168 N 0.00 -0.10 -1.00 3.16 5.85 -0.57 -3.36 115.31 119.30 3ghg h LEU 168 Ca -0.00 0.00 0.21 0.00 0.84 0.00 0.00 57.88 58.93 3ghg h LEU 168 Cb 0.79 0.02 -0.19 0.00 0.37 0.00 0.00 40.66 41.66 3ghg h LEU 168 CO 0.01 0.11 -0.23 -0.09 -0.34 0.00 0.00 178.44 177.91 3ghg h ARG 169 N -0.48 0.00 -0.98 1.25 2.43 -1.21 0.73 114.38 116.12 3ghg h ARG 169 Ca -0.01 -0.00 0.35 0.00 -0.81 0.00 0.00 59.98 59.50 3ghg h ARG 169 Cb 0.09 -0.00 -0.17 0.00 -0.42 0.00 0.00 29.97 29.47 3ghg h ARG 169 CO 0.02 0.00 0.44 1.03 -1.51 0.00 0.00 179.97 179.94 3ghg h SER 170 N 0.00 0.22 0.01 -3.80 0.87 -1.66 -1.33 113.55 107.86 3ghg h SER 170 Ca 0.49 0.23 -0.00 0.00 -1.23 0.00 0.00 61.79 61.28 3ghg h SER 170 Cb 0.77 0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.99 3ghg h SER 170 CO -1.02 -0.30 -0.00 -0.29 -0.53 0.00 0.00 176.83 174.69 3ghg h ILE 171 N 0.13 1.63 0.00 2.23 2.10 0.34 -1.50 117.51 122.43 3ghg h ILE 171 Ca 0.74 -2.03 -0.00 0.00 1.08 0.00 0.00 64.86 64.66 3ghg h ILE 171 Cb 1.79 2.98 0.00 0.00 -1.09 0.00 0.00 36.82 40.49 3ghg h ILE 171 CO -0.73 0.51 -0.00 -0.07 -1.08 0.00 0.00 178.15 176.78 3ghg h LEU 172 N -0.89 -0.00 -0.99 2.19 4.07 -1.31 0.67 115.31 119.05 3ghg h LEU 172 Ca -0.00 -0.03 0.27 0.00 0.08 0.00 0.00 57.88 58.20 3ghg h LEU 172 Cb 0.85 0.00 -0.18 0.00 1.08 0.00 0.00 40.66 42.41 3ghg h LEU 172 CO 0.00 0.03 0.01 1.21 -1.08 0.00 0.00 178.44 178.61 3ghg n GLU 173 N -5.08 -0.08 0.08 1.13 2.13 -0.54 -0.72 120.64 117.55 3ghg n GLU 173 Ca -0.07 1.49 -0.13 0.00 0.66 0.00 0.00 57.16 59.10 3ghg n GLU 173 Cb 0.04 -2.36 -0.06 0.00 0.27 0.00 0.00 31.44 29.34 3ghg n GLU 173 CO 0.00 0.00 0.00 -0.97 -0.41 0.00 0.00 177.13 175.75 3ghg h ASN 174 N 0.00 0.49 1.22 4.31 -0.73 0.55 -3.20 115.58 118.23 3ghg h ASN 174 Ca 0.60 -0.42 -0.05 0.00 1.87 0.00 0.00 56.30 58.30 3ghg h ASN 174 Cb 1.22 -0.15 -0.01 0.00 0.27 0.00 0.00 38.32 39.65 3ghg h ASN 174 CO -0.94 1.23 -0.24 -0.07 -0.37 0.00 0.00 177.43 177.04 3ghg h LEU 175 N 0.19 0.00 -1.45 0.34 3.38 0.84 -2.62 115.31 116.00 3ghg h LEU 175 Ca -0.09 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 3ghg h LEU 175 Cb 1.64 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.38 3ghg h LEU 175 CO 0.17 0.24 -0.28 -0.09 0.09 0.00 0.00 178.44 178.57 3ghg h ARG 176 N 0.00 0.00 0.00 1.13 2.43 -0.92 0.42 114.38 117.44 3ghg h ARG 176 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3ghg h ARG 176 Cb 0.92 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.47 3ghg h ARG 176 CO 0.03 0.28 -0.64 0.66 -1.51 0.00 0.00 179.97 178.78 3ghg h SER 177 N 0.00 0.00 0.00 -3.80 4.64 -1.48 -3.18 113.55 109.73 3ghg h SER 177 Ca -0.00 -0.19 -0.16 0.00 -0.47 0.00 0.00 61.79 60.97 3ghg h SER 177 Cb 0.54 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 3ghg h SER 177 CO 0.04 0.09 -0.96 0.11 -0.87 0.00 0.00 176.83 175.23 3ghg h LYS 178 N 0.00 0.00 -0.31 4.77 1.79 -1.13 -3.23 116.57 118.46 3ghg h LYS 178 Ca 0.00 0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.50 3ghg h LYS 178 Cb 0.78 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.39 3ghg h LYS 178 CO 0.00 0.81 -0.18 1.51 -1.08 0.00 0.00 179.45 180.51 3ghg n ILE 179 N -4.49 -0.21 0.26 1.86 0.00 0.10 -1.50 119.36 115.37 3ghg n ILE 179 Ca -0.25 1.59 0.10 0.00 0.00 0.00 0.00 62.75 64.19 3ghg n ILE 179 Cb 0.57 -2.05 0.67 0.00 0.00 0.00 0.00 39.64 38.84 3ghg n ILE 179 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 176.55 176.61 3ghg h GLN 180 N 0.00 0.00 0.00 9.51 -0.00 -1.70 0.21 115.11 123.13 3ghg h GLN 180 Ca 0.05 0.00 -0.15 0.00 -0.00 0.00 0.00 58.65 58.55 3ghg h GLN 180 Cb 0.13 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 27.59 3ghg h GLN 180 CO -0.29 0.09 -0.71 1.57 -0.00 0.00 0.00 178.83 179.49 3ghg h LYS 181 N 0.00 0.00 0.08 0.06 5.09 -1.40 -1.52 116.57 118.89 3ghg h LYS 181 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 60.65 60.73 3ghg h LYS 181 Cb 0.19 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.52 3ghg h LYS 181 CO 0.01 0.67 -0.04 -0.07 -2.09 0.00 0.00 179.45 177.93 3ghg h LEU 182 N 0.00 -0.10 -1.01 7.07 4.07 0.31 0.37 115.31 126.03 3ghg h LEU 182 Ca -0.01 -0.36 0.26 0.00 0.08 0.00 0.00 57.88 57.85 3ghg h LEU 182 Cb 1.53 0.02 -0.13 0.00 1.08 0.00 0.00 40.66 43.17 3ghg h LEU 182 CO 0.09 0.32 0.59 -0.08 -1.08 0.00 0.00 178.44 178.28 3ghg h GLU 183 N -0.53 0.51 0.01 1.13 4.81 -0.59 0.81 114.58 120.74 3ghg h GLU 183 Ca -0.01 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 3ghg h GLU 183 Cb 0.45 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.71 3ghg h GLU 183 CO 0.02 0.34 -0.01 0.77 -0.73 0.00 0.00 179.01 179.40 3ghg h SER 184 N 0.53 -0.02 -0.57 1.04 0.02 -1.24 -3.11 113.55 110.21 3ghg h SER 184 Ca 0.66 0.00 0.23 0.00 -0.84 0.00 0.00 61.79 61.84 3ghg h SER 184 Cb 1.32 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.76 3ghg h SER 184 CO -0.50 0.00 0.26 0.47 -1.14 0.00 0.00 176.83 175.92 3ghg n ASP 185 N -2.12 0.16 0.27 3.07 10.43 0.13 0.05 116.55 128.54 3ghg n ASP 185 Ca -0.00 0.94 -0.15 0.00 2.57 0.00 0.00 54.79 58.16 3ghg n ASP 185 Cb 0.01 -0.44 -0.08 0.00 1.84 0.00 0.00 41.12 42.45 3ghg n ASP 185 CO 0.00 0.00 0.00 0.58 -1.07 0.00 0.00 177.20 176.71 3ghg h VAL 186 N 0.00 0.38 0.00 2.53 2.07 -0.99 -3.10 116.25 117.14 3ghg h VAL 186 Ca 0.46 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.60 3ghg h VAL 186 Cb 1.19 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 3ghg h VAL 186 CO -0.45 0.05 0.00 -1.20 0.02 0.00 0.00 177.57 175.99 3ghg n SER 187 N -5.29 0.00 0.05 0.57 7.64 0.11 0.45 113.62 117.14 3ghg n SER 187 Ca -0.11 0.33 -0.09 0.00 1.01 0.00 0.00 58.87 60.00 3ghg n SER 187 Cb 0.32 -0.36 0.04 0.00 -1.01 0.00 0.00 64.21 63.19 3ghg n SER 187 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ghg h ALA 188 N 2.18 0.63 0.19 -0.43 0.00 -1.23 -3.22 119.26 117.37 3ghg h ALA 188 Ca 0.00 -0.60 -0.35 0.00 0.00 0.00 0.00 54.91 53.96 3ghg h ALA 188 Cb 0.05 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.79 3ghg h ALA 188 CO 0.00 0.76 -1.73 0.37 0.00 0.00 0.00 179.25 178.65 3ghg h GLN 189 N 0.27 0.40 -0.95 0.00 5.75 -0.03 -2.77 115.11 117.77 3ghg h GLN 189 Ca -0.03 -0.68 0.30 0.00 -0.15 0.00 0.00 58.65 58.09 3ghg h GLN 189 Cb 1.28 0.25 -0.16 0.00 1.07 0.00 0.00 27.48 29.92 3ghg h GLN 189 CO 0.12 1.32 0.30 0.52 -2.65 0.00 0.00 178.83 178.43 3ghg h MET 190 N 0.11 0.12 -0.06 1.69 2.86 -1.50 0.21 114.93 118.36 3ghg h MET 190 Ca -0.34 -0.01 -0.18 0.00 -2.06 0.00 0.00 59.70 57.11 3ghg h MET 190 Cb 2.10 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 33.73 3ghg h MET 190 CO 0.18 0.08 -0.75 1.49 1.06 0.00 0.00 176.91 178.98 3ghg h GLU 191 N 0.13 0.35 0.00 1.72 4.57 -1.54 -2.42 114.58 117.39 3ghg h GLU 191 Ca 0.66 -0.30 0.00 0.00 -1.18 0.00 0.00 59.36 58.54 3ghg h GLU 191 Cb 1.48 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 30.13 3ghg h GLU 191 CO -0.75 0.95 0.00 1.88 -1.18 0.00 0.00 179.01 179.91 3ghg h TYR 192 N 0.24 0.00 0.00 0.92 0.05 -0.72 -3.02 116.97 114.44 3ghg h TYR 192 Ca -0.03 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.75 3ghg h TYR 192 Cb 1.33 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.07 3ghg h TYR 192 CO 0.04 0.00 -0.43 0.00 -1.05 0.00 0.00 178.16 176.72 3ghg h ARG 194 N 0.00 -0.44 -4.96 0.00 3.08 -1.37 -3.40 114.38 107.30 3ghg h ARG 194 Ca 0.00 0.03 -0.63 0.00 0.07 0.00 0.00 59.98 59.45 3ghg h ARG 194 Cb 0.55 0.10 -0.16 0.00 0.08 0.00 0.00 29.97 30.53 3ghg h ARG 194 CO 0.00 -0.29 -0.51 0.95 -1.07 0.00 0.00 179.97 179.04 3ghg s THR 195 N -5.92 5.32 0.64 2.04 -4.23 -1.24 -5.09 115.64 107.16 3ghg s THR 195 Ca -0.15 0.18 -0.09 0.00 -1.18 0.00 0.00 61.69 60.45 3ghg s THR 195 Cb 0.10 -3.52 0.01 0.00 1.34 0.00 0.00 72.50 70.43 3ghg s THR 195 CO 0.65 0.28 0.99 -2.16 -0.54 0.00 0.00 174.62 173.84 3ghg s PRO 196 N 1.56 2.90 0.42 3.99 0.04 -1.26 -5.00 135.00 137.64 3ghg s PRO 196 Ca 0.07 0.22 -0.19 0.00 0.04 0.00 0.00 61.00 61.14 3ghg s PRO 196 Cb -0.15 -2.15 -0.10 0.00 0.04 0.00 0.00 34.50 32.13 3ghg s PRO 196 CO 0.09 -0.85 0.90 0.00 0.04 0.00 0.00 177.00 177.18 3ghg s THR 198 N -2.21 0.19 0.33 0.00 -4.23 -1.26 -5.16 115.64 103.29 3ghg s THR 198 Ca 0.59 -0.72 0.10 0.00 -1.18 0.00 0.00 61.69 60.49 3ghg s THR 198 Cb -0.09 -0.28 -0.06 0.00 1.34 0.00 0.00 72.50 73.41 3ghg s THR 198 CO 0.17 -0.34 -0.11 0.68 -0.54 0.00 0.00 174.62 174.49 3ghg s VAL 199 N -1.07 2.38 -0.19 2.29 -7.23 -1.26 -4.99 120.40 110.33 3ghg s VAL 199 Ca -0.11 -2.22 -0.05 0.00 -1.81 0.00 0.00 61.98 57.79 3ghg s VAL 199 Cb -0.07 -2.58 0.07 0.00 0.56 0.00 0.00 36.38 34.35 3ghg s VAL 199 CO -0.00 -0.26 0.09 -0.44 -0.31 0.00 0.00 175.10 174.18 3ghg s SER 200 N -3.60 2.58 -0.68 4.85 0.01 -1.26 -5.06 113.70 110.55 3ghg s SER 200 Ca 0.32 -0.73 0.05 0.00 1.31 0.00 0.00 55.95 56.90 3ghg s SER 200 Cb 0.00 -0.31 0.20 0.00 0.21 0.00 0.00 66.02 66.12 3ghg s SER 200 CO 0.17 -0.36 0.58 0.00 0.41 0.00 0.00 173.24 174.04 3ghg n ASN 202 N 1.61 0.78 -4.73 0.00 3.02 -1.26 -4.86 115.26 109.82 3ghg n ASN 202 Ca 0.23 1.17 -0.41 0.00 -0.03 0.00 0.00 54.58 55.55 3ghg n ASN 202 Cb 0.37 -0.91 -0.04 0.00 -0.61 0.00 0.00 39.78 38.60 3ghg n ASN 202 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3ghg s ILE 203 N 1.83 4.01 0.35 2.41 1.09 -1.26 -4.76 121.20 124.87 3ghg s ILE 203 Ca 0.99 1.68 -0.26 0.00 -1.10 0.00 0.00 60.65 61.96 3ghg s ILE 203 Cb -1.39 -4.07 -0.12 0.00 -1.06 0.00 0.00 42.46 35.81 3ghg s ILE 203 CO 0.72 0.26 1.00 -2.65 -0.10 0.00 0.00 174.94 174.17 3ghg n PRO 204 N 2.65 1.37 -0.05 2.79 -0.02 -1.26 -4.94 135.00 135.54 3ghg n PRO 204 Ca 0.03 0.49 0.06 0.00 -2.02 0.00 0.00 63.50 62.06 3ghg n PRO 204 Cb 0.47 -1.94 0.27 0.00 -0.02 0.00 0.00 33.50 32.27 3ghg n PRO 204 