#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jig n GLU 37 N 0.00 1.07 -2.07 5.31 4.07 -1.26 -4.96 120.64 122.79 2jig n GLU 37 Ca 0.00 -0.08 -0.43 0.00 -0.06 0.00 0.00 57.16 56.60 2jig n GLU 37 Cb 0.00 -1.20 -0.03 0.00 -0.06 0.00 0.00 31.44 30.15 2jig n GLU 37 CO 0.00 0.00 0.00 -0.46 -0.06 0.00 0.00 177.13 176.61 2jig s TRP 38 N -2.59 2.07 0.00 4.31 -0.00 -0.98 -4.86 118.94 116.90 2jig s TRP 38 Ca -0.02 0.43 0.00 0.00 -0.00 0.00 0.00 56.10 56.51 2jig s TRP 38 Cb 0.07 -3.92 0.00 0.00 -0.00 0.00 0.00 33.47 29.62 2jig s TRP 38 CO 0.46 -3.27 0.42 0.54 -0.00 0.00 0.00 176.95 175.09 2jig n ARG 39 N 7.39 -0.06 0.00 5.86 1.74 -1.26 -5.01 116.66 125.32 2jig n ARG 39 Ca 0.18 -0.42 0.00 0.00 -0.77 0.00 0.00 57.85 56.84 2jig n ARG 39 Cb 0.44 -0.92 0.00 0.00 -1.02 0.00 0.00 32.46 30.97 2jig n ARG 39 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jig n GLY 40 N 0.11 1.08 3.61 -0.13 0.00 -1.26 -5.06 105.19 103.54 2jig n GLY 40 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2jig n GLY 40 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jig s GLU 41 N -0.74 3.71 -0.06 1.61 2.12 -1.26 -5.00 118.70 119.08 2jig s GLU 41 Ca 0.00 0.86 0.04 0.00 0.36 0.00 0.00 54.97 56.23 2jig s GLU 41 Cb 0.00 -3.94 -0.02 0.00 0.26 0.00 0.00 34.13 30.43 2jig s GLU 41 CO 0.00 -1.40 -0.18 0.08 -0.54 0.00 0.00 175.26 173.22 2jig s VAL 42 N 4.82 2.71 -0.21 3.70 1.01 -1.26 -1.27 120.40 129.90 2jig s VAL 42 Ca 0.55 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.66 2jig s VAL 42 Cb -0.12 -2.05 -0.01 0.00 0.00 0.00 0.00 36.38 34.20 2jig s VAL 42 CO 0.30 0.57 -0.05 -0.69 0.00 0.00 0.00 175.10 175.23 2jig s VAL 43 N -0.36 3.36 0.08 2.92 1.01 0.11 -4.95 120.40 122.57 2jig s VAL 43 Ca 0.03 -0.50 -0.31 0.00 0.00 0.00 0.00 61.98 61.20 2jig s VAL 43 Cb -0.12 -2.51 -0.08 0.00 0.00 0.00 0.00 36.38 33.66 2jig s VAL 43 CO 0.02 0.44 1.53 -2.28 0.00 0.00 0.00 175.10 174.81 2jig s HIS 44 N 1.30 2.80 -0.25 5.22 5.65 -1.26 -0.75 115.29 127.99 2jig s HIS 44 Ca 0.04 0.61 -0.12 0.00 0.25 0.00 0.00 55.06 55.84 2jig s HIS 44 Cb -0.14 -3.83 -0.11 0.00 -1.18 0.00 0.00 32.58 27.31 2jig s HIS 44 CO -0.02 -3.17 -0.32 1.28 -0.65 0.00 0.00 174.74 171.86 2jig n LEU 45 N 4.94 1.80 -3.58 8.88 4.77 -0.44 -4.92 117.00 128.44 2jig n LEU 45 Ca 0.14 0.30 -0.15 0.00 -0.03 0.00 0.00 56.01 56.26 2jig n LEU 45 Cb 0.41 -0.74 -0.06 0.00 -2.33 0.00 0.00 43.42 40.70 2jig n LEU 45 CO 0.61 0.53 0.31 -0.55 -1.33 0.00 0.00 177.39 176.95 2jig s SER 46 N -7.25 -0.49 0.04 -1.43 0.15 -0.86 -4.97 113.70 98.89 2jig s SER 46 Ca -0.35 0.38 0.20 0.00 0.70 0.00 0.00 55.95 56.88 2jig s SER 46 Cb 0.13 0.48 -0.17 0.00 -1.71 0.00 0.00 66.02 64.76 2jig s SER 46 CO 0.44 -0.63 0.70 0.79 1.20 0.00 0.00 173.24 175.74 2jig n TRP 47 N 0.75 0.59 -3.61 3.44 7.02 -1.26 -1.49 117.44 122.88 2jig n TRP 47 Ca -0.19 0.19 -0.29 0.00 -1.02 0.00 0.00 57.50 56.18 2jig n TRP 47 Cb 0.58 -0.88 -0.13 0.00 -2.42 0.00 0.00 31.31 28.46 2jig n TRP 47 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2jig s SER 48 N -5.28 3.46 0.85 -0.99 0.15 -1.26 -2.69 113.70 107.94 2jig s SER 48 Ca -0.05 -2.18 -0.12 0.00 0.70 0.00 0.00 55.95 54.30 2jig s SER 48 Cb 0.10 -0.72 0.10 0.00 -1.71 0.00 0.00 66.02 63.79 2jig s SER 48 CO 0.84 -0.32 1.13 -2.16 1.20 0.00 0.00 173.24 173.93 2jig s PRO 49 N 0.98 1.68 -0.30 5.44 0.04 -1.25 -3.52 135.00 138.06 2jig s PRO 49 Ca 0.16 0.35 -0.29 0.00 0.04 0.00 0.00 61.00 61.26 2jig s PRO 49 Cb -0.22 -1.90 -0.00 0.00 0.04 0.00 0.00 34.50 32.42 2jig s PRO 49 CO -0.07 -1.84 1.42 1.03 0.04 0.00 0.00 177.00 177.58 2jig s ARG 50 N -5.32 3.80 -0.05 4.56 0.52 -1.09 -4.37 118.95 117.00 2jig s ARG 50 Ca 0.62 1.29 -0.03 0.00 -0.52 0.00 0.00 55.73 57.10 2jig s ARG 50 Cb -0.14 -3.96 0.02 0.00 0.52 0.00 0.00 34.95 31.40 2jig s ARG 50 CO 0.52 -1.28 0.11 0.00 0.02 0.00 0.00 175.30 174.68 2jig s ALA 51 N 4.88 -0.23 0.00 2.13 0.00 -0.55 -1.07 121.76 126.92 2jig s ALA 51 Ca 0.62 0.44 0.00 0.00 0.00 0.00 0.00 51.96 53.02 2jig s ALA 51 Cb -0.18 -0.29 -0.00 0.00 0.00 0.00 0.00 23.12 22.65 2jig s ALA 51 CO 0.27 -0.10 -0.01 -0.06 0.00 0.00 0.00 175.76 175.86 2jig s PHE 52 N 0.58 0.11 -0.24 0.00 0.40 -0.01 -1.33 117.98 117.49 2jig s PHE 52 Ca -0.04 -0.04 -0.07 0.00 -0.60 0.00 0.00 56.93 56.18 2jig s PHE 52 Cb -0.06 -0.07 -0.02 0.00 0.51 0.00 0.00 43.02 43.37 2jig s PHE 52 CO -0.02 -0.01 0.04 -1.17 0.70 0.00 0.00 175.22 174.76 2jig s LEU 53 N -0.08 3.33 -0.43 -0.37 2.96 0.07 -0.54 118.68 123.62 2jig s LEU 53 Ca -0.00 -0.24 -0.14 0.00 -0.22 0.00 0.00 54.13 53.53 2jig s LEU 53 Cb -0.01 -1.88 0.05 0.00 0.50 0.00 0.00 46.19 44.84 2jig s LEU 53 CO -0.00 -0.02 0.32 -0.76 -1.32 0.00 0.00 176.35 174.57 2jig s LEU 54 N 1.54 5.26 0.18 -0.68 1.43 0.13 0.09 118.68 126.63 2jig s LEU 54 Ca 0.06 -1.12 -0.30 0.00 -1.03 0.00 0.00 54.13 51.74 2jig s LEU 54 Cb -0.15 -2.14 -0.08 0.00 0.03 0.00 0.00 46.19 43.85 2jig s LEU 54 CO 0.02 -0.52 1.21 -0.54 0.23 0.00 0.00 176.35 176.75 2jig s LYS 55 N 1.63 4.48 -1.54 1.70 -0.14 -0.40 -1.01 119.74 124.46 2jig s LYS 55 Ca 0.04 1.90 -0.11 0.00 -1.36 0.00 0.00 55.97 56.44 2jig s LYS 55 Cb -0.21 -3.24 0.08 0.00 -1.68 0.00 0.00 37.83 32.78 2jig s LYS 55 CO 0.08 -0.11 0.75 0.09 -0.76 0.00 0.00 175.35 175.40 2jig n ASN 56 N 2.54 -2.83 -0.25 2.83 4.13 -1.23 -4.56 115.26 115.89 2jig n ASN 56 Ca 0.05 -0.92 -0.07 0.00 1.68 0.00 0.00 54.58 55.31 2jig n ASN 56 Cb 0.44 -3.31 0.05 0.00 -1.54 0.00 0.00 39.78 35.42 2jig n ASN 56 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 2jig h PHE 57 N -1.80 1.18 -3.61 3.10 3.57 -0.52 -2.60 116.94 116.25 2jig h PHE 57 Ca -0.60 -0.14 -0.68 0.00 3.53 0.00 0.00 57.97 60.08 2jig h PHE 57 Cb 1.38 -0.33 -0.18 0.00 2.79 0.00 0.00 35.95 39.60 2jig h PHE 57 CO 0.56 0.95 -0.69 -0.51 -2.23 0.00 0.00 178.31 176.40 2jig s LEU 58 N -9.56 3.21 0.85 0.59 1.43 -0.37 -4.28 118.68 110.56 2jig s LEU 58 Ca -0.12 -0.05 -0.11 0.00 -1.03 0.00 0.00 54.13 52.82 2jig s LEU 58 Cb 0.15 -1.76 0.10 0.00 0.03 0.00 0.00 46.19 44.71 2jig s LEU 58 CO 0.84 0.33 1.09 -0.94 0.23 0.00 0.00 176.35 177.91 2jig s SER 59 N -1.05 3.85 0.21 2.29 1.04 -1.26 -4.39 113.70 114.40 2jig s SER 59 Ca 0.14 1.53 -0.09 0.00 0.48 0.00 0.00 55.95 58.01 2jig s SER 59 Cb -0.11 -2.23 0.23 0.00 0.10 0.00 0.00 66.02 64.01 2jig s SER 59 CO 0.04 -2.41 1.84 0.44 0.98 0.00 0.00 173.24 174.13 2jig h ASP 60 N -1.39 0.69 -0.52 7.02 5.19 -1.97 -1.34 116.42 124.10 2jig h ASP 60 Ca -0.48 0.01 0.04 0.00 -0.62 0.00 0.00 57.03 55.98 2jig h ASP 60 Cb 1.27 -0.13 -0.04 0.00 0.18 0.00 0.00 39.33 40.61 2jig h ASP 60 CO 0.55 0.46 0.28 -0.33 -3.12 0.00 0.00 179.24 177.07 2jig h GLU 61 N 0.82 0.53 -0.45 3.56 5.08 -1.99 0.61 114.58 122.75 2jig h GLU 61 Ca 0.30 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.61 2jig h GLU 61 Cb 0.10 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2jig h GLU 61 CO -0.14 0.35 0.19 0.93 -1.00 0.00 0.00 179.01 179.34 2jig h GLU 62 N 0.54 0.66 0.01 2.33 5.08 -1.86 0.92 114.58 122.26 2jig h GLU 62 Ca 0.22 -0.11 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 2jig h GLU 62 Cb 0.10 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 2jig h GLU 62 CO -0.14 0.59 -0.08 0.00 -1.00 0.00 0.00 179.01 178.37 2jig h ASP 64 N -0.15 0.64 -0.58 0.00 3.32 -0.76 -2.29 116.42 116.60 2jig h ASP 64 Ca 0.03 -0.10 0.11 0.00 0.02 0.00 0.00 57.03 57.09 2jig h ASP 64 Cb 0.19 -0.16 -0.08 0.00 0.22 0.00 0.00 39.33 39.49 2jig h ASP 64 CO -0.08 0.56 0.13 0.22 -1.72 0.00 0.00 179.24 178.35 2jig h TYR 65 N 0.68 0.20 -0.17 4.55 3.20 -0.59 -0.79 116.97 124.05 2jig h TYR 65 Ca 0.18 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 62.03 2jig h TYR 65 Cb 0.07 -0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.33 2jig h TYR 65 CO -0.01 -0.02 -0.09 0.82 -1.64 0.00 0.00 178.16 177.21 2jig h ILE 66 N 0.26 1.32 -0.20 1.81 2.04 -1.03 -0.67 117.51 121.03 2jig h ILE 66 Ca 0.30 -1.16 0.04 0.00 1.00 0.00 0.00 64.86 65.04 2jig h ILE 66 Cb 0.44 1.73 -0.04 0.00 -0.74 0.00 0.00 36.82 38.21 2jig h ILE 66 CO -0.39 0.34 -0.06 0.58 0.00 0.00 0.00 178.15 178.63 2jig h VAL 67 N 0.03 0.78 -0.24 1.67 2.07 -1.32 -1.14 116.25 118.10 2jig h VAL 67 Ca 0.04 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 2jig h VAL 67 Cb 0.58 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 2jig h VAL 67 CO 0.03 0.00 0.06 -0.33 0.02 0.00 0.00 177.57 177.35 2jig h GLU 68 N -0.01 0.34 -0.02 1.57 5.08 -0.96 -0.50 114.58 120.08 2jig h GLU 68 Ca 0.10 -0.04 -0.21 0.00 -1.00 0.00 0.00 59.36 58.20 2jig h GLU 68 Cb 0.16 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 2jig h GLU 68 CO -0.21 0.32 -0.87 -0.22 -1.00 0.00 0.00 179.01 177.03 2jig h LYS 69 N 0.34 0.38 0.06 2.33 3.64 -0.87 -3.35 116.57 119.10 2jig h LYS 69 Ca 0.08 -0.38 -0.25 0.00 -1.27 0.00 0.00 60.65 58.84 2jig h LYS 69 Cb 0.14 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 2jig h LYS 69 CO -0.00 1.04 -1.22 0.00 -2.27 0.00 0.00 179.45 177.00 2jig h ALA 70 N 0.83 0.29 -0.35 5.00 0.00 -0.39 -3.38 119.26 121.26 2jig h ALA 70 Ca -0.06 -0.98 0.04 0.00 0.00 0.00 0.00 54.91 53.91 2jig h ALA 70 Cb 1.49 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 19.23 2jig h ALA 70 CO 0.15 1.17 -0.40 0.00 0.00 0.00 0.00 179.25 180.17 2jig h ARG 71 N 0.03 -0.23 0.00 0.00 3.08 -1.25 -1.08 114.38 114.93 2jig h ARG 71 Ca -0.11 0.02 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 2jig h ARG 71 Cb 1.89 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 32.00 2jig h ARG 71 CO 0.15 -0.15 -0.01 -1.00 -1.07 0.00 0.00 179.97 177.89 2jig h PRO 72 N -0.24 0.00 0.00 0.04 0.13 -1.78 -1.05 132.00 129.10 2jig h PRO 72 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 2jig h PRO 72 Cb 0.40 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.53 2jig h PRO 72 CO -0.46 0.01 0.00 1.63 -0.23 0.00 0.00 178.00 178.95 2jig n LYS 73 N -3.86 0.56 -1.35 0.86 5.02 -0.44 -5.21 118.16 113.74 2jig n LYS 73 Ca -0.03 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 2jig n LYS 73 Cb 0.09 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 2jig n LYS 73 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2jig n MET 74 N -1.21 1.39 0.00 1.97 2.81 -0.40 -4.92 117.12 116.76 2jig n MET 74 Ca 0.16 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 2jig n MET 74 Cb 0.19 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.70 2jig n MET 74 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2jig n THR 94 N -0.62 0.00 -3.63 2.03 -2.24 -1.26 -5.03 114.28 103.52 2jig n THR 94 Ca 0.00 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.63 2jig n THR 94 Cb 0.00 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.16 2jig n THR 94 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2jig s SER 95 N 0.00 -0.40 -0.04 3.42 1.04 -1.26 0.25 113.70 116.71 2jig s SER 95 Ca 0.00 0.28 0.03 0.00 0.48 0.00 0.00 55.95 56.74 2jig s SER 95 Cb 0.00 0.44 -0.03 0.00 0.10 0.00 0.00 66.02 66.53 2jig s SER 95 CO 0.00 -0.59 -0.11 -0.89 0.98 0.00 0.00 173.24 172.63 2jig s THR 96 N -1.74 3.38 0.12 2.02 2.01 -0.06 -4.95 115.64 116.41 2jig s THR 96 Ca -0.10 -0.69 0.05 0.00 0.31 0.00 0.00 61.69 61.27 2jig s THR 96 Cb -0.02 -2.38 -0.04 0.00 0.01 0.00 0.00 72.50 70.07 2jig s THR 96 CO 0.04 0.53 -0.12 -0.83 -0.69 0.00 0.00 174.62 173.54 2jig s GLY 97 N -0.95 1.04 0.15 4.40 0.00 -1.26 -0.40 107.32 110.29 2jig s GLY 97 Ca 0.13 -1.32 -0.08 0.00 0.00 0.00 0.00 44.72 43.46 2jig s GLY 97 CO 0.03 -1.39 0.24 -1.08 0.00 0.00 0.00 173.10 170.90 2jig s THR 98 N -2.45 0.08 0.04 0.90 -1.32 0.06 -4.91 115.64 108.04 2jig s THR 98 Ca 0.10 -1.45 0.08 0.00 -1.21 0.00 0.00 61.69 59.22 2jig s THR 98 Cb -0.03 -1.83 -0.03 0.00 -1.51 0.00 0.00 72.50 69.10 2jig s THR 98 CO 0.02 -0.35 -0.24 0.26 -2.21 0.00 0.00 174.62 172.10 2jig s TRP 99 N -3.97 2.15 -0.22 9.09 0.52 -1.26 -0.48 118.94 124.77 2jig s TRP 99 Ca 0.17 -0.40 -0.00 0.00 0.02 0.00 0.00 56.10 55.89 2jig s TRP 99 Cb 0.04 -1.30 0.02 0.00 -1.15 0.00 0.00 33.47 31.09 2jig s TRP 99 CO -0.01 0.10 -0.13 -0.06 0.02 0.00 0.00 176.95 176.88 2jig s PHE 100 N -0.77 2.95 0.61 -1.98 0.08 -0.15 -4.98 117.98 113.73 2jig s PHE 100 Ca 0.10 -1.60 -0.19 0.00 0.12 0.00 0.00 56.93 55.36 2jig s PHE 100 Cb -0.10 -1.99 -0.03 0.00 -0.57 0.00 0.00 43.02 40.34 2jig s PHE 100 CO 0.02 -0.76 1.24 0.00 -0.10 0.00 0.00 175.22 175.62 2jig s ALA 101 N 1.30 2.51 0.24 5.36 0.00 -1.26 -1.09 121.76 128.82 2jig s ALA 101 Ca 0.02 1.09 -0.31 0.00 0.00 0.00 0.00 51.96 52.75 2jig s ALA 101 Cb -0.15 -3.49 -0.12 0.00 0.00 0.00 0.00 23.12 19.36 2jig s ALA 101 CO -0.08 -1.30 1.63 1.63 0.00 0.00 0.00 175.76 177.64 2jig n LYS 102 N -1.66 2.61 -1.10 0.00 5.02 -1.26 -3.16 118.16 118.62 2jig n LYS 102 Ca 0.14 0.94 -0.03 0.00 -2.02 0.00 0.00 58.31 57.33 2jig n LYS 102 Cb 0.49 -2.73 -0.01 0.00 -0.02 0.00 0.00 35.03 32.75 2jig n LYS 102 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jig n GLY 103 N 3.06 0.58 0.22 0.72 0.00 -1.26 -4.90 105.19 103.61 2jig n GLY 103 Ca 0.13 -0.25 0.11 0.00 0.00 0.00 0.00 46.02 46.02 2jig n GLY 103 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jig n GLU 104 N -1.87 0.60 -3.76 1.61 1.02 -1.19 -4.85 120.64 112.19 2jig n GLU 104 Ca -0.03 -0.44 -0.14 0.00 -0.02 0.00 0.00 57.16 56.52 2jig n GLU 104 Cb 0.24 -1.49 -0.15 0.00 -0.02 0.00 0.00 31.44 30.01 2jig n GLU 104 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2jig s ASP 105 N -2.71 0.00 0.30 1.62 -1.08 -1.26 -5.06 116.67 108.48 2jig s ASP 105 Ca 0.16 0.13 0.06 0.00 -0.52 0.00 0.00 52.55 52.38 2jig s ASP 105 Cb 0.18 0.03 0.46 0.00 -1.46 0.00 0.00 42.92 42.12 2jig s ASP 105 CO 0.66 -0.13 1.71 0.77 0.52 0.00 0.00 175.17 178.69 2jig h SER 106 N 7.26 0.28 0.01 -0.34 4.64 -1.99 0.86 113.55 124.27 2jig h SER 106 Ca -0.45 -0.11 -0.00 0.00 -0.47 0.00 0.00 61.79 60.76 2jig h SER 106 Cb 1.13 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2jig h SER 106 CO 0.46 0.64 -0.01 0.58 -0.87 0.00 0.00 176.83 177.64 2jig h VAL 107 N 0.23 1.19 -0.39 0.95 2.07 -2.00 -2.71 116.25 115.59 2jig h VAL 107 Ca 0.02 -0.61 -0.11 0.00 0.82 0.00 0.00 66.70 66.83 2jig h VAL 107 Cb 0.78 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 2jig h VAL 107 CO 0.06 0.16 -0.19 0.40 0.02 0.00 0.00 177.57 178.02 2jig h ILE 108 N -0.27 1.27 -0.99 4.57 2.04 -1.93 -2.58 117.51 119.60 2jig h ILE 108 Ca -0.00 -1.27 0.04 0.00 1.00 0.00 0.00 64.86 64.62 2jig h ILE 108 Cb 0.27 1.17 -0.06 0.00 -0.74 0.00 0.00 36.82 37.46 2jig h ILE 108 CO 0.00 0.43 0.65 0.28 0.00 0.00 0.00 178.15 179.51 2jig h SER 109 N 0.66 1.08 -0.61 1.72 0.02 -0.83 0.36 113.55 115.95 2jig h SER 109 Ca 0.10 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2jig h SER 109 Cb 0.68 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 2jig h SER 109 CO 0.05 0.74 0.40 0.50 -1.14 0.00 0.00 176.83 177.37 2jig h LYS 110 N 1.25 0.81 -0.64 3.45 3.64 -1.14 -1.35 116.57 122.61 2jig h LYS 110 Ca 0.40 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.68 2jig h LYS 110 Cb 0.01 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 31.62 2jig h LYS 110 CO -0.12 0.55 0.22 0.82 -2.27 0.00 0.00 179.45 178.65 2jig h ILE 111 N 0.83 1.24 -0.47 2.00 2.04 -0.75 -2.08 117.51 120.32 2jig h ILE 111 Ca 0.22 -0.80 0.03 0.00 1.00 0.00 0.00 64.86 65.32 2jig h ILE 111 Cb -0.08 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 2jig h ILE 111 CO -0.05 0.31 0.26 -0.33 0.00 0.00 0.00 178.15 178.34 2jig h GLU 112 N 0.90 0.50 -0.81 2.37 5.08 0.03 -1.59 114.58 121.06 2jig h GLU 112 Ca 0.21 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 2jig h GLU 112 Cb 0.25 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 2jig h GLU 112 CO -0.01 0.33 0.43 0.87 -1.00 0.00 0.00 179.01 179.63 2jig h LYS 113 N 0.52 1.13 -0.55 2.33 1.57 -1.05 -2.15 116.57 118.38 2jig h LYS 113 Ca 0.20 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 2jig h LYS 113 Cb 0.07 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.13 2jig h LYS 113 CO -0.12 0.84 0.30 -0.09 -0.57 0.00 0.00 179.45 179.81 2jig h ARG 114 N 1.14 0.76 -0.75 3.15 2.43 -0.89 -0.65 114.38 119.57 2jig h ARG 114 Ca 0.28 -0.09 -0.03 0.00 -0.81 0.00 0.00 59.98 59.34 2jig h ARG 114 Cb 0.04 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.41 2jig h ARG 114 CO -0.04 0.59 0.36 0.28 -1.51 0.00 0.00 179.97 179.65 2jig h VAL 115 N 0.73 1.24 -0.53 0.20 2.07 -1.07 -0.78 116.25 118.11 2jig h VAL 115 Ca 0.19 -0.67 -0.05 0.00 0.82 0.00 0.00 66.70 67.00 2jig h VAL 115 Cb 0.05 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 2jig h VAL 115 CO -0.03 0.28 0.14 0.00 0.02 0.00 0.00 177.57 177.99 2jig h ALA 116 N 1.33 0.70 0.15 1.67 0.00 -0.96 -2.17 119.26 119.98 2jig h ALA 116 Ca 0.26 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2jig h ALA 116 Cb 0.11 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2jig h ALA 116 CO -0.03 0.39 -0.07 1.96 0.00 0.00 0.00 179.25 181.49 2jig h GLN 117 N 0.75 -0.19 -0.02 0.00 1.08 -0.48 0.22 115.11 116.46 2jig h GLN 117 Ca 0.17 0.01 -0.09 0.00 -1.45 0.00 0.00 58.65 57.29 2jig h GLN 117 Cb 0.32 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.78 2jig h GLN 117 CO -0.00 -0.04 -0.42 -0.39 -0.95 0.00 0.00 178.83 177.03 2jig h VAL 118 N -0.31 1.31 0.00 -0.54 -1.51 -1.13 -2.90 116.25 111.16 2jig h VAL 118 Ca -0.02 -1.47 0.00 0.00 -1.23 0.00 0.00 66.70 63.98 2jig h VAL 118 Cb 0.25 1.76 0.00 0.00 -2.13 0.00 0.00 31.29 31.17 2jig h VAL 118 CO 0.03 0.42 -0.78 0.71 -1.23 0.00 0.00 177.57 176.72 2jig h THR 119 N 0.04 0.00 -3.61 7.19 1.35 -1.35 -3.48 112.91 113.05 2jig h THR 119 Ca 0.00 -0.58 -0.40 0.00 -0.55 0.00 0.00 66.41 64.88 2jig h THR 119 Cb 0.76 1.08 0.01 0.00 -1.73 0.00 0.00 68.15 68.27 2jig h THR 119 CO 0.06 0.00 -0.55 0.23 -0.25 0.00 0.00 175.52 175.01 2jig n MET 120 N -2.19 -2.83 -4.91 4.72 0.00 0.76 -4.99 117.12 107.67 2jig n MET 120 Ca 0.02 0.94 -0.30 0.00 0.00 0.00 0.00 57.70 58.37 2jig n MET 120 Cb 0.46 -5.67 -0.17 0.00 0.00 0.00 0.00 33.22 27.84 2jig n MET 120 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 2jig s ILE 121 N -3.06 1.74 0.69 2.02 1.01 -1.11 -5.04 121.20 117.45 2jig s ILE 121 Ca 0.11 -0.82 -0.14 0.00 0.00 0.00 0.00 60.65 59.79 2jig s ILE 121 Cb -0.05 -1.53 0.02 0.00 0.01 0.00 0.00 42.46 40.91 2jig s ILE 121 CO 0.14 0.49 1.12 -2.16 0.00 0.00 0.00 174.94 174.53 2jig s PRO 122 N 0.54 2.58 0.55 2.79 0.04 -1.26 -4.53 135.00 135.71 2jig s PRO 122 Ca -0.15 1.43 0.22 0.00 0.04 0.00 0.00 61.00 62.54 2jig s PRO 122 Cb -0.17 -1.92 1.49 0.00 0.04 0.00 0.00 34.50 33.94 2jig s PRO 122 CO 0.05 -1.43 2.16 -0.07 0.04 0.00 0.00 177.00 177.76 2jig h LEU 123 N -0.20 0.00 -2.54 -3.56 3.38 -1.94 -1.61 115.31 108.84 2jig h LEU 123 Ca -0.46 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.50 2jig h LEU 123 Cb 1.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 2jig h LEU 123 CO 0.53 0.00 -0.02 1.05 0.09 0.00 0.00 178.44 180.09 2jig h GLU 124 N 0.00 0.00 -0.00 1.13 9.09 -1.96 -1.01 114.58 121.83 2jig h GLU 124 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.44 2jig h GLU 124 Cb 0.16 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.26 2jig h GLU 124 CO -0.00 0.02 -0.12 0.09 0.05 0.00 0.00 179.01 179.05 2jig n ASN 125 N -3.27 0.18 -4.85 3.06 4.13 -0.61 -1.30 115.26 112.59 2jig n ASN 125 Ca -0.02 0.08 -0.36 0.00 1.68 0.00 0.00 54.58 55.97 2jig n ASN 125 Cb 0.13 -0.25 -0.06 0.00 -1.54 0.00 0.00 39.78 38.06 2jig n ASN 125 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 2jig s HIS 126 N -2.85 3.63 1.06 3.10 3.76 -0.39 -0.35 115.29 123.25 2jig s HIS 126 Ca 0.18 0.92 -0.18 0.00 -0.15 0.00 0.00 55.06 55.83 2jig s HIS 126 Cb 0.19 -2.25 0.24 0.00 1.11 0.00 0.00 32.58 31.87 2jig s HIS 126 CO 0.55 0.52 1.25 -1.21 -0.85 0.00 0.00 174.74 175.00 2jig s GLU 127 N -1.73 -0.14 1.16 1.40 