#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gj1 s LYS 1 N 0.00 0.91 -0.20 5.55 1.02 -1.26 -5.13 119.74 120.63 2gj1 s LYS 1 Ca 0.00 -0.04 -0.29 0.00 0.02 0.00 0.00 55.97 55.66 2gj1 s LYS 1 Cb 0.00 -1.23 0.00 0.00 -0.52 0.00 0.00 37.83 36.08 2gj1 s LYS 1 CO 0.00 -0.31 1.09 0.00 -0.92 0.00 0.00 175.35 175.21 2gj1 n ASP 2 N 6.25 0.14 0.00 0.00 9.92 -1.26 -4.88 116.55 126.72 2gj1 n ASP 2 Ca 0.12 0.53 0.00 0.00 -0.53 0.00 0.00 54.79 54.91 2gj1 n ASP 2 Cb 0.46 -0.56 0.00 0.00 -0.64 0.00 0.00 41.12 40.38 2gj1 n ASP 2 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 2gj1 n GLU 3 N -1.65 0.00 -0.29 -1.24 4.07 -1.26 -4.00 120.64 116.26 2gj1 n GLU 3 Ca 0.03 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.13 2gj1 n GLU 3 Cb 0.19 -3.02 0.00 0.00 -0.06 0.00 0.00 31.44 28.55 2gj1 n GLU 3 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2gj1 n ASN 4 N 0.02 0.00 -4.75 4.31 4.13 -1.26 -5.09 115.26 112.62 2gj1 n ASN 4 Ca 0.00 -1.50 -0.41 0.00 1.68 0.00 0.00 54.58 54.35 2gj1 n ASN 4 Cb 0.00 -0.10 -0.02 0.00 -1.54 0.00 0.00 39.78 38.12 2gj1 n ASN 4 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2gj1 s SER 5 N -0.50 6.69 0.00 6.41 0.15 -1.26 -4.90 113.70 120.30 2gj1 s SER 5 Ca 0.00 2.66 0.32 0.00 0.70 0.00 0.00 55.95 59.63 2gj1 s SER 5 Cb 0.00 -2.63 1.88 0.00 -1.71 0.00 0.00 66.02 63.56 2gj1 s SER 5 CO 0.00 -0.66 2.21 -2.65 1.20 0.00 0.00 173.24 173.34 2gj1 n PRO 6 N 2.02 0.96 -4.48 5.44 -0.02 -1.26 -4.86 135.00 132.81 2gj1 n PRO 6 Ca 0.05 -0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.23 2gj1 n PRO 6 Cb 0.41 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.26 2gj1 n PRO 6 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2gj1 s TYR 7 N -2.04 2.38 0.69 6.00 2.02 -1.26 -5.08 117.35 120.05 2gj1 s TYR 7 Ca 0.46 -0.35 -0.15 0.00 -0.37 0.00 0.00 57.07 56.67 2gj1 s TYR 7 Cb 0.22 -1.31 0.02 0.00 -0.40 0.00 0.00 41.96 40.48 2gj1 s TYR 7 CO 0.38 0.31 1.14 1.03 -1.57 0.00 0.00 175.55 176.84 2gj1 s ARG 8 N -1.89 2.53 0.88 -0.62 0.52 -1.26 -5.03 118.95 114.08 2gj1 s ARG 8 Ca 0.15 1.52 -0.13 0.00 -0.52 0.00 0.00 55.73 56.75 2gj1 s ARG 8 Cb -0.10 -1.90 0.12 0.00 0.52 0.00 0.00 34.95 33.59 2gj1 s ARG 8 CO 0.06 -1.49 1.18 0.95 0.02 0.00 0.00 175.30 176.03 2gj1 s THR 9 N -2.22 1.99 0.12 0.02 -4.23 -1.26 -4.99 115.64 105.07 2gj1 s THR 9 Ca 0.70 0.00 -0.07 0.00 -1.18 0.00 0.00 61.69 61.14 2gj1 s THR 9 Cb -0.24 -2.89 -0.18 0.00 1.34 0.00 0.00 72.50 70.54 2gj1 s THR 9 CO 0.43 0.00 1.30 0.40 -0.54 0.00 0.00 174.62 176.21 2gj1 h ILE 10 N -1.35 1.36 0.00 2.99 1.08 -1.92 -3.33 117.51 116.34 2gj1 h ILE 10 Ca -0.47 -2.30 0.00 0.00 -0.39 0.00 0.00 64.86 61.69 2gj1 h ILE 10 Cb 1.32 2.31 0.00 0.00 -3.07 0.00 0.00 36.82 37.38 2gj1 h ILE 10 CO 0.60 0.70 -0.26 0.35 -0.69 0.00 0.00 178.15 178.85 2gj1 n THR 11 N -3.80 0.35 -0.19 -0.27 -2.24 -1.26 -4.49 114.28 102.38 2gj1 n THR 11 Ca -0.07 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 2gj1 n THR 11 Cb 0.81 -0.33 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 2gj1 n THR 11 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gj1 n GLY 12 N 1.37 0.78 3.75 3.38 0.00 -1.25 -0.48 105.19 112.74 2gj1 n GLY 12 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 2gj1 n GLY 12 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gj1 s ASP 13 N -2.85 4.29 0.00 1.61 1.01 -1.26 -3.68 116.67 115.80 2gj1 s ASP 13 Ca 0.00 1.95 0.00 0.00 0.71 0.00 0.00 52.55 55.21 2gj1 s ASP 13 Cb 0.00 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.39 2gj1 s ASP 13 CO 0.00 -2.18 0.00 0.00 0.21 0.00 0.00 175.17 173.20 2gj1 h ASN 15 N 0.00 -0.06 -3.49 0.00 -0.73 -1.75 -3.40 115.58 106.15 2gj1 h ASN 15 Ca 0.00 -0.36 -0.60 0.00 1.87 0.00 0.00 56.30 57.21 2gj1 h ASN 15 Cb 0.07 0.01 -0.11 0.00 0.27 0.00 0.00 38.32 38.57 2gj1 h ASN 15 CO 0.00 0.34 -0.02 0.21 -0.37 0.00 0.00 177.43 177.59 2gj1 s ASN 16 N -5.52 6.53 0.10 1.15 3.84 -1.26 -4.61 114.94 115.18 2gj1 s ASN 16 Ca -0.15 0.64 -0.13 0.00 0.21 0.00 0.00 52.86 53.43 2gj1 s ASN 16 Cb 0.02 -2.29 -0.12 0.00 -0.55 0.00 0.00 41.25 38.31 2gj1 s ASN 16 CO 0.65 -0.22 1.35 0.03 -2.79 0.00 0.00 177.10 176.12 2gj1 h ARG 17 N 7.62 0.79 0.00 0.43 3.08 -1.95 -2.52 114.38 121.83 2gj1 h ARG 17 Ca -0.32 -0.55 -0.13 0.00 0.07 0.00 0.00 59.98 59.04 2gj1 h ARG 17 Cb 1.15 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 31.26 2gj1 h ARG 17 CO 0.74 1.17 -0.64 0.00 -1.07 0.00 0.00 179.97 180.17 2gj1 h ARG 18 N 0.54 0.00 -2.40 0.04 3.08 -1.95 -3.38 114.38 110.31 2gj1 h ARG 18 Ca -0.01 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.45 2gj1 h ARG 18 Cb 1.20 0.00 -0.38 0.00 0.08 0.00 0.00 29.97 30.87 2gj1 h ARG 18 CO 0.13 0.64 -0.96 0.45 -1.07 0.00 0.00 179.97 179.16 2gj1 s SER 19 N -6.76 1.61 0.59 7.04 0.15 -1.22 -5.03 113.70 110.08 2gj1 s SER 19 Ca -0.01 -3.03 0.29 0.00 0.70 0.00 0.00 55.95 53.90 2gj1 s SER 19 Cb 0.12 -0.47 1.61 0.00 -1.71 0.00 0.00 66.02 65.58 2gj1 s SER 19 CO 0.76 -0.18 2.04 1.55 1.20 0.00 0.00 173.24 178.61 2gj1 h PRO 20 N 5.72 0.00 -0.00 5.44 0.13 -1.64 -1.94 132.00 139.71 2gj1 h PRO 20 Ca 0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.38 2gj1 h PRO 20 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 2gj1 h PRO 20 CO 0.37 0.00 -0.14 0.00 -0.23 0.00 0.00 178.00 178.00 2gj1 n ALA 21 N -2.31 2.82 -1.64 -0.56 0.00 -1.26 -0.90 120.51 116.66 2gj1 n ALA 21 Ca 0.03 -0.29 -0.42 0.00 0.00 0.00 0.00 53.44 52.76 2gj1 n ALA 21 Cb 0.42 -1.30 -0.03 0.00 0.00 0.00 0.00 19.45 18.55 2gj1 n ALA 21 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2gj1 n LEU 22 N -0.92 3.84 0.00 0.00 7.94 -0.73 -1.61 117.00 125.52 2gj1 n LEU 22 Ca 0.14 0.63 0.00 0.00 -1.11 0.00 0.00 56.01 55.67 2gj1 n LEU 22 Cb 0.29 -1.54 0.00 0.00 0.53 0.00 0.00 43.42 42.70 2gj1 n LEU 22 CO 0.24 -0.13 0.00 0.61 -1.11 0.00 0.00 177.39 177.00 2gj1 n GLY 23 N 5.02 0.81 3.78 -3.96 0.00 -1.26 -4.63 105.19 104.95 2gj1 n GLY 23 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 2gj1 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gj1 s ALA 24 N -3.21 2.35 0.63 4.61 0.00 -0.63 -1.72 121.76 123.80 2gj1 s ALA 24 Ca 0.00 0.23 -0.12 0.00 0.00 0.00 0.00 51.96 52.07 2gj1 s ALA 24 Cb 0.00 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 19.84 2gj1 s ALA 24 CO 0.00 -1.64 1.04 0.00 0.00 0.00 0.00 175.76 175.16 2gj1 s ALA 25 N -2.93 2.89 -1.24 0.00 0.00 0.36 -4.02 121.76 116.82 2gj1 s ALA 25 Ca 0.60 0.07 -0.02 0.00 0.00 0.00 0.00 51.96 52.62 2gj1 s ALA 25 Cb -0.16 -3.14 0.00 0.00 0.00 0.00 0.00 23.12 19.82 2gj1 s ALA 25 CO 0.56 -0.85 0.20 0.09 0.00 0.00 0.00 175.76 175.75 2gj1 n ASN 26 N -2.66 -4.76 -4.58 0.00 3.02 0.64 -4.95 115.26 101.97 2gj1 n ASN 26 Ca 0.07 -0.10 -0.27 0.00 -0.03 0.00 0.00 54.58 54.25 2gj1 n ASN 26 Cb 0.54 -3.77 -0.11 0.00 -0.61 0.00 0.00 39.78 35.83 2gj1 n ASN 26 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2gj1 s ARG 27 N -5.04 1.89 0.42 3.52 1.81 -1.21 -4.91 118.95 115.44 2gj1 s ARG 27 Ca 0.10 -2.06 -0.25 0.00 -1.72 0.00 0.00 55.73 51.80 2gj1 s ARG 27 Cb -0.04 -1.54 -0.08 0.00 -0.45 0.00 0.00 34.95 32.84 2gj1 s ARG 27 CO 0.12 -0.04 1.25 0.00 -0.68 0.00 0.00 175.30 175.94 2gj1 s ALA 28 N -2.78 3.15 0.36 2.13 0.00 -1.26 -0.43 121.76 122.93 2gj1 s ALA 28 Ca 0.35 1.11 -0.28 0.00 0.00 0.00 0.00 51.96 53.14 2gj1 s ALA 28 Cb 0.09 -3.45 -0.11 0.00 0.00 0.00 0.00 23.12 19.66 2gj1 s ALA 28 CO 0.17 -0.75 1.43 -0.51 0.00 0.00 0.00 175.76 176.10 2gj1 s LEU 29 N -2.63 4.35 0.69 0.00 1.43 -0.45 -4.75 118.68 117.33 2gj1 s LEU 29 Ca 0.59 2.94 -0.15 0.00 -1.03 0.00 0.00 54.13 56.48 2gj1 s LEU 29 Cb -0.35 -3.67 0.02 0.00 0.03 0.00 0.00 46.19 42.22 2gj1 s LEU 29 CO 0.43 -0.77 1.14 0.00 0.23 0.00 0.00 176.35 177.38 2gj1 s ALA 30 N -1.13 2.34 -0.21 4.21 0.00 -0.73 -4.67 121.76 121.57 2gj1 s ALA 30 Ca 0.52 0.62 0.00 0.00 0.00 0.00 0.00 51.96 53.11 2gj1 s ALA 30 Cb -0.44 -3.36 0.03 0.00 0.00 0.00 0.00 23.12 19.34 2gj1 s ALA 30 CO 0.60 -1.49 -0.14 1.03 0.00 0.00 0.00 175.76 175.76 2gj1 s ARG 31 N -4.09 2.85 0.29 0.00 1.81 -1.26 -0.53 118.95 118.02 2gj1 s ARG 31 Ca 0.69 -0.94 0.19 0.00 -1.72 0.00 0.00 55.73 53.94 2gj1 s ARG 31 Cb -0.23 -2.75 0.12 0.00 -0.45 0.00 0.00 34.95 31.64 2gj1 s ARG 31 CO 0.43 -0.32 1.35 -1.49 -0.68 0.00 0.00 175.30 174.60 2gj1 h TRP 32 N 7.94 0.00 -3.95 -0.53 6.55 -1.98 -3.45 115.95 120.53 2gj1 h TRP 32 Ca -0.38 0.00 -0.25 0.00 0.95 0.00 0.00 58.89 59.21 2gj1 h TRP 32 Cb 1.12 0.00 -0.20 0.00 -0.86 0.00 0.00 29.16 29.22 2gj1 h TRP 32 CO 0.53 0.26 -0.72 -0.51 -1.05 0.00 0.00 178.44 176.95 2gj1 s LEU 33 N -6.11 2.31 0.58 -4.49 1.43 -1.26 -5.14 118.68 106.00 2gj1 s LEU 33 Ca 0.03 -0.64 -0.20 0.00 -1.03 0.00 0.00 54.13 52.30 2gj1 s LEU 33 Cb 0.07 -0.12 -0.04 0.00 0.03 0.00 0.00 46.19 46.13 2gj1 s LEU 33 CO 0.74 -0.27 1.13 -2.65 0.23 0.00 0.00 176.35 175.52 2gj1 n PRO 34 N 1.16 1.16 -2.04 1.29 -0.02 -1.26 -4.95 135.00 130.35 2gj1 n PRO 34 Ca -0.21 0.44 -0.35 0.00 -2.02 0.00 0.00 63.50 61.36 2gj1 n PRO 34 Cb 0.56 -2.33 0.03 0.00 -0.02 0.00 0.00 33.50 31.74 2gj1 n PRO 34 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gj1 s ALA 35 N -1.42 2.56 -0.31 3.55 0.00 -1.26 -4.70 121.76 120.19 2gj1 s ALA 35 Ca 0.75 0.91 0.03 0.00 0.00 0.00 0.00 51.96 53.64 2gj1 s ALA 35 Cb -0.42 -3.41 0.09 0.00 0.00 0.00 0.00 23.12 19.37 2gj1 s ALA 35 CO 0.47 -1.09 0.02 -1.21 0.00 0.00 0.00 175.76 173.95 2gj1 s GLU 36 N -3.41 1.48 0.20 0.00 2.02 -0.06 -4.99 118.70 113.94 2gj1 s GLU 36 Ca 0.75 -1.52 0.11 0.00 0.02 0.00 0.00 54.97 54.32 2gj1 s GLU 36 Cb -0.27 -2.85 -0.04 0.00 0.10 0.00 0.00 34.13 31.06 2gj1 s GLU 36 CO 0.32 -0.84 -0.19 0.71 0.02 0.00 0.00 175.26 175.28 2gj1 s TYR 37 N 1.13 2.40 0.39 1.61 2.02 -1.26 -4.26 117.35 119.38 2gj1 s TYR 37 Ca 0.05 -0.31 0.10 0.00 -0.37 0.00 0.00 57.07 56.54 2gj1 s TYR 37 Cb -0.19 -1.16 0.88 0.00 -0.40 0.00 0.00 41.96 41.09 2gj1 s TYR 37 CO -0.10 0.53 1.93 1.49 -1.57 0.00 0.00 175.55 177.83 2gj1 h GLU 38 N 2.98 0.58 -0.25 -0.62 4.81 0.80 -1.73 114.58 121.15 2gj1 h GLU 38 Ca -0.46 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2gj1 h GLU 38 Cb 1.21 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.46 2gj1 h GLU 38 CO 0.51 0.38 0.00 -0.40 -0.73 0.00 0.00 179.01 178.78 2gj1 n ASP 39 N -4.50 3.49 0.00 1.04 5.75 -1.25 -4.95 116.55 116.13 2gj1 n ASP 39 Ca 0.13 -2.78 0.00 0.00 -0.01 0.00 0.00 54.79 52.13 2gj1 n ASP 39 Cb 0.38 -0.45 0.00 0.00 -1.03 0.00 0.00 41.12 40.01 2gj1 n ASP 39 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2gj1 n GLY 40 N -0.38 2.16 0.59 6.12 0.00 -0.65 -4.72 105.19 108.32 2gj1 n GLY 40 Ca 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.19 2gj1 n GLY 40 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gj1 n LEU 41 N 0.00 1.21 0.00 0.99 4.77 -1.26 -4.71 117.00 117.99 2gj1 n LEU 41 Ca 0.00 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2gj1 n LEU 41 Cb 0.00 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2gj1 n LEU 41 CO 0.00 0.21 0.00 0.00 -1.33 0.00 0.00 177.39 176.27 2gj1 n ALA 42 N -2.85 0.04 -2.64 -1.18 0.00 -1.26 -0.13 120.51 112.49 2gj1 n ALA 42 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.02 2gj1 n ALA 42 Cb 0.52 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.92 2gj1 n ALA 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2gj1 s LEU 43 N -0.18 4.36 0.51 0.00 1.02 -1.26 -4.95 118.68 118.17 2gj1 s LEU 43 Ca 0.00 1.38 -0.19 0.00 0.02 0.00 0.00 54.13 55.34 2gj1 s LEU 43 Cb 0.00 -3.25 -0.08 0.00 0.02 0.00 0.00 46.19 42.88 2gj1 s LEU 43 CO 0.00 -0.13 1.03 -2.16 0.02 0.00 0.00 176.35 175.11 2gj1 s PRO 44 N 0.67 3.76 0.28 1.29 0.04 -1.26 0.13 135.00 139.90 2gj1 s PRO 44 Ca 0.42 1.25 -0.30 0.00 0.04 0.00 0.00 61.00 62.41 2gj1 s PRO 44 Cb -0.19 -2.10 -0.11 0.00 0.04 0.00 0.00 34.50 32.15 2gj1 s PRO 44 CO 0.22 -0.45 1.52 -0.06 0.04 0.00 0.00 177.00 178.26 2gj1 s PHE 45 N -2.19 2.86 0.00 0.56 0.40 -1.26 -1.71 117.98 116.64 2gj1 s PHE 45 Ca 0.65 0.92 0.00 0.00 -0.60 0.00 0.00 56.93 57.90 2gj1 s PHE 45 Cb -0.15 -3.95 0.00 0.00 0.51 0.00 0.00 43.02 39.43 2gj1 s PHE 45 CO 0.24 -3.13 0.00 0.41 0.70 0.00 0.00 175.22 173.44 2gj1 n GLY 46 N 2.06 0.26 0.14 4.36 0.00 -1.26 -4.90 105.19 105.84 2gj1 n GLY 46 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 2gj1 n GLY 46 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2gj1 h TRP 47 N 0.00 -0.22 -3.36 1.61 2.91 -1.70 -3.41 115.95 111.78 2gj1 h TRP 47 Ca 0.00 -0.01 -0.69 0.00 1.13 0.00 0.00 58.89 59.32 2gj1 h TRP 47 Cb 0.00 0.07 -0.19 0.00 -0.51 0.00 0.00 29.16 28.54 2gj1 h TRP 47 CO 0.00 0.21 -0.07 0.99 -1.03 0.00 0.00 178.44 178.54 2gj1 s THR 48 N -3.59 4.98 -0.72 2.65 2.01 -1.26 -4.98 115.64 114.73 2gj1 s THR 48 Ca -0.13 -0.50 -0.26 0.00 0.31 0.00 0.00 61.69 61.11 2gj1 s THR 48 Cb 0.01 -4.20 -0.00 0.00 0.01 0.00 0.00 72.50 68.31 2gj1 s THR 48 CO 0.49 -0.66 1.67 -1.10 -0.69 0.00 0.00 174.62 174.33 2gj1 s GLN 49 N 2.37 2.85 0.00 4.92 1.11 -1.26 -1.74 119.66 127.90 2gj1 s GLN 49 Ca 0.13 0.12 0.00 0.00 0.01 0.00 0.00 55.36 55.62 2gj1 s GLN 49 Cb -0.19 -4.49 0.00 0.00 -1.01 0.00 0.00 33.01 27.32 2gj1 s GLN 49 CO 0.12 -2.61 0.00 2.89 0.01 0.00 0.00 175.29 175.70 2gj1 n ARG 50 N 9.18 0.00 -3.31 2.91 -4.01 -1.26 -5.11 116.66 115.06 2gj1 n ARG 50 Ca 0.19 0.00 -0.38 0.00 -1.04 0.00 0.00 57.85 56.62 2gj1 n ARG 50 Cb 0.50 0.00 -0.06 0.00 -3.04 0.00 0.00 32.46 29.86 2gj1 n ARG 50 CO 0.00 0.00 0.00 0.15 -3.04 0.00 0.00 177.63 174.74 2gj1 s LYS 51 N 0.00 4.28 0.48 2.89 1.02 -0.71 -5.08 119.74 122.62 2gj1 s LYS 51 Ca 0.00 0.40 0.08 0.00 0.02 0.00 0.00 55.97 56.47 2gj1 s LYS 51 Cb 0.00 -3.48 0.04 0.00 -0.52 0.00 0.00 37.83 33.86 2gj1 s LYS 51 CO 0.00 0.05 0.66 0.95 -0.92 0.00 0.00 175.35 176.09 2gj1 s THR 52 N 0.99 2.69 -0.28 2.17 -4.23 -1.26 -4.76 115.64 110.97 2gj1 s THR 52 Ca 0.24 -0.98 -0.03 0.00 -1.18 0.00 0.00 61.69 59.74 2gj1 s THR 52 Cb -0.15 -2.71 0.03 0.00 1.34 0.00 0.00 72.50 71.01 2gj1 s THR 52 CO 0.10 0.00 -0.00 -0.60 -0.54 0.00 0.00 174.62 173.57 2gj1 s ARG 53 N -4.48 2.76 -1.66 3.99 3.52 0.14 -4.61 118.95 118.61 2gj1 s ARG 53 Ca 0.58 -1.04 0.00 0.00 -0.13 0.00 0.00 55.73 55.13 2gj1 s ARG 53 Cb -0.09 -3.15 0.00 0.00 -1.56 0.00 0.00 34.95 30.15 2gj1 s ARG 53 CO 0.35 -0.49 0.00 0.09 -0.81 0.00 0.00 175.30 174.45 2gj1 n ASN 54 N 4.71 -5.49 0.00 -2.12 3.02 -1.26 -2.10 115.26 112.02 2gj1 n ASN 54 Ca -0.15 0.05 0.00 0.00 -0.03 0.00 0.00 54.58 54.45 2gj1 n ASN 54 Cb 0.46 -4.60 0.00 0.00 -0.61 0.00 0.00 39.78 35.03 2gj1 n ASN 54 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2gj1 n GLY 55 N -0.94 0.16 3.23 7.41 0.00 -1.26 -5.06 105.19 108.72 2gj1 n GLY 55 Ca -0.23 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.58 2gj1 n GLY 55 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gj1 s PHE 56 N -2.05 1.54 0.37 1.61 0.40 -0.89 -4.96 117.98 114.00 2gj1 s PHE 56 Ca 0.00 -0.42 -0.27 0.00 -0.60 0.00 0.00 56.93 55.64 2gj1 s PHE 56 Cb 0.00 -0.87 -0.09 0.00 0.51 0.00 0.00 43.02 42.57 2gj1 s PHE 56 CO 0.00 0.12 1.28 1.03 0.70 0.00 0.00 175.22 178.35 2gj1 s ARG 57 N -1.66 4.15 0.18 0.44 0.52 -1.26 0.23 118.95 121.55 2gj1 s ARG 57 Ca 0.03 2.13 -0.28 0.00 -0.52 0.00 0.00 55.73 57.09 2gj1 s ARG 57 Cb -0.10 -2.88 -0.08 0.00 0.52 0.00 0.00 34.95 32.41 2gj1 s ARG 57 CO 0.03 -0.33 0.89 0.14 0.02 0.00 0.00 175.30 176.05 2gj1 s VAL 58 N -1.23 4.28 0.54 3.52 -7.23 -1.26 -4.87 120.40 114.14 2gj1 s VAL 58 Ca 0.53 1.95 -0.19 0.00 -1.81 0.00 0.00 61.98 62.46 2gj1 s VAL 58 Cb -0.38 -4.26 -0.06 0.00 0.56 0.00 0.00 36.38 32.24 2gj1 s VAL 58 CO 0.49 0.46 1.11 -2.16 -0.31 0.00 0.00 175.10 174.69 2gj1 s PRO 59 N -0.86 3.43 0.31 4.82 0.04 -1.26 -4.97 135.00 136.52 2gj1 s PRO 59 Ca 0.41 1.54 -0.29 0.00 0.04 0.00 0.00 61.00 62.70 2gj1 s PRO 59 Cb -0.24 -2.02 -0.12 0.00 0.04 0.00 0.00 34.50 32.15 2gj1 s PRO 59 CO 0.29 -0.77 1.43 1.28 0.04 0.00 0.00 177.00 179.28 2gj1 n LEU 60 N -1.28 3.90 -0.18 -3.56 4.77 -1.26 -4.90 117.00 114.49 2gj1 n LEU 60 Ca 0.11 1.18 -0.02 0.00 -0.03 0.00 0.00 56.01 57.25 2gj1 n LEU 60 Cb 0.51 -1.53 0.08 0.00 -2.33 0.00 0.00 43.42 40.16 2gj1 n LEU 60 CO 0.42 -0.20 0.98 0.00 -1.33 0.00 0.00 177.39 177.26 2gj1 h ALA 61 N 3.56 0.69 0.00 -1.18 0.00 -1.89 -1.84 119.26 118.60 2gj1 h ALA 61 Ca -0.47 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 2gj1 h ALA 61 Cb 1.26 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 2gj1 h ALA 61 CO 0.70 -0.20 -0.44 -0.09 0.00 0.00 0.00 179.25 179.22 2gj1 h ARG 62 N 0.39 0.00 -0.24 0.00 9.65 -1.86 -2.02 114.38 120.29 2gj1 h ARG 62 Ca 0.27 0.00 -0.19 0.00 -1.10 0.00 0.00 59.98 58.96 2gj1 h ARG 62 Cb 0.30 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.88 2gj1 h ARG 62 CO -0.27 0.44 -0.60 1.49 2.80 0.00 0.00 179.97 183.83 2gj1 h GLU 63 N 0.00 0.81 -0.84 0.20 4.81 -1.67 -0.77 114.58 117.13 2gj1 h GLU 63 Ca -0.00 -0.55 -0.03 0.00 -0.13 0.00 0.00 59.36 58.64 2gj1 h GLU 63 Cb 0.83 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 30.25 2gj1 h GLU 63 CO 0.06 1.17 0.39 0.28 -0.73 0.00 0.00 179.01 180.19 2gj1 h VAL 64 N 0.61 1.26 0.11 0.32 2.07 -1.27 -1.95 116.25 117.40 2gj1 h VAL 64 Ca -0.00 -0.74 0.01 0.00 0.82 0.00 0.00 66.70 66.79 2gj1 h VAL 64 Cb 1.21 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 2gj1 h VAL 64 CO 0.13 0.32 -0.16 -1.28 0.02 0.00 0.00 177.57 176.60 2gj1 h SER 65 N 1.19 -0.43 -0.87 0.57 0.87 -1.05 -1.09 113.55 112.75 2gj1 h SER 65 Ca 0.29 0.05 0.03 0.00 -1.23 0.00 0.00 61.79 60.93 2gj1 h SER 65 Cb 0.13 0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 62.20 2gj1 h SER 65 CO -0.03 -0.23 0.57 0.78 -0.53 0.00 0.00 176.83 177.38 2gj1 h ASN 66 N -0.32 0.94 0.63 6.23 2.35 -0.90 -1.80 115.58 122.71 2gj1 h ASN 66 Ca 0.02 -0.01 -0.24 0.00 -0.55 0.00 0.00 56.30 55.52 2gj1 h ASN 66 Cb 0.32 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.44 2gj1 h ASN 66 CO -0.07 0.65 -1.52 0.11 -1.65 0.00 0.00 177.43 174.94 2gj1 h LYS 67 N 1.10 0.00 0.00 0.81 1.57 -1.26 -3.39 116.57 115.40 2gj1 h LYS 67 Ca 0.35 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.92 2gj1 h LYS 67 Cb -0.00 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.27 2gj1 h LYS 67 CO -0.11 0.46 -1.73 -0.89 -0.57 0.00 0.00 179.45 176.61 2gj1 n ILE 68 N -3.02 0.72 0.16 1.86 2.08 -0.42 -4.80 119.36 115.94 2gj1 n ILE 68 Ca -0.13 -0.21 0.10 0.00 0.56 0.00 0.00 62.75 63.07 2gj1 n ILE 68 Cb 0.97 -1.44 0.08 0.00 -0.75 0.00 0.00 39.64 38.50 2gj1 n ILE 68 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 2gj1 h VAL 69 N -0.32 0.12 -3.68 1.39 2.07 -1.34 -3.44 116.25 111.04 2gj1 h VAL 69 Ca -0.32 -1.18 -0.49 0.00 0.82 0.00 0.00 66.70 65.52 2gj1 h VAL 69 Cb 1.34 1.86 0.04 0.00 -1.52 0.00 0.00 31.29 33.01 2gj1 h VAL 69 CO -0.15 0.07 0.15 -0.83 0.02 0.00 0.00 177.57 176.83 2gj1 s GLY 70 N -4.33 1.56 0.02 2.17 0.00 -0.91 -2.59 107.32 103.23 2gj1 s GLY 70 Ca 0.03 -0.43 -0.28 0.00 0.00 0.00 0.00 44.72 44.05 2gj1 s GLY 70 CO 0.73 -0.25 0.82 -2.52 0.00 0.00 0.00 173.10 171.88 2gj1 s TYR 71 N -2.77 -0.41 -0.18 1.90 -0.85 -1.26 -4.74 117.35 109.04 2gj1 s TYR 71 Ca 0.49 0.34 -0.01 0.00 -0.52 0.00 0.00 57.07 57.36 2gj1 s TYR 71 Cb -0.10 0.53 -0.11 0.00 0.38 0.00 0.00 41.96 42.66 2gj1 s TYR 71 CO 0.45 -0.60 -0.18 1.28 -1.52 0.00 0.00 175.55 174.98 2gj1 n LEU 72 N -0.11 2.57 -4.60 -3.49 4.77 -1.26 -4.67 117.00 110.21 2gj1 n LEU 72 Ca -0.11 -0.01 -0.43 0.00 -0.03 0.00 0.00 56.01 55.42 2gj1 n LEU 72 Cb 0.62 -0.59 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 2gj1 n LEU 72 CO 0.12 0.69 1.05 -0.62 -1.33 0.00 0.00 177.39 177.30 2gj1 s ASP 73 N -5.93 6.59 0.05 -1.43 -1.08 -1.26 -4.88 116.67 108.73 2gj1 s ASP 73 Ca -0.24 0.42 0.27 0.00 -0.52 0.00 0.00 52.55 52.48 2gj1 s ASP 73 Cb 0.07 -2.55 0.86 0.00 -1.46 0.00 0.00 42.92 39.84 2gj1 s ASP 73 CO 0.38 -1.30 1.69 1.21 0.52 0.00 0.00 175.17 177.67 2gj1 n GLU 74 N 7.96 0.07 -2.06 4.34 4.07 -1.26 -4.85 120.64 128.91 2gj1 n GLU 74 