#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jdz s ASP 4 N 0.00 3.72 -0.27 0.00 1.01 -1.26 -5.03 116.67 114.84 2jdz s ASP 4 Ca 0.00 2.20 -0.08 0.00 0.71 0.00 0.00 52.55 55.38 2jdz s ASP 4 Cb 0.00 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.33 2jdz s ASP 4 CO 0.00 -2.58 0.11 -0.89 0.21 0.00 0.00 175.17 172.02 2jdz s THR 5 N -2.41 4.57 -0.08 -1.27 2.01 -1.26 -5.03 115.64 112.18 2jdz s THR 5 Ca 0.69 -0.15 0.04 0.00 0.31 0.00 0.00 61.69 62.58 2jdz s THR 5 Cb -0.25 -3.18 0.00 0.00 0.01 0.00 0.00 72.50 69.08 2jdz s THR 5 CO 0.52 0.27 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.90 2jdz s ILE 6 N 1.64 1.67 -0.10 1.82 -1.09 -1.26 -3.19 121.20 120.69 2jdz s ILE 6 Ca 0.06 -0.80 0.04 0.00 -2.23 0.00 0.00 60.65 57.71 2jdz s ILE 6 Cb -0.16 -1.45 0.00 0.00 -1.58 0.00 0.00 42.46 39.27 2jdz s ILE 6 CO 0.06 0.47 -0.22 -0.69 -1.23 0.00 0.00 174.94 173.33 2jdz s VAL 7 N 0.36 1.88 0.04 2.92 1.01 -0.20 -1.21 120.40 125.21 2jdz s VAL 7 Ca -0.14 -0.91 -0.08 0.00 0.00 0.00 0.00 61.98 60.85 2jdz s VAL 7 Cb -0.16 -1.64 -0.00 0.00 0.00 0.00 0.00 36.38 34.58 2jdz s VAL 7 CO 0.06 0.52 0.16 0.00 0.00 0.00 0.00 175.10 175.84 2jdz s ALA 8 N 0.44 -0.25 -0.24 5.51 0.00 -0.41 0.05 121.76 126.86 2jdz s ALA 8 Ca -0.17 -0.39 -0.00 0.00 0.00 0.00 0.00 51.96 51.40 2jdz s ALA 8 Cb -0.17 0.28 0.03 0.00 0.00 0.00 0.00 23.12 23.26 2jdz s ALA 8 CO 0.07 -0.35 -0.09 0.08 0.00 0.00 0.00 175.76 175.47 2jdz s VAL 9 N -2.63 2.63 -0.14 0.00 1.01 -0.62 -0.47 120.40 120.17 2jdz s VAL 9 Ca -0.05 -1.14 -0.07 0.00 0.00 0.00 0.00 61.98 60.72 2jdz s VAL 9 Cb -0.01 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 2jdz s VAL 9 CO -0.04 0.19 0.12 -1.83 0.00 0.00 0.00 175.10 173.54 2jdz s GLU 10 N 1.27 3.64 -0.50 2.72 -1.05 -0.04 -1.79 118.70 122.95 2jdz s GLU 10 Ca -0.01 -0.19 -0.13 0.00 -0.15 0.00 0.00 54.97 54.49 2jdz s GLU 10 Cb -0.17 -3.22 0.12 0.00 -0.44 0.00 0.00 34.13 30.42 2jdz s GLU 10 CO -0.06 0.62 0.41 -0.51 0.95 0.00 0.00 175.26 176.67 2jdz s LEU 11 N -0.57 5.89 -0.40 1.83 1.43 0.14 -0.97 118.68 126.03 2jdz s LEU 11 Ca 0.12 -1.80 -0.12 0.00 -1.03 0.00 0.00 54.13 51.30 2jdz s LEU 11 Cb -0.12 -2.11 0.04 0.00 0.03 0.00 0.00 46.19 44.03 2jdz s LEU 11 CO 0.02 -0.76 0.26 -0.62 0.23 0.00 0.00 176.35 175.48 2jdz s ASP 12 N 3.06 5.86 0.23 2.29 -1.08 -0.16 -1.52 116.67 125.36 2jdz s ASP 12 Ca 0.04 -1.11 0.19 0.00 -0.52 0.00 0.00 52.55 51.15 2jdz s ASP 12 Cb -0.28 -2.07 0.05 0.00 -1.46 0.00 0.00 42.92 39.16 2jdz s ASP 12 CO 0.02 -0.46 1.21 0.77 0.52 0.00 0.00 175.17 177.22 2jdz h SER 13 N 8.52 0.00 -3.26 -0.34 4.64 -1.57 -2.08 113.55 119.46 2jdz h SER 13 