#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gr6 s LEU 11 N 0.00 4.04 0.07 -4.53 2.01 -1.26 -4.74 118.68 114.27 2gr6 s LEU 11 Ca 0.00 1.37 -0.19 0.00 0.01 0.00 0.00 54.13 55.32 2gr6 s LEU 11 Cb 0.00 -4.17 -0.07 0.00 0.01 0.00 0.00 46.19 41.97 2gr6 s LEU 11 CO 0.00 -0.23 0.57 0.00 1.01 0.00 0.00 176.35 177.70 2gr6 s ALA 12 N -2.02 3.59 0.11 4.21 0.00 0.35 -5.00 121.76 123.00 2gr6 s ALA 12 Ca 0.56 0.04 -0.36 0.00 0.00 0.00 0.00 51.96 52.20 2gr6 s ALA 12 Cb -0.10 -2.64 -0.16 0.00 0.00 0.00 0.00 23.12 20.22 2gr6 s ALA 12 CO 0.17 0.39 1.41 -0.35 0.00 0.00 0.00 175.76 177.37 2gr6 n PRO 13 N 1.76 1.47 -1.67 0.00 -0.04 -1.26 -4.77 135.00 130.48 2gr6 n PRO 13 Ca -0.10 0.53 -0.42 0.00 -0.04 0.00 0.00 63.50 63.46 2gr6 n PRO 13 Cb 0.51 -2.21 -0.03 0.00 -0.04 0.00 0.00 33.50 31.73 2gr6 n PRO 13 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2gr6 s LEU 14 N 0.61 4.15 0.68 1.53 2.96 -1.26 -4.95 118.68 122.40 2gr6 s LEU 14 Ca 0.82 2.43 -0.17 0.00 -0.22 0.00 0.00 54.13 56.99 2gr6 s LEU 14 Cb -0.86 -3.52 0.01 0.00 0.50 0.00 0.00 46.19 42.31 2gr6 s LEU 14 CO 0.44 -1.31 1.28 -2.84 -1.32 0.00 0.00 176.35 172.60 2gr6 s PRO 15 N 4.99 2.38 0.19 0.98 0.02 -1.26 -4.92 135.00 137.38 2gr6 s PRO 15 Ca 0.91 2.00 -0.22 0.00 0.02 0.00 0.00 61.00 63.72 2gr6 s PRO 15 Cb -0.39 -1.83 0.12 0.00 0.02 0.00 0.00 34.50 32.41 2gr6 s PRO 15 CO 0.39 -1.71 1.57 -1.35 -0.33 0.00 0.00 177.00 175.57 2gr6 h PRO 16 N 0.28 -0.12 0.00 5.54 0.11 -2.05 -2.24 132.00 133.52 2gr6 h PRO 16 Ca -0.50 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2gr6 h PRO 16 Cb 1.33 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.47 2gr6 h PRO 16 CO 0.52 -0.08 0.00 -2.39 -0.21 0.00 0.00 178.00 175.84 2gr6 n HIS 17 N -5.42 0.00 -3.24 0.65 1.44 -1.26 -4.73 115.22 102.65 2gr6 n HIS 17 Ca 0.05 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.36 2gr6 n HIS 17 Cb 0.36 -0.15 -0.08 0.00 0.12 0.00 0.00 29.99 30.24 2gr6 n HIS 17 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2gr6 s VAL 18 N -2.31 5.05 0.20 0.61 1.01 -0.85 -4.89 120.40 119.22 2gr6 s VAL 18 Ca 0.21 0.69 -0.30 0.00 0.00 0.00 0.00 61.98 62.57 2gr6 s VAL 18 Cb 0.12 -3.87 -0.09 0.00 0.00 0.00 0.00 36.38 32.53 2gr6 s VAL 18 CO 0.23 -0.02 1.36 -2.84 0.00 0.00 0.00 175.10 173.84 2gr6 s PRO 19 N 2.34 4.34 0.52 2.72 0.02 -1.26 -4.86 135.00 138.83 2gr6 s PRO 19 Ca 0.20 2.13 0.27 0.00 0.02 0.00 0.00 61.00 63.62 2gr6 s PRO 19 Cb -0.15 -3.18 1.40 0.00 0.02 0.00 0.00 34.50 32.58 2gr6 s PRO 19 CO 0.11 -0.34 1.95 0.93 -0.33 0.00 0.00 177.00 179.32 2gr6 h GLU 20 N 5.58 0.04 0.00 5.54 4.39 -1.97 -0.20 114.58 127.96 2gr6 h GLU 20 Ca -0.44 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.25 2gr6 h GLU 20 Cb 1.21 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.86 2gr6 h GLU 20 CO 0.79 0.02 0.00 -2.39 -1.16 0.00 0.00 179.01 176.28 2gr6 n HIS 21 N -4.35 0.00 0.53 4.33 1.44 -1.26 -2.89 115.22 113.03 2gr6 n HIS 21 Ca 0.14 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.91 2gr6 n HIS 21 Cb 0.74 -0.01 0.04 0.00 0.12 0.00 0.00 29.99 30.88 2gr6 n HIS 21 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2gr6 n LEU 22 N -1.01 1.84 -4.66 2.39 4.77 -0.09 -4.96 117.00 115.28 2gr6 n LEU 22 Ca 0.23 -0.92 -0.43 0.00 -0.03 0.00 0.00 56.01 54.86 2gr6 n LEU 22 Cb 0.11 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.18 2gr6 n LEU 22 CO 0.18 0.35 0.98 -0.69 -1.33 0.00 0.00 177.39 176.87 2gr6 s VAL 23 N -1.22 4.51 -0.27 4.08 1.01 -1.14 0.51 120.40 127.87 2gr6 s VAL 23 Ca 0.13 1.82 -0.04 0.00 0.00 0.00 0.00 61.98 63.90 2gr6 s VAL 23 Cb 0.10 -4.17 0.09 0.00 0.00 0.00 0.00 36.38 32.40 2gr6 s VAL 23 CO 0.21 -0.14 0.12 0.12 0.00 0.00 0.00 175.10 175.40 2gr6 s PHE 24 N 3.18 0.54 -1.20 5.22 5.36 0.89 -4.88 117.98 127.10 2gr6 s PHE 24 Ca 0.49 -0.93 -0.21 0.00 -0.96 0.00 0.00 56.93 55.33 2gr6 s PHE 24 Cb -0.18 -1.00 -0.04 0.00 -0.34 0.00 0.00 43.02 41.46 2gr6 s PHE 24 CO 0.11 -0.78 1.88 -0.25 -1.46 0.00 0.00 175.22 174.72 2gr6 n ASP 25 N 5.18 3.64 -4.68 6.13 10.43 -1.26 -3.82 116.55 132.18 2gr6 n ASP 25 Ca -0.06 -2.77 -0.37 0.00 2.57 0.00 0.00 54.79 54.17 2gr6 n ASP 25 Cb 0.43 -1.69 -0.09 0.00 1.84 0.00 0.00 41.12 41.62 2gr6 n ASP 25 CO 0.00 0.00 0.00 0.12 -1.07 0.00 0.00 177.20 176.25 2gr6 s PHE 26 N 8.12 3.35 -0.52 1.24 5.36 -1.26 -4.96 117.98 129.31 2gr6 s PHE 26 Ca 0.62 0.36 -0.14 0.00 -0.96 0.00 0.00 56.93 56.81 2gr6 s PHE 26 Cb 0.03 -2.32 0.13 0.00 -0.34 0.00 0.00 43.02 40.52 2gr6 s PHE 26 CO 0.11 0.10 0.45 0.34 -1.46 0.00 0.00 175.22 174.76 2gr6 s ASP 27 N 0.90 6.03 0.66 6.13 2.15 -1.26 -4.65 116.67 126.64 2gr6 s ASP 27 Ca 0.11 -1.83 0.38 0.00 0.43 0.00 0.00 52.55 51.63 2gr6 s ASP 27 Cb -0.13 -2.15 2.06 0.00 -0.30 0.00 0.00 42.92 42.40 2gr6 s ASP 27 CO 0.04 -0.81 2.17 0.00 -0.17 0.00 0.00 175.17 176.40 2gr6 h MET 28 N 8.75 0.00 -0.01 4.34 -0.00 -1.96 -0.19 114.93 125.86 2gr6 h MET 28 Ca -0.27 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.43 2gr6 h MET 28 Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.69 2gr6 h MET 28 CO 0.98 0.00 -0.63 0.66 -0.00 0.00 0.00 176.91 177.93 2gr6 n TYR 29 N -3.04 0.00 -2.76 -0.10 4.02 -1.26 -2.87 117.16 111.15 2gr6 n TYR 29 Ca -0.02 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.78 2gr6 n TYR 29 Cb 0.22 -0.05 0.06 0.00 -0.02 0.00 0.00 39.34 39.54 2gr6 n TYR 29 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2gr6 n ASN 30 N -0.84 -2.57 -4.78 7.72 2.85 -0.22 -4.43 115.26 112.99 2gr6 n ASN 30 Ca 0.07 -3.44 -0.41 0.00 -0.11 0.00 0.00 54.58 50.70 2gr6 n ASN 30 Cb 0.38 1.78 -0.00 0.00 1.24 0.00 0.00 39.78 43.18 2gr6 n ASN 30 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 2gr6 s PRO 31 N 0.45 4.11 0.18 1.20 0.04 -0.39 -4.63 135.00 135.94 2gr6 s PRO 31 Ca 0.28 2.57 -0.24 0.00 0.04 0.00 0.00 61.00 63.66 2gr6 s PRO 31 Cb 0.25 -2.97 0.07 0.00 0.04 0.00 0.00 34.50 31.89 2gr6 s PRO 31 CO -0.17 -0.54 1.57 1.03 0.04 0.00 0.00 177.00 178.93 2gr6 h SER 32 N 3.06 -1.42 -0.32 6.66 0.87 -1.88 -1.82 113.55 118.70 2gr6 h SER 32 Ca -0.51 0.25 -0.07 0.00 -1.23 0.00 0.00 61.79 60.23 2gr6 h SER 32 Cb 1.24 0.66 -0.04 0.00 -0.44 0.00 0.00 62.40 63.82 2gr6 h SER 32 CO 0.65 -0.32 0.09 -3.20 -0.53 0.00 0.00 176.83 173.51 2gr6 n ASN 33 N -5.41 3.21 -0.16 6.23 4.05 -1.26 -4.55 115.26 117.37 2gr6 n ASN 33 Ca 0.03 -2.51 0.29 0.00 0.45 0.00 0.00 54.58 52.83 2gr6 n ASN 33 Cb 0.35 -0.61 0.69 0.00 1.23 0.00 0.00 39.78 41.45 2gr6 n ASN 33 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 2gr6 h LEU 34 N 1.57 0.00 -1.26 1.20 5.85 -1.58 0.99 115.31 122.08 2gr6 h LEU 34 Ca 0.09 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.81 2gr6 h LEU 34 Cb 1.38 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.41 2gr6 h LEU 34 CO 0.31 0.00 0.00 0.28 -0.34 0.00 0.00 178.44 178.69 2gr6 h SER 35 N 0.00 0.00 0.20 1.25 0.02 -1.85 -2.66 113.55 110.51 2gr6 h SER 35 Ca 0.42 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.37 2gr6 h SER 35 Cb 1.99 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.53 2gr6 h SER 35 CO -0.00 0.00 -0.22 0.00 -1.14 0.00 0.00 176.83 175.46 2gr6 n ALA 36 N -2.08 3.01 0.00 3.77 0.00 0.34 -4.99 120.51 120.57 2gr6 n ALA 36 Ca 0.01 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.04 2gr6 n ALA 36 Cb 0.33 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.64 2gr6 n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gr6 n GLY 37 N 1.32 4.07 0.36 0.00 0.00 -1.00 -4.76 105.19 105.17 2gr6 n GLY 37 Ca 0.13 -1.26 -0.03 0.00 0.00 0.00 0.00 46.02 44.86 2gr6 n GLY 37 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2gr6 h VAL 38 N 0.00 1.25 -0.47 1.61 3.04 -1.87 0.46 116.25 120.26 2gr6 h VAL 38 Ca 0.00 -0.61 -0.13 0.00 -1.01 0.00 0.00 66.70 64.95 2gr6 h VAL 38 Cb 0.00 0.08 -0.01 0.00 -2.01 0.00 0.00 31.29 29.34 2gr6 h VAL 38 CO 0.00 0.28 -0.22 1.56 -1.01 0.00 0.00 177.57 178.18 2gr6 h GLN 39 N 1.20 0.96 -0.09 4.17 7.50 -1.93 -2.52 115.11 124.40 2gr6 h GLN 39 Ca 0.30 -0.41 0.00 0.00 0.50 0.00 0.00 58.65 59.05 2gr6 h GLN 39 Cb 0.02 -0.03 -0.00 0.00 0.05 0.00 0.00 27.48 27.51 2gr6 h GLN 39 CO -0.05 1.07 0.06 0.93 -1.50 0.00 0.00 178.83 179.34 2gr6 h GLU 40 N 0.83 0.12 -0.99 1.46 3.07 -1.74 0.09 114.58 117.43 2gr6 h GLU 40 Ca 0.11 -0.01 0.15 0.00 -0.50 0.00 0.00 59.36 59.11 2gr6 h GLU 40 Cb 0.79 -0.03 -0.09 0.00 -0.84 0.00 0.00 28.75 28.58 2gr6 h GLU 40 CO 0.07 0.11 0.62 0.00 -1.40 0.00 0.00 179.01 178.40 2gr6 h ALA 41 N 1.01 1.64 -0.00 3.43 0.00 -0.77 0.71 119.26 125.28 2gr6 h ALA 41 Ca 0.03 0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.82 2gr6 h ALA 41 Cb 0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2gr6 h ALA 41 CO -0.01 0.07 -0.77 -1.49 0.00 0.00 0.00 179.25 177.05 2gr6 h TRP 42 N 0.86 0.08 0.00 0.00 4.06 -1.03 -3.11 115.95 116.80 2gr6 h TRP 42 Ca 0.52 -0.04 0.00 0.00 2.06 0.00 0.00 58.89 61.43 2gr6 h TRP 42 Cb 0.69 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 28.84 2gr6 h TRP 42 CO -0.00 0.80 0.00 0.00 -3.56 0.00 0.00 178.44 175.68 2gr6 n ALA 43 N -2.41 1.65 0.29 1.49 0.00 0.22 -1.69 120.51 120.06 2gr6 n ALA 43 Ca -0.01 -0.05 0.17 0.00 0.00 0.00 0.00 53.44 53.55 2gr6 n ALA 43 Cb 0.74 -1.18 0.68 0.00 0.00 0.00 0.00 19.45 19.69 2gr6 n ALA 43 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2gr6 h VAL 44 N 0.00 0.00 0.00 0.00 -1.51 -1.44 -0.83 116.25 112.47 2gr6 h VAL 44 Ca 0.00 -0.49 0.00 0.00 -1.23 0.00 0.00 66.70 64.98 2gr6 h VAL 44 Cb 0.12 1.47 0.00 0.00 -2.13 0.00 0.00 31.29 30.75 2gr6 h VAL 44 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 177.57 176.52 2gr6 n LEU 45 N -3.03 0.00 -0.05 4.19 4.77 -0.68 -3.08 117.00 119.11 2gr6 n LEU 45 Ca 0.01 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.05 2gr6 n LEU 45 Cb 0.30 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.47 2gr6 n LEU 45 CO 0.27 0.00 0.53 0.00 -1.33 0.00 0.00 177.39 176.86 2gr6 n GLN 46 N -0.83 1.87 -1.71 3.23 6.02 -0.32 -4.80 117.38 120.84 2gr6 n GLN 46 Ca 0.14 -2.13 -0.31 0.00 -0.01 0.00 0.00 57.00 54.69 2gr6 n GLN 46 Cb 0.06 -1.29 0.04 0.00 1.02 0.00 0.00 30.24 30.07 2gr6 n GLN 46 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2gr6 s GLU 47 N -2.11 3.14 0.45 -1.09 2.02 -1.18 -4.94 118.70 114.99 2gr6 s GLU 47 Ca 0.19 0.82 0.16 0.00 0.02 0.00 0.00 54.97 56.16 2gr6 s GLU 47 Cb 0.17 -2.02 1.10 0.00 0.10 0.00 0.00 34.13 33.47 2gr6 s GLU 47 CO 0.02 -0.92 1.97 0.66 0.02 0.00 0.00 175.26 177.01 2gr6 h SER 48 N -0.58 0.31 -0.02 -0.19 4.64 -1.96 -1.40 113.55 114.35 2gr6 h SER 48 Ca -0.44 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2gr6 h SER 48 Cb 1.21 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2gr6 h SER 48 CO 0.60 0.18 0.00 -0.46 -0.87 0.00 0.00 176.83 176.27 2gr6 n ASN 49 N -4.46 0.15 -4.35 4.97 6.94 -1.26 -4.80 115.26 112.45 2gr6 n ASN 49 Ca 0.11 -1.71 -0.33 0.00 -0.02 0.00 0.00 54.58 52.63 2gr6 n ASN 49 Cb 0.44 -0.01 -0.15 0.00 -2.36 0.00 0.00 39.78 37.70 2gr6 n ASN 49 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2gr6 s VAL 50 N -1.97 2.89 0.58 3.53 1.01 -0.53 -5.12 120.40 120.80 2gr6 s VAL 50 Ca 0.16 -0.72 -0.18 0.00 0.00 0.00 0.00 61.98 61.23 2gr6 s VAL 50 Cb 0.07 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 2gr6 s VAL 50 CO 0.12 0.53 1.16 -2.84 0.00 0.00 0.00 175.10 174.08 2gr6 s PRO 51 N 0.30 3.09 0.12 2.72 0.02 -1.26 -4.79 135.00 135.21 2gr6 s PRO 51 Ca -0.11 1.68 0.09 0.00 0.02 0.00 0.00 61.00 62.67 2gr6 s PRO 51 Cb -0.16 -1.96 0.48 0.00 0.02 0.00 0.00 34.50 32.88 2gr6 s PRO 51 CO 0.06 -1.07 1.28 -0.25 -0.33 0.00 0.00 177.00 176.69 2gr6 n ASP 52 N -1.60 0.22 -3.25 2.53 10.43 -1.26 -4.11 116.55 119.51 2gr6 n ASP 52 Ca 0.12 0.60 -0.04 0.00 2.57 0.00 0.00 54.79 58.04 2gr6 n ASP 52 Cb 0.50 -0.63 -0.04 0.00 1.84 0.00 0.00 41.12 42.80 2gr6 n ASP 52 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 2gr6 s LEU 53 N -3.59 -1.07 0.41 0.64 2.96 -1.26 -1.81 118.68 114.95 2gr6 s LEU 53 Ca -0.01 -0.16 0.08 0.00 -0.22 0.00 0.00 54.13 53.82 2gr6 s LEU 53 Cb 0.03 1.43 -0.01 0.00 0.50 0.00 0.00 46.19 48.14 2gr6 s LEU 53 CO 0.09 -0.33 0.43 0.68 -1.32 0.00 0.00 176.35 175.90 2gr6 s VAL 54 N 2.64 2.91 -0.05 1.68 -7.23 -0.98 -4.93 120.40 114.44 2gr6 s VAL 54 Ca 0.10 -1.23 0.05 0.00 -1.81 0.00 0.00 61.98 59.09 2gr6 s VAL 54 Cb -0.12 -3.04 -0.01 0.00 0.56 0.00 0.00 36.38 33.78 2gr6 s VAL 54 CO -0.28 -0.02 -0.20 0.86 -0.31 0.00 0.00 175.10 175.15 2gr6 s TRP 55 N -2.41 1.96 -0.02 2.82 -0.11 0.18 -1.24 118.94 120.13 2gr6 s TRP 55 Ca 0.49 -0.58 0.05 0.00 1.22 0.00 0.00 56.10 57.28 2gr6 s TRP 55 Cb -0.06 -1.31 -0.03 0.00 -1.50 0.00 0.00 33.47 30.58 2gr6 s TRP 55 CO 0.29 -0.19 -0.17 -0.08 -4.62 0.00 0.00 176.95 172.19 2gr6 s THR 56 N -0.00 2.87 -2.56 5.86 -1.32 -0.37 -0.08 115.64 120.05 2gr6 s THR 56 Ca -0.04 -0.90 0.25 0.00 -1.21 0.00 0.00 61.69 59.78 2gr6 s THR 56 Cb -0.12 -2.14 0.43 0.00 -1.51 0.00 0.00 72.50 69.16 2gr6 s THR 56 CO 0.03 0.51 1.54 0.54 -2.21 0.00 0.00 174.62 175.04 2gr6 n ARG 57 N 2.09 1.94 -1.99 7.08 1.74 -1.26 -0.89 116.66 125.36 2gr6 n ARG 57 Ca -0.17 -1.38 -0.32 0.00 -0.77 0.00 0.00 57.85 55.22 2gr6 n ARG 57 Cb 0.52 -1.46 0.01 0.00 -1.02 0.00 0.00 32.46 30.51 2gr6 n ARG 57 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2gr6 n ASN 59 N -2.33 -1.23 0.00 0.00 4.13 -1.26 -0.73 115.26 113.84 2gr6 n ASN 59 Ca 0.07 -1.19 0.00 0.00 1.68 0.00 0.00 54.58 55.14 2gr6 n ASN 59 Cb 0.54 -2.16 0.00 0.00 -1.54 0.00 0.00 39.78 36.61 2gr6 n ASN 59 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2gr6 n GLY 60 N -2.22 2.81 0.15 7.41 0.00 -1.26 -4.63 105.19 107.45 2gr6 n GLY 60 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2gr6 n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gr6 n GLY 61 N -2.00 -1.51 3.48 -0.02 0.00 0.09 -4.89 105.19 100.34 2gr6 n GLY 61 Ca 0.00 -1.04 -0.11 0.00 0.00 0.00 0.00 46.02 44.87 2gr6 n GLY 61 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2gr6 s HIS 62 N -0.31 -0.44 0.69 1.61 -3.43 -0.07 -4.73 115.29 108.60 2gr6 s HIS 62 Ca 0.00 0.36 -0.11 0.00 -0.80 0.00 0.00 55.06 54.50 2gr6 s HIS 62 Cb 0.00 0.53 0.00 0.00 -1.43 0.00 0.00 32.58 31.68 2gr6 s HIS 62 CO 0.00 -0.65 1.06 -1.58 -2.00 0.00 0.00 174.74 171.57 2gr6 s TRP 63 N -3.07 3.30 -0.21 0.38 0.52 0.19 -1.24 118.94 118.81 2gr6 s TRP 63 Ca 0.02 1.25 -0.04 0.00 0.02 0.00 0.00 56.10 57.35 2gr6 s TRP 63 Cb -0.01 -2.90 0.11 0.00 -1.15 0.00 0.00 33.47 29.52 2gr6 s TRP 63 CO -0.08 -1.11 0.30 0.42 0.02 0.00 0.00 176.95 176.49 2gr6 s ILE 64 N -3.18 -0.46 0.12 2.03 1.01 -0.37 0.27 121.20 120.61 2gr6 s ILE 64 Ca 0.57 -0.06 -0.30 0.00 0.00 0.00 0.00 60.65 60.87 2gr6 s ILE 64 Cb -0.12 -0.72 -0.06 0.00 0.01 0.00 0.00 42.46 41.57 2gr6 s ILE 64 CO 0.54 -0.14 1.08 0.00 0.00 0.00 0.00 174.94 176.42 2gr6 s ALA 65 N 2.44 3.32 -0.76 9.38 0.00 -0.88 -2.33 121.76 132.93 2gr6 s ALA 65 Ca 0.09 0.74 0.16 0.00 0.00 0.00 0.00 51.96 52.95 2gr6 s ALA 65 Cb -0.15 -3.36 -0.18 0.00 0.00 0.00 0.00 23.12 19.43 2gr6 s ALA 65 CO -0.13 -0.22 0.69 0.25 0.00 0.00 0.00 175.76 176.34 2gr6 n THR 66 N 2.98 0.00 -4.38 0.00 -2.24 -0.75 -4.45 114.28 105.45 2gr6 n THR 66 Ca 0.04 -0.12 -0.27 0.00 -2.27 0.00 0.00 64.05 61.44 2gr6 n THR 66 Cb 0.47 0.98 -0.11 0.00 -2.10 0.00 0.00 70.33 69.58 2gr6 n THR 66 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2gr6 s ARG 67 N -2.56 1.69 0.49 -0.78 1.81 -1.26 -4.77 118.95 113.58 2gr6 s ARG 67 Ca 0.06 -1.44 0.17 0.00 -1.72 0.00 0.00 55.73 52.80 2gr6 s ARG 67 Cb 0.12 -1.95 1.21 0.00 -0.45 0.00 0.00 34.95 33.88 2gr6 s ARG 67 CO 0.67 0.41 2.09 0.78 -0.68 0.00 0.00 175.30 178.57 2gr6 h GLY 68 N 3.12 0.00 0.83 -3.53 0.00 -1.84 -2.19 103.07 99.47 2gr6 h GLY 68 Ca -0.47 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.79 2gr6 h GLY 68 CO 0.50 0.00 -0.17 -1.61 0.00 0.00 0.00 176.54 175.25 2gr6 h GLN 69 N 0.00 0.48 -0.25 4.80 5.75 -1.96 0.24 115.11 124.17 2gr6 h GLN 69 Ca -0.00 -0.24 -0.05 0.00 -0.15 0.00 0.00 58.65 58.21 2gr6 h GLN 69 Cb 0.16 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 2gr6 h GLN 69 CO 0.01 0.81 -0.03 -0.07 -2.65 0.00 0.00 178.83 176.90 2gr6 h LEU 70 N 0.17 0.46 -0.43 -2.39 4.07 -1.90 -0.45 115.31 114.83 2gr6 h LEU 70 Ca 0.04 -0.34 0.06 0.00 0.08 0.00 0.00 57.88 57.72 2gr6 h LEU 70 Cb 0.71 -0.13 -0.05 0.00 1.08 0.00 0.00 40.66 42.27 2gr6 h LEU 70 CO 0.04 0.69 0.12 0.40 -1.08 0.00 0.00 178.44 178.62 2gr6 h ILE 71 N 0.23 0.82 -0.36 1.22 2.04 -1.37 0.10 117.51 120.20 2gr6 h ILE 71 Ca 0.07 -0.09 -0.08 0.00 1.00 0.00 0.00 64.86 65.76 2gr6 h ILE 71 Cb 0.47 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 2gr6 h ILE 71 CO 0.02 0.05 -0.08 0.03 0.00 0.00 0.00 178.15 178.17 2gr6 h ARG 72 N 0.27 0.68 -0.24 2.37 3.08 -0.88 -2.40 114.38 117.26 2gr6 h ARG 72 Ca 0.21 -0.26 0.04 0.00 0.07 0.00 0.00 59.98 60.04 2gr6 h ARG 72 Cb 0.23 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.20 2gr6 h ARG 72 CO -0.24 0.84 0.01 1.49 -1.07 0.00 0.00 179.97 181.00 2gr6 h GLU 73 N 0.47 0.08 -0.40 0.04 4.81 -0.52 -1.48 114.58 117.58 2gr6 h GLU 73 Ca 0.09 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 2gr6 h GLU 73 Cb 0.58 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.92 2gr6 h GLU 73 CO 0.03 0.05 0.17 0.00 -0.73 0.00 0.00 179.01 178.53 2gr6 h ALA 74 N 1.20 0.51 0.00 2.92 0.00 -0.79 -1.97 119.26 121.13 2gr6 h ALA 74 Ca 0.11 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2gr6 h ALA 74 Cb 0.14 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2gr6 h ALA 74 CO -0.18 0.11 -0.09 1.88 0.00 0.00 0.00 179.25 180.96 2gr6 h TYR 75 N 0.50 0.00 0.00 0.00 0.05 -1.14 -2.00 116.97 114.37 2gr6 h TYR 75 Ca 0.13 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.73 2gr6 h TYR 75 Cb 0.17 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.89 2gr6 h TYR 75 CO -0.00 0.09 -0.87 0.93 -1.05 0.00 0.00 178.16 177.26 2gr6 h GLU 76 N 0.00 0.00 -3.66 4.88 5.08 -0.84 -3.40 114.58 116.64 2gr6 h GLU 76 Ca -0.00 0.00 -0.78 0.00 -1.00 0.00 0.00 59.36 57.58 2gr6 h GLU 76 Cb 0.21 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 29.22 2gr6 h GLU 76 CO 0.01 0.87 1.01 -3.47 -1.00 0.00 0.00 179.01 176.43 2gr6 n ASP 77 N -3.36 5.62 0.00 1.42 4.64 -0.75 -4.80 116.55 119.32 2gr6 n ASP 77 Ca 0.00 -3.13 0.10 0.00 -1.38 0.00 0.00 54.79 50.38 2gr6 n ASP 77 Cb 0.87 -1.41 0.59 0.00 -1.04 0.00 0.00 41.12 40.13 2gr6 n ASP 77 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2gr6 n TYR 78 N 3.20 0.00 -0.03 -0.67 0.18 -1.26 -1.16 117.16 117.42 2gr6 n TYR 78 Ca 0.30 0.00 -0.14 0.00 1.88 0.00 0.00 57.90 59.94 2gr6 n TYR 78 Cb 0.38 -0.07 -0.11 0.00 -0.38 0.00 0.00 39.34 39.17 2gr6 n TYR 78 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2gr6 h ARG 79 N 0.00 0.11 0.09 -3.48 2.47 -1.93 -3.37 114.38 108.28 2gr6 h ARG 79 Ca 0.00 -0.10 -0.37 0.00 -1.26 0.00 0.00 59.98 58.26 2gr6 h ARG 79 Cb 0.04 0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.36 2gr6 h ARG 79 CO 0.00 0.78 -2.06 0.72 0.56 0.00 0.00 179.97 179.97 2gr6 n HIS 80 N -4.64 0.99 -3.47 3.04 8.25 -1.07 -4.63 115.22 113.69 2gr6 n HIS 80 Ca -0.09 0.22 -0.43 0.00 -0.26 0.00 0.00 57.72 57.16 2gr6 n HIS 80 Cb 0.41 -1.13 -0.04 0.00 1.12 0.00 0.00 29.99 30.35 2gr6 n HIS 80 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2gr6 s PHE 81 N -2.54 3.75 0.60 4.41 0.08 -0.31 -1.11 117.98 122.86 2gr6 s PHE 81 Ca -0.25 -2.41 -0.16 0.00 0.12 0.00 0.00 56.93 54.22 2gr6 s PHE 81 Cb 0.07 -3.59 -0.03 0.00 -0.57 0.00 0.00 43.02 38.90 2gr6 s PHE 81 CO 0.72 -0.91 1.07 0.45 -0.10 0.00 0.00 175.22 176.45 2gr6 s SER 82 N 1.36 5.66 0.00 1.36 0.15 -0.78 -4.31 113.70 117.14 2gr6 s SER 82 Ca 0.21 1.88 0.22 0.00 0.70 0.00 0.00 55.95 58.95 2gr6 s SER 82 Cb -0.12 -2.54 0.61 0.00 -1.71 0.00 0.00 66.02 62.25 2gr6 s SER 82 CO -0.08 -1.25 1.51 -1.20 1.20 0.00 0.00 173.24 173.42 2gr6 n SER 83 N -2.03 3.85 -0.08 5.45 7.64 -1.26 -0.89 113.62 126.29 2gr6 n SER 83 Ca 0.09 -2.00 -0.02 0.00 1.01 0.00 0.00 58.87 57.95 2gr6 n SER 83 Cb 0.53 -0.46 0.22 0.00 -1.01 0.00 0.00 64.21 63.49 2gr6 n SER 83 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2gr6 h GLU 84 N 4.12 0.71 -2.89 1.43 5.08 -1.89 -3.33 114.58 117.82 2gr6 h GLU 84 Ca 0.00 -0.16 -0.61 0.00 -1.00 0.00 0.00 59.36 57.59 2gr6 h GLU 84 Cb 0.97 -0.10 -0.40 0.00 0.50 0.00 0.00 28.75 29.72 2gr6 h GLU 84 CO 0.00 0.69 -0.74 0.00 -1.00 0.00 0.00 179.01 177.96 2gr6 n PRO 86 N 2.92 0.40 -4.00 0.00 -0.04 -1.25 -3.79 135.00 129.25 2gr6 n PRO 86 Ca 0.16 -0.32 -0.27 0.00 -0.04 0.00 0.00 63.50 63.04 2gr6 n PRO 86 Cb 0.38 -1.49 -0.04 0.00 -0.04 0.00 0.00 33.50 32.30 2gr6 n PRO 86 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2gr6 s TRP 87 N -2.82 3.34 -0.02 0.54 0.23 -1.26 -0.12 118.94 118.84 2gr6 s TRP 87 Ca 0.13 0.08 0.04 0.00 -2.03 0.00 0.00 56.10 54.32 2gr6 s TRP 87 Cb 0.17 -1.62 -0.01 0.00 0.03 0.00 0.00 33.47 32.05 2gr6 s TRP 87 CO 0.74 0.53 -0.14 0.42 0.96 0.00 0.00 176.95 179.45 2gr6 s ILE 88 N -1.69 1.17 0.94 2.03 1.01 -1.26 -2.88 121.20 120.52 2gr6 s ILE 88 Ca 0.33 -0.61 -0.11 0.00 0.00 0.00 0.00 60.65 60.26 2gr6 s ILE 88 Cb -0.11 -0.99 0.15 0.00 0.01 0.00 0.00 42.46 41.52 2gr6 s ILE 88 CO 0.26 0.34 1.09 -2.16 0.00 0.00 0.00 174.94 174.47 2gr6 s PRO 89 N -0.18 0.90 0.28 2.79 0.04 -1.26 -4.88 135.00 132.68 2gr6 s PRO 89 Ca 0.02 1.07 -0.00 0.00 0.04 0.00 0.00 61.00 62.13 2gr6 s PRO 89 Cb -0.07 -1.75 0.63 0.00 0.04 0.00 0.00 34.50 33.35 2gr6 s PRO 89 CO 0.00 -2.56 1.65 -0.09 0.04 0.00 0.00 177.00 176.04 2gr6 h ARG 90 N -1.79 0.20 0.00 4.56 2.43 -1.82 0.22 114.38 118.17 2gr6 h ARG 90 Ca -0.49 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 58.64 2gr6 h ARG 90 Cb 1.28 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2gr6 h ARG 90 CO 0.50 0.13 -0.11 1.05 -1.51 0.00 0.00 179.97 180.03 2gr6 h GLU 91 N 0.21 0.00 0.03 0.20 9.09 -1.98 0.59 114.58 122.72 2gr6 h GLU 91 Ca 0.51 0.00 -0.06 0.00 0.05 0.00 0.00 59.36 59.86 2gr6 h GLU 91 Cb 0.99 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 28.10 2gr6 h GLU 91 CO -0.63 0.11 -0.25 0.00 0.05 0.00 0.00 179.01 178.28 2gr6 h ALA 92 N 1.89 -0.01 -0.56 1.06 0.00 -0.92 -2.26 119.26 118.46 2gr6 h ALA 92 Ca -0.00 -0.53 0.09 0.00 0.00 0.00 0.00 54.91 54.47 2gr6 h ALA 92 Cb 0.26 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2gr6 h ALA 92 CO 0.01 0.10 0.38 0.78 0.00 0.00 0.00 179.25 180.52 2gr6 h GLY 93 N -0.71 0.53 1.60 0.00 0.00 -0.76 0.23 103.07 103.95 2gr6 h GLY 93 Ca -0.04 -0.16 -0.21 0.00 0.00 0.00 0.00 47.33 46.92 2gr6 h GLY 93 CO 0.05 0.10 -0.86 0.83 0.00 0.00 0.00 176.54 176.66 2gr6 h GLU 94 N 0.39 0.37 0.00 4.80 5.08 -0.91 -3.19 114.58 121.12 2gr6 h GLU 94 Ca 0.26 -0.37 -0.13 0.00 -1.00 0.00 0.00 59.36 58.11 2gr6 h GLU 94 Cb 0.49 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 2gr6 h GLU 94 CO -0.07 1.04 -0.64 0.00 -1.00 0.00 0.00 179.01 178.34 2gr6 h ALA 95 N 0.84 0.64 -2.20 3.43 0.00 -0.58 -3.44 119.26 117.95 2gr6 h ALA 95 Ca -0.06 -0.58 -0.55 0.00 0.00 0.00 0.00 54.91 53.71 2gr6 h ALA 95 Cb 1.48 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 19.17 2gr6 h ALA 95 CO 0.15 0.80 1.33 0.12 0.00 0.00 0.00 179.25 181.65 2gr6 s PHE 96 N -3.01 1.28 -0.02 0.00 5.36 0.67 -4.84 117.98 117.42 2gr6 s PHE 96 Ca 0.02 -0.02 0.11 0.00 -0.96 0.00 0.00 56.93 56.08 2gr6 s PHE 96 Cb 0.09 -4.11 0.19 0.00 -0.34 0.00 0.00 43.02 38.86 2gr6 s PHE 96 CO 0.76 -4.85 1.08 -0.40 -1.46 0.00 0.00 175.22 170.35 2gr6 n ASP 97 N 9.17 0.65 -4.76 6.13 3.85 -1.26 -4.90 116.55 125.44 2gr6 n ASP 97 Ca 0.24 -2.22 -0.39 0.00 -0.71 0.00 0.00 54.79 51.71 2gr6 n ASP 97 Cb 0.43 -0.27 0.02 0.00 -1.35 0.00 0.00 41.12 39.95 2gr6 n ASP 97 CO 0.00 0.00 0.00 -0.36 -1.01 0.00 0.00 177.20 175.83 2gr6 s PHE 98 N -0.46 2.48 -0.08 2.11 0.08 -1.26 -4.80 117.98 116.05 2gr6 s PHE 98 Ca 0.17 1.37 -0.01 0.00 0.12 0.00 0.00 56.93 58.58 2gr6 s PHE 98 Cb 0.18 -3.76 -0.03 0.00 -0.57 0.00 0.00 43.02 38.84 2gr6 s PHE 98 CO -0.06 -2.61 -0.04 0.42 -0.10 0.00 0.00 175.22 172.84 2gr6 s ILE 99 N -1.30 3.98 -1.48 0.64 1.01 -0.30 -0.50 121.20 123.25 2gr6 s ILE 99 Ca 0.66 -0.37 0.14 0.00 0.00 0.00 0.00 60.65 61.08 2gr6 s ILE 99 Cb -0.39 -2.66 0.52 0.00 0.01 0.00 0.00 42.46 39.94 2gr6 s ILE 99 CO 0.48 0.59 1.40 -0.81 0.00 0.00 0.00 174.94 176.61 2gr6 n PRO 100 N 2.28 2.79 -0.04 2.79 -0.04 -1.26 -4.06 135.00 137.45 2gr6 n PRO 100 Ca -0.18 -2.06 0.12 0.00 -0.04 0.00 0.00 63.50 61.34 2gr6 n PRO 100 Cb 0.53 -1.64 0.53 0.00 -0.04 0.00 0.00 33.50 32.89 2gr6 n PRO 100 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2gr6 h THR 101 N 3.07 0.89 -0.53 0.52 2.02 -1.89 -2.11 112.91 114.88 2gr6 h THR 101 Ca 0.00 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.07 2gr6 h THR 101 Cb 1.01 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 67.96 2gr6 h THR 101 CO 0.12 0.06 0.00 -1.54 0.37 0.00 0.00 175.52 174.53 2gr6 n SER 102 N -4.46 4.97 -4.41 4.18 3.41 0.34 -4.83 113.62 112.82 2gr6 n SER 102 Ca 0.09 -2.71 -0.30 0.00 -0.26 0.00 0.00 58.87 55.68 2gr6 n SER 102 Cb 0.37 -0.64 -0.13 0.00 -0.26 0.00 0.00 64.21 63.55 2gr6 n SER 102 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2gr6 s MET 103 N -2.37 1.87 0.04 4.33 -1.94 -0.79 -3.86 119.30 116.58 2gr6 s MET 103 Ca 0.48 -1.08 -0.00 0.00 -1.71 0.00 0.00 55.69 53.37 2gr6 s MET 103 Cb 0.35 -2.07 -0.04 0.00 2.01 0.00 0.00 34.83 35.08 2gr6 s MET 103 CO 0.16 0.52 0.17 -0.51 -0.01 0.00 0.00 175.02 175.35 2gr6 s ASP 104 N -1.47 6.18 0.87 3.03 1.01 -1.26 -4.69 116.67 120.34 2gr6 s ASP 104 Ca 0.14 0.24 -0.11 0.00 0.71 0.00 0.00 52.55 53.52 2gr6 s ASP 104 Cb -0.10 -1.87 0.11 0.00 1.01 0.00 0.00 42.92 42.07 2gr6 s ASP 104 CO 0.04 0.20 1.09 -2.16 0.21 0.00 0.00 175.17 174.56 2gr6 s PRO 105 N -2.30 1.49 0.38 8.23 0.04 -1.26 -2.29 135.00 139.29 2gr6 s PRO 105 Ca 0.31 0.79 0.19 0.00 0.04 0.00 0.00 61.00 62.33 2gr6 s PRO 105 Cb -0.13 -1.84 0.75 0.00 0.04 0.00 0.00 34.50 33.33 2gr6 s PRO 105 CO 0.24 -2.07 1.77 -1.00 0.04 0.00 0.00 177.00 175.98 2gr6 h PRO 106 N -1.43 0.00 -0.82 0.56 0.13 -2.01 -3.45 132.00 124.99 2gr6 h PRO 106 Ca -0.49 0.00 0.19 0.00 -0.87 0.00 0.00 66.00 64.84 2gr6 h PRO 106 Cb 1.28 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.29 2gr6 h PRO 106 CO 0.56 0.36 0.25 1.49 -0.23 0.00 0.00 178.00 180.43 2gr6 h GLU 107 N 0.00 0.29 -0.90 0.86 4.81 -1.95 -1.44 114.58 116.25 2gr6 h GLU 107 Ca -0.00 -0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.27 2gr6 h GLU 107 Cb 0.82 -0.07 -0.06 0.00 0.63 0.00 0.00 28.75 30.07 2gr6 h GLU 107 CO 0.05 0.19 0.56 0.37 -0.73 0.00 0.00 179.01 179.45 2gr6 h GLN 108 N 0.30 0.99 -0.71 1.92 4.15 -1.73 -3.22 115.11 116.80 2gr6 h GLN 108 Ca 0.49 -0.06 0.15 0.00 0.77 0.00 0.00 58.65 60.00 2gr6 h GLN 108 Cb 0.90 -0.22 -0.13 0.00 0.21 0.00 0.00 27.48 28.24 2gr6 h GLN 108 CO -0.55 0.65 -0.07 0.00 -1.93 0.00 0.00 178.83 176.94 2gr6 h ARG 109 N 1.01 0.06 0.00 1.69 3.08 -1.56 0.12 114.38 118.79 2gr6 h ARG 109 Ca 0.39 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.44 2gr6 h ARG 109 Cb 0.18 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.22 2gr6 h ARG 109 CO -0.18 0.04 0.00 -0.56 -1.07 0.00 0.00 179.97 178.20 2gr6 h GLN 110 N 0.06 0.00 0.00 0.04 3.07 -1.70 -2.27 115.11 114.31 2gr6 h GLN 110 Ca 0.37 0.00 -0.20 0.00 0.09 0.00 0.00 58.65 58.91 2gr6 h GLN 110 Cb 0.62 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 28.14 2gr6 h GLN 110 CO -0.67 0.00 -1.73 1.19 0.09 0.00 0.00 178.83 177.71 2gr6 n PHE 111 N -2.56 0.64 -0.13 0.06 3.01 0.02 -4.18 117.46 114.31 2gr6 n PHE 111 Ca -0.02 0.21 -0.06 0.00 1.01 0.00 0.00 57.45 58.60 2gr6 n PHE 111 Cb 0.05 -1.00 0.12 0.00 -0.01 0.00 0.00 39.48 38.65 2gr6 n PHE 111 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2gr6 h ARG 112 N 0.00 0.85 -0.17 -1.08 3.08 -1.30 -2.08 114.38 113.67 2gr6 h ARG 112 Ca -0.23 -0.25 0.05 0.00 0.07 0.00 0.00 59.98 59.62 2gr6 h ARG 112 Cb 1.68 -0.09 -0.06 0.00 0.08 0.00 0.00 29.97 31.58 2gr6 h ARG 112 CO 0.04 0.87 -0.20 0.00 -1.07 0.00 0.00 