Ca 0.12 0.04 -0.41 0.00 -0.06 0.00 0.00 57.16 56.85 2gj1 n GLU 74 Cb 0.49 -1.57 -0.02 0.00 -0.06 0.00 0.00 31.44 30.28 2gj1 n GLU 74 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 2gj1 s GLU 75 N -3.04 4.30 0.00 5.31 2.12 -1.26 -3.34 118.70 122.79 2gj1 s GLU 75 Ca 0.12 2.25 0.00 0.00 0.36 0.00 0.00 54.97 57.70 2gj1 s GLU 75 Cb 0.17 -3.12 0.00 0.00 0.26 0.00 0.00 34.13 31.44 2gj1 s GLU 75 CO 0.61 -0.37 0.00 0.41 -0.54 0.00 0.00 175.26 175.37 2gj1 n GLY 76 N 2.13 0.59 0.06 -1.50 0.00 -1.26 -4.92 105.19 100.29 2gj1 n GLY 76 Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.21 2gj1 n GLY 76 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2gj1 n VAL 77 N -2.67 0.00 -2.51 1.61 3.14 -1.21 -4.95 118.33 111.73 2gj1 n VAL 77 Ca 0.00 -0.03 -0.36 0.00 -2.96 0.00 0.00 64.34 60.98 2gj1 n VAL 77 Cb 0.03 0.17 -0.04 0.00 -1.06 0.00 0.00 33.84 32.94 2gj1 n VAL 77 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 2gj1 s LEU 78 N -2.85 4.12 -0.34 6.55 1.43 -1.26 -1.16 118.68 125.17 2gj1 s LEU 78 Ca 0.16 2.06 -0.29 0.00 -1.03 0.00 0.00 54.13 55.03 2gj1 s LEU 78 Cb 0.18 -4.20 0.02 0.00 0.03 0.00 0.00 46.19 42.22 2gj1 s LEU 78 CO 0.62 -0.54 1.09 -0.62 0.23 0.00 0.00 176.35 177.13 2gj1 s ASP 79 N -1.55 6.89 0.00 2.29 -1.08 0.97 -4.54 116.67 119.66 2gj1 s ASP 79 Ca 0.59 0.98 0.21 0.00 -0.52 0.00 0.00 52.55 53.80 2gj1 s ASP 79 Cb -0.23 -2.54 0.88 0.00 -1.46 0.00 0.00 42.92 39.57 2gj1 s ASP 79 CO 0.28 -0.93 1.66 0.00 0.52 0.00 0.00 175.17 176.70 2gj1 n GLN 80 N 6.99 0.00 -1.37 4.34 1.13 -1.26 -3.48 117.38 123.73 2gj1 n GLN 80 Ca 0.12 0.15 0.03 0.00 -1.94 0.00 0.00 57.00 55.36 2gj1 n GLN 80 Cb 0.47 -1.51 0.08 0.00 0.11 0.00 0.00 30.24 29.40 2gj1 n GLN 80 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2gj1 n ASN 81 N -1.51 1.46 -3.72 1.08 5.15 -1.26 -4.58 115.26 111.87 2gj1 n ASN 81 Ca 0.05 -2.66 -0.14 0.00 -0.60 0.00 0.00 54.58 51.22 2gj1 n ASN 81 Cb 0.24 -0.39 -0.14 0.00 -0.53 0.00 0.00 39.78 38.96 2gj1 n ASN 81 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2gj1 s ARG 82 N -1.49 0.10 0.91 1.20 1.81 -1.23 -3.56 118.95 116.69 2gj1 s ARG 82 Ca 0.35 0.48 -0.12 0.00 -1.72 0.00 0.00 55.73 54.73 2gj1 s ARG 82 Cb 0.38 -0.18 0.13 0.00 -0.45 0.00 0.00 34.95 34.84 2gj1 s ARG 82 CO -0.12 -0.21 1.11 -1.54 -0.68 0.00 0.00 175.30 173.87 2gj1 s SER 83 N 1.57 3.50 0.44 0.23 1.04 -0.40 -2.09 113.70 117.99 2gj1 s SER 83 Ca -0.05 1.14 0.10 0.00 0.48 0.00 0.00 55.95 57.61 2gj1 s SER 83 Cb -0.11 -1.78 0.98 0.00 0.10 0.00 0.00 66.02 65.20 2gj1 s SER 83 CO -0.07 -2.57 2.07 0.25 0.98 0.00 0.00 173.24 173.90 2gj1 h LEU 84 N -1.51 0.35 -2.04 2.42 6.46 -0.82 -1.75 115.31 118.41 2gj1 h LEU 84 Ca -0.51 -0.01 0.07 0.00 -0.12 0.00 0.00 57.88 57.32 2gj1 h LEU 84 Cb 1.31 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 41.15 2gj1 h LEU 84 CO 0.60 0.25 0.19 0.25 -0.62 0.00 0.00 178.44 179.10 2gj1 h LEU 85 N 0.41 0.00 -0.42 2.25 5.85 -1.74 -1.86 115.31 119.80 2gj1 h LEU 85 Ca 0.13 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 2gj1 h LEU 85 Cb 0.03 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 2gj1 h LEU 85 CO -0.03 0.00 0.22 0.15 -0.34 0.00 0.00 178.44 178.44 2gj1 h PHE 86 N 0.00 0.59 -0.27 1.25 3.57 -1.57 0.17 116.94 120.68 2gj1 h PHE 86 Ca 0.12 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 2gj1 h PHE 86 Cb 0.49 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 2gj1 h PHE 86 CO 0.00 0.47 0.13 1.98 -2.23 0.00 0.00 178.31 178.66 2gj1 h MET 87 N 0.54 0.38 -0.40 1.11 4.05 -1.50 -3.20 114.93 115.92 2gj1 h MET 87 Ca 0.15 -0.05 -0.08 0.00 -0.28 0.00 0.00 59.70 59.44 2gj1 h MET 87 Cb 0.09 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 30.80 2gj1 h MET 87 CO -0.02 0.37 -0.07 0.37 0.23 0.00 0.00 176.91 177.79 2gj1 h GLN 88 N 0.30 0.67 -0.32 0.39 5.75 -0.76 -2.51 115.11 118.63 2gj1 h GLN 88 Ca 0.09 -0.19 -0.08 0.00 -0.15 0.00 0.00 58.65 58.32 2gj1 h GLN 88 Cb 0.11 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.57 2gj1 h GLN 88 CO -0.01 0.74 -0.15 2.35 -2.65 0.00 0.00 178.83 179.10 2gj1 h TRP 89 N 0.62 0.62 -0.86 3.99 2.91 -0.74 -2.81 115.95 119.68 2gj1 h TRP 89 Ca 0.12 -0.11 -0.01 0.00 1.13 0.00 0.00 58.89 60.02 2gj1 h TRP 89 Cb 0.49 -0.16 -0.04 0.00 -0.51 0.00 0.00 29.16 28.94 2gj1 h TRP 89 CO 0.02 0.69 0.49 0.78 -1.03 0.00 0.00 178.44 179.39 2gj1 h GLY 90 N 0.96 1.27 1.75 2.65 0.00 -1.44 -0.84 103.07 107.42 2gj1 h GLY 90 Ca 0.09 -0.56 -0.08 0.00 0.00 0.00 0.00 47.33 46.79 2gj1 h GLY 90 CO 0.04 0.54 -0.24 -1.61 0.00 0.00 0.00 176.54 175.27 2gj1 h GLN 91 N 1.19 0.30 -0.09 4.80 4.15 -1.39 -1.31 115.11 122.75 2gj1 h GLN 91 Ca 0.30 -0.10 -0.02 0.00 0.77 0.00 0.00 58.65 59.60 2gj1 h GLN 91 Cb -0.00 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 27.66 2gj1 h GLN 91 CO -0.05 0.52 -0.04 0.82 -1.93 0.00 0.00 178.83 178.15 2gj1 h ILE 92 N 0.27 1.32 -0.22 2.39 2.04 -1.14 -1.56 117.51 120.61 2gj1 h ILE 92 Ca 0.04 -1.03 -0.01 0.00 1.00 0.00 0.00 64.86 64.87 2gj1 h ILE 92 Cb 0.57 1.83 -0.01 0.00 -0.74 0.00 0.00 36.82 38.46 2gj1 h ILE 92 CO 0.04 0.29 0.12 0.58 0.00 0.00 0.00 178.15 179.17 2gj1 h VAL 93 N -0.18 1.12 -0.81 1.67 2.07 -1.07 -1.85 116.25 117.20 2gj1 h VAL 93 Ca 0.02 -0.34 0.12 0.00 0.82 0.00 0.00 66.70 67.32 2gj1 h VAL 93 Cb 0.47 0.94 -0.08 0.00 -1.52 0.00 0.00 31.29 31.11 2gj1 h VAL 93 CO 0.01 0.12 0.43 -0.78 0.02 0.00 0.00 177.57 177.38 2gj1 h ASP 94 N 0.24 0.57 1.04 0.57 1.82 -1.25 -1.80 116.42 117.61 2gj1 h ASP 94 Ca 0.08 0.07 -0.07 0.00 -0.39 0.00 0.00 57.03 56.72 2gj1 h ASP 94 Cb 0.09 -0.03 -0.01 0.00 0.68 0.00 0.00 39.33 40.06 2gj1 h ASP 94 CO -0.01 0.29 -0.34 0.45 -1.61 0.00 0.00 179.24 178.02 2gj1 h HIS 95 N 0.68 0.00 -0.00 0.28 3.86 -0.86 -1.67 115.15 117.43 2gj1 h HIS 95 Ca 0.42 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.52 2gj1 h HIS 95 Cb 0.49 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.95 2gj1 h HIS 95 CO -0.08 0.34 -0.49 0.22 0.86 0.00 0.00 177.93 178.78 2gj1 h ASP 96 N 0.00 0.01 0.09 2.45 1.82 -0.52 -3.38 116.42 116.90 2gj1 h ASP 96 Ca -0.00 -0.01 -0.37 0.00 -0.39 0.00 0.00 57.03 56.26 2gj1 h ASP 96 Cb 0.95 -0.00 -0.05 0.00 0.68 0.00 0.00 39.33 40.90 2gj1 h ASP 96 CO 0.04 0.50 -2.25 0.18 -1.61 0.00 0.00 179.24 176.11 2gj1 n LEU 97 N -3.96 2.04 -3.74 2.28 4.77 -0.93 -4.42 117.00 113.05 2gj1 n LEU 97 Ca -0.02 0.04 -0.13 0.00 -0.03 0.00 0.00 56.01 55.88 2gj1 n LEU 97 Cb 0.51 -0.55 -0.10 0.00 -2.33 0.00 0.00 43.42 40.95 2gj1 n LEU 97 CO 0.40 0.76 0.05 1.51 -1.33 0.00 0.00 177.39 178.79 2gj1 s ASP 98 N -6.39 -0.41 -0.21 -1.43 -4.77 -0.68 -4.36 116.67 98.42 2gj1 s ASP 98 Ca -0.23 0.78 -0.04 0.00 -3.30 0.00 0.00 52.55 49.76 2gj1 s ASP 98 Cb 0.08 0.78 0.11 0.00 -1.09 0.00 0.00 42.92 42.79 2gj1 s ASP 98 CO 0.72 -0.14 0.34 0.12 0.70 0.00 0.00 175.17 176.91 2gj1 s PHE 99 N 0.31 -0.66 -0.65 2.11 5.36 -1.26 -4.63 117.98 118.55 2gj1 s PHE 99 Ca -0.01 0.88 -0.05 0.00 -0.96 0.00 0.00 56.93 56.80 2gj1 s PHE 99 Cb -0.03 -0.00 0.17 0.00 -0.34 0.00 0.00 43.02 42.82 2gj1 s PHE 99 CO -0.01 -0.60 0.49 0.00 -1.46 0.00 0.00 175.22 173.65 2gj1 s ALA 100 N 2.50 3.66 0.56 11.12 0.00 -1.26 -0.23 121.76 138.11 2gj1 s ALA 100 Ca 0.07 -3.26 -0.20 0.00 0.00 0.00 0.00 51.96 48.57 2gj1 s ALA 100 Cb -0.14 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.14 2gj1 s ALA 100 CO -0.13 -2.13 1.25 -2.14 0.00 0.00 0.00 175.76 172.61 2gj1 s PRO 101 N -0.01 3.13 0.70 0.00 0.02 -1.26 -4.74 135.00 132.84 2gj1 s PRO 101 Ca 0.17 1.97 -0.15 0.00 0.02 0.00 0.00 61.00 63.00 2gj1 s PRO 101 Cb -0.19 -2.11 0.02 0.00 0.02 0.00 0.00 34.50 32.25 2gj1 s PRO 101 CO -0.04 -1.12 1.17 -1.21 -0.33 0.00 0.00 177.00 175.47 2gj1 s GLU 102 N -3.09 2.39 0.73 5.54 2.02 -1.26 -1.10 118.70 123.93 2gj1 s GLU 102 Ca 0.74 1.64 -0.13 0.00 0.02 0.00 0.00 54.97 57.24 2gj1 s GLU 102 Cb -0.34 -1.88 0.04 0.00 0.10 0.00 0.00 34.13 32.05 2gj1 s GLU 102 CO 0.38 -1.62 1.12 0.95 0.02 0.00 0.00 175.26 176.12 2gj1 s THR 103 N -2.09 2.99 0.00 3.63 -4.23 -0.19 -4.47 115.64 111.28 2gj1 s THR 103 Ca 0.72 0.41 0.00 0.00 -1.18 0.00 0.00 61.69 61.64 2gj1 s THR 103 Cb -0.26 -2.87 0.00 0.00 1.34 0.00 0.00 72.50 70.71 2gj1 s THR 103 CO 0.43 -0.34 0.00 1.21 -0.54 0.00 0.00 174.62 175.38 2gj1 n GLU 104 N -2.99 0.00 -2.60 3.99 2.13 -1.26 -4.93 120.64 114.98 2gj1 n GLU 104 Ca 0.11 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 57.79 2gj1 n GLU 104 Cb 0.52 0.00 -0.00 0.00 0.27 0.00 0.00 31.44 32.23 2gj1 n GLU 104 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2gj1 n LEU 105 N 0.00 -1.19 -3.37 4.31 4.32 -1.26 -4.89 117.00 114.92 2gj1 n LEU 105 Ca 0.00 0.11 -0.27 0.00 -0.02 0.00 0.00 56.01 55.83 2gj1 n LEU 105 Cb 0.00 -2.10 -0.10 0.00 -1.62 0.00 0.00 43.42 39.60 2gj1 n LEU 105 CO 0.00 -0.07 -0.31 0.61 -1.22 0.00 0.00 177.39 176.40 2gj1 n GLY 106 N -0.86 2.15 2.83 -0.72 0.00 -1.26 -4.89 105.19 102.44 2gj1 n GLY 106 Ca -0.12 -1.30 -0.30 0.00 0.00 0.00 0.00 46.02 44.30 2gj1 n GLY 106 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2gj1 s SER 107 N -0.04 4.06 -0.17 1.61 1.04 -1.26 -4.69 113.70 114.25 2gj1 s SER 107 Ca 0.33 -1.60 -0.00 0.00 0.48 0.00 0.00 55.95 55.16 2gj1 s SER 107 Cb 0.05 -1.06 -0.00 0.00 0.10 0.00 0.00 66.02 65.11 2gj1 s SER 107 CO -0.19 -0.37 0.15 -3.20 0.98 0.00 0.00 173.24 170.61 2gj1 n ASN 108 N 4.71 -2.05 -4.41 7.02 2.85 -1.26 -5.08 115.26 117.04 2gj1 n ASN 108 Ca -0.03 -0.09 -0.29 0.00 -0.11 0.00 0.00 54.58 54.06 2gj1 n ASN 108 Cb 0.43 -1.18 -0.13 0.00 1.24 0.00 0.00 39.78 40.14 2gj1 n ASN 108 CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 2gj1 s GLU 109 N -4.14 1.53 0.00 1.20 2.56 -1.26 -5.03 118.70 113.56 2gj1 s GLU 109 Ca 0.00 -1.29 0.20 0.00 0.00 0.00 0.00 54.97 53.89 2gj1 s GLU 109 Cb -0.00 -1.96 0.18 0.00 2.00 0.00 0.00 34.13 34.34 2gj1 s GLU 109 CO 0.11 0.46 1.16 0.72 -0.56 0.00 0.00 175.26 177.15 2gj1 n HIS 110 N 0.95 0.03 0.18 5.30 8.25 -1.26 -4.12 115.22 124.55 2gj1 n HIS 110 Ca -0.17 -0.02 0.06 0.00 -0.26 0.00 0.00 57.72 57.33 2gj1 n HIS 110 Cb 0.53 -0.00 0.17 0.00 1.12 0.00 0.00 29.99 31.81 2gj1 n HIS 110 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2gj1 h SER 111 N 3.98 0.00 0.71 0.41 0.87 -1.95 0.15 113.55 117.71 2gj1 h SER 111 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2gj1 h SER 111 Cb 0.85 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.81 2gj1 h SER 111 CO 0.00 0.33 0.00 0.29 -0.53 0.00 0.00 176.83 176.92 2gj1 n LYS 112 N -3.24 0.10 -0.06 2.24 5.02 -1.26 -2.06 118.16 118.90 2gj1 n LYS 112 Ca 0.02 0.08 -0.07 0.00 -2.02 0.00 0.00 58.31 56.32 2gj1 n LYS 112 Cb 0.62 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 34.06 2gj1 n LYS 112 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2gj1 n THR 113 N -1.44 0.70 0.25 -0.18 -1.04 -0.98 -3.85 114.28 107.73 2gj1 n THR 113 Ca 0.07 -0.34 0.08 0.00 -2.04 0.00 0.00 64.05 61.83 2gj1 n THR 113 Cb 0.25 -0.86 0.62 0.00 -1.82 0.00 0.00 70.33 68.52 2gj1 n THR 113 CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 2gj1 h GLN 114 N 0.00 0.00 0.16 -2.82 4.15 -0.66 0.45 115.11 116.39 2gj1 h GLN 114 Ca -0.28 0.00 -0.25 0.00 0.77 0.00 0.00 58.65 58.89 2gj1 h GLN 114 Cb 1.51 0.00 0.02 0.00 0.21 0.00 0.00 27.48 29.22 2gj1 h GLN 114 CO -0.02 0.12 -1.18 0.00 -1.93 0.00 0.00 178.83 175.82 2gj1 h GLU 116 N -0.21 -0.66 0.06 0.00 4.39 -1.55 -2.97 114.58 113.64 2gj1 h GLU 116 Ca -0.22 0.05 -0.24 0.00 0.34 0.00 0.00 59.36 59.29 2gj1 h GLU 116 Cb 1.82 0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 30.61 2gj1 h GLU 116 CO 0.16 -0.37 -1.09 0.93 -1.16 0.00 0.00 179.01 177.48 2gj1 h GLU 117 N -1.08 0.13 -0.00 2.33 4.39 -0.32 -3.38 114.58 116.66 2gj1 h GLU 117 Ca -0.07 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.41 2gj1 h GLU 117 Cb 0.60 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 2gj1 h GLU 117 CO 0.12 1.09 -0.10 0.66 -1.16 0.00 0.00 179.01 179.62 2gj1 n TYR 118 N -3.46 0.00 -3.20 4.33 4.02 -1.21 -5.01 117.16 112.64 2gj1 n TYR 118 Ca -0.04 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.62 2gj1 n TYR 118 Cb 0.96 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 40.31 2gj1 n TYR 118 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2gj1 s ILE 120 N -3.11 4.65 0.21 0.00 -1.09 -1.18 -4.90 121.20 115.78 2gj1 s ILE 120 Ca 0.37 1.30 -0.30 0.00 -2.23 0.00 0.00 60.65 59.78 2gj1 s ILE 120 Cb -0.17 -4.28 -0.08 0.00 -1.58 0.00 0.00 42.46 36.34 2gj1 s ILE 120 CO 0.45 -0.42 1.17 -1.58 -1.23 0.00 0.00 174.94 173.33 2gj1 s GLN 121 N 3.32 4.52 0.00 2.79 0.74 -1.26 -4.67 119.66 125.10 2gj1 s GLN 121 Ca 0.37 1.86 0.00 0.00 0.05 0.00 0.00 55.36 57.64 2gj1 s GLN 121 Cb -0.13 -3.23 0.00 0.00 1.10 0.00 0.00 33.01 30.75 2gj1 s GLN 121 CO 0.16 -0.02 0.00 0.41 -0.55 0.00 0.00 175.29 175.29 2gj1 n GLY 122 N 1.94 3.06 7.00 2.59 0.00 -0.80 -5.02 105.19 113.96 2gj1 n GLY 122 Ca 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2gj1 n GLY 122 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2gj1 n ASP 123 N 0.00 0.00 -0.19 1.61 8.00 -1.26 -1.16 116.55 123.55 2gj1 n ASP 123 Ca 0.00 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.64 2gj1 n ASP 123 Cb 0.00 0.00 0.60 0.00 -0.02 0.00 0.00 41.12 41.70 2gj1 n ASP 123 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2gj1 n ASN 124 N 7.10 0.68 -4.67 -2.24 3.02 -1.26 -4.79 115.26 113.11 2gj1 n ASN 124 Ca 0.00 -0.85 -0.40 0.00 -0.03 0.00 0.00 54.58 53.31 2gj1 n ASN 124 Cb 0.00 -0.02 -0.06 0.00 -0.61 0.00 0.00 39.78 39.09 2gj1 n ASN 124 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2gj1 n PHE 126 N 4.84 -0.64 -1.89 0.00 7.35 -0.47 -1.90 117.46 124.76 2gj1 n PHE 126 Ca -0.03 -3.41 -0.38 0.00 -0.76 0.00 0.00 57.45 52.87 2gj1 n PHE 126 Cb 0.50 0.04 0.03 0.00 0.35 0.00 0.00 39.48 40.40 2gj1 n PHE 126 CO 0.00 0.00 0.00 -2.14 -0.76 0.00 0.00 176.76 173.86 2gj1 s PRO 127 N -0.40 3.23 -0.48 -7.13 0.02 -1.26 -4.39 135.00 124.58 2gj1 s PRO 127 Ca 0.34 2.12 -0.20 0.00 0.02 0.00 0.00 61.00 63.27 2gj1 s PRO 127 Cb 0.08 -2.25 0.04 0.00 0.02 0.00 0.00 34.50 32.40 2gj1 s PRO 127 CO -0.17 -1.08 0.64 0.42 -0.33 0.00 0.00 177.00 176.48 2gj1 s ILE 128 N -1.37 4.84 0.22 2.83 1.01 -0.17 -4.95 121.20 123.62 2gj1 s ILE 128 Ca 0.71 -0.26 -0.26 0.00 0.00 0.00 0.00 60.65 60.84 2gj1 s ILE 128 Cb -0.37 -4.27 -0.09 0.00 0.01 0.00 0.00 42.46 37.74 2gj1 s ILE 128 CO 0.44 -0.74 0.84 -0.04 0.00 0.00 0.00 174.94 175.44 2gj1 s MET 129 N 2.74 4.59 0.22 2.79 -1.94 -1.26 -0.29 119.30 126.14 2gj1 s MET 129 Ca 0.18 1.22 -0.28 0.00 -1.71 0.00 0.00 55.69 55.11 2gj1 s MET 129 Cb -0.17 -3.12 -0.09 0.00 2.01 0.00 0.00 34.83 33.46 2gj1 s MET 129 CO 0.15 0.48 0.87 -0.06 -0.01 0.00 0.00 175.02 176.44 2gj1 s PHE 130 N -1.30 3.92 0.90 -0.03 2.99 -1.01 -4.59 117.98 118.87 2gj1 s PHE 130 Ca 0.41 1.78 -0.13 0.00 0.00 0.00 0.00 56.93 58.99 2gj1 s PHE 130 Cb -0.22 -2.88 0.14 0.00 0.00 0.00 0.00 43.02 40.05 2gj1 s PHE 130 CO 0.26 0.46 1.16 -1.25 -0.00 0.00 0.00 175.22 175.85 2gj1 s PRO 131 N -1.27 1.20 0.34 0.24 0.04 -1.26 -4.99 135.00 129.29 2gj1 s PRO 131 Ca 0.40 0.19 -0.29 0.00 0.04 0.00 0.00 61.00 61.34 2gj1 s PRO 131 Cb -0.24 -1.85 -0.11 0.00 0.04 0.00 0.00 34.50 32.34 2gj1 s PRO 131 CO 0.29 -2.14 1.39 0.21 0.04 0.00 0.00 177.00 176.79 2gj1 s LYS 132 N -5.39 4.26 -0.03 4.56 2.20 -1.26 -2.80 119.74 121.27 2gj1 s LYS 132 Ca 0.64 2.36 0.00 0.00 -0.36 0.00 0.00 55.97 58.61 2gj1 s LYS 132 Cb -0.13 -3.04 0.00 0.00 -1.51 0.00 0.00 37.83 33.15 2gj1 s LYS 132 CO 0.52 -0.34 0.00 0.09 -0.36 0.00 0.00 175.35 175.27 2gj1 n ASN 133 N 0.85 -3.43 -4.70 1.43 5.03 -1.26 -5.00 115.26 108.18 2gj1 n ASN 133 Ca 0.01 0.01 -0.42 0.00 0.87 0.00 0.00 54.58 55.05 2gj1 n ASN 133 Cb 0.41 -0.96 -0.03 0.00 -1.02 0.00 0.00 39.78 38.18 2gj1 n ASN 133 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2gj1 s ASP 134 N -2.10 7.11 0.55 6.41 -1.08 -1.12 -4.92 116.67 121.51 2gj1 s ASP 134 Ca 0.00 1.86 0.25 0.00 -0.52 0.00 0.00 52.55 54.14 2gj1 s ASP 134 Cb 0.00 -2.57 1.47 0.00 -1.46 0.00 0.00 42.92 40.37 2gj1 s ASP 134 CO 0.00 -0.50 2.07 -0.65 0.52 0.00 0.00 175.17 176.61 2gj1 h PRO 135 N 7.13 0.00 0.00 4.34 0.11 -1.94 -1.96 132.00 139.67 2gj1 h PRO 135 Ca -0.38 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.73 2gj1 h PRO 135 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2gj1 h PRO 135 CO 0.84 0.00 -0.03 0.87 -0.21 0.00 0.00 178.00 179.46 2gj1 h LYS 136 N 0.00 0.00 -0.70 1.05 1.57 -1.93 -2.55 116.57 114.01 2gj1 h LYS 136 Ca 0.13 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2gj1 h LYS 136 Cb 0.60 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.88 2gj1 h LYS 136 CO -0.00 0.03 0.43 -0.07 -0.57 0.00 0.00 179.45 179.27 2gj1 h LEU 137 N 0.00 0.84 -1.36 2.94 3.38 -1.49 0.44 115.31 120.07 2gj1 h LEU 137 Ca -0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2gj1 h LEU 137 Cb 0.46 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2gj1 h LEU 137 CO 0.00 0.65 0.00 0.11 0.09 0.00 0.00 178.44 179.29 2gj1 h LYS 138 N 0.96 0.00 0.00 1.13 1.57 -1.60 -3.35 116.57 115.27 2gj1 h LYS 138 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 2gj1 h LYS 138 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2gj1 h LYS 138 CO -0.05 0.00 -0.29 -2.37 -0.57 0.00 0.00 179.45 176.18 2gj1 n THR 139 N -2.95 0.00 -0.01 -0.16 5.66 -0.99 -4.92 114.28 110.91 2gj1 n THR 139 Ca 0.01 -0.05 -0.02 0.00 -3.05 0.00 0.00 64.05 60.94 2gj1 n THR 139 Cb 0.29 0.41 -0.01 0.00 -1.55 0.00 0.00 70.33 69.48 2gj1 n THR 139 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2gj1 n GLN 140 N -0.54 0.04 -1.56 1.09 6.02 0.15 -5.08 117.38 117.51 2gj1 n GLN 140 Ca 0.00 0.02 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 2gj1 n GLN 140 Cb 0.00 -0.65 0.00 0.00 1.02 0.00 0.00 30.24 30.61 2gj1 n GLN 140 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2gj1 n GLY 141 N 2.98 -0.31 0.01 1.08 0.00 -1.07 -4.95 105.19 102.92 2gj1 n GLY 141 Ca -0.04 -1.04 0.11 0.00 0.00 0.00 0.00 46.02 45.06 2gj1 n GLY 141 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2gj1 n LYS 142 N 0.00 0.19 -3.84 1.61 5.02 -1.26 -4.02 118.16 115.86 2gj1 n LYS 142 Ca 0.00 -0.02 -0.06 0.00 -2.02 0.00 0.00 58.31 56.20 2gj1 n LYS 142 Cb 0.00 -1.54 -0.02 0.00 -0.02 0.00 0.00 35.03 33.45 2gj1 n LYS 142 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2gj1 s MET 144 N -3.77 3.70 0.46 0.00 -1.94 0.60 -4.96 119.30 113.38 2gj1 s MET 144 Ca 0.11 -0.51 -0.24 0.00 -1.71 0.00 0.00 55.69 53.35 2gj1 s MET 144 Cb -0.05 -2.94 -0.07 0.00 2.01 0.00 0.00 34.83 33.78 2gj1 s MET 144 CO 0.06 0.24 1.32 -1.25 -0.01 0.00 0.00 175.02 175.38 2gj1 s PRO 145 N 0.38 3.65 -0.18 2.03 0.04 -1.26 -1.00 135.00 138.66 2gj1 s PRO 145 Ca -0.03 2.16 -0.10 0.00 0.04 0.00 0.00 61.00 63.06 2gj1 s PRO 145 Cb -0.14 -2.54 0.06 0.00 0.04 0.00 0.00 34.50 31.92 2gj1 s PRO 145 CO 0.03 -0.76 0.43 0.12 0.04 0.00 0.00 177.00 176.86 2gj1 s PHE 146 N -1.31 -0.63 -0.07 0.56 2.19 -1.26 -4.80 117.98 112.65 2gj1 s PHE 146 Ca 0.63 1.35 0.04 0.00 0.33 0.00 0.00 56.93 59.27 2gj1 s PHE 146 Cb -0.38 0.29 -0.02 0.00 -1.31 0.00 0.00 43.02 41.60 2gj1 s PHE 146 CO 0.47 -0.35 -0.18 -0.06 1.83 0.00 0.00 175.22 176.94 2gj1 s PHE 147 N 1.34 2.63 0.63 10.12 0.40 -1.26 -1.36 117.98 130.47 2gj1 s PHE 147 Ca -0.09 -0.45 -0.18 0.00 -0.60 0.00 0.00 56.93 55.61 2gj1 s PHE 147 Cb -0.08 -1.66 -0.02 0.00 0.51 0.00 0.00 43.02 41.77 2gj1 s PHE 147 CO -0.12 -0.03 1.25 1.03 0.70 0.00 0.00 175.22 178.04 2gj1 s ARG 148 N -0.32 2.71 0.43 0.44 0.52 -0.09 -4.68 118.95 117.96 2gj1 s ARG 148 Ca 0.02 1.93 -0.23 0.00 -0.52 0.00 0.00 55.73 56.93 2gj1 s ARG 148 Cb -0.13 -1.88 -0.08 0.00 0.52 0.00 0.00 34.95 33.38 2gj1 s ARG 148 CO 0.02 -1.44 1.08 0.00 0.02 0.00 0.00 175.30 174.99 2gj1 s ALA 149 N -1.53 3.03 0.76 2.13 0.00 -1.26 -1.03 121.76 123.86 2gj1 s ALA 149 Ca 0.80 0.76 -0.14 0.00 0.00 0.00 0.00 51.96 53.38 2gj1 s ALA 149 Cb -0.34 -3.30 0.06 0.00 0.00 