#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gjx s TRP 24 N 0.00 -0.94 0.87 -1.77 -0.11 -1.26 -4.29 118.94 111.44 2gjx s TRP 24 Ca 0.00 1.76 -0.12 0.00 1.22 0.00 0.00 56.10 58.96 2gjx s TRP 24 Cb 0.00 0.46 0.11 0.00 -1.50 0.00 0.00 33.47 32.55 2gjx s TRP 24 CO 0.00 -0.52 1.13 -1.25 -4.62 0.00 0.00 176.95 171.69 2gjx s PRO 25 N 2.43 1.51 0.02 5.86 0.04 -1.26 -4.72 135.00 138.88 2gjx s PRO 25 Ca -0.05 0.39 -0.30 0.00 0.04 0.00 0.00 61.00 61.08 2gjx s PRO 25 Cb -0.11 -1.87 -0.05 0.00 0.04 0.00 0.00 34.50 32.51 2gjx s PRO 25 CO -0.15 -1.97 1.20 -0.46 0.04 0.00 0.00 177.00 175.67 2gjx s TRP 26 N -3.26 3.35 0.73 0.56 -0.11 -1.26 -5.01 118.94 113.93 2gjx s TRP 26 Ca 0.63 1.26 -0.13 0.00 1.22 0.00 0.00 56.10 59.08 2gjx s TRP 26 Cb -0.14 -3.42 0.04 0.00 -1.50 0.00 0.00 33.47 28.44 2gjx s TRP 26 CO 0.53 -1.31 1.13 -2.14 -4.62 0.00 0.00 176.95 170.55 2gjx s PRO 27 N 1.44 2.35 0.08 5.86 0.02 -1.26 -4.33 135.00 139.17 2gjx s PRO 27 Ca 0.58 1.44 -0.30 0.00 0.02 0.00 0.00 61.00 62.73 2gjx s PRO 27 Cb -0.28 -1.89 -0.17 0.00 0.02 0.00 0.00 34.50 32.18 2gjx s PRO 27 CO 0.27 -1.61 1.65 1.96 -0.33 0.00 0.00 177.00 178.94 2gjx h GLN 28 N -0.49 -0.65 -4.21 5.54 1.08 -1.82 -3.40 115.11 111.16 2gjx h GLN 28 Ca -0.46 0.04 -0.63 0.00 -1.45 0.00 0.00 58.65 56.16 2gjx h GLN 28 Cb 1.26 0.15 -0.40 0.00 -0.05 0.00 0.00 27.48 28.43 2gjx h GLN 28 CO 0.51 -0.43 -0.74 -0.80 -0.95 0.00 0.00 178.83 176.42 2gjx s ASN 29 N -4.60 4.42 -0.27 1.46 0.01 -1.09 -4.96 114.94 109.92 2gjx s ASN 29 Ca -0.16 -1.89 0.03 0.00 -0.71 0.00 0.00 52.86 50.12 2gjx s ASN 29 Cb 0.04 -1.29 0.07 0.00 0.41 0.00 0.00 41.25 40.48 2gjx s ASN 29 CO 0.63 -0.39 -0.07 0.12 -1.51 0.00 0.00 177.10 175.89 2gjx s PHE 30 N 1.22 3.11 -0.41 2.20 5.99 -1.26 -0.85 117.98 127.98 2gjx s PHE 30 Ca 0.10 -2.29 -0.12 0.00 0.00 0.00 0.00 56.93 54.61 2gjx s PHE 30 Cb -0.18 -2.00 0.04 0.00 0.00 0.00 0.00 43.02 40.88 2gjx s PHE 30 CO -0.15 -0.87 0.27 -1.14 -0.00 0.00 0.00 175.22 173.33 2gjx s GLN 31 N 1.15 2.84 0.54 10.12 0.74 -0.24 -5.02 119.66 129.79 2gjx s GLN 31 Ca -0.05 -1.17 0.03 0.00 0.05 0.00 0.00 55.36 54.22 2gjx s GLN 31 Cb -0.20 -3.86 0.10 0.00 1.10 0.00 0.00 33.01 30.16 2gjx s GLN 31 CO -0.06 -0.81 0.75 -2.37 -0.55 0.00 0.00 175.29 172.25 2gjx n THR 32 N 5.05 0.00 -3.52 -0.34 5.66 -1.26 -1.94 114.28 117.93 2gjx n THR 32 Ca -0.11 -1.38 -0.04 0.00 -3.05 0.00 0.00 64.05 59.47 2gjx n THR 32 Cb 0.45 -0.85 0.01 0.00 -1.55 0.00 0.00 70.33 68.40 2gjx n THR 32 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2gjx n SER 33 N -2.75 -1.17 0.00 1.09 2.88 -1.19 -4.95 113.62 107.53 2gjx n SER 33 Ca 0.13 -1.76 0.00 0.00 -1.33 0.00 0.00 58.87 55.92 2gjx n SER 33 Cb 0.48 1.94 0.00 0.00 -0.75 0.00 0.00 64.21 65.88 2gjx n SER 33 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2gjx n ASP 34 N -1.19 1.49 -4.64 -3.46 10.43 -1.26 -4.71 116.55 113.21 2gjx n ASP 34 Ca -0.04 -1.50 -0.43 0.00 2.57 0.00 0.00 54.79 55.40 2gjx n ASP 34 Cb 0.33 0.00 -0.03 0.00 1.84 0.00 0.00 41.12 43.26 2gjx n ASP 34 CO 0.00 0.00 0.00 -1.58 -1.07 0.00 0.00 177.20 174.55 2gjx s GLN 35 N -0.50 4.07 0.23 -1.24 -0.44 -1.26 -4.94 119.66 115.59 2gjx s GLN 35 Ca 0.00 0.98 0.08 0.00 -2.50 0.00 0.00 55.36 53.92 2gjx s GLN 35 Cb 0.00 -3.72 -0.04 0.00 -1.64 0.00 0.00 33.01 27.61 2gjx s GLN 35 CO 0.00 -0.78 0.08 -0.98 0.50 0.00 0.00 175.29 174.10 2gjx s ARG 36 N 3.36 2.58 0.06 1.67 1.70 -1.26 0.27 118.95 127.33 2gjx s ARG 36 Ca 0.41 -1.19 0.04 0.00 -0.47 0.00 0.00 55.73 54.53 2gjx s ARG 36 Cb -0.13 -2.38 -0.03 0.00 -0.57 0.00 0.00 34.95 31.84 2gjx s ARG 36 CO 0.13 0.40 -0.13 0.71 -1.08 0.00 0.00 175.30 175.34 2gjx s TYR 37 N -2.10 1.08 -0.10 5.89 1.51 -0.56 -4.05 117.35 119.02 2gjx s TYR 37 Ca 0.31 -0.47 -0.18 0.00 -1.01 0.00 0.00 57.07 55.72 2gjx s TYR 37 Cb -0.08 -0.61 -0.04 0.00 -0.11 0.00 0.00 41.96 41.12 2gjx s TYR 37 CO 0.22 0.02 0.49 0.08 -1.11 0.00 0.00 175.55 175.24 2gjx s VAL 38 N -1.28 5.16 0.18 0.71 1.01 -1.14 -1.57 120.40 123.46 2gjx s VAL 38 Ca -0.04 0.98 0.05 0.00 0.00 0.00 0.00 61.98 62.96 2gjx s VAL 38 Cb -0.10 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 2gjx s VAL 38 CO 0.02 0.34 0.20 -0.76 0.00 0.00 0.00 175.10 174.90 2gjx s LEU 39 N 0.48 3.98 -0.28 3.92 1.43 -1.01 -1.44 118.68 125.76 2gjx s LEU 39 Ca 0.26 -0.05 0.02 0.00 -1.03 0.00 0.00 54.13 53.33 2gjx s LEU 39 Cb -0.15 -2.57 0.08 0.00 0.03 0.00 0.00 46.19 43.58 2gjx s LEU 39 CO 0.11 0.04 -0.00 -0.31 0.23 0.00 0.00 176.35 176.42 2gjx s TYR 40 N -1.81 2.83 0.18 0.29 2.02 -1.26 -4.58 117.35 115.02 2gjx s TYR 40 Ca 0.32 -2.23 -0.20 0.00 -0.37 0.00 0.00 57.07 54.60 2gjx s TYR 40 Cb -0.10 -2.08 0.12 0.00 -0.40 0.00 0.00 41.96 39.50 2gjx s TYR 40 CO 0.25 -0.86 1.37 -2.30 -1.57 0.00 0.00 175.55 172.44 2gjx n PRO 41 N 4.54 -0.27 -0.04 -1.71 -0.02 -1.26 -1.41 135.00 134.83 2gjx n PRO 41 Ca -0.05 1.35 -0.15 0.00 -2.02 0.00 0.00 63.50 62.63 2gjx n PRO 41 Cb 0.43 -2.00 -0.13 0.00 -0.02 0.00 0.00 33.50 31.78 2gjx n PRO 41 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 2gjx h ASN 42 N 0.00 0.12 -0.05 2.55 4.21 -1.96 -3.33 115.58 117.12 2gjx h ASN 42 Ca 0.25 -0.90 0.00 0.00 1.21 0.00 0.00 56.30 56.86 2gjx h ASN 42 Cb 0.47 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.63 2gjx h ASN 42 CO -0.86 1.01 0.00 -3.20 -1.29 0.00 0.00 177.43 173.09 2gjx n ASN 43 N -4.53 1.19 -4.66 5.81 5.15 -1.08 -4.78 115.26 112.35 2gjx n ASN 43 Ca -0.10 -2.06 -0.37 0.00 -0.60 0.00 0.00 54.58 51.45 2gjx n ASN 43 Cb 0.52 -0.43 -0.09 0.00 -0.53 0.00 0.00 39.78 39.25 2gjx n ASN 43 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 2gjx s PHE 44 N -1.29 3.32 0.04 1.20 5.36 -0.50 -4.78 117.98 121.34 2gjx s PHE 44 Ca 0.04 0.26 0.02 0.00 -0.96 0.00 0.00 56.93 56.29 2gjx s PHE 44 Cb 0.03 -2.29 -0.02 0.00 -0.34 0.00 0.00 43.02 40.40 2gjx s PHE 44 CO 0.02 0.07 -0.08 1.14 -1.46 0.00 0.00 175.22 174.91 2gjx s GLN 45 N 1.06 0.53 -0.18 10.12 -2.07 -0.98 -5.02 119.66 123.12 2gjx s GLN 45 Ca 0.08 -0.77 -0.13 0.00 -1.82 0.00 0.00 55.36 52.72 2gjx s GLN 45 Cb -0.14 -0.27 -0.05 0.00 -1.09 0.00 0.00 33.01 31.46 2gjx s GLN 45 CO 0.05 0.04 0.25 -0.06 -1.32 0.00 0.00 175.29 174.25 2gjx s PHE 46 N -1.46 3.44 0.05 9.60 0.40 -1.26 -3.12 117.98 125.62 2gjx s PHE 46 Ca -0.09 0.52 0.04 0.00 -0.60 0.00 0.00 56.93 56.79 2gjx s PHE 46 Cb -0.09 -2.31 -0.02 0.00 0.51 0.00 0.00 43.02 41.11 2gjx s PHE 46 CO 0.00 0.23 -0.12 1.14 0.70 0.00 0.00 175.22 177.17 2gjx s GLN 47 N 0.51 0.74 0.54 0.44 -2.07 -1.13 -4.99 119.66 113.71 2gjx s GLN 47 Ca 0.14 -0.81 -0.09 0.00 -1.82 0.00 0.00 55.36 52.78 2gjx s GLN 47 Cb -0.13 -0.69 -0.04 0.00 -1.09 0.00 0.00 33.01 31.06 2gjx s GLN 47 CO 0.03 0.15 0.92 0.71 -1.32 0.00 0.00 175.29 175.78 2gjx s TYR 48 N -1.13 3.58 -0.08 9.60 1.51 -1.26 -1.56 117.35 128.01 2gjx s TYR 48 Ca -0.03 1.12 -0.12 0.00 -1.01 0.00 0.00 57.07 57.03 2gjx s TYR 48 Cb -0.09 -2.56 -0.05 0.00 -0.11 0.00 0.00 41.96 39.15 2gjx s TYR 48 CO 0.01 -0.47 0.29 0.34 -1.11 0.00 0.00 175.55 174.61 2gjx s ASP 49 N -3.97 6.58 0.60 2.29 -1.08 -1.10 -4.80 116.67 115.19 2gjx s ASP 49 Ca 0.52 0.69 0.30 0.00 -0.52 0.00 0.00 52.55 53.54 2gjx s ASP 49 Cb -0.11 -2.17 1.66 0.00 -1.46 0.00 0.00 42.92 40.84 2gjx s ASP 49 CO 0.47 0.31 2.06 -0.37 0.52 0.00 0.00 175.17 178.16 2gjx h VAL 50 N 4.01 0.39 -0.09 1.11 -1.51 -1.97 0.49 116.25 118.68 2gjx h VAL 50 Ca -0.51 0.00 -0.13 0.00 -1.23 0.00 0.00 66.70 64.83 2gjx h VAL 50 Cb 1.21 0.79 -0.01 0.00 -2.13 0.00 0.00 31.29 31.15 2gjx h VAL 50 CO 0.63 0.00 -0.53 0.28 -1.23 0.00 0.00 177.57 176.72 2gjx h SER 51 N 0.00 0.29 -3.47 4.19 0.02 -1.98 -3.48 113.55 109.12 2gjx h SER 51 Ca 0.10 -0.15 -0.53 0.00 -0.84 0.00 0.00 61.79 60.37 2gjx h SER 51 Cb 0.60 -0.08 0.21 0.00 0.14 0.00 0.00 62.40 63.27 2gjx h SER 51 CO -0.00 0.77 -0.49 -0.24 -1.14 0.00 0.00 176.83 175.72 2gjx n SER 52 N -3.93 -1.81 0.04 3.07 2.88 0.17 -4.98 113.62 109.06 2gjx n SER 52 Ca -0.02 0.36 -0.22 0.00 -1.33 0.00 0.00 58.87 57.65 2gjx n SER 52 Cb 0.57 -1.23 -0.14 0.00 -0.75 0.00 0.00 64.21 62.65 2gjx n SER 52 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2gjx h ALA 53 N -1.50 0.19 -2.51 -1.46 0.00 -1.05 -3.45 119.26 109.49 2gjx h ALA 53 Ca -0.44 -1.15 -0.56 0.00 0.00 0.00 0.00 54.91 52.77 2gjx h ALA 53 Cb 1.28 0.50 -0.04 0.00 0.00 0.00 0.00 17.79 19.53 2gjx h ALA 53 CO 0.35 0.97 0.27 0.00 0.00 0.00 0.00 179.25 180.85 2gjx s ALA 54 N -2.53 3.32 0.24 0.00 0.00 -1.26 -4.93 121.76 116.59 2gjx s ALA 54 Ca -0.18 0.27 0.01 0.00 0.00 0.00 0.00 51.96 52.06 2gjx s ALA 54 Cb 0.05 -3.17 -0.05 0.00 0.00 0.00 0.00 23.12 19.95 2gjx s ALA 54 CO 0.81 -0.29 0.08 -1.14 0.00 0.00 0.00 175.76 175.22 2gjx s GLN 55 N 1.22 1.35 -0.33 0.00 2.00 -1.26 -4.79 119.66 117.85 2gjx s GLN 55 Ca 0.43 -1.72 -0.44 0.00 -2.00 0.00 0.00 55.36 51.63 2gjx s GLN 55 Cb -0.19 -0.26 -0.20 0.00 0.80 0.00 0.00 33.01 33.17 2gjx s GLN 55 CO 0.20 -0.26 1.44 -2.30 -0.50 0.00 0.00 175.29 173.87 2gjx n PRO 56 N -0.42 0.09 0.00 1.67 -0.02 -1.26 -1.35 135.00 133.71 2gjx n PRO 56 Ca -0.01 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 2gjx n PRO 56 Cb 0.66 -1.55 0.00 0.00 -0.02 0.00 0.00 33.50 32.59 2gjx n PRO 56 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gjx n GLY 57 N 3.23 1.40 3.55 -1.23 0.00 -1.26 -5.06 105.19 105.83 2gjx n GLY 57 Ca 0.27 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.90 2gjx n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gjx h SER 59 N 11.58 -0.64 0.09 0.00 4.64 -1.91 0.76 113.55 128.08 2gjx h SER 59 Ca -0.16 0.20 0.01 0.00 -0.47 0.00 0.00 61.79 61.37 2gjx h SER 59 Cb 1.07 0.42 -0.02 0.00 -0.31 0.00 0.00 62.40 63.56 2gjx h SER 59 CO 1.28 -0.22 -0.16 0.58 -0.87 0.00 0.00 176.83 177.43 2gjx h VAL 60 N -0.00 0.63 -0.03 0.95 2.07 -1.91 -2.56 116.25 115.40 2gjx h VAL 60 Ca 0.32 0.00 -0.20 0.00 0.82 0.00 0.00 66.70 67.65 2gjx h VAL 60 Cb 0.50 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 2gjx h VAL 60 CO -0.70 0.00 -0.82 -0.07 0.02 0.00 0.00 177.57 176.00 2gjx h LEU 61 N -0.31 0.42 -0.53 2.57 4.07 -1.82 -1.48 115.31 118.24 2gjx h LEU 61 Ca 0.03 -0.31 0.03 0.00 0.08 0.00 0.00 57.88 57.71 2gjx h LEU 61 Cb 0.33 -0.13 -0.04 0.00 1.08 0.00 0.00 40.66 41.91 2gjx h LEU 61 CO -0.09 1.07 0.31 0.44 -1.08 0.00 0.00 178.44 179.09 2gjx h ASP 62 N 0.21 0.50 0.34 -0.43 3.32 -0.82 0.74 116.42 120.28 2gjx h ASP 62 Ca -0.05 0.01 -0.21 0.00 0.02 0.00 0.00 57.03 56.81 2gjx h ASP 62 Cb 1.42 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 40.87 2gjx h ASP 62 CO 0.14 0.35 -0.85 -0.33 -1.72 0.00 0.00 179.24 176.82 2gjx h GLU 63 N 0.62 0.38 -0.25 3.56 4.39 -1.47 -3.13 114.58 118.67 2gjx h GLU 63 Ca 0.22 -0.37 -0.00 0.00 0.34 0.00 0.00 59.36 59.54 2gjx h GLU 63 Cb 0.04 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 2gjx h GLU 63 CO -0.10 1.03 0.14 0.00 -1.16 0.00 0.00 179.01 178.92 2gjx h ALA 64 N 0.85 0.32 -0.58 3.43 0.00 -0.78 0.20 119.26 122.70 2gjx h ALA 64 Ca -0.06 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.83 2gjx h ALA 64 Cb 1.46 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 2gjx h ALA 64 CO 0.14 -0.16 0.38 0.74 0.00 0.00 0.00 179.25 180.36 2gjx h PHE 65 N 0.30 0.65 -0.04 0.00 0.04 -0.92 0.29 116.94 117.27 2gjx h PHE 65 Ca 0.09 0.02 -0.12 0.00 2.80 0.00 0.00 57.97 60.76 2gjx h PHE 65 Cb 0.04 -0.22 0.01 0.00 2.20 0.00 0.00 35.95 37.98 2gjx h PHE 65 CO -0.04 0.39 -0.44 0.37 -0.60 0.00 0.00 178.31 177.99 2gjx h GLN 66 N 0.68 0.36 -0.64 1.51 -0.00 -1.35 -2.60 115.11 113.08 2gjx h GLN 66 Ca 0.23 -0.34 -0.07 0.00 -0.00 0.00 0.00 58.65 58.46 2gjx h GLN 66 Cb 0.07 0.08 -0.03 0.00 0.00 0.00 0.00 27.48 27.61 2gjx h GLN 66 CO -0.06 1.00 0.10 -0.09 0.00 0.00 0.00 178.83 179.79 2gjx h ARG 67 N -0.15 1.04 0.00 1.69 2.43 -0.24 -2.94 114.38 116.20 2gjx h ARG 67 Ca -0.04 -0.27 -0.17 0.00 -0.81 0.00 0.00 59.98 58.68 2gjx h ARG 67 Cb 1.13 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.52 2gjx h ARG 67 CO 0.09 0.96 -0.83 1.88 -1.51 0.00 0.00 179.97 180.55 2gjx h TYR 68 N 0.98 0.00 0.00 2.20 0.05 -1.01 -2.89 116.97 116.29 2gjx h TYR 68 Ca 0.20 -0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.94 2gjx h TYR 68 Cb 0.42 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.15 2gjx h TYR 68 CO 0.03 0.83 -0.17 0.07 -1.05 0.00 0.00 178.16 177.87 2gjx h ARG 69 N 0.00 0.00 0.03 4.88 0.11 -1.39 -1.63 114.38 116.38 2gjx h ARG 69 Ca -0.01 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 59.86 2gjx h ARG 69 Cb 1.47 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.54 2gjx h ARG 69 CO 0.11 0.17 -0.96 0.22 0.10 0.00 0.00 179.97 179.60 2gjx h ASP 70 N 0.00 0.28 -0.12 0.08 3.58 -1.40 -1.67 116.42 117.17 2gjx h ASP 70 Ca -0.00 -0.25 -0.09 0.00 0.42 0.00 0.00 57.03 57.11 2gjx h ASP 70 Cb 0.71 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.67 2gjx h ASP 70 CO 0.02 1.09 -0.28 -0.07 -2.88 0.00 0.00 179.24 177.13 2gjx h LEU 71 N 0.10 0.45 -0.07 2.28 4.07 -1.25 -0.09 115.31 120.80 2gjx h LEU 71 Ca -0.06 -0.57 -0.15 0.00 0.08 0.00 0.00 57.88 57.17 2gjx h LEU 71 Cb 1.63 -0.13 0.01 0.00 1.08 0.00 0.00 40.66 43.25 2gjx h LEU 71 CO 0.15 0.94 -0.56 -0.07 -1.08 0.00 0.00 178.44 177.82 2gjx h LEU 72 N -0.02 0.62 -2.80 1.67 -0.00 -1.39 -3.38 115.31 110.00 2gjx h LEU 72 Ca -0.00 -0.68 -0.04 0.00 -0.00 0.00 0.00 57.88 57.16 2gjx h LEU 72 Cb 0.88 -0.18 -0.08 0.00 -0.00 0.00 0.00 40.66 41.27 2gjx h LEU 72 CO 0.06 1.20 -0.47 0.49 -0.00 0.00 0.00 178.44 179.72 2gjx n PHE 73 N -4.21 0.00 0.46 1.13 3.72 -0.63 -5.09 117.46 112.85 2gjx n PHE 73 Ca -0.09 -0.84 0.00 0.00 -0.05 0.00 0.00 57.45 56.47 2gjx n PHE 73 Cb 0.64 -0.16 0.00 0.00 -0.94 0.00 0.00 39.48 39.02 2gjx n PHE 73 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2gjx n GLY 74 N -0.65 0.34 0.00 1.37 0.00 -0.04 -4.90 105.19 101.30 2gjx n GLY 74 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2gjx n GLY 74 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2gjx n THR 89 N 0.12 0.00 -3.46 2.61 -1.04 -1.26 -5.01 114.28 106.25 2gjx n THR 89 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.89 2gjx n THR 89 Cb 0.07 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.56 2gjx n THR 89 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 2gjx s LEU 90 N 0.00 -0.40 -0.06 -4.42 0.05 -1.26 -2.86 118.68 109.72 2gjx s LEU 90 Ca 0.00 -0.03 0.02 0.00 0.05 0.00 0.00 54.13 54.16 2gjx s LEU 90 Cb 0.00 2.46 0.02 0.00 -2.05 0.00 0.00 46.19 46.62 2gjx s LEU 90 CO 0.00 -0.94 -0.09 -1.61 -0.55 0.00 0.00 176.35 173.16 2gjx s GLU 91 N -3.67 1.40 -0.10 1.48 0.41 -0.52 -4.84 118.70 112.86 2gjx s GLU 91 Ca 0.01 -0.29 0.09 0.00 -0.41 0.00 0.00 54.97 54.37 2gjx s GLU 91 Cb -0.00 -1.25 -0.13 0.00 -1.78 0.00 0.00 34.13 30.97 2gjx s GLU 91 CO -0.12 -0.05 0.05 1.63 -0.49 0.00 0.00 175.26 176.28 2gjx n LYS 92 N 4.04 2.21 -4.57 1.61 4.01 -1.26 -4.18 118.16 120.02 2gjx n LYS 92 Ca -0.22 -0.01 -0.26 0.00 -0.51 0.00 0.00 58.31 57.31 2gjx n LYS 92 Cb 0.51 -1.26 -0.11 0.00 -0.51 0.00 0.00 35.03 33.66 2gjx n LYS 92 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 2gjx s ASN 93 N -4.21 3.38 -0.23 4.39 0.01 -1.26 -2.32 114.94 114.70 2gjx s ASN 93 Ca -0.05 -1.40 -0.03 0.00 -0.71 0.00 0.00 52.86 50.67 2gjx s ASN 93 Cb 0.03 -0.21 0.12 0.00 0.41 0.00 0.00 41.25 41.59 2gjx s ASN 93 CO 0.42 -0.54 0.29 0.54 -1.51 0.00 0.00 177.10 176.31 2gjx s VAL 94 N -2.92 -0.45 0.03 1.60 0.11 -1.18 -4.87 120.40 112.72 2gjx s VAL 94 Ca 0.33 -0.16 -0.30 0.00 -2.93 0.00 0.00 61.98 58.92 2gjx s VAL 94 Cb 0.09 -0.78 -0.05 0.00 -1.53 0.00 0.00 36.38 34.11 2gjx s VAL 94 CO 0.16 -0.22 1.15 -0.76 -3.33 0.00 0.00 175.10 172.11 2gjx s LEU 95 N 2.42 4.36 -0.20 2.54 1.43 -0.68 -2.86 118.68 125.68 2gjx s LEU 95 Ca 0.09 1.91 0.00 0.00 -1.03 0.00 0.00 54.13 55.11 2gjx s LEU 95 Cb -0.15 -3.57 0.02 0.00 0.03 0.00 0.00 46.19 42.51 2gjx s LEU 95 CO -0.17 -0.45 -0.15 -0.69 0.23 0.00 0.00 176.35 175.12 2gjx s VAL 96 N 1.23 2.35 -0.10 -1.59 1.01 -0.60 0.34 120.40 123.03 2gjx s VAL 96 Ca 0.57 -0.97 -0.00 0.00 0.00 0.00 0.00 61.98 61.58 2gjx s VAL 96 Cb -0.27 -2.07 0.02 0.00 0.00 0.00 0.00 36.38 34.06 2gjx s VAL 96 CO 0.28 0.42 -0.07 0.54 0.00 0.00 0.00 175.10 176.27 2gjx s VAL 97 N 1.30 0.93 -0.18 2.92 0.11 -0.84 -2.71 120.40 121.93 2gjx s VAL 97 Ca 0.03 -0.24 -0.07 0.00 -2.93 0.00 0.00 61.98 58.77 2gjx s VAL 97 Cb -0.14 -0.96 -0.04 0.00 -1.53 0.00 0.00 36.38 33.71 2gjx s VAL 97 CO -0.10 0.35 0.06 -0.55 -3.33 0.00 0.00 175.10 171.53 2gjx s SER 98 N 1.64 5.60 -0.10 3.54 0.15 -1.26 -2.18 113.70 121.08 2gjx s SER 98 Ca 0.03 0.07 -0.24 0.00 0.70 0.00 0.00 55.95 56.51 2gjx s SER 98 Cb -0.13 -1.96 -0.28 0.00 -1.71 0.00 0.00 66.02 61.94 2gjx s SER 98 CO -0.07 0.17 0.75 -0.37 1.20 0.00 0.00 173.24 174.92 2gjx h VAL 99 N 4.89 1.51 -3.23 4.45 -1.51 -1.39 0.11 116.25 121.08 2gjx h VAL 99 Ca -0.37 -2.42 -0.56 0.00 -1.23 0.00 0.00 66.70 62.12 2gjx h VAL 99 Cb 1.17 3.14 -0.04 0.00 -2.13 0.00 0.00 31.29 33.42 2gjx h VAL 99 CO 0.70 0.64 