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3ghg n VAL 205 N -0.12 0.13 -4.35 -1.45 0.31 -1.26 -4.72 118.33 106.88 3ghg n VAL 205 Ca 0.09 -0.16 -0.28 0.00 -0.01 0.00 0.00 64.34 63.98 3ghg n VAL 205 Cb 0.36 0.03 -0.12 0.00 -0.91 0.00 0.00 33.84 33.20 3ghg n VAL 205 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3ghg s VAL 206 N -1.87 2.62 0.08 2.52 0.11 -1.26 -5.13 120.40 117.47 3ghg s VAL 206 Ca 0.19 -1.71 -0.27 0.00 -2.93 0.00 0.00 61.98 57.26 3ghg s VAL 206 Cb 0.09 -2.21 0.08 0.00 -1.53 0.00 0.00 36.38 32.82 3ghg s VAL 206 CO 0.14 0.03 1.02 -0.55 -3.33 0.00 0.00 175.10 172.41 3ghg s SER 207 N -2.31 -0.19 0.00 3.54 0.15 -1.26 -4.46 113.70 109.17 3ghg s SER 207 Ca 0.18 -0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.57 3ghg s SER 207 Cb -0.10 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 3ghg s SER 207 CO 0.09 -0.71 0.00 0.61 1.20 0.00 0.00 173.24 174.43 3ghg n GLY 208 N -0.42 0.98 0.20 9.45 0.00 -1.26 -4.79 105.19 109.35 3ghg n GLY 208 Ca -0.07 -0.51 0.06 0.00 0.00 0.00 0.00 46.02 45.50 3ghg n GLY 208 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ghg h LYS 209 N 0.00 0.00 0.00 1.61 6.56 -1.93 0.11 116.57 122.92 3ghg h LYS 209 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 3ghg h LYS 209 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 3ghg h LYS 209 CO 0.00 0.35 0.00 -0.85 -2.06 0.00 0.00 179.45 176.89 3ghg n GLU 210 N -3.57 0.00 0.09 3.15 -0.00 -1.26 -3.06 120.64 115.99 3ghg n GLU 210 Ca -0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.16 57.24 3ghg n GLU 210 Cb 0.48 0.00 0.40 0.00 -0.00 0.00 0.00 31.44 32.32 3ghg n GLU 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3ghg n GLU 212 N -1.98 0.00 -0.14 0.00 4.07 -1.22 -2.48 120.64 118.88 3ghg n GLU 212 Ca 0.01 0.35 0.08 0.00 -0.06 0.00 0.00 57.16 57.54 3ghg n GLU 212 Cb 0.13 -0.84 0.15 0.00 -0.06 0.00 0.00 31.44 30.81 3ghg n GLU 212 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 3ghg n GLU 213 N -1.62 -0.03 -0.10 5.31 0.00 -1.16 0.15 120.64 123.19 3ghg n GLU 213 Ca 0.00 0.62 -0.12 0.00 0.00 0.00 0.00 57.16 57.65 3ghg n GLU 213 Cb 0.00 -1.00 -0.04 0.00 0.00 0.00 0.00 31.44 30.40 3ghg n GLU 213 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 3ghg h ILE 214 N 0.00 1.29 -0.32 6.31 2.04 -1.26 -2.46 117.51 123.12 3ghg h ILE 214 Ca 0.27 -1.28 -0.07 0.00 1.00 0.00 0.00 64.86 64.79 3ghg h ILE 214 Cb 0.60 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 38.14 3ghg h ILE 214 CO -0.38 0.41 -0.10 -0.29 0.00 0.00 0.00 178.15 177.79 3ghg h ILE 215 N 0.40 1.23 -0.42 -0.67 2.10 0.17 -1.81 117.51 118.52 3ghg h ILE 215 Ca 0.07 -0.99 -0.02 0.00 1.08 0.00 0.00 64.86 64.99 3ghg h ILE 215 Cb 0.70 1.10 -0.02 0.00 -1.09 0.00 0.00 36.82 37.51 3ghg h ILE 215 CO 0.05 0.33 0.15 0.03 -1.08 0.00 0.00 178.15 177.63 3ghg h ARG 216 N 0.49 0.59 -0.00 2.19 3.08 -0.93 0.20 114.38 120.01 3ghg h ARG 216 Ca 0.09 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3ghg h ARG 216 Cb 0.47 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.41 3ghg h ARG 216 CO 0.03 0.50 0.00 1.63 -1.07 0.00 0.00 179.97 181.06 3ghg n LYS 217 N -4.36 1.00 -1.67 0.04 5.02 -0.72 -4.89 118.16 112.58 3ghg n LYS 217 Ca 0.03 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 3ghg n LYS 217 Cb 0.15 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 3ghg n LYS 217 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ghg n GLY 218 N 0.79 0.63 3.28 0.72 0.00 0.71 -5.06 105.19 106.27 3ghg n GLY 218 Ca 0.14 -0.40 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 3ghg n GLY 218 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ghg s GLY 219 N -2.88 1.53 -0.31 -0.02 0.00 -1.13 -5.02 107.32 99.48 3ghg s GLY 219 Ca 0.00 -1.08 0.14 0.00 0.00 0.00 0.00 44.72 43.78 3ghg s GLY 219 CO 0.00 0.16 1.12 -1.84 0.00 0.00 0.00 173.10 172.54 3ghg n GLU 220 N 4.29 2.58 -3.84 2.90 0.28 -1.26 -4.24 120.64 121.35 3ghg n GLU 220 Ca -0.19 -3.86 -0.12 0.00 -0.16 0.00 0.00 57.16 52.83 3ghg n GLU 220 Cb 0.51 -1.89 -0.12 0.00 1.43 0.00 0.00 31.44 31.37 3ghg n GLU 220 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 3ghg s THR 221 N -4.25 0.02 -0.51 3.84 -4.23 -1.26 -4.99 115.64 104.27 3ghg s THR 221 Ca 0.39 -0.19 -0.27 0.00 -1.18 0.00 0.00 61.69 60.43 3ghg s THR 221 Cb 0.38 -0.27 0.03 0.00 1.34 0.00 0.00 72.50 73.98 3ghg s THR 221 CO -0.02 -0.11 1.06 -0.44 -0.54 0.00 0.00 174.62 174.57 3ghg s SER 222 N -0.32 6.51 0.22 3.99 0.01 -1.26 -4.66 113.70 118.19 3ghg s SER 222 Ca -0.04 0.17 -0.05 0.00 1.31 0.00 0.00 55.95 57.34 3ghg s SER 222 Cb -0.03 -2.50 0.02 0.00 0.21 0.00 0.00 66.02 63.72 3ghg s SER 222 CO 0.01 -1.24 0.37 -1.84 0.41 0.00 0.00 173.24 170.95 3ghg n GLU 223 N 7.71 0.54 -3.07 12.44 0.28 -1.20 -4.60 120.64 132.74 3ghg n GLU 223 Ca 0.08 -1.47 -0.40 0.00 -0.16 0.00 0.00 57.16 55.21 3ghg n GLU 223 Cb 0.49 1.60 -0.05 0.00 1.43 0.00 0.00 31.44 34.91 3ghg n GLU 223 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 177.13 178.38 3ghg s MET 224 N -2.26 4.40 0.19 3.44 -2.45 -0.69 -2.02 119.30 119.91 3ghg s MET 224 Ca 0.13 0.82 0.08 0.00 -1.25 0.00 0.00 55.69 55.47 3ghg s MET 224 Cb -0.02 -3.46 -0.05 0.00 1.25 0.00 0.00 34.83 32.55 3ghg s MET 224 CO 0.10 0.02 -0.15 0.71 1.05 0.00 0.00 175.02 176.75 3ghg s TYR 225 N 0.96 1.73 0.20 4.11 2.02 -1.03 -4.42 117.35 120.92 3ghg s TYR 225 Ca 0.36 -0.55 -0.12 0.00 -0.37 0.00 0.00 57.07 56.39 3ghg s TYR 225 Cb -0.17 -0.82 -0.07 0.00 -0.40 0.00 0.00 41.96 40.50 3ghg s TYR 225 CO 0.16 0.35 0.57 -1.17 -1.57 0.00 0.00 175.55 173.89 3ghg s LEU 226 N -3.14 4.23 0.11 -1.29 2.96 -1.26 -2.22 118.68 118.07 3ghg s LEU 226 Ca 0.20 1.02 -0.11 0.00 -0.22 0.00 0.00 54.13 55.03 3ghg s LEU 226 Cb -0.02 -3.55 0.01 0.00 0.50 0.00 0.00 46.19 43.13 3ghg s LEU 226 CO 0.07 -0.01 0.26 0.27 -1.32 0.00 0.00 176.35 175.62 3ghg s ILE 227 N -1.68 0.11 -0.40 6.68 -4.36 0.11 -4.15 121.20 117.51 3ghg s ILE 227 Ca 0.44 -1.03 0.05 0.00 -0.26 0.00 0.00 60.65 59.85 3ghg s ILE 227 Cb -0.13 -1.35 0.17 0.00 1.25 0.00 0.00 42.46 42.40 3ghg s ILE 227 CO 0.20 -0.51 0.51 -1.58 0.24 0.00 0.00 174.94 173.79 3ghg s GLN 228 N -3.86 0.77 0.54 0.37 0.74 0.38 -1.70 119.66 116.89 3ghg s GLN 228 Ca 0.06 -0.72 0.36 0.00 0.05 0.00 0.00 55.36 55.11 3ghg s GLN 228 Cb 0.04 -0.38 1.77 0.00 1.10 0.00 0.00 33.01 35.54 3ghg s GLN 228 CO -0.10 -1.22 2.08 -1.35 -0.55 0.00 0.00 175.29 174.15 3ghg h PRO 229 N 6.77 0.00 -3.14 1.67 0.11 -1.73 -3.35 132.00 132.33 3ghg h PRO 229 Ca 0.06 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.02 3ghg h PRO 229 Cb 1.10 0.00 -0.24 0.00 0.11 0.00 0.00 31.00 31.97 3ghg h PRO 229 CO 0.15 0.00 -0.41 0.34 -0.21 0.00 0.00 178.00 177.87 3ghg s ASP 230 N -5.04 -0.23 0.12 -2.05 -1.08 -1.26 -4.97 116.67 102.16 3ghg s ASP 230 Ca -0.02 0.39 0.24 0.00 -0.52 0.00 0.00 52.55 52.65 3ghg s ASP 230 Cb 0.10 0.47 0.93 0.00 -1.46 0.00 0.00 42.92 42.96 3ghg s ASP 230 CO 0.42 -0.16 1.74 -1.54 0.52 0.00 0.00 175.17 176.14 3ghg n SER 231 N 2.59 0.40 -2.49 -0.34 3.41 -1.26 -2.97 113.62 112.96 3ghg n SER 231 Ca -0.15 0.56 -0.27 0.00 -0.26 0.00 0.00 58.87 58.75 3ghg n SER 231 Cb 0.58 -0.66 -0.05 0.00 -0.26 0.00 0.00 64.21 63.82 3ghg n SER 231 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3ghg n SER 232 N -1.90 6.55 -3.64 4.04 7.64 -1.26 -4.91 113.62 120.13 3ghg n SER 232 Ca 0.05 -3.24 -0.05 0.00 1.01 0.00 0.00 58.87 56.63 3ghg n SER 232 Cb 0.31 -1.21 -0.07 0.00 -1.01 0.00 0.00 64.21 62.23 3ghg n SER 232 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3ghg s VAL 233 N -2.45 0.00 0.33 0.44 0.11 -1.16 -5.14 120.40 112.54 3ghg s VAL 233 Ca 0.57 0.00 -0.26 0.00 -2.93 0.00 0.00 61.98 59.36 3ghg s VAL 233 Cb 0.38 -1.00 -0.10 0.00 -1.53 0.00 0.00 36.38 34.14 3ghg s VAL 233 CO -0.22 0.00 0.98 -1.59 -3.33 0.00 0.00 175.10 170.94 3ghg s LYS 234 N 0.33 4.50 0.16 1.54 -2.85 -1.26 -4.82 119.74 117.34 3ghg s LYS 234 Ca 0.03 1.41 -0.34 0.00 -1.00 0.00 0.00 55.97 56.07 3ghg s LYS 234 Cb -0.05 -2.78 -0.14 0.00 -2.06 0.00 0.00 37.83 32.80 3ghg s LYS 234 CO -0.11 0.19 1.60 -2.30 0.10 0.00 0.00 175.35 174.82 3ghg n PRO 235 N 0.49 2.20 -4.68 1.78 -0.02 -1.26 -4.96 135.00 128.56 3ghg n PRO 235 Ca 0.02 0.79 -0.30 0.00 -2.02 0.00 0.00 63.50 61.99 3ghg n PRO 235 Cb 0.49 -2.57 -0.08 0.00 -0.02 0.00 0.00 33.50 31.32 3ghg n PRO 235 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 3ghg s TYR 236 N 1.01 1.92 -0.01 6.00 1.13 -0.69 -4.89 117.35 121.82 3ghg s TYR 236 Ca 0.79 -1.00 0.06 0.00 -1.41 0.00 0.00 57.07 55.50 3ghg s TYR 236 Cb -0.66 -1.51 -0.03 0.00 -1.10 0.00 0.00 41.96 38.66 3ghg s TYR 236 CO 0.38 0.12 -0.19 1.03 -2.51 0.00 0.00 175.55 174.38 3ghg s ARG 237 N -3.82 2.22 -0.22 -3.49 0.52 -1.26 0.08 118.95 112.99 3ghg s ARG 237 Ca 0.14 -0.87 -0.16 0.00 -0.52 0.00 0.00 55.73 54.32 3ghg s ARG 237 Cb 0.03 -2.21 0.06 0.00 0.52 0.00 0.00 34.95 33.35 3ghg s ARG 237 CO 0.08 0.57 0.55 0.08 0.02 0.00 0.00 175.30 176.60 3ghg s VAL 238 N -0.77 -0.01 0.11 3.52 1.01 -0.94 -4.98 120.40 118.34 3ghg s VAL 238 Ca 0.12 0.02 -0.31 0.00 0.00 0.00 0.00 61.98 61.82 3ghg s VAL 238 Cb -0.10 -0.78 -0.09 0.00 0.00 0.00 0.00 36.38 35.40 3ghg s VAL 238 CO 0.02 0.01 1.56 -0.47 0.00 0.00 0.00 175.10 176.21 3ghg s TYR 239 N 0.90 2.85 -0.13 5.22 6.14 -1.26 -2.47 117.35 128.60 3ghg s TYR 239 Ca -0.05 0.59 -0.17 0.00 0.64 0.00 0.00 57.07 58.08 3ghg s TYR 239 Cb -0.05 -3.88 -0.04 0.00 0.42 0.00 0.00 41.96 38.40 3ghg s TYR 239 CO -0.08 -3.33 0.41 0.00 0.64 0.00 0.00 175.55 173.20 3ghg s ASP 241 N 0.54 6.27 -0.06 0.00 3.68 0.22 -3.24 116.67 124.08 3ghg s ASP 241 Ca 0.23 -0.23 0.11 0.00 2.13 0.00 0.00 52.55 54.79 3ghg s ASP 241 Cb -0.14 -2.25 0.32 0.00 -1.45 0.00 0.00 42.92 39.39 3ghg s ASP 241 CO 0.08 -0.52 1.26 0.23 0.13 0.00 0.00 175.17 176.35 3ghg n MET 242 N 5.72 2.80 -0.02 4.34 2.81 -1.26 -1.49 117.12 130.01 3ghg n MET 242 Ca -0.06 -2.23 -0.06 0.00 -1.81 0.00 0.00 57.70 53.54 3ghg n MET 242 Cb 0.49 -1.41 -0.02 0.00 -0.71 0.00 0.00 33.22 31.57 3ghg n MET 242 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3ghg n ASN 243 N -0.06 0.63 -4.68 7.83 5.03 -1.26 -3.68 115.26 119.07 3ghg n ASN 243 Ca 0.13 0.10 -0.42 0.00 0.87 0.00 0.00 54.58 55.26 3ghg n ASN 243 Cb 0.55 -0.24 -0.03 0.00 -1.02 0.00 0.00 39.78 39.04 3ghg n ASN 243 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 3ghg s THR 244 N -2.14 4.27 -1.03 3.41 -4.23 -1.26 -3.43 115.64 111.23 3ghg s THR 244 Ca -0.09 1.59 -0.08 0.00 -1.18 0.00 0.00 61.69 61.93 3ghg s THR 244 Cb 0.03 -4.02 -0.05 0.00 1.34 0.00 0.00 72.50 69.80 3ghg s THR 244 CO 0.11 -0.02 0.88 -0.62 -0.54 0.00 0.00 174.62 174.43 3ghg n GLU 245 N 5.37 -1.98 -1.61 3.99 1.02 -1.26 -2.89 120.64 123.28 3ghg n GLU 245 Ca 0.11 0.87 -0.18 0.00 -0.02 0.00 0.00 57.16 57.94 3ghg n GLU 245 Cb 0.46 -5.53 -0.07 0.00 -0.02 0.00 0.00 31.44 26.28 3ghg n GLU 245 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3ghg n ASN 246 N -2.99 -5.22 -0.37 1.62 3.02 -1.22 -4.81 115.26 105.29 3ghg n ASN 246 Ca -0.07 0.41 0.00 0.00 -0.03 0.00 0.00 54.58 54.89 3ghg n ASN 246 Cb 0.60 -4.33 0.00 0.00 -0.61 0.00 0.00 39.78 35.45 3ghg n ASN 246 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ghg n GLY 247 N -0.75 0.23 1.09 7.41 0.00 -1.14 -4.88 105.19 107.14 3ghg n GLY 247 Ca -0.19 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 44.96 3ghg n GLY 247 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ghg n GLY 248 N 0.00 0.74 3.48 -0.02 0.00 -1.10 -4.89 105.19 103.39 3ghg n GLY 248 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3ghg n GLY 248 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3ghg s TRP 249 N -2.05 3.22 -0.15 1.61 0.52 -0.56 -3.40 118.94 118.13 3ghg s TRP 249 Ca 0.00 -0.45 -0.28 0.00 0.02 0.00 0.00 56.10 55.39 3ghg s TRP 249 Cb 0.00 -2.46 -0.01 0.00 -1.15 0.00 0.00 33.47 29.85 3ghg s TRP 249 CO 0.00 -0.46 0.95 0.99 0.02 0.00 0.00 176.95 178.45 3ghg s THR 250 N 1.67 4.81 -0.08 2.01 2.01 -0.21 0.71 115.64 126.55 3ghg s THR 250 Ca 0.05 1.89 -0.28 0.00 0.31 0.00 0.00 61.69 63.66 3ghg s THR 250 Cb -0.18 -4.25 -0.02 0.00 0.01 0.00 0.00 72.50 68.06 3ghg s THR 250 CO 0.09 -0.01 0.92 -0.69 -0.69 0.00 0.00 174.62 174.24 3ghg s VAL 251 N 2.22 4.87 -0.20 3.82 1.01 -0.53 -1.19 120.40 130.40 3ghg s VAL 251 Ca 0.44 1.89 0.07 0.00 0.00 0.00 0.00 61.98 64.38 3ghg s VAL 251 Cb -0.17 -4.25 -0.17 0.00 0.00 0.00 0.00 36.38 31.80 3ghg s VAL 251 CO 0.14 0.09 -0.09 -0.38 0.00 0.00 0.00 175.10 174.86 3ghg n ILE 252 N 4.26 1.20 -3.66 2.22 5.41 0.00 -4.60 119.36 124.19 3ghg n ILE 252 Ca 0.06 -0.57 -0.15 0.00 1.00 0.00 0.00 62.75 63.09 3ghg n ILE 252 Cb 0.50 -0.99 -0.08 0.00 -0.71 0.00 0.00 39.64 38.36 3ghg n ILE 252 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 3ghg s GLN 253 N -2.42 0.79 -0.26 0.38 -0.44 -1.10 -1.47 119.66 115.13 3ghg s GLN 253 Ca -0.21 0.20 -0.14 0.00 -2.50 0.00 0.00 55.36 52.70 3ghg s GLN 253 Cb 0.06 0.37 0.08 0.00 -1.64 0.00 0.00 33.01 31.88 3ghg s GLN 253 CO 0.57 -0.21 0.63 1.21 0.50 0.00 0.00 175.29 178.00 3ghg s ASN 254 N -0.87 -0.87 -0.05 6.67 2.47 -0.11 -0.67 114.94 121.50 3ghg s ASN 254 Ca -0.09 1.40 0.02 0.00 0.42 0.00 0.00 52.86 54.61 3ghg s ASN 254 Cb -0.03 1.32 0.02 0.00 -1.45 0.00 0.00 41.25 41.11 3ghg s ASN 254 CO 0.05 -0.23 -0.08 -0.13 -3.72 0.00 0.00 177.10 172.99 3ghg s ARG 255 N 1.67 1.24 0.00 0.43 1.81 0.25 -2.41 118.95 121.94 3ghg s ARG 255 Ca -0.10 -0.25 0.00 0.00 -1.72 0.00 0.00 55.73 53.66 3ghg s ARG 255 Cb -0.06 -1.10 0.00 0.00 -0.45 0.00 0.00 34.95 33.34 3ghg s ARG 255 CO -0.19 -0.03 0.00 0.00 -0.68 0.00 0.00 175.30 174.41 3ghg n GLN 256 N 3.92 0.00 -0.92 3.54 10.64 -1.25 -1.06 117.38 132.25 3ghg n GLN 256 Ca -0.24 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 54.93 3ghg n GLN 256 Cb 0.51 -0.07 0.00 0.00 -0.86 0.00 0.00 30.24 29.82 3ghg n GLN 256 CO 0.00 0.00 0.00 -0.40 -1.83 0.00 0.00 177.06 174.83 3ghg n ASP 257 N 0.00 0.00 0.09 2.61 5.75 -1.26 -4.78 116.55 118.96 3ghg n ASP 257 Ca 0.00 -0.86 0.04 0.00 -0.01 0.00 0.00 54.79 53.96 3ghg n ASP 257 Cb 0.11 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.18 3ghg n ASP 257 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3ghg h GLY 258 N 0.00 0.00 0.00 6.12 0.00 -1.96 -3.43 103.07 103.80 3ghg h GLY 258 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3ghg h GLY 258 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 3ghg n SER 259 N -2.94 0.00 -4.15 0.19 3.41 -1.26 -4.46 113.62 104.41 3ghg n SER 259 Ca -0.04 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.27 3ghg n SER 259 Cb 0.73 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 64.51 3ghg n SER 259 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3ghg s VAL 260 N -3.34 1.81 -0.09 -3.33 1.01 -1.26 -5.07 120.40 110.12 3ghg s VAL 260 Ca 0.00 -0.86 -0.30 0.00 0.00 0.00 0.00 61.98 60.83 3ghg s VAL 260 Cb 0.00 -1.60 -0.02 0.00 0.00 0.00 0.00 36.38 34.76 3ghg s VAL 260 CO 0.00 0.50 1.11 -0.62 0.00 0.00 0.00 175.10 176.09 3ghg s ASP 261 N 0.62 7.14 0.00 3.32 2.15 -1.26 -4.93 116.67 123.70 3ghg s ASP 261 Ca -0.13 1.66 0.18 0.00 0.43 0.00 0.00 52.55 54.69 3ghg s ASP 261 Cb -0.17 -2.56 0.03 0.00 -0.30 0.00 0.00 42.92 39.93 3ghg s ASP 261 CO 0.04 -0.54 0.97 0.49 -0.17 0.00 0.00 175.17 175.96 3ghg n PHE 262 N 5.23 0.00 -2.73 -5.34 3.01 -1.26 -4.67 117.46 111.71 3ghg n PHE 262 Ca 0.10 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.13 3ghg n PHE 262 Cb 0.47 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.94 3ghg n PHE 262 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3ghg n GLY 263 N 1.20 3.30 3.58 1.37 0.00 -1.24 -4.24 105.19 109.16 3ghg n GLY 263 Ca 0.08 -1.83 -0.26 0.00 0.00 0.00 0.00 46.02 44.01 3ghg n GLY 263 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ghg s ARG 264 N 2.35 1.90 0.88 1.61 0.52 -1.26 -5.04 118.95 119.90 3ghg s ARG 264 Ca 0.46 -1.96 -0.13 0.00 -0.52 0.00 0.00 55.73 53.58 3ghg s ARG 264 Cb 0.01 -1.72 0.13 0.00 0.52 0.00 0.00 34.95 33.89 3ghg s ARG 264 CO 0.02 0.08 1.20 0.15 0.02 0.00 0.00 175.30 176.77 3ghg s LYS 265 N -3.66 1.38 0.08 3.54 1.02 -1.26 -4.69 119.74 116.15 3ghg s LYS 265 Ca 0.34 0.03 -0.27 0.00 0.02 0.00 0.00 55.97 56.09 3ghg s LYS 265 Cb 0.04 -1.89 -0.12 0.00 -0.52 0.00 0.00 37.83 35.35 3ghg s LYS 265 CO 0.17 -1.98 1.43 2.35 -0.92 0.00 0.00 175.35 176.40 3ghg h TRP 266 N -1.34 -1.18 -0.42 3.18 2.91 -1.93 -2.69 115.95 114.49 3ghg h TRP 266 Ca -0.47 0.03 0.08 0.00 1.13 0.00 0.00 58.89 59.67 3ghg h TRP 266 Cb 1.31 0.50 -0.09 0.00 -0.51 0.00 0.00 29.16 30.36 3ghg h TRP 266 CO -0.11 -0.47 -0.30 0.22 -1.03 0.00 0.00 178.44 176.75 3ghg h ASP 267 N -0.60 -1.02 -0.74 2.65 3.58 -1.99 0.98 116.42 119.29 3ghg h ASP 267 Ca -0.01 0.19 0.16 0.00 0.42 0.00 0.00 57.03 57.79 3ghg h ASP 267 Cb 0.60 0.49 -0.11 0.00 1.72 0.00 0.00 39.33 42.02 3ghg h ASP 267 CO -0.20 -0.31 0.15 -0.65 -2.88 0.00 0.00 179.24 175.35 3ghg h PRO 268 N -0.22 0.23 0.00 0.28 0.11 -1.87 0.73 132.00 131.26 3ghg h PRO 268 Ca 0.18 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.27 3ghg h PRO 268 Cb 0.52 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.58 3ghg h PRO 268 CO -0.55 0.15 -0.04 1.88 -0.21 0.00 0.00 178.00 179.23 3ghg h TYR 269 N 0.24 0.00 0.00 0.65 0.05 -0.54 0.65 116.97 118.02 3ghg h TYR 269 Ca 0.41 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.97 3ghg h TYR 269 Cb 0.72 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.46 3ghg h TYR 269 CO -0.29 0.04 -0.94 -0.22 -1.05 0.00 0.00 178.16 175.70 3ghg h LYS 270 N 0.00 0.41 0.06 4.88 3.64 0.16 0.13 116.57 125.85 3ghg h LYS 270 Ca -0.00 -0.44 -0.28 0.00 -1.27 0.00 0.00 60.65 58.66 3ghg h LYS 270 Cb 0.09 0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 3ghg h LYS 270 CO 0.01 1.11 -1.41 1.96 -2.27 0.00 0.00 179.45 178.84 3ghg h GLN 271 N 0.23 0.13 0.00 1.90 1.08 -0.09 -2.25 115.11 116.11 3ghg h GLN 271 Ca -0.08 -0.22 0.00 0.00 -1.45 0.00 0.00 58.65 56.90 3ghg h GLN 271 Cb 1.58 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 29.09 3ghg h GLN 271 CO 0.16 0.95 0.00 0.41 -0.95 0.00 0.00 178.83 179.41 3ghg n GLY 272 N 1.55 1.73 3.83 3.46 0.00 0.22 -2.86 105.19 113.11 3ghg n GLY 272 Ca -0.12 -1.85 -0.08 0.00 0.00 0.00 0.00 46.02 43.98 3ghg n GLY 272 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3ghg s PHE 273 N -2.97 -0.03 0.00 1.61 -0.12 -0.07 -4.78 117.98 111.62 3ghg s PHE 273 Ca 0.00 -0.51 0.00 0.00 -0.05 0.00 0.00 56.93 56.37 3ghg s PHE 273 Cb 0.00 0.74 0.00 0.00 -0.63 0.00 0.00 43.02 43.13 3ghg s PHE 273 CO 0.00 -1.37 0.00 0.41 -0.05 0.00 0.00 175.22 174.21 3ghg n GLY 274 N -0.49 -0.36 3.31 1.99 0.00 -1.26 -2.11 105.19 106.28 3ghg n GLY 274 Ca -0.06 -1.45 -0.32 0.00 0.00 0.00 0.00 46.02 44.19 3ghg n GLY 274 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ghg s ASN 275 N -4.00 3.43 -0.04 1.61 0.01 -0.80 -4.99 114.94 110.16 3ghg s ASN 275 Ca 0.00 -0.44 -0.14 0.00 -0.71 0.00 0.00 52.86 51.57 3ghg s ASN 275 Cb 0.00 -1.17 -0.31 0.00 0.41 0.00 0.00 41.25 40.18 3ghg s ASN 275 CO 0.00 0.22 0.75 0.58 -1.51 0.00 0.00 177.10 177.14 3ghg h VAL 276 N 5.21 1.10 -3.14 1.60 2.07 -1.86 -3.24 116.25 117.98 3ghg h VAL 276 Ca -0.29 -2.54 0.02 0.00 0.82 0.00 0.00 66.70 64.71 3ghg h VAL 276 Cb 1.20 2.87 -0.05 0.00 -1.52 0.00 0.00 31.29 33.79 3ghg h VAL 276 CO 0.50 0.80 0.17 0.00 0.02 0.00 0.00 177.57 179.06 3ghg s ALA 277 N -2.55 -0.89 0.20 1.67 0.00 -1.26 -1.83 121.76 117.10 3ghg s ALA 277 Ca -0.15 -0.54 -0.14 0.00 0.00 