0.00 0.00 23.12 19.54 2gj1 s ALA 149 CO 0.37 -0.36 1.22 0.20 0.00 0.00 0.00 175.76 177.19 2gj1 s GLY 150 N -1.54 2.32 0.38 0.00 0.00 -0.26 -4.63 107.32 103.59 2gj1 s GLY 150 Ca 0.60 0.92 0.05 0.00 0.00 0.00 0.00 44.72 46.29 2gj1 s GLY 150 CO 0.29 1.34 0.18 -0.11 0.00 0.00 0.00 173.10 174.79 2gj1 s PHE 151 N -1.98 1.75 0.00 1.90 -0.71 -1.26 -2.53 117.98 115.15 2gj1 s PHE 151 Ca 0.75 -1.41 0.00 0.00 -1.04 0.00 0.00 56.93 55.23 2gj1 s PHE 151 Cb -0.30 -1.00 0.00 0.00 -1.21 0.00 0.00 43.02 40.51 2gj1 s PHE 151 CO 0.47 -0.49 0.00 1.33 -1.34 0.00 0.00 175.22 175.19 2gj1 n VAL 152 N -0.80 0.00 0.00 -2.49 0.24 -0.93 -4.59 118.33 109.76 2gj1 n VAL 152 Ca -0.01 0.15 0.00 0.00 -2.04 0.00 0.00 64.34 62.44 2gj1 n VAL 152 Cb 0.64 -0.47 0.00 0.00 -1.47 0.00 0.00 33.84 32.54 2gj1 n VAL 152 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2gj1 n PRO 154 N -0.51 0.77 -2.54 0.00 -0.02 -1.26 -5.20 135.00 126.24 2gj1 n PRO 154 Ca 0.00 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.49 2gj1 n PRO 154 Cb 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 33.50 33.53 2gj1 n PRO 154 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2gj1 n THR 155 N -0.46 0.96 0.15 3.45 -2.24 -1.26 -4.53 114.28 110.34 2gj1 n THR 155 Ca 0.00 -2.44 -0.08 0.00 -2.27 0.00 0.00 64.05 59.26 2gj1 n THR 155 Cb 0.00 1.23 -0.04 0.00 -2.10 0.00 0.00 70.33 69.42 2gj1 n THR 155 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2gj1 h PRO 156 N 2.21 -0.44 0.00 -0.78 0.11 -2.05 -3.48 132.00 127.57 2gj1 h PRO 156 Ca -0.17 0.03 0.08 0.00 0.11 0.00 0.00 66.00 66.05 2gj1 h PRO 156 Cb 1.40 0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.59 2gj1 h PRO 156 CO 0.15 -0.29 -0.11 0.98 -0.21 0.00 0.00 178.00 178.51 2gj1 n TYR 156 N -3.61 -2.07 0.00 0.65 9.36 -1.26 -5.04 117.16 115.19 2gj1 n TYR 156 Ca -0.06 0.39 0.00 0.00 3.32 0.00 0.00 57.90 61.55 2gj1 n TYR 156 Cb 0.20 -0.65 0.00 0.00 -0.63 0.00 0.00 39.34 38.26 2gj1 n TYR 156 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2gj1 n GLN 157 N -1.63 0.00 0.00 2.98 10.64 -1.26 -5.12 117.38 122.99 2gj1 n GLN 157 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2gj1 n GLN 157 Cb 0.14 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.52 2gj1 n GLN 157 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 2gj1 n SER 158 N -1.35 0.00 -1.40 2.61 7.64 -1.26 -4.93 113.62 114.92 2gj1 n SER 158 Ca 0.00 0.47 0.00 0.00 1.01 0.00 0.00 58.87 60.35 2gj1 n SER 158 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2gj1 n SER 158 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2gj1 n LEU 159 N -0.65 0.00 -4.82 -3.43 0.00 -1.26 -5.06 117.00 101.78 2gj1 n LEU 159 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 56.01 55.64 2gj1 n LEU 159 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 43.42 43.36 2gj1 n LEU 159 CO 0.00 0.00 0.37 0.00 0.00 0.00 0.00 177.39 177.76 2gj1 s ALA 160 N -2.95 3.47 0.02 1.96 0.00 -1.26 -4.83 121.76 118.17 2gj1 s ALA 160 Ca 0.00 0.11 -0.30 0.00 0.00 0.00 0.00 51.96 51.77 2gj1 s ALA 160 Cb 0.00 -2.75 -0.07 0.00 0.00 0.00 0.00 23.12 20.29 2gj1 s ALA 160 CO 0.00 0.36 1.69 0.50 0.00 0.00 0.00 175.76 178.31 2gj1 s ARG 161 N -1.78 4.19 -0.16 0.00 3.52 0.81 -5.01 118.95 120.52 2gj1 s ARG 161 Ca 0.39 2.31 0.01 0.00 -0.13 0.00 0.00 55.73 58.32 2gj1 s ARG 161 Cb -0.17 -3.81 0.01 0.00 -1.56 0.00 0.00 34.95 29.41 2gj1 s ARG 161 CO 0.21 -0.80 -0.18 -1.21 -0.81 0.00 0.00 175.30 172.51 2gj1 s GLU 162 N 3.38 3.10 0.53 5.12 0.41 -1.26 -4.97 118.70 125.00 2gj1 s GLU 162 Ca 0.75 -0.80 -0.17 0.00 -0.41 0.00 0.00 54.97 54.34 2gj1 s GLU 162 Cb -0.38 -2.56 -0.07 0.00 -1.78 0.00 0.00 34.13 29.35 2gj1 s GLU 162 CO 0.32 -0.06 1.02 -0.65 -0.49 0.00 0.00 175.26 175.40 2gj1 s GLN 163 N 0.96 3.73 0.22 1.61 1.11 -1.26 -2.19 119.66 123.84 2gj1 s GLN 163 Ca -0.03 1.13 -0.17 0.00 0.01 0.00 0.00 55.36 56.30 2gj1 s GLN 163 Cb -0.15 -2.10 -0.08 0.00 -1.01 0.00 0.00 33.01 29.68 2gj1 s GLN 163 CO -0.04 -0.47 0.67 0.42 0.01 0.00 0.00 175.29 175.89 2gj1 s ILE 164 N -2.40 4.68 -0.33 1.08 1.01 -1.05 -1.34 121.20 122.86 2gj1 s ILE 164 Ca 0.62 1.06 -0.07 0.00 0.00 0.00 0.00 60.65 62.27 2gj1 s ILE 164 Cb -0.13 -3.77 0.03 0.00 0.01 0.00 0.00 42.46 38.60 2gj1 s ILE 164 CO 0.29 0.14 0.10 0.21 0.00 0.00 0.00 174.94 175.68 2gj1 s ASN 165 N -1.81 5.28 0.00 3.58 2.47 0.43 -4.06 114.94 120.82 2gj1 s ASN 165 Ca 0.44 -0.98 0.26 0.00 0.42 0.00 0.00 52.86 52.99 2gj1 s ASN 165 Cb -0.15 -1.88 1.36 0.00 -1.45 0.00 0.00 41.25 39.12 2gj1 s ASN 165 CO 0.20 -0.28 1.89 0.00 -3.72 0.00 0.00 177.10 175.19 2gj1 n ALA 166 N 4.84 2.62 -2.60 1.71 0.00 0.68 -0.26 120.51 127.50 2gj1 n ALA 166 Ca -0.13 -0.26 -0.27 0.00 0.00 0.00 0.00 53.44 52.77 2gj1 n ALA 166 Cb 0.46 -1.33 -0.10 0.00 0.00 0.00 0.00 19.45 18.48 2gj1 n ALA 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2gj1 s VAL 167 N -1.97 1.55 0.17 0.00 -7.23 -1.26 -4.31 120.40 107.34 2gj1 s VAL 167 Ca 0.38 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.25 2gj1 s VAL 167 Cb 0.18 -2.74 -0.07 0.00 0.56 0.00 0.00 36.38 34.31 2gj1 s VAL 167 CO 0.30 0.00 1.00 0.42 -0.31 0.00 0.00 175.10 176.52 2gj1 s THR 168 N -2.92 4.17 0.36 5.32 -4.23 -1.26 -4.08 115.64 113.01 2gj1 s THR 168 Ca 0.29 1.91 0.20 0.00 -1.18 0.00 0.00 61.69 62.92 2gj1 s THR 168 Cb 0.08 -4.22 0.20 0.00 1.34 0.00 0.00 72.50 69.90 2gj1 s THR 168 CO 0.14 0.35 1.94 0.28 -0.54 0.00 0.00 174.62 176.79 2gj1 h SER 169 N 5.05 0.00 -4.06 3.99 0.02 -1.53 -3.39 113.55 113.63 2gj1 h SER 169 Ca -0.44 0.00 -0.49 0.00 -0.84 0.00 0.00 61.79 60.02 2gj1 h SER 169 Cb 1.21 0.00 0.05 0.00 0.14 0.00 0.00 62.40 63.80 2gj1 h SER 169 CO 0.71 0.23 0.43 -0.36 -1.14 0.00 0.00 176.83 176.70 2gj1 s PHE 170 N -4.16 2.83 -0.94 3.45 0.08 -1.26 -4.78 117.98 113.19 2gj1 s PHE 170 Ca -0.02 1.56 -0.24 0.00 0.12 0.00 0.00 56.93 58.34 2gj1 s PHE 170 Cb 0.13 -3.23 0.04 0.00 -0.57 0.00 0.00 43.02 39.40 2gj1 s PHE 170 CO 0.65 -1.29 1.41 -1.17 -0.10 0.00 0.00 175.22 174.72 2gj1 s LEU 171 N -3.52 3.41 -0.02 -0.37 0.20 -1.26 -4.71 118.68 112.41 2gj1 s LEU 171 Ca 0.69 -1.17 0.02 0.00 0.69 0.00 0.00 54.13 54.36 2gj1 s LEU 171 Cb -0.22 -2.57 0.03 0.00 -0.43 0.00 0.00 46.19 43.00 2gj1 s LEU 171 CO 0.26 -1.61 0.91 -0.90 -0.29 0.00 0.00 176.35 174.73 2gj1 n ASP 172 N 9.05 0.36 -1.76 3.68 5.75 -1.26 -4.75 116.55 127.62 2gj1 n ASP 172 Ca 0.25 -1.92 -0.16 0.00 -0.01 0.00 0.00 54.79 52.95 2gj1 n ASP 172 Cb 0.50 -0.18 -0.02 0.00 -1.03 0.00 0.00 41.12 40.40 2gj1 n ASP 172 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2gj1 n ALA 173 N -0.19 -0.44 0.33 2.12 0.00 -1.26 -4.70 120.51 116.36 2gj1 n ALA 173 Ca 0.02 0.15 0.21 0.00 0.00 0.00 0.00 53.44 53.82 2gj1 n ALA 173 Cb 0.63 -1.81 1.12 0.00 0.00 0.00 0.00 19.45 19.40 2gj1 n ALA 173 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2gj1 h SER 174 N 0.00 0.00 1.34 0.00 4.64 -1.84 -1.41 113.55 116.28 2gj1 h SER 174 Ca -0.38 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.94 2gj1 h SER 174 Cb 1.25 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2gj1 h SER 174 CO 0.46 0.00 -0.02 0.17 -0.87 0.00 0.00 176.83 176.58 2gj1 h LEU 175 N 0.00 0.00 0.03 5.97 -0.00 -1.83 0.12 115.31 119.59 2gj1 h LEU 175 Ca -0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 57.88 57.60 2gj1 h LEU 175 Cb 0.02 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 40.64 2gj1 h LEU 175 CO 0.00 0.02 -1.55 0.52 -0.00 0.00 0.00 178.44 177.43 2gj1 n VAL 176 N -3.11 1.59 0.34 0.15 0.31 -0.57 -2.25 118.33 114.78 2gj1 n VAL 176 Ca 0.02 -0.20 0.11 0.00 -0.01 0.00 0.00 64.34 64.26 2gj1 n VAL 176 Cb 0.39 -1.95 0.01 0.00 -0.91 0.00 0.00 33.84 31.38 2gj1 n VAL 176 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 2gj1 n TYR 177 N -4.19 0.51 0.00 3.52 4.01 -0.95 -2.90 117.16 117.16 2gj1 n TYR 177 Ca -0.34 0.15 0.00 0.00 -0.16 0.00 0.00 57.90 57.54 2gj1 n TYR 177 Cb 0.78 -0.65 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 2gj1 n TYR 177 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2gj1 n GLY 178 N 1.29 1.75 0.31 2.72 0.00 0.40 -4.00 105.19 107.65 2gj1 n GLY 178 Ca 0.01 -1.89 0.03 0.00 0.00 0.00 0.00 46.02 44.17 2gj1 n GLY 178 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2gj1 n SER 179 N -0.15 2.15 -4.03 1.61 7.64 -1.26 -4.72 113.62 114.87 2gj1 n SER 179 Ca 0.00 -1.74 -0.19 0.00 1.01 0.00 0.00 58.87 57.95 2gj1 n SER 179 Cb 0.00 -0.08 -0.15 0.00 -1.01 0.00 0.00 64.21 62.97 2gj1 n SER 179 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2gj1 s GLU 180 N -0.83 0.82 0.23 1.43 2.02 -1.26 -4.22 118.70 116.89 2gj1 s GLU 180 Ca 0.11 -0.34 -0.07 0.00 0.02 0.00 0.00 54.97 54.69 2gj1 s GLU 180 Cb 0.06 -0.79 0.33 0.00 0.10 0.00 0.00 34.13 33.83 2gj1 s GLU 180 CO 0.08 0.19 1.80 -1.35 0.02 0.00 0.00 175.26 176.00 2gj1 h PRO 181 N 5.98 0.67 -0.39 0.39 0.11 -1.94 -0.24 132.00 136.58 2gj1 h PRO 181 Ca -0.31 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.71 2gj1 h PRO 181 Cb 1.18 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 2gj1 h PRO 181 CO 0.49 0.44 0.07 0.66 -0.21 0.00 0.00 178.00 179.46 2gj1 h SER 182 N 0.69 0.61 -0.28 -2.05 4.64 -2.00 -2.08 113.55 113.09 2gj1 h SER 182 Ca 0.35 -0.25 -0.05 0.00 -0.47 0.00 0.00 61.79 61.37 2gj1 h SER 182 Cb 0.31 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 2gj1 h SER 182 CO -0.24 0.71 -0.00 0.25 -0.87 0.00 0.00 176.83 176.68 2gj1 h LEU 183 N 0.49 0.48 -1.49 5.97 5.85 -1.88 -2.47 115.31 122.26 2gj1 h LEU 183 Ca 0.12 -0.31 0.06 0.00 0.84 0.00 0.00 57.88 58.58 2gj1 h LEU 183 Cb 0.35 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 2gj1 h LEU 183 CO 0.01 0.68 0.41 0.00 -0.34 0.00 0.00 178.44 179.19 2gj1 h ALA 184 N 0.82 1.77 -0.36 1.25 0.00 -0.91 -0.90 119.26 120.94 2gj1 h ALA 184 Ca 0.08 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 2gj1 h ALA 184 Cb 0.43 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2gj1 h ALA 184 CO 0.01 0.14 -0.42 1.03 0.00 0.00 0.00 179.25 180.01 2gj1 h SER 185 N 0.63 0.97 0.08 0.00 0.87 -1.30 -3.12 113.55 111.69 2gj1 h SER 185 Ca 0.26 -0.46 -0.08 0.00 -1.23 0.00 0.00 61.79 60.29 2gj1 h SER 185 Cb 0.24 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 2gj1 h SER 185 CO -0.08 1.25 -0.24 -0.09 -0.53 0.00 0.00 176.83 177.14 2gj1 h ARG 186 N 0.73 0.27 0.00 2.24 2.43 -0.72 -2.64 114.38 116.70 2gj1 h ARG 186 Ca 0.05 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2gj1 h ARG 186 Cb 1.01 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.54 2gj1 h ARG 186 CO 0.10 0.51 -0.01 -0.07 -1.51 0.00 0.00 179.97 178.99 2gj1 h LEU 187 N 0.25 0.00-10.14 3.80 4.07 -1.24 -3.46 115.31 108.59 2gj1 h LEU 187 Ca 0.04 0.00 -0.48 0.00 0.08 0.00 0.00 57.88 57.52 2gj1 h LEU 187 Cb 0.57 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.31 2gj1 h LEU 187 CO 0.04 0.01 0.27 -0.13 -1.08 0.00 0.00 178.44 177.54 2gj1 s ARG 188 N -3.48 3.95 -0.72 1.13 0.52 -1.00 -0.44 118.95 118.91 2gj1 s ARG 188 Ca 0.03 0.81 -0.17 0.00 -0.52 0.00 0.00 55.73 55.89 2gj1 s ARG 188 Cb 0.07 -2.25 0.15 0.00 0.52 0.00 0.00 34.95 33.45 2gj1 s ARG 188 CO 0.60 -0.12 0.76 1.21 0.02 0.00 0.00 175.30 177.76 2gj1 s ASN 189 N -2.87 6.46 0.00 0.23 3.84 -0.54 -4.31 114.94 117.75 2gj1 s ASN 189 Ca 0.57 -2.05 0.19 0.00 0.21 0.00 0.00 52.86 51.78 2gj1 s ASN 189 Cb -0.10 -2.27 0.53 0.00 -0.55 0.00 0.00 41.25 38.86 2gj1 s ASN 189 CO 0.27 -0.87 1.44 0.18 -2.79 0.00 0.00 177.10 175.33 2gj1 n LEU 190 N 5.33 3.10 -0.03 3.21 4.77 -1.26 -4.13 117.00 127.98 2gj1 n LEU 190 Ca 0.03 -1.50 -0.15 0.00 -0.03 0.00 0.00 56.01 54.36 2gj1 n LEU 190 Cb 0.45 -0.35 -0.10 0.00 -2.33 0.00 0.00 43.42 41.08 2gj1 n LEU 190 CO 0.47 0.75 0.45 0.28 -1.33 0.00 0.00 177.39 178.01 2gj1 h SER 191 N 3.52 0.27 -3.26 -1.43 0.02 -1.98 -3.44 113.55 107.25 2gj1 h SER 191 Ca 0.00 -0.68 -0.65 0.00 -0.84 0.00 0.00 61.79 59.61 2gj1 h SER 191 Cb 0.80 -0.08 -0.16 0.00 0.14 0.00 0.00 62.40 63.10 2gj1 h SER 191 CO 0.00 0.91 -0.61 -0.94 -1.14 0.00 0.00 176.83 175.05 2gj1 s SER 192 N -6.26 5.33 -0.33 3.07 1.04 -1.26 -5.01 113.70 110.29 2gj1 s SER 192 Ca -0.15 0.10 -0.07 0.00 0.48 0.00 0.00 55.95 56.31 2gj1 s SER 192 Cb 0.02 -1.69 -0.23 0.00 0.10 0.00 0.00 66.02 64.22 2gj1 s SER 192 CO 0.75 0.29 3.49 -0.81 0.98 0.00 0.00 173.24 177.93 2gj1 n PRO 193 N 2.74 2.35 -0.08 4.02 -0.04 -1.26 -4.20 135.00 138.52 2gj1 n PRO 193 Ca -0.18 -1.26 0.06 0.00 -0.04 0.00 0.00 63.50 62.08 2gj1 n PRO 193 Cb 0.53 -2.16 0.10 0.00 -0.04 0.00 0.00 33.50 31.93 2gj1 n PRO 193 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2gj1 n LEU 194 N 2.68 2.42 -1.53 1.53 4.77 -1.26 -2.95 117.00 122.66 2gj1 n LEU 194 Ca 0.50 -1.41 -0.15 0.00 -0.03 0.00 0.00 56.01 54.92 2gj1 n LEU 194 Cb 0.78 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.74 2gj1 n LEU 194 CO 0.27 0.53 -0.18 0.61 -1.33 0.00 0.00 177.39 177.29 2gj1 n GLY 195 N 0.65 0.28 3.92 -0.72 0.00 -1.22 -4.73 105.19 103.37 2gj1 n GLY 195 Ca 0.09 -0.28 -0.26 0.00 0.00 0.00 0.00 46.02 45.57 2gj1 n GLY 195 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gj1 s LEU 196 N -4.02 3.56 0.17 0.99 1.43 -1.26 -4.00 118.68 115.54 2gj1 s LEU 196 Ca 0.00 0.76 -0.07 0.00 -1.03 0.00 0.00 54.13 53.80 2gj1 s LEU 196 Cb 0.00 -3.67 -0.06 0.00 0.03 0.00 0.00 46.19 42.49 2gj1 s LEU 196 CO 0.00 -0.69 0.43 -0.04 0.23 0.00 0.00 176.35 176.28 2gj1 s MET 197 N -4.75 3.68 0.35 1.70 -1.94 -1.26 -1.47 119.30 115.61 2gj1 s MET 197 Ca 0.49 0.04 -0.28 0.00 -1.71 0.00 0.00 55.69 54.23 2gj1 s MET 197 Cb -0.10 -2.79 -0.10 0.00 2.01 0.00 0.00 34.83 33.85 2gj1 s MET 197 CO 0.43 0.42 1.31 0.00 -0.01 0.00 0.00 175.02 177.18 2gj1 s ALA 198 N -1.70 3.44 0.30 3.03 0.00 0.41 -4.52 121.76 122.71 2gj1 s ALA 198 Ca 0.43 1.26 0.09 0.00 0.00 0.00 0.00 51.96 53.74 2gj1 s ALA 198 Cb -0.12 -3.48 -0.06 0.00 0.00 0.00 0.00 23.12 19.46 2gj1 s ALA 198 CO 0.23 -0.70 -0.11 0.14 0.00 0.00 0.00 175.76 175.32 2gj1 s VAL 199 N -1.17 2.02 0.32 0.00 -7.23 -1.26 -4.48 120.40 108.60 2gj1 s VAL 199 Ca 0.51 -2.22 -0.29 0.00 -1.81 0.00 0.00 61.98 58.17 2gj1 s VAL 199 Cb -0.39 -2.45 -0.12 0.00 0.56 0.00 0.00 36.38 33.97 2gj1 s VAL 199 CO 0.52 -0.31 1.42 -3.20 -0.31 0.00 0.00 175.10 173.22 2gj1 n ASN 200 N -0.64 3.24 -0.42 4.85 2.85 -0.78 -4.67 115.26 119.68 2gj1 n ASN 200 Ca -0.05 1.19 0.05 0.00 -0.11 0.00 0.00 54.58 55.65 2gj1 n ASN 200 Cb 0.62 -1.53 0.06 0.00 1.24 0.00 0.00 39.78 40.18 2gj1 n ASN 200 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2gj1 n GLN 201 N 1.14 1.03 -0.00 1.20 1.13 -1.26 -4.53 117.38 116.08 2gj1 n GLN 201 Ca 0.06 -1.32 0.07 0.00 -1.94 0.00 0.00 57.00 53.87 2gj1 n GLN 201 Cb 0.36 -1.19 -0.10 0.00 0.11 0.00 0.00 30.24 29.42 2gj1 n GLN 201 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2gj1 n GLU 202 N 0.49 1.01 -3.73 -1.09 4.71 -1.26 -5.02 120.64 115.74 2gj1 n GLU 202 Ca 0.07 -0.09 -0.14 0.00 -0.01 0.00 0.00 57.16 56.99 2gj1 n GLU 202 Cb 0.28 -1.28 -0.09 0.00 -1.01 0.00 0.00 31.44 29.34 2gj1 n GLU 202 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2gj1 s ALA 203 N -2.78 -0.96 0.09 0.62 0.00 -1.26 -5.16 121.76 112.30 2gj1 s ALA 203 Ca -0.02 0.79 0.04 0.00 0.00 0.00 0.00 51.96 52.76 2gj1 s ALA 203 Cb 0.09 -0.28 -0.03 0.00 0.00 0.00 0.00 23.12 22.90 2gj1 s ALA 203 CO 0.57 -0.23 -0.11 -1.58 0.00 0.00 0.00 175.76 174.41 2gj1 s TRP 204 N -0.58 1.10 -0.84 0.00 0.52 -1.26 -4.49 118.94 113.39 2gj1 s TRP 204 Ca -0.07 -0.57 -0.03 0.00 0.02 0.00 0.00 56.10 55.44 2gj1 s TRP 204 Cb -0.04 -0.61 0.21 0.00 -1.15 0.00 0.00 33.47 31.89 2gj1 s TRP 204 CO 0.03 0.03 0.72 0.34 0.02 0.00 0.00 176.95 178.08 2gj1 s ASP 205 N -2.17 5.94 -1.41 2.95 2.15 0.18 -4.67 116.67 119.65 2gj1 s ASP 205 Ca 0.02 -3.45 -0.05 0.00 0.43 0.00 0.00 52.55 49.50 2gj1 s ASP 205 Cb -0.06 -1.93 0.03 0.00 -0.30 0.00 0.00 42.92 40.66 2gj1 s ASP 205 CO 0.01 -0.26 0.77 1.41 -0.17 0.00 0.00 175.17 176.93 2gj1 n HIS 206 N 2.72 -2.01 -0.99 -5.34 8.25 -1.26 -0.38 115.22 116.21 2gj1 n HIS 206 Ca 0.18 0.85 0.00 0.00 -0.26 0.00 0.00 57.72 58.49 2gj1 n HIS 206 Cb 0.38 -4.14 0.00 0.00 1.12 0.00 0.00 29.99 27.35 2gj1 n HIS 206 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gj1 n GLY 207 N -1.66 0.87 3.84 -1.41 0.00 -1.26 -5.03 105.19 100.54 2gj1 n GLY 207 Ca -0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 2gj1 n GLY 207 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gj1 s LEU 208 N 0.00 4.06 0.51 0.99 1.43 0.49 -5.09 118.68 121.07 2gj1 s LEU 208 Ca 0.00 0.11 -0.21 0.00 -1.03 0.00 0.00 54.13 53.01 2gj1 s LEU 208 Cb 0.00 -2.70 -0.07 0.00 0.03 0.00 0.00 46.19 43.45 2gj1 s LEU 208 CO 0.00 0.16 1.14 0.00 0.23 0.00 0.00 176.35 177.88 2gj1 s ALA 209 N -1.46 2.81 0.26 4.21 0.00 -1.26 -0.64 121.76 125.67 2gj1 s ALA 209 Ca 0.32 0.86 0.10 0.00 0.00 0.00 0.00 51.96 53.23 2gj1 s ALA 209 Cb -0.12 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 2gj1 s ALA 209 CO 0.25 -0.70 -0.02 0.71 0.00 0.00 0.00 175.76 176.00 2gj1 s TYR 210 N -1.69 2.68 0.70 0.00 4.12 -1.26 -4.79 117.35 117.10 2gj1 s TYR 210 Ca 0.69 -0.23 -0.14 0.00 0.02 0.00 0.00 57.07 57.42 2gj1 s TYR 210 Cb -0.25 -1.19 0.02 0.00 -1.52 0.00 0.00 41.96 39.02 2gj1 s TYR 210 CO 0.29 0.62 1.12 -0.51 0.02 0.00 0.00 175.55 177.09 2gj1 s LEU 211 N -3.63 3.28 0.70 -1.29 1.43 -1.26 -1.87 118.68 116.04 2gj1 s LEU 211 Ca 0.31 2.01 -0.14 0.00 -1.03 0.00 0.00 54.13 55.28 2gj1 s LEU 211 Cb -0.06 -4.55 0.02 0.00 0.03 0.00 0.00 46.19 41.63 2gj1 s LEU 211 CO 0.20 -1.85 1.12 -2.84 0.23 0.00 0.00 176.35 173.20 2gj1 s PRO 212 N -4.27 2.55 0.39 1.29 0.02 -1.26 -4.04 135.00 129.67 2gj1 s PRO 212 Ca 0.66 1.39 -0.23 0.00 0.02 0.00 0.00 61.00 62.85 2gj1 s PRO 212 Cb -0.21 -1.92 -0.11 0.00 0.02 0.00 0.00 34.50 32.29 2gj1 s PRO 212 CO 0.46 -1.45 0.94 -0.06 -0.33 0.00 0.00 177.00 176.56 2gj1 s PHE 213 N -2.43 3.45 0.29 6.54 0.08 -1.26 0.31 117.98 124.95 2gj1 s PHE 213 Ca 0.67 1.66 -0.29 0.00 0.12 0.00 0.00 56.93 59.09 2gj1 s PHE 213 Cb -0.21 -2.87 -0.09 0.00 -0.57 0.00 0.00 43.02 39.28 2gj1 s PHE 213 CO 0.45 0.01 1.04 1.21 -0.10 0.00 0.00 175.22 177.83 2gj1 s ASN 214 N -1.98 7.31 0.28 1.36 2.47 0.86 -4.49 114.94 120.75 2gj1 s ASN 214 Ca 0.57 2.12 0.01 0.00 0.42 0.00 0.00 52.86 55.98 2gj1 s ASN 214 Cb -0.12 -2.61 0.42 0.00 -1.45 0.00 0.00 41.25 37.48 2gj1 s ASN 214 CO 0.17 -0.10 1.76 -1.13 -3.72 0.00 0.00 177.10 174.08 2gj1 h ASN 215 N 3.67 0.59 -3.61 -4.21 -0.73 -1.96 -3.45 115.58 105.89 2gj1 h ASN 215 Ca -0.46 -0.16 -0.53 0.00 1.87 0.00 0.00 56.30 57.02 2gj1 h ASN 215 Cb 1.21 -0.16 0.06 0.00 0.27 0.00 0.00 38.32 39.70 2gj1 h ASN 215 CO 0.66 0.74 0.71 -0.75 -0.37 0.00 0.00 177.43 178.42 2gj1 s LYS 216 N -4.76 4.30 -0.01 6.67 2.20 -1.26 -5.05 119.74 121.83 2gj1 s LYS 216 Ca -0.08 2.27 0.01 0.00 -0.36 0.00 0.00 55.97 57.82 2gj1 s LYS 216 Cb 0.14 -3.09 0.00 0.00 -1.51 0.00 0.00 37.83 33.38 2gj1 s LYS 216 CO 0.79 -0.33 -0.05 0.15 -0.36 0.00 0.00 175.35 175.56 2gj1 s LYS 217 N -1.01 0.47 0.44 4.03 1.02 -1.26 -3.93 119.74 119.50 2gj1 s LYS 217 Ca 0.55 -0.15 -0.24 0.00 0.02 0.00 0.00 55.97 56.14 2gj1 s LYS 217 Cb -0.41 -0.48 -0.08 0.00 -0.52 0.00 0.00 37.83 36.35 2gj1 s LYS 217 CO 0.48 0.07 1.22 -1.25 -0.92 0.00 0.00 175.35 174.95 2gj1 s PRO 218 N 0.12 3.82 -0.20 -1.68 0.04 -1.26 -5.17 135.00 130.67 2gj1 s PRO 218 Ca -0.01 1.94 -0.04 0.00 0.04 0.00 0.00 61.00 62.94 2gj1 s PRO 218 Cb -0.05 -2.55 -0.02 0.00 0.04 0.00 0.00 34.50 31.92 2gj1 s PRO 218 CO -0.00 -0.55 -0.03 0.45 0.04 0.00 0.00 177.00 176.91 2gj1 s SER 219 N -1.09 4.52 0.44 6.66 0.15 -1.25 -5.00 113.70 118.13 2gj1 s SER 219 Ca 0.61 -0.29 0.12 0.00 0.70 0.00 0.00 55.95 57.09 2gj1 s SER 219 Cb -0.33 -1.77 0.96 0.00 -1.71 0.00 0.00 66.02 63.18 2gj1 s SER 219 CO 0.41 0.04 2.00 -0.65 1.20 0.00 0.00 173.24 176.24 2gj1 h PRO 220 N 7.63 0.13 0.00 5.44 0.11 -1.91 -2.22 132.00 141.18 2gj1 h PRO 220 Ca -0.37 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.69 2gj1 h PRO 220 Cb 1.18 