Ca -0.26 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.39 2jdz h SER 13 Cb 1.10 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 62.84 2jdz h SER 13 CO 0.73 0.30 -0.84 -0.47 -0.87 0.00 0.00 176.83 175.67 2jdz s TYR 14 N -3.10 2.90 -0.27 4.77 6.14 -1.23 -4.41 117.35 122.15 2jdz s TYR 14 Ca 0.02 -1.80 -0.29 0.00 0.64 0.00 0.00 57.07 55.64 2jdz s TYR 14 Cb 0.08 -1.93 0.01 0.00 0.42 0.00 0.00 41.96 40.54 2jdz s TYR 14 CO 0.76 -0.82 1.18 -2.14 0.64 0.00 0.00 175.55 175.17 2jdz s PRO 15 N 1.25 4.07 -0.79 4.97 0.02 -1.26 -4.97 135.00 138.28 2jdz s PRO 15 Ca 0.02 1.27 -0.06 0.00 0.02 0.00 0.00 61.00 62.25 2jdz s PRO 15 Cb -0.15 -3.78 0.20 0.00 0.02 0.00 0.00 34.50 30.80 2jdz s PRO 15 CO -0.11 -0.90 0.68 -0.80 -0.33 0.00 0.00 177.00 175.54 2jdz s ASN 16 N 2.02 6.04 0.37 2.53 -0.87 -1.26 -4.91 114.94 118.84 2jdz s ASN 16 Ca 0.50 -3.10 0.10 0.00 -1.57 0.00 0.00 52.86 48.80 2jdz s ASN 16 Cb -0.16 -2.00 0.70 0.00 -0.02 0.00 0.00 41.25 39.78 2jdz s ASN 16 CO 0.16 -0.37 1.84 0.71 -2.57 0.00 0.00 177.10 176.88 2jdz h THR 17 N 4.68 1.23 -0.98 1.60 1.35 -1.86 -1.23 112.91 117.71 2jdz h THR 17 Ca 0.08 -1.10 0.27 0.00 -0.55 0.00 0.00 66.41 65.10 2jdz h THR 17 Cb 0.94 1.49 -0.18 0.00 -1.73 0.00 0.00 68.15 68.66 2jdz h THR 17 CO 0.78 0.33 0.01 -0.90 -0.25 0.00 0.00 175.52 175.49 2jdz n ASP 18 N -4.16 -0.13 -1.29 5.36 3.85 -1.26 -1.85 116.55 117.06 2jdz n ASP 18 Ca -0.01 1.66 -0.03 0.00 -0.71 0.00 0.00 54.79 55.69 2jdz n ASP 18 Cb 0.36 -0.60 0.22 0.00 -1.35 0.00 0.00 41.12 39.75 2jdz n ASP 18 CO 0.00 0.00 0.00 2.30 -1.01 0.00 0.00 177.20 178.49 2jdz n ILE 19 N -5.47 2.60 0.00 2.12 -5.35 -0.49 -4.97 119.36 107.80 2jdz n ILE 19 Ca 0.23 -2.32 0.00 0.00 -0.27 0.00 0.00 62.75 60.38 2jdz n ILE 19 Cb 0.74 -0.33 0.00 0.00 -1.74 0.00 0.00 39.64 38.31 2jdz n ILE 19 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2jdz n GLY 20 N -0.89 1.56 3.71 3.28 0.00 -0.77 -4.70 105.19 107.38 2jdz n GLY 20 Ca 0.34 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.93 2jdz n GLY 20 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jdz n ASP 21 N 0.00 3.10 -4.56 1.61 8.00 -1.05 -4.95 116.55 118.69 2jdz n ASP 21 Ca 0.00 1.18 -0.29 0.00 0.71 0.00 0.00 54.79 56.39 2jdz n ASP 21 Cb 0.00 -1.50 0.22 0.00 -0.02 0.00 0.00 41.12 39.82 2jdz n ASP 21 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2jdz s PRO 22 N -1.18 -0.28 -0.03 -0.24 0.04 -1.26 -4.06 135.00 128.00 2jdz s PRO 22 Ca 0.61 0.90 0.00 0.00 0.04 0.00 0.00 61.00 62.55 2jdz s PRO 22 Cb -0.57 -1.62 0.04 0.00 0.04 0.00 0.00 34.50 32.39 2jdz s PRO 22 CO 0.56 -3.31 1.01 -1.13 0.04 0.00 0.00 177.00 