#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 0.36 0.98 1.96 -0.11 -1.26 -4.06 118.94 116.82 2gjx s TRP 24 Ca 0.00 -0.01 -0.17 0.00 1.22 0.00 0.00 56.10 57.15 2gjx s TRP 24 Cb 0.00 -0.49 0.23 0.00 -1.50 0.00 0.00 33.47 31.70 2gjx s TRP 24 CO 0.00 -0.17 1.26 -0.35 -4.62 0.00 0.00 176.95 173.07 2gjx n PRO 25 N 4.43 -1.50 -3.04 5.86 -0.04 -1.26 -4.74 135.00 134.70 2gjx n PRO 25 Ca -0.21 -1.96 -0.40 0.00 -0.04 0.00 0.00 63.50 60.89 2gjx n PRO 25 Cb 0.50 -1.37 -0.05 0.00 -0.04 0.00 0.00 33.50 32.55 2gjx n PRO 25 CO 0.00 0.00 0.00 -0.46 -0.04 0.00 0.00 175.50 175.00 2gjx s TRP 26 N -3.71 3.47 0.94 0.54 -0.11 -1.26 -5.03 118.94 113.78 2gjx s TRP 26 Ca 0.73 1.13 -0.11 0.00 1.22 0.00 0.00 56.10 59.07 2gjx s TRP 26 Cb -0.03 -2.84 0.16 0.00 -1.50 0.00 0.00 33.47 29.26 2gjx s TRP 26 CO 0.52 -0.07 1.10 -2.14 -4.62 0.00 0.00 176.95 171.74 2gjx s PRO 27 N 1.46 0.88 0.03 5.86 0.02 -1.26 -4.24 135.00 137.74 2gjx s PRO 27 Ca 0.34 1.20 -0.29 0.00 0.02 0.00 0.00 61.00 62.28 2gjx s PRO 27 Cb -0.17 -1.74 -0.16 0.00 0.02 0.00 0.00 34.50 32.45 2gjx s PRO 27 CO 0.14 -2.62 1.26 1.96 -0.33 0.00 0.00 177.00 177.41 2gjx h GLN 28 N -1.84 -0.92 -6.28 5.54 1.08 -1.86 -3.44 115.11 107.38 2gjx h GLN 28 Ca -0.48 0.06 -0.68 0.00 -1.45 0.00 0.00 58.65 56.10 2gjx h GLN 28 Cb 1.28 0.21 -0.20 0.00 -0.05 0.00 0.00 27.48 28.72 2gjx h GLN 28 CO 0.47 -0.59 -0.73 -0.80 -0.95 0.00 0.00 178.83 176.23 2gjx s ASN 29 N -4.44 4.37 -0.30 1.46 0.02 -0.50 -4.96 114.94 110.59 2gjx s ASN 29 Ca -0.15 -0.14 0.03 0.00 -1.02 0.00 0.00 52.86 51.57 2gjx s ASN 29 Cb 0.02 -0.99 0.17 0.00 0.02 0.00 0.00 41.25 40.46 2gjx s ASN 29 CO 0.49 0.33 0.44 0.12 0.02 0.00 0.00 177.10 178.50 2gjx s PHE 30 N -0.85 -1.13 -0.39 2.20 5.36 -1.26 -2.83 117.98 119.09 2gjx s PHE 30 Ca 0.14 0.36 -0.17 0.00 -0.96 0.00 0.00 56.93 56.30 2gjx s PHE 30 Cb -0.11 -0.08 0.01 0.00 -0.34 0.00 0.00 43.02 42.50 2gjx s PHE 30 CO 0.03 -1.01 0.45 -0.65 -1.46 0.00 0.00 175.22 172.58 2gjx s GLN 31 N 2.49 3.35 0.35 10.12 1.11 0.76 -4.98 119.66 132.86 2gjx s GLN 31 Ca 0.10 -0.51 0.08 0.00 0.01 0.00 0.00 55.36 55.04 2gjx s GLN 31 Cb -0.12 -3.89 -0.03 0.00 -1.01 0.00 0.00 33.01 27.96 2gjx s GLN 31 CO -0.27 -0.73 0.23 -0.08 0.01 0.00 0.00 175.29 174.44 2gjx s THR 32 N 2.21 3.13 0.24 -0.19 -1.32 -1.26 -0.61 115.64 117.85 2gjx s THR 32 Ca 0.14 -1.54 -0.19 0.00 -1.21 0.00 0.00 61.69 58.90 2gjx s THR 32 Cb -0.16 -3.06 0.02 0.00 -1.51 0.00 0.00 72.50 67.79 2gjx s THR 32 CO 0.13 -0.15 0.62 -0.55 -2.21 0.00 0.00 174.62 172.46 2gjx s SER 33 N -3.94 -0.25 0.00 8.08 0.15 -1.13 -4.98 113.70 111.63 2gjx s SER 33 Ca 0.40 -0.59 0.22 0.00 0.70 0.00 0.00 55.95 56.68 2gjx s SER 33 Cb -0.03 0.66 0.57 0.00 -1.71 0.00 0.00 66.02 65.50 2gjx s SER 33 CO 0.25 -1.21 1.46 0.47 1.20 0.00 0.00 173.24 175.41 2gjx n ASP 34 N -0.41 2.56 -4.61 5.45 10.43 -1.26 -4.39 116.55 124.32 2gjx n ASP 34 Ca -0.06 -1.86 -0.43 0.00 2.57 0.00 0.00 54.79 55.01 2gjx n ASP 34 Cb 0.61 -0.17 -0.03 0.00 1.84 0.00 0.00 41.12 43.37 2gjx n ASP 34 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 2gjx s GLN 35 N -1.66 3.50 0.20 -1.24 -1.52 -1.26 -4.92 119.66 112.76 2gjx s GLN 35 Ca 0.35 1.77 -0.14 0.00 -1.95 0.00 0.00 55.36 55.39 2gjx s GLN 35 Cb 0.20 -4.19 -0.07 0.00 -0.22 0.00 0.00 33.01 28.72 2gjx s GLN 35 CO 0.29 -1.67 0.60 1.03 -0.25 0.00 0.00 175.29 175.29 2gjx s ARG 36 N 5.43 3.99 -0.04 2.91 0.52 -1.26 -0.48 118.95 130.02 2gjx s ARG 36 Ca 0.84 0.53 0.01 0.00 -0.52 0.00 0.00 55.73 56.58 2gjx s ARG 36 Cb -0.28 -2.80 0.02 0.00 0.52 0.00 0.00 34.95 32.42 2gjx s ARG 36 CO 0.34 0.39 -0.04 0.71 0.02 0.00 0.00 175.30 176.72 2gjx s TYR 37 N -1.62 0.65 0.37 -0.53 1.51 -0.49 -4.00 117.35 113.24 2gjx s TYR 37 Ca 0.43 -0.16 -0.24 0.00 -1.01 0.00 0.00 57.07 56.09 2gjx s TYR 37 Cb -0.14 -0.60 -0.10 0.00 -0.11 0.00 0.00 41.96 41.01 2gjx s TYR 37 CO 0.20 -0.17 0.96 0.08 -1.11 0.00 0.00 175.55 175.50 2gjx s VAL 38 N 0.89 4.23 0.38 0.71 1.01 -1.00 -1.56 120.40 125.05 2gjx s VAL 38 Ca -0.11 1.66 0.08 0.00 0.00 0.00 0.00 61.98 63.61 2gjx s VAL 38 Cb -0.14 -3.83 -0.06 0.00 0.00 0.00 0.00 36.38 32.35 2gjx s VAL 38 CO -0.00 -0.03 0.06 -0.76 0.00 0.00 0.00 175.10 174.36 2gjx s LEU 39 N -2.51 2.99 -0.38 3.92 1.43 -1.12 -0.90 118.68 122.12 2gjx s LEU 39 Ca 0.55 -1.10 0.01 0.00 -1.03 0.00 0.00 54.13 52.56 2gjx s LEU 39 Cb -0.16 -1.27 0.14 0.00 0.03 0.00 0.00 46.19 44.93 2gjx s LEU 39 CO 0.20 -0.37 0.23 -0.31 0.23 0.00 0.00 176.35 176.33 2gjx s TYR 40 N -2.59 1.00 0.17 0.29 2.02 -1.26 -4.78 117.35 112.21 2gjx s TYR 40 Ca 0.37 -1.84 -0.25 0.00 -0.37 0.00 0.00 57.07 54.97 2gjx s TYR 40 Cb 0.03 -1.11 0.04 0.00 -0.40 0.00 0.00 41.96 40.53 2gjx s TYR 40 CO 0.20 -0.82 1.57 -1.00 -1.57 0.00 0.00 175.55 173.93 2gjx h PRO 41 N 6.83 -0.22 -0.74 -1.71 0.13 -1.96 -2.20 132.00 132.12 2gjx h PRO 41 Ca 0.07 0.02 0.09 0.00 -0.87 0.00 0.00 66.00 65.30 2gjx h PRO 41 Cb 0.95 0.05 -0.10 0.00 0.13 0.00 0.00 31.00 32.03 2gjx h PRO 41 CO 0.32 -0.15 -0.36 0.09 -0.23 0.00 0.00 178.00 177.67 2gjx n ASN 42 N -5.41 -0.63 -3.11 1.44 3.02 -1.26 -3.03 115.26 106.28 2gjx n ASN 42 Ca 0.02 1.30 -0.19 0.00 -0.03 0.00 0.00 54.58 55.68 2gjx n ASN 42 Cb 0.35 -0.23 -0.03 0.00 -0.61 0.00 0.00 39.78 39.26 2gjx n ASN 42 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2gjx n ASN 43 N -5.01 1.49 -4.63 6.41 5.03 -1.14 -5.06 115.26 112.36 2gjx n ASN 43 Ca 0.05 -3.11 -0.41 0.00 0.87 0.00 0.00 54.58 51.97 2gjx n ASN 43 Cb 0.24 -0.60 -0.05 0.00 -1.02 0.00 0.00 39.78 38.35 2gjx n ASN 43 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 2gjx s PHE 44 N -2.65 3.28 -0.06 3.10 5.36 -0.84 -4.98 117.98 121.19 2gjx s PHE 44 Ca 0.41 1.00 -0.01 0.00 -0.96 0.00 0.00 56.93 57.37 2gjx s PHE 44 Cb 0.35 -3.03 -0.03 0.00 -0.34 0.00 0.00 43.02 39.96 2gjx s PHE 44 CO -0.08 -0.41 0.01 1.14 -1.46 0.00 0.00 175.22 174.41 2gjx s GLN 45 N 2.78 2.93 -0.15 10.12 -2.07 -0.85 -5.00 119.66 127.43 2gjx s GLN 45 Ca 0.32 -0.47 -0.12 0.00 -1.82 0.00 0.00 55.36 53.28 2gjx s GLN 45 Cb -0.15 -2.76 -0.05 0.00 -1.09 0.00 0.00 33.01 28.96 2gjx s GLN 45 CO 0.09 0.68 0.23 -0.06 -1.32 0.00 0.00 175.29 174.91 2gjx s PHE 46 N -0.96 3.49 0.04 9.60 0.40 -1.26 -2.90 117.98 126.39 2gjx s PHE 46 Ca 0.16 0.55 -0.03 0.00 -0.60 0.00 0.00 56.93 57.00 2gjx s PHE 46 Cb -0.11 -2.22 -0.02 0.00 0.51 0.00 0.00 43.02 41.18 2gjx s PHE 46 CO 0.05 0.37 0.04 1.14 0.70 0.00 0.00 175.22 177.53 2gjx s GLN 47 N 0.05 0.52 0.62 0.44 -2.07 -1.19 -5.00 119.66 113.04 2gjx s GLN 47 Ca 0.15 -0.81 -0.05 0.00 -1.82 0.00 0.00 55.36 52.83 2gjx s GLN 47 Cb -0.13 0.20 0.03 0.00 -1.09 0.00 0.00 33.01 32.03 2gjx s GLN 47 CO 0.03 -0.12 0.91 0.71 -1.32 0.00 0.00 175.29 175.51 2gjx s TYR 48 N -2.57 3.04 0.09 9.60 1.51 -1.26 -1.13 117.35 126.63 2gjx s TYR 48 Ca -0.05 0.42 0.06 0.00 -1.01 0.00 0.00 57.07 56.49 2gjx s TYR 48 Cb -0.02 -2.90 -0.04 0.00 -0.11 0.00 0.00 41.96 38.89 2gjx s TYR 48 CO -0.05 -1.05 -0.06 0.16 -1.11 0.00 0.00 175.55 173.45 2gjx s ASP 49 N -4.41 4.64 0.03 2.29 3.84 -1.09 -4.77 116.67 117.20 2gjx s ASP 49 Ca 0.57 -0.30 0.00 0.00 -0.00 0.00 0.00 52.55 52.82 2gjx s ASP 49 Cb -0.11 -0.98 0.00 0.00 -1.38 0.00 0.00 42.92 40.45 2gjx s ASP 49 CO 0.43 0.18 0.24 1.33 -0.00 0.00 0.00 175.17 177.36 2gjx n VAL 50 N 0.70 0.00 0.00 2.11 0.24 -1.26 -0.58 118.33 119.54 2gjx n VAL 50 Ca -0.13 0.24 0.00 0.00 -2.04 0.00 0.00 64.34 62.42 2gjx n VAL 50 Cb 0.52 -0.69 0.00 0.00 -1.47 0.00 0.00 33.84 32.20 2gjx n VAL 50 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2gjx n SER 51 N -0.53 0.00 -4.87 -1.34 7.64 -1.26 -5.01 113.62 108.25 2gjx n SER 51 Ca 0.00 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.58 2gjx n SER 51 Cb 0.24 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.41 2gjx n SER 51 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2gjx s SER 52 N -0.99 6.53 0.18 6.43 0.15 0.25 -4.98 113.70 121.28 2gjx s SER 52 Ca 0.00 1.15 0.03 0.00 0.70 0.00 0.00 55.95 57.83 2gjx s SER 52 Cb 0.00 -2.33 0.06 0.00 -1.71 0.00 0.00 66.02 62.04 2gjx s SER 52 CO 0.00 -0.40 1.42 0.00 1.20 0.00 0.00 173.24 175.46 2gjx h ALA 53 N 1.26 0.60 -2.87 5.45 0.00 0.90 -3.43 119.26 121.17 2gjx h ALA 53 Ca -0.47 -0.67 -0.58 0.00 0.00 0.00 0.00 54.91 53.18 2gjx h ALA 53 Cb 1.19 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 18.82 2gjx h ALA 53 CO 0.64 0.86 -0.12 0.00 0.00 0.00 0.00 179.25 180.63 2gjx s ALA 54 N -3.37 3.50 0.12 0.00 0.00 -1.24 -4.86 121.76 115.91 2gjx s ALA 54 Ca -0.03 -0.26 -0.00 0.00 0.00 0.00 0.00 51.96 51.67 2gjx s ALA 54 Cb 0.11 -2.68 -0.04 0.00 0.00 0.00 0.00 23.12 20.50 2gjx s ALA 54 CO 0.82 -0.12 0.02 -1.14 0.00 0.00 0.00 175.76 175.35 2gjx s GLN 55 N 0.89 0.90 -0.49 0.00 2.00 -1.26 -4.76 119.66 116.93 2gjx s GLN 55 Ca 0.25 -1.41 -0.44 0.00 -2.00 0.00 0.00 55.36 51.76 2gjx s GLN 55 Cb -0.15 0.10 -0.19 0.00 0.80 0.00 0.00 33.01 33.57 2gjx s GLN 55 CO 0.10 -0.19 2.09 -2.30 -0.50 0.00 0.00 175.29 174.49 2gjx n PRO 56 N -0.08 0.00 0.00 1.67 -0.02 -1.26 -1.43 135.00 133.88 2gjx n PRO 56 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.40 2gjx n PRO 56 Cb 0.63 -1.48 0.00 0.00 -0.02 0.00 0.00 33.50 32.62 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 7.25 0.66 3.55 -1.23 0.00 -1.26 -5.08 105.19 109.08 2gjx n GLY 57 Ca 0.53 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.16 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 14.20 0.70 0.24 0.00 4.64 -1.92 -1.40 113.55 130.01 2gjx h SER 59 Ca -0.27 0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.11 2gjx h SER 59 Cb 1.15 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2gjx h SER 59 CO 1.21 0.28 -0.11 0.58 -0.87 0.00 0.00 176.83 177.92 2gjx h VAL 60 N 0.70 0.78 -0.12 0.95 2.07 -1.89 -3.23 116.25 115.51 2gjx h VAL 60 Ca 0.53 -0.82 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 2gjx h VAL 60 Cb 0.90 1.20 -0.00 0.00 -1.52 0.00 0.00 31.29 31.87 2gjx h VAL 60 CO -0.30 0.16 -0.06 -0.07 0.02 0.00 0.00 177.57 177.32 2gjx h LEU 61 N -0.78 0.26 -0.74 2.57 -0.00 -1.88 -1.54 115.31 113.21 2gjx h LEU 61 Ca -0.03 -0.41 0.17 0.00 -0.00 0.00 0.00 57.88 57.60 2gjx h LEU 61 Cb 0.51 -0.07 -0.12 0.00 -0.00 0.00 0.00 40.66 40.97 2gjx h LEU 61 CO 0.05 0.62 0.05 0.44 -0.00 0.00 0.00 178.44 179.61 2gjx h ASP 62 N -0.09 -0.24 -0.29 -0.43 3.32 -1.41 0.27 116.42 117.54 2gjx h ASP 62 Ca 0.03 0.18 -0.16 0.00 0.02 0.00 0.00 57.03 57.10 2gjx h ASP 62 Cb 0.52 0.30 -0.01 0.00 0.22 0.00 0.00 39.33 40.36 2gjx h ASP 62 CO 0.02 -0.14 -0.41 -0.33 -1.72 0.00 0.00 179.24 176.66 2gjx h GLU 63 N 0.14 0.85 -0.75 3.56 3.07 -1.56 -3.19 114.58 116.70 2gjx h GLU 63 Ca 0.41 -0.45 -0.03 0.00 -0.50 0.00 0.00 59.36 58.78 2gjx h GLU 63 Cb 0.71 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.61 2gjx h GLU 63 CO -0.61 1.10 0.34 0.00 -1.40 0.00 0.00 179.01 178.44 2gjx h ALA 64 N 0.84 1.19 -0.69 3.43 0.00 0.08 0.25 119.26 124.35 2gjx h ALA 64 Ca 0.05 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2gjx h ALA 64 Cb 0.98 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2gjx h ALA 64 CO 0.09 0.61 0.25 0.74 0.00 0.00 0.00 179.25 180.94 2gjx h PHE 65 N 1.08 1.06 0.06 0.00 0.04 -0.56 -0.87 116.94 117.74 2gjx h PHE 65 Ca 0.26 -0.08 -0.19 0.00 2.80 0.00 0.00 57.97 60.76 2gjx h PHE 65 Cb 0.14 -0.32 0.02 0.00 2.20 0.00 0.00 35.95 37.99 2gjx h PHE 65 CO 0.01 0.82 -0.78 1.96 -0.60 0.00 0.00 178.31 179.72 2gjx h GLN 66 N 1.01 0.42 -0.75 1.51 1.08 -1.47 -2.26 115.11 114.65 2gjx h GLN 66 Ca 0.23 -0.54 0.01 0.00 -1.45 0.00 0.00 58.65 56.91 2gjx h GLN 66 Cb 0.24 0.17 -0.04 0.00 -0.05 0.00 0.00 27.48 27.80 2gjx h GLN 66 CO -0.01 1.20 0.49 -0.09 -0.95 0.00 0.00 178.83 179.46 2gjx h ARG 67 N -0.11 0.96 0.00 1.46 2.43 -0.88 -1.29 114.38 116.95 2gjx h ARG 67 Ca -0.12 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 58.88 2gjx h ARG 67 Cb 1.52 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 30.84 2gjx h ARG 67 CO 0.15 0.64 -0.55 1.88 -1.51 0.00 0.00 179.97 180.58 2gjx h TYR 68 N 0.99 0.00 -0.23 2.20 0.05 -1.25 -2.38 116.97 116.35 2gjx h TYR 68 Ca 0.28 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.98 2gjx h TYR 68 Cb -0.08 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.64 2gjx h TYR 68 CO -0.02 0.55 -0.22 -0.09 -1.05 0.00 0.00 178.16 177.33 2gjx h ARG 69 N 0.00 0.42 -0.14 4.88 2.43 -0.80 -1.67 114.38 119.50 2gjx h ARG 69 Ca -0.01 -0.14 -0.07 0.00 -0.81 0.00 0.00 59.98 58.95 2gjx h ARG 69 Cb 1.14 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.66 2gjx h ARG 69 CO 0.07 0.62 -0.20 0.22 -1.51 0.00 0.00 179.97 179.17 2gjx h ASP 70 N 0.38 0.41 -0.76 -3.80 3.58 -1.05 0.03 116.42 115.21 2gjx h ASP 70 Ca 0.06 -0.52 -0.00 0.00 0.42 0.00 0.00 57.03 56.99 2gjx h ASP 70 Cb 0.60 -0.12 -0.04 0.00 1.72 0.00 0.00 39.33 41.49 2gjx h ASP 70 CO 0.04 0.85 0.46 -0.07 -2.88 0.00 0.00 179.24 177.65 2gjx h LEU 71 N -0.02 0.90 0.08 2.28 4.07 -1.33 -3.12 115.31 118.18 2gjx h LEU 71 Ca 0.01 -0.06 -0.27 0.00 0.08 0.00 0.00 57.88 57.65 2gjx h LEU 71 Cb 0.76 -0.23 0.03 0.00 1.08 0.00 0.00 40.66 42.30 2gjx h LEU 71 CO 0.05 0.69 -1.09 -0.07 -1.08 0.00 0.00 178.44 176.94 2gjx h LEU 72 N 1.03 0.82 -7.75 1.67 4.07 -1.34 -3.46 115.31 110.36 2gjx h LEU 72 Ca 0.27 -0.81 -0.43 0.00 0.08 0.00 0.00 57.88 56.99 2gjx h LEU 72 Cb -0.05 -0.26 -0.34 0.00 1.08 0.00 0.00 40.66 41.09 2gjx h LEU 72 CO -0.05 1.53 -0.78 -0.36 -1.08 0.00 0.00 178.44 177.70 2gjx s PHE 73 N -3.04 0.88 0.00 1.13 0.08 -0.01 -5.10 117.98 111.92 2gjx s PHE 73 Ca -0.10 -0.28 0.00 0.00 0.12 0.00 0.00 56.93 56.67 2gjx s PHE 73 Cb 0.05 -0.77 0.00 0.00 -0.57 0.00 0.00 43.02 41.74 2gjx s PHE 73 CO 0.91 -0.23 0.00 0.41 -0.10 0.00 0.00 175.22 176.21 2gjx n GLY 74 N 4.17 1.26 0.00 4.36 0.00 -1.25 -4.00 105.19 109.72 2gjx n GLY 74 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.06 0.00 -4.01 2.61 -1.04 -1.26 -5.05 114.28 104.48 2gjx n THR 89 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.88 2gjx n THR 89 Cb 0.00 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.37 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 2.05 -0.15 -4.42 2.34 -1.26 -2.38 118.68 114.85 2gjx s LEU 90 Ca 0.00 -0.13 0.01 0.00 0.06 0.00 0.00 54.13 54.08 2gjx s LEU 90 Cb 0.00 -0.11 0.02 0.00 -0.56 0.00 0.00 46.19 45.54 2gjx s LEU 90 CO 0.00 -0.02 -0.18 -1.61 -1.06 0.00 0.00 176.35 173.48 2gjx s GLU 91 N -0.31 2.72 0.00 1.48 0.41 -0.07 -4.90 118.70 118.03 2gjx s GLU 91 Ca -0.01 -0.73 0.03 0.00 -0.41 0.00 0.00 54.97 53.84 2gjx s GLU 91 Cb -0.03 -2.34 0.03 0.00 -1.78 0.00 0.00 34.13 30.01 2gjx s GLU 91 CO -0.00 -0.16 0.64 1.63 -0.49 0.00 0.00 175.26 176.88 2gjx n LYS 92 N 4.50 -0.23 -3.61 1.61 5.02 -1.26 -4.25 118.16 119.94 2gjx n LYS 92 Ca -0.19 -0.77 -0.16 0.00 -2.02 0.00 0.00 58.31 55.17 2gjx n LYS 92 Cb 0.50 -1.05 -0.07 0.00 -0.02 0.00 0.00 35.03 34.39 2gjx n LYS 92 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2gjx s ASN 93 N -0.31 -0.60 -0.22 4.39 3.84 -1.26 -2.00 114.94 118.79 2gjx s ASN 93 Ca 0.03 0.87 0.01 0.00 0.21 0.00 0.00 52.86 53.98 2gjx s ASN 93 Cb 0.02 0.83 0.05 0.00 -0.55 0.00 0.00 41.25 41.60 2gjx s ASN 93 CO 0.03 -0.42 -0.10 0.54 -2.79 0.00 0.00 177.10 174.36 2gjx s VAL 94 N -0.57 1.76 0.13 -5.21 0.11 -1.14 -4.80 120.40 110.68 2gjx s VAL 94 Ca -0.07 -1.20 -0.30 0.00 -2.93 0.00 0.00 61.98 57.48 2gjx s VAL 94 Cb -0.03 -1.87 -0.07 0.00 -1.53 0.00 0.00 36.38 32.89 2gjx s VAL 94 CO 0.05 0.08 1.15 -0.76 -3.33 0.00 0.00 175.10 172.29 2gjx s LEU 95 N 1.32 4.43 -0.10 2.54 1.02 -0.53 -3.18 118.68 124.18 2gjx s LEU 95 Ca -0.04 2.06 0.04 0.00 0.02 0.00 0.00 54.13 56.21 2gjx s LEU 95 Cb -0.18 -3.59 -0.00 0.00 0.02 0.00 0.00 46.19 42.44 2gjx s LEU 95 CO -0.07 -0.34 -0.23 -0.69 0.02 0.00 0.00 176.35 175.04 2gjx s VAL 96 N 0.34 2.18 -0.10 -1.59 1.01 -0.28 0.44 120.40 122.39 2gjx s VAL 96 Ca 0.53 -0.98 -0.03 0.00 0.00 0.00 0.00 61.98 61.50 2gjx s VAL 96 Cb -0.29 -1.84 0.04 0.00 0.00 0.00 0.00 36.38 34.29 2gjx s VAL 96 CO 0.33 0.56 0.06 0.54 0.00 0.00 0.00 175.10 176.59 2gjx s VAL 97 N 0.30 -0.01 -0.16 2.92 0.11 -0.80 -2.67 120.40 120.07 2gjx s VAL 97 Ca -0.17 0.12 -0.08 0.00 -2.93 0.00 0.00 61.98 58.92 2gjx s VAL 97 Cb -0.17 -0.40 -0.04 0.00 -1.53 0.00 0.00 36.38 34.23 2gjx s VAL 97 CO 0.08 -0.00 0.13 -0.55 -3.33 0.00 0.00 175.10 171.42 2gjx s SER 98 N 2.12 6.23 -0.15 3.54 0.15 -1.26 -2.30 113.70 122.02 2gjx s SER 98 Ca 0.04 0.32 -0.07 0.00 0.70 0.00 0.00 55.95 56.94 2gjx s SER 98 Cb -0.14 -2.06 -0.24 0.00 -1.71 0.00 0.00 66.02 61.88 2gjx s SER 98 CO -0.06 0.29 0.24 1.33 1.20 0.00 0.00 173.24 176.24 2gjx n VAL 99 N 2.80 1.71 -2.65 4.45 0.24 -0.87 0.13 118.33 124.14 2gjx n VAL 99 Ca -0.18 -0.58 -0.43 0.00 -2.04 0.00 0.00 64.34 61.11 2gjx n VAL 99 Cb 0.53 -1.72 -0.02 0.00 -1.47 0.00 0.00 33.84 31.16 2gjx n VAL 99 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2gjx s VAL 100 N -2.53 4.68 0.25 3.34 1.01 -0.32 -4.51 120.40 122.31 2gjx s VAL 100 Ca -0.25 1.99 0.01 0.00 0.00 0.00 0.00 61.98 63.72 2gjx s VAL 100 Cb 0.07 -4.28 0.02 0.00 0.00 0.00 0.00 36.38 32.19 2gjx s VAL 100 CO 0.72 -0.10 1.63 0.71 0.00 0.00 0.00 175.10 178.07 2gjx h THR 101 N 5.29 1.30 0.00 3.92 1.35 -1.88 -3.42 112.91 119.47 2gjx h THR 101 Ca -0.25 -1.52 -0.15 0.00 -0.55 0.00 0.00 66.41 63.95 2gjx h THR 101 Cb 1.10 1.55 -0.02 0.00 -1.73 0.00 0.00 68.15 69.05 2gjx h THR 101 CO 0.93 0.47 0.44 -2.65 -0.25 0.00 0.00 175.52 174.45 2gjx n PRO 102 N -4.04 0.00 -0.62 4.72 -0.02 -1.26 -4.65 135.00 129.13 2gjx n PRO 102 Ca -0.01 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.23 2gjx n PRO 102 Cb 0.49 -0.39 0.02 0.00 -0.02 0.00 0.00 33.50 33.60 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 1.75 -1.98 0.99 -1.23 0.00 -1.26 -4.78 105.19 98.68 2gjx n GLY 103 Ca 0.17 -0.12 0.09 0.00 0.00 0.00 0.00 46.02 46.16 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 1.07 2.88 -4.74 0.00 4.13 -1.26 -4.17 115.26 113.17 2gjx n ASN 105 Ca 0.18 -1.89 -0.25 0.00 1.68 0.00 0.00 54.58 54.29 2gjx n ASN 105 Cb 0.46 -0.05 -0.06 0.00 -1.54 0.00 0.00 39.78 38.58 2gjx n ASN 105 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2gjx s GLN 106 N -1.66 2.67 0.35 3.52 1.03 -1.25 -5.11 119.66 119.20 2gjx s GLN 106 Ca 0.27 -1.03 -0.27 0.00 0.04 0.00 0.00 55.36 54.38 2gjx s GLN 106 Cb 0.18 -2.49 -0.09 0.00 0.03 0.00 0.00 33.01 30.64 2gjx s GLN 106 CO 0.27 0.45 1.11 -0.51 -2.54 0.00 0.00 175.29 174.07 2gjx s LEU 107 N -3.19 4.33 0.38 2.60 2.01 -1.26 -5.03 118.68 118.52 2gjx s LEU 107 Ca 0.30 2.24 -0.24 0.00 0.01 0.00 0.00 54.13 56.43 2gjx s LEU 107 Cb -0.09 -3.90 -0.09 0.00 0.01 0.00 0.00 46.19 42.12 2gjx s LEU 107 CO 0.21 -0.40 1.02 -2.16 1.01 0.00 0.00 176.35 176.03 2gjx s PRO 108 N -2.00 4.28 0.44 1.29 0.04 -1.26 -5.07 135.00 132.73 2gjx s PRO 108 Ca 0.52 1.45 0.03 0.00 0.04 0.00 0.00 61.00 63.04 2gjx s PRO 108 Cb -0.29 -2.59 -0.02 0.00 0.04 0.00 0.00 34.50 31.64 2gjx s PRO 108 CO 0.37 -0.03 0.11 0.95 0.04 0.00 0.00 177.00 178.44 2gjx s THR 109 N -1.67 0.65 0.45 1.26 -4.23 -1.26 -4.78 115.64 106.06 2gjx s THR 109 Ca 0.56 -2.00 0.22 0.00 -1.18 0.00 0.00 61.69 59.29 2gjx s THR 109 Cb -0.21 -2.25 0.26 0.00 1.34 0.00 0.00 72.50 71.64 2gjx s THR 109 CO 0.26 0.00 2.06 0.25 -0.54 0.00 0.00 174.62 176.66 2gjx h LEU 110 N 1.64 0.00 -1.91 4.79 5.85 -1.97 -2.46 115.31 121.25 2gjx h LEU 110 Ca -0.36 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.36 2gjx h LEU 110 Cb 1.29 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.32 2gjx h LEU 110 CO 0.59 0.13 0.00 -0.62 -0.34 0.00 0.00 178.44 178.20 2gjx n GLU 111 N -3.96 2.21 -2.12 1.25 4.71 -1.26 -4.84 120.64 116.63 2gjx n GLU 111 Ca -0.02 -1.88 -0.40 0.00 -0.01 0.00 0.00 57.16 54.86 2gjx n GLU 111 Cb 0.22 -1.43 -0.01 0.00 -1.01 0.00 0.00 31.44 29.21 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 -1.12 6.51 -0.26 1.62 0.01 -0.93 -5.00 113.70 114.53 2gjx s SER 112 Ca 0.36 2.60 -0.13 0.00 1.31 0.00 0.00 55.95 60.09 2gjx s SER 112 Cb 0.19 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.74 2gjx s SER 112 CO 0.25 -0.70 0.27 -0.69 0.41 0.00 0.00 173.24 172.78 2gjx s VAL 113 N -1.24 5.26 -0.20 3.43 1.01 -1.26 -4.97 120.40 122.42 2gjx s VAL 113 Ca 0.54 0.37 0.16 0.00 0.00 0.00 0.00 61.98 63.05 2gjx s VAL 113 Cb -0.37 -3.61 0.58 0.00 0.00 0.00 0.00 36.38 32.98 2gjx s VAL 113 CO 0.48 0.23 1.49 -0.62 0.00 0.00 0.00 175.10 176.68 2gjx n GLU 114 N 4.99 3.17 -1.90 2.72 1.02 -1.26 -3.92 120.64 125.45 2gjx n GLU 114 Ca -0.12 -2.92 -0.39 0.00 -0.02 0.00 0.00 57.16 53.71 2gjx n GLU 114 Cb 0.51 -1.92 0.01 0.00 -0.02 0.00 0.00 31.44 30.02 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 -1.78 6.00 0.09 1.62 -0.87 -1.26 -4.47 114.94 114.26 2gjx s ASN 115 Ca 0.45 2.79 -0.26 0.00 -1.57 0.00 0.00 52.86 54.27 2gjx s ASN 115 Cb 0.36 -2.65 0.07 0.00 -0.02 0.00 0.00 41.25 39.02 2gjx s ASN 115 CO 0.10 -1.08 0.64 -0.72 -2.57 0.00 0.00 177.10 173.46 2gjx s TYR 116 N -1.24 -0.57 0.13 2.20 1.13 -0.94 -2.51 117.35 115.54 2gjx s TYR 116 Ca 0.60 0.56 0.06 0.00 -1.41 0.00 0.00 57.07 56.88 2gjx s TYR 116 Cb -0.41 0.51 -0.04 0.00 -1.10 0.00 0.00 41.96 40.93 2gjx s TYR 116 CO 0.52 -0.76 -0.14 0.95 -2.51 0.00 0.00 175.55 173.61 2gjx s THR 117 N -2.95 1.33 -0.24 -3.49 -4.23 0.31 -1.57 115.64 104.79 2gjx s THR 117 Ca -0.02 -1.76 -0.04 0.00 -1.18 0.00 0.00 61.69 58.69 2gjx s THR 117 Cb -0.01 -1.57 0.09 0.00 1.34 0.00 0.00 72.50 72.35 2gjx s THR 117 CO -0.06 -0.45 0.14 -0.22 -0.54 0.00 0.00 174.62 173.49 2gjx s LEU 118 N -2.54 0.35 -0.23 4.79 2.96 -0.16 -1.99 118.68 121.86 2gjx s LEU 118 Ca 0.10 -0.90 -0.05 0.00 -0.22 0.00 0.00 54.13 53.06 2gjx s LEU 118 Cb -0.04 -0.18 -0.01 0.00 0.50 0.00 0.00 46.19 46.45 2gjx s LEU 118 CO 0.03 -0.39 -0.01 0.42 -1.32 0.00 0.00 176.35 175.08 2gjx s THR 119 N 2.15 3.66 -0.21 3.68 -4.23 -0.81 -1.41 115.64 118.48 2gjx s THR 119 Ca 0.06 -0.40 0.00 0.00 -1.18 0.00 0.00 61.69 60.18 2gjx s THR 119 Cb -0.16 -2.69 0.05 0.00 1.34 0.00 0.00 72.50 71.05 2gjx s THR 119 CO -0.24 0.39 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.55 2gjx s ILE 120 N 1.52 1.37 0.00 2.99 1.01 -0.29 -1.75 121.20 126.05 2gjx s ILE 120 Ca 0.06 -1.03 0.00 0.00 0.00 0.00 0.00 60.65 59.68 2gjx s ILE 120 Cb -0.15 -1.62 0.00 0.00 0.01 0.00 0.00 42.46 40.70 2gjx s ILE 120 CO -0.01 -0.04 0.00 -0.46 0.00 0.00 0.00 174.94 174.43 2gjx n ASN 121 N 4.75 0.00 0.05 3.58 6.94 -0.78 -2.37 115.26 127.43 2gjx n ASN 121 Ca -0.12 -0.67 0.12 0.00 -0.02 0.00 0.00 54.58 53.90 2gjx n ASN 121 Cb 0.45 0.00 0.59 0.00 -2.36 0.00 0.00 39.78 38.46 2gjx n ASN 121 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 2gjx h ASP 122 N 0.00 0.16 0.00 0.53 5.19 -2.01 -3.03 116.42 117.26 2gjx h ASP 122 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2gjx h ASP 122 Cb 0.00 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.48 2gjx h ASP 122 CO 0.00 0.10 -0.91 0.47 -3.12 0.00 0.00 179.24 175.78 2gjx n ASP 123 N -4.46 2.38 -4.53 6.45 10.43 -1.26 -5.06 116.55 120.49 2gjx n ASP 123 Ca 0.05 -0.24 -0.24 0.00 2.57 0.00 0.00 54.79 56.94 2gjx n ASP 123 Cb 0.33 1.18 -0.09 0.00 1.84 0.00 0.00 41.12 44.37 2gjx n ASP 123 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 2gjx s GLN 124 N -2.11 1.87 -0.38 -1.24 -0.21 -1.15 -5.03 119.66 111.41 2gjx s GLN 124 Ca -0.01 -1.69 0.06 0.00 0.02 0.00 0.00 55.36 53.74 2gjx s GLN 124 Cb 0.04 -1.87 0.28 0.00 1.00 0.00 0.00 33.01 32.46 2gjx s GLN 124 CO 0.25 0.31 1.24 0.00 -2.12 0.00 0.00 175.29 174.97 2gjx s LEU 126 N -2.34 4.01 -0.35 0.00 2.96 -0.72 -1.45 118.68 120.79 2gjx s LEU 126 Ca 0.17 0.27 0.02 0.00 -0.22 0.00 0.00 54.13 54.37 2gjx s LEU 126 Cb 0.27 -2.12 0.10 0.00 0.50 0.00 0.00 46.19 44.94 2gjx s LEU 126 CO -0.08 0.34 0.08 -0.22 -1.32 0.00 0.00 176.35 175.15 2gjx s LEU 127 N -1.31 4.82 -0.17 -0.68 0.20 0.17 -1.92 118.68 119.78 2gjx s LEU 127 Ca 0.18 -2.09 -0.08 0.00 0.69 0.00 0.00 54.13 52.83 2gjx s LEU 127 Cb -0.12 -1.67 -0.04 0.00 -0.43 0.00 0.00 46.19 43.93 2gjx s LEU 127 CO 0.08 -0.41 0.09 -0.22 -0.29 0.00 0.00 176.35 175.61 2gjx s LEU 128 N 0.96 4.03 0.10 -0.68 2.96 -0.84 -1.91 118.68 123.30 2gjx s LEU 128 Ca 0.09 0.20 -0.03 0.00 -0.22 0.00 0.00 54.13 54.17 2gjx s LEU 128 Cb -0.20 -2.02 -0.03 0.00 0.50 0.00 0.00 46.19 44.44 2gjx s LEU 128 CO -0.07 0.22 0.07 -0.94 -1.32 0.00 0.00 176.35 174.32 2gjx s SER 129 N 0.08 0.31 0.00 3.68 1.04 -0.97 0.11 113.70 117.95 2gjx s SER 129 Ca 0.07 -1.01 0.00 0.00 0.48 0.00 0.00 55.95 55.49 2gjx s SER 129 Cb -0.12 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.29 2gjx s SER 129 CO 0.00 -0.70 0.14 -0.62 0.98 0.00 0.00 173.24 173.03 2gjx n GLU 130 N -0.03 0.00 -2.51 4.02 -0.58 -1.05 -2.68 120.64 117.82 2gjx n GLU 130 Ca -0.10 0.11 -0.24 0.00 -0.42 0.00 0.00 57.16 56.50 2gjx n GLU 130 Cb 0.62 -0.72 0.12 0.00 -0.57 0.00 0.00 31.44 30.89 2gjx n GLU 130 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2gjx s THR 131 N -0.49 2.11 0.25 2.62 -4.23 -1.25 -1.17 115.64 113.48 2gjx s THR 131 Ca 0.00 -0.52 0.26 0.00 -1.18 0.00 0.00 61.69 60.25 2gjx s THR 131 Cb 0.00 -2.59 0.26 0.00 1.34 0.00 0.00 72.50 71.51 2gjx s THR 131 CO 0.00 0.00 1.93 1.62 -0.54 0.00 0.00 174.62 177.63 2gjx h VAL 132 N -0.67 0.55 0.00 2.29 3.04 -1.86 -2.85 116.25 116.75 2gjx h VAL 132 Ca -0.37 -0.88 -0.10 0.00 -1.01 0.00 0.00 66.70 64.34 2gjx h VAL 132 Cb 1.26 1.59 -0.01 0.00 -2.01 0.00 0.00 31.29 32.12 2gjx h VAL 132 CO 0.40 0.18 -0.49 -0.50 -1.01 0.00 0.00 177.57 176.15 2gjx h TRP 133 N 0.00 0.00 0.00 3.17 4.06 -1.94 -2.72 115.95 118.52 2gjx h TRP 133 Ca -0.00 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 60.87 2gjx h TRP 133 Cb 0.58 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.72 2gjx h TRP 133 CO 0.00 0.49 -0.39 0.78 -3.56 0.00 0.00 178.44 175.77 2gjx h GLY 134 N 2.12 0.00 0.98 1.49 0.00 -1.69 -2.95 103.07 103.02 2gjx h GLY 134 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 2gjx h GLY 134 CO 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 176.54 176.52 2gjx h ALA 135 N 1.61 0.55 -0.10 3.60 0.00 -1.57 -0.99 119.26 122.37 2gjx h ALA 135 Ca -0.00 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.62 2gjx h ALA 135 Cb 0.74 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2gjx h ALA 135 CO 0.05 0.41 -0.03 -0.07 0.00 0.00 0.00 179.25 179.61 2gjx h LEU 136 N 0.58 -0.10 -1.12 0.00 3.38 -1.51 0.74 115.31 117.28 2gjx h LEU 136 Ca 0.10 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.12 2gjx h LEU 136 Cb 0.61 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.37 2gjx h LEU 136 CO 0.04 -0.04 0.60 0.03 0.09 0.00 0.00 178.44 179.16 2gjx h ARG 137 N -0.00 1.17 -0.58 1.13 -0.00 -1.46 -2.08 114.38 112.55 2gjx h ARG 137 Ca 0.05 -0.07 -0.08 0.00 -0.50 0.00 0.00 59.98 59.38 2gjx h ARG 137 Cb 0.08 -0.26 -0.02 0.00 0.00 0.00 0.00 29.97 29.76 2gjx h ARG 137 CO -0.10 0.77 0.03 0.78 0.00 0.00 0.00 179.97 181.45 2gjx h GLY 138 N 1.20 1.06 1.19 0.04 0.00 -0.52 -2.15 103.07 103.89 2gjx h GLY 138 Ca 0.34 -0.73 -0.11 0.00 0.00 0.00 0.00 47.33 46.83 2gjx h GLY 138 CO -0.08 0.67 -0.10 1.41 0.00 0.00 0.00 176.54 178.44 2gjx h LEU 139 N 0.91 0.95 -0.47 3.11 3.38 -0.36 0.15 115.31 122.97 2gjx h LEU 139 Ca 0.17 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 2gjx h LEU 139 Cb 0.48 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2gjx h LEU 139 CO 0.02 1.06 0.17 -0.08 0.09 0.00 0.00 178.44 179.70 2gjx h GLU 140 N 0.85 0.71 -0.39 1.13 4.57 -1.25 0.54 114.58 120.75 2gjx h GLU 140 Ca 0.14 -0.14 -0.05 0.00 -1.18 0.00 0.00 59.36 58.13 2gjx h GLU 140 Cb 0.65 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.11 2gjx h GLU 140 CO 0.04 0.66 0.02 1.15 -1.18 0.00 0.00 179.01 179.71 2gjx h THR 141 N 0.62 1.21 -0.27 0.32 2.02 -1.20 -2.29 112.91 113.31 2gjx h THR 141 Ca 0.15 -0.81 -0.13 0.00 0.77 0.00 0.00 66.41 66.40 2gjx h THR 141 Cb 0.22 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 2gjx h THR 141 CO -0.01 0.28 -0.37 0.15 0.37 0.00 0.00 175.52 175.94 2gjx h PHE 142 N 0.58 0.73 0.00 3.16 3.57 -0.46 -2.93 116.94 121.59 2gjx h PHE 142 Ca 0.12 -0.20 -0.07 0.00 3.53 0.00 0.00 57.97 61.35 2gjx h PHE 142 Cb 0.33 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 2gjx h PHE 142 CO 0.01 0.90 -0.36 0.66 -2.23 0.00 0.00 178.31 177.30 2gjx h SER 143 N 0.52 0.00 1.10 0.41 4.64 -0.37 -2.90 113.55 116.95 2gjx h SER 143 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2gjx h SER 143 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 2gjx h SER 143 CO 0.08 0.36 -0.54 1.56 -0.87 0.00 0.00 176.83 177.41 2gjx h GLN 144 N 0.00 0.00 0.00 4.77 4.20 -1.35 -3.30 115.11 119.43 2gjx h GLN 144 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2gjx h GLN 144 Cb 0.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.56 2gjx h GLN 144 CO 0.05 0.00 -0.41 -0.07 -0.67 0.00 0.00 178.83 177.72 2gjx h LEU 145 N 0.00 0.00 -9.53 1.46 3.38 -1.33 -3.45 115.31 105.84 2gjx h LEU 145 Ca 0.00 -0.09 -0.53 0.00 0.09 0.00 0.00 57.88 57.35 2gjx h LEU 145 Cb 0.82 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 2gjx h LEU 145 CO 0.00 0.05 0.48 -0.69 0.09 0.00 0.00 178.44 178.37 2gjx s VAL 146 N -3.18 4.17 0.04 1.22 1.01 -1.21 -4.57 120.40 117.88 2gjx s VAL 146 Ca 0.07 1.66 -0.01 0.00 0.00 0.00 0.00 61.98 63.70 2gjx s VAL 146 Cb 0.11 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.39 2gjx s VAL 146 CO 0.69 0.19 -0.02 -1.66 0.00 0.00 0.00 175.10 174.29 2gjx s TRP 147 N 0.56 0.45 -0.07 5.22 1.48 -0.95 -4.98 118.94 120.66 2gjx s TRP 147 Ca 0.54 -0.94 0.02 0.00 -1.06 0.00 0.00 56.10 54.65 2gjx s TRP 147 Cb -0.27 -0.34 -0.03 0.00 -1.16 0.00 0.00 33.47 31.67 2gjx s TRP 147 CO 0.31 -0.34 -0.11 0.15 -4.06 0.00 0.00 176.95 172.90 2gjx s LYS 148 N -3.40 2.71 0.99 3.25 1.02 -1.26 -0.21 119.74 122.84 2gjx s LYS 148 Ca 0.02 -0.62 -0.16 0.00 0.02 0.00 0.00 55.97 55.23 2gjx s LYS 148 Cb 0.04 -2.51 0.20 0.00 -0.52 0.00 0.00 37.83 35.05 2gjx s LYS 148 CO -0.08 0.60 1.25 -1.54 -0.92 0.00 0.00 175.35 174.66 2gjx s SER 149 N -0.66 2.83 0.00 2.83 1.04 -0.01 -4.84 113.70 114.89 2gjx s SER 149 Ca 0.10 0.44 0.08 0.00 0.48 0.00 0.00 55.95 57.05 2gjx s SER 149 Cb -0.11 -0.61 0.37 0.00 0.10 0.00 0.00 66.02 65.76 2gjx s SER 149 CO 0.01 -2.93 1.17 0.00 0.98 0.00 0.00 173.24 172.48 2gjx n ALA 150 N -3.93 1.46 0.92 5.32 0.00 -1.26 -0.85 120.51 122.17 2gjx n ALA 150 Ca 0.13 -0.03 0.10 0.00 0.00 0.00 0.00 53.44 53.65 2gjx n ALA 150 Cb 0.60 -1.13 0.01 0.00 0.00 0.00 0.00 19.45 18.93 2gjx n ALA 150 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2gjx n GLU 151 N -1.38 1.47 -0.55 0.00 1.02 -1.26 -4.96 120.64 114.99 2gjx n GLU 151 Ca 0.03 -1.11 0.00 0.00 -0.02 0.00 0.00 57.16 56.06 2gjx n GLU 151 Cb 0.07 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 2gjx n GLU 151 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2gjx n GLY 152 N 1.33 0.74 3.70 0.62 0.00 -0.03 -5.04 105.19 106.51 2gjx n GLY 152 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.39 4.82 0.30 2.61 2.01 -1.26 -4.70 115.64 117.03 2gjx s THR 153 Ca 0.00 2.05 -0.29 0.00 0.31 0.00 0.00 61.69 63.76 2gjx s THR 153 Cb 0.00 -4.32 -0.09 0.00 0.01 0.00 0.00 72.50 68.10 2gjx s THR 153 CO 0.00 0.07 1.08 -0.36 -0.69 0.00 0.00 174.62 174.72 2gjx s PHE 154 N 1.56 3.57 0.16 4.92 0.08 -1.26 -0.83 117.98 126.18 2gjx s PHE 154 Ca 0.50 1.71 -0.07 0.00 0.12 0.00 0.00 56.93 59.19 2gjx s PHE 154 Cb -0.19 -3.23 -0.02 0.00 -0.57 0.00 0.00 43.02 39.01 2gjx s PHE 154 CO 0.22 -0.46 0.23 -0.06 -0.10 0.00 0.00 175.22 175.06 2gjx s PHE 155 N -1.25 0.53 -0.08 0.36 0.08 0.71 -2.80 117.98 115.54 2gjx s PHE 155 Ca 0.46 -0.89 -0.04 0.00 0.12 0.00 0.00 56.93 56.58 2gjx s PHE 155 Cb -0.30 -0.16 0.04 0.00 -0.57 0.00 0.00 43.02 42.02 2gjx s PHE 155 CO 0.38 -0.68 0.18 0.42 -0.10 0.00 0.00 175.22 175.42 2gjx s ILE 156 N -4.00 -0.04 0.44 0.64 1.09 -0.60 -2.23 121.20 116.51 2gjx s ILE 156 Ca 0.20 0.13 -0.12 0.00 -1.10 0.00 0.00 60.65 59.76 2gjx s ILE 156 Cb 0.04 -0.28 -0.06 0.00 -1.06 0.00 0.00 42.46 41.10 2gjx s ILE 156 CO 0.01 0.05 0.83 0.20 -0.10 0.00 0.00 174.94 175.94 2gjx s ASN 157 N 0.94 6.52 -0.51 3.58 -0.87 -1.26 -1.39 114.94 121.94 2gjx s ASN 157 Ca -0.07 1.23 -0.26 0.00 -1.57 0.00 0.00 52.86 52.19 2gjx s ASN 157 Cb -0.09 -2.37 -0.06 0.00 -0.02 0.00 0.00 41.25 38.72 2gjx s ASN 157 CO -0.05 -0.47 2.29 -0.75 -2.57 0.00 0.00 177.10 175.54 2gjx s LYS 158 N -4.01 2.22 0.30 -0.60 2.20 0.37 -4.89 119.74 115.34 2gjx s LYS 158 Ca 0.53 1.24 0.10 0.00 -0.36 0.00 0.00 55.97 57.48 2gjx s LYS 158 Cb -0.10 -4.54 -0.05 0.00 -1.51 0.00 0.00 37.83 31.63 2gjx s LYS 158 CO 0.33 -3.15 -0.01 0.95 -0.36 0.00 0.00 175.35 173.11 2gjx s THR 159 N 11.50 3.02 -0.26 3.43 -4.23 -1.00 -2.84 115.64 125.26 2gjx s THR 159 Ca 0.91 -1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 59.42 2gjx s THR 159 Cb -0.16 -2.76 0.13 0.00 1.34 0.00 0.00 72.50 71.04 2gjx s THR 159 CO 0.25 -0.31 0.32 -0.70 -0.54 0.00 0.00 174.62 173.64 2gjx s GLU 160 N -3.68 0.32 -0.02 3.99 2.56 0.23 -1.13 118.70 120.96 2gjx s GLU 160 Ca 0.33 0.17 0.05 0.00 0.00 0.00 0.00 54.97 55.52 2gjx s GLU 160 Cb -0.04 -0.67 -0.01 0.00 2.00 0.00 0.00 34.13 35.41 2gjx s GLU 160 CO 0.19 -0.84 -0.17 0.42 -0.56 0.00 0.00 175.26 174.30 2gjx s ILE 161 N 2.44 1.35 -0.14 -3.70 1.01 -0.50 -0.17 121.20 121.48 2gjx s ILE 161 Ca 0.10 -0.73 -0.00 