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 2gj1 h PRO 220 CO 0.60 0.23 -0.14 0.00 -0.21 0.00 0.00 178.00 178.48 2gj1 h GLU 222 N 0.00 0.33 -0.32 0.00 5.08 -1.40 -3.34 114.58 114.93 2gj1 h GLU 222 Ca -0.00 -0.57 -0.03 0.00 -1.00 0.00 0.00 59.36 57.76 2gj1 h GLU 222 Cb 1.00 0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 2gj1 h GLU 222 CO 0.02 1.27 0.08 0.35 -1.00 0.00 0.00 179.01 179.73 2gj1 h PHE 223 N 0.09 0.47 0.00 4.33 3.57 -1.34 -2.77 116.94 121.29 2gj1 h PHE 223 Ca -0.16 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.32 2gj1 h PHE 223 Cb 2.01 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 40.61 2gj1 h PHE 223 CO 0.08 0.41 0.00 -0.84 -2.23 0.00 0.00 178.31 175.73 2gj1 h ILE 224 N 0.46 0.00 -1.37 1.41 -0.00 -1.66 -3.36 117.51 112.99 2gj1 h ILE 224 Ca 0.11 -0.32 -0.16 0.00 -0.00 0.00 0.00 64.86 64.48 2gj1 h ILE 224 Cb 0.18 1.14 -0.24 0.00 -0.00 0.00 0.00 36.82 37.90 2gj1 h ILE 224 CO -0.00 0.00 -0.53 0.21 -0.00 0.00 0.00 178.15 177.83 2gj1 s ASN 225 N -4.52 -0.49 0.00 2.16 3.84 -1.06 -5.01 114.94 109.86 2gj1 s ASN 225 Ca 0.05 -0.91 0.15 0.00 0.21 0.00 0.00 52.86 52.35 2gj1 s ASN 225 Cb 0.10 1.44 0.74 0.00 -0.55 0.00 0.00 41.25 42.97 2gj1 s ASN 225 CO 0.45 -0.23 1.42 0.35 -2.79 0.00 0.00 177.10 176.31 2gj1 n THR 226 N 4.54 0.64 0.01 -5.21 -2.24 -1.13 -2.04 114.28 108.85 2gj1 n THR 226 Ca 0.10 0.16 -0.22 0.00 -2.27 0.00 0.00 64.05 61.82 2gj1 n THR 226 Cb 0.52 -0.91 -0.14 0.00 -2.10 0.00 0.00 70.33 67.70 2gj1 n THR 226 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2gj1 h THR 227 N 0.00 0.81 -0.11 4.28 2.02 -1.95 -3.36 112.91 114.60 2gj1 h THR 227 Ca 0.00 -2.37 -0.17 0.00 0.77 0.00 0.00 66.41 64.64 2gj1 h THR 227 Cb 0.16 2.57 -0.01 0.00 -1.74 0.00 0.00 68.15 69.13 2gj1 h THR 227 CO 0.00 0.78 -0.66 0.00 0.37 0.00 0.00 175.52 176.01 2gj1 h ALA 228 N -0.02 0.65 -6.50 6.16 0.00 -1.85 -3.47 119.26 114.23 2gj1 h ALA 228 Ca -0.37 -0.57 -0.50 0.00 0.00 0.00 0.00 54.91 53.47 2gj1 h ALA 228 Cb 1.90 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.59 2gj1 h ALA 228 CO 0.06 0.73 -0.91 0.54 0.00 0.00 0.00 179.25 179.67 2gj1 n ARG 229 N -3.88 -2.49 -3.76 0.00 1.74 -0.87 -4.95 116.66 102.44 2gj1 n ARG 229 Ca -0.04 0.38 -0.36 0.00 -0.77 0.00 0.00 57.85 57.05 2gj1 n ARG 229 Cb 0.66 -4.25 -0.12 0.00 -1.02 0.00 0.00 32.46 27.74 2gj1 n ARG 229 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2gj1 s VAL 230 N -3.84 4.47 0.85 1.55 1.01 -1.26 -4.97 120.40 118.20 2gj1 s VAL 230 Ca 0.14 -0.12 -0.12 0.00 0.00 0.00 0.00 61.98 61.88 2gj1 s VAL 230 Cb -0.06 -3.09 0.10 0.00 0.00 0.00 0.00 36.38 33.34 2gj1 s VAL 230 CO 0.89 0.34 1.11 -2.84 0.00 0.00 0.00 175.10 174.60 2gj1 s PRO 231 N 1.52 1.61 0.75 2.72 0.02 -1.26 -3.29 135.00 137.07 2gj1 s PRO 231 Ca 0.06 0.57 -0.12 0.00 0.02 0.00 0.00 61.00 61.53 2gj1 s PRO 231 Cb -0.15 -1.87 0.05 0.00 0.02 0.00 0.00 34.50 32.55 2gj1 s PRO 231 CO 0.04 -1.93 1.12 0.00 -0.33 0.00 0.00 177.00 175.90 2gj1 s PHE 233 N -2.58 3.52 -0.21 0.00 0.08 -1.26 -0.10 117.98 117.43 2gj1 s PHE 233 Ca 0.65 1.19 -0.06 0.00 0.12 0.00 0.00 56.93 58.84 2gj1 s PHE 233 Cb -0.20 -2.59 -0.03 0.00 -0.57 0.00 0.00 43.02 39.63 2gj1 s PHE 233 CO 0.50 -0.34 0.02 -1.17 -0.10 0.00 0.00 175.22 174.12 2gj1 s LEU 234 N -4.36 3.32 0.34 -0.37 2.96 0.15 -4.40 118.68 116.31 2gj1 s LEU 234 Ca 0.54 -0.20 0.01 0.00 -0.22 0.00 0.00 54.13 54.26 2gj1 s LEU 234 Cb -0.10 -1.85 -0.01 0.00 0.50 0.00 0.00 46.19 44.73 2gj1 s LEU 234 CO 0.39 0.04 0.42 0.00 -1.32 0.00 0.00 176.35 175.87 2gj1 s ALA 235 N 1.15 1.12 -0.02 5.97 0.00 -1.26 -4.31 121.76 124.41 2gj1 s ALA 235 Ca 0.03 -1.70 0.29 0.00 0.00 0.00 0.00 51.96 50.58 2gj1 s ALA 235 Cb -0.14 1.26 1.45 0.00 0.00 0.00 0.00 23.12 25.68 2gj1 s ALA 235 CO 0.02 -0.75 1.88 0.78 0.00 0.00 0.00 175.76 177.69 2gj1 h GLY 236 N 2.12 0.00 -4.72 0.00 0.00 -1.36 -3.41 103.07 95.69 2gj1 h GLY 236 Ca -0.27 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.54 2gj1 h GLY 236 CO 0.38 0.00 -0.82 -0.35 0.00 0.00 0.00 176.54 175.75 2gj1 s ASP 237 N -4.54 2.04 0.21 0.19 2.15 -0.95 -3.66 116.67 112.11 2gj1 s ASP 237 Ca -0.01 -0.43 0.25 0.00 0.43 0.00 0.00 52.55 52.79 2gj1 s ASP 237 Cb 0.09 -0.18 0.90 0.00 -0.30 0.00 0.00 42.92 43.43 2gj1 s ASP 237 CO 0.33 0.13 1.75 0.33 -0.17 0.00 0.00 175.17 177.54 2gj1 n PHE 238 N 2.13 0.79 0.82 -5.34 -0.00 -1.26 -3.27 117.46 111.33 2gj1 n PHE 238 Ca -0.17 0.26 0.12 0.00 -0.00 0.00 0.00 57.45 57.66 2gj1 n PHE 238 Cb 0.54 -0.92 0.26 0.00 -0.00 0.00 0.00 39.48 39.36 2gj1 n PHE 238 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 2gj1 n ARG 239 N -2.17 2.18 -0.46 -4.13 3.00 -1.26 -4.63 116.66 109.19 2gj1 n ARG 239 Ca 0.04 -1.77 0.38 0.00 -0.01 0.00 0.00 57.85 56.49 2gj1 n ARG 239 Cb 0.34 -1.47 0.67 0.00 0.00 0.00 0.00 32.46 32.00 2gj1 n ARG 239 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2gj1 h ALA 240 N 4.43 2.87 -0.44 7.54 0.00 -1.91 -0.13 119.26 131.62 2gj1 h ALA 240 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2gj1 h ALA 240 Cb 0.81 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2gj1 h ALA 240 CO 0.00 -1.46 0.00 0.43 0.00 0.00 0.00 179.25 178.22 2gj1 n SER 241 N -4.55 3.12 -0.31 0.00 7.64 -1.26 -2.58 113.62 115.67 2gj1 n SER 241 Ca 0.36 -1.95 0.16 0.00 1.01 0.00 0.00 58.87 58.45 2gj1 n SER 241 Cb 1.45 -0.29 0.40 0.00 -1.01 0.00 0.00 64.21 64.77 2gj1 n SER 241 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 2gj1 h GLU 242 N 3.80 0.59 -3.13 1.43 4.22 -1.36 -2.34 114.58 117.79 2gj1 h GLU 242 Ca 0.00 -0.04 -0.09 0.00 0.08 0.00 0.00 59.36 59.32 2gj1 h GLU 242 Cb 0.85 -0.13 -0.17 0.00 0.50 0.00 0.00 28.75 29.79 2gj1 h GLU 242 CO 0.00 0.39 -0.18 1.14 -2.18 0.00 0.00 179.01 178.18 2gj1 s GLN 243 N -5.67 0.84 0.33 1.92 1.03 -1.26 -1.63 119.66 115.22 2gj1 s GLN 243 Ca -0.10 -0.39 0.01 0.00 0.04 0.00 0.00 55.36 54.92 2gj1 s GLN 243 Cb 0.24 0.37 0.58 0.00 0.03 0.00 0.00 33.01 34.23 2gj1 s GLN 243 CO 0.80 -0.27 1.98 0.97 -2.54 0.00 0.00 175.29 176.22 2gj1 h ILE 244 N 3.21 1.15 0.00 3.63 2.10 -1.73 -1.95 117.51 123.92 2gj1 h ILE 244 Ca -0.31 -0.33 -0.07 0.00 1.08 0.00 0.00 64.86 65.23 2gj1 h ILE 244 Cb 1.20 0.11 -0.01 0.00 -1.09 0.00 0.00 36.82 37.03 2gj1 h ILE 244 CO 0.44 0.17 -0.34 -0.07 -1.08 0.00 0.00 178.15 177.27 2gj1 h LEU 245 N 0.95 0.00 -0.28 2.19 4.07 -1.95 -1.50 115.31 118.80 2gj1 h LEU 245 Ca 0.28 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 58.04 2gj1 h LEU 245 Cb -0.03 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.72 2gj1 h LEU 245 CO -0.07 0.34 -0.71 0.25 -1.08 0.00 0.00 178.44 177.17 2gj1 h LEU 246 N 0.00 0.81 -0.75 1.67 5.85 -1.64 -1.72 115.31 119.52 2gj1 h LEU 246 Ca -0.00 -0.50 -0.13 0.00 0.84 0.00 0.00 57.88 58.08 2gj1 h LEU 246 Cb 0.85 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 2gj1 h LEU 246 CO 0.04 1.28 -0.45 0.00 -0.34 0.00 0.00 178.44 178.98 2gj1 h ALA 247 N 0.71 0.92 0.27 1.25 0.00 -1.24 -2.35 119.26 118.81 2gj1 h ALA 247 Ca -0.03 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 2gj1 h ALA 247 Cb 1.32 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2gj1 h ALA 247 CO 0.14 0.64 -0.13 1.15 0.00 0.00 0.00 179.25 181.06 2gj1 h THR 248 N 0.33 0.75 -1.00 0.00 2.02 -1.18 -1.61 112.91 112.21 2gj1 h THR 248 Ca 0.02 -0.05 0.10 0.00 0.77 0.00 0.00 66.41 67.25 2gj1 h THR 248 Cb 0.92 0.78 -0.08 0.00 -1.74 0.00 0.00 68.15 68.03 2gj1 h THR 248 CO 0.08 0.01 0.64 0.00 0.37 0.00 0.00 175.52 176.62 2gj1 h ALA 249 N 0.34 1.46 -0.72 6.16 0.00 -1.15 -1.83 119.26 123.53 2gj1 h ALA 249 Ca -0.04 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2gj1 h ALA 249 Cb 0.30 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2gj1 h ALA 249 CO 0.06 0.31 0.33 0.45 0.00 0.00 0.00 179.25 180.40 2gj1 h HIS 250 N 1.07 1.04 -0.38 0.00 3.86 -1.20 -2.74 115.15 116.80 2gj1 h HIS 250 Ca 0.47 -0.05 -0.03 0.00 -1.16 0.00 0.00 60.37 59.60 2gj1 h HIS 250 Cb 0.36 -0.32 -0.02 0.00 1.06 0.00 0.00 27.41 28.49 2gj1 h HIS 250 CO -0.00 0.77 0.13 1.15 0.86 0.00 0.00 177.93 180.83 2gj1 h THR 251 N 1.03 1.21 -0.66 2.45 2.02 -0.48 -1.80 112.91 116.69 2gj1 h THR 251 Ca 0.25 -0.68 0.08 0.00 0.77 0.00 0.00 66.41 66.83 2gj1 h THR 251 Cb 0.14 0.93 -0.07 0.00 -1.74 0.00 0.00 68.15 67.41 2gj1 h THR 251 CO -0.03 0.24 0.32 -0.07 0.37 0.00 0.00 175.52 176.35 2gj1 h LEU 252 N 0.47 0.41 -0.59 2.58 4.07 -1.19 -0.83 115.31 120.24 2gj1 h LEU 252 Ca 0.12 0.06 -0.14 0.00 0.08 0.00 0.00 57.88 58.00 2gj1 h LEU 252 Cb 0.24 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 41.96 2gj1 h LEU 252 CO -0.01 0.24 -0.39 -0.07 -1.08 0.00 0.00 178.44 177.14 2gj1 h LEU 253 N 0.56 0.74 -0.51 1.67 3.38 -1.32 -0.64 115.31 119.19 2gj1 h LEU 253 Ca 0.32 -0.33 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2gj1 h LEU 253 Cb 0.32 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2gj1 h LEU 253 CO -0.25 1.04 0.14 0.25 0.09 0.00 0.00 178.44 179.70 2gj1 h LEU 254 N 0.57 0.76 -0.77 1.67 5.85 -1.08 -2.16 115.31 120.15 2gj1 h LEU 254 Ca 0.05 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.52 2gj1 h LEU 254 Cb 0.92 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.71 2gj1 h LEU 254 CO 0.08 0.78 0.39 0.03 -0.34 0.00 0.00 178.44 179.38 2gj1 h ARG 255 N 0.69 1.10 -0.72 1.25 3.08 -0.92 -2.89 114.38 115.98 2gj1 h ARG 255 Ca 0.16 -0.15 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 2gj1 h ARG 255 Cb 0.31 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 2gj1 h ARG 255 CO -0.00 0.84 0.29 1.49 -1.07 0.00 0.00 179.97 181.52 2gj1 h GLU 256 N 1.08 1.07 -0.09 0.04 4.57 -0.87 -0.88 114.58 119.50 2gj1 h GLU 256 Ca 0.27 -0.18 0.01 0.00 -1.18 0.00 0.00 59.36 58.27 2gj1 h GLU 256 Cb 0.09 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.49 2gj1 h GLU 256 CO -0.04 0.87 0.04 1.25 -1.18 0.00 0.00 179.01 179.95 2gj1 h HIS 257 N 1.05 0.07 -0.72 0.92 2.76 -1.20 -0.23 115.15 117.79 2gj1 h HIS 257 Ca 0.24 0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.36 2gj1 h HIS 257 Cb 0.20 -0.02 -0.03 0.00 1.55 0.00 0.00 27.41 29.11 2gj1 h HIS 257 CO 0.02 0.04 0.22 -0.91 -1.30 0.00 0.00 177.93 175.99 2gj1 h ASN 258 N 0.08 1.04 0.27 3.26 2.35 -1.31 -0.39 115.58 120.89 2gj1 h ASN 258 Ca 0.04 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.59 2gj1 h ASN 258 Cb 0.01 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.08 2gj1 h ASN 258 CO -0.03 0.97 -0.32 -0.09 -1.65 0.00 0.00 177.43 176.31 2gj1 h ARG 259 N 1.07 -0.62 -0.54 0.81 2.43 -0.98 -2.23 114.38 114.32 2gj1 h ARG 259 Ca 0.23 0.04 0.08 0.00 -0.81 0.00 0.00 59.98 59.53 2gj1 h ARG 259 Cb 0.31 0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 29.93 2gj1 h ARG 259 CO -0.01 -0.41 0.17 -0.07 -1.51 0.00 0.00 179.97 178.14 2gj1 h LEU 260 N -0.64 0.13 -1.15 3.80 4.07 -0.83 -2.18 115.31 118.52 2gj1 h LEU 260 Ca -0.01 0.08 -0.06 0.00 0.08 0.00 0.00 57.88 57.98 2gj1 h LEU 260 Cb 0.60 0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.40 2gj1 h LEU 260 CO -0.09 0.10 -0.00 0.00 -1.08 0.00 0.00 178.44 177.36 2gj1 h ALA 261 N 1.38 1.30 0.00 1.53 0.00 -0.88 -1.04 119.26 121.56 2gj1 h ALA 261 Ca 0.27 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 2gj1 h ALA 261 Cb 0.33 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2gj1 h ALA 261 CO -0.29 0.47 -0.70 0.07 0.00 0.00 0.00 179.25 178.80 2gj1 h ARG 262 N 0.56 0.00 0.00 0.00 0.11 -1.16 -2.69 114.38 111.19 2gj1 h ARG 262 Ca 0.12 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 60.07 2gj1 h ARG 262 Cb 0.36 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.43 2gj1 h ARG 262 CO 0.01 0.22 -0.62 0.93 0.10 0.00 0.00 179.97 180.62 2gj1 h GLU 263 N 0.00 0.00 0.00 0.08 4.39 -1.17 -2.84 114.58 115.04 2gj1 h GLU 263 Ca -0.04 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.53 2gj1 h GLU 263 Cb 1.25 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.88 2gj1 h GLU 263 CO 0.03 0.62 -0.64 -0.07 -1.16 0.00 0.00 179.01 177.79 2gj1 h LEU 264 N 0.00 0.00 -0.38 1.33 3.38 -1.17 -3.13 115.31 115.34 2gj1 h LEU 264 Ca -0.01 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 2gj1 h LEU 264 Cb 1.24 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 2gj1 h LEU 264 CO 0.08 0.64 -0.49 0.50 0.09 0.00 0.00 178.44 179.26 2gj1 h LYS 265 N 0.00 0.84 -0.85 1.13 1.63 -1.41 -0.07 116.57 117.84 2gj1 h LYS 265 Ca -0.01 -0.50 0.02 0.00 -0.85 0.00 0.00 60.65 59.32 2gj1 h LYS 265 Cb 1.45 0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 33.08 2gj1 h LYS 265 CO 0.08 1.13 0.56 0.87 -3.45 0.00 0.00 179.45 178.64 2gj1 h LYS 266 N 0.66 1.08 0.07 1.90 1.57 -1.50 -2.51 116.57 117.85 2gj1 h LYS 266 Ca 0.03 -0.06 -0.25 0.00 -1.87 0.00 0.00 60.65 58.50 2gj1 h LYS 266 Cb 1.08 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.14 2gj1 h LYS 266 CO 0.11 0.71 -1.12 -0.07 -0.57 0.00 0.00 179.45 178.51 2gj1 h LEU 267 N 1.11 0.31 -6.49 2.94 3.38 -1.49 -3.40 115.31 111.67 2gj1 h LEU 267 Ca 0.33 -0.32 -0.60 0.00 0.09 0.00 0.00 57.88 57.39 2gj1 h LEU 267 Cb -0.06 -0.10 -0.40 0.00 0.09 0.00 0.00 40.66 40.19 2gj1 h LEU 267 CO -0.09 1.22 -0.82 0.59 0.09 0.00 0.00 178.44 179.42 2gj1 n ASN 268 N -3.52 1.30 0.33 -0.43 3.02 -0.05 -4.66 115.26 111.25 2gj1 n ASN 268 Ca -0.06 -2.84 0.22 0.00 -0.03 0.00 0.00 54.58 51.88 2gj1 n ASN 268 Cb 0.96 -0.65 1.16 0.00 -0.61 0.00 0.00 39.78 40.65 2gj1 n ASN 268 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2gj1 h PRO 269 N 5.06 0.00 0.00 3.52 0.11 -1.67 -2.18 132.00 136.83 2gj1 h PRO 269 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 2gj1 h PRO 269 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 2gj1 h PRO 269 CO 0.56 0.00 -0.38 1.12 -0.21 0.00 0.00 178.00 179.09 2gj1 h HIS 270 N 0.00 0.00 -3.53 0.65 2.07 -1.93 -3.47 115.15 108.94 2gj1 h HIS 270 Ca -0.00 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 56.99 2gj1 h HIS 270 Cb 0.05 0.00 0.09 0.00 2.57 0.00 0.00 27.41 30.11 2gj1 h HIS 270 CO 0.00 0.00 0.84 -1.58 -3.07 0.00 0.00 177.93 174.12 2gj1 s TRP 271 N -3.23 2.73 0.86 6.12 0.52 -0.82 -5.01 118.94 120.12 2gj1 s TRP 271 Ca 0.05 0.94 -0.12 0.00 0.02 0.00 0.00 56.10 56.99 2gj1 s TRP 271 Cb 0.09 -4.02 0.14 0.00 -1.15 0.00 0.00 33.47 28.53 2gj1 s TRP 271 CO 0.70 -3.28 1.21 0.54 0.02 0.00 0.00 176.95 176.14 2gj1 s ASN 272 N 0.26 3.83 0.22 2.95 2.20 -1.26 -4.87 114.94 118.28 2gj1 s ASN 272 Ca 0.59 0.36 -0.08 0.00 -0.94 0.00 0.00 52.86 52.79 2gj1 s ASN 272 Cb -0.47 -0.63 0.27 0.00 -2.00 0.00 0.00 41.25 38.41 2gj1 s ASN 272 CO 0.52 -2.28 1.84 1.23 -2.94 0.00 0.00 177.10 175.47 2gj1 h GLY 273 N -1.24 1.12 1.00 0.45 0.00 -1.89 -1.51 103.07 101.00 2gj1 h GLY 273 Ca -0.44 -0.33 -0.02 0.00 0.00 0.00 0.00 47.33 46.54 2gj1 h GLY 273 CO 0.48 0.23 0.31 -2.09 0.00 0.00 0.00 176.54 175.48 2gj1 h GLU 274 N 0.85 0.91 -0.21 4.80 4.57 -1.94 -1.44 114.58 122.11 2gj1 h GLU 274 Ca 0.33 -0.13 -0.12 0.00 -1.18 0.00 0.00 59.36 58.25 2gj1 h GLU 274 Cb 0.14 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 2gj1 h GLU 274 CO -0.16 0.72 -0.39 -0.22 -1.18 0.00 0.00 179.01 177.78 2gj1 h LYS 275 N 0.87 0.49 -0.62 1.92 3.64 -1.84 -1.26 116.57 119.77 2gj1 h LYS 275 Ca 0.22 -0.24 -0.09 0.00 -1.27 0.00 0.00 60.65 59.27 2gj1 h LYS 275 Cb 0.11 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 2gj1 h LYS 275 CO -0.03 0.80 0.03 -0.07 -2.27 0.00 0.00 179.45 177.91 2gj1 h LEU 276 N 0.41 1.06 0.19 5.20 -0.00 -1.06 -1.48 115.31 119.62 2gj1 h LEU 276 Ca 0.04 -0.30 -0.01 0.00 -0.00 0.00 0.00 57.88 57.61 2gj1 h LEU 276 Cb 0.87 -0.28 0.00 0.00 -0.00 0.00 0.00 40.66 41.25 2gj1 h LEU 276 CO 0.07 1.09 -0.09 0.22 -0.00 0.00 0.00 178.44 179.74 2gj1 h TYR 277 N 0.99 -0.23 -0.75 1.13 3.20 -0.97 -1.66 116.97 118.67 2gj1 h TYR 277 Ca 0.18 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.00 2gj1 h TYR 277 Cb 0.54 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.85 2gj1 h TYR 277 CO 0.04 -0.02 0.28 1.96 -1.64 0.00 0.00 178.16 178.78 2gj1 h GLN 278 N -0.41 1.14 -0.36 1.82 1.08 -1.23 0.31 115.11 117.46 2gj1 h GLN 278 Ca -0.03 -0.22 -0.14 0.00 -1.45 0.00 0.00 58.65 56.82 2gj1 h GLN 278 Cb 0.32 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.56 2gj1 h GLN 278 CO 0.04 0.94 -0.32 0.93 -0.95 0.00 0.00 178.83 179.47 2gj1 h GLU 279 N 1.09 0.85 -0.47 1.46 4.39 -1.26 -0.05 114.58 120.60 2gj1 h GLU 279 Ca 0.25 -0.44 -0.03 0.00 0.34 0.00 0.00 59.36 59.48 2gj1 h GLU 279 Cb 0.24 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.88 2gj1 h GLU 279 CO -0.02 1.08 0.19 0.00 -1.16 0.00 0.00 179.01 179.10 2gj1 h ALA 280 N 0.76 0.61 -0.26 3.43 0.00 -1.17 -2.60 119.26 120.03 2gj1 h ALA 280 Ca 0.06 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.87 2gj1 h ALA 280 Cb 0.91 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 2gj1 h ALA 280 CO 0.08 0.22 -0.00 -0.09 0.00 0.00 0.00 179.25 179.46 2gj1 h ARG 281 N 0.62 0.07 -0.92 0.00 2.43 -0.78 -1.26 114.38 114.54 2gj1 h ARG 281 Ca 0.16 -0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.35 2gj1 h ARG 281 Cb 0.19 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.68 2gj1 h ARG 281 CO -0.01 0.05 0.60 -0.22 -1.51 0.00 0.00 179.97 178.88 2gj1 h LYS 282 N 0.07 1.16 -0.19 0.20 3.64 -0.96 -1.57 116.57 118.93 2gj1 h LYS 282 Ca 0.12 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.38 2gj1 h LYS 282 Cb 0.16 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 2gj1 h LYS 282 CO -0.21 0.77 -0.07 0.82 -2.27 0.00 0.00 179.45 178.49 2gj1 h ILE 283 N 1.20 1.30 -0.82 2.00 2.04 -1.12 -2.53 117.51 119.58 2gj1 h ILE 283 Ca 0.35 -1.10 0.05 0.00 1.00 0.00 0.00 64.86 65.16 2gj1 h ILE 283 Cb -0.06 1.64 -0.06 0.00 -0.74 0.00 0.00 36.82 37.60 2gj1 h ILE 283 CO -0.10 0.33 0.51 0.25 0.00 0.00 0.00 178.15 179.14 2gj1 h LEU 284 N 0.08 0.81 -0.97 1.44 5.85 -0.99 -0.92 115.31 120.61 2gj1 h LEU 284 Ca 0.04 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.71 2gj1 h LEU 284 Cb 0.54 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 2gj1 h LEU 284 CO 0.02 0.53 0.03 1.23 -0.34 0.00 0.00 178.44 179.92 2gj1 h GLY 285 N 0.95 0.84 1.45 3.75 0.00 -1.27 -1.74 103.07 107.05 2gj1 h GLY 285 Ca 0.35 -0.53 -0.10 0.00 0.00 0.00 0.00 47.33 47.05 2gj1 h GLY 285 CO -0.15 0.49 -0.22 0.00 0.00 0.00 0.00 176.54 176.66 2gj1 h ALA 286 N 1.30 1.00 -0.07 3.60 0.00 -0.97 -2.49 119.26 121.64 2gj1 h ALA 286 Ca 0.15 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 2gj1 h ALA 286 Cb 0.40 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2gj1 h ALA 286 CO 0.01 0.59 0.04 0.35 0.00 0.00 0.00 179.25 180.24 2gj1 h PHE 287 N 0.56 0.10 -0.58 0.00 3.57 -0.47 -1.14 116.94 118.98 2gj1 h PHE 287 Ca 0.08 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.62 2gj1 h PHE 287 Cb 0.68 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.35 2gj1 h PHE 287 CO 0.03 0.16 0.34 0.82 -2.23 0.00 0.00 178.31 177.42 2gj1 h ILE 288 N 0.01 1.02 -0.57 1.41 1.08 -1.23 -1.26 117.51 117.97 2gj1 h ILE 288 Ca 0.02 -0.22 0.01 0.00 -0.39 0.00 0.00 64.86 64.28 2gj1 h ILE 288 Cb 0.10 0.31 -0.03 0.00 -3.07 0.00 0.00 36.82 34.13 2gj1 h ILE 288 CO -0.00 0.12 0.37 1.56 -0.69 0.00 0.00 178.15 179.51 2gj1 h GLN 289 N 0.66 0.74 0.11 2.37 4.20 -1.32 -1.21 115.11 120.64 2gj1 h GLN 289 Ca 0.24 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.90 2gj1 h GLN 289 Cb 0.08 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.69 2gj1 h GLN 289 CO -0.13 0.49 -0.05 0.82 -0.67 0.00 0.00 178.83 179.29 2gj1 h ILE 290 N 0.76 1.10 -0.53 2.54 2.04 -0.80 -1.19 117.51 121.43 2gj1 h ILE 290 Ca 0.22 -0.90 0.07 0.00 1.00 0.00 0.00 64.86 65.25 2gj1 h ILE 290 Cb -0.07 1.66 -0.06 0.00 -0.74 0.00 0.00 36.82 37.61 2gj1 h ILE 290 CO -0.06 0.21 0.20 0.40 0.00 0.00 0.00 178.15 178.90 2gj1 h ILE 291 N -0.57 0.83 -0.18 -0.67 1.08 -1.24 0.59 117.51 117.35 2gj1 h ILE 291 Ca -0.01 -0.13 -0.00 0.00 -0.39 0.00 0.00 64.86 64.32 2gj1 h ILE 291 Cb 0.46 0.41 -0.01 0.00 -3.07 0.00 0.00 36.82 34.61 2gj1 h ILE 291 CO 0.02 0.07 0.11 0.74 -0.69 0.00 0.00 178.15 178.40 2gj1 h THR 292 N 0.38 1.08 0.01 -0.27 2.02 -1.15 -0.86 112.91 114.13 2gj1 h THR 292 Ca 0.25 -0.20 -0.26 0.00 0.77 0.00 0.00 66.41 66.97 2gj1 h THR 292 Cb 0.27 0.89 -0.04 0.00 -1.74 0.00 0.00 68.15 67.54 2gj1 h THR 292 CO -0.25 0.08 -1.42 -0.26 0.37 0.00 0.00 175.52 174.04 2gj1 h PHE 293 N 0.21 0.05 0.09 3.16 -1.00 -0.96 -0.20 116.94 118.29 2gj1 h PHE 293 Ca 0.06 -0.04 -0.29 0.00 2.81 0.00 0.00 57.97 60.52 2gj1 h PHE 293 Cb 0.03 -0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.57 2gj1 h PHE 293 CO -0.05 1.05 -1.55 -0.09 -1.61 0.00 0.00 178.31 176.06 2gj1 h ARG 294 N 0.01 0.19 0.02 1.51 2.43 -0.96 -3.41 114.38 114.16 2gj1 h ARG 294 Ca -0.17 -0.32 -0.39 0.00 -0.81 0.00 0.00 59.98 58.28 2gj1 h ARG 294 Cb 1.92 0.12 -0.06 0.00 -0.42 0.00 0.00 29.97 31.53 2gj1 h ARG 294 CO 0.11 1.15 -2.36 -0.25 -1.51 0.00 0.00 179.97 177.11 2gj1 n ASP 295 N -3.92 2.00 -0.09 -3.80 8.00 -0.42 -4.68 116.55 113.63 2gj1 n ASP 295 Ca -0.29 0.02 -0.17 0.00 0.71 0.00 0.00 54.79 55.07 2gj1 n ASP 295 Cb 0.89 -0.58 -0.10 0.00 -0.02 0.00 0.00 41.12 41.31 2gj1 n ASP 295 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2gj1 h TYR 296 N -0.19 0.00 -0.93 1.24 3.20 -1.20 -3.38 116.97 115.70 2gj1 h TYR 296 Ca -0.57 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.32 2gj1 h TYR 296 Cb 1.85 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 40.07 2gj1 h TYR 296 CO 0.02 1.11 0.61 -0.07 -1.64 0.00 0.00 178.16 178.20 2gj1 h LEU 297 N -1.00 1.05 -2.13 2.82 3.38 -1.27 -2.27 115.31 115.89 2gj1 h LEU 297 Ca -0.20 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.76 2gj1 h LEU 297 Cb 1.06 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 2gj1 h LEU 297 CO -0.12 0.74 0.03 -0.65 0.09 0.00 0.00 178.44 178.54 2gj1 h PRO 298 N 1.23 0.00 -0.02 1.13 0.11 -1.79 0.80 132.00 133.45 2gj1 h PRO 298 Ca 0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.46 2gj1 h PRO 298 Cb -0.