0.00 0.00 51.96 51.14 3ghg s ALA 277 Cb 0.04 0.86 0.01 0.00 0.00 0.00 0.00 23.12 24.03 3ghg s ALA 277 CO 0.86 -0.99 0.44 0.95 0.00 0.00 0.00 175.76 177.02 3ghg s THR 278 N -3.56 0.03 0.20 0.00 -4.23 0.18 -4.74 115.64 103.52 3ghg s THR 278 Ca 0.14 -1.10 -0.30 0.00 -1.18 0.00 0.00 61.69 59.25 3ghg s THR 278 Cb -0.05 -1.79 -0.09 0.00 1.34 0.00 0.00 72.50 71.91 3ghg s THR 278 CO 0.09 -0.15 1.35 0.20 -0.54 0.00 0.00 174.62 175.56 3ghg s ASN 279 N -2.93 6.83 0.51 3.99 -0.87 -1.26 -3.27 114.94 117.94 3ghg s ASN 279 Ca 0.14 2.46 -0.19 0.00 -1.57 0.00 0.00 52.86 53.70 3ghg s ASN 279 Cb 0.00 -2.61 -0.08 0.00 -0.02 0.00 0.00 41.25 38.55 3ghg s ASN 279 CO 0.01 -0.58 1.01 -0.89 -2.57 0.00 0.00 177.10 174.08 3ghg s THR 280 N 0.16 4.06 0.00 1.60 2.01 -1.26 -4.84 115.64 117.38 3ghg s THR 280 Ca 0.58 1.15 0.00 0.00 0.31 0.00 0.00 61.69 63.73 3ghg s THR 280 Cb -0.38 -3.52 0.00 0.00 0.01 0.00 0.00 72.50 68.62 3ghg s THR 280 CO 0.39 -0.41 0.00 -0.90 -0.69 0.00 0.00 174.62 173.01 3ghg n ASP 281 N -1.28 0.00 -1.03 3.53 3.85 -1.26 0.20 116.55 120.56 3ghg n ASP 281 Ca 0.08 0.00 -0.13 0.00 -0.71 0.00 0.00 54.79 54.03 3ghg n ASP 281 Cb 0.53 0.00 -0.06 0.00 -1.35 0.00 0.00 41.12 40.25 3ghg n ASP 281 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3ghg n GLY 282 N 0.00 1.22 3.89 6.12 0.00 -1.26 -4.94 105.19 110.22 3ghg n GLY 282 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 3ghg n GLY 282 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ghg s LYS 283 N -3.04 3.53 0.00 1.61 -0.14 0.13 -4.99 119.74 116.84 3ghg s LYS 283 Ca 0.00 0.45 0.17 0.00 -1.36 0.00 0.00 55.97 55.23 3ghg s LYS 283 Cb 0.00 -2.23 0.62 0.00 -1.68 0.00 0.00 37.83 34.54 3ghg s LYS 283 CO 0.00 -0.41 1.46 0.27 -0.76 0.00 0.00 175.35 175.91 3ghg n ASN 284 N -2.51 1.63 -0.99 2.83 2.04 -1.26 -4.80 115.26 112.19 3ghg n ASN 284 Ca 0.03 -1.79 0.00 0.00 -0.44 0.00 0.00 54.58 52.38 3ghg n ASN 284 Cb 0.55 -0.14 0.00 0.00 -2.53 0.00 0.00 39.78 37.66 3ghg n ASN 284 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3ghg n TYR 285 N 0.32 -0.36 -3.82 -2.53 4.11 -1.26 -3.98 117.16 109.64 3ghg n TYR 285 Ca 0.14 0.00 -0.30 0.00 -0.00 0.00 0.00 57.90 57.74 3ghg n TYR 285 Cb 0.30 0.00 -0.15 0.00 -0.00 0.00 0.00 39.34 39.49 3ghg n TYR 285 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 3ghg n GLY 287 N 4.69 -1.02 3.67 0.00 0.00 -1.22 -1.70 105.19 109.61 3ghg n GLY 287 Ca -0.01 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 3ghg n GLY 287 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ghg s LEU 288 N -5.44 4.26 1.01 0.99 1.43 -1.20 -4.33 118.68 115.40 3ghg s LEU 288 Ca -0.08 1.94 -0.13 0.00 -1.03 0.00 0.00 54.13 54.83 3ghg s LEU 288 Cb 0.08 -3.55 0.19 0.00 0.03 0.00 0.00 46.19 42.94 3ghg s LEU 288 CO 0.84 -0.76 1.11 -2.16 0.23 0.00 0.00 176.35 175.61 3ghg s PRO 289 N 3.14 0.37 0.32 1.29 0.04 -1.26 0.52 135.00 139.41 3ghg s PRO 289 Ca 0.61 0.35 0.03 0.00 0.04 0.00 0.00 61.00 62.03 3ghg s PRO 289 Cb -0.27 -1.74 -0.05 0.00 0.04 0.00 0.00 34.50 32.47 3ghg s PRO 289 CO 0.22 -2.74 0.09 0.20 0.04 0.00 0.00 177.00 174.82 3ghg s GLY 290 N -3.69 2.07 -0.10 0.56 0.00 -0.76 -4.49 107.32 100.91 3ghg s GLY 290 Ca 0.66 -1.81 -0.30 0.00 0.00 0.00 0.00 44.72 43.27 3ghg s GLY 290 CO 0.56 -1.72 1.02 -0.54 0.00 0.00 0.00 173.10 172.42 3ghg s GLU 291 N -3.90 4.42 0.17 2.90 2.02 -1.22 -4.76 118.70 118.32 3ghg s GLU 291 Ca 0.34 1.41 -0.23 0.00 0.02 0.00 0.00 54.97 56.51 3ghg s GLU 291 Cb 0.07 -3.54 0.07 0.00 0.10 0.00 0.00 34.13 30.82 3ghg s GLU 291 CO 0.15 -0.33 0.61 1.52 0.02 0.00 0.00 175.26 177.24 3ghg s TYR 292 N 2.03 -0.51 -0.08 1.61 -0.85 -1.01 -1.90 117.35 116.65 3ghg s TYR 292 Ca 0.49 0.28 0.04 0.00 -0.52 0.00 0.00 57.07 57.36 3ghg s TYR 292 Cb -0.19 0.57 -0.01 0.00 0.38 0.00 0.00 41.96 42.71 3ghg s TYR 292 CO 0.18 -0.88 -0.21 -0.46 -1.52 0.00 0.00 175.55 172.67 3ghg s TRP 293 N -3.75 2.57 0.68 -3.49 -0.11 -0.89 -0.93 118.94 113.01 3ghg s TRP 293 Ca 0.02 -0.70 -0.11 0.00 1.22 0.00 0.00 56.10 56.53 3ghg s TRP 293 Cb -0.01 -1.68 -0.00 0.00 -1.50 0.00 0.00 33.47 30.28 3ghg s TRP 293 CO -0.11 -0.20 1.08 -1.17 -4.62 0.00 0.00 176.95 171.92 3ghg s LEU 294 N -0.03 3.00 0.60 5.86 2.96 -0.54 -0.89 118.68 129.64 3ghg s LEU 294 Ca -0.06 1.22 -0.18 0.00 -0.22 0.00 0.00 54.13 54.89 3ghg s LEU 294 Cb -0.15 -4.09 -0.05 0.00 0.50 0.00 0.00 46.19 42.40 3ghg s LEU 294 CO 0.05 -1.21 0.94 0.61 -1.32 0.00 0.00 176.35 175.42 3ghg n GLY 295 N -2.91 -0.38 0.00 7.98 0.00 -1.13 -4.25 105.19 104.49 3ghg n GLY 295 Ca 0.07 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3ghg n GLY 295 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ghg n ASN 296 N -0.72 0.00 0.29 1.61 5.03 0.45 -2.35 115.26 119.56 3ghg n ASN 296 Ca 0.14 0.95 0.15 0.00 0.87 0.00 0.00 54.58 56.69 3ghg n ASN 296 Cb 0.47 -0.45 0.86 0.00 -1.02 0.00 0.00 39.78 39.64 3ghg n ASN 296 CO 0.00 0.00 0.00 -2.24 -1.83 0.00 0.00 177.26 173.19 3ghg h ASP 297 N 0.00 0.00 -0.96 6.41 2.03 -1.85 3.34 116.42 125.39 3ghg h ASP 297 Ca 0.00 0.00 0.21 0.00 -0.73 0.00 0.00 57.03 56.51 3ghg h ASP 297 Cb 0.00 0.00 -0.08 0.00 -0.83 0.00 0.00 39.33 38.42 3ghg h ASP 297 CO 0.00 0.06 0.62 0.11 -1.03 0.00 0.00 179.24 178.99 3ghg h LYS 298 N 0.00 0.49 0.14 4.15 1.57 -1.77 -2.35 116.57 118.79 3ghg h LYS 298 Ca -0.00 -0.03 -0.32 0.00 -1.87 0.00 0.00 60.65 58.43 3ghg h LYS 298 Cb 0.17 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 3ghg h LYS 298 CO 0.01 0.32 -1.64 0.82 -0.57 0.00 0.00 179.45 178.39 3ghg h ILE 299 N 0.50 1.04 -0.08 1.86 2.04 0.65 -2.62 117.51 120.91 3ghg h ILE 299 Ca 0.52 -2.67 -0.02 0.00 1.00 0.00 0.00 64.86 63.70 3ghg h ILE 299 Cb 1.16 2.74 -0.00 0.00 -0.74 0.00 0.00 36.82 39.98 3ghg h ILE 299 CO -0.25 0.82 -0.02 0.77 0.00 0.00 0.00 178.15 179.47 3ghg h SER 300 N 0.08 0.16 -0.02 1.72 4.64 -1.19 0.39 113.55 119.32 3ghg h SER 300 Ca -0.29 -0.37 -0.05 0.00 -0.47 0.00 0.00 61.79 60.61 3ghg h SER 300 Cb 2.05 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 64.08 3ghg h SER 300 CO 0.16 0.49 -0.10 -0.61 -0.87 0.00 0.00 176.83 175.91 3ghg h GLN 301 N -0.18 0.27 0.51 4.77 -0.00 -1.55 1.17 115.11 120.11 3ghg h GLN 301 Ca 0.02 -0.06 -0.02 0.00 -0.00 0.00 0.00 58.65 58.60 3ghg h GLN 301 Cb 0.42 -0.04 -0.01 0.00 0.00 0.00 0.00 27.48 27.86 3ghg h GLN 301 CO 0.01 0.39 -0.36 -0.07 0.00 0.00 0.00 178.83 178.80 3ghg h LEU 302 N 0.26 -0.92 -1.21 -2.39 3.38 -1.21 -2.92 115.31 110.30 3ghg h LEU 302 Ca 0.05 0.06 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 3ghg h LEU 302 Cb 0.35 0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3ghg h LEU 302 CO 0.02 -0.54 -0.25 0.71 0.09 0.00 0.00 178.44 178.47 3ghg h THR 303 N -0.84 1.23 -0.00 0.22 1.35 0.81 -3.19 112.91 112.48 3ghg h THR 303 Ca -0.06 -1.10 0.00 0.00 -0.55 0.00 0.00 66.41 64.71 3ghg h THR 303 Cb 0.70 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.54 3ghg h THR 303 CO 0.03 0.33 -0.10 0.54 -0.25 0.00 0.00 175.52 176.07 3ghg n ARG 304 N -4.17 0.41 -0.22 4.72 1.74 0.39 -3.46 116.66 116.08 3ghg n ARG 304 Ca -0.01 -0.10 0.26 0.00 -0.77 0.00 0.00 57.85 57.23 3ghg n ARG 304 Cb 0.36 -1.50 0.65 0.00 -1.02 0.00 0.00 32.46 30.95 3ghg n ARG 304 CO 0.00 0.00 0.00 0.52 -1.52 0.00 0.00 177.63 176.63 3ghg h MET 305 N 0.25 0.14 0.00 5.56 2.86 -1.50 -3.47 114.93 118.76 3ghg h MET 305 Ca 0.00 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 3ghg h MET 305 Cb 0.38 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.01 3ghg h MET 305 CO 0.00 0.09 0.00 0.41 1.06 0.00 0.00 176.91 178.47 3ghg n GLY 306 N -1.64 -0.11 3.76 8.32 0.00 -1.22 -5.15 105.19 109.15 3ghg n GLY 306 Ca 0.20 -1.20 -0.41 0.00 0.00 0.00 0.00 46.02 44.60 3ghg n GLY 306 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ghg s PRO 307 N -2.00 4.15 -0.06 1.61 0.05 -1.26 -4.84 135.00 132.65 3ghg s PRO 307 Ca 0.00 2.52 -0.03 0.00 0.05 0.00 0.00 61.00 63.54 3ghg s PRO 307 Cb 0.00 -3.02 0.04 0.00 0.05 0.00 0.00 34.50 31.57 3ghg s PRO 307 CO 0.00 -0.54 0.09 0.99 0.05 0.00 0.00 177.00 177.59 3ghg s THR 308 N -0.50 -0.16 0.03 1.26 2.01 -1.26 -0.89 115.64 116.13 3ghg s THR 308 Ca 0.58 0.37 -0.12 0.00 0.31 0.00 0.00 61.69 62.83 3ghg s THR 308 Cb -0.46 -0.22 -0.06 0.00 0.01 0.00 0.00 72.50 71.77 3ghg s THR 308 CO 0.53 0.14 0.39 -1.83 -0.69 0.00 0.00 174.62 173.16 3ghg s GLU 309 N 2.21 3.81 -0.14 4.92 -1.05 0.29 -0.97 118.70 127.76 3ghg s GLU 309 Ca 0.04 0.27 0.01 0.00 -0.15 0.00 0.00 54.97 55.14 3ghg s GLU 309 Cb -0.12 -3.12 -0.00 0.00 -0.44 0.00 0.00 34.13 30.44 3ghg s GLU 309 CO -0.04 0.64 -0.17 -1.17 0.95 0.00 0.00 175.26 175.47 3ghg s LEU 310 N -1.44 2.43 -0.07 1.83 2.96 0.55 -1.75 118.68 123.19 3ghg s LEU 310 Ca 0.27 -0.47 0.02 0.00 -0.22 0.00 0.00 54.13 53.73 3ghg s LEU 310 Cb -0.15 -1.54 -0.03 0.00 0.50 0.00 0.00 46.19 44.97 3ghg s LEU 310 CO 0.15 0.11 -0.11 -0.22 -1.32 0.00 0.00 176.35 174.95 3ghg s LEU 311 N 0.67 2.89 -0.14 -0.68 2.96 0.02 0.62 118.68 125.03 3ghg s LEU 311 Ca -0.08 -0.16 0.02 0.00 -0.22 0.00 0.00 54.13 53.69 3ghg s LEU 311 Cb -0.16 -1.61 0.01 0.00 0.50 0.00 0.00 46.19 44.93 3ghg s LEU 311 CO 0.02 0.32 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.55 3ghg s ILE 312 N -0.55 1.83 -0.15 6.68 1.01 0.17 -2.11 121.20 128.08 3ghg s ILE 312 Ca 0.08 -0.83 0.01 0.00 0.00 0.00 0.00 60.65 59.91 3ghg s ILE 312 Cb -0.12 -1.65 0.00 0.00 0.01 0.00 0.00 42.46 40.71 3ghg s ILE 312 CO 0.02 0.50 -0.17 -1.61 0.00 0.00 0.00 174.94 173.68 3ghg s GLU 313 N 1.05 3.14 0.04 2.79 2.02 -0.91 0.55 118.70 127.38 3ghg s GLU 313 Ca -0.03 -0.78 0.09 0.00 0.02 0.00 0.00 54.97 54.26 3ghg s GLU 313 Cb -0.14 -2.58 -0.03 0.00 0.10 0.00 0.00 34.13 31.48 3ghg s GLU 313 CO -0.05 -0.02 -0.25 0.00 0.02 0.00 0.00 175.26 174.96 