0.60 -0.69 -1.23 0.00 0.00 177.57 177.60 2gjx s VAL 100 N -2.35 4.77 0.02 7.19 1.01 0.88 -4.65 120.40 127.27 2gjx s VAL 100 Ca -0.18 2.04 -0.23 0.00 0.00 0.00 0.00 61.98 63.61 2gjx s VAL 100 Cb 0.00 -4.31 -0.16 0.00 0.00 0.00 0.00 36.38 31.91 2gjx s VAL 100 CO 0.75 -0.03 1.35 0.74 0.00 0.00 0.00 175.10 177.91 2gjx h THR 101 N 5.16 1.34 0.00 3.92 2.02 -1.86 -3.41 112.91 120.07 2gjx h THR 101 Ca -0.29 -1.11 0.00 0.00 0.77 0.00 0.00 66.41 65.78 2gjx h THR 101 Cb 1.13 1.90 0.00 0.00 -1.74 0.00 0.00 68.15 69.44 2gjx h THR 101 CO 0.88 0.31 0.00 -2.65 0.37 0.00 0.00 175.52 174.43 2gjx n PRO 102 N -4.73 0.00 0.00 6.66 -0.02 -1.26 -4.73 135.00 130.92 2gjx n PRO 102 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 2gjx n PRO 102 Cb 0.28 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.76 2gjx n PRO 102 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gjx n GLY 103 N 0.00 0.03 0.00 -1.23 0.00 -1.26 -4.82 105.19 97.91 2gjx n GLY 103 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2gjx n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gjx n ASN 105 N 0.00 1.86 -4.78 0.00 6.94 -1.26 -4.04 115.26 113.98 2gjx n ASN 105 Ca 0.00 0.00 -0.38 0.00 -0.02 0.00 0.00 54.58 54.18 2gjx n ASN 105 Cb 0.49 1.52 -0.06 0.00 -2.36 0.00 0.00 39.78 39.37 2gjx n ASN 105 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2gjx s GLN 106 N -2.87 4.60 0.58 -3.83 1.03 -1.26 -5.06 119.66 112.86 2gjx s GLN 106 Ca -0.05 1.26 -0.14 0.00 0.04 0.00 0.00 55.36 56.46 2gjx s GLN 106 Cb 0.08 -3.05 -0.05 0.00 0.03 0.00 0.00 33.01 30.02 2gjx s GLN 106 CO 0.57 0.43 1.02 -0.48 -2.54 0.00 0.00 175.29 174.29 2gjx s LEU 107 N -1.59 3.43 0.62 2.60 -0.00 -1.26 -5.04 118.68 117.45 2gjx s LEU 107 Ca 0.43 1.60 -0.17 0.00 -0.00 0.00 0.00 54.13 55.99 2gjx s LEU 107 Cb -0.21 -4.50 -0.02 0.00 -0.00 0.00 0.00 46.19 41.45 2gjx s LEU 107 CO 0.26 -0.92 1.15 -2.16 -0.00 0.00 0.00 176.35 174.68 2gjx s PRO 108 N -4.46 2.89 0.27 1.48 0.04 -1.26 -5.06 135.00 128.89 2gjx s PRO 108 Ca 0.59 1.61 0.02 0.00 0.04 0.00 0.00 61.00 63.26 2gjx s PRO 108 Cb -0.12 -1.94 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 2gjx s PRO 108 CO 0.41 -1.22 0.08 0.95 0.04 0.00 0.00 177.00 177.26 2gjx s THR 109 N -1.96 0.76 0.59 1.26 -4.23 -1.26 -4.82 115.64 105.99 2gjx s THR 109 Ca 0.72 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 59.53 2gjx s THR 109 Cb -0.25 -2.66 0.36 0.00 1.34 0.00 0.00 72.50 71.29 2gjx s THR 109 CO 0.36 -0.02 2.23 0.25 -0.54 0.00 0.00 174.62 176.90 2gjx h LEU 110 N 2.32 0.00 -0.31 4.79 5.85 -1.97 -1.57 115.31 124.42 2gjx h LEU 110 Ca -0.39 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.33 2gjx h LEU 110 Cb 1.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.27 2gjx h LEU 110 CO 0.64 0.00 -0.43 -0.62 -0.34 0.00 0.00 178.44 177.69 2gjx n GLU 111 N -3.81 0.48 -1.78 1.25 4.71 -1.26 -4.92 120.64 115.31 2gjx n GLU 111 Ca -0.02 -0.31 -0.42 0.00 -0.01 0.00 0.00 57.16 56.41 2gjx n GLU 111 Cb 0.13 -1.49 -0.02 0.00 -1.01 0.00 0.00 31.44 29.04 2gjx n GLU 111 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 2gjx s SER 112 N -2.73 6.40 -0.14 1.62 0.01 -0.59 -4.97 113.70 113.29 2gjx s SER 112 Ca 0.17 2.89 -0.20 0.00 1.31 0.00 0.00 55.95 60.12 2gjx s SER 112 Cb 0.18 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.76 2gjx s SER 112 CO 0.62 -0.93 0.57 -0.69 0.41 0.00 0.00 173.24 173.22 2gjx s VAL 113 N 0.54 5.10 -0.19 3.43 1.01 -1.26 -4.96 120.40 124.07 2gjx s VAL 113 Ca 0.68 1.11 0.16 0.00 0.00 0.00 0.00 61.98 63.93 2gjx s VAL 113 Cb -0.48 -3.90 0.58 0.00 0.00 0.00 0.00 36.38 32.58 2gjx s VAL 113 CO 0.40 0.23 1.48 -0.62 0.00 0.00 0.00 175.10 176.60 2gjx n GLU 114 N 4.24 3.24 -1.88 2.72 1.02 -1.26 -4.09 120.64 124.64 2gjx n GLU 114 Ca -0.04 -2.91 -0.40 0.00 -0.02 0.00 0.00 57.16 53.79 2gjx n GLU 114 Cb 0.51 -1.92 -0.00 0.00 -0.02 0.00 0.00 31.44 30.00 2gjx n GLU 114 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2gjx s ASN 115 N -1.75 6.30 0.08 1.62 -0.87 -1.26 -4.46 114.94 114.59 2gjx s ASN 115 Ca 0.45 2.91 -0.26 0.00 -1.57 0.00 0.00 52.86 54.39 2gjx s ASN 115 Cb 0.36 -2.66 0.07 0.00 -0.02 0.00 0.00 41.25 39.00 2gjx s ASN 115 CO 0.10 -0.89 0.62 -0.72 -2.57 0.00 0.00 177.10 173.64 2gjx s TYR 116 N -1.16 -0.57 -0.04 2.20 1.13 -0.92 -1.29 117.35 116.71 2gjx s TYR 116 Ca 0.55 0.61 0.02 0.00 -1.41 0.00 0.00 57.07 56.83 2gjx s TYR 116 Cb -0.44 0.49 0.01 0.00 -1.10 0.00 0.00 41.96 40.92 2gjx s TYR 116 CO 0.58 -0.75 -0.09 0.95 -2.51 0.00 0.00 175.55 173.73 2gjx s THR 117 N -2.78 0.81 -0.30 -3.49 -4.23 0.24 -1.26 115.64 104.62 2gjx s THR 117 Ca -0.04 -0.35 -0.05 0.00 -1.18 0.00 0.00 61.69 60.08 2gjx s THR 117 Cb -0.01 -0.74 0.03 0.00 1.34 0.00 0.00 72.50 73.13 2gjx s THR 117 CO -0.04 0.26 0.04 -0.22 -0.54 0.00 0.00 174.62 174.12 2gjx s LEU 118 N 0.38 3.91 -0.31 4.79 2.96 -0.66 -0.78 118.68 128.97 2gjx s LEU 118 Ca -0.06 -1.03 -0.01 0.00 -0.22 0.00 0.00 54.13 52.81 2gjx s LEU 118 Cb -0.11 -1.80 0.06 0.00 0.50 0.00 0.00 46.19 44.85 2gjx s LEU 118 CO 0.01 -0.25 0.02 -0.89 -1.32 0.00 0.00 176.35 173.92 2gjx s THR 119 N 1.37 2.89 -0.18 3.68 2.01 0.62 -0.07 115.64 125.95 2gjx s THR 119 Ca -0.01 -1.56 0.00 0.00 0.31 0.00 0.00 61.69 60.43 2gjx s THR 119 Cb -0.19 -2.73 0.04 0.00 0.01 0.00 0.00 72.50 69.63 2gjx s THR 119 CO 0.01 -0.20 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.03 2gjx s ILE 120 N 1.20 1.36 0.00 1.82 1.01 0.13 0.52 121.20 127.24 2gjx s ILE 120 Ca -0.03 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 59.79 2gjx s ILE 120 Cb -0.20 -1.50 0.00 0.00 0.01 0.00 0.00 42.46 40.77 2gjx s ILE 120 CO -0.02 0.13 0.00 -0.46 0.00 0.00 0.00 174.94 174.59 2gjx n ASN 121 N 4.78 0.00 0.01 3.58 2.04 0.72 -1.22 115.26 125.17 2gjx n ASN 121 Ca -0.13 -0.16 -0.06 0.00 -0.44 0.00 0.00 54.58 53.79 2gjx n ASN 121 Cb 0.47 0.00 0.13 0.00 -2.53 0.00 0.00 39.78 37.85 2gjx n ASN 121 CO 0.00 0.00 0.00 0.44 -0.44 0.00 0.00 177.26 177.26 2gjx h ASP 122 N 0.00 0.52 0.13 0.53 5.19 -2.00 -3.30 116.42 117.49 2gjx h ASP 122 Ca 0.00 -0.23 -0.27 0.00 -0.62 0.00 0.00 57.03 55.91 2gjx h ASP 122 Cb 0.00 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 39.37 2gjx h ASP 122 CO 0.00 0.87 -1.37 0.44 -3.12 0.00 0.00 179.24 176.06 2gjx h ASP 123 N 0.41 0.44 -5.21 6.45 3.32 -2.00 -3.49 116.42 116.33 2gjx h ASP 123 Ca 0.04 -0.88 -0.18 0.00 0.02 0.00 0.00 57.03 56.02 2gjx h ASP 123 Cb 0.89 -0.14 -0.15 0.00 0.22 0.00 0.00 39.33 40.15 2gjx h ASP 123 CO 0.08 1.61 -0.66 0.00 -1.72 0.00 0.00 179.24 178.54 2gjx s GLN 124 N -2.49 0.85 -0.42 3.56 -2.07 -1.24 -5.09 119.66 112.76 2gjx s GLN 124 Ca -0.18 -1.38 0.04 0.00 -1.82 0.00 0.00 55.36 52.02 2gjx s GLN 124 Cb 0.04 0.14 0.17 0.00 -1.09 0.00 0.00 33.01 32.27 2gjx s GLN 124 CO 0.79 -0.18 0.36 0.00 -1.32 0.00 0.00 175.29 174.94 2gjx s LEU 126 N 0.13 2.33 -0.40 0.00 0.20 0.18 -1.69 118.68 119.44 2gjx s LEU 126 Ca 0.32 -0.39 -0.04 0.00 0.69 0.00 0.00 54.13 54.72 2gjx s LEU 126 Cb 0.03 -1.45 0.10 0.00 -0.43 0.00 0.00 46.19 44.45 2gjx s LEU 126 CO -0.19 0.28 0.19 -0.22 -0.29 0.00 0.00 176.35 176.12 2gjx s LEU 127 N -0.34 5.08 -0.35 -0.68 0.20 0.15 -0.28 118.68 122.46 2gjx s LEU 127 Ca 0.02 -1.87 -0.10 0.00 0.69 0.00 0.00 54.13 52.87 2gjx s LEU 127 Cb -0.12 -1.84 0.02 0.00 -0.43 0.00 0.00 46.19 43.82 2gjx s LEU 127 CO 0.02 -0.51 0.17 -0.22 -0.29 0.00 0.00 176.35 175.52 2gjx s LEU 128 N 1.19 4.50 0.10 -0.68 2.96 0.04 -1.98 118.68 124.82 2gjx s LEU 128 Ca 0.06 -0.93 0.09 0.00 -0.22 0.00 0.00 54.13 53.13 2gjx s LEU 128 Cb -0.23 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.44 2gjx s LEU 128 CO -0.03 -0.34 -0.21 -0.94 -1.32 0.00 0.00 176.35 173.51 2gjx s SER 129 N 1.53 3.65 0.03 3.68 1.04 -0.93 0.80 113.70 123.50 2gjx s SER 129 Ca 0.02 -0.59 -0.24 0.00 0.48 0.00 0.00 55.95 55.62 2gjx s SER 129 Cb -0.19 -0.45 -0.17 0.00 0.10 0.00 0.00 66.02 65.32 2gjx s SER 129 CO 0.06 0.20 1.44 -0.08 0.98 0.00 0.00 173.24 175.83 2gjx h GLU 130 N 4.03 0.09 -5.26 4.02 4.57 -1.49 -2.76 114.58 117.77 2gjx h GLU 130 Ca -0.49 -0.03 -0.58 0.00 -1.18 0.00 0.00 59.36 57.07 2gjx h GLU 130 Cb 1.16 -0.01 -0.13 0.00 -0.16 0.00 0.00 28.75 29.61 2gjx h GLU 130 CO 0.44 0.39 -0.56 0.99 -1.18 0.00 0.00 179.01 179.10 2gjx s THR 131 N -4.89 1.20 0.38 0.32 2.01 -1.26 -0.08 115.64 113.32 2gjx s THR 131 Ca -0.15 -2.00 0.06 0.00 0.31 0.00 0.00 61.69 59.91 2gjx s THR 131 Cb 0.04 -2.55 0.22 0.00 0.01 0.00 0.00 72.50 70.21 2gjx s THR 131 CO 0.69 0.00 1.98 1.62 -0.69 0.00 0.00 174.62 178.21 2gjx h VAL 132 N 1.75 1.15 0.00 3.82 3.04 -1.87 -2.40 116.25 121.73 2gjx h VAL 132 Ca -0.41 -0.45 -0.05 0.00 -1.01 0.00 0.00 66.70 64.77 2gjx h VAL 132 Cb 1.27 0.68 -0.01 0.00 -2.01 0.00 0.00 31.29 31.22 2gjx h VAL 132 CO 0.70 0.18 -0.25 -0.50 -1.01 0.00 0.00 177.57 176.68 2gjx h TRP 133 N 0.55 0.00 -0.00 3.17 4.06 -1.96 -2.58 115.95 119.17 2gjx h TRP 133 Ca 0.14 0.00 -0.16 0.00 2.06 0.00 0.00 58.89 60.93 2gjx h TRP 133 Cb 0.10 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.24 2gjx h TRP 133 CO 0.00 0.25 -0.75 0.78 -3.56 0.00 0.00 178.44 175.17 2gjx h GLY 134 N 2.60 0.03 1.21 1.49 0.00 -1.61 -3.11 103.07 103.67 2gjx h GLY 134 Ca -0.00 -0.04 -0.12 0.00 0.00 0.00 0.00 47.33 47.17 2gjx h GLY 134 CO 0.03 0.04 -0.17 0.00 0.00 0.00 0.00 176.54 176.44 2gjx h ALA 135 N 1.23 0.81 -0.51 3.60 0.00 -1.28 -0.71 119.26 122.41 2gjx h ALA 135 Ca -0.01 -0.36 0.02 0.00 0.00 0.00 0.00 54.91 54.56 2gjx h ALA 135 Cb 1.32 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 2gjx h ALA 135 CO 0.10 0.65 0.30 -0.07 0.00 0.00 0.00 179.25 180.23 2gjx h LEU 136 N 0.80 0.48 -0.53 0.00 3.38 -1.50 0.46 115.31 118.41 2gjx h LEU 136 Ca 0.12 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2gjx h LEU 136 Cb 0.71 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 2gjx h LEU 136 CO 0.05 0.34 0.32 0.03 0.09 0.00 0.00 178.44 179.27 2gjx h ARG 137 N 0.60 0.72 -0.90 1.13 2.47 -1.44 -2.38 114.38 114.57 2gjx h ARG 137 Ca 0.20 -0.07 0.02 0.00 -1.26 0.00 0.00 59.98 58.88 2gjx h ARG 137 Cb 0.02 -0.15 -0.05 0.00 -1.65 0.00 0.00 29.97 28.15 2gjx h ARG 137 CO -0.09 0.52 0.59 0.78 0.56 0.00 0.00 179.97 182.33 2gjx h GLY 138 N 0.71 1.29 1.06 0.04 0.00 -0.36 -1.36 103.07 104.45 2gjx h GLY 138 Ca 0.19 -0.46 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 2gjx h GLY 138 CO -0.04 0.43 0.14 1.41 0.00 0.00 0.00 176.54 178.49 2gjx h LEU 139 N 1.19 1.05 -0.42 3.11 3.38 -0.67 0.79 115.31 123.74 2gjx h LEU 139 Ca 0.34 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 2gjx h LEU 139 Cb -0.08 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.37 2gjx h LEU 139 CO -0.09 1.03 0.12 -0.08 0.09 0.00 0.00 178.44 179.51 2gjx h GLU 140 N 1.03 0.67 -0.87 1.13 4.57 -1.04 0.73 114.58 120.79 2gjx h GLU 140 Ca 0.21 -0.15 -0.02 0.00 -1.18 0.00 0.00 59.36 58.22 2gjx h GLU 140 Cb 0.40 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.86 2gjx h GLU 140 CO 0.01 0.66 0.49 1.15 -1.18 0.00 0.00 179.01 180.14 2gjx h THR 141 N 0.55 1.25 -0.67 0.32 2.02 -1.05 -2.56 112.91 112.77 2gjx h THR 141 Ca 0.14 -0.61 -0.07 0.00 0.77 0.00 0.00 66.41 66.63 2gjx h THR 141 Cb 0.28 0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 66.73 2gjx h THR 141 CO -0.00 0.28 0.15 0.15 0.37 0.00 0.00 175.52 176.47 2gjx h PHE 142 N 1.22 1.15 -0.45 3.16 3.57 -0.44 -2.80 116.94 122.34 2gjx h PHE 142 Ca 0.31 -0.14 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 2gjx h PHE 142 Cb 0.02 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 38.41 2gjx h PHE 142 CO 0.01 0.95 0.18 0.66 -2.23 0.00 0.00 178.31 177.87 2gjx h SER 143 N 1.01 0.58 1.86 0.41 4.64 -0.47 -2.50 113.55 119.09 2gjx h SER 143 Ca 0.21 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2gjx h SER 143 Cb 0.39 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2gjx h SER 143 CO 0.01 0.53 -0.08 1.56 -0.87 0.00 0.00 176.83 177.97 2gjx h GLN 144 N 0.64 0.00 0.00 4.77 4.20 -1.30 -3.21 115.11 120.21 2gjx h GLN 144 Ca 0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 2gjx h GLN 144 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.91 2gjx h GLN 144 CO -0.02 0.00 -0.33 -0.07 -0.67 0.00 0.00 178.83 177.75 2gjx h LEU 145 N 0.00 0.00 -9.38 1.46 3.38 -1.19 -3.42 115.31 106.15 2gjx h LEU 145 Ca 0.00 -0.05 -0.54 0.00 0.09 0.00 0.00 57.88 57.37 2gjx h LEU 145 Cb 0.97 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 2gjx h LEU 145 CO 0.00 0.03 0.61 -0.69 0.09 0.00 0.00 178.44 178.48 2gjx s VAL 146 N -3.19 4.24 0.12 1.22 1.01 -1.12 -4.54 120.40 118.13 2gjx s VAL 146 Ca 0.07 1.59 -0.01 0.00 0.00 0.00 0.00 61.98 63.63 2gjx s VAL 146 Cb 0.10 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 2gjx s VAL 146 CO 0.68 0.06 0.04 -1.66 0.00 0.00 0.00 175.10 174.22 2gjx s TRP 147 N 1.66 0.84 -0.00 5.22 1.48 -1.05 -4.99 118.94 122.10 2gjx s TRP 147 Ca 0.56 -1.21 0.04 0.00 -1.06 0.00 0.00 56.10 54.44 2gjx s TRP 147 Cb -0.26 -0.48 -0.01 0.00 -1.16 0.00 0.00 33.47 31.56 2gjx s TRP 147 CO 0.25 -0.49 -0.13 -1.59 -4.06 0.00 0.00 176.95 170.93 2gjx s LYS 148 N -4.03 1.05 0.89 3.25 -2.85 -1.26 0.40 119.74 117.20 2gjx s LYS 148 Ca 0.22 -0.52 -0.13 0.00 -1.00 0.00 0.00 55.97 54.54 2gjx s LYS 148 Cb 0.07 -1.03 0.20 0.00 -2.06 0.00 0.00 37.83 35.02 2gjx s LYS 148 CO 0.00 0.28 1.22 -1.13 0.10 0.00 0.00 175.35 175.82 2gjx n SER 149 N 2.62 0.33 0.30 0.03 3.41 -0.77 -4.86 113.62 114.68 2gjx n SER 149 Ca -0.15 -1.58 0.17 0.00 -0.26 0.00 0.00 58.87 57.05 2gjx n SER 149 Cb 0.55 -0.91 0.92 0.00 -0.26 0.00 0.00 64.21 64.51 2gjx n SER 149 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gjx h ALA 150 N -1.57 1.26 0.00 7.33 0.00 -2.02 0.11 119.26 124.38 2gjx h ALA 150 Ca -0.39 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 2gjx h ALA 150 Cb 1.14 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2gjx h ALA 150 CO 0.30 0.05 -0.35 0.93 0.00 0.00 0.00 179.25 180.19 2gjx h GLU 151 N 0.00 0.00 0.00 0.00 3.07 -2.05 -3.46 114.58 112.13 2gjx h GLU 151 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2gjx h GLU 151 Cb 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 2gjx h GLU 151 CO 0.01 0.35 0.00 0.41 -1.40 0.00 0.00 179.01 178.37 2gjx n GLY 152 N 0.12 0.48 3.73 -3.84 0.00 0.39 -5.07 105.19 101.00 2gjx n GLY 152 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2gjx n GLY 152 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gjx s THR 153 N -2.00 3.15 0.22 2.61 2.01 -1.26 -4.69 115.64 115.69 2gjx s THR 153 Ca 0.00 0.89 -0.30 0.00 0.31 0.00 0.00 61.69 62.59 2gjx s THR 153 Cb 0.00 -3.57 -0.09 0.00 0.01 0.00 0.00 72.50 68.85 2gjx s THR 153 CO 0.00 0.11 1.00 -0.36 -0.69 0.00 0.00 174.62 174.68 2gjx s PHE 154 N 0.54 3.81 0.23 4.92 0.08 -1.26 -1.84 117.98 124.45 2gjx s PHE 154 Ca 0.61 1.81 0.00 0.00 0.12 0.00 0.00 56.93 59.47 2gjx s PHE 154 Cb -0.38 -3.11 -0.04 0.00 -0.57 0.00 0.00 43.02 38.93 2gjx s PHE 154 CO 0.35 0.03 0.14 -0.06 -0.10 0.00 0.00 175.22 175.59 2gjx s PHE 155 N -0.89 1.29 -0.27 0.36 0.08 0.16 -2.42 117.98 116.30 2gjx s PHE 155 Ca 0.44 -1.38 -0.08 0.00 0.12 0.00 0.00 56.93 56.03 2gjx s PHE 155 Cb -0.28 -0.64 0.13 0.00 -0.57 0.00 0.00 43.02 41.66 2gjx s PHE 155 CO 0.34 -0.61 0.58 -1.50 -0.10 0.00 0.00 175.22 173.93 2gjx s ILE 156 N -4.01 -0.90 0.80 0.64 1.10 -0.61 -2.52 121.20 115.70 2gjx s ILE 156 Ca 0.39 0.04 -0.11 0.00 -0.51 0.00 0.00 60.65 60.45 2gjx s ILE 156 Cb 0.07 -0.92 0.07 0.00 0.15 0.00 0.00 42.46 41.83 2gjx s ILE 156 CO 0.14 0.01 1.09 0.20 -2.11 0.00 0.00 174.94 174.27 2gjx s ASN 157 N 2.82 4.31 -0.37 4.50 -0.87 -1.26 -1.49 114.94 122.58 2gjx s ASN 157 Ca -0.01 1.59 -0.29 0.00 -1.57 0.00 0.00 52.86 52.58 2gjx s ASN 157 Cb -0.12 -2.32 -0.00 0.00 -0.02 0.00 0.00 41.25 38.78 2gjx s ASN 157 CO -0.18 -2.12 1.62 -0.75 -2.57 0.00 0.00 177.10 173.10 2gjx s LYS 158 N -4.98 3.45 -0.00 -0.60 2.20 0.14 -4.89 119.74 115.05 2gjx s LYS 158 Ca 0.61 1.19 0.04 0.00 -0.36 0.00 0.00 55.97 57.46 2gjx s LYS 158 Cb -0.16 -4.12 -0.01 0.00 -1.51 0.00 0.00 37.83 32.03 2gjx s LYS 158 CO 0.56 -1.72 -0.14 -0.08 -0.36 0.00 0.00 175.35 173.61 2gjx s THR 159 N 6.20 1.12 -0.19 3.43 -1.32 -0.36 -3.15 115.64 121.36 2gjx s THR 159 Ca 0.71 -0.66 -0.01 0.00 -1.21 0.00 0.00 61.69 60.52 2gjx s THR 159 Cb -0.18 -0.94 0.05 0.00 -1.51 0.00 0.00 72.50 69.92 2gjx s THR 159 CO 0.33 0.27 -0.03 -0.70 -2.21 0.00 0.00 174.62 172.29 2gjx s GLU 160 N -0.45 1.25 0.08 7.08 2.56 -0.82 0.21 118.70 128.61 2gjx s GLU 160 Ca 0.05 -0.63 0.09 0.00 0.00 0.00 0.00 54.97 54.48 2gjx s GLU 160 Cb -0.06 -2.21 -0.03 0.00 2.00 0.00 0.00 34.13 33.83 2gjx s GLU 160 CO -0.00 -0.55 -0.24 0.42 -0.56 0.00 0.00 175.26 174.33 2gjx s ILE 161 N 1.63 1.98 -0.36 -3.70 1.01 0.90 -1.08 121.20 121.58 2gjx s ILE 161 Ca -0.02 -1.48 0.01 0.00 0.00 0.00 0.00 60.65 59.16 2gjx s ILE 161 Cb -0.17 -1.74 0.15 0.00 0.01 0.00 0.00 42.46 40.71 2gjx s ILE 161 CO -0.07 0.17 0.25 -0.70 0.00 0.00 0.00 174.94 174.59 2gjx s GLU 162 N -1.58 0.59 0.21 2.79 -6.30 -0.03 -1.66 118.70 112.72 2gjx s GLU 162 Ca 0.10 -1.31 0.09 0.00 -2.50 0.00 0.00 54.97 51.35 2gjx s GLU 162 Cb -0.10 -1.21 -0.04 0.00 0.00 0.00 0.00 34.13 32.79 2gjx s GLU 162 CO 0.03 -1.22 -0.04 0.34 0.02 0.00 0.00 175.26 174.39 2gjx s ASP 163 N 1.05 4.51 -0.12 -1.70 2.15 -0.39 -2.65 116.67 119.51 2gjx s ASP 163 Ca 0.19 -0.54 -0.30 0.00 0.43 0.00 0.00 52.55 52.33 2gjx s ASP 163 Cb -0.20 -0.85 0.12 0.00 -0.30 0.00 0.00 42.92 41.69 2gjx s ASP 163 CO -0.01 0.07 0.95 0.72 -0.17 0.00 0.00 175.17 176.72 2gjx s PHE 164 N -1.91 -0.39 0.38 -5.34 -0.71 -1.26 -2.16 117.98 106.58 2gjx s PHE 164 Ca 0.28 0.58 -0.25 0.00 -1.04 0.00 0.00 56.93 56.49 2gjx s PHE 164 Cb -0.08 0.47 -0.09 0.00 -1.21 0.00 0.00 43.02 42.10 2gjx s PHE 164 CO 0.18 -0.41 1.06 -1.25 -1.34 0.00 0.00 175.22 173.45 2gjx s PRO 165 N -1.58 4.25 0.10 1.99 0.04 -1.26 -4.65 135.00 133.89 2gjx s PRO 165 Ca -0.01 1.56 -0.12 0.00 0.04 0.00 0.00 61.00 62.47 2gjx s PRO 165 Cb -0.01 -2.65 -0.16 0.00 0.04 0.00 0.00 34.50 31.72 2gjx s PRO 165 CO -0.00 -0.08 1.28 -0.09 0.04 0.00 0.00 177.00 178.16 2gjx h ARG 166 N 2.73 0.75 -6.26 4.56 2.43 -0.93 -3.44 114.38 114.22 2gjx h ARG 166 Ca -0.48 -0.66 -0.64 0.00 -0.81 0.00 0.00 59.98 57.39 2gjx h ARG 166 Cb 1.21 0.15 -0.29 0.00 -0.42 0.00 0.00 29.97 30.62 2gjx h ARG 166 CO 0.63 1.26 -0.87 -0.06 -1.51 0.00 0.00 179.97 179.43 2gjx s PHE 167 N -3.63 2.03 -0.58 2.20 0.08 -0.74 -5.02 117.98 112.32 2gjx s PHE 167 Ca -0.10 -0.38 0.25 0.00 0.12 0.00 0.00 56.93 56.81 2gjx s PHE 167 Cb 0.08 -1.30 0.58 0.00 -0.57 0.00 0.00 43.02 41.82 2gjx s PHE 167 CO 0.91 -0.02 1.70 -1.00 -0.10 0.00 0.00 175.22 176.71 2gjx h PRO 168 N 5.48 0.00 -3.64 0.24 0.13 -1.86 -3.41 132.00 128.95 2gjx h PRO 168 Ca -0.41 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.03 2gjx h PRO 168 Cb 1.13 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 31.90 2gjx h PRO 168 CO 0.47 0.00 -0.43 -1.58 -0.23 0.00 0.00 178.00 176.23 2gjx s HIS 169 N -3.16 3.39 -0.54 1.56 2.46 -0.29 -4.95 115.29 113.76 2gjx s HIS 169 Ca 0.09 -2.79 -0.03 0.00 0.47 0.00 0.00 55.06 52.80 2gjx s HIS 169 Cb 0.09 -3.13 0.14 0.00 -0.13 0.00 0.00 32.58 29.55 2gjx s HIS 169 CO 0.63 -0.83 0.35 1.03 -2.47 0.00 0.00 174.74 173.45 2gjx s ARG 170 N -0.01 2.35 0.50 2.88 0.52 -1.26 -1.79 118.95 122.14 2gjx s ARG 170 Ca 0.16 -2.24 0.06 0.00 -0.52 0.00 0.00 55.73 53.19 2gjx s ARG 170 Cb -0.21 -3.68 0.01 0.00 0.52 0.00 0.00 34.95 31.59 2gjx s ARG 170 CO -0.03 -1.14 0.38 0.20 0.02 0.00 0.00 175.30 174.73 2gjx s GLY 171 N 1.17 2.29 -0.15 -3.53 0.00 -0.48 -0.88 107.32 105.74 2gjx s GLY 171 Ca 0.13 -1.56 -0.08 0.00 0.00 0.00 0.00 44.72 43.22 2gjx s GLY 171 CO -0.04 -1.87 0.36 -2.27 0.00 0.00 0.00 173.10 169.28 2gjx s LEU 172 N -4.20 0.06 -0.18 0.66 1.98 -0.32 -2.32 118.68 114.35 2gjx s LEU 172 Ca 0.39 0.78 -0.08 0.00 -2.89 0.00 0.00 54.13 52.33 2gjx s LEU 172 Cb -0.02 1.16 -0.04 0.00 0.66 0.00 0.00 46.19 47.95 2gjx s LEU 172 CO 0.24 -0.18 0.09 -0.22 -1.89 0.00 0.00 176.35 174.38 2gjx s LEU 173 N 1.36 3.97 -0.11 -0.68 0.20 0.14 -1.14 118.68 122.42 2gjx s LEU 173 Ca -0.09 0.15 0.02 0.00 0.69 0.00 0.00 54.13 54.90 2gjx s LEU 173 Cb -0.09 -2.01 -0.01 0.00 -0.43 0.00 0.00 46.19 43.66 2gjx s LEU 173 CO -0.11 0.19 -0.19 -0.76 -0.29 0.00 0.00 176.35 175.19 2gjx s LEU 174 N 0.26 2.37 -0.56 -0.68 1.02 -0.87 -1.54 118.68 118.68 2gjx s LEU 174 Ca 0.06 -0.46 -0.16 0.00 0.02 0.00 0.00 54.13 53.58 2gjx s LEU 174 Cb -0.12 -1.50 0.13 0.00 0.02 0.00 0.00 46.19 44.72 2gjx s LEU 174 CO -0.00 0.16 0.55 -0.62 0.02 0.00 0.00 176.35 176.45 2gjx s ASP 175 N 0.36 6.22 -0.15 2.29 2.15 -1.20 -1.41 116.67 124.93 2gjx s ASP 175 Ca -0.15 -1.78 0.11 0.00 0.43 0.00 0.00 52.55 51.15 2gjx s ASP 175 Cb -0.17 -2.22 0.58 0.00 -0.30 0.00 0.00 42.92 40.80 2gjx s ASP 175 CO 0.07 -0.88 1.40 0.35 -0.17 0.00 0.00 175.17 175.93 2gjx n THR 176 N 5.23 1.86 -0.05 1.71 -2.24 -0.98 -4.25 114.28 115.56 2gjx n THR 176 Ca -0.12 -0.97 -0.06 0.00 -2.27 0.00 0.00 64.05 60.63 2gjx n THR 176 Cb 0.41 -0.27 -0.02 0.00 -2.10 0.00 0.00 70.33 68.35 2gjx n THR 176 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2gjx n SER 177 N 0.51 1.43 -0.31 3.42 2.88 -1.24 -4.15 113.62 116.17 2gjx n SER 177 Ca 0.20 0.23 0.17 0.00 -1.33 0.00 0.00 58.87 58.14 2gjx n SER 177 Cb 0.88 -0.61 0.43 0.00 -0.75 0.00 0.00 64.21 64.16 2gjx n SER 177 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2gjx h ARG 178 N -0.64 0.54 -3.42 -1.46 -0.00 -1.85 -3.37 114.38 104.18 2gjx h ARG 178 Ca 0.00 -0.03 -0.26 0.00 -0.50 0.00 0.00 59.98 59.18 2gjx h ARG 178 Cb 0.64 -0.12 -0.32 0.00 0.00 0.00 0.00 29.97 30.17 2gjx h ARG 178 CO 0.00 0.36 -0.66 -1.01 0.00 0.00 0.00 179.97 178.66 2gjx s HIS 179 N -5.62 -0.06 0.44 3.04 3.76 -1.26 -4.90 115.29 110.69 2gjx s HIS 179 Ca -0.10 0.28 -0.24 0.00 -0.15 0.00 0.00 55.06 54.85 2gjx s HIS 179 Cb 0.24 -0.14 -0.08 0.00 1.11 0.00 0.00 32.58 33.72 2gjx s HIS 179 CO 0.79 -0.11 1.19 -0.47 -0.85 0.00 0.00 174.74 175.29 2gjx s TYR 180 N 0.96 2.91 -0.16 1.40 5.04 -1.26 -4.24 117.35 122.01 2gjx s TYR 180 Ca -0.08 1.52 0.00 0.00 -2.44 0.00 0.00 57.07 56.08 2gjx s TYR 180 Cb -0.11 -3.43 0.02 0.00 0.35 0.00 0.00 41.96 38.80 2gjx s TYR 180 CO -0.04 -1.56 -0.14 -0.51 -1.34 0.00 0.00 175.55 171.96 2gjx s LEU 181 N -2.80 1.79 0.48 6.97 1.43 -1.26 -4.53 118.68 120.76 2gjx s LEU 181 Ca 0.61 -0.54 -0.23 0.00 -1.03 0.00 0.00 54.13 52.94 2gjx s LEU 181 Cb -0.31 -1.21 -0.08 0.00 0.03 0.00 0.00 46.19 44.62 2gjx s LEU 181 CO 0.38 -0.06 1.11 -2.65 0.23 0.00 0.00 176.35 175.36 2gjx n PRO 182 N 4.75 1.44 -0.34 1.29 -0.02 -1.26 -4.81 135.00 136.05 2gjx n PRO 182 Ca -0.17 0.52 0.19 0.00 -2.02 0.00 0.00 63.50 62.03 2gjx n PRO 182 Cb 0.50 -2.24 0.43 0.00 -0.02 0.00 0.00 33.50 32.17 2gjx n PRO 182 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2gjx h LEU 183 N 1.41 0.59 -1.40 2.45 5.85 -1.99 0.09 115.31 122.30 2gjx h LEU 183 Ca -0.47 0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.33 2gjx h LEU 183 Cb 1.33 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.35 2gjx h LEU 183 CO 0.56 0.11 0.13 0.77 -0.34 0.00 0.00 178.44 179.68 2gjx h SER 184 N 0.52 0.49 0.17 1.25 4.64 -1.99 -1.13 113.55 117.49 2gjx h SER 184 Ca 0.62 -0.05 -0.15 0.00 -0.47 0.00 0.00 61.79 61.74 2gjx h SER 184 Cb 1.32 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 2gjx h SER 184 CO -0.39 0.46 -0.54 0.28 -0.87 0.00 0.00 176.83 175.77 2gjx h SER 185 N 0.54 0.44 -0.16 4.97 0.02 -1.32 -1.75 113.55 116.28 2gjx h SER 185 Ca 0.13 -0.23 -0.14 0.00 -0.84 0.00 0.00 61.79 60.72 2gjx h SER 185 Cb 0.14 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.56 2gjx h SER 185 CO -0.01 0.89 -0.43 0.40 -1.14 0.00 0.00 176.83 176.55 2gjx h ILE 186 N 0.31 1.34 -0.33 3.27 2.04 -1.24 -2.30 117.51 120.60 2gjx h ILE 186 Ca 0.01 -1.68 -0.07 0.00 1.00 0.00 0.00 64.86 64.12 2gjx h ILE 186 Cb 1.04 1.97 -0.02 0.00 -0.74 0.00 0.00 36.82 39.08 2gjx h ILE 186 CO 0.09 0.52 -0.08 -0.07 0.00 0.00 0.00 178.15 178.61 2gjx h LEU 187 N 0.23 0.53 -0.53 1.44 3.38 -1.21 -1.73 115.31 117.42 2gjx h LEU 187 Ca -0.01 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 2gjx h LEU 187 Cb 1.04 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 2gjx h LEU 187 CO 0.09 0.66 -0.06 0.44 0.09 0.00 0.00 178.44 179.66 2gjx h ASP 188 N 0.52 0.98 -0.66 -0.43 3.45 -1.29 -2.10 116.42 116.88 2gjx h ASP 188 Ca 0.10 -0.33 -0.01 0.00 0.43 0.00 0.00 57.03 57.21 2gjx h ASP 188 Cb 0.45 -0.26 -0.03 0.00 -0.56 0.00 0.00 39.33 38.93 2gjx h ASP 188 CO 0.02 1.08 0.36 0.74 -1.57 0.00 0.00 179.24 179.88 2gjx h THR 189 N 0.86 1.21 -0.37 0.35 2.02 -1.01 -2.20 112.91 113.77 2gjx h THR 189 Ca 0.14 -0.51 -0.02 0.00 0.77 0.00 0.00 66.41 66.79 2gjx h THR 189 Cb 0.62 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 2gjx h THR 189 CO 0.04 0.22 0.12 -0.07 0.37 0.00 0.00 175.52 176.21 2gjx h LEU 190 N 0.90 0.47 -0.94 2.58 3.38 -1.14 0.39 115.31 120.95 2gjx h LEU 190 Ca 0.23 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 2gjx h LEU 190 Cb 0.03 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 2gjx h LEU 190 CO -0.04 0.45 0.20 0.44 0.09 0.00 0.00 178.44 179.59 2gjx h ASP 191 N 0.52 0.91 0.80 -0.43 3.32 -0.77 -2.44 116.42 118.32 2gjx h ASP 191 Ca 0.13 -0.15 -0.24 0.00 0.02 0.00 0.00 57.03 56.78 2gjx h ASP 191 Cb 0.15 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 2gjx h ASP 191 CO -0.01 0.85 -1.21 0.58 -1.72 0.00 0.00 179.24 177.73 2gjx h VAL 192 N 0.94 1.49 -0.72 -1.35 2.07 -0.98 -3.07 116.25 114.63 2gjx h VAL 192 Ca 0.21 -3.19 0.05 0.00 0.82 0.00 0.00 66.70 64.59 2gjx h VAL 192 Cb 0.27 2.80 -0.04 0.00 -1.52 0.00 0.00 31.29 32.79 2gjx h VAL 192 CO -0.01 0.88 0.47 0.24 0.02 0.00 0.00 177.57 179.17 2gjx h MET 193 N 0.02 0.79 -0.56 1.57 2.86 -0.83 -0.93 114.93 117.85 2gjx h MET 193 Ca -0.10 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.42 2gjx h MET 193 Cb 1.87 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 33.33 2gjx h MET 193 CO 0.14 0.52 0.04 0.00 1.06 0.00 0.00 176.91 178.67 2gjx h ALA 194 N 1.59 1.02 -0.32 6.32 0.00 -1.39 0.18 119.26 126.67 2gjx h ALA 194 Ca 0.30 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 2gjx h ALA 194 Cb 0.15 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2gjx h ALA 194 CO -0.09 0.61 -0.11 1.88 0.00 0.00 0.00 179.25 181.54 2gjx h TYR 195 N 0.86 0.58 -0.06 0.00 0.05 -1.11 -2.66 116.97 114.63 2gjx h TYR 195 Ca 0.17 -0.09 0.00 0.00 0.05 0.00 0.00 58.73 58.86 2gjx h TYR 195 Cb 0.45 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.04 2gjx h TYR 195 CO 0.03 0.64 0.00 0.09 -1.05 0.00 0.00 178.16 177.87 2gjx n ASN 196 N -4.20 1.83 -1.39 3.88 5.03 -0.71 -4.67 115.26 115.03 2gjx n ASN 196 Ca 0.01 -1.63 -0.13 0.00 0.87 0.00 0.00 54.58 53.69 2gjx n ASN 196 Cb 0.32 -0.03 -0.02 0.00 -1.02 0.00 0.00 39.78 39.04 2gjx n ASN 196 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 2gjx n LYS 197 N 0.43 -1.03 -2.79 3.52 5.02 -0.40 -4.59 118.16 118.32 2gjx n LYS 197 Ca 0.18 0.73 -0.42 0.00 -2.02 0.00 0.00 58.31 56.78 2gjx n LYS 197 Cb 0.40 -4.92 -0.03 0.00 -0.02 0.00 0.00 35.03 30.45 2gjx n LYS 197 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2gjx s LEU 198 N -3.63 4.29 0.00 -0.35 1.02 0.50 -4.94 118.68 115.58 2gjx s LEU 198 Ca 0.00 1.45 0.09 0.00 0.02 0.00 0.00 54.13 55.69 2gjx s LEU 198 Cb 0.00 -3.42 0.20 0.00 0.02 0.00 0.00 46.19 42.99 2gjx s LEU 198 CO 0.00 -0.32 1.10 -0.46 0.02 0.00 0.00 176.35 176.69 2gjx n ASN 199 N 4.45 2.49 -3.83 2.29 6.94 -0.06 -4.40 115.26 123.13 2gjx n ASN 199 Ca 0.05 -1.84 -0.24 0.00 -0.02 0.00 0.00 54.58 52.53 2gjx n ASN 199 Cb 0.50 -0.14 -0.17 0.00 -2.36 0.00 0.00 39.78 37.61 2gjx n ASN 199 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2gjx s VAL 200 N -0.93 0.64 -0.52 3.53 1.01 -0.82 0.25 120.40 123.55 2gjx s VAL 200 Ca 0.17 -0.05 -0.16 0.00 0.00 0.00 0.00 61.98 61.94 2gjx s VAL 200 Cb 0.09 -0.74 0.11 0.00 0.00 0.00 0.00 36.38 35.84 2gjx s VAL 200 CO 0.12 0.30 0.48 0.12 0.00 0.00 0.00 175.10 176.12 2gjx s PHE 201 N 1.84 3.23 -1.01 5.22 5.36 0.11 -1.17 117.98 131.56 2gjx s PHE 201 Ca 0.05 -1.15 -0.23 0.00 -0.96 0.00 0.00 56.93 54.64 2gjx s PHE 201 Cb -0.12 -3.60 0.05 0.00 -0.34 0.00 0.00 43.02 39.00 2gjx s PHE 201 CO -0.06 -0.96 1.47 -1.58 -1.46 0.00 0.00 175.22 172.63 2gjx s HIS 202 N 1.68 2.49 -0.48 10.12 5.65 -0.29 -1.38 115.29 133.07 2gjx s HIS 202 Ca 0.04 -0.76 -0.28 0.00 0.25 0.00 0.00 55.06 54.31 2gjx s HIS 202 Cb -0.28 -4.67 0.03 0.00 -1.18 0.00 0.00 32.58 26.48 2gjx s HIS 202 CO 0.04 -1.94 1.09 -0.46 -0.65 0.00 0.00 174.74 172.83 2gjx s TRP 203 N 5.21 2.82 -1.15 3.88 -0.11 0.12 -2.04 118.94 127.67 2gjx s TRP 203 Ca 0.47 0.59 -0.11 0.00 1.22 0.00 0.00 56.10 58.26 2gjx s TRP 203 Cb -0.00 -4.33 0.23 0.00 -1.50 0.00 0.00 33.47 27.86 2gjx s TRP 203 CO -0.09 -1.26 1.25 -1.58 -4.62 0.00 0.00 176.95 170.65 2gjx s HIS 204 N 4.32 3.91 0.08 5.86 5.65 -0.50 -1.49 115.29 133.13 2gjx s HIS 204 Ca 0.44 -2.42 -0.27 0.00 0.25 0.00 0.00 55.06 53.07 2gjx s HIS 204 Cb -0.08 -4.06 -0.16 0.00 -1.18 0.00 0.00 32.58 27.10 2gjx s HIS 204 CO 0.30 -1.16 1.69 -0.07 -0.65 0.00 0.00 174.74 174.85 2gjx h LEU 205 N 8.09 -0.33 -9.22 8.88 4.07 -1.81 -2.59 115.31 122.40 2gjx h LEU 205 Ca 0.24 0.01 -0.56 0.00 0.08 0.00 0.00 57.88 57.66 2gjx h LEU 205 Cb 0.88 0.09 -0.14 0.00 1.08 0.00 0.00 40.66 42.57 2gjx h LEU 205 CO 1.11 -0.23 -0.71 0.68 -1.08 0.00 0.00 178.44 178.22 2gjx s VAL 206 N -6.13 2.06 0.00 1.22 -7.23 -1.26 -3.63 120.40 105.43 2gjx s VAL 206 Ca -0.15 -2.24 0.00 0.00 -1.81 0.00 0.00 61.98 57.79 2gjx s VAL 206 Cb 0.05 -2.42 0.00 0.00 0.56 0.00 0.00 36.38 34.57 2gjx s VAL 206 CO 0.64 -0.33 0.00 -0.67 -0.31 0.00 0.00 175.10 174.43 2gjx n ASP 207 N -0.63 0.00 0.01 4.85 4.64 -1.07 -4.58 116.55 119.77 2gjx n ASP 207 Ca -0.06 -0.13 -0.10 0.00 -1.38 0.00 0.00 54.79 53.13 2gjx n ASP 207 Cb 0.62 0.00 -0.04 0.00 -1.04 0.00 0.00 41.12 40.66 2gjx n ASP 207 CO 0.00 0.00 0.00 0.44 -0.82 0.00 0.00 177.20 176.82 2gjx h ASP 208 N 0.00 -0.24 1.31 1.67 3.32 -1.93 -3.29 116.42 117.27 2gjx h ASP 208 Ca 0.00 0.05 -0.12 0.00 0.02 0.00 0.00 57.03 56.98 2gjx h ASP 208 Cb 0.00 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 2gjx h ASP 208 CO 0.00 -0.11 -0.72 1.55 -1.72 0.00 0.00 179.24 178.25 2gjx h PRO 209 N -0.09 0.00 -3.05 3.56 0.13 -1.94 -2.20 132.00 128.41 2gjx h PRO 209 Ca 0.06 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.05 2gjx h PRO 209 Cb 0.18 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 31.08 2gjx h PRO 209 CO -0.14 0.48 -0.33 0.45 -0.23 0.00 0.00 178.00 178.23 2gjx s SER 210 N -6.32 -0.24 -0.58 1.44 0.15 -1.24 -4.77 113.70 102.14 2gjx s SER 210 Ca 0.02 0.33 0.04 0.00 0.70 0.00 0.00 55.95 57.04 2gjx s SER 210 Cb 0.08 0.46 0.16 0.00 -1.71 0.00 0.00 66.02 65.02 2gjx s SER 210 CO 0.76 -0.27 0.41 0.12 1.20 0.00 0.00 173.24 175.46 2gjx s PHE 211 N -0.59 2.65 -0.86 3.44 2.19 -1.14 -2.59 117.98 121.08 2gjx s PHE 211 Ca -0.07 -2.93 0.27 0.00 0.33 0.00 0.00 56.93 54.53 2gjx s PHE 211 Cb -0.04 -2.10 1.01 0.00 -1.31 0.00 0.00 43.02 40.58 2gjx s PHE 211 CO 0.02 -0.66 1.84 -0.35 1.83 0.00 0.00 175.22 177.90 2gjx n PRO 212 N 2.46 0.13 -2.38 10.12 -0.04 -1.26 -3.15 135.00 140.89 2gjx n PRO 212 Ca 0.21 0.12 -0.42 0.00 -0.04 0.00 0.00 63.50 63.36 2gjx n PRO 212 Cb 0.38 -1.66 -0.03 0.00 -0.04 0.00 0.00 33.50 32.16 2gjx n PRO 212 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 2gjx s TYR 213 N -3.06 3.13 -0.45 0.54 5.04 -1.26 -0.47 117.35 120.81 2gjx s TYR 213 Ca 0.12 1.10 -0.23 0.00 -2.44 0.00 0.00 57.07 55.63 2gjx s TYR 213 Cb 0.15 -3.50 0.03 0.00 0.35 0.00 0.00 41.96 38.99 2gjx s TYR 213 CO 0.56 -1.67 0.76 -2.00 -1.34 0.00 0.00 175.55 171.86 2gjx s GLU 214 N 2.08 3.37 -0.05 4.97 2.12 -0.78 -4.24 118.70 126.18 2gjx s GLU 214 Ca 0.59 -0.18 -0.13 0.00 0.36 0.00 0.00 54.97 55.60 2gjx s GLU 214 Cb -0.28 -3.95 -0.05 0.00 0.26 0.00 0.00 34.13 30.11 2gjx s GLU 214 CO 0.24 -1.11 0.35 0.45 -0.54 0.00 0.00 175.26 174.65 2gjx s SER 215 N 2.14 6.68 0.05 -1.70 0.15 -1.26 -4.69 113.70 115.07 2gjx s SER 215 Ca 0.28 0.81 0.23 0.00 0.70 0.00 0.00 55.95 57.97 2gjx s SER 215 Cb -0.13 -2.21 -0.02 0.00 -1.71 0.00 0.00 66.02 61.95 2gjx s SER 215 CO 0.22 0.29 0.95 2.22 1.20 0.00 0.00 173.24 178.12 2gjx n PHE 216 N 2.18 0.30 0.04 3.44 1.16 -1.26 -2.80 117.46 120.52 2gjx n PHE 216 Ca -0.14 0.09 -0.08 0.00 -1.87 0.00 0.00 57.45 55.44 2gjx n PHE 216 Cb 0.53 -0.48 -0.13 0.00 -1.61 0.00 0.00 39.48 37.79 2gjx n PHE 216 CO 0.00 0.00 0.00 1.79 -1.87 0.00 0.00 176.76 176.68 2gjx h THR 217 N 0.00 1.49 -2.38 1.97 1.35 -1.95 -3.40 112.91 109.99 2gjx h THR 217 Ca 0.00 -3.22 -0.59 0.00 -0.55 0.00 0.00 66.41 62.05 2gjx h THR 217 Cb 0.78 2.75 -0.38 0.00 -1.73 0.00 0.00 68.15 69.57 2gjx h THR 217 CO 0.00 0.86 -0.97 -0.36 -0.25 0.00 0.00 175.52 174.80 2gjx s PHE 218 N -2.68 1.10 0.50 4.73 0.08 -1.26 -4.99 117.98 115.47 2gjx s PHE 218 Ca -0.01 -2.32 0.41 0.00 0.12 0.00 0.00 56.93 55.13 2gjx s PHE 218 Cb 0.09 -0.94 2.19 0.00 -0.57 0.00 0.00 43.02 43.79 2gjx s PHE 218 CO 0.83 -0.83 2.25 -1.35 -0.10 0.00 0.00 175.22 176.02 2gjx h PRO 219 N 5.67 0.00 0.00 0.24 0.11 -1.74 -2.54 132.00 133.74 2gjx h PRO 219 Ca 0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.37 2gjx h PRO 219 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 2gjx h PRO 219 CO 0.37 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.09 2gjx h GLU 220 N 0.00 0.00 0.11 1.05 4.39 -1.87 -2.87 114.58 115.39 2gjx h GLU 220 Ca 0.00 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 2gjx h GLU 220 Cb 0.05 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 2gjx h GLU 220 CO 0.00 0.00 -0.05 -0.07 -1.16 0.00 0.00 179.01 177.73 2gjx h LEU 221 N 0.00 -0.12 -0.06 1.33 3.38 -1.72 -2.47 115.31 115.64 2gjx h LEU 221 Ca 0.00 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 2gjx h LEU 221 Cb 0.75 0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.54 2gjx h LEU 221 