#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 0.08 0.86 1.96 -0.11 -1.26 -4.08 118.94 116.40 2gjx s TRP 24 Ca 0.00 0.17 -0.13 0.00 1.22 0.00 0.00 56.10 57.36 2gjx s TRP 24 Cb 0.00 -0.38 0.13 0.00 -1.50 0.00 0.00 33.47 31.72 2gjx s TRP 24 CO 0.00 -0.15 1.23 -1.25 -4.62 0.00 0.00 176.95 172.16 2gjx s PRO 25 N 1.61 1.46 0.01 5.86 0.04 -1.26 -4.73 135.00 137.98 2gjx s PRO 25 Ca -0.02 -0.11 -0.30 0.00 0.04 0.00 0.00 61.00 60.60 2gjx s PRO 25 Cb -0.13 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 2gjx s PRO 25 CO -0.03 -1.90 1.07 -0.46 0.04 0.00 0.00 177.00 175.72 2gjx s TRP 26 N -3.68 3.54 0.83 0.56 -0.11 -1.26 -5.03 118.94 113.79 2gjx s TRP 26 Ca 0.67 1.52 -0.10 0.00 1.22 0.00 0.00 56.10 59.41 2gjx s TRP 26 Cb -0.08 -3.25 0.09 0.00 -1.50 0.00 0.00 33.47 28.74 2gjx s TRP 26 CO 0.50 -0.54 1.11 -2.14 -4.62 0.00 0.00 176.95 171.26 2gjx s PRO 27 N 1.18 1.74 0.08 5.86 0.02 -1.26 -4.41 135.00 138.21 2gjx s PRO 27 Ca 0.54 1.29 -0.20 0.00 0.02 0.00 0.00 61.00 62.65 2gjx s PRO 27 Cb -0.24 -1.83 -0.10 0.00 0.02 0.00 0.00 34.50 32.35 2gjx s PRO 27 CO 0.27 -2.05 1.59 1.96 -0.33 0.00 0.00 177.00 178.44 2gjx h GLN 28 N -1.43 0.27 -3.81 5.54 1.08 -1.84 -3.42 115.11 111.51 2gjx h GLN 28 Ca -0.44 -0.06 -0.51 0.00 -1.45 0.00 0.00 58.65 56.19 2gjx h GLN 28 Cb 1.25 -0.04 -0.39 0.00 -0.05 0.00 0.00 27.48 28.25 2gjx h GLN 28 CO 0.48 0.39 -0.77 -0.80 -0.95 0.00 0.00 178.83 177.18 2gjx s ASN 29 N -5.64 2.60 -0.34 1.46 0.01 -1.17 -4.99 114.94 106.88 2gjx s ASN 29 Ca -0.14 -0.61 -0.00 0.00 -0.71 0.00 0.00 52.86 51.40 2gjx s ASN 29 Cb 0.07 -0.68 0.11 0.00 0.41 0.00 0.00 41.25 41.16 2gjx s ASN 29 CO 0.71 -0.24 0.13 0.12 -1.51 0.00 0.00 177.10 176.31 2gjx s PHE 30 N 1.80 1.65 -0.44 2.20 5.99 -1.26 -2.20 117.98 125.71 2gjx s PHE 30 Ca 0.01 -1.83 -0.27 0.00 0.00 0.00 0.00 56.93 54.84 2gjx s PHE 30 Cb -0.15 -1.67 0.03 0.00 0.00 0.00 0.00 43.02 41.22 2gjx s PHE 30 CO -0.07 -0.86 1.00 -0.65 -0.00 0.00 0.00 175.22 174.64 2gjx s GLN 31 N 1.36 3.67 0.22 10.12 -1.52 0.47 -4.97 119.66 129.01 2gjx s GLN 31 Ca 0.12 0.40 0.06 0.00 -1.95 0.00 0.00 55.36 53.98 2gjx s GLN 31 Cb -0.19 -3.89 -0.03 0.00 -0.22 0.00 0.00 33.01 28.68 2gjx s GLN 31 CO -0.19 -1.21 0.24 -0.08 -0.25 0.00 0.00 175.29 173.79 2gjx s THR 32 N 3.92 4.75 0.29 -0.19 -1.32 -1.26 -1.31 115.64 120.52 2gjx s THR 32 Ca 0.41 -1.17 0.01 0.00 -1.21 0.00 0.00 61.69 59.74 2gjx s THR 32 Cb -0.10 -3.54 -0.02 0.00 -1.51 0.00 0.00 72.50 67.33 2gjx s THR 32 CO 0.26 -0.27 0.29 -0.55 -2.21 0.00 0.00 174.62 172.14 2gjx s SER 33 N -3.68 0.94 -0.00 8.08 0.15 -1.08 -5.01 113.70 113.10 2gjx s SER 33 Ca 0.33 -1.53 0.14 0.00 0.70 0.00 0.00 55.95 55.58 2gjx s SER 33 Cb -0.09 0.53 -0.16 0.00 -1.71 0.00 0.00 66.02 64.59 2gjx s SER 33 CO 0.26 -1.05 0.57 0.47 1.20 0.00 0.00 173.24 174.68 2gjx n ASP 34 N -1.06 0.76 -4.77 5.45 10.43 -1.26 -4.60 116.55 121.50 2gjx n ASP 34 Ca 0.04 -0.75 -0.41 0.00 2.57 0.00 0.00 54.79 56.24 2gjx n ASP 34 Cb 0.63 1.06 -0.01 0.00 1.84 0.00 0.00 41.12 44.64 2gjx n ASP 34 CO 0.00 0.00 0.00 -1.58 -1.07 0.00 0.00 177.20 174.55 2gjx s GLN 35 N -2.39 4.26 0.30 -1.24 0.74 -1.26 -4.90 119.66 115.17 2gjx s GLN 35 Ca 0.04 2.35 0.09 0.00 0.05 0.00 0.00 55.36 57.89 2gjx s GLN 35 Cb 0.10 -3.04 -0.04 0.00 1.10 0.00 0.00 33.01 31.13 2gjx s GLN 35 CO 0.58 -0.33 0.08 1.03 -0.55 0.00 0.00 175.29 176.10 2gjx s ARG 36 N -1.75 2.38 -0.03 1.67 0.52 -1.26 -1.44 118.95 119.03 2gjx s ARG 36 Ca 0.51 -1.46 -0.01 0.00 -0.52 0.00 0.00 55.73 54.26 2gjx s ARG 36 Cb -0.42 -2.20 0.03 0.00 0.52 0.00 0.00 34.95 32.88 2gjx s ARG 36 CO 0.55 0.24 0.05 0.71 0.02 0.00 0.00 175.30 176.88 2gjx s TYR 37 N -2.36 0.00 0.34 -0.53 1.51 0.83 -4.70 117.35 112.44 2gjx s TYR 37 Ca 0.35 0.21 -0.27 0.00 -1.01 0.00 0.00 57.07 56.35 2gjx s TYR 37 Cb -0.05 -0.26 -0.09 0.00 -0.11 0.00 0.00 41.96 41.46 2gjx s TYR 37 CO 0.22 -0.12 1.08 0.08 -1.11 0.00 0.00 175.55 175.70 2gjx s VAL 38 N 1.30 3.55 0.31 0.71 1.01 -1.00 -1.04 120.40 125.24 2gjx s VAL 38 Ca -0.06 1.38 0.10 0.00 0.00 0.00 0.00 61.98 63.39 2gjx s VAL 38 Cb -0.13 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.40 2gjx s VAL 38 CO -0.03 0.19 -0.05 -0.76 0.00 0.00 0.00 175.10 174.45 2gjx s LEU 39 N -2.03 2.93 -0.36 3.92 1.43 -0.63 -0.51 118.68 123.43 2gjx s LEU 39 Ca 0.51 -0.92 0.00 0.00 -1.03 0.00 0.00 54.13 52.69 2gjx s LEU 39 Cb -0.28 -1.37 0.12 0.00 0.03 0.00 0.00 46.19 44.69 2gjx s LEU 39 CO 0.35 -0.11 0.16 -0.31 0.23 0.00 0.00 176.35 176.68 2gjx s TYR 40 N -2.47 1.65 0.37 0.29 2.02 -1.26 -4.60 117.35 113.35 2gjx s TYR 40 Ca 0.33 -1.96 0.26 0.00 -0.37 0.00 0.00 57.07 55.33 2gjx s TYR 40 Cb -0.03 -1.66 1.29 0.00 -0.40 0.00 0.00 41.96 41.16 2gjx s TYR 40 CO 0.18 -0.84 1.40 -2.30 -1.57 0.00 0.00 175.55 172.43 2gjx n PRO 41 N 4.28 -0.04 0.03 -1.71 -0.01 -1.26 -0.92 135.00 135.36 2gjx n PRO 41 Ca 0.04 1.16 0.05 0.00 -0.01 0.00 0.00 63.50 64.74 2gjx n PRO 41 Cb 0.39 -2.21 -0.09 0.00 -0.01 0.00 0.00 33.50 31.57 2gjx n PRO 41 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 175.50 175.58 2gjx n ASN 42 N -4.67 0.54 -1.33 2.55 3.02 -1.26 -4.33 115.26 109.78 2gjx n ASN 42 Ca 0.35 0.23 -0.08 0.00 -0.03 0.00 0.00 54.58 55.05 2gjx n ASN 42 Cb 1.32 0.81 0.17 0.00 -0.61 0.00 0.00 39.78 41.47 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 -2.65 2.99 -4.61 6.41 4.13 -0.10 -4.99 115.26 116.44 2gjx n ASN 43 Ca -0.08 -3.80 -0.34 0.00 1.68 0.00 0.00 54.58 52.04 2gjx n ASN 43 Cb 0.72 -0.63 -0.10 0.00 -1.54 0.00 0.00 39.78 38.23 2gjx n ASN 43 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 2gjx s PHE 44 N -3.33 3.17 0.04 3.10 5.36 -0.95 -4.82 117.98 120.56 2gjx s PHE 44 Ca 0.46 -0.01 0.02 0.00 -0.96 0.00 0.00 56.93 56.44 2gjx s PHE 44 Cb 0.41 -1.98 -0.02 0.00 -0.34 0.00 0.00 43.02 41.09 2gjx s PHE 44 CO -0.00 0.17 -0.07 1.14 -1.46 0.00 0.00 175.22 175.00 2gjx s GLN 45 N 0.09 0.48 -0.31 10.12 -2.07 -1.22 -5.01 119.66 121.73 2gjx s GLN 45 Ca 0.03 -0.73 -0.09 0.00 -1.82 0.00 0.00 55.36 52.74 2gjx s GLN 45 Cb -0.13 -0.20 -0.00 0.00 -1.09 0.00 0.00 33.01 31.59 2gjx s GLN 45 CO 0.02 0.03 0.15 -0.06 -1.32 0.00 0.00 175.29 174.10 2gjx s PHE 46 N -1.43 3.18 0.08 9.60 0.40 -1.26 -2.93 117.98 125.62 2gjx s PHE 46 Ca -0.11 -0.64 0.09 0.00 -0.60 0.00 0.00 56.93 55.67 2gjx s PHE 46 Cb -0.10 -2.35 -0.03 0.00 0.51 0.00 0.00 43.02 41.05 2gjx s PHE 46 CO 0.00 -0.48 -0.23 1.14 0.70 0.00 0.00 175.22 176.35 2gjx s GLN 47 N 1.60 1.38 0.64 0.44 -2.07 -1.21 -5.02 119.66 115.43 2gjx s GLN 47 Ca 0.04 -1.12 -0.13 0.00 -1.82 0.00 0.00 55.36 52.33 2gjx s GLN 47 Cb -0.17 -1.63 -0.02 0.00 -1.09 0.00 0.00 33.01 30.10 2gjx s GLN 47 CO 0.06 0.40 1.06 0.71 -1.32 0.00 0.00 175.29 176.20 2gjx s TYR 48 N -0.96 3.06 0.13 9.60 1.51 -1.26 -2.06 117.35 127.36 2gjx s TYR 48 Ca 0.09 1.47 -0.09 0.00 -1.01 0.00 0.00 57.07 57.53 2gjx s TYR 48 Cb -0.10 -2.94 -0.06 0.00 -0.11 0.00 0.00 41.96 38.75 2gjx s TYR 48 CO 0.03 -1.15 0.43 0.34 -1.11 0.00 0.00 175.55 174.10 2gjx s ASP 49 N -3.26 6.62 0.49 2.29 3.68 -0.94 -4.81 116.67 120.73 2gjx s ASP 49 Ca 0.61 0.79 0.21 0.00 2.13 0.00 0.00 52.55 56.28 2gjx s ASP 49 Cb -0.15 -2.17 1.25 0.00 -1.45 0.00 0.00 42.92 40.40 2gjx s ASP 49 CO 0.45 0.10 1.98 -0.37 0.13 0.00 0.00 175.17 177.46 2gjx h VAL 50 N 2.51 0.79 -2.46 1.11 -1.51 -1.96 -2.70 116.25 112.03 2gjx h VAL 50 Ca -0.48 -0.06 -0.81 0.00 -1.23 0.00 0.00 66.70 64.13 2gjx h VAL 50 Cb 1.18 0.60 -0.27 0.00 -2.13 0.00 0.00 31.29 30.67 2gjx h VAL 50 CO 0.68 0.03 0.99 -1.54 -1.23 0.00 0.00 177.57 176.50 2gjx n SER 51 N -4.42 7.02 -3.82 4.19 3.41 -1.26 -4.95 113.62 113.79 2gjx n SER 51 Ca 0.10 -3.57 -0.13 0.00 -0.26 0.00 0.00 58.87 55.01 2gjx n SER 51 Cb 0.53 -1.21 -0.14 0.00 -0.26 0.00 0.00 64.21 63.13 2gjx n SER 51 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2gjx s SER 52 N -1.46 -0.07 0.10 4.04 0.15 -1.02 -4.88 113.70 110.56 2gjx s SER 52 Ca 0.36 0.17 -0.19 0.00 0.70 0.00 0.00 55.95 57.00 2gjx s SER 52 Cb 0.14 0.14 -0.07 0.00 -1.71 0.00 0.00 66.02 64.52 2gjx s SER 52 CO -0.04 -0.06 1.64 0.00 1.20 0.00 0.00 173.24 175.98 2gjx h ALA 53 N 6.38 0.33 -2.53 5.45 0.00 -1.47 -3.41 119.26 124.02 2gjx h ALA 53 Ca -0.30 -0.12 -0.53 0.00 0.00 0.00 0.00 54.91 53.95 2gjx h ALA 53 Cb 1.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2gjx h ALA 53 CO 0.46 -0.07 0.52 0.00 0.00 0.00 0.00 179.25 180.16 2gjx s ALA 54 N -5.51 3.37 0.22 0.00 0.00 -1.24 -5.02 121.76 113.58 2gjx s ALA 54 Ca -0.13 0.82 -0.11 0.00 0.00 0.00 0.00 51.96 52.53 2gjx s ALA 54 Cb 0.08 -3.41 -0.01 0.00 0.00 0.00 0.00 23.12 19.78 2gjx s ALA 54 CO 0.72 -0.36 0.42 -1.14 0.00 0.00 0.00 175.76 175.40 2gjx s GLN 55 N 0.66 1.43 0.04 0.00 2.00 -1.26 -4.77 119.66 117.76 2gjx s GLN 55 Ca 0.56 -1.24 -0.38 0.00 -2.00 0.00 0.00 55.36 52.30 2gjx s GLN 55 Cb -0.29 0.44 -0.19 0.00 0.80 0.00 0.00 33.01 33.77 2gjx s GLN 55 CO 0.31 -0.58 1.04 -2.30 -0.50 0.00 0.00 175.29 173.26 2gjx n PRO 56 N -0.34 0.19 0.00 1.67 -0.02 -1.26 -1.26 135.00 133.98 2gjx n PRO 56 Ca -0.03 0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 2gjx n PRO 56 Cb 0.62 -1.52 0.00 0.00 -0.02 0.00 0.00 33.50 32.58 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 1.70 0.85 3.55 -1.23 0.00 -1.26 -5.05 105.19 103.76 2gjx n GLY 57 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 2gjx n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gjx h SER 59 N 11.47 0.23 0.11 0.00 4.64 -1.90 0.21 113.55 128.31 2gjx h SER 59 Ca -0.16 0.12 -0.01 0.00 -0.47 0.00 0.00 61.79 61.27 2gjx h SER 59 Cb 1.07 0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2gjx h SER 59 CO 1.28 0.07 -0.06 0.58 -0.87 0.00 0.00 176.83 177.84 2gjx h VAL 60 N 0.40 1.08 0.01 0.95 2.07 -1.90 -3.22 116.25 115.63 2gjx h VAL 60 Ca 0.42 -0.88 -0.19 0.00 0.82 0.00 0.00 66.70 66.86 2gjx h VAL 60 Cb 0.66 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 2gjx h VAL 60 CO -0.43 0.21 -0.89 -0.07 0.02 0.00 0.00 177.57 176.41 2gjx h LEU 61 N -0.58 0.15 -1.60 2.57 4.07 -1.87 -1.73 115.31 116.32 2gjx h LEU 61 Ca -0.02 -0.13 -0.03 0.00 0.08 0.00 0.00 57.88 57.79 2gjx h LEU 61 Cb 0.46 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 2gjx h LEU 61 CO 0.03 0.96 -0.03 0.44 -1.08 0.00 0.00 178.44 178.75 2gjx h ASP 62 N 0.06 0.19 0.47 -0.43 3.32 -0.71 -1.35 116.42 117.97 2gjx h ASP 62 Ca -0.03 -0.02 -0.30 0.00 0.02 0.00 0.00 57.03 56.70 2gjx h ASP 62 Cb 1.53 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.99 2gjx h ASP 62 CO 0.13 0.26 -1.70 -0.33 -1.72 0.00 0.00 179.24 175.88 2gjx h GLU 63 N 0.20 0.04 -0.61 3.56 4.39 -1.56 -3.34 114.58 117.26 2gjx h GLU 63 Ca 0.05 -0.07 -0.03 0.00 0.34 0.00 0.00 59.36 59.64 2gjx h GLU 63 Cb 0.20 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.85 2gjx h GLU 63 CO 0.01 0.63 0.26 0.00 -1.16 0.00 0.00 179.01 178.75 2gjx h ALA 64 N 0.86 0.79 -0.59 3.43 0.00 -0.93 -0.85 119.26 121.97 2gjx h ALA 64 Ca -0.29 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 2gjx h ALA 64 Cb 2.00 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 19.53 2gjx h ALA 64 CO 0.09 0.39 0.31 0.74 0.00 0.00 0.00 179.25 180.78 2gjx h PHE 65 N 0.84 0.82 -0.01 0.00 0.04 -1.42 -1.46 116.94 115.76 2gjx h PHE 65 Ca 0.20 -0.03 -0.14 0.00 2.80 0.00 0.00 57.97 60.81 2gjx h PHE 65 Cb 0.18 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.05 2gjx h PHE 65 CO 0.01 0.61 -0.66 0.37 -0.60 0.00 0.00 178.31 178.03 2gjx h GLN 66 N 0.80 0.03 -0.22 1.51 5.75 -1.65 -1.71 115.11 119.62 2gjx h GLN 66 Ca 0.21 -0.03 -0.09 0.00 -0.15 0.00 0.00 58.65 58.59 2gjx h GLN 66 Cb 0.07 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.62 2gjx h GLN 66 CO -0.03 0.68 -0.21 -0.09 -2.65 0.00 0.00 178.83 176.53 2gjx h ARG 67 N 0.02 0.54 0.00 1.69 2.43 -0.84 -2.99 114.38 115.23 2gjx h ARG 67 Ca -0.01 -0.28 -0.06 0.00 -0.81 0.00 0.00 59.98 58.82 2gjx h ARG 67 Cb 1.17 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 2gjx h ARG 67 CO 0.09 0.86 -0.31 1.88 -1.51 0.00 0.00 179.97 180.98 2gjx h TYR 68 N 0.23 0.00 -0.03 2.20 0.05 -1.26 -1.61 116.97 116.55 2gjx h TYR 68 Ca 0.04 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.67 2gjx h TYR 68 Cb 0.76 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.49 2gjx h TYR 68 CO 0.08 0.31 -0.66 0.07 -1.05 0.00 0.00 178.16 176.90 2gjx h ARG 69 N 0.00 0.13 0.02 4.88 0.11 -1.34 -1.55 114.38 116.63 2gjx h ARG 69 Ca -0.00 -0.10 -0.23 0.00 0.10 0.00 0.00 59.98 59.74 2gjx h ARG 69 Cb 1.22 0.02 0.02 0.00 1.11 0.00 0.00 29.97 32.34 2gjx h ARG 69 CO 0.04 0.75 -0.93 0.22 0.10 0.00 0.00 179.97 180.15 2gjx h ASP 70 N 0.09 0.78 0.10 0.08 3.58 -1.48 -0.97 116.42 118.61 2gjx h ASP 70 Ca -0.01 -0.76 -0.02 0.00 0.42 0.00 0.00 57.03 56.66 2gjx h ASP 70 Cb 1.18 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.99 2gjx h ASP 70 CO 0.10 1.45 -0.07 0.25 -2.88 0.00 0.00 179.24 178.08 2gjx h LEU 71 N 0.21 0.00 0.10 2.28 5.85 -1.16 -0.43 115.31 122.16 2gjx h LEU 71 Ca -0.12 0.00 -0.36 0.00 0.84 0.00 0.00 57.88 58.24 2gjx h LEU 71 Cb 1.61 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.62 2gjx h LEU 71 CO 0.18 0.07 -1.99 0.18 -0.34 0.00 0.00 178.44 176.55 2gjx n LEU 72 N -4.23 2.60 -3.29 2.25 4.77 -0.59 -4.72 117.00 113.79 2gjx n LEU 72 Ca -0.03 0.20 -0.25 0.00 -0.03 0.00 0.00 56.01 55.90 2gjx n LEU 72 Cb 0.16 -1.09 -0.08 0.00 -2.33 0.00 0.00 43.42 40.08 2gjx n LEU 72 CO 0.33 0.82 -0.19 0.49 -1.33 0.00 0.00 177.39 177.51 2gjx n PHE 73 N -3.55 0.79 -2.09 -1.77 3.01 -0.37 -5.10 117.46 108.38 2gjx n PHE 73 Ca -0.33 -3.73 0.00 0.00 1.01 0.00 0.00 57.45 54.40 2gjx n PHE 73 Cb 1.01 -0.36 -0.00 0.00 -0.01 0.00 0.00 39.48 40.11 2gjx n PHE 73 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2gjx n GLY 74 N 1.39 0.72 0.00 1.37 0.00 -0.19 -4.62 105.19 103.86 2gjx n GLY 74 Ca 0.24 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2gjx n GLY 74 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2gjx n THR 89 N 0.09 0.00 -3.50 2.61 -1.04 -1.26 -5.09 114.28 106.10 2gjx n THR 89 Ca -0.02 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 61.74 2gjx n THR 89 Cb 0.74 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 69.23 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 4.10 -0.04 -4.42 2.34 -1.26 -2.39 118.68 117.01 2gjx s LEU 90 Ca 0.00 0.44 -0.02 0.00 0.06 0.00 0.00 54.13 54.62 2gjx s LEU 90 Cb 0.00 -3.27 0.03 0.00 -0.56 0.00 0.00 46.19 42.39 2gjx s LEU 90 CO 0.00 -0.20 0.04 -1.61 -1.06 0.00 0.00 176.35 173.52 2gjx s GLU 91 N -3.94 0.05 -0.18 1.48 0.41 0.34 -4.83 118.70 112.03 2gjx s GLU 91 Ca 0.40 0.30 0.20 0.00 -0.41 0.00 0.00 54.97 55.46 2gjx s GLU 91 Cb -0.10 -0.55 0.43 0.00 -1.78 0.00 0.00 34.13 32.13 2gjx s GLU 91 CO 0.33 -0.30 1.18 0.36 -0.49 0.00 0.00 175.26 176.34 2gjx n LYS 92 N 5.09 1.04 -3.53 1.61 -0.00 -1.26 -4.12 118.16 116.98 2gjx n LYS 92 Ca -0.08 -2.53 0.01 0.00 -0.00 0.00 0.00 58.31 55.72 2gjx n LYS 92 Cb 0.50 -0.67 -0.06 0.00 -0.00 0.00 0.00 35.03 34.80 2gjx n LYS 92 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 2gjx s ASN 93 N -2.66 -0.24 -0.23 -5.58 3.84 -1.26 -3.46 114.94 105.35 2gjx s ASN 93 Ca 0.24 0.37 0.01 0.00 0.21 0.00 0.00 52.86 53.68 2gjx s ASN 93 Cb 0.33 1.16 0.03 0.00 -0.55 0.00 0.00 41.25 42.23 2gjx s ASN 93 CO -0.09 -0.06 -0.12 0.54 -2.79 0.00 0.00 177.10 174.59 2gjx s VAL 94 N 1.48 2.42 0.06 -5.21 0.11 -1.15 -4.74 120.40 113.37 2gjx s VAL 94 Ca -0.06 -1.18 -0.28 0.00 -2.93 0.00 0.00 61.98 57.53 2gjx s VAL 94 Cb -0.03 -2.22 -0.05 0.00 -1.53 0.00 0.00 36.38 32.55 2gjx s VAL 94 CO -0.13 0.24 0.91 -0.76 -3.33 0.00 0.00 175.10 172.02 2gjx s LEU 95 N 1.25 4.45 -0.09 2.54 1.02 -0.10 -3.28 118.68 124.46 2gjx s LEU 95 Ca -0.01 1.65 0.03 0.00 0.02 0.00 0.00 54.13 55.82 2gjx s LEU 95 Cb -0.16 -3.48 -0.02 0.00 0.02 0.00 0.00 46.19 42.55 2gjx s LEU 95 CO -0.07 -0.10 -0.17 -0.69 0.02 0.00 0.00 176.35 175.34 2gjx s VAL 96 N 0.26 2.77 -0.13 -1.59 1.01 -0.88 0.02 120.40 121.87 2gjx s VAL 96 Ca 0.46 -0.79 -0.04 0.00 0.00 0.00 0.00 61.98 61.61 2gjx s VAL 96 Cb -0.22 -2.11 0.06 0.00 0.00 0.00 0.00 36.38 34.11 2gjx s VAL 96 CO 0.27 0.56 0.12 0.54 0.00 0.00 0.00 175.10 176.59 2gjx s VAL 97 N -0.06 -0.16 -0.23 2.92 0.11 -0.88 -2.21 120.40 119.88 2gjx s VAL 97 Ca -0.04 0.06 -0.10 0.00 -2.93 0.00 0.00 61.98 58.97 2gjx s VAL 97 Cb -0.14 -0.46 -0.05 0.00 -1.53 0.00 0.00 36.38 34.20 2gjx s VAL 97 CO 0.04 -0.10 0.14 -0.55 -3.33 0.00 0.00 175.10 171.30 2gjx s SER 98 N 2.20 6.04 -0.01 3.54 0.15 -1.26 -1.71 113.70 122.65 2gjx s SER 98 Ca 0.04 0.11 -0.14 0.00 0.70 0.00 0.00 55.95 56.65 2gjx s SER 98 Cb -0.14 -2.08 -0.33 0.00 -1.71 0.00 0.00 66.02 61.75 2gjx s SER 98 CO -0.08 0.08 0.83 -0.37 1.20 0.00 0.00 173.24 174.91 2gjx h VAL 99 N 4.99 1.14 -2.75 4.45 -1.51 -0.88 -1.14 116.25 120.54 2gjx h VAL 99 Ca -0.38 -2.60 -0.53 0.00 -1.23 0.00 0.00 66.70 61.96 2gjx h VAL 