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.02 2gj1 h PRO 298 CO -0.09 0.00 -0.04 0.44 -0.21 0.00 0.00 178.00 178.10 2gj1 n ILE 299 N -4.31 0.00 -0.11 4.15 -5.35 -0.88 -1.60 119.36 111.25 2gj1 n ILE 299 Ca -0.02 -0.38 -0.21 0.00 -0.27 0.00 0.00 62.75 61.87 2gj1 n ILE 299 Cb 0.13 1.08 -0.08 0.00 -1.74 0.00 0.00 39.64 39.02 2gj1 n ILE 299 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 2gj1 n VAL 300 N 0.76 1.51 0.14 7.28 0.31 -0.76 -4.02 118.33 123.55 2gj1 n VAL 300 Ca 0.15 -0.11 0.01 0.00 -0.01 0.00 0.00 64.34 64.38 2gj1 n VAL 300 Cb 0.49 -2.07 0.13 0.00 -0.91 0.00 0.00 33.84 31.49 2gj1 n VAL 300 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2gj1 h LEU 301 N -1.00 0.00 0.00 7.52 4.07 -1.01 0.92 115.31 125.81 2gj1 h LEU 301 Ca -0.40 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.56 2gj1 h LEU 301 Cb 1.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.03 2gj1 h LEU 301 CO -0.24 0.57 0.00 0.61 -1.08 0.00 0.00 178.44 178.30 2gj1 n GLY 302 N 0.74 3.65 0.00 0.83 0.00 -0.63 -1.94 105.19 107.85 2gj1 n GLY 302 Ca 0.00 -0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.05 2gj1 n GLY 302 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gj1 n SER 304 N 5.25 0.00 0.08 1.61 3.41 -0.41 -2.19 113.62 121.38 2gj1 n SER 304 Ca 0.00 0.44 0.13 0.00 -0.26 0.00 0.00 58.87 59.18 2gj1 n SER 304 Cb 0.00 -0.47 0.34 0.00 -0.26 0.00 0.00 64.21 63.81 2gj1 n SER 304 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2gj1 n GLU 305 N -1.47 0.26 -0.16 4.33 -0.58 -0.82 -4.29 120.64 117.90 2gj1 n GLU 305 Ca 0.05 0.16 -0.04 0.00 -0.42 0.00 0.00 57.16 56.91 2gj1 n GLU 305 Cb 0.21 -1.75 0.03 0.00 -0.57 0.00 0.00 31.44 29.35 2gj1 n GLU 305 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 2gj1 h MET 306 N 0.00 -0.10 -0.77 3.49 4.05 -1.53 -2.21 114.93 117.87 2gj1 h MET 306 Ca 0.00 0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 59.39 2gj1 h MET 306 Cb 0.73 0.02 -0.04 0.00 -0.80 0.00 0.00 31.60 31.51 2gj1 h MET 306 CO 0.00 -0.06 0.34 1.96 0.23 0.00 0.00 176.91 179.37 2gj1 h GLN 307 N -0.10 1.13 -0.92 0.39 4.20 -1.77 0.74 115.11 118.77 2gj1 h GLN 307 Ca 0.24 -0.18 0.03 0.00 0.06 0.00 0.00 58.65 58.80 2gj1 h GLN 307 Cb 0.47 -0.20 -0.05 0.00 0.30 0.00 0.00 27.48 28.00 2gj1 h GLN 307 CO -0.57 0.89 0.60 -0.22 -0.67 0.00 0.00 178.83 178.86 2gj1 h LYS 308 N 1.11 1.13 0.00 1.46 3.64 -1.65 -3.30 116.57 118.97 2gj1 h LYS 308 Ca 0.26 -0.07 -0.27 0.00 -1.27 0.00 0.00 60.65 59.30 2gj1 h LYS 308 Cb 0.16 -0.26 -0.05 0.00 -0.41 0.00 0.00 32.23 31.68 2gj1 h LYS 308 CO -0.03 0.75 -2.18 0.91 -2.27 0.00 0.00 179.45 176.63 2gj1 n TRP 309 N -4.44 0.00 -3.75 1.91 7.02 -1.05 -4.80 117.44 112.34 2gj1 n TRP 309 Ca 0.12 0.00 -0.29 0.00 -1.02 0.00 0.00 57.50 56.31 2gj1 n TRP 309 Cb 0.09 -0.82 -0.13 0.00 -2.42 0.00 0.00 31.31 28.04 2gj1 n TRP 309 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 2gj1 s ILE 310 N -2.61 1.75 0.81 -0.99 1.01 0.23 -4.67 121.20 116.73 2gj1 s ILE 310 Ca -0.09 -3.00 -0.11 0.00 0.00 0.00 0.00 60.65 57.45 2gj1 s ILE 310 Cb 0.07 -2.20 0.08 0.00 0.01 0.00 0.00 42.46 40.41 2gj1 s ILE 310 CO 0.76 -0.94 1.10 -2.16 0.00 0.00 0.00 174.94 173.70 2gj1 s PRO 311 N -0.11 2.00 0.44 2.79 0.04 -1.25 -4.42 135.00 134.50 2gj1 s PRO 311 Ca 0.20 0.66 -0.25 0.00 0.04 0.00 0.00 61.00 61.66 2gj1 s PRO 311 Cb -0.18 -1.91 -0.09 0.00 0.04 0.00 0.00 34.50 32.36 2gj1 s PRO 311 CO -0.05 -1.68 1.23 -2.30 0.04 0.00 0.00 177.00 174.23 2gj1 n PRO 312 N -3.48 1.78 -1.69 0.56 -0.02 -1.26 -4.87 135.00 126.02 2gj1 n PRO 312 Ca 0.07 0.64 -0.44 0.00 -2.02 0.00 0.00 63.50 61.75 2gj1 n PRO 312 Cb 0.56 -2.34 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 2gj1 n PRO 312 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 2gj1 n TYR 313 N -0.37 2.33 -0.03 6.00 9.36 -1.26 -4.92 117.16 128.27 2gj1 n TYR 313 Ca 0.08 0.37 0.00 0.00 3.32 0.00 0.00 57.90 61.67 2gj1 n TYR 313 Cb 0.40 -2.50 0.00 0.00 -0.63 0.00 0.00 39.34 36.61 2gj1 n TYR 313 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 2gj1 n GLN 314 N 2.22 2.24 0.00 2.98 6.02 -1.26 -5.12 117.38 124.46 2gj1 n GLN 314 Ca 0.11 -1.30 0.00 0.00 -0.01 0.00 0.00 57.00 55.81 2gj1 n GLN 314 Cb 0.32 -0.98 0.00 0.00 1.02 0.00 0.00 30.24 30.60 2gj1 n GLN 314 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2gj1 n GLY 315 N -0.40 2.14 3.72 1.08 0.00 -1.26 -5.03 105.19 105.45 2gj1 n GLY 315 Ca 0.00 -2.08 -0.42 0.00 0.00 0.00 0.00 46.02 43.53 2gj1 n GLY 315 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2gj1 s TYR 316 N -2.10 3.22 -0.36 1.61 5.04 -1.26 -4.89 117.35 118.60 2gj1 s TYR 316 Ca 0.00 0.99 -0.00 0.00 -2.44 0.00 0.00 57.07 55.62 2gj1 s TYR 316 Cb 0.00 -3.70 0.09 0.00 0.35 0.00 0.00 41.96 38.71 2gj1 s TYR 316 CO 0.00 -2.38 0.11 1.21 -1.34 0.00 0.00 175.55 173.14 2gj1 s ASN 317 N 0.88 5.00 0.00 4.32 3.84 -0.27 -4.99 114.94 123.73 2gj1 s ASN 317 Ca 0.63 -1.91 0.12 0.00 0.21 0.00 0.00 52.86 51.91 2gj1 s ASN 317 Cb -0.38 -1.73 0.60 0.00 -0.55 0.00 0.00 41.25 39.19 2gj1 s ASN 317 CO 0.33 -0.43 1.27 -0.46 -2.79 0.00 0.00 177.10 175.03 2gj1 n ASN 318 N 4.48 0.00 -0.29 -4.21 2.04 -1.26 -2.05 115.26 113.96 2gj1 n ASN 318 Ca -0.03 0.10 0.11 0.00 -0.44 0.00 0.00 54.58 54.32 2gj1 n ASN 318 Cb 0.42 -0.27 0.06 0.00 -2.53 0.00 0.00 39.78 37.46 2gj1 n ASN 318 CO 0.00 0.00 0.00 -1.20 -0.44 0.00 0.00 177.26 175.62 2gj1 n SER 319 N -1.27 1.48 -4.75 0.53 7.64 -1.26 -4.92 113.62 111.06 2gj1 n SER 319 Ca 0.06 -1.18 -0.40 0.00 1.01 0.00 0.00 58.87 58.36 2gj1 n SER 319 Cb 0.09 0.51 -0.05 0.00 -1.01 0.00 0.00 64.21 63.75 2gj1 n SER 319 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2gj1 s VAL 320 N -2.64 4.54 -0.47 0.44 1.01 -0.87 -5.03 120.40 117.37 2gj1 s VAL 320 Ca 0.17 1.76 -0.26 0.00 0.00 0.00 0.00 61.98 63.64 2gj1 s VAL 320 Cb 0.18 -4.17 0.03 0.00 0.00 0.00 0.00 36.38 32.41 2gj1 s VAL 320 CO 0.64 0.41 0.99 -0.62 0.00 0.00 0.00 175.10 176.53 2gj1 s ASP 321 N -0.44 6.53 0.00 3.32 2.15 -1.26 -4.68 116.67 122.29 2gj1 s ASP 321 Ca 0.39 0.20 0.29 0.00 0.43 0.00 0.00 52.55 53.86 2gj1 s ASP 321 Cb -0.22 -2.48 1.28 0.00 -0.30 0.00 0.00 42.92 41.20 2gj1 s ASP 321 CO 0.26 -1.13 1.93 -0.81 -0.17 0.00 0.00 175.17 175.25 2gj1 n PRO 322 N 7.41 0.20 -1.97 4.34 -0.04 -1.26 -4.71 135.00 138.97 2gj1 n PRO 322 Ca 0.08 -0.02 -0.40 0.00 -0.04 0.00 0.00 63.50 63.12 2gj1 n PRO 322 Cb 0.49 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.45 2gj1 n PRO 322 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2gj1 s ARG 323 N -2.81 3.95 0.17 0.54 0.52 -1.26 -4.58 118.95 115.48 2gj1 s ARG 323 Ca 0.20 2.28 -0.30 0.00 -0.52 0.00 0.00 55.73 57.38 2gj1 s ARG 323 Cb 0.19 -2.79 -0.08 0.00 0.52 0.00 0.00 34.95 32.80 2gj1 s ARG 323 CO 0.51 -0.55 1.27 0.42 0.02 0.00 0.00 175.30 176.97 2gj1 s ILE 324 N -1.22 3.42 0.46 1.52 -1.09 -1.26 -4.81 121.20 118.22 2gj1 s ILE 324 Ca 0.57 1.14 -0.10 0.00 -2.23 0.00 0.00 60.65 60.03 2gj1 s ILE 324 Cb -0.41 -3.73 -0.06 0.00 -1.58 0.00 0.00 42.46 36.69 2gj1 s ILE 324 CO 0.53 0.16 0.83 -0.94 -1.23 0.00 0.00 174.94 174.29 2gj1 s SER 325 N 0.42 6.44 0.15 3.58 1.04 -1.26 -1.78 113.70 122.29 2gj1 s SER 325 Ca 0.56 1.17 -0.17 0.00 0.48 0.00 0.00 55.95 58.00 2gj1 s SER 325 Cb -0.35 -2.34 0.03 0.00 0.10 0.00 0.00 66.02 63.46 2gj1 s SER 325 CO 0.36 -0.52 1.77 -1.13 0.98 0.00 0.00 173.24 174.70 2gj1 h ASN 326 N 0.78 0.22 -0.36 7.02 -0.73 -1.08 -2.89 115.58 118.55 2gj1 h ASN 326 Ca -0.47 0.02 -0.01 0.00 1.87 0.00 0.00 56.30 57.72 2gj1 h ASN 326 Cb 1.19 -0.02 -0.02 0.00 0.27 0.00 0.00 38.32 39.74 2gj1 h ASN 326 CO 0.63 0.17 0.20 1.62 -0.37 0.00 0.00 177.43 179.68 2gj1 h VAL 327 N 0.33 1.13 -0.88 2.57 3.04 -1.94 -2.23 116.25 118.27 2gj1 h VAL 327 Ca 0.15 -0.34 0.09 0.00 -1.01 0.00 0.00 66.70 65.59 2gj1 h VAL 327 Cb 0.07 0.61 -0.07 0.00 -2.01 0.00 0.00 31.29 29.89 2gj1 h VAL 327 CO -0.11 0.14 0.53 0.15 -1.01 0.00 0.00 177.57 177.26 2gj1 h PHE 328 N 0.54 0.96 0.00 3.17 3.57 -1.87 0.56 116.94 123.87 2gj1 h PHE 328 Ca 0.14 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.67 2gj1 h PHE 328 Cb 0.03 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.47 2gj1 h PHE 328 CO 0.00 0.42 0.00 1.79 -2.23 0.00 0.00 178.31 178.29 2gj1 h THR 329 N 0.89 0.00 0.00 4.41 1.35 -1.43 0.14 112.91 118.27 2gj1 h THR 329 Ca 0.41 -0.06 -0.37 0.00 -0.55 0.00 0.00 66.41 65.84 2gj1 h THR 329 Cb 0.34 0.71 -0.07 0.00 -1.73 0.00 0.00 68.15 67.40 2gj1 h THR 329 CO -0.23 0.00 -2.39 0.49 -0.25 0.00 0.00 175.52 173.14 2gj1 n PHE 330 N -2.47 0.01 -0.20 4.73 3.01 -0.34 -4.29 117.46 117.92 2gj1 n PHE 330 Ca -0.01 0.01 -0.10 0.00 1.01 0.00 0.00 57.45 58.36 2gj1 n PHE 330 Cb 0.08 -1.00 0.02 0.00 -0.01 0.00 0.00 39.48 38.57 2gj1 n PHE 330 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2gj1 h ALA 331 N 0.94 0.78 0.00 4.37 0.00 0.01 -2.46 119.26 122.91 2gj1 h ALA 331 Ca -0.55 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.04 2gj1 h ALA 331 Cb 2.23 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.81 2gj1 h ALA 331 CO 0.02 0.63 0.00 0.34 0.00 0.00 0.00 179.25 180.24 2gj1 n PHE 332 N -4.20 0.00 1.78 0.00 -0.00 -0.05 -2.55 117.46 112.42 2gj1 n PHE 332 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.47 2gj1 n PHE 332 Cb 0.36 -0.24 0.00 0.00 -0.00 0.00 0.00 39.48 39.59 2gj1 n PHE 332 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 2gj1 n ARG 333 N -1.24 0.99 0.27 -4.13 1.74 -0.92 -3.43 116.66 109.93 2gj1 n ARG 333 Ca 0.10 0.00 0.14 0.00 -0.77 0.00 0.00 57.85 57.32 2gj1 n ARG 333 Cb 0.14 -1.10 0.77 0.00 -1.02 0.00 0.00 32.46 31.25 2gj1 n ARG 333 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2gj1 h PHE 334 N 0.00 0.00 0.00 -1.55 -5.15 -1.69 -2.54 116.94 106.01 2gj1 h PHE 334 Ca 0.00 0.00 -0.00 0.00 -0.20 0.00 0.00 57.97 57.77 2gj1 h PHE 334 Cb 0.10 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.27 2gj1 h PHE 334 CO 0.00 0.09 -0.02 0.78 -2.00 0.00 0.00 178.31 177.17 2gj1 h GLY 335 N 0.93 0.00 1.70 6.09 0.00 -1.87 -2.20 103.07 107.73 2gj1 h GLY 335 Ca -0.00 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.37 2gj1 h GLY 335 CO 0.01 0.00 0.11 0.45 0.00 0.00 0.00 176.54 177.12 2gj1 h HIS 336 N 0.00 0.00 -0.13 5.60 3.86 -1.76 0.54 115.15 123.26 2gj1 h HIS 336 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2gj1 h HIS 336 Cb 0.04 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.51 2gj1 h HIS 336 CO 0.00 0.00 0.00 -1.33 0.86 0.00 0.00 177.93 177.46 2gj1 n MET 337 N -4.12 1.66 0.00 2.45 2.81 -0.83 -3.65 117.12 115.44 2gj1 n MET 337 Ca 0.00 -0.99 0.08 0.00 -1.81 0.00 0.00 57.70 54.98 2gj1 n MET 337 Cb 0.23 -1.40 0.04 0.00 -0.71 0.00 0.00 33.22 31.38 2gj1 n MET 337 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2gj1 n GLU 338 N 0.21 1.47 -3.07 0.03 1.02 0.18 -3.94 120.64 116.54 2gj1 n GLU 338 Ca 0.17 -1.19 -0.40 0.00 -0.02 0.00 0.00 57.16 55.71 2gj1 n GLU 338 Cb 0.31 -1.29 -0.05 0.00 -0.02 0.00 0.00 31.44 30.39 2gj1 n GLU 338 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2gj1 s VAL 339 N -1.58 4.99 0.85 2.62 1.01 -1.21 -0.39 120.40 126.69 2gj1 s VAL 339 Ca 0.17 1.29 -0.12 0.00 0.00 0.00 0.00 61.98 63.32 2gj1 s VAL 339 Cb 0.13 -3.99 0.13 0.00 0.00 0.00 0.00 36.38 32.66 2gj1 s VAL 339 CO 0.29 0.10 1.20 -2.16 0.00 0.00 0.00 175.10 174.53 2gj1 s PRO 340 N 1.90 1.39 0.24 2.72 0.04 -1.26 -4.52 135.00 135.51 2gj1 s PRO 340 Ca 0.31 -0.28 0.24 0.00 0.04 0.00 0.00 61.00 61.32 2gj1 s PRO 340 Cb -0.16 -1.97 0.40 0.00 0.04 0.00 0.00 34.50 32.81 2gj1 s PRO 340 CO 0.11 -1.89 1.46 0.66 0.04 0.00 0.00 177.00 177.38 2gj1 h SER 341 N -1.20 0.00 -4.21 6.66 4.64 -1.97 -3.46 113.55 114.01 2gj1 h SER 341 Ca -0.44 -0.07 -0.30 0.00 -0.47 0.00 0.00 61.79 60.51 2gj1 h SER 341 Cb 1.28 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.22 2gj1 h SER 341 CO 0.51 0.03 -0.70 0.42 -0.87 0.00 0.00 176.83 176.22 2gj1 s THR 342 N -3.20 0.96 -0.02 2.95 -4.23 -1.26 -0.71 115.64 110.13 2gj1 s THR 342 Ca 0.06 -2.01 0.05 0.00 -1.18 0.00 0.00 61.69 58.61 2gj1 s THR 342 Cb 0.10 -1.88 -0.01 0.00 1.34 0.00 0.00 72.50 72.05 2gj1 s THR 342 CO 0.69 -0.71 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.20 2gj1 s VAL 343 N -3.46 1.33 0.15 2.29 1.01 -0.40 -4.83 120.40 116.48 2gj1 s VAL 343 Ca 0.17 -0.70 0.09 0.00 0.00 0.00 0.00 61.98 61.55 2gj1 s VAL 343 Cb 0.04 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 2gj1 s VAL 343 CO 0.00 0.38 -0.16 -0.44 0.00 0.00 0.00 175.10 174.88 2gj1 s SER 344 N -0.24 3.92 -0.20 3.32 0.01 -1.26 -1.15 113.70 118.11 2gj1 s SER 344 Ca 0.03 -0.61 -0.03 0.00 1.31 0.00 0.00 55.95 56.65 2gj1 s SER 344 Cb -0.08 -0.55 -0.01 0.00 0.21 0.00 0.00 66.02 65.59 2gj1 s SER 344 CO 0.00 0.15 -0.07 -0.13 0.41 0.00 0.00 173.24 173.60 2gj1 s ARG 345 N -2.43 3.39 0.10 12.44 3.00 -0.71 -4.38 118.95 130.36 2gj1 s ARG 345 Ca 0.20 -0.64 0.06 0.00 0.00 0.00 0.00 55.73 55.35 2gj1 s ARG 345 Cb -0.10 -2.91 -0.04 0.00 0.00 0.00 0.00 34.95 31.90 2gj1 s ARG 345 CO 0.12 -0.09 -0.03 -0.51 0.00 0.00 0.00 175.30 174.79 2gj1 s LEU 346 N 1.18 3.34 0.00 2.53 1.43 -0.75 -1.08 118.68 125.33 2gj1 s LEU 346 Ca 0.02 -0.25 0.04 0.00 -1.03 0.00 0.00 54.13 52.91 2gj1 s LEU 346 Cb -0.14 -2.08 0.12 0.00 0.03 0.00 0.00 46.19 44.11 2gj1 s LEU 346 CO -0.02 0.17 0.87 -0.90 0.23 0.00 0.00 176.35 176.70 2gj1 n ASP 347 N 0.53 1.62 -0.36 2.29 5.68 0.11 -4.21 116.55 122.21 2gj1 n ASP 347 Ca -0.11 -2.26 0.33 0.00 -0.50 0.00 0.00 54.79 52.25 2gj1 n ASP 347 Cb 0.52 -0.52 0.68 0.00 -1.14 0.00 0.00 41.12 40.66 2gj1 n ASP 347 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2gj1 h GLU 348 N 0.00 0.11 -0.66 0.11 5.08 -1.98 1.97 114.58 119.20 2gj1 h GLU 348 Ca -0.29 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 2gj1 h GLU 348 Cb 1.18 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2gj1 h GLU 348 CO 0.35 0.07 0.00 0.09 -1.00 0.00 0.00 179.01 178.53 2gj1 n ASN 349 N -4.33 3.91 -3.21 1.42 5.03 -1.26 -4.90 115.26 111.92 2gj1 n ASN 349 Ca 0.28 -2.49 -0.23 0.00 0.87 0.00 0.00 54.58 53.01 2gj1 n ASN 349 Cb 1.22 -0.56 0.04 0.00 -1.02 0.00 0.00 39.78 39.46 2gj1 n ASN 349 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2gj1 n TYR 350 N 0.57 -2.21 -4.16 3.10 4.01 0.67 -5.01 117.16 114.13 2gj1 n TYR 350 Ca 0.19 0.66 -0.27 0.00 -0.16 0.00 0.00 57.90 58.31 2gj1 n TYR 350 Cb 0.79 -4.57 -0.07 0.00 -0.31 0.00 0.00 39.34 35.18 2gj1 n TYR 350 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2gj1 s GLN 351 N -5.90 2.52 -0.16 -0.72 -1.52 -1.23 -4.75 119.66 107.91 2gj1 s GLN 351 Ca 0.39 -1.00 -0.41 0.00 -1.95 0.00 0.00 55.36 52.39 2gj1 s GLN 351 Cb -0.17 -2.45 -0.19 0.00 -0.22 0.00 0.00 33.01 29.97 2gj1 s GLN 351 CO 0.48 0.48 1.21 -2.30 -0.25 0.00 0.00 175.29 174.92 2gj1 n PRO 352 N 0.02 0.00 -3.04 2.91 -0.02 -1.26 0.07 135.00 133.67 2gj1 n PRO 352 Ca -0.10 0.00 -0.45 0.00 -2.02 0.00 0.00 63.50 60.94 2gj1 n PRO 352 Cb 0.54 -1.45 -0.03 0.00 -0.02 0.00 0.00 33.50 32.54 2gj1 n PRO 352 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 2gj1 s TRP 353 N 0.99 3.15 0.00 6.00 -0.00 -0.24 -4.64 118.94 124.20 2gj1 s TRP 353 Ca 0.93 -1.28 0.00 0.00 -0.00 0.00 0.00 56.10 55.75 2gj1 s TRP 353 Cb -1.31 -4.12 0.00 0.00 -0.00 0.00 0.00 33.47 28.04 2gj1 s TRP 353 CO 0.63 -1.36 0.00 0.41 -0.00 0.00 0.00 176.95 176.63 2gj1 n GLY 354 N 5.13 -2.23 0.12 5.86 0.00 -1.26 -3.79 105.19 109.01 2gj1 n GLY 354 Ca 0.09 -1.70 -0.02 0.00 0.00 0.00 0.00 46.02 44.40 2gj1 n GLY 354 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gj1 h PRO 355 N 0.00 0.00 -1.61 1.61 0.13 -2.02 -3.31 132.00 126.80 2gj1 h PRO 355 Ca 0.00 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.50 2gj1 h PRO 355 Cb 0.00 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 30.74 2gj1 h PRO 355 CO 0.00 0.71 -0.36 0.39 -0.23 0.00 0.00 178.00 178.51 2gj1 n GLU 356 N -3.49 3.29 -0.18 0.86 1.02 -1.26 -4.81 120.64 116.07 2gj1 n GLU 356 Ca -0.00 -4.30 -0.05 0.00 -0.02 0.00 0.00 57.16 52.79 2gj1 n GLU 356 Cb 0.74 -2.25 0.13 0.00 -0.02 0.00 0.00 31.44 30.04 2gj1 n GLU 356 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2gj1 h ALA 357 N 2.66 1.11 -3.10 0.62 0.00 -1.66 -3.42 119.26 115.46 2gj1 h ALA 357 Ca 0.36 -0.23 -0.64 0.00 0.00 0.00 0.00 54.91 54.40 2gj1 h ALA 357 Cb 0.74 -0.24 -0.21 0.00 0.00 0.00 0.00 17.79 18.08 2gj1 h ALA 357 CO 0.97 0.60 -0.63 -2.00 0.00 0.00 0.00 179.25 178.19 2gj1 s GLU 358 N -5.24 3.71 0.06 0.00 2.12 -1.26 -1.74 118.70 116.34 2gj1 s GLU 358 Ca -0.11 -0.47 0.09 0.00 0.36 0.00 0.00 54.97 54.84 2gj1 s GLU 358 Cb 0.15 -3.19 -0.03 0.00 0.26 0.00 0.00 34.13 31.32 2gj1 s GLU 358 CO 0.82 0.01 -0.24 -0.51 -0.54 0.00 0.00 175.26 174.80 2gj1 s LEU 359 N 1.05 2.19 0.33 2.70 1.43 -0.30 -4.96 118.68 121.12 2gj1 s LEU 359 Ca 0.03 -0.58 -0.29 0.00 -1.03 0.00 0.00 54.13 52.26 2gj1 s LEU 359 Cb -0.14 -1.12 -0.10 0.00 0.03 0.00 0.00 46.19 44.85 2gj1 s LEU 359 CO 0.02 0.20 1.30 -2.84 0.23 0.00 0.00 176.35 175.26 2gj1 s PRO 360 N -1.33 4.36 0.29 1.29 0.02 -1.26 -1.27 135.00 137.10 2gj1 s PRO 360 Ca 0.10 2.21 0.04 0.00 0.02 0.00 0.00 61.00 63.36 2gj1 s PRO 360 Cb -0.09 -3.07 0.68 0.00 0.02 0.00 0.00 34.50 32.04 2gj1 s PRO 360 CO 0.02 -0.18 1.77 1.25 -0.33 0.00 0.00 177.00 179.53 2gj1 h LEU 361 N 3.41 0.69 -2.23 -5.54 6.46 -1.24 -2.26 115.31 114.59 2gj1 h LEU 361 Ca -0.49 0.10 0.00 0.00 -0.12 0.00 0.00 57.88 57.37 2gj1 h LEU 361 Cb 1.23 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 41.14 2gj1 h LEU 361 CO 0.66 0.24 0.00 1.12 -0.62 0.00 0.00 178.44 179.84 2gj1 h HIS 362 N 0.70 0.00 -0.00 1.25 2.07 -1.82 0.54 115.15 117.88 2gj1 h HIS 362 Ca 0.55 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.07 2gj1 h HIS 362 Cb 0.85 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.83 2gj1 h HIS 362 CO -0.04 0.00 -0.09 0.25 -3.07 0.00 0.00 177.93 174.99 2gj1 n THR 363 N -2.94 0.00 0.09 6.12 -2.24 -0.85 -3.96 114.28 110.50 2gj1 n THR 363 Ca -0.01 -0.03 