3ghg s MET 314 N 0.88 1.74 0.52 1.61 0.23 -0.94 -2.09 119.30 121.24 3ghg s MET 314 Ca -0.05 -1.05 0.06 0.00 -1.03 0.00 0.00 55.69 53.62 3ghg s MET 314 Cb -0.15 -1.87 0.03 0.00 -1.53 0.00 0.00 34.83 31.30 3ghg s MET 314 CO -0.02 0.49 0.37 -2.00 -2.03 0.00 0.00 175.02 171.83 3ghg s GLU 315 N -1.14 2.27 0.31 3.16 2.12 -0.93 -1.34 118.70 123.14 3ghg s GLU 315 Ca 0.11 -1.99 -0.00 0.00 0.36 0.00 0.00 54.97 53.45 3ghg s GLU 315 Cb -0.10 -2.09 -0.02 0.00 0.26 0.00 0.00 34.13 32.19 3ghg s GLU 315 CO 0.02 -0.54 0.35 0.16 -0.54 0.00 0.00 175.26 174.71 3ghg s ASP 316 N -4.23 0.92 0.02 -1.70 3.84 -0.77 -3.49 116.67 111.27 3ghg s ASP 316 Ca 0.34 -1.50 0.10 0.00 -0.00 0.00 0.00 52.55 51.49 3ghg s ASP 316 Cb -0.02 0.57 0.42 0.00 -1.38 0.00 0.00 42.92 42.52 3ghg s ASP 316 CO 0.21 -1.13 1.31 0.79 -0.00 0.00 0.00 175.17 176.35 3ghg n TRP 317 N -0.51 0.05 -0.03 2.11 7.02 -1.26 -0.22 117.44 124.59 3ghg n TRP 317 Ca 0.03 0.02 -0.12 0.00 -1.02 0.00 0.00 57.50 56.41 3ghg n TRP 317 Cb 0.63 -0.53 -0.14 0.00 -2.42 0.00 0.00 31.31 28.84 3ghg n TRP 317 CO 0.00 0.00 0.00 1.17 -2.02 0.00 0.00 177.69 176.84 3ghg n LYS 318 N -1.55 0.67 0.00 -0.99 3.00 -1.26 -5.02 118.16 113.01 3ghg n LYS 318 Ca 0.02 0.23 0.00 0.00 -0.00 0.00 0.00 58.31 58.56 3ghg n LYS 318 Cb 0.11 -1.72 0.00 0.00 0.00 0.00 0.00 35.03 33.42 3ghg n LYS 318 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3ghg n GLY 319 N 1.71 1.49 3.37 3.14 0.00 0.69 -5.14 105.19 110.45 3ghg n GLY 319 Ca -0.24 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 3ghg n GLY 319 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ghg s ASP 320 N -2.00 3.27 0.25 1.61 -0.00 -1.26 -4.88 116.67 113.66 3ghg s ASP 320 Ca 0.00 -0.66 0.06 0.00 -0.00 0.00 0.00 52.55 51.96 3ghg s ASP 320 Cb 0.00 -0.27 -0.05 0.00 -0.00 0.00 0.00 42.92 42.59 3ghg s ASP 320 CO 0.00 0.22 -0.07 -0.54 -0.00 0.00 0.00 175.17 174.78 3ghg s LYS 321 N -1.63 1.43 -0.24 8.23 3.01 -1.26 -1.85 119.74 127.43 3ghg s LYS 321 Ca 0.13 -1.70 -0.15 0.00 -1.01 0.00 0.00 55.97 53.23 3ghg s LYS 321 Cb -0.10 -1.01 0.07 0.00 -1.01 0.00 0.00 37.83 35.78 3ghg s LYS 321 CO 0.04 0.04 0.59 0.14 0.51 0.00 0.00 175.35 176.68 3ghg s VAL 322 N -3.10 -0.01 0.45 3.17 -7.23 -0.45 -5.00 120.40 108.23 3ghg s VAL 322 Ca 0.27 0.03 -0.05 0.00 -1.81 0.00 0.00 61.98 60.42 3ghg s VAL 322 Cb 0.03 -0.86 -0.04 0.00 0.56 0.00 0.00 36.38 36.08 3ghg s VAL 322 CO 0.10 0.01 0.74 -0.54 -0.31 0.00 0.00 175.10 175.10 3ghg s LYS 323 N 1.27 3.55 -0.07 4.82 1.02 -1.26 -2.21 119.74 126.86 3ghg s LYS 323 Ca -0.08 0.14 0.02 0.00 0.02 0.00 0.00 55.97 56.07 3ghg s LYS 323 Cb -0.06 -2.43 0.01 0.00 -0.52 0.00 0.00 37.83 34.84 3ghg s LYS 323 CO -0.13 -0.13 -0.13 0.00 -0.92 0.00 0.00 175.35 174.04 3ghg s ALA 324 N -2.63 1.34 -0.14 5.17 0.00 0.19 0.24 121.76 125.93 3ghg s ALA 324 Ca 0.46 -0.47 0.01 0.00 0.00 0.00 0.00 51.96 51.97 3ghg s ALA 324 Cb -0.10 -0.61 0.02 0.00 0.00 0.00 0.00 23.12 22.43 3ghg s ALA 324 CO 0.42 0.09 -0.15 -1.58 0.00 0.00 0.00 175.76 174.54 3ghg s HIS 325 N 0.71 2.17 -0.21 0.00 2.46 -0.31 0.44 115.29 120.55 3ghg s HIS 325 Ca -0.14 -1.15 0.02 0.00 0.47 0.00 0.00 55.06 54.26 3ghg s HIS 325 Cb -0.16 -1.57 0.04 0.00 -0.13 0.00 0.00 32.58 30.77 3ghg s HIS 325 CO 0.03 -0.61 -0.13 0.71 -2.47 0.00 0.00 174.74 172.27 3ghg s TYR 326 N 1.26 2.80 0.23 3.88 1.51 0.20 -0.69 117.35 126.54 3ghg s TYR 326 Ca 0.00 -1.85 -0.07 0.00 -1.01 0.00 0.00 57.07 54.14 3ghg s TYR 326 Cb -0.14 -1.82 0.25 0.00 -0.11 0.00 0.00 41.96 40.14 3ghg s TYR 326 CO -0.07 -0.81 1.88 0.78 -1.11 0.00 0.00 175.55 176.23 3ghg h GLY 327 N 7.90 1.24 -4.73 0.71 0.00 -0.42 0.16 103.07 107.92 3ghg h GLY 327 Ca -0.30 -0.43 -0.68 0.00 0.00 0.00 0.00 47.33 45.92 3ghg h GLY 327 CO 0.52 0.38 -0.76 -0.32 0.00 0.00 0.00 176.54 176.36 3ghg s GLY 328 N -3.05 1.62 -0.28 4.60 0.00 -0.37 -3.48 107.32 106.36 3ghg s GLY 328 Ca -0.13 -1.06 -0.19 0.00 0.00 0.00 0.00 44.72 43.34 3ghg s GLY 328 CO 0.79 -0.90 0.88 -0.12 0.00 0.00 0.00 173.10 173.76 3ghg s PHE 329 N -0.88 -0.71 -0.18 1.90 5.36 -0.15 -1.32 117.98 122.01 3ghg s PHE 329 Ca 0.14 1.51 -0.28 0.00 -0.96 0.00 0.00 56.93 57.34 3ghg s PHE 329 Cb -0.11 0.42 0.08 0.00 -0.34 0.00 0.00 43.02 43.08 3ghg s PHE 329 CO 0.04 -0.35 0.78 0.95 -1.46 0.00 0.00 175.22 175.19 3ghg s THR 330 N 1.06 0.00 0.01 0.12 -4.23 -0.78 -4.21 115.64 107.61 3ghg s THR 330 Ca -0.05 0.00 0.06 0.00 -1.18 0.00 0.00 61.69 60.51 3ghg s THR 330 Cb -0.04 -1.00 -0.02 0.00 1.34 0.00 0.00 72.50 72.78 3ghg s THR 330 CO -0.12 0.00 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.09 3ghg s VAL 331 N -0.39 1.36 0.83 2.29 1.01 -1.26 -1.46 120.40 122.78 3ghg s VAL 331 Ca -0.04 -0.89 -0.09 0.00 0.00 0.00 0.00 61.98 60.96 3ghg s VAL 331 Cb -0.03 -1.16 0.15 0.00 0.00 0.00 0.00 36.38 35.34 3ghg s VAL 331 CO 0.03 0.25 1.15 -1.10 0.00 0.00 0.00 175.10 175.44 3ghg s GLN 332 N -0.74 1.25 0.91 2.72 -1.52 -0.18 -4.50 119.66 117.59 3ghg s GLN 332 Ca 0.06 -0.68 -0.12 0.00 -1.95 0.00 0.00 55.36 52.67 3ghg s GLN 332 Cb -0.07 -2.08 0.14 0.00 -0.22 0.00 0.00 33.01 30.77 3ghg s GLN 332 CO 0.00 -1.88 1.09 0.54 -0.25 0.00 0.00 175.29 174.80 3ghg s ASN 333 N -4.78 3.36 0.45 5.90 2.20 -1.26 -3.97 114.94 116.83 3ghg s ASN 333 Ca 0.69 1.46 0.12 0.00 -0.94 0.00 0.00 52.86 54.19 3ghg s ASN 333 Cb -0.05 -2.13 1.02 0.00 -2.00 0.00 0.00 41.25 38.09 3ghg s ASN 333 CO 0.48 -2.70 2.04 -0.08 -2.94 0.00 0.00 177.10 173.90 3ghg h GLU 334 N -1.60 0.36 -0.97 3.55 4.81 -1.98 0.52 114.58 119.28 3ghg h GLU 334 Ca -0.50 -0.02 0.30 0.00 -0.13 0.00 0.00 59.36 59.01 3ghg h GLU 334 Cb 1.29 -0.08 -0.17 0.00 0.63 0.00 0.00 28.75 30.42 3ghg h GLU 334 CO 0.55 0.24 0.22 0.00 -0.73 0.00 0.00 179.01 179.28 3ghg h ALA 335 N 1.77 1.46 -0.53 2.92 0.00 -2.04 -0.09 119.26 122.75 3ghg h ALA 335 Ca 0.18 0.29 -0.33 0.00 0.00 0.00 0.00 54.91 55.05 3ghg h ALA 335 Cb 0.23 0.45 -0.21 0.00 0.00 0.00 0.00 17.79 18.27 3ghg h ALA 335 CO -0.04 -0.64 -0.13 0.09 0.00 0.00 0.00 179.25 178.53 3ghg n ASN 336 N -5.36 3.69 -3.59 0.00 3.02 0.17 -4.95 115.26 108.25 3ghg n ASN 336 Ca 0.27 -3.79 -0.27 0.00 -0.03 0.00 0.00 54.58 50.76 3ghg n ASN 336 Cb 0.88 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 3ghg n ASN 336 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3ghg n LYS 337 N -1.01 -3.98 -3.39 3.52 5.02 -0.05 -1.07 118.16 117.21 3ghg n LYS 337 Ca 0.40 0.52 -0.25 0.00 -2.02 0.00 0.00 58.31 56.96 3ghg n LYS 337 Cb 0.98 -5.29 0.02 0.00 -0.02 0.00 0.00 35.03 30.71 3ghg n LYS 337 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3ghg n TYR 338 N -4.22 -1.98 -1.49 2.13 4.01 -0.72 -2.09 117.16 112.79 3ghg n TYR 338 Ca 0.01 0.59 -0.53 0.00 -0.16 0.00 0.00 57.90 57.81 3ghg n TYR 338 Cb 0.54 -3.67 -0.06 0.00 -0.31 0.00 0.00 39.34 35.84 3ghg n TYR 338 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 3ghg n GLN 339 N -4.06 0.31 -3.35 -0.72 7.27 -0.23 -4.17 117.38 112.44 3ghg n GLN 339 Ca -0.03 0.11 -0.23 0.00 0.07 0.00 0.00 57.00 56.92 3ghg n GLN 339 Cb 0.56 -1.47 -0.01 0.00 2.41 0.00 0.00 30.24 31.73 3ghg n GLN 339 CO 0.00 0.00 0.00 -1.50 0.07 0.00 0.00 177.06 175.63 3ghg s ILE 340 N -0.32 4.79 -0.26 1.69 2.07 -0.74 -1.01 121.20 127.41 3ghg s ILE 340 Ca 0.79 -0.55 -0.08 0.00 -1.41 0.00 0.00 60.65 59.39 3ghg s ILE 340 Cb -1.06 -3.74 0.12 0.00 0.13 0.00 0.00 42.46 37.91 3ghg s ILE 340 CO 0.55 -0.46 0.56 -0.55 -1.91 0.00 0.00 174.94 173.13 3ghg s SER 341 N -4.08 -0.82 0.21 4.50 0.15 -0.53 -3.07 113.70 110.06 3ghg s SER 341 Ca 0.42 1.27 0.10 0.00 0.70 0.00 0.00 55.95 58.44 3ghg s SER 341 Cb -0.10 1.93 -0.04 0.00 -1.71 0.00 0.00 66.02 66.10 3ghg s SER 341 CO 0.35 -0.23 -0.16 0.68 1.20 0.00 0.00 173.24 175.09 3ghg s VAL 342 N 2.79 2.79 0.26 4.45 -7.23 -1.26 -1.86 120.40 120.33 3ghg s VAL 342 Ca -0.01 -1.97 -0.20 0.00 -1.81 0.00 0.00 61.98 57.99 3ghg s VAL 342 Cb -0.12 -2.40 0.07 0.00 0.56 0.00 0.00 36.38 34.49 3ghg s VAL 342 CO -0.17 -0.20 0.93 0.54 -0.31 0.00 0.00 175.10 175.89 3ghg s ASN 343 N -3.01 -0.02 -1.14 4.85 2.20 -0.44 -4.94 114.94 112.45 3ghg s ASN 343 Ca 0.25 -0.82 -0.10 0.00 -0.94 0.00 0.00 52.86 51.25 3ghg s ASN 343 Cb -0.07 0.64 -0.03 0.00 -2.00 0.00 0.00 41.25 39.78 3ghg s ASN 343 CO 0.14 -1.25 0.84 0.29 -2.94 0.00 0.00 177.10 174.18 3ghg n LYS 344 N -0.61 -2.65 -2.81 3.55 5.02 -1.26 -1.24 118.16 118.15 3ghg n LYS 344 Ca -0.05 0.68 -0.32 0.00 -2.02 0.00 0.00 58.31 56.60 3ghg n LYS 344 Cb 0.60 -5.13 -0.05 0.00 -0.02 0.00 0.00 35.03 30.43 3ghg n LYS 344 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 3ghg s TYR 345 N -3.47 3.39 0.30 2.13 5.04 -1.26 -0.96 117.35 122.53 3ghg s TYR 345 Ca 0.35 1.35 -0.12 0.00 -2.44 0.00 0.00 57.07 56.22 3ghg s TYR 345 Cb -0.08 -2.67 0.01 0.00 0.35 0.00 0.00 41.96 39.57 3ghg s TYR 345 CO 0.79 -0.11 0.56 -0.98 -1.34 0.00 0.00 175.55 174.47 3ghg s ARG 346 N -3.47 1.78 0.00 4.97 1.70 0.13 -4.94 118.95 119.11 3ghg s ARG 346 Ca 0.57 -1.38 0.00 0.00 -0.47 0.00 0.00 55.73 54.45 3ghg s ARG 346 Cb -0.10 0.51 0.00 0.00 -0.57 0.00 0.00 34.95 34.79 3ghg s ARG 346 CO 0.22 -0.77 0.00 0.41 -1.08 0.00 0.00 175.30 174.09 3ghg n GLY 347 N -0.46 -1.66 0.02 3.88 0.00 -1.26 -1.17 105.19 104.54 3ghg n GLY 347 Ca -0.02 -2.22 0.09 0.00 0.00 0.00 0.00 46.02 43.87 3ghg n GLY 347 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ghg n THR 348 N -0.43 0.10 -0.18 2.61 -2.24 -1.06 -4.39 114.28 108.70 3ghg n THR 348 Ca 0.00 -0.51 0.04 0.00 -2.27 0.00 0.00 64.05 61.31 3ghg n THR 348 Cb 0.00 -0.02 0.33 0.00 -2.10 0.00 0.00 70.33 68.53 3ghg n THR 348 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ghg h ALA 349 N 1.87 1.63 0.00 6.98 0.00 -0.47 -3.47 119.26 125.79 3ghg h ALA 349 Ca -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3ghg