99 Cb 1.17 2.92 0.03 0.00 -2.13 0.00 0.00 31.29 33.28 2gjx h VAL 99 CO 0.67 0.82 0.94 -0.69 -1.23 0.00 0.00 177.57 178.08 2gjx s VAL 100 N -2.58 2.95 0.16 7.19 1.01 0.11 -4.65 120.40 124.59 2gjx s VAL 100 Ca -0.13 0.52 -0.12 0.00 0.00 0.00 0.00 61.98 62.25 2gjx s VAL 100 Cb 0.04 -3.34 0.04 0.00 0.00 0.00 0.00 36.38 33.13 2gjx s VAL 100 CO 0.90 0.01 1.66 0.00 0.00 0.00 0.00 175.10 177.67 2gjx h THR 101 N 4.54 1.24 -0.52 3.92 1.03 -1.88 -3.44 112.91 117.80 2gjx h THR 101 Ca -0.42 -0.88 -0.72 0.00 -0.01 0.00 0.00 66.41 64.38 2gjx h THR 101 Cb 1.20 0.80 -0.01 0.00 -1.07 0.00 0.00 68.15 69.07 2gjx h THR 101 CO 0.92 0.32 0.80 -2.65 -0.01 0.00 0.00 175.52 174.90 2gjx n PRO 102 N -4.42 0.00 -0.84 0.00 -0.01 -1.26 -4.80 135.00 123.68 2gjx n PRO 102 Ca 0.02 0.00 -0.35 0.00 -0.01 0.00 0.00 63.50 63.16 2gjx n PRO 102 Cb 0.23 -1.28 0.10 0.00 -0.01 0.00 0.00 33.50 32.55 2gjx n PRO 102 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 2gjx n GLY 103 N 4.59 -2.89 0.00 -1.23 0.00 -1.26 -4.83 105.19 99.57 2gjx n GLY 103 Ca 0.35 -0.63 0.12 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.14 3.38 -4.88 0.00 4.13 -1.26 -4.14 115.26 111.34 2gjx n ASN 105 Ca 0.15 -2.00 -0.36 0.00 1.68 0.00 0.00 54.58 54.05 2gjx n ASN 105 Cb 0.14 -0.42 -0.06 0.00 -1.54 0.00 0.00 39.78 37.90 2gjx n ASN 105 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2gjx s GLN 106 N -1.16 3.49 0.52 3.52 -1.52 -1.20 -5.08 119.66 118.23 2gjx s GLN 106 Ca 0.42 -0.12 -0.23 0.00 -1.95 0.00 0.00 55.36 53.48 2gjx s GLN 106 Cb 0.22 -3.16 -0.06 0.00 -0.22 0.00 0.00 33.01 29.79 2gjx s GLN 106 CO 0.29 0.73 1.37 -0.51 -0.25 0.00 0.00 175.29 176.92 2gjx s LEU 107 N -1.32 3.93 0.48 2.90 2.01 -1.26 -4.99 118.68 120.43 2gjx s LEU 107 Ca 0.20 2.79 -0.21 0.00 0.01 0.00 0.00 54.13 56.92 2gjx s LEU 107 Cb -0.13 -4.18 -0.08 0.00 0.01 0.00 0.00 46.19 41.81 2gjx s LEU 107 CO 0.09 -1.44 1.05 -2.16 1.01 0.00 0.00 176.35 174.90 2gjx s PRO 108 N -2.78 3.81 0.33 1.29 0.04 -1.26 -5.07 135.00 131.37 2gjx s PRO 108 Ca 0.68 1.40 0.04 0.00 0.04 0.00 0.00 61.00 63.16 2gjx s PRO 108 Cb -0.41 -2.14 -0.07 0.00 0.04 0.00 0.00 34.50 31.93 2gjx s PRO 108 CO 0.49 -0.43 0.05 0.95 0.04 0.00 0.00 177.00 178.11 2gjx s THR 109 N -1.93 1.27 0.55 1.26 -4.23 -1.26 -4.83 115.64 106.48 2gjx s THR 109 Ca 0.67 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 59.40 2gjx s THR 109 Cb -0.18 -2.82 0.31 0.00 1.34 0.00 0.00 72.50 71.16 2gjx s THR 109 CO 0.21 0.00 2.20 0.25 -0.54 0.00 0.00 174.62 176.74 2gjx h LEU 110 N 2.08 0.00 0.00 4.79 6.46 -1.97 -1.62 115.31 125.04 2gjx h LEU 110 Ca -0.41 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.35 2gjx h LEU 110 Cb 1.24 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.17 2gjx h LEU 110 CO 0.71 0.01 -0.22 -0.33 -0.62 0.00 0.00 178.44 177.99 2gjx h GLU 111 N 0.00 0.00 -6.41 1.25 3.07 -1.96 -3.46 114.58 107.07 2gjx h GLU 111 Ca -0.00 0.00 -0.62 0.00 -0.50 0.00 0.00 59.36 58.24 2gjx h GLU 111 Cb 0.02 0.00 0.06 0.00 -0.84 0.00 0.00 28.75 27.98 2gjx h GLU 111 CO 0.00 0.00 0.66 0.43 -1.40 0.00 0.00 179.01 178.70 2gjx n SER 112 N -2.29 2.50 -4.47 1.42 7.64 -0.61 -4.91 113.62 112.89 2gjx n SER 112 Ca 0.05 1.10 -0.43 0.00 1.01 0.00 0.00 58.87 60.59 2gjx n SER 112 Cb 0.44 -1.33 -0.05 0.00 -1.01 0.00 0.00 64.21 62.26 2gjx n SER 112 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2gjx s VAL 113 N 0.76 4.68 -1.30 0.44 1.01 -1.26 -4.92 120.40 119.81 2gjx s VAL 113 Ca 0.81 -0.20 0.04 0.00 0.00 0.00 0.00 61.98 62.63 2gjx s VAL 113 Cb -0.79 -4.40 0.17 0.00 0.00 0.00 0.00 36.38 31.36 2gjx s VAL 113 CO 0.42 -0.93 0.92 -0.62 0.00 0.00 0.00 175.10 174.89 2gjx n GLU 114 N 6.68 1.69 -1.73 2.72 1.02 -1.26 -3.37 120.64 126.39 2gjx n GLU 114 Ca -0.03 -0.68 -0.42 0.00 -0.02 0.00 0.00 57.16 56.01 2gjx n GLU 114 Cb 0.46 -1.46 -0.01 0.00 -0.02 0.00 0.00 31.44 30.41 2gjx n GLU 114 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2gjx n ASN 115 N 0.08 3.56 -3.61 1.62 4.13 -1.26 -4.39 115.26 115.38 2gjx n ASN 115 Ca 0.06 1.17 -0.11 0.00 1.68 0.00 0.00 54.58 57.38 2gjx n ASN 115 Cb 0.34 -1.56 -0.05 0.00 -1.54 0.00 0.00 39.78 36.97 2gjx n ASN 115 CO 0.00 0.00 0.00 -0.72 0.28 0.00 0.00 177.26 176.82 2gjx s TYR 116 N -0.36 -0.27 -0.01 3.10 1.13 -0.75 -1.90 117.35 118.29 2gjx s TYR 116 Ca 0.61 0.06 0.02 0.00 -1.41 0.00 0.00 57.07 56.35 2gjx s TYR 116 Cb -0.52 0.29 -0.00 0.00 -1.10 0.00 0.00 41.96 40.62 2gjx s TYR 116 CO 0.53 -0.68 -0.05 0.95 -2.51 0.00 0.00 175.55 173.79 2gjx s THR 117 N -3.39 0.42 -0.16 -3.49 -4.23 0.10 -0.65 115.64 104.25 2gjx s THR 117 Ca 0.00 -0.21 0.01 0.00 -1.18 0.00 0.00 61.69 60.30 2gjx s THR 117 Cb 0.01 -0.36 0.02 0.00 1.34 0.00 0.00 72.50 73.51 2gjx s THR 117 CO -0.09 0.12 -0.16 -0.22 -0.54 0.00 0.00 174.62 173.73 2gjx s LEU 118 N -0.06 1.85 -0.09 4.79 2.96 0.29 -1.77 118.68 126.65 2gjx s LEU 118 Ca 0.01 -0.54 0.01 0.00 -0.22 0.00 0.00 54.13 53.39 2gjx s LEU 118 Cb -0.03 -1.29 0.02 0.00 0.50 0.00 0.00 46.19 45.39 2gjx s LEU 118 CO -0.00 -0.03 -0.11 0.28 -1.32 0.00 0.00 176.35 175.17 2gjx s THR 119 N 1.38 1.14 -0.14 3.68 -1.32 -0.50 0.49 115.64 120.37 2gjx s THR 119 Ca 0.04 -0.42 -0.02 0.00 -1.21 0.00 0.00 61.69 60.08 2gjx s THR 119 Cb -0.13 -1.09 0.05 0.00 -1.51 0.00 0.00 72.50 69.82 2gjx s THR 119 CO -0.11 0.37 0.03 -0.63 -2.21 0.00 0.00 174.62 172.07 2gjx s ILE 120 N 1.18 0.39 0.00 5.08 1.01 0.64 -1.14 121.20 128.36 2gjx s ILE 120 Ca -0.04 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.37 2gjx s ILE 120 Cb -0.14 -0.77 0.00 0.00 0.01 0.00 0.00 42.46 41.55 2gjx s ILE 120 CO -0.03 -0.03 0.00 -0.46 0.00 0.00 0.00 174.94 174.42 2gjx n ASN 121 N 5.12 0.13 -0.13 3.58 2.04 -0.11 -1.52 115.26 124.35 2gjx n ASN 121 Ca -0.08 0.00 0.01 0.00 -0.44 0.00 0.00 54.58 54.07 2gjx n ASN 121 Cb 0.48 0.00 0.29 0.00 -2.53 0.00 0.00 39.78 38.02 2gjx n ASN 121 CO 0.00 0.00 0.00 0.44 -0.44 0.00 0.00 177.26 177.26 2gjx h ASP 122 N 0.00 0.73 0.00 0.53 5.19 -2.00 -3.26 116.42 117.61 2gjx h ASP 122 Ca 0.00 -0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.37 2gjx h ASP 122 Cb 0.00 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.33 2gjx h ASP 122 CO 0.00 0.57 -0.10 -0.90 -3.12 0.00 0.00 179.24 175.69 2gjx n ASP 123 N -4.40 1.31 -3.89 6.45 3.85 -1.26 -5.05 116.55 113.56 2gjx n ASP 123 Ca 0.06 -2.14 -0.11 0.00 -0.71 0.00 0.00 54.79 51.89 2gjx n ASP 123 Cb 0.08 -0.17 -0.13 0.00 -1.35 0.00 0.00 41.12 39.55 2gjx n ASP 123 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 2gjx s GLN 124 N -1.17 0.15 -0.45 0.11 -0.21 -1.23 -5.06 119.66 111.79 2gjx s GLN 124 Ca 0.10 -0.14 0.06 0.00 0.02 0.00 0.00 55.36 55.40 2gjx s GLN 124 Cb 0.09 0.06 0.22 0.00 1.00 0.00 0.00 33.01 34.38 2gjx s GLN 124 CO 0.01 -0.03 0.65 0.00 -2.12 0.00 0.00 175.29 173.80 2gjx s LEU 126 N -0.42 2.41 -0.41 0.00 0.20 -0.29 -0.93 118.68 119.25 2gjx s LEU 126 Ca 0.33 -0.41 0.03 0.00 0.69 0.00 0.00 54.13 54.77 2gjx s LEU 126 Cb 0.14 -1.50 0.11 0.00 -0.43 0.00 0.00 46.19 44.51 2gjx s LEU 126 CO -0.16 0.21 0.14 -0.22 -0.29 0.00 0.00 176.35 176.03 2gjx s LEU 127 N 0.07 4.74 -0.07 -0.68 0.20 0.10 -1.41 118.68 121.64 2gjx s LEU 127 Ca -0.08 -2.39 -0.03 0.00 0.69 0.00 0.00 54.13 52.33 2gjx s LEU 127 Cb -0.15 -1.67 -0.04 0.00 -0.43 0.00 0.00 46.19 43.91 2gjx s LEU 127 CO 0.05 -0.36 0.05 -1.48 -0.29 0.00 0.00 176.35 174.32 2gjx s LEU 128 N 0.59 3.85 0.05 -0.68 0.05 -0.73 -2.08 118.68 119.74 2gjx s LEU 128 Ca 0.12 0.22 -0.02 0.00 0.05 0.00 0.00 54.13 54.50 2gjx s LEU 128 Cb -0.21 -1.99 -0.03 0.00 -2.05 0.00 0.00 46.19 41.90 2gjx s LEU 128 CO -0.05 0.36 0.01 -0.94 -0.55 0.00 0.00 176.35 175.17 2gjx s SER 129 N -1.15 0.41 0.00 1.48 1.04 -0.69 0.02 113.70 114.81 2gjx s SER 129 Ca 0.16 -0.91 0.00 0.00 0.48 0.00 0.00 55.95 55.68 2gjx s SER 129 Cb -0.12 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.22 2gjx s SER 129 CO 0.06 -0.61 0.63 1.21 0.98 0.00 0.00 173.24 175.51 2gjx n GLU 130 N 0.16 0.00 -3.03 4.02 4.07 -0.80 -1.95 120.64 123.11 2gjx n GLU 130 Ca -0.15 0.44 -0.20 0.00 -0.06 0.00 0.00 57.16 57.19 2gjx n GLU 130 Cb 0.61 -1.27 0.07 0.00 -0.06 0.00 0.00 31.44 30.79 2gjx n GLU 130 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 2gjx s THR 131 N -2.13 2.03 0.19 6.31 -1.32 -1.22 0.07 115.64 119.58 2gjx s THR 131 Ca 0.00 -0.99 0.18 0.00 -1.21 0.00 0.00 61.69 59.67 2gjx s THR 131 Cb 0.00 -2.04 0.13 0.00 -1.51 0.00 0.00 72.50 69.09 2gjx s THR 131 CO 0.00 0.00 1.75 1.62 -2.21 0.00 0.00 174.62 175.78 2gjx h VAL 132 N 0.10 0.91 -0.01 5.08 3.04 -1.89 -3.03 116.25 120.45 2gjx h VAL 132 Ca -0.28 -1.49 -0.12 0.00 -1.01 0.00 0.00 66.70 63.80 2gjx h VAL 132 Cb 1.29 1.90 -0.02 0.00 -2.01 0.00 0.00 31.29 32.45 2gjx h VAL 132 CO 0.40 0.36 -0.55 -0.50 -1.01 0.00 0.00 177.57 176.28 2gjx h TRP 133 N 0.00 0.03 -0.21 3.17 4.06 -1.95 -2.42 115.95 118.63 2gjx h TRP 133 Ca -0.00 -0.01 -0.11 0.00 2.06 0.00 0.00 58.89 60.83 2gjx h TRP 133 Cb 0.87 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 29.01 2gjx h TRP 133 CO 0.00 0.57 -0.33 0.78 -3.56 0.00 0.00 178.44 175.90 2gjx h GLY 134 N 1.63 0.48 1.36 1.49 0.00 -1.73 -2.82 103.07 103.46 2gjx h GLY 134 Ca -0.00 -0.43 -0.04 0.00 0.00 0.00 0.00 47.33 46.86 2gjx h GLY 134 CO 0.07 0.39 0.17 0.00 0.00 0.00 0.00 176.54 177.17 2gjx h ALA 135 N 1.27 1.27 -0.20 3.60 0.00 -1.45 -0.95 119.26 122.80 2gjx h ALA 135 Ca 0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2gjx h ALA 135 Cb 0.76 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2gjx h ALA 135 CO 0.06 0.52 0.09 -0.07 0.00 0.00 0.00 179.25 179.85 2gjx h LEU 136 N 0.80 0.27 -0.77 0.00 3.38 -1.28 -1.72 115.31 115.99 2gjx h LEU 136 Ca 0.18 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.04 2gjx h LEU 136 Cb 0.23 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2gjx h LEU 136 CO -0.01 0.32 0.50 0.03 0.09 0.00 0.00 178.44 179.37 2gjx h ARG 137 N 0.19 0.96 -0.78 1.13 2.47 -1.26 -2.18 114.38 114.91 2gjx h ARG 137 Ca 0.07 -0.06 0.01 0.00 -1.26 0.00 0.00 59.98 58.75 2gjx h ARG 137 Cb 0.13 -0.22 -0.04 0.00 -1.65 0.00 0.00 29.97 28.19 2gjx h ARG 137 CO -0.01 0.63 0.51 0.78 0.56 0.00 0.00 179.97 182.45 2gjx h GLY 138 N 0.99 1.10 1.24 0.04 0.00 -0.96 -1.74 103.07 103.74 2gjx h GLY 138 Ca 0.30 -0.40 -0.04 0.00 0.00 0.00 0.00 47.33 47.19 2gjx h GLY 138 CO -0.09 0.38 0.26 1.41 0.00 0.00 0.00 176.54 178.49 2gjx h LEU 139 N 1.03 0.89 -0.22 3.11 3.38 -0.80 0.28 115.31 122.98 2gjx h LEU 139 Ca 0.29 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 2gjx h LEU 139 Cb -0.08 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 2gjx h LEU 139 CO -0.08 0.80 0.06 -0.08 0.09 0.00 0.00 178.44 179.24 2gjx h GLU 140 N 0.95 0.35 -1.00 1.13 4.57 -0.88 0.52 114.58 120.22 2gjx h GLU 140 Ca 0.22 -0.08 0.01 0.00 -1.18 0.00 0.00 59.36 58.33 2gjx h GLU 140 Cb 0.19 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.69 2gjx h GLU 140 CO -0.02 0.45 0.66 1.15 -1.18 0.00 0.00 179.01 180.08 2gjx h THR 141 N 0.18 1.25 -0.63 0.32 2.02 -1.06 -2.31 112.91 112.69 2gjx h THR 141 Ca 0.07 -0.46 -0.03 0.00 0.77 0.00 0.00 66.41 66.76 2gjx h THR 141 Cb 0.25 -0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 66.42 2gjx h THR 141 CO -0.00 0.25 0.29 0.15 0.37 0.00 0.00 175.52 176.57 2gjx h PHE 142 N 1.35 0.92 0.00 3.16 3.57 -0.54 -1.98 116.94 123.42 2gjx h PHE 142 Ca 0.37 -0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.78 2gjx h PHE 142 Cb -0.15 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.30 2gjx h PHE 142 CO -0.00 0.71 -0.18 0.66 -2.23 0.00 0.00 178.31 177.27 2gjx h SER 143 N 0.87 0.00 1.21 0.41 4.64 -0.37 -2.38 113.55 117.93 2gjx h SER 143 Ca 0.21 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.49 2gjx h SER 143 Cb 0.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 2gjx h SER 143 CO -0.02 0.18 -0.81 1.56 -0.87 0.00 0.00 176.83 176.86 2gjx h GLN 144 N 0.00 0.00 0.00 4.77 4.20 -1.02 -3.33 115.11 119.73 2gjx h GLN 144 Ca -0.00 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 2gjx h GLN 144 Cb 0.43 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 2gjx h GLN 144 CO 0.02 0.10 -0.49 -0.07 -0.67 0.00 0.00 178.83 177.72 2gjx h LEU 145 N 0.00 0.00 -9.48 1.46 3.38 -0.85 -3.44 115.31 106.38 2gjx h LEU 145 Ca -0.03 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.41 2gjx h LEU 145 Cb 1.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.91 2gjx h LEU 145 CO 0.01 0.41 0.71 -0.69 0.09 0.00 0.00 178.44 178.98 2gjx s VAL 146 N -3.01 3.61 0.08 1.22 1.01 -1.09 -4.67 120.40 117.54 2gjx s VAL 146 Ca 0.04 1.12 0.01 0.00 0.00 0.00 0.00 61.98 63.15 2gjx s VAL 146 Cb 0.07 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 2gjx s VAL 146 CO 0.74 0.06 -0.06 -1.66 0.00 0.00 0.00 175.10 174.18 2gjx s TRP 147 N 1.45 0.78 0.01 5.22 1.48 -0.96 -5.00 118.94 121.93 2gjx s TRP 147 Ca 0.63 -0.85 0.03 0.00 -1.06 0.00 0.00 56.10 54.85 2gjx s TRP 147 Cb -0.33 -0.47 -0.03 0.00 -1.16 0.00 0.00 33.47 31.47 2gjx s TRP 147 CO 0.29 -0.17 -0.06 0.15 -4.06 0.00 0.00 176.95 173.09 2gjx s LYS 148 N -3.36 2.54 0.82 3.25 1.02 -1.26 -1.04 119.74 121.70 2gjx s LYS 148 Ca 0.06 -0.74 -0.06 0.00 0.02 0.00 0.00 55.97 55.26 2gjx s LYS 148 Cb 0.02 -2.50 0.16 0.00 -0.52 0.00 0.00 37.83 34.99 2gjx s LYS 148 CO -0.04 0.60 1.12 -1.54 -0.92 0.00 0.00 175.35 174.56 2gjx s SER 149 N -1.50 3.83 0.56 2.83 1.04 -0.64 -4.92 113.70 114.90 2gjx s SER 149 Ca 0.18 -0.20 0.32 0.00 0.48 0.00 0.00 55.95 56.73 2gjx s SER 149 Cb -0.11 -0.01 1.63 0.00 0.10 0.00 0.00 66.02 67.62 2gjx s SER 149 CO 0.08 -2.23 2.11 0.00 0.98 0.00 0.00 173.24 174.19 2gjx h ALA 150 N -0.96 1.16 0.00 5.32 0.00 -2.00 -1.63 119.26 121.15 2gjx h ALA 150 Ca -0.38 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.40 2gjx h ALA 150 Cb 1.25 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 2gjx h ALA 150 CO 0.38 0.09 -0.29 0.93 0.00 0.00 0.00 179.25 180.35 2gjx h GLU 151 N 0.00 0.00 0.00 0.00 3.07 -2.05 -3.47 114.58 112.13 2gjx h GLU 151 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2gjx h GLU 151 Cb 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 2gjx h GLU 151 CO 0.01 0.29 0.00 0.41 -1.40 0.00 0.00 179.01 178.32 2gjx n GLY 152 N 1.01 1.09 3.77 -3.84 0.00 -0.61 -5.09 105.19 101.52 2gjx n GLY 152 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 2gjx n GLY 152 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gjx s THR 153 N -2.00 4.70 0.10 2.61 2.01 -1.26 -4.78 115.64 117.03 2gjx s THR 153 Ca 0.00 1.47 -0.26 0.00 0.31 0.00 0.00 61.69 63.21 2gjx s THR 153 Cb 0.00 -4.04 -0.06 0.00 0.01 0.00 0.00 72.50 68.41 2gjx s THR 153 CO 0.00 0.44 0.80 -0.36 -0.69 0.00 0.00 174.62 174.82 2gjx s PHE 154 N -0.49 3.82 0.14 4.92 0.08 -1.26 -1.61 117.98 123.56 2gjx s PHE 154 Ca 0.34 1.59 -0.05 0.00 0.12 0.00 0.00 56.93 58.94 2gjx s PHE 154 Cb -0.20 -2.84 -0.02 0.00 -0.57 0.00 0.00 43.02 39.38 2gjx s PHE 154 CO 0.21 0.35 0.15 -0.06 -0.10 0.00 0.00 175.22 175.78 2gjx s PHE 155 N -0.46 0.60 -0.09 0.36 0.08 -0.21 -1.60 117.98 116.67 2gjx s PHE 155 Ca 0.39 -0.99 -0.05 0.00 0.12 0.00 0.00 56.93 56.40 2gjx s PHE 155 Cb -0.22 -0.28 0.03 0.00 -0.57 0.00 0.00 43.02 41.99 2gjx s PHE 155 CO 0.25 -0.59 0.21 0.42 -0.10 0.00 0.00 175.22 175.41 2gjx s ILE 156 N -3.99 -0.03 0.57 0.64 1.01 -0.20 -2.27 121.20 116.93 2gjx s ILE 156 Ca 0.19 0.10 -0.06 0.00 0.00 0.00 0.00 60.65 60.87 2gjx s ILE 156 Cb 0.06 -0.32 -0.01 0.00 0.01 0.00 0.00 42.46 42.20 2gjx s ILE 156 CO -0.01 0.04 0.89 0.20 0.00 0.00 0.00 174.94 176.07 2gjx s ASN 157 N 0.80 5.83 0.09 3.58 -0.87 -1.26 -0.12 114.94 123.00 2gjx s ASN 157 Ca -0.06 0.87 -0.31 0.00 -1.57 0.00 0.00 52.86 51.79 2gjx s ASN 157 Cb -0.07 -1.94 -0.09 0.00 -0.02 0.00 0.00 41.25 39.13 2gjx s ASN 157 CO -0.05 -0.93 1.64 -0.75 -2.57 0.00 0.00 177.10 174.45 2gjx s LYS 158 N -4.96 4.20 -0.02 -0.60 2.20 -0.52 -4.90 119.74 115.13 2gjx s LYS 158 Ca 0.52 2.35 -0.02 0.00 -0.36 0.00 0.00 55.97 58.46 2gjx s LYS 158 Cb -0.11 -3.51 0.00 0.00 -1.51 0.00 0.00 37.83 32.71 2gjx s LYS 158 CO 0.46 -0.71 0.06 -0.08 -0.36 0.00 0.00 175.35 174.72 2gjx s THR 159 N 2.33 0.02 -0.26 3.43 -1.32 -0.58 -2.62 115.64 116.64 2gjx s THR 159 Ca 0.73 -0.14 -0.00 0.00 -1.21 0.00 0.00 61.69 61.07 2gjx s THR 159 Cb -0.41 -0.14 0.07 0.00 -1.51 0.00 0.00 72.50 70.51 2gjx s THR 159 CO 0.32 -0.08 0.01 -0.70 -2.21 0.00 0.00 174.62 171.97 2gjx s GLU 160 N -0.22 1.17 -0.07 7.08 2.56 -0.43 -0.26 118.70 128.53 2gjx s GLU 160 Ca -0.03 -0.99 0.02 0.00 0.00 0.00 0.00 54.97 53.98 2gjx s GLU 160 Cb -0.02 -2.40 0.01 0.00 2.00 0.00 0.00 34.13 33.72 2gjx s GLU 160 CO 0.00 -0.74 -0.14 0.42 -0.56 0.00 0.00 175.26 174.24 2gjx s ILE 161 N 1.49 1.27 -0.26 -3.70 1.01 0.18 -0.40 121.20 120.80 2gjx s ILE 161 Ca 0.01 -0.56 0.00 0.00 0.00 0.00 0.00 60.65 60.10 2gjx s ILE 161 Cb -0.18 -1.15 0.07 