0.00 0.00 0.00 0.00 60.65 60.02 2gjx s ILE 161 Cb -0.14 -1.13 0.03 0.00 0.01 0.00 0.00 42.46 41.23 2gjx s ILE 161 CO -0.23 0.38 -0.07 -0.70 0.00 0.00 0.00 174.94 174.32 2gjx s GLU 162 N -0.37 1.55 0.05 2.79 2.12 -1.13 -0.99 118.70 122.72 2gjx s GLU 162 Ca 0.06 -0.40 0.03 0.00 0.36 0.00 0.00 54.97 55.02 2gjx s GLU 162 Cb -0.07 -1.82 -0.02 0.00 0.26 0.00 0.00 34.13 32.48 2gjx s GLU 162 CO -0.00 -0.34 -0.10 0.34 -0.54 0.00 0.00 175.26 174.61 2gjx s ASP 163 N 1.65 1.19 -0.12 -1.70 2.15 -0.61 -1.41 116.67 117.83 2gjx s ASP 163 Ca 0.03 -0.51 -0.29 0.00 0.43 0.00 0.00 52.55 52.21 2gjx s ASP 163 Cb -0.14 -0.02 0.08 0.00 -0.30 0.00 0.00 42.92 42.54 2gjx s ASP 163 CO -0.08 -0.10 0.73 0.72 -0.17 0.00 0.00 175.17 176.26 2gjx s PHE 164 N -1.15 -0.65 0.21 -5.34 -0.71 -1.26 -2.22 117.98 106.85 2gjx s PHE 164 Ca -0.05 1.26 -0.30 0.00 -1.04 0.00 0.00 56.93 56.80 2gjx s PHE 164 Cb -0.09 0.38 -0.09 0.00 -1.21 0.00 0.00 43.02 42.02 2gjx s PHE 164 CO 0.01 -0.52 1.26 -1.25 -1.34 0.00 0.00 175.22 173.37 2gjx s PRO 165 N -0.79 4.44 0.28 1.99 0.04 -1.26 -4.77 135.00 134.93 2gjx s PRO 165 Ca -0.07 1.98 0.03 0.00 0.04 0.00 0.00 61.00 62.98 2gjx s PRO 165 Cb -0.01 -3.20 0.42 0.00 0.04 0.00 0.00 34.50 31.74 2gjx s PRO 165 CO 0.07 -0.16 1.72 -0.09 0.04 0.00 0.00 177.00 178.57 2gjx h ARG 166 N 5.13 0.44 -5.63 4.56 2.43 -1.38 -3.43 114.38 116.49 2gjx h ARG 166 Ca -0.45 -0.17 -0.50 0.00 -0.81 0.00 0.00 59.98 58.05 2gjx h ARG 166 Cb 1.21 -0.02 -0.25 0.00 -0.42 0.00 0.00 29.97 30.49 2gjx h ARG 166 CO 0.75 0.68 -0.81 -0.06 -1.51 0.00 0.00 179.97 179.02 2gjx s PHE 167 N -4.43 1.46 -0.77 2.20 0.08 -0.99 -5.00 117.98 110.52 2gjx s PHE 167 Ca -0.06 -0.37 0.26 0.00 0.12 0.00 0.00 56.93 56.88 2gjx s PHE 167 Cb 0.14 -0.86 0.66 0.00 -0.57 0.00 0.00 43.02 42.38 2gjx s PHE 167 CO 0.79 0.06 1.58 -0.35 -0.10 0.00 0.00 175.22 177.20 2gjx n PRO 168 N 1.82 0.20 -4.01 0.24 -0.04 -1.25 -4.68 135.00 127.28 2gjx n PRO 168 Ca -0.18 0.10 -0.31 0.00 -0.04 0.00 0.00 63.50 63.08 2gjx n PRO 168 Cb 0.54 -1.67 -0.15 0.00 -0.04 0.00 0.00 33.50 32.18 2gjx n PRO 168 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2gjx s HIS 169 N -3.10 3.48 -0.35 0.54 5.04 -0.87 -4.87 115.29 115.16 2gjx s HIS 169 Ca 0.10 -2.74 0.01 0.00 -1.54 0.00 0.00 55.06 50.89 2gjx s HIS 169 Cb 0.14 -2.60 0.11 0.00 0.04 0.00 0.00 32.58 30.27 2gjx s HIS 169 CO 0.65 -0.92 0.11 1.03 -2.34 0.00 0.00 174.74 173.27 2gjx s ARG 170 N 1.01 1.11 0.53 2.88 0.52 -1.26 -2.35 118.95 121.39 2gjx s ARG 170 Ca 0.06 -1.56 0.04 0.00 -0.52 0.00 0.00 55.73 53.75 2gjx s ARG 170 Cb -0.19 -2.50 0.04 0.00 0.52 0.00 0.00 34.95 32.81 2gjx s ARG 170 CO -0.08 -1.01 0.30 0.41 0.02 0.00 0.00 175.30 174.94 2gjx n GLY 171 N 4.36 2.96 2.85 -3.53 0.00 -0.82 -0.36 105.19 110.66 2gjx n GLY 171 Ca 0.02 -2.32 -0.14 0.00 0.00 0.00 0.00 46.02 43.58 2gjx n GLY 171 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2gjx s LEU 172 N 0.00 -0.36 0.19 0.99 1.98 0.17 -2.22 118.68 119.43 2gjx s LEU 172 Ca 0.23 0.07 -0.30 0.00 -2.89 0.00 0.00 54.13 51.24 2gjx s LEU 172 Cb -0.02 0.74 -0.09 0.00 0.66 0.00 0.00 46.19 47.48 2gjx s LEU 172 CO 0.14 -0.30 1.35 -0.76 -1.89 0.00 0.00 176.35 174.89 2gjx s LEU 173 N 2.43 4.40 -0.15 -0.68 1.43 0.90 -2.53 118.68 124.49 2gjx s LEU 173 Ca 0.09 2.44 -0.01 0.00 -1.03 0.00 0.00 54.13 55.61 2gjx s LEU 173 Cb -0.15 -3.61 0.04 0.00 0.03 0.00 0.00 46.19 42.50 2gjx s LEU 173 CO -0.13 -0.58 -0.02 -0.22 0.23 0.00 0.00 176.35 175.62 2gjx s LEU 174 N 0.08 1.31 -0.37 1.79 2.96 -0.69 -2.44 118.68 121.33 2gjx s LEU 174 Ca 0.59 -0.58 -0.22 0.00 -0.22 0.00 0.00 54.13 53.70 2gjx s LEU 174 Cb -0.38 -0.75 0.01 0.00 0.50 0.00 0.00 46.19 45.57 2gjx s LEU 174 CO 0.37 -0.21 0.73 -0.62 -1.32 0.00 0.00 176.35 175.30 2gjx s ASP 175 N 1.75 6.49 -0.13 3.68 -1.08 -1.16 -2.06 116.67 124.15 2gjx s ASP 175 Ca 0.01 0.21 0.15 0.00 -0.52 0.00 0.00 52.55 52.40 2gjx s ASP 175 Cb -0.15 -2.37 0.43 0.00 -1.46 0.00 0.00 42.92 39.37 2gjx s ASP 175 CO -0.07 -0.71 1.34 0.35 0.52 0.00 0.00 175.17 176.59 2gjx n THR 176 N 5.76 1.91 -0.08 1.71 -2.24 -1.02 -4.42 114.28 115.90 2gjx n THR 176 Ca 0.01 -1.70 -0.15 0.00 -2.27 0.00 0.00 64.05 59.94 2gjx n THR 176 Cb 0.48 -0.06 -0.05 0.00 -2.10 0.00 0.00 70.33 68.60 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 -0.41 1.68 -0.26 3.42 2.88 -1.24 -4.01 113.62 115.69 2gjx n SER 177 Ca 0.18 0.28 0.10 0.00 -1.33 0.00 0.00 58.87 58.10 2gjx n SER 177 Cb 0.74 -0.66 0.36 0.00 -0.75 0.00 0.00 64.21 63.90 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 -0.80 0.72 -3.13 -1.46 -0.00 -1.83 -3.40 114.38 104.47 2gjx h ARG 178 Ca -0.26 -0.04 -0.22 0.00 -0.50 0.00 0.00 59.98 58.95 2gjx h ARG 178 Cb 1.12 -0.16 -0.31 0.00 0.00 0.00 0.00 29.97 30.62 2gjx h ARG 178 CO -0.16 0.48 -0.55 -1.01 0.00 0.00 0.00 179.97 178.73 2gjx s HIS 179 N -5.70 -0.25 0.38 3.04 3.76 -1.25 -4.88 115.29 110.39 2gjx s HIS 179 Ca -0.10 0.64 -0.26 0.00 -0.15 0.00 0.00 55.06 55.19 2gjx s HIS 179 Cb 0.21 -0.03 -0.09 0.00 1.11 0.00 0.00 32.58 33.78 2gjx s HIS 179 CO 0.79 -0.21 1.23 -0.47 -0.85 0.00 0.00 174.74 175.23 2gjx s TYR 180 N 1.30 3.02 -0.11 1.40 5.04 -1.26 -4.10 117.35 122.64 2gjx s TYR 180 Ca -0.08 1.50 0.03 0.00 -2.44 0.00 0.00 57.07 56.07 2gjx s TYR 180 Cb -0.11 -3.52 0.00 0.00 0.35 0.00 0.00 41.96 38.68 2gjx s TYR 180 CO -0.07 -1.60 -0.22 -0.51 -1.34 0.00 0.00 175.55 171.80 2gjx s LEU 181 N -2.28 2.17 0.77 6.97 1.43 -1.26 -4.51 118.68 121.97 2gjx s LEU 181 Ca 0.55 -0.54 -0.14 0.00 -1.03 0.00 0.00 54.13 52.97 2gjx s LEU 181 Cb -0.35 -1.44 0.06 0.00 0.03 0.00 0.00 46.19 44.49 2gjx s LEU 181 CO 0.45 0.14 1.19 -2.84 0.23 0.00 0.00 176.35 175.51 2gjx s PRO 182 N 0.47 1.89 0.28 1.29 0.02 -1.26 -4.86 135.00 132.84 2gjx s PRO 182 Ca -0.15 1.69 0.02 0.00 0.02 0.00 0.00 61.00 62.58 2gjx s PRO 182 Cb -0.17 -1.81 0.62 0.00 0.02 0.00 0.00 34.50 33.15 2gjx s PRO 182 CO 0.06 -2.01 1.78 1.25 -0.33 0.00 0.00 177.00 177.75 2gjx h LEU 183 N -0.69 0.71 -0.36 -5.54 5.85 -2.00 -1.92 115.31 111.36 2gjx h LEU 183 Ca -0.46 0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.40 2gjx h LEU 183 Cb 1.29 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 42.22 2gjx h LEU 183 CO 0.48 0.30 0.02 0.28 -0.34 0.00 0.00 178.44 179.18 2gjx h SER 184 N 0.76 -0.10 -0.56 1.25 0.02 -1.99 -0.60 113.55 112.34 2gjx h SER 184 Ca 0.52 0.07 0.07 0.00 -0.84 0.00 0.00 61.79 61.61 2gjx h SER 184 Cb 0.71 0.12 -0.06 0.00 0.14 0.00 0.00 62.40 63.32 2gjx h SER 184 CO -0.35 -0.01 0.23 0.28 -1.14 0.00 0.00 176.83 175.84 2gjx h SER 185 N 0.13 0.27 -0.15 3.07 0.02 -1.70 0.40 113.55 115.58 2gjx h SER 185 Ca 0.17 0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.17 2gjx h SER 185 Cb 0.23 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 2gjx h SER 185 CO -0.27 0.17 0.03 0.40 -1.14 0.00 0.00 176.83 176.03 2gjx h ILE 186 N 0.43 1.21 -0.89 3.27 2.04 -1.34 -1.38 117.51 120.85 2gjx h ILE 186 Ca 0.27 -0.66 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 2gjx h ILE 186 Cb 0.27 1.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.67 2gjx h ILE 186 CO -0.25 0.20 0.50 -0.07 0.00 0.00 0.00 178.15 178.53 2gjx h LEU 187 N 0.04 1.11 -0.98 1.44 3.38 -0.61 -1.53 115.31 118.16 2gjx h LEU 187 Ca 0.05 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 2gjx h LEU 187 Cb 0.27 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2gjx h LEU 187 CO 0.00 0.88 -0.12 0.44 0.09 0.00 0.00 178.44 179.73 2gjx h ASP 188 N 1.24 0.59 -0.42 -0.43 3.45 -0.10 -1.60 116.42 119.15 2gjx h ASP 188 Ca 0.31 -0.16 -0.07 0.00 0.43 0.00 0.00 57.03 57.55 2gjx h ASP 188 Cb 0.02 -0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 38.61 2gjx h ASP 188 CO -0.05 0.74 0.00 0.74 -1.57 0.00 0.00 179.24 179.11 2gjx h THR 189 N 0.56 1.26 -0.90 0.35 2.02 -0.74 -2.23 112.91 113.23 2gjx h THR 189 Ca 0.10 -1.01 0.02 0.00 0.77 0.00 0.00 66.41 66.28 2gjx h THR 189 Cb 0.53 1.09 -0.05 0.00 -1.74 0.00 0.00 68.15 67.99 2gjx h THR 189 CO 0.03 0.34 0.60 -0.07 0.37 0.00 0.00 175.52 176.79 2gjx h LEU 190 N 0.57 1.02 -0.28 2.58 3.38 -0.99 0.35 115.31 121.94 2gjx h LEU 190 Ca 0.12 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.10 2gjx h LEU 190 Cb 0.48 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 2gjx h LEU 190 CO 0.02 0.73 0.10 0.44 0.09 0.00 0.00 178.44 179.81 2gjx h ASP 191 N 1.20 0.10 0.34 -0.43 5.19 -1.00 -1.96 116.42 119.87 2gjx h ASP 191 Ca 0.34 0.03 -0.16 0.00 -0.62 0.00 0.00 57.03 56.62 2gjx h ASP 191 Cb -0.10 0.02 -0.01 0.00 0.18 0.00 0.00 39.33 39.42 2gjx h ASP 191 CO -0.08 0.09 -0.66 0.58 -3.12 0.00 0.00 179.24 176.06 2gjx h VAL 192 N 0.22 1.39 -0.54 -1.35 2.07 -0.76 -2.69 116.25 114.60 2gjx h VAL 192 Ca 0.12 -2.07 0.05 0.00 0.82 0.00 0.00 66.70 65.62 2gjx h VAL 192 Cb 0.09 2.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.89 2gjx h VAL 192 CO -0.13 0.62 0.36 0.24 0.02 0.00 0.00 177.57 178.67 2gjx h MET 193 N 0.21 0.54 -0.35 1.57 2.86 -0.07 -1.37 114.93 118.32 2gjx h MET 193 Ca -0.01 -0.03 -0.12 0.00 -2.06 0.00 0.00 59.70 57.47 2gjx h MET 193 Cb 1.19 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.72 2gjx h MET 193 CO 0.11 0.35 -0.27 0.00 1.06 0.00 0.00 176.91 178.16 2gjx h ALA 194 N 1.70 0.87 0.00 6.32 0.00 -1.02 0.86 119.26 127.98 2gjx h ALA 194 Ca 0.23 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 2gjx h ALA 194 Cb 0.20 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2gjx h ALA 194 CO -0.06 0.63 -0.19 1.88 0.00 0.00 0.00 179.25 181.51 2gjx h TYR 195 N 0.62 0.00 -0.53 0.00 0.05 -1.13 -2.54 116.97 113.44 2gjx h TYR 195 Ca 0.08 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.86 2gjx h TYR 195 Cb 0.78 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.52 2gjx h TYR 195 CO 0.04 0.19 0.00 0.09 -1.05 0.00 0.00 178.16 177.43 2gjx n ASN 196 N -4.08 3.68 -0.22 3.88 3.02 -0.99 -4.66 115.26 115.88 2gjx n ASN 196 Ca -0.02 -2.00 -0.03 0.00 -0.03 0.00 0.00 54.58 52.50 2gjx n ASN 196 Cb 0.27 -0.35 -0.01 0.00 -0.61 0.00 0.00 39.78 39.08 2gjx n ASN 196 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2gjx n LYS 197 N 1.56 -1.42 -1.95 3.52 4.01 -0.80 -4.73 118.16 118.35 2gjx n LYS 197 Ca 0.21 0.50 -0.41 0.00 -0.51 0.00 0.00 58.31 58.11 2gjx n LYS 197 Cb 0.62 -4.63 -0.01 0.00 -0.51 0.00 0.00 35.03 30.49 2gjx n LYS 197 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2gjx s LEU 198 N -0.66 4.37 0.00 -0.35 1.02 0.23 -4.94 118.68 118.35 2gjx s LEU 198 Ca 0.00 2.83 0.00 0.00 0.02 0.00 0.00 54.13 56.98 2gjx s LEU 198 Cb 0.00 -3.65 0.00 0.00 0.02 0.00 0.00 46.19 42.56 2gjx s LEU 198 CO 0.00 -0.73 0.59 -0.46 0.02 0.00 0.00 176.35 175.77 2gjx n ASN 199 N 1.23 0.94 -3.82 2.29 6.94 0.52 -4.44 115.26 118.92 2gjx n ASN 199 Ca 0.03 -1.34 -0.27 0.00 -0.02 0.00 0.00 54.58 52.97 2gjx n ASN 199 Cb 0.40 0.00 -0.17 0.00 -2.36 0.00 0.00 39.78 37.66 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 -0.34 0.83 -0.91 3.53 1.01 -0.38 0.44 120.40 124.57 2gjx s VAL 200 Ca 0.00 -0.54 -0.17 0.00 0.00 0.00 0.00 61.98 61.28 2gjx s VAL 200 Cb 0.00 -1.12 0.17 0.00 0.00 0.00 0.00 36.38 35.42 2gjx s VAL 200 CO 0.00 0.01 1.01 0.12 0.00 0.00 0.00 175.10 176.25 2gjx s PHE 201 N 1.74 3.39 -0.72 5.22 5.36 0.22 -0.66 117.98 132.53 2gjx s PHE 201 Ca 0.00 -1.67 -0.26 0.00 -0.96 0.00 0.00 56.93 54.05 2gjx s PHE 201 Cb -0.16 -4.11 -0.02 0.00 -0.34 0.00 0.00 43.02 38.39 2gjx s PHE 201 CO -0.07 -1.30 1.83 -1.58 -1.46 0.00 0.00 175.22 172.64 2gjx s HIS 202 N 1.66 1.78 -0.52 10.12 5.65 -1.05 -1.71 115.29 131.21 2gjx s HIS 202 Ca 0.28 0.62 -0.20 0.00 0.25 0.00 0.00 55.06 56.01 2gjx s HIS 202 Cb -0.07 -4.14 0.06 0.00 -1.18 0.00 0.00 32.58 27.25 2gjx s HIS 202 CO -0.09 -2.11 0.72 -0.46 -0.65 0.00 0.00 174.74 172.14 2gjx s TRP 203 N 9.00 2.97 -1.18 3.88 -0.00 0.58 -1.70 118.94 132.48 2gjx s TRP 203 Ca 0.65 -0.42 -0.15 0.00 -0.00 0.00 0.00 56.10 56.18 2gjx s TRP 203 Cb -0.10 -3.71 0.16 0.00 -0.00 0.00 0.00 33.47 29.82 2gjx s TRP 203 CO 0.13 -1.14 1.43 -1.58 -0.00 0.00 0.00 176.95 175.79 2gjx s HIS 204 N 3.00 3.38 0.09 5.86 5.65 -0.88 -1.17 115.29 131.23 2gjx s HIS 204 Ca 0.19 -1.99 -0.24 0.00 0.25 0.00 0.00 55.06 53.26 2gjx s HIS 204 Cb -0.18 -4.36 -0.15 0.00 -1.18 0.00 0.00 32.58 26.72 2gjx s HIS 204 CO 0.14 -1.45 1.72 -0.07 -0.65 0.00 0.00 174.74 174.42 2gjx h LEU 205 N 10.09 -0.15 -9.09 8.88 4.07 -1.82 -2.71 115.31 124.58 2gjx h LEU 205 Ca 0.31 0.01 -0.52 0.00 0.08 0.00 0.00 57.88 57.76 2gjx h LEU 205 Cb 0.89 0.05 -0.14 0.00 1.08 0.00 0.00 40.66 42.54 2gjx h LEU 205 CO 1.25 -0.10 -0.72 0.68 -1.08 0.00 0.00 178.44 178.47 2gjx s VAL 206 N -6.17 1.95 0.00 1.22 -7.23 -1.26 -3.62 120.40 105.29 2gjx s VAL 206 Ca -0.14 -2.24 0.00 0.00 -1.81 0.00 0.00 61.98 57.79 2gjx s VAL 206 Cb 0.06 -2.28 0.00 0.00 0.56 0.00 0.00 36.38 34.72 2gjx s VAL 206 CO 0.66 -0.43 0.00 -0.67 -0.31 0.00 0.00 175.10 174.35 2gjx n ASP 207 N -0.54 0.00 -0.09 4.85 2.03 -1.23 -4.59 116.55 116.98 2gjx n ASP 207 Ca -0.06 -0.20 -0.06 0.00 0.52 0.00 0.00 54.79 54.99 2gjx n ASP 207 Cb 0.61 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 41.02 2gjx n ASP 207 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 2gjx h ASP 208 N 0.00 -0.09 -0.37 1.67 3.32 -1.94 -3.01 116.42 116.00 2gjx h ASP 208 Ca 0.00 0.07 0.05 0.00 0.02 0.00 0.00 57.03 57.17 2gjx h ASP 208 Cb 0.00 0.12 -0.08 0.00 0.22 0.00 0.00 39.33 39.58 2gjx h ASP 208 CO 0.00 -0.01 -0.53 1.55 -1.72 0.00 0.00 179.24 178.52 2gjx h PRO 209 N 0.12 -0.40 -2.61 3.56 0.13 -1.94 -2.72 132.00 128.15 2gjx h PRO 209 Ca 0.16 0.03 -0.12 0.00 -0.87 0.00 0.00 66.00 65.19 2gjx h PRO 209 Cb 0.21 0.09 -0.28 0.00 0.13 0.00 0.00 31.00 31.14 2gjx h PRO 209 CO -0.25 -0.26 -0.38 0.45 -0.23 0.00 0.00 178.00 177.32 2gjx s SER 210 N -5.03 -0.21 -0.63 1.44 0.15 -1.13 -4.73 113.70 103.56 2gjx s SER 210 Ca -0.15 0.90 0.05 0.00 0.70 0.00 0.00 55.95 57.45 2gjx s SER 210 Cb 0.09 1.11 0.16 0.00 -1.71 0.00 0.00 66.02 65.67 2gjx s SER 210 CO 0.62 -0.22 0.43 0.12 1.20 0.00 0.00 173.24 175.39 2gjx s PHE 211 N 2.31 3.12 -0.05 3.44 2.19 0.74 -3.54 117.98 126.19 2gjx s PHE 211 Ca -0.03 -3.14 0.24 0.00 0.33 0.00 0.00 56.93 54.33 2gjx s PHE 211 Cb -0.11 -2.44 0.72 0.00 -1.31 0.00 0.00 43.02 39.88 2gjx s PHE 211 CO -0.12 -0.62 1.74 -1.00 1.83 0.00 0.00 175.22 177.05 2gjx h PRO 212 N 5.64 0.00 -6.28 10.12 0.13 -1.81 -3.29 132.00 136.51 2gjx h PRO 212 Ca 0.12 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.70 2gjx h PRO 212 Cb 0.80 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.90 2gjx h PRO 212 CO 0.66 0.19 0.69 -0.47 -0.23 0.00 0.00 178.00 178.84 2gjx s TYR 213 N -3.43 3.24 0.08 1.56 5.04 -1.26 -1.17 117.35 121.40 2gjx s TYR 213 Ca 0.03 1.29 -0.21 0.00 -2.44 0.00 0.00 57.07 55.74 2gjx s TYR 213 Cb 0.08 -3.37 -0.07 0.00 0.35 0.00 0.00 41.96 38.96 2gjx s TYR 213 CO 0.65 -1.07 0.62 -1.83 -1.34 0.00 0.00 175.55 172.58 2gjx s GLU 214 N 2.32 4.31 -0.07 4.97 -1.05 -1.18 -4.30 118.70 123.71 2gjx s GLU 214 Ca 0.54 0.84 0.05 0.00 -0.15 0.00 0.00 54.97 56.25 2gjx s GLU 214 Cb -0.23 -3.27 -0.01 0.00 -0.44 0.00 0.00 34.13 30.19 2gjx s GLU 214 CO 0.20 0.56 -0.25 0.45 0.95 0.00 0.00 175.26 177.17 2gjx s SER 215 N -0.89 3.06 0.18 0.83 0.15 -1.26 -4.77 113.70 111.00 2gjx s SER 215 Ca 0.31 -0.52 0.26 0.00 0.70 0.00 0.00 55.95 56.69 2gjx s SER 215 Cb -0.20 -1.00 0.67 0.00 -1.71 0.00 0.00 66.02 63.78 2gjx s SER 215 CO 0.20 0.22 1.64 2.22 1.20 0.00 0.00 173.24 178.72 2gjx n PHE 216 N 3.12 0.81 0.06 3.44 1.16 -1.26 -2.46 117.46 122.32 2gjx n PHE 216 Ca -0.18 0.23 -0.22 0.00 -1.87 0.00 0.00 57.45 55.42 2gjx n PHE 216 Cb 0.52 -0.85 -0.15 0.00 -1.61 0.00 0.00 39.48 37.40 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 0.91 -2.90 1.97 1.35 -1.95 -3.42 112.91 108.88 2gjx h THR 217 Ca 0.00 -2.52 -0.61 0.00 -0.55 0.00 0.00 66.41 62.73 2gjx h THR 217 Cb 0.74 2.72 -0.40 0.00 -1.73 0.00 0.00 68.15 69.48 2gjx h THR 217 CO 0.00 0.85 -0.75 -0.36 -0.25 0.00 0.00 175.52 175.02 2gjx s PHE 218 N -2.58 2.11 0.38 4.73 0.08 -1.23 -4.98 117.98 116.50 2gjx s PHE 218 Ca -0.16 -2.57 0.11 0.00 0.12 0.00 0.00 56.93 54.43 2gjx s PHE 218 Cb 0.06 -1.87 0.77 0.00 -0.57 0.00 0.00 43.02 41.40 2gjx s PHE 218 CO 0.84 -0.75 1.88 -1.35 -0.10 0.00 0.00 175.22 175.74 2gjx h PRO 219 N 6.32 0.12 0.00 0.24 0.11 -1.74 -2.99 132.00 134.06 2gjx h PRO 219 Ca 0.06 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.14 2gjx h PRO 219 Cb 0.89 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.99 2gjx h PRO 219 CO 0.50 0.37 0.00 0.39 -0.21 0.00 0.00 178.00 179.05 2gjx n GLU 220 N -4.20 0.11 0.29 1.05 -0.58 -1.26 -2.80 120.64 113.24 2gjx n GLU 220 Ca -0.01 0.43 -0.11 0.00 -0.42 0.00 0.00 57.16 57.04 2gjx n GLU 220 Cb 0.33 -1.75 -0.05 0.00 -0.57 0.00 0.00 31.44 29.40 2gjx n GLU 220 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 2gjx h LEU 221 N 0.00 -0.62 -0.49 -4.62 3.38 -1.79 -2.75 115.31 108.42 2gjx h LEU 221 Ca 0.00 0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.83 2gjx h LEU 221 Cb 0.23 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2gjx h LEU 221 CO 0.00 -0.44 -0.46 -0.03 0.09 0.00 0.00 178.44 177.60 2gjx h MET 222 N -0.74 0.73 0.00 1.13 4.05 -1.74 -0.56 114.93 117.79 2gjx h MET 222 Ca -0.08 -0.41 0.00 0.00 -0.28 0.00 0.00 59.70 58.94 2gjx h MET 222 Cb 0.56 0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.39 2gjx h MET 222 CO 0.12 1.03 0.00 0.54 0.23 0.00 0.00 176.91 178.83 2gjx n ARG 223 N -4.02 0.16 0.00 0.39 1.74 -1.12 -2.35 116.66 111.46 2gjx n ARG 223 Ca -0.03 0.18 0.00 0.00 -0.77 0.00 0.00 57.85 57.23 2gjx n ARG 223 Cb 0.57 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.51 2gjx n ARG 223 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2gjx n LYS 224 N -1.33 0.00 0.00 5.56 5.02 -1.04 -4.88 118.16 121.50 2gjx n LYS 224 Ca 0.06 -0.18 0.00 0.00 -2.02 0.00 0.00 58.31 56.17 2gjx n LYS 224 Cb 0.12 -0.