h ALA 349 Cb 1.06 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3ghg h ALA 349 CO 0.00 0.29 0.00 0.41 0.00 0.00 0.00 179.25 179.95 3ghg n GLY 350 N -1.44 1.33 3.51 0.00 0.00 -1.26 -3.79 105.19 103.54 3ghg n GLY 350 Ca 0.09 -0.92 -0.35 0.00 0.00 0.00 0.00 46.02 44.84 3ghg n GLY 350 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3ghg n ASN 351 N 0.00 0.48 -0.11 1.61 4.05 -1.26 -4.68 115.26 115.35 3ghg n ASN 351 Ca 0.00 -0.19 -0.15 0.00 0.45 0.00 0.00 54.58 54.70 3ghg n ASN 351 Cb 0.00 -1.03 -0.14 0.00 1.23 0.00 0.00 39.78 39.84 3ghg n ASN 351 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3ghg n ALA 352 N 11.23 1.43 -0.17 5.20 0.00 -1.26 -3.79 120.51 133.16 3ghg n ALA 352 Ca 0.59 -1.15 -0.05 0.00 0.00 0.00 0.00 53.44 52.83 3ghg n ALA 352 Cb 0.18 -0.19 0.12 0.00 0.00 0.00 0.00 19.45 19.56 3ghg n ALA 352 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3ghg h LEU 353 N 0.00 0.89 0.00 0.00 3.38 -1.91 -0.22 115.31 117.45 3ghg h LEU 353 Ca -0.55 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.21 3ghg h LEU 353 Cb 2.05 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 42.56 3ghg h LEU 353 CO -0.03 0.90 -0.17 0.24 0.09 0.00 0.00 178.44 179.47 3ghg h MET 354 N 0.88 0.00 -0.01 1.13 2.86 -1.92 0.13 114.93 118.00 3ghg h MET 354 Ca 0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 3ghg h MET 354 Cb 0.40 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.06 3ghg h MET 354 CO 0.01 0.23 -0.40 -0.25 1.06 0.00 0.00 176.91 177.55 3ghg n ASP 355 N -4.70 1.86 -0.61 1.22 9.92 -1.22 -4.61 116.55 118.41 3ghg n ASP 355 Ca -0.05 -1.43 0.08 0.00 -0.53 0.00 0.00 54.79 52.86 3ghg n ASP 355 Cb 0.17 0.47 -0.02 0.00 -0.64 0.00 0.00 41.12 41.09 3ghg n ASP 355 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3ghg n GLY 356 N 1.29 -1.65 3.65 0.44 0.00 -0.10 -4.84 105.19 103.99 3ghg n GLY 356 Ca 0.08 -1.37 -0.43 0.00 0.00 0.00 0.00 46.02 44.30 3ghg n GLY 356 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ghg n ALA 357 N -1.76 1.54 0.53 4.61 0.00 -1.26 -4.70 120.51 119.47 3ghg n ALA 357 Ca 0.00 0.15 0.13 0.00 0.00 0.00 0.00 53.44 53.72 3ghg n ALA 357 Cb 0.28 -2.70 0.41 0.00 0.00 0.00 0.00 19.45 17.44 3ghg n ALA 357 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3ghg h SER 358 N 11.10 0.00 1.03 0.00 4.64 -1.90 -3.04 113.55 125.38 3ghg h SER 358 Ca -0.48 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.74 3ghg h SER 358 Cb 1.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 3ghg h SER 358 CO 0.94 0.00 -1.03 0.06 -0.87 0.00 0.00 176.83 175.94 3ghg h GLN 359 N 0.00 0.00 -7.37 4.77 -0.00 -1.92 -3.46 115.11 107.14 3ghg h GLN 359 Ca 0.00 0.00 -0.48 0.00 -0.00 0.00 0.00 58.65 58.17 3ghg h GLN 359 Cb 0.68 0.00 0.13 0.00 -0.00 0.00 0.00 27.48 28.29 3ghg h GLN 359 CO 0.00 0.23 0.28 -0.51 -0.00 0.00 0.00 178.83 178.83 3ghg s LEU 360 N -5.83 2.37 -0.00 0.06 1.43 -1.15 -5.07 118.68 110.49 3ghg s LEU 360 Ca -0.00 1.40 0.04 0.00 -1.03 0.00 0.00 54.13 54.54 3ghg s LEU 360 Cb 0.08 -3.89 -0.01 0.00 0.03 0.00 0.00 46.19 42.40 3ghg s LEU 360 CO 0.78 -2.39 -0.12 -0.04 0.23 0.00 0.00 176.35 174.81 3ghg s MET 361 N -5.03 0.95 3.38 1.70 -1.94 -1.26 -4.74 119.30 112.36 3ghg s MET 361 Ca 0.62 -0.47 0.00 0.00 -1.71 0.00 0.00 55.69 54.14 3ghg s MET 361 Cb -0.17 -0.92 0.00 0.00 2.01 0.00 0.00 34.83 35.76 3ghg s MET 361 CO 0.56 0.25 0.00 0.41 -0.01 0.00 0.00 175.02 176.23 3ghg n GLY 362 N 2.66 2.67 0.25 -0.03 0.00 -1.26 -1.92 105.19 107.56 3ghg n GLY 362 Ca -0.14 0.33 -0.04 0.00 0.00 0.00 0.00 46.02 46.17 3ghg n GLY 362 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3ghg h GLU 363 N 0.00 0.73 0.00 1.61 4.81 -1.98 -1.96 114.58 117.79 3ghg h GLU 363 Ca 0.00 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 3ghg h GLU 363 Cb 0.00 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.21 3ghg h GLU 363 CO 0.00 0.48 -0.02 -0.91 -0.73 0.00 0.00 179.01 177.84 3ghg h ASN 364 N 0.75 0.00 0.01 1.04 2.35 -1.79 -3.02 115.58 114.92 3ghg h ASN 364 Ca 0.26 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.01 3ghg h ASN 364 Cb 0.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.42 3ghg h ASN 364 CO -0.12 0.02 -0.01 -0.09 -1.65 0.00 0.00 177.43 175.58 3ghg h ARG 365 N 0.00 -0.02 0.00 0.81 2.43 -1.28 -3.35 114.38 112.97 3ghg h ARG 365 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3ghg h ARG 365 Cb 0.42 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 3ghg h ARG 365 CO 0.00 0.71 0.00 0.25 -1.51 0.00 0.00 179.97 179.42 3ghg n THR 366 N -4.68 0.00 -0.87 0.20 -2.24 -0.91 0.15 114.28 105.92 3ghg n THR 366 Ca -0.08 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.78 3ghg n THR 366 Cb 0.36 -0.33 0.40 0.00 -2.10 0.00 0.00 70.33 68.66 3ghg n THR 366 CO 0.00 0.00 0.00 1.15 -0.57 0.00 0.00 175.07 175.65 3ghg n MET 367 N -0.67 4.79 0.00 -0.78 0.00 -1.17 -4.29 117.12 114.99 3ghg n MET 367 Ca 0.06 -3.14 0.00 0.00 0.00 0.00 0.00 57.70 54.61 3ghg n MET 367 Cb 0.03 -2.23 0.00 0.00 0.00 0.00 0.00 33.22 31.02 3ghg n MET 367 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 3ghg n THR 368 N 0.70 0.25 -2.47 3.17 -2.24 0.39 -2.84 114.28 111.23 3ghg n THR 368 Ca 0.28 -0.58 -0.42 0.00 -2.27 0.00 0.00 64.05 61.06 3ghg n THR 368 Cb 1.17 0.94 -0.03 0.00 -2.10 0.00 0.00 70.33 70.31 3ghg n THR 368 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3ghg s ILE 369 N -0.25 4.06 -0.13 2.28 1.01 -1.25 -2.57 121.20 124.36 3ghg s ILE 369 Ca 0.00 1.55 0.19 0.00 0.00 0.00 0.00 60.65 62.39 3ghg s ILE 369 Cb 0.00 -3.99 -0.20 0.00 0.01 0.00 0.00 42.46 38.28 3ghg s ILE 369 CO 0.00 0.16 0.59 1.41 0.00 0.00 0.00 174.94 177.10 3ghg n HIS 370 N 3.48 0.55 -1.69 3.97 8.25 -0.72 -4.65 115.22 124.41 3ghg n HIS 370 Ca 0.07 0.18 -0.50 0.00 -0.26 0.00 0.00 57.72 57.21 3ghg n HIS 370 Cb 0.47 -0.93 -0.05 0.00 1.12 0.00 0.00 29.99 30.59 3ghg n HIS 370 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3ghg n ASN 371 N -2.71 3.29 0.00 0.41 2.85 0.39 -0.10 115.26 119.40 3ghg n ASN 371 Ca -0.13 0.99 0.00 0.00 -0.11 0.00 0.00 54.58 55.33 3ghg n ASN 371 Cb 0.84 -1.34 0.00 0.00 1.24 0.00 0.00 39.78 40.52 3ghg n ASN 371 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3ghg n GLY 372 N 4.34 2.01 3.70 8.20 0.00 -1.17 -5.04 105.19 117.23 3ghg n GLY 372 Ca 0.23 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 3ghg n GLY 372 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3ghg s MET 373 N -0.54 0.27 -0.02 1.61 -1.94 0.86 -4.54 119.30 115.00 3ghg s MET 373 Ca 0.00 0.27 0.03 0.00 -1.71 0.00 0.00 55.69 54.28 3ghg s MET 373 Cb 0.00 -1.74 -0.03 0.00 2.01 0.00 0.00 34.83 35.07 3ghg s MET 373 CO 0.00 -2.78 -0.08 -0.06 -0.01 0.00 0.00 175.02 172.09 3ghg s PHE 374 N -3.11 2.88 0.26 -0.03 0.08 -1.26 -1.79 117.98 115.00 3ghg s PHE 374 Ca 0.66 -0.04 -0.30 0.00 0.12 0.00 0.00 56.93 57.38 3ghg s PHE 374 Cb -0.15 -1.64 -0.11 0.00 -0.57 0.00 0.00 43.02 40.55 3ghg s PHE 374 CO 0.56 0.34 1.56 0.12 -0.10 0.00 0.00 175.22 177.70 3ghg s PHE 375 N -0.91 2.87 -0.01 0.36 5.36 -0.89 -3.51 117.98 121.24 3ghg s PHE 375 Ca 0.15 0.80 0.03 0.00 -0.96 0.00 0.00 56.93 56.95 3ghg s PHE 375 Cb -0.11 -3.99 -0.01 0.00 -0.34 0.00 0.00 43.02 38.57 3ghg s PHE 375 CO 0.05 -3.38 -0.11 -1.12 -1.46 0.00 0.00 175.22 169.20 3ghg s SER 376 N 0.58 1.38 0.41 6.13 0.01 -0.12 -4.55 113.70 117.53 3ghg s SER 376 Ca 0.64 -0.21 0.05 0.00 1.31 0.00 0.00 55.95 57.74 3ghg s SER 376 Cb -0.46 -0.21 -0.06 0.00 0.21 0.00 0.00 66.02 65.50 3ghg s SER 376 CO 0.43 0.13 0.03 0.42 0.41 0.00 0.00 173.24 174.66 3ghg s THR 377 N -0.17 1.62 0.33 1.44 -4.23 -1.00 -2.02 115.64 111.62 3ghg s THR 377 Ca 0.03 -2.00 0.11 0.00 -1.18 0.00 0.00 61.69 58.65 3ghg s THR 377 Cb -0.06 -2.79 0.04 0.00 1.34 0.00 0.00 72.50 71.03 3ghg s THR 377 CO -0.00 0.00 1.74 0.10 -0.54 0.00 0.00 174.62 175.92 3ghg h TYR 378 N 1.78 0.02 -0.38 3.99 -0.00 -1.86 -0.28 116.97 120.24 3ghg h TYR 378 Ca -0.43 -0.00 -0.09 0.00 0.00 0.00 0.00 58.73 58.21 3ghg h TYR 378 Cb 1.25 -0.00 -0.05 0.00 0.00 0.00 0.00 36.73 37.93 3ghg h TYR 378 CO 0.86 0.48 0.12 -0.40 -0.00 0.00 0.00 178.16 179.21 3ghg n ASP 379 N -3.98 3.49 -3.06 0.10 5.75 -1.26 -4.64 116.55 112.96 3ghg n ASP 379 Ca -0.02 -2.61 -0.00 0.00 -0.01 0.00 0.00 54.79 52.15 3ghg n ASP 379 Cb 0.49 -0.63 -0.00 0.00 -1.03 0.00 0.00 41.12 39.95 3ghg n ASP 379 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 3ghg s ARG 380 N -1.88 0.79 -0.59 0.11 6.06 -0.11 -4.90 118.95 118.43 3ghg s ARG 380 Ca 0.29 -0.40 -0.28 0.00 -2.50 0.00 0.00 55.73 52.84 3ghg s ARG 380 Cb 0.23 0.06 0.03 0.00 0.06 0.00 0.00 34.95 35.33 3ghg s ARG 380 CO 0.08 -1.09 1.18 0.34 -2.50 0.00 0.00 175.30 173.31 3ghg s ASP 381 N 1.63 6.42 -0.15 -2.12 3.68 -1.25 -2.38 116.67 122.51 3ghg s ASP 381 Ca 0.19 0.03 0.17 0.00 2.13 0.00 0.00 52.55 55.08 3ghg s ASP 381 Cb -0.02 -2.55 0.34 0.00 -1.45 0.00 0.00 42.92 39.24 3ghg s ASP 381 CO -0.08 -1.49 1.19 0.59 0.13 0.00 0.00 175.17 175.51 3ghg n ASN 382 N 8.44 2.33 -3.65 -0.34 3.02 -1.26 -5.06 115.26 118.74 3ghg n ASN 382 Ca 0.08 -3.26 -0.30 0.00 -0.03 0.00 0.00 54.58 51.07 3ghg n ASN 382 Cb 0.49 -0.46 0.25 0.00 -0.61 0.00 0.00 39.78 39.44 3ghg n ASN 382 CO 0.00 0.00 0.00 1.51 -2.62 0.00 0.00 177.26 176.15 3ghg s ASP 383 N -2.88 0.92 -0.08 6.41 1.47 -1.26 -4.25 116.67 117.00 3ghg s ASP 383 Ca 0.34 0.43 0.20 0.00 1.18 0.00 0.00 52.55 54.70 3ghg s ASP 383 Cb 0.30 -0.52 0.71 0.00 -0.34 0.00 0.00 42.92 43.07 3ghg s ASP 383 CO 0.01 -4.11 1.61 0.61 0.68 0.00 0.00 175.17 173.98 3ghg n GLY 384 N -1.46 2.66 3.08 2.12 0.00 -1.25 -4.82 105.19 105.51 3ghg n GLY 384 Ca 0.16 -0.85 -0.35 0.00 0.00 0.00 0.00 46.02 44.98 3ghg n GLY 384 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3ghg