179.97 179.60 2gr6 h ALA 113 N 1.18 -0.12 -0.18 0.04 0.00 -1.72 1.75 119.26 120.22 2gr6 h ALA 113 Ca 0.15 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2gr6 h ALA 113 Cb 0.50 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2gr6 h ALA 113 CO 0.03 -0.65 0.02 1.25 0.00 0.00 0.00 179.25 179.90 2gr6 h LEU 114 N -0.24 0.30 -0.89 0.00 5.85 -1.71 -2.53 115.31 116.08 2gr6 h LEU 114 Ca 0.11 -0.28 -0.06 0.00 0.84 0.00 0.00 57.88 58.50 2gr6 h LEU 114 Cb 0.41 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 2gr6 h LEU 114 CO -0.31 0.50 0.12 0.00 -0.34 0.00 0.00 178.44 178.41 2gr6 h ALA 115 N 0.81 1.09 0.00 1.25 0.00 -1.03 -1.34 119.26 120.05 2gr6 h ALA 115 Ca 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2gr6 h ALA 115 Cb 0.33 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2gr6 h ALA 115 CO 0.01 0.60 0.00 -1.71 0.00 0.00 0.00 179.25 178.14 2gr6 n ASN 116 N -4.24 0.00 0.03 0.00 5.15 0.59 -1.47 115.26 115.32 2gr6 n ASN 116 Ca 0.04 0.35 0.11 0.00 -0.60 0.00 0.00 54.58 54.48 2gr6 n ASN 116 Cb 0.25 -0.42 0.04 0.00 -0.53 0.00 0.00 39.78 39.13 2gr6 n ASN 116 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2gr6 n GLN 117 N -1.42 0.30 -0.05 1.20 6.02 -0.51 -2.18 117.38 120.74 2gr6 n GLN 117 Ca 0.04 0.01 -0.03 0.00 -0.01 0.00 0.00 57.00 57.01 2gr6 n GLN 117 Cb 0.13 -1.61 -0.14 0.00 1.02 0.00 0.00 30.24 29.64 2gr6 n GLN 117 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 2gr6 n VAL 118 N -2.00 1.03 -0.76 5.09 3.14 -0.54 -4.52 118.33 119.77 2gr6 n VAL 118 Ca 0.02 -0.73 0.01 0.00 -2.96 0.00 0.00 64.34 60.68 2gr6 n VAL 118 Cb 0.44 -0.45 0.01 0.00 -1.06 0.00 0.00 33.84 32.79 2gr6 n VAL 118 CO 0.00 0.00 0.00 1.33 -6.46 0.00 0.00 176.83 171.70 2gr6 n VAL 119 N -2.68 0.56 -1.04 1.55 0.24 -1.09 -4.91 118.33 110.96 2gr6 n VAL 119 Ca -0.20 -0.60 -0.30 0.00 -2.04 0.00 0.00 64.34 61.20 2gr6 n VAL 119 Cb 0.94 0.63 0.23 0.00 -1.47 0.00 0.00 33.84 34.18 2gr6 n VAL 119 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2gr6 s GLY 120 N -0.78 1.57 0.27 7.63 0.00 -0.92 -4.57 107.32 110.51 2gr6 s GLY 120 Ca 0.03 -0.82 -0.01 0.00 0.00 0.00 0.00 44.72 43.93 2gr6 s GLY 120 CO 0.00 0.02 1.81 1.98 0.00 0.00 0.00 173.10 176.91 2gr6 h MET 121 N -2.53 0.80 0.00 2.90 1.85 -1.91 -0.74 114.93 115.31 2gr6 h MET 121 Ca -0.47 -0.05 -0.00 0.00 -0.61 0.00 0.00 59.70 58.57 2gr6 h MET 121 Cb 1.31 -0.18 -0.00 0.00 0.43 0.00 0.00 31.60 33.15 2gr6 h MET 121 CO 0.38 0.53 -0.01 -1.35 -0.40 0.00 0.00 176.91 176.06 2gr6 h PRO 122 N 0.83 0.00 0.20 0.39 0.11 -1.91 -1.35 132.00 130.27 2gr6 h PRO 122 Ca 0.47 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 66.24 2gr6 h PRO 122 Cb 0.53 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.65 2gr6 h PRO 122 CO -0.29 0.01 -1.57 0.28 -0.21 0.00 0.00 178.00 176.22 2gr6 h VAL 123 N 0.00 1.15 -0.80 3.15 2.07 -1.49 -3.10 116.25 117.23 2gr6 h VAL 123 Ca -0.00 -2.69 0.02 0.00 0.82 0.00 0.00 66.70 64.86 2gr6 h VAL 123 Cb 0.02 2.89 -0.05 0.00 -1.52 0.00 0.00 31.29 32.64 2gr6 h VAL 123 CO 0.00 0.84 0.52 0.58 0.02 0.00 0.00 177.57 179.53 2gr6 h VAL 124 N 0.11 1.15 -0.43 2.57 2.07 -0.59 -0.78 116.25 120.35 2gr6 h VAL 124 Ca -0.28 -0.35 0.02 0.00 0.82 0.00 0.00 66.70 66.92 2gr6 h VAL 124 Cb 2.10 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 31.88 2gr6 h VAL 124 CO 0.22 0.19 0.24 0.44 0.02 0.00 0.00 177.57 178.68 2gr6 h ASP 125 N 1.03 0.39 -0.39 0.57 3.45 -1.35 0.23 116.42 120.34 2gr6 h ASP 125 Ca 0.31 0.01 0.07 0.00 0.43 0.00 0.00 57.03 57.85 2gr6 h ASP 125 Cb -0.03 -0.07 -0.06 0.00 -0.56 0.00 0.00 39.33 38.61 2gr6 h ASP 125 CO -0.10 0.28 0.04 0.11 -1.57 0.00 0.00 179.24 178.00 2gr6 h LYS 126 N 0.49 0.15 0.00 3.56 1.57 -1.22 -2.36 116.57 118.76 2gr6 h LYS 126 Ca 0.18 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2gr6 h LYS 126 Cb 0.03 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2gr6 h LYS 126 CO -0.09 0.10 0.00 -0.07 -0.57 0.00 0.00 179.45 178.82 2gr6 h LEU 127 N 0.16 0.00 -0.84 2.94 3.38 -0.34 -3.37 115.31 117.25 2gr6 h LEU 127 Ca 0.19 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.27 2gr6 h LEU 127 Cb 0.25 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.88 2gr6 h LEU 127 CO -0.28 0.00 -0.40 1.21 0.09 0.00 0.00 178.44 179.06 2gr6 n GLU 128 N -2.34 -0.27 -0.07 1.13 2.13 0.73 -0.69 120.64 121.26 2gr6 n GLU 128 Ca 0.04 1.28 -0.11 0.00 0.66 0.00 0.00 57.16 59.02 2gr6 n GLU 128 Cb 0.34 -1.89 -0.05 0.00 0.27 0.00 0.00 31.44 30.11 2gr6 n GLU 128 CO 0.00 0.00 0.00 -0.97 -0.41 0.00 0.00 177.13 175.75 2gr6 h ASN 129 N 0.00 -1.39 -0.18 4.31 -1.24 -1.78 0.22 115.58 115.53 2gr6 h ASN 129 Ca 0.22 0.20 -0.11 0.00 0.71 0.00 0.00 56.30 57.32 2gr6 h ASN 129 Cb 0.43 0.59 -0.01 0.00 0.73 0.00 0.00 38.32 40.06 2gr6 h ASN 129 CO -0.81 -0.39 -0.26 0.03 -1.29 0.00 0.00 177.43 174.70 2gr6 h ARG 130 N -0.40 0.65 -0.17 6.67 2.47 -1.18 -2.13 114.38 120.30 2gr6 h ARG 130 Ca 0.11 -0.27 -0.00 0.00 -1.26 0.00 0.00 59.98 58.56 2gr6 h ARG 130 Cb 0.60 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.89 2gr6 h ARG 130 CO -0.50 0.85 0.09 0.82 0.56 0.00 0.00 179.97 181.78 2gr6 h ILE 131 N 0.56 1.11 -0.10 2.04 2.04 -0.60 -1.45 117.51 121.12 2gr6 h ILE 131 Ca 0.07 -0.31 0.02 0.00 1.00 0.00 0.00 64.86 65.65 2gr6 h ILE 131 Cb 0.74 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 2gr6 h ILE 131 CO 0.06 0.10 -0.05 -0.61 0.00 0.00 0.00 178.15 177.65 2gr6 h GLN 132 N 0.16 -0.05 0.00 2.37 5.75 -0.81 -2.64 115.11 119.89 2gr6 h GLN 132 Ca 0.06 0.00 -0.12 0.00 -0.15 0.00 0.00 58.65 58.44 2gr6 h GLN 132 Cb 0.09 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.63 2gr6 h GLN 132 CO -0.01 -0.03 -0.57 1.05 -2.65 0.00 0.00 178.83 176.62 2gr6 h GLU 133 N -0.05 0.00 -0.45 1.69 -0.00 -1.28 -2.33 114.58 112.16 2gr6 h GLU 133 Ca 0.06 0.00 -0.14 0.00 -0.00 0.00 0.00 59.36 59.28 2gr6 h GLU 133 Cb 0.14 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 28.87 2gr6 h GLU 133 CO -0.13 0.57 -0.27 1.25 -0.00 0.00 0.00 179.01 180.43 2gr6 h LEU 134 N 0.00 1.00 0.06 3.06 5.85 -1.20 -1.35 115.31 122.73 2gr6 h LEU 134 Ca -0.01 -0.40 -0.00 0.00 0.84 0.00 0.00 57.88 58.31 2gr6 h LEU 134 Cb 1.20 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.96 2gr6 h LEU 134 CO 0.07 1.20 -0.03 0.00 -0.34 0.00 0.00 178.44 179.34 2gr6 h ALA 135 N 0.86 -0.08 -0.61 1.25 0.00 -1.38 0.25 119.26 119.55 2gr6 h ALA 135 Ca 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2gr6 h ALA 135 Cb 0.85 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 2gr6 h ALA 135 CO 0.08 -0.52 0.35 0.00 0.00 0.00 0.00 179.25 179.16 2gr6 h SER 137 N 0.83 1.02 -0.25 0.00 0.87 -1.14 0.35 113.55 115.24 2gr6 h SER 137 Ca 0.22 -0.39 -0.04 0.00 -1.23 0.00 0.00 61.79 60.34 2gr6 h SER 137 Cb 0.01 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.68 2gr6 h SER 137 CO -0.04 1.20 -0.02 0.25 -0.53 0.00 0.00 176.83 177.69 2gr6 h LEU 138 N 0.85 0.44 -0.31 2.23 5.85 -0.84 -2.60 115.31 120.93 2gr6 h LEU 138 Ca 0.11 -0.33 -0.09 0.00 0.84 0.00 0.00 57.88 58.41 2gr6 h LEU 138 Cb 0.81 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 2gr6 h LEU 138 CO 0.07 0.66 -0.17 0.40 -0.34 0.00 0.00 178.44 179.06 2gr6 h ILE 139 N 0.21 1.29 0.00 4.05 2.04 -1.23 -2.89 117.51 120.99 2gr6 h ILE 139 Ca 0.07 -1.28 -0.02 0.00 1.00 0.00 0.00 64.86 64.62 2gr6 h ILE 139 Cb 0.45 1.47 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 2gr6 h ILE 139 CO 0.02 0.41 -0.12 -0.08 0.00 0.00 0.00 178.15 178.38 2gr6 h GLU 140 N 0.41 0.00 -0.06 2.37 4.57 -0.97 0.12 114.58 121.03 2gr6 h GLU 140 Ca 0.07 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 58.09 2gr6 h GLU 140 Cb 0.70 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.28 2gr6 h GLU 140 CO 0.05 0.12 -0.65 1.03 -1.18 0.00 0.00 179.01 178.38 2gr6 h SER 141 N 0.00 0.26 0.51 1.04 0.87 -1.29 -3.24 113.55 111.69 2gr6 h SER 141 Ca -0.00 -0.16 -0.30 0.00 -1.23 0.00 0.00 61.79 60.10 2gr6 h SER 141 Cb 0.23 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 2gr6 h SER 141 CO 0.02 0.83 -1.41 -0.07 -0.53 0.00 0.00 176.83 175.67 2gr6 h LEU 142 N 0.16 0.45 -0.78 2.23 3.38 -1.11 -3.41 115.31 116.23 2gr6 h LEU 142 Ca -0.01 -0.54 0.07 0.00 0.09 0.00 0.00 57.88 57.48 2gr6 h LEU 142 Cb 1.17 -0.15 -0.09 0.00 0.09 0.00 0.00 40.66 41.68 2gr6 h LEU 142 CO 0.10 1.44 -0.46 -1.14 0.09 0.00 0.00 178.44 178.47 2gr6 n ARG 143 N -3.51 -0.34 0.28 1.13 0.63 0.33 -0.97 116.66 114.21 2gr6 n ARG 143 Ca -0.13 1.24 0.13 0.00 -0.92 0.00 0.00 57.85 58.17 2gr6 n ARG 143 Cb 1.04 -1.82 0.83 0.00 0.45 0.00 0.00 32.46 32.96 2gr6 n ARG 143 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 2gr6 h PRO 144 N 0.00 0.00 -0.79 -0.14 0.13 -1.79 -3.06 132.00 126.34 2gr6 h PRO 144 Ca 0.12 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.25 2gr6 h PRO 144 Cb 0.32 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.41 2gr6 h PRO 144 CO -0.73 0.02 0.46 1.96 -0.23 0.00 0.00 178.00 179.48 2gr6 h GLN 145 N 0.00 1.08 -0.08 0.86 4.20 -1.31 -3.45 115.11 116.41 2gr6 h GLN 145 Ca -0.00 -0.10 -0.03 0.00 0.06 0.00 0.00 58.65 58.57 2gr6 h GLN 145 Cb 0.05 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 2gr6 h GLN 145 CO 0.00 0.77 -0.03 0.41 -0.67 0.00 0.00 178.83 179.31 2gr6 n GLY 146 N -1.25 0.53 3.61 3.46 0.00 -1.16 -4.96 105.19 105.42 2gr6 n GLY 146 Ca 0.08 -0.74 -0.03 0.00 0.00 0.00 0.00 46.02 45.34 2gr6 n GLY 146 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2gr6 s GLN 147 N -1.69 0.47 0.00 1.61 -2.07 -1.26 -1.76 119.66 114.96 2gr6 s GLN 147 Ca 0.00 -0.22 0.00 0.00 -1.82 0.00 0.00 55.36 53.32 2gr6 s GLN 147 Cb 0.00 0.19 0.00 0.00 -1.09 0.00 0.00 33.01 32.11 2gr6 s GLN 147 CO 0.00 -0.21 0.00 0.00 -1.32 0.00 0.00 175.29 173.76 2gr6 s ASN 149 N 0.00 6.16 0.35 0.00 -0.87 -1.26 -1.01 114.94 118.30 2gr6 s ASN 149 Ca 0.00 -2.95 0.16 0.00 -1.57 0.00 0.00 52.86 48.50 2gr6 s ASN 149 Cb 0.00 -2.05 1.16 0.00 -0.02 0.00 0.00 41.25 40.34 2gr6 s ASN 149 CO 0.00 -0.43 1.62 0.15 -2.57 0.00 0.00 177.10 175.87 2gr6 h PHE 150 N 7.21 0.81 -0.04 2.20 3.57 -1.70 0.43 116.94 129.42 2gr6 h PHE 150 Ca 0.08 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 2gr6 h PHE 150 Cb 0.97 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.52 2gr6 h PHE 150 CO 0.86 -0.31 0.02 1.79 -2.23 0.00 0.00 178.31 178.44 2gr6 h THR 151 N 0.17 1.15 0.00 4.41 1.35 -1.93 -0.09 112.91 117.97 2gr6 h THR 151 Ca 0.77 -0.44 -0.08 0.00 -0.55 0.00 0.00 66.41 66.10 2gr6 h THR 151 Cb 1.86 1.37 -0.01 0.00 -1.73 0.00 0.00 68.15 69.63 2gr6 h THR 151 CO -0.69 0.12 -0.84 1.05 -0.25 0.00 0.00 175.52 174.91 2gr6 h GLU 152 N -0.11 0.00 0.00 4.72 4.11 -1.73 -1.48 114.58 120.10 2gr6 h GLU 152 Ca 0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.44 2gr6 h GLU 152 Cb 0.18 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 2gr6 h GLU 152 CO -0.00 0.22 -0.65 -0.44 0.07 0.00 0.00 179.01 178.21 2gr6 h ASP 153 N 0.00 0.00 0.00 3.06 3.32 -0.15 -3.41 116.42 119.24 2gr6 h ASP 153 Ca -0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.00 2gr6 h ASP 153 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 2gr6 h ASP 153 CO 0.03 0.01 0.00 0.00 -1.72 0.00 0.00 179.24 177.56 2gr6 n TYR 154 N -2.83 -2.07 -0.21 4.55 9.36 -0.24 -4.81 117.16 120.91 2gr6 n TYR 154 Ca 0.01 0.44 0.23 0.00 3.32 0.00 0.00 57.90 61.90 2gr6 n TYR 154 Cb 0.55 1.07 0.60 0.00 -0.63 0.00 0.00 39.34 40.93 2gr6 n TYR 154 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2gr6 h ALA 155 N 0.00 2.46 0.00 2.98 0.00 -1.15 -1.17 119.26 122.38 2gr6 h ALA 155 Ca 0.00 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2gr6 h ALA 155 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2gr6 h ALA 155 CO 0.00 -0.73 -0.67 0.93 0.00 0.00 0.00 179.25 178.78 2gr6 h GLU 156 N 0.23 0.00 -0.27 0.00 5.08 -1.48 -3.39 114.58 114.75 2gr6 h GLU 156 Ca 0.44 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.78 2gr6 h GLU 156 Cb 1.37 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.61 2gr6 h GLU 156 CO -0.11 0.24 0.07 -1.00 -1.00 0.00 0.00 179.01 177.21 2gr6 h PRO 157 N -1.00 0.38 0.60 2.33 0.13 -1.77 -2.25 132.00 130.42 2gr6 h PRO 157 Ca -0.08 -0.05 -0.03 0.00 -0.87 0.00 0.00 66.00 64.97 2gr6 h PRO 157 Cb 0.68 -0.07 0.01 0.00 0.13 0.00 0.00 31.00 31.75 2gr6 h PRO 157 CO -0.05 0.35 -0.29 0.35 -0.23 0.00 0.00 178.00 178.13 2gr6 h PHE 158 N 0.38 -0.75 -0.45 1.56 3.57 -1.45 -0.87 116.94 118.93 2gr6 h PHE 158 Ca 0.09 -0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.48 2gr6 h PHE 158 Cb 0.15 0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.12 2gr6 h PHE 158 CO 0.00 -0.46 -0.10 -1.35 -2.23 0.00 0.00 178.31 174.17 2gr6 h PRO 159 N -0.93 0.80 0.07 6.41 0.11 -1.75 -3.01 132.00 133.70 2gr6 h PRO 159 Ca -0.08 -0.27 -0.00 0.00 0.11 0.00 0.00 66.00 65.76 2gr6 h PRO 159 Cb 0.62 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.66 2gr6 h PRO 159 CO 0.14 0.87 -0.03 0.82 -0.21 0.00 0.00 178.00 179.59 2gr6 h ILE 160 N 0.73 1.16 -0.73 4.15 2.04 -1.47 -1.66 117.51 121.73 2gr6 h ILE 160 Ca 0.12 -0.82 0.07 0.00 1.00 0.00 0.00 64.86 65.23 2gr6 h ILE 160 Cb 0.59 1.70 -0.05 0.00 -0.74 0.00 0.00 36.82 38.32 2gr6 h ILE 160 CO 0.04 0.20 0.48 0.03 0.00 0.00 0.00 178.15 178.90 2gr6 h ARG 161 N -0.46 0.74 -0.47 2.37 3.08 -1.21 0.36 114.38 118.78 2gr6 h ARG 161 Ca -0.01 -0.04 -0.12 0.00 0.07 0.00 0.00 59.98 59.87 2gr6 h ARG 161 Cb 0.40 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 2gr6 h ARG 161 CO 0.02 0.49 -0.19 0.82 -1.07 0.00 0.00 179.97 180.04 2gr6 h ILE 162 N 0.76 1.27 -0.13 2.04 2.04 -1.47 0.52 117.51 122.54 2gr6 h ILE 162 Ca 0.32 -1.34 -0.03 0.00 1.00 0.00 0.00 64.86 64.81 2gr6 h ILE 162 Cb 0.27 1.10 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2gr6 h ILE 162 CO -0.11 0.46 -0.04 0.15 0.00 0.00 0.00 178.15 178.61 2gr6 h PHE 163 N 0.82 0.29 -0.68 1.37 3.57 -0.13 0.23 116.94 122.42 2gr6 h PHE 163 Ca 0.11 -0.07 0.04 0.00 3.53 0.00 0.00 57.97 61.58 2gr6 h PHE 163 Cb 0.74 