2.02 0.05 -4.91 118.70 116.54 2jig s GLU 127 Ca 0.32 -0.31 -0.19 0.00 0.02 0.00 0.00 54.97 54.81 2jig s GLU 127 Cb -0.15 -1.75 0.29 0.00 0.10 0.00 0.00 34.13 32.63 2jig s GLU 127 CO 0.17 -2.95 0.90 0.41 0.02 0.00 0.00 175.26 173.81 2jig n GLY 128 N -2.72 -3.15 3.56 -1.39 0.00 -1.26 -4.76 105.19 95.47 2jig n GLY 128 Ca 0.15 -1.42 -0.41 0.00 0.00 0.00 0.00 46.02 44.33 2jig n GLY 128 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jig s LEU 129 N 0.00 4.30 -0.07 0.99 2.96 -0.25 -4.50 118.68 122.11 2jig s LEU 129 Ca 0.62 0.07 -0.24 0.00 -0.22 0.00 0.00 54.13 54.36 2jig s LEU 129 Cb -0.08 -2.68 -0.04 0.00 0.50 0.00 0.00 46.19 43.90 2jig s LEU 129 CO 0.49 -0.53 0.71 -1.58 -1.32 0.00 0.00 176.35 174.12 2jig s GLN 130 N 2.53 4.43 -0.12 1.98 0.74 -0.72 -0.98 119.66 127.54 2jig s GLN 130 Ca 0.21 0.90 0.02 0.00 0.05 0.00 0.00 55.36 56.54 2jig s GLN 130 Cb -0.15 -3.45 -0.01 0.00 1.10 0.00 0.00 33.01 30.50 2jig s GLN 130 CO 0.14 0.04 -0.18 0.08 -0.55 0.00 0.00 175.29 174.82 2jig s VAL 131 N 0.86 2.54 -0.02 1.34 1.01 0.37 0.51 120.40 127.01 2jig s VAL 131 Ca 0.38 -0.84 0.07 0.00 0.00 0.00 0.00 61.98 61.59 2jig s VAL 131 Cb -0.18 -2.03 -0.02 0.00 0.00 0.00 0.00 36.38 34.16 2jig s VAL 131 CO 0.18 0.54 -0.24 -0.76 0.00 0.00 0.00 175.10 174.82 2jig s LEU 132 N 0.40 2.05 -0.18 3.92 1.43 -0.08 -0.76 118.68 125.45 2jig s LEU 132 Ca -0.14 -0.43 -0.00 0.00 -1.03 0.00 0.00 54.13 52.52 2jig s LEU 132 Cb -0.17 -1.23 0.01 0.00 0.03 0.00 0.00 46.19 44.83 2jig s LEU 132 CO 0.07 0.29 -0.15 -2.28 0.23 0.00 0.00 176.35 174.51 2jig s HIS 133 N -0.56 2.82 0.03 0.29 5.65 0.46 -1.82 115.29 122.16 2jig s HIS 133 Ca 0.09 -1.33 -0.21 0.00 0.25 0.00 0.00 55.06 53.87 2jig s HIS 133 Cb -0.09 -1.96 -0.06 0.00 -1.18 0.00 0.00 32.58 29.29 2jig s HIS 133 CO -0.01 -0.66 0.61 0.71 -0.65 0.00 0.00 174.74 174.74 2jig s TYR 134 N 1.22 3.74 0.02 3.88 1.51 -0.24 -0.89 117.35 126.59 2jig s TYR 134 Ca 0.02 1.27 -0.04 0.00 -1.01 0.00 0.00 57.07 57.31 2jig s TYR 134 Cb -0.14 -2.60 -0.01 0.00 -0.11 0.00 0.00 41.96 39.10 2jig s TYR 134 CO -0.07 0.43 -0.08 0.72 -1.11 0.00 0.00 175.55 175.44 2jig n HIS 135 N 2.36 0.00 0.00 2.71 8.25 0.14 -4.44 115.22 124.24 2jig n HIS 135 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 2jig n HIS 135 Cb 0.51 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.51 2jig n HIS 135 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 2jig n GLN 138 N -3.52 0.00 -4.20 -0.41 -0.06 -1.26 -4.94 117.38 102.99 2jig n GLN 138 Ca -0.03 0.00 -0.17 0.00 -2.00 0.00 0.00 57.00 54.80 2jig n GLN 138 Cb 0.11 0.00 -0.11 0.00 -4.06 0.00 0.00 30.24 26.18 2jig n GLN 138 CO 0.00 0.00 0.00 0.15 -0.20 0.00 0.00 177.06 177.01 2jig s LYS 139 N -5.03 0.91 -0.16 3.69 1.02 -1.26 -4.40 119.74 114.50 2jig s LYS 139 Ca 0.00 -1.14 -0.29 0.00 0.02 0.00 0.00 55.97 54.56 2jig s LYS 139 Cb 0.00 -0.76 -0.04 0.00 -0.52 0.00 0.00 37.83 36.51 2jig s LYS 139 CO 0.00 0.15 1.66 -0.47 -0.92 0.00 0.00 175.35 175.76 2jig s TYR 140 N -2.01 2.01 -0.37 3.18 5.04 -1.24 -4.81 117.35 119.14 2jig s TYR 140 Ca 0.05 0.42 0.01 0.00 -2.44 0.00 0.00 57.07 55.11 2jig s TYR 140 Cb -0.06 -3.95 0.14 0.00 0.35 0.00 0.00 41.96 38.44 2jig s TYR 140 CO 0.02 -3.31 0.22 -1.21 -1.34 0.00 0.00 175.55 169.93 2jig s GLU 141 N 4.54 0.75 0.36 4.97 2.02 -1.26 -5.02 118.70 125.06 2jig s GLU 141 Ca 0.74 -1.50 -0.28 0.00 0.02 0.00 0.00 54.97 53.94 2jig s GLU 141 Cb -0.28 -1.59 -0.10 0.00 0.10 0.00 0.00 34.13 32.26 2jig s GLU 141 CO 0.30 -1.19 1.34 -1.25 0.02 0.00 0.00 175.26 174.47 2jig s PRO 142 N 0.89 4.22 0.23 0.39 0.04 -1.26 -4.64 135.00 134.88 2jig s PRO 142 Ca 0.18 2.26 -0.14 0.00 0.04 0.00 0.00 61.00 63.34 2jig s PRO 142 Cb -0.23 -2.98 0.00 0.00 0.04 0.00 0.00 34.50 31.33 2jig s PRO 142 CO 0.00 -0.32 0.48 -3.38 0.04 0.00 0.00 177.00 173.83 2jig s HIS 143 N -1.17 0.24 -0.03 0.56 -3.43 0.42 -4.91 115.29 106.98 2jig s HIS 143 Ca 0.51 -0.61 -0.01 0.00 -0.80 0.00 0.00 55.06 54.16 2jig s HIS 143 Cb -0.40 0.24 -0.04 0.00 -1.43 0.00 0.00 32.58 30.94 2jig s HIS 143 CO 0.54 -0.97 0.04 0.71 -2.00 0.00 0.00 174.74 173.06 2jig s TYR 144 N -3.98 3.22 -0.22 0.38 2.02 -1.26 -1.76 117.35 115.74 2jig s TYR 144 Ca 0.19 0.19 0.19 0.00 -0.37 0.00 0.00 57.07 57.26 2jig s TYR 144 Cb -0.01 -1.74 0.05 0.00 -0.40 0.00 0.00 41.96 39.86 2jig s TYR 144 CO 0.06 0.52 1.24 -0.44 -1.57 0.00 0.00 175.55 175.35 2jig h ASP 145 N 4.45 0.00 -4.27 2.29 5.19 -1.96 -3.46 116.42 118.67 2jig h ASP 145 Ca -0.50 0.00 -0.52 0.00 -0.62 0.00 0.00 57.03 55.40 2jig h ASP 145 Cb 1.19 0.00 0.14 0.00 0.18 0.00 0.00 39.33 40.83 2jig h ASP 145 CO 0.59 0.32 0.32 -0.72 -3.12 0.00 0.00 179.24 176.63 2jig s TYR 146 N -3.08 2.39 -0.11 4.55 -0.85 -1.26 -4.76 117.35 114.23 2jig s TYR 146 Ca 0.02 1.60 -0.21 0.00 -0.52 0.00 0.00 57.07 57.95 2jig s TYR 146 Cb 0.08 -3.15 -0.04 0.00 0.38 0.00 0.00 41.96 39.23 2jig s TYR 146 CO 0.76 -2.00 0.62 -0.06 -1.52 0.00 0.00 175.55 173.35 2jig s PHE 147 N -2.67 3.51 0.20 -3.49 0.08 -1.26 -4.96 117.98 109.39 2jig s PHE 147 Ca 0.64 1.08 0.10 0.00 0.12 0.00 0.00 56.93 58.87 2jig s PHE 147 Cb -0.20 -2.73 0.17 0.00 -0.57 0.00 0.00 43.02 39.69 2jig s PHE 147 CO 0.52 0.05 1.50 0.45 -0.10 0.00 0.00 175.22 177.65 2jig h HIS 148 N 6.90 0.00 -3.70 0.36 3.86 -1.94 -3.42 115.15 117.21 2jig h HIS 148 Ca -0.39 0.00 -0.66 0.00 -1.16 0.00 0.00 60.37 58.17 2jig h HIS 148 Cb 1.18 0.00 -0.17 0.00 1.06 0.00 0.00 27.41 29.48 2jig h HIS 148 CO 0.65 0.73 -0.32 0.34 0.86 0.00 0.00 177.93 180.19 2jig s ASP 149 N -6.77 6.16 0.57 2.45 -1.08 -1.26 -4.95 116.67 111.79 2jig s ASP 149 Ca -0.00 -0.15 0.27 0.00 -0.52 0.00 0.00 52.55 52.15 2jig s ASP 149 Cb 0.12 -2.18 1.55 0.00 -1.46 0.00 0.00 42.92 40.94 2jig s ASP 149 CO 0.78 -0.27 2.07 -0.65 0.52 0.00 0.00 175.17 177.62 2jig h PRO 150 N 8.41 0.00 -0.00 4.34 0.11 -1.97 0.26 132.00 143.15 2jig h PRO 150 Ca -0.31 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.76 2jig h PRO 150 Cb 1.15 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2jig h PRO 150 CO 0.66 0.00 -0.18 0.28 -0.21 0.00 0.00 178.00 178.55 2jig h VAL 151 N 0.00 1.13 0.00 3.15 2.07 -1.96 -0.92 116.25 119.72 2jig h VAL 151 Ca 0.12 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 67.00 2jig h VAL 151 Cb 0.58 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.69 2jig h VAL 151 CO -0.00 0.18 0.00 0.59 0.02 0.00 0.00 177.57 178.36 2jig n ASN 152 N -4.32 0.36 -1.42 0.57 3.02 0.08 -3.33 115.26 110.21 2jig n ASN 152 Ca -0.02 0.54 -0.11 0.00 -0.03 0.00 0.00 54.58 54.96 2jig n ASN 152 Cb 0.25 -0.63 0.16 0.00 -0.61 0.00 0.00 39.78 