CO 0.00 -0.09 -0.79 -0.03 0.09 0.00 0.00 178.44 177.62 2gjx h MET 222 N -0.14 0.65 0.00 1.13 4.05 -1.73 -2.05 114.93 116.84 2gjx h MET 222 Ca -0.01 -0.61 -0.03 0.00 -0.28 0.00 0.00 59.70 58.77 2gjx h MET 222 Cb 0.11 0.15 -0.00 0.00 -0.80 0.00 0.00 31.60 31.06 2gjx h MET 222 CO 0.02 1.22 -0.13 0.00 0.23 0.00 0.00 176.91 178.26 2gjx h ARG 223 N 0.30 0.00 0.00 0.39 3.08 -1.50 -2.85 114.38 113.80 2gjx h ARG 223 Ca -0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2gjx h ARG 223 Cb 1.45 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.50 2gjx h ARG 223 CO 0.16 0.13 0.00 1.63 -1.07 0.00 0.00 179.97 180.81 2gjx n LYS 224 N -4.03 1.57 -0.03 0.04 5.02 -0.94 -4.76 118.16 115.04 2gjx n LYS 224 Ca -0.02 -1.05 -0.03 0.00 -2.02 0.00 0.00 58.31 55.18 2gjx n LYS 224 Cb 0.21 -0.87 -0.03 0.00 -0.02 0.00 0.00 35.03 34.31 2gjx n LYS 224 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2gjx n GLY 225 N -0.29 -0.17 3.79 0.72 0.00 -0.77 -4.74 105.19 103.73 2gjx n GLY 225 Ca 0.00 -0.06 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 2gjx n GLY 225 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2gjx s SER 226 N -4.00 5.57 0.20 1.61 1.04 -1.08 -2.86 113.70 114.19 2gjx s SER 226 Ca -0.05 1.90 -0.10 0.00 0.48 0.00 0.00 55.95 58.18 2gjx s SER 226 Cb 0.02 -2.54 0.26 0.00 0.10 0.00 0.00 66.02 63.85 2gjx s SER 226 CO 0.17 -1.31 1.74 1.88 0.98 0.00 0.00 173.24 176.70 2gjx h TYR 227 N 0.37 0.38 -3.07 5.02 0.05 -1.86 -3.41 116.97 114.46 2gjx h TYR 227 Ca -0.47 0.03 -0.28 0.00 0.05 0.00 0.00 58.73 58.06 2gjx h TYR 227 Cb 1.23 -0.08 -0.35 0.00 1.01 0.00 0.00 36.73 38.54 2gjx h TYR 227 CO 0.57 0.10 -0.62 1.21 -1.05 0.00 0.00 178.16 178.37 2gjx s ASN 228 N -5.39 0.63 0.00 3.88 3.04 -1.26 -5.04 114.94 110.80 2gjx s ASN 228 Ca -0.13 0.37 0.02 0.00 0.04 0.00 0.00 52.86 53.16 2gjx s ASN 228 Cb 0.17 0.33 0.10 0.00 -1.54 0.00 0.00 41.25 40.31 2gjx s ASN 228 CO 0.74 -0.24 0.56 -2.65 -3.04 0.00 0.00 177.10 172.48 2gjx n PRO 229 N 5.25 0.06 0.08 0.43 -0.02 -1.26 -2.92 135.00 136.61 2gjx n PRO 229 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 2gjx n PRO 229 Cb 0.50 -1.47 0.00 0.00 -0.02 0.00 0.00 33.50 32.51 2gjx n PRO 229 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2gjx n VAL 230 N -0.97 0.45 0.06 -1.45 0.31 -1.26 -4.91 118.33 110.55 2gjx n VAL 230 Ca 0.01 0.15 -0.16 0.00 -0.01 0.00 0.00 64.34 64.33 2gjx n VAL 230 Cb 0.01 -1.01 -0.07 0.00 -0.91 0.00 0.00 33.84 31.85 2gjx n VAL 230 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2gjx h THR 231 N 0.00 1.35 -2.37 2.52 1.35 -2.01 -3.35 112.91 110.41 2gjx h THR 231 Ca 0.00 -2.40 -0.75 0.00 -0.55 0.00 0.00 66.41 62.70 2gjx h THR 231 Cb 0.12 2.44 -0.31 0.00 -1.73 0.00 0.00 68.15 68.67 2gjx h THR 231 CO 0.00 0.73 0.56 1.41 -0.25 0.00 0.00 175.52 177.97 2gjx n HIS 232 N -3.78 2.98 -4.17 4.73 8.25 -1.15 -5.01 115.22 117.08 2gjx n HIS 232 Ca -0.09 -2.94 -0.15 0.00 -0.26 0.00 0.00 57.72 54.28 2gjx n HIS 232 Cb 0.87 -1.03 -0.11 0.00 1.12 0.00 0.00 29.99 30.84 2gjx n HIS 232 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2gjx s ILE 233 N -3.99 0.96 -0.31 1.59 -1.09 -1.26 -4.60 121.20 112.50 2gjx s ILE 233 Ca 0.40 -1.51 -0.00 0.00 -2.23 0.00 0.00 60.65 57.31 2gjx s ILE 233 Cb 0.18 -1.22 0.07 0.00 -1.58 0.00 0.00 42.46 39.91 2gjx s ILE 233 CO -0.08 -0.46 0.01 -0.31 -1.23 0.00 0.00 174.94 172.88 2gjx s TYR 234 N -2.04 3.39 0.87 3.97 1.51 0.38 -5.00 117.35 120.42 2gjx s TYR 234 Ca 0.02 -2.23 -0.13 0.00 -1.01 0.00 0.00 57.07 53.72 2gjx s TYR 234 Cb -0.05 -2.37 0.12 0.00 -0.11 0.00 0.00 41.96 39.55 2gjx s TYR 234 CO 0.01 -0.87 1.21 0.99 -1.11 0.00 0.00 175.55 175.78 2gjx s THR 235 N 1.15 1.99 0.40 -0.71 2.01 -1.26 -1.86 115.64 117.35 2gjx s THR 235 Ca -0.02 0.00 0.16 0.00 0.31 0.00 0.00 61.69 62.14 2gjx s THR 235 Cb -0.20 -2.96 0.16 0.00 0.01 0.00 0.00 72.50 69.50 2gjx s THR 235 CO -0.03 0.00 1.92 0.00 -0.69 0.00 0.00 174.62 175.82 2gjx h ALA 236 N -1.29 1.46 -0.27 7.40 0.00 -2.00 -1.48 119.26 123.08 2gjx h ALA 236 Ca -0.46 -0.24 -0.17 0.00 0.00 0.00 0.00 54.91 54.04 2gjx h ALA 236 Cb 1.30 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 2gjx h ALA 236 CO 0.57 0.33 -0.51 0.37 0.00 0.00 0.00 179.25 180.02 2gjx h GLN 237 N 0.00 0.77 -0.26 0.00 5.75 -1.99 -2.36 115.11 117.03 2gjx h GLN 237 Ca -0.00 -0.47 -0.03 0.00 -0.15 0.00 0.00 58.65 58.00 2gjx h GLN 237 Cb 0.50 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.08 2gjx h GLN 237 CO 0.03 1.09 0.06 -0.44 -2.65 0.00 0.00 178.83 176.93 2gjx h ASP 238 N 0.60 0.39 -0.43 -0.69 3.32 -1.76 -2.61 116.42 115.24 2gjx h ASP 238 Ca 0.02 -0.24 -0.03 0.00 0.02 0.00 0.00 57.03 56.80 2gjx h ASP 238 Cb 1.09 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.52 2gjx h ASP 238 CO 0.11 0.53 0.13 0.58 -1.72 0.00 0.00 179.24 178.87 2gjx h VAL 239 N 0.24 1.22 0.00 -1.35 2.07 -1.29 -1.96 116.25 115.18 2gjx h VAL 239 Ca 0.08 -0.73 -0.03 0.00 0.82 0.00 0.00 66.70 66.84 2gjx h VAL 239 Cb 0.29 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2gjx h VAL 239 CO 0.00 0.26 -0.15 0.07 0.02 0.00 0.00 177.57 177.77 2gjx h LYS 240 N 0.56 0.00 -0.01 1.57 2.10 -1.46 -1.93 116.57 117.40 2gjx h LYS 240 Ca 0.14 0.00 -0.24 0.00 -2.00 0.00 0.00 60.65 58.55 2gjx h LYS 240 Cb 0.27 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.61 2gjx h LYS 240 CO -0.00 0.15 -0.93 0.93 -2.00 0.00 0.00 179.45 177.60 2gjx h GLU 241 N 0.00 0.65 0.13 0.07 5.08 -1.13 -2.59 114.58 116.80 2gjx h GLU 241 Ca -0.00 -0.69 -0.00 0.00 -1.00 0.00 0.00 59.36 57.67 2gjx h GLU 241 Cb 0.58 0.19 -0.00 0.00 0.50 0.00 0.00 28.75 30.02 2gjx h GLU 241 CO 0.02 1.28 -0.08 0.28 -1.00 0.00 0.00 179.01 179.50 2gjx h VAL 242 N 0.30 0.82 -0.15 3.13 2.07 -1.03 0.74 116.25 122.13 2gjx h VAL 242 Ca -0.11 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.44 2gjx h VAL 242 Cb 1.60 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 32.14 2gjx h VAL 242 CO 0.18 0.00 -0.08 0.40 0.02 0.00 0.00 177.57 178.09 2gjx h ILE 243 N -0.21 0.75 -0.34 4.57 2.04 -1.43 0.25 117.51 123.13 2gjx h ILE 243 Ca -0.01 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.73 2gjx h ILE 243 Cb 0.18 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 2gjx h ILE 243 CO 0.01 0.00 -0.26 -0.08 0.00 0.00 0.00 178.15 177.81 2gjx h GLU 244 N -0.07 0.69 -0.38 2.37 4.57 -1.41 0.10 114.58 120.46 2gjx h GLU 244 Ca 0.09 -0.29 -0.03 0.00 -1.18 0.00 0.00 59.36 57.95 2gjx h GLU 244 Cb 0.20 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 2gjx h GLU 244 CO -0.20 0.89 0.13 -0.92 -1.18 0.00 0.00 179.01 177.72 2gjx h TYR 245 N 0.60 0.61 -0.34 0.92 3.20 -0.43 -1.72 116.97 119.81 2gjx h TYR 245 Ca 0.08 -0.06 -0.09 0.00 3.14 0.00 0.00 58.73 61.80 2gjx h TYR 245 Cb 0.76 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.84 2gjx h TYR 245 CO 0.04 0.58 -0.16 0.00 -1.64 0.00 0.00 178.16 176.97 2gjx h ALA 246 N 0.97 1.09 -0.77 1.82 0.00 -0.32 -2.95 119.26 119.11 2gjx h ALA 246 Ca 0.12 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 2gjx h ALA 246 Cb 0.25 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2gjx h ALA 246 CO -0.00 0.56 0.38 -0.09 0.00 0.00 0.00 179.25 180.09 2gjx h ARG 247 N 0.55 1.10 0.00 0.00 2.43 -0.41 0.45 114.38 118.50 2gjx h ARG 247 Ca 0.09 -0.16 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 2gjx h ARG 247 Cb 0.59 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 29.94 2gjx h ARG 247 CO 0.04 0.85 -0.11 -0.07 -1.51 0.00 0.00 179.97 179.17 2gjx h LEU 248 N 1.08 0.00 -1.05 3.80 3.38 -1.15 -0.27 115.31 121.11 2gjx h LEU 248 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2gjx h LEU 248 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2gjx h LEU 248 CO -0.04 0.11 -0.11 0.54 0.09 0.00 0.00 178.44 179.04 2gjx n ARG 249 N -3.74 1.56 -2.94 1.13 3.00 -0.66 -4.93 116.66 110.08 2gjx n ARG 249 Ca -0.02 -1.05 -0.10 0.00 -0.01 0.00 0.00 57.85 56.67 2gjx n ARG 249 Cb 0.21 -1.48 0.03 0.00 0.00 0.00 0.00 32.46 31.23 2gjx n ARG 249 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2gjx n GLY 250 N 1.27 0.33 3.32 -0.13 0.00 -0.11 -4.89 105.19 104.98 2gjx n GLY 250 Ca 0.15 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 2gjx n GLY 250 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gjx s ILE 251 N -3.12 2.78 0.41 -0.61 1.01 0.15 -4.70 121.20 117.11 2gjx s ILE 251 Ca 0.24 -0.75 -0.22 0.00 0.00 0.00 0.00 60.65 59.91 2gjx s ILE 251 Cb -0.11 -2.15 -0.10 0.00 0.01 0.00 0.00 42.46 40.11 2gjx s ILE 251 CO 0.30 0.53 0.98 -0.13 0.00 0.00 0.00 174.94 176.61 2gjx s ARG 252 N 0.46 4.23 -0.48 2.79 0.52 0.14 -3.79 118.95 122.82 2gjx s ARG 252 Ca -0.11 1.25 -0.04 0.00 -0.52 0.00 0.00 55.73 56.31 2gjx s ARG 252 Cb -0.16 -2.34 0.13 0.00 0.52 0.00 0.00 34.95 33.09 2gjx s ARG 252 CO 0.05 -0.04 0.29 0.08 0.02 0.00 0.00 175.30 175.70 2gjx s VAL 253 N -1.96 3.60 -0.41 3.52 1.01 -1.26 0.05 120.40 124.95 2gjx s VAL 253 Ca 0.60 -2.22 -0.24 0.00 0.00 0.00 0.00 61.98 60.12 2gjx s VAL 253 Cb -0.14 -3.41 0.02 0.00 0.00 0.00 0.00 36.38 32.84 2gjx s VAL 253 CO 0.18 -0.76 0.83 -0.22 0.00 0.00 0.00 175.10 175.14 2gjx s LEU 254 N 0.89 4.11 -0.01 3.92 2.96 -0.48 -4.69 118.68 125.38 2gjx s LEU 254 Ca 0.10 0.22 -0.16 0.00 -0.22 0.00 0.00 54.13 54.07 2gjx s LEU 254 Cb -0.23 -3.08 -0.06 0.00 0.50 0.00 0.00 46.19 43.33 2gjx s LEU 254 CO -0.03 -0.86 0.46 0.00 -1.32 0.00 0.00 176.35 174.59 2gjx s ALA 255 N 3.34 3.63 -0.19 5.97 0.00 -1.26 -0.71 121.76 132.54 2gjx s ALA 255 Ca 0.33 -0.16 -0.00 0.00 0.00 0.00 0.00 51.96 52.13 2gjx s ALA 255 Cb -0.12 -2.49 0.05 0.00 0.00 0.00 0.00 23.12 20.55 2gjx s ALA 255 CO 0.21 0.36 -0.05 -2.00 0.00 0.00 0.00 175.76 174.28 2gjx s GLU 256 N -0.73 1.43 -0.89 0.00 2.12 -0.55 -1.01 118.70 119.07 2gjx s GLU 256 Ca 0.25 -0.66 -0.01 0.00 0.36 0.00 0.00 54.97 54.92 2gjx s GLU 256 Cb -0.17 -2.21 0.25 0.00 0.26 0.00 0.00 34.13 32.26 2gjx s GLU 256 CO 0.14 -0.50 0.95 1.19 -0.54 0.00 0.00 175.26 176.50 2gjx n PHE 257 N 4.83 3.69 -1.57 5.30 3.72 -1.22 -3.36 117.46 128.85 2gjx n PHE 257 Ca -0.12 -3.78 -0.56 0.00 -0.05 0.00 0.00 57.45 52.94 2gjx n PHE 257 Cb 0.47 -1.06 -0.07 0.00 -0.94 0.00 0.00 39.48 37.88 2gjx n PHE 257 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2gjx n ASP 258 N 1.76 0.97 -3.75 4.37 2.03 -1.26 -4.78 116.55 115.88 2gjx n ASP 258 Ca 0.25 1.14 -0.13 0.00 0.52 0.00 0.00 54.79 56.56 2gjx n ASP 258 Cb 0.37 -1.06 -0.08 0.00 -0.72 0.00 0.00 41.12 39.63 2gjx n ASP 258 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2gjx s THR 259 N 0.59 0.06 -1.32 5.18 -4.23 -1.10 -4.67 115.64 110.16 2gjx s THR 259 Ca 0.89 -0.49 0.26 0.00 -1.18 0.00 0.00 61.69 61.17 2gjx s THR 259 Cb -1.12 -0.67 0.13 0.00 1.34 0.00 0.00 72.50 72.17 2gjx s THR 259 CO 0.54 -0.27 1.49 -0.81 -0.54 0.00 0.00 174.62 175.03 2gjx n PRO 260 N 1.16 0.36 -2.06 3.99 -0.04 -1.26 -1.81 135.00 135.34 2gjx n PRO 260 Ca -0.21 -0.20 -0.27 0.00 -0.04 0.00 0.00 63.50 62.77 2gjx n PRO 260 Cb 0.56 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.62 2gjx n PRO 260 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2gjx s GLY 261 N -2.79 1.66 -1.26 0.55 0.00 -1.26 -2.00 107.32 102.22 2gjx s GLY 261 Ca 0.17 -0.86 -0.04 0.00 0.00 0.00 0.00 44.72 43.99 2gjx s GLY 261 CO 0.62 -0.38 0.72 1.42 0.00 0.00 0.00 173.10 175.48 2gjx n HIS 262 N -3.18 -1.95 -2.28 1.90 8.25 -1.26 -4.84 115.22 111.86 2gjx n HIS 262 Ca 0.09 0.77 0.04 0.00 -0.26 0.00 0.00 57.72 58.37 2gjx n HIS 262 Cb 0.61 -4.18 0.06 0.00 1.12 0.00 0.00 29.99 27.60 2gjx n HIS 262 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2gjx n THR 263 N -4.16 0.51 0.20 1.59 -2.24 -1.26 -3.68 114.28 105.23 2gjx n THR 263 Ca -0.25 -1.50 0.04 0.00 -2.27 0.00 0.00 64.05 60.07 2gjx n THR 263 Cb 0.66 0.71 0.42 0.00 -2.10 0.00 0.00 70.33 70.02 2gjx n THR 263 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2gjx h LEU 264 N 0.98 0.00 0.00 3.22 3.38 -1.76 -2.36 115.31 118.77 2gjx h LEU 264 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2gjx h LEU 264 Cb 1.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.44 2gjx h LEU 264 CO 0.08 0.29 0.00 -1.54 0.09 0.00 0.00 178.44 177.36 2gjx n SER 265 N -4.19 0.00 0.08 -0.43 3.41 -0.83 -2.90 113.62 108.76 2gjx n SER 265 Ca -0.02 0.46 -0.11 0.00 -0.26 0.00 0.00 58.87 58.94 2gjx n SER 265 Cb 0.34 -0.49 -0.13 0.00 -0.26 0.00 0.00 64.21 63.67 2gjx n SER 265 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 2gjx h TRP 266 N 0.00 0.23 0.00 7.33 4.06 -1.71 -3.40 115.95 122.46 2gjx h TRP 266 Ca 0.00 -0.17 0.00 0.00 2.06 0.00 0.00 58.89 60.78 2gjx h TRP 266 Cb 0.44 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 28.59 2gjx h TRP 266 CO 0.00 1.14 0.00 0.41 -3.56 0.00 0.00 178.44 176.43 2gjx n GLY 267 N 1.45 -2.77 3.77 1.49 0.00 -1.14 -3.87 105.19 104.11 2gjx n GLY 267 Ca -0.05 0.54 -0.41 0.00 0.00 0.00 0.00 46.02 46.10 2gjx n GLY 267 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2gjx s PRO 268 N -2.51 4.30 0.00 1.61 0.04 -1.26 -3.30 135.00 133.87 2gjx s PRO 268 Ca 0.00 2.27 0.00 0.00 0.04 0.00 0.00 61.00 63.31 2gjx s PRO 268 Cb 0.00 -3.04 0.00 0.00 0.04 0.00 0.00 34.50 31.50 2gjx s PRO 268 CO 0.00 -0.25 0.00 0.41 0.04 0.00 0.00 177.00 177.20 2gjx n GLY 269 N 0.74 3.02 3.01 0.56 0.00 -1.26 -4.60 105.19 106.66 2gjx n GLY 269 Ca 0.00 -0.81 -0.33 0.00 0.00 0.00 0.00 46.02 44.89 2gjx n GLY 269 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2gjx s ILE 270 N 0.00 3.05 0.32 -0.61 1.10 -1.21 -4.76 121.20 119.09 2gjx s ILE 270 Ca 0.00 -3.16 -0.29 0.00 -0.51 0.00 0.00 60.65 56.69 2gjx s ILE 270 Cb 0.00 -3.06 -0.10 0.00 0.15 0.00 0.00 42.46 39.45 2gjx s ILE 270 CO 0.00 -0.83 1.37 -2.16 -2.11 0.00 0.00 174.94 171.21 2gjx s PRO 271 N -0.18 4.29 0.00 3.50 0.04 -1.26 -3.16 135.00 138.23 2gjx s PRO 271 Ca 0.17 2.30 0.00 0.00 0.04 0.00 0.00 61.00 63.50 2gjx s PRO 271 Cb -0.23 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.24 2gjx s PRO 271 CO -0.02 -0.30 0.00 0.41 0.04 0.00 0.00 177.00 177.14 2gjx n GLY 272 N 1.04 1.37 0.10 0.56 0.00 -1.26 -4.93 105.19 102.07 2gjx n GLY 272 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 2gjx n GLY 272 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2gjx h LEU 273 N 0.00 0.23-10.30 0.99 5.85 -1.86 -3.45 115.31 106.77 2gjx h LEU 273 Ca 0.00 -0.39 -0.50 0.00 0.84 0.00 0.00 57.88 57.83 2gjx h LEU 273 Cb 0.00 -0.06 0.04 0.00 0.37 0.00 0.00 40.66 41.01 2gjx h LEU 273 CO 0.00 0.57 0.36 -0.76 -0.34 0.00 0.00 178.44 178.27 2gjx s LEU 274 N -9.35 3.41 -0.35 2.25 1.43 -1.26 -0.23 118.68 114.58 2gjx s LEU 274 Ca -0.14 1.39 -0.23 0.00 -1.03 0.00 0.00 54.13 54.12 2gjx s LEU 274 Cb 0.05 -4.39 0.01 0.00 0.03 0.00 0.00 46.19 41.88 2gjx s LEU 274 CO 0.72 -0.74 0.75 -0.89 0.23 0.00 0.00 176.35 176.42 2gjx s THR 275 N -2.94 4.78 -0.21 5.49 2.01 -0.03 -4.54 115.64 120.20 2gjx s THR 275 Ca 0.55 0.88 -0.29 0.00 0.31 0.00 0.00 61.69 63.14 2gjx s THR 275 Cb -0.11 -4.16 -0.03 0.00 0.01 0.00 0.00 72.50 68.21 2gjx s THR 275 CO 0.46 -0.36 1.58 -2.16 -0.69 0.00 0.00 174.62 173.44 2gjx s PRO 276 N 2.98 3.85 0.64 4.92 0.04 -1.26 0.22 135.00 146.39 2gjx s PRO 276 Ca 0.30 1.67 -0.16 0.00 0.04 0.00 0.00 61.00 62.86 2gjx s PRO 276 Cb -0.14 -4.01 -0.01 0.00 0.04 0.00 0.00 34.50 30.39 2gjx s PRO 276 CO 0.15 -1.22 1.11 0.00 0.04 0.00 0.00 177.00 177.09 2gjx s TYR 278 N -2.25 2.16 -0.06 0.00 1.51 -1.26 -2.59 117.35 114.87 2gjx s TYR 278 Ca 0.68 -0.39 0.13 0.00 -1.01 0.00 0.00 57.07 56.48 2gjx s TYR 278 Cb -0.21 -1.15 -0.23 0.00 -0.11 0.00 0.00 41.96 40.26 2gjx s TYR 278 CO 0.39 0.33 0.63 -1.13 -1.11 0.00 0.00 175.55 174.67 2gjx n SER 279 N 0.83 0.82 0.00 2.29 3.41 -1.19 -4.88 113.62 114.89 2gjx n SER 279 Ca -0.17 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 58.82 2gjx n SER 279 Cb 0.54 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 2gjx n SER 279 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gjx n GLY 280 N 1.56 -0.28 0.53 5.00 0.00 -1.26 -5.01 105.19 105.74 2gjx n GLY 280 Ca -0.18 0.21 -0.11 0.00 0.00 0.00 0.00 46.02 45.95 2gjx n GLY 280 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2gjx n SER 281 N 0.00 1.28 -4.66 1.61 2.88 -1.26 -5.00 113.62 108.48 2gjx n SER 281 Ca 0.00 0.21 -0.26 0.00 -1.33 0.00 0.00 58.87 57.49 2gjx n SER 281 Cb 0.00 -0.49 -0.08 0.00 -0.75 0.00 0.00 64.21 62.89 2gjx n SER 281 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 2gjx s GLU 282 N -2.37 2.37 0.43 -1.46 -1.05 -1.26 -5.05 118.70 110.31 2gjx s GLU 282 Ca -0.19 -1.14 -0.25 0.00 -0.15 0.00 0.00 54.97 53.24 2gjx s GLU 282 Cb 0.05 -2.33 -0.08 0.00 -0.44 0.00 0.00 34.13 31.33 2gjx s GLU 282 CO 0.25 0.45 1.31 -1.25 0.95 0.00 0.00 175.26 176.96 2gjx s PRO 283 N -3.00 3.83 -0.45 -4.83 0.04 -1.26 -3.19 135.00 126.15 2gjx s PRO 283 Ca 0.28 2.16 0.05 0.00 0.04 0.00 0.00 61.00 63.52 2gjx s PRO 283 Cb -0.09 -2.66 0.42 0.00 0.04 0.00 0.00 34.50 32.21 2gjx s PRO 283 CO 0.18 -0.60 1.14 0.43 0.04 0.00 0.00 177.00 178.19 2gjx