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.38 2gr6 h PHE 163 CO 0.05 0.57 0.45 0.52 -2.23 0.00 0.00 178.31 177.66 2gr6 h MET 164 N -0.08 0.78 -0.25 1.11 2.86 -0.25 0.44 114.93 119.54 2gr6 h MET 164 Ca 0.03 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 2gr6 h MET 164 Cb 0.48 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 2gr6 h MET 164 CO 0.02 0.51 0.07 1.25 1.06 0.00 0.00 176.91 179.82 2gr6 h LEU 165 N 0.80 0.37 -0.77 1.22 5.85 -0.62 0.29 115.31 122.44 2gr6 h LEU 165 Ca 0.27 -0.21 -0.09 0.00 0.84 0.00 0.00 57.88 58.69 2gr6 h LEU 165 Cb 0.09 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 2gr6 h LEU 165 CO -0.08 0.48 -0.03 0.25 -0.34 0.00 0.00 178.44 178.72 2gr6 h LEU 166 N 0.23 0.87 -0.02 2.25 5.85 0.19 -2.72 115.31 121.96 2gr6 h LEU 166 Ca 0.08 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.56 2gr6 h LEU 166 Cb 0.25 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.05 2gr6 h LEU 166 CO -0.00 0.95 0.00 0.00 -0.34 0.00 0.00 178.44 179.05 2gr6 n ALA 167 N -2.48 2.27 -2.41 1.25 0.00 0.14 -0.92 120.51 118.36 2gr6 n ALA 167 Ca 0.02 -0.03 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 2gr6 n ALA 167 Cb 0.34 -1.47 0.01 0.00 0.00 0.00 0.00 19.45 18.33 2gr6 n ALA 167 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gr6 n GLY 168 N 1.29 0.21 3.60 0.00 0.00 0.79 -4.12 105.19 106.97 2gr6 n GLY 168 Ca 0.06 -0.50 -0.34 0.00 0.00 0.00 0.00 46.02 45.24 2gr6 n GLY 168 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gr6 s LEU 169 N -2.49 3.26 0.53 0.99 1.43 0.19 -5.03 118.68 117.57 2gr6 s LEU 169 Ca 0.07 0.01 -0.21 0.00 -1.03 0.00 0.00 54.13 52.97 2gr6 s LEU 169 Cb -0.03 -1.72 -0.05 0.00 0.03 0.00 0.00 46.19 44.41 2gr6 s LEU 169 CO 0.09 0.36 1.29 -2.16 0.23 0.00 0.00 176.35 176.16 2gr6 s PRO 170 N -0.85 3.25 0.41 1.29 0.04 -1.26 -4.51 135.00 133.37 2gr6 s PRO 170 Ca 0.13 2.05 0.28 0.00 0.04 0.00 0.00 61.00 63.51 2gr6 s PRO 170 Cb -0.11 -2.23 1.08 0.00 0.04 0.00 0.00 34.50 33.27 2gr6 s PRO 170 CO 0.02 -1.04 1.83 0.93 0.04 0.00 0.00 177.00 178.78 2gr6 h GLU 171 N 1.50 0.00 0.00 4.56 5.08 -1.98 -2.65 114.58 121.08 2gr6 h GLU 171 Ca -0.50 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.85 2gr6 h GLU 171 Cb 1.29 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 2gr6 h GLU 171 CO 0.58 0.00 -0.01 1.05 -1.00 0.00 0.00 179.01 179.63 2gr6 h GLU 172 N 0.00 0.00 0.00 2.33 9.09 -2.05 -1.75 114.58 122.20 2gr6 h GLU 172 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2gr6 h GLU 172 Cb 0.53 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.63 2gr6 h GLU 172 CO 0.00 0.01 -0.18 -0.25 0.05 0.00 0.00 179.01 178.64 2gr6 n ASP 173 N -3.14 0.75 -0.12 3.06 10.43 -1.00 -4.37 116.55 122.16 2gr6 n ASP 173 Ca -0.02 0.43 -0.06 0.00 2.57 0.00 0.00 54.79 57.71 2gr6 n ASP 173 Cb 0.17 -0.51 -0.00 0.00 1.84 0.00 0.00 41.12 42.62 2gr6 n ASP 173 CO 0.00 0.00 0.00 0.40 -1.07 0.00 0.00 177.20 176.53 2gr6 h ILE 174 N 0.00 0.29 -1.00 0.53 2.04 -1.48 -2.29 117.51 115.60 2gr6 h ILE 174 Ca 0.00 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.00 2gr6 h ILE 174 Cb 0.73 0.29 -0.09 0.00 -0.74 0.00 0.00 36.82 37.01 2gr6 h ILE 174 CO 0.00 0.00 0.62 -0.65 0.00 0.00 0.00 178.15 178.12 2gr6 h PRO 175 N -0.20 0.91 -0.36 2.37 0.11 -1.81 0.47 132.00 133.50 2gr6 h PRO 175 Ca 0.19 -0.06 -0.15 0.00 0.11 0.00 0.00 66.00 66.09 2gr6 h PRO 175 Cb 0.50 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.40 2gr6 h PRO 175 CO -0.52 0.61 -0.36 1.25 -0.21 0.00 0.00 178.00 178.76 2gr6 h HIS 176 N 0.94 1.05 -0.15 0.65 -0.00 -1.73 -2.89 115.15 113.03 2gr6 h HIS 176 Ca 0.51 -0.32 -0.17 0.00 -0.00 0.00 0.00 60.37 60.40 2gr6 h HIS 176 Cb 0.58 -0.22 0.01 0.00 -0.00 0.00 0.00 27.41 27.77 2gr6 h HIS 176 CO -0.01 1.13 -0.57 -0.07 -0.00 0.00 0.00 177.93 178.41 2gr6 h LEU 177 N 0.68 0.76 -0.80 0.26 3.38 -0.87 -2.82 115.31 115.90 2gr6 h LEU 177 Ca 0.06 -0.62 0.04 0.00 0.09 0.00 0.00 57.88 57.45 2gr6 h LEU 177 Cb 0.95 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.43 2gr6 h LEU 177 CO 0.09 1.25 0.51 0.50 0.09 0.00 0.00 178.44 180.88 2gr6 h LYS 178 N 0.32 0.96 0.04 1.13 1.63 -1.00 -1.13 116.57 118.51 2gr6 h LYS 178 Ca -0.03 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 59.71 2gr6 h LYS 178 Cb 1.21 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 32.62 2gr6 h LYS 178 CO 0.12 0.63 -0.02 -0.92 -3.45 0.00 0.00 179.45 175.81 2gr6 h TYR 179 N 0.98 -0.05 -0.33 1.91 3.20 -1.51 0.27 116.97 121.45 2gr6 h TYR 179 Ca 0.33 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.20 2gr6 h TYR 179 Cb 0.03 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 2gr6 h TYR 179 CO -0.03 -0.02 0.21 -0.07 -1.64 0.00 0.00 178.16 176.60 2gr6 h LEU 180 N -0.06 0.35 -0.16 2.82 3.38 -1.22 -2.06 115.31 118.37 2gr6 h LEU 180 Ca -0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2gr6 h LEU 180 Cb 0.05 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2gr6 h LEU 180 CO 0.01 0.25 0.10 0.74 0.09 0.00 0.00 178.44 179.63 2gr6 h THR 181 N 0.42 1.06 -0.85 0.22 2.02 -1.05 -2.25 112.91 112.48 2gr6 h THR 181 Ca 0.12 -0.12 0.16 0.00 0.77 0.00 0.00 66.41 67.35 2gr6 h THR 181 Cb -0.03 0.85 -0.06 0.00 -1.74 0.00 0.00 68.15 67.17 2gr6 h THR 181 CO -0.04 0.05 0.56 0.44 0.37 0.00 0.00 175.52 176.90 2gr6 h ASP 182 N 0.20 0.48 0.87 4.18 5.19 -0.19 0.11 116.42 127.27 2gr6 h ASP 182 Ca 0.06 0.04 -0.07 0.00 -0.62 0.00 0.00 57.03 56.44 2gr6 h ASP 182 Cb -0.00 -0.06 -0.01 0.00 0.18 0.00 0.00 39.33 39.44 2gr6 h ASP 182 CO -0.01 0.23 -0.32 1.56 -3.12 0.00 0.00 179.24 177.58 2gr6 h GLN 183 N 0.50 0.00 0.00 3.56 1.08 -0.78 0.23 115.11 119.70 2gr6 h GLN 183 Ca 0.43 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.60 2gr6 h GLN 183 Cb 0.91 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.34 2gr6 h GLN 183 CO -0.17 0.32 -0.15 0.52 -0.95 0.00 0.00 178.83 178.40 2gr6 h MET 184 N 0.00 0.00 0.00 1.46 2.86 -0.50 -3.15 114.93 115.60 2gr6 h MET 184 Ca -0.00 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.47 2gr6 h MET 184 Cb 0.84 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.47 2gr6 h MET 184 CO 0.04 0.15 -1.61 0.25 1.06 0.00 0.00 176.91 176.80 2gr6 n THR 185 N -3.15 0.61 -3.12 2.22 -2.24 -1.09 -4.83 114.28 102.69 2gr6 n THR 185 Ca 0.03 -0.30 -0.17 0.00 -2.27 0.00 0.00 64.05 61.34 2gr6 n THR 185 Cb 0.56 -0.83 -0.01 0.00 -2.10 0.00 0.00 70.33 67.95 2gr6 n THR 185 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2gr6 n ARG 186 N -2.58 0.98 -1.60 -0.78 1.74 0.05 -1.21 116.66 113.27 2gr6 n ARG 186 Ca -0.17 -3.19 -0.50 0.00 -0.77 0.00 0.00 57.85 53.22 2gr6 n ARG 186 Cb 0.74 -1.61 -0.05 0.00 -1.02 0.00 0.00 32.46 30.53 2gr6 n ARG 186 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2gr6 n PRO 187 N 0.28 1.29 0.00 5.56 -0.04 -1.19 -4.67 135.00 136.22 2gr6 n PRO 187 Ca 0.22 0.46 0.13 0.00 -0.04 0.00 0.00 63.50 64.28 2gr6 n PRO 187 Cb 0.67 -2.06 0.42 0.00 -0.04 0.00 0.00 33.50 32.49 2gr6 n PRO 187 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2gr6 n ASP 188 N 2.40 1.21 0.00 3.54 5.68 -1.26 -4.94 116.55 123.17 2gr6 n ASP 188 Ca 0.17 -1.11 0.00 0.00 -0.50 0.00 0.00 54.79 53.35 2gr6 n ASP 188 Cb 0.23 0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.30 2gr6 n ASP 188 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2gr6 n GLY 189 N 1.29 1.73 0.34 6.12 0.00 -1.26 -4.95 105.19 108.45 2gr6 n GLY 189 Ca 0.14 -0.18 0.08 0.00 0.00 0.00 0.00 46.02 46.07 2gr6 n GLY 189 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2gr6 h SER 190 N 1.19 0.46 -3.89 1.61 4.64 -2.01 -3.43 113.55 112.12 2gr6 h SER 190 Ca 0.00 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.96 2gr6 h SER 190 Cb 0.00 -0.10 -0.29 0.00 -0.31 0.00 0.00 62.40 61.70 2gr6 h SER 190 CO 0.00 0.30 -0.77 -0.32 -0.87 0.00 0.00 176.83 175.17 2gr6 s MET 191 N -5.48 0.61 0.61 4.77 0.00 -1.26 -5.13 119.30 113.41 2gr6 s MET 191 Ca -0.08 -0.23 -0.09 0.00 0.00 0.00 0.00 55.69 55.29 2gr6 s MET 191 Cb 0.19 -0.59 -0.02 0.00 0.00 0.00 0.00 34.83 34.41 2gr6 s MET 191 CO 0.75 0.12 0.98 0.95 0.00 0.00 0.00 175.02 177.82 2gr6 s THR 192 N -0.00 4.34 0.17 10.11 -4.23 -1.26 -4.83 115.64 119.94 2gr6 s THR 192 Ca 0.00 0.55 -0.14 0.00 -1.18 0.00 0.00 61.69 60.93 2gr6 s THR 192 Cb -0.04 -3.73 0.07 0.00 1.34 0.00 0.00 72.50 70.13 2gr6 s THR 192 CO -0.00 -0.89 1.76 0.15 -0.54 0.00 0.00 174.62 175.10 2gr6 h PHE 193 N -0.27 0.33 -0.89 3.99 3.57 -1.95 -1.31 116.94 120.40 2gr6 h PHE 193 Ca -0.45 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.15 2gr6 h PHE 193 Cb 1.22 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 39.81 2gr6 h PHE 193 CO 0.59 0.13 0.58 0.00 -2.23 0.00 0.00 178.31 177.38 2gr6 h ALA 194 N 1.29 1.58 -0.21 2.41 0.00 -1.90 0.08 119.26 122.50 2gr6 h ALA 194 Ca 0.21 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 2gr6 h ALA 194 Cb 0.19 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2gr6 h ALA 194 CO -0.20 0.26 -0.25 0.93 0.00 0.00 0.00 179.25 179.99 2gr6 h GLU 195 N 0.95 0.54 -0.33 0.00 5.08 -1.75 -1.71 114.58 117.35 2gr6 h GLU 195 Ca 0.40 -0.30 0.02 0.00 -1.00 0.00 0.00 59.36 58.48 2gr6 h GLU 195 Cb 0.31 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 2gr6 h GLU 195 CO -0.16 0.90 0.18 0.00 -1.00 0.00 0.00 179.01 178.92 2gr6 h ALA 196 N 0.64 0.40 -0.43 3.43 0.00 -0.56 -0.14 119.26 122.60 2gr6 h ALA 196 Ca 0.03 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2gr6 h ALA 196 Cb 0.82 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 2gr6 h ALA 196 CO 0.06 -0.19 0.27 -0.22 0.00 0.00 0.00 179.25 179.17 2gr6 h LYS 197 N 0.37 0.53 -0.69 0.00 3.64 -0.98 0.61 116.57 120.04 2gr6 h LYS 197 Ca 0.13 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.52 2gr6 h LYS 197 Cb 0.02 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 31.68 2gr6 h LYS 197 CO -0.08 0.35 0.43 1.49 -2.27 0.00 0.00 179.45 179.37 2gr6 h GLU 198 N 0.54 0.80 -0.63 1.90 4.81 -0.87 0.15 114.58 121.28 2gr6 h GLU 198 Ca 0.17 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.29 2gr6 h GLU 198 Cb -0.02 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.16 2gr6 h GLU 198 CO -0.06 0.53 0.14 0.00 -0.73 0.00 0.00 179.01 178.89 2gr6 h ALA 199 N 1.31 0.83 -0.61 2.92 0.00 -0.42 0.26 119.26 123.55 2gr6 h ALA 199 Ca 0.28 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2gr6 h ALA 199 Cb 0.05 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2gr6 h ALA 199 CO -0.12 0.55 0.09 1.25 0.00 0.00 0.00 179.25 181.03 2gr6 h LEU 200 N 0.93 0.97 -0.35 0.00 5.85 -0.25 -2.08 115.31 120.39 2gr6 h LEU 200 Ca 0.20 -0.26 -0.07 0.00 0.84 0.00 0.00 57.88 58.58 2gr6 h LEU 200 Cb 0.37 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 2gr6 h LEU 200 CO 0.00 0.99 -0.06 1.88 -0.34 0.00 0.00 178.44 180.92 2gr6 h TYR 201 N 0.92 0.73 -0.83 1.25 0.05 -0.39 -1.71 116.97 116.99 2gr6 h TYR 201 Ca 0.18 -0.15 0.19 0.00 0.05 0.00 0.00 58.73 59.00 2gr6 h TYR 201 Cb 0.43 -0.18 -0.06 0.00 1.01 0.00 0.00 36.73 37.94 2gr6 h TYR 201 CO 0.03 0.80 0.56 0.22 -1.05 0.00 0.00 178.16 178.72 2gr6 h ASP 202 N 0.45 0.34 -0.10 3.88 -0.00 -0.27 -0.15 116.42 120.57 2gr6 h ASP 202 Ca 0.09 0.03 -0.05 0.00 -0.00 0.00 0.00 57.03 57.10 2gr6 h ASP 202 Cb 0.55 -0.04 -0.00 0.00 -0.00 0.00 0.00 39.33 39.84 2gr6 h ASP 202 CO 0.03 0.15 -0.14 0.22 -0.00 0.00 0.00 179.24 179.50 2gr6 h TYR 203 N 0.35 0.34 -0.22 0.28 3.20 -0.81 -3.37 116.97 116.75 2gr6 h TYR 203 Ca 0.42 -0.11 -0.11 0.00 3.14 0.00 0.00 58.73 62.07 2gr6 h TYR 203 Cb 1.09 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 39.29 2gr6 h TYR 203 CO -0.00 0.73 -0.29 -0.07 -1.64 0.00 0.00 178.16 176.88 2gr6 h LEU 204 N -0.15 0.63 -0.96 2.82 3.38 -0.21 -3.38 115.31 117.44 2gr6 h LEU 204 Ca 0.01 -0.51 0.15 0.00 0.09 0.00 0.00 57.88 57.62 2gr6 h LEU 204 Cb 0.69 -0.18 -0.15 0.00 0.09 0.00 0.00 40.66 41.10 2gr6 h LEU 204 CO 0.03 1.01 -0.38 -0.38 0.09 0.00 0.00 178.44 178.81 2gr6 n ILE 205 N -4.33 -0.51 -0.18 1.22 5.41 -0.30 -0.76 119.36 119.90 2gr6 n ILE 205 Ca -0.05 2.26 -0.02 0.00 1.00 0.00 0.00 62.75 65.94 2gr6 n ILE 205 Cb 0.47 -2.97 0.19 0.00 -0.71 0.00 0.00 39.64 36.62 2gr6 n ILE 205 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 2gr6 h PRO 206 N 0.00 0.93 -0.24 0.38 0.11 -1.79 -2.41 132.00 128.98 2gr6 h PRO 206 Ca 0.33 -0.14 -0.13 0.00 0.11 0.00 0.00 66.00 66.17 2gr6 h PRO 206 Cb 0.57 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.51 2gr6 h PRO 206 CO -0.95 0.74 -0.35 0.82 -0.21 0.00 0.00 178.00 178.05 2gr6 h ILE 207 N 0.92 1.31 -0.07 4.15 2.04 -1.22 -2.39 117.51 122.26 2gr6 h ILE 207 Ca 0.22 -1.55 -0.05 0.00 1.00 0.00 0.00 64.86 64.49 2gr6 h ILE 207 Cb 0.15 1.