38.95 2jig n ASN 152 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jig n ALA 153 N -1.63 4.65 -1.53 5.41 0.00 -0.36 -4.83 120.51 122.22 2jig n ALA 153 Ca 0.06 -3.29 -0.29 0.00 0.00 0.00 0.00 53.44 49.93 2jig n ALA 153 Cb 0.36 -0.78 0.15 0.00 0.00 0.00 0.00 19.45 19.18 2jig n ALA 153 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2jig s GLY 154 N -2.63 1.59 0.36 0.00 0.00 -1.14 -3.88 107.32 101.62 2jig s GLY 154 Ca 0.48 -0.60 0.11 0.00 0.00 0.00 0.00 44.72 44.71 2jig s GLY 154 CO 0.00 -0.00 1.84 -0.56 0.00 0.00 0.00 173.10 174.38 2jig h PRO 155 N -1.58 0.61 -0.08 2.90 0.13 -1.93 -1.11 132.00 130.94 2jig h PRO 155 Ca -0.50 -0.04 0.02 0.00 -0.87 0.00 0.00 66.00 64.61 2jig h PRO 155 Cb 1.32 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 2jig h PRO 155 CO 0.59 0.40 0.06 0.93 -0.23 0.00 0.00 178.00 179.74 2jig h GLU 156 N 0.63 0.04 -0.02 0.86 5.08 -1.90 -1.55 114.58 117.72 2jig h GLU 156 Ca 0.49 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.84 2jig h GLU 156 Cb 0.90 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.14 2jig h GLU 156 CO -0.24 0.02 -0.06 0.72 -1.00 0.00 0.00 179.01 178.46 2jig n HIS 157 N -4.52 0.00 -0.60 4.33 8.25 -0.54 -1.47 115.22 120.66 2jig n HIS 157 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2jig n HIS 157 Cb 0.14 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.24 2jig n HIS 157 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jig n GLY 158 N 1.28 0.69 7.00 -1.41 0.00 -0.58 -4.69 105.19 107.48 2jig n GLY 158 Ca 0.16 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.58 2jig n GLY 158 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jig n GLY 159 N -2.42 0.37 3.72 -0.02 0.00 -0.53 -1.57 105.19 104.73 2jig n GLY 159 Ca 0.00 -0.94 -0.34 0.00 0.00 0.00 0.00 46.02 44.74 2jig n GLY 159 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jig s GLN 160 N 0.00 2.01 0.18 1.61 -1.52 -1.25 -4.68 119.66 116.01 2jig s GLN 160 Ca 0.00 1.77 -0.30 0.00 -1.95 0.00 0.00 55.36 54.88 2jig s GLN 160 Cb 0.00 -1.82 -0.08 0.00 -0.22 0.00 0.00 33.01 30.90 2jig s GLN 160 CO 0.00 -1.94 1.15 1.03 -0.25 0.00 0.00 175.29 175.29 2jig s ARG 161 N -3.96 4.53 -0.06 2.91 0.52 -1.26 -1.59 118.95 120.04 2jig s ARG 161 Ca 0.74 1.80 0.01 0.00 -0.52 0.00 0.00 55.73 57.77 2jig s ARG 161 Cb -0.29 -3.26 -0.05 0.00 0.52 0.00 0.00 34.95 31.87 2jig s ARG 161 CO 0.47 -0.02 -0.04 1.55 0.02 0.00 0.00 175.30 177.28 2jig n VAL 162 N 2.49 0.35 -4.57 3.52 3.14 0.40 -4.53 118.33 119.14 2jig n VAL 162 Ca 0.04 -0.15 -0.22 0.00 -2.96 0.00 0.00 64.34 61.04 2jig n VAL 162 Cb 0.45 -0.76 -0.15 0.00 -1.06 0.00 0.00 33.84 32.32 2jig n VAL 162 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 2jig s VAL 163 N -2.12 1.03 -0.15 1.55 1.01 -0.97 -0.59 120.40 120.16 2jig s VAL 163 Ca -0.07 -0.52 -0.01 0.00 0.00 0.00 0.00 61.98 61.38 2jig s VAL 163 Cb 0.02 -0.88 -0.01 0.00 0.00 0.00 0.00 36.38 35.51 2jig s VAL 163 CO 0.16 0.30 -0.12 -0.89 0.00 0.00 0.00 175.10 174.55 2jig s THR 164 N -0.05 3.07 -0.25 3.92 2.01 -0.65 -0.85 115.64 122.84 2jig s THR 164 Ca 0.00 -0.64 -0.06 0.00 0.31 0.00 0.00 61.69 61.30 2jig s THR 164 Cb -0.08 -2.31 -0.01 0.00 0.01 0.00 0.00 72.50 70.11 2jig s THR 164 CO 0.00 0.51 0.03 -0.04 -0.69 0.00 0.00 174.62 174.44 2jig s MET 165 N 0.55 3.41 -0.31 4.92 -1.94 0.06 -1.66 119.30 124.33 2jig s MET 165 Ca -0.08 -0.63 -0.06 0.00 -1.71 0.00 0.00 55.69 53.22 2jig s MET 165 Cb -0.15 -3.22 0.03 0.00 2.01 0.00 0.00 34.83 33.49 2jig s MET 165 CO 0.04 -0.26 0.07 -1.17 -0.01 0.00 0.00 175.02 173.69 2jig s LEU 166 N 1.53 3.99 -0.30 -0.03 2.96 0.68 -0.18 118.68 127.34 2jig s LEU 166 Ca 0.05 -0.95 -0.11 0.00 -0.22 0.00 0.00 54.13 52.90 2jig s LEU 166 Cb -0.15 -1.84 -0.03 0.00 0.50 0.00 0.00 46.19 44.66 2jig s LEU 166 CO 0.01 -0.25 0.19 -0.04 -1.32 0.00 0.00 176.35 174.94 2jig s MET 167 N 1.42 3.73 -0.28 1.98 -1.94 0.11 -0.71 119.30 123.61 2jig s MET 167 Ca -0.00 -0.47 -0.29 0.00 -1.71 0.00 0.00 55.69 53.22 2jig s MET 167 Cb -0.18 -3.66 0.01 0.00 2.01 0.00 0.00 34.83 33.01 2jig s MET 167 CO 0.02 -0.28 1.05 0.71 -0.01 0.00 0.00 175.02 176.51 2jig s TYR 168 N 1.72 3.22 -0.87 -0.03 2.02 -0.49 -0.47 117.35 122.46 2jig s TYR 168 Ca 0.06 1.29 0.24 0.00 -0.37 0.00 0.00 57.07 58.30 2jig s TYR 168 Cb -0.16 -3.52 0.34 0.00 -0.40 0.00 0.00 41.96 38.22 2jig s TYR 168 CO 0.10 -0.65 1.29 1.28 -1.57 0.00 0.00 175.55 176.00 2jig n LEU 169 N 6.64 0.59 -4.01 -1.29 4.77 0.31 -0.61 117.00 123.40 2jig n LEU 169 Ca 0.12 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 56.02 2jig n LEU 169 Cb 0.47 -0.19 -0.10 0.00 -2.33 0.00 0.00 43.42 41.27 2jig n LEU 169 CO 0.56 0.09 -0.29 0.42 -1.33 0.00 0.00 177.39 176.84 2jig s THR 170 N -3.07 0.18 -0.09 -5.08 -4.23 -1.19 -4.69 115.64 97.47 2jig s THR 170 Ca 0.09 -1.48 -0.20 0.00 -1.18 0.00 0.00 61.69 58.92 2jig s THR 170 Cb 0.16 -1.24 -0.04 0.00 1.34 0.00 0.00 72.50 72.72 2jig s THR 170 CO 0.73 -0.82 0.55 -0.89 -0.54 0.00 0.00 174.62 173.65 2jig s THR 171 N -3.41 5.12 -0.21 3.99 2.01 -1.26 -3.38 115.64 118.50 2jig s THR 171 Ca 0.02 1.11 -0.04 0.00 0.31 0.00 0.00 61.69 63.09 2jig s THR 171 Cb 0.04 -3.88 -0.01 0.00 0.01 0.00 0.00 72.50 68.65 2jig s THR 171 CO -0.08 0.33 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.43 2jig s VAL 172 N 0.52 3.40 0.13 3.82 1.01 -0.27 -4.63 120.40 124.38 2jig s VAL 172 Ca 0.29 -0.49 -0.15 0.00 0.00 0.00 0.00 61.98 61.63 2jig s VAL 172 Cb -0.16 -2.53 -0.01 0.00 0.00 0.00 0.00 36.38 33.67 2jig s VAL 172 CO 0.13 0.44 1.62 -0.08 0.00 0.00 0.00 175.10 177.21 2jig h GLU 173 N 7.86 0.64 -3.40 2.72 4.81 -1.75 -3.44 114.58 122.02 2jig h GLU 173 Ca -0.39 -0.16 -0.25 0.00 -0.13 0.00 0.00 59.36 58.42 2jig h GLU 173 Cb 1.17 -0.08 -0.31 0.00 0.63 0.00 0.00 28.75 30.15 2jig h GLU 173 CO 0.60 0.67 -0.65 -2.00 -0.73 0.00 0.00 179.01 176.91 2jig s GLU 174 N -5.26 0.05 1.97 1.92 2.12 -0.61 -4.96 118.70 113.93 2jig s GLU 174 Ca -0.13 0.26 0.00 0.00 0.36 0.00 0.00 54.97 55.46 2jig s GLU 174 Cb 0.10 -0.16 0.00 0.00 0.26 0.00 0.00 34.13 34.33 2jig s GLU 174 CO 0.77 -0.13 0.00 0.41 -0.54 0.00 0.00 175.26 175.77 2jig n GLY 175 N 3.95 -1.10 3.00 -1.50 0.00 -1.26 -0.63 105.19 107.65 2jig n GLY 175 Ca -0.24 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.57 2jig n GLY 175 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jig n GLY 176 N 0.00 0.70 3.76 -0.02 0.00 -0.84 -4.72 105.19 104.06 2jig n GLY 176 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2jig n GLY 176 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jig s GLU 177 N -0.27 3.26 -0.11 