n SER 284 N -0.08 4.81 0.00 6.66 7.64 -1.07 -4.90 113.62 126.68 2gjx n SER 284 Ca 0.05 -3.72 0.00 0.00 1.01 0.00 0.00 58.87 56.20 2gjx n SER 284 Cb 0.44 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 2gjx n SER 284 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gjx n GLY 285 N -0.49 1.23 3.73 0.23 0.00 -1.26 -4.94 105.19 103.69 2gjx n GLY 285 Ca 0.40 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.98 2gjx n GLY 285 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gjx n THR 286 N 0.00 2.20 -4.18 2.61 -2.24 -1.26 -4.84 114.28 106.56 2gjx n THR 286 Ca 0.00 -0.50 -0.30 0.00 -2.27 0.00 0.00 64.05 60.98 2gjx n THR 286 Cb 0.00 -1.72 -0.09 0.00 -2.10 0.00 0.00 70.33 66.42 2gjx n THR 286 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2gjx s PHE 287 N -1.14 2.90 0.00 4.78 0.08 -1.26 -1.29 117.98 122.05 2gjx s PHE 287 Ca 0.57 -0.07 0.00 0.00 0.12 0.00 0.00 56.93 57.54 2gjx s PHE 287 Cb -0.51 -1.51 0.00 0.00 -0.57 0.00 0.00 43.02 40.43 2gjx s PHE 287 CO 0.61 0.45 0.00 0.41 -0.10 0.00 0.00 175.22 176.60 2gjx n GLY 288 N 0.69 3.63 3.39 4.36 0.00 0.13 -4.87 105.19 112.52 2gjx n GLY 288 Ca -0.12 -1.82 -0.30 0.00 0.00 0.00 0.00 46.02 43.78 2gjx n GLY 288 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2gjx s PRO 289 N 3.28 -2.43 0.26 1.61 0.02 -1.26 -4.05 135.00 132.43 2gjx s PRO 289 Ca 0.00 0.10 -0.30 0.00 0.02 0.00 0.00 61.00 60.82 2gjx s PRO 289 Cb 0.00 -1.44 -0.10 0.00 0.02 0.00 0.00 34.50 32.98 2gjx s PRO 289 CO 0.00 -4.54 1.49 0.08 -0.33 0.00 0.00 177.00 173.70 2gjx s VAL 290 N -2.49 2.46 -0.41 3.83 1.01 -0.85 -0.85 120.40 123.11 2gjx s VAL 290 Ca 0.69 0.39 -0.29 0.00 0.00 0.00 0.00 61.98 62.77 2gjx s VAL 290 Cb -0.12 -3.25 0.01 0.00 0.00 0.00 0.00 36.38 33.02 2gjx s VAL 290 CO 0.58 0.06 1.40 0.21 0.00 0.00 0.00 175.10 177.35 2gjx s ASN 291 N 0.41 6.36 0.00 3.32 3.84 0.67 -4.72 114.94 124.82 2gjx s ASN 291 Ca 0.61 0.85 0.13 0.00 0.21 0.00 0.00 52.86 54.65 2gjx s ASN 291 Cb -0.44 -2.54 0.37 0.00 -0.55 0.00 0.00 41.25 38.09 2gjx s ASN 291 CO 0.45 -1.41 1.31 -0.81 -2.79 0.00 0.00 177.10 173.85 2gjx n PRO 292 N 8.03 1.96 -0.18 0.43 -0.04 -1.26 -3.96 135.00 139.98 2gjx n PRO 292 Ca 0.16 -1.49 0.09 0.00 -0.04 0.00 0.00 63.50 62.21 2gjx n PRO 292 Cb 0.48 -1.32 0.18 0.00 -0.04 0.00 0.00 33.50 32.79 2gjx n PRO 292 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2gjx n SER 293 N 0.72 3.08 -4.42 3.54 3.41 -1.26 -4.94 113.62 113.75 2gjx n SER 293 Ca 0.14 -1.90 -0.32 0.00 -0.26 0.00 0.00 58.87 56.53 2gjx n SER 293 Cb 0.35 -0.23 -0.14 0.00 -0.26 0.00 0.00 64.21 63.93 2gjx n SER 293 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2gjx s LEU 294 N -1.14 2.48 0.23 1.04 1.43 -1.25 -5.01 118.68 116.46 2gjx s LEU 294 Ca 0.30 -0.31 -0.06 0.00 -1.03 0.00 0.00 54.13 53.03 2gjx s LEU 294 Cb 0.17 -1.48 0.23 0.00 0.03 0.00 0.00 46.19 45.14 2gjx s LEU 294 CO 0.23 0.33 1.79 -1.13 0.23 0.00 0.00 176.35 177.81 2gjx h ASN 295 N 5.33 1.02 -0.98 2.29 -0.73 -1.93 -2.78 115.58 117.80 2gjx h ASN 295 Ca -0.45 -0.16 0.19 0.00 1.87 0.00 0.00 56.30 57.75 2gjx h ASN 295 Cb 1.14 -0.26 -0.09 0.00 0.27 0.00 0.00 38.32 39.37 2gjx h ASN 295 CO 0.49 0.92 0.61 -1.13 -0.37 0.00 0.00 177.43 177.95 2gjx h ASN 296 N 1.07 0.68 -0.17 1.15 -0.73 -1.97 -2.55 115.58 113.07 2gjx h ASN 296 Ca 0.24 0.08 -0.01 0.00 1.87 0.00 0.00 56.30 58.49 2gjx h ASN 296 Cb 0.23 -0.04 -0.01 0.00 0.27 0.00 0.00 38.32 38.77 2gjx h ASN 296 CO -0.02 0.25 0.07 0.74 -0.37 0.00 0.00 177.43 178.11 2gjx h THR 297 N 0.67 1.14 0.00 -3.57 2.02 -1.78 -2.31 112.91 109.08 2gjx h THR 297 Ca 0.55 -0.43 -0.10 0.00 0.77 0.00 0.00 66.41 67.20 2gjx h THR 297 Cb 0.98 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 68.49 2gjx h THR 297 CO -0.32 0.14 -0.49 1.88 0.37 0.00 0.00 175.52 177.10 2gjx h TYR 298 N 0.13 0.00 0.00 3.16 0.05 -1.55 -1.46 116.97 117.31 2gjx h TYR 298 Ca 0.06 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.76 2gjx h TYR 298 Cb 0.15 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.88 2gjx h TYR 298 CO -0.02 0.49 -0.36 0.93 -1.05 0.00 0.00 178.16 178.15 2gjx h GLU 299 N 0.00 0.00 -0.03 4.88 3.07 -1.47 -2.27 114.58 118.76 2gjx h GLU 299 Ca -0.00 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.78 2gjx h GLU 299 Cb 1.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.92 2gjx h GLU 299 CO 0.06 0.36 -0.26 0.35 -1.40 0.00 0.00 179.01 178.12 2gjx h PHE 300 N 0.00 0.32 -0.49 4.33 3.57 -0.98 -2.95 116.94 120.74 2gjx h PHE 300 Ca -0.00 -0.15 -0.06 0.00 3.53 0.00 0.00 57.97 61.29 2gjx h PHE 300 Cb 1.12 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.79 2gjx h PHE 300 CO 0.00 0.91 0.08 0.52 -2.23 0.00 0.00 178.31 177.58 2gjx h MET 301 N -0.36 0.77 -0.63 1.11 2.86 -1.31 0.70 114.93 118.07 2gjx h MET 301 Ca -0.02 -0.17 -0.06 0.00 -2.06 0.00 0.00 59.70 57.38 2gjx h MET 301 Cb 0.96 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.48 2gjx h MET 301 CO 0.05 0.73 0.14 1.03 1.06 0.00 0.00 176.91 179.92 2gjx h SER 302 N 0.73 0.96 -0.05 1.22 0.87 -1.49 -0.78 113.55 115.02 2gjx h SER 302 Ca 0.16 -0.24 -0.19 0.00 -1.23 0.00 0.00 61.79 60.29 2gjx h SER 302 Cb 0.34 -0.25 0.01 0.00 -0.44 0.00 0.00 62.40 62.06 2gjx h SER 302 CO 0.01 0.95 -0.72 0.74 -0.53 0.00 0.00 176.83 177.28 2gjx h THR 303 N 0.93 1.35 0.01 2.23 2.02 -1.30 -3.08 112.91 115.07 2gjx h THR 303 Ca 0.20 -2.04 -0.00 0.00 0.77 0.00 0.00 66.41 65.33 2gjx h THR 303 Cb 0.37 2.36 0.00 0.00 -1.74 0.00 0.00 68.15 69.14 2gjx h THR 303 CO 0.00 0.62 -0.01 0.15 0.37 0.00 0.00 175.52 176.65 2gjx h PHE 304 N 0.17 -0.02 0.00 3.16 3.57 -0.82 -3.04 116.94 119.96 2gjx h PHE 304 Ca -0.08 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.42 2gjx h PHE 304 Cb 1.38 0.01 0.00 0.00 2.79 0.00 0.00 35.95 40.13 2gjx h PHE 304 CO 0.12 0.33 0.00 1.19 -2.23 0.00 0.00 178.31 177.72 2gjx n PHE 305 N -4.93 0.12 -0.05 0.41 3.72 -0.30 -1.77 117.46 114.65 2gjx n PHE 305 Ca -0.08 0.05 -0.15 0.00 -0.05 0.00 0.00 57.45 57.22 2gjx n PHE 305 Cb 0.19 -0.57 -0.07 0.00 -0.94 0.00 0.00 39.48 38.09 2gjx n PHE 305 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2gjx h LEU 306 N 0.00 0.65 -0.22 4.37 6.46 -1.43 -1.76 115.31 123.37 2gjx h LEU 306 Ca 0.00 -0.57 -0.01 0.00 -0.12 0.00 0.00 57.88 57.18 2gjx h LEU 306 Cb 0.29 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.02 2gjx h LEU 306 CO 0.00 1.10 0.08 -0.08 -0.62 0.00 0.00 178.44 178.92 2gjx h GLU 307 N 0.22 0.33 -0.57 1.25 4.81 -1.31 -2.19 114.58 117.13 2gjx h GLU 307 Ca -0.00 -0.07 0.07 0.00 -0.13 0.00 0.00 59.36 59.23 2gjx h GLU 307 Cb 1.01 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 30.28 2gjx h GLU 307 CO 0.09 0.40 0.26 0.28 -0.73 0.00 0.00 179.01 179.31 2gjx h VAL 308 N 0.19 0.88 0.00 0.32 2.07 -1.41 0.27 116.25 118.56 2gjx h VAL 308 Ca 0.07 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 2gjx h VAL 308 Cb 0.20 0.36 -0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2gjx h VAL 308 CO -0.00 0.09 -0.00 0.77 0.02 0.00 0.00 177.57 178.44 2gjx h SER 309 N 0.48 0.00 0.26 0.57 4.64 -1.23 -1.46 113.55 116.81 2gjx h SER 309 Ca 0.27 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.25 2gjx h SER 309 Cb 0.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 2gjx h SER 309 CO -0.22 0.00 -1.79 0.28 -0.87 0.00 0.00 176.83 174.23 2gjx h SER 310 N 0.00 0.43 -0.09 4.97 0.02 -0.42 -3.38 113.55 115.08 2gjx h SER 310 Ca -0.00 -0.75 -0.21 0.00 -0.84 0.00 0.00 61.79 59.99 2gjx h SER 310 Cb 0.49 -0.14 0.01 0.00 0.14 0.00 0.00 62.40 62.90 2gjx h SER 310 CO 0.00 1.65 -0.77 0.58 -1.14 0.00 0.00 176.83 177.15 2gjx h VAL 311 N 0.07 1.31 -3.58 2.27 2.07 -0.41 -3.42 116.25 114.57 2gjx h VAL 311 Ca -0.34 -2.02 -0.70 0.00 0.82 0.00 0.00 66.70 64.45 2gjx h VAL 311 Cb 2.05 2.20 -0.20 0.00 -1.52 0.00 0.00 31.29 33.82 2gjx h VAL 311 CO 0.13 0.63 -0.41 -0.36 0.02 0.00 0.00 177.57 177.57 2gjx s PHE 312 N -3.56 3.23 0.09 1.57 0.08 -0.56 -4.96 117.98 113.86 2gjx s PHE 312 Ca -0.11 -0.42 0.26 0.00 0.12 0.00 0.00 56.93 56.77 2gjx s PHE 312 Cb 0.07 -2.59 0.96 0.00 -0.57 0.00 0.00 43.02 40.89 2gjx s PHE 312 CO 0.88 -0.52 1.84 -1.00 -0.10 0.00 0.00 175.22 176.32 2gjx h PRO 313 N 8.59 0.00 -6.77 0.24 0.13 -1.82 -3.43 132.00 128.94 2gjx h PRO 313 Ca -0.28 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.27 2gjx h PRO 313 Cb 1.13 0.00 0.14 0.00 0.13 0.00 0.00 31.00 32.41 2gjx h PRO 313 CO 0.71 0.17 0.22 -3.47 -0.23 0.00 0.00 178.00 175.39 2gjx n ASP 314 N -3.31 1.31 0.13 1.44 2.03 -1.26 -4.89 116.55 112.00 2gjx n ASP 314 Ca 0.00 0.94 0.02 0.00 0.52 0.00 0.00 54.79 56.28 2gjx n ASP 314 Cb 0.42 -1.40 0.36 0.00 -0.72 0.00 0.00 41.12 39.78 2gjx n ASP 314 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 2gjx h PHE 315 N 1.17 0.22 -3.05 -0.67 3.04 -1.92 -3.44 116.94 112.28 2gjx h PHE 315 Ca -0.47 -0.03 -0.63 0.00 3.98 0.00 0.00 57.97 60.82 2gjx h PHE 315 Cb 1.34 -0.06 -0.07 0.00 2.56 0.00 0.00 35.95 39.72 2gjx h PHE 315 CO 0.41 0.40 -0.56 0.71 -2.02 0.00 0.00 178.31 177.26 2gjx s TYR 316 N -4.57 3.30 0.00 0.41 1.51 -1.26 0.15 117.35 116.90 2gjx s TYR 316 Ca -0.05 0.13 0.02 0.00 -1.01 0.00 0.00 57.07 56.16 2gjx s TYR 316 Cb 0.15 -1.66 -0.01 0.00 -0.11 0.00 0.00 41.96 40.33 2gjx s TYR 316 CO 0.74 0.54 -0.08 -0.51 -1.11 0.00 0.00 175.55 175.13 2gjx s LEU 317 N -2.49 2.05 -0.16 -1.29 1.43 -0.60 -4.62 118.68 113.01 2gjx s LEU 317 Ca 0.31 -0.20 -0.18 0.00 -1.03 0.00 0.00 54.13 53.03 2gjx s LEU 317 Cb -0.12 -0.38 -0.04 0.00 0.03 0.00 0.00 46.19 45.68 2gjx s LEU 317 CO 0.24 0.06 0.49 -2.28 0.23 0.00 0.00 176.35 175.10 2gjx s HIS 318 N -0.34 3.45 -2.18 0.29 5.65 -0.18 -0.60 115.29 121.38 2gjx s HIS 318 Ca 0.02 0.83 0.18 0.00 0.25 0.00 0.00 55.06 56.34 2gjx s HIS 318 Cb -0.04 -2.60 0.17 0.00 -1.18 0.00 0.00 32.58 28.92 2gjx s HIS 318 CO -0.00 0.04 1.09 1.28 -0.65 0.00 0.00 174.74 176.50 2gjx n LEU 319 N 4.19 2.56 0.00 8.88 4.77 -0.61 -3.46 117.00 133.33 2gjx n LEU 319 Ca -0.06 -1.07 0.00 0.00 -0.03 0.00 0.00 56.01 54.85 2gjx n LEU 319 Cb 0.51 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2gjx n LEU 319 CO 0.42 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.56 2gjx n GLY 320 N 1.01 2.12 0.95 -0.72 0.00 -1.26 -2.70 105.19 104.60 2gjx n GLY 320 Ca 0.11 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2gjx n GLY 320 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gjx n GLY 321 N 0.00 0.72 3.95 -0.02 0.00 -0.75 -2.40 105.19 106.69 2gjx n GLY 321 Ca 0.00 -0.40 -0.23 0.00 0.00 0.00 0.00 46.02 45.40 2gjx n GLY 321 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2gjx s ASP 322 N -2.36 6.26 -1.38 1.61 -4.77 -1.26 -4.32 116.67 110.44 2gjx s ASP 322 Ca 0.00 0.28 -0.08 0.00 -3.30 0.00 0.00 52.55 49.45 2gjx s ASP 322 Cb 0.00 -1.90 0.01 0.00 -1.09 0.00 0.00 42.92 39.94 2gjx s ASP 322 CO 0.00 -0.25 0.14 -0.62 0.70 0.00 0.00 175.17 175.14 2gjx n GLU 323 N -1.67 -0.78 -3.05 2.11 1.02 -1.26 -4.59 120.64 112.42 2gjx n GLU 323 Ca -0.06 0.07 -0.41 0.00 -0.02 0.00 0.00 57.16 56.74 2gjx n GLU 323 Cb 0.57 -3.10 -0.06 0.00 -0.02 0.00 0.00 31.44 28.83 2gjx n GLU 323 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2gjx s VAL 324 N -4.15 4.89 -0.17 2.62 1.01 -1.26 -4.71 120.40 118.63 2gjx s VAL 324 Ca 0.11 1.02 -0.20 0.00 0.00 0.00 0.00 61.98 62.91 2gjx s VAL 324 Cb -0.06 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 2gjx s VAL 324 CO 0.93 -0.16 0.56 -0.62 0.00 0.00 0.00 175.10 175.81 2gjx s ASP 325 N 1.61 6.66 0.00 3.32 2.15 -1.26 -4.95 116.67 124.21 2gjx s ASP 325 Ca 0.28 0.80 0.28 0.00 0.43 0.00 0.00 52.55 54.34 2gjx s ASP 325 Cb -0.15 -2.32 1.02 0.00 -0.30 0.00 0.00 42.92 41.18 2gjx s ASP 325 CO 0.12 -0.16 1.73 0.49 -0.17 0.00 0.00 175.17 177.17 2gjx n PHE 326 N 4.54 0.00 0.06 -5.34 3.72 -1.26 -4.28 117.46 114.90 2gjx n PHE 326 Ca -0.04 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.24 2gjx n PHE 326 Cb 0.51 -0.08 -0.07 0.00 -0.94 0.00 0.00 39.48 38.89 2gjx n PHE 326 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 2gjx h THR 327 N 1.46 0.98 -0.47 4.37 2.02 -2.00 -2.39 112.91 116.88 2gjx h THR 327 Ca 0.00 -0.11 -0.08 0.00 0.77 0.00 0.00 66.41 66.99 2gjx h THR 327 Cb 0.45 1.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.89 2gjx h THR 327 CO 0.00 0.03 -0.04 0.00 0.37 0.00 0.00 175.52 175.88 2gjx h TRP 329 N 0.74 0.51 -0.75 0.00 6.55 -1.78 -3.02 115.95 118.19 2gjx h TRP 329 Ca 0.14 -0.04 -0.04 0.00 0.95 0.00 0.00 58.89 59.90 2gjx h TRP 329 Cb 0.50 -0.15 -0.03 0.00 -0.86 0.00 0.00 29.16 28.62 2gjx h TRP 329 CO 0.03 0.49 0.32 -0.22 -1.05 0.00 0.00 178.44 178.00 2gjx h LYS 330 N 0.38 1.10 0.00 0.49 3.64 -1.26 -2.48 116.57 118.44 2gjx h LYS 330 Ca 0.11 -0.18 -0.05 0.00 -1.27 0.00 0.00 60.65 59.26 2gjx h LYS 330 Cb 0.20 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2gjx h LYS 330 CO -0.01 0.88 -0.24 0.66 -2.27 0.00 0.00 179.45 178.47 2gjx h SER 331 N 1.08 0.00 -3.04 4.20 4.64 -1.44 -3.43 113.55 115.57 2gjx h SER 331 Ca 0.25 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.00 2gjx h SER 331 Cb 0.18 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.22 2gjx h SER 331 CO -0.02 0.24 0.81 0.21 -0.87 0.00 0.00 176.83 177.19 2gjx s ASN 332 N -6.61 7.05 0.18 4.97 3.84 -0.94 -4.54 114.94 118.90 2gjx s ASN 332 Ca -0.03 1.54 -0.08 0.00 0.21 0.00 0.00 52.86 54.50 2gjx s ASN 332 Cb 0.14 -2.54 0.07 0.00 -0.55 0.00 0.00 41.25 38.36 2gjx s ASN 332 CO 0.66 -0.67 1.58 -0.65 -2.79 0.00 0.00 177.10 175.23 2gjx h PRO 333 N 7.68 0.93 -0.21 0.43 0.11 -1.85 -1.91 132.00 137.17 2gjx h PRO 333 Ca -0.24 -0.39 -0.04 0.00 0.11 0.00 0.00 66.00 65.44 2gjx h PRO 333 Cb 1.09 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 2gjx h PRO 333 CO 0.96 1.05 -0.04 1.49 -0.21 0.00 0.00 178.00 181.24 2gjx h GLU 334 N 0.80 0.32 0.03 1.05 4.22 -1.94 -1.97 114.58 117.09 2gjx h GLU 334 Ca 0.11 -0.06 -0.24 0.00 0.08 0.00 0.00 59.36 59.25 2gjx h GLU 334 Cb 0.78 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.95 2gjx h GLU 334 CO 0.06 0.39 -1.18 0.82 -2.18 0.00 0.00 179.01 176.92 2gjx h ILE 335 N 0.31 1.52 -0.71 2.32 2.04 -1.82 -3.16 117.51 118.01 2gjx h ILE 335 Ca 0.07 -3.22 0.01 0.00 1.00 0.00 0.00 64.86 62.71 2gjx h ILE 335 Cb 0.29 2.79 -0.03 0.00 -0.74 0.00 0.00 36.82 39.12 2gjx h ILE 335 CO 0.01 0.88 0.46 1.56 0.00 0.00 0.00 178.15 181.07 2gjx h GLN 336 N 0.02 0.94 -0.30 2.37 1.08 -0.82 -1.95 115.11 116.44 2gjx h GLN 336 Ca -0.09 -0.06 -0.10 0.00 -1.45 0.00 0.00 58.65 56.95 2gjx h GLN 336 Cb 1.85 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 29.06 2gjx h GLN 336 CO 0.14 0.62 -0.23 0.22 -0.95 0.00 0.00 178.83 178.63 2gjx h ASP 337 N 0.96 0.58 -0.80 1.46 3.58 -1.39 -3.16 116.42 117.65 2gjx h ASP 337 Ca 0.26 -0.20 -0.04 0.00 0.42 0.00 0.00 57.03 57.48 2gjx h ASP 337 Cb -0.10 -0.16 -0.04 0.00 1.72 0.00 0.00 39.33 40.75 2gjx h ASP 337 CO -0.05 0.80 0.36 0.15 -2.88 0.00 0.00 179.24 177.62 2gjx h PHE 338 N 0.51 1.18 0.00 0.28 3.57 -1.32 -2.71 116.94 118.46 2gjx h PHE 338 Ca 0.08 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2gjx h PHE 338 Cb 0.67 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 39.05 2gjx h PHE 338 CO 0.03 0.87 0.00 0.52 -2.23 0.00 0.00 178.31 177.50 2gjx h MET 339 N 1.16 0.00 0.00 1.11 2.86 -1.49 -2.74 114.93 115.83 2gjx h MET 339 Ca 0.27 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.88 2gjx h MET 339 Cb 0.16 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 2gjx h MET 339 CO -0.03 0.00 -0.56 0.00 1.06 0.00 0.00 176.91 177.38 2gjx h ARG 340 N 0.00 0.00 0.16 1.72 3.08 -1.53 0.98 114.38 118.79 2gjx h ARG 340 Ca 0.00 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.83 2gjx h ARG 340 Cb 0.59 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.66 2gjx h ARG 340 CO 0.00 0.11 -1.00 0.87 -1.07 0.00 0.00 179.97 178.88 2gjx h LYS 341 N 0.00 0.34 0.00 0.04 1.79 -1.40 -3.31 116.57 114.04 2gjx h LYS 341 Ca -0.02 -0.59 0.00 0.00 -2.18 0.00 0.00 60.65 57.86 2gjx h LYS 341 Cb 1.13 0.22 0.00 0.00 -1.58 0.00 0.00 32.23 32.00 2gjx h LYS 341 CO 0.02 1.28 -0.14 0.87 -1.08 0.00 0.00 179.45 180.40 2gjx h LYS 342 N -0.26 0.00 -2.14 3.15 1.79 -1.62 -3.48 116.57 114.01 2gjx h LYS 342 Ca -0.18 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.24 2gjx h LYS 342 Cb 1.76 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 32.43 2gjx h LYS 342 CO 0.17 0.00 -0.10 0.41 -1.08 0.00 0.00 179.45 178.85 2gjx n GLY 343 N 1.24 0.51 0.13 3.86 0.00 -0.74 -5.00 105.19 105.19 2gjx n GLY 343 Ca 0.04 -0.46 -0.22 0.00 0.00 0.00 0.00 46.02 45.38 2gjx n GLY 343 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2gjx n PHE 344 N -2.03 1.01 0.00 1.61 3.72 0.26 -5.03 117.46 117.00 2gjx n PHE 344 Ca -0.02 0.28 0.00 0.00 -0.05 0.00 0.00 57.45 57.66 2gjx n PHE 344 Cb 0.52 -1.12 0.00 0.00 -0.94 0.00 0.00 39.48 37.93 2gjx n PHE 344 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2gjx n GLY 345 N 1.80 0.97 0.00 1.37 0.00 -1.21 -4.40 105.19 103.72 2gjx n GLY 