0.08 0.00 -2.27 0.00 0.00 64.05 61.81 2gj1 n THR 363 Cb 0.14 -0.24 0.15 0.00 -2.10 0.00 0.00 70.33 68.28 2gj1 n THR 363 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2gj1 n LEU 364 N -1.13 2.87 -4.71 3.22 4.77 0.18 -4.78 117.00 117.42 2gj1 n LEU 364 Ca 0.13 -1.62 -0.42 0.00 -0.03 0.00 0.00 56.01 54.08 2gj1 n LEU 364 Cb 0.27 -0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 41.14 2gj1 n LEU 364 CO 0.24 0.66 0.89 -0.36 -1.33 0.00 0.00 177.39 177.48 2gj1 s PHE 365 N -1.10 3.42 -1.31 -1.77 0.08 -1.24 -2.57 117.98 113.48 2gj1 s PHE 365 Ca 0.26 1.30 -0.06 0.00 0.12 0.00 0.00 56.93 58.55 2gj1 s PHE 365 Cb 0.15 -3.41 0.04 0.00 -0.57 0.00 0.00 43.02 39.23 2gj1 s PHE 365 CO 0.20 -1.25 0.42 1.19 -0.10 0.00 0.00 175.22 175.69 2gj1 n PHE 366 N 4.06 -1.76 -3.58 0.36 3.72 -0.64 -4.94 117.46 114.69 2gj1 n PHE 366 Ca 0.09 0.39 -0.41 0.00 -0.05 0.00 0.00 57.45 57.47 2gj1 n PHE 366 Cb 0.46 -3.29 -0.11 0.00 -0.94 0.00 0.00 39.48 35.60 2gj1 n PHE 366 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2gj1 s ASN 367 N -2.58 5.77 -0.02 4.37 3.84 -1.21 -4.00 114.94 121.10 2gj1 s ASN 367 Ca 0.30 -1.09 0.17 0.00 0.21 0.00 0.00 52.86 52.45 2gj1 s ASN 367 Cb -0.15 -2.03 -0.24 0.00 -0.55 0.00 0.00 41.25 38.27 2gj1 s ASN 367 CO 0.37 -0.43 0.44 0.35 -2.79 0.00 0.00 177.10 175.04 2gj1 n THR 368 N 5.01 0.00 0.03 -5.21 -2.24 -1.26 -4.53 114.28 106.08 2gj1 n THR 368 Ca -0.12 -0.32 -0.02 0.00 -2.27 0.00 0.00 64.05 61.33 2gj1 n THR 368 Cb 0.45 0.32 0.24 0.00 -2.10 0.00 0.00 70.33 69.25 2gj1 n THR 368 CO 0.00 0.00 0.00 4.11 -0.57 0.00 0.00 175.07 178.61 2gj1 h TRP 369 N 0.00 0.47 0.00 4.78 5.08 -1.89 -1.94 115.95 122.45 2gj1 h TRP 369 Ca 0.00 -0.09 -0.00 0.00 1.08 0.00 0.00 58.89 59.88 2gj1 h TRP 369 Cb 0.67 -0.12 -0.00 0.00 -3.00 0.00 0.00 29.16 26.71 2gj1 h TRP 369 CO 0.00 0.62 -0.02 0.00 -1.28 0.00 0.00 178.44 177.76 2gj1 h ARG 370 N 0.39 0.00 0.00 0.12 2.47 -1.94 1.16 114.38 116.57 2gj1 h ARG 370 Ca 0.06 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.73 2gj1 h ARG 370 Cb 0.59 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.91 2gj1 h ARG 370 CO 0.04 0.02 -0.47 0.82 0.56 0.00 0.00 179.97 180.95 2gj1 h ILE 371 N 0.00 0.44 -0.36 2.04 2.04 -1.67 -3.04 117.51 116.97 2gj1 h ILE 371 Ca -0.00 -1.44 -0.06 0.00 1.00 0.00 0.00 64.86 64.37 2gj1 h ILE 371 Cb 0.11 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 2gj1 h ILE 371 CO 0.00 0.15 0.01 0.40 0.00 0.00 0.00 178.15 178.71 2gj1 h ILE 372 N -1.00 1.26 -0.00 -0.67 1.08 -1.18 -0.26 117.51 116.73 2gj1 h ILE 372 Ca -0.08 -0.97 0.00 0.00 -0.39 0.00 0.00 64.86 63.43 2gj1 h ILE 372 Cb 0.61 1.18 0.00 0.00 -3.07 0.00 0.00 36.82 35.54 2gj1 h ILE 372 CO -0.05 0.32 -0.73 1.17 -0.69 0.00 0.00 178.15 178.18 2gj1 n LYS 373 N -4.50 0.18 -2.61 2.37 3.00 0.40 -4.64 118.16 112.35 2gj1 n LYS 373 Ca -0.02 -0.13 -0.14 0.00 -0.00 0.00 0.00 58.31 58.02 2gj1 n LYS 373 Cb 0.27 -1.50 0.02 0.00 0.00 0.00 0.00 35.03 33.82 2gj1 n LYS 373 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2gj1 n ASP 374 N -1.29 2.31 0.00 3.14 2.03 -1.15 -4.98 116.55 116.61 2gj1 n ASP 374 Ca 0.06 -2.98 0.00 0.00 0.52 0.00 0.00 54.79 52.39 2gj1 n ASP 374 Cb 0.35 -0.51 0.00 0.00 -0.72 0.00 0.00 41.12 40.24 2gj1 n ASP 374 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2gj1 n GLY 375 N -0.17 1.10 7.00 0.27 0.00 -1.25 -4.77 105.19 107.36 2gj1 n GLY 375 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2gj1 n GLY 375 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gj1 n GLY 376 N -0.67 -1.47 0.02 -0.02 0.00 -0.11 -4.55 105.19 98.41 2gj1 n GLY 376 Ca 0.00 -1.30 0.10 0.00 0.00 0.00 0.00 46.02 44.82 2gj1 n GLY 376 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2gj1 n ILE 377 N -0.00 0.11 -0.20 -0.61 -5.35 -1.26 -4.55 119.36 107.49 2gj1 n ILE 377 Ca 0.00 -0.52 0.00 0.00 -0.27 0.00 0.00 62.75 61.97 2gj1 n ILE 377 Cb 0.00 -0.05 0.11 0.00 -1.74 0.00 0.00 39.64 37.96 2gj1 n ILE 377 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 2gj1 h ASP 378 N 0.00 0.18 -0.19 7.28 5.19 -1.97 0.21 116.42 127.12 2gj1 h ASP 378 Ca -0.02 0.09 -0.02 0.00 -0.62 0.00 0.00 57.03 56.46 2gj1 h ASP 378 Cb 1.04 0.08 -0.01 0.00 0.18 0.00 0.00 39.33 40.61 2gj1 h ASP 378 CO 0.00 0.11 0.07 -0.65 -3.12 0.00 0.00 179.24 175.65 2gj1 h PRO 379 N 0.38 0.36 -0.06 3.56 0.11 -1.80 -0.89 132.00 133.65 2gj1 h PRO 379 Ca 0.31 -0.04 -0.18 0.00 0.11 0.00 0.00 66.00 66.19 2gj1 h PRO 379 Cb 0.40 -0.07 0.01 0.00 0.11 0.00 0.00 31.00 31.46 2gj1 h PRO 379 CO -0.33 0.33 -0.68 -0.07 -0.21 0.00 0.00 178.00 177.04 2gj1 h LEU 380 N 0.36 0.70 -0.65 2.35 3.38 -1.39 -1.97 115.31 118.09 2gj1 h LEU 380 Ca 0.09 -0.70 0.02 0.00 0.09 0.00 0.00 57.88 57.39 2gj1 h LEU 380 Cb 0.12 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 2gj1 h LEU 380 CO -0.01 1.29 0.41 0.58 0.09 0.00 0.00 178.44 180.81 2gj1 h VAL 381 N 0.16 1.10 -0.86 1.22 2.07 -0.36 -1.82 116.25 117.77 2gj1 h VAL 381 Ca -0.07 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.19 2gj1 h VAL 381 Cb 1.35 0.22 -0.05 0.00 -1.52 0.00 0.00 31.29 31.29 2gj1 h VAL 381 CO 0.14 0.15 0.56 0.03 0.02 0.00 0.00 177.57 178.47 2gj1 h ARG 382 N 0.80 1.09 -0.84 1.57 3.08 -1.20 -1.66 114.38 117.23 2gj1 h ARG 382 Ca 0.26 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 2gj1 h ARG 382 Cb -0.00 -0.25 -0.04 0.00 0.08 0.00 0.00 29.97 29.76 2gj1 h ARG 382 CO -0.10 0.72 0.48 0.78 -1.07 0.00 0.00 179.97 180.79 2gj1 h GLY 383 N 1.13 1.23 1.67 0.04 0.00 -1.30 0.88 103.07 106.72 2gj1 h GLY 383 Ca 0.33 -0.53 0.01 0.00 0.00 0.00 0.00 47.33 47.13 2gj1 h GLY 383 CO -0.09 0.51 0.21 1.41 0.00 0.00 0.00 176.54 178.58 2gj1 h LEU 384 N 1.16 0.34 0.15 3.11 3.38 -0.48 0.41 115.31 123.38 2gj1 h LEU 384 Ca 0.30 -0.01 -0.33 0.00 0.09 0.00 0.00 57.88 57.93 2gj1 h LEU 384 Cb -0.01 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2gj1 h LEU 384 CO -0.05 0.24 -1.69 -0.07 0.09 0.00 0.00 178.44 176.96 2gj1 h LEU 385 N 0.39 0.48 0.00 1.67 3.38 -0.70 -2.61 115.31 117.93 2gj1 h LEU 385 Ca 0.12 -0.74 0.00 0.00 0.09 0.00 0.00 57.88 57.35 2gj1 h LEU 385 Cb -0.00 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.59 2gj1 h LEU 385 CO -0.03 1.63 -1.17 0.00 0.09 0.00 0.00 178.44 178.96 2gj1 n ALA 386 N -2.78 4.05 -2.04 1.53 0.00 0.20 -4.46 120.51 117.01 2gj1 n ALA 386 Ca -0.22 -0.53 -0.17 0.00 0.00 0.00 0.00 53.44 52.52 2gj1 n ALA 386 Cb 1.06 -0.83 0.01 0.00 0.00 0.00 0.00 19.45 19.69 2gj1 n ALA 386 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2gj1 s LYS 387 N -3.14 2.80 0.25 0.00 -0.14 0.12 -4.83 119.74 114.81 2gj1 s LYS 387 Ca 0.04 -1.27 0.08 0.00 -1.36 0.00 0.00 55.97 53.47 2gj1 s LYS 387 Cb 0.15 -2.72 -0.04 0.00 -1.68 0.00 0.00 37.83 33.54 2gj1 s LYS 387 CO 0.85 -0.26 0.06 0.15 -0.76 0.00 0.00 175.35 175.40 2gj1 s LYS 388 N -4.33 2.51 0.76 1.68 1.02 -1.26 -0.60 119.74 119.53 2gj1 s LYS 388 Ca 0.54 -1.26 -0.12 0.00 0.02 0.00 0.00 55.97 55.15 2gj1 s LYS 388 Cb -0.09 -2.31 0.05 0.00 -0.52 0.00 0.00 37.83 34.95 2gj1 s LYS 388 CO 0.32 0.39 1.12 -1.12 -0.92 0.00 0.00 175.35 175.14 2gj1 s SER 389 N -3.63 4.92 0.26 2.83 0.01 -0.89 -4.29 113.70 112.91 2gj1 s SER 389 Ca 0.31 1.09 -0.21 0.00 1.31 0.00 0.00 55.95 58.45 2gj1 s SER 389 Cb -0.07 -1.80 -0.09 0.00 0.21 0.00 0.00 66.02 64.27 2gj1 s SER 389 CO 0.21 -1.67 0.79 -0.75 0.41 0.00 0.00 173.24 172.23 2gj1 s LYS 390 N -5.35 4.34 -0.05 12.44 2.20 0.48 -0.02 119.74 133.77 2gj1 s LYS 390 Ca 0.60 1.00 -0.16 0.00 -0.36 0.00 0.00 55.97 57.04 2gj1 s LYS 390 Cb -0.12 -2.84 -0.05 0.00 -1.51 0.00 0.00 37.83 33.31 2gj1 s LYS 390 CO 0.52 0.35 0.44 -1.17 -0.36 0.00 0.00 175.35 175.13 2gj1 s LEU 391 N -2.03 4.38 0.21 5.43 2.96 -0.31 -4.33 118.68 124.98 2gj1 s LEU 391 Ca 0.45 0.89 -0.32 0.00 -0.22 0.00 0.00 54.13 54.93 2gj1 s LEU 391 Cb -0.17 -2.64 -0.12 0.00 0.50 0.00 0.00 46.19 43.76 2gj1 s LEU 391 CO 0.22 0.17 1.67 0.80 -1.32 0.00 0.00 176.35 177.88 2gj1 n MET 392 N 2.71 2.60 -3.88 1.98 1.56 -1.25 -4.90 117.12 115.93 2gj1 n MET 392 Ca -0.11 0.94 -0.17 0.00 -0.27 0.00 0.00 57.70 58.09 2gj1 n MET 392 Cb 0.52 -2.75 -0.16 0.00 2.15 0.00 0.00 33.22 32.97 2gj1 n MET 392 CO 0.00 0.00 0.00 1.21 -0.73 0.00 0.00 175.97 176.45 2gj1 s ASN 393 N 1.02 0.48 0.52 6.12 3.84 -1.23 -5.04 114.94 120.64 2gj1 s ASN 393 Ca 0.75 -0.01 0.24 0.00 0.21 0.00 0.00 52.86 54.05 2gj1 s ASN 393 Cb -0.55 -0.20 1.37 0.00 -0.55 0.00 0.00 41.25 41.31 2gj1 s ASN 393 CO 0.36 -0.12 2.00 1.56 -2.79 0.00 0.00 177.10 178.10 2gj1 h GLN 394 N 7.39 0.03 -0.01 0.43 4.20 -1.92 -0.80 115.11 124.43 2gj1 h GLN 394 Ca -0.40 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.31 2gj1 h GLN 394 Cb 1.13 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.90 2gj1 h GLN 394 CO 0.44 0.02 -0.40 -0.25 -0.67 0.00 0.00 178.83 177.97 2gj1 n ASP 395 N -4.39 1.75 -3.21 1.46 8.00 -1.26 -4.71 116.55 114.20 2gj1 n ASP 395 Ca 0.10 -1.35 -0.18 0.00 0.71 0.00 0.00 54.79 54.07 2gj1 n ASP 395 Cb 0.58 0.37 -0.06 0.00 -0.02 0.00 0.00 41.12 41.98 2gj1 n ASP 395 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2gj1 s LYS 396 N -2.47 0.89 -0.06 -1.24 1.02 -0.31 -4.76 119.74 112.81 2gj1 s LYS 396 Ca 0.21 -1.52 -0.02 0.00 0.02 0.00 0.00 55.97 54.65 2gj1 s LYS 396 Cb 0.18 -0.87 -0.01 0.00 -0.52 0.00 0.00 37.83 36.62 2gj1 s LYS 396 CO 0.55 -1.33 -0.04 0.52 -0.92 0.00 0.00 175.35 174.14 2gj1 h MET 397 N 5.80 0.00 -4.98 1.68 2.86 -1.58 -3.27 114.93 115.45 2gj1 h MET 397 Ca 0.16 0.00 -0.63 0.00 -2.06 0.00 0.00 59.70 57.17 2gj1 h MET 397 Cb 1.00 0.00 -0.34 0.00 0.06 0.00 0.00 31.60 32.32 2gj1 h MET 397 CO 0.23 0.00 -0.85 0.08 1.06 0.00 0.00 176.91 177.42 2gj1 s VAL 398 N -1.41 1.77 0.61 -2.22 1.01 -1.07 -4.48 120.40 114.62 2gj1 s VAL 398 Ca -0.03 -0.81 -0.18 0.00 0.00 0.00 0.00 61.98 60.95 2gj1 s VAL 398 Cb 0.00 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.76 2gj1 s VAL 398 CO 0.05 0.50 1.07 1.07 0.00 0.00 0.00 175.10 177.78 2gj1 n THR 399 N 4.10 4.04 0.28 3.92 5.66 -1.26 -4.60 114.28 126.41 2gj1 n THR 399 Ca -0.19 -0.50 0.16 0.00 -3.05 0.00 0.00 64.05 60.46 2gj1 n THR 399 Cb 0.51 -1.26 0.79 0.00 -1.55 0.00 0.00 70.33 68.82 2gj1 n THR 399 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 2gj1 h SER 400 N 0.53 0.00 -0.51 1.09 0.02 -1.95 0.52 113.55 113.25 2gj1 h SER 400 Ca -0.49 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.48 2gj1 h SER 400 Cb 1.36 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.87 2gj1 h SER 400 CO 0.52 0.07 0.34 -0.33 -1.14 0.00 0.00 176.83 176.29 2gj1 h GLU 401 N 0.00 0.62 0.00 3.45 4.39 -1.92 -1.09 114.58 120.03 2gj1 h GLU 401 Ca -0.00 -0.04 -0.26 0.00 0.34 0.00 0.00 59.36 59.40 2gj1 h GLU 401 Cb 0.37 -0.14 -0.05 0.00 -0.10 0.00 0.00 28.75 28.83 2gj1 h GLU 401 CO 0.01 0.41 -2.07 1.28 -1.16 0.00 0.00 179.01 177.48 2gj1 n LEU 402 N -4.47 0.26 0.13 1.33 4.77 -0.55 -3.27 117.00 115.19 2gj1 n LEU 402 Ca 0.05 0.12 0.05 0.00 -0.03 0.00 0.00 56.01 56.20 2gj1 n LEU 402 Cb 0.10 0.30 0.02 0.00 -2.33 0.00 0.00 43.42 41.51 2gj1 n LEU 402 CO 0.35 0.34 0.31 -0.09 -1.33 0.00 0.00 177.39 176.96 2gj1 h ARG 403 N 0.00 0.00 0.00 3.23 2.43 -0.64 -2.07 114.38 117.33 2gj1 h ARG 403 Ca -0.35 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.82 2gj1 h ARG 403 Cb 1.88 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.43 2gj1 h ARG 403 CO 0.03 0.30 -0.50 0.09 -1.51 0.00 0.00 179.97 178.39 2gj1 n ASN 404 N -3.06 2.51 -0.43 -3.80 3.02 -0.44 -4.08 115.26 108.97 2gj1 n ASN 404 Ca -0.00 -0.04 0.07 0.00 -0.03 0.00 0.00 54.58 54.58 2gj1 n ASN 404 Cb 0.70 0.58 0.13 0.00 -0.61 0.00 0.00 39.78 40.58 2gj1 n ASN 404 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2gj1 n LYS 405 N -0.83 1.08 -2.09 3.52 5.02 -1.10 -3.74 118.16 120.02 2gj1 n LYS 405 Ca 0.00 -2.55 -0.41 0.00 -2.02 0.00 0.00 58.31 53.33 2gj1 n LYS 405 Cb 0.00 -1.26 -0.02 0.00 -0.02 0.00 0.00 35.03 33.73 2gj1 n LYS 405 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2gj1 s LEU 406 N -2.33 4.41 -0.17 -0.35 2.96 -0.98 -4.43 118.68 117.79 2gj1 s LEU 406 Ca 0.30 2.65 -0.08 0.00 -0.22 0.00 0.00 54.13 56.78 2gj1 s LEU 406 Cb 0.28 -3.64 -0.04 0.00 0.50 0.00 0.00 46.19 43.29 2gj1 s LEU 406 CO -0.03 -0.59 0.10 0.12 -1.32 0.00 0.00 176.35 174.63 2gj1 s PHE 407 N -0.61 3.36 -0.14 5.38 5.36 -1.26 -1.59 117.98 128.49 2gj1 s PHE 407 Ca 0.53 0.25 -0.02 0.00 -0.96 0.00 0.00 56.93 56.73 2gj1 s PHE 407 Cb -0.40 -2.07 -0.03 0.00 -0.34 0.00 0.00 43.02 40.19 2gj1 s PHE 407 CO 0.48 0.32 -0.06 -0.65 -1.46 0.00 0.00 175.22 173.85 2gj1 s GLN 408 N 0.06 3.47 0.24 10.12 -1.52 -1.26 -4.98 119.66 125.79 2gj1 s GLN 408 Ca 0.07 -0.55 -0.13 0.00 -1.95 0.00 0.00 55.36 52.81 2gj1 s GLN 408 Cb -0.12 -2.82 0.33 0.00 -0.22 0.00 0.00 33.01 30.18 2gj1 s GLN 408 CO 0.00 0.31 1.58 -1.35 -0.25 0.00 0.00 175.29 175.58 2gj1 h PRO 409 N 6.44 -0.02 0.00 2.91 0.11 -1.99 -0.31 132.00 139.15 2gj1 h PRO 409 Ca -0.33 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.73 2gj1 h PRO 409 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2gj1 h PRO 409 CO 0.60 -0.01 -0.22 1.15 -0.21 0.00 0.00 178.00 179.31 2gj1 h THR 410 N -0.02 0.89 -0.89 -1.15 2.02 -2.02 -3.45 112.91 108.28 2gj1 h THR 410 Ca 0.38 -0.84 -0.58 0.00 0.77 0.00 0.00 66.41 66.15 2gj1 h THR 410 Cb 0.62 1.49 -0.06 0.00 -1.74 0.00 0.00 68.15 68.46 2gj1 h THR 410 CO -0.89 0.22 -0.37 -1.00 0.37 0.00 0.00 175.52 173.84 2gj1 s HIS 411 N -4.22 1.99 -0.84 3.16 3.76 -0.13 -5.08 115.29 113.94 2gj1 s HIS 411 Ca -0.03 -0.75 0.09 0.00 -0.15 0.00 0.00 55.06 54.22 2gj1 s HIS 411 Cb 0.14 -1.93 -0.00 0.00 1.11 0.00 0.00 32.58 31.89 2gj1 s HIS 411 CO 0.65 -0.23 0.60 1.63 -0.85 0.00 0.00 174.74 176.55 2gj1 n LYS 412 N -1.58 2.17 -4.15 1.40 5.02 -1.26 -4.60 118.16 115.15 2gj1 n LYS 412 Ca -0.02 -0.57 -0.29 0.00 -2.02 0.00 0.00 58.31 55.41 2gj1 n LYS 412 Cb 0.64 -1.06 -0.08 0.00 -0.02 0.00 0.00 35.03 34.52 2gj1 n LYS 412 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2gj1 s ILE 413 N -1.30 3.92 -1.28 -0.18 -4.36 -1.26 -5.02 121.20 111.72 2gj1 s ILE 413 Ca 0.08 -1.15 -0.07 0.00 -0.26 0.00 0.00 60.65 59.24 2gj1 s ILE 413 Cb 0.07 -2.91 0.16 0.00 1.25 0.00 0.00 42.46 41.04 2gj1 s ILE 413 CO 0.24 0.03 2.05 1.41 0.24 0.00 0.00 174.94 178.91 2gj1 n HIS 413 N 0.28 2.73 -1.55 1.37 8.25 -1.26 -4.32 115.22 120.72 2gj1 n HIS 413 Ca -0.10 -2.78 0.00 0.00 -0.26 0.00 0.00 57.72 54.58 2gj1 n HIS 413 Cb 0.53 -1.83 0.01 0.00 1.12 0.00 0.00 29.99 29.82 2gj1 n HIS 413 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gj1 n GLY 414 N 2.17 -0.56 3.95 -1.41 0.00 -1.08 -4.33 105.19 103.94 2gj1 n GLY 414 Ca 0.48 -0.04 -0.25 0.00 0.00 0.00 0.00 46.02 46.21 2gj1 n GLY 414 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gj1 s PHE 415 N -0.13 2.49 -0.24 1.61 0.40 -0.62 -4.72 117.98 116.77 2gj1 s PHE 415 Ca 0.01 0.18 -0.00 0.00 -0.60 0.00 0.00 56.93 56.51 2gj1 s PHE 415 Cb 0.01 -3.15 0.07 0.00 0.51 0.00 0.00 43.02 40.46 2gj1 s PHE 415 CO 0.00 -1.48 0.01 0.34 0.70 0.00 0.00 175.22 174.78 2gj1 s ASP 416 N -4.58 3.64 0.28 1.36 -1.08 -1.26 -2.31 116.67 112.71 2gj1 s ASP 416 Ca 0.62 -1.20 -0.01 0.00 -0.52 0.00 0.00 52.55 51.44 2gj1 s ASP 416 Cb -0.09 -0.96 0.39 0.00 -1.46 0.00 0.00 42.92 40.80 2gj1 s ASP 416 CO 0.44 -0.30 1.83 0.25 0.52 0.00 0.00 175.17 177.91 2gj1 h LEU 417 N 8.05 0.79 -0.22 -1.34 5.85 -1.59 0.07 115.31 126.92 2gj1 h LEU 417 Ca -0.16 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.40 2gj1 h LEU 417 Cb 1.07 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 2gj1 h LEU 417 CO 0.40 0.76 0.05 0.00 -0.34 0.00 0.00 178.44 179.32 2gj1 h ALA 418 N 1.34 0.29 -0.65 1.25 0.00 -1.88 0.87 119.26 120.48 2gj1 h ALA 418 Ca 0.18 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2gj1 h ALA 418 Cb 0.27 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2gj1 h ALA 418 CO -0.00 -0.06 0.17 0.00 0.00 0.00 0.00 179.25 179.36 2gj1 h ALA 419 N 0.86 1.08 -0.50 0.00 0.00 -1.76 -2.14 119.26 116.80 2gj1 h ALA 419 Ca 0.07 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 2gj1 h ALA 419 Cb 0.28 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2gj1 h ALA 419 CO 0.00 0.61 0.20 0.82 0.00 0.00 0.00 179.25 180.89 2gj1 h ILE 420 N 0.97 1.21 -0.72 0.00 2.04 -0.69 -1.33 117.51 118.98 2gj1 h ILE 420 Ca 0.21 -0.66 0.06 0.00 1.00 0.00 0.00 64.86 65.47 2gj1 h ILE 420 Cb 0.32 0.70 -0.06 0.00 -0.74 0.00 0.00 36.82 37.04 2gj1 h ILE 420 CO -0.00 0.25 0.41 0.78 0.00 0.00 0.00 178.15 179.59 2gj1 h ASN 421 N 0.67 0.62 0.10 1.72 -0.26 -0.43 0.72 115.58 118.73 2gj1 h ASN 421 Ca 0.17 0.03 -0.01 0.00 -0.56 0.00 0.00 56.30 55.93 2gj1 h ASN 421 Cb 0.19 -0.09 0.00 0.00 -1.06 0.00 0.00 38.32 37.36 2gj1 h ASN 421 CO -0.01 0.39 -0.05 -0.07 -1.06 0.00 0.00 177.43 176.63 2gj1 h LEU 422 N 0.75 -0.12 -1.11 1.61 3.38 -1.18 -1.76 115.31 116.88 2gj1 h LEU 422 Ca 0.32 -0.27 0.10 0.00 0.09 0.00 0.00 57.88 58.12 2gj1 h LEU 422 Cb 0.20 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 40.91 2gj1 h LEU 422 CO -0.19 0.21 0.61 -0.61 0.09 0.00 0.00 178.44 178.55 2gj1 h GLN 423 N -0.46 0.94 -0.28 1.13 5.75 -1.13 -1.98 115.11 119.09 2gj1 h GLN 423 Ca -0.01 -0.06 -0.10 0.00 -0.15 0.00 0.00 58.65 58.33 2gj1 h GLN 423 Cb 0.38 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 2gj1 h GLN 423 CO 0.02 0.62 -0.25 -0.09 -2.65 0.00 0.00 178.83 176.49 2gj1 h ARG 424 N 0.97 0.54 -0.43 1.69 9.65 -0.68 -1.34 114.38 124.77 2gj1 h ARG 424 Ca 0.44 -0.21 0.04 0.00 -1.10 0.00 0.00 59.98 59.15 2gj1 h ARG 424 Cb 0.39 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 28.90 2gj1 h ARG 424 CO -0.20 0.75 0.20 0.00 2.80 0.00 0.00 179.97 183.52 2gj1 h ARG 426 N 0.41 0.51 -0.76 0.00 3.08 -1.30 -2.15 114.38 114.16 2gj1 h ARG 426 Ca 0.19 -0.20 0.15 0.00 0.07 0.00 0.00 59.98 60.19 2gj1 h ARG 426 Cb 0.12 -0.03 -0.10 0.00 0.08 0.00 0.00 29.97 30.04 2gj1 h ARG 426 CO -0.15 0.74 0.29 0.22 -1.07 0.00 0.00 179.97 180.00 2gj1 h ASP 427 N 0.26 0.24 -0.01 7.04 3.58 -1.01 -0.71 116.42 125.80 2gj1 h ASP 427 Ca 0.06 0.12 0.00 0.00 0.42 0.00 0.00 57.03 57.63 2gj1 h ASP 427 Cb 0.56 0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.72 2gj1 h ASP 427 CO 0.03 0.07 0.00 1.41 -2.88 0.00 0.00 179.24 177.87 2gj1 n HIS 428 N -5.03 0.01 -3.30 0.28 8.25 -0.24 -4.83 115.22 110.36 2gj1 n HIS 428 Ca 0.15 -0.01 -0.17 0.00 -0.26 0.00 0.00 57.72 57.43 2gj1 n HIS 428 Cb 0.45 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.62 2gj1 n HIS 428 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gj1 n GLY 429 N 0.91 -0.20 3.74 -1.41 0.00 -0.27 -4.87 105.19 103.09 2gj1 n GLY 429 Ca 0.19 0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 2gj1 n GLY 429 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2gj1 s MET 430 N -5.84 4.41 0.86 1.61 -1.94 -0.83 -0.88 119.30 116.70 2gj1 s MET 430 Ca 0.37 1.99 -0.11 0.00 -1.71 0.00 0.00 55.69 56.24 2gj1 s MET 430 Cb -0.16 -3.22 0.11 0.00 2.01 0.00 0.00 34.83 33.57 2gj1 s MET 430 CO 0.56 -0.22 1.14 -2.14 -0.01 0.00 0.00 175.02 174.36 2gj1 s PRO 431 N -0.05 1.43 0.93 2.03 0.02 -1.26 -4.65 135.00 133.45 2gj1 s PRO 431 Ca 0.56 1.49 -0.16 0.00 0.02 0.00 0.00 61.00 62.91 2gj1 s PRO 431 Cb -0.35 -1.78 0.22 0.00 0.02 0.00 0.00 34.50 32.61 2gj1 s PRO 431 CO 0.37 -2.32 1.15 0.41 -0.33 0.00 0.00 177.00 176.28 2gj1 n GLY 432 N -0.09 -1.75 0.12 0.52 0.00 -1.26 -4.53 105.19 98.20 2gj1 n GLY 432 Ca 0.11 -1.66 -0.08 0.00 0.00 0.00 0.00 46.02 44.39 2gj1 n GLY 432 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2gj1 h TYR 433 N -1.89 0.13 -0.02 1.61 3.20 -1.30 -2.73 116.97 115.97 2gj1 h TYR 433 Ca -0.38 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.42 2gj1 h TYR 433 Cb 1.08 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 39.31 2gj1 h TYR 433 CO 0.00 0.06 -0.38 -0.91 -1.64 0.00 0.00 178.16 175.29 2gj1 h ASN 434 N 0.18 0.04 0.27 -2.11 2.35 -1.80 -0.76 115.58 113.75 2gj1 h ASN 434 Ca 0.10 -0.01 -0.11 0.00 -0.55 0.00 0.00 