1.61 8.01 -1.26 -4.43 118.70 125.51 2jig s GLU 177 Ca 0.00 1.89 -0.28 0.00 0.01 0.00 0.00 54.97 56.59 2jig s GLU 177 Cb 0.00 -2.15 -0.02 0.00 -4.31 0.00 0.00 34.13 27.66 2jig s GLU 177 CO 0.00 -0.99 0.94 0.99 0.01 0.00 0.00 175.26 176.20 2jig s THR 178 N -1.52 4.83 -0.05 3.63 2.01 -0.78 -0.31 115.64 123.46 2jig s THR 178 Ca 0.72 1.90 0.05 0.00 0.31 0.00 0.00 61.69 64.66 2jig s THR 178 Cb -0.32 -4.25 -0.02 0.00 0.01 0.00 0.00 72.50 67.92 2jig s THR 178 CO 0.36 0.04 -0.18 0.54 -0.69 0.00 0.00 174.62 174.69 2jig s VAL 179 N 1.90 2.69 -0.45 3.82 0.11 -0.42 0.09 120.40 128.14 2jig s VAL 179 Ca 0.45 -0.86 0.03 0.00 -2.93 0.00 0.00 61.98 58.68 2jig s VAL 179 Cb -0.18 -2.03 0.12 0.00 -1.53 0.00 0.00 36.38 32.77 2jig s VAL 179 CO 0.17 0.58 0.20 -0.76 -3.33 0.00 0.00 175.10 171.96 2jig s LEU 180 N -0.55 4.02 0.30 2.54 1.02 0.24 -2.07 118.68 124.19 2jig s LEU 180 Ca 0.08 -2.67 0.25 0.00 0.02 0.00 0.00 54.13 51.81 2jig s LEU 180 Cb -0.11 -1.49 1.00 0.00 0.02 0.00 0.00 46.19 45.61 2jig s LEU 180 CO 0.01 -0.28 1.76 1.55 0.02 0.00 0.00 176.35 179.41 2jig h PRO 181 N 6.89 0.00 -0.41 1.29 0.13 -1.80 -2.07 132.00 136.03 2jig h PRO 181 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2jig h PRO 181 Cb 0.93 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.06 2jig h PRO 181 CO 0.60 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.46 2jig n ASN 182 N -2.40 3.43 -4.81 1.44 3.02 -1.26 -4.75 115.26 109.94 2jig n ASN 182 Ca 0.02 -1.97 -0.33 0.00 -0.03 0.00 0.00 54.58 52.28 2jig n ASN 182 Cb 0.28 -0.27 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 2jig n ASN 182 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jig s ALA 183 N -1.35 2.79 0.14 5.41 0.00 -1.03 -4.67 121.76 123.06 2jig s ALA 183 Ca 0.38 0.39 -0.14 0.00 0.00 0.00 0.00 51.96 52.59 2jig s ALA 183 Cb 0.22 -3.22 0.02 0.00 0.00 0.00 0.00 23.12 20.13 2jig s ALA 183 CO 0.30 -0.70 1.63 1.49 0.00 0.00 0.00 175.76 178.48 2jig h GLU 184 N 0.60 0.78 -4.48 0.00 4.81 -1.90 -3.43 114.58 110.96 2jig h GLU 184 Ca -0.47 -0.20 -0.72 0.00 -0.13 0.00 0.00 59.36 57.84 2jig h GLU 184 Cb 1.22 -0.09 -0.24 0.00 0.63 0.00 0.00 28.75 30.26 2jig h GLU 184 CO 0.58 0.78 -0.45 -0.65 -0.73 0.00 0.00 179.01 178.55 2jig s GLN 185 N -5.22 2.85 0.42 1.92 -1.52 -1.26 -5.03 119.66 111.82 2jig s GLN 185 Ca -0.13 -1.19 -0.20 0.00 -1.95 0.00 0.00 55.36 51.89 2jig s GLN 185 Cb 0.11 -3.89 -0.11 0.00 -0.22 0.00 0.00 33.01 28.91 2jig s GLN 185 CO 0.79 -0.83 0.93 0.15 -0.25 0.00 0.00 175.29 176.08 2jig s LYS 186 N 1.58 4.19 0.55 2.91 1.02 -1.26 -3.41 119.74 125.32 2jig s LYS 186 Ca 0.03 1.06 -0.16 0.00 0.02 0.00 0.00 55.97 56.92 2jig s LYS 186 Cb -0.21 -2.21 -0.06 0.00 -0.52 0.00 0.00 37.83 34.83 2jig s LYS 186 CO 0.07 -0.02 1.01 0.14 -0.92 0.00 0.00 175.35 175.62 2jig s VAL 187 N -2.18 4.38 0.11 3.17 -7.23 0.03 -4.85 120.40 113.83 2jig s VAL 187 Ca 0.61 1.08 -0.14 0.00 -1.81 0.00 0.00 61.98 61.72 2jig s VAL 187 Cb -0.09 -3.65 0.02 0.00 0.56 0.00 0.00 36.38 33.22 2jig s VAL 187 CO 0.15 -0.71 0.34 0.28 -0.31 0.00 0.00 175.10 174.85 2jig s THR 188 N -2.66 0.09 0.00 5.32 -1.32 -1.26 -4.67 115.64 111.14 2jig s THR 188 Ca 0.59 -0.76 0.00 0.00 -1.21 0.00 0.00 61.69 60.32 2jig s THR 188 Cb -0.12 -1.22 0.00 0.00 -1.51 0.00 0.00 72.50 69.66 2jig s THR 188 CO 0.36 -0.42 0.00 0.61 -2.21 0.00 0.00 174.62 172.96 2jig n GLY 189 N -0.17 -1.79 3.77 6.08 0.00 -1.26 -4.92 105.19 106.90 2jig n GLY 189 Ca -0.16 -1.72 -0.37 0.00 0.00 0.00 0.00 46.02 43.77 2jig n GLY 189 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jig s ASP 190 N -4.00 5.80 0.00 1.61 2.15 -1.26 -3.68 116.67 117.29 2jig s ASP 190 Ca 0.00 2.37 0.00 0.00 0.43 0.00 0.00 52.55 55.35 2jig s ASP 190 Cb 0.00 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 40.02 2jig s ASP 190 CO 0.00 -1.18 0.00 0.61 -0.17 0.00 0.00 175.17 174.43 2jig n GLY 191 N 0.45 0.79 3.35 2.66 0.00 -1.26 -5.05 105.19 106.13 2jig n GLY 191 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 2jig n GLY 191 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2jig s TRP 192 N -2.53 2.67 0.71 1.61 0.52 -1.24 -4.92 118.94 115.77 2jig s TRP 192 Ca 0.00 -0.62 -0.14 0.00 0.02 0.00 0.00 56.10 55.36 2jig s TRP 192 Cb 0.00 -1.73 0.03 0.00 -1.15 0.00 0.00 33.47 30.62 2jig s TRP 192 CO 0.00 -0.16 1.14 -1.54 0.02 0.00 0.00 176.95 176.41 2jig s SER 193 N 0.02 4.57 0.48 2.95 1.04 -1.26 -4.86 113.70 116.64 2jig s SER 193 Ca -0.06 2.11 0.16 0.00 0.48 0.00 0.00 55.95 58.64 2jig s SER 193 Cb -0.15 -2.56 1.15 0.00 0.10 0.00 0.00 66.02 64.56 2jig s SER 193 CO 0.05 -2.00 2.06 -0.33 0.98 0.00 0.00 173.24 174.00 2jig h GLU 194 N -0.35 0.00 -0.75 4.02 4.39 -1.99 0.10 114.58 120.00 2jig h GLU 194 Ca -0.46 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.23 2jig h GLU 194 Cb 1.26 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.88 2jig h GLU 194 CO 0.51 0.11 0.46 0.00 -1.16 0.00 0.00 179.01 178.93 2jig h ALA 196 N 1.24 1.40 0.00 0.00 0.00 -1.17 -2.41 119.26 118.32 2jig h ALA 196 Ca 0.27 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2jig h ALA 196 Cb -0.05 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.59 2jig h ALA 196 CO -0.05 0.43 0.00 1.63 0.00 0.00 0.00 179.25 181.25 2jig n LYS 197 N -4.30 0.01 0.32 0.00 5.02 -0.76 -1.99 118.16 116.44 2jig n LYS 197 Ca 0.02 0.27 0.19 0.00 -2.02 0.00 0.00 58.31 56.78 2jig n LYS 197 Cb 0.22 -1.50 1.05 0.00 -0.02 0.00 0.00 35.03 34.79 2jig n LYS 197 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jig h ARG 198 N 0.00 0.00 0.00 1.97 3.08 -1.49 -3.43 114.38 114.50 2jig h ARG 198 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2jig h ARG 198 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2jig h ARG 198 CO 0.00 0.01 0.00 0.41 -1.07 0.00 0.00 179.97 179.32 2jig n GLY 199 N -1.02 2.91 3.72 0.04 0.00 -0.84 -4.53 105.19 105.47 2jig n GLY 199 Ca -0.03 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 2jig n GLY 199 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jig s LEU 200 N 0.00 4.40 0.14 0.99 2.96 -0.81 -0.79 118.68 125.56 2jig s LEU 200 Ca 0.00 2.06 0.06 0.00 -0.22 0.00 0.00 54.13 56.03 2jig s LEU 200 Cb 0.00 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.06 2jig s LEU 200 CO 0.00 -0.43 -0.14 0.00 -1.32 0.00 0.00 176.35 174.46 2jig s ALA 201 N 0.75 1.61 -0.11 5.97 0.00 -1.26 0.79 121.76 129.51 2jig s ALA 201 Ca 0.57 -1.38 0.02 0.00 0.00 0.00 0.00 51.96 51.17 2jig s ALA 201 Cb -0.30 -0.08 0.01 0.00 0.00 0.00 0.00 23.12 22.76 2jig s ALA 201 CO 0.31 0.09 -0.17 0.08 0.00 0.00 0.00 175.76 176.08 2jig s VAL 