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.65 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 0.00 0.39 3.97 0.72 0.00 -0.23 -4.70 105.19 105.35 2gjx n GLY 225 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.34 4.80 0.09 1.61 1.04 -0.99 -0.18 113.70 119.73 2gjx s SER 226 Ca 0.00 -0.07 -0.16 0.00 0.48 0.00 0.00 55.95 56.20 2gjx s SER 226 Cb 0.00 -0.56 -0.09 0.00 0.10 0.00 0.00 66.02 65.46 2gjx s SER 226 CO 0.00 -1.52 1.41 1.88 0.98 0.00 0.00 173.24 175.98 2gjx h TYR 227 N -0.30 0.77 -2.43 5.02 0.05 -1.87 -3.45 116.97 114.76 2gjx h TYR 227 Ca -0.40 -0.23 -0.07 0.00 0.05 0.00 0.00 58.73 58.08 2gjx h TYR 227 Cb 1.29 -0.16 -0.26 0.00 1.01 0.00 0.00 36.73 38.60 2gjx h TYR 227 CO 0.12 0.95 -0.32 1.21 -1.05 0.00 0.00 178.16 179.07 2gjx s ASN 228 N -6.47 -0.43 0.00 3.88 3.04 -1.26 -5.03 114.94 108.68 2gjx s ASN 228 Ca -0.13 1.09 0.02 0.00 0.04 0.00 0.00 52.86 53.88 2gjx s ASN 228 Cb 0.08 1.46 0.13 0.00 -1.54 0.00 0.00 41.25 41.37 2gjx s ASN 228 CO 0.82 -0.23 0.60 -2.65 -3.04 0.00 0.00 177.10 172.60 2gjx n PRO 229 N 5.29 0.07 0.04 0.43 -0.02 -1.26 -2.72 135.00 136.83 2gjx n PRO 229 Ca -0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.38 2gjx n PRO 229 Cb 0.50 -1.48 0.00 0.00 -0.02 0.00 0.00 33.50 32.50 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 -0.98 0.28 0.09 -1.45 0.31 -1.26 -4.90 118.33 110.42 2gjx n VAL 230 Ca 0.02 0.09 -0.13 0.00 -0.01 0.00 0.00 64.34 64.31 2gjx n VAL 230 Cb 0.01 -1.04 -0.12 0.00 -0.91 0.00 0.00 33.84 31.78 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 1.56 -2.07 2.52 1.35 -1.99 -3.36 112.91 110.91 2gjx h THR 231 Ca 0.00 -3.13 -0.67 0.00 -0.55 0.00 0.00 66.41 62.06 2gjx h THR 231 Cb 0.29 2.87 -0.36 0.00 -1.73 0.00 0.00 68.15 69.23 2gjx h THR 231 CO 0.00 0.91 0.03 1.41 -0.25 0.00 0.00 175.52 177.62 2gjx n HIS 232 N -3.49 3.43 -4.25 4.73 8.25 -1.10 -5.03 115.22 117.75 2gjx n HIS 232 Ca -0.06 -3.19 -0.19 0.00 -0.26 0.00 0.00 57.72 54.02 2gjx n HIS 232 Cb 0.98 -0.69 -0.11 0.00 1.12 0.00 0.00 29.99 31.28 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 -4.76 1.44 -0.40 1.59 -1.09 -1.26 -4.60 121.20 112.13 2gjx s ILE 233 Ca 0.47 -1.68 -0.03 0.00 -2.23 0.00 0.00 60.65 57.18 2gjx s ILE 233 Cb 0.31 -1.53 0.10 0.00 -1.58 0.00 0.00 42.46 39.76 2gjx s ILE 233 CO -0.19 -0.33 0.19 -0.31 -1.23 0.00 0.00 174.94 173.07 2gjx s TYR 234 N -1.88 3.56 0.76 3.97 1.51 -0.32 -5.01 117.35 119.94 2gjx s TYR 234 Ca 0.08 -2.35 -0.11 0.00 -1.01 0.00 0.00 57.07 53.68 2gjx s TYR 234 Cb -0.06 -3.12 0.05 0.00 -0.11 0.00 0.00 41.96 38.72 2gjx s TYR 234 CO 0.04 -0.95 1.10 0.99 -1.11 0.00 0.00 175.55 175.61 2gjx s THR 235 N 1.16 3.28 0.35 -0.71 2.01 -1.26 -3.08 115.64 117.39 2gjx s THR 235 Ca 0.07 0.45 0.05 0.00 0.31 0.00 0.00 61.69 62.57 2gjx s THR 235 Cb -0.22 -2.93 0.29 0.00 0.01 0.00 0.00 72.50 69.65 2gjx s THR 235 CO -0.04 -0.52 1.95 0.00 -0.69 0.00 0.00 174.62 175.33 2gjx h ALA 236 N -0.96 1.67 -0.46 7.40 0.00 -1.99 -0.49 119.26 124.44 2gjx h ALA 236 Ca -0.44 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 2gjx h ALA 236 Cb 1.23 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2gjx h ALA 236 CO 0.52 0.21 0.22 0.37 0.00 0.00 0.00 179.25 180.57 2gjx h GLN 237 N 0.79 0.66 -0.01 0.00 5.75 -1.99 -1.40 115.11 118.91 2gjx h GLN 237 Ca 0.32 -0.10 0.01 0.00 -0.15 0.00 0.00 58.65 58.73 2gjx h GLN 237 Cb 0.24 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.66 2gjx h GLN 237 CO -0.11 0.56 -0.03 -0.44 -2.65 0.00 0.00 178.83 176.16 2gjx h ASP 238 N 0.60 -0.09 -0.66 -0.69 3.32 -1.50 -1.45 116.42 115.94 2gjx h ASP 238 Ca 0.16 0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.24 2gjx h ASP 238 Cb 0.11 0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.67 2gjx h ASP 238 CO -0.02 -0.05 0.44 0.58 -1.72 0.00 0.00 179.24 178.47 2gjx h VAL 239 N -0.05 1.15 -0.38 -1.35 2.07 -1.08 -1.40 116.25 115.21 2gjx h VAL 239 Ca 0.02 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 2gjx h VAL 239 Cb 0.07 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.03 2gjx h VAL 239 CO -0.04 0.16 0.18 0.50 0.02 0.00 0.00 177.57 178.39 2gjx h LYS 240 N 0.88 0.55 -0.67 1.57 3.64 -0.70 -2.06 116.57 119.77 2gjx h LYS 240 Ca 0.25 -0.08 -0.06 0.00 -1.27 0.00 0.00 60.65 59.49 2gjx h LYS 240 Cb -0.07 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.63 2gjx h LYS 240 CO -0.06 0.49 0.20 0.93 -2.27 0.00 0.00 179.45 178.74 2gjx h GLU 241 N 0.48 1.04 -0.11 1.90 5.08 -0.68 -2.45 114.58 119.83 2gjx h GLU 241 Ca 0.13 -0.22 0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2gjx h GLU 241 Cb 0.12 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2gjx h GLU 241 CO -0.02 0.90 0.03 0.28 -1.00 0.00 0.00 179.01 179.19 2gjx h VAL 242 N 1.00 0.96 -0.57 3.13 2.07 -0.98 0.19 116.25 122.05 2gjx h VAL 242 Ca 0.22 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.70 2gjx h VAL 242 Cb 0.30 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 2gjx h VAL 242 CO -0.01 0.01 0.30 0.40 0.02 0.00 0.00 177.57 178.30 2gjx h ILE 243 N 0.08 1.19 -0.23 4.57 2.04 -1.24 -0.41 117.51 123.51 2gjx h ILE 243 Ca 0.05 -0.51 -0.20 0.00 1.00 0.00 0.00 64.86 65.19 2gjx h ILE 243 Cb 0.04 0.48 0.01 0.00 -0.74 0.00 0.00 36.82 36.61 2gjx h ILE 243 CO -0.06 0.21 -0.66 -0.08 0.00 0.00 0.00 178.15 177.56 2gjx h GLU 244 N 0.77 0.85 -0.73 2.37 4.57 -1.30 -0.60 114.58 120.52 2gjx h GLU 244 Ca 0.20 -0.61 -0.04 0.00 -1.18 0.00 0.00 59.36 57.73 2gjx h GLU 244 Cb 0.07 0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.73 2gjx h GLU 244 CO -0.03 1.23 0.28 -0.92 -1.18 0.00 0.00 179.01 178.39 2gjx h TYR 245 N 0.62 1.10 -0.26 0.92 3.20 -0.49 -2.04 116.97 120.03 2gjx h TYR 245 Ca -0.02 -0.08 -0.19 0.00 3.14 0.00 0.00 58.73 61.58 2gjx h TYR 245 Cb 1.28 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 39.22 2gjx h TYR 245 CO 0.08 0.84 -0.58 0.00 -1.64 0.00 0.00 178.16 176.86 2gjx h ALA 246 N 1.24 0.48 -0.54 1.82 0.00 -1.00 -3.22 119.26 118.04 2gjx h ALA 246 Ca 0.24 -0.53 0.03 0.00 0.00 0.00 0.00 54.91 54.65 2gjx h ALA 246 Cb 0.22 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2gjx h ALA 246 CO -0.02 0.68 0.31 -0.09 0.00 0.00 0.00 179.25 180.14 2gjx h ARG 247 N 0.62 0.60 -0.16 0.00 2.43 -0.75 0.82 114.38 117.94 2gjx h ARG 247 Ca 0.00 -0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.18 2gjx h ARG 247 Cb 1.19 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.59 2gjx h ARG 247 CO 0.13 0.40 0.14 -0.07 -1.51 0.00 0.00 179.97 179.06 2gjx h LEU 248 N 0.62 0.00 -2.26 3.80 3.38 -1.39 0.42 115.31 119.88 2gjx h LEU 248 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2gjx h LEU 248 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2gjx h LEU 248 CO -0.11 0.00 0.00 0.54 0.09 0.00 0.00 178.44 178.96 2gjx n ARG 249 N -4.07 2.45 -3.10 1.13 3.00 -0.50 -4.94 116.66 110.64 2gjx n ARG 249 Ca 0.01 -2.23 -0.13 0.00 -0.01 0.00 0.00 57.85 55.49 2gjx n ARG 249 Cb 0.27 -1.51 0.07 0.00 0.00 0.00 0.00 32.46 31.29 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 1.50 -0.16 3.19 -0.13 0.00 0.15 -4.88 105.19 104.86 2gjx n GLY 250 Ca 0.20 -0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.26 1.77 0.03 -0.61 1.01 0.17 -4.70 121.20 115.60 2gjx s ILE 251 Ca 0.06 -0.89 -0.22 0.00 0.00 0.00 0.00 60.65 59.60 2gjx s ILE 251 Cb -0.03 -1.52 -0.06 0.00 0.01 0.00 0.00 42.46 40.87 2gjx s ILE 251 CO 0.54 0.50 0.66 -0.13 0.00 0.00 0.00 174.94 176.52 2gjx s ARG 252 N 0.12 4.39 -0.55 2.79 0.52 0.17 -3.83 118.95 122.55 2gjx s ARG 252 Ca -0.09 0.87 -0.17 0.00 -0.52 0.00 0.00 55.73 55.82 2gjx s ARG 252 Cb -0.14 -3.34 0.11 0.00 0.52 0.00 0.00 34.95 32.10 2gjx s ARG 252 CO 0.05 0.36 0.57 0.08 0.02 0.00 0.00 175.30 176.37 2gjx s VAL 253 N -0.24 5.06 -0.50 3.52 1.01 -1.26 0.70 120.40 128.68 2gjx s VAL 253 Ca 0.34 -1.21 -0.18 0.00 0.00 0.00 0.00 61.98 60.93 2gjx s VAL 253 Cb -0.19 -4.36 0.06 0.00 0.00 0.00 0.00 36.38 31.89 2gjx s VAL 253 CO 0.20 -0.92 0.56 -0.22 0.00 0.00 0.00 175.10 174.72 2gjx s LEU 254 N 2.05 5.17 0.11 3.92 2.96 -0.69 -4.67 118.68 127.53 2gjx s LEU 254 Ca 0.07 -1.05 -0.24 0.00 -0.22 0.00 0.00 54.13 52.68 2gjx s LEU 254 Cb -0.27 -2.37 -0.07 0.00 0.50 0.00 0.00 46.19 43.99 2gjx s LEU 254 CO 0.05 -0.83 0.74 0.00 -1.32 0.00 0.00 176.35 174.99 2gjx s ALA 255 N 2.34 3.44 -0.16 5.97 0.00 -1.26 -0.31 121.76 131.79 2gjx s ALA 255 Ca 0.12 0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.37 2gjx s ALA 255 Cb -0.21 -2.92 0.02 0.00 0.00 0.00 0.00 23.12 20.01 2gjx s ALA 255 CO 0.10 0.23 -0.18 -2.00 0.00 0.00 0.00 175.76 173.92 2gjx s GLU 256 N -0.78 2.69 -0.79 0.00 2.12 -0.31 -1.51 118.70 120.11 2gjx s GLU 256 Ca 0.36 -0.71 0.02 0.00 0.36 0.00 0.00 54.97 54.99 2gjx s GLU 256 Cb -0.22 -2.34 0.23 0.00 0.26 0.00 0.00 34.13 32.06 2gjx s GLU 256 CO 0.24 -0.19 0.80 1.19 -0.54 0.00 0.00 175.26 176.76 2gjx n PHE 257 N 4.60 3.55 -1.67 5.30 3.72 -1.14 -3.50 117.46 128.33 2gjx n PHE 257 Ca -0.19 -3.98 -0.64 0.00 -0.05 0.00 0.00 57.45 52.59 2gjx n PHE 257 Cb 0.50 -0.83 -0.09 0.00 -0.94 0.00 0.00 39.48 38.12 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 1.56 1.02 -3.78 4.37 -0.08 -1.26 -4.65 116.55 113.74 2gjx n ASP 258 Ca 0.25 1.17 -0.13 0.00 -1.51 0.00 0.00 54.79 54.57 2gjx n ASP 258 Cb 0.37 -0.93 -0.09 0.00 2.34 0.00 0.00 41.12 42.81 2gjx n ASP 258 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 2gjx s THR 259 N 2.13 0.06 -1.01 5.18 -4.23 -0.95 -4.60 115.64 112.21 2gjx s THR 259 Ca 1.00 -0.46 0.26 0.00 -1.18 0.00 0.00 61.69 61.30 2gjx s THR 259 Cb -1.37 -0.57 0.07 0.00 1.34 0.00 0.00 72.50 71.97 2gjx s THR 259 CO 0.72 -0.25 1.54 -0.81 -0.54 0.00 0.00 174.62 175.27 2gjx n PRO 260 N 1.46 0.01 -1.93 3.99 -0.04 -1.26 -0.98 135.00 136.25 2gjx n PRO 260 Ca -0.21 -0.01 -0.30 0.00 -0.04 0.00 0.00 63.50 62.95 2gjx n PRO 260 Cb 0.56 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.56 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 -2.99 1.63 -1.36 0.55 0.00 -1.26 -2.48 107.32 101.40 2gjx s GLY 261 Ca 0.12 -0.36 -0.08 0.00 0.00 0.00 0.00 44.72 44.40 2gjx s GLY 261 CO 0.66 -0.00 1.13 1.42 0.00 0.00 0.00 173.10 176.31 2gjx n HIS 262 N -2.95 -2.73 -2.14 1.90 8.25 -1.26 -4.81 115.22 111.48 2gjx n HIS 262 Ca 0.07 0.99 -0.10 0.00 -0.26 0.00 0.00 57.72 58.42 2gjx n HIS 262 Cb 0.57 -4.92 0.07 0.00 1.12 0.00 0.00 29.99 26.83 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 -4.86 1.94 0.07 1.59 -2.24 -1.26 -3.41 114.28 106.12 2gjx n THR 263 Ca -0.03 -3.41 -0.06 0.00 -2.27 0.00 0.00 64.05 58.28 2gjx n THR 263 Cb 0.57 -0.22 0.10 0.00 -2.10 0.00 0.00 70.33 68.69 2gjx n THR 263 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2gjx h LEU 264 N 1.89 0.32 -0.06 3.22 6.46 -1.78 -2.93 115.31 122.42 2gjx h LEU 264 Ca 0.12 -0.19 0.00 0.00 -0.12 0.00 0.00 57.88 57.69 2gjx h LEU 264 Cb 1.40 -0.09 0.00 0.00 -0.73 0.00 0.00 40.66 41.24 2gjx h LEU 264 CO 0.40 0.86 0.00 -1.54 -0.62 0.00 0.00 178.44 177.54 2gjx n SER 265 N -3.87 0.08 0.07 1.25 3.41 -1.02 -2.64 113.62 110.89 2gjx n SER 265 Ca -0.03 0.52 -0.08 0.00 -0.26 0.00 0.00 58.87 59.02 2gjx n SER 265 Cb 0.63 -0.53 -0.12 0.00 -0.26 0.00 0.00 64.21 63.93 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 0.08 0.00 7.33 4.06 -1.83 -3.40 115.95 122.20 2gjx h TRP 266 Ca 0.00 -0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.89 2gjx h TRP 266 Cb 0.32 -0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.48 2gjx h TRP 266 CO 0.00 1.05 0.00 0.41 -3.56 0.00 0.00 178.44 176.34 2gjx n GLY 267 N 1.37 -3.27 3.73 1.49 0.00 -1.08 -3.69 105.19 103.74 2gjx n GLY 267 Ca -0.01 0.65 -0.42 0.00 0.00 0.00 0.00 46.02 46.24 2gjx n GLY 267 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2gjx s PRO 268 N -2.18 4.15 0.00 1.61 0.02 -1.26 -2.82 135.00 134.51 2gjx s PRO 268 Ca 0.00 2.54 0.00 0.00 0.02 0.00 0.00 61.00 63.56 2gjx s PRO 268 Cb 0.00 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.44 2gjx s PRO 268 CO 0.00 -0.69 0.00 0.41 -0.33 0.00 0.00 177.00 176.39 2gjx n GLY 269 N 3.48 2.96 3.00 0.52 0.00 -1.26 -4.45 105.19 109.44 2gjx n GLY 269 Ca 0.13 -0.82 -0.32 0.00 0.00 0.00 0.00 46.02 45.01 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 3.03 0.52 -0.61 1.10 -1.13 -4.77 121.20 119.34 2gjx s ILE 270 Ca 0.00 -3.28 -0.21 0.00 -0.51 0.00 0.00 60.65 56.66 2gjx s ILE 270 Cb 0.00 -3.04 -0.06 0.00 0.15 0.00 0.00 42.46 39.51 2gjx s ILE 270 CO 0.00 -0.84 1.17 -2.16 -2.11 0.00 0.00 174.94 170.99 2gjx s PRO 271 N -0.32 3.46 0.00 3.50 0.04 -1.24 -3.34 135.00 137.10 2gjx s PRO 271 Ca 0.18 1.74 0.00 0.00 0.04 0.00 0.00 61.00 62.95 2gjx s PRO 271 Cb -0.23 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.15 2gjx s PRO 271 CO -0.02 -0.79 0.00 0.41 0.04 0.00 0.00 177.00 176.64 2gjx n GLY 272 N 0.35 2.86 0.17 0.56 0.00 -1.26 -4.92 105.19 102.95 2gjx n GLY 272 Ca 0.10 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.30-10.04 0.99 5.85 -1.89 -3.44 115.31 106.47 2gjx h LEU 273 Ca 0.00 -0.03 -0.45 0.00 0.84 0.00 0.00 57.88 58.24 2gjx h LEU 273 Cb 0.00 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2gjx h LEU 273 CO 0.00 -0.17 0.35 -0.76 -0.34 0.00 0.00 178.44 177.52 2gjx s LEU 274 N -10.04 3.97 -0.29 2.25 1.43 -1.26 -0.64 118.68 114.10 2gjx s LEU 274 Ca -0.15 1.75 -0.29 0.00 -1.03 0.00 0.00 54.13 54.42 2gjx s LEU 274 Cb 0.05 -4.49 0.01 0.00 0.03 0.00 0.00 46.19 41.79 2gjx s LEU 274 CO 0.64 -0.41 1.12 -0.89 0.23 0.00 0.00 176.35 177.04 2gjx s THR 275 N -2.08 4.46 -0.16 5.49 2.01 0.18 -4.66 115.64 120.88 2gjx s THR 275 Ca 0.62 1.70 -0.29 0.00 0.31 0.00 0.00 61.69 64.02 2gjx s THR 275 Cb -0.12 -4.33 -0.03 0.00 0.01 0.00 0.00 72.50 68.04 2gjx s THR 275 CO 0.16 -0.41 1.50 -2.84 -0.69 0.00 0.00 174.62 172.34 2gjx s PRO 276 N 3.65 4.06 0.03 4.92 0.02 -1.26 -0.50 135.00 145.93 2gjx s PRO 276 Ca 0.48 1.81 -0.30 0.00 0.02 0.00 0.00 61.00 63.00 2gjx s PRO 276 Cb -0.14 -3.93 -0.05 0.00 0.02 0.00 0.00 34.50 30.40 2gjx s PRO 276 CO 0.15 -0.96 1.20 0.00 -0.33 0.00 0.00 177.00 177.06 2gjx s TYR 278 N 1.34 3.59 0.00 0.00 1.51 -1.26 -1.16 117.35 121.37 2gjx s TYR 278 Ca 0.58 0.53 0.00 0.00 -1.01 0.00 0.00 57.07 57.17 2gjx s TYR 278 Cb -0.28 -1.97 0.00 0.00 -0.11 0.00 0.00 41.96 39.60 2gjx s TYR 278 CO 0.28 0.70 0.00 0.45 -1.11 0.00 0.00 175.55 175.87 2gjx n SER 279 N 2.10 0.00 0.00 2.29 2.88 -1.07 -4.70 113.62 115.11 2gjx n SER 279 Ca -0.19 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.35 2gjx n SER 279 Cb 0.55 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 2gjx n SER 279 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2gjx n GLY 280 N 2.86 0.21 0.11 0.46 0.00 -1.26 -4.95 105.19 102.62 2gjx n GLY 280 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2gjx n GLY 280 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2gjx h SER 281 N 0.00 0.36 -2.94 1.61 0.87 -1.98 -3.47 113.55 108.00 2gjx h SER 281 Ca 0.00 -0.89 -0.48 0.00 -1.23 0.00 0.00 61.79 59.20 2gjx h SER 281 Cb 0.00 -0.12 0.02 0.00 -0.44 0.00 0.00 62.40 61.86 2gjx h SER 281 CO 0.00 1.46 -0.12 -1.61 -0.53 0.00 0.00 176.83 176.03 2gjx s GLU 282 N -2.43 3.43 0.49 2.24 0.41 -1.26 -5.05 118.70 116.54 2gjx s GLU 282 Ca -0.18 -0.26 -0.11 0.00 -0.41 0.00 0.00 54.97 54.02 2gjx s GLU 282 Cb 0.02 -2.59 -0.06 0.00 -1.78 0.00 0.00 34.13 29.72 2gjx s GLU 282 CO 0.78 0.02 0.88 -1.25 -0.49 0.00 0.00 175.26 175.20 2gjx s PRO 283 N -4.44 3.75 0.24 0.39 0.04 -1.26 -2.61 135.00 131.11 2gjx s PRO 283 Ca 0.43 0.62 0.08 0.00 0.04 0.00 0.00 61.00 62.16 2gjx s PRO 283 Cb -0.10 -2.25 -0.04 0.00 0.04 0.00 0.00 34.50 32.15 2gjx s PRO 283 CO 0.38 -0.24 0.12 -1.12 0.04 0.00 0.00 177.00 176.18 2gjx s SER 284 N -3.50 5.20 0.00 6.66 0.01 -0.31 -4.78 113.70 116.98 2gjx s SER 284 Ca 0.53 -0.36 0.02 0.00 1.31 0.00 0.00 55.95 57.45 2gjx s SER 284 Cb -0.10 -1.22 0.12 0.00 0.21 0.00 0.00 66.02 65.02 2gjx s SER 284 CO 0.38 -0.01 0.49 0.61 0.41 0.00 0.00 173.24 175.12 2gjx n GLY 285 N -0.95 -0.35 3.74 3.44 0.00 -1.26 -4.38 105.19 105.42 2gjx n GLY 285 Ca -0.08 -0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.53 2gjx n GLY 285 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gjx s THR 286 N -2.00 4.48 -0.14 2.61 2.01 -1.26 -4.99 115.64 116.35 2gjx s THR 286 Ca 0.03 1.93 0.02 0.00 0.31 0.00 0.00 61.69 63.98 2gjx s THR 286 Cb 0.01 -4.25 0.01 0.00 0.01 0.00 0.00 72.50 68.28 2gjx s THR 286 CO 0.02 0.38 -0.21 -0.36 -0.69 0.00 0.00 174.62 173.76 2gjx s PHE 287 N -0.30 2.68 0.00 4.92 0.08 -1.26 -0.70 117.98 123.40 2gjx s PHE 287 Ca 0.43 -1.26 0.00 0.00 0.12 0.00 0.00 56.93 56.22 2gjx s PHE 287 Cb -0.23 -1.82 0.00 0.00 -0.57 0.00 0.00 43.02 40.40 2gjx s PHE 287 CO 0.28 -0.57 0.00 0.41 -0.10 0.00 0.00 175.22 175.24 2gjx n GLY 288 N 4.02 1.38 2.37 4.36 0.00 0.35 -4.93 105.19 112.74 2gjx n GLY 288 Ca -0.20 -1.79 -0.21 0.00 0.00 0.00 0.00 46.02 43.83 2gjx n GLY 288 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2gjx n PRO 289 N 0.00 -2.71 -1.94 1.61 -0.02 -1.26 -4.12 135.00 126.56 2gjx n PRO 289 Ca 0.00 -1.17 -0.41 0.00 -2.02 0.00 0.00 63.50 59.90 2gjx n PRO 289 Cb 0.00 -1.15 -0.02 0.00 -0.02 0.00 0.00 33.50 32.31 2gjx n PRO 289 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2gjx s VAL 290 N -2.27 2.41 -0.26 -1.45 1.01 -1.04 -0.64 120.40 118.17 2gjx s VAL 290 Ca 0.48 0.38 -0.29 0.00 0.00 0.00 0.00 61.98 62.55 2gjx s VAL 290 Cb -0.05 -3.24 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 2gjx s VAL 290 CO 0.38 0.07 1.46 0.21 0.00 0.00 0.00 175.10 177.22 2gjx s ASN 291 N 0.09 6.52 0.00 3.32 3.84 0.19 -4.69 114.94 124.21 2gjx s ASN 291 Ca 0.56 1.42 0.26 0.00 0.21 0.00 0.00 52.86 55.31 2gjx s ASN 291 Cb -0.44 -2.54 0.73 0.00 -0.55 0.00 0.00 41.25 38.46 2gjx s ASN 291 CO 0.51 -1.17 1.56 -0.81 -2.79 0.00 0.00 177.10 174.39 2gjx n PRO 292 N 7.50 0.38 -0.01 0.43 -0.04 -1.26 -4.08 135.00 137.92 2gjx n PRO 292 Ca 0.17 -0.21 -0.16 0.00 -0.04 0.00 0.00 63.50 63.26 2gjx n PRO 292 Cb 0.46 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.28 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 -1.13 1.63 -4.76 3.54 3.41 -1.26 -4.87 113.62 110.18 2gjx n SER 293 Ca 0.09 0.28 -0.39 0.00 -0.26 0.00 0.00 58.87 58.58 2gjx n SER 293 Cb 0.33 -0.54 0.02 0.00 -0.26 0.00 0.00 64.21 63.77 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 -6.66 4.04 0.17 1.04 1.43 -1.26 -4.93 118.68 112.51 2gjx s LEU 294 Ca -0.16 2.85 0.00 0.00 -1.03 0.00 0.00 54.13 55.79 2gjx s LEU 294 Cb 0.07 -4.04 0.01 0.00 0.03 0.00 0.00 46.19 42.26 2gjx s LEU 294 CO 0.79 -1.27 1.39 -1.13 0.23 0.00 0.00 176.35 176.36 2gjx h ASN 295 N 2.09 0.37 0.43 2.29 -1.24 -1.93 -3.27 115.58 114.31 2gjx h ASN 295 Ca -0.51 -0.28 -0.12 0.00 0.71 0.00 0.00 56.30 56.11 2gjx h ASN 295 Cb 1.27 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 40.20 2gjx h ASN 295 CO 0.60 1.05 -0.51 -1.13 -1.29 0.00 0.00 177.43 176.15 2gjx h ASN 296 N 0.18 0.11 -0.77 1.15 -0.00 -1.97 -3.26 115.58 111.01 2gjx h ASN 296 Ca -0.05 -0.05 0.04 0.00 -0.00 0.00 0.00 56.30 56.24 2gjx h ASN 296 Cb 1.44 -0.03 -0.05 0.00 -0.00 0.00 0.00 38.32 39.68 2gjx h ASN 296 CO 0.13 0.61 0.49 0.74 -0.00 0.00 0.00 177.43 179.40 2gjx h THR 297 N 0.08 1.09 0.00 -3.57 2.02 -1.86 -2.81 112.91 107.85 2gjx h THR 297 Ca -0.00 -0.32 -0.00 0.00 0.77 0.00 0.00 66.41 66.86 2gjx h THR 297 Cb 0.94 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 67.43 2gjx h THR 297 CO 0.07 0.17 -0.01 1.88 0.37 0.00 0.00 175.52 178.01 2gjx h TYR 298 N 0.93 0.00 -0.30 3.16 0.05 -1.73 -2.55 116.97 116.54 2gjx h TYR 298 Ca 0.32 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.93 2gjx h TYR 298 Cb 0.05 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.79 2gjx h TYR 298 CO -0.04 0.01 -0.46 0.93 -1.05 0.00 0.00 178.16 177.55 2gjx h GLU 299 N 0.00 0.83 0.42 4.88 3.07 -1.62 -2.68 114.58 119.48 2gjx h GLU 299 Ca -0.00 -0.50 -0.02 0.00 -0.50 0.00 0.00 59.36 58.34 2gjx h GLU 299 Cb 0.82 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.78 2gjx h GLU 299 CO 0.00 1.14 -0.20 0.35 -1.40 0.00 0.00 179.01 178.90 2gjx h PHE 300 N 0.61 -0.53 -0.90 4.33 3.57 -1.40 -1.75 116.94 120.87 2gjx h PHE 300 Ca 0.03 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.61 2gjx h PHE 300 Cb 1.06 0.17 -0.07 0.00 2.79 0.00 0.00 35.95 39.91 2gjx h PHE 300 CO 0.07 -0.27 0.55 0.52 -2.23 0.00 0.00 178.31 176.96 2gjx h MET 301 N -0.68 0.90 -0.56 1.11 2.86 -1.55 0.37 114.93 117.38 2gjx h MET 301 Ca -0.06 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.45 2gjx h MET 301 Cb 0.50 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 2gjx h MET 301 CO 0.10 0.59 0.05 1.03 1.06 0.00 0.00 176.91 179.74 2gjx h SER 302 N 0.92 0.89 0.67 1.22 0.87 -1.41 -1.38 113.55 115.33 2gjx h SER 302 Ca 0.43 -0.21 -0.23 0.00 -1.23 0.00 0.00 61.79 60.55 2gjx h SER 302 Cb 0.34 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 2gjx h SER 302 CO -0.23 0.92 -1.02 0.74 -0.53 0.00 0.00 176.83 176.70 2gjx h THR 303 N 0.87 1.54 0.02 2.23 2.02 -0.31 -3.05 112.91 116.22 2gjx h THR 303 Ca 0.17 -2.92 -0.00 0.00 0.77 0.00 0.00 66.41 64.43 2gjx h THR 303 Cb 0.44 2.70 0.00 0.00 -1.74 0.00 0.00 68.15 69.55 2gjx h THR 303 CO 0.02 0.85 -0.01 0.15 0.37 0.00 0.00 175.52 176.90 2gjx h PHE 304 N 0.08 -0.02 0.00 3.16 3.57 -0.18 -3.21 116.94 120.34 2gjx h PHE 304 Ca -0.07 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.43 2gjx h PHE 304 Cb 1.72 0.01 0.00 0.00 2.79 0.00 0.00 35.95 40.46 2gjx h PHE 304 CO 0.04 0.68 0.00 1.19 -2.23 0.00 0.00 178.31 177.99 2gjx n PHE 305 N -4.75 0.61 -0.16 0.41 3.72 -0.53 -1.20 117.46 115.55 2gjx n PHE 305 Ca -0.09 0.25 -0.08 0.00 -0.05 0.00 0.00 57.45 57.48 2gjx n PHE 305 Cb 0.35 -0.90 0.07 0.00 -0.94 0.00 0.00 39.48 38.06 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 0.93 -0.01 4.37 6.46 -1.54 -1.72 115.31 123.80 2gjx h LEU 306 Ca 0.00 -0.27 -0.07 0.00 -0.12 0.00 0.00 57.88 57.42 2gjx h LEU 306 Cb 0.30 -0.25 0.01 0.00 -0.73 0.00 0.00 40.66 39.98 2gjx h LEU 306 CO 0.00 1.01 -0.29 -0.08 -0.62 0.00 0.00 178.44 178.47 2gjx h GLU 307 N 0.86 0.21 -0.17 1.25 4.81 -1.19 -3.08 114.58 117.27 2gjx h GLU 307 Ca 0.15 -0.21 0.05 0.00 -0.13 0.00 0.00 59.36 59.22 2gjx h GLU 307 Cb 0.57 0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.95 2gjx h GLU 307 CO 0.03 0.93 -0.28 0.28 -0.73 0.00 0.00 179.01 179.24 2gjx h VAL 308 N -0.42 0.34 -0.01 0.32 2.07 -1.25 0.81 116.25 118.11 2gjx h VAL 308 Ca -0.03 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 2gjx h VAL 308 Cb 1.02 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.13 2gjx h VAL 308 CO 0.06 0.00 -0.02 0.77 0.02 0.00 0.00 177.57 178.40 2gjx h SER 309 N -0.34 0.01 1.73 0.57 4.64 -1.44 -0.44 113.55 118.27 2gjx h SER 309 Ca 0.11 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 2gjx h SER 309 Cb 0.51 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2gjx h SER 309 CO -0.36 0.03 -0.07 0.28 -0.87 0.00 0.00 176.83 175.85 2gjx h SER 310 N 0.01 0.00 0.00 4.97 0.02 -1.04 -3.35 113.55 114.16 2gjx h SER 310 Ca 0.00 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.81 2gjx h SER 310 Cb 0.04 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 2gjx h SER 310 CO 0.00 0.07 -0.87 0.58 -1.14 0.00 0.00 176.83 175.47 2gjx h VAL 311 N 0.00 0.82 -3.60 2.27 2.07 0.66 -3.45 116.25 115.02 2gjx h VAL 311 Ca -0.00 -1.92 -0.65 0.00 0.82 0.00 0.00 66.70 64.95 2gjx h VAL 311 Cb 0.95 1.85 -0.16 0.00 -1.52 0.00 0.00 31.29 32.41 2gjx h VAL 311 CO 0.01 0.28 -0.06 -0.36 0.02 0.00 0.00 177.57 177.46 2gjx s PHE 312 N -2.28 3.16 0.18 1.57 0.08 -0.52 -4.96 117.98 115.22 2gjx s PHE 312 Ca -0.23 0.07 0.29 0.00 0.12 0.00 0.00 56.93 57.18 2gjx s PHE 312 Cb 0.04 -2.96 1.25 0.00 -0.57 0.00 0.00 43.02 40.77 2gjx s PHE 312 CO 0.50 -0.60 1.95 -1.00 -0.10 0.00 0.00 175.22 175.98 2gjx h PRO 313 N 8.55 0.00 -6.75 0.24 0.13 -1.88 -3.44 132.00 128.85 2gjx h PRO 313 Ca -0.27 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.28 2gjx h PRO 313 Cb 1.12 0.00 0.16 0.00 0.13 0.00 0.00 31.00 32.41 2gjx h PRO 313 CO 0.79 0.11 0.05 -3.47 -0.23 0.00 0.00 178.00 175.24 2gjx n ASP 314 N -3.28 0.54 -0.14 1.44 2.03 -1.26 -4.90 116.55 110.98 2gjx n ASP 314 Ca -0.00 0.82 -0.05 0.00 0.52 0.00 0.00 54.79 56.09 2gjx n ASP 314 Cb 0.34 -1.35 0.14 0.00 -0.72 0.00 0.00 41.12 39.53 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 0.59 0.91 -2.77 -0.67 3.04 -1.93 -3.45 116.94 112.66 2gjx h PHE 315 Ca -0.47 -0.12 -0.56 0.00 3.98 0.00 0.00 57.97 60.79 2gjx h PHE 315 Cb 1.37 -0.25 -0.03 0.00 2.56 0.00 0.00 35.95 39.59 2gjx h PHE 315 CO 0.37 0.80 -0.43 0.71 -2.02 0.00 0.00 178.31 177.74 2gjx s TYR 316 N -5.08 3.49 -0.03 0.41 1.51 -1.26 0.43 117.35 116.82 2gjx s TYR 316 Ca -0.10 0.24 0.00 0.00 -1.01 0.00 0.00 57.07 56.21 2gjx s TYR 316 Cb 0.15 -1.76 0.03 0.00 -0.11 0.00 0.00 41.96 40.26 2gjx s TYR 316 CO 0.82 0.50 0.01 -0.51 -1.11 0.00 0.00 175.55 175.25 2gjx s LEU 317 N -3.01 1.16 0.01 -1.29 1.43 -0.65 -4.70 118.68 111.63 2gjx s LEU 317 Ca 0.36 -0.01 -0.29 0.00 -1.03 0.00 0.00 54.13 53.16 2gjx s LEU 317 Cb -0.12 -0.18 -0.04 0.00 0.03 0.00 0.00 46.19 45.89 2gjx s LEU 317 CO 0.28 -0.10 0.95 -2.28 0.23 0.00 0.00 176.35 175.42 2gjx s HIS 318 N 1.01 3.68 -1.31 0.29 2.46 -0.57 -2.34 115.29 118.50 2gjx s HIS 318 Ca -0.10 1.67 0.11 0.00 0.47 0.00 0.00 55.06 57.21 2gjx s HIS 318 Cb -0.13 -3.07 0.12 0.00 -0.13 0.00 0.00 32.58 29.37 2gjx s HIS 318 CO -0.02 0.04 0.91 1.28 -2.47 0.00 0.00 174.74 174.48 2gjx n LEU 319 N 3.70 2.08 0.00 8.88 4.77 -0.85 -2.86 117.00 132.72 2gjx n LEU 319 Ca 0.05 -1.16 0.00 0.00 -0.03 0.00 0.00 56.01 54.87 2gjx n LEU 319 Cb 0.51 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2gjx n LEU 319 CO 0.51 0.42 0.00 0.61 -1.33 0.00 0.00 177.39 177.61 2gjx n GLY 320 N 0.61 1.91 1.19 -0.72 0.00 -1.26 -2.25 105.19 104.66 2gjx n GLY 320 Ca 0.07 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 0.68 3.91 -0.02 0.00 -0.15 -1.98 105.19 107.63 2gjx n GLY 321 Ca 0.00 -0.21 -0.28 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.19 6.42 -0.95 1.61 -4.77 -1.26 -4.12 116.67 111.40 2gjx s ASP 322 Ca 0.00 0.64 -0.11 0.00 -3.30 0.00 0.00 52.55 49.77 2gjx s ASP 322 Cb 0.00 -2.11 0.01 0.00 -1.09 0.00 0.00 42.92 39.73 2gjx s ASP 322 CO 0.00 -0.18 0.64 -0.62 0.70 0.00 0.00 175.17 175.71 2gjx n GLU 323 N -0.95 -1.13 -3.40 2.11 1.02 -1.26 -4.55 120.64 112.48 2gjx n GLU 323 Ca -0.02 0.56 -0.40 0.00 -0.02 0.00 0.00 57.16 57.28 2gjx n GLU 323 Cb 0.54 -2.52 -0.09 0.00 -0.02 0.00 0.00 31.44 29.35 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 -3.17 5.17 -0.46 2.62 1.01 -1.26 -4.69 120.40 119.63 2gjx s VAL 324 Ca 0.17 0.26 -0.29 0.00 0.00 0.00 0.00 61.98 62.12 2gjx s VAL 324 Cb -0.09 -3.77 0.01 0.00 0.00 0.00 0.00 36.38 32.54 2gjx s VAL 324 CO 0.91 0.01 1.38 -0.62 0.00 0.00 0.00 175.10 176.79 2gjx s ASP 325 N 1.71 6.31 0.31 3.32 2.15 -1.26 -4.87 116.67 124.34 2gjx s ASP 325 Ca 0.13 0.66 0.19 0.00 0.43 0.00 0.00 52.55 53.96 2gjx s ASP 325 Cb -0.16 -2.54 0.15 0.00 -0.30 0.00 0.00 42.92 40.07 2gjx s ASP 325 CO 0.11 -1.48 1.40 -0.26 -0.17 0.00 0.00 175.17 174.77 2gjx h PHE 326 N 10.65 0.00 0.00 -5.34 0.04 -1.96 -3.36 116.94 116.97 2gjx h PHE 326 Ca -0.27 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.44 2gjx h PHE 326 Cb 1.10 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.24 2gjx h PHE 326 CO 0.99 0.24 -0.28 0.00 -0.60 0.00 0.00 178.31 178.66 2gjx h THR 327 N 0.00 0.91 -0.11 -1.55 1.03 -2.01 -2.88 112.91 108.31 2gjx h THR 327 Ca -0.02 -1.08 -0.20 0.00 -0.01 0.00 0.00 66.41 65.10 2gjx h THR 327 Cb 1.20 1.63 0.00 0.00 -1.07 0.00 0.00 68.15 69.91 2gjx h THR 327 CO 0.03 0.27 -0.76 0.00 -0.01 0.00 0.00 175.52 175.06 2gjx h TRP 329 N 0.40 0.93 -0.57 0.00 6.55 -1.75 -3.11 115.95 118.41 2gjx h TRP 329 Ca -0.04 -0.06 0.07 0.00 0.95 0.00 0.00 58.89 59.80 2gjx h TRP 329 Cb 1.36 -0.28 -0.06 0.00 -0.86 0.00 0.00 29.16 29.32 2gjx h TRP 329 CO 0.06 0.73 0.27 -0.22 -1.05 0.00 0.00 178.44 178.23 2gjx h LYS 330 N 0.87 0.49 -0.13 0.49 3.64 -1.47 -2.68 116.57 117.78 2gjx h LYS 330 Ca 0.21 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.48 2gjx h LYS 330 Cb 0.17 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 2gjx h LYS 330 CO -0.02 0.32 -0.31 0.66 -2.27 0.00 0.00 179.45 177.83 2gjx h SER 331 N 0.50 0.24 -2.67 4.20 4.64 -1.47 -3.44 113.55 115.56 2gjx h SER 331 Ca 0.27 -0.08 -0.54 0.00 -0.47 0.00 0.00 61.79 60.96 2gjx h SER 331 Cb 0.23 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.26 2gjx h SER 331 CO -0.22 0.55 1.03 0.21 -0.87 0.00 0.00 176.83 177.54 2gjx s ASN 332 N -6.87 6.68 0.21 4.97 3.84 -1.01 -4.61 114.94 118.14 2gjx s ASN 332 Ca -0.05 2.27 -0.08 0.00 0.21 0.00 0.00 52.86 55.21 2gjx s ASN 332 Cb 0.14 -2.54 0.16 0.00 -0.55 0.00 0.00 41.25 38.45 2gjx s ASN 332 CO 0.76 -0.89 1.78 -0.65 -2.79 0.00 0.00 177.10 175.31 2gjx h PRO 333 N 9.04 1.18 0.00 0.43 0.11 -1.86 -2.62 132.00 138.29 2gjx h PRO 333 Ca -0.40 -0.21 -0.03 0.00 0.11 0.00 0.00 66.00 65.47 2gjx h PRO 333 Cb 1.18 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 2gjx h PRO 333 CO 0.94 0.96 -0.15 1.49 -0.21 0.00 0.00 178.00 181.02 2gjx h GLU 334 N 1.15 0.00 -0.02 1.05 4.81 -1.94 -1.70 114.58 117.94 2gjx h GLU 334 Ca 0.27 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.35 2gjx h GLU 334 Cb 0.21 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.60 2gjx h GLU 334 CO -0.02 0.15 -0.57 0.82 -0.73 0.00 0.00 179.01 178.66 2gjx h ILE 335 N 0.00 1.42 -0.36 2.32 1.08 -1.75 -2.96 117.51 117.26 2gjx h ILE 335 Ca -0.00 -2.03 -0.04 0.00 -0.39 0.00 0.00 64.86 62.39 2gjx h ILE 335 Cb 0.61 2.54 -0.02 0.00 -3.07 0.00 0.00 36.82 36.88 2gjx h ILE 335 CO 0.02 0.59 0.04 1.56 -0.69 0.00 0.00 178.15 179.68 2gjx h GLN 336 N -0.09 0.54 0.00 2.37 4.20 -1.31 0.21 115.11 121.04 2gjx h GLN 336 Ca -0.07 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.53 2gjx h GLN 336 Cb 1.28 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.97 2gjx h GLN 336 CO 0.11 0.54 -0.04 0.22 -0.67 0.00 0.00 178.83 178.99 2gjx h ASP 337 N 0.53 0.00 0.64 1.46 3.58 -1.30 -0.42 116.42 120.91 2gjx h ASP 337 Ca 0.12 0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.45 2gjx h ASP 337 Cb 0.28 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.31 2gjx h ASP 337 CO 0.00 0.04 -1.45 0.33 -2.88 0.00 0.00 179.24 175.29 2gjx n PHE 338 N -3.63 0.78 -0.14 0.28 7.35 -0.12 -3.76 117.46 118.22 2gjx n PHE 338 Ca -0.02 0.25 -0.10 0.00 -0.76 0.00 0.00 57.45 56.82 2gjx n PHE 338 Cb 0.14 -0.97 -0.01 0.00 0.35 0.00 0.00 39.48 38.98 2gjx n PHE 338 CO 0.00 0.00 0.00 0.52 -0.76 0.00 0.00 176.76 176.52 2gjx h MET 339 N 0.00 0.67 0.09 -4.13 2.86 0.68 -3.21 114.93 111.90 2gjx h MET 339 Ca -0.13 -0.18 -0.27 0.00 -2.06 0.00 0.00 59.70 57.06 2gjx h MET 339 Cb 1.39 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.97 2gjx h MET 339 CO 0.03 0.72 -1.30 0.07 1.06 0.00 0.00 176.91 177.49 2gjx h ARG 340 N 0.52 0.20 0.00 1.72 0.11 -1.69 -1.74 114.38 113.50 2gjx h ARG 340 Ca 0.12 -0.34 0.00 0.00 0.10 0.00 0.00 59.98 59.86 2gjx h ARG 340 Cb 0.38 0.13 0.00 0.00 1.11 0.00 0.00 29.97 31.59 2gjx h ARG 340 CO 0.01 1.11 0.00 1.63 0.10 0.00 0.00 179.97 182.82 2gjx n LYS 341 N -3.45 0.71 0.00 0.08 5.02 -1.23 -2.20 118.16 117.09 2gjx n LYS 341 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 2gjx n LYS 341 Cb 1.01 -1.01 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2gjx n LYS 341 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2gjx n LYS 342 N -0.51 2.74 -1.99 1.97 4.76 -1.21 -5.06 118.16 118.85 2gjx n LYS 342 Ca 0.00 0.00 -0.02 0.00 -2.87 0.00 0.00 58.31 55.42 2gjx n LYS 342 Cb 0.00 -0.22 0.01 0.00 -1.84 0.00 0.00 35.03 32.98 2gjx n LYS 342 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2gjx n GLY 343 N 0.42 0.47 0.01 0.72 0.00 -0.93 -5.00 105.19 100.87 2gjx n GLY 343 Ca 0.00 -0.32 0.02 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.51 0.00 0.00 1.61 3.72 -0.66 -5.05 117.46 115.56 2gjx n PHE 344 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 2gjx n PHE 344 Cb 