56.30 55.73 2gj1 h ASN 434 Cb 0.08 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 2gj1 h ASN 434 CO -0.12 0.41 -0.44 -1.28 -1.65 0.00 0.00 177.43 174.36 2gj1 h SER 435 N 0.03 0.22 0.57 5.81 0.87 -1.82 -1.44 113.55 117.79 2gj1 h SER 435 Ca 0.00 -0.10 -0.23 0.00 -1.23 0.00 0.00 61.79 60.23 2gj1 h SER 435 Cb 0.68 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.58 2gj1 h SER 435 CO 0.05 0.64 -1.04 -0.50 -0.53 0.00 0.00 176.83 175.45 2gj1 h TRP 436 N 0.18 0.42 -0.31 2.24 4.06 -1.15 -2.66 115.95 118.73 2gj1 h TRP 436 Ca 0.01 -0.27 0.03 0.00 2.06 0.00 0.00 58.89 60.73 2gj1 h TRP 436 Cb 0.84 -0.03 -0.03 0.00 -1.00 0.00 0.00 29.16 28.94 2gj1 h TRP 436 CO 0.01 1.13 0.10 0.00 -3.56 0.00 0.00 178.44 176.13 2gj1 h ARG 437 N 0.12 0.23 -0.25 0.49 2.47 -0.97 -2.38 114.38 114.08 2gj1 h ARG 437 Ca -0.08 -0.01 0.03 0.00 -1.26 0.00 0.00 59.98 58.66 2gj1 h ARG 437 Cb 1.71 -0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 29.95 2gj1 h ARG 437 CO 0.17 0.15 0.06 0.78 0.56 0.00 0.00 179.97 181.69 2gj1 h GLY 438 N 0.23 0.29 0.12 0.04 0.00 -1.30 0.73 103.07 103.19 2gj1 h GLY 438 Ca 0.14 -0.03 0.22 0.00 0.00 0.00 0.00 47.33 47.67 2gj1 h GLY 438 CO -0.14 0.00 0.63 -2.75 0.00 0.00 0.00 176.54 174.28 2gj1 h PHE 439 N 0.16 0.67 -0.17 5.60 3.57 -1.28 0.13 116.94 125.61 2gj1 h PHE 439 Ca 0.12 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.64 2gj1 h PHE 439 Cb 0.11 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.65 2gj1 h PHE 439 CO -0.15 0.13 0.00 0.00 -2.23 0.00 0.00 178.31 176.06 2gj1 n GLY 441 N 1.26 0.13 3.69 0.00 0.00 0.45 -5.04 105.19 105.69 2gj1 n GLY 441 Ca 0.17 -0.46 -0.23 0.00 0.00 0.00 0.00 46.02 45.50 2gj1 n GLY 441 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gj1 s LEU 442 N -2.75 3.29 0.79 0.99 1.43 0.16 -5.00 118.68 117.59 2gj1 s LEU 442 Ca 0.07 -0.63 -0.13 0.00 -1.03 0.00 0.00 54.13 52.41 2gj1 s LEU 442 Cb -0.03 -1.80 0.07 0.00 0.03 0.00 0.00 46.19 44.45 2gj1 s LEU 442 CO 0.09 -0.09 1.17 -0.94 0.23 0.00 0.00 176.35 176.82 2gj1 s SER 443 N -3.74 3.89 -0.41 2.29 1.04 -1.26 -3.91 113.70 111.59 2gj1 s SER 443 Ca 0.33 2.23 0.03 0.00 0.48 0.00 0.00 55.95 59.02 2gj1 s SER 443 Cb -0.05 -2.57 0.12 0.00 0.10 0.00 0.00 66.02 63.61 2gj1 s SER 443 CO 0.21 -2.46 0.17 -1.10 0.98 0.00 0.00 173.24 171.04 2gj1 s GLN 444 N -4.24 1.46 0.35 4.02 -0.21 -1.26 -4.77 119.66 115.01 2gj1 s GLN 444 Ca 0.70 -2.01 -0.28 0.00 0.02 0.00 0.00 55.36 53.79 2gj1 s GLN 444 Cb -0.26 -2.84 -0.11 0.00 1.00 0.00 0.00 33.01 30.81 2gj1 s GLN 444 CO 0.50 -1.05 1.38 -1.25 -2.12 0.00 0.00 175.29 172.75 2gj1 s PRO 445 N 0.52 4.25 -0.00 2.91 0.04 -1.26 -4.94 135.00 136.52 2gj1 s PRO 445 Ca 0.14 2.36 0.03 0.00 0.04 0.00 0.00 61.00 63.58 2gj1 s PRO 445 Cb -0.22 -3.03 -0.04 0.00 0.04 0.00 0.00 34.50 31.25 2gj1 s PRO 445 CO -0.06 -0.34 0.13 1.63 0.04 0.00 0.00 177.00 178.40 2gj1 n LYS 446 N 0.72 4.56 -4.48 4.56 4.76 -1.26 -4.61 118.16 122.41 2gj1 n LYS 446 Ca 0.01 -0.01 -0.23 0.00 -2.87 0.00 0.00 58.31 55.21 2gj1 n LYS 446 Cb 0.41 -0.76 -0.10 0.00 -1.84 0.00 0.00 35.03 32.74 2gj1 n LYS 446 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2gj1 s THR 447 N -1.53 1.76 0.17 -0.18 -4.23 -1.26 -4.72 115.64 105.65 2gj1 s THR 447 Ca 0.01 -2.11 -0.18 0.00 -1.18 0.00 0.00 61.69 58.23 2gj1 s THR 447 Cb 0.02 -2.61 0.09 0.00 1.34 0.00 0.00 72.50 71.35 2gj1 s THR 447 CO 0.14 -0.20 1.66 0.25 -0.54 0.00 0.00 174.62 175.93 2gj1 h LEU 448 N 2.14 -0.43 -1.28 4.79 6.46 -1.96 0.15 115.31 125.17 2gj1 h LEU 448 Ca -0.41 0.12 -0.06 0.00 -0.12 0.00 0.00 57.88 57.41 2gj1 h LEU 448 Cb 1.24 0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 41.42 2gj1 h LEU 448 CO 0.70 -0.15 -0.20 0.50 -0.62 0.00 0.00 178.44 178.67 2gj1 h LYS 449 N -0.03 0.24 -0.36 1.25 1.63 -1.98 0.11 116.57 117.42 2gj1 h LYS 449 Ca 0.19 -0.07 -0.08 0.00 -0.85 0.00 0.00 60.65 59.84 2gj1 h LYS 449 Cb 0.32 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.91 2gj1 h LYS 449 CO -0.41 0.44 -0.09 0.78 -3.45 0.00 0.00 179.45 176.71 2gj1 h GLY 450 N 0.87 0.76 1.49 5.01 0.00 -1.71 -2.61 103.07 106.87 2gj1 h GLY 450 Ca 0.04 -0.63 -0.11 0.00 0.00 0.00 0.00 47.33 46.63 2gj1 h GLY 450 CO 0.03 0.58 -0.26 -2.00 0.00 0.00 0.00 176.54 174.89 2gj1 h LEU 451 N 0.50 0.60 -0.36 3.11 5.85 -0.21 -2.23 115.31 122.57 2gj1 h LEU 451 Ca 0.09 -0.21 0.01 0.00 0.84 0.00 0.00 57.88 58.61 2gj1 h LEU 451 Cb 0.60 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 2gj1 h LEU 451 CO 0.04 0.84 0.21 1.56 -0.34 0.00 0.00 178.44 180.75 2gj1 h GLN 452 N 0.51 0.42 -0.59 1.25 4.20 -0.77 0.36 115.11 120.50 2gj1 h GLN 452 Ca 0.07 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.70 2gj1 h GLN 452 Cb 0.72 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 2gj1 h GLN 452 CO 0.06 0.28 0.16 1.15 -0.67 0.00 0.00 178.83 179.80 2gj1 h THR 453 N 0.43 1.25 -0.23 -0.54 2.02 -1.17 0.63 112.91 115.29 2gj1 h THR 453 Ca 0.14 -0.87 -0.08 0.00 0.77 0.00 0.00 66.41 66.37 2gj1 h THR 453 Cb -0.00 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.09 2gj1 h THR 453 CO -0.06 0.33 -0.16 0.58 0.37 0.00 0.00 175.52 176.58 2gj1 h VAL 454 N 0.85 1.31 0.00 3.16 2.07 -1.13 -3.08 116.25 119.43 2gj1 h VAL 454 Ca 0.19 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.43 2gj1 h VAL 454 Cb 0.33 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.73 2gj1 h VAL 454 CO -0.00 0.39 0.00 -0.07 0.02 0.00 0.00 177.57 177.91 2gj1 h LEU 455 N 0.22 0.00 -0.49 2.57 4.07 -0.86 -3.43 115.31 117.39 2gj1 h LEU 455 Ca 0.05 0.00 -0.45 0.00 0.08 0.00 0.00 57.88 57.55 2gj1 h LEU 455 Cb 0.68 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.38 2gj1 h LEU 455 CO 0.04 0.00 -0.70 0.29 -1.08 0.00 0.00 178.44 176.99 2gj1 n LYS 456 N -2.44 -5.08 -3.49 1.13 5.02 0.22 -4.48 118.16 109.03 2gj1 n LYS 456 Ca 0.05 0.61 -0.04 0.00 -2.02 0.00 0.00 58.31 56.91 2gj1 n LYS 456 Cb 0.44 -5.47 -0.06 0.00 -0.02 0.00 0.00 35.03 29.92 2gj1 n LYS 456 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2gj1 s ASN 457 N -3.13 -0.61 0.03 4.39 3.84 -1.07 -5.04 114.94 113.35 2gj1 s ASN 457 Ca 0.59 0.97 -0.21 0.00 0.21 0.00 0.00 52.86 54.41 2gj1 s ASN 457 Cb -0.29 1.72 -0.15 0.00 -0.55 0.00 0.00 41.25 41.98 2gj1 s ASN 457 CO 0.72 -0.25 1.34 0.11 -2.79 0.00 0.00 177.10 176.24 2gj1 h LYS 458 N 8.10 0.31 -0.17 0.43 1.57 -1.93 -2.88 116.57 122.00 2gj1 h LYS 458 Ca -0.19 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.41 2gj1 h LYS 458 Cb 1.13 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.43 2gj1 h LYS 458 CO 0.17 0.69 -0.00 0.82 -0.57 0.00 0.00 179.45 180.57 2gj1 h ILE 459 N -0.07 1.25 -0.27 1.86 5.03 -1.99 -2.10 117.51 121.23 2gj1 h ILE 459 Ca 0.02 -0.85 0.01 0.00 -0.12 0.00 0.00 64.86 63.93 2gj1 h ILE 459 Cb 0.63 1.48 -0.02 0.00 -3.03 0.00 0.00 36.82 35.88 2gj1 h ILE 459 CO 0.03 0.25 0.14 0.25 -0.68 0.00 0.00 178.15 178.15 2gj1 h LEU 460 N 0.05 0.22 -0.86 1.44 5.85 -1.95 -1.63 115.31 118.43 2gj1 h LEU 460 Ca 0.05 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.81 2gj1 h LEU 460 Cb 0.38 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.32 2gj1 h LEU 460 CO 0.01 0.17 0.55 0.00 -0.34 0.00 0.00 178.44 178.83 2gj1 h ALA 461 N 1.13 1.13 -0.43 1.25 0.00 -1.43 -1.50 119.26 119.40 2gj1 h ALA 461 Ca 0.11 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 2gj1 h ALA 461 Cb 0.02 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2gj1 h ALA 461 CO -0.06 0.40 0.07 -0.22 0.00 0.00 0.00 179.25 179.43 2gj1 h LYS 462 N 1.08 0.72 -0.49 0.00 3.64 -1.14 -0.46 116.57 119.93 2gj1 h LYS 462 Ca 0.34 -0.20 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 2gj1 h LYS 462 Cb -0.00 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 2gj1 h LYS 462 CO -0.11 0.76 0.21 0.87 -2.27 0.00 0.00 179.45 178.90 2gj1 h LYS 463 N 0.58 0.71 -0.84 1.90 1.57 -1.00 -1.68 116.57 117.82 2gj1 h LYS 463 Ca 0.13 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2gj1 h LYS 463 Cb 0.39 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.54 2gj1 h LYS 463 CO 0.01 0.63 0.50 -0.07 -0.57 0.00 0.00 179.45 179.95 2gj1 h LEU 464 N 0.64 1.02 -0.32 2.94 4.07 -1.10 -2.59 115.31 119.96 2gj1 h LEU 464 Ca 0.16 -0.07 -0.06 0.00 0.08 0.00 0.00 57.88 57.99 2gj1 h LEU 464 Cb 0.17 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.64 2gj1 h LEU 464 CO -0.02 0.79 -0.04 0.24 -1.08 0.00 0.00 178.44 178.33 2gj1 h MET 465 N 1.16 0.59 -0.20 1.13 2.86 -0.87 -0.34 114.93 119.27 2gj1 h MET 465 Ca 0.30 -0.21 0.02 0.00 -2.06 0.00 0.00 59.70 57.75 2gj1 h MET 465 Cb -0.04 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 2gj1 h MET 465 CO -0.06 0.75 0.14 -0.44 1.06 0.00 0.00 176.91 178.36 2gj1 h ASP 466 N 0.38 0.18 0.15 1.22 3.32 -1.18 0.56 116.42 121.05 2gj1 h ASP 466 Ca 0.09 -0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.79 2gj1 h ASP 466 Cb 0.51 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.01 2gj1 h ASP 466 CO 0.02 0.13 -1.79 -0.07 -1.72 0.00 0.00 179.24 175.81 2gj1 h LEU 467 N 0.21 0.49 0.00 1.55 3.38 -1.31 -3.41 115.31 116.22 2gj1 h LEU 467 Ca 0.08 -0.92 -0.14 0.00 0.09 0.00 0.00 57.88 56.98 2gj1 h LEU 467 Cb 0.07 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 2gj1 h LEU 467 CO -0.02 1.79 -2.10 -1.22 0.09 0.00 0.00 178.44 176.98 2gj1 n TYR 468 N -3.62 0.05 0.00 1.13 4.01 -0.15 -4.24 117.16 114.35 2gj1 n TYR 468 Ca -0.28 0.02 0.00 0.00 -0.16 0.00 0.00 57.90 57.48 2gj1 n TYR 468 Cb 1.03 -0.72 0.00 0.00 -0.31 0.00 0.00 39.34 39.34 2gj1 n TYR 468 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2gj1 n LYS 469 N -2.47 0.00 -3.70 -0.72 4.76 0.20 -4.76 118.16 111.46 2gj1 n LYS 469 Ca -0.15 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.18 2gj1 n LYS 469 Cb 0.80 -0.74 -0.10 0.00 -1.84 0.00 0.00 35.03 33.15 2gj1 n LYS 469 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 2gj1 s THR 470 N -0.20 -0.01 0.66 -0.18 -1.32 -1.26 -5.01 115.64 108.31 2gj1 s THR 470 Ca 0.00 0.05 0.40 0.00 -1.21 0.00 0.00 61.69 60.93 2gj1 s THR 470 Cb 0.00 -0.64 0.41 0.00 -1.51 0.00 0.00 72.50 70.76 2gj1 s THR 470 CO 0.00 0.02 2.27 -0.65 -2.21 0.00 0.00 174.62 174.05 2gj1 h PRO 471 N 6.50 0.00 -0.22 7.08 0.11 -1.84 0.94 132.00 144.56 2gj1 h PRO 471 Ca -0.33 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.78 2gj1 h PRO 471 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2gj1 h PRO 471 CO 0.26 0.00 0.12 -0.44 -0.21 0.00 0.00 178.00 177.74 2gj1 h ASP 472 N 0.00 0.26 0.37 -2.05 3.32 -1.95 -2.99 116.42 113.38 2gj1 h ASP 472 Ca 0.01 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2gj1 h ASP 472 Cb 0.15 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.64 2gj1 h ASP 472 CO -0.00 0.21 -0.22 0.59 -1.72 0.00 0.00 179.24 178.10 2gj1 n ASN 473 N -4.48 0.68 -4.69 6.45 4.13 0.33 -3.95 115.26 113.72 2gj1 n ASN 473 Ca 0.00 -0.59 -0.42 0.00 1.68 0.00 0.00 54.58 55.25 2gj1 n ASN 473 Cb 0.09 0.04 -0.03 0.00 -1.54 0.00 0.00 39.78 38.34 2gj1 n ASN 473 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2gj1 s ILE 474 N -2.60 3.01 0.40 2.41 1.01 -1.13 -4.84 121.20 119.46 2gj1 s ILE 474 Ca 0.23 0.51 -0.27 0.00 0.00 0.00 0.00 60.65 61.12 2gj1 s ILE 474 Cb 0.19 -3.33 -0.10 0.00 0.01 0.00 0.00 42.46 39.23 2gj1 s ILE 474 CO 0.53 0.00 1.44 -1.81 0.00 0.00 0.00 174.94 175.11 2gj1 s ASP 475 N 2.20 6.24 0.26 3.58 1.01 -1.26 -1.26 116.67 127.43 2gj1 s ASP 475 Ca 0.73 2.96 -0.04 0.00 0.71 0.00 0.00 52.55 56.90 2gj1 s ASP 475 Cb -0.40 -2.66 0.32 0.00 1.01 0.00 0.00 42.92 41.19 2gj1 s ASP 475 CO 0.32 -0.93 1.90 -0.29 0.21 0.00 0.00 175.17 176.38 2gj1 h ILE 476 N 2.74 1.18 -0.39 0.77 6.09 -1.89 -1.08 117.51 124.93 2gj1 h ILE 476 Ca -0.51 -0.43 0.04 0.00 -1.37 0.00 0.00 64.86 62.59 2gj1 h ILE 476 Cb 1.25 -0.20 -0.04 0.00 0.47 0.00 0.00 36.82 38.30 2gj1 h ILE 476 CO 0.63 0.23 0.16 -0.25 -3.07 0.00 0.00 178.15 175.85 2gj1 h TRP 477 N 1.26 0.28 0.16 2.19 7.01 -1.90 0.96 115.95 125.91 2gj1 h TRP 477 Ca 0.40 0.02 -0.31 0.00 2.11 0.00 0.00 58.89 61.11 2gj1 h TRP 477 Cb -0.00 -0.07 0.01 0.00 -2.10 0.00 0.00 29.16 27.00 2gj1 h TRP 477 CO -0.00 0.13 -1.44 0.97 -2.79 0.00 0.00 178.44 175.30 2gj1 h ILE 478 N 0.33 1.29 -0.22 2.65 2.10 -1.89 -3.01 117.51 118.75 2gj1 h ILE 478 Ca 0.17 -2.84 0.03 0.00 1.08 0.00 0.00 64.86 63.30 2gj1 h ILE 478 Cb 0.13 2.89 -0.03 0.00 -1.09 0.00 0.00 36.82 38.72 2gj1 h ILE 478 CO -0.16 0.85 0.03 1.23 -1.08 0.00 0.00 178.15 179.02 2gj1 h GLY 479 N 1.22 0.23 1.54 8.18 0.00 -1.07 -1.13 103.07 112.04 2gj1 h GLY 479 Ca -0.22 -0.01 -0.08 0.00 0.00 0.00 0.00 47.33 47.03 2gj1 h GLY 479 CO 0.20 -0.01 -0.13 -1.33 0.00 0.00 0.00 176.54 175.27 2gj1 h GLY 480 N 0.12 0.60 1.92 4.60 0.00 -0.92 -3.01 103.07 106.37 2gj1 h GLY 480 Ca 0.10 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2gj1 h GLY 480 CO -0.14 0.39 -0.06 3.43 0.00 0.00 0.00 176.54 180.16 2gj1 h ASN 481 N 0.51 0.00 1.50 0.19 4.21 -1.35 -3.27 115.58 117.37 2gj1 h ASN 481 Ca 0.09 -0.02 0.00 0.00 1.21 0.00 0.00 56.30 57.58 2gj1 h ASN 481 Cb 0.52 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.72 2gj1 h ASN 481 CO 0.03 0.01 0.00 0.00 -1.29 0.00 0.00 177.43 176.18 2gj1 h ALA 482 N 2.44 1.00 -2.72 -0.83 0.00 -1.07 -3.46 119.26 114.62 2gj1 h ALA 482 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.41 2gj1 h ALA 482 Cb 0.78 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.58 2gj1 h ALA 482 CO 0.00 0.00 0.44 -1.21 0.00 0.00 0.00 179.25 178.48 2gj1 s GLU 483 N -3.13 4.57 0.62 0.00 2.02 -1.23 -4.91 118.70 116.63 2gj1 s GLU 483 Ca 0.10 1.68 -0.19 0.00 0.02 0.00 0.00 54.97 56.59 2gj1 s GLU 483 Cb 0.11 -3.05 -0.02 0.00 0.10 0.00 0.00 34.13 31.27 2gj1 s GLU 483 CO 0.59 0.18 1.27 -2.14 0.02 0.00 0.00 175.26 175.19 2gj1 s PRO 484 N -1.65 2.74 0.48 0.39 0.02 -1.26 -4.26 135.00 131.46 2gj1 s PRO 484 Ca 0.47 2.01 -0.21 0.00 0.02 0.00 0.00 61.00 63.29 2gj1 s PRO 484 Cb -0.29 -1.91 -0.08 0.00 0.02 0.00 0.00 34.50 32.24 2gj1 s PRO 484 CO 0.36 -1.43 1.07 -1.64 -0.33 0.00 0.00 177.00 175.03 2gj1 s MET 485 N -3.31 3.75 0.76 5.54 -1.94 -1.26 -4.10 119.30 118.73 2gj1 s MET 485 Ca 0.80 1.48 -0.11 0.00 -1.71 0.00 0.00 55.69 56.15 2gj1 s MET 485 Cb -0.36 -2.17 0.04 0.00 2.01 0.00 0.00 34.83 34.35 2gj1 s MET 485 CO 0.38 -0.49 1.08 0.14 -0.01 0.00 0.00 175.02 176.12 2gj1 s VAL 486 N -1.84 3.47 0.07 -6.03 -7.23 -0.86 -4.91 120.40 103.06 2gj1 s VAL 486 Ca 0.67 0.48 -0.34 0.00 -1.81 0.00 0.00 61.98 60.98 2gj1 s VAL 486 Cb -0.20 -3.22 -0.13 0.00 0.56 0.00 0.00 36.38 33.40 2gj1 s VAL 486 CO 0.24 -0.62 1.71 1.21 -0.31 0.00 0.00 175.10 177.32 2gj1 n GLU 487 N -3.31 2.20 -1.53 4.82 2.13 -1.26 -1.86 120.64 121.83 2gj1 n GLU 487 Ca 0.07 0.80 -0.18 0.00 0.66 0.00 0.00 57.16 58.51 2gj1 n GLU 487 Cb 0.55 -2.60 -0.08 0.00 0.27 0.00 0.00 31.44 29.58 2gj1 n GLU 487 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2gj1 n ARG 488 N 4.76 -1.52 -1.85 5.31 1.74 -1.26 -1.29 116.66 122.56 2gj1 n ARG 488 Ca 0.19 1.14 0.00 0.00 -0.77 0.00 0.00 57.85 58.41 2gj1 n ARG 488 Cb 0.30 -5.54 0.00 0.00 -1.02 0.00 0.00 32.46 26.20 2gj1 n ARG 488 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2gj1 n GLY 489 N -0.23 4.14 0.25 -0.13 0.00 -0.78 -3.92 105.19 104.52 2gj1 n GLY 489 Ca -0.18 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 43.64 2gj1 n GLY 489 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gj1 n ARG 490 N -0.08 0.12 -4.17 1.61 5.12 0.32 -4.73 116.66 114.85 2gj1 n ARG 490 Ca 0.00 -0.84 -0.12 0.00 -1.93 0.00 0.00 57.85 54.96 2gj1 n ARG 490 Cb 0.00 -0.55 -0.10 0.00 -1.16 0.00 0.00 32.46 30.65 2gj1 n ARG 490 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 2gj1 s VAL 491 N -0.12 0.80 0.68 1.55 -7.23 -1.23 -4.95 120.40 109.89 2gj1 s VAL 491 Ca 0.01 -1.81 -0.12 0.00 -1.81 0.00 0.00 61.98 58.26 2gj1 s VAL 491 Cb 0.01 -1.53 0.16 0.00 0.56 0.00 0.00 36.38 35.58 2gj1 s VAL 491 CO 0.00 -0.74 0.91 0.61 -0.31 0.00 0.00 175.10 175.57 2gj1 n GLY 492 N 0.21 -1.44 0.13 2.32 0.00 -1.26 -2.03 105.19 103.12 2gj1 n GLY 492 Ca -0.14 -1.69 -0.08 0.00 0.00 0.00 0.00 46.02 44.11 2gj1 n GLY 492 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2gj1 h PRO 493 N 0.00 0.28 -0.02 1.61 0.11 -1.90 -0.11 132.00 131.97 2gj1 h PRO 493 Ca -0.30 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.81 2gj1 h PRO 493 Cb 0.82 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.85 2gj1 h PRO 493 CO 0.21 0.19 -0.06 1.25 -0.21 0.00 0.00 178.00 179.37 2gj1 h LEU 494 N 0.29 -0.18 -0.58 2.35 5.85 -1.94 -2.38 115.31 118.71 2gj1 h LEU 494 Ca 0.12 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.84 2gj1 h LEU 494 Cb 0.04 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 2gj1 h LEU 494 CO -0.08 -0.09 0.25 -0.07 -0.34 0.00 0.00 178.44 178.11 2gj1 h LEU 495 N -0.10 0.79 -0.80 2.25 4.07 -1.80 -1.62 115.31 118.10 2gj1 h LEU 495 Ca 0.03 -0.16 0.08 0.00 0.08 0.00 0.00 57.88 57.92 2gj1 h LEU 495 Cb 0.14 -0.20 -0.07 0.00 1.08 0.00 0.00 40.66 41.61 2gj1 h LEU 495 CO -0.08 0.73 0.46 0.00 -1.08 0.00 0.00 178.44 178.47 2gj1 h ALA 496 N 1.09 1.11 0.11 1.53 0.00 -0.92 0.31 119.26 122.49 2gj1 h ALA 496 Ca 0.20 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2gj1 h ALA 496 Cb 0.17 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2gj1 h ALA 496 CO -0.02 0.12 -0.05 0.00 0.00 0.00 0.00 179.25 179.30 2gj1 h LEU 498 N -0.33 0.42 0.18 0.00 3.38 -0.84 -1.55 115.31 116.56 2gj1 h LEU 498 Ca -0.02 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 2gj1 h LEU 498 Cb 0.27 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2gj1 h LEU 498 CO 0.03 0.46 -0.09 -0.07 0.09 0.00 0.00 178.44 178.86 2gj1 h LEU 499 N 0.34 -0.21 -0.55 1.67 3.38 -0.45 -2.95 115.31 116.55 2gj1 h LEU 499 Ca 0.10 -0.16 0.08 0.00 0.09 0.00 0.00 57.88 57.99 2gj1 h LEU 499 Cb 0.17 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 40.91 2gj1 h LEU 499 CO -0.01 0.04 0.19 1.23 0.09 0.00 0.00 178.44 179.99 2gj1 h GLY 500 N -0.46 0.74 1.00 0.83 0.00 -0.69 -1.61 103.07 102.88 2gj1 h GLY 500 Ca -0.02 -0.10 -0.00 0.00 0.00 0.00 0.00 47.33 47.20 2gj1 h GLY 500 CO 0.04 -0.00 0.35 3.21 0.00 0.00 0.00 176.54 180.14 2gj1 h ARG 501 N 0.37 0.77 -0.21 4.80 3.08 -1.33 -1.77 114.38 120.09 2gj1 h ARG 501 Ca 0.27 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.24 2gj1 h ARG 501 Cb 0.31 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 2gj1 h ARG 501 CO -0.27 0.54 0.08 0.37 -1.07 0.00 0.00 179.97 179.62 2gj1 h GLN 502 N 0.77 0.31 -0.28 0.04 5.75 -1.25 -2.17 115.11 118.27 2gj1 h GLN 502 Ca 0.20 -0.06 -0.07 0.00 -0.15 0.00 0.00 58.65 58.58 2gj1 h GLN 502 Cb -0.03 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.45 2gj1 h GLN 502 CO -0.04 0.38 -0.12 0.74 -2.65 0.00 0.00 178.83 177.14 2gj1 h PHE 503 N 0.18 0.50 -0.71 3.99 0.04 -1.24 -1.92 116.94 117.77 2gj1 h PHE 503 Ca 0.07 -0.07 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 2gj1 h PHE 503 Cb 0.18 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 38.16 2gj1 h PHE 503 CO -0.01 0.58 0.41 0.37 -0.60 0.00 0.00 178.31 179.06 2gj1 h GLN 504 N 0.44 0.97 -0.38 1.51 -0.00 -1.13 -2.79 115.11 113.73 2gj1 h GLN 504 Ca 0.08 -0.10 -0.06 0.00 -0.00 0.00 0.00 58.65 58.57 2gj1 h GLN 504 Cb 0.47 -0.20 -0.01 0.00 0.00 0.00 0.00 27.48 27.74 2gj1 h GLN 504 CO 0.03 0.70 -0.01 1.96 0.00 0.00 0.00 178.83 181.50 2gj1 h GLN 505 N 0.97 0.68 0.00 1.69 4.20 -0.77 -0.41 115.11 121.47 2gj1 h GLN 505 Ca 0.25 -0.22 -0.08 0.00 0.06 0.00 0.00 58.65 58.66 2gj1 h GLN 505 Cb -0.01 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 2gj1 h GLN 505 CO -0.05 0.79 -0.38 -0.84 -0.67 0.00 0.00 178.83 177.69 2gj1 h ILE 506 N 0.50 1.03 0.19 2.54 3.07 -1.38 0.66 117.51 124.12 2gj1 h ILE 506 Ca 0.11 -1.40 -0.01 0.00 1.55 0.00 0.00 64.86 65.10 2gj1 h ILE 506 Cb 0.49 1.81 0.00 0.00 -0.27 0.00 0.00 36.82 38.85 2gj1 h ILE 506 CO 0.02 0.37 -0.09 -0.09 -1.05 0.00 0.00 178.15 177.31 2gj1 h ARG 507 N 0.00 -0.25 0.00 0.16 