0.00 0.01 0.00 0.00 42.46 41.21 2gjx s ILE 161 CO -0.12 0.39 0.01 -1.83 0.00 0.00 0.00 174.94 173.39 2gjx s GLU 162 N 0.64 1.21 0.24 2.79 4.04 -0.93 0.10 118.70 126.79 2gjx s GLU 162 Ca -0.15 -1.01 0.11 0.00 0.04 0.00 0.00 54.97 53.96 2gjx s GLU 162 Cb -0.16 -2.43 -0.05 0.00 0.02 0.00 0.00 34.13 31.52 2gjx s GLU 162 CO 0.04 -0.74 -0.19 0.34 -1.84 0.00 0.00 175.26 172.87 2gjx s ASP 163 N 1.48 3.28 -0.08 0.83 2.15 0.18 -3.04 116.67 121.46 2gjx s ASP 163 Ca 0.01 -0.98 -0.30 0.00 0.43 0.00 0.00 52.55 51.71 2gjx s ASP 163 Cb -0.18 -0.25 0.11 0.00 -0.30 0.00 0.00 42.92 42.30 2gjx s ASP 163 CO -0.11 0.01 0.90 0.72 -0.17 0.00 0.00 175.17 176.51 2gjx s PHE 164 N -2.40 -0.41 0.43 -5.34 -0.71 -1.26 -1.82 117.98 106.47 2gjx s PHE 164 Ca 0.26 0.57 -0.22 0.00 -1.04 0.00 0.00 56.93 56.50 2gjx s PHE 164 Cb -0.05 0.47 -0.09 0.00 -1.21 0.00 0.00 43.02 42.14 2gjx s PHE 164 CO 0.12 -0.46 1.01 -1.25 -1.34 0.00 0.00 175.22 173.29 2gjx s PRO 165 N -1.82 4.09 0.03 1.99 0.04 -1.26 -4.70 135.00 133.37 2gjx s PRO 165 Ca -0.01 1.33 -0.17 0.00 0.04 0.00 0.00 61.00 62.19 2gjx s PRO 165 Cb -0.01 -2.30 -0.27 0.00 0.04 0.00 0.00 34.50 31.97 2gjx s PRO 165 CO -0.01 -0.18 1.09 -0.09 0.04 0.00 0.00 177.00 177.86 2gjx h ARG 166 N 2.05 0.56 -6.59 4.56 2.43 -1.14 -3.45 114.38 112.80 2gjx h ARG 166 Ca -0.49 -0.70 -0.70 0.00 -0.81 0.00 0.00 59.98 57.29 2gjx h ARG 166 Cb 1.20 0.22 -0.28 0.00 -0.42 0.00 0.00 29.97 30.69 2gjx h ARG 166 CO 0.61 1.29 -0.87 -0.06 -1.51 0.00 0.00 179.97 179.44 2gjx s PHE 167 N -3.04 2.39 0.17 2.20 0.08 -0.90 -5.04 117.98 113.84 2gjx s PHE 167 Ca -0.11 -0.39 0.01 0.00 0.12 0.00 0.00 56.93 56.57 2gjx s PHE 167 Cb 0.05 -1.50 0.01 0.00 -0.57 0.00 0.00 43.02 41.01 2gjx s PHE 167 CO 0.89 0.03 1.39 -1.35 -0.10 0.00 0.00 175.22 176.08 2gjx h PRO 168 N 5.31 0.24 -3.91 0.24 0.11 -1.86 -3.41 132.00 128.72 2gjx h PRO 168 Ca -0.44 -0.25 -0.76 0.00 0.11 0.00 0.00 66.00 64.66 2gjx h PRO 168 Cb 1.13 0.07 -0.27 0.00 0.11 0.00 0.00 31.00 32.03 2gjx h PRO 168 CO 0.47 0.96 -0.10 -1.58 -0.21 0.00 0.00 178.00 177.53 2gjx s HIS 169 N -3.29 3.56 -0.27 0.65 5.65 -0.07 -4.93 115.29 116.59 2gjx s HIS 169 Ca -0.03 -1.94 0.03 0.00 0.25 0.00 0.00 55.06 53.36 2gjx s HIS 169 Cb 0.10 -3.68 0.06 0.00 -1.18 0.00 0.00 32.58 27.89 2gjx s HIS 169 CO 0.83 -0.97 -0.08 1.03 -0.65 0.00 0.00 174.74 174.90 2gjx s ARG 170 N 0.58 2.18 0.45 2.88 0.52 -1.26 -2.20 118.95 122.10 2gjx s ARG 170 Ca 0.13 -1.40 0.03 0.00 -0.52 0.00 0.00 55.73 53.97 2gjx s ARG 170 Cb -0.18 -2.96 -0.02 0.00 0.52 0.00 0.00 34.95 32.31 2gjx s ARG 170 CO -0.05 -0.62 0.10 0.20 0.02 0.00 0.00 175.30 174.96 2gjx s GLY 171 N 1.10 2.80 -0.03 -3.53 0.00 -0.51 -1.83 107.32 105.32 2gjx s GLY 171 Ca -0.06 -0.90 -0.02 0.00 0.00 0.00 0.00 44.72 43.74 2gjx s GLY 171 CO -0.05 -1.94 0.08 -2.27 0.00 0.00 0.00 173.10 168.92 2gjx s LEU 172 N -3.70 1.42 -0.20 0.66 1.98 -0.43 -1.82 118.68 116.59 2gjx s LEU 172 Ca 0.17 0.16 -0.07 0.00 -2.89 0.00 0.00 54.13 51.50 2gjx s LEU 172 Cb 0.01 0.22 -0.03 0.00 0.66 0.00 0.00 46.19 47.05 2gjx s LEU 172 CO 0.11 -0.07 0.04 -0.22 -1.89 0.00 0.00 176.35 174.33 2gjx s LEU 173 N 0.43 3.54 -0.20 -0.68 0.20 0.24 -0.63 118.68 121.57 2gjx s LEU 173 Ca -0.03 -0.08 -0.02 0.00 0.69 0.00 0.00 54.13 54.69 2gjx s LEU 173 Cb -0.05 -1.91 -0.00 0.00 -0.43 0.00 0.00 46.19 43.80 2gjx s LEU 173 CO -0.02 0.09 -0.09 -0.76 -0.29 0.00 0.00 176.35 175.28 2gjx s LEU 174 N 0.87 2.66 -0.54 -0.68 1.02 -0.99 -1.82 118.68 119.20 2gjx s LEU 174 Ca 0.03 -0.46 -0.20 0.00 0.02 0.00 0.00 54.13 53.51 2gjx s LEU 174 Cb -0.14 -1.65 0.06 0.00 0.02 0.00 0.00 46.19 44.48 2gjx s LEU 174 CO 0.02 -0.00 0.71 -0.62 0.02 0.00 0.00 176.35 176.48 2gjx s ASP 175 N 1.35 6.23 -0.42 2.29 2.15 -1.16 -2.08 116.67 125.03 2gjx s ASP 175 Ca 0.04 -0.90 0.05 0.00 0.43 0.00 0.00 52.55 52.18 2gjx s ASP 175 Cb -0.14 -2.33 0.65 0.00 -0.30 0.00 0.00 42.92 40.80 2gjx s ASP 175 CO -0.06 -1.02 1.84 0.35 -0.17 0.00 0.00 175.17 176.11 2gjx n THR 176 N 5.72 3.08 -0.01 1.71 -2.24 -1.00 -4.27 114.28 117.28 2gjx n THR 176 Ca -0.05 -2.05 -0.03 0.00 -2.27 0.00 0.00 64.05 59.64 2gjx n THR 176 Cb 0.45 -0.44 -0.01 0.00 -2.10 0.00 0.00 70.33 68.23 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 -1.09 1.32 0.24 3.42 2.88 -1.17 -4.46 113.62 114.76 2gjx n SER 177 Ca 0.54 0.20 0.18 0.00 -1.33 0.00 0.00 58.87 58.46 2gjx n SER 177 Cb 1.55 -0.47 0.88 0.00 -0.75 0.00 0.00 64.21 65.42 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 -0.37 0.00 -2.64 -1.46 -0.00 -1.81 -3.37 114.38 104.73 2gjx h ARG 178 Ca 0.00 0.00 -0.11 0.00 -0.50 0.00 0.00 59.98 59.37 2gjx h ARG 178 Cb 0.37 0.00 -0.24 0.00 0.00 0.00 0.00 29.97 30.10 2gjx h ARG 178 CO 0.00 0.00 -0.19 -1.01 0.00 0.00 0.00 179.97 178.77 2gjx s HIS 179 N -4.46 -0.50 0.20 3.04 3.76 -1.25 -4.83 115.29 111.25 2gjx s HIS 179 Ca -0.04 1.22 -0.30 0.00 -0.15 0.00 0.00 55.06 55.79 2gjx s HIS 179 Cb 0.14 0.18 -0.08 0.00 1.11 0.00 0.00 32.58 33.92 2gjx s HIS 179 CO 0.47 -0.25 0.95 -0.47 -0.85 0.00 0.00 174.74 174.60 2gjx s TYR 180 N 0.30 3.92 -0.22 1.40 5.04 -1.26 -4.27 117.35 122.25 2gjx s TYR 180 Ca -0.01 1.87 0.01 0.00 -2.44 0.00 0.00 57.07 56.51 2gjx s TYR 180 Cb -0.03 -3.02 0.04 0.00 0.35 0.00 0.00 41.96 39.29 2gjx s TYR 180 CO -0.00 0.33 -0.14 -0.51 -1.34 0.00 0.00 175.55 173.89 2gjx s LEU 181 N -0.80 2.81 0.66 6.97 1.43 -1.26 -4.46 118.68 124.03 2gjx s LEU 181 Ca 0.43 -0.97 -0.17 0.00 -1.03 0.00 0.00 54.13 52.39 2gjx s LEU 181 Cb -0.25 -1.54 -0.06 0.00 0.03 0.00 0.00 46.19 44.37 2gjx s LEU 181 CO 0.32 -0.09 0.57 -2.65 0.23 0.00 0.00 176.35 174.72 2gjx n PRO 182 N 4.55 0.43 -0.25 1.29 -0.02 -1.26 -4.78 135.00 134.96 2gjx n PRO 182 Ca -0.18 0.18 0.10 0.00 -2.02 0.00 0.00 63.50 61.59 2gjx n PRO 182 Cb 0.46 -1.82 0.36 0.00 -0.02 0.00 0.00 33.50 32.49 2gjx n PRO 182 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2gjx h LEU 183 N -0.07 0.68 -0.93 2.45 5.85 -1.99 -1.85 115.31 119.44 2gjx h LEU 183 Ca -0.46 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.27 2gjx h LEU 183 Cb 1.37 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 42.25 2gjx h LEU 183 CO 0.45 0.37 0.43 0.77 -0.34 0.00 0.00 178.44 180.12 2gjx h SER 184 N 0.73 1.07 -0.65 1.25 4.64 -1.99 -1.95 113.55 116.66 2gjx h SER 184 Ca 0.41 -0.11 -0.06 0.00 -0.47 0.00 0.00 61.79 61.56 2gjx h SER 184 Cb 0.58 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.36 2gjx h SER 184 CO -0.18 0.89 0.19 0.28 -0.87 0.00 0.00 176.83 177.13 2gjx h SER 185 N 1.18 0.95 -0.30 4.97 0.02 -1.68 -0.28 113.55 118.43 2gjx h SER 185 Ca 0.29 -0.22 -0.09 0.00 -0.84 0.00 0.00 61.79 60.93 2gjx h SER 185 Cb 0.08 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.35 2gjx h SER 185 CO -0.04 0.92 -0.12 0.40 -1.14 0.00 0.00 176.83 176.85 2gjx h ILE 186 N 0.94 1.26 -0.08 3.27 2.04 -1.35 -1.21 117.51 122.37 2gjx h ILE 186 Ca 0.21 -1.16 -0.14 0.00 1.00 0.00 0.00 64.86 64.77 2gjx h ILE 186 Cb 0.32 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 2gjx h ILE 186 CO -0.00 0.39 -0.57 -0.07 0.00 0.00 0.00 178.15 177.90 2gjx h LEU 187 N 0.66 0.27 -0.38 1.44 3.38 -1.07 -2.22 115.31 117.38 2gjx h LEU 187 Ca 0.11 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 2gjx h LEU 187 Cb 0.59 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2gjx h LEU 187 CO 0.04 0.78 -0.11 0.44 0.09 0.00 0.00 178.44 179.67 2gjx h ASP 188 N 0.18 0.76 -0.50 -0.43 3.45 -0.68 -2.03 116.42 117.18 2gjx h ASP 188 Ca -0.00 -0.37 -0.02 0.00 0.43 0.00 0.00 57.03 57.07 2gjx h ASP 188 Cb 1.05 -0.21 -0.03 0.00 -0.56 0.00 0.00 39.33 39.59 2gjx h ASP 188 CO 0.09 0.96 0.25 0.74 -1.57 0.00 0.00 179.24 179.70 2gjx h THR 189 N 0.55 1.18 -0.63 0.35 2.02 -1.13 -2.09 112.91 113.16 2gjx h THR 189 Ca 0.09 -0.52 -0.08 0.00 0.77 0.00 0.00 66.41 66.68 2gjx h THR 189 Cb 0.64 0.51 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 2gjx h THR 189 CO 0.04 0.21 0.09 -0.07 0.37 0.00 0.00 175.52 176.16 2gjx h LEU 190 N 0.75 0.99 -0.24 2.58 3.38 -1.15 -0.60 115.31 121.01 2gjx h LEU 190 Ca 0.19 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 57.93 2gjx h LEU 190 Cb 0.09 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2gjx h LEU 190 CO -0.02 0.99 0.15 0.44 0.09 0.00 0.00 178.44 180.09 2gjx h ASP 191 N 0.97 0.26 0.31 -0.43 3.32 -0.70 -2.01 116.42 118.14 2gjx h ASP 191 Ca 0.19 -0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.09 2gjx h ASP 191 Cb 0.43 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2gjx h ASP 191 CO 0.01 0.19 -0.58 0.58 -1.72 0.00 0.00 179.24 177.71 2gjx h VAL 192 N 0.31 1.37 -0.54 -1.35 2.07 -1.33 -2.51 116.25 114.27 2gjx h VAL 192 Ca 0.09 -1.93 0.01 0.00 0.82 0.00 0.00 66.70 65.70 2gjx h VAL 192 Cb -0.02 1.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 2gjx h VAL 192 CO -0.03 0.57 0.36 0.24 0.02 0.00 0.00 177.57 178.73 2gjx h MET 193 N 0.21 0.69 -0.42 1.57 2.86 -0.87 -0.59 114.93 118.38 2gjx h MET 193 Ca -0.00 -0.04 -0.13 0.00 -2.06 0.00 0.00 59.70 57.46 2gjx h MET 193 Cb 1.09 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.58 2gjx h MET 193 CO 0.09 0.46 -0.26 0.00 1.06 0.00 0.00 176.91 178.25 2gjx h ALA 194 N 1.67 0.74 -0.62 6.32 0.00 -0.98 0.48 119.26 126.86 2gjx h ALA 194 Ca 0.20 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 2gjx h ALA 194 Cb -0.04 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2gjx h ALA 194 CO -0.05 0.66 0.18 1.88 0.00 0.00 0.00 179.25 181.92 2gjx h TYR 195 N 0.76 0.98 -0.14 0.00 0.05 -0.80 -2.38 116.97 115.43 2gjx h TYR 195 Ca 0.09 -0.09 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2gjx h TYR 195 Cb 0.82 -0.29 0.00 0.00 1.01 0.00 0.00 36.73 38.28 2gjx h TYR 195 CO 0.05 0.79 0.00 0.09 -1.05 0.00 0.00 178.16 178.04 2gjx n ASN 196 N -4.27 1.46 -2.98 3.88 3.02 -0.35 -4.74 115.26 111.27 2gjx n ASN 196 Ca 0.05 -1.67 -0.16 0.00 -0.03 0.00 0.00 54.58 52.77 2gjx n ASN 196 Cb 0.22 -0.09 0.07 0.00 -0.61 0.00 0.00 39.78 39.37 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 0.18 -5.84 -3.89 3.52 5.02 -0.76 -4.63 118.16 111.76 2gjx n LYS 197 Ca 0.16 0.68 -0.36 0.00 -2.02 0.00 0.00 58.31 56.77 2gjx n LYS 197 Cb 0.30 -5.23 -0.08 0.00 -0.02 0.00 0.00 35.03 30.00 2gjx n LYS 197 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2gjx s LEU 198 N -5.78 4.16 -0.08 -0.35 1.02 0.16 -4.98 118.68 112.84 2gjx s LEU 198 Ca 0.20 0.29 0.11 0.00 0.02 0.00 0.00 54.13 54.76 2gjx s LEU 198 Cb -0.09 -2.04 0.18 0.00 0.02 0.00 0.00 46.19 44.26 2gjx s LEU 198 CO 0.59 0.29 1.10 -0.46 0.02 0.00 0.00 176.35 177.89 2gjx n ASN 199 N 2.79 2.25 -3.71 2.29 0.23 -0.76 -4.41 115.26 113.93 2gjx n ASN 199 Ca -0.18 -2.63 -0.22 0.00 -0.53 0.00 0.00 54.58 51.02 2gjx n ASN 199 Cb 0.53 -0.26 -0.18 0.00 -2.08 0.00 0.00 39.78 37.80 2gjx n ASN 199 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 2gjx s VAL 200 N -2.09 0.11 -0.49 3.53 1.01 -0.92 0.12 120.40 121.66 2gjx s VAL 200 Ca 0.19 0.26 -0.13 0.00 0.00 0.00 0.00 61.98 62.30 2gjx s VAL 200 Cb 0.17 -0.35 0.11 0.00 0.00 0.00 0.00 36.38 36.31 2gjx s VAL 200 CO 0.02 0.19 0.41 0.12 0.00 0.00 0.00 175.10 175.84 2gjx s PHE 201 N 2.08 3.30 -1.05 5.22 5.36 0.17 -1.31 117.98 131.75 2gjx s PHE 201 Ca 0.05 -1.38 -0.21 0.00 -0.96 0.00 0.00 56.93 54.44 2gjx s PHE 201 Cb -0.12 -3.48 0.08 0.00 -0.34 0.00 0.00 43.02 39.16 2gjx s PHE 201 CO -0.04 -0.94 1.41 -1.58 -1.46 0.00 0.00 175.22 172.60 2gjx s HIS 202 N 1.53 2.78 -0.45 10.12 5.65 0.19 -0.86 115.29 134.25 2gjx s HIS 202 Ca 0.04 -1.17 -0.28 0.00 0.25 0.00 0.00 55.06 53.90 2gjx s HIS 202 Cb -0.27 -4.58 0.03 0.00 -1.18 0.00 0.00 32.58 26.58 2gjx s HIS 202 CO 0.03 -1.77 1.06 -0.46 -0.65 0.00 0.00 174.74 172.95 2gjx s TRP 203 N 4.08 2.89 -1.02 3.88 -0.11 0.42 -2.34 118.94 126.74 2gjx s TRP 203 Ca 0.44 0.68 -0.10 0.00 1.22 0.00 0.00 56.10 58.33 2gjx s TRP 203 Cb -0.01 -4.20 0.26 0.00 -1.50 0.00 0.00 33.47 28.02 2gjx s TRP 203 CO -0.07 -1.15 0.99 -1.58 -4.62 0.00 0.00 176.95 170.52 2gjx s HIS 204 N 4.14 4.11 0.06 5.86 5.65 -0.88 -0.44 115.29 133.79 2gjx s HIS 204 Ca 0.44 -2.52 -0.30 0.00 0.25 0.00 0.00 55.06 52.93 2gjx s HIS 204 Cb -0.09 -3.80 -0.18 0.00 -1.18 0.00 0.00 32.58 27.34 2gjx s HIS 204 CO 0.28 -0.95 1.54 -0.07 -0.65 0.00 0.00 174.74 174.89 2gjx h LEU 205 N 6.94 -0.63 -9.28 8.88 4.07 -1.82 -2.66 115.31 120.81 2gjx h LEU 205 Ca 0.16 -0.01 -0.61 0.00 0.08 0.00 0.00 57.88 57.50 2gjx h LEU 205 Cb 0.92 0.16 -0.13 0.00 1.08 0.00 0.00 40.66 42.69 2gjx h LEU 205 CO 0.93 -0.40 -0.73 0.68 -1.08 0.00 0.00 178.44 177.84 2gjx s VAL 206 N -5.76 2.54 0.00 1.22 -7.23 -1.26 -3.05 120.40 106.86 2gjx s VAL 206 Ca -0.16 -2.32 0.00 0.00 -1.81 0.00 0.00 61.98 57.68 2gjx s VAL 206 Cb 0.03 -2.41 0.00 0.00 0.56 0.00 0.00 36.38 34.56 2gjx s VAL 206 CO 0.60 -0.36 0.00 -0.67 -0.31 0.00 0.00 175.10 174.36 2gjx n ASP 207 N -0.68 0.00 -0.00 4.85 -0.08 -1.22 -4.62 116.55 114.80 2gjx n ASP 207 Ca -0.05 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.22 2gjx n ASP 207 Cb 0.60 0.00 -0.00 0.00 2.34 0.00 0.00 41.12 44.06 2gjx n ASP 207 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2gjx n ASP 208 N 0.00 0.36 -0.08 1.67 10.43 -1.26 -2.49 116.55 125.18 2gjx n ASP 208 Ca 0.00 0.05 0.16 0.00 2.57 0.00 0.00 54.79 57.57 2gjx n ASP 208 Cb 0.00 -0.29 0.87 0.00 1.84 0.00 0.00 41.12 43.54 2gjx n ASP 208 CO 0.00 0.00 0.00 -0.81 -1.07 0.00 0.00 177.20 175.32 2gjx n PRO 209 N -2.85 1.11 -3.81 -0.24 -0.04 -1.26 -2.88 135.00 125.03 2gjx n PRO 209 Ca -0.02 -0.16 -0.11 0.00 -0.04 0.00 0.00 63.50 63.18 2gjx n PRO 209 Cb 0.06 -1.49 -0.08 0.00 -0.04 0.00 0.00 33.50 31.95 2gjx n PRO 209 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2gjx s SER 210 N -1.99 -0.02 -0.44 3.54 0.01 -1.26 -4.65 113.70 108.89 2gjx s SER 210 Ca 0.46 -0.34 0.06 0.00 1.31 0.00 0.00 55.95 57.44 2gjx s SER 210 Cb 0.22 0.32 0.21 0.00 0.21 0.00 0.00 66.02 66.98 2gjx s SER 210 CO 0.36 -0.60 0.56 0.33 0.41 0.00 0.00 173.24 174.30 2gjx n PHE 211 N 0.54 -1.74 0.15 2.43 -0.00 -1.21 -3.46 117.46 114.18 2gjx n PHE 211 Ca -0.18 -2.75 0.03 0.00 -0.00 0.00 0.00 57.45 54.55 2gjx n PHE 211 Cb 0.60 0.54 0.16 0.00 -0.00 0.00 0.00 39.48 40.77 2gjx n PHE 211 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.76 175.41 2gjx h PRO 212 N 4.73 0.00 -6.48 -7.13 0.11 -1.82 -3.20 132.00 118.21 2gjx h PRO 212 Ca 0.10 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.68 2gjx h PRO 212 Cb 0.96 0.00 0.03 0.00 0.11 0.00 0.00 31.00 32.10 2gjx h PRO 212 CO 0.32 0.49 1.00 -0.47 -0.21 0.00 0.00 178.00 179.13 2gjx s TYR 213 N -3.23 2.47 -0.26 0.65 5.04 -1.26 -1.05 117.35 119.71 2gjx s TYR 213 Ca 0.02 0.31 -0.19 0.00 -2.44 0.00 0.00 57.07 54.77 2gjx s TYR 213 Cb 0.09 -3.99 -0.02 0.00 0.35 0.00 0.00 41.96 38.39 2gjx s TYR 213 CO 0.72 -3.95 0.57 -2.00 -1.34 0.00 0.00 175.55 169.55 2gjx s GLU 214 N 2.45 4.08 -0.07 4.97 2.12 -0.97 -4.66 118.70 126.61 2gjx s GLU 214 Ca 0.74 0.42 -0.02 0.00 0.36 0.00 0.00 54.97 56.48 2gjx s GLU 214 Cb -0.41 -3.65 -0.03 0.00 0.26 0.00 0.00 34.13 30.29 2gjx s GLU 214 CO 0.33 -0.38 0.02 0.45 -0.54 0.00 0.00 175.26 175.13 2gjx s SER 215 N 1.52 5.36 -0.02 -1.70 0.15 -1.26 -4.67 113.70 113.08 2gjx s SER 215 Ca 0.23 0.15 0.11 0.00 0.70 0.00 0.00 55.95 57.14 2gjx s SER 215 Cb -0.16 -1.52 -0.23 0.00 -1.71 0.00 0.00 66.02 62.41 2gjx s SER 215 CO 0.09 0.35 0.76 2.19 1.20 0.00 0.00 173.24 177.83 2gjx h PHE 216 N 4.90 0.02 0.00 3.44 -0.00 -1.99 -3.09 116.94 120.21 2gjx h PHE 216 Ca -0.51 -0.01 -0.09 0.00 -0.00 0.00 0.00 57.97 57.36 2gjx h PHE 216 Cb 1.19 -0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 37.13 2gjx h PHE 216 CO 0.64 1.02 -0.44 1.79 -0.00 0.00 0.00 178.31 181.32 2gjx h THR 217 N 0.00 1.21 -2.29 0.88 1.35 -1.95 -3.36 112.91 108.74 2gjx h THR 217 Ca -0.24 -1.58 -0.57 0.00 -0.55 0.00 0.00 66.41 63.47 2gjx h THR 217 Cb 1.98 1.88 -0.37 0.00 -1.73 0.00 0.00 68.15 69.90 2gjx h THR 217 CO 0.09 0.44 -0.96 0.49 -0.25 0.00 0.00 175.52 175.32 2gjx n PHE 218 N -3.85 -1.06 -0.88 4.73 3.72 -1.25 -5.01 117.46 113.86 2gjx n PHE 218 Ca -0.01 -3.22 -0.11 0.00 -0.05 0.00 0.00 57.45 54.06 2gjx n PHE 218 Cb 0.49 0.31 -0.06 0.00 -0.94 0.00 0.00 39.48 39.28 2gjx n PHE 218 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2gjx n PRO 219 N 2.82 1.68 0.00 -1.08 -0.04 -1.17 -3.67 135.00 133.53 2gjx n PRO 219 Ca 0.29 -0.92 0.00 0.00 -0.04 0.00 0.00 63.50 62.83 2gjx n PRO 219 Cb 0.48 -1.61 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 2gjx n PRO 219 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2gjx n GLU 220 N 1.60 0.65 0.26 0.54 -0.58 -1.26 -4.62 120.64 117.23 2gjx n GLU 220 Ca 0.27 0.00 0.13 0.00 -0.42 0.00 0.00 57.16 57.14 2gjx n GLU 220 Cb 0.67 -0.77 0.71 0.00 -0.57 0.00 0.00 31.44 31.48 2gjx n GLU 220 CO 0.00 0.00 0.00 1.37 -0.48 0.00 0.00 177.13 178.02 2gjx h LEU 221 N 0.00 0.00 0.12 -4.62 8.10 -1.76 -1.20 115.31 115.95 2gjx h LEU 221 Ca 0.00 0.00 -0.30 0.00 0.11 0.00 0.00 57.88 57.69 2gjx h LEU 221 Cb 0.54 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.76 2gjx h LEU 221 CO 0.00 0.12 -1.56 -0.03 -4.11 0.00 0.00 178.44 172.86 2gjx h MET 222 N 0.00 0.25 0.00 0.17 4.05 -1.79 -2.59 114.93 115.03 2gjx h MET 222 Ca -0.00 -0.43 -0.05 0.00 -0.28 0.00 0.00 59.70 58.94 2gjx h MET 222 Cb 0.40 0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 31.35 2gjx h MET 222 CO 0.02 1.21 -0.22 0.07 0.23 0.00 0.00 176.91 178.21 2gjx h ARG 223 N -0.22 0.00 -0.29 0.39 0.11 -1.80 -1.54 114.38 111.02 2gjx h ARG 223 Ca -0.33 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.75 2gjx h ARG 223 Cb 1.83 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.91 2gjx h ARG 223 CO 0.06 0.22 0.00 1.63 0.10 0.00 0.00 179.97 181.99 2gjx n LYS 224 N -3.20 3.00 0.00 0.08 5.02 -0.46 -4.64 118.16 117.96 2gjx n LYS 224 Ca 0.02 -2.71 0.00 0.00 -2.02 0.00 0.00 58.31 53.61 2gjx n LYS 224 Cb 0.56 -1.75 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 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 -0.25 0.00 3.77 0.72 0.00 -0.97 -4.60 105.19 103.86 2gjx n GLY 225 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.42 5.30 0.30 1.61 1.04 -0.59 -3.34 113.70 114.60 2gjx s SER 226 Ca 0.00 2.15 0.07 0.00 0.48 0.00 0.00 55.95 58.65 2gjx s SER 226 Cb 0.00 -2.57 0.81 0.00 0.10 0.00 0.00 66.02 64.36 2gjx s SER 226 CO 0.00 -1.51 1.70 1.88 0.98 0.00 0.00 173.24 176.29 2gjx h TYR 227 N 0.59 0.78 -2.94 5.02 0.05 -1.84 -3.40 116.97 115.23 2gjx h TYR 227 Ca -0.49 0.04 -0.18 0.00 0.05 0.00 0.00 58.73 58.15 2gjx h TYR 227 Cb 1.26 -0.20 -0.29 0.00 1.01 0.00 0.00 36.73 38.52 2gjx h TYR 227 CO 0.52 -0.03 -0.44 1.21 -1.05 0.00 0.00 178.16 178.36 2gjx s ASN 228 N -5.15 -0.32 0.32 3.88 3.04 -1.26 -5.04 114.94 110.40 2gjx s ASN 228 Ca -0.11 0.60 0.19 0.00 0.04 0.00 0.00 52.86 53.58 2gjx s ASN 228 Cb 0.26 0.49 1.03 0.00 -1.54 0.00 0.00 41.25 41.49 2gjx s ASN 228 CO 0.79 -0.17 1.55 -0.81 -3.04 0.00 0.00 177.10 175.41 2gjx n PRO 229 N 4.24 0.12 0.00 0.43 -0.04 -1.26 -3.32 135.00 135.17 2gjx n PRO 229 Ca -0.25 0.62 0.00 0.00 -0.04 0.00 0.00 63.50 63.83 2gjx n PRO 229 Cb 0.53 -1.99 0.00 0.00 -0.04 0.00 0.00 33.50 32.01 2gjx n PRO 229 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2gjx n VAL 230 N -2.19 0.00 0.42 0.52 0.24 -1.26 -4.88 118.33 111.18 2gjx n VAL 230 Ca -0.01 0.00 0.13 0.00 -2.04 0.00 0.00 64.34 62.41 2gjx n VAL 230 Cb 0.11 -0.56 0.31 0.00 -1.47 0.00 0.00 33.84 32.24 2gjx n VAL 230 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 2gjx h THR 231 N 0.00 0.00 -1.99 3.34 1.35 -2.00 -3.34 112.91 110.27 2gjx h THR 231 Ca 0.00 -0.71 -0.56 0.00 -0.55 0.00 0.00 66.41 64.59 2gjx h THR 231 Cb 0.42 1.70 -0.42 0.00 -1.73 0.00 0.00 68.15 68.13 2gjx h THR 231 CO 0.00 0.00 -0.78 1.41 -0.25 0.00 0.00 175.52 175.90 2gjx n HIS 232 N -2.67 3.13 -4.23 4.73 8.25 -1.21 -5.04 115.22 118.18 2gjx n HIS 232 Ca 0.05 -3.70 -0.20 0.00 -0.26 0.00 0.00 57.72 53.61 2gjx n HIS 232 Cb 0.47 -0.38 -0.12 0.00 1.12 0.00 0.00 29.99 31.08 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 -4.31 1.38 -0.42 1.59 -1.09 -1.26 -4.53 121.20 112.56 2gjx s ILE 233 Ca 0.46 -1.47 -0.02 0.00 -2.23 0.00 0.00 60.65 57.38 2gjx s ILE 233 Cb 0.33 -1.34 0.11 0.00 -1.58 0.00 0.00 42.46 39.99 2gjx s ILE 233 CO -0.13 -0.20 0.21 -0.31 -1.23 0.00 0.00 174.94 173.28 2gjx s TYR 234 N -1.40 3.59 0.86 3.97 1.51 -0.21 -5.00 117.35 120.67 2gjx s TYR 234 Ca 0.03 -2.50 -0.11 0.00 -1.01 0.00 0.00 57.07 53.47 2gjx s TYR 234 Cb -0.09 -3.19 0.11 0.00 -0.11 0.00 0.00 41.96 38.67 2gjx s TYR 234 CO 0.03 -0.96 1.09 0.99 -1.11 0.00 0.00 175.55 175.60 2gjx s THR 235 N 1.00 2.81 0.58 -0.71 2.01 -1.26 -2.30 115.64 117.76 2gjx s THR 235 Ca 0.09 0.26 0.27 0.00 0.31 0.00 0.00 61.69 62.63 2gjx s THR 235 Cb -0.22 -2.78 0.34 0.00 0.01 0.00 0.00 72.50 69.85 2gjx s THR 235 CO -0.04 -0.34 2.24 0.00 -0.69 0.00 0.00 174.62 175.78 2gjx h ALA 236 N -1.43 1.60 -0.04 7.40 0.00 -1.99 -0.56 119.26 124.24 2gjx h ALA 236 Ca -0.48 -0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.20 2gjx h ALA 236 Cb 1.27 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.08 2gjx h ALA 236 CO 0.55 0.00 -0.84 0.37 0.00 0.00 0.00 179.25 179.33 2gjx h GLN 237 N 0.00 0.64 -0.46 0.00 5.75 -1.99 -2.31 115.11 116.73 2gjx h GLN 237 Ca -0.00 -0.64 -0.00 0.00 -0.15 0.00 0.00 58.65 57.86 2gjx h GLN 237 Cb 0.01 0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.71 2gjx h GLN 237 CO 0.00 1.24 0.28 -0.44 -2.65 0.00 0.00 178.83 177.26 2gjx h ASP 238 N 0.28 0.56 -0.39 -0.69 3.32 -1.57 -2.55 116.42 115.36 2gjx h ASP 238 Ca -0.09 -0.06 -0.10 0.00 0.02 0.00 0.00 57.03 56.80 2gjx h ASP 238 Cb 1.51 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.90 2gjx h ASP 238 CO 0.17 0.45 -0.11 0.58 -1.72 0.00 0.00 179.24 178.60 2gjx h VAL 239 N 0.62 1.26 0.00 -1.35 2.07 -1.20 -2.30 116.25 115.35 2gjx h VAL 239 Ca 0.17 -1.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.46 2gjx h VAL 239 Cb -0.01 1.03 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 2gjx h VAL 239 CO -0.03 0.42 -0.10 0.07 0.02 0.00 0.00 177.57 177.95 2gjx h LYS 240 N 0.76 0.00 0.20 1.57 2.10 -1.27 -2.78 116.57 117.15 2gjx h LYS 240 Ca 0.13 0.00 -0.33 0.00 -2.00 0.00 0.00 60.65 58.45 2gjx h LYS 240 Cb 0.62 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.97 2gjx h LYS 240 CO 0.04 0.10 -1.53 0.93 -2.00 0.00 0.00 179.45 176.99 2gjx h GLU 241 N 0.00 0.41 -0.94 0.07 5.08 -1.17 -2.80 114.58 115.23 2gjx h GLU 241 Ca -0.00 -0.71 0.05 0.00 -1.00 0.00 0.00 59.36 57.70 2gjx h GLU 241 Cb 0.66 0.26 -0.06 0.00 0.50 0.00 0.00 28.75 30.12 2gjx h GLU 241 CO 0.01 1.32 0.61 0.28 -1.00 0.00 0.00 179.01 180.24 2gjx h VAL 242 N 0.11 1.12 -0.03 3.13 2.07 -1.29 0.47 116.25 121.83 2gjx h VAL 242 Ca -0.26 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 2gjx h VAL 242 Cb 2.10 -0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 31.75 2gjx h VAL 242 CO 0.22 0.21 -0.01 0.40 0.02 0.00 0.00 177.57 178.41 2gjx h ILE 243 N 1.14 1.29 -0.39 4.57 2.04 -1.56 -1.99 117.51 122.60 2gjx h ILE 243 Ca 0.39 -0.89 -0.15 0.00 1.00 0.00 0.00 64.86 65.21 2gjx h ILE 243 Cb 0.09 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 2gjx h ILE 243 CO -0.13 0.24 -0.34 -0.08 0.00 0.00 0.00 178.15 177.84 2gjx h GLU 244 N -0.29 0.92 -0.59 2.37 4.57 -1.20 -0.04 114.58 120.33 2gjx h GLU 244 Ca 0.01 -0.47 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 2gjx h GLU 244 Cb 0.39 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.95 2gjx h GLU 244 CO 0.00 1.12 0.38 -0.92 -1.18 0.00 0.00 179.01 178.42 2gjx h TYR 245 N 0.74 0.74 -0.17 0.92 3.20 -0.12 -1.69 116.97 120.59 2gjx h TYR 245 Ca 0.07 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.81 2gjx h TYR 245 Cb 0.93 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 2gjx h TYR 245 CO 0.06 0.47 -0.51 0.00 -1.64 0.00 0.00 178.16 176.54 2gjx h ALA 246 N 1.21 0.79 -0.79 1.82 0.00 -1.26 -3.14 119.26 117.88 2gjx h ALA 246 Ca 0.21 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 2gjx h ALA 246 Cb -0.08 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 2gjx h ALA 246 CO -0.05 0.68 0.36 -0.09 0.00 0.00 0.00 179.25 180.15 2gjx h ARG 247 N 0.38 1.15 0.00 0.00 2.43 -0.54 0.25 114.38 118.05 2gjx h ARG 247 Ca 0.01 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 2gjx h ARG 247 Cb 1.03 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.38 2gjx h ARG 247 CO 0.09 0.90 0.00 1.28 -1.51 0.00 0.00 179.97 180.73 2gjx n LEU 248 N -4.30 0.16 -0.09 3.80 4.77 -0.68 -1.99 117.00 118.68 2gjx n LEU 248 Ca 0.08 0.55 0.08 0.00 -0.03 0.00 0.00 56.01 56.68 2gjx n LEU 248 Cb 0.15 -0.53 0.12 0.00 -2.33 0.00 0.00 43.42 40.83 2gjx n LEU 248 CO 0.40 -0.38 0.56 0.54 -1.33 0.00 0.00 177.39 177.18 2gjx n ARG 249 N -1.69 1.65 -3.58 3.23 1.74 -0.40 -4.87 116.66 112.74 2gjx n ARG 249 Ca 0.02 -2.40 -0.23 0.00 -0.77 0.00 0.00 57.85 54.48 2gjx n ARG 249 Cb 0.15 -1.42 0.08 0.00 -1.02 0.00 0.00 32.46 30.25 2gjx n ARG 249 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2gjx n GLY 250 N -1.23 -0.51 3.13 -0.13 0.00 -0.78 -4.83 105.19 100.85 2gjx n GLY 250 Ca 0.13 0.23 -0.33 0.00 0.00 0.00 0.00 46.02 46.05 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 -3.33 2.15 0.04 -0.61 1.01 0.76 -4.48 121.20 116.74 2gjx s ILE 251 Ca 0.47 -0.92 -0.30 0.00 0.00 0.00 0.00 60.65 59.91 2gjx s ILE 251 Cb -0.21 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.30 2gjx s ILE 251 CO 0.74 0.52 1.03 -0.13 0.00 0.00 0.00 174.94 177.10 2gjx s ARG 252 N 1.30 4.56 -0.26 2.79 0.52 0.12 -3.84 118.95 124.14 2gjx s ARG 252 Ca 0.05 1.51 -0.16 0.00 -0.52 0.00 0.00 55.73 56.61 2gjx s ARG 252 Cb -0.13 -3.41 -0.03 0.00 0.52 0.00 0.00 34.95 31.89 2gjx s ARG 252 CO -0.12 -0.04 0.42 0.08 0.02 0.00 0.00 175.30 175.66 2gjx s VAL 253 N 0.78 5.14 -0.25 3.52 1.01 -1.26 0.43 120.40 129.77 2gjx s VAL 253 Ca 0.52 0.69 0.02 0.00 0.00 0.00 0.00 61.98 63.22 2gjx s VAL 253 Cb -0.24 -3.75 0.05 0.00 0.00 0.00 0.00 36.38 32.45 2gjx s VAL 253 CO 0.29 0.15 -0.11 -0.22 0.00 0.00 0.00 175.10 175.21 2gjx s LEU 254 N 2.02 3.29 0.20 3.92 0.20 -0.04 -4.55 118.68 123.73 2gjx s LEU 254 Ca 0.18 -1.25 -0.16 0.00 0.69 0.00 0.00 54.13 53.58 2gjx s LEU 254 Cb -0.16 -1.56 -0.08 0.00 -0.43 0.00 0.00 46.19 43.97 2gjx s LEU 254 CO 0.09 -0.17 0.64 0.00 -0.29 0.00 0.00 176.35 176.62 2gjx s ALA 255 N 1.15 3.48 -0.17 5.97 0.00 -1.26 -0.44 121.76 130.50 2gjx s ALA 255 Ca -0.06 -0.01 -0.02 0.00 0.00 0.00 0.00 51.96 51.87 2gjx s ALA 255 Cb -0.19 -2.65 0.05 0.00 0.00 0.00 0.00 23.12 20.33 2gjx s ALA 255 CO -0.06 0.40 0.00 -2.00 0.00 0.00 0.00 175.76 174.10 2gjx s GLU 256 N -2.17 0.93 -0.82 0.00 2.12 0.42 -1.75 118.70 117.42 2gjx s GLU 256 Ca 0.43 -0.41 0.01 0.00 0.36 0.00 0.00 54.97 55.35 2gjx s GLU 256 Cb -0.15 -1.95 0.21 0.00 0.26 0.00 0.00 34.13 32.50 2gjx s GLU 256 CO 0.20 -0.53 0.70 1.19 -0.54 0.00 0.00 175.26 176.28 2gjx n PHE 257 N 4.99 3.80 -2.18 5.30 3.72 -1.23 -3.40 117.46 128.45 2gjx n PHE 257 Ca -0.10 -4.16 -0.41 0.00 -0.05 0.00 0.00 57.45 52.74 2gjx n PHE 257 Cb 0.47 -0.92 -0.03 0.00 -0.94 0.00 0.00 39.48 38.07 2gjx n PHE 257 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 2gjx s ASP 258 N -0.85 6.87 0.10 4.37 -4.77 -1.26 -4.62 116.67 116.51 2gjx s ASP 258 Ca 0.28 2.58 -0.11 0.00 -3.30 0.00 0.00 52.55 52.00 2gjx s ASP 258 Cb -0.04 -2.64 0.01 0.00 -1.09 0.00 0.00 42.92 39.16 2gjx s ASP 258 CO -0.13 -0.47 0.26 0.42 0.70 0.00 0.00 175.17 175.95 2gjx s THR 259 N -0.95 0.12 -1.31 2.11 -4.23 -1.25 -4.64 115.64 105.49 2gjx s THR 259 Ca 0.49 -0.98 0.27 0.00 -1.18 0.00 0.00 61.69 60.29 2gjx s THR 259 Cb -0.38 -1.29 0.22 0.00 1.34 0.00 0.00 72.50 72.39 2gjx s THR 259 CO 0.49 -0.54 1.66 -0.81 -0.54 0.00 0.00 174.62 174.88 2gjx n PRO 260 N -0.12 0.34 -1.86 3.99 -0.04 -1.26 -3.03 135.00 133.02 2gjx n PRO 260 Ca -0.15 -0.15 -0.30 0.00 -0.04 0.00 0.00 63.50 62.85 2gjx n PRO 260 Cb 0.63 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.63 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 -2.76 1.64 -0.99 0.55 0.00 -1.26 -1.47 107.32 103.03 2gjx s GLY 261 Ca 0.19 -0.26 -0.12 0.00 0.00 0.00 0.00 44.72 44.53 2gjx s GLY 261 CO 0.57 0.08 0.75 1.42 0.00 0.00 0.00 173.10 175.93 2gjx n HIS 262 N -2.96 -2.21 -2.08 1.90 8.25 -1.26 -4.85 115.22 112.01 2gjx n HIS 262 Ca 0.07 0.70 0.00 0.00 -0.26 0.00 0.00 57.72 58.23 2gjx n HIS 262 Cb 0.56 -3.51 0.00 0.00 1.12 0.00 0.00 29.99 28.16 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 -3.31 0.00 0.61 1.59 -2.24 -1.04 -4.32 114.28 105.57 2gjx n THR 263 Ca -0.11 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 2gjx n THR 263 Cb 0.59 0.52 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 2gjx n THR 263 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2gjx n LEU 264 N 0.08 1.23 0.00 3.22 0.00 -1.24 -1.13 117.00 119.16 2gjx n LEU 264 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 56.01 55.40 2gjx n LEU 264 Cb 0.75 -0.30 0.00 0.00 0.00 0.00 0.00 43.42 43.86 2gjx n LEU 264 CO -0.01 0.23 -0.22 -1.54 0.00 0.00 0.00 177.39 175.85 2gjx n SER 265 N 0.45 2.20 -0.00 1.96 3.41 -1.14 -4.66 113.62 115.85 2gjx n SER 265 Ca 0.00 -0.08 0.14 0.00 -0.26 0.00 0.00 58.87 58.67 2gjx n SER 265 Cb 0.23 0.60 0.64 0.00 -0.26 0.00 0.00 64.21 65.42 2gjx n SER 265 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2gjx n TRP 266 N -0.82 0.00 0.00 7.33 7.02 -0.29 -4.45 117.44 126.24 2gjx n TRP 266 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2gjx n TRP 266 Cb 0.00 -0.46 0.00 0.00 -2.42 0.00 0.00 31.31 28.43 2gjx n TRP 266 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2gjx n GLY 267 N 1.46 -1.62 3.64 6.99 0.00 -1.25 -3.94 105.19 110.47 2gjx n GLY 267 Ca 0.08 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.56 2gjx n GLY 267 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2gjx n PRO 268 N -0.11 1.29 0.00 1.61 -0.04 -1.26 -1.29 135.00 135.20 2gjx n PRO 268 Ca 0.00 0.45 0.00 0.00 -0.04 0.00 0.00 63.50 63.91 2gjx n PRO 268 Cb 0.00 -2.26 0.00 0.00 -0.04 0.00 0.00 33.50 31.20 2gjx n PRO 268 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2gjx n GLY 269 N 4.83 3.15 2.91 0.55 0.00 -1.26 -4.35 105.19 111.01 2gjx n GLY 269 Ca 0.30 -0.77 -0.30 0.00 0.00 0.00 0.00 46.02 45.24 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 2.31 0.73 -0.61 1.10 -0.42 -4.60 121.20 119.70 2gjx s ILE 270 Ca 0.00 -3.06 -0.12 0.00 -0.51 0.00 0.00 60.65 56.96 2gjx s ILE 270 Cb 0.00 -2.62 0.03 0.00 0.15 0.00 0.00 42.46 40.03 2gjx s ILE 270 CO 0.00 -0.80 1.09 -2.84 -2.11 0.00 0.00 174.94 170.29 2gjx s PRO 271 N -0.04 2.51 -0.64 3.50 0.02 -1.23 -3.91 135.00 135.21 2gjx s PRO 271 Ca 0.16 1.22 0.00 0.00 0.02 0.00 0.00 61.00 62.41 2gjx s PRO 271 Cb -0.25 -1.92 0.00 0.00 0.02 0.00 0.00 34.50 32.35 2gjx s PRO 271 CO -0.01 -1.46 0.00 0.41 -0.33 0.00 0.00 177.00 175.61 2gjx n GLY 272 N -1.04 0.80 0.09 0.52 0.00 -1.26 -4.90 105.19 99.39 2gjx n GLY 272 Ca 0.09 -0.77 -0.08 0.00 0.00 0.00 0.00 46.02 45.26 2gjx n GLY 272 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2gjx n LEU 273 N -0.71 0.00 -4.45 0.99 7.94 -1.25 -4.80 117.00 114.73 2gjx n LEU 273 Ca -0.06 0.00 -0.34 0.00 -1.11 0.00 0.00 56.01 54.50 2gjx n LEU 273 Cb 0.23 0.45 -0.13 0.00 0.53 0.00 0.00 43.42 44.50 2gjx n LEU 273 CO 0.09 0.45 -0.37 -0.76 -1.11 0.00 0.00 177.39 175.69 2gjx s LEU 274 N -5.38 3.10 0.02 -1.96 1.43 -1.26 0.16 118.68 114.80 2gjx s LEU 274 Ca -0.10 -0.21 -0.34 0.00 -1.03 0.00 0.00 54.13 52.46 2gjx s LEU 274 Cb 0.06 -1.75 -0.13 0.00 0.03 0.00 0.00 46.19 44.41 2gjx s LEU 274 CO 0.82 0.14 1.73 0.35 0.23 0.00 0.00 176.35 179.61 2gjx n THR 275 N 3.75 0.30 -2.54 5.49 -2.24 -1.07 -4.78 114.28 113.19 2gjx n THR 275 Ca -0.18 -0.05 -0.42 0.00 -2.27 0.00 0.00 64.05 61.13 2gjx n THR 275 Cb 0.52 -1.68 -0.03 0.00 -2.10 0.00 0.00 70.33 67.04 2gjx n THR 275 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2gjx s PRO 276 N 2.57 4.44 0.47 -0.78 0.02 -1.26 -1.88 135.00 138.58 2gjx s PRO 276 Ca 0.86 1.60 -0.21 0.00 0.02 0.00 0.00 61.00 63.28 2gjx s PRO 276 Cb -0.70 -3.46 -0.09 0.00 0.02 0.00 0.00 34.50 30.27 2gjx s PRO 276 CO 0.46 -0.26 1.03 0.00 -0.33 0.00 0.00 177.00 177.90 2gjx s TYR 278 N -1.95 1.89 0.30 0.00 1.51 -1.26 0.27 117.35 118.12 2gjx s TYR 278 Ca 0.65 -2.38 0.06 0.00 -1.01 0.00 0.00 57.07 54.40 2gjx s TYR 278 Cb -0.16 -1.80 0.76 0.00 -0.11 0.00 0.00 41.96 40.64 2gjx s TYR 278 CO 0.20 -0.78 1.76 0.66 -1.11 0.00 0.00 175.55 176.28 2gjx h SER 279 N 6.70 0.71 0.00 2.29 4.64 -1.87 -3.43 113.55 122.58 2gjx h SER 279 Ca 0.01 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 2gjx h SER 279 Cb 0.93 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 2gjx h SER 279 CO 0.47 0.21 0.00 0.61 -0.87 0.00 0.00 176.83 177.25 2gjx n GLY 280 N -1.32 -0.45 0.13 -0.77 0.00 -1.26 -5.05 105.19 96.46 2gjx n GLY 280 Ca 0.24 0.24 -0.26 0.00 0.00 0.00 0.00 46.02 46.24 2gjx n GLY 280 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2gjx n SER 281 N -0.31 1.94 -4.95 1.61 2.88 -1.26 -5.02 113.62 108.50 2gjx n SER 281 Ca 0.00 0.36 -0.23 0.00 -1.33 0.00 0.00 58.87 57.68 2gjx n SER 281 Cb 0.00 -0.84 -0.02 0.00 -0.75 0.00 0.00 64.21 62.61 2gjx n SER 281 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2gjx s GLU 282 N -2.52 3.46 0.15 -1.46 0.41 -1.26 -5.04 118.70 112.44 2gjx s GLU 282 Ca -0.36 -0.53 -0.34 0.00 -0.41 0.00 0.00 54.97 53.33 2gjx s GLU 282 Cb 0.12 -2.76 -0.15 0.00 -1.78 0.00 0.00 34.13 29.56 2gjx s GLU 282 CO 0.49 0.27 1.47 -2.30 -0.49 0.00 0.00 175.26 174.71 2gjx n PRO 283 N -1.62 1.81 0.00 0.39 -0.02 -1.26 -3.81 135.00 130.49 2gjx n PRO 283 Ca -0.07 0.65 0.09 0.00 -2.02 0.00 0.00 63.50 62.15 2gjx n PRO 