0.52 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.06 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 1.05 2.62 0.44 1.37 0.00 -1.25 -2.09 105.19 107.34 2gjx n GLY 345 Ca 0.01 0.18 0.07 0.00 0.00 0.00 0.00 46.02 46.28 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 6.39 1.03 -3.33 1.61 -0.58 -1.26 -4.66 120.64 119.83 2gjx n GLU 346 Ca 0.00 -2.47 -0.43 0.00 -0.42 0.00 0.00 57.16 53.83 2gjx n GLU 346 Cb 0.00 -1.21 -0.08 0.00 -0.57 0.00 0.00 31.44 29.57 2gjx n GLU 346 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2gjx s ASP 347 N -2.59 6.17 0.00 1.62 3.68 -0.89 -4.92 116.67 119.75 2gjx s ASP 347 Ca 0.29 -0.92 0.26 0.00 2.13 0.00 0.00 52.55 54.31 2gjx s ASP 347 Cb 0.27 -2.21 0.71 0.00 -1.45 0.00 0.00 42.92 40.24 2gjx s ASP 347 CO -0.02 -0.63 1.54 0.49 0.13 0.00 0.00 175.17 176.68 2gjx n PHE 348 N 5.52 0.00 0.13 -5.34 3.72 -1.26 -3.79 117.46 116.44 2gjx n PHE 348 Ca -0.09 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.30 2gjx n PHE 348 Cb 0.46 -0.14 0.15 0.00 -0.94 0.00 0.00 39.48 39.01 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 0.98 0.00 0.00 -1.08 1.57 -1.94 -2.71 116.57 113.39 2gjx h LYS 349 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2gjx h LYS 349 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 2gjx h LYS 349 CO 0.00 0.63 -0.65 0.00 -0.57 0.00 0.00 179.45 178.86 2gjx n GLN 350 N -3.69 0.16 -0.07 3.15 10.64 -1.25 -2.64 117.38 123.68 2gjx n GLN 350 Ca -0.01 0.03 -0.15 0.00 -1.83 0.00 0.00 57.00 55.05 2gjx n GLN 350 Cb 0.65 -1.58 -0.05 0.00 -0.86 0.00 0.00 30.24 28.39 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 0.81 -0.72 2.61 5.85 -1.62 -2.30 115.31 119.94 2gjx h LEU 351 Ca 0.00 -0.54 -0.10 0.00 0.84 0.00 0.00 57.88 58.08 2gjx h LEU 351 Cb 0.63 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2gjx h LEU 351 CO 0.00 1.20 -0.10 -0.08 -0.34 0.00 0.00 178.44 179.11 2gjx h GLU 352 N 0.46 0.87 -0.80 1.25 4.81 -1.55 -2.70 114.58 116.92 2gjx h GLU 352 Ca 0.01 -0.30 0.08 0.00 -0.13 0.00 0.00 59.36 59.02 2gjx h GLU 352 Cb 1.05 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 30.31 2gjx h GLU 352 CO 0.10 0.93 0.52 1.03 -0.73 0.00 0.00 179.01 180.87 2gjx h SER 353 N 0.78 0.72 -0.59 1.04 0.87 -1.37 0.88 113.55 115.88 2gjx h SER 353 Ca 0.13 0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.65 2gjx h SER 353 Cb 0.62 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 2gjx h SER 353 CO 0.04 0.45 0.16 0.15 -0.53 0.00 0.00 176.83 177.10 2gjx h PHE 354 N 0.81 0.97 -0.37 2.24 3.57 -1.10 -1.59 116.94 121.48 2gjx h PHE 354 Ca 0.36 -0.11 -0.10 0.00 3.53 0.00 0.00 57.97 61.65 2gjx h PHE 354 Cb 0.33 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 2gjx h PHE 354 CO -0.00 0.82 -0.14 -0.92 -2.23 0.00 0.00 178.31 175.83 2gjx h TYR 355 N 0.85 0.86 -0.22 0.41 3.20 -0.90 -2.73 116.97 118.43 2gjx h TYR 355 Ca 0.19 -0.20 -0.05 0.00 3.14 0.00 0.00 58.73 61.81 2gjx h TYR 355 Cb 0.32 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 2gjx h TYR 355 CO 0.02 0.92 -0.05 0.82 -1.64 0.00 0.00 178.16 178.24 2gjx h ILE 356 N 0.55 1.28 -0.41 1.81 2.04 -0.85 -1.85 117.51 120.08 2gjx h ILE 356 Ca 0.09 -1.03 0.07 0.00 1.00 0.00 0.00 64.86 64.98 2gjx h ILE 356 Cb 0.68 1.52 -0.06 0.00 -0.74 0.00 0.00 36.82 38.22 2gjx h ILE 356 CO 0.05 0.32 0.06 1.56 0.00 0.00 0.00 178.15 180.13 2gjx h GLN 357 N 0.14 0.17 -0.85 2.37 4.20 -1.32 0.30 115.11 120.13 2gjx h GLN 357 Ca 0.05 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 2gjx h GLN 357 Cb 0.50 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.20 2gjx h GLN 357 CO 0.02 0.11 0.51 1.15 -0.67 0.00 0.00 178.83 179.96 2gjx h THR 358 N 0.18 1.23 -0.47 -0.54 2.02 -1.44 -1.26 112.91 112.64 2gjx h THR 358 Ca 0.20 -0.50 -0.13 0.00 0.77 0.00 0.00 66.41 66.75 2gjx h THR 358 Cb 0.26 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.70 2gjx h THR 358 CO -0.28 0.24 -0.22 0.25 0.37 0.00 0.00 175.52 175.88 2gjx h LEU 359 N 1.16 0.98 -1.00 2.58 5.85 -0.43 -2.61 115.31 121.83 2gjx h LEU 359 Ca 0.30 -0.37 -0.09 0.00 0.84 0.00 0.00 57.88 58.56 2gjx h LEU 359 Cb -0.05 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.69 2gjx h LEU 359 CO -0.06 1.15 -0.29 -0.07 -0.34 0.00 0.00 178.44 178.83 2gjx h LEU 360 N 0.82 0.37 -0.45 2.25 3.38 -0.08 -2.46 115.31 119.15 2gjx h LEU 360 Ca 0.11 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 2gjx h LEU 360 Cb 0.78 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 2gjx h LEU 360 CO 0.06 0.65 -0.05 0.44 0.09 0.00 0.00 178.44 179.63 2gjx h ASP 361 N 0.32 0.83 -0.55 -0.43 3.32 -1.10 -1.49 116.42 117.33 2gjx h ASP 361 Ca 0.05 -0.34 -0.02 0.00 0.02 0.00 0.00 57.03 56.74 2gjx h ASP 361 Cb 0.68 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.98 2gjx h ASP 361 CO 0.05 0.97 0.28 0.40 -1.72 0.00 0.00 179.24 179.22 2gjx h ILE 362 N 0.68 1.20 -0.65 0.35 2.04 -1.29 -1.08 117.51 118.76 2gjx h ILE 362 Ca 0.12 -0.54 -0.06 0.00 1.00 0.00 0.00 64.86 65.38 2gjx h ILE 362 Cb 0.58 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 2gjx h ILE 362 CO 0.03 0.22 0.15 0.58 0.00 0.00 0.00 178.15 179.14 2gjx h VAL 363 N 0.74 1.26 -0.03 1.67 2.07 -1.36 -2.62 116.25 117.97 2gjx h VAL 363 Ca 0.19 -0.94 -0.06 0.00 0.82 0.00 0.00 66.70 66.71 2gjx h VAL 363 Cb 0.10 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 2gjx h VAL 363 CO -0.03 0.36 -0.27 0.28 0.02 0.00 0.00 177.57 177.93 2gjx h SER 364 N 0.96 0.04 0.56 0.57 0.02 -0.99 -2.48 113.55 112.24 2gjx h SER 364 Ca 0.20 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.07 2gjx h SER 364 Cb 0.37 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 2gjx h SER 364 CO 0.00 0.32 -0.33 0.77 -1.14 0.00 0.00 176.83 176.45 2gjx h SER 365 N 0.04 0.00 -0.27 3.07 4.64 -0.82 -2.15 113.55 118.06 2gjx h SER 365 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2gjx h SER 365 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2gjx h SER 365 CO 0.04 0.33 0.00 -1.22 -0.87 0.00 0.00 176.83 175.11 2gjx n TYR 366 N -3.77 0.35 -2.63 4.77 4.02 -0.97 -4.94 117.16 113.98 2gjx n TYR 366 Ca -0.01 -0.18 -0.08 0.00 -0.01 0.00 0.00 57.90 57.62 2gjx n TYR 366 Cb 0.42 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.78 2gjx n TYR 366 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2gjx n GLY 367 N 1.20 0.05 3.03 2.72 0.00 -0.81 -5.05 105.19 106.33 2gjx n GLY 367 Ca 0.16 -0.17 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 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 -4.53 0.70 0.85 1.61 -0.14 -0.98 -4.99 119.74 112.27 2gjx s LYS 368 Ca 0.02 -0.37 -0.10 0.00 -1.36 0.00 0.00 55.97 54.17 2gjx s LYS 368 Cb -0.00 -0.67 0.16 0.00 -1.68 0.00 0.00 37.83 35.64 2gjx s LYS 368 CO 0.34 0.18 1.18 0.20 -0.76 0.00 0.00 175.35 176.49 2gjx s GLY 369 N -0.36 1.76 -0.13 -3.33 0.00 0.17 -4.02 107.32 101.42 2gjx s GLY 369 Ca 0.02 -1.38 -0.11 0.00 0.00 0.00 0.00 44.72 43.26 2gjx s GLY 369 CO -0.00 -0.71 0.33 -2.52 0.00 0.00 0.00 173.10 170.20 2gjx s TYR 370 N -3.57 -0.38 -0.08 1.90 1.13 -1.26 -1.64 117.35 113.45 2gjx s TYR 370 Ca 0.70 0.92 0.00 0.00 -1.41 0.00 0.00 57.07 57.28 2gjx s TYR 370 Cb -0.05 0.13 -0.03 0.00 -1.10 0.00 0.00 41.96 40.91 2gjx s TYR 370 CO 0.49 -0.20 -0.07 0.08 -2.51 0.00 0.00 175.55 173.34 2gjx s VAL 371 N 0.39 3.68 0.07 -3.49 1.01 -0.99 -2.84 120.40 118.23 2gjx s VAL 371 Ca -0.02 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.49 2gjx s VAL 371 Cb -0.04 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 2gjx s VAL 371 CO -0.02 0.59 -0.05 0.54 0.00 0.00 0.00 175.10 176.16 2gjx s VAL 372 N -0.64 0.47 0.73 2.92 0.11 -0.28 -2.01 120.40 121.69 2gjx s VAL 372 Ca 0.10 -1.72 -0.11 0.00 -2.93 0.00 0.00 61.98 57.32 2gjx s VAL 372 Cb -0.11 -1.40 0.03 0.00 -1.53 0.00 0.00 36.38 33.36 2gjx s VAL 372 CO 0.02 -0.84 1.07 0.26 -3.33 0.00 0.00 175.10 172.28 2gjx s TRP 373 N -3.32 2.91 0.58 1.54 0.52 -0.84 -0.59 118.94 119.75 2gjx s TRP 373 Ca 0.06 1.47 0.35 0.00 0.02 0.00 0.00 56.10 58.00 2gjx s TRP 373 Cb 0.03 -2.95 1.99 0.00 -1.15 0.00 0.00 33.47 31.40 2gjx s TRP 373 CO -0.06 -1.45 2.27 -0.56 0.02 0.00 0.00 176.95 177.17 2gjx h GLN 374 N -0.88 0.00 -0.41 4.98 3.07 -1.74 -2.98 115.11 117.15 2gjx h GLN 374 Ca -0.44 0.00 0.07 0.00 0.09 0.00 0.00 58.65 58.37 2gjx h GLN 374 Cb 1.22 0.00 -0.06 0.00 0.08 0.00 0.00 27.48 28.72 2gjx h GLN 374 CO 0.55 0.02 0.06 0.93 0.09 0.00 0.00 178.83 180.48 2gjx h GLU 375 N 0.00 0.18 -0.88 0.06 3.07 -1.89 0.55 114.58 115.67 2gjx h GLU 375 Ca -0.00 -0.01 0.16 0.00 -0.50 0.00 0.00 59.36 59.01 2gjx h GLU 375 Cb 0.06 -0.04 -0.10 0.00 -0.84 0.00 0.00 28.75 27.83 2gjx h GLU 375 CO 0.00 0.12 0.46 0.28 -1.40 0.00 0.00 179.01 178.47 2gjx h VAL 376 N 0.19 0.68 0.10 3.13 2.07 -1.67 0.44 116.25 121.19 2gjx h VAL 376 Ca 0.20 -0.21 -0.26 0.00 0.82 0.00 0.00 66.70 67.25 2gjx h VAL 376 Cb 0.26 0.02 0.01 0.00 -1.52 0.00 0.00 31.29 30.05 2gjx h VAL 376 CO -0.28 0.11 -1.17 0.15 0.02 0.00 0.00 177.57 176.40 2gjx h PHE 377 N 0.61 0.56 -0.35 1.57 3.04 -1.46 -2.05 116.94 118.86 2gjx h PHE 377 Ca 0.50 -0.38 -0.12 0.00 3.98 0.00 0.00 57.97 61.94 2gjx h PHE 377 Cb 0.76 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.22 2gjx h PHE 377 CO -0.09 1.26 -0.29 -0.44 -2.02 0.00 0.00 178.31 176.74 2gjx h ASP 378 N 0.12 0.76 -0.01 0.41 3.45 0.14 -2.55 116.42 118.75 2gjx h ASP 378 Ca -0.13 -0.30 0.00 0.00 0.43 0.00 0.00 57.03 57.03 2gjx h ASP 378 Cb 1.87 -0.21 0.00 0.00 -0.56 0.00 0.00 39.33 40.43 2gjx h ASP 378 CO 0.20 1.00 0.00 0.59 -1.57 0.00 0.00 179.24 179.46 2gjx n ASN 379 N -4.09 0.22 -3.33 6.45 4.13 0.14 -4.94 115.26 113.85 2gjx n ASN 379 Ca -0.01 -1.15 -0.17 0.00 1.68 0.00 0.00 54.58 54.93 2gjx n ASN 379 Cb 0.47 -0.00 0.06 0.00 -1.54 0.00 0.00 39.78 38.76 2gjx n ASN 379 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2gjx n LYS 380 N -0.79 -1.95 -3.24 3.52 4.76 -0.96 -4.88 118.16 114.62 2gjx n LYS 380 Ca 0.22 0.84 -0.39 0.00 -2.87 0.00 0.00 58.31 56.10 2gjx n LYS 380 Cb 0.14 -5.44 -0.07 0.00 -1.84 0.00 0.00 35.03 27.82 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 -3.37 5.10 -0.32 -0.18 1.01 -0.78 -4.98 120.40 116.87 2gjx s VAL 381 Ca 0.42 0.94 -0.35 0.00 0.00 0.00 0.00 61.98 62.99 2gjx s VAL 381 Cb -0.08 -3.84 -0.11 0.00 0.00 0.00 0.00 36.38 32.35 2gjx s VAL 381 CO 0.77 0.16 2.15 1.17 0.00 0.00 0.00 175.10 179.35 2gjx n LYS 382 N 4.94 1.18 -4.16 2.72 4.81 -1.26 -4.86 118.16 121.52 2gjx n LYS 382 Ca -0.05 0.33 -0.13 0.00 -0.87 0.00 0.00 58.31 57.59 2gjx n LYS 382 Cb 0.50 -2.49 -0.11 0.00 0.02 0.00 0.00 35.03 32.96 2gjx n LYS 382 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 2gjx s ILE 383 N 7.02 0.83 0.44 3.15 2.07 -1.26 -4.70 121.20 128.75 2gjx s ILE 383 Ca 1.08 -1.62 -0.25 0.00 -1.41 0.00 0.00 60.65 58.45 2gjx s ILE 383 Cb -0.84 -1.32 -0.08 0.00 0.13 0.00 0.00 42.46 40.36 2gjx s ILE 383 CO 0.49 -0.60 1.36 -1.10 -1.91 0.00 0.00 174.94 173.18 2gjx s GLN 384 N -2.83 3.76 0.53 3.50 -1.52 -1.26 -4.91 119.66 116.92 2gjx s GLN 384 Ca 0.05 2.26 0.35 0.00 -1.95 0.00 0.00 55.36 56.06 2gjx s GLN 384 Cb -0.02 -2.65 1.59 0.00 -0.22 0.00 0.00 33.01 31.71 2gjx s GLN 384 CO -0.01 -0.70 2.03 -1.00 -0.25 0.00 0.00 175.29 175.36 2gjx h PRO 385 N 2.38 0.00 -0.01 2.91 0.13 -1.98 -2.76 132.00 132.67 2gjx h PRO 385 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2gjx h PRO 385 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2gjx h PRO 385 CO 0.61 0.00 -0.05 -0.40 -0.23 0.00 0.00 178.00 177.94 2gjx n ASP 386 N -2.92 1.05 -4.77 1.44 5.75 -1.26 -4.58 116.55 111.26 2gjx n ASP 386 Ca -0.00 -1.22 -0.38 0.00 -0.01 0.00 0.00 54.79 53.18 2gjx n ASP 386 Cb 0.22 0.01 -0.00 0.00 -1.03 0.00 0.00 41.12 40.31 2gjx n ASP 386 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2gjx s THR 387 N -2.12 2.93 -0.26 2.12 2.01 -1.05 -4.85 115.64 114.42 2gjx s THR 387 Ca 0.37 0.72 -0.12 0.00 0.31 0.00 0.00 61.69 62.97 2gjx s THR 387 Cb 0.21 -3.38 -0.05 0.00 0.01 0.00 0.00 72.50 69.29 2gjx s THR 387 CO 0.38 0.02 0.25 -0.63 -0.69 0.00 0.00 174.62 173.95 2gjx s ILE 388 N -1.46 5.28 -0.23 1.82 1.01 -1.13 -3.50 121.20 122.99 2gjx s ILE 388 Ca 0.63 0.33 -0.11 0.00 0.00 0.00 0.00 60.65 61.51 2gjx s ILE 388 Cb -0.31 -3.59 -0.05 0.00 0.01 0.00 0.00 42.46 38.52 2gjx s ILE 388 CO 0.38 0.25 0.17 -0.63 0.00 0.00 0.00 174.94 175.11 2gjx s ILE 389 N 1.59 5.36 -0.36 2.92 -1.09 0.63 -1.13 121.20 129.13 2gjx s ILE 389 Ca 0.10 0.21 -0.11 0.00 -2.23 0.00 0.00 60.65 58.63 2gjx s ILE 389 Cb -0.15 -3.51 0.01 0.00 -1.58 0.00 0.00 42.46 37.24 2gjx s ILE 389 CO 0.09 0.36 0.20 -1.58 -1.23 0.00 0.00 174.94 172.78 2gjx s GLN 390 N 0.90 3.02 -0.36 2.79 0.74 0.24 -0.84 119.66 126.15 2gjx s GLN 390 Ca 0.08 -0.95 -0.28 0.00 0.05 0.00 0.00 55.36 54.26 2gjx s GLN 390 Cb -0.13 -3.70 0.02 0.00 1.10 0.00 0.00 33.01 30.30 2gjx s GLN 390 CO 0.03 -0.61 1.04 0.08 -0.55 0.00 0.00 175.29 175.29 2gjx s VAL 391 N 1.59 4.48 -0.01 1.34 1.01 0.37 -1.94 120.40 127.23 2gjx s VAL 391 Ca 0.03 1.50 0.02 0.00 0.00 0.00 0.00 61.98 63.53 2gjx s VAL 391 Cb -0.18 -4.42 -0.03 0.00 0.00 0.00 0.00 36.38 31.74 2gjx s VAL 391 CO 0.07 -0.59 0.03 -2.67 0.00 0.00 0.00 175.10 171.95 2gjx n TRP 392 N 7.01 0.00 -3.07 5.22 4.27 -1.26 -1.71 117.44 127.90 2gjx n TRP 392 Ca 0.11 0.00 -0.36 0.00 -3.89 0.00 0.00 57.50 53.35 2gjx n TRP 392 Cb 0.48 -0.09 -0.06 0.00 -1.36 0.00 0.00 31.31 30.28 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 -2.12 4.28 -0.16 -2.67 0.52 -1.26 -3.99 118.95 113.55 2gjx s ARG 393 Ca -0.01 0.91 0.11 0.00 -0.52 0.00 0.00 55.73 56.23 2gjx s ARG 393 Cb 0.01 -2.87 -0.18 0.00 0.52 0.00 0.00 34.95 32.43 2gjx s ARG 393 CO 0.10 0.38 0.01 -0.85 0.02 0.00 0.00 175.30 174.96 2gjx n GLU 394 N 0.71 1.27 0.00 3.54 0.28 -1.26 -4.28 120.64 120.90 2gjx n GLU 394 Ca -0.02 0.02 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2gjx n GLU 394 Cb 0.51 -1.40 0.00 0.00 1.43 0.00 0.00 31.44 31.98 2gjx n GLU 394 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2gjx n ASP 395 N -2.68 0.00 -4.71 -1.84 9.92 -1.26 -2.33 116.55 113.65 2gjx n ASP 395 Ca -0.27 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 53.57 2gjx n ASP 395 Cb 0.98 -0.24 -0.03 0.00 -0.64 0.00 0.00 41.12 41.19 2gjx n ASP 395 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 2gjx s ILE 396 N -0.85 3.83 -0.67 0.53 2.07 -1.26 0.74 121.20 125.58 2gjx s ILE 396 Ca 0.00 1.31 0.24 0.00 -1.41 0.00 0.00 60.65 60.80 2gjx s ILE 396 Cb 0.00 -3.84 0.07 0.00 0.13 0.00 0.00 42.46 38.82 2gjx s ILE 396 CO 0.00 0.10 1.37 -0.81 -1.91 0.00 0.00 174.94 173.69 2gjx n PRO 397 N 3.97 0.27 -3.62 3.50 -0.05 -1.26 -4.77 135.00 133.04 2gjx n PRO 397 Ca 0.10 0.09 -0.12 0.00 -0.05 0.00 0.00 63.50 63.52 2gjx n PRO 397 Cb 0.45 -1.68 -0.05 0.00 -0.05 0.00 0.00 33.50 32.17 2gjx n PRO 397 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 175.50 175.99 2gjx s VAL 398 N -3.15 0.05 0.16 0.52 0.11 0.23 -5.14 120.40 113.18 2gjx s VAL 398 Ca 0.07 -0.43 -0.32 0.00 -2.93 0.00 0.00 61.98 58.37 2gjx s VAL 398 Cb 0.14 -1.04 -0.17 0.00 -1.53 0.00 0.00 36.38 33.77 2gjx s VAL 398 CO 0.71 -0.24 0.81 -3.20 -3.33 0.00 0.00 175.10 169.85 2gjx n ASN 399 N 0.14 -0.24 0.26 3.54 4.05 -1.21 -4.32 115.26 117.47 2gjx n ASN 399 Ca -0.17 1.14 0.16 0.00 0.45 0.00 0.00 54.58 56.16 2gjx n ASN 399 Cb 0.62 -1.03 0.89 0.00 1.23 0.00 0.00 39.78 41.49 2gjx n ASN 399 CO 0.00 0.00 0.00 0.10 -3.05 0.00 0.00 177.26 174.31 2gjx h TYR 400 N 1.97 0.00 -0.03 1.20 -0.00 -1.64 0.13 116.97 118.59 2gjx h TYR 400 Ca -0.37 0.00 -0.15 0.00 0.00 0.00 0.00 58.73 58.21 2gjx h TYR 400 Cb 1.41 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 38.13 2gjx h TYR 400 CO 0.48 0.00 -0.67 0.52 -0.00 0.00 0.00 178.16 178.49 2gjx h MET 401 N 0.00 0.14 -0.09 0.10 2.86 -1.89 -2.00 114.93 114.05 2gjx h MET 401 Ca 0.04 -0.11 -0.20 0.00 -2.06 0.00 0.00 59.70 57.37 2gjx h MET 401 Cb 0.23 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.91 2gjx h MET 401 CO -0.00 0.75 -0.78 0.87 1.06 0.00 0.00 176.91 178.82 2gjx h LYS 402 N 0.10 0.54 -0.54 1.72 1.79 -1.13 -2.89 116.57 116.16 2gjx h LYS 402 Ca -0.01 -0.46 0.01 0.00 -2.18 0.00 0.00 60.65 58.01 2gjx h LYS 402 Cb 1.19 0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 31.92 2gjx h LYS 402 CO 0.10 1.09 0.35 0.93 -1.08 0.00 0.00 179.45 180.83 2gjx h GLU 403 N 0.36 0.68 -0.68 3.15 4.39 -1.01 0.27 114.58 121.75 2gjx h GLU 403 Ca -0.05 -0.04 0.06 0.00 0.34 0.00 0.00 59.36 59.67 2gjx h GLU 403 Cb 1.38 -0.15 -0.06 0.00 -0.10 0.00 0.00 28.75 29.82 2gjx h GLU 403 CO 0.14 0.45 0.38 -0.07 -1.16 0.00 0.00 179.01 178.76 2gjx h LEU 404 N 0.70 0.57 0.67 1.33 3.38 -1.39 