345 Ca -0.35 -1.27 0.09 0.00 0.00 0.00 0.00 46.02 44.49 2gjx n GLY 345 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2gjx n GLU 346 N 0.44 0.73 -3.15 1.61 -0.58 -1.26 -4.86 120.64 113.56 2gjx n GLU 346 Ca 0.00 -0.05 -0.40 0.00 -0.42 0.00 0.00 57.16 56.29 2gjx n GLU 346 Cb 0.00 -1.41 -0.06 0.00 -0.57 0.00 0.00 31.44 29.40 2gjx n GLU 346 CO 0.00 0.00 0.00 0.16 -0.48 0.00 0.00 177.13 176.81 2gjx s ASP 347 N -3.21 6.71 0.00 1.62 3.84 -1.26 -4.93 116.67 119.44 2gjx s ASP 347 Ca 0.03 0.85 0.26 0.00 -0.00 0.00 0.00 52.55 53.70 2gjx s ASP 347 Cb 0.14 -2.34 0.73 0.00 -1.38 0.00 0.00 42.92 40.06 2gjx s ASP 347 CO 0.78 -0.20 1.55 0.49 -0.00 0.00 0.00 175.17 177.79 2gjx n PHE 348 N 4.65 0.00 -0.03 2.11 3.72 -1.26 -3.95 117.46 122.70 2gjx n PHE 348 Ca -0.03 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.33 2gjx n PHE 348 Cb 0.50 -0.06 0.17 0.00 -0.94 0.00 0.00 39.48 39.15 2gjx n PHE 348 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2gjx h LYS 349 N 2.01 0.60 0.00 -1.08 1.57 -1.91 0.46 116.57 118.21 2gjx h LYS 349 Ca 0.00 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 2gjx h LYS 349 Cb 0.57 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.84 2gjx h LYS 349 CO 0.00 0.77 -0.67 0.00 -0.57 0.00 0.00 179.45 178.98 2gjx n GLN 350 N -4.13 0.20 -0.03 3.15 10.64 -1.25 -2.14 117.38 123.81 2gjx n GLN 350 Ca 0.00 0.04 -0.17 0.00 -1.83 0.00 0.00 57.00 55.04 2gjx n GLN 350 Cb 0.40 -1.61 -0.07 0.00 -0.86 0.00 0.00 30.24 28.10 2gjx n GLN 350 CO 0.00 0.00 0.00 1.25 -1.83 0.00 0.00 177.06 176.48 2gjx h LEU 351 N 0.00 0.95 -0.78 2.61 5.85 -1.59 -2.16 115.31 120.19 2gjx h LEU 351 Ca 0.00 -0.61 -0.08 0.00 0.84 0.00 0.00 57.88 58.03 2gjx h LEU 351 Cb 0.67 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 2gjx h LEU 351 CO 0.00 1.41 0.05 -0.08 -0.34 0.00 0.00 178.44 179.47 2gjx h GLU 352 N 0.56 0.97 -0.86 1.25 4.81 -0.94 -2.73 114.58 117.64 2gjx h GLU 352 Ca -0.04 -0.27 0.04 0.00 -0.13 0.00 0.00 59.36 58.96 2gjx h GLU 352 Cb 1.36 -0.11 -0.05 0.00 0.63 0.00 0.00 28.75 30.58 2gjx h GLU 352 CO 0.15 0.92 0.55 1.03 -0.73 0.00 0.00 179.01 180.94 2gjx h SER 353 N 0.90 0.91 -0.93 1.04 0.87 -1.32 -1.16 113.55 113.86 2gjx h SER 353 Ca 0.17 -0.00 0.06 0.00 -1.23 0.00 0.00 61.79 60.79 2gjx h SER 353 Cb 0.46 -0.20 -0.06 0.00 -0.44 0.00 0.00 62.40 62.16 2gjx h SER 353 CO 0.02 0.62 0.59 0.15 -0.53 0.00 0.00 176.83 177.68 2gjx h PHE 354 N 1.06 1.09 -0.06 2.24 3.57 -1.08 0.30 116.94 124.07 2gjx h PHE 354 Ca 0.35 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.86 2gjx h PHE 354 Cb 0.03 -0.36 -0.00 0.00 2.79 0.00 0.00 35.95 38.41 2gjx h PHE 354 CO -0.02 0.56 -0.03 -0.92 -2.23 0.00 0.00 178.31 175.67 2gjx h TYR 355 N 1.07 0.14 -0.45 0.41 3.20 -1.23 -2.90 116.97 117.22 2gjx h TYR 355 Ca 0.40 -0.04 -0.09 0.00 3.14 0.00 0.00 58.73 62.14 2gjx h TYR 355 Cb 0.16 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 2gjx h TYR 355 CO -0.02 0.53 -0.09 0.82 -1.64 0.00 0.00 178.16 177.76 2gjx h ILE 356 N -0.28 1.27 0.02 1.81 2.04 -0.92 -0.85 117.51 120.60 2gjx h ILE 356 Ca 0.01 -1.20 0.03 0.00 1.00 0.00 0.00 64.86 64.70 2gjx h ILE 356 Cb 0.49 1.13 -0.05 0.00 -0.74 0.00 0.00 36.82 37.66 2gjx h ILE 356 CO 0.01 0.41 -0.28 1.56 0.00 0.00 0.00 178.15 179.85 2gjx h GLN 357 N 0.69 -0.42 -0.50 2.37 4.20 -0.49 0.60 115.11 121.55 2gjx h GLN 357 Ca 0.12 0.03 0.05 0.00 0.06 0.00 0.00 58.65 58.90 2gjx h GLN 357 Cb 0.63 0.10 -0.04 0.00 0.30 0.00 0.00 27.48 28.46 2gjx h GLN 357 CO 0.04 -0.28 0.25 1.15 -0.67 0.00 0.00 178.83 179.32 2gjx h THR 358 N -0.44 0.95 -0.94 -0.54 2.02 -1.45 -1.60 112.91 110.91 2gjx h THR 358 Ca 0.06 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 67.06 2gjx h THR 358 Cb 0.51 0.42 -0.05 0.00 -1.74 0.00 0.00 68.15 67.30 2gjx h THR 358 CO -0.23 0.09 0.56 0.25 0.37 0.00 0.00 175.52 176.56 2gjx h LEU 359 N 0.49 1.14 -0.59 2.58 5.85 -0.33 -1.63 115.31 122.80 2gjx h LEU 359 Ca 0.22 -0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.80 2gjx h LEU 359 Cb 0.14 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 2gjx h LEU 359 CO -0.16 0.88 0.10 -0.07 -0.34 0.00 0.00 178.44 178.84 2gjx h LEU 360 N 1.30 0.95 -0.56 2.25 3.38 0.73 -2.07 115.31 121.28 2gjx h LEU 360 Ca 0.34 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2gjx h LEU 360 Cb -0.05 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.43 2gjx h LEU 360 CO -0.06 0.97 0.30 0.44 0.09 0.00 0.00 178.44 180.17 2gjx h ASP 361 N 0.89 0.71 0.08 -0.43 3.32 -0.79 0.45 116.42 120.64 2gjx h ASP 361 Ca 0.18 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 2gjx h ASP 361 Cb 0.42 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 2gjx h ASP 361 CO 0.01 0.61 -0.06 0.40 -1.72 0.00 0.00 179.24 178.48 2gjx h ILE 362 N 0.76 0.87 -0.18 0.35 2.04 -1.18 -0.38 117.51 119.79 2gjx h ILE 362 Ca 0.20 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.95 2gjx h ILE 362 Cb 0.06 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 2gjx h ILE 362 CO -0.03 0.00 -0.33 0.58 0.00 0.00 0.00 178.15 178.37 2gjx h VAL 363 N -0.14 1.28 0.00 1.67 2.07 -1.19 -2.88 116.25 117.07 2gjx h VAL 363 Ca -0.00 -1.38 -0.10 0.00 0.82 0.00 0.00 66.70 66.04 2gjx h VAL 363 Cb 0.12 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 2gjx h VAL 363 CO -0.00 0.42 -0.46 -1.28 0.02 0.00 0.00 177.57 176.27 2gjx h SER 364 N 0.32 0.00 0.94 0.57 0.87 0.17 -2.76 113.55 113.66 2gjx h SER 364 Ca 0.04 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 2gjx h SER 364 Cb 0.74 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.70 2gjx h SER 364 CO 0.06 0.46 0.00 -1.54 -0.53 0.00 0.00 176.83 175.28 2gjx n SER 365 N -3.82 0.73 -1.04 6.23 3.41 -0.18 -2.06 113.62 116.89 2gjx n SER 365 Ca -0.01 0.65 0.09 0.00 -0.26 0.00 0.00 58.87 59.33 2gjx n SER 365 Cb 0.51 -0.81 0.25 0.00 -0.26 0.00 0.00 64.21 63.90 2gjx n SER 365 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2gjx n TYR 366 N -2.27 0.75 -2.66 7.33 0.53 -1.05 -4.92 117.16 114.87 2gjx n TYR 366 Ca 0.03 -0.38 -0.11 0.00 -1.02 0.00 0.00 57.90 56.42 2gjx n TYR 366 Cb 0.29 0.00 0.02 0.00 -1.03 0.00 0.00 39.34 38.61 2gjx n TYR 366 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2gjx n GLY 367 N 1.40 0.09 3.40 2.72 0.00 -0.87 -5.03 105.19 106.90 2gjx n GLY 367 Ca 0.19 -0.32 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 2gjx n GLY 367 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gjx s LYS 368 N -5.14 2.99 0.89 1.61 -0.14 -1.14 -4.96 119.74 113.85 2gjx s LYS 368 Ca 0.16 -0.71 -0.13 0.00 -1.36 0.00 0.00 55.97 53.93 2gjx s LYS 368 Cb -0.07 -2.50 0.16 0.00 -1.68 0.00 0.00 37.83 33.74 2gjx s LYS 368 CO 0.20 0.38 1.24 0.20 -0.76 0.00 0.00 175.35 176.61 2gjx s GLY 369 N -0.10 1.74 -0.16 -3.33 0.00 0.41 -4.16 107.32 101.72 2gjx s GLY 369 Ca -0.02 -1.15 -0.18 0.00 0.00 0.00 0.00 44.72 43.37 2gjx s GLY 369 CO 0.04 -0.48 0.50 -2.52 0.00 0.00 0.00 173.10 170.64 2gjx s TYR 370 N -3.71 -0.52 0.01 1.90 1.13 -1.26 -1.55 117.35 113.34 2gjx s TYR 370 Ca 0.70 1.22 0.03 0.00 -1.41 0.00 0.00 57.07 57.62 2gjx s TYR 370 Cb -0.06 0.20 -0.03 0.00 -1.10 0.00 0.00 41.96 40.97 2gjx s TYR 370 CO 0.51 -0.30 -0.07 0.08 -2.51 0.00 0.00 175.55 173.26 2gjx s VAL 371 N -0.00 3.65 0.02 -3.49 1.01 0.23 -2.82 120.40 119.00 2gjx s VAL 371 Ca -0.02 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 61.11 2gjx s VAL 371 Cb -0.03 -2.59 -0.01 0.00 0.00 0.00 0.00 36.38 33.75 2gjx s VAL 371 CO 0.02 0.38 0.09 0.54 0.00 0.00 0.00 175.10 176.13 2gjx s VAL 372 N -1.01 0.11 1.07 2.92 0.11 -0.44 -1.57 120.40 121.59 2gjx s VAL 372 Ca 0.17 -0.88 -0.13 0.00 -2.93 0.00 0.00 61.98 58.22 2gjx s VAL 372 Cb -0.11 -0.58 0.23 0.00 -1.53 0.00 0.00 36.38 34.39 2gjx s VAL 372 CO 0.08 -0.49 1.07 0.26 -3.33 0.00 0.00 175.10 172.69 2gjx s TRP 373 N -1.86 1.81 0.16 1.54 0.52 -1.01 -0.81 118.94 119.28 2gjx s TRP 373 Ca -0.11 1.01 0.33 0.00 0.02 0.00 0.00 56.10 57.35 2gjx s TRP 373 Cb -0.06 -3.21 1.39 0.00 -1.15 0.00 0.00 33.47 30.44 2gjx s TRP 373 CO -0.01 -3.31 2.00 -0.56 0.02 0.00 0.00 176.95 175.08 2gjx h GLN 374 N -2.20 0.00 -0.74 4.98 3.07 -1.87 -3.13 115.11 115.22 2gjx h GLN 374 Ca -0.58 0.00 0.06 0.00 0.09 0.00 0.00 58.65 58.22 2gjx h GLN 374 Cb 1.34 0.00 -0.06 0.00 0.08 0.00 0.00 27.48 28.84 2gjx h GLN 374 CO 0.55 0.03 0.43 0.93 0.09 0.00 0.00 178.83 180.87 2gjx h GLU 375 N 0.00 0.77 -0.84 0.06 3.07 -1.91 0.20 114.58 115.93 2gjx h GLU 375 Ca -0.00 -0.05 0.09 0.00 -0.50 0.00 0.00 59.36 58.91 2gjx h GLU 375 Cb 0.50 -0.17 -0.07 0.00 -0.84 0.00 0.00 28.75 28.16 2gjx h GLU 375 CO 0.00 0.51 0.49 0.28 -1.40 0.00 0.00 179.01 178.89 2gjx h VAL 376 N 0.79 0.93 -0.07 3.13 2.07 -1.73 0.30 116.25 121.67 2gjx h VAL 376 Ca 0.33 -0.29 -0.23 0.00 0.82 0.00 0.00 66.70 67.33 2gjx h VAL 376 Cb 0.19 0.02 0.01 0.00 -1.52 0.00 0.00 31.29 29.99 2gjx h VAL 376 CO -0.18 0.15 -0.88 0.15 0.02 0.00 0.00 177.57 176.83 2gjx h PHE 377 N 0.83 0.93 0.00 1.57 3.04 -1.56 -2.85 116.94 118.90 2gjx h PHE 377 Ca 0.40 -0.45 -0.10 0.00 3.98 0.00 0.00 57.97 61.80 2gjx h PHE 377 Cb 0.34 -0.13 -0.01 0.00 2.56 0.00 0.00 35.95 38.71 2gjx h PHE 377 CO -0.05 1.28 -0.46 -0.44 -2.02 0.00 0.00 178.31 176.62 2gjx h ASP 378 N 0.42 0.00 -0.29 0.41 3.45 -0.20 -3.00 116.42 117.20 2gjx h ASP 378 Ca -0.08 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.38 2gjx h ASP 378 Cb 1.51 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 40.28 2gjx h ASP 378 CO 0.17 0.46 0.01 0.59 -1.57 0.00 0.00 179.24 178.89 2gjx n ASN 379 N -3.99 3.34 -4.06 6.45 3.02 0.99 -4.91 115.26 116.11 2gjx n ASN 379 Ca -0.02 -2.47 -0.28 0.00 -0.03 0.00 0.00 54.58 51.79 2gjx n ASN 379 Cb 0.48 -0.59 -0.04 0.00 -0.61 0.00 0.00 39.78 39.02 2gjx n ASN 379 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2gjx n LYS 380 N 0.29 -2.84 -2.88 3.52 4.76 -1.14 -4.69 118.16 115.19 2gjx n LYS 380 Ca 0.14 0.34 -0.41 0.00 -2.87 0.00 0.00 58.31 55.51 2gjx n LYS 380 Cb 0.73 -4.43 -0.04 0.00 -1.84 0.00 0.00 35.03 29.45 2gjx n LYS 380 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2gjx s VAL 381 N -3.95 4.96 -0.21 -0.18 1.01 -1.08 -4.92 120.40 116.03 2gjx s VAL 381 Ca 0.10 1.76 -0.34 0.00 0.00 0.00 0.00 61.98 63.50 2gjx s VAL 381 Cb -0.05 -4.18 -0.11 0.00 0.00 0.00 0.00 36.38 32.04 2gjx s VAL 381 CO 0.91 0.21 2.03 1.17 0.00 0.00 0.00 175.10 179.42 2gjx n LYS 382 N 3.83 1.73 -4.46 2.72 3.00 -1.26 -4.91 118.16 118.82 2gjx n LYS 382 Ca 0.02 0.57 -0.20 0.00 -0.00 0.00 0.00 58.31 58.71 2gjx n LYS 382 Cb 0.51 -2.65 -0.15 0.00 0.00 0.00 0.00 35.03 32.74 2gjx n LYS 382 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.40 175.90 2gjx s ILE 383 N 5.79 0.84 0.36 3.15 2.07 -1.26 -4.66 121.20 127.48 2gjx s ILE 383 Ca 1.00 -0.45 -0.28 0.00 -1.41 0.00 0.00 60.65 59.51 2gjx s ILE 383 Cb -0.71 -0.70 -0.10 0.00 0.13 0.00 0.00 42.46 41.08 2gjx s ILE 383 CO 0.49 0.24 1.32 -1.58 -1.91 0.00 0.00 174.94 173.50 2gjx s GLN 384 N -0.24 4.21 0.60 3.50 2.00 -1.26 -4.92 119.66 123.55 2gjx s GLN 384 Ca 0.04 2.22 0.29 0.00 -2.00 0.00 0.00 55.36 55.91 2gjx s GLN 384 Cb -0.04 -2.96 1.67 0.00 0.80 0.00 0.00 33.01 32.47 2gjx s GLN 384 CO -0.00 -0.31 2.08 -1.00 -0.50 0.00 0.00 175.29 175.56 2gjx h PRO 385 N 3.12 0.00 -0.27 1.67 0.13 -2.00 -1.94 132.00 132.71 2gjx h PRO 385 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2gjx h PRO 385 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2gjx h PRO 385 CO 0.64 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.16 2gjx n ASP 386 N -3.72 1.94 -4.78 1.44 8.00 -1.26 -4.73 116.55 113.44 2gjx n ASP 386 Ca 0.02 -1.84 -0.37 0.00 0.71 0.00 0.00 54.79 53.30 2gjx n ASP 386 Cb 0.35 -0.18 -0.05 0.00 -0.02 0.00 0.00 41.12 41.23 2gjx n ASP 386 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2gjx s THR 387 N -1.65 3.82 -0.12 -3.53 2.01 -0.73 -4.78 115.64 110.65 2gjx s THR 387 Ca 0.30 1.48 -0.03 0.00 0.31 0.00 0.00 61.69 63.75 2gjx s THR 387 Cb 0.16 -3.81 -0.03 0.00 0.01 0.00 0.00 72.50 68.83 2gjx s THR 387 CO 0.23 0.10 -0.00 -0.63 -0.69 0.00 0.00 174.62 173.62 2gjx s ILE 388 N -1.57 4.24 -0.15 1.82 1.01 -1.13 -3.84 121.20 121.59 2gjx s ILE 388 Ca 0.54 -0.25 -0.05 0.00 0.00 0.00 0.00 60.65 60.88 2gjx s ILE 388 Cb -0.23 -2.82 -0.04 0.00 0.01 0.00 0.00 42.46 39.38 2gjx s ILE 388 CO 0.29 0.55 0.03 -0.63 0.00 0.00 0.00 174.94 175.18 2gjx s ILE 389 N -0.31 4.54 -0.42 2.92 -1.09 -0.41 -1.33 121.20 125.10 2gjx s ILE 389 Ca 0.06 -0.13 -0.07 0.00 -2.23 0.00 0.00 60.65 58.28 2gjx s ILE 389 Cb -0.12 -3.00 0.10 0.00 -1.58 0.00 0.00 42.46 37.85 2gjx s ILE 389 CO 0.02 0.52 0.25 -1.58 -1.23 0.00 0.00 174.94 172.91 2gjx s GLN 390 N -0.05 2.38 -0.02 2.79 0.74 0.01 -0.05 119.66 125.46 2gjx s GLN 390 Ca 0.05 -1.63 -0.30 0.00 0.05 0.00 0.00 55.36 53.52 2gjx s GLN 390 Cb -0.12 -3.72 -0.05 0.00 1.10 0.00 0.00 33.01 30.22 2gjx s GLN 390 CO 0.01 -1.03 1.43 0.08 -0.55 0.00 0.00 175.29 175.24 2gjx s VAL 391 N 1.31 3.73 0.00 1.34 1.01 0.77 -2.72 120.40 125.83 2gjx s VAL 391 Ca 0.05 1.07 0.00 0.00 0.00 0.00 0.00 61.98 63.09 2gjx s VAL 391 Cb -0.24 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.46 2gjx s VAL 391 CO -0.01 -0.02 0.00 -2.67 0.00 0.00 0.00 175.10 172.40 2gjx n TRP 392 N 5.73 0.00 -2.73 5.22 4.27 -1.26 -0.86 117.44 127.81 2gjx n TRP 392 Ca 0.14 0.00 -0.35 0.00 -3.89 0.00 0.00 57.50 53.40 2gjx n TRP 392 Cb 0.44 0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 30.33 2gjx n TRP 392 CO 0.00 0.00 0.00 1.03 -2.29 0.00 0.00 177.69 176.43 2gjx s ARG 393 N -1.21 4.24 -0.19 -2.67 0.52 -1.26 -3.95 118.95 114.42 2gjx s ARG 393 Ca 0.00 1.26 -0.16 0.00 -0.52 0.00 0.00 55.73 56.31 2gjx s ARG 393 Cb 0.00 -2.36 -0.11 0.00 0.52 0.00 0.00 34.95 33.00 2gjx s ARG 393 CO 0.00 -0.04 -0.05 0.39 0.02 0.00 0.00 175.30 175.63 2gjx n GLU 394 N -0.33 0.52 -0.06 3.54 1.02 -1.26 -4.21 120.64 119.86 2gjx n GLU 394 Ca 0.06 0.49 -0.11 0.00 -0.02 0.00 0.00 57.16 57.57 2gjx n GLU 394 Cb 0.52 -1.67 -0.04 0.00 -0.02 0.00 0.00 31.44 30.23 2gjx n GLU 394 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2gjx n ASP 395 N -4.48 1.34 -4.74 1.62 8.00 -1.26 -2.24 116.55 114.79 2gjx n ASP 395 Ca -0.24 0.10 -0.37 0.00 0.71 0.00 0.00 54.79 54.98 2gjx n ASP 395 Cb 0.54 -0.30 -0.06 0.00 -0.02 0.00 0.00 41.12 41.28 2gjx n ASP 395 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2gjx s ILE 396 N -2.21 5.20 -0.20 0.53 1.10 -1.26 -1.45 121.20 122.91 2gjx s ILE 396 Ca -0.16 0.83 0.17 0.00 -0.51 0.00 0.00 60.65 60.98 2gjx s ILE 396 Cb 0.06 -3.75 0.07 0.00 0.15 0.00 0.00 42.46 38.99 2gjx s ILE 396 CO 0.21 0.37 1.36 1.55 -2.11 0.00 0.00 174.94 176.32 2gjx h PRO 397 N 6.50 0.00 -3.99 3.50 0.13 -1.95 -3.45 132.00 132.74 2gjx h PRO 397 Ca -0.42 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.59 2gjx h PRO 397 Cb 1.18 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.15 2gjx h PRO 397 CO 0.74 0.36 -0.57 0.54 -0.23 0.00 0.00 178.00 178.84 2gjx s VAL 398 N -3.02 0.17 0.47 1.56 0.11 -0.53 -5.14 120.40 114.02 2gjx s VAL 398 Ca 0.03 -1.36 -0.21 0.00 -2.93 0.00 0.00 61.98 57.51 2gjx s VAL 398 Cb 0.07 -1.14 -0.11 0.00 -1.53 0.00 0.00 36.38 33.67 2gjx s VAL 398 CO 0.75 -0.75 0.58 -3.20 -3.33 0.00 0.00 175.10 169.14 2gjx n ASN 399 N 0.46 -0.74 0.25 3.54 5.15 -1.21 -4.37 115.26 118.34 2gjx n ASN 399 Ca -0.17 0.86 0.12 0.00 -0.60 0.00 0.00 54.58 54.79 2gjx n ASN 399 Cb 0.60 -1.15 0.68 0.00 -0.53 0.00 0.00 39.78 39.37 2gjx n ASN 399 CO 0.00 0.00 0.00 0.10 1.40 0.00 0.00 177.26 178.76 2gjx h TYR 400 N 0.69 0.00 0.00 1.20 -0.00 -1.62 -0.06 116.97 117.19 2gjx h TYR 400 Ca -0.42 0.00 -0.18 0.00 0.00 0.00 0.00 58.73 58.13 2gjx h TYR 400 Cb 1.39 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 38.10 2gjx h TYR 400 CO 0.35 0.14 -0.85 0.52 -0.00 0.00 0.00 178.16 178.32 2gjx h MET 401 N 0.00 0.02 0.00 0.10 2.86 -1.89 -2.80 114.93 113.22 2gjx h MET 401 Ca -0.00 -0.02 -0.11 0.00 -2.06 0.00 0.00 59.70 57.51 2gjx h MET 401 Cb 0.39 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 2gjx h MET 401 CO 0.02 0.85 -0.53 -0.22 1.06 0.00 0.00 176.91 178.09 2gjx h LYS 402 N 0.01 0.00 -0.08 1.72 3.11 -1.57 -3.09 116.57 116.67 2gjx h LYS 402 Ca -0.01 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.82 2gjx h LYS 402 Cb 1.50 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.72 2gjx h LYS 402 CO 0.11 0.53 0.00 0.93 -2.81 0.00 0.00 179.45 178.22 2gjx h GLU 403 N 0.00 0.14 -0.66 1.90 4.39 -0.95 -2.29 114.58 117.11 2gjx h GLU 403 Ca -0.01 -0.04 0.07 0.00 0.34 0.00 0.00 59.36 59.72 2gjx h GLU 403 Cb 1.29 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.88 2gjx h GLU 403 CO 0.07 0.39 0.44 -0.07 -1.16 0.00 0.00 179.01 178.68 2gjx h LEU 404 N -0.14 0.56 -0.02 1.33 3.38 -1.50 0.21 115.31 119.13 2gjx h LEU 404 Ca 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 2gjx h LEU 404 Cb 0.33 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 2gjx h LEU 404 CO 0.00 0.36 0.00 -0.08 0.09 0.00 0.00 178.44 178.82 2gjx h GLU 405 N 0.63 