283 Cb 0.57 -2.36 0.50 0.00 -0.02 0.00 0.00 33.50 32.19 2gjx n PRO 283 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2gjx n SER 284 N 2.95 0.00 0.00 2.55 2.88 0.77 -4.84 113.62 117.93 2gjx n SER 284 Ca 0.17 -0.43 0.00 0.00 -1.33 0.00 0.00 58.87 57.28 2gjx n SER 284 Cb 0.26 -0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.66 2gjx n SER 284 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2gjx n GLY 285 N 0.11 2.86 3.98 0.46 0.00 -1.26 -4.95 105.19 106.39 2gjx n GLY 285 Ca 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 2gjx n GLY 285 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2gjx s THR 286 N -0.85 3.12 0.09 2.61 -4.23 -1.26 -4.97 115.64 110.15 2gjx s THR 286 Ca 0.00 -0.74 0.05 0.00 -1.18 0.00 0.00 61.69 59.82 2gjx s THR 286 Cb 0.00 -3.13 -0.03 0.00 1.34 0.00 0.00 72.50 70.68 2gjx s THR 286 CO 0.00 -0.08 -0.13 -0.36 -0.54 0.00 0.00 174.62 173.51 2gjx s PHE 287 N -2.58 1.22 0.00 3.99 0.08 -1.26 -1.52 117.98 117.90 2gjx s PHE 287 Ca 0.54 -0.53 0.00 0.00 0.12 0.00 0.00 56.93 57.06 2gjx s PHE 287 Cb -0.10 -0.66 0.00 0.00 -0.57 0.00 0.00 43.02 41.68 2gjx s PHE 287 CO 0.36 0.06 0.00 0.41 -0.10 0.00 0.00 175.22 175.96 2gjx n GLY 288 N 0.91 4.21 3.40 4.36 0.00 -0.79 -4.94 105.19 112.35 2gjx n GLY 288 Ca -0.18 -1.80 -0.29 0.00 0.00 0.00 0.00 46.02 43.74 2gjx n GLY 288 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2gjx s PRO 289 N 2.97 -1.92 0.23 1.61 0.02 -1.26 -4.44 135.00 132.20 2gjx s PRO 289 Ca 0.00 0.49 -0.32 0.00 0.02 0.00 0.00 61.00 61.19 2gjx s PRO 289 Cb 0.00 -1.47 -0.12 0.00 0.02 0.00 0.00 34.50 32.93 2gjx s PRO 289 CO 0.00 -4.30 1.65 0.28 -0.33 0.00 0.00 177.00 174.30 2gjx n VAL 290 N -5.27 0.36 -2.13 3.83 0.31 -0.54 -2.61 118.33 112.28 2gjx n VAL 290 Ca 0.07 -0.09 -0.42 0.00 -0.01 0.00 0.00 64.34 63.89 2gjx n VAL 290 Cb 0.57 -1.90 -0.03 0.00 -0.91 0.00 0.00 33.84 31.58 2gjx n VAL 290 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2gjx s ASN 291 N 0.89 5.95 -0.15 4.52 3.84 0.42 -4.73 114.94 125.68 2gjx s ASN 291 Ca 0.72 0.98 0.15 0.00 0.21 0.00 0.00 52.86 54.91 2gjx s ASN 291 Cb -0.53 -2.53 0.69 0.00 -0.55 0.00 0.00 41.25 38.32 2gjx s ASN 291 CO 0.39 -1.72 1.57 -0.81 -2.79 0.00 0.00 177.10 173.74 2gjx n PRO 292 N 8.44 3.90 -0.00 0.43 -0.04 -1.26 -4.24 135.00 142.23 2gjx n PRO 292 Ca 0.20 -2.67 0.09 0.00 -0.04 0.00 0.00 63.50 61.08 2gjx n PRO 292 Cb 0.48 -1.99 -0.11 0.00 -0.04 0.00 0.00 33.50 31.84 2gjx n PRO 292 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2gjx n SER 293 N 0.81 0.84 -1.70 3.54 2.88 -1.26 -4.92 113.62 113.80 2gjx n SER 293 Ca 0.24 -0.82 0.00 0.00 -1.33 0.00 0.00 58.87 56.96 2gjx n SER 293 Cb 0.94 1.10 0.00 0.00 -0.75 0.00 0.00 64.21 65.50 2gjx n SER 293 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2gjx n LEU 294 N -1.52 0.00 0.00 2.46 4.77 -1.26 -5.06 117.00 116.39 2gjx n LEU 294 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2gjx n LEU 294 Cb 0.31 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 2gjx n LEU 294 CO 0.37 -0.32 0.04 0.59 -1.33 0.00 0.00 177.39 176.74 2gjx n ASN 295 N -2.12 0.15 0.00 -1.43 3.02 -1.26 -4.43 115.26 109.19 2gjx n ASN 295 Ca 0.00 -0.57 0.07 0.00 -0.03 0.00 0.00 54.58 54.05 2gjx n ASN 295 Cb 0.00 0.84 0.30 0.00 -0.61 0.00 0.00 39.78 40.30 2gjx n ASN 295 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2gjx n ASN 296 N -0.84 0.02 -0.10 6.41 4.05 -1.26 -2.05 115.26 121.49 2gjx n ASN 296 Ca 0.00 0.50 -0.19 0.00 0.45 0.00 0.00 54.58 55.34 2gjx n ASN 296 Cb 0.00 -0.51 -0.09 0.00 1.23 0.00 0.00 39.78 40.41 2gjx n ASN 296 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 177.26 174.62 2gjx n THR 297 N -1.52 1.51 1.46 -0.44 -1.04 -1.26 -3.36 114.28 109.64 2gjx n THR 297 Ca 0.03 -0.03 0.14 0.00 -2.04 0.00 0.00 64.05 62.15 2gjx n THR 297 Cb 0.16 -2.10 0.74 0.00 -1.82 0.00 0.00 70.33 67.31 2gjx n THR 297 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2gjx n TYR 298 N -4.44 0.00 -0.10 -1.42 4.01 -1.18 -1.08 117.16 112.95 2gjx n TYR 298 Ca -0.30 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.32 2gjx n TYR 298 Cb 0.63 -0.17 -0.11 0.00 -0.31 0.00 0.00 39.34 39.38 2gjx n TYR 298 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 2gjx n GLU 299 N -1.17 0.81 -0.19 -0.72 4.07 -0.87 -3.61 120.64 118.96 2gjx n GLU 299 Ca 0.16 0.07 -0.10 0.00 -0.06 0.00 0.00 57.16 57.24 2gjx n GLU 299 Cb 0.17 -1.41 0.01 0.00 -0.06 0.00 0.00 31.44 30.15 2gjx n GLU 299 CO 0.00 0.00 0.00 0.35 -0.06 0.00 0.00 177.13 177.42 2gjx h PHE 300 N 0.00 1.07 -0.02 4.31 3.57 -1.54 -2.23 116.94 122.11 2gjx h PHE 300 Ca -0.45 -0.19 -0.14 0.00 3.53 0.00 0.00 57.97 60.72 2gjx h PHE 300 Cb 1.81 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 40.26 2gjx h PHE 300 CO 0.02 0.97 -0.64 1.98 -2.23 0.00 0.00 178.31 178.41 2gjx h MET 301 N 0.86 0.08 -0.08 1.11 4.05 -1.32 -0.91 114.93 118.71 2gjx h MET 301 Ca 0.15 -0.06 -0.09 0.00 -0.28 0.00 0.00 59.70 59.42 2gjx h MET 301 Cb 0.56 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.35 2gjx h MET 301 CO 0.03 0.69 -0.34 1.03 0.23 0.00 0.00 176.91 178.55 2gjx h SER 302 N 0.06 0.17 0.18 1.39 0.87 -1.57 -2.77 113.55 111.87 2gjx h SER 302 Ca -0.01 -0.06 -0.35 0.00 -1.23 0.00 0.00 61.79 60.14 2gjx h SER 302 Cb 1.14 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 2gjx h SER 302 CO 0.09 0.51 -1.80 0.74 -0.53 0.00 0.00 176.83 175.84 2gjx h THR 303 N 0.15 0.87 -0.14 2.23 2.02 -1.21 -3.29 112.91 113.54 2gjx h THR 303 Ca 0.02 -2.47 0.00 0.00 0.77 0.00 0.00 66.41 64.73 2gjx h THR 303 Cb 0.68 2.71 -0.01 0.00 -1.74 0.00 0.00 68.15 69.80 2gjx h THR 303 CO 0.05 0.87 0.09 0.15 0.37 0.00 0.00 175.52 177.04 2gjx h PHE 304 N 0.09 0.16 0.00 3.16 3.57 -1.15 -2.07 116.94 120.70 2gjx h PHE 304 Ca -0.36 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.14 2gjx h PHE 304 Cb 2.08 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 40.77 2gjx h PHE 304 CO 0.10 0.10 0.00 1.19 -2.23 0.00 0.00 178.31 177.47 2gjx n PHE 305 N -5.00 0.09 0.08 0.41 3.72 -1.05 -2.12 117.46 113.59 2gjx n PHE 305 Ca -0.04 0.03 -0.07 0.00 -0.05 0.00 0.00 57.45 57.31 2gjx n PHE 305 Cb 0.03 -0.55 0.05 0.00 -0.94 0.00 0.00 39.48 38.07 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 0.31 -0.00 4.37 7.12 -1.45 -2.48 115.31 123.19 2gjx h LEU 306 Ca 0.00 -0.21 -0.08 0.00 0.13 0.00 0.00 57.88 57.71 2gjx h LEU 306 Cb 0.38 -0.09 0.01 0.00 -0.53 0.00 0.00 40.66 40.42 2gjx h LEU 306 CO 0.00 0.94 -0.33 -0.08 -0.13 0.00 0.00 178.44 178.84 2gjx h GLU 307 N 0.17 0.23 -0.69 1.25 4.81 -1.21 -3.25 114.58 115.89 2gjx h GLU 307 Ca -0.03 -0.24 0.08 0.00 -0.13 0.00 0.00 59.36 59.04 2gjx h GLU 307 Cb 1.30 0.07 -0.07 0.00 0.63 0.00 0.00 28.75 30.68 2gjx h GLU 307 CO 0.12 0.96 0.36 0.28 -0.73 0.00 0.00 179.01 180.00 2gjx h VAL 308 N -0.40 0.89 0.00 0.32 2.07 -1.49 0.07 116.25 117.71 2gjx h VAL 308 Ca -0.04 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.26 2gjx h VAL 308 Cb 1.07 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 2gjx h VAL 308 CO 0.07 0.12 0.00 0.77 0.02 0.00 0.00 177.57 178.54 2gjx h SER 309 N 0.63 0.00 0.21 0.57 4.64 -1.55 -0.94 113.55 117.10 2gjx h SER 309 Ca 0.33 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.30 2gjx h SER 309 Cb 0.30 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.38 2gjx h SER 309 CO -0.24 0.00 -1.85 0.28 -0.87 0.00 0.00 176.83 174.16 2gjx h SER 310 N 0.00 0.46 0.17 4.97 0.02 -1.09 -3.40 113.55 114.68 2gjx h SER 310 Ca 0.00 -0.84 -0.01 0.00 -0.84 0.00 0.00 61.79 60.10 2gjx h SER 310 Cb 0.32 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.71 2gjx h SER 310 CO 0.00 1.74 -0.08 0.58 -1.14 0.00 0.00 176.83 177.93 2gjx h VAL 311 N 0.08 0.86 -3.58 2.27 2.07 -0.73 -3.42 116.25 113.80 2gjx h VAL 311 Ca -0.37 -1.07 -0.63 0.00 0.82 0.00 0.00 66.70 65.45 2gjx h VAL 311 Cb 2.06 1.42 -0.14 0.00 -1.52 0.00 0.00 31.29 33.11 2gjx h VAL 311 CO 0.13 0.21 0.16 -0.36 0.02 0.00 0.00 177.57 177.73 2gjx s PHE 312 N -3.61 3.12 -1.74 1.57 0.08 -0.39 -4.95 117.98 112.05 2gjx s PHE 312 Ca -0.13 0.25 0.31 0.00 0.12 0.00 0.00 56.93 57.48 2gjx s PHE 312 Cb 0.01 -3.23 1.71 0.00 -0.57 0.00 0.00 43.02 40.93 2gjx s PHE 312 CO 0.50 -0.71 2.14 -0.35 -0.10 0.00 0.00 175.22 176.69 2gjx n PRO 313 N 6.16 0.75 -2.31 0.24 -0.04 -1.26 -4.69 135.00 133.84 2gjx n PRO 313 Ca -0.01 -0.02 -0.41 0.00 -0.04 0.00 0.00 63.50 63.02 2gjx n PRO 313 Cb 0.48 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.41 2gjx n PRO 313 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2gjx s ASP 314 N -2.27 7.02 0.46 3.54 2.15 -1.26 -4.92 116.67 121.40 2gjx s ASP 314 Ca 0.39 2.35 0.19 0.00 0.43 0.00 0.00 52.55 55.91 2gjx s ASP 314 Cb 0.21 -2.62 1.16 0.00 -0.30 0.00 0.00 42.92 41.38 2gjx s ASP 314 CO 0.41 -0.40 1.94 0.15 -0.17 0.00 0.00 175.17 177.10 2gjx h PHE 315 N 4.74 0.34 -3.16 -5.34 3.04 -1.94 -3.43 116.94 111.20 2gjx h PHE 315 Ca -0.46 0.01 -0.64 0.00 3.98 0.00 0.00 57.97 60.86 2gjx h PHE 315 Cb 1.22 -0.11 -0.09 0.00 2.56 0.00 0.00 35.95 39.53 2gjx h PHE 315 CO 0.61 0.13 -0.59 0.71 -2.02 0.00 0.00 178.31 177.14 2gjx s TYR 316 N -5.29 3.22 -0.01 0.41 1.51 -1.26 0.96 117.35 116.90 2gjx s TYR 316 Ca -0.07 0.10 0.01 0.00 -1.01 0.00 0.00 57.07 56.10 2gjx s TYR 316 Cb 0.21 -1.64 0.00 0.00 -0.11 0.00 0.00 41.96 40.42 2gjx s TYR 316 CO 0.76 0.53 -0.04 -0.51 -1.11 0.00 0.00 175.55 175.18 2gjx s LEU 317 N -2.34 1.88 -1.07 -1.29 1.43 -0.78 -4.67 118.68 111.83 2gjx s LEU 317 Ca 0.29 -0.07 -0.19 0.00 -1.03 0.00 0.00 54.13 53.13 2gjx s LEU 317 Cb -0.12 -0.23 0.11 0.00 0.03 0.00 0.00 46.19 45.97 2gjx s LEU 317 CO 0.22 0.03 1.38 -2.28 0.23 0.00 0.00 176.35 175.93 2gjx s HIS 318 N 0.08 2.97 -1.42 0.29 5.65 -0.71 -1.62 115.29 120.54 2gjx s HIS 318 Ca -0.00 -1.43 0.00 0.00 0.25 0.00 0.00 55.06 53.88 2gjx s HIS 318 Cb -0.04 -4.49 0.00 0.00 -1.18 0.00 0.00 32.58 26.88 2gjx s HIS 318 CO -0.00 -1.65 0.48 1.28 -0.65 0.00 0.00 174.74 174.20 2gjx n LEU 319 N 7.33 0.00 0.00 8.88 4.77 -1.16 -3.55 117.00 133.27 2gjx n LEU 319 Ca 0.33 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 2gjx n LEU 319 Cb 0.48 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 2gjx n LEU 319 CO 0.62 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 2gjx n GLY 320 N -0.98 2.89 1.72 -0.72 0.00 -1.25 -3.85 105.19 102.99 2gjx n GLY 320 Ca 0.00 -0.22 -0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.37 0.00 -0.02 0.00 -1.17 -3.68 105.19 99.95 2gjx n GLY 321 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2gjx n GLY 321 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2gjx n ASP 322 N -1.15 0.00 -4.62 1.61 5.75 -1.26 -4.21 116.55 112.68 2gjx n ASP 322 Ca -0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 54.79 54.35 2gjx n ASP 322 Cb 0.50 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.57 2gjx n ASP 322 CO 0.00 0.00 0.00 -1.83 -0.11 0.00 0.00 177.20 175.26 2gjx s GLU 323 N 2.91 3.70 -0.02 0.11 -1.05 -1.26 -4.78 118.70 118.31 2gjx s GLU 323 Ca 0.00 1.40 0.07 0.00 -0.15 0.00 0.00 54.97 56.29 2gjx s GLU 323 Cb 0.00 -4.03 -0.02 0.00 -0.44 0.00 0.00 34.13 29.64 2gjx s GLU 323 CO 0.00 -1.40 -0.23 0.08 0.95 0.00 0.00 175.26 174.65 2gjx s VAL 324 N 5.35 1.83 -0.07 1.83 1.01 -1.26 -4.53 120.40 124.56 2gjx s VAL 324 Ca 0.68 -0.99 0.05 0.00 0.00 0.00 0.00 61.98 61.71 2gjx s VAL 324 Cb -0.21 -1.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.64 2gjx s VAL 324 CO 0.29 0.51 -0.22 1.51 0.00 0.00 0.00 175.10 177.20 2gjx s ASP 325 N -0.55 3.31 -0.73 3.32 3.84 -1.26 -5.04 116.67 119.56 2gjx s ASP 325 Ca 0.09 -0.45 -0.01 0.00 -0.00 0.00 0.00 52.55 52.17 2gjx s ASP 325 Cb -0.09 -1.01 0.40 0.00 -1.38 0.00 0.00 42.92 40.84 2gjx s ASP 325 CO -0.01 0.24 1.97 0.49 -0.00 0.00 0.00 175.17 177.86 2gjx n PHE 326 N 3.01 3.11 -0.08 2.11 3.72 -1.26 -4.51 117.46 123.57 2gjx n PHE 326 Ca -0.18 -2.68 -0.13 0.00 -0.05 0.00 0.00 57.45 54.42 2gjx n PHE 326 Cb 0.52 -1.25 -0.09 0.00 -0.94 0.00 0.00 39.48 37.73 2gjx n PHE 326 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 2gjx h THR 327 N 1.56 0.93 0.00 4.37 2.02 -1.99 -2.75 112.91 117.06 2gjx h THR 327 Ca 0.57 -1.86 -0.00 0.00 0.77 0.00 0.00 66.41 65.88 2gjx h THR 327 Cb 0.47 1.92 -0.00 0.00 -1.74 0.00 0.00 68.15 68.80 2gjx h THR 327 CO 1.47 0.31 -0.02 0.00 0.37 0.00 0.00 175.52 177.66 2gjx h TRP 329 N 0.00 0.42 -0.28 0.00 4.06 -1.84 -3.01 115.95 115.30 2gjx h TRP 329 Ca -0.00 -0.28 -0.18 0.00 2.06 0.00 0.00 58.89 60.49 2gjx h TRP 329 Cb 0.13 -0.03 -0.00 0.00 -1.00 0.00 0.00 29.16 28.26 2gjx h TRP 329 CO 0.00 1.17 -0.55 -0.22 -3.56 0.00 0.00 178.44 175.28 2gjx h LYS 330 N 0.10 0.86 0.00 0.49 1.63 -0.77 -3.20 116.57 115.68 2gjx h LYS 330 Ca -0.09 -0.54 0.00 0.00 -0.85 0.00 0.00 60.65 59.16 2gjx h LYS 330 Cb 1.80 0.06 0.00 0.00 -0.60 0.00 0.00 32.23 33.49 2gjx h LYS 330 CO 0.18 1.18 0.00 0.66 -3.45 0.00 0.00 179.45 178.01 2gjx h SER 331 N 0.66 0.00 -3.57 4.20 4.64 -1.45 -3.44 113.55 114.59 2gjx h SER 331 Ca 0.01 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.72 2gjx h SER 331 Cb 1.15 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.13 2gjx h SER 331 CO 0.12 0.00 0.43 0.21 -0.87 0.00 0.00 176.83 176.73 2gjx s ASN 332 N -5.08 6.52 0.42 4.97 2.47 -1.14 -4.19 114.94 118.92 2gjx s ASN 332 Ca 0.09 0.23 0.21 0.00 0.42 0.00 0.00 52.86 53.81 2gjx s ASN 332 Cb 0.10 -2.41 0.89 0.00 -1.45 0.00 0.00 41.25 38.38 2gjx s ASN 332 CO 0.60 -0.85 1.83 -0.65 -3.72 0.00 0.00 177.10 174.32 2gjx h PRO 333 N 8.70 0.00 -0.29 0.43 0.11 -1.87 -1.62 132.00 137.46 2gjx h PRO 333 Ca -0.24 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.82 2gjx h PRO 333 Cb 1.09 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2gjx h PRO 333 CO 0.95 0.29 -0.02 1.49 -0.21 0.00 0.00 178.00 180.51 2gjx h GLU 334 N 0.00 0.45 0.13 1.05 4.22 -1.95 -1.10 114.58 117.37 2gjx h GLU 334 Ca -0.00 -0.09 -0.17 0.00 0.08 0.00 0.00 59.36 59.18 2gjx h GLU 334 Cb 0.72 -0.07 0.02 0.00 0.50 0.00 0.00 28.75 29.92 2gjx h GLU 334 CO 0.04 0.49 -0.72 0.82 -2.18 0.00 0.00 179.01 177.46 2gjx h ILE 335 N 0.43 1.54 -0.57 2.32 1.08 -1.77 -3.31 117.51 117.24 2gjx h ILE 335 Ca 0.09 -2.52 0.02 0.00 -0.39 0.00 0.00 64.86 62.07 2gjx h ILE 335 Cb 0.32 3.23 -0.03 0.00 -3.07 0.00 0.00 36.82 37.26 2gjx h ILE 335 CO 0.01 0.71 0.38 -0.61 -0.69 0.00 0.00 178.15 177.95 2gjx h GLN 336 N -0.44 0.69 0.00 2.37 4.15 -1.09 -0.51 115.11 120.28 2gjx h GLN 336 Ca -0.13 -0.04 -0.09 0.00 0.77 0.00 0.00 58.65 59.16 2gjx h GLN 336 Cb 1.57 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 29.09 2gjx h GLN 336 CO 0.13 0.45 -0.45 0.22 -1.93 0.00 0.00 178.83 177.26 2gjx h ASP 337 N 0.71 0.00 1.72 -0.69 3.58 -1.34 -2.38 116.42 118.02 2gjx h ASP 337 Ca 0.22 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.64 2gjx h ASP 337 Cb 0.02 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.07 2gjx h ASP 337 CO -0.06 0.45 -0.14 0.15 -2.88 0.00 0.00 179.24 176.76 2gjx h PHE 338 N 0.00 0.00 -0.17 0.28 3.57 -1.21 -3.16 116.94 116.26 2gjx h PHE 338 Ca -0.00 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.43 2gjx h PHE 338 Cb 0.83 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.56 2gjx h PHE 338 CO 0.00 0.14 -0.20 0.52 -2.23 0.00 0.00 178.31 176.55 2gjx h MET 339 N 0.00 0.29 0.00 1.11 2.86 -0.76 -2.53 114.93 115.90 2gjx h MET 339 Ca -0.00 -0.08 -0.08 0.00 -2.06 0.00 0.00 59.70 57.48 2gjx h MET 339 Cb 1.04 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.66 2gjx h MET 339 CO 0.02 0.48 -0.42 0.00 1.06 0.00 0.00 176.91 178.05 2gjx h ARG 340 N 0.27 0.00 0.57 1.72 3.08 -1.55 0.21 114.38 118.68 2gjx h ARG 340 Ca 0.05 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 2gjx h ARG 340 Cb 0.51 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.56 2gjx h ARG 340 CO 0.03 0.35 -0.27 0.87 -1.07 0.00 0.00 179.97 179.88 2gjx h LYS 341 N 0.00 -0.74 0.00 0.04 1.79 -1.46 -3.30 116.57 112.90 2gjx h LYS 341 Ca -0.01 0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.51 2gjx h LYS 341 Cb 1.28 0.17 0.00 0.00 -1.58 0.00 0.00 32.23 32.10 2gjx h LYS 341 CO 0.05 -0.45 -0.16 0.87 -1.08 0.00 0.00 179.45 178.68 2gjx h LYS 342 N -1.13 0.00 -1.14 3.15 1.79 -1.66 -3.48 116.57 114.10 2gjx h LYS 342 Ca -0.08 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.39 2gjx h LYS 342 Cb 0.63 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.28 2gjx h LYS 342 CO 0.13 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.91 2gjx n GLY 343 N 1.25 0.50 0.06 3.86 0.00 -0.89 -5.01 105.19 104.96 2gjx n GLY 343 Ca 0.04 -0.29 0.05 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.65 0.30 0.00 1.61 3.72 0.68 -5.03 117.46 118.10 2gjx n PHE 344 Ca 0.00 0.10 0.00 0.00 -0.05 0.00 0.00 57.45 57.50 2gjx n PHE 344 Cb 0.29 -0.77 0.00 0.00 -0.94 0.00 0.00 39.48 38.07 