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 2gr6 h ILE 207 CO -0.02 0.49 -0.17 0.40 0.00 0.00 0.00 178.15 178.85 2gr6 h ILE 208 N 0.37 1.16 -0.06 -0.67 2.04 -0.79 -0.39 117.51 119.18 2gr6 h ILE 208 Ca 0.02 -0.74 -0.15 0.00 1.00 0.00 0.00 64.86 64.99 2gr6 h ILE 208 Cb 0.94 1.30 0.01 0.00 -0.74 0.00 0.00 36.82 38.32 2gr6 h ILE 208 CO 0.08 0.22 -0.56 -0.08 0.00 0.00 0.00 178.15 177.82 2gr6 h GLU 209 N 0.11 0.48 -0.78 2.37 4.57 -1.36 -2.52 114.58 117.44 2gr6 h GLU 209 Ca 0.02 -0.44 -0.04 0.00 -1.18 0.00 0.00 59.36 57.72 2gr6 h GLU 209 Cb 0.37 0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.03 2gr6 h GLU 209 CO 0.02 1.08 0.32 1.96 -1.18 0.00 0.00 179.01 181.21 2gr6 h GLN 210 N 0.04 1.15 0.00 1.92 4.20 -1.14 -2.25 115.11 119.04 2gr6 h GLN 210 Ca -0.05 -0.20 -0.00 0.00 0.06 0.00 0.00 58.65 58.46 2gr6 h GLN 210 Cb 1.23 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 28.82 2gr6 h GLN 210 CO 0.11 0.92 -0.00 0.00 -0.67 0.00 0.00 178.83 179.19 2gr6 h ARG 211 N 1.13 0.00 0.00 1.46 -0.00 -1.09 -0.89 114.38 114.98 2gr6 h ARG 211 Ca 0.26 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.73 2gr6 h ARG 211 Cb 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 30.16 2gr6 h ARG 211 CO -0.02 0.00 -0.80 0.00 0.00 0.00 0.00 179.97 179.15 2gr6 h ARG 212 N 0.00 0.00 0.07 0.04 3.08 -0.96 -2.79 114.38 113.82 2gr6 h ARG 212 Ca -0.00 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.73 2gr6 h ARG 212 Cb 0.58 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.60 2gr6 h ARG 212 CO 0.00 0.02 -1.72 0.37 -1.07 0.00 0.00 179.97 177.58 2gr6 h GLN 213 N 0.00 0.16 -2.67 0.04 4.15 -1.12 -3.41 115.11 112.26 2gr6 h GLN 213 Ca -0.01 -0.27 -0.60 0.00 0.77 0.00 0.00 58.65 58.54 2gr6 h GLN 213 Cb 1.03 0.10 -0.39 0.00 0.21 0.00 0.00 27.48 28.43 2gr6 h GLN 213 CO 0.00 0.92 -0.82 0.15 -1.93 0.00 0.00 178.83 177.15 2gr6 s LYS 214 N -2.60 1.37 0.26 1.69 1.02 -0.37 -5.11 119.74 116.00 2gr6 s LYS 214 Ca -0.11 -2.39 -0.30 0.00 0.02 0.00 0.00 55.97 53.19 2gr6 s LYS 214 Cb 0.07 -2.10 -0.13 0.00 -0.52 0.00 0.00 37.83 35.15 2gr6 s LYS 214 CO 0.82 -1.32 1.32 -2.30 -0.92 0.00 0.00 175.35 172.95 2gr6 n PRO 215 N 2.78 1.91 0.00 -1.68 -0.02 -1.05 -4.51 135.00 132.42 2gr6 n PRO 215 Ca 0.23 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.38 2gr6 n PRO 215 Cb 0.42 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 2gr6 n PRO 215 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gr6 n GLY 216 N 1.78 6.81 0.00 -1.23 0.00 -1.26 -5.07 105.19 106.23 2gr6 n GLY 216 Ca 0.10 -1.97 0.08 0.00 0.00 0.00 0.00 46.02 44.24 2gr6 n GLY 216 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gr6 n THR 217 N 0.00 0.00 -1.12 2.61 -2.24 -1.26 -4.66 114.28 107.61 2gr6 n THR 217 Ca 0.00 -0.28 -0.30 0.00 -2.27 0.00 0.00 64.05 61.20 2gr6 n THR 217 Cb 0.00 0.45 0.13 0.00 -2.10 0.00 0.00 70.33 68.81 2gr6 n THR 217 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2gr6 s ASP 218 N -3.42 3.64 0.23 3.42 1.47 -1.26 -4.80 116.67 115.95 2gr6 s ASP 218 Ca -0.01 1.70 -0.07 0.00 1.18 0.00 0.00 52.55 55.35 2gr6 s ASP 218 Cb 0.11 -2.36 0.32 0.00 -0.34 0.00 0.00 42.92 40.66 2gr6 s ASP 218 CO 0.70 -2.56 1.81 0.00 0.68 0.00 0.00 175.17 175.79 2gr6 h ALA 219 N -1.50 1.05 -0.55 2.11 0.00 -1.21 -1.17 119.26 118.00 2gr6 h ALA 219 Ca -0.47 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.38 2gr6 h ALA 219 Cb 1.26 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 2gr6 h ALA 219 CO 0.51 0.08 0.00 0.82 0.00 0.00 0.00 179.25 180.67 2gr6 h ILE 220 N 0.75 1.26 -0.72 0.00 2.04 -1.83 -2.26 117.51 116.75 2gr6 h ILE 220 Ca 0.35 -1.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.11 2gr6 h ILE 220 Cb 0.28 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 2gr6 h ILE 220 CO -0.22 0.39 0.36 0.28 0.00 0.00 0.00 178.15 178.96 2gr6 h SER 221 N 0.86 0.93 -0.13 1.72 0.02 -1.65 0.25 113.55 115.56 2gr6 h SER 221 Ca 0.16 -0.13 -0.06 0.00 -0.84 0.00 0.00 61.79 60.92 2gr6 h SER 221 Cb 0.50 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 2gr6 h SER 221 CO 0.02 0.79 -0.09 0.40 -1.14 0.00 0.00 176.83 176.81 2gr6 h ILE 222 N 1.00 1.21 0.14 3.27 1.08 -0.99 -1.88 117.51 121.35 2gr6 h ILE 222 Ca 0.25 -0.92 -0.01 0.00 -0.39 0.00 0.00 64.86 63.79 2gr6 h ILE 222 Cb 0.10 1.11 0.00 0.00 -3.07 0.00 0.00 36.82 34.96 2gr6 h ILE 222 CO -0.03 0.30 -0.07 0.58 -0.69 0.00 0.00 178.15 178.24 2gr6 h VAL 223 N 0.43 0.21 -0.96 1.67 2.07 -1.09 -2.92 116.25 115.66 2gr6 h VAL 223 Ca 0.08 -0.98 0.27 0.00 0.82 0.00 0.00 66.70 66.90 2gr6 h VAL 223 Cb 0.43 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 2gr6 h VAL 223 CO 0.02 0.06 0.68 0.00 0.02 0.00 0.00 177.57 178.36 2gr6 h ALA 224 N -0.91 2.83 -0.36 1.67 0.00 -0.93 0.15 119.26 121.72 2gr6 h ALA 224 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2gr6 h ALA 224 Cb 0.25 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2gr6 h ALA 224 CO 0.03 -1.12 0.00 0.09 0.00 0.00 0.00 179.25 178.26 2gr6 n ASN 225 N -4.28 3.65 -4.55 0.00 4.13 -0.71 -4.85 115.26 108.65 2gr6 n ASN 225 Ca 0.20 -2.51 -0.27 0.00 1.68 0.00 0.00 54.58 53.68 2gr6 n ASN 225 Cb 1.00 -0.42 0.13 0.00 -1.54 0.00 0.00 39.78 38.94 2gr6 n ASN 225 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 2gr6 s GLY 226 N -1.38 1.75 0.17 7.41 0.00 0.52 -4.94 107.32 110.85 2gr6 s GLY 226 Ca 0.36 -1.30 0.11 0.00 0.00 0.00 0.00 44.72 43.89 2gr6 s GLY 226 CO 0.14 -0.70 -0.25 1.20 0.00 0.00 0.00 173.10 173.50 2gr6 s GLN 227 N -5.45 1.45 -0.42 2.90 -0.21 -1.26 -1.89 119.66 114.77 2gr6 s GLN 227 Ca 0.67 -1.45 0.03 0.00 0.02 0.00 0.00 55.36 54.63 2gr6 s GLN 227 Cb -0.06 -1.82 0.12 0.00 1.00 0.00 0.00 33.01 32.25 2gr6 s GLN 227 CO 0.48 0.41 0.18 0.14 -2.12 0.00 0.00 175.29 174.37 2gr6 s VAL 228 N -1.47 1.90 -1.13 1.09 -7.23 0.17 -4.71 120.40 109.03 2gr6 s VAL 228 Ca 0.18 -2.58 -0.01 0.00 -1.81 0.00 0.00 61.98 57.76 2gr6 s VAL 228 Cb -0.09 -2.36 -0.01 0.00 0.56 0.00 0.00 36.38 34.48 2gr6 s VAL 228 CO 0.08 -0.76 0.95 0.59 -0.31 0.00 0.00 175.10 175.65 2gr6 n ASN 229 N 3.76 -2.89 0.00 4.85 4.13 -1.26 -3.47 115.26 120.38 2gr6 n ASN 229 Ca 0.05 -0.62 0.00 0.00 1.68 0.00 0.00 54.58 55.69 2gr6 n ASN 229 Cb 0.36 -4.99 0.00 0.00 -1.54 0.00 0.00 39.78 33.62 2gr6 n ASN 229 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2gr6 n GLY 230 N -1.15 1.54 3.26 7.41 0.00 -1.26 -5.05 105.19 109.94 2gr6 n GLY 230 Ca -0.24 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.56 2gr6 n GLY 230 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2gr6 s ARG 231 N -0.57 1.07 0.22 1.61 1.04 -1.23 -5.09 118.95 116.00 2gr6 s ARG 231 Ca 0.00 -1.15 -0.32 0.00 -1.04 0.00 0.00 55.73 53.22 2gr6 s ARG 231 Cb 0.00 -1.23 -0.13 0.00 -2.04 0.00 0.00 34.95 31.55 2gr6 s ARG 231 CO 0.00 0.28 1.51 -2.30 -0.04 0.00 0.00 175.30 174.75 2gr6 n PRO 232 N 1.02 2.22 -2.56 3.89 -0.02 -1.26 -0.65 135.00 137.63 2gr6 n PRO 232 Ca -0.19 0.80 -0.37 0.00 -2.02 0.00 0.00 63.50 61.72 2gr6 n PRO 232 Cb 0.54 -2.52 -0.04 0.00 -0.02 0.00 0.00 33.50 31.46 2gr6 n PRO 232 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 2gr6 s ILE 233 N 0.36 3.76 0.51 4.25 2.07 -0.79 -4.82 121.20 126.54 2gr6 s ILE 233 Ca 0.72 1.36 -0.05 0.00 -1.41 0.00 0.00 60.65 61.26 2gr6 s ILE 233 Cb -0.63 -3.71 -0.03 0.00 0.13 0.00 0.00 42.46 38.23 2gr6 s ILE 233 CO 0.44 0.02 0.82 0.42 -1.91 0.00 0.00 174.94 174.73 2gr6 s THR 234 N -1.66 4.66 0.35 4.00 -4.23 -1.26 -4.91 115.64 112.60 2gr6 s THR 234 Ca 0.57 0.19 0.03 0.00 -1.18 0.00 0.00 61.69 61.29 2gr6 s THR 234 Cb -0.22 -3.79 0.27 0.00 1.34 0.00 0.00 72.50 70.11 2gr6 s THR 234 CO 0.27 -0.79 1.99 0.28 -0.54 0.00 0.00 174.62 175.84 2gr6 h SER 235 N 0.13 0.74 0.08 3.99 0.02 -1.96 -0.43 113.55 116.13 2gr6 h SER 235 Ca -0.46 -0.01 -0.14 0.00 -0.84 0.00 0.00 61.79 60.33 2gr6 h SER 235 Cb 1.21 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.57 2gr6 h SER 235 CO 0.61 0.52 -0.47 -0.78 -1.14 0.00 0.00 176.83 175.57 2gr6 h ASP 236 N 0.86 0.49 -0.17 3.07 1.82 -1.99 -2.31 116.42 118.19 2gr6 h ASP 236 Ca 0.26 -0.24 -0.05 0.00 -0.39 0.00 0.00 57.03 56.61 2gr6 h ASP 236 Cb -0.01 -0.14 -0.00 0.00 0.68 0.00 0.00 39.33 39.86 2gr6 h ASP 236 CO -0.07 0.89 -0.11 -0.33 -1.61 0.00 0.00 179.24 178.01 2gr6 h GLU 237 N 0.37 0.37 -0.87 0.28 5.08 -1.69 -2.46 114.58 115.66 2gr6 h GLU 237 Ca 0.02 -0.17 0.08 0.00 -1.00 0.00 0.00 59.36 58.29 2gr6 h GLU 237 Cb 0.96 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.15 2gr6 h GLU 237 CO 0.08 0.70 0.56 0.00 -1.00 0.00 0.00 179.01 179.36 2gr6 h ALA 238 N 0.66 1.62 -0.34 3.43 0.00 -1.07 0.17 119.26 123.73 2gr6 h ALA 238 Ca 0.03 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2gr6 h ALA 238 Cb 0.61 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2gr6 h ALA 238 CO 0.03 0.22 0.09 -0.22 0.00 0.00 0.00 179.25 179.36 2gr6 h LYS 239 N 0.89 0.55 0.00 0.00 3.64 -1.28 0.34 116.57 120.71 2gr6 h LYS 239 Ca 0.39 -0.13 -0.10 0.00 -1.27 0.00 0.00 60.65 59.54 2gr6 h LYS 239 Cb 0.34 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 2gr6 h LYS 239 CO -0.16 0.60 -0.46 0.00 -2.27 0.00 0.00 179.45 177.16 2gr6 h ARG 240 N 0.40 0.00 0.00 1.90 3.08 -0.85 -1.79 114.38 117.12 2gr6 h ARG 240 Ca 0.11 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.91 2gr6 h ARG 240 Cb 0.29 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.37 2gr6 h ARG 240 CO 0.00 0.46 -0.99 1.98 -1.07 0.00 0.00 179.97 180.35 2gr6 h MET 241 N 0.00 0.66 -0.62 0.04 4.05 -0.78 -0.76 114.93 117.52 2gr6 h MET 241 Ca -0.00 -0.72 -0.04 0.00 -0.28 0.00 0.00 59.70 58.66 2gr6 h MET 241 Cb 0.94 0.21 -0.03 0.00 -0.80 0.00 0.00 31.60 31.92 2gr6 h MET 241 CO 0.06 1.30 0.22 0.00 0.23 0.00 0.00 176.91 178.72 2gr6 h GLY 243 N 1.01 0.64 1.67 0.00 0.00 -1.31 -0.48 103.07 104.59 2gr6 h GLY 243 Ca 0.21 -0.12 -0.04 0.00 0.00 0.00 0.00 47.33 47.37 2gr6 h GLY 243 CO -0.01 0.05 -0.02 0.00 0.00 0.00 0.00 176.54 176.55 2gr6 h ALA 244 N 1.29 1.45 -0.28 3.60 0.00 -1.31 -2.21 119.26 121.80 2gr6 h ALA 244 Ca 0.22 -0.18 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 2gr6 h ALA 244 Cb 0.19 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2gr6 h ALA 244 CO -0.20 0.39 -0.47 -0.07 0.00 0.00 0.00 179.25 178.90 2gr6 h LEU 245 N 0.40 0.91 -0.59 0.00 3.38 -0.75 -2.97 115.31 115.69 2gr6 h LEU 245 Ca 0.09 -0.52 -0.13 0.00 0.09 0.00 0.00 57.88 57.40 2gr6 h LEU 245 Cb 0.31 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2gr6 h LEU 245 CO 0.01 1.25 -0.31 -0.07 0.09 0.00 0.00 178.44 179.41 2gr6 h LEU 246 N 0.59 0.81 0.38 1.67 3.38 -0.98 -0.17 115.31 121.00 2gr6 h LEU 246 Ca 0.02 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.65 2gr6 h LEU 246 Cb 1.07 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 2gr6 h LEU 246 CO 0.11 1.06 -0.40 0.25 0.09 0.00 0.00 178.44 179.55 2gr6 h LEU 247 N 0.66 -1.10 -0.34 1.67 5.85 -1.38 0.11 115.31 120.78 2gr6 h LEU 247 Ca 0.07 0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.83 2gr6 h LEU 247 Cb 0.85 0.37 -0.01 0.00 0.37 0.00 0.00 40.66 42.24 2gr6 h LEU 247 CO 0.07 -0.55 0.00 1.23 -0.34 0.00 0.00 178.44 178.86 2gr6 h GLY 248 N -0.81 0.64 2.00 3.75 0.00 -1.50 -1.23 103.07 105.91 2gr6 h GLY 248 Ca -0.03 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 46.79 2gr6 h GLY 248 CO -0.08 0.43 -0.16 -1.33 0.00 0.00 0.00 176.54 175.41 2gr6 h GLY 249 N 0.40 0.00 0.00 4.60 0.00 -0.86 -3.20 103.07 104.02 2gr6 h GLY 249 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.12 2gr6 h GLY 249 CO 0.02 0.00 -2.26 1.04 0.00 0.00 0.00 176.54 175.33 2gr6 n LEU 250 N -3.70 0.00 -0.09 3.11 4.32 0.36 -4.46 117.00 116.54 2gr6 n LEU 250 Ca -0.02 0.00 -0.18 0.00 -0.02 0.00 0.00 56.01 55.80 2gr6 n LEU 250 Cb 0.28 0.41 -0.07 0.00 -1.62 0.00 0.00 43.42 42.42 2gr6 n LEU 250 CO 0.32 0.41 -1.12 -0.67 -1.22 0.00 0.00 177.39 175.11 2gr6 n ASP 251 N -2.64 1.70 0.00 -1.43 -0.08 -0.47 -4.69 116.55 108.93 2gr6 n ASP 251 Ca -0.28 0.13 0.00 0.00 -1.51 0.00 0.00 54.79 53.14 2gr6 n ASP 251 Cb 1.05 -0.47 0.00 0.00 2.34 0.00 0.00 41.12 44.04 2gr6 n ASP 251 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 2gr6 n THR 252 N -3.59 0.00 -0.28 5.18 -2.24 -1.21 -2.76 114.28 109.38 2gr6 n THR 252 Ca -0.35 1.42 0.10 0.00 -2.27 0.00 0.00 64.05 62.95 2gr6 n THR 252 Cb 0.78 -2.42 0.25 0.00 -2.10 0.00 0.00 70.33 66.83 2gr6 n THR 252 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2gr6 h VAL 253 N 0.00 0.47 -0.59 2.28 2.07 -1.90 -0.54 116.25 118.05 2gr6 h VAL 253 Ca 0.00 -0.11 0.12 0.00 0.82 0.00 0.00 66.70 67.53 2gr6 h VAL 253 Cb 0.00 0.12 -0.11 0.00 -1.52 0.00 0.00 31.29 29.78 2gr6 h VAL 253 CO 0.00 0.06 -0.18 0.58 0.02 0.00 0.00 177.57 178.04 2gr6 h VAL 254 N 0.32 0.36 -0.15 2.57 2.07 -1.75 -0.21 116.25 119.46 2gr6 h VAL 254 Ca 0.49 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.88 2gr6 h VAL 254 Cb 0.90 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2gr6 h VAL 254 CO -0.54 0.00 -0.41 0.78 0.02 0.00 0.00 177.57 177.42 2gr6 h ASN 255 N -0.04 0.62 -0.87 0.57 2.35 -0.96 -3.20 115.58 114.06 2gr6 h ASN 255 Ca 0.28 -0.58 0.09 0.00 -0.55 0.00 0.00 56.30 55.53 2gr6 h ASN 255 Cb 0.47 -0.18 -0.06 0.00 0.05 0.00 0.00 38.32 38.59 2gr6 h ASN 255 CO -0.62 1.09 0.56 0.15 -1.65 0.00 0.00 177.43 176.96 2gr6 h PHE 256 N 0.18 0.94 -0.74 1.19 3.04 -0.74 -1.90 116.94 118.92 2gr6 h PHE 256 Ca -0.01 0.02 0.02 0.00 3.98 0.00 0.00 57.97 61.99 2gr6 h PHE 256 Cb 1.02 -0.30 -0.04 0.00 2.56 0.00 0.00 35.95 39.18 2gr6 h PHE 256 CO 0.10 0.45 0.48 -0.07 -2.02 0.00 0.00 178.31 177.25 2gr6 h LEU 257 N 0.89 0.80 -0.72 0.59 3.38 -1.04 -2.29 115.31 116.92 2gr6 h LEU 257 Ca 0.39 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.31 2gr6 h LEU 257 Cb 0.35 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 2gr6 h LEU 257 CO -0.16 0.57 0.27 0.28 0.09 0.00 0.00 178.44 179.49 2gr6 h SER 258 N 0.95 1.01 -0.57 -0.43 0.02 -1.39 -1.06 113.55 112.08 2gr6 h SER 258 Ca 0.29 -0.18 0.01 0.00 -0.84 0.00 0.00 61.79 61.06 2gr6 h SER 258 Cb -0.04 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.21 2gr6 h SER 258 CO -0.09 0.92 0.37 -0.26 -1.14 0.00 0.00 176.83 176.63 2gr6 h PHE 259 N 1.04 0.70 -0.45 3.45 0.04 -1.28 0.28 116.94 120.72 2gr6 h PHE 259 Ca 0.24 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.98 2gr6 h PHE 259 Cb 0.24 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 38.14 2gr6 h PHE 259 CO 0.02 0.43 0.08 0.77 -0.60 0.00 0.00 178.31 179.01 2gr6 h SER 260 N 0.75 0.70 -0.43 2.17 0.02 -1.15 -2.27 113.55 113.33 2gr6 h SER 260 Ca 0.21 -0.25 -0.12 0.00 -0.84 0.00 0.00 61.79 60.79 2gr6 h SER 260 Cb -0.06 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.28 2gr6 h SER 260 CO -0.06 0.77 -0.19 -0.03 -1.14 0.00 0.00 176.83 176.18 2gr6 h MET 261 N 0.60 0.90 -0.43 3.45 -1.53 -0.88 -0.93 114.93 116.10 2gr6 h MET 261 Ca 0.14 -0.38 0.06 0.00 -3.44 0.00 0.00 59.70 56.08 2gr6 h MET 261 Cb 0.36 -0.03 -0.06 0.00 -0.55 0.00 0.00 31.60 31.33 2gr6 h MET 261 CO 0.01 1.03 0.11 1.49 0.14 0.00 0.00 176.91 179.69 2gr6 h GLU 262 N 0.72 0.24 -0.02 0.39 4.81 -0.33 0.10 114.58 120.50 2gr6 h GLU 262 Ca 0.10 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2gr6 h GLU 262 Cb 0.76 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.08 2gr6 h GLU 262 CO 0.06 0.16 0.01 0.35 -0.73 0.00 0.00 179.01 178.86 2gr6 h PHE 263 N 0.25 0.03 -0.96 0.92 3.04 -1.19 -2.74 116.94 116.29 2gr6 h PHE 263 Ca 0.21 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.16 2gr6 h PHE 263 Cb 0.24 -0.01 -0.05 0.00 2.56 0.00 0.00 35.95 38.70 2gr6 h PHE 263 CO -0.19 0.12 0.61 -0.07 -2.02 0.00 0.00 178.31 176.75 2gr6 h LEU 264 N -0.06 1.12 -2.74 0.59 3.38 -0.76 -0.18 115.31 116.67 2gr6 h LEU 264 Ca 0.01 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2gr6 h LEU 264 Cb 0.10 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 2gr6 h LEU 264 CO -0.00 0.84 -0.01 0.00 0.09 0.00 0.00 178.44 179.36 2gr6 h ALA 265 N 1.36 1.15 -0.01 1.53 0.00 -0.61 -1.12 119.26 121.55 2gr6 h ALA 265 Ca 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2gr6 h ALA 265 Cb -0.