202 N -2.35 1.59 0.20 0.00 1.01 0.11 -4.97 120.40 116.00 2jig s VAL 202 Ca 0.12 -0.70 -0.30 0.00 0.00 0.00 0.00 61.98 61.10 2jig s VAL 202 Cb -0.04 -1.44 -0.08 0.00 0.00 0.00 0.00 36.38 34.82 2jig s VAL 202 CO 0.04 0.46 1.09 -0.54 0.00 0.00 0.00 175.10 176.14 2jig s LYS 203 N 0.91 4.62 -0.52 2.72 -0.14 -1.26 -1.86 119.74 124.21 2jig s LYS 203 Ca -0.08 1.72 -0.27 0.00 -1.36 0.00 0.00 55.97 55.98 2jig s LYS 203 Cb -0.15 -3.26 -0.01 0.00 -1.68 0.00 0.00 37.83 32.73 2jig s LYS 203 CO -0.01 0.13 1.69 -2.14 -0.76 0.00 0.00 175.35 174.26 2jig s PRO 204 N -0.64 3.04 -0.14 -1.68 0.02 -1.26 -4.95 135.00 129.39 2jig s PRO 204 Ca 0.48 0.77 0.02 0.00 0.02 0.00 0.00 61.00 62.28 2jig s PRO 204 Cb -0.30 -4.25 0.00 0.00 0.02 0.00 0.00 34.50 29.98 2jig s PRO 204 CO 0.36 -2.23 -0.19 0.42 -0.33 0.00 0.00 177.00 175.03 2jig s ILE 205 N 7.46 2.33 -0.34 2.83 1.01 -1.26 -1.11 121.20 132.12 2jig s ILE 205 Ca 0.65 -0.89 -0.41 0.00 0.00 0.00 0.00 60.65 60.01 2jig s ILE 205 Cb -0.14 -1.95 -0.16 0.00 0.01 0.00 0.00 42.46 40.22 2jig s ILE 205 CO 0.26 0.54 1.84 1.17 0.00 0.00 0.00 174.94 178.74 2jig n LYS 206 N 4.03 0.92 0.00 2.79 4.81 -1.22 -1.45 118.16 128.05 2jig n LYS 206 Ca -0.20 0.32 0.00 0.00 -0.87 0.00 0.00 58.31 57.57 2jig n LYS 206 Cb 0.52 -2.04 0.00 0.00 0.02 0.00 0.00 35.03 33.53 2jig n LYS 206 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2jig n GLY 207 N 4.84 1.84 3.80 3.14 0.00 0.22 -4.86 105.19 114.17 2jig n GLY 207 Ca 0.32 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.00 2jig n GLY 207 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jig s ASP 208 N -1.57 6.13 -0.08 1.61 1.01 -0.53 -0.07 116.67 123.18 2jig s ASP 208 Ca 0.00 1.86 0.01 0.00 0.71 0.00 0.00 52.55 55.13 2jig s ASP 208 Cb 0.00 -2.55 0.02 0.00 1.01 0.00 0.00 42.92 41.40 2jig s ASP 208 CO 0.00 -0.93 -0.09 0.00 0.21 0.00 0.00 175.17 174.37 2jig s ALA 209 N -2.21 1.19 -0.18 5.23 0.00 -0.18 -1.39 121.76 124.22 2jig s ALA 209 Ca 0.65 -0.41 -0.21 0.00 0.00 0.00 0.00 51.96 52.00 2jig s ALA 209 Cb -0.16 -0.69 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 2jig s ALA 209 CO 0.27 -0.14 0.61 -1.17 0.00 0.00 0.00 175.76 175.34 2jig s LEU 210 N 1.17 4.17 -0.22 0.00 2.96 0.11 0.20 118.68 127.08 2jig s LEU 210 Ca -0.06 0.85 -0.05 0.00 -0.22 0.00 0.00 54.13 54.65 2jig s LEU 210 Cb -0.14 -2.87 -0.02 0.00 0.50 0.00 0.00 46.19 43.66 2jig s LEU 210 CO -0.02 -0.22 -0.01 -0.32 -1.32 0.00 0.00 176.35 174.47 2jig s MET 211 N 1.64 3.51 0.07 1.98 -2.45 0.30 -0.23 119.30 124.11 2jig s MET 211 Ca 0.29 -0.56 0.02 0.00 -1.25 0.00 0.00 55.69 54.19 2jig s MET 211 Cb -0.16 -3.10 -0.03 0.00 1.25 0.00 0.00 34.83 32.79 2jig s MET 211 CO 0.11 -0.13 -0.08 -0.59 1.05 0.00 0.00 175.02 175.38 2jig s PHE 212 N 1.37 0.80 -0.19 4.11 -0.71 -0.67 -0.83 117.98 121.86 2jig s PHE 212 Ca 0.04 -0.67 -0.09 0.00 -1.04 0.00 0.00 56.93 55.18 2jig s PHE 212 Cb -0.15 -0.47 -0.05 0.00 -1.21 0.00 0.00 43.02 41.15 2jig s PHE 212 CO -0.00 -0.10 0.12 0.71 -1.34 0.00 0.00 175.22 174.61 2jig s TYR 213 N -2.30 3.40 -0.58 3.49 1.51 -0.23 -1.64 117.35 121.00 2jig s TYR 213 Ca -0.00 0.31 0.24 0.00 -1.01 0.00 0.00 57.07 56.60 2jig s TYR 213 Cb -0.04 -2.11 0.27 0.00 -0.11 0.00 0.00 41.96 39.97 2jig s TYR 213 CO -0.02 0.32 1.26 0.77 -1.11 0.00 0.00 175.55 176.78 2jig h SER 214 N 6.45 0.00 -3.64 2.29 0.02 -1.12 -3.41 113.55 114.13 2jig h SER 214 Ca -0.42 -0.19 -0.68 0.00 -0.84 0.00 0.00 61.79 59.66 2jig h SER 214 Cb 1.16 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 63.50 2jig h SER 214 CO 0.73 0.10 -0.84 -0.76 -1.14 0.00 0.00 176.83 174.91 2jig s LEU 215 N -4.39 2.44 0.84 5.07 1.43 -1.25 -0.58 118.68 122.23 2jig s LEU 215 Ca 0.05 -0.75 -0.12 0.00 -1.03 0.00 0.00 54.13 52.29 2jig s LEU 215 Cb 0.13 -1.27 0.09 0.00 0.03 0.00 0.00 46.19 45.17 2jig s LEU 215 CO 0.74 0.16 1.10 -0.54 0.23 0.00 0.00 176.35 178.04 2jig s LYS 216 N -2.28 1.76 0.62 1.70 1.02 0.64 -4.79 119.74 118.42 2jig s LYS 216 Ca 0.17 0.66 0.32 0.00 0.02 0.00 0.00 55.97 57.14 2jig s LYS 216 Cb -0.09 -1.88 1.81 0.00 -0.52 0.00 0.00 37.83 37.14 2jig s LYS 216 CO 0.08 -1.85 2.10 -1.35 -0.92 0.00 0.00 175.35 173.41 2jig h PRO 217 N -1.26 0.00 -0.13 -1.68 0.11 -2.01 0.06 132.00 127.09 2jig h PRO 217 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2jig h PRO 217 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2jig h PRO 217 CO 0.58 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.97 2jig n ASP 218 N -3.43 1.25 0.00 -2.05 5.75 -1.26 -4.92 116.55 111.90 2jig n ASP 218 Ca 0.00 -1.65 0.00 0.00 -0.01 0.00 0.00 54.79 53.13 2jig n ASP 218 Cb 0.30 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.31 2jig n ASP 218 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jig n GLY 219 N 1.04 1.35 3.78 6.12 0.00 0.01 -5.04 105.19 112.44 2jig n GLY 219 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 2jig n GLY 219 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jig s SER 220 N -3.03 5.98 0.32 1.61 1.04 -1.26 -4.73 113.70 113.64 2jig s SER 220 Ca 0.00 2.12 -0.29 0.00 0.48 0.00 0.00 55.95 58.26 2jig s SER 220 Cb 0.00 -2.58 -0.12 0.00 0.10 0.00 0.00 66.02 63.43 2jig s SER 220 CO 0.00 -1.04 1.51 0.59 0.98 0.00 0.00 173.24 175.29 2jig n ASN 221 N -1.06 3.63 -4.34 7.02 3.02 -1.26 -0.26 115.26 122.00 2jig n ASN 221 Ca 0.10 1.18 -0.42 0.00 -0.03 0.00 0.00 54.58 55.42 2jig n ASN 221 Cb 0.51 -1.58 -0.10 0.00 -0.61 0.00 0.00 39.78 38.01 2jig n ASN 221 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2jig s ASP 222 N 0.19 5.82 0.61 6.41 2.15 0.25 -4.65 116.67 127.44 2jig s ASP 222 Ca 0.60 -1.31 0.39 0.00 0.43 0.00 0.00 52.55 52.66 2jig s ASP 222 Cb -0.51 -2.06 1.90 0.00 -0.30 0.00 0.00 42.92 41.96 2jig s ASP 222 CO 0.55 -0.53 2.18 1.55 -0.17 0.00 0.00 175.17 178.75 2jig h PRO 223 N 8.52 0.00 0.00 4.34 0.13 -1.93 -0.94 132.00 142.11 2jig h PRO 223 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 2jig h PRO 223 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2jig h PRO 223 CO 0.77 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.54 2jig n ALA 224 N -2.08 1.37 1.52 -0.56 0.00 -1.26 -3.29 120.51 116.21 2jig n ALA 224 Ca -0.01 0.13 0.08 0.00 0.00 0.00 0.00 53.44 53.63 2jig n ALA 224 Cb 0.18 -1.34 0.34 0.00 0.00 0.00 0.00 19.45 18.64 2jig n ALA 224 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2jig n SER 225 N -2.20 0.94 -4.61 0.00 3.41 -0.36 -3.90 113.62 106.90 2jig n SER 225 Ca 0.01 -1.70 -0.48 0.00 -0.26 0.00 0.00 58.87 56.43 2jig n SER 225 Cb 0.13 -0.08 -0.04 0.00 -0.26 0.00 0.00 64.21 63.97 2jig n SER 225 