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 1.37 2.16 0.28 1.37 0.00 -1.13 -2.21 105.19 107.03 2gjx n GLY 345 Ca -0.10 -0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.00 2gjx n GLY 345 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2gjx n GLU 346 N 4.70 1.56 -3.39 1.61 0.00 -1.26 -4.75 120.64 119.10 2gjx n GLU 346 Ca 0.00 -2.72 -0.44 0.00 0.00 0.00 0.00 57.16 54.00 2gjx n GLU 346 Cb 0.00 -1.57 -0.07 0.00 0.00 0.00 0.00 31.44 29.80 2gjx n GLU 346 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 2gjx s ASP 347 N -2.78 6.11 0.00 -1.84 2.15 -0.94 -4.93 116.67 114.43 2gjx s ASP 347 Ca 0.34 -1.44 0.19 0.00 0.43 0.00 0.00 52.55 52.08 2gjx s ASP 347 Cb 0.30 -2.17 0.73 0.00 -0.30 0.00 0.00 42.92 41.48 2gjx s ASP 347 CO 0.03 -0.68 1.52 0.49 -0.17 0.00 0.00 175.17 176.36 2gjx n PHE 348 N 5.18 0.21 -0.01 -5.34 3.72 -1.26 -3.92 117.46 116.04 2gjx n PHE 348 Ca -0.12 -0.10 -0.13 0.00 -0.05 0.00 0.00 57.45 57.04 2gjx n PHE 348 Cb 0.43 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.83 2gjx n PHE 348 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 2gjx h LYS 349 N 1.86 0.10 0.00 -1.08 2.10 -1.97 -3.17 116.57 114.40 2gjx h LYS 349 Ca 0.00 -0.16 -0.02 0.00 -2.00 0.00 0.00 60.65 58.47 2gjx h LYS 349 Cb 0.41 0.06 -0.00 0.00 -0.90 0.00 0.00 32.23 31.80 2gjx h LYS 349 CO 0.00 0.75 -0.09 0.37 -2.00 0.00 0.00 179.45 178.48 2gjx h GLN 350 N 0.03 0.00 -0.21 0.07 4.15 -1.97 -2.52 115.11 114.66 2gjx h GLN 350 Ca -0.32 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.01 2gjx h GLN 350 Cb 2.02 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 29.70 2gjx h GLN 350 CO 0.09 0.09 -0.20 1.25 -1.93 0.00 0.00 178.83 178.13 2gjx h LEU 351 N 0.00 0.53 -0.34 -2.39 5.85 -1.69 -2.24 115.31 115.04 2gjx h LEU 351 Ca -0.00 -0.47 0.00 0.00 0.84 0.00 0.00 57.88 58.25 2gjx h LEU 351 Cb 0.99 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.87 2gjx h LEU 351 CO 0.01 0.90 0.00 -1.84 -0.34 0.00 0.00 178.44 177.17 2gjx n GLU 352 N -4.44 0.23 0.00 1.25 -0.00 -1.20 -2.60 120.64 113.88 2gjx n GLU 352 Ca -0.05 0.31 -0.18 0.00 -0.00 0.00 0.00 57.16 57.24 2gjx n GLU 352 Cb 0.40 -1.83 -0.10 0.00 -0.00 0.00 0.00 31.44 29.91 2gjx n GLU 352 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.13 177.90 2gjx h SER 353 N 0.00 0.74 -0.99 -1.84 0.02 -1.24 -3.03 113.55 107.21 2gjx h SER 353 Ca 0.00 -0.70 0.08 0.00 -0.84 0.00 0.00 61.79 60.33 2gjx h SER 353 Cb 0.56 -0.22 -0.07 0.00 0.14 0.00 0.00 62.40 62.80 2gjx h SER 353 CO 0.00 1.34 0.63 0.15 -1.14 0.00 0.00 176.83 177.81 2gjx h PHE 354 N 0.21 1.16 0.17 3.45 3.57 -1.15 0.12 116.94 124.47 2gjx h PHE 354 Ca -0.08 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.44 2gjx h PHE 354 Cb 1.41 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 39.77 2gjx h PHE 354 CO 0.12 0.56 -0.08 -0.92 -2.23 0.00 0.00 178.31 175.75 2gjx h TYR 355 N 1.10 -0.21 -0.44 0.41 3.20 -1.57 0.11 116.97 119.56 2gjx h TYR 355 Ca 0.44 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 62.22 2gjx h TYR 355 Cb 0.26 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 2gjx h TYR 355 CO -0.00 -0.01 -0.09 0.82 -1.64 0.00 0.00 178.16 177.23 2gjx h ILE 356 N -0.38 1.25 -0.47 1.81 2.04 -1.35 -0.37 117.51 120.04 2gjx h ILE 356 Ca -0.02 -1.14 -0.07 0.00 1.00 0.00 0.00 64.86 64.63 2gjx h ILE 356 Cb 0.30 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 2gjx h ILE 356 CO 0.04 0.39 0.04 1.56 0.00 0.00 0.00 178.15 180.18 2gjx h GLN 357 N 0.71 0.81 -0.16 2.37 4.20 -0.73 0.11 115.11 122.42 2gjx h GLN 357 Ca 0.12 -0.24 -0.11 0.00 0.06 0.00 0.00 58.65 58.48 2gjx h GLN 357 Cb 0.57 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 2gjx h GLN 357 CO 0.03 0.84 -0.38 1.15 -0.67 0.00 0.00 178.83 179.80 2gjx h THR 358 N 0.67 1.30 0.00 -0.54 2.02 -0.72 -2.71 112.91 112.92 2gjx h THR 358 Ca 0.14 -1.49 -0.10 0.00 0.77 0.00 0.00 66.41 65.72 2gjx h THR 358 Cb 0.45 1.60 -0.01 0.00 -1.74 0.00 0.00 68.15 68.45 2gjx h THR 358 CO 0.02 0.46 -0.50 0.25 0.37 0.00 0.00 175.52 176.12 2gjx h LEU 359 N 0.30 0.00 -0.02 2.58 6.46 -0.91 -3.32 115.31 120.40 2gjx h LEU 359 Ca 0.03 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.78 2gjx h LEU 359 Cb 0.81 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.74 2gjx h LEU 359 CO 0.07 0.50 -0.02 0.25 -0.62 0.00 0.00 178.44 178.61 2gjx h LEU 360 N 0.00 0.06 -0.80 2.25 7.12 -0.66 -3.14 115.31 120.14 2gjx h LEU 360 Ca -0.00 -0.48 0.04 0.00 0.13 0.00 0.00 57.88 57.56 2gjx h LEU 360 Cb 1.29 -0.02 -0.05 0.00 -0.53 0.00 0.00 40.66 41.36 2gjx h LEU 360 CO 0.06 0.53 0.50 0.44 -0.13 0.00 0.00 178.44 179.84 2gjx h ASP 361 N -0.41 0.82 0.15 1.25 3.32 -1.62 -1.49 116.42 118.43 2gjx h ASP 361 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2gjx h ASP 361 Cb 0.51 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 2gjx h ASP 361 CO 0.01 0.56 -0.14 0.40 -1.72 0.00 0.00 179.24 178.35 2gjx h ILE 362 N 0.97 0.70 -0.77 0.35 2.04 -1.65 -0.02 117.51 119.13 2gjx h ILE 362 Ca 0.33 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.18 2gjx h ILE 362 Cb 0.05 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 36.79 2gjx h ILE 362 CO -0.13 0.00 0.45 0.58 0.00 0.00 0.00 178.15 179.05 2gjx h VAL 363 N -0.31 1.22 -1.00 1.67 2.07 -1.47 -1.44 116.25 116.99 2gjx h VAL 363 Ca 0.00 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.03 2gjx h VAL 363 Cb 0.29 0.15 -0.05 0.00 -1.52 0.00 0.00 31.29 30.16 2gjx h VAL 363 CO -0.03 0.24 0.66 0.28 0.02 0.00 0.00 177.57 178.74 2gjx h SER 364 N 1.07 1.14 0.85 0.57 0.02 -0.81 -1.89 113.55 114.49 2gjx h SER 364 Ca 0.28 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 2gjx h SER 364 Cb -0.02 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.24 2gjx h SER 364 CO -0.05 0.82 0.00 0.77 -1.14 0.00 0.00 176.83 177.23 2gjx h SER 365 N 1.34 0.00 -0.02 3.07 4.64 0.08 -1.96 113.55 120.70 2gjx h SER 365 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 2gjx h SER 365 Cb -0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.96 2gjx h SER 365 CO -0.09 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 174.65 2gjx n TYR 366 N -2.52 0.01 -2.57 4.77 0.53 -0.72 -4.94 117.16 111.73 2gjx n TYR 366 Ca 0.02 -0.01 -0.03 0.00 -1.02 0.00 0.00 57.90 56.86 2gjx n TYR 366 Cb 0.26 0.00 0.01 0.00 -1.03 0.00 0.00 39.34 38.58 2gjx n TYR 366 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2gjx n GLY 367 N 1.16 0.65 3.18 2.72 0.00 -0.74 -5.07 105.19 107.10 2gjx n GLY 367 Ca 0.19 -0.51 -0.24 0.00 0.00 0.00 0.00 46.02 45.46 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 -4.99 1.36 0.85 1.61 -0.14 -1.17 -4.98 119.74 112.28 2gjx s LYS 368 Ca 0.07 -0.72 -0.13 0.00 -1.36 0.00 0.00 55.97 53.83 2gjx s LYS 368 Cb -0.03 -1.36 0.12 0.00 -1.68 0.00 0.00 37.83 34.88 2gjx s LYS 368 CO 0.11 0.36 1.21 0.20 -0.76 0.00 0.00 175.35 176.48 2gjx s GLY 369 N -0.68 1.66 -0.10 -3.33 0.00 0.27 -4.32 107.32 100.82 2gjx s GLY 369 Ca 0.06 -0.87 -0.07 0.00 0.00 0.00 0.00 44.72 43.85 2gjx s GLY 369 CO 0.00 -0.29 0.25 -2.52 0.00 0.00 0.00 173.10 170.54 2gjx s TYR 370 N -3.65 -0.31 -0.12 1.90 1.13 -1.26 -1.86 117.35 113.18 2gjx s TYR 370 Ca 0.66 0.74 0.00 0.00 -1.41 0.00 0.00 57.07 57.06 2gjx s TYR 370 Cb -0.08 0.07 -0.02 0.00 -1.10 0.00 0.00 41.96 40.83 2gjx s TYR 370 CO 0.50 -0.19 -0.13 0.08 -2.51 0.00 0.00 175.55 173.30 2gjx s VAL 371 N 0.83 3.12 0.12 -3.49 1.01 -0.64 -2.31 120.40 119.04 2gjx s VAL 371 Ca -0.06 -0.65 0.07 0.00 0.00 0.00 0.00 61.98 61.34 2gjx s VAL 371 Cb -0.07 -2.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 2gjx s VAL 371 CO -0.05 0.53 -0.16 -0.69 0.00 0.00 0.00 175.10 174.73 2gjx s VAL 372 N 0.15 1.49 0.00 2.92 1.01 -0.07 -2.99 120.40 122.90 2gjx s VAL 372 Ca -0.07 -1.66 0.00 0.00 0.00 0.00 0.00 61.98 60.25 2gjx s VAL 372 Cb -0.15 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.70 2gjx s VAL 372 CO 0.05 -0.29 0.00 0.79 0.00 0.00 0.00 175.10 175.65 2gjx n TRP 373 N 0.71 -0.87 0.09 5.22 7.02 -1.24 0.75 117.44 129.11 2gjx n TRP 373 Ca -0.17 0.00 -0.04 0.00 -1.02 0.00 0.00 57.50 56.27 2gjx n TRP 373 Cb 0.56 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.43 2gjx n TRP 373 CO 0.00 0.00 0.00 1.96 -2.02 0.00 0.00 177.69 177.63 2gjx h GLN 374 N 0.00 -0.25 -0.15 -0.99 4.20 -1.81 -3.34 115.11 112.77 2gjx h GLN 374 Ca 0.00 0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.74 2gjx h GLN 374 Cb 0.00 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 2gjx h GLN 374 CO 0.00 -0.17 -0.08 0.39 -0.67 0.00 0.00 178.83 178.31 2gjx n GLU 375 N -3.61 -0.05 -0.24 1.46 4.71 -1.26 0.01 120.64 121.65 2gjx n GLU 375 Ca -0.03 0.22 0.05 0.00 -0.01 0.00 0.00 57.16 57.39 2gjx n GLU 375 Cb 0.10 -0.33 0.16 0.00 -1.01 0.00 0.00 31.44 30.36 2gjx n GLU 375 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2gjx h VAL 376 N 0.00 0.46 -0.04 2.62 2.07 -1.76 -0.92 116.25 118.68 2gjx h VAL 376 Ca 0.03 -0.07 -0.25 0.00 0.82 0.00 0.00 66.70 67.24 2gjx h VAL 376 Cb 0.07 0.25 0.02 0.00 -1.52 0.00 0.00 31.29 30.11 2gjx h VAL 376 CO -0.14 0.03 -0.93 0.15 0.02 0.00 0.00 177.57 176.70 2gjx h PHE 377 N 0.19 1.02 -0.58 1.57 3.04 -0.64 -2.23 116.94 119.32 2gjx h PHE 377 Ca 0.40 -0.53 0.03 0.00 3.98 0.00 0.00 57.97 61.86 2gjx h PHE 377 Cb 0.69 -0.13 -0.04 0.00 2.56 0.00 0.00 35.95 39.03 2gjx h PHE 377 CO -0.32 1.36 0.34 -0.44 -2.02 0.00 0.00 178.31 177.23 2gjx h ASP 378 N 0.40 0.54 -2.29 0.41 3.45 -0.81 -1.41 116.42 116.71 2gjx h ASP 378 Ca -0.10 0.01 -0.81 0.00 0.43 0.00 0.00 57.03 56.56 2gjx h ASP 378 Cb 1.58 -0.10 -0.27 0.00 -0.56 0.00 0.00 39.33 39.98 2gjx h ASP 378 CO 0.19 0.37 1.04 -0.46 -1.57 0.00 0.00 179.24 178.81 2gjx n ASN 379 N -4.78 7.30 0.00 6.45 2.04 -0.46 -5.00 115.26 120.81 2gjx n ASN 379 Ca 0.05 -3.66 0.00 0.00 -0.44 0.00 0.00 54.58 50.54 2gjx n ASN 379 Cb 0.10 -1.18 0.00 0.00 -2.53 0.00 0.00 39.78 36.16 2gjx n ASN 379 CO 0.00 0.00 0.00 1.17 -0.44 0.00 0.00 177.26 177.99 2gjx n LYS 380 N 0.10 0.00 -3.84 -3.83 4.81 -0.53 -4.91 118.16 109.96 2gjx n LYS 380 Ca 0.45 0.00 -0.34 0.00 -0.87 0.00 0.00 58.31 57.56 2gjx n LYS 380 Cb 0.27 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.27 2gjx n LYS 380 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2gjx s VAL 381 N 0.00 5.37 -0.75 3.15 1.01 -0.84 -4.95 120.40 123.39 2gjx s VAL 381 Ca 0.00 -0.02 -0.15 0.00 0.00 0.00 0.00 61.98 61.81 2gjx s VAL 381 Cb 0.00 -3.55 -0.20 0.00 0.00 0.00 0.00 36.38 32.63 2gjx s VAL 381 CO 0.00 0.33 1.98 0.29 0.00 0.00 0.00 175.10 177.70 2gjx n LYS 382 N 0.97 0.17 -3.57 2.72 4.01 -1.26 -4.84 118.16 116.36 2gjx n LYS 382 Ca -0.11 -0.51 -0.36 0.00 -0.51 0.00 0.00 58.31 56.82 2gjx n LYS 382 Cb 0.53 -2.22 -0.08 0.00 -0.51 0.00 0.00 35.03 32.75 2gjx n LYS 382 CO 0.00 0.00 0.00 -1.50 -1.11 0.00 0.00 177.40 174.79 2gjx s ILE 383 N 6.91 5.32 0.29 -0.18 -1.16 -1.26 -4.96 121.20 126.16 2gjx s ILE 383 Ca 0.86 0.46 -0.28 0.00 -0.51 0.00 0.00 60.65 61.18 2gjx s ILE 383 Cb -0.35 -3.60 -0.09 0.00 0.61 0.00 0.00 42.46 39.03 2gjx s ILE 383 CO 0.26 0.38 0.98 -1.10 -2.81 0.00 0.00 174.94 172.65 2gjx s GLN 384 N 0.60 4.67 0.00 3.50 1.11 -1.26 -4.88 119.66 123.39 2gjx s GLN 384 Ca 0.14 1.51 0.00 0.00 0.01 0.00 0.00 55.36 57.02 2gjx s GLN 384 Cb -0.13 -3.06 0.00 0.00 -1.01 0.00 0.00 33.01 28.82 2gjx s GLN 384 CO 0.03 0.32 0.00 -2.30 0.01 0.00 0.00 175.29 173.36 2gjx n PRO 385 N 1.02 0.00 0.00 2.91 -0.02 -1.26 -1.22 135.00 136.42 2gjx n PRO 385 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2gjx n PRO 385 Cb 0.48 -1.36 0.00 0.00 -0.02 0.00 0.00 33.50 32.59 2gjx n PRO 385 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2gjx n ASP 386 N 1.56 0.00 -4.74 2.55 8.00 -1.26 -5.04 116.55 117.62 2gjx n ASP 386 Ca 0.00 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.16 2gjx n ASP 386 Cb 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.16 2gjx n ASP 386 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2gjx s THR 387 N 0.00 2.68 -0.22 -3.53 2.01 -0.36 -4.83 115.64 111.39 2gjx s THR 387 Ca 0.00 0.35 -0.00 0.00 0.31 0.00 0.00 61.69 62.35 2gjx s THR 387 Cb 0.00 -2.94 0.03 0.00 0.01 0.00 0.00 72.50 69.59 2gjx s THR 387 CO 0.00 -0.16 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.02 2gjx s ILE 388 N -2.00 2.57 0.05 1.82 1.01 -0.98 -3.72 121.20 119.96 2gjx s ILE 388 Ca 0.73 -1.02 -0.21 0.00 0.00 0.00 0.00 60.65 60.14 2gjx s ILE 388 Cb -0.27 -2.25 -0.06 0.00 0.01 0.00 0.00 42.46 39.89 2gjx s ILE 388 CO 0.41 0.30 0.63 -0.63 0.00 0.00 0.00 174.94 175.66 2gjx s ILE 389 N 1.30 4.75 -0.32 2.92 -1.09 -0.73 -0.89 121.20 127.13 2gjx s ILE 389 Ca 0.01 1.35 -0.02 0.00 -2.23 0.00 0.00 60.65 59.76 2gjx s ILE 389 Cb -0.16 -3.97 0.06 0.00 -1.58 0.00 0.00 42.46 36.81 2gjx s ILE 389 CO -0.07 0.47 0.05 -1.58 -1.23 0.00 0.00 174.94 172.58 2gjx s GLN 390 N -0.63 2.32 -0.15 2.79 0.74 0.23 -0.48 119.66 124.48 2gjx s GLN 390 Ca 0.32 -1.39 -0.29 0.00 0.05 0.00 0.00 55.36 54.04 2gjx s GLN 390 Cb -0.20 -3.27 -0.01 0.00 1.10 0.00 0.00 33.01 30.63 2gjx s GLN 390 CO 0.20 -0.72 1.16 0.08 -0.55 0.00 0.00 175.29 175.46 2gjx s VAL 391 N 1.22 4.43 0.00 1.34 1.01 0.88 -2.78 120.40 126.50 2gjx s VAL 391 Ca -0.02 1.73 0.00 0.00 0.00 0.00 0.00 61.98 63.70 2gjx s VAL 391 Cb -0.20 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.06 2gjx s VAL 391 CO -0.02 -0.10 0.00 -2.67 0.00 0.00 0.00 175.10 172.32 2gjx n TRP 392 N 5.99 0.00 -2.95 5.22 4.27 -1.26 -1.78 117.44 126.93 2gjx n TRP 392 Ca 0.12 0.00 -0.40 0.00 -3.89 0.00 0.00 57.50 53.33 2gjx n TRP 392 Cb 0.46 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.37 2gjx n TRP 392 CO 0.00 0.00 0.00 0.50 -2.29 0.00 0.00 177.69 175.90 2gjx s ARG 393 N -1.62 4.45 0.01 -2.67 3.52 -1.26 -4.20 118.95 117.18 2gjx s ARG 393 Ca 0.00 1.02 -0.24 0.00 -0.13 0.00 0.00 55.73 56.37 2gjx s ARG 393 Cb 0.00 -3.46 -0.14 0.00 -1.56 0.00 0.00 34.95 29.79 2gjx s ARG 393 CO 0.00 0.00 1.06 1.05 -0.81 0.00 0.00 175.30 176.60 2gjx h GLU 394 N 6.82 -0.85 0.00 5.12 4.11 -1.86 -3.38 114.58 124.55 2gjx h GLU 394 Ca -0.40 0.06 -0.14 0.00 0.07 0.00 0.00 59.36 58.95 2gjx h GLU 394 Cb 1.20 0.19 -0.21 0.00 0.50 0.00 0.00 28.75 30.43 2gjx h GLU 394 CO 0.76 -0.57 -0.52 -0.40 0.07 0.00 0.00 179.01 178.35 2gjx n ASP 395 N -5.17 -0.32 -0.00 3.06 3.85 -1.25 0.93 116.55 117.65 2gjx n ASP 395 Ca -0.11 -1.97 -0.17 0.00 -0.71 0.00 0.00 54.79 51.83 2gjx n ASP 395 Cb 0.35 0.09 -0.12 0.00 -1.35 0.00 0.00 41.12 40.09 2gjx n ASP 395 CO 0.00 0.00 0.00 0.40 -1.01 0.00 0.00 177.20 176.59 2gjx h ILE 396 N 5.66 1.52 0.11 2.12 5.03 -1.99 -3.35 117.51 126.62 2gjx h ILE 396 Ca -0.44 -2.14 -0.34 0.00 -0.12 0.00 0.00 64.86 61.83 2gjx h ILE 396 Cb 1.55 2.84 -0.02 0.00 -3.03 0.00 0.00 36.82 38.17 2gjx h ILE 396 CO -0.15 0.60 -1.81 1.55 -0.68 0.00 0.00 178.15 177.66 2gjx h PRO 397 N -0.38 0.24 0.00 2.37 0.13 -1.92 -3.49 132.00 128.95 2gjx h PRO 397 Ca -0.07 -0.42 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2gjx h PRO 397 Cb 1.24 0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.52 2gjx h PRO 397 CO 0.09 1.09 0.00 1.55 -0.23 0.00 0.00 178.00 180.50 2gjx n VAL 398 N -3.42 0.00 -1.57 1.56 3.14 -1.26 -5.15 118.33 111.63 2gjx n VAL 398 Ca -0.25 0.00 -0.48 0.00 -2.96 0.00 0.00 64.34 60.65 2gjx n VAL 398 Cb 1.05 0.00 -0.04 0.00 -1.06 0.00 0.00 33.84 33.80 2gjx n VAL 398 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 2gjx n ASN 399 N 0.00 1.21 0.24 6.55 2.85 -1.23 -3.88 115.26 121.00 2gjx n ASN 399 Ca 0.00 1.15 0.17 0.00 -0.11 0.00 0.00 54.58 55.79 2gjx n ASN 399 Cb 0.00 -1.21 0.86 0.00 1.24 0.00 0.00 39.78 40.67 2gjx n ASN 399 CO 0.00 0.00 0.00 0.10 -2.11 0.00 0.00 177.26 175.25 2gjx h TYR 400 N 3.04 0.00 -0.01 1.20 -0.00 0.38 0.19 116.97 121.76 2gjx h TYR 400 Ca -0.42 0.00 -0.17 0.00 -0.00 0.00 0.00 58.73 58.14 2gjx h TYR 400 Cb 1.35 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 38.06 2gjx h TYR 400 CO 0.52 0.00 -0.77 0.52 -0.00 0.00 0.00 178.16 178.44 2gjx h MET 401 N 0.00 0.14 0.01 0.10 2.86 -1.89 -2.02 114.93 114.13 2gjx h MET 401 Ca 0.06 -0.13 -0.20 0.00 -2.06 0.00 0.00 59.70 57.37 2gjx h MET 401 Cb 0.36 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 2gjx h MET 401 CO -0.00 0.84 -0.91 -0.22 1.06 0.00 0.00 176.91 177.68 2gjx h LYS 402 N 0.09 0.17 -0.27 1.72 3.11 -1.05 -3.13 116.57 117.21 2gjx h LYS 402 Ca -0.02 -0.20 -0.00 0.00 -2.81 0.00 0.00 60.65 57.61 2gjx h LYS 402 Cb 1.35 0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 32.63 2gjx h LYS 402 CO 0.11 0.97 0.16 0.93 -2.81 0.00 0.00 179.45 178.81 2gjx h GLU 403 N 0.09 0.37 -0.70 1.90 4.39 -0.95 -2.79 114.58 116.90 2gjx h GLU 403 Ca -0.05 -0.04 0.07 0.00 0.34 0.00 0.00 59.36 59.68 2gjx h GLU 403 Cb 1.56 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 30.09 2gjx h GLU 403 CO 0.14 0.31 0.46 -0.07 -1.16 0.00 0.00 179.01 