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2gr6 h ALA 265 CO -0.07 0.01 -0.33 1.63 0.00 0.00 0.00 179.25 180.48 2gr6 n LYS 266 N -3.31 1.55 -3.87 0.00 5.02 -0.21 -3.89 118.16 113.45 2gr6 n LYS 266 Ca -0.03 -0.97 -0.30 0.00 -2.02 0.00 0.00 58.31 55.00 2gr6 n LYS 266 Cb 0.09 -1.35 -0.14 0.00 -0.02 0.00 0.00 35.03 33.62 2gr6 n LYS 266 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2gr6 s SER 267 N -2.03 4.11 0.33 4.39 0.01 -0.43 -4.95 113.70 115.13 2gr6 s SER 267 Ca 0.16 -2.96 0.02 0.00 1.31 0.00 0.00 55.95 54.49 2gr6 s SER 267 Cb 0.15 -1.44 0.57 0.00 0.21 0.00 0.00 66.02 65.51 2gr6 s SER 267 CO 0.43 -0.23 1.91 -0.65 0.41 0.00 0.00 173.24 175.11 2gr6 h PRO 268 N 6.48 0.70 -0.60 12.44 0.11 -1.88 -2.39 132.00 146.86 2gr6 h PRO 268 Ca -0.04 -0.11 -0.07 0.00 0.11 0.00 0.00 66.00 65.90 2gr6 h PRO 268 Cb 0.89 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 31.85 2gr6 h PRO 268 CO 0.62 0.60 0.10 0.93 -0.21 0.00 0.00 178.00 180.04 2gr6 h GLU 269 N 0.69 0.96 0.00 1.05 5.08 -1.94 -1.36 114.58 119.06 2gr6 h GLU 269 Ca 0.17 -0.23 -0.11 0.00 -1.00 0.00 0.00 59.36 58.19 2gr6 h GLU 269 Cb 0.17 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 2gr6 h GLU 269 CO -0.01 0.88 -0.51 0.45 -1.00 0.00 0.00 179.01 178.82 2gr6 h HIS 270 N 0.91 0.00 0.07 4.33 3.86 -1.86 -2.25 115.15 120.20 2gr6 h HIS 270 Ca 0.19 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.39 2gr6 h HIS 270 Cb 0.39 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.86 2gr6 h HIS 270 CO 0.03 0.51 -0.03 0.00 0.86 0.00 0.00 177.93 179.29 2gr6 h ARG 271 N 0.00 -0.09 -0.65 2.45 3.08 -1.11 -3.15 114.38 114.91 2gr6 h ARG 271 Ca -0.01 0.01 0.14 0.00 0.07 0.00 0.00 59.98 60.19 2gr6 h ARG 271 Cb 1.07 0.02 -0.12 0.00 0.08 0.00 0.00 29.97 31.02 2gr6 h ARG 271 CO 0.07 0.44 -0.07 0.37 -1.07 0.00 0.00 179.97 179.70 2gr6 h GLN 272 N -0.67 0.06 -0.66 0.04 4.15 -1.23 -0.03 115.11 116.77 2gr6 h GLN 272 Ca -0.01 -0.00 0.14 0.00 0.77 0.00 0.00 58.65 59.55 2gr6 h GLN 272 Cb 0.56 -0.01 -0.10 0.00 0.21 0.00 0.00 27.48 28.13 2gr6 h GLN 272 CO 0.01 0.04 0.08 1.49 -1.93 0.00 0.00 178.83 178.52 2gr6 h GLU 273 N 0.06 0.18 0.00 1.69 4.81 -1.42 -0.06 114.58 119.84 2gr6 h GLU 273 Ca 0.33 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.43 2gr6 h GLU 273 Cb 0.54 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.86 2gr6 h GLU 273 CO -0.61 0.12 -0.65 -0.07 -0.73 0.00 0.00 179.01 177.07 2gr6 h LEU 274 N 0.19 0.00 -0.53 1.64 3.38 -1.16 -2.06 115.31 116.77 2gr6 h LEU 274 Ca 0.36 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.18 2gr6 h LEU 274 Cb 0.58 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2gr6 h LEU 274 CO -0.51 0.57 -0.42 0.40 0.09 0.00 0.00 178.44 178.57 2gr6 h ILE 275 N 0.00 1.29 0.16 1.22 2.04 -0.15 -2.38 117.51 119.69 2gr6 h ILE 275 Ca -0.02 -1.60 -0.30 0.00 1.00 0.00 0.00 64.86 63.94 2gr6 h ILE 275 Cb 1.45 1.52 0.02 0.00 -0.74 0.00 0.00 36.82 39.07 2gr6 h ILE 275 CO 0.07 0.52 -1.30 -0.33 0.00 0.00 0.00 178.15 177.11 2gr6 h GLU 276 N 0.58 0.43 -2.61 2.37 5.08 -1.07 -3.40 114.58 115.96 2gr6 h GLU 276 Ca 0.04 -0.68 -0.60 0.00 -1.00 0.00 0.00 59.36 57.13 2gr6 h GLU 276 Cb 0.97 0.24 -0.39 0.00 0.50 0.00 0.00 28.75 30.07 2gr6 h GLU 276 CO 0.09 1.31 -0.84 1.03 -1.00 0.00 0.00 179.01 179.60 2gr6 s ARG 277 N -2.75 1.43 0.57 2.33 0.52 -0.78 -4.96 118.95 115.31 2gr6 s ARG 277 Ca -0.07 -2.52 0.26 0.00 -0.52 0.00 0.00 55.73 52.89 2gr6 s ARG 277 Cb 0.06 -2.10 1.62 0.00 0.52 0.00 0.00 34.95 35.05 2gr6 s ARG 277 CO 0.91 -1.35 2.16 -1.35 0.02 0.00 0.00 175.30 175.69 2gr6 h PRO 278 N 5.57 0.00 0.00 3.54 0.11 -1.66 -1.61 132.00 137.96 2gr6 h PRO 278 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 2gr6 h PRO 278 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2gr6 h PRO 278 CO 0.49 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.43 2gr6 n GLU 279 N -4.01 0.02 0.00 1.05 0.00 -1.26 -1.24 120.64 115.20 2gr6 n GLU 279 Ca -0.00 0.32 0.13 0.00 0.00 0.00 0.00 57.16 57.61 2gr6 n GLU 279 Cb 0.22 -1.50 0.34 0.00 0.00 0.00 0.00 31.44 30.49 2gr6 n GLU 279 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2gr6 n ARG 280 N -1.47 1.15 -0.24 3.44 1.74 -0.60 -4.35 116.66 116.33 2gr6 n ARG 280 Ca 0.03 -0.74 -0.03 0.00 -0.77 0.00 0.00 57.85 56.33 2gr6 n ARG 280 Cb 0.10 -1.48 0.08 0.00 -1.02 0.00 0.00 32.46 30.14 2gr6 n ARG 280 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 2gr6 h ILE 281 N 1.82 1.07 -0.59 0.55 2.04 -1.35 -0.54 117.51 120.50 2gr6 h ILE 281 Ca 0.00 -0.28 0.05 0.00 1.00 0.00 0.00 64.86 65.64 2gr6 h ILE 281 Cb 0.57 0.19 -0.05 0.00 -0.74 0.00 0.00 36.82 36.79 2gr6 h ILE 281 CO 0.00 0.15 0.32 -0.65 0.00 0.00 0.00 178.15 177.96 2gr6 h PRO 282 N 0.81 0.58 -0.48 2.37 0.11 -1.81 0.26 132.00 133.84 2gr6 h PRO 282 Ca 0.28 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.32 2gr6 h PRO 282 Cb 0.05 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.01 2gr6 h PRO 282 CO -0.12 0.38 0.15 0.00 -0.21 0.00 0.00 178.00 178.20 2gr6 h ALA 283 N 1.31 0.63 -0.96 -0.75 0.00 -1.75 -2.49 119.26 115.25 2gr6 h ALA 283 Ca 0.26 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2gr6 h ALA 283 Cb 0.16 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 2gr6 h ALA 283 CO -0.17 0.28 0.60 0.00 0.00 0.00 0.00 179.25 179.96 2gr6 h ALA 284 N 1.01 1.25 -0.91 0.00 0.00 -0.25 -1.73 119.26 118.63 2gr6 h ALA 284 Ca 0.15 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.04 2gr6 h ALA 284 Cb 0.27 -0.39 -0.07 0.00 0.00 0.00 0.00 17.79 17.61 2gr6 h ALA 284 CO -0.01 0.66 0.57 0.00 0.00 0.00 0.00 179.25 180.48 2gr6 h GLU 286 N 1.02 -0.13 -1.00 0.00 4.39 -0.92 -0.34 114.58 117.59 2gr6 h GLU 286 Ca 0.41 0.01 0.11 0.00 0.34 0.00 0.00 59.36 60.22 2gr6 h GLU 286 Cb 0.22 0.03 -0.08 0.00 -0.10 0.00 0.00 28.75 28.82 2gr6 h GLU 286 CO -0.19 0.17 0.64 1.49 -1.16 0.00 0.00 179.01 179.96 2gr6 h GLU 287 N -0.44 1.01 0.00 2.33 4.57 -0.82 0.21 114.58 121.44 2gr6 h GLU 287 Ca -0.01 -0.06 -0.09 0.00 -1.18 0.00 0.00 59.36 58.02 2gr6 h GLU 287 Cb 0.36 -0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 2gr6 h GLU 287 CO 0.02 0.67 -0.43 -0.07 -1.18 0.00 0.00 179.01 178.02 2gr6 h LEU 288 N 1.04 0.00 -0.58 1.64 3.38 -0.58 -1.49 115.31 118.72 2gr6 h LEU 288 Ca 0.48 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.29 2gr6 h LEU 288 Cb 0.41 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2gr6 h LEU 288 CO -0.24 0.43 -0.56 -0.07 0.09 0.00 0.00 178.44 178.09 2gr6 h LEU 289 N 0.00 0.49 0.21 1.67 3.38 0.11 -1.18 115.31 120.00 2gr6 h LEU 289 Ca -0.00 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 2gr6 h LEU 289 Cb 0.85 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.46 2gr6 h LEU 289 CO 0.06 0.95 -0.10 -0.09 0.09 0.00 0.00 178.44 179.35 2gr6 h ARG 290 N 0.34 -0.27 -0.08 1.13 2.43 -0.67 -2.55 114.38 114.70 2gr6 h ARG 290 Ca 0.00 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.15 2gr6 h ARG 290 Cb 1.09 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.69 2gr6 h ARG 290 CO 0.10 0.11 -0.15 -0.09 -1.51 0.00 0.00 179.97 178.43 2gr6 h ARG 291 N -0.89 0.13 -0.44 0.20 9.65 -1.35 -3.15 114.38 118.53 2gr6 h ARG 291 Ca -0.03 -0.03 -0.31 0.00 -1.10 0.00 0.00 59.98 58.52 2gr6 h ARG 291 Cb 0.51 -0.02 -0.22 0.00 -1.39 0.00 0.00 29.97 28.85 2gr6 h ARG 291 CO 0.05 0.29 -0.47 1.19 2.80 0.00 0.00 179.97 183.82 2gr6 n PHE 292 N -4.30 1.55 -1.69 2.20 3.01 -0.45 -4.98 117.46 112.81 2gr6 n PHE 292 Ca -0.01 -1.92 -0.39 0.00 1.01 0.00 0.00 57.45 56.14 2gr6 n PHE 292 Cb 0.26 -0.41 0.04 0.00 -0.01 0.00 0.00 39.48 39.36 2gr6 n PHE 292 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2gr6 n SER 293 N -0.94 2.07 0.00 4.37 2.88 -0.96 -4.91 113.62 116.13 2gr6 n SER 293 Ca 0.35 0.96 0.00 0.00 -1.33 0.00 0.00 58.87 58.85 2gr6 n SER 293 Cb 0.87 -1.50 0.00 0.00 -0.75 0.00 0.00 64.21 62.83 2gr6 n SER 293 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2gr6 n LEU 294 N -0.66 0.34 -4.59 2.46 -0.00 -1.26 -4.89 117.00 108.39 2gr6 n LEU 294 Ca 0.11 -0.34 -0.30 0.00 -0.00 0.00 0.00 56.01 55.48 2gr6 n LEU 294 Cb 0.44 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.76 2gr6 n LEU 294 CO 0.53 0.08 -0.40 -0.69 -0.00 0.00 0.00 177.39 176.92 2gr6 s VAL 295 N -0.17 3.51 -0.29 1.47 1.01 -1.26 0.15 120.40 124.82 2gr6 s VAL 295 Ca 0.00 -1.09 0.03 0.00 0.00 0.00 0.00 61.98 60.92 2gr6 s VAL 295 Cb 0.00 -2.61 0.20 0.00 0.00 0.00 0.00 36.38 33.97 2gr6 s VAL 295 CO 0.00 0.20 0.64 0.00 0.00 0.00 0.00 175.10 175.94 2gr6 s ALA 296 N -1.15 -2.52 0.00 5.51 0.00 0.29 -1.92 121.76 121.96 2gr6 s ALA 296 Ca 0.21 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.44 2gr6 s ALA 296 Cb -0.11 -2.48 0.00 0.00 0.00 0.00 0.00 23.12 20.53 2gr6 s ALA 296 CO 0.12 -1.73 0.00 -0.40 0.00 0.00 0.00 175.76 173.76 2gr6 n ASP 297 N 5.40 1.43 0.00 0.00 5.75 -1.26 -4.38 116.55 123.49 2gr6 n ASP 297 Ca 0.04 -0.31 0.00 0.00 -0.01 0.00 0.00 54.79 54.51 2gr6 n ASP 297 Cb 0.54 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.63 2gr6 n ASP 297 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2gr6 n GLY 298 N 3.58 3.31 3.43 6.12 0.00 0.84 -2.17 105.19 120.30 2gr6 n GLY 298 Ca 0.00 -0.76 -0.23 0.00 0.00 0.00 0.00 46.02 45.03 2gr6 n GLY 298 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gr6 s ARG 299 N 1.22 1.80 -0.04 1.61 1.81 -0.79 -4.18 118.95 120.38 2gr6 s ARG 299 Ca 0.00 -2.07 -0.00 0.00 -1.72 0.00 0.00 55.73 51.94 2gr6 s ARG 299 Cb 0.00 -0.35 0.03 0.00 -0.45 0.00 0.00 34.95 34.18 2gr6 s ARG 299 CO 0.00 -0.49 0.00 -1.50 -0.68 0.00 0.00 175.30 172.64 2gr6 s ILE 300 N -3.35 0.23 -0.13 1.52 2.07 -0.07 -2.19 121.20 119.28 2gr6 s ILE 300 Ca 0.30 0.10 -0.35 0.00 -1.41 0.00 0.00 60.65 59.29 2gr6 s ILE 300 Cb 0.03 -0.35 -0.12 0.00 0.13 0.00 0.00 42.46 42.16 2gr6 s ILE 300 CO 0.17 0.18 1.90 0.18 -1.91 0.00 0.00 174.94 175.46 2gr6 n LEU 301 N 4.43 3.28 0.12 8.50 7.99 -0.81 -1.87 117.00 138.65 2gr6 n LEU 301 Ca -0.20 0.93 0.13 0.00 -0.01 0.00 0.00 56.01 56.86 2gr6 n LEU 301 Cb 0.50 -1.35 0.46 0.00 -0.11 0.00 0.00 43.42 42.92 2gr6 n LEU 301 CO 0.19 -0.14 0.87 0.35 -1.51 0.00 0.00 177.39 177.15 2gr6 n THR 302 N 5.28 0.72 -3.79 -5.08 -2.24 -0.27 -1.14 114.28 107.77 2gr6 n THR 302 Ca 0.24 -0.01 -0.01 0.00 -2.27 0.00 0.00 64.05 62.00 2gr6 n THR 302 Cb 0.28 -0.90 0.00 0.00 -2.10 0.00 0.00 70.33 67.61 2gr6 n THR 302 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2gr6 s SER 303 N -4.42 -0.06 0.66 3.42 1.04 -1.26 -4.83 113.70 108.24 2gr6 s SER 303 Ca 0.07 -0.40 -0.17 0.00 0.48 0.00 0.00 55.95 55.93 2gr6 s SER 303 Cb 0.11 0.36 -0.00 0.00 0.10 0.00 0.00 66.02 66.58 2gr6 s SER 303 CO 0.49 -0.69 1.25 -1.81 0.98 0.00 0.00 173.24 173.45 2gr6 s ASP 304 N -3.22 4.62 -0.29 7.02 1.01 -1.26 -4.01 116.67 120.54 2gr6 s ASP 304 Ca 0.18 2.50 -0.21 0.00 0.71 0.00 0.00 52.55 55.73 2gr6 s ASP 304 Cb -0.00 -2.61 0.17 0.00 1.01 0.00 0.00 42.92 41.50 2gr6 s ASP 304 CO 0.01 -1.98 1.23 -0.47 0.21 0.00 0.00 175.17 174.17 2gr6 s TYR 305 N -1.60 -0.23 -0.39 4.23 5.04 -0.19 -4.91 117.35 119.30 2gr6 s TYR 305 Ca 0.79 0.51 -0.18 0.00 -2.44 0.00 0.00 57.07 55.75 2gr6 s TYR 305 Cb -0.34 0.32 0.01 0.00 0.35 0.00 0.00 41.96 42.30 2gr6 s TYR 305 CO 0.40 -0.11 0.49 -2.00 -1.34 0.00 0.00 175.55 172.99 2gr6 s GLU 306 N 0.57 3.37 -0.27 4.97 2.12 -1.26 -0.66 118.70 127.54 2gr6 s GLU 306 Ca -0.00 -0.43 -0.04 0.00 0.36 0.00 0.00 54.97 54.85 2gr6 s GLU 306 Cb -0.04 -3.89 0.02 0.00 0.26 0.00 0.00 34.13 30.48 2gr6 s GLU 306 CO -0.12 -0.77 0.00 0.12 -0.54 0.00 0.00 175.26 173.95 2gr6 s PHE 307 N 2.35 3.11 -1.32 5.30 5.36 0.13 -4.68 117.98 128.22 2gr6 s PHE 307 Ca 0.16 -1.32 -0.00 0.00 -0.96 0.00 0.00 56.93 54.81 2gr6 s PHE 307 Cb -0.16 -2.14 0.00 0.00 -0.34 0.00 0.00 43.02 40.38 2gr6 s PHE 307 CO 0.14 -0.67 0.67 0.72 -1.46 0.00 0.00 175.22 174.63 2gr6 n HIS 308 N 4.75 -1.89 -0.43 10.12 8.25 -1.26 -1.51 115.22 133.25 2gr6 n HIS 308 Ca -0.16 0.83 0.00 0.00 -0.26 0.00 0.00 57.72 58.14 2gr6 n HIS 308 Cb 0.47 -4.33 0.00 0.00 1.12 0.00 0.00 29.99 27.25 2gr6 n HIS 308 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gr6 n GLY 309 N -1.61 1.72 3.65 -1.41 0.00 -1.26 -4.99 105.19 101.28 2gr6 n GLY 309 Ca -0.30 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 2gr6 n GLY 309 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gr6 s VAL 310 N -3.06 4.44 -0.13 1.61 1.01 -0.57 -5.08 120.40 118.63 2gr6 s VAL 310 Ca 0.00 -0.18 -0.21 0.00 0.00 0.00 0.00 61.98 61.59 2gr6 s VAL 310 Cb 0.00 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.42 2gr6 s VAL 310 CO 0.00 0.55 0.61 -1.10 0.00 0.00 0.00 175.10 175.16 2gr6 s GLN 311 N -0.34 4.33 -0.09 2.72 -1.52 -1.26 0.18 119.66 123.67 2gr6 s GLN 311 Ca 0.07 0.66 0.03 0.00 -1.95 0.00 0.00 55.36 54.17 2gr6 s GLN 311 Cb -0.12 -3.49 -0.01 0.00 -0.22 0.00 0.00 33.01 29.17 2gr6 s GLN 311 CO 0.02 -0.01 -0.19 -0.51 -0.25 0.00 0.00 175.29 174.35 2gr6 s LEU 312 N 1.12 2.39 0.29 2.90 1.43 0.17 -4.93 118.68 122.04 2gr6 s LEU 312 Ca 0.31 -0.41 -0.09 0.00 -1.03 0.00 0.00 54.13 52.91 2gr6 s LEU 312 Cb -0.16 -1.49 -0.07 0.00 0.03 0.00 0.00 46.19 44.50 2gr6 s LEU 312 CO 