174.17 2jdz n SER 23 N -4.63 2.87 -3.81 6.66 3.41 -1.26 -4.63 113.62 112.22 2jdz n SER 23 Ca 0.05 -2.10 -0.10 0.00 -0.26 0.00 0.00 58.87 56.47 2jdz n SER 23 Cb 0.54 -0.52 -0.06 0.00 -0.26 0.00 0.00 64.21 63.91 2jdz n SER 23 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2jdz s TYR 24 N -0.30 0.09 0.36 7.33 -0.85 -1.26 -4.98 117.35 117.74 2jdz s TYR 24 Ca 0.04 -0.46 -0.28 0.00 -0.52 0.00 0.00 57.07 55.84 2jdz s TYR 24 Cb 0.03 0.09 -0.12 0.00 0.38 0.00 0.00 41.96 42.35 2jdz s TYR 24 CO 0.01 -0.69 1.40 -2.30 -1.52 0.00 0.00 175.55 172.45 2jdz n PRO 25 N -0.19 2.44 -3.61 -3.49 -0.02 -1.26 -4.56 135.00 124.30 2jdz n PRO 25 Ca -0.12 0.86 -0.13 0.00 -2.02 0.00 0.00 63.50 62.08 2jdz n PRO 25 Cb 0.63 -2.52 -0.05 0.00 -0.02 0.00 0.00 33.50 31.53 2jdz n PRO 25 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2jdz s HIS 26 N -1.09 -0.34 0.02 6.00 -3.43 -0.78 -0.81 115.29 114.86 2jdz s HIS 26 Ca 0.54 0.31 0.00 0.00 -0.80 0.00 0.00 55.06 55.11 2jdz s HIS 26 Cb -0.52 0.29 -0.04 0.00 -1.43 0.00 0.00 32.58 30.89 2jdz s HIS 26 CO 0.63 -0.63 0.10 0.96 -2.00 0.00 0.00 174.74 173.80 2jdz s ILE 27 N -2.67 4.83 0.08 -5.38 -4.36 0.09 -0.98 121.20 112.80 2jdz s ILE 27 Ca -0.04 -0.46 -0.08 0.00 -0.26 0.00 0.00 60.65 59.81 2jdz s ILE 27 Cb -0.00 -3.25 -0.01 0.00 1.25 0.00 0.00 42.46 40.45 2jdz s ILE 27 CO -0.04 0.28 0.16 -0.83 0.24 0.00 0.00 174.94 174.75 2jdz s GLY 28 N -1.98 0.14 -0.28 6.27 0.00 -0.15 -1.37 107.32 109.95 2jdz s GLY 28 Ca 0.26 -0.67 -0.06 0.00 0.00 0.00 0.00 44.72 44.25 2jdz s GLY 28 CO 0.18 -0.84 0.05 -0.42 0.00 0.00 0.00 173.10 172.06 2jdz s ILE 29 N -3.74 3.75 -0.31 0.90 1.01 -0.22 -0.86 121.20 121.73 2jdz s ILE 29 Ca 0.04 -0.72 -0.09 0.00 0.00 0.00 0.00 60.65 59.88 2jdz s ILE 29 Cb 0.05 -2.91 -0.01 0.00 0.01 0.00 0.00 42.46 39.60 2jdz s ILE 29 CO -0.10 0.13 0.14 -1.81 0.00 0.00 0.00 174.94 173.30 2jdz s ASP 30 N 1.47 5.49 -0.43 3.58 1.01 0.37 -0.13 116.67 128.03 2jdz s ASP 30 Ca 0.02 -0.53 -0.06 0.00 0.71 0.00 0.00 52.55 52.69 2jdz s ASP 30 Cb -0.17 -1.99 0.11 0.00 1.01 0.00 0.00 42.92 41.88 2jdz s ASP 30 CO 0.01 -0.19 0.27 -0.63 0.21 0.00 0.00 175.17 174.84 2jdz s ILE 31 N 1.60 3.80 -1.30 0.77 -1.09 -1.26 -1.29 121.20 122.44 2jdz s ILE 31 Ca 0.04 -1.83 0.00 0.00 -2.23 0.00 0.00 60.65 56.63 2jdz s ILE 31 Cb -0.17 -3.51 0.00 0.00 -1.58 0.00 0.00 42.46 37.21 2jdz s ILE 31 CO 0.06 -0.68 0.00 0.29 -1.23 0.00 0.00 174.94 173.37 2jdz n LYS 32 N 4.77 -1.30 -3.59 2.79 5.02 -0.35 -4.92 118.16 120.59 2jdz n LYS 32 Ca -0.06 0.90 -0.11 0.00 -2.02 0.00 0.00 58.31 57.02 2jdz n LYS 32 Cb 0.41 -5.12 -0.06 0.00 -0.02 0.00 0.00 35.03 30.25 