178.68 2gjx h LEU 404 N 0.34 0.62 0.37 1.33 3.38 -1.36 -2.24 115.31 117.75 2gjx h LEU 404 Ca 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 2gjx h LEU 404 Cb 0.04 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2gjx h LEU 404 CO -0.02 0.40 -0.18 -0.08 0.09 0.00 0.00 178.44 178.66 2gjx h GLU 405 N 0.71 -0.48 -0.67 1.13 4.81 -1.45 -2.18 114.58 116.45 2gjx h GLU 405 Ca 0.30 0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.65 2gjx h GLU 405 Cb 0.28 0.11 -0.07 0.00 0.63 0.00 0.00 28.75 29.70 2gjx h GLU 405 CO -0.10 -0.19 0.33 -0.07 -0.73 0.00 0.00 179.01 178.25 2gjx h LEU 406 N -0.74 0.44 -0.39 1.64 -0.00 -1.26 0.71 115.31 115.71 2gjx h LEU 406 Ca -0.05 0.05 -0.01 0.00 -0.00 0.00 0.00 57.88 57.87 2gjx h LEU 406 Cb 0.51 -0.02 -0.02 0.00 -0.00 0.00 0.00 40.66 41.13 2gjx h LEU 406 CO 0.08 0.27 0.20 0.58 -0.00 0.00 0.00 178.44 179.57 2gjx h VAL 407 N 0.59 1.16 -0.04 1.22 2.07 -1.42 0.78 116.25 120.60 2gjx h VAL 407 Ca 0.32 -0.42 -0.17 0.00 0.82 0.00 0.00 66.70 67.26 2gjx h VAL 407 Cb 0.31 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 2gjx h VAL 407 CO -0.25 0.16 -0.71 0.71 0.02 0.00 0.00 177.57 177.51 2gjx h THR 408 N 0.50 1.43 -0.38 2.57 1.35 -0.87 -1.98 112.91 115.53 2gjx h THR 408 Ca 0.14 -2.22 -0.10 0.00 -0.55 0.00 0.00 66.41 63.67 2gjx h THR 408 Cb 0.08 2.17 -0.02 0.00 -1.73 0.00 0.00 68.15 68.66 2gjx h THR 408 CO -0.02 0.65 -0.19 0.50 -0.25 0.00 0.00 175.52 176.21 2gjx h LYS 409 N 0.15 0.71 0.00 4.72 3.64 0.66 -1.85 116.57 124.61 2gjx h LYS 409 Ca -0.02 -0.27 -0.00 0.00 -1.27 0.00 0.00 60.65 59.09 2gjx h LYS 409 Cb 1.26 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 33.03 2gjx h LYS 409 CO 0.11 0.86 -0.02 0.00 -2.27 0.00 0.00 179.45 178.13 2gjx h ALA 410 N 1.15 1.01 0.00 5.00 0.00 -0.74 -3.47 119.26 122.22 2gjx h ALA 410 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2gjx h ALA 410 Cb 0.67 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2gjx h ALA 410 CO 0.05 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.73 2gjx n GLY 411 N -0.18 1.57 3.43 0.00 0.00 -0.69 -5.09 105.19 104.23 2gjx n GLY 411 Ca -0.00 -0.10 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 2gjx n GLY 411 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gjx s PHE 412 N -2.00 2.56 0.16 1.61 0.08 -0.77 -4.93 117.98 114.70 2gjx s PHE 412 Ca 0.00 -0.26 -0.33 0.00 0.12 0.00 0.00 56.93 56.46 2gjx s PHE 412 Cb 0.00 -1.53 -0.12 0.00 -0.57 0.00 0.00 43.02 40.79 2gjx s PHE 412 CO 0.00 0.17 1.70 0.54 -0.10 0.00 0.00 175.22 177.53 2gjx n ARG 413 N 2.01 2.52 -3.95 0.44 1.74 -1.24 -4.07 116.66 114.10 2gjx n ARG 413 Ca -0.16 0.91 -0.28 0.00 -0.77 0.00 0.00 57.85 57.54 2gjx n ARG 413 Cb 0.52 -2.74 -0.04 0.00 -1.02 0.00 0.00 32.46 29.19 2gjx n ARG 413 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2gjx s ALA 414 N 1.49 3.94 -0.16 7.54 0.00 -0.06 -1.77 121.76 132.75 2gjx s ALA 414 Ca 0.79 -0.97 -0.04 0.00 0.00 0.00 0.00 51.96 51.73 2gjx s ALA 414 Cb -0.58 -1.75 0.05 0.00 0.00 0.00 0.00 23.12 20.84 2gjx s ALA 414 CO 0.36 0.65 0.07 -1.17 0.00 0.00 0.00 175.76 175.67 2gjx s LEU 415 N -2.92 0.55 0.10 0.00 2.96 0.37 -2.14 118.68 117.60 2gjx s LEU 415 Ca 0.34 -0.55 -0.16 0.00 -0.22 0.00 0.00 54.13 53.54 2gjx s LEU 415 Cb -0.12 -0.33 -0.07 0.00 0.50 0.00 0.00 46.19 46.17 2gjx s LEU 415 CO 0.28 -0.32 0.54 -0.22 -1.32 0.00 0.00 176.35 175.31 2gjx s LEU 416 N 2.06 4.43 0.00 -0.68 2.96 -0.34 -0.09 118.68 127.02 2gjx s LEU 416 Ca 0.02 1.13 0.00 0.00 -0.22 0.00 0.00 54.13 55.06 2gjx s LEU 416 Cb -0.16 -3.03 0.00 0.00 0.50 0.00 0.00 46.19 43.50 2gjx s LEU 416 CO -0.08 0.20 0.01 -0.24 -1.32 0.00 0.00 176.35 174.93 2gjx n SER 417 N 1.30 0.00 0.11 3.68 2.88 -0.73 -2.09 113.62 118.77 2gjx n SER 417 Ca -0.08 -0.54 -0.13 0.00 -1.33 0.00 0.00 58.87 56.78 2gjx n SER 417 Cb 0.51 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.89 2gjx n SER 417 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2gjx h ALA 418 N 0.00 -0.28 0.00 -1.46 0.00 -1.60 -3.22 119.26 112.69 2gjx h ALA 418 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2gjx h ALA 418 Cb 0.54 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2gjx h ALA 418 CO 0.00 -0.52 0.00 -1.00 0.00 0.00 0.00 179.25 177.73 2gjx h PRO 419 N -0.57 0.00 -2.31 0.00 0.13 -1.91 -3.37 132.00 123.98 2gjx h PRO 419 Ca -0.03 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.42 2gjx h PRO 419 Cb 0.42 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 31.37 2gjx h PRO 419 CO 0.05 0.00 1.44 0.91 -0.23 0.00 0.00 178.00 180.16 2gjx n TRP 420 N -2.62 2.37 -3.15 1.56 8.01 -1.22 -4.85 117.44 117.54 2gjx n TRP 420 Ca 0.04 -2.46 -0.45 0.00 -1.31 0.00 0.00 57.50 53.32 2gjx n TRP 420 Cb 0.44 -1.52 -0.01 0.00 -2.01 0.00 0.00 31.31 28.21 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 -2.19 3.64 0.36 -5.99 1.51 -1.26 -1.57 117.35 111.85 2gjx s TYR 421 Ca 0.53 -1.98 0.31 0.00 -1.01 0.00 0.00 57.07 54.92 2gjx s TYR 421 Cb 0.27 -4.04 1.68 0.00 -0.11 0.00 0.00 41.96 39.76 2gjx s TYR 421 CO -0.17 -1.19 1.93 -0.07 -1.11 0.00 0.00 175.55 174.94 2gjx h LEU 422 N 8.64 0.00 -0.46 -1.29 -0.00 -1.16 0.68 115.31 121.71 2gjx h LEU 422 Ca 0.17 0.00 -0.17 0.00 -0.00 0.00 0.00 57.88 57.88 2gjx h LEU 422 Cb 0.98 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.63 2gjx h LEU 422 CO 0.99 0.00 -0.74 -0.55 -0.00 0.00 0.00 178.44 178.14 2gjx h ASN 423 N 0.00 0.28 -0.78 -0.43 -1.07 -1.83 -3.40 115.58 108.35 2gjx h ASN 423 Ca 0.00 -0.19 -0.30 0.00 0.07 0.00 0.00 56.30 55.88 2gjx h ASN 423 Cb 0.25 -0.08 -0.05 0.00 -2.07 0.00 0.00 38.32 36.37 2gjx h ASN 423 CO 0.00 0.92 0.75 -0.13 0.07 0.00 0.00 177.43 179.04 2gjx s ARG 424 N -3.50 2.54 0.43 4.14 3.00 0.23 -4.95 118.95 120.84 2gjx s ARG 424 Ca -0.04 -0.22 -0.05 0.00 0.00 0.00 0.00 55.73 55.42 2gjx s ARG 424 Cb 0.11 -5.02 -0.04 0.00 0.00 0.00 0.00 34.95 30.00 2gjx s ARG 424 CO 0.81 -3.36 0.73 0.96 0.00 0.00 0.00 175.30 174.44 2gjx s ILE 425 N 10.13 4.92 0.06 1.52 -4.36 -1.26 -4.97 121.20 127.23 2gjx s ILE 425 Ca 0.70 0.19 -0.26 0.00 -0.26 0.00 0.00 60.65 61.02 2gjx s ILE 425 Cb -0.07 -3.83 0.08 0.00 1.25 0.00 0.00 42.46 39.90 2gjx s ILE 425 CO 0.01 -0.70 0.73 -0.94 0.24 0.00 0.00 174.94 174.27 2gjx s SER 426 N -3.83 -0.50 0.66 4.36 1.04 -1.26 -5.16 113.70 109.01 2gjx s SER 426 Ca 0.47 0.11 -0.17 0.00 0.48 0.00 0.00 55.95 56.85 2gjx s SER 426 Cb -0.10 0.50 -0.00 0.00 0.10 0.00 0.00 66.02 66.52 2gjx s SER 426 CO 0.40 -0.77 1.18 -0.47 0.98 0.00 0.00 173.24 174.56 2gjx s TYR 427 N -3.05 2.32 0.00 5.02 5.04 -1.26 -4.73 117.35 120.69 2gjx s TYR 427 Ca 0.01 1.56 0.00 0.00 -2.44 0.00 0.00 57.07 56.19 2gjx s TYR 427 Cb -0.01 -3.41 0.00 0.00 0.35 0.00 0.00 41.96 38.90 2gjx s TYR 427 CO -0.08 -2.23 0.00 0.41 -1.34 0.00 0.00 175.55 172.31 2gjx n GLY 428 N 0.23 -1.34 3.23 8.97 0.00 -1.26 -4.55 105.19 110.48 2gjx n GLY 428 Ca 0.13 -1.53 -0.39 0.00 0.00 0.00 0.00 46.02 44.22 2gjx n GLY 428 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2gjx n PRO 429 N -1.17 2.23 0.00 1.61 -0.02 -1.26 -4.71 135.00 131.68 2gjx n PRO 429 Ca 0.00 -2.50 0.10 0.00 -2.02 0.00 0.00 63.50 59.08 2gjx n PRO 429 Cb 0.01 -3.33 0.55 0.00 -0.02 0.00 0.00 33.50 30.70 2gjx n PRO 429 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2gjx n ASP 430 N 9.01 0.00 0.25 2.55 5.68 -1.26 -2.78 116.55 130.00 2gjx n ASP 430 Ca 0.49 -0.35 0.12 0.00 -0.50 0.00 0.00 54.79 54.55 2gjx n ASP 430 Cb 0.43 -0.12 0.67 0.00 -1.14 0.00 0.00 41.12 40.95 2gjx n ASP 430 CO 0.00 0.00 0.00 4.11 -1.33 0.00 0.00 177.20 179.98 2gjx h TRP 431 N 0.00 0.00 -0.24 2.11 5.08 -1.92 -2.29 115.95 118.70 2gjx h TRP 431 Ca 0.00 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 59.89 2gjx h TRP 431 Cb 0.08 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.23 2gjx h TRP 431 CO 0.00 0.14 -0.21 0.87 -1.28 0.00 0.00 178.44 177.96 2gjx h LYS 432 N 0.00 0.43 -0.50 0.12 1.57 -1.93 -1.96 116.57 114.30 2gjx h LYS 432 Ca -0.00 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 2gjx h LYS 432 Cb 0.42 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 2gjx h LYS 432 CO 0.02 0.63 0.12 -0.44 -0.57 0.00 0.00 179.45 179.21 2gjx h ASP 433 N 0.39 0.77 0.41 0.86 3.45 -1.64 -1.92 116.42 118.74 2gjx h ASP 433 Ca 0.06 -0.23 -0.06 0.00 0.43 0.00 0.00 57.03 57.23 2gjx h ASP 433 Cb 0.59 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 39.15 2gjx h ASP 433 CO 0.04 0.80 -0.27 -0.26 -1.57 0.00 0.00 179.24 177.99 2gjx h PHE 434 N 0.70 0.00 0.17 4.55 0.04 -1.48 -3.19 116.94 117.73 2gjx h PHE 434 Ca 0.16 0.00 -0.26 0.00 2.80 0.00 0.00 57.97 60.66 2gjx h PHE 434 Cb 0.34 0.00 0.03 0.00 2.20 0.00 0.00 35.95 38.52 2gjx h PHE 434 CO 0.02 0.27 -1.13 -0.92 -0.60 0.00 0.00 178.31 175.95 2gjx h TYR 435 N 0.00 0.82 0.00 -0.55 3.20 -1.04 -3.34 116.97 116.06 2gjx h TYR 435 Ca -0.00 -0.56 -0.04 0.00 3.14 0.00 0.00 58.73 61.26 2gjx h TYR 435 Cb 0.55 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 2gjx h TYR 435 CO 0.00 1.43 -0.20 0.28 -1.64 0.00 0.00 178.16 178.03 2gjx h VAL 436 N -0.02 0.60 -1.79 1.81 2.07 -1.35 -3.45 116.25 114.11 2gjx h VAL 436 Ca -0.19 -0.91 -0.67 0.00 0.82 0.00 0.00 66.70 65.74 2gjx h VAL 436 Cb 1.87 1.60 0.03 0.00 -1.52 0.00 0.00 31.29 33.27 2gjx h VAL 436 CO 0.21 0.19 0.83 0.52 0.02 0.00 0.00 177.57 179.35 2gjx n VAL 437 N -3.52 0.26 -3.82 2.57 0.31 -1.21 -4.95 118.33 107.97 2gjx n VAL 437 Ca -0.01 -0.05 -0.36 0.00 -0.01 0.00 0.00 64.34 63.91 2gjx n VAL 437 Cb 0.35 -1.32 -0.13 0.00 -0.91 0.00 0.00 33.84 31.83 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 2.59 2.67 0.15 5.55 2.56 -1.26 -5.02 118.70 125.94 2gjx s GLU 438 Ca 0.91 -1.13 -0.24 0.00 0.00 0.00 0.00 54.97 54.51 2gjx s GLU 438 Cb -0.90 -3.31 0.01 0.00 2.00 0.00 0.00 34.13 31.93 2gjx s GLU 438 CO 0.54 -0.58 1.61 -1.35 -0.56 0.00 0.00 175.26 174.91 2gjx h PRO 439 N 8.14 -0.31 -0.93 4.30 0.11 -1.95 -2.49 132.00 138.86 2gjx h PRO 439 Ca -0.25 0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.86 2gjx h PRO 439 Cb 1.09 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2gjx h PRO 439 CO 0.58 -0.21 0.03 1.28 -0.21 0.00 0.00 178.00 179.47 2gjx n LEU 440 N -5.41 2.35 -3.27 2.35 4.77 -1.26 -4.61 117.00 111.92 2gjx n LEU 440 Ca -0.01 -1.19 -0.38 0.00 -0.03 0.00 0.00 56.01 54.39 2gjx n LEU 440 Cb 0.32 -0.54 -0.03 0.00 -2.33 0.00 0.00 43.42 40.84 2gjx n LEU 440 CO 0.12 0.39 3.36 0.00 -1.33 0.00 0.00 177.39 179.93 2gjx n ALA 441 N 0.14 7.52 -2.90 -1.18 0.00 -0.94 -4.82 120.51 118.32 2gjx n ALA 441 Ca 0.07 -3.46 -0.10 0.00 0.00 0.00 0.00 53.44 49.95 2gjx n ALA 441 Cb 0.51 -3.35 -0.06 0.00 0.00 0.00 0.00 19.45 16.55 2gjx n ALA 441 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2gjx s PHE 442 N 2.15 0.19 -0.17 0.00 -0.71 -1.26 -4.98 117.98 113.21 2gjx s PHE 442 Ca 0.69 -0.55 -0.29 0.00 -1.04 0.00 0.00 56.93 55.75 2gjx s PHE 442 Cb 0.18 0.10 -0.00 0.00 -1.21 0.00 0.00 43.02 42.09 2gjx s PHE 442 CO -0.06 -0.77 1.00 -2.00 -1.34 0.00 0.00 175.22 172.05 2gjx s GLU 443 N -3.92 4.34 0.00 1.99 2.12 -1.26 -4.99 118.70 116.97 2gjx s GLU 443 Ca 0.13 1.33 0.00 0.00 0.36 0.00 0.00 54.97 56.79 2gjx s GLU 443 Cb 0.02 -3.59 0.00 0.00 0.26 0.00 0.00 34.13 30.82 2gjx s GLU 443 CO -0.02 -0.45 0.00 0.41 -0.54 0.00 0.00 175.26 174.66 2gjx n GLY 444 N 3.24 0.93 3.79 -1.50 0.00 -1.26 -4.92 105.19 105.47 2gjx n GLY 444 Ca 0.10 -0.57 -0.34 0.00 0.00 0.00 0.00 46.02 45.20 2gjx n GLY 444 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2gjx s THR 445 N -2.00 3.48 0.16 2.61 -1.32 -1.26 -4.84 115.64 112.47 2gjx s THR 445 Ca 0.00 0.82 -0.30 0.00 -1.21 0.00 0.00 61.69 61.00 2gjx s THR 445 Cb 0.00 -3.31 -0.04 0.00 -1.51 0.00 0.00 72.50 67.64 2gjx s THR 445 CO 0.00 -0.30 1.55 -0.65 -2.21 0.00 0.00 174.62 173.01 2gjx h PRO 446 N 0.87 -0.14 0.00 7.08 0.11 -2.02 -0.74 132.00 137.15 2gjx h PRO 446 Ca -0.48 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 2gjx h PRO 446 Cb 1.24 0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 2gjx h PRO 446 CO 0.57 -0.09 -0.08 1.05 -0.21 0.00 0.00 178.00 179.24 2gjx h GLU 447 N -0.15 0.00 -0.06 1.05 9.09 -2.01 -1.98 114.58 120.53 2gjx h GLU 447 Ca 0.15 0.00 -0.19 0.00 0.05 0.00 0.00 59.36 59.37 2gjx h GLU 447 Cb 0.50 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.60 2gjx h GLU 447 CO -0.81 0.08 -0.77 0.37 0.05 0.00 0.00 179.01 177.92 2gjx h GLN 448 N 0.00 0.39 0.00 1.06 4.15 -1.53 -3.14 115.11 116.04 2gjx h GLN 448 Ca -0.00 -0.34 0.00 0.00 0.77 0.00 0.00 58.65 59.08 2gjx h GLN 448 Cb 0.34 0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.11 2gjx h GLN 448 CO 0.01 0.99 0.00 0.87 -1.93 0.00 0.00 178.83 178.77 2gjx h LYS 449 N 0.26 0.00 0.00 1.69 1.57 -0.51 -3.06 116.57 116.52 2gjx h LYS 449 Ca -0.04 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 2gjx h LYS 449 Cb 1.36 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.67 2gjx h LYS 449 CO 0.13 0.00 -0.07 0.00 -0.57 0.00 0.00 179.45 178.94 2gjx h ALA 450 N 2.19 1.07 0.00 3.86 0.00 -1.43 -2.77 119.26 122.17 2gjx h ALA 450 Ca 0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2gjx h ALA 450 Cb 0.64 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 2gjx h ALA 450 CO 0.00 0.09 -0.01 -0.07 0.00 0.00 0.00 179.25 179.26 2gjx h LEU 451 N 0.00 0.00 -8.81 0.00 3.38 -1.68 -3.41 115.31 104.79 2gjx h LEU 451 Ca -0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 2gjx h LEU 451 Cb 0.44 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 2gjx h LEU 451 CO 0.01 0.01 1.12 -0.69 0.09 0.00 0.00 178.44 178.98 2gjx s VAL 452 N -3.83 3.80 -2.83 1.22 1.01 -1.05 -0.88 120.40 117.84 2gjx s VAL 452 Ca -0.01 0.81 0.24 0.00 0.00 0.00 0.00 61.98 63.02 2gjx s VAL 452 Cb 0.10 -4.07 0.27 0.00 0.00 0.00 0.00 36.38 32.69 2gjx s VAL 452 CO 0.51 -0.67 1.31 2.30 0.00 0.00 0.00 175.10 178.55 2gjx n ILE 453 N 7.16 0.16 0.00 2.22 -5.35 -0.91 -4.93 119.36 117.71 2gjx n ILE 453 Ca 0.18 -0.58 0.00 0.00 -0.27 0.00 0.00 62.75 62.08 2gjx n ILE 453 Cb 0.48 1.32 0.00 0.00 -1.74 0.00 0.00 39.64 39.70 2gjx n ILE 453 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2gjx n GLY 454 N 1.40 0.85 2.91 3.28 0.00 -1.26 -0.89 105.19 111.49 2gjx n GLY 454 Ca 0.16 -1.98 -0.11 0.00 0.00 0.00 0.00 46.02 44.09 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 1.94 3.03 -0.02 0.00 -0.93 -1.20 105.19 108.00 2gjx n GLY 455 Ca 0.00 -1.47 -0.12 0.00 0.00 0.00 0.00 46.02 44.43 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 -2.50 0.26 0.22 1.61 2.02 -0.89 -1.42 118.70 118.01 2gjx s GLU 456 Ca 0.21 -0.10 -0.18 0.00 0.02 0.00 0.00 54.97 54.92 2gjx s GLU 456 Cb -0.02 0.11 -0.08 0.00 0.10 0.00 0.00 34.13 34.24 2gjx s GLU 456 CO 0.15 -0.05 0.69 0.00 0.02 0.00 0.00 175.26 176.08 2gjx s ALA 457 N -0.55 3.44 -0.09 5.21 0.00 -0.75 -4.55 121.76 124.46 2gjx s ALA 457 Ca -0.06 0.09 0.04 0.00 0.00 0.00 0.00 51.96 52.03 2gjx s ALA 457 Cb -0.04 -2.76 -0.01 0.00 0.00 0.00 0.00 23.12 20.31 2gjx s ALA 457 CO 0.00 0.35 -0.21 0.00 0.00 0.00 0.00 175.76 175.91 2gjx n MET 459 N 3.18 1.82 -1.95 0.00 2.81 -0.76 -0.57 117.12 121.66 2gjx n MET 459 Ca -0.18 -4.17 -0.42 0.00 -1.81 0.00 0.00 57.70 51.11 2gjx n MET 459 Cb 0.52 -1.94 -0.03 0.00 -0.71 0.00 0.00 33.22 31.06 2gjx n MET 459 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 2gjx s TRP 460 N -1.87 2.46 -0.18 2.03 0.52 -1.26 -3.01 118.94 117.64 2gjx s TRP 460 Ca 0.36 0.36 0.00 0.00 0.02 0.00 0.00 56.10 56.85 2gjx s TRP 460 Cb 0.13 -3.94 0.19 0.00 -1.15 0.00 0.00 33.47 28.69 2gjx s TRP 460 CO -0.07 -3.76 1.61 0.41 0.02 0.00 0.00 176.95 175.17 2gjx n GLY 461 N 3.97 3.16 0.28 0.98 0.00 -1.26 -4.29 105.19 108.03 2gjx n GLY 461 Ca 0.16 -0.53 -0.04 0.00 0.00 0.00 0.00 46.02 45.61 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 0.76 0.73 0.00 1.61 3.07 -1.90 -3.24 114.58 115.61 2gjx h GLU 462 Ca 0.20 -0.19 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 2gjx h GLU 462 Cb 1.32 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 29.15 2gjx h GLU 462 CO 0.43 0.75 -0.05 0.66 -1.40 0.00 0.00 179.01 179.40 2gjx n TYR 463 N -4.22 0.00 -3.87 4.33 4.01 -1.26 -5.00 117.16 111.15 2gjx n TYR 463 Ca 0.02 -0.73 -0.17 0.00 -0.16 0.00 0.00 57.90 56.86 2gjx n TYR 463 Cb 0.30 -0.11 -0.16 0.00 -0.31 0.00 0.00 39.34 39.05 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 -2.01 0.12 0.01 -0.72 1.01 -1.22 -5.00 120.40 112.58 2gjx s VAL 464 Ca 0.20 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.31 2gjx s VAL 464 Cb 0.17 -0.24 -0.00 0.00 0.00 0.00 0.00 36.38 36.31 2gjx s VAL 464 CO 0.02 0.14 0.01 -0.90 0.00 0.00 0.00 175.10 174.36 2gjx n ASP 465 N 4.27 -0.01 0.10 3.32 5.75 -1.26 -4.57 116.55 124.14 2gjx n ASP 465 Ca -0.24 -1.03 0.03 0.00 -0.01 0.00 0.00 54.79 53.53 2gjx n ASP 465 Cb 0.50 0.03 0.17 0.00 -1.03 0.00 0.00 41.12 40.80 2gjx n ASP 