0.03 -0.32 1.13 4.81 -1.44 -1.29 114.58 118.13 2gjx h GLU 405 Ca 0.29 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.50 2gjx h GLU 405 Cb 0.32 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 2gjx h GLU 405 CO -0.09 0.25 0.16 -0.07 -0.73 0.00 0.00 179.01 178.52 2gjx h LEU 406 N -0.20 0.41 -0.52 1.64 4.07 -0.79 0.47 115.31 120.40 2gjx h LEU 406 Ca 0.01 -0.12 -0.04 0.00 0.08 0.00 0.00 57.88 57.81 2gjx h LEU 406 Cb 0.23 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 41.84 2gjx h LEU 406 CO 0.00 0.41 0.17 0.58 -1.08 0.00 0.00 178.44 178.52 2gjx h VAL 407 N 0.38 1.23 -0.15 1.22 2.07 -0.99 -0.75 116.25 119.26 2gjx h VAL 407 Ca 0.11 -0.76 -0.22 0.00 0.82 0.00 0.00 66.70 66.64 2gjx h VAL 407 Cb 0.10 0.75 0.01 0.00 -1.52 0.00 0.00 31.29 30.63 2gjx h VAL 407 CO -0.01 0.28 -0.78 0.71 0.02 0.00 0.00 177.57 177.79 2gjx h THR 408 N 0.71 1.28 0.00 2.57 1.35 -1.17 -2.37 112.91 115.29 2gjx h THR 408 Ca 0.17 -1.98 -0.06 0.00 -0.55 0.00 0.00 66.41 63.99 2gjx h THR 408 Cb 0.27 1.98 -0.01 0.00 -1.73 0.00 0.00 68.15 68.66 2gjx h THR 408 CO -0.01 0.63 -0.29 0.50 -0.25 0.00 0.00 175.52 176.10 2gjx h LYS 409 N 0.53 0.00 0.00 4.72 3.64 -0.85 -1.71 116.57 122.90 2gjx h LYS 409 Ca -0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2gjx h LYS 409 Cb 1.40 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.22 2gjx h LYS 409 CO 0.16 0.29 0.00 0.00 -2.27 0.00 0.00 179.45 177.63 2gjx h ALA 410 N 1.71 1.00 0.00 5.00 0.00 -1.02 -3.47 119.26 122.48 2gjx h ALA 410 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2gjx h ALA 410 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2gjx h ALA 410 CO 0.04 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.70 2gjx n GLY 411 N 0.39 0.79 3.91 0.00 0.00 -0.64 -5.08 105.19 104.54 2gjx n GLY 411 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 2gjx n GLY 411 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gjx s PHE 412 N -2.00 3.38 0.43 1.61 0.08 -0.91 -4.99 117.98 115.58 2gjx s PHE 412 Ca 0.00 0.79 -0.09 0.00 0.12 0.00 0.00 56.93 57.75 2gjx s PHE 412 Cb 0.00 -2.65 -0.05 0.00 -0.57 0.00 0.00 43.02 39.74 2gjx s PHE 412 CO 0.00 -0.70 0.78 1.03 -0.10 0.00 0.00 175.22 176.23 2gjx s ARG 413 N -4.98 3.70 0.01 0.44 0.52 -1.25 -4.16 118.95 113.23 2gjx s ARG 413 Ca 0.53 0.40 0.00 0.00 -0.52 0.00 0.00 55.73 56.14 2gjx s ARG 413 Cb -0.11 -2.38 -0.01 0.00 0.52 0.00 0.00 34.95 32.98 2gjx s ARG 413 CO 0.47 -0.10 -0.02 0.00 0.02 0.00 0.00 175.30 175.66 2gjx s ALA 414 N -2.51 0.13 -0.02 2.13 0.00 -0.78 -1.29 121.76 119.43 2gjx s ALA 414 Ca 0.50 -0.22 0.03 0.00 0.00 0.00 0.00 51.96 52.27 2gjx s ALA 414 Cb -0.10 0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.01 2gjx s ALA 414 CO 0.36 -0.02 -0.08 -0.51 0.00 0.00 0.00 175.76 175.51 2gjx s LEU 415 N -0.46 3.11 -0.18 0.00 2.01 0.93 -2.40 118.68 121.69 2gjx s LEU 415 Ca -0.04 -0.12 -0.05 0.00 0.01 0.00 0.00 54.13 53.93 2gjx s LEU 415 Cb -0.03 -1.74 -0.03 0.00 0.01 0.00 0.00 46.19 44.40 2gjx s LEU 415 CO -0.00 0.31 -0.01 -0.22 1.01 0.00 0.00 176.35 177.44 2gjx s LEU 416 N -1.17 3.32 0.00 1.79 2.96 -0.31 -0.17 118.68 125.11 2gjx s LEU 416 Ca 0.15 -0.14 0.00 0.00 -0.22 0.00 0.00 54.13 53.92 2gjx s LEU 416 Cb -0.11 -1.82 0.00 0.00 0.50 0.00 0.00 46.19 44.76 2gjx s LEU 416 CO 0.05 0.12 0.00 -1.20 -1.32 0.00 0.00 176.35 174.00 2gjx n SER 417 N 3.85 0.00 -0.21 3.68 7.64 -0.04 -1.72 113.62 126.82 2gjx n SER 417 Ca -0.17 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.62 2gjx n SER 417 Cb 0.52 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.68 2gjx n SER 417 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2gjx h ALA 418 N 0.00 -0.37 -0.07 -0.43 0.00 -1.54 -1.06 119.26 115.79 2gjx h ALA 418 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2gjx h ALA 418 Cb 0.00 1.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2gjx h ALA 418 CO 0.00 -0.85 0.00 -0.35 0.00 0.00 0.00 179.25 178.05 2gjx n PRO 419 N -5.40 1.52 -1.77 0.00 -0.04 -1.26 -4.13 135.00 123.92 2gjx n PRO 419 Ca 0.01 -0.77 -0.30 0.00 -0.04 0.00 0.00 63.50 62.40 2gjx n PRO 419 Cb 0.35 -1.43 0.04 0.00 -0.04 0.00 0.00 33.50 32.42 2gjx n PRO 419 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2gjx n TRP 420 N -0.04 3.04 -2.88 0.54 8.01 -0.40 -4.76 117.44 120.94 2gjx n TRP 420 Ca 0.18 -2.65 -0.44 0.00 -1.31 0.00 0.00 57.50 53.28 2gjx n TRP 420 Cb 0.28 -0.86 -0.02 0.00 -2.01 0.00 0.00 31.31 28.69 2gjx n TRP 420 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.69 177.39 2gjx s TYR 421 N -3.74 3.06 0.44 -5.99 1.51 -1.24 -1.61 117.35 109.77 2gjx s TYR 421 Ca 0.57 -1.35 0.09 0.00 -1.01 0.00 0.00 57.07 55.37 2gjx s TYR 421 Cb 0.45 -4.33 0.95 0.00 -0.11 0.00 0.00 41.96 38.93 2gjx s TYR 421 CO -0.05 -1.54 2.07 -0.07 -1.11 0.00 0.00 175.55 174.85 2gjx h LEU 422 N 10.67 0.34 -2.13 -1.29 3.38 -1.68 -2.02 115.31 122.58 2gjx h LEU 422 Ca 0.17 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.20 2gjx h LEU 422 Cb 1.02 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 2gjx h LEU 422 CO 1.15 0.26 0.23 -0.55 0.09 0.00 0.00 178.44 179.62 2gjx h ASN 423 N 0.40 0.00 -1.48 -0.43 -1.07 -1.82 -3.33 115.58 107.84 2gjx h ASN 423 Ca 0.11 0.00 -0.66 0.00 0.07 0.00 0.00 56.30 55.81 2gjx h ASN 423 Cb -0.02 0.00 -0.12 0.00 -2.07 0.00 0.00 38.32 36.11 2gjx h ASN 423 CO -0.02 0.00 1.54 -0.13 0.07 0.00 0.00 177.43 178.89 2gjx s ARG 424 N -4.79 3.79 0.56 4.14 0.52 -0.76 -5.00 118.95 117.42 2gjx s ARG 424 Ca -0.05 -1.75 -0.15 0.00 -0.52 0.00 0.00 55.73 53.26 2gjx s ARG 424 Cb 0.17 -5.27 -0.06 0.00 0.52 0.00 0.00 34.95 30.30 2gjx s ARG 424 CO 0.61 -2.06 1.01 0.96 0.02 0.00 0.00 175.30 175.84 2gjx s ILE 425 N 3.72 4.46 0.16 1.52 -4.36 -1.25 -5.01 121.20 120.44 2gjx s ILE 425 Ca 0.45 1.07 -0.14 0.00 -0.26 0.00 0.00 60.65 61.77 2gjx s ILE 425 Cb -0.00 -3.70 0.02 0.00 1.25 0.00 0.00 42.46 40.03 2gjx s ILE 425 CO -0.03 -0.78 0.41 -0.94 0.24 0.00 0.00 174.94 173.84 2gjx s SER 426 N -3.32 -0.15 0.40 4.36 1.04 -1.26 -5.15 113.70 109.62 2gjx s SER 426 Ca 0.59 -0.56 -0.25 0.00 0.48 0.00 0.00 55.95 56.21 2gjx s SER 426 Cb -0.11 0.50 -0.08 0.00 0.10 0.00 0.00 66.02 66.42 2gjx s SER 426 CO 0.38 -0.94 1.13 -0.47 0.98 0.00 0.00 173.24 174.32 2gjx s TYR 427 N -3.88 3.13 0.00 5.02 5.04 -1.26 -4.79 117.35 120.61 2gjx s TYR 427 Ca 0.09 1.59 0.00 0.00 -2.44 0.00 0.00 57.07 56.31 2gjx s TYR 427 Cb 0.01 -3.30 0.00 0.00 0.35 0.00 0.00 41.96 39.02 2gjx s TYR 427 CO -0.05 -1.09 0.00 0.41 -1.34 0.00 0.00 175.55 173.48 2gjx n GLY 428 N 0.55 -1.80 3.23 8.97 0.00 -1.26 -4.68 105.19 110.19 2gjx n GLY 428 Ca 0.05 -1.75 -0.44 0.00 0.00 0.00 0.00 46.02 43.88 2gjx n GLY 428 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2gjx n PRO 429 N 0.00 3.61 0.00 1.61 -0.04 -1.26 -4.81 135.00 134.10 2gjx n PRO 429 Ca 0.00 -3.96 0.10 0.00 -0.04 0.00 0.00 63.50 59.60 2gjx n PRO 429 Cb 0.00 -2.86 0.60 0.00 -0.04 0.00 0.00 33.50 31.21 2gjx n PRO 429 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2gjx n ASP 430 N 4.10 0.00 0.28 3.54 5.75 -1.26 -2.82 116.55 126.14 2gjx n ASP 430 Ca 0.34 -0.87 0.16 0.00 -0.01 0.00 0.00 54.79 54.41 2gjx n ASP 430 Cb 0.39 0.00 0.77 0.00 -1.03 0.00 0.00 41.12 41.25 2gjx n ASP 430 CO 0.00 0.00 0.00 4.11 -0.11 0.00 0.00 177.20 181.20 2gjx h TRP 431 N 0.00 0.00 0.00 2.11 5.08 -1.91 -1.80 115.95 119.43 2gjx h TRP 431 Ca 0.00 0.00 -0.09 0.00 1.08 0.00 0.00 58.89 59.88 2gjx h TRP 431 Cb 0.00 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.15 2gjx h TRP 431 CO 0.00 0.07 -0.42 0.87 -1.28 0.00 0.00 178.44 177.67 2gjx h LYS 432 N 0.00 0.00 -0.23 0.12 1.57 -1.94 -1.45 116.57 114.65 2gjx h LYS 432 Ca -0.00 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 2gjx h LYS 432 Cb 0.40 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.70 2gjx h LYS 432 CO 0.01 0.42 -0.26 -0.44 -0.57 0.00 0.00 179.45 178.61 2gjx h ASP 433 N 0.00 0.62 -0.50 0.86 3.45 -1.56 -2.72 116.42 116.58 2gjx h ASP 433 Ca -0.00 -0.49 -0.12 0.00 0.43 0.00 0.00 57.03 56.85 2gjx h ASP 433 Cb 0.90 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 39.47 2gjx h ASP 433 CO 0.06 0.99 -0.13 -0.26 -1.57 0.00 0.00 179.24 178.32 2gjx h PHE 434 N 0.27 1.11 -0.32 4.55 0.04 -1.46 -3.20 116.94 117.93 2gjx h PHE 434 Ca 0.03 -0.23 -0.11 0.00 2.80 0.00 0.00 57.97 60.46 2gjx h PHE 434 Cb 0.82 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 38.69 2gjx h PHE 434 CO 0.08 1.04 -0.25 -0.92 -0.60 0.00 0.00 178.31 177.66 2gjx h TYR 435 N 0.87 0.72 0.00 -0.55 3.20 -1.28 -3.16 116.97 116.77 2gjx h TYR 435 Ca 0.13 -0.16 0.00 0.00 3.14 0.00 0.00 58.73 61.84 2gjx h TYR 435 Cb 0.69 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.79 2gjx h TYR 435 CO 0.04 0.82 0.00 -0.24 -1.64 0.00 0.00 178.16 177.15 2gjx h VAL 436 N 0.56 0.00 -2.55 1.81 3.04 -1.48 -3.46 116.25 114.17 2gjx h VAL 436 Ca 0.08 -0.48 -0.55 0.00 -1.01 0.00 0.00 66.70 64.74 2gjx h VAL 436 Cb 0.72 1.44 0.06 0.00 -2.01 0.00 0.00 31.29 31.50 2gjx h VAL 436 CO 0.06 0.00 0.92 0.52 -1.01 0.00 0.00 177.57 178.05 2gjx n VAL 437 N -2.35 0.08 -3.85 1.51 0.31 -1.19 -4.98 118.33 107.86 2gjx n VAL 437 Ca 0.05 -0.02 -0.36 0.00 -0.01 0.00 0.00 64.34 64.00 2gjx n VAL 437 Cb 0.40 -1.81 -0.13 0.00 -0.91 0.00 0.00 33.84 31.40 2gjx n VAL 437 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 2gjx s GLU 438 N 0.94 2.36 0.51 5.55 2.56 -1.26 -5.00 118.70 124.36 2gjx s GLU 438 Ca 0.76 -1.38 0.16 0.00 0.00 0.00 0.00 54.97 54.50 2gjx s GLU 438 Cb -0.57 -3.33 1.24 0.00 2.00 0.00 0.00 34.13 33.47 2gjx s GLU 438 CO 0.36 -0.74 2.12 -1.35 -0.56 0.00 0.00 175.26 175.09 2gjx h PRO 439 N 8.05 0.07 -0.54 4.30 0.11 -1.93 -2.63 132.00 139.42 2gjx h PRO 439 Ca -0.19 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.86 2gjx h PRO 439 Cb 1.06 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 2gjx h PRO 439 CO 0.58 0.04 0.06 1.28 -0.21 0.00 0.00 178.00 179.76 2gjx n LEU 440 N -4.51 5.41 -3.46 2.35 4.77 -1.26 -4.74 117.00 115.55 2gjx n LEU 440 Ca -0.00 -3.05 -0.40 0.00 -0.03 0.00 0.00 56.01 52.53 2gjx n LEU 440 Cb 0.16 -0.67 -0.01 0.00 -2.33 0.00 0.00 43.42 40.57 2gjx n LEU 440 CO 0.34 0.70 2.68 0.00 -1.33 0.00 0.00 177.39 179.78 2gjx n ALA 441 N 0.15 6.91 -2.57 -1.18 0.00 -0.99 -4.89 120.51 117.94 2gjx n ALA 441 Ca 0.30 -3.93 -0.12 0.00 0.00 0.00 0.00 53.44 49.68 2gjx n ALA 441 Cb 1.18 -2.98 -0.08 0.00 0.00 0.00 0.00 19.45 17.57 2gjx n ALA 441 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2gjx s PHE 442 N 0.03 1.00 -0.18 0.00 -0.71 -1.26 -5.00 117.98 111.86 2gjx s PHE 442 Ca 0.58 -1.22 -0.29 0.00 -1.04 0.00 0.00 56.93 54.95 2gjx s PHE 442 Cb 0.18 -0.31 -0.01 0.00 -1.21 0.00 0.00 43.02 41.67 2gjx s PHE 442 CO -0.08 -0.83 1.17 -2.00 -1.34 0.00 0.00 175.22 172.15 2gjx s GLU 443 N -3.89 4.25 0.00 1.99 2.56 -1.26 -4.97 118.70 117.38 2gjx s GLU 443 Ca 0.34 1.54 0.00 0.00 0.00 0.00 0.00 54.97 56.85 2gjx s GLU 443 Cb 0.03 -3.70 0.00 0.00 2.00 0.00 0.00 34.13 32.46 2gjx s GLU 443 CO 0.14 -0.66 0.00 0.41 -0.56 0.00 0.00 175.26 174.59 2gjx n GLY 444 N 3.48 1.00 3.92 -1.50 0.00 -1.26 -4.79 105.19 106.04 2gjx n GLY 444 Ca 0.13 -0.85 -0.27 0.00 0.00 0.00 0.00 46.02 45.03 2gjx n GLY 444 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2gjx s THR 445 N -2.00 4.16 0.17 2.61 -4.23 -1.26 -4.85 115.64 110.24 2gjx s THR 445 Ca 0.00 0.04 -0.21 0.00 -1.18 0.00 0.00 61.69 60.34 2gjx s THR 445 Cb 0.00 -3.61 0.08 0.00 1.34 0.00 0.00 72.50 70.31 2gjx s THR 445 CO 0.00 -0.60 1.61 -0.65 -0.54 0.00 0.00 174.62 174.44 2gjx h PRO 446 N 0.02 -0.20 0.00 3.99 0.11 -2.02 0.13 132.00 134.04 2gjx h PRO 446 Ca -0.46 0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.63 2gjx h PRO 446 Cb 1.24 0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.39 2gjx h PRO 446 CO 0.61 -0.13 -0.15 1.05 -0.21 0.00 0.00 178.00 179.16 2gjx h GLU 447 N -0.20 0.00 -0.15 1.05 9.09 -1.99 -2.04 114.58 120.34 2gjx h GLU 447 Ca 0.18 0.00 -0.21 0.00 0.05 0.00 0.00 59.36 59.39 2gjx h GLU 447 Cb 0.50 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.61 2gjx h GLU 447 CO -0.51 0.15 -0.72 0.37 0.05 0.00 0.00 179.01 178.35 2gjx h GLN 448 N 0.00 0.75 0.00 1.06 4.15 -1.52 -3.11 115.11 116.44 2gjx h GLN 448 Ca -0.00 -0.61 -0.01 0.00 0.77 0.00 0.00 58.65 58.80 2gjx h GLN 448 Cb 0.62 0.12 -0.00 0.00 0.21 0.00 0.00 27.48 28.43 2gjx h GLN 448 CO 0.02 1.22 -0.07 0.87 -1.93 0.00 0.00 178.83 178.94 2gjx h LYS 449 N 0.46 0.00 0.00 1.69 1.57 -0.52 -2.97 116.57 116.81 2gjx h LYS 449 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2gjx h LYS 449 Cb 1.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.66 2gjx h LYS 449 CO 0.15 0.07 0.00 0.00 -0.57 0.00 0.00 179.45 179.10 2gjx n ALA 450 N -2.13 1.69 0.80 3.86 0.00 -0.79 -2.46 120.51 121.47 2gjx n ALA 450 Ca 0.01 -0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.56 2gjx n ALA 450 Cb 0.37 -1.28 0.51 0.00 0.00 0.00 0.00 19.45 19.05 2gjx n ALA 450 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2gjx n LEU 451 N -1.70 0.21 -4.60 0.00 4.77 -1.12 -4.63 117.00 109.93 2gjx n LEU 451 Ca 0.03 0.53 -0.43 0.00 -0.03 0.00 0.00 56.01 56.11 2gjx n LEU 451 Cb 0.19 -0.47 -0.02 0.00 -2.33 0.00 0.00 43.42 40.79 2gjx n LEU 451 CO 0.16 -0.12 0.97 -0.69 -1.33 0.00 0.00 177.39 176.38 2gjx s VAL 452 N -3.04 4.29 -2.24 4.08 1.01 -1.03 -1.86 120.40 121.61 2gjx s VAL 452 Ca 0.11 1.20 0.21 0.00 0.00 0.00 0.00 61.98 63.51 2gjx s VAL 452 Cb 0.15 -4.55 0.48 0.00 0.00 0.00 0.00 36.38 32.47 2gjx s VAL 452 CO 0.49 -0.91 1.45 2.30 0.00 0.00 0.00 175.10 178.42 2gjx n ILE 453 N 6.65 0.60 0.00 2.22 -5.35 -1.01 -4.95 119.36 117.52 2gjx n ILE 453 Ca 0.11 -0.72 0.00 0.00 -0.27 0.00 0.00 62.75 61.87 2gjx n ILE 453 Cb 0.49 0.64 0.00 0.00 -1.74 0.00 0.00 39.64 39.03 2gjx n ILE 453 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2gjx n GLY 454 N 1.44 0.32 2.50 3.28 0.00 -1.26 -1.14 105.19 110.34 2gjx n GLY 454 Ca 0.19 -1.72 -0.01 0.00 0.00 0.00 0.00 46.02 44.49 2gjx n GLY 454 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gjx n GLY 455 N 0.00 0.71 2.92 -0.02 0.00 -0.74 -1.16 105.19 106.90 2gjx n GLY 455 Ca 0.00 -1.04 -0.11 0.00 0.00 0.00 0.00 46.02 44.87 2gjx n GLY 455 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gjx s GLU 456 N -2.03 0.11 0.16 1.61 2.02 -0.70 -1.38 118.70 118.49 2gjx s GLU 456 Ca 0.16 -0.13 -0.19 0.00 0.02 0.00 0.00 54.97 54.82 2gjx s GLU 456 Cb -0.01 0.04 -0.08 0.00 0.10 0.00 0.00 34.13 34.18 2gjx s GLU 456 CO 0.02 -0.02 0.66 0.00 0.02 0.00 0.00 175.26 175.94 2gjx s ALA 457 N -0.38 3.49 -0.19 5.21 0.00 -0.98 -4.38 121.76 124.54 2gjx s ALA 457 Ca -0.04 0.10 0.01 0.00 0.00 0.00 0.00 51.96 52.03 2gjx s ALA 457 Cb -0.03 -2.73 0.03 0.00 0.00 0.00 0.00 23.12 20.39 2gjx s ALA 457 CO -0.00 0.37 -0.17 0.00 0.00 0.00 0.00 175.76 175.95 2gjx n MET 459 N 4.62 2.75 -2.20 0.00 2.81 -0.59 -1.70 117.12 122.81 2gjx n MET 459 Ca -0.19 -4.48 -0.41 0.00 -1.81 0.00 0.00 57.70 50.81 2gjx n MET 459 Cb 0.49 -2.43 -0.03 0.00 -0.71 0.00 0.00 33.22 30.54 2gjx n MET 459 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 2gjx s TRP 460 N -1.40 3.20 -0.57 2.03 0.52 -1.26 -3.25 118.94 118.21 2gjx s TRP 460 Ca 0.28 1.41 0.08 0.00 0.02 0.00 0.00 56.10 57.89 2gjx s TRP 460 Cb -0.07 -3.59 0.45 0.00 -1.15 0.00 0.00 33.47 29.11 2gjx s TRP 460 CO -0.12 -1.65 1.20 0.41 0.02 0.00 0.00 176.95 176.81 2gjx n GLY 461 N 1.28 2.36 0.35 0.98 0.00 -1.26 -4.39 105.19 104.51 2gjx n GLY 461 Ca 0.01 -0.51 0.07 0.00 0.00 0.00 0.00 46.02 45.59 2gjx n GLY 461 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2gjx h GLU 462 N 2.16 0.90 0.00 1.61 3.07 -1.92 -3.00 114.58 117.40 2gjx h GLU 462 Ca 0.01 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 2gjx h GLU 462 Cb 1.35 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 29.05 2gjx h GLU 462 CO 0.29 0.60 -0.10 0.66 -1.40 0.00 0.00 179.01 179.05 2gjx n TYR 463 N -4.66 0.00 -4.45 4.33 4.01 -1.26 -4.98 117.16 110.15 2gjx n TYR 463 Ca 0.19 -0.70 -0.21 0.00 -0.16 0.00 0.00 57.90 57.02 2gjx n TYR 463 Cb 0.37 -0.11 -0.16 0.00 -0.31 0.00 0.00 39.34 39.13 2gjx n TYR 463 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2gjx s VAL 464 N -1.95 0.87 0.00 -0.72 1.01 -1.13 -4.99 120.40 113.49 2gjx s VAL 464 Ca 0.20 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 61.78 2gjx s VAL 464 Cb 0.18 -0.77 0.00 0.00 0.00 0.00 0.00 36.38 35.78 2gjx s VAL 464 CO 0.02 0.27 0.00 -0.90 0.00 0.00 0.00 175.10 174.49 2gjx n ASP 465 N 3.32 0.00 0.23 3.32 3.85 -1.26 -4.59 116.55 121.43 2gjx n ASP 465 Ca -0.19 0.00 0.15 0.00 -0.71 0.00 0.00 54.79 54.04 2gjx n ASP 465 Cb 0.54 0.00 0.80 0.00 -1.35 0.00 0.00 41.12 41.11 2gjx n ASP 465 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.20 175.06 2gjx h ASN 466 N 0.00 0.00 0.90 -1.12 -0.00 -1.96 -1.62 115.58 111.79 2gjx h ASN 466 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 56.30 56.10 2gjx h ASN 466 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 38.32 38.29 