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2jig n LEU 226 N -0.11 2.07 -3.55 1.04 7.94 -1.21 -4.83 117.00 118.36 2jig n LEU 226 Ca 0.12 1.13 -0.11 0.00 -1.11 0.00 0.00 56.01 56.05 2jig n LEU 226 Cb 0.19 -1.28 -0.03 0.00 0.53 0.00 0.00 43.42 42.83 2jig n LEU 226 CO 0.10 -0.97 0.31 -1.38 -1.11 0.00 0.00 177.39 174.34 2jig s HIS 227 N 0.06 -0.36 0.39 1.96 -3.43 -0.72 -3.85 115.29 109.34 2jig s HIS 227 Ca 0.74 0.09 -0.15 0.00 -0.80 0.00 0.00 55.06 54.94 2jig s HIS 227 Cb -0.81 0.45 0.05 0.00 -1.43 0.00 0.00 32.58 30.85 2jig s HIS 227 CO 0.49 -0.83 0.78 0.20 -2.00 0.00 0.00 174.74 173.38 2jig s GLY 228 N -2.79 0.43 -0.11 -1.38 0.00 -0.88 -0.44 107.32 102.15 2jig s GLY 228 Ca 0.03 -0.80 -0.00 0.00 0.00 0.00 0.00 44.72 43.95 2jig s GLY 228 CO -0.10 -0.34 -0.10 -0.56 0.00 0.00 0.00 173.10 171.99 2jig s SER 229 N -3.08 4.27 0.18 1.64 0.01 -1.26 -1.30 113.70 114.16 2jig s SER 229 Ca 0.16 -0.22 -0.30 0.00 1.31 0.00 0.00 55.95 56.90 2jig s SER 229 Cb -0.05 -1.45 -0.07 0.00 0.21 0.00 0.00 66.02 64.65 2jig s SER 229 CO 0.12 0.23 0.96 0.00 0.41 0.00 0.00 173.24 174.96 2jig n PRO 231 N 2.14 0.32 -2.18 0.00 -0.01 -1.26 -2.12 135.00 131.89 2jig n PRO 231 Ca 0.00 0.12 -0.42 0.00 -0.01 0.00 0.00 63.50 63.19 2jig n PRO 231 Cb 0.48 -1.57 -0.03 0.00 -0.01 0.00 0.00 33.50 32.36 2jig n PRO 231 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 175.50 176.48 2jig s THR 232 N -0.07 3.43 -0.23 3.45 2.01 -1.26 -1.98 115.64 120.99 2jig s THR 232 Ca 0.84 0.97 0.02 0.00 0.31 0.00 0.00 61.69 63.84 2jig s THR 232 Cb -1.13 -3.62 -0.15 0.00 0.01 0.00 0.00 72.50 67.61 2jig s THR 232 CO 0.55 0.05 -0.19 0.18 -0.69 0.00 0.00 174.62 174.51 2jig n LEU 233 N 4.44 2.87 -3.67 4.42 4.77 0.20 -4.84 117.00 125.20 2jig n LEU 233 Ca 0.12 -0.12 -0.17 0.00 -0.03 0.00 0.00 56.01 55.82 2jig n LEU 233 Cb 0.43 -0.76 -0.15 0.00 -2.33 0.00 0.00 43.42 40.60 2jig n LEU 233 CO 0.59 0.87 -0.23 -0.75 -1.33 0.00 0.00 177.39 176.54 2jig s LYS 234 N -2.46 0.04 0.00 3.23 2.20 -0.49 -4.96 119.74 117.29 2jig s LYS 234 Ca -0.30 0.57 0.00 0.00 -0.36 0.00 0.00 55.97 55.88 2jig s LYS 234 Cb 0.08 -0.26 0.00 0.00 -1.51 0.00 0.00 37.83 36.14 2jig s LYS 234 CO 0.54 -0.31 0.00 0.41 -0.36 0.00 0.00 175.35 175.63 2jig n GLY 235 N 5.33 0.45 2.67 5.54 0.00 -1.26 -1.57 105.19 116.34 2jig n GLY 235 Ca -0.05 -2.21 -0.27 0.00 0.00 0.00 0.00 46.02 43.50 2jig n GLY 235 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jig s ASP 236 N -4.00 2.75 -0.32 1.61 2.15 -1.26 -5.00 116.67 112.59 2jig s ASP 236 Ca 0.00 -0.79 -0.16 0.00 0.43 0.00 0.00 52.55 52.03 2jig s ASP 236 Cb 0.00 -0.43 -0.02 0.00 -0.30 0.00 0.00 42.92 42.17 2jig s ASP 236 CO 0.00 -0.34 0.40 -0.75 -0.17 0.00 0.00 175.17 174.31 2jig s LYS 237 N 1.99 3.71 -0.04 4.34 2.20 -1.26 -4.75 119.74 125.92 2jig s LYS 237 Ca 0.01 -0.22 0.06 0.00 -0.36 0.00 0.00 55.97 55.47 2jig s LYS 237 Cb -0.17 -3.76 -0.02 0.00 -1.51 0.00 0.00 37.83 32.38 2jig s LYS 237 CO -0.11 -0.48 -0.24 -1.58 -0.36 0.00 0.00 175.35 172.58 2jig s TRP 238 N 2.12 2.44 0.17 4.03 0.52 -1.26 -1.08 118.94 125.88 2jig s TRP 238 Ca 0.14 -0.55 -0.05 0.00 0.02 0.00 0.00 56.10 55.67 2jig s TRP 238 Cb -0.16 -1.57 -0.03 0.00 -1.15 0.00 0.00 33.47 30.56 2jig s TRP 238 CO 0.12 -0.10 0.19 -1.54 0.02 0.00 0.00 176.95 175.63 2jig s SER 239 N -0.38 0.15 -0.01 2.95 1.04 -0.75 -0.53 113.70 116.16 2jig s SER 239 Ca 0.03 -1.10 0.04 0.00 0.48 0.00 0.00 55.95 55.40 2jig s SER 239 Cb -0.12 0.39 -0.01 0.00 0.10 0.00 0.00 66.02 66.38 2jig s SER 239 CO 0.02 -0.85 -0.12 0.00 0.98 0.00 0.00 173.24 173.27 2jig s ALA 240 N -4.04 1.02 -0.11 5.32 0.00 0.38 -0.91 121.76 123.42 2jig s ALA 240 Ca 0.24 -0.54 0.04 0.00 0.00 0.00 0.00 51.96 51.70 2jig s ALA 240 Cb 0.05 -0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.92 2jig s ALA 240 CO 0.04 0.25 -0.23 0.99 0.00 0.00 0.00 175.76 176.80 2jig s THR 241 N -0.31 2.02 -0.31 0.00 2.01 0.18 0.09 115.64 119.32 2jig s THR 241 Ca 0.04 -0.99 -0.06 0.00 0.31 0.00 0.00 61.69 60.99 2jig s THR 241 Cb -0.05 -1.76 0.02 0.00 0.01 0.00 0.00 72.50 70.73 2jig s THR 241 CO -0.00 0.55 0.08 -0.75 -0.69 0.00 0.00 174.62 173.81 2jig s LYS 242 N 0.43 2.89 -0.08 4.92 2.47 0.75 -1.75 119.74 129.37 2jig s LYS 242 Ca -0.17 -0.99 -0.16 0.00 -1.56 0.00 0.00 55.97 53.09 2jig s LYS 242 Cb -0.17 -3.38 -0.05 0.00 -1.46 0.00 0.00 37.83 32.77 2jig s LYS 242 CO 0.07 -0.53 0.41 -1.58 0.16 0.00 0.00 175.35 173.88 2jig s TRP 243 N 1.45 3.58 -0.09 4.03 0.51 -1.26 -0.76 118.94 126.41 2jig s TRP 243 Ca 0.01 0.86 0.02 0.00 -2.12 0.00 0.00 56.10 54.87 2jig s TRP 243 Cb -0.18 -2.40 0.01 0.00 -0.81 0.00 0.00 33.47 30.09 2jig s TRP 243 CO 0.02 0.37 -0.16 0.42 -0.51 0.00 0.00 176.95 177.10 2jig s ILE 244 N -0.08 1.45 0.50 2.03 1.01 -0.03 -0.77 121.20 125.31 2jig s ILE 244 Ca 0.23 -0.64 0.07 0.00 0.00 0.00 0.00 60.65 60.30 2jig s ILE 244 Cb -0.15 -1.30 0.04 0.00 0.01 0.00 0.00 42.46 41.06 2jig s ILE 244 CO 0.10 0.43 0.68 -1.00 0.00 0.00 0.00 174.94 175.15 2jig s HIS 245 N 0.70 2.39 -0.76 3.97 3.76 0.52 -0.45 115.29 125.42 2jig s HIS 245 Ca -0.13 -0.42 0.26 0.00 -0.15 0.00 0.00 55.06 54.63 2jig s HIS 245 Cb -0.16 -2.43 0.85 0.00 1.11 0.00 0.00 32.58 31.95 2jig s HIS 245 CO 0.03 -0.75 1.78 1.33 -0.85 0.00 0.00 174.74 176.28 2jig n VAL 246 N -2.08 0.51 -3.95 -0.90 0.24 -0.62 -4.71 118.33 106.81 2jig n VAL 246 Ca 0.10 -0.25 -0.09 0.00 -2.04 0.00 0.00 64.34 62.06 2jig n VAL 246 Cb 0.60 -0.55 -0.08 0.00 -1.47 0.00 0.00 33.84 32.34 2jig n VAL 246 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jig s ALA 247 N -3.09 0.05 0.26 2.33 0.00 -0.61 -5.02 121.76 115.68 2jig s ALA 247 Ca 0.11 -0.87 -0.30 0.00 0.00 0.00 0.00 51.96 50.89 2jig s ALA 247 Cb 0.13 0.69 -0.11 0.00 0.00 0.00 0.00 23.12 23.83 2jig s ALA 247 CO 0.59 -0.56 1.58 -2.14 0.00 0.00 0.00 175.76 175.23 2jig s PRO 248 N -3.94 4.16 0.10 0.00 0.02 -1.26 -4.35 135.00 129.74 2jig s PRO 248 Ca 0.13 2.50 -0.31 0.00 0.02 0.00 0.00 61.00 63.34 2jig s PRO 248 Cb 0.05 -3.06 -0.08 0.00 0.02 0.00 0.00 34.50 31.42 2jig s PRO 248 CO -0.04 -0.60 1.40 0.42 -0.33 0.00 0.00 177.00 177.84 2jig s ILE 249 N 0.31 3.33 0.00 2.83 1.01 -0.42 -2.30 121.20 125.96 2jig s ILE 249 Ca 0.65 0.94 0.00 0.00 0.00 0.00 0.00 60.65 62.24 2jig s ILE 249 Cb -0.46 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 38.40 2jig s ILE 249 CO 0.42 0.07 0.00 0.61 0.00 0.00 0.00 174.94 176.04 2jig n GLY 250 N 3.52 0.70 0.00 6.18 0.00 -0.54 -4.92 105.19 110.12 2jig n GLY 250 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2jig n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93