0.13 0.21 0.61 -0.75 0.23 0.00 0.00 176.35 176.78 2gr6 s LYS 313 N 0.05 3.77 0.32 1.70 2.47 -1.26 -1.02 119.74 125.76 2gr6 s LYS 313 Ca -0.08 0.26 -0.29 0.00 -1.56 0.00 0.00 55.97 54.31 2gr6 s LYS 313 Cb -0.15 -2.58 -0.13 0.00 -1.46 0.00 0.00 37.83 33.51 2gr6 s LYS 313 CO 0.05 0.21 1.31 1.17 0.16 0.00 0.00 175.35 178.25 2gr6 n LYS 314 N -0.60 2.09 0.00 4.03 4.81 -1.26 -1.69 118.16 125.55 2gr6 n LYS 314 Ca 0.00 0.74 0.00 0.00 -0.87 0.00 0.00 58.31 58.18 2gr6 n LYS 314 Cb 0.53 -2.33 0.00 0.00 0.02 0.00 0.00 35.03 33.25 2gr6 n LYS 314 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2gr6 n GLY 315 N 1.10 2.36 3.73 3.14 0.00 -0.29 -4.94 105.19 110.29 2gr6 n GLY 315 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 2gr6 n GLY 315 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gr6 s ASP 316 N -2.60 4.62 -0.14 1.61 -0.00 -0.68 -4.70 116.67 114.78 2gr6 s ASP 316 Ca 0.00 2.51 -0.04 0.00 -0.00 0.00 0.00 52.55 55.02 2gr6 s ASP 316 Cb 0.00 -2.61 -0.03 0.00 -0.00 0.00 0.00 42.92 40.28 2gr6 s ASP 316 CO 0.00 -1.98 -0.02 -1.10 -0.00 0.00 0.00 175.17 172.07 2gr6 s GLN 317 N -3.50 3.54 -0.09 8.23 -0.21 -1.26 -1.92 119.66 124.44 2gr6 s GLN 317 Ca 0.79 -0.47 0.02 0.00 0.02 0.00 0.00 55.36 55.72 2gr6 s GLN 317 Cb -0.34 -2.92 0.01 0.00 1.00 0.00 0.00 33.01 30.77 2gr6 s GLN 317 CO 0.40 0.36 -0.14 -1.50 -2.12 0.00 0.00 175.29 172.28 2gr6 s ILE 318 N 0.05 1.39 -0.12 1.08 2.07 -0.93 0.56 121.20 125.31 2gr6 s ILE 318 Ca 0.01 -0.60 -0.20 0.00 -1.41 0.00 0.00 60.65 58.46 2gr6 s ILE 318 Cb -0.13 -1.27 -0.04 0.00 0.13 0.00 0.00 42.46 41.15 2gr6 s ILE 318 CO 0.02 0.42 0.54 -0.22 -1.91 0.00 0.00 174.94 173.79 2gr6 s LEU 319 N 0.87 4.27 -0.59 8.50 2.96 0.14 -1.89 118.68 132.93 2gr6 s LEU 319 Ca -0.10 0.89 0.04 0.00 -0.22 0.00 0.00 54.13 54.74 2gr6 s LEU 319 Cb -0.15 -2.80 0.14 0.00 0.50 0.00 0.00 46.19 43.88 2gr6 s LEU 319 CO 0.01 -0.06 0.35 -0.76 -1.32 0.00 0.00 176.35 174.57 2gr6 s LEU 320 N 0.83 4.52 -0.61 -0.68 1.43 -0.92 -2.07 118.68 121.18 2gr6 s LEU 320 Ca 0.29 -3.31 -0.26 0.00 -1.03 0.00 0.00 54.13 49.82 2gr6 s LEU 320 Cb -0.16 -1.65 -0.10 0.00 0.03 0.00 0.00 46.19 44.31 2gr6 s LEU 320 CO 0.12 -0.18 2.45 -2.65 0.23 0.00 0.00 176.35 176.32 2gr6 n PRO 321 N 2.72 0.82 0.20 1.29 -0.02 -1.26 -4.31 135.00 134.43 2gr6 n PRO 321 Ca 0.10 -0.11 0.17 0.00 -2.02 0.00 0.00 63.50 61.64 2gr6 n PRO 321 Cb 0.33 -3.17 0.82 0.00 -0.02 0.00 0.00 33.50 31.46 2gr6 n PRO 321 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2gr6 h GLN 322 N 17.61 0.00 -0.66 -0.52 7.50 -1.82 -0.19 115.11 137.03 2gr6 h GLN 322 Ca -0.18 0.00 -0.08 0.00 0.50 0.00 0.00 58.65 58.89 2gr6 h GLN 322 Cb 1.24 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 28.74 2gr6 h GLN 322 CO 1.18 0.00 0.10 1.98 -1.50 0.00 0.00 178.83 180.59 2gr6 h MET 323 N 0.00 1.09 -0.31 1.46 4.05 -1.64 -3.30 114.93 116.28 2gr6 h MET 323 Ca 0.09 -0.30 -0.11 0.00 -0.28 0.00 0.00 59.70 59.11 2gr6 h MET 323 Cb 0.51 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.17 2gr6 h MET 323 CO -0.00 1.01 -0.26 -0.07 0.23 0.00 0.00 176.91 177.81 2gr6 h LEU 324 N 1.01 0.63 -0.82 3.39 3.38 -1.33 -3.32 115.31 118.25 2gr6 h LEU 324 Ca 0.20 -0.23 0.18 0.00 0.09 0.00 0.00 57.88 58.12 2gr6 h LEU 324 Cb 0.45 -0.17 -0.15 0.00 0.09 0.00 0.00 40.66 40.87 2gr6 h LEU 324 CO 0.01 0.87 -0.07 0.28 0.09 0.00 0.00 178.44 179.62 2gr6 h SER 325 N 0.54 -0.53 1.77 -0.43 0.02 -1.64 0.21 113.55 113.50 2gr6 h SER 325 Ca 0.07 0.23 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 2gr6 h SER 325 Cb 0.73 0.43 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2gr6 h SER 325 CO 0.06 -0.24 -0.07 1.23 -1.14 0.00 0.00 176.83 176.66 2gr6 h GLY 326 N 0.05 0.00 -0.30 -3.77 0.00 -1.74 -3.05 103.07 94.26 2gr6 h GLY 326 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.77 2gr6 h GLY 326 CO -0.78 0.00 -0.03 1.04 0.00 0.00 0.00 176.54 176.77 2gr6 n LEU 327 N -2.83 1.37 -4.67 3.11 4.77 -0.06 -4.66 117.00 114.02 2gr6 n LEU 327 Ca 0.04 -0.44 -0.43 0.00 -0.03 0.00 0.00 56.01 55.15 2gr6 n LEU 327 Cb 0.50 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.55 2gr6 n LEU 327 CO 0.33 0.23 1.04 -0.62 -1.33 0.00 0.00 177.39 177.05 2gr6 s ASP 328 N -2.07 6.98 0.22 -1.43 3.68 -0.45 -4.77 116.67 118.82 2gr6 s ASP 328 Ca 0.37 1.73 0.19 0.00 2.13 0.00 0.00 52.55 56.96 2gr6 s ASP 328 Cb 0.21 -2.54 0.88 0.00 -1.45 0.00 0.00 42.92 40.01 2gr6 s ASP 328 CO 0.36 -0.71 1.57 1.21 0.13 0.00 0.00 175.17 177.73 2gr6 n GLU 329 N 6.17 0.12 0.02 4.34 2.13 -1.26 -0.75 120.64 131.41 2gr6 n GLU 329 Ca 0.13 0.49 0.13 0.00 0.66 0.00 0.00 57.16 58.57 2gr6 n GLU 329 Cb 0.45 -1.81 0.33 0.00 0.27 0.00 0.00 31.44 30.68 2gr6 n GLU 329 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2gr6 n ARG 330 N -2.06 0.07 -0.07 5.31 1.74 -1.26 -3.97 116.66 116.43 2gr6 n ARG 330 Ca 0.01 0.03 -0.07 0.00 -0.77 0.00 0.00 57.85 57.04 2gr6 n ARG 330 Cb 0.12 -1.55 -0.09 0.00 -1.02 0.00 0.00 32.46 29.91 2gr6 n ARG 330 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2gr6 n GLU 331 N -1.67 1.62 -3.59 5.56 1.02 0.07 -4.96 120.64 118.69 2gr6 n GLU 331 Ca 0.05 0.01 -0.17 0.00 -0.02 0.00 0.00 57.16 57.04 2gr6 n GLU 331 Cb 0.36 -1.33 -0.14 0.00 -0.02 0.00 0.00 31.44 30.32 2gr6 n GLU 331 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2gr6 s ASN 332 N -4.76 1.01 0.31 1.62 0.01 -0.54 -4.68 114.94 107.90 2gr6 s ASN 332 Ca -0.09 0.11 -0.30 0.00 -0.71 0.00 0.00 52.86 51.87 2gr6 s ASN 332 Cb 0.04 0.38 -0.11 0.00 0.41 0.00 0.00 41.25 41.97 2gr6 s ASN 332 CO 0.49 -0.28 1.58 0.00 -1.51 0.00 0.00 177.10 177.38 2gr6 s ALA 333 N 2.33 3.72 -1.21 0.60 0.00 -1.26 -2.19 121.76 123.74 2gr6 s ALA 333 Ca 0.04 1.58 -0.03 0.00 0.00 0.00 0.00 51.96 53.55 2gr6 s ALA 333 Cb -0.14 -3.65 -0.01 0.00 0.00 0.00 0.00 23.12 19.32 2gr6 s ALA 333 CO -0.09 -1.01 0.83 0.00 0.00 0.00 0.00 175.76 175.48 2gr6 n ALA 334 N 1.82 -2.16 0.01 0.00 0.00 -1.26 -4.87 120.51 114.05 2gr6 n ALA 334 Ca 0.07 -0.09 0.22 0.00 0.00 0.00 0.00 53.44 53.63 2gr6 n ALA 334 Cb 0.38 -3.01 0.72 0.00 0.00 0.00 0.00 19.45 17.54 2gr6 n ALA 334 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2gr6 h PRO 335 N -1.74 0.00 -0.00 0.00 0.13 -1.74 -1.53 132.00 127.12 2gr6 h PRO 335 Ca -0.61 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 2gr6 h PRO 335 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2gr6 h PRO 335 CO 0.52 0.00 -0.18 -1.33 -0.23 0.00 0.00 178.00 176.77 2gr6 n MET 336 N -4.11 0.49 -3.48 0.86 2.81 -1.26 -4.80 117.12 107.64 2gr6 n MET 336 Ca 0.10 -0.20 -0.38 0.00 -1.81 0.00 0.00 57.70 55.42 2gr6 n MET 336 Cb 0.66 -1.50 -0.06 0.00 -0.71 0.00 0.00 33.22 31.61 2gr6 n MET 336 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 2gr6 s HIS 337 N -2.64 3.66 -0.36 2.03 5.04 -0.58 -5.06 115.29 117.37 2gr6 s HIS 337 Ca 0.23 0.92 -0.19 0.00 -1.54 0.00 0.00 55.06 54.48 2gr6 s HIS 337 Cb 0.19 -2.34 0.00 0.00 0.04 0.00 0.00 32.58 30.48 2gr6 s HIS 337 CO 0.53 0.51 0.56 0.08 -2.34 0.00 0.00 174.74 174.08 2gr6 s VAL 338 N -0.58 4.96 -0.34 0.89 1.01 -1.26 -5.01 120.40 120.08 2gr6 s VAL 338 Ca 0.23 0.37 0.03 0.00 0.00 0.00 0.00 61.98 62.61 2gr6 s VAL 338 Cb -0.16 -4.02 0.10 0.00 0.00 0.00 0.00 36.38 32.30 2gr6 s VAL 338 CO 0.11 -0.29 0.07 -0.62 0.00 0.00 0.00 175.10 174.38 2gr6 s ASP 339 N 1.79 4.54 0.32 3.32 3.68 -1.26 -4.96 116.67 124.10 2gr6 s ASP 339 Ca 0.20 -2.03 0.18 0.00 2.13 0.00 0.00 52.55 53.04 2gr6 s ASP 339 Cb -0.15 -1.41 1.00 0.00 -1.45 0.00 0.00 42.92 40.91 2gr6 s ASP 339 CO 0.14 -0.39 1.53 0.49 0.13 0.00 0.00 175.17 177.07 2gr6 n PHE 340 N 4.39 0.63 -0.37 -5.34 3.72 -1.26 -0.27 117.46 118.96 2gr6 n PHE 340 Ca 0.02 0.33 0.10 0.00 -0.05 0.00 0.00 57.45 57.85 2gr6 n PHE 340 Cb 0.42 -0.95 0.29 0.00 -0.94 0.00 0.00 39.48 38.30 2gr6 n PHE 340 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2gr6 n SER 341 N -2.18 3.85 -4.66 4.37 7.64 -1.26 -4.55 113.62 116.83 2gr6 n SER 341 Ca -0.01 -2.07 -0.51 0.00 1.01 0.00 0.00 58.87 57.29 2gr6 n SER 341 Cb 0.13 -0.45 -0.05 0.00 -1.01 0.00 0.00 64.21 62.83 2gr6 n SER 341 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2gr6 n ARG 342 N 1.33 1.67 0.07 1.43 0.63 0.63 -4.88 116.66 117.55 2gr6 n ARG 342 Ca 0.22 0.61 -0.13 0.00 -0.92 0.00 0.00 57.85 57.63 2gr6 n ARG 342 Cb 0.62 -2.35 -0.07 0.00 0.45 0.00 0.00 32.46 31.11 2gr6 n ARG 342 CO 0.00 0.00 0.00 0.37 -2.51 0.00 0.00 177.63 175.49 2gr6 h GLN 343 N 6.84 -0.09 -3.39 -0.14 4.15 -1.94 -3.38 115.11 117.16 2gr6 h GLN 343 Ca -0.47 0.01 -0.61 0.00 0.77 0.00 0.00 58.65 58.34 2gr6 h GLN 343 Cb 1.29 0.02 -0.40 0.00 0.21 0.00 0.00 27.48 28.60 2gr6 h GLN 343 CO 0.90 -0.03 -0.73 0.21 -1.93 0.00 0.00 178.83 177.26 2gr6 s LYS 344 N -6.03 1.26 -0.73 1.69 2.47 -1.26 -5.06 119.74 112.08 2gr6 s LYS 344 Ca -0.14 -1.85 -0.26 0.00 -1.56 0.00 0.00 55.97 52.16 2gr6 s LYS 344 Cb 0.05 -2.49 0.00 0.00 -1.46 0.00 0.00 37.83 33.93 2gr6 s LYS 344 CO 0.66 -1.08 1.61 0.08 0.16 0.00 0.00 175.35 176.78 2gr6 s VAL 345 N 0.64 3.55 -0.15 4.02 1.01 -1.26 -4.96 120.40 123.25 2gr6 s VAL 345 Ca 0.15 0.14 -0.22 0.00 0.00 0.00 0.00 61.98 62.05 2gr6 s VAL 345 Cb -0.22 -4.42 -0.03 0.00 0.00 0.00 0.00 36.38 31.71 2gr6 s VAL 345 CO -0.07 -1.36 0.67 -0.55 0.00 0.00 0.00 175.10 173.78 2gr6 s SER 346 N 6.17 6.81 0.14 3.32 0.15 -1.26 -5.04 113.70 124.00 2gr6 s SER 346 Ca 0.53 0.99 -0.25 0.00 0.70 0.00 0.00 55.95 57.92 2gr6 s SER 346 Cb -0.09 -2.38 0.07 0.00 -1.71 0.00 0.00 66.02 61.91 2gr6 s SER 346 CO 0.14 -0.22 0.91 -1.38 1.20 0.00 0.00 173.24 173.88 2gr6 s HIS 347 N 1.50 -0.19 -0.14 3.44 -3.43 -1.26 -4.23 115.29 110.98 2gr6 s HIS 347 Ca 0.32 -0.10 0.22 0.00 -0.80 0.00 0.00 55.06 54.70 2gr6 s HIS 347 Cb -0.16 0.63 0.46 0.00 -1.43 0.00 0.00 32.58 32.07 2gr6 s HIS 347 CO 0.13 -0.83 1.15 0.25 -2.00 0.00 0.00 174.74 173.45 2gr6 n THR 348 N -0.43 0.89 -0.34 -5.38 -2.24 -1.26 -4.91 114.28 100.61 2gr6 n THR 348 Ca -0.07 -2.18 0.02 0.00 -2.27 0.00 0.00 64.05 59.54 2gr6 n THR 348 Cb 0.61 0.81 0.16 0.00 -2.10 0.00 0.00 70.33 69.81 2gr6 n THR 348 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2gr6 h THR 349 N 5.50 1.06 -0.43 4.28 2.02 -1.87 -0.52 112.91 122.95 2gr6 h THR 349 Ca -0.13 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 66.69 2gr6 h THR 349 Cb 1.55 -0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 2gr6 h THR 349 CO 0.17 0.19 0.00 0.49 0.37 0.00 0.00 175.52 176.75 2gr6 n PHE 350 N -4.57 1.03 0.00 3.16 3.72 -1.26 -4.81 117.46 114.74 2gr6 n PHE 350 Ca 0.14 -0.40 0.00 0.00 -0.05 0.00 0.00 57.45 57.13 2gr6 n PHE 350 Cb 0.18 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.53 2gr6 n PHE 350 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2gr6 n GLY 351 N 0.83 -1.66 3.57 1.37 0.00 -0.20 -0.01 105.19 109.08 2gr6 n GLY 351 Ca 0.17 -2.05 -0.13 0.00 0.00 0.00 0.00 46.02 44.01 2gr6 n GLY 351 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2gr6 s HIS 352 N 0.00 -0.47 0.00 1.61 2.46 -1.26 -4.62 115.29 113.01 2gr6 s HIS 352 Ca 0.00 0.85 0.00 0.00 0.47 0.00 0.00 55.06 56.38 2gr6 s HIS 352 Cb 0.00 0.43 0.00 0.00 -0.13 0.00 0.00 32.58 32.88 2gr6 s HIS 352 CO 0.00 -0.41 0.00 0.41 -2.47 0.00 0.00 174.74 172.27 2gr6 n GLY 353 N 0.93 0.19 0.08 1.59 0.00 -1.26 -4.18 105.19 102.55 2gr6 n GLY 353 Ca -0.13 -1.37 0.13 0.00 0.00 0.00 0.00 46.02 44.65 2gr6 n GLY 353 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gr6 n SER 354 N 1.22 0.63 -1.98 1.61 3.41 -1.26 -3.78 113.62 113.48 2gr6 n SER 354 Ca 0.00 0.53 -0.01 0.00 -0.26 0.00 0.00 58.87 59.13 2gr6 n SER 354 Cb 0.00 -0.68 0.35 0.00 -0.26 0.00 0.00 64.21 63.61 2gr6 n SER 354 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2gr6 n HIS 355 N -2.08 2.34 -1.54 7.33 -0.00 -1.26 -4.99 115.22 115.01 2gr6 n HIS 355 Ca 0.06 -1.02 -0.56 0.00 -0.00 0.00 0.00 57.72 56.20 2gr6 n HIS 355 Cb 0.41 -0.63 -0.07 0.00 -0.00 0.00 0.00 29.99 29.70 2gr6 n HIS 355 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.34 176.23 2gr6 n LEU 356 N 0.15 0.80 -4.69 2.41 7.94 -1.25 -4.73 117.00 117.63 2gr6 n LEU 356 Ca 0.36 1.14 -0.58 0.00 -1.11 0.00 0.00 56.01 55.82 2gr6 n LEU 356 Cb 1.33 -1.05 -0.07 0.00 0.53 0.00 0.00 43.42 44.15 2gr6 n LEU 356 CO 0.40 -1.49 1.20 0.00 -1.11 0.00 0.00 177.39 176.39 2gr6 h LEU 358 N 6.27 0.00 -2.25 0.00 3.38 -1.90 -3.11 115.31 117.70 2gr6 h LEU 358 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2gr6 h LEU 358 Cb 1.