0.64 115.31 121.22 2gjx h LEU 404 Ca 0.20 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 2gjx h LEU 404 Cb -0.06 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 40.62 2gjx h LEU 404 CO -0.06 0.37 -0.32 -0.08 0.09 0.00 0.00 178.44 178.44 2gjx h GLU 405 N 0.70 -0.87 -0.73 1.13 4.81 -1.09 -1.63 114.58 116.90 2gjx h GLU 405 Ca 0.31 0.06 0.08 0.00 -0.13 0.00 0.00 59.36 59.68 2gjx h GLU 405 Cb 0.19 0.20 -0.07 0.00 0.63 0.00 0.00 28.75 29.70 2gjx h GLU 405 CO -0.18 -0.56 0.40 -0.07 -0.73 0.00 0.00 179.01 177.87 2gjx h LEU 406 N -0.98 0.56 -0.44 1.64 4.07 -0.27 0.83 115.31 120.72 2gjx h LEU 406 Ca -0.09 0.04 -0.03 0.00 0.08 0.00 0.00 57.88 57.88 2gjx h LEU 406 Cb 0.71 -0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.37 2gjx h LEU 406 CO 0.15 0.34 0.16 0.58 -1.08 0.00 0.00 178.44 178.59 2gjx h VAL 407 N 0.70 1.21 0.00 1.22 2.07 -0.86 -1.72 116.25 118.87 2gjx h VAL 407 Ca 0.35 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 67.19 2gjx h VAL 407 Cb 0.30 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 2gjx h VAL 407 CO -0.23 0.25 0.00 0.71 0.02 0.00 0.00 177.57 178.32 2gjx h THR 408 N 0.57 0.00 0.00 2.57 1.35 -0.80 -1.52 112.91 115.08 2gjx h THR 408 Ca 0.14 -0.85 -0.09 0.00 -0.55 0.00 0.00 66.41 65.07 2gjx h THR 408 Cb 0.23 1.84 -0.01 0.00 -1.73 0.00 0.00 68.15 68.48 2gjx h THR 408 CO -0.01 0.00 -0.43 0.50 -0.25 0.00 0.00 175.52 175.33 2gjx h LYS 409 N 0.00 0.00 -0.25 4.72 1.63 0.10 -2.69 116.57 120.08 2gjx h LYS 409 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2gjx h LYS 409 Cb 0.89 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.52 2gjx h LYS 409 CO 0.00 0.43 0.00 0.00 -3.45 0.00 0.00 179.45 176.43 2gjx n ALA 410 N -2.29 2.48 -1.96 5.00 0.00 -0.68 -4.94 120.51 118.11 2gjx n ALA 410 Ca 0.00 -0.69 -0.01 0.00 0.00 0.00 0.00 53.44 52.74 2gjx n ALA 410 Cb 0.57 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.01 2gjx n ALA 410 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gjx n GLY 411 N 1.26 0.34 3.69 0.00 0.00 -1.01 -5.06 105.19 104.41 2gjx n GLY 411 Ca 0.17 -0.87 -0.29 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.04 2.98 -0.10 1.61 0.08 -0.59 -4.85 117.98 115.07 2gjx s PHE 412 Ca 0.00 -0.05 -0.30 0.00 0.12 0.00 0.00 56.93 56.70 2gjx s PHE 412 Cb 0.00 -1.50 -0.02 0.00 -0.57 0.00 0.00 43.02 40.93 2gjx s PHE 412 CO 0.00 0.49 1.08 1.03 -0.10 0.00 0.00 175.22 177.72 2gjx s ARG 413 N -2.54 4.38 0.35 0.44 0.52 -1.23 -3.99 118.95 116.89 2gjx s ARG 413 Ca 0.27 1.49 0.02 0.00 -0.52 0.00 0.00 55.73 56.98 2gjx s ARG 413 Cb -0.11 -3.56 -0.02 0.00 0.52 0.00 0.00 34.95 31.78 2gjx s ARG 413 CO 0.19 -0.39 0.54 0.00 0.02 0.00 0.00 175.30 175.66 2gjx s ALA 414 N 2.19 3.83 -0.20 2.13 0.00 -0.67 -0.27 121.76 128.77 2gjx s ALA 414 Ca 0.51 -1.08 -0.04 0.00 0.00 0.00 0.00 51.96 51.34 2gjx s ALA 414 Cb -0.20 -1.99 0.10 0.00 0.00 0.00 0.00 23.12 21.03 2gjx s ALA 414 CO 0.18 -0.07 0.29 -1.17 0.00 0.00 0.00 175.76 174.99 2gjx s LEU 415 N -4.30 -0.34 0.01 0.00 2.96 -0.02 -2.59 118.68 114.40 2gjx s LEU 415 Ca 0.42 0.14 -0.26 0.00 -0.22 0.00 0.00 54.13 54.21 2gjx s LEU 415 Cb -0.10 0.73 -0.05 0.00 0.50 0.00 0.00 46.19 47.28 2gjx s LEU 415 CO 0.35 -0.30 0.79 -0.22 -1.32 0.00 0.00 176.35 175.65 2gjx s LEU 416 N 2.43 4.40 0.00 -0.68 2.96 -0.19 -0.48 118.68 127.12 2gjx s LEU 416 Ca 0.07 1.43 0.00 0.00 -0.22 0.00 0.00 54.13 55.41 2gjx s LEU 416 Cb -0.15 -3.26 0.00 0.00 0.50 0.00 0.00 46.19 43.28 2gjx s LEU 416 CO -0.13 -0.07 0.00 -1.20 -1.32 0.00 0.00 176.35 173.64 2gjx n SER 417 N 3.24 0.00 -0.28 3.68 7.64 -0.77 -0.90 113.62 126.23 2gjx n SER 417 Ca -0.01 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.83 2gjx n SER 417 Cb 0.51 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.72 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 -0.02 0.00 -0.43 0.00 -1.46 0.13 119.26 117.48 2gjx h ALA 418 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2gjx h ALA 418 Cb 0.00 0.91 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2gjx h ALA 418 CO 0.00 -0.68 0.00 -0.35 0.00 0.00 0.00 179.25 178.22 2gjx n PRO 419 N -5.44 0.18 -2.88 0.00 -0.04 -1.26 -4.16 135.00 121.39 2gjx n PRO 419 Ca 0.06 0.22 -0.38 0.00 -0.04 0.00 0.00 63.50 63.36 2gjx n PRO 419 Cb 0.37 -1.74 -0.00 0.00 -0.04 0.00 0.00 33.50 32.09 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 -2.05 2.87 -3.50 0.54 8.01 0.03 -4.78 117.44 118.56 2gjx n TRP 420 Ca 0.05 -2.94 -0.42 0.00 -1.31 0.00 0.00 57.50 52.88 2gjx n TRP 420 Cb 0.35 -1.05 -0.06 0.00 -2.01 0.00 0.00 31.31 28.54 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 -3.53 3.53 0.44 -5.99 1.51 -1.25 -0.91 117.35 111.15 2gjx s TYR 421 Ca 0.38 -2.10 0.13 0.00 -1.01 0.00 0.00 57.07 54.46 2gjx s TYR 421 Cb 0.15 -3.56 0.98 0.00 -0.11 0.00 0.00 41.96 39.42 2gjx s TYR 421 CO -0.04 -0.95 2.00 -0.07 -1.11 0.00 0.00 175.55 175.38 2gjx h LEU 422 N 7.85 0.10 -1.58 -1.29 3.38 -0.99 -2.54 115.31 120.24 2gjx h LEU 422 Ca -0.05 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.91 2gjx h LEU 422 Cb 1.03 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 2gjx h LEU 422 CO 0.80 0.22 0.29 -0.55 0.09 0.00 0.00 178.44 179.29 2gjx h ASN 423 N 0.10 0.49 -0.99 -0.43 -1.07 -1.86 -3.34 115.58 108.48 2gjx h ASN 423 Ca 0.02 -0.01 -0.54 0.00 0.07 0.00 0.00 56.30 55.84 2gjx h ASN 423 Cb 0.25 -0.12 -0.09 0.00 -2.07 0.00 0.00 38.32 36.30 2gjx h ASN 423 CO 0.02 0.35 1.40 -0.13 0.07 0.00 0.00 177.43 179.14 2gjx s ARG 424 N -5.51 3.39 0.52 4.14 0.52 -0.96 -4.97 118.95 116.08 2gjx s ARG 424 Ca -0.08 -1.04 -0.07 0.00 -0.52 0.00 0.00 55.73 54.02 2gjx s ARG 424 Cb 0.18 -5.31 -0.04 0.00 0.52 0.00 0.00 34.95 30.29 2gjx s ARG 424 CO 0.74 -2.49 0.87 0.96 0.02 0.00 0.00 175.30 175.39 2gjx s ILE 425 N 6.09 4.84 -0.02 1.52 -4.36 -1.26 -4.98 121.20 123.03 2gjx s ILE 425 Ca 0.52 0.44 -0.29 0.00 -0.26 0.00 0.00 60.65 61.06 2gjx s ILE 425 Cb -0.01 -3.86 0.08 0.00 1.25 0.00 0.00 42.46 39.92 2gjx s ILE 425 CO -0.06 -0.94 0.72 -0.94 0.24 0.00 0.00 174.94 173.96 2gjx s SER 426 N -4.09 -0.59 0.61 4.36 1.04 -1.26 -5.16 113.70 108.62 2gjx s SER 426 Ca 0.50 0.48 -0.19 0.00 0.48 0.00 0.00 55.95 57.22 2gjx s SER 426 Cb -0.11 0.51 -0.03 0.00 0.10 0.00 0.00 66.02 66.50 2gjx s SER 426 CO 0.47 -0.65 1.26 0.00 0.98 0.00 0.00 173.24 175.30 2gjx n TYR 427 N 0.54 1.87 -2.42 5.02 9.36 -1.26 -4.66 117.16 125.61 2gjx n TYR 427 Ca -0.17 0.43 0.00 0.00 3.32 0.00 0.00 57.90 61.48 2gjx n TYR 427 Cb 0.59 -2.28 0.00 0.00 -0.63 0.00 0.00 39.34 37.02 2gjx n TYR 427 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2gjx n GLY 428 N 0.93 -2.09 3.43 2.98 0.00 -1.26 -4.61 105.19 104.57 2gjx n GLY 428 Ca 0.14 -1.64 -0.43 0.00 0.00 0.00 0.00 46.02 44.09 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 -0.08 3.19 0.00 1.61 -0.04 -1.26 -4.76 135.00 133.66 2gjx n PRO 429 Ca 0.00 -3.29 0.11 0.00 -0.04 0.00 0.00 63.50 60.28 2gjx n PRO 429 Cb 0.00 -3.39 0.62 0.00 -0.04 0.00 0.00 33.50 30.69 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 7.55 0.00 0.19 3.54 5.75 -1.26 -2.69 116.55 129.62 2gjx n ASP 430 Ca 0.47 -0.33 0.03 0.00 -0.01 0.00 0.00 54.79 54.95 2gjx n ASP 430 Cb 0.44 -0.16 0.36 0.00 -1.03 0.00 0.00 41.12 40.73 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 -2.32 115.95 118.91 2gjx h TRP 431 Ca 0.00 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 59.95 2gjx h TRP 431 Cb 0.12 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.28 2gjx h TRP 431 CO 0.00 0.39 -0.10 0.87 -1.28 0.00 0.00 178.44 178.31 2gjx h LYS 432 N 0.00 0.00 0.04 0.12 1.57 -1.92 -0.40 116.57 115.98 2gjx h LYS 432 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2gjx h LYS 432 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.03 2gjx h LYS 432 CO 0.05 0.10 -0.02 -0.44 -0.57 0.00 0.00 179.45 178.57 2gjx h ASP 433 N 0.00 -0.05 -0.26 0.86 3.45 -1.62 -2.83 116.42 115.97 2gjx h ASP 433 Ca -0.00 -0.37 -0.07 0.00 0.43 0.00 0.00 57.03 57.02 2gjx h ASP 433 Cb 0.20 0.01 -0.02 0.00 -0.56 0.00 0.00 39.33 38.97 2gjx h ASP 433 CO 0.01 0.35 -0.07 -0.26 -1.57 0.00 0.00 179.24 177.71 2gjx h PHE 434 N -0.46 0.68 -0.23 4.55 0.04 -1.42 -3.16 116.94 116.94 2gjx h PHE 434 Ca -0.01 -0.10 -0.14 0.00 2.80 0.00 0.00 57.97 60.53 2gjx h PHE 434 Cb 0.42 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.37 2gjx h PHE 434 CO 0.06 0.68 -0.43 -0.92 -0.60 0.00 0.00 178.31 177.10 2gjx h TYR 435 N 0.59 0.67 0.00 -0.55 3.20 -1.11 -3.17 116.97 116.60 2gjx h TYR 435 Ca 0.11 -0.20 0.00 0.00 3.14 0.00 0.00 58.73 61.78 2gjx h TYR 435 Cb 0.47 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.60 2gjx h TYR 435 CO 0.02 0.90 0.00 -0.24 -1.64 0.00 0.00 178.16 177.20 2gjx h VAL 436 N 0.45 0.00 -2.19 1.81 3.04 -1.46 -3.46 116.25 114.44 2gjx h VAL 436 Ca 0.03 -0.70 -0.58 0.00 -1.01 0.00 0.00 66.70 64.44 2gjx h VAL 436 Cb 0.94 1.70 0.02 0.00 -2.01 0.00 0.00 31.29 31.95 2gjx h VAL 436 CO 0.08 0.00 1.11 0.52 -1.01 0.00 0.00 177.57 178.28 2gjx n VAL 437 N -2.64 0.56 -3.60 1.51 0.31 -1.20 -4.96 118.33 108.31 2gjx n VAL 437 Ca 0.05 -0.10 -0.40 0.00 -0.01 0.00 0.00 64.34 63.87 2gjx n VAL 437 Cb 0.47 -2.00 -0.11 0.00 -0.91 0.00 0.00 33.84 31.29 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 3.76 2.78 0.60 5.55 2.56 -1.26 -4.98 118.70 127.71 2gjx s GLU 438 Ca 0.89 -1.14 0.38 0.00 0.00 0.00 0.00 54.97 55.10 2gjx s GLU 438 Cb -0.60 -3.73 1.92 0.00 2.00 0.00 0.00 34.13 33.72 2gjx s GLU 438 CO 0.46 -0.74 2.20 -1.35 -0.56 0.00 0.00 175.26 175.28 2gjx h PRO 439 N 8.42 0.00 -0.02 4.30 0.11 -1.94 -2.82 132.00 140.07 2gjx h PRO 439 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2gjx h PRO 439 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2gjx h PRO 439 CO 0.68 0.02 -0.08 1.28 -0.21 0.00 0.00 178.00 179.69 2gjx n LEU 440 N -3.21 2.13 -4.58 2.35 4.77 -1.26 -4.88 117.00 112.33 2gjx n LEU 440 Ca -0.02 -0.94 -0.30 0.00 -0.03 0.00 0.00 56.01 54.73 2gjx n LEU 440 Cb 0.17 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.21 2gjx n LEU 440 CO 0.24 0.39 1.52 0.00 -1.33 0.00 0.00 177.39 178.21 2gjx s ALA 441 N -1.46 1.96 0.26 -1.18 0.00 -1.06 -4.83 121.76 115.44 2gjx s ALA 441 Ca 0.17 -2.12 -0.20 0.00 0.00 0.00 0.00 51.96 49.82 2gjx s ALA 441 Cb 0.13 -4.65 0.06 0.00 0.00 0.00 0.00 23.12 18.67 2gjx s ALA 441 CO 0.25 -4.91 0.91 -0.59 0.00 0.00 0.00 175.76 171.42 2gjx s PHE 442 N 9.97 0.05 -0.31 0.00 -0.71 -1.26 -5.00 117.98 120.71 2gjx s PHE 442 Ca 0.67 -0.54 -0.29 0.00 -1.04 0.00 0.00 56.93 55.72 2gjx s PHE 442 Cb -0.01 0.75 0.00 0.00 -1.21 0.00 0.00 43.02 42.55 2gjx s PHE 442 CO 0.09 -1.18 1.31 -2.00 -1.34 0.00 0.00 175.22 172.10 2gjx s GLU 443 N -2.48 3.88 -0.05 1.99 2.56 -1.26 -4.96 118.70 118.38 2gjx s GLU 443 Ca 0.17 1.21 -0.31 0.00 0.00 0.00 0.00 54.97 56.05 2gjx s GLU 443 Cb -0.04 -3.89 0.12 0.00 2.00 0.00 0.00 34.13 32.32 2gjx s GLU 443 CO 0.07 -1.17 1.35 0.20 -0.56 0.00 0.00 175.26 175.15 2gjx s GLY 444 N 2.90 -0.38 0.29 -1.50 0.00 -1.26 -4.86 107.32 102.50 2gjx s GLY 444 Ca 0.57 0.63 0.06 0.00 0.00 0.00 0.00 44.72 45.98 2gjx s GLY 444 CO 0.24 1.63 0.36 -0.51 0.00 0.00 0.00 173.10 174.82 2gjx s THR 445 N -2.18 4.51 0.31 0.90 -4.23 -1.26 -4.94 115.64 108.75 2gjx s THR 445 Ca 0.18 -1.11 0.07 0.00 -1.18 0.00 0.00 61.69 59.66 2gjx s THR 445 Cb 0.05 -3.55 0.30 0.00 1.34 0.00 0.00 72.50 70.64 2gjx s THR 445 CO -0.04 -0.26 1.75 -0.65 -0.54 0.00 0.00 174.62 174.89 2gjx h PRO 446 N 1.14 0.65 0.00 3.99 0.11 -2.02 0.08 132.00 135.94 2gjx h PRO 446 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2gjx h PRO 446 Cb 1.24 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2gjx h PRO 446 CO 0.58 0.43 -0.55 1.05 -0.21 0.00 0.00 178.00 179.30 2gjx h GLU 447 N 0.67 0.00 0.09 1.05 9.09 -2.00 -3.24 114.58 120.24 2gjx h GLU 447 Ca 0.60 0.00 -0.27 0.00 0.05 0.00 0.00 59.36 59.75 2gjx h GLU 447 Cb 1.03 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 28.14 2gjx h GLU 447 CO -0.43 0.00 -1.14 0.37 0.05 0.00 0.00 179.01 177.86 2gjx h GLN 448 N 0.00 0.43 -0.00 1.06 4.15 -1.41 -3.19 115.11 116.15 2gjx h GLN 448 Ca 0.00 -0.57 0.00 0.00 0.77 0.00 0.00 58.65 58.85 2gjx h GLN 448 Cb 0.92 0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.80 2gjx h GLN 448 CO 0.00 1.23 -0.00 1.63 -1.93 0.00 0.00 178.83 179.76 2gjx n LYS 449 N -3.69 0.40 0.03 1.69 5.02 -0.22 -3.06 118.16 118.33 2gjx n LYS 449 Ca -0.10 -0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.33 2gjx n LYS 449 Cb 0.95 -1.50 0.56 0.00 -0.02 0.00 0.00 35.03 35.02 2gjx n LYS 449 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2gjx n ALA 450 N -1.30 2.30 0.32 7.82 0.00 -1.20 -3.31 120.51 125.15 2gjx n ALA 450 Ca 0.14 -0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.62 2gjx n ALA 450 Cb 0.25 -1.47 0.24 0.00 0.00 0.00 0.00 19.45 18.48 2gjx n ALA 450 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2gjx h LEU 451 N 0.00 0.00 -8.60 0.00 3.38 -1.70 -3.42 115.31 104.96 2gjx h LEU 451 Ca 0.00 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.42 2gjx h LEU 451 Cb 0.56 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.24 2gjx h LEU 451 CO 0.00 0.00 1.09 -0.69 0.09 0.00 0.00 178.44 178.93 2gjx s VAL 452 N -3.20 3.82 -0.83 1.22 1.01 -1.21 -1.68 120.40 119.53 2gjx s VAL 452 Ca 0.08 0.71 0.13 0.00 0.00 0.00 0.00 61.98 62.90 2gjx s VAL 452 Cb 0.07 -4.45 0.62 0.00 0.00 0.00 0.00 36.38 32.63 2gjx s VAL 452 CO 0.65 -1.16 1.49 2.30 0.00 0.00 0.00 175.10 178.38 2gjx n ILE 453 N 6.86 1.84 0.00 2.22 -5.35 -1.07 -4.95 119.36 118.91 2gjx n ILE 453 Ca 0.12 -1.03 0.00 0.00 -0.27 0.00 0.00 62.75 61.57 2gjx n ILE 453 Cb 0.49 -0.13 0.00 0.00 -1.74 0.00 0.00 39.64 38.26 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 0.76 0.21 0.77 3.28 0.00 -1.26 -2.04 105.19 106.91 2gjx n GLY 454 Ca 0.22 -1.98 -0.01 0.00 0.00 0.00 0.00 46.02 44.24 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 1.23 2.87 -0.02 0.00 -0.99 -1.03 105.19 107.25 2gjx n GLY 455 Ca 0.00 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.01 0.01 0.09 1.61 2.02 -0.08 -1.95 118.70 118.39 2gjx s GLU 456 Ca 0.04 0.03 -0.26 0.00 0.02 0.00 0.00 54.97 54.81 2gjx s GLU 456 Cb -0.01 -0.02 -0.06 0.00 0.10 0.00 0.00 34.13 34.14 2gjx s GLU 456 CO 0.01 -0.02 0.80 0.00 0.02 0.00 0.00 175.26 176.07 2gjx s ALA 457 N 0.12 3.38 -0.12 5.21 0.00 -0.94 -4.38 121.76 125.01 2gjx s ALA 457 Ca -0.01 0.35 -0.03 0.00 0.00 0.00 0.00 51.96 52.28 2gjx s ALA 457 Cb -0.01 -3.03 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 2gjx s ALA 457 CO -0.00 0.12 -0.03 0.00 0.00 0.00 0.00 175.76 175.85 2gjx n MET 459 N 2.98 0.99 -2.05 0.00 0.00 -1.02 -0.26 117.12 117.76 2gjx n MET 459 Ca -0.18 -3.78 -0.33 0.00 0.00 0.00 0.00 57.70 53.41 2gjx n MET 459 Cb 0.53 -1.93 0.01 0.00 0.00 0.00 0.00 33.22 31.83 2gjx n MET 459 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 2gjx s TRP 460 N -0.74 2.86 -0.29 1.12 0.52 -1.26 -3.01 118.94 118.14 2gjx s TRP 460 Ca 0.30 1.53 0.11 0.00 0.02 0.00 0.00 56.10 58.07 2gjx s TRP 460 Cb 0.02 -3.09 0.66 0.00 -1.15 0.00 0.00 33.47 29.91 2gjx s TRP 460 CO -0.18 -1.28 1.66 0.41 0.02 0.00 0.00 176.95 177.58 2gjx n GLY 461 N -0.66 3.97 0.28 0.98 0.00 -1.26 -4.42 105.19 104.09 2gjx n GLY 461 Ca 0.10 -1.05 0.04 0.00 0.00 0.00 0.00 46.02 45.11 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 2.17 0.36 0.00 1.61 3.07 -1.94 -3.12 114.58 116.74 2gjx h GLU 462 Ca 0.20 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 59.00 2gjx h GLU 462 Cb 2.02 -0.08 -0.06 0.00 -0.84 0.00 0.00 28.75 29.79 2gjx h GLU 462 CO 0.56 0.29 -0.45 0.66 -1.40 0.00 0.00 179.01 178.67 2gjx n TYR 463 N -4.45 0.00 -4.49 4.33 4.01 -1.26 -5.04 117.16 110.26 2gjx n TYR 463 Ca 0.01 -0.50 -0.22 0.00 -0.16 0.00 0.00 57.90 57.04 2gjx n TYR 463 Cb 0.11 -0.11 -0.16 0.00 -0.31 0.00 0.00 39.34 38.87 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 -1.09 0.94 0.00 -0.72 1.01 -1.18 -4.99 120.40 114.36 2gjx s VAL 464 Ca 0.18 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.71 2gjx s VAL 464 Cb 0.17 -0.83 0.00 0.00 0.00 0.00 0.00 36.38 35.73 2gjx s VAL 464 CO -0.03 0.29 0.00 -0.90 0.00 0.00 0.00 175.10 174.46 2gjx n ASP 465 N 3.27 0.00 0.23 3.32 3.85 -1.26 -4.52 116.55 121.44 2gjx n ASP 465 Ca -0.18 -0.60 0.16 0.00 -0.71 0.00 0.00 54.79 53.46 2gjx n ASP 465 Cb 0.54 0.00 0.69 0.00 -1.35 0.00 0.00 41.12 41.00 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 1.02 -1.12 -0.00 -1.94 -1.36 115.58 112.17 2gjx h ASN 466 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 56.30 56.22 2gjx h ASN 466 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 38.31 2gjx h ASN 466 CO 