465 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2gjx n ASN 466 N -2.77 0.16 0.11 -1.12 5.15 -1.26 -1.51 115.26 114.02 2gjx n ASN 466 Ca 0.00 0.39 0.12 0.00 -0.60 0.00 0.00 54.58 54.50 2gjx n ASN 466 Cb 0.01 -0.34 0.19 0.00 -0.53 0.00 0.00 39.78 39.11 2gjx n ASN 466 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2gjx h THR 467 N 0.00 0.00 0.00 -0.44 1.03 -1.97 -3.39 112.91 108.14 2gjx h THR 467 Ca 0.00 -0.69 0.00 0.00 -0.01 0.00 0.00 66.41 65.71 2gjx h THR 467 Cb 0.66 1.43 0.00 0.00 -1.07 0.00 0.00 68.15 69.17 2gjx h THR 467 CO 0.00 0.00 -0.02 -0.46 -0.01 0.00 0.00 175.52 175.03 2gjx n ASN 468 N -2.45 0.00 0.39 0.00 6.94 -0.57 -4.97 115.26 114.60 2gjx n ASN 468 Ca 0.03 -1.04 -0.15 0.00 -0.02 0.00 0.00 54.58 53.40 2gjx n ASN 468 Cb 0.48 -0.01 -0.07 0.00 -2.36 0.00 0.00 39.78 37.82 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 -0.84 0.07 -4.53 5.85 -1.64 -2.98 115.31 111.24 2gjx h LEU 469 Ca 0.00 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.77 2gjx h LEU 469 Cb 1.02 0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.22 2gjx h LEU 469 CO 0.00 -0.58 -0.31 0.58 -0.34 0.00 0.00 178.44 177.79 2gjx h VAL 470 N -1.03 0.33 -0.29 1.05 2.07 -1.88 0.10 116.25 116.60 2gjx h VAL 470 Ca -0.10 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.46 2gjx h VAL 470 Cb 0.76 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 2gjx h VAL 470 CO 0.17 0.00 0.05 1.55 0.02 0.00 0.00 177.57 179.35 2gjx h PRO 471 N -0.50 0.15 0.00 1.57 0.13 -1.61 -0.60 132.00 131.14 2gjx h PRO 471 Ca 0.04 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 65.10 2gjx h PRO 471 Cb 0.55 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.64 2gjx h PRO 471 CO -0.22 0.10 -0.30 -0.09 -0.23 0.00 0.00 178.00 177.27 2gjx h ARG 472 N 0.15 0.00 0.07 0.86 2.43 -1.35 -3.24 114.38 113.30 2gjx h ARG 472 Ca 0.14 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.30 2gjx h ARG 472 Cb 0.15 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 2gjx h ARG 472 CO -0.19 0.30 -0.04 1.25 -1.51 0.00 0.00 179.97 179.78 2gjx h LEU 473 N 0.00 -0.09 -9.39 3.80 6.46 -0.31 -3.44 115.31 112.34 2gjx h LEU 473 Ca -0.00 -0.48 -0.66 0.00 -0.12 0.00 0.00 57.88 56.62 2gjx h LEU 473 Cb 0.61 0.02 -0.13 0.00 -0.73 0.00 0.00 40.66 40.43 2gjx h LEU 473 CO 0.04 0.59 -0.67 0.26 -0.62 0.00 0.00 178.44 178.04 2gjx s TRP 474 N -2.68 2.99 -0.35 1.25 0.52 -0.29 -1.54 118.94 118.83 2gjx s TRP 474 Ca -0.12 -0.00 0.09 0.00 0.02 0.00 0.00 56.10 56.08 2gjx s TRP 474 Cb -0.01 -1.58 0.70 0.00 -1.15 0.00 0.00 33.47 31.43 2gjx s TRP 474 CO 0.45 0.46 1.75 -0.35 0.02 0.00 0.00 176.95 179.27 2gjx n PRO 475 N 0.95 3.52 -0.17 4.98 -0.04 -1.26 -1.76 135.00 141.23 2gjx n PRO 475 Ca -0.13 -2.87 -0.01 0.00 -0.04 0.00 0.00 63.50 60.45 2gjx n PRO 475 Cb 0.52 -2.16 0.23 0.00 -0.04 0.00 0.00 33.50 32.05 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 2.46 0.90 0.00 0.54 3.08 -1.81 -0.87 114.38 118.68 2gjx h ARG 476 Ca 0.27 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2gjx h ARG 476 Cb 2.28 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 32.15 2gjx h ARG 476 CO 0.72 0.67 0.00 0.00 -1.07 0.00 0.00 179.97 180.29 2gjx n ALA 477 N -2.44 1.77 0.13 0.04 0.00 -0.59 -2.30 120.51 117.11 2gjx n ALA 477 Ca 0.06 -0.04 -0.02 0.00 0.00 0.00 0.00 53.44 53.45 2gjx n ALA 477 Cb 0.11 -1.29 0.20 0.00 0.00 0.00 0.00 19.45 18.47 2gjx n ALA 477 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2gjx h GLY 478 N 2.85 0.10 0.99 0.00 0.00 -1.42 -2.45 103.07 103.14 2gjx h GLY 478 Ca 0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 2gjx h GLY 478 CO 0.00 0.10 0.30 0.00 0.00 0.00 0.00 176.54 176.94 2gjx h ALA 479 N 1.38 0.63 -0.65 3.60 0.00 -1.54 -1.13 119.26 121.55 2gjx h ALA 479 Ca -0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 2gjx h ALA 479 Cb 0.99 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 2gjx h ALA 479 CO 0.08 0.11 0.09 0.28 0.00 0.00 0.00 179.25 179.80 2gjx h VAL 480 N 0.66 1.26 -0.32 0.00 2.07 -1.68 -2.52 116.25 115.72 2gjx h VAL 480 Ca 0.18 -1.05 0.04 0.00 0.82 0.00 0.00 66.70 66.69 2gjx h VAL 480 Cb -0.02 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 30.38 2gjx h VAL 480 CO -0.03 0.39 0.08 0.00 0.02 0.00 0.00 177.57 178.03 2gjx h ALA 481 N 1.08 0.35 -0.40 1.67 0.00 -0.90 -1.65 119.26 119.40 2gjx h ALA 481 Ca 0.20 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.06 2gjx h ALA 481 Cb 0.46 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2gjx h ALA 481 CO 0.02 -0.32 -0.11 1.49 0.00 0.00 0.00 179.25 180.32 2gjx h GLU 482 N 0.21 0.78 -0.08 0.00 4.81 -1.15 -1.66 114.58 117.49 2gjx h GLU 482 Ca 0.15 -0.31 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 2gjx h GLU 482 Cb 0.14 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.48 2gjx h GLU 482 CO -0.17 0.92 0.05 -0.09 -0.73 0.00 0.00 179.01 178.99 2gjx h ARG 483 N 0.59 0.11 0.00 1.92 9.65 -1.21 0.46 114.38 125.90 2gjx h ARG 483 Ca 0.10 -0.01 -0.23 0.00 -1.10 0.00 0.00 59.98 58.74 2gjx h ARG 483 Cb 0.64 -0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 29.16 2gjx h ARG 483 CO 0.04 0.07 -1.20 -0.07 2.80 0.00 0.00 179.97 181.62 2gjx h LEU 484 N 0.11 0.00 0.00 3.80 3.38 -1.04 -3.40 115.31 118.16 2gjx h LEU 484 Ca 0.03 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.79 2gjx h LEU 484 Cb -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2gjx h LEU 484 CO -0.01 0.98 -1.43 1.87 0.09 0.00 0.00 178.44 179.95 2gjx n TRP 485 N -3.25 0.50 -0.89 1.13 -0.00 -0.65 -2.11 117.44 112.17 2gjx n TRP 485 Ca -0.05 0.22 -0.29 0.00 -0.00 0.00 0.00 57.50 57.38 2gjx n TRP 485 Cb 0.97 -0.88 0.22 0.00 -0.00 0.00 0.00 31.31 31.61 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 -6.62 1.57 0.58 5.87 0.01 0.16 -1.16 113.70 114.10 2gjx s SER 486 Ca -0.29 1.21 -0.18 0.00 1.31 0.00 0.00 55.95 58.00 2gjx s SER 486 Cb 0.07 -1.87 -0.04 0.00 0.21 0.00 0.00 66.02 64.39 2gjx s SER 486 CO 0.45 -3.79 1.11 0.21 0.41 0.00 0.00 173.24 171.63 2gjx s ASN 487 N -3.14 5.56 0.41 2.44 3.84 -1.26 -4.61 114.94 118.17 2gjx s ASN 487 Ca 0.67 2.08 0.18 0.00 0.21 0.00 0.00 52.86 56.00 2gjx s ASN 487 Cb -0.20 -2.57 1.08 0.00 -0.55 0.00 0.00 41.25 39.02 2gjx s ASN 487 CO 0.60 -1.33 1.82 0.50 -2.79 0.00 0.00 177.10 175.90 2gjx h LYS 488 N 0.77 0.40 0.00 0.43 3.64 -1.94 -1.57 116.57 118.30 2gjx h LYS 488 Ca -0.49 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 58.75 2gjx h LYS 488 Cb 1.25 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.96 2gjx h LYS 488 CO 0.56 0.27 -0.59 -0.07 -2.27 0.00 0.00 179.45 177.35 2gjx h LEU 489 N 0.41 0.00 -8.26 5.20 3.38 -2.02 -3.41 115.31 110.62 2gjx h LEU 489 Ca 0.53 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 58.22 2gjx h LEU 489 Cb 1.31 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.02 2gjx h LEU 489 CO -0.23 0.59 0.71 -0.89 0.09 0.00 0.00 178.44 178.71 2gjx s THR 490 N -3.09 3.39 0.00 0.22 2.01 -0.59 -4.55 115.64 113.04 2gjx s THR 490 Ca 0.02 -0.29 0.00 0.00 0.31 0.00 0.00 61.69 61.73 2gjx s THR 490 Cb 0.09 -3.89 0.00 0.00 0.01 0.00 0.00 72.50 68.71 2gjx s THR 490 CO 0.75 -0.84 0.63 -1.54 -0.69 0.00 0.00 174.62 172.93 2gjx n SER 491 N 14.39 0.00 -4.67 3.53 3.41 -1.26 -4.84 113.62 124.18 2gjx n SER 491 Ca 0.39 -1.39 -0.43 0.00 -0.26 0.00 0.00 58.87 57.19 2gjx n SER 491 Cb 0.47 -0.08 -0.02 0.00 -0.26 0.00 0.00 64.21 64.32 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 -0.39 6.98 0.10 4.04 3.68 -1.26 -4.94 116.67 124.87 2gjx s ASP 492 Ca 0.00 1.77 -0.16 0.00 2.13 0.00 0.00 52.55 56.29 2gjx s ASP 492 Cb 0.00 -2.55 -0.07 0.00 -1.45 0.00 0.00 42.92 38.86 2gjx s ASP 492 CO 0.00 -0.69 1.48 -0.07 0.13 0.00 0.00 175.17 176.02 2gjx h LEU 493 N 9.08 0.62 -0.59 -1.34 4.07 -1.98 -0.34 115.31 124.84 2gjx h LEU 493 Ca -0.30 -0.38 -0.01 0.00 0.08 0.00 0.00 57.88 57.27 2gjx h LEU 493 Cb 1.13 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 42.67 2gjx h LEU 493 CO 0.93 0.87 0.35 0.74 -1.08 0.00 0.00 178.44 180.24 2gjx h THR 494 N 0.37 1.18 -0.28 0.22 2.02 -1.99 0.28 112.91 114.71 2gjx h THR 494 Ca 0.07 -0.42 -0.10 0.00 0.77 0.00 0.00 66.41 66.73 2gjx h THR 494 Cb 0.61 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 2gjx h THR 494 CO 0.04 0.19 -0.25 0.15 0.37 0.00 0.00 175.52 176.01 2gjx h PHE 495 N 0.80 0.61 0.36 3.16 -0.00 -1.97 -1.68 116.94 118.22 2gjx h PHE 495 Ca 0.21 -0.13 -0.02 0.00 -0.00 0.00 0.00 57.97 58.03 2gjx h PHE 495 Cb 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 35.95 35.81 2gjx h PHE 495 CO -0.02 0.75 -0.17 0.00 -0.00 0.00 0.00 178.31 178.87 2gjx h ALA 496 N 1.25 -0.48 -0.25 2.41 0.00 -0.34 -3.16 119.26 118.69 2gjx h ALA 496 Ca 0.07 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.86 2gjx h ALA 496 Cb 0.69 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 2gjx h ALA 496 CO 0.05 -0.65 -0.08 -0.92 0.00 0.00 0.00 179.25 177.65 2gjx h TYR 497 N -0.71 -0.18 -0.77 0.00 3.20 -0.41 0.30 116.97 118.38 2gjx h TYR 497 Ca -0.05 0.02 0.13 0.00 3.14 0.00 0.00 58.73 61.98 2gjx h TYR 497 Cb 0.49 0.12 -0.14 0.00 1.54 0.00 0.00 36.73 38.75 2gjx h TYR 497 CO 0.00 -0.13 -0.34 0.93 -1.64 0.00 0.00 178.16 176.98 2gjx h GLU 498 N -0.03 -0.08 0.00 1.82 5.08 -1.32 -0.95 114.58 119.10 2gjx h GLU 498 Ca 0.13 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2gjx h GLU 498 Cb 0.22 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2gjx h GLU 498 CO -0.27 -0.05 -0.94 2.89 -1.00 0.00 0.00 179.01 179.63 2gjx n ARG 499 N -5.46 0.21 0.07 2.33 1.85 -1.13 -3.13 116.66 111.40 2gjx n ARG 499 Ca 0.07 -0.00 -0.12 0.00 -1.00 0.00 0.00 57.85 56.80 2gjx n ARG 499 Cb 0.38 -1.57 -0.02 0.00 -1.05 0.00 0.00 32.46 30.20 2gjx n ARG 499 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 2gjx h LEU 500 N 0.00 0.47 -0.50 2.89 5.85 -0.34 -0.64 115.31 123.05 2gjx h LEU 500 Ca 0.00 -0.36 -0.17 0.00 0.84 0.00 0.00 57.88 58.19 2gjx h LEU 500 Cb 0.67 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 2gjx h LEU 500 CO 0.00 1.15 -0.68 0.77 -0.34 0.00 0.00 178.44 179.34 2gjx h SER 501 N 0.21 0.39 -0.24 1.25 4.64 -1.31 -1.14 113.55 117.36 2gjx h SER 501 Ca -0.06 -0.25 -0.07 0.00 -0.47 0.00 0.00 61.79 60.94 2gjx h SER 501 Cb 1.51 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 63.47 2gjx h SER 501 CO 0.15 0.96 -0.07 -0.74 -0.87 0.00 0.00 176.83 176.26 2gjx h HIS 502 N 0.24 0.64 0.00 4.77 -0.00 -1.48 -2.25 115.15 117.06 2gjx h HIS 502 Ca -0.02 -0.09 -0.12 0.00 -0.00 0.00 0.00 60.37 60.14 2gjx h HIS 502 Cb 1.23 -0.17 -0.02 0.00 -0.00 0.00 0.00 27.41 28.45 2gjx h HIS 502 CO 0.03 0.66 -0.58 0.35 -0.00 0.00 0.00 177.93 178.40 2gjx h PHE 503 N 0.56 0.00 0.31 5.26 -0.00 -0.79 -2.78 116.94 119.50 2gjx h PHE 503 Ca 0.11 0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 58.06 2gjx h PHE 503 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.41 2gjx h PHE 503 CO 0.02 0.58 -0.15 -0.09 -0.00 0.00 0.00 178.31 178.67 2gjx h ARG 504 N 0.00 -0.40 -0.40 1.11 2.43 -0.64 -0.55 114.38 115.93 2gjx h ARG 504 Ca -0.01 0.03 0.10 0.00 -0.81 0.00 0.00 59.98 59.30 2gjx h ARG 504 Cb 1.08 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 2gjx h ARG 504 CO 0.07 -0.12 0.28 0.00 -1.51 0.00 0.00 179.97 178.70 2gjx h GLU 506 N 0.07 0.58 -0.77 0.00 4.57 -1.23 -2.43 114.58 115.38 2gjx h GLU 506 Ca 0.19 -0.31 0.02 0.00 -1.18 0.00 0.00 59.36 58.08 2gjx h GLU 506 Cb 0.67 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.23 2gjx h GLU 506 CO -0.01 0.90 0.50 -0.07 -1.18 0.00 0.00 179.01 179.14 2gjx h LEU 507 N 0.29 0.85 -1.07 1.64 3.38 0.62 -1.77 115.31 119.25 2gjx h LEU 507 Ca 0.04 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2gjx h LEU 507 Cb 0.79 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.30 2gjx h LEU 507 CO 0.06 0.60 0.48 -0.07 0.09 0.00 0.00 178.44 179.60 2gjx h LEU 508 N 1.00 1.00 -1.41 1.67 4.07 -1.06 0.13 115.31 120.71 2gjx h LEU 508 Ca 0.29 -0.07 -0.06 0.00 0.08 0.00 0.00 57.88 58.12 2gjx h LEU 508 Cb -0.06 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 41.42 2gjx h LEU 508 CO -0.08 0.78 -0.29 -0.09 -1.08 0.00 0.00 178.44 177.67 2gjx h ARG 509 N 1.14 0.00 -0.13 1.13 2.43 -0.90 -1.12 114.38 116.93 2gjx h ARG 509 Ca 0.29 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.46 2gjx h ARG 509 Cb -0.02 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 2gjx h ARG 509 CO -0.05 0.29 0.00 0.54 -1.51 0.00 0.00 179.97 179.24 2gjx n ARG 510 N -3.99 1.45 -0.62 0.20 1.74 -0.47 -4.89 116.66 110.08 2gjx n ARG 510 Ca -0.02 -0.69 0.00 0.00 -0.77 0.00 0.00 57.85 56.37 2gjx n ARG 510 Cb 0.36 -1.30 0.00 0.00 -1.02 0.00 0.00 32.46 30.50 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 0.95 0.77 3.69 -0.13 0.00 -0.42 -5.03 105.19 105.02 2gjx n GLY 511 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.87 4.63 -1.59 1.61 1.01 0.32 -4.94 120.40 118.58 2gjx s VAL 512 Ca 0.00 1.91 -0.09 0.00 0.00 0.00 0.00 61.98 63.80 2gjx s VAL 512 Cb 0.00 -4.23 -0.06 0.00 0.00 0.00 0.00 36.38 32.09 2gjx s VAL 512 CO 0.00 0.01 2.90 1.67 0.00 0.00 0.00 175.10 179.68 2gjx n GLN 513 N 4.96 3.82 -2.93 2.72 7.27 -1.26 -3.60 117.38 128.36 2gjx n GLN 513 Ca 0.09 -2.36 -0.40 0.00 0.07 0.00 0.00 57.00 54.41 2gjx n GLN 513 Cb 0.48 -2.78 -0.05 0.00 2.41 0.00 0.00 30.24 30.30 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 1.75 3.39 0.67 1.69 0.00 -1.26 -2.46 121.76 125.54 2gjx s ALA 514 Ca 0.68 0.39 -0.13 0.00 0.00 0.00 0.00 51.96 52.90 2gjx s ALA 514 Cb 0.18 -3.03 -0.00 0.00 0.00 0.00 0.00 23.12 20.27 2gjx s ALA 514 CO -0.06 0.17 1.07 1.14 0.00 0.00 0.00 175.76 178.07 2gjx s GLN 515 N -0.65 2.96 0.40 0.00 -2.07 -0.72 -4.90 119.66 114.68 2gjx s GLN 515 Ca 0.38 1.09 -0.24 0.00 -1.82 0.00 0.00 55.36 54.78 2gjx s GLN 515 Cb -0.23 -1.99 -0.09 0.00 -1.09 0.00 0.00 33.01 29.62 2gjx s GLN 515 CO 0.26 -1.09 1.04 -1.25 -1.32 0.00 0.00 175.29 172.93 2gjx s PRO 516 N -4.64 4.19 0.14 9.60 0.04 -1.26 -4.28 135.00 138.79 2gjx s PRO 516 Ca 0.61 1.47 0.08 0.00 0.04 0.00 0.00 61.00 63.20 2gjx s PRO 516 Cb -0.15 -2.53 -0.16 0.00 0.04 0.00 0.00 34.50 31.70 2gjx s PRO 516 CO 0.48 -0.11 1.31 -0.07 0.04 0.00 0.00 177.00 178.66 2gjx h LEU 517 N 2.50 0.00 0.00 -3.56 3.38 -1.97 -3.49 115.31 112.17 2gjx h LEU 517 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2gjx h LEU 517 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2gjx h LEU 517 CO 0.62 0.93 0.00 -3.20 0.09 0.00 0.00 178.44 176.89 2gjx n ASN 518 N -3.35 0.00 -4.76 -0.43 2.85 -1.26 -4.67 115.26 103.63 2gjx n ASN 518 Ca 0.00 -0.82 -0.38 0.00 -0.11 0.00 0.00 54.58 53.27 2gjx n ASN 518 Cb 0.90 0.00 0.02 0.00 1.24 0.00 0.00 39.78 41.94 2gjx n ASN 518 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 2gjx s VAL 519 N -2.52 2.42 -5.00 3.44 -7.23 -1.26 -4.89 120.40 105.35 2gjx s VAL 519 Ca 0.00 0.33 0.00 0.00 -1.81 0.00 0.00 61.98 60.50 2gjx s VAL 519 Cb 0.00 -3.18 0.00 0.00 0.56 0.00 0.00 36.38 33.76 2gjx s VAL 519 CO 0.00 0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.41 2gjx n GLY 520 N 0.63 0.09 3.49 2.32 0.00 -1.26 -5.16 105.19 105.29 2gjx n GLY 520 Ca 0.08 -1.25 -0.11 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 -3.63 -0.44 -0.19 1.61 -0.71 -1.26 -5.13 117.98 108.23 2gjx s PHE 521 Ca 0.00 0.38 0.01 0.00 -1.04 0.00 0.00 56.93 56.27 2gjx s PHE 521 Cb 0.00 0.52 0.02 0.00 -1.21 0.00 0.00 43.02 42.35 2gjx s PHE 521 CO 0.00 -0.63 -0.18 0.00 -1.34 0.00 0.00 175.22 173.07 2gjx n GLU 523 N 4.63 -0.06 -3.38 0.00 0.00 -1.26 -1.60 120.64 118.98 2gjx n GLU 523 Ca -0.20 1.25 -0.45 0.00 0.00 0.00 0.00 57.16 57.76 2gjx n GLU 523 Cb 0.50 -2.20 -0.02 0.00 0.00 0.00 0.00 31.44 29.72 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 -5.44 3.83 0.64 5.31 1.03 -1.26 -5.06 119.66 118.71 2gjx s GLN 524 Ca -0.09 -2.91 -0.17 0.00 0.04 0.00 0.00 55.36 52.23 2gjx s GLN 524 Cb 0.30 -4.42 -0.01 0.00 0.03 0.00 0.00 33.01 28.90 2gjx s GLN 524 CO 0.70 -1.26 1.19 -1.21 -2.54 0.00 0.00 175.29 172.17 2gjx s GLU 525 N -0.68 2.75 0.09 9.60 0.41 -0.63 -4.73 118.70 125.50 2gjx s GLU 525 Ca 0.25 1.74 -0.30 0.00 -0.41 0.00 0.00 54.97 56.25 2gjx s GLU 525 Cb -0.10 -1.91 -0.06 0.00 -1.78 0.00 0.00 34.13 30.28 2gjx s GLU 525 CO -0.09 -1.36 1.19 0.12 -0.49 0.00 0.00 175.26 174.64 2gjx s PHE 526 N -1.80 3.45 -0.30 1.61 5.36 -1.26 -5.02 117.98 120.02 2gjx s PHE 526 Ca 0.75 1.33 -0.09 0.00 -0.96 0.00 0.00 56.93 57.97 2gjx s PHE 526 Cb -0.28 -3.41 0.14 0.00 -0.34 0.00 0.00 43.02 39.12 2gjx s PHE 526 CO 0.37 -1.23 0.66 -1.83 -1.46 0.00 0.00 175.22 171.72 2gjx s GLU 527 N 0.79 0.57 0.00 10.12 -1.05 -1.26 -5.21 118.70 122.66 2gjx s GLU 527 Ca 0.57 1.36 0.00 0.00 -0.15 0.00 0.00 54.97 56.75 2gjx s GLU 527 Cb -0.30 0.81 0.00 0.00 -0.44 0.00 0.00 34.13 34.20 2gjx s GLU 527 CO 0.31 -0.26 0.00 1.04 0.95 0.00 0.00 175.26 177.29