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.08 2gr6 h LEU 358 CO 0.92 0.15 0.00 0.61 0.09 0.00 0.00 178.44 180.21 2gr6 n GLY 359 N 0.75 1.85 0.36 0.83 0.00 -1.26 -4.41 105.19 103.30 2gr6 n GLY 359 Ca 0.02 -0.66 0.06 0.00 0.00 0.00 0.00 46.02 45.45 2gr6 n GLY 359 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2gr6 h GLN 360 N 3.51 0.77 -0.23 1.61 3.07 -1.89 0.78 115.11 122.73 2gr6 h GLN 360 Ca 0.00 -0.05 -0.13 0.00 0.09 0.00 0.00 58.65 58.56 2gr6 h GLN 360 Cb 0.84 -0.17 -0.01 0.00 0.08 0.00 0.00 27.48 28.22 2gr6 h GLN 360 CO 0.02 0.51 -0.42 0.45 0.09 0.00 0.00 178.83 179.48 2gr6 h HIS 361 N 0.79 0.64 -0.01 0.06 3.86 -1.85 -0.99 115.15 117.65 2gr6 h HIS 361 Ca 0.33 -0.19 -0.24 0.00 -1.16 0.00 0.00 60.37 59.12 2gr6 h HIS 361 Cb 0.28 -0.14 0.01 0.00 1.06 0.00 0.00 27.41 28.62 2gr6 h HIS 361 CO -0.00 0.87 -0.95 1.25 0.86 0.00 0.00 177.93 179.96 2gr6 h LEU 362 N 0.44 0.69 0.26 2.43 5.85 -1.61 -2.69 115.31 120.67 2gr6 h LEU 362 Ca 0.04 -0.54 -0.01 0.00 0.84 0.00 0.00 57.88 58.21 2gr6 h LEU 362 Cb 0.91 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.74 2gr6 h LEU 362 CO 0.08 1.33 -0.13 0.00 -0.34 0.00 0.00 178.44 179.39 2gr6 h ALA 363 N 0.63 -0.35 -0.49 1.25 0.00 -0.71 -1.05 119.26 118.54 2gr6 h ALA 363 Ca -0.09 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.77 2gr6 h ALA 363 Cb 1.59 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.48 2gr6 h ALA 363 CO 0.17 -0.69 0.27 0.00 0.00 0.00 0.00 179.25 179.01 2gr6 h ARG 364 N -0.37 0.52 -0.55 0.00 3.08 -1.25 0.43 114.38 116.25 2gr6 h ARG 364 Ca -0.04 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 59.99 2gr6 h ARG 364 Cb 0.28 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.19 2gr6 h ARG 364 CO 0.06 0.35 0.36 -0.09 -1.07 0.00 0.00 179.97 179.58 2gr6 h ARG 365 N 0.54 0.71 -0.76 0.04 9.65 -1.36 0.26 114.38 123.45 2gr6 h ARG 365 Ca 0.20 -0.04 -0.06 0.00 -1.10 0.00 0.00 59.98 58.98 2gr6 h ARG 365 Cb 0.06 -0.16 -0.03 0.00 -1.39 0.00 0.00 29.97 28.45 2gr6 h ARG 365 CO -0.11 0.47 0.26 0.93 2.80 0.00 0.00 179.97 184.31 2gr6 h GLU 366 N 0.73 1.17 -0.20 0.20 5.08 -0.63 -0.70 114.58 120.24 2gr6 h GLU 366 Ca 0.20 -0.24 -0.07 0.00 -1.00 0.00 0.00 59.36 58.26 2gr6 h GLU 366 Cb -0.07 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.00 2gr6 h GLU 366 CO -0.05 0.98 -0.13 0.82 -1.00 0.00 0.00 179.01 179.63 2gr6 h ILE 367 N 1.13 1.32 -0.46 3.13 2.04 -0.29 -1.81 117.51 122.57 2gr6 h ILE 367 Ca 0.25 -1.24 -0.05 0.00 1.00 0.00 0.00 64.86 64.82 2gr6 h ILE 367 Cb 0.28 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 2gr6 h ILE 367 CO -0.01 0.38 0.06 0.40 0.00 0.00 0.00 178.15 178.97 2gr6 h ILE 368 N 0.13 1.22 -0.31 -0.67 2.04 -0.39 -1.40 117.51 118.13 2gr6 h ILE 368 Ca 0.04 -0.84 -0.15 0.00 1.00 0.00 0.00 64.86 64.90 2gr6 h ILE 368 Cb 0.64 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 2gr6 h ILE 368 CO 0.04 0.30 -0.42 0.58 0.00 0.00 0.00 178.15 178.64 2gr6 h VAL 369 N 0.68 1.29 -0.07 1.67 2.07 -1.10 -2.63 116.25 118.16 2gr6 h VAL 369 Ca 0.15 -1.61 -0.00 0.00 0.82 0.00 0.00 66.70 66.06 2gr6 h VAL 369 Cb 0.34 1.50 -0.00 0.00 -1.52 0.00 0.00 31.29 31.60 2gr6 h VAL 369 CO 0.01 0.52 0.03 0.74 0.02 0.00 0.00 177.57 178.89 2gr6 h THR 370 N 0.63 1.10 -0.33 2.57 2.02 -0.84 -0.76 112.91 117.29 2gr6 h THR 370 Ca 0.05 -0.29 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 2gr6 h THR 370 Cb 0.99 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.55 2gr6 h THR 370 CO 0.09 0.09 0.21 -0.07 0.37 0.00 0.00 175.52 176.20 2gr6 h LEU 371 N -0.00 0.39 0.17 2.58 3.38 -1.26 -0.22 115.31 120.35 2gr6 h LEU 371 Ca 0.02 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2gr6 h LEU 371 Cb 0.11 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2gr6 h LEU 371 CO -0.00 0.32 -0.08 0.50 0.09 0.00 0.00 178.44 179.27 2gr6 h LYS 372 N 0.43 -0.22 -0.01 1.13 3.64 -1.43 -1.71 116.57 118.40 2gr6 h LYS 372 Ca 0.12 0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.44 2gr6 h LYS 372 Cb -0.01 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 2gr6 h LYS 372 CO -0.02 0.09 -0.36 0.93 -2.27 0.00 0.00 179.45 177.82 2gr6 h GLU 373 N -0.54 0.03 0.00 1.90 4.39 -1.15 -0.81 114.58 118.41 2gr6 h GLU 373 Ca -0.02 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 2gr6 h GLU 373 Cb 0.41 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 2gr6 h GLU 373 CO 0.04 0.39 -0.08 2.35 -1.16 0.00 0.00 179.01 180.55 2gr6 h TRP 374 N 0.03 0.07 0.00 4.33 2.91 -1.06 -3.17 115.95 119.06 2gr6 h TRP 374 Ca 0.00 -0.04 -0.03 0.00 1.13 0.00 0.00 58.89 59.95 2gr6 h TRP 374 Cb 0.65 -0.01 -0.00 0.00 -0.51 0.00 0.00 29.16 29.29 2gr6 h TRP 374 CO 0.00 0.86 -0.12 -0.07 -1.03 0.00 0.00 178.44 178.08 2gr6 h LEU 375 N -0.74 0.00 -0.89 0.65 3.38 -1.26 0.69 115.31 117.14 2gr6 h LEU 375 Ca -0.01 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 2gr6 h LEU 375 Cb 0.88 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 2gr6 h LEU 375 CO 0.01 0.12 -0.49 0.74 0.09 0.00 0.00 178.44 178.92 2gr6 h THR 376 N 0.00 1.34 0.00 0.22 2.02 -1.19 -3.16 112.91 112.14 2gr6 h THR 376 Ca -0.00 -1.69 -0.26 0.00 0.77 0.00 0.00 66.41 65.22 2gr6 h THR 376 Cb 0.31 1.84 -0.05 0.00 -1.74 0.00 0.00 68.15 68.51 2gr6 h THR 376 CO 0.02 0.50 -2.00 0.54 0.37 0.00 0.00 175.52 174.95 2gr6 n ARG 377 N -3.96 0.61 -3.77 6.66 1.74 -0.85 -4.63 116.66 112.45 2gr6 n ARG 377 Ca -0.02 0.09 -0.28 0.00 -0.77 0.00 0.00 57.85 56.87 2gr6 n ARG 377 Cb 0.52 -1.35 -0.11 0.00 -1.02 0.00 0.00 32.46 30.50 2gr6 n ARG 377 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2gr6 n ILE 378 N -2.95 1.32 0.02 0.55 5.41 0.24 -1.79 119.36 122.15 2gr6 n ILE 378 Ca -0.30 -4.71 -0.14 0.00 1.00 0.00 0.00 62.75 58.60 2gr6 n ILE 378 Cb 0.85 -2.11 -0.02 0.00 -0.71 0.00 0.00 39.64 37.65 2gr6 n ILE 378 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 2gr6 h PRO 379 N 5.26 0.60 -4.72 0.38 0.13 -1.70 -3.38 132.00 128.57 2gr6 h PRO 379 Ca 0.17 -0.49 -0.69 0.00 -0.87 0.00 0.00 66.00 64.11 2gr6 h PRO 379 Cb 0.76 0.11 -0.30 0.00 0.13 0.00 0.00 31.00 31.70 2gr6 h PRO 379 CO 0.68 1.12 -0.64 0.34 -0.23 0.00 0.00 178.00 179.27 2gr6 s ASP 380 N -7.05 5.16 0.12 1.44 3.68 -1.26 -4.90 116.67 113.85 2gr6 s ASP 380 Ca -0.08 -1.13 -0.11 0.00 2.13 0.00 0.00 52.55 53.36 2gr6 s ASP 380 Cb 0.09 -1.82 0.01 0.00 -1.45 0.00 0.00 42.92 39.75 2gr6 s ASP 380 CO 0.87 -0.29 0.29 0.72 0.13 0.00 0.00 175.17 176.89 2gr6 s PHE 381 N 1.37 0.09 0.17 -5.34 -0.12 -1.26 -4.50 117.98 108.39 2gr6 s PHE 381 Ca -0.02 -0.48 -0.15 0.00 -0.05 0.00 0.00 56.93 56.23 2gr6 s PHE 381 Cb -0.19 0.05 0.02 0.00 -0.63 0.00 0.00 43.02 42.27 2gr6 s PHE 381 CO 0.02 -0.65 0.43 -1.54 -0.05 0.00 0.00 175.22 173.43 2gr6 s SER 382 N -2.87 -0.18 0.35 1.98 1.04 -0.70 -4.66 113.70 108.67 2gr6 s SER 382 Ca 0.07 -0.52 -0.28 0.00 0.48 0.00 0.00 55.95 55.69 2gr6 s SER 382 Cb 0.03 0.51 -0.11 0.00 0.10 0.00 0.00 66.02 66.56 2gr6 s SER 382 CO -0.08 -0.96 1.38 -0.63 0.98 0.00 0.00 173.24 173.93 2gr6 s ILE 383 N -3.87 2.46 0.47 -1.02 1.01 -1.25 -1.61 121.20 117.38 2gr6 s ILE 383 Ca 0.09 0.46 -0.23 0.00 0.00 0.00 0.00 60.65 60.97 2gr6 s ILE 383 Cb 0.01 -3.29 -0.09 0.00 0.01 0.00 0.00 42.46 39.10 2gr6 s ILE 383 CO -0.05 0.11 1.02 0.00 0.00 0.00 0.00 174.94 176.02 2gr6 n ALA 384 N 0.69 0.29 -1.70 9.38 0.00 -0.44 -4.78 120.51 123.95 2gr6 n ALA 384 Ca 0.00 0.17 -0.43 0.00 0.00 0.00 0.00 53.44 53.19 2gr6 n ALA 384 Cb 0.41 -2.11 -0.03 0.00 0.00 0.00 0.00 19.45 17.72 2gr6 n ALA 384 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2gr6 n PRO 385 N -0.16 2.69 0.00 0.00 -0.02 -1.26 -2.54 135.00 133.72 2gr6 n PRO 385 Ca 0.10 0.97 0.00 0.00 -2.02 0.00 0.00 63.50 62.55 2gr6 n PRO 385 Cb 0.41 -2.82 0.00 0.00 -0.02 0.00 0.00 33.50 31.07 2gr6 n PRO 385 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gr6 n GLY 386 N 3.97 2.70 3.73 -1.23 0.00 -1.26 -5.01 105.19 108.11 2gr6 n GLY 386 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2gr6 n GLY 386 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gr6 n ALA 387 N -0.06 1.80 -3.96 4.61 0.00 -1.05 -5.00 120.51 116.85 2gr6 n ALA 387 Ca 0.00 0.35 -0.30 0.00 0.00 0.00 0.00 53.44 53.49 2gr6 n ALA 387 Cb 0.00 -2.33 -0.16 0.00 0.00 0.00 0.00 19.45 16.96 2gr6 n ALA 387 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2gr6 s GLN 388 N -1.98 1.75 0.13 0.00 2.00 -1.26 -4.94 119.66 115.36 2gr6 s GLN 388 Ca 0.54 -0.96 -0.31 0.00 -2.00 0.00 0.00 55.36 52.64 2gr6 s GLN 388 Cb -0.53 -2.54 -0.08 0.00 0.80 0.00 0.00 33.01 30.66 2gr6 s GLN 388 CO 0.63 -0.55 1.37 0.42 -0.50 0.00 0.00 175.29 176.67 2gr6 s ILE 389 N 1.39 3.30 -0.12 -2.34 -1.09 -1.26 -5.03 121.20 116.05 2gr6 s ILE 389 Ca -0.05 0.95 -0.01 0.00 -2.23 0.00 0.00 60.65 59.32 2gr6 s ILE 389 Cb -0.18 -3.61 -0.02 0.00 -1.58 0.00 0.00 42.46 37.06 2gr6 s ILE 389 CO -0.07 0.08 -0.08 -1.10 -1.23 0.00 0.00 174.94 172.54 2gr6 s GLN 390 N 0.92 3.33 0.26 2.79 -0.21 -1.26 -5.00 119.66 120.49 2gr6 s GLN 390 Ca 0.63 -0.60 0.06 0.00 0.02 0.00 0.00 55.36 55.48 2gr6 s GLN 390 Cb -0.37 -2.72 -0.03 0.00 1.00 0.00 0.00 33.01 30.89 2gr6 s GLN 390 CO 0.31 0.33 0.31 -1.01 -2.12 0.00 0.00 175.29 173.12 2gr6 s HIS 391 N 0.08 3.28 0.09 0.91 3.76 -1.26 -1.40 115.29 120.74 2gr6 s HIS 391 Ca -0.03 -0.08 0.09 0.00 -0.15 0.00 0.00 55.06 54.89 2gr6 s HIS 391 Cb -0.14 -1.57 -0.03 0.00 1.11 0.00 0.00 32.58 31.95 2gr6 s HIS 391 CO 0.04 0.41 -0.23 0.15 -0.85 0.00 0.00 174.74 174.26 2gr6 s LYS 392 N -3.95 1.31 0.06 1.40 -0.14 0.97 -4.87 119.74 114.51 2gr6 s LYS 392 Ca 0.35 -1.16 0.08 0.00 -1.36 0.00 0.00 55.97 53.88 2gr6 s LYS 392 Cb -0.08 -1.60 -0.03 0.00 -1.68 0.00 0.00 37.83 34.44 2gr6 s LYS 392 CO 0.28 0.39 -0.23 0.45 -0.76 0.00 0.00 175.35 175.47 2gr6 s SER 393 N -1.73 2.76 0.00 2.83 0.15 -1.26 -1.21 113.70 115.23 2gr6 s SER 393 Ca 0.09 -0.58 0.00 0.00 0.70 0.00 0.00 55.95 56.16 2gr6 s SER 393 Cb -0.10 -0.22 0.00 0.00 -1.71 0.00 0.00 66.02 63.99 2gr6 s SER 393 CO 0.04 0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.27 2gr6 n GLY 394 N 1.68 -0.68 0.25 9.45 0.00 -1.14 -4.37 105.19 110.38 2gr6 n GLY 394 Ca -0.17 -0.46 0.09 0.00 0.00 0.00 0.00 46.02 45.48 2gr6 n GLY 394 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2gr6 h ILE 395 N 0.00 0.86 -3.28 -0.61 1.08 -1.36 -3.37 117.51 110.83 2gr6 h ILE 395 Ca 0.00 -0.36 -0.39 0.00 -0.39 0.00 0.00 64.86 63.72 2gr6 h ILE 395 Cb 0.00 1.20 -0.39 0.00 -3.07 0.00 0.00 36.82 34.56 2gr6 h ILE 395 CO 0.00 0.09 -0.75 -0.69 -0.69 0.00 0.00 178.15 176.12 2gr6 s VAL 396 N -4.62 0.02 0.54 1.67 1.01 -1.25 -0.55 120.40 117.21 2gr6 s VAL 396 Ca -0.04 0.32 -0.05 0.00 0.00 0.00 0.00 61.98 62.20 2gr6 s VAL 396 Cb 0.15 -0.27 -0.01 0.00 0.00 0.00 0.00 36.38 36.25 2gr6 s VAL 396 CO 0.64 0.17 0.85 -0.44 0.00 0.00 0.00 175.10 176.32 2gr6 s SER 397 N 2.12 5.85 0.26 3.32 0.01 0.12 -4.62 113.70 120.76 2gr6 s SER 397 Ca 0.05 0.77 -0.07 0.00 1.31 0.00 0.00 55.95 58.00 2gr6 s SER 397 Cb -0.12 -1.89 0.03 0.00 0.21 0.00 0.00 66.02 64.24 2gr6 s SER 397 CO -0.04 -0.87 0.48 0.61 0.41 0.00 0.00 173.24 173.83 2gr6 n GLY 398 N -2.44 1.63 3.42 3.44 0.00 -0.35 -4.77 105.19 106.12 2gr6 n GLY 398 Ca 0.03 -1.28 -0.33 0.00 0.00 0.00 0.00 46.02 44.44 2gr6 n GLY 398 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gr6 s VAL 399 N -2.48 3.11 0.12 1.61 1.01 -1.26 -0.02 120.40 122.49 2gr6 s VAL 399 Ca 0.13 -0.66 -0.11 0.00 0.00 0.00 0.00 61.98 61.33 2gr6 s VAL 399 Cb -0.03 -2.28 -0.11 0.00 0.00 0.00 0.00 36.38 33.97 2gr6 s VAL 399 CO 0.10 0.55 1.38 -0.61 0.00 0.00 0.00 175.10 176.52 2gr6 h GLN 400 N 6.16 0.84 -1.60 2.72 4.15 -1.57 -3.47 115.11 122.34 2gr6 h GLN 400 Ca -0.34 -0.58 0.06 0.00 0.77 0.00 0.00 58.65 58.56 2gr6 h GLN 400 Cb 1.19 0.09 -0.25 0.00 0.21 0.00 0.00 27.48 28.72 2gr6 h GLN 400 CO 0.54 1.21 0.47 0.00 -1.93 0.00 0.00 178.83 179.12 2gr6 s ALA 401 N -4.01 -1.95 -0.40 3.38 0.00 -1.26 -4.99 121.76 112.53 2gr6 s ALA 401 Ca -0.10 1.75 0.01 0.00 0.00 0.00 0.00 51.96 53.62 2gr6 s ALA 401 Cb 0.10 -1.11 0.14 0.00 0.00 0.00 0.00 23.12 22.25 2gr6 s ALA 401 CO 0.89 -0.27 0.23 -1.17 0.00 0.00 0.00 175.76 175.45 2gr6 s LEU 402 N -0.32 1.87 -0.07 0.00 2.96 -1.26 -4.63 118.68 117.22 2gr6 s LEU 402 Ca 0.01 -2.46 -0.30 0.00 -0.22 0.00 0.00 54.13 51.16 2gr6 s LEU 402 Cb -0.03 -0.72 -0.03 0.00 0.50 0.00 0.00 46.19 45.92 2gr6 s LEU 402 CO -0.03 -0.28 1.12 -2.16 -1.32 0.00 0.00 176.35 173.69 2gr6 s PRO 403 N 0.65 4.38 0.19 0.98 0.04 -1.26 -1.69 135.00 138.30 2gr6 s PRO 403 Ca 0.19 1.57 0.11 0.00 0.04 0.00 0.00 61.00 62.90 2gr6 s PRO 403 Cb -0.22 -3.55 -0.04 0.00 0.04 0.00 0.00 34.50 30.73 2gr6 s PRO 403 CO -0.01 -0.39 -0.24 -0.51 0.04 0.00 0.00 177.00 175.90 2gr6 s LEU 404 N 2.10 2.43 0.05 -3.56 1.43 -0.18 -1.33 118.68 119.62 2gr6 s LEU 404 Ca 0.53 -0.87 -0.01 0.00 -1.03 0.00 0.00 54.13 52.75 2gr6 s LEU 404 Cb -0.22 -1.15 -0.04 0.00 0.03 0.00 0.00 46.19 44.81 2gr6 s LEU 404 CO 0.21 0.11 -0.03 0.68 0.23 0.00 0.00 176.35 177.55 2gr6 s VAL 405 N -1.69 0.22 0.03 -1.59 -7.23 -0.63 -1.77 120.40 107.73 2gr6 s VAL 405 Ca 0.20 -1.69 -0.28 0.00 -1.81 0.00 0.00 61.98 58.40 2gr6 s VAL 405 Cb -0.08 -1.36 0.09 0.00 0.56 0.00 0.00 36.38 35.60 2gr6 s VAL 405 CO 0.10 -0.93 0.97 -1.66 -0.31 0.00 0.00 175.10 173.26 2gr6 s TRP 406 N -3.59 -0.23 -0.39 2.82 -2.14 -0.72 -1.71 118.94 112.98 2gr6 s TRP 406 Ca 0.04 0.05 -0.20 0.00 2.66 0.00 0.00 56.10 58.66 2gr6 s TRP 406 Cb 0.06 0.57 0.01 0.00 -3.10 0.00 0.00 33.47 31.00 2gr6 s TRP 406 CO -0.09 -0.59 0.59 0.34 -2.66 0.00 0.00 176.95 174.55 2gr6 s ASP 407 N -2.64 6.35 0.39 -2.66 3.68 -1.26 -4.43 116.67 116.09 2gr6 s ASP 407 Ca 0.08 -0.11 0.18 0.00 2.13 0.00 0.00 52.55 54.84 2gr6 s ASP 407 Cb -0.01 -2.30 1.10 0.00 -1.45 0.00 0.00 42.92 40.26 2gr6 s ASP 407 CO -0.05 -0.62 1.75 -0.65 0.13 0.00 0.00 175.17 175.73 2gr6 h PRO 408 N 8.61 0.38 0.00 4.34 0.11 -1.86 0.31 132.00 143.89 2gr6 h PRO 408 Ca -0.26 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2gr6 h PRO 408 Cb 1.11 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2gr6 h PRO 408 CO 0.84 0.25 0.03 0.00 -0.21 0.00 0.00 178.00 178.90 2gr6 h ALA 409 N 1.64 1.02 -0.27 -0.75 0.00 -1.95 -0.47 119.26 118.47 2gr6 h ALA 409 Ca 0.62 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.53 2gr6 h ALA 409 Cb 1.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.36 2gr6 h ALA 409 CO -0.34 -0.02 0.00 0.25 0.00 0.00 0.00 179.25 179.14 2gr6 n THR 410 N -2.46 0.37 -2.93 0.00 -2.24 0.11 -4.97 114.28 102.16 2gr6 n THR 410 Ca -0.02 -0.68 -0.18 0.00 -2.27 0.00 0.00 64.05 60.90 2gr6 n THR 410 Cb 0.07 1.11 0.02 0.00 -2.10 0.00 0.00 70.33 69.43 2gr6 n THR 410 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2gr6 s THR 411 N -1.54 2.84 -0.13 4.28 -4.23 -0.19 -4.62 115.64 112.06 2gr6 s THR 411 Ca 0.33 -0.93 -0.06 0.00 -1.18 0.00 0.00 61.69 59.85 2gr6 s THR 411 Cb 0.20 -2.92 0.05 0.00 1.34 0.00 0.00 72.50 71.18 2gr6 s THR 411 CO 0.29 0.00 0.30 -1.59 -0.54 0.00 0.00 174.62 173.08 2gr6 s LYS 412 N -4.47 0.25 0.14 3.99 -2.85 -0.74 -5.04 119.74 111.02 2gr6 s LYS 412 Ca 0.56 0.65 -0.30 0.00 -1.00 0.00 0.00 55.97 55.89 2gr6 s LYS 412 Cb -0.10 -0.06 -0.07 0.00 -2.06 0.00 0.00 37.83 35.55 2gr6 s LYS 412 CO 0.35 -0.19 1.01 0.00 0.10 0.00 0.00 175.35 176.62 2gr6 s ALA 413 N 1.54 3.30 -2.50 0.59 0.00 -1.26 -4.39 121.76 119.04 2gr6 s ALA 413 Ca -0.07 0.66 0.28 0.00 0.00 0.00 0.00 51.96 52.83 2gr6 s ALA 413 Cb -0.10 -3.30 1.05 0.00 0.00 0.00 0.00 23.12 20.77 2gr6 s ALA 413 CO -0.10 -0.06 1.75 0.28 0.00 0.00 0.00 175.76 177.62