0.00 0.00 -1.03 0.00 -0.00 0.00 0.00 177.43 176.40 2gjx h THR 467 N 0.00 0.32 0.00 -3.57 1.03 -1.98 -3.40 112.91 105.31 2gjx h THR 467 Ca 0.09 -1.57 0.00 0.00 -0.01 0.00 0.00 66.41 64.91 2gjx h THR 467 Cb 1.05 1.88 0.00 0.00 -1.07 0.00 0.00 68.15 70.01 2gjx h THR 467 CO -0.00 0.18 0.00 -0.46 -0.01 0.00 0.00 175.52 175.23 2gjx n ASN 468 N -2.87 0.28 0.26 0.00 6.94 -0.87 -4.91 115.26 114.09 2gjx n ASN 468 Ca -0.03 -1.08 -0.16 0.00 -0.02 0.00 0.00 54.58 53.29 2gjx n ASN 468 Cb 0.69 0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 38.04 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 -0.81 0.11 -4.53 5.85 -1.49 -2.85 115.31 111.59 2gjx h LEU 469 Ca 0.00 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.79 2gjx h LEU 469 Cb 0.59 0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.85 2gjx h LEU 469 CO 0.00 -0.47 -0.18 0.58 -0.34 0.00 0.00 178.44 178.03 2gjx h VAL 470 N -0.73 0.60 0.00 1.05 2.07 -1.86 0.03 116.25 117.40 2gjx h VAL 470 Ca -0.04 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.43 2gjx h VAL 470 Cb 0.62 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 2gjx h VAL 470 CO 0.01 0.00 -0.24 1.55 0.02 0.00 0.00 177.57 178.92 2gjx h PRO 471 N -0.35 0.00 0.00 1.57 0.13 -1.55 -1.50 132.00 130.31 2gjx h PRO 471 Ca 0.02 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.97 2gjx h PRO 471 Cb 0.36 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.47 2gjx h PRO 471 CO -0.09 0.24 -0.88 -0.09 -0.23 0.00 0.00 178.00 176.95 2gjx h ARG 472 N 0.00 0.00 0.29 0.86 2.43 -1.22 -3.36 114.38 113.38 2gjx h ARG 472 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 2gjx h ARG 472 Cb 0.46 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2gjx h ARG 472 CO 0.03 0.88 -0.14 -0.07 -1.51 0.00 0.00 179.97 179.16 2gjx h LEU 473 N 0.00 -0.33 -9.69 3.80 3.38 -0.54 -3.44 115.31 108.49 2gjx h LEU 473 Ca -0.01 -0.04 -0.64 0.00 0.09 0.00 0.00 57.88 57.28 2gjx h LEU 473 Cb 1.59 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 42.35 2gjx h LEU 473 CO 0.11 0.14 -0.57 0.26 0.09 0.00 0.00 178.44 178.47 2gjx s TRP 474 N -2.96 3.29 -0.97 1.13 0.52 -0.60 -1.08 118.94 118.26 2gjx s TRP 474 Ca -0.07 0.15 0.13 0.00 0.02 0.00 0.00 56.10 56.32 2gjx s TRP 474 Cb 0.01 -1.68 0.58 0.00 -1.15 0.00 0.00 33.47 31.22 2gjx s TRP 474 CO 0.23 0.55 1.43 -0.35 0.02 0.00 0.00 176.95 178.82 2gjx n PRO 475 N 0.56 3.38 -0.35 4.98 -0.04 -1.26 -3.02 135.00 139.25 2gjx n PRO 475 Ca -0.09 -2.25 -0.00 0.00 -0.04 0.00 0.00 63.50 61.12 2gjx n PRO 475 Cb 0.52 -1.86 0.13 0.00 -0.04 0.00 0.00 33.50 32.25 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 3.10 1.17 0.00 0.54 3.08 -1.80 -0.36 114.38 120.11 2gjx h ARG 476 Ca 0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2gjx h ARG 476 Cb 1.32 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 31.11 2gjx h ARG 476 CO 0.24 0.77 0.00 0.00 -1.07 0.00 0.00 179.97 179.92 2gjx h ALA 477 N 1.40 1.00 0.00 0.04 0.00 -1.42 -2.20 119.26 118.08 2gjx h ALA 477 Ca 0.38 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.21 2gjx h ALA 477 Cb 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2gjx h ALA 477 CO -0.13 0.00 -0.38 0.78 0.00 0.00 0.00 179.25 179.52 2gjx h GLY 478 N 1.49 0.00 1.67 0.00 0.00 -1.31 -2.08 103.07 102.83 2gjx h GLY 478 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 2gjx h GLY 478 CO 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 176.54 176.43 2gjx h ALA 479 N 1.62 1.35 -0.14 3.60 0.00 -1.44 -2.13 119.26 122.12 2gjx h ALA 479 Ca -0.00 -0.24 -0.18 0.00 0.00 0.00 0.00 54.91 54.48 2gjx h ALA 479 Cb 0.69 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.37 2gjx h ALA 479 CO 0.05 0.44 -0.63 0.28 0.00 0.00 0.00 179.25 179.39 2gjx h VAL 480 N 0.38 1.32 -0.15 0.00 2.07 -1.57 -3.10 116.25 115.19 2gjx h VAL 480 Ca 0.07 -1.88 0.05 0.00 0.82 0.00 0.00 66.70 65.77 2gjx h VAL 480 Cb 0.43 2.05 -0.06 0.00 -1.52 0.00 0.00 31.29 32.19 2gjx h VAL 480 CO 0.02 0.58 -0.26 0.00 0.02 0.00 0.00 177.57 177.94 2gjx h ALA 481 N 0.52 -0.24 0.00 1.67 0.00 -0.91 -1.51 119.26 118.80 2gjx h ALA 481 Ca -0.04 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2gjx h ALA 481 Cb 1.26 0.51 -0.01 0.00 0.00 0.00 0.00 17.79 19.55 2gjx h ALA 481 CO 0.13 -0.72 -0.17 1.49 0.00 0.00 0.00 179.25 179.98 2gjx h GLU 482 N -0.32 0.00 0.00 0.00 4.81 -1.49 -0.86 114.58 116.73 2gjx h GLU 482 Ca 0.11 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 2gjx h GLU 482 Cb 0.48 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.86 2gjx h GLU 482 CO -0.33 0.17 -0.06 -0.09 -0.73 0.00 0.00 179.01 177.97 2gjx h ARG 483 N 0.00 0.00 0.00 1.92 9.65 -1.24 0.39 114.38 125.09 2gjx h ARG 483 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2gjx h ARG 483 Cb 0.32 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.90 2gjx h ARG 483 CO 0.02 0.06 -1.09 1.28 2.80 0.00 0.00 179.97 183.04 2gjx n LEU 484 N -3.14 0.88 -0.03 3.80 4.77 -0.57 -4.67 117.00 118.05 2gjx n LEU 484 Ca 0.02 -0.43 -0.06 0.00 -0.03 0.00 0.00 56.01 55.51 2gjx n LEU 484 Cb 0.45 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.51 2gjx n LEU 484 CO 0.32 0.22 -0.45 1.87 -1.33 0.00 0.00 177.39 178.02 2gjx n TRP 485 N -1.58 0.00 -0.38 -1.77 -0.00 -0.44 -2.36 117.44 110.91 2gjx n TRP 485 Ca 0.03 0.00 -0.29 0.00 -0.00 0.00 0.00 57.50 57.24 2gjx n TRP 485 Cb 0.36 -0.28 0.28 0.00 -0.00 0.00 0.00 31.31 31.66 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 -6.00 -0.28 0.70 5.87 0.01 0.12 -1.87 113.70 112.24 2gjx s SER 486 Ca -0.15 1.22 -0.12 0.00 1.31 0.00 0.00 55.95 58.21 2gjx s SER 486 Cb 0.03 -1.83 0.02 0.00 0.21 0.00 0.00 66.02 64.45 2gjx s SER 486 CO 0.21 -4.94 1.08 0.21 0.41 0.00 0.00 173.24 170.21 2gjx s ASN 487 N -2.71 5.07 0.58 2.44 3.04 -1.26 -4.57 114.94 117.52 2gjx s ASN 487 Ca 0.69 1.78 0.27 0.00 0.04 0.00 0.00 52.86 55.64 2gjx s ASN 487 Cb -0.20 -2.52 1.62 0.00 -1.54 0.00 0.00 41.25 38.61 2gjx s ASN 487 CO 0.62 -1.65 2.11 0.50 -3.04 0.00 0.00 177.10 175.64 2gjx h LYS 488 N -0.59 0.00 -0.02 0.43 3.64 -1.94 -1.68 116.57 116.40 2gjx h LYS 488 Ca -0.45 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 2gjx h LYS 488 Cb 1.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2gjx h LYS 488 CO 0.54 0.00 -0.05 1.28 -2.27 0.00 0.00 179.45 178.95 2gjx n LEU 489 N -3.92 1.70 -4.44 5.20 4.77 -1.26 -4.73 117.00 114.32 2gjx n LEU 489 Ca 0.02 -0.56 -0.43 0.00 -0.03 0.00 0.00 56.01 55.00 2gjx n LEU 489 Cb 0.31 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.34 2gjx n LEU 489 CO 0.29 0.29 0.65 -0.89 -1.33 0.00 0.00 177.39 176.39 2gjx s THR 490 N -2.08 4.48 0.00 -5.08 2.01 -0.63 -4.70 115.64 109.63 2gjx s THR 490 Ca 0.34 -0.50 0.00 0.00 0.31 0.00 0.00 61.69 61.84 2gjx s THR 490 Cb 0.21 -4.61 0.00 0.00 0.01 0.00 0.00 72.50 68.10 2gjx s THR 490 CO 0.36 -1.33 0.20 -1.54 -0.69 0.00 0.00 174.62 171.62 2gjx n SER 491 N 7.28 0.00 -4.61 3.53 3.41 -1.26 -4.87 113.62 117.10 2gjx n SER 491 Ca -0.05 -1.03 -0.43 0.00 -0.26 0.00 0.00 58.87 57.09 2gjx n SER 491 Cb 0.45 -0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.37 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 -0.03 6.21 0.34 4.04 2.15 -1.26 -4.90 116.67 123.22 2gjx s ASP 492 Ca 0.00 1.26 0.02 0.00 0.43 0.00 0.00 52.55 54.26 2gjx s ASP 492 Cb 0.00 -2.53 0.60 0.00 -0.30 0.00 0.00 42.92 40.69 2gjx s ASP 492 CO 0.00 -1.46 2.00 -0.07 -0.17 0.00 0.00 175.17 175.47 2gjx h LEU 493 N 12.50 0.75 -0.28 -1.34 4.07 -1.98 -0.20 115.31 128.84 2gjx h LEU 493 Ca -0.32 -0.03 -0.07 0.00 0.08 0.00 0.00 57.88 57.55 2gjx h LEU 493 Cb 1.14 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 42.69 2gjx h LEU 493 CO 1.04 0.56 -0.08 0.74 -1.08 0.00 0.00 178.44 179.61 2gjx h THR 494 N 0.88 1.29 -0.17 0.22 2.02 -2.00 -1.59 112.91 113.56 2gjx h THR 494 Ca 0.24 -1.12 -0.05 0.00 0.77 0.00 0.00 66.41 66.25 2gjx h THR 494 Cb -0.08 1.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 2gjx h THR 494 CO -0.05 0.36 -0.10 0.15 0.37 0.00 0.00 175.52 176.24 2gjx h PHE 495 N 0.30 0.27 -0.12 3.16 -0.00 -1.86 -2.25 116.94 116.45 2gjx h PHE 495 Ca 0.07 -0.03 -0.16 0.00 -0.00 0.00 0.00 57.97 57.85 2gjx h PHE 495 Cb 0.57 -0.08 -0.01 0.00 -0.00 0.00 0.00 35.95 36.43 2gjx h PHE 495 CO 0.05 0.37 -0.60 0.00 -0.00 0.00 0.00 178.31 178.14 2gjx h ALA 496 N 1.65 0.75 0.09 2.41 0.00 -0.85 -3.23 119.26 120.07 2gjx h ALA 496 Ca 0.05 -0.54 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 2gjx h ALA 496 Cb 0.35 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2gjx h ALA 496 CO 0.02 0.71 -0.04 -0.92 0.00 0.00 0.00 179.25 179.02 2gjx h TYR 497 N 0.29 -0.11 -0.63 0.00 3.20 -0.68 0.15 116.97 119.20 2gjx h TYR 497 Ca -0.00 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 61.94 2gjx h TYR 497 Cb 1.13 0.04 -0.04 0.00 1.54 0.00 0.00 36.73 39.40 2gjx h TYR 497 CO 0.03 0.08 0.42 0.93 -1.64 0.00 0.00 178.16 177.98 2gjx h GLU 498 N -0.28 0.52 0.14 1.82 3.07 -1.61 -1.72 114.58 116.51 2gjx h GLU 498 Ca -0.01 -0.03 -0.33 0.00 -0.50 0.00 0.00 59.36 58.49 2gjx h GLU 498 Cb 0.24 -0.12 -0.00 0.00 -0.84 0.00 0.00 28.75 28.03 2gjx h GLU 498 CO 0.02 0.34 -1.68 0.00 -1.40 0.00 0.00 179.01 176.29 2gjx h ARG 499 N 0.53 0.29 -0.17 2.33 3.08 -1.53 -3.00 114.38 115.91 2gjx h ARG 499 Ca 0.28 -0.49 -0.20 0.00 0.07 0.00 0.00 59.98 59.63 2gjx h ARG 499 Cb 0.41 0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.64 2gjx h ARG 499 CO -0.09 1.16 -0.70 1.25 -1.07 0.00 0.00 179.97 180.52 2gjx h LEU 500 N 0.08 0.84 -0.56 3.04 5.85 -0.57 0.13 115.31 124.13 2gjx h LEU 500 Ca -0.31 -0.52 -0.15 0.00 0.84 0.00 0.00 57.88 57.74 2gjx h LEU 500 Cb 2.05 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.83 2gjx h LEU 500 CO 0.15 1.30 -0.50 0.77 -0.34 0.00 0.00 178.44 179.82 2gjx h SER 501 N 0.51 0.62 -0.63 1.25 4.64 -1.48 0.82 113.55 119.29 2gjx h SER 501 Ca -0.03 -0.32 -0.09 0.00 -0.47 0.00 0.00 61.79 60.88 2gjx h SER 501 Cb 1.31 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 63.20 2gjx h SER 501 CO 0.14 1.02 0.04 -0.74 -0.87 0.00 0.00 176.83 176.42 2gjx h HIS 502 N 0.45 1.17 -0.06 4.77 -0.00 -1.47 -2.28 115.15 117.73 2gjx h HIS 502 Ca 0.02 -0.18 -0.11 0.00 -0.00 0.00 0.00 60.37 60.10 2gjx h HIS 502 Cb 1.04 -0.31 -0.01 0.00 -0.00 0.00 0.00 27.41 28.12 2gjx h HIS 502 CO 0.04 1.01 -0.46 0.35 -0.00 0.00 0.00 177.93 178.87 2gjx h PHE 503 N 1.00 0.16 0.20 5.26 -0.00 -0.71 -2.84 116.94 120.00 2gjx h PHE 503 Ca 0.19 -0.05 -0.01 0.00 -0.00 0.00 0.00 57.97 58.10 2gjx h PHE 503 Cb 0.51 -0.03 0.00 0.00 -0.00 0.00 0.00 35.95 36.43 2gjx h PHE 503 CO 0.04 0.57 -0.10 -0.09 -0.00 0.00 0.00 178.31 178.73 2gjx h ARG 504 N 0.11 -0.26 -0.40 1.11 2.43 -0.44 -0.84 114.38 116.10 2gjx h ARG 504 Ca 0.01 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.27 2gjx h ARG 504 Cb 0.85 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.44 2gjx h ARG 504 CO 0.07 0.02 0.27 0.00 -1.51 0.00 0.00 179.97 178.81 2gjx h GLU 506 N 0.21 0.34 -0.56 0.00 4.22 -1.26 -2.64 114.58 114.89 2gjx h GLU 506 Ca 0.18 -0.30 -0.07 0.00 0.08 0.00 0.00 59.36 59.25 2gjx h GLU 506 Cb 0.44 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 2gjx h GLU 506 CO -0.03 0.95 0.06 -0.07 -2.18 0.00 0.00 179.01 177.74 2gjx h LEU 507 N 0.23 0.88 -0.89 1.64 3.38 0.39 -2.00 115.31 118.93 2gjx h LEU 507 Ca -0.03 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.68 2gjx h LEU 507 Cb 1.34 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.83 2gjx h LEU 507 CO 0.13 0.90 0.17 -0.07 0.09 0.00 0.00 178.44 179.66 2gjx h LEU 508 N 0.86 0.92 -1.65 1.67 4.07 -1.20 -0.26 115.31 119.72 2gjx h LEU 508 Ca 0.17 -0.17 -0.04 0.00 0.08 0.00 0.00 57.88 57.92 2gjx h LEU 508 Cb 0.42 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.92 2gjx h LEU 508 CO 0.01 0.88 -0.19 -0.09 -1.08 0.00 0.00 178.44 177.97 2gjx h ARG 509 N 0.94 0.00 -0.28 1.13 2.43 -1.09 -0.75 114.38 116.77 2gjx h ARG 509 Ca 0.20 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.37 2gjx h ARG 509 Cb 0.31 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2gjx h ARG 509 CO -0.00 0.19 0.00 0.54 -1.51 0.00 0.00 179.97 179.19 2gjx n ARG 510 N -3.80 1.76 -1.70 0.20 1.74 -0.68 -4.92 116.66 109.26 2gjx n ARG 510 Ca -0.02 -1.16 -0.00 0.00 -0.77 0.00 0.00 57.85 55.90 2gjx n ARG 510 Cb 0.30 -1.31 -0.00 0.00 -1.02 0.00 0.00 32.46 30.42 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 1.07 0.37 3.67 -0.13 0.00 -0.29 -5.05 105.19 104.83 2gjx n GLY 511 Ca 0.13 -0.95 -0.35 0.00 0.00 0.00 0.00 46.02 44.86 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 -2.01 5.04 -1.47 1.61 1.01 -0.20 -5.00 120.40 119.38 2gjx s VAL 512 Ca 0.00 0.06 -0.12 0.00 0.00 0.00 0.00 61.98 61.92 2gjx s VAL 512 Cb 0.00 -3.29 0.03 0.00 0.00 0.00 0.00 36.38 33.12 2gjx s VAL 512 CO 0.00 0.44 2.37 1.67 0.00 0.00 0.00 175.10 179.58 2gjx n GLN 513 N 3.62 3.20 -3.39 2.72 7.27 -1.26 -3.92 117.38 125.61 2gjx n GLN 513 Ca -0.16 -2.64 -0.38 0.00 0.07 0.00 0.00 57.00 53.89 2gjx n GLN 513 Cb 0.52 -3.11 -0.06 0.00 2.41 0.00 0.00 30.24 30.00 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 2.49 3.54 0.80 1.69 0.00 -1.26 -2.31 121.76 126.71 2gjx s ALA 514 Ca 0.52 -0.25 -0.11 0.00 0.00 0.00 0.00 51.96 52.12 2gjx s ALA 514 Cb 0.15 -2.55 0.07 0.00 0.00 0.00 0.00 23.12 20.79 2gjx s ALA 514 CO -0.07 0.10 1.09 1.14 0.00 0.00 0.00 175.76 178.02 2gjx s GLN 515 N 0.31 2.02 0.50 0.00 -2.07 -1.17 -4.91 119.66 114.34 2gjx s GLN 515 Ca 0.23 1.05 -0.19 0.00 -1.82 0.00 0.00 55.36 54.63 2gjx s GLN 515 Cb -0.15 -1.88 -0.08 0.00 -1.09 0.00 0.00 33.01 29.81 2gjx s GLN 515 CO 0.09 -1.77 1.02 -2.14 -1.32 0.00 0.00 175.29 171.17 2gjx s PRO 516 N -4.93 3.82 0.06 9.60 0.02 -1.26 -4.38 135.00 137.93 2gjx s PRO 516 Ca 0.62 1.24 -0.10 0.00 0.02 0.00 0.00 61.00 62.78 2gjx s PRO 516 Cb -0.17 -2.10 -0.29 0.00 0.02 0.00 0.00 34.50 31.96 2gjx s PRO 516 CO 0.56 -0.40 1.11 -0.07 -0.33 0.00 0.00 177.00 177.87 2gjx h LEU 517 N 1.36 0.66 0.00 -5.54 3.38 -1.96 -3.49 115.31 109.72 2gjx h LEU 517 Ca -0.49 -0.67 0.00 0.00 0.09 0.00 0.00 57.88 56.81 2gjx h LEU 517 Cb 1.21 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2gjx h LEU 517 CO 0.59 1.51 0.00 -3.20 0.09 0.00 0.00 178.44 177.43 2gjx n ASN 518 N -3.67 0.00 -4.77 -0.43 5.15 -1.26 -4.71 115.26 105.57 2gjx n ASN 518 Ca -0.12 -0.26 -0.35 0.00 -0.60 0.00 0.00 54.58 53.25 2gjx n ASN 518 Cb 1.02 0.00 0.02 0.00 -0.53 0.00 0.00 39.78 40.29 2gjx n ASN 518 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2gjx s VAL 519 N -2.97 3.08 -3.09 3.44 -7.23 -1.26 -4.89 120.40 107.49 2gjx s VAL 519 Ca 0.00 0.63 0.00 0.00 -1.81 0.00 0.00 61.98 60.80 2gjx s VAL 519 Cb 0.00 -3.21 0.00 0.00 0.56 0.00 0.00 36.38 33.73 2gjx s VAL 519 CO 0.00 -0.19 0.00 0.61 -0.31 0.00 0.00 175.10 175.21 2gjx n GLY 520 N 0.07 0.46 3.64 2.32 0.00 -1.26 -5.15 105.19 105.27 2gjx n GLY 520 Ca 0.12 -1.35 -0.04 0.00 0.00 0.00 0.00 46.02 44.74 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 -0.19 -0.10 1.61 -0.71 -1.26 -5.14 117.98 108.19 2gjx s PHE 521 Ca 0.00 -0.01 0.02 0.00 -1.04 0.00 0.00 56.93 55.91 2gjx s PHE 521 Cb 0.00 0.58 0.01 0.00 -1.21 0.00 0.00 43.02 42.40 2gjx s PHE 521 CO 0.00 -0.59 -0.17 0.00 -1.34 0.00 0.00 175.22 173.12 2gjx n GLU 523 N 3.94 -0.18 -3.13 0.00 0.00 -1.26 -2.95 120.64 117.05 2gjx n GLU 523 Ca -0.20 1.34 -0.43 0.00 0.00 0.00 0.00 57.16 57.87 2gjx n GLU 523 Cb 0.52 -1.99 -0.06 0.00 0.00 0.00 0.00 31.44 29.90 2gjx n GLU 523 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.13 178.27 2gjx s GLN 524 N -5.88 3.18 0.34 5.31 0.00 -1.26 -5.06 119.66 116.30 2gjx s GLN 524 Ca -0.12 -0.67 -0.10 0.00 -0.00 0.00 0.00 55.36 54.47 2gjx s GLN 524 Cb 0.19 -4.03 -0.07 0.00 0.00 0.00 0.00 33.01 29.10 2gjx s GLN 524 CO 0.63 -1.14 0.69 -2.00 0.00 0.00 0.00 175.29 173.48 2gjx s GLU 525 N 2.74 3.81 0.26 9.60 2.56 -1.15 -4.83 118.70 131.68 2gjx s GLU 525 Ca 0.18 0.40 -0.30 0.00 0.00 0.00 0.00 54.97 55.26 2gjx s GLU 525 Cb -0.17 -2.48 -0.09 0.00 2.00 0.00 0.00 34.13 33.39 2gjx s GLU 525 CO 0.15 0.11 1.22 0.12 -0.56 0.00 0.00 175.26 176.29 2gjx s PHE 526 N -2.15 3.34 -0.29 5.30 5.36 -1.26 -5.02 117.98 123.26 2gjx s PHE 526 Ca 0.50 1.46 0.05 0.00 -0.96 0.00 0.00 56.93 57.99 2gjx s PHE 526 Cb -0.10 -3.49 0.19 0.00 -0.34 0.00 0.00 43.02 39.28 2gjx s PHE 526 CO 0.26 -1.32 0.57 -1.83 -1.46 0.00 0.00 175.22 171.44 2gjx s GLU 527 N -0.99 0.54 0.00 10.12 -1.05 -1.26 -5.22 118.70 120.84 2gjx s GLU 527 Ca 0.50 0.48 0.00 0.00 -0.15 0.00 0.00 54.97 55.80 2gjx s GLU 527 Cb -0.35 0.17 0.00 0.00 -0.44 0.00 0.00 34.13 33.51 2gjx s GLU 527 CO 0.43 -1.05 0.00 0.94 0.95 0.00 0.00 175.26 176.53