s TRP 385 N -1.56 3.50 -0.34 1.61 -0.00 -1.26 -4.62 118.94 116.27 3ghg s TRP 385 Ca 0.51 -2.69 -0.20 0.00 -0.00 0.00 0.00 56.10 53.73 3ghg s TRP 385 Cb 0.31 -3.13 -0.00 0.00 -0.00 0.00 0.00 33.47 30.64 3ghg s TRP 385 CO 0.28 -0.90 0.61 -0.51 -0.00 0.00 0.00 176.95 176.43 3ghg s LEU 386 N 0.52 4.23 -0.10 5.86 1.43 -1.26 -4.95 118.68 124.40 3ghg s LEU 386 Ca 0.13 0.21 -0.11 0.00 -1.03 0.00 0.00 54.13 53.33 3ghg s LEU 386 Cb -0.22 -2.75 0.03 0.00 0.03 0.00 0.00 46.19 43.28 3ghg s LEU 386 CO -0.04 -0.53 0.30 -0.89 0.23 0.00 0.00 176.35 175.42 3ghg s THR 387 N 2.61 0.01 0.59 5.49 2.01 -1.26 -4.99 115.64 120.09 3ghg s THR 387 Ca 0.23 -0.05 0.28 0.00 0.31 0.00 0.00 61.69 62.47 3ghg s THR 387 Cb -0.15 -0.44 0.37 0.00 0.01 0.00 0.00 72.50 72.30 3ghg s THR 387 CO 0.13 -0.02 2.00 -1.28 -0.69 0.00 0.00 174.62 174.76 3ghg h SER 388 N 5.52 0.00 -2.94 3.53 0.87 -1.96 -3.44 113.55 115.12 3ghg h SER 388 Ca -0.26 0.00 -0.54 0.00 -1.23 0.00 0.00 61.79 59.75 3ghg h SER 388 Cb 1.19 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.15 3ghg h SER 388 CO 0.32 0.00 0.80 -0.62 -0.53 0.00 0.00 176.83 176.80 3ghg s ASP 389 N -5.55 6.87 0.04 6.23 -1.08 -1.26 -4.99 116.67 116.94 3ghg s ASP 389 Ca -0.04 2.11 -0.29 0.00 -0.52 0.00 0.00 52.55 53.81 3ghg s ASP 389 Cb 0.16 -2.56 -0.16 0.00 -1.46 0.00 0.00 42.92 38.89 3ghg s ASP 389 CO 0.56 -0.69 1.41 -0.65 0.52 0.00 0.00 175.17 176.32 3ghg h PRO 390 N 7.65 -1.01 0.00 4.34 0.11 -2.04 -3.27 132.00 137.78 3ghg h PRO 390 Ca -0.38 0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3ghg h PRO 390 Cb 1.18 0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.52 3ghg h PRO 390 CO 0.89 -0.67 0.00 0.00 -0.21 0.00 0.00 178.00 178.01 3ghg h ARG 391 N -1.07 0.00 -2.66 1.05 3.08 -1.99 -3.29 114.38 109.50 3ghg h ARG 391 Ca -0.11 0.00 -0.81 0.00 0.07 0.00 0.00 59.98 59.14 3ghg h ARG 391 Cb 0.80 0.00 -0.27 0.00 0.08 0.00 0.00 29.97 30.58 3ghg h ARG 391 CO 0.18 0.00 0.95 1.63 -1.07 0.00 0.00 179.97 181.66 3ghg n LYS 392 N -2.52 4.86 -4.44 0.04 4.76 -1.23 -4.78 118.16 114.84 3ghg n LYS 392 Ca -0.02 -4.56 -0.30 0.00 -2.87 0.00 0.00 58.31 50.57 3ghg n LYS 392 Cb 0.05 -2.51 -0.12 0.00 -1.84 0.00 0.00 35.03 30.61 3ghg n LYS 392 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 3ghg s GLN 393 N -3.31 1.76 0.08 1.97 -0.21 -1.24 -4.82 119.66 113.88 3ghg s GLN 393 Ca 0.35 -1.17 -0.30 0.00 0.02 0.00 0.00 55.36 54.26 3ghg s GLN 393 Cb 0.11 -2.07 -0.17 0.00 1.00 0.00 0.00 33.01 31.87 3ghg s GLN 393 CO 0.01 0.49 1.66 0.00 -2.12 0.00 0.00 175.29 175.33 3ghg h SER 395 N -0.62 0.95 -0.41 0.00 0.87 -1.87 0.33 113.55 112.80 3ghg h SER 395 Ca -0.06 0.02 0.09 0.00 -1.23 0.00 0.00 61.79 60.61 3ghg h SER 395 Cb 0.48 -0.18 -0.09 0.00 -0.44 0.00 0.00 62.40 62.18 3ghg h SER 395 CO 0.10 0.57 -0.19 0.11 -0.53 0.00 0.00 176.83 176.89 3ghg h LYS 396 N 1.06 -0.11 0.05 2.24 1.79 -1.86 -1.83 116.57 117.91 3ghg h LYS 396 Ca 0.45 0.01 -0.00 0.00 -2.18 0.00 0.00 60.65 58.92 3ghg h LYS 396 Cb 0.32 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.99 3ghg h LYS 396 CO -0.20 -0.07 -0.02 0.93 -1.08 0.00 0.00 179.45 179.00 3ghg h GLU 397 N -0.11 -0.07 -1.32 3.15 5.08 -1.28 -3.33 114.58 116.71 3ghg h GLU 397 Ca 0.20 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 58.11 3ghg h GLU 397 Cb 0.42 0.01 -0.20 0.00 0.50 0.00 0.00 28.75 29.49 3ghg h GLU 397 CO -0.48 0.56 0.59 -0.25 -1.00 0.00 0.00 179.01 178.43 3ghg n ASP 398 N -4.77 6.87 -1.05 1.42 8.00 0.11 -4.58 116.55 122.55 3ghg n ASP 398 Ca -0.08 -3.33 0.00 0.00 0.71 0.00 0.00 54.79 52.09 3ghg n ASP 398 Cb 0.32 -1.02 0.00 0.00 -0.02 0.00 0.00 41.12 40.40 3ghg n ASP 398 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ghg n GLY 399 N -0.14 -0.08 3.64 0.44 0.00 -0.69 -4.55 105.19 103.80 3ghg n GLY 399 Ca 0.42 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.43 3ghg n GLY 399 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ghg s GLY 400 N -0.96 -0.36 -0.12 -0.02 0.00 -1.25 -3.69 107.32 100.93 3ghg s GLY 400 Ca 0.00 0.73 -0.29 0.00 0.00 0.00 0.00 44.72 45.16 3ghg s GLY 400 CO 0.00 0.17 0.98 -0.32 0.00 0.00 0.00 173.10 173.93 3ghg s GLY 401 N -2.81 2.30 0.08 0.20 0.00 -1.26 -4.64 107.32 101.19 3ghg s GLY 401 Ca 0.12 0.32 -0.26 0.00 0.00 0.00 0.00 44.72 44.90 3ghg s GLY 401 CO -0.03 1.88 0.71 0.86 0.00 0.00 0.00 173.10 176.52 3ghg s TRP 402 N 2.05 -0.48 -0.85 1.90 -0.11 -0.85 -4.75 118.94 115.84 3ghg s TRP 402 Ca 0.47 0.37 -0.19 0.00 1.22 0.00 0.00 56.10 57.97 3ghg s TRP 402 Cb -0.18 0.54 -0.13 0.00 -1.50 0.00 0.00 33.47 32.20 3ghg s TRP 402 CO 0.17 -0.71 1.98 0.91 -4.62 0.00 0.00 176.95 174.68 3ghg n TRP 403 N -0.19 1.92 -2.03 5.86 8.01 -1.26 -0.95 117.44 128.82 3ghg n TRP 403 Ca -0.14 -1.93 -0.32 0.00 -1.31 0.00 0.00 57.50 53.80 3ghg n TRP 403 Cb 0.63 -1.77 0.00 0.00 -2.01 0.00 0.00 31.31 28.16 3ghg n TRP 403 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.69 177.39 3ghg s TYR 404 N 4.59 3.41 -0.32 -5.99 2.02 -1.23 -4.61 117.35 115.22 3ghg s TYR 404 Ca 0.54 1.40 0.16 0.00 -0.37 0.00 0.00 57.07 58.80 3ghg s TYR 404 Cb 0.14 -2.81 0.44 0.00 -0.40 0.00 0.00 41.96 39.34 3ghg s TYR 404 CO 0.08 -0.72 1.37 -1.71 -1.57 0.00 0.00 175.55 173.00 3ghg n ASN 405 N -2.32 -0.37 -1.95 2.29 5.15 -1.26 -3.93 115.26 112.87 3ghg n ASN 405 Ca 0.07 -2.19 -0.09 0.00 -0.60 0.00 0.00 54.58 51.77 3ghg n ASN 405 Cb 0.54 0.27 0.04 0.00 -0.53 0.00 0.00 39.78 40.10 3ghg n ASN 405 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 3ghg n ARG 406 N -1.13 -3.18 0.01 1.20 0.63 -1.26 -4.35 116.66 108.59 3ghg n ARG 406 Ca -0.08 0.36 0.00 0.00 -0.92 0.00 0.00 57.85 57.22 3ghg n ARG 406 Cb 0.85 -3.97 0.00 0.00 0.45 0.00 0.00 32.46 29.79 3ghg n ARG 406 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3ghg s HIS 408 N -2.00 -0.14 -0.14 0.00 -3.43 -1.26 -4.52 115.29 103.81 3ghg s HIS 408 Ca 0.00 -0.07 -0.11 0.00 -0.80 0.00 0.00 55.06 54.08 3ghg s HIS 408 Cb 0.00 0.15 -0.04 0.00 -1.43 0.00 0.00 32.58 31.26 3ghg s HIS 408 CO 0.00 -0.58 -0.22 0.00 -2.00 0.00 0.00 174.74 171.94 3ghg n ALA 409 N 0.25 0.56 -2.78 -1.38 0.00 -1.06 -4.80 120.51 111.29 3ghg n ALA 409 Ca -0.17 -0.55 -0.35 0.00 0.00 0.00 0.00 53.44 52.37 3ghg n ALA 409 Cb 0.61 0.02 -0.05 0.00 0.00 0.00 0.00 19.45 20.03 3ghg n ALA 409 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ghg s ALA 410 N -2.84 3.85 -0.41 0.00 0.00 -1.26 -2.83 121.76 118.27 3ghg s ALA 410 Ca -0.18 -0.58 0.04 0.00 0.00 0.00 0.00 51.96 51.24 3ghg s ALA 410 Cb 0.03 -2.05 0.17 0.00 0.00 0.00 0.00 23.12 21.26 3ghg s ALA 410 CO 0.27 0.64 0.45 1.21 0.00 0.00 0.00 175.76 178.33 3ghg s ASN 411 N -1.58 0.60 0.00 0.00 2.47 -0.43 -5.01 114.94 110.99 3ghg s ASN 411 Ca 0.25 -1.89 0.29 0.00 0.42 0.00 0.00 52.86 51.94 3ghg s ASN 411 Cb -0.13 0.67 1.32 0.00 -1.45 0.00 0.00 41.25 41.66 3ghg s ASN 411 CO 0.14 -0.20 1.91 -2.65 -3.72 0.00 0.00 177.10 172.58 3ghg n PRO 412 N 3.72 1.03 -0.20 0.43 -0.02 -1.26 -1.98 135.00 136.71 3ghg n PRO 412 Ca 0.16 -0.38 0.09 0.00 -2.02 0.00 0.00 63.50 61.35 3ghg n PRO 412 Cb 0.48 -1.49 0.19 0.00 -0.02 0.00 0.00 33.50 32.66 3ghg n PRO 412 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3ghg n ASN 413 N -0.65 3.18 -4.47 2.55 3.02 -1.26 -4.85 115.26 112.78 3ghg n ASN 413 Ca 0.18 -1.93 -0.29 0.00 -0.03 0.00 0.00 54.58 52.51 3ghg n ASN 413 Cb 0.26 -0.27 0.23 0.00 -0.61 0.00 0.00 39.78 39.39 3ghg n ASN 413 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ghg n GLY 414 N 1.04 -1.86 3.77 7.41 0.00 -1.22 -4.17 105.19 110.16 3ghg n GLY 414 Ca 0.16 -1.04 -0.34 0.00 0.00 0.00 0.00 46.02 44.80 3ghg n GLY 414 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ghg s ARG 415 N -4.26 2.87 -0.89 1.61 1.81 -1.26 -4.08 118.95 114.75 3ghg s ARG 415 Ca 0.66 1.47 -0.16 0.00 -1.72 0.00 0.00 55.73 55.98 3ghg s ARG 415 Cb -0.23 -1.95 0.18 0.00 -0.45 0.00 0.00 34.95 32.49 3ghg s ARG 415 CO 0.64 -1.21 0.95 -0.47 -0.68 0.00 0.00 175.30 174.54 3ghg s TYR 416 N -2.19 3.46 -0.35 -0.53 6.14 -1.26 -2.94 117.35 119.68 3ghg s TYR 416 Ca 0.69 -1.72 -0.28 0.00 0.64 0.00 0.00 57.07 56.39 3ghg s TYR 416 Cb -0.22 -4.05 0.02 0.00 0.42 0.00 0.00 41.96 38.13 3ghg s TYR 416 CO 0.39 -1.23 1.04 0.71 0.64 0.00 0.00 175.55 177.09 3ghg s TYR 417 N 1.36 3.10 0.36 4.97 2.02 -1.26 -4.97 117.35 122.93 3ghg s TYR 417 Ca 0.26 1.04 -0.27 0.00 -0.37 0.00 0.00 57.07 57.72 3ghg s TYR 417 Cb -0.07 -3.75 -0.09 0.00 -0.40 0.00 0.00 41.96 37.64 3ghg s TYR 417 CO -0.09 -0.83 1.22 -0.46 -1.57 0.00 0.00 175.55 173.82 3ghg s TRP 418 N 3.68 3.10 0.00 2.71 -0.11 -1.26 -1.05 118.94 126.01 3ghg s TRP 418 Ca 0.44 1.51 0.00 0.00 1.22 0.00 0.00 56.10 59.27 3ghg s TRP 418 Cb -0.12 -3.51 0.00 0.00 -1.50 0.00 0.00 33.47 28.34 3ghg s TRP 418 CO 0.18 -1.50 0.00 0.41 -4.62 0.00 0.00 176.95 171.42 3ghg n GLY 419 N 0.77 0.35 4.47 5.86 0.00 -1.26 -4.47 105.19 110.92 3ghg n GLY 419 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3ghg n GLY 419 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ghg n GLY 420 N -1.79 0.68 3.74 -0.02 0.00 -0.22 -4.91 105.19 102.67 3ghg n GLY 420 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3ghg n GLY 420 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ghg s GLN 421 N 0.00 4.55 0.19 1.61 -1.52 -1.26 -1.07 119.66 122.17 3ghg s GLN 421 Ca 0.00 1.78 -0.14 0.00 -1.95 0.00 0.00 55.36 55.05 3ghg s GLN 421 Cb 0.00 -3.26 0.01 0.00 -0.22 0.00 0.00 33.01 29.54 3ghg s GLN 421 CO 0.00 0.01 0.44 1.52 -0.25 0.00 0.00 175.29 177.02 3ghg s TYR 422 N -0.20 0.11 0.24 0.91 1.13 -1.15 -4.91 117.35 113.48 3ghg s TYR 422 Ca 0.51 -0.47 0.02 0.00 -1.41 0.00 0.00 57.07 55.72 3ghg s TYR 422 Cb -0.31 0.23 -0.05 0.00 -1.10 0.00 0.00 41.96 40.73 3ghg s TYR 422 CO 0.36 -0.87 0.05 