2gjx h ASN 466 CO 0.00 0.00 -1.17 0.00 -0.00 0.00 0.00 177.43 176.26 2gjx h THR 467 N 0.00 1.11 0.00 -3.57 1.03 -1.98 -3.40 112.91 106.10 2gjx h THR 467 Ca 0.00 -2.75 0.00 0.00 -0.01 0.00 0.00 66.41 63.65 2gjx h THR 467 Cb 0.10 2.51 0.00 0.00 -1.07 0.00 0.00 68.15 69.69 2gjx h THR 467 CO 0.00 0.63 -0.25 -0.46 -0.01 0.00 0.00 175.52 175.43 2gjx n ASN 468 N -3.16 0.05 0.46 0.00 6.94 -1.02 -4.93 115.26 113.60 2gjx n ASN 468 Ca -0.06 -1.53 -0.18 0.00 -0.02 0.00 0.00 54.58 52.79 2gjx n ASN 468 Cb 0.91 -0.10 -0.09 0.00 -2.36 0.00 0.00 39.78 38.14 2gjx n ASN 468 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 2gjx h LEU 469 N 0.00 -0.99 0.19 -4.53 5.85 -1.53 -2.94 115.31 111.37 2gjx h LEU 469 Ca 0.00 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.76 2gjx h LEU 469 Cb 1.19 0.26 -0.03 0.00 0.37 0.00 0.00 40.66 42.45 2gjx h LEU 469 CO 0.00 -0.65 -0.26 0.58 -0.34 0.00 0.00 178.44 177.77 2gjx h VAL 470 N -1.30 0.43 -0.77 1.05 2.07 -1.86 0.32 116.25 116.18 2gjx h VAL 470 Ca -0.12 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.44 2gjx h VAL 470 Cb 0.90 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 2gjx h VAL 470 CO 0.20 0.00 0.51 1.55 0.02 0.00 0.00 177.57 179.85 2gjx h PRO 471 N -0.52 0.91 0.00 1.57 0.13 -1.61 -1.29 132.00 131.20 2gjx h PRO 471 Ca 0.01 -0.05 -0.16 0.00 -0.87 0.00 0.00 66.00 64.92 2gjx h PRO 471 Cb 0.51 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 31.41 2gjx h PRO 471 CO -0.10 0.60 -0.77 -0.09 -0.23 0.00 0.00 178.00 177.41 2gjx h ARG 472 N 0.94 0.00 0.33 0.86 2.43 -1.30 -3.33 114.38 114.31 2gjx h ARG 472 Ca 0.31 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.46 2gjx h ARG 472 Cb 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 2gjx h ARG 472 CO -0.09 0.77 -0.16 -0.07 -1.51 0.00 0.00 179.97 178.91 2gjx h LEU 473 N 0.00 -0.37 -9.74 3.80 3.38 -0.29 -3.44 115.31 108.65 2gjx h LEU 473 Ca -0.01 0.01 -0.64 0.00 0.09 0.00 0.00 57.88 57.34 2gjx h LEU 473 Cb 1.42 0.10 -0.07 0.00 0.09 0.00 0.00 40.66 42.20 2gjx h LEU 473 CO 0.10 -0.09 -0.53 0.26 0.09 0.00 0.00 178.44 178.27 2gjx s TRP 474 N -3.10 3.43 -0.37 1.13 0.52 -0.55 -0.96 118.94 119.04 2gjx s TRP 474 Ca -0.06 0.26 0.11 0.00 0.02 0.00 0.00 56.10 56.43 2gjx s TRP 474 Cb 0.01 -1.77 0.68 0.00 -1.15 0.00 0.00 33.47 31.24 2gjx s TRP 474 CO 0.19 0.60 1.56 -0.35 0.02 0.00 0.00 176.95 178.97 2gjx n PRO 475 N 0.82 4.14 -0.02 4.98 -0.04 -1.26 -2.55 135.00 141.06 2gjx n PRO 475 Ca -0.10 -2.64 0.01 0.00 -0.04 0.00 0.00 63.50 60.74 2gjx n PRO 475 Cb 0.52 -2.14 0.34 0.00 -0.04 0.00 0.00 33.50 32.18 2gjx n PRO 475 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2gjx h ARG 476 N 3.18 0.58 0.00 0.54 3.08 -1.76 -1.37 114.38 118.63 2gjx h ARG 476 Ca 0.04 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 2gjx h ARG 476 Cb 1.80 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 31.74 2gjx h ARG 476 CO 0.45 0.50 -0.00 0.00 -1.07 0.00 0.00 179.97 179.84 2gjx h ALA 477 N 1.59 1.00 0.00 0.04 0.00 -1.36 -2.74 119.26 117.78 2gjx h ALA 477 Ca 0.14 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2gjx h ALA 477 Cb 0.14 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2gjx h ALA 477 CO -0.01 0.00 -0.15 0.78 0.00 0.00 0.00 179.25 179.87 2gjx h GLY 478 N 2.14 0.00 1.04 0.00 0.00 -1.51 -1.93 103.07 102.82 2gjx h GLY 478 Ca -0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 2gjx h GLY 478 CO 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 176.54 176.42 2gjx h ALA 479 N 1.85 0.65 -0.13 3.60 0.00 -1.54 -2.40 119.26 121.28 2gjx h ALA 479 Ca -0.00 -0.34 -0.16 0.00 0.00 0.00 0.00 54.91 54.41 2gjx h ALA 479 Cb 0.58 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2gjx h ALA 479 CO 0.02 0.56 -0.59 0.28 0.00 0.00 0.00 179.25 179.51 2gjx h VAL 480 N 0.76 1.35 -0.52 0.00 2.07 -1.63 -2.94 116.25 115.34 2gjx h VAL 480 Ca 0.12 -1.90 0.05 0.00 0.82 0.00 0.00 66.70 65.78 2gjx h VAL 480 Cb 0.67 1.90 -0.05 0.00 -1.52 0.00 0.00 31.29 32.29 2gjx h VAL 480 CO 0.05 0.58 0.26 0.00 0.02 0.00 0.00 177.57 178.47 2gjx h ALA 481 N 1.04 0.66 -0.14 1.67 0.00 -1.13 -2.21 119.26 119.15 2gjx h ALA 481 Ca -0.00 0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.74 2gjx h ALA 481 Cb 1.13 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 2gjx h ALA 481 CO 0.10 -0.09 -0.70 1.49 0.00 0.00 0.00 179.25 180.06 2gjx h GLU 482 N 0.50 0.59 0.00 0.00 4.81 -1.44 -2.72 114.58 116.32 2gjx h GLU 482 Ca 0.23 -0.45 -0.02 0.00 -0.13 0.00 0.00 59.36 58.99 2gjx h GLU 482 Cb 0.14 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.60 2gjx h GLU 482 CO -0.16 1.07 -0.08 -0.09 -0.73 0.00 0.00 179.01 179.02 2gjx h ARG 483 N 0.41 0.00 0.00 1.92 9.65 -1.30 0.23 114.38 125.29 2gjx h ARG 483 Ca -0.03 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 2gjx h ARG 483 Cb 1.28 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.86 2gjx h ARG 483 CO 0.13 0.08 -1.39 1.28 2.80 0.00 0.00 179.97 182.87 2gjx n LEU 484 N -3.32 0.48 -0.10 3.80 4.77 -0.86 -4.59 117.00 117.18 2gjx n LEU 484 Ca -0.01 0.12 -0.20 0.00 -0.03 0.00 0.00 56.01 55.89 2gjx n LEU 484 Cb 0.27 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.25 2gjx n LEU 484 CO 0.28 -0.06 -1.11 1.87 -1.33 0.00 0.00 177.39 177.04 2gjx n TRP 485 N -2.36 0.00 -0.92 -1.77 -0.00 -1.01 -1.80 117.44 109.58 2gjx n TRP 485 Ca -0.01 0.00 -0.29 0.00 -0.00 0.00 0.00 57.50 57.20 2gjx n TRP 485 Cb 0.53 -0.72 0.23 0.00 -0.00 0.00 0.00 31.31 31.35 2gjx n TRP 485 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 177.69 176.57 2gjx s SER 486 N -6.78 1.08 0.66 5.87 0.01 0.78 -0.66 113.70 114.66 2gjx s SER 486 Ca -0.30 0.94 -0.11 0.00 1.31 0.00 0.00 55.95 57.79 2gjx s SER 486 Cb 0.10 -1.41 -0.01 0.00 0.21 0.00 0.00 66.02 64.91 2gjx s SER 486 CO 0.39 -4.06 1.05 0.21 0.41 0.00 0.00 173.24 171.24 2gjx s ASN 487 N -3.45 5.69 0.54 2.44 3.84 -1.26 -4.54 114.94 118.19 2gjx s ASN 487 Ca 0.69 1.58 0.23 0.00 0.21 0.00 0.00 52.86 55.56 2gjx s ASN 487 Cb -0.15 -2.49 1.40 0.00 -0.55 0.00 0.00 41.25 39.45 2gjx s ASN 487 CO 0.58 -1.24 2.07 0.50 -2.79 0.00 0.00 177.10 176.22 2gjx h LYS 488 N -0.45 0.00 0.00 0.43 3.64 -1.95 -2.46 116.57 115.77 2gjx h LYS 488 Ca -0.44 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.92 2gjx h LYS 488 Cb 1.20 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.02 2gjx h LYS 488 CO 0.58 0.00 -0.16 -0.07 -2.27 0.00 0.00 179.45 177.53 2gjx h LEU 489 N 0.00 0.00 -8.20 5.20 3.38 -2.03 -3.41 115.31 110.25 2gjx h LEU 489 Ca 0.13 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.58 2gjx h LEU 489 Cb 0.56 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.23 2gjx h LEU 489 CO -0.00 0.09 1.26 -0.89 0.09 0.00 0.00 178.44 178.99 2gjx s THR 490 N -3.17 3.76 0.00 0.22 2.01 -0.93 -4.59 115.64 112.93 2gjx s THR 490 Ca 0.06 -0.42 0.00 0.00 0.31 0.00 0.00 61.69 61.64 2gjx s THR 490 Cb 0.06 -4.75 0.00 0.00 0.01 0.00 0.00 72.50 67.81 2gjx s THR 490 CO 0.69 -1.66 0.00 -1.54 -0.69 0.00 0.00 174.62 171.42 2gjx n SER 491 N 10.24 0.00 -4.64 3.53 3.41 -1.26 -4.88 113.62 120.01 2gjx n SER 491 Ca 0.29 -0.81 -0.42 0.00 -0.26 0.00 0.00 58.87 57.66 2gjx n SER 491 Cb 0.50 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.42 2gjx n SER 491 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2gjx s ASP 492 N 0.00 6.24 0.32 4.04 2.15 -1.26 -4.88 116.67 123.28 2gjx s ASP 492 Ca 0.00 2.20 0.00 0.00 0.43 0.00 0.00 52.55 55.18 2gjx s ASP 492 Cb 0.00 -2.53 0.53 0.00 -0.30 0.00 0.00 42.92 40.63 2gjx s ASP 492 CO 0.00 -1.29 1.97 -0.07 -0.17 0.00 0.00 175.17 175.62 2gjx h LEU 493 N 11.81 0.82 -0.30 -1.34 -0.00 -1.98 0.84 115.31 125.17 2gjx h LEU 493 Ca -0.43 -0.04 -0.05 0.00 -0.00 0.00 0.00 57.88 57.37 2gjx h LEU 493 Cb 1.21 -0.21 -0.01 0.00 -0.00 0.00 0.00 40.66 41.65 2gjx h LEU 493 CO 0.96 0.62 0.00 0.74 -0.00 0.00 0.00 178.44 180.76 2gjx h THR 494 N 0.95 1.26 0.00 0.22 2.02 -2.00 -0.24 112.91 115.12 2gjx h THR 494 Ca 0.25 -0.93 -0.08 0.00 0.77 0.00 0.00 66.41 66.42 2gjx h THR 494 Cb -0.07 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 2gjx h THR 494 CO -0.05 0.30 -0.37 0.15 0.37 0.00 0.00 175.52 175.92 2gjx h PHE 495 N 0.32 0.00 -0.05 3.16 -0.00 -1.86 -2.51 116.94 116.00 2gjx h PHE 495 Ca 0.08 0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 58.03 2gjx h PHE 495 Cb 0.43 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.38 2gjx h PHE 495 CO 0.04 0.37 -0.05 0.00 -0.00 0.00 0.00 178.31 178.66 2gjx h ALA 496 N 1.63 0.07 -0.31 2.41 0.00 -0.56 -3.09 119.26 119.42 2gjx h ALA 496 Ca -0.00 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.68 2gjx h ALA 496 Cb 0.70 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 2gjx h ALA 496 CO 0.05 -0.14 0.08 -0.92 0.00 0.00 0.00 179.25 178.32 2gjx h TYR 497 N -0.32 0.15 -0.45 0.00 3.20 -0.87 0.11 116.97 118.80 2gjx h TYR 497 Ca 0.01 0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.96 2gjx h TYR 497 Cb 0.55 -0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.74 2gjx h TYR 497 CO 0.09 0.05 0.12 0.93 -1.64 0.00 0.00 178.16 177.72 2gjx h GLU 498 N 0.21 0.27 0.07 1.82 5.08 -1.52 -0.15 114.58 120.36 2gjx h GLU 498 Ca 0.14 -0.02 -0.27 0.00 -1.00 0.00 0.00 59.36 58.22 2gjx h GLU 498 Cb 0.13 -0.06 0.02 0.00 0.50 0.00 0.00 28.75 29.34 2gjx h GLU 498 CO -0.17 0.18 -1.13 0.00 -1.00 0.00 0.00 179.01 176.89 2gjx h ARG 499 N 0.27 0.51 -0.49 2.33 3.08 -1.42 -2.68 114.38 115.98 2gjx h ARG 499 Ca 0.22 -0.64 -0.10 0.00 0.07 0.00 0.00 59.98 59.52 2gjx h ARG 499 Cb 0.24 0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 2gjx h ARG 499 CO -0.25 1.26 -0.09 1.25 -1.07 0.00 0.00 179.97 181.07 2gjx h LEU 500 N 0.24 0.93 -0.75 3.04 5.85 -0.60 0.15 115.31 124.18 2gjx h LEU 500 Ca -0.14 -0.35 -0.12 0.00 0.84 0.00 0.00 57.88 58.11 2gjx h LEU 500 Cb 1.80 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.56 2gjx h LEU 500 CO 0.21 1.07 -0.40 0.77 -0.34 0.00 0.00 178.44 179.74 2gjx h SER 501 N 0.79 0.50 0.07 1.25 4.64 -1.12 0.25 113.55 119.93 2gjx h SER 501 Ca 0.13 -0.22 -0.12 0.00 -0.47 0.00 0.00 61.79 61.11 2gjx h SER 501 Cb 0.64 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 2gjx h SER 501 CO 0.04 0.85 -0.41 -0.74 -0.87 0.00 0.00 176.83 175.71 2gjx h HIS 502 N 0.40 0.51 -0.01 4.77 -0.00 -1.26 -2.46 115.15 117.10 2gjx h HIS 502 Ca 0.04 -0.14 -0.16 0.00 -0.00 0.00 0.00 60.37 60.10 2gjx h HIS 502 Cb 0.87 -0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 28.15 2gjx h HIS 502 CO 0.03 0.77 -0.73 0.35 -0.00 0.00 0.00 177.93 178.35 2gjx h PHE 503 N 0.36 0.07 -0.52 5.26 -0.00 -0.31 -2.92 116.94 118.87 2gjx h PHE 503 Ca 0.03 -0.03 -0.06 0.00 -0.00 0.00 0.00 57.97 57.91 2gjx h PHE 503 Cb 0.87 -0.01 -0.02 0.00 -0.00 0.00 0.00 35.95 36.79 2gjx h PHE 503 CO 0.03 0.76 0.11 -0.09 -0.00 0.00 0.00 178.31 179.12 2gjx h ARG 504 N 0.03 0.85 -0.30 1.11 1.12 -0.16 -0.00 114.38 117.03 2gjx h ARG 504 Ca -0.01 -0.21 -0.09 0.00 -1.11 0.00 0.00 59.98 58.56 2gjx h ARG 504 Cb 1.29 -0.11 -0.02 0.00 -0.01 0.00 0.00 29.97 31.13 2gjx h ARG 504 CO 0.10 0.82 -0.19 0.00 -3.11 0.00 0.00 179.97 177.59 2gjx h GLU 506 N 0.49 0.80 -0.47 0.00 4.57 -1.26 -2.07 114.58 116.64 2gjx h GLU 506 Ca 0.08 -0.30 0.00 0.00 -1.18 0.00 0.00 59.36 57.97 2gjx h GLU 506 Cb 0.60 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.12 2gjx h GLU 506 CO 0.04 0.91 0.31 -0.07 -1.18 0.00 0.00 179.01 179.02 2gjx h LEU 507 N 0.71 0.54 -1.14 1.64 3.38 -0.73 -2.00 115.31 117.70 2gjx h LEU 507 Ca 0.11 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.09 2gjx h LEU 507 Cb 0.67 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.24 2gjx h LEU 507 CO 0.05 0.39 0.58 -0.07 0.09 0.00 0.00 178.44 179.49 2gjx h LEU 508 N 0.64 0.98 -1.57 1.67 4.07 -1.19 0.25 115.31 120.15 2gjx h LEU 508 Ca 0.17 -0.02 -0.03 0.00 0.08 0.00 0.00 57.88 58.09 2gjx h LEU 508 Cb -0.07 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.42 2gjx h LEU 508 CO -0.04 0.69 -0.03 -0.09 -1.08 0.00 0.00 178.44 177.89 2gjx h ARG 509 N 1.15 0.24 -0.06 1.13 2.43 -0.76 -0.95 114.38 117.55 2gjx h ARG 509 Ca 0.34 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.47 2gjx h ARG 509 Cb -0.05 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 2gjx h ARG 509 CO -0.09 0.29 0.00 0.54 -1.51 0.00 0.00 179.97 179.20 2gjx n ARG 510 N -4.37 1.42 -0.35 0.20 1.74 -0.39 -4.89 116.66 110.02 2gjx n ARG 510 Ca -0.01 -0.62 0.00 0.00 -0.77 0.00 0.00 57.85 56.46 2gjx n ARG 510 Cb 0.19 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.23 2gjx n ARG 510 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2gjx n GLY 511 N 1.03 0.80 3.71 -0.13 0.00 -0.36 -5.06 105.19 105.19 2gjx n GLY 511 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2gjx n GLY 511 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gjx s VAL 512 N -2.10 4.96 -1.44 1.61 1.01 -0.06 -4.96 120.40 119.41 2gjx s VAL 512 Ca 0.00 1.72 -0.08 0.00 0.00 0.00 0.00 61.98 63.62 2gjx s VAL 512 Cb 0.00 -4.17 0.04 0.00 0.00 0.00 0.00 36.38 32.25 2gjx s VAL 512 CO 0.00 0.20 2.52 1.67 0.00 0.00 0.00 175.10 179.49 2gjx n GLN 513 N 3.93 3.98 -3.14 2.72 7.27 -1.26 -3.62 117.38 127.25 2gjx n GLN 513 Ca 0.02 -2.92 -0.39 0.00 0.07 0.00 0.00 57.00 53.78 2gjx n GLN 513 Cb 0.51 -2.79 -0.05 0.00 2.41 0.00 0.00 30.24 30.31 2gjx n GLN 513 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2gjx s ALA 514 N 0.69 3.46 0.61 1.69 0.00 -1.26 -2.43 121.76 124.51 2gjx s ALA 514 Ca 0.57 0.11 -0.14 0.00 0.00 0.00 0.00 51.96 52.50 2gjx s ALA 514 Cb 0.17 -2.81 -0.03 0.00 0.00 0.00 0.00 23.12 20.44 2gjx s ALA 514 CO -0.07 0.16 1.04 1.14 0.00 0.00 0.00 175.76 178.03 2gjx s GLN 515 N -0.25 3.38 0.51 0.00 -2.07 -1.06 -4.90 119.66 115.26 2gjx s GLN 515 Ca 0.33 1.05 -0.21 0.00 -1.82 0.00 0.00 55.36 54.71 2gjx s GLN 515 Cb -0.19 -2.05 -0.07 0.00 -1.09 0.00 0.00 33.01 29.61 2gjx s GLN 515 CO 0.19 -0.75 1.12 -1.25 -1.32 0.00 0.00 175.29 173.28 2gjx s PRO 516 N -4.43 3.56 0.10 9.60 0.04 -1.26 -4.29 135.00 138.32 2gjx s PRO 516 Ca 0.60 1.59 -0.11 0.00 0.04 0.00 0.00 61.00 63.13 2gjx s PRO 516 Cb -0.14 -2.13 -0.17 0.00 0.04 0.00 0.00 34.50 32.10 2gjx s PRO 516 CO 0.42 -0.67 1.25 -0.07 0.04 0.00 0.00 177.00 177.97 2gjx h LEU 517 N 1.51 0.81 0.00 -3.56 3.38 -1.97 -3.49 115.31 111.98 2gjx h LEU 517 Ca -0.50 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 56.85 2gjx h LEU 517 Cb 1.25 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2gjx h LEU 517 CO 0.58 1.42 0.00 -3.20 0.09 0.00 0.00 178.44 177.33 2gjx n ASN 518 N -3.85 0.00 -4.68 -0.43 2.85 -1.26 -4.65 115.26 103.24 2gjx n ASN 518 Ca -0.09 -0.87 -0.40 0.00 -0.11 0.00 0.00 54.58 53.12 2gjx n ASN 518 Cb 0.84 0.00 0.03 0.00 1.24 0.00 0.00 39.78 41.88 2gjx n ASN 518 CO 0.00 0.00 0.00 1.33 -2.11 0.00 0.00 177.26 176.48 2gjx n VAL 519 N 0.00 3.15 0.00 3.44 0.24 -1.26 -4.85 118.33 119.05 2gjx n VAL 519 Ca 0.00 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.80 2gjx n VAL 519 Cb 0.00 -1.45 0.00 0.00 -1.47 0.00 0.00 33.84 30.92 2gjx n VAL 519 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2gjx n GLY 520 N 0.95 -0.02 3.63 7.63 0.00 -1.26 -5.16 105.19 110.96 2gjx n GLY 520 Ca 0.10 -1.08 -0.03 0.00 0.00 0.00 0.00 46.02 45.00 2gjx n GLY 520 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2gjx s PHE 521 N -4.00 -0.08 -0.02 1.61 -0.71 -1.26 -5.15 117.98 108.37 2gjx s PHE 521 Ca 0.00 0.08 0.04 0.00 -1.04 0.00 0.00 56.93 56.01 2gjx s PHE 521 Cb 0.00 0.50 -0.03 0.00 -1.21 0.00 0.00 43.02 42.28 2gjx s PHE 521 CO 0.00 -0.10 -0.13 0.00 -1.34 0.00 0.00 175.22 173.66 2gjx h GLU 523 N 5.02 1.20 -3.49 0.00 4.22 -2.01 -3.11 114.58 116.42 2gjx h GLU 523 Ca -0.47 -0.07 -0.80 0.00 0.08 0.00 0.00 59.36 58.10 2gjx h GLU 523 Cb 1.16 -0.27 -0.27 0.00 0.50 0.00 0.00 28.75 29.87 2gjx h GLU 523 CO 0.51 0.80 0.69 0.00 -2.18 0.00 0.00 179.01 178.83 2gjx n GLN 524 N -4.46 3.79 -1.76 1.92 0.00 -1.26 -5.04 117.38 110.58 2gjx n GLN 524 Ca 0.12 -4.40 -0.37 0.00 0.00 0.00 0.00 57.00 52.35 2gjx n GLN 524 Cb 0.07 -2.60 0.06 0.00 0.00 0.00 0.00 30.24 27.77 2gjx n GLN 524 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 2gjx s GLU 525 N -1.39 2.74 0.02 2.61 2.56 -1.18 -4.74 118.70 119.32 2gjx s GLU 525 Ca 0.32 2.12 -0.30 0.00 0.00 0.00 0.00 54.97 57.11 2gjx s GLU 525 Cb -0.05 -1.97 -0.06 0.00 2.00 0.00 0.00 34.13 34.05 2gjx s GLU 525 CO -0.02 -1.47 1.51 0.12 -0.56 0.00 0.00 175.26 174.84 2gjx s PHE 526 N -1.36 2.64 -0.29 5.30 5.36 -1.26 -4.97 117.98 123.40 2gjx s PHE 526 Ca 0.79 0.60 0.04 0.00 -0.96 0.00 0.00 56.93 57.40 2gjx s PHE 526 Cb -0.38 -3.78 0.19 0.00 -0.34 0.00 0.00 43.02 38.70 2gjx s PHE 526 CO 0.42 -3.03 0.53 -1.83 -1.46 0.00 0.00 175.22 169.85 2gjx s GLU 527 N 2.61 0.51 0.00 10.12 -1.05 -1.26 -5.21 118.70 124.42 2gjx s GLU 527 Ca 0.68 0.47 0.00 0.00 -0.15 0.00 0.00 54.97 55.96 2gjx s GLU 527 Cb -0.34 0.09 0.00 0.00 -0.44 0.00 0.00 34.13 33.44 2gjx s GLU 527 CO 0.28 -0.99 0.00 0.94 0.95 0.00 0.00 175.26 176.44