1.12 -1.44 -3.23 114.38 110.75 2gj1 h ARG 507 Ca -0.00 0.02 -0.05 0.00 -1.11 0.00 0.00 59.98 58.84 2gj1 h ARG 507 Cb 0.78 0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 30.79 2gj1 h ARG 507 CO 0.05 0.07 -0.22 -0.44 -3.11 0.00 0.00 179.97 176.32 2gj1 h ASP 508 N -0.98 0.00 -0.62 -3.80 3.32 -0.99 -2.74 116.42 110.61 2gj1 h ASP 508 Ca -0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.02 2gj1 h ASP 508 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 2gj1 h ASP 508 CO 0.04 0.22 0.00 0.61 -1.72 0.00 0.00 179.24 178.39 2gj1 n GLY 509 N -0.77 1.96 3.46 2.75 0.00 0.22 -1.11 105.19 111.70 2gj1 n GLY 509 Ca -0.02 -0.68 -0.40 0.00 0.00 0.00 0.00 46.02 44.92 2gj1 n GLY 509 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2gj1 s ASP 510 N -0.98 5.85 0.52 1.61 2.15 -1.04 -4.72 116.67 120.06 2gj1 s ASP 510 Ca 0.42 -0.67 0.28 0.00 0.43 0.00 0.00 52.55 53.01 2gj1 s ASP 510 Cb 0.22 -2.08 1.39 0.00 -0.30 0.00 0.00 42.92 42.16 2gj1 s ASP 510 CO 0.27 -0.30 2.03 -0.09 -0.17 0.00 0.00 175.17 176.92 2gj1 h ARG 511 N 8.46 0.00 -0.59 4.34 2.43 -1.88 -2.56 114.38 124.59 2gj1 h ARG 511 Ca -0.29 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 2gj1 h ARG 511 Cb 1.14 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 2gj1 h ARG 511 CO 0.65 0.13 0.00 1.19 -1.51 0.00 0.00 179.97 180.43 2gj1 n PHE 512 N -3.51 1.68 -1.68 2.20 3.01 -1.26 -4.92 117.46 112.99 2gj1 n PHE 512 Ca -0.01 -0.68 -0.44 0.00 1.01 0.00 0.00 57.45 57.32 2gj1 n PHE 512 Cb 0.27 -0.36 -0.02 0.00 -0.01 0.00 0.00 39.48 39.36 2gj1 n PHE 512 CO 0.00 0.00 0.00 1.87 1.01 0.00 0.00 176.76 179.64 2gj1 n TRP 513 N 0.78 2.21 0.05 1.38 -0.00 -0.96 -4.85 117.44 116.06 2gj1 n TRP 513 Ca 0.26 0.43 0.19 0.00 -0.00 0.00 0.00 57.50 58.38 2gj1 n TRP 513 Cb 1.02 -2.47 0.70 0.00 -0.00 0.00 0.00 31.31 30.56 2gj1 n TRP 513 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 177.69 177.80 2gj1 h TRP 514 N 4.17 0.00 0.00 5.87 5.08 -1.93 0.20 115.95 129.34 2gj1 h TRP 514 Ca -0.45 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.52 2gj1 h TRP 514 Cb 1.27 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.43 2gj1 h TRP 514 CO 0.56 0.00 -0.41 0.39 -1.28 0.00 0.00 178.44 177.71 2gj1 n GLU 515 N -4.29 0.00 -1.97 0.12 1.02 -1.26 -4.44 120.64 109.83 2gj1 n GLU 515 Ca 0.08 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.79 2gj1 n GLU 515 Cb 0.53 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.42 2gj1 n GLU 515 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2gj1 s ASN 516 N -3.02 6.37 0.13 1.62 2.47 0.06 -4.90 114.94 117.67 2gj1 s ASN 516 Ca 0.11 1.97 -0.34 0.00 0.42 0.00 0.00 52.86 55.02 2gj1 s ASN 516 Cb 0.18 -2.53 -0.17 0.00 -1.45 0.00 0.00 41.25 37.28 2gj1 s ASN 516 CO 0.67 -1.21 1.05 -2.65 -3.72 0.00 0.00 177.10 171.24 2gj1 n PRO 517 N 7.61 0.70 0.00 0.43 -0.02 -1.26 -1.70 135.00 140.76 2gj1 n PRO 517 Ca 0.20 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2gj1 n PRO 517 Cb 0.44 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 32.24 2gj1 n PRO 517 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gj1 n GLY 518 N 1.92 2.83 0.08 -1.23 0.00 -1.26 -4.90 105.19 102.64 2gj1 n GLY 518 Ca 0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 2gj1 n GLY 518 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2gj1 h VAL 519 N 0.00 1.31 -2.03 1.61 2.07 -1.65 -3.46 116.25 114.10 2gj1 h VAL 519 Ca 0.00 -1.54 -0.59 0.00 0.82 0.00 0.00 66.70 65.39 2gj1 h VAL 519 Cb 0.00 2.28 -0.13 0.00 -1.52 0.00 0.00 31.29 31.92 2gj1 h VAL 519 CO 0.00 0.37 -0.65 -0.36 0.02 0.00 0.00 177.57 176.95 2gj1 s PHE 520 N -3.21 2.33 0.55 1.57 0.40 -1.26 -5.12 117.98 113.24 2gj1 s PHE 520 Ca -0.15 -0.63 -0.04 0.00 -0.60 0.00 0.00 56.93 55.51 2gj1 s PHE 520 Cb -0.00 -1.47 0.00 0.00 0.51 0.00 0.00 43.02 42.06 2gj1 s PHE 520 CO 0.59 0.44 0.84 0.95 0.70 0.00 0.00 175.22 178.74 2gj1 s THR 521 N -2.77 3.89 0.28 0.64 -4.23 -1.26 -4.86 115.64 107.33 2gj1 s THR 521 Ca 0.33 -0.08 0.01 0.00 -1.18 0.00 0.00 61.69 60.78 2gj1 s THR 521 Cb 0.06 -3.51 0.26 0.00 1.34 0.00 0.00 72.50 70.65 2gj1 s THR 521 CO 0.16 -0.49 1.77 -0.33 -0.54 0.00 0.00 174.62 175.19 2gj1 h GLU 522 N -0.00 0.66 -0.13 3.99 5.08 -2.00 0.22 114.58 122.39 2gj1 h GLU 522 Ca -0.46 -0.04 -0.13 0.00 -1.00 0.00 0.00 59.36 57.74 2gj1 h GLU 522 Cb 1.25 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 2gj1 h GLU 522 CO 0.60 0.44 -0.47 -0.22 -1.00 0.00 0.00 179.01 178.35 2gj1 h LYS 523 N 0.68 0.34 -0.16 2.33 3.64 -1.97 0.24 116.57 121.66 2gj1 h LYS 523 Ca 0.50 -0.18 -0.08 0.00 -1.27 0.00 0.00 60.65 59.62 2gj1 h LYS 523 Cb 0.73 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.56 2gj1 h LYS 523 CO -0.37 0.74 -0.22 1.96 -2.27 0.00 0.00 179.45 179.29 2gj1 h GLN 524 N 0.27 0.44 -0.66 1.90 4.20 -1.57 -2.41 115.11 117.28 2gj1 h GLN 524 Ca 0.02 -0.25 0.00 0.00 0.06 0.00 0.00 58.65 58.47 2gj1 h GLN 524 Cb 0.94 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.71 2gj1 h GLN 524 CO 0.08 0.84 0.42 0.00 -0.67 0.00 0.00 178.83 179.49 2gj1 h ARG 525 N 0.07 0.88 -0.56 1.46 3.08 -0.40 -0.14 114.38 118.77 2gj1 h ARG 525 Ca 0.02 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.96 2gj1 h ARG 525 Cb 0.78 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 2gj1 h ARG 525 CO 0.05 0.60 0.17 0.22 -1.07 0.00 0.00 179.97 179.94 2gj1 h ASP 526 N 0.90 0.78 0.31 7.04 1.82 -0.87 -2.26 116.42 124.15 2gj1 h ASP 526 Ca 0.24 -0.13 -0.21 0.00 -0.39 0.00 0.00 57.03 56.55 2gj1 h ASP 526 Cb -0.07 -0.20 -0.00 0.00 0.68 0.00 0.00 39.33 39.74 2gj1 h ASP 526 CO -0.05 0.75 -0.84 -1.28 -1.61 0.00 0.00 179.24 176.21 2gj1 h SER 527 N 0.82 0.50 0.44 2.28 0.87 -0.71 -3.30 113.55 114.45 2gj1 h SER 527 Ca 0.19 -0.37 -0.07 0.00 -1.23 0.00 0.00 61.79 60.31 2gj1 h SER 527 Cb 0.25 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 2gj1 h SER 527 CO -0.01 1.14 -0.35 -0.07 -0.53 0.00 0.00 176.83 177.02 2gj1 h LEU 528 N 0.25 0.00 -1.64 2.23 3.38 -0.66 -2.94 115.31 115.92 2gj1 h LEU 528 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2gj1 h LEU 528 Cb 1.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.20 2gj1 h LEU 528 CO 0.14 0.35 0.00 1.56 0.09 0.00 0.00 178.44 180.58 2gj1 h GLN 529 N 0.00 0.00 -0.17 1.13 4.20 -1.50 -2.71 115.11 116.06 2gj1 h GLN 529 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2gj1 h GLN 529 Cb 0.66 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.44 2gj1 h GLN 529 CO 0.04 0.00 0.00 1.63 -0.67 0.00 0.00 178.83 179.83 2gj1 n LYS 530 N -2.44 2.12 -1.70 1.46 5.02 -1.11 -4.95 118.16 116.56 2gj1 n LYS 530 Ca -0.01 -1.65 -0.33 0.00 -2.02 0.00 0.00 58.31 54.29 2gj1 n LYS 530 Cb 0.07 -1.46 0.05 0.00 -0.02 0.00 0.00 35.03 33.67 2gj1 n LYS 530 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2gj1 s VAL 531 N -1.80 3.16 0.05 -0.18 -7.23 -1.02 -4.79 120.40 108.59 2gj1 s VAL 531 Ca 0.34 0.53 -0.23 0.00 -1.81 0.00 0.00 61.98 60.81 2gj1 s VAL 531 Cb 0.20 -3.05 0.06 0.00 0.56 0.00 0.00 36.38 34.15 2gj1 s VAL 531 CO 0.30 -0.34 0.55 -0.94 -0.31 0.00 0.00 175.10 174.36 2gj1 s SER 532 N -2.58 -0.48 0.41 4.85 1.04 -1.26 -4.99 113.70 110.68 2gj1 s SER 532 Ca 0.67 0.22 0.14 0.00 0.48 0.00 0.00 55.95 57.47 2gj1 s SER 532 Cb -0.21 0.51 0.88 0.00 0.10 0.00 0.00 66.02 67.29 2gj1 s SER 532 CO 0.43 -0.73 1.91 0.15 0.98 0.00 0.00 173.24 175.97 2gj1 h PHE 533 N 2.72 0.00 -0.23 5.02 3.57 -1.96 -2.46 116.94 123.60 2gj1 h PHE 533 Ca -0.31 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.22 2gj1 h PHE 533 Cb 1.21 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.92 2gj1 h PHE 533 CO 0.35 0.28 0.05 0.77 -2.23 0.00 0.00 178.31 177.52 2gj1 h SER 534 N 0.00 0.01 -0.84 0.41 0.02 -1.88 -1.72 113.55 109.56 2gj1 h SER 534 Ca -0.00 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 2gj1 h SER 534 Cb 0.50 0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.05 2gj1 h SER 534 CO 0.04 0.04 0.46 -0.09 -1.14 0.00 0.00 176.83 176.13 2gj1 h ARG 535 N 0.14 1.17 -0.59 3.45 9.65 -1.80 -2.01 114.38 124.39 2gj1 h ARG 535 Ca 0.11 -0.14 0.08 0.00 -1.10 0.00 0.00 59.98 58.93 2gj1 h ARG 535 Cb 0.10 -0.23 -0.06 0.00 -1.39 0.00 0.00 29.97 28.39 2gj1 h ARG 535 CO -0.14 0.86 0.24 1.25 2.80 0.00 0.00 179.97 184.98 2gj1 h LEU 536 N 1.17 0.27 0.39 3.80 5.85 -0.95 -0.71 115.31 125.12 2gj1 h LEU 536 Ca 0.29 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 59.06 2gj1 h LEU 536 Cb 0.04 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.10 2gj1 h LEU 536 CO -0.05 0.17 -0.19 0.40 -0.34 0.00 0.00 178.44 178.43 2gj1 h ILE 537 N 0.44 0.62 -0.69 4.05 2.04 -0.80 -2.46 117.51 120.70 2gj1 h ILE 537 Ca 0.29 -0.13 0.15 0.00 1.00 0.00 0.00 64.86 66.17 2gj1 h ILE 537 Cb 0.32 0.69 -0.11 0.00 -0.74 0.00 0.00 36.82 36.97 2gj1 h ILE 537 CO -0.27 0.03 0.09 0.00 0.00 0.00 0.00 178.15 178.00 2gj1 h ASP 539 N 0.19 0.00 0.00 0.00 3.32 -1.11 -3.35 116.42 115.48 2gj1 h ASP 539 Ca 0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.43 2gj1 h ASP 539 Cb 0.64 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.19 2gj1 h ASP 539 CO -0.53 0.10 0.00 0.59 -1.72 0.00 0.00 179.24 177.67 2gj1 n ASN 540 N -3.16 1.70 -2.07 6.45 3.02 -0.59 -5.05 115.26 115.55 2gj1 n ASN 540 Ca 0.02 -1.84 -0.09 0.00 -0.03 0.00 0.00 54.58 52.64 2gj1 n ASN 540 Cb 0.46 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.59 2gj1 n ASN 540 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2gj1 n THR 541 N -0.42 0.00 -0.67 3.41 -2.24 -0.16 -4.98 114.28 109.22 2gj1 n THR 541 Ca 0.00 -1.12 0.08 0.00 -2.27 0.00 0.00 64.05 60.74 2gj1 n THR 541 Cb 0.28 0.55 0.29 0.00 -2.10 0.00 0.00 70.33 69.34 2gj1 n THR 541 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2gj1 n HIS 542 N -0.30 1.15 -2.48 4.78 8.25 -1.26 -4.83 115.22 120.53 2gj1 n HIS 542 Ca 0.03 -0.68 -0.40 0.00 -0.26 0.00 0.00 57.72 56.40 2gj1 n HIS 542 Cb 0.28 -0.25 -0.04 0.00 1.12 0.00 0.00 29.99 31.10 2gj1 n HIS 542 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2gj1 s ILE 543 N -2.07 3.55 -0.02 1.59 -1.09 -1.26 -4.94 121.20 116.96 2gj1 s ILE 543 Ca 0.43 1.52 0.08 0.00 -2.23 0.00 0.00 60.65 60.44 2gj1 s ILE 543 Cb 0.30 -3.97 -0.12 0.00 -1.58 0.00 0.00 42.46 37.09 2gj1 s ILE 543 CO 0.17 0.34 0.15 0.35 -1.23 0.00 0.00 174.94 174.73 2gj1 n THR 544 N 1.43 0.08 -3.89 2.92 -2.24 -1.26 -4.66 114.28 106.66 2gj1 n THR 544 Ca -0.00 -0.21 -0.35 0.00 -2.27 0.00 0.00 64.05 61.22 2gj1 n THR 544 Cb 0.45 0.14 -0.14 0.00 -2.10 0.00 0.00 70.33 68.69 2gj1 n THR 544 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2gj1 s LYS 545 N -2.50 3.37 0.06 -0.78 -0.14 -1.26 -0.08 119.74 118.41 2gj1 s LYS 545 Ca -0.03 -0.64 0.01 0.00 -1.36 0.00 0.00 55.97 53.96 2gj1 s LYS 545 Cb 0.05 -3.06 -0.03 0.00 -1.68 0.00 0.00 37.83 33.11 2gj1 s LYS 545 CO 0.33 -0.22 -0.06 0.14 -0.76 0.00 0.00 175.35 174.78 2gj1 s VAL 546 N 1.49 0.52 0.89 3.17 -7.23 -0.41 -4.87 120.40 113.96 2gj1 s VAL 546 Ca 0.05 -1.45 -0.14 0.00 -1.81 0.00 0.00 61.98 58.63 2gj1 s VAL 546 Cb -0.15 -1.06 -0.01 0.00 0.56 0.00 0.00 36.38 35.72 2gj1 s VAL 546 CO -0.02 -0.64 0.27 -2.65 -0.31 0.00 0.00 175.10 171.75 2gj1 n PRO 547 N 0.78 -0.10 -0.02 4.82 -0.02 -1.26 -0.69 135.00 138.51 2gj1 n PRO 547 Ca -0.18 0.01 -0.10 0.00 -2.02 0.00 0.00 63.50 61.21 2gj1 n PRO 547 Cb 0.58 -1.73 -0.14 0.00 -0.02 0.00 0.00 33.50 32.19 2gj1 n PRO 547 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2gj1 n LEU 549 N -0.38 0.98 -4.00 2.45 4.32 -1.26 -4.67 117.00 114.43 2gj1 n LEU 549 Ca 0.06 0.37 -0.31 0.00 -0.02 0.00 0.00 56.01 56.11 2gj1 n LEU 549 Cb 0.53 0.08 -0.14 0.00 -1.62 0.00 0.00 43.42 42.27 2gj1 n LEU 549 CO 0.51 0.43 -0.21 -1.00 -1.22 0.00 0.00 177.39 175.91 2gj1 s HIS 550 N -2.59 3.43 -0.32 -1.77 3.76 -1.26 -4.84 115.29 111.70 2gj1 s HIS 550 Ca -0.07 -3.03 0.25 0.00 -0.15 0.00 0.00 55.06 52.07 2gj1 s HIS 550 Cb 0.08 -2.92 1.11 0.00 1.11 0.00 0.00 32.58 31.96 2gj1 s HIS 550 CO 0.82 -0.84 1.76 0.00 -0.85 0.00 0.00 174.74 175.63 2gj1 h ALA 551 N 7.03 1.00 0.00 -1.40 0.00 -1.99 -3.15 119.26 120.75 2gj1 h ALA 551 Ca -0.06 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2gj1 h ALA 551 Cb 0.95 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2gj1 h ALA 551 CO 0.64 0.00 -0.90 0.74 0.00 0.00 0.00 179.25 179.73 2gj1 h PHE 552 N 0.00 0.00 -3.55 0.00 0.04 -1.95 -3.42 116.94 108.06 2gj1 h PHE 552 Ca 0.00 0.00 -0.48 0.00 2.80 0.00 0.00 57.97 60.29 2gj1 h PHE 552 Cb 0.31 0.00 0.05 0.00 2.20 0.00 0.00 35.95 38.51 2gj1 h PHE 552 CO 0.00 0.14 0.14 1.14 -0.60 0.00 0.00 178.31 179.13 2gj1 s GLN 553 N -3.23 3.05 0.07 1.51 -2.07 -1.19 -1.28 119.66 116.51 2gj1 s GLN 553 Ca 0.00 -0.01 -0.31 0.00 -1.82 0.00 0.00 55.36 53.22 2gj1 s GLN 553 Cb 0.09 -2.32 -0.08 0.00 -1.09 0.00 0.00 33.01 29.61 2gj1 s GLN 553 CO 0.77 -0.57 1.55 0.00 -1.32 0.00 0.00 175.29 175.73 2gj1 s ALA 554 N -2.91 3.66 -0.09 2.60 0.00 -1.23 -3.70 121.76 120.09 2gj1 s ALA 554 Ca 0.52 1.14 0.03 0.00 0.00 0.00 0.00 51.96 53.64 2gj1 s ALA 554 Cb -0.10 -3.65 0.01 0.00 0.00 0.00 0.00 23.12 19.38 2gj1 s ALA 554 CO 0.44 -0.97 -0.17 -0.80 0.00 0.00 0.00 175.76 174.26 2gj1 s ASN 555 N 1.99 2.45 -0.11 0.00 -0.87 -1.26 -4.93 114.94 112.21 2gj1 s ASN 555 Ca 0.70 -0.43 -0.14 0.00 -1.57 0.00 0.00 52.86 51.42 2gj1 s ASN 555 Cb -0.38 -1.11 -0.05 0.00 -0.02 0.00 0.00 41.25 39.69 2gj1 s ASN 555 CO 0.30 0.07 0.32 0.20 -2.57 0.00 0.00 177.10 175.42 2gj1 s ASN 556 N 0.69 6.55 -0.07 -1.22 0.01 -1.26 -4.69 114.94 114.96 2gj1 s ASN 556 Ca -0.13 0.65 -0.15 0.00 -0.71 0.00 0.00 52.86 52.53 2gj1 s ASN 556 Cb -0.16 -2.20 -0.05 0.00 0.41 0.00 0.00 41.25 39.25 2gj1 s ASN 556 CO 0.03 0.18 0.37 -0.47 -1.51 0.00 0.00 177.10 175.71 2gj1 s TYR 557 N -0.10 3.62 -2.54 2.20 5.04 -1.26 -0.54 117.35 123.77 2gj1 s TYR 557 Ca 0.19 0.85 0.24 0.00 -2.44 0.00 0.00 57.07 55.91 2gj1 s TYR 557 Cb -0.14 -2.32 0.22 0.00 0.35 0.00 0.00 41.96 40.07 2gj1 s TYR 557 CO 0.07 0.48 1.25 -0.35 -1.34 0.00 0.00 175.55 175.66 2gj1 n PRO 558 N 2.54 1.78 -0.28 4.97 -0.05 -1.26 -4.95 135.00 137.76 2gj1 n PRO 558 Ca -0.13 -1.43 0.05 0.00 -0.05 0.00 0.00 63.50 61.94 2gj1 n PRO 558 Cb 0.52 -1.47 0.19 0.00 -0.05 0.00 0.00 33.50 32.70 2gj1 n PRO 558 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 175.50 176.70 2gj1 h HIS 559 N 3.50 0.69 -0.16 0.54 2.76 -1.94 -1.75 115.15 118.78 2gj1 h HIS 559 Ca 0.00 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 2gj1 h HIS 559 Cb 0.84 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 29.62 2gj1 h HIS 559 CO 0.00 0.18 0.00 -0.25 -1.30 0.00 0.00 177.93 176.56 2gj1 n ASP 560 N -4.89 1.68 -4.76 3.26 8.00 0.29 -4.88 116.55 115.25 2gj1 n ASP 560 Ca 0.15 -1.70 -0.36 0.00 0.71 0.00 0.00 54.79 53.59 2gj1 n ASP 560 Cb 0.39 -0.10 -0.08 0.00 -0.02 0.00 0.00 41.12 41.31 2gj1 n ASP 560 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2gj1 s PHE 561 N -1.79 3.39 0.38 1.24 0.40 -0.66 -4.21 117.98 116.72 2gj1 s PHE 561 Ca 0.32 0.32 0.08 0.00 -0.60 0.00 0.00 56.93 57.05 2gj1 s PHE 561 Cb 0.18 -1.95 -0.07 0.00 0.51 0.00 0.00 43.02 41.68 2gj1 s PHE 561 CO 0.27 0.50 -0.03 0.14 0.70 0.00 0.00 175.22 176.79 2gj1 s VAL 562 N -0.55 2.05 0.30 -0.44 -7.23 0.13 -4.88 120.40 109.77 2gj1 s VAL 562 Ca 0.11 -2.09 -0.28 0.00 -1.81 0.00 0.00 61.98 57.92 2gj1 s VAL 562 Cb -0.12 -2.83 -0.09 0.00 0.56 0.00 0.00 36.38 33.90 2gj1 s VAL 562 CO 0.02 -0.09 1.00 -0.62 -0.31 0.00 0.00 175.10 175.10 2gj1 s ASP 563 N -3.65 7.32 0.52 4.85 -1.08 -1.26 -1.29 116.67 122.09 2gj1 s ASP 563 Ca 0.34 2.02 0.29 0.00 -0.52 0.00 0.00 52.55 54.67 2gj1 s ASP 563 Cb 0.07 -2.60 1.42 0.00 -1.46 0.00 0.00 42.92 40.34 2gj1 s ASP 563 CO 0.17 -0.08 1.91 0.00 0.52 0.00 0.00 175.17 177.69 2gj1 n SER 565 N -4.32 0.00 0.01 0.00 7.64 -1.26 -1.76 113.62 113.94 2gj1 n SER 565 Ca 0.16 0.10 0.11 0.00 1.01 0.00 0.00 58.87 60.25 2gj1 n SER 565 Cb 0.85 -0.30 0.07 0.00 -1.01 0.00 0.00 64.21 63.82 2gj1 n SER 565 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2gj1 n THR 566 N -1.30 0.09 -3.26 0.44 -1.04 0.41 -4.91 114.28 104.71 2gj1 n THR 566 Ca 0.07 -0.12 -0.38 0.00 -2.04 0.00 0.00 64.05 61.58 2gj1 n THR 566 Cb 0.13 0.36 -0.06 0.00 -1.82 0.00 0.00 70.33 68.94 2gj1 n THR 566 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2gj1 s VAL 567 N -3.10 5.15 0.12 12.58 1.01 -0.72 -5.02 120.40 130.43 2gj1 s VAL 567 Ca 0.07 1.03 -0.35 0.00 0.00 0.00 0.00 61.98 62.73 2gj1 s VAL 567 Cb 0.16 -3.86 -0.16 0.00 0.00 0.00 0.00 36.38 32.52 2gj1 s VAL 567 CO 0.78 0.29 1.37 0.47 0.00 0.00 0.00 175.10 178.00 2gj1 n ASP 568 N 3.89 1.95 -4.93 3.32 9.92 -1.26 -4.99 116.55 124.45 2gj1 n ASP 568 Ca -0.06 1.12 -0.25 0.00 -0.53 0.00 0.00 54.79 55.07 2gj1 n ASP 568 Cb 0.51 -1.25 -0.00 0.00 -0.64 0.00 0.00 41.12 39.74 2gj1 n ASP 568 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2gj1 s LYS 569 N 0.40 3.41 -0.16 -1.24 1.02 -1.26 -4.80 119.74 117.11 2gj1 s LYS 569 Ca 0.81 -0.17 -0.25 0.00 0.02 0.00 0.00 55.97 56.37 2gj1 s LYS 569 Cb -0.87 -2.54 -0.02 0.00 -0.52 0.00 0.00 37.83 33.89 2gj1 s LYS 569 CO 0.46 -0.07 0.81 -1.17 -0.92 0.00 0.00 175.35 174.46 2gj1 s LEU 570 N -4.52 4.19 -0.38 3.17 2.96 -1.26 -4.89 118.68 117.94 2gj1 s LEU 570 Ca 0.44 1.17 -0.20 0.00 -0.22 0.00 0.00 54.13 55.32 2gj1 s LEU 570 Cb -0.10 -3.21 0.01 0.00 0.50 0.00 0.00 46.19 43.39 2gj1 s LEU 570 CO 0.40 -0.37 0.61 -0.62 -1.32 0.00 0.00 176.35 175.05 2gj1 s ASP 571 N 1.13 6.36 0.00 3.68 2.15 -1.26 -4.95 116.67 123.78 2gj1 s ASP 571 Ca 0.38 -0.08 0.21 0.00 0.43 0.00 0.00 52.55 53.49 2gj1 s ASP 571 Cb -0.17 -2.31 0.60 0.00 -0.30 0.00 0.00 42.92 40.75 2gj1 s ASP 571 CO 0.13 -0.63 1.48 0.18 -0.17 0.00 0.00 175.17 176.15 2gj1 n LEU 572 N 6.04 2.34 0.11 -1.34 4.77 -1.26 -4.39 117.00 123.28 2gj1 n LEU 572 Ca -0.02 -1.00 0.05 0.00 -0.03 0.00 0.00 56.01 55.00 2gj1 n LEU 572 Cb 0.48 -0.17 0.49 0.00 -2.33 0.00 0.00 43.42 41.89 2gj1 n LEU 572 CO 0.50 0.50 1.06 0.77 -1.33 0.00 0.00 177.39 178.89 2gj1 h SER 573 N 3.05 0.26 0.00 -1.43 4.64 -1.99 -0.08 113.55 117.99 2gj1 h SER 573 Ca 0.00 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2gj1 h SER 573 Cb 0.67 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 2gj1 h SER 573 CO 0.00 0.24 0.09 -2.65 -0.87 0.00 0.00 176.83 173.64 2gj1 n PRO 574 N -4.45 0.08 -0.08 4.77 -0.02 -1.26 -1.25 135.00 132.79 2gj1 n PRO 574 Ca 0.00 0.55 0.12 0.00 -2.02 0.00 0.00 63.50 62.15 2gj1 n PRO 574 Cb 0.12 -1.84 0.29 0.00 -0.02 0.00 0.00 33.50 32.05 2gj1 n PRO 574 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2gj1 n TRP 575 N -1.90 0.21 -2.12 6.00 8.01 -0.04 -4.83 117.44 122.77 2gj1 n TRP 575 Ca -0.01 -0.11 -0.42 0.00 -1.31 0.00 0.00 57.50 55.65 2gj1 n TRP 575 Cb 0.11 0.00 -0.03 0.00 -2.01 0.00 0.00 31.31 29.38 2gj1 n TRP 575 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2gj1 s ALA 576 N -1.79 3.62 -0.51 6.99 0.00 -0.38 -4.94 121.76 124.75 2gj1 s ALA 576 Ca 0.34 1.12 -0.05 0.00 0.00 0.00 0.00 51.96 53.38 2gj1 s ALA 576 Cb 0.20 -3.57 0.13 0.00 0.00 0.00 0.00 23.12 19.88 2gj1 s ALA 576 CO 0.30 -0.73 0.34 0.45 0.00 0.00 0.00 175.76 176.12 2gj1 s SER 577 N 1.37 5.41 0.34 0.00 0.15 -1.26 -5.08 113.70 114.63 2gj1 s SER 577 Ca 0.66 -2.31 -0.27 0.00 0.70 0.00 0.00 55.95 54.73 2gj1 s SER 577 Cb -0.37 -1.89 -0.09 0.00 -1.71 0.00 0.00 66.02 61.95 2gj1 s SER 577 CO 0.30 -0.52 1.12 -0.13 1.20 0.00 0.00 173.24 175.21 2gj1 s ARG 578 N 0.74 4.36 0.00 5.44 0.52 -1.26 -5.02 118.95 123.72 2gj1 s ARG 578 Ca 0.11 1.77 0.00 0.00 -0.52 0.00 0.00 55.73 57.09 2gj1 s ARG 578 Cb -0.22 -2.89 0.00 0.00 0.52 0.00 0.00 34.95 32.35 2gj1 s ARG 578 CO -0.03 -0.03 0.00 0.39 0.02 0.00 0.00 175.30 175.64 2gj1 n GLU 579 N 0.58 0.00 0.00 3.54 -0.58 -1.26 -5.29 120.64 117.62 2gj1 n GLU 579 Ca 0.02 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 2gj1 n GLU 579 Cb 0.46 -0.02 0.00 0.00 -0.57 0.00 0.00 31.44 31.31 2gj1 n GLU 579 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74