0.95 -2.51 0.00 0.00 175.55 173.52 3ghg s THR 423 N -3.93 0.78 0.29 -3.49 -4.23 -1.26 -4.71 115.64 99.08 3ghg s THR 423 Ca 0.14 -2.01 -0.02 0.00 -1.18 0.00 0.00 61.69 58.63 3ghg s THR 423 Cb 0.00 -2.48 0.19 0.00 1.34 0.00 0.00 72.50 71.55 3ghg s THR 423 CO 0.00 -0.18 1.87 4.11 -0.54 0.00 0.00 174.62 179.89 3ghg h TRP 424 N 2.44 0.92 -0.50 3.99 5.08 -1.88 -3.23 115.95 122.76 3ghg h TRP 424 Ca -0.38 -0.05 -0.32 0.00 1.08 0.00 0.00 58.89 59.22 3ghg h TRP 424 Cb 1.23 -0.28 -0.12 0.00 -3.00 0.00 0.00 29.16 26.99 3ghg h TRP 424 CO 0.52 0.70 0.05 -0.40 -1.28 0.00 0.00 178.44 178.03 3ghg n ASP 425 N -4.32 5.89 0.00 0.11 5.75 -1.26 -2.29 116.55 120.43 3ghg n ASP 425 Ca 0.06 -2.84 0.00 0.00 -0.01 0.00 0.00 54.79 51.99 3ghg n ASP 425 Cb 0.16 -1.28 0.00 0.00 -1.03 0.00 0.00 41.12 38.96 3ghg n ASP 425 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 3ghg n MET 426 N 1.52 0.82 -2.25 0.11 0.00 -1.22 -5.10 117.12 111.00 3ghg n MET 426 Ca 0.41 0.00 -0.39 0.00 0.00 0.00 0.00 57.70 57.72 3ghg n MET 426 Cb 0.70 -0.10 -0.02 0.00 0.00 0.00 0.00 33.22 33.80 3ghg n MET 426 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3ghg s ALA 427 N -0.34 3.24 0.24 3.04 0.00 -0.97 -4.96 121.76 122.01 3ghg s ALA 427 Ca 0.00 1.04 0.02 0.00 0.00 0.00 0.00 51.96 53.01 3ghg s ALA 427 Cb 0.00 -3.40 0.26 0.00 0.00 0.00 0.00 23.12 19.98 3ghg s ALA 427 CO 0.00 -0.55 1.59 -0.22 0.00 0.00 0.00 175.76 176.58 3ghg h LYS 428 N 2.86 0.39 -0.04 0.00 3.64 -1.91 -2.63 116.57 118.87 3ghg h LYS 428 Ca -0.49 -0.22 -0.00 0.00 -1.27 0.00 0.00 60.65 58.67 3ghg h LYS 428 Cb 1.23 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.07 3ghg h LYS 428 CO 0.63 0.80 -0.03 0.72 -2.27 0.00 0.00 179.45 179.30 3ghg n HIS 429 N -3.96 0.14 -1.12 1.91 8.25 -1.26 -4.99 115.22 114.17 3ghg n HIS 429 Ca -0.02 -1.02 -0.04 0.00 -0.26 0.00 0.00 57.72 56.37 3ghg n HIS 429 Cb 0.56 -0.18 -0.02 0.00 1.12 0.00 0.00 29.99 31.47 3ghg n HIS 429 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ghg n GLY 430 N -1.29 0.59 0.00 -1.41 0.00 -0.99 -4.98 105.19 97.10 3ghg n GLY 430 Ca 0.17 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3ghg n GLY 430 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ghg n THR 431 N -2.48 0.00 -2.49 2.61 -2.24 -1.26 -4.78 114.28 103.64 3ghg n THR 431 Ca -0.04 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.38 3ghg n THR 431 Cb 0.34 -0.91 0.01 0.00 -2.10 0.00 0.00 70.33 67.66 3ghg n THR 431 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3ghg n ASP 432 N -1.10 6.39 -4.72 3.42 3.85 -1.26 -4.82 116.55 118.30 3ghg n ASP 432 Ca 0.00 -3.73 -0.38 0.00 -0.71 0.00 0.00 54.79 49.96 3ghg n ASP 432 Cb 0.00 -0.90 0.05 0.00 -1.35 0.00 0.00 41.12 38.92 3ghg n ASP 432 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 3ghg n ASP 433 N -0.29 2.29 0.00 -1.12 3.85 -1.26 -4.89 116.55 115.13 3ghg n ASP 433 Ca 0.44 0.94 0.00 0.00 -0.71 0.00 0.00 54.79 55.46 3ghg n ASP 433 Cb 0.34 -1.54 0.00 0.00 -1.35 0.00 0.00 41.12 38.57 3ghg n ASP 433 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3ghg n GLY 434 N 0.87 3.78 3.50 6.12 0.00 -1.26 -4.58 105.19 113.63 3ghg n GLY 434 Ca 0.12 -1.62 -0.29 0.00 0.00 0.00 0.00 46.02 44.22 3ghg n GLY 434 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3ghg n VAL 435 N -1.32 0.53 -4.01 1.61 0.31 -1.15 -4.39 118.33 109.91 3ghg n VAL 435 Ca 0.00 -0.52 -0.35 0.00 -0.01 0.00 0.00 64.34 63.46 3ghg n VAL 435 Cb 0.00 -2.06 -0.12 0.00 -0.91 0.00 0.00 33.84 30.75 3ghg n VAL 435 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3ghg s VAL 436 N 11.91 4.34 -0.34 2.52 1.01 -0.84 -0.22 120.40 138.79 3ghg s VAL 436 Ca 0.73 -0.18 -0.14 0.00 0.00 0.00 0.00 61.98 62.39 3ghg s VAL 436 Cb 0.04 -2.98 -0.01 0.00 0.00 0.00 0.00 36.38 33.43 3ghg s VAL 436 CO 0.22 0.42 0.32 0.86 0.00 0.00 0.00 175.10 176.92 3ghg s TRP 437 N 0.88 3.22 0.06 5.22 -0.11 -1.26 -1.32 118.94 125.63 3ghg s TRP 437 Ca 0.02 -0.09 -0.22 0.00 1.22 0.00 0.00 56.10 57.03 3ghg s TRP 437 Cb -0.14 -2.60 -0.14 0.00 -1.50 0.00 0.00 33.47 29.10 3ghg s TRP 437 CO 0.02 -0.40 1.58 1.98 -4.62 0.00 0.00 176.95 175.51 3ghg h MET 438 N 8.47 0.12 0.00 5.86 1.85 -1.76 -2.45 114.93 127.01 3ghg h MET 438 Ca -0.30 -0.02 0.00 0.00 -0.61 0.00 0.00 59.70 58.76 3ghg h MET 438 Cb 1.15 -0.02 0.00 0.00 0.43 0.00 0.00 31.60 33.16 3ghg h MET 438 CO 0.67 0.27 0.00 0.09 -0.40 0.00 0.00 176.91 177.54 3ghg n ASN 439 N -4.93 0.34 -0.03 1.39 3.02 -1.26 -0.39 115.26 113.39 3ghg n ASN 439 Ca -0.06 0.66 -0.06 0.00 -0.03 0.00 0.00 54.58 55.09 3ghg n ASN 439 Cb 0.12 -0.70 -0.02 0.00 -0.61 0.00 0.00 39.78 38.57 3ghg n ASN 439 CO 0.00 0.00 0.00 1.87 -2.62 0.00 0.00 177.26 176.51 3ghg n TRP 440 N -1.95 0.00 0.52 3.10 -0.00 -1.07 -4.77 117.44 113.26 3ghg n TRP 440 Ca -0.01 0.00 0.06 0.00 -0.00 0.00 0.00 57.50 57.55 3ghg n TRP 440 Cb 0.02 -0.31 0.03 0.00 -0.00 0.00 0.00 31.31 31.05 3ghg n TRP 440 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 3ghg n LYS 441 N -4.04 1.33 -0.27 5.87 4.76 -0.95 -5.10 118.16 119.76 3ghg n LYS 441 Ca -0.09 -0.96 0.04 0.00 -2.87 0.00 0.00 58.31 54.43 3ghg n LYS 441 Cb 0.32 -1.19 -0.01 0.00 -1.84 0.00 0.00 35.03 32.32 3ghg n LYS 441 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3ghg n GLY 442 N 0.83 -2.08 0.26 0.72 0.00 0.47 -4.37 105.19 101.02 3ghg n GLY 442 Ca 0.06 -1.41 0.13 0.00 0.00 0.00 0.00 46.02 44.80 3ghg n GLY 442 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3ghg h SER 443 N -0.25 0.00 -0.83 1.61 0.02 -1.88 -3.31 113.55 108.90 3ghg h SER 443 Ca 0.01 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.37 3ghg h SER 443 Cb 0.25 0.00 -0.36 0.00 0.14 0.00 0.00 62.40 62.43 3ghg h SER 443 CO 0.00 0.13 -0.07 0.79 -1.14 0.00 0.00 176.83 176.53 3ghg n TRP 444 N -3.46 2.87 -3.71 3.45 7.02 -1.26 -4.81 117.44 117.54 3ghg n TRP 444 Ca -0.01 -2.52 -0.12 0.00 -1.02 0.00 0.00 57.50 53.83 3ghg n TRP 444 Cb 0.29 -0.81 -0.12 0.00 -2.42 0.00 0.00 31.31 28.25 3ghg n TRP 444 CO 0.00 0.00 0.00 -0.47 -2.02 0.00 0.00 177.69 175.20 3ghg s TYR 445 N -3.68 -0.45 -0.23 -5.99 6.14 -1.25 -2.95 117.35 108.95 3ghg s TYR 445 Ca 0.56 1.00 -0.05 0.00 0.64 0.00 0.00 57.07 59.22 3ghg s TYR 445 Cb 0.45 0.14 -0.02 0.00 0.42 0.00 0.00 41.96 42.95 3ghg s TYR 445 CO 0.02 -0.28 0.00 0.45 0.64 0.00 0.00 175.55 176.38 3ghg s SER 446 N 1.36 4.64 0.94 4.32 0.15 -0.23 -4.26 113.70 120.63 3ghg s SER 446 Ca -0.09 -0.33 -0.11 0.00 0.70 0.00 0.00 55.95 56.12 3ghg s SER 446 Cb -0.10 -1.81 0.11 0.00 -1.71 0.00 0.00 66.02 62.51 3ghg s SER 446 CO -0.10 -0.03 0.86 0.23 1.20 0.00 0.00 173.24 175.40 3ghg n MET 447 N 4.85 -0.50 -0.07 5.44 0.00 0.69 -4.16 117.12 123.37 3ghg n MET 447 Ca -0.17 -0.09 -0.12 0.00 0.00 0.00 0.00 57.70 57.32 3ghg n MET 447 Cb 0.51 -2.18 -0.10 0.00 0.00 0.00 0.00 33.22 31.46 3ghg n MET 447 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 175.97 175.88 3ghg h ARG 448 N -1.82 0.00 -6.55 0.03 2.43 -1.83 -3.46 114.38 103.18 3ghg h ARG 448 Ca -0.44 0.00 -0.67 0.00 -0.81 0.00 0.00 59.98 58.06 3ghg h ARG 448 Cb 1.28 0.00 -0.16 0.00 -0.42 0.00 0.00 29.97 30.66 3ghg h ARG 448 CO 0.39 0.75 -0.75 0.15 -1.51 0.00 0.00 179.97 179.01 3ghg s LYS 449 N -2.11 2.12 -0.26 0.20 -0.14 -1.25 -3.97 119.74 114.34 3ghg s LYS 449 Ca -0.16 -1.01 -0.26 0.00 -1.36 0.00 0.00 55.97 53.17 3ghg s LYS 449 Cb -0.01 -2.29 0.11 0.00 -1.68 0.00 0.00 37.83 33.96 3ghg s LYS 449 CO 0.52 0.51 0.94 1.41 -0.76 0.00 0.00 175.35 177.97 3ghg s MET 450 N -2.10 0.62 -0.06 1.68 -2.45 -0.22 -2.19 119.30 114.58 3ghg s MET 450 Ca 0.20 0.64 -0.30 0.00 -1.25 0.00 0.00 55.69 54.98 3ghg s MET 450 Cb -0.11 0.30 0.09 0.00 1.25 0.00 0.00 34.83 36.36 3ghg s MET 450 CO 0.12 -0.09 0.78 -1.54 1.05 0.00 0.00 175.02 175.34 3ghg s SER 451 N 0.08 -0.55 0.10 1.11 1.04 -0.89 0.87 113.70 115.46 3ghg s SER 451 Ca 0.01 0.51 0.03 0.00 0.48 0.00 0.00 55.95 56.99 3ghg s SER 451 Cb -0.04 0.47 -0.04 0.00 0.10 0.00 0.00 66.02 66.51 3ghg s SER 451 CO -0.03 -0.57 -0.09 -0.04 0.98 0.00 0.00 173.24 173.49 3ghg s MET 452 N -1.54 0.85 -0.22 4.02 -1.94 0.16 -2.14 119.30 118.49 3ghg s MET 452 Ca -0.06 -1.21 -0.29 0.00 -1.71 0.00 0.00 55.69 52.42 3ghg s MET 452 Cb -0.00 -0.46 0.15 0.00 2.01 0.00 0.00 34.83 36.53 3ghg s MET 452 CO 0.04 0.06 1.16 -1.59 -0.01 0.00 0.00 175.02 174.67 3ghg s LYS 453 N -3.07 0.36 0.30 2.03 -2.85 -0.90 -0.82 119.74 114.80 3ghg s LYS 453 Ca 0.07 0.12 0.03 0.00 -1.00 0.00 0.00 55.97 55.19 3ghg s LYS 453 Cb -0.01 0.17 -0.05 0.00 -2.06 0.00 0.00 37.83 35.88 3ghg s LYS 453 CO -0.01 -0.11 0.09 0.96 0.10 0.00 0.00 175.35 176.39 3ghg s ILE 454 N -0.94 0.75 -0.18 3.79 -4.36 -0.33 -0.80 121.20 119.13 3ghg s ILE 454 Ca 0.03 -2.00 -0.30 0.00 -0.26 0.00 0.00 60.65 58.12 3ghg s ILE 454 Cb -0.01 -2.65 0.14 0.00 1.25 0.00 0.00 42.46 41.19 3ghg s ILE 454 CO -0.03 0.00 1.05 -0.60 0.24 0.00 0.00 174.94 175.60 3ghg s ARG 455 N -3.93 0.51 0.91 0.37 3.52 -0.72 -1.05 118.95 118.57 3ghg s ARG 455 Ca 0.36 0.15 -0.12 0.00 -0.13 0.00 0.00 55.73 55.99 3ghg s ARG 455 Cb 0.07 0.24 0.14 0.00 -1.56 0.00 0.00 34.95 33.84 3ghg s ARG 455 CO 0.15 -0.16 1.10 -2.14 -0.81 0.00 0.00 175.30 173.44 3ghg s PRO 456 N -1.02 1.11 0.00 5.12 0.02 -1.26 -0.55 135.00 138.43 3ghg s PRO 456 Ca -0.00 0.68 0.00 0.00 0.02 0.00 0.00 61.00 61.70 3ghg s PRO 456 Cb -0.01 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.71 3ghg s PRO 456 CO -0.00 -2.30 0.00 0.34 -0.33 0.00 0.00 177.00 174.71 3ghg n PHE 457 N -3.90 0.00 -0.87 6.54 7.35 -0.07 -4.62 117.46 121.89 3ghg n PHE 457 Ca 0.06 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.75 3ghg n PHE 457 Cb 0.56 -0.19 0.00 0.00 0.35 0.00 0.00 39.48 40.20 3ghg n PHE 457 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19