2jdz n LYS 32 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2jdz s SER 33 N -2.59 -0.42 0.31 4.39 0.15 -1.26 -4.94 113.70 109.34 2jdz s SER 33 Ca 0.00 0.56 0.24 0.00 0.70 0.00 0.00 55.95 57.45 2jdz s SER 33 Cb 0.00 0.48 1.09 0.00 -1.71 0.00 0.00 66.02 65.88 2jdz s SER 33 CO 0.00 -0.32 1.73 -0.29 1.20 0.00 0.00 173.24 175.57 2jdz h ILE 34 N 2.87 0.00 -2.41 6.45 6.09 -1.84 -3.40 117.51 125.27 2jdz h ILE 34 Ca -0.22 -0.19 -0.63 0.00 -1.37 0.00 0.00 64.86 62.45 2jdz h ILE 34 Cb 1.16 0.88 -0.14 0.00 0.47 0.00 0.00 36.82 39.20 2jdz h ILE 34 CO 0.26 0.00 0.76 -0.13 -3.07 0.00 0.00 178.15 175.97 2jdz s ARG 35 N -3.42 3.28 0.44 2.19 0.52 -1.26 -4.97 118.95 115.74 2jdz s ARG 35 Ca 0.02 -1.03 -0.24 0.00 -0.52 0.00 0.00 55.73 53.96 2jdz s ARG 35 Cb 0.09 -4.50 -0.09 0.00 0.52 0.00 0.00 34.95 30.96 2jdz s ARG 35 CO 0.35 -1.88 1.22 0.43 0.02 0.00 0.00 175.30 175.45 2jdz n SER 36 N 7.70 2.26 0.13 0.23 7.64 -1.26 -4.80 113.62 125.53 2jdz n SER 36 Ca 0.07 1.07 -0.00 0.00 1.01 0.00 0.00 58.87 61.01 2jdz n SER 36 Cb 0.47 -1.48 0.14 0.00 -1.01 0.00 0.00 64.21 62.33 2jdz n SER 36 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2jdz h LYS 37 N 1.84 0.00 -3.01 1.43 1.79 -0.88 -3.45 116.57 114.28 2jdz h LYS 37 Ca -0.48 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 57.84 2jdz h LYS 37 Cb 1.31 0.00 -0.26 0.00 -1.58 0.00 0.00 32.23 31.70 2jdz h LYS 37 CO 0.59 0.63 -0.38 0.45 -1.08 0.00 0.00 179.45 179.65 2jdz s SER 38 N -6.69 -0.31 0.09 0.86 0.15 -1.21 -5.01 113.70 101.58 2jdz s SER 38 Ca -0.00 0.60 0.01 0.00 0.70 0.00 0.00 55.95 57.26 2jdz s SER 38 Cb 0.11 0.59 -0.04 0.00 -1.71 0.00 0.00 66.02 64.97 2jdz s SER 38 CO 0.75 -0.11 -0.06 0.42 1.20 0.00 0.00 173.24 175.44 2jdz s THR 39 N 0.29 0.64 -0.07 6.45 -4.23 -1.26 -1.06 115.64 116.39 2jdz s THR 39 Ca -0.01 -1.91 -0.09 0.00 -1.18 0.00 0.00 61.69 58.50 2jdz s THR 39 Cb -0.03 -1.65 0.02 0.00 1.34 0.00 0.00 72.50 72.18 2jdz s THR 39 CO -0.01 -0.88 0.23 0.00 -0.54 0.00 0.00 174.62 173.42 2jdz s ALA 40 N -3.62 -0.57 0.27 3.99 0.00 -0.47 -4.99 121.76 116.37 2jdz s ALA 40 Ca 0.11 0.55 -0.30 0.00 0.00 0.00 0.00 51.96 52.32 2jdz s ALA 40 Cb 0.05 -0.30 -0.11 0.00 0.00 0.00 0.00 23.12 22.77 2jdz s ALA 40 CO -0.05 -0.13 1.49 0.50 0.00 0.00 0.00 175.76 177.57 2jdz s ARG 41 N -0.15 4.21 -0.25 0.00 3.52 -1.26 -0.73 118.95 124.29 2jdz s ARG 41 Ca -0.03 2.41 -0.00 0.00 -0.13 0.00 0.00 55.73 57.99 2jdz s ARG 41 Cb -0.03 -3.07 0.04 0.00 -1.56 0.00 0.00 34.95 30.33 2jdz s ARG 41 CO 0.01 -0.49 -0.08 -0.46 -0.81 0.00 0.00 175.30 173.46 2jdz s TRP 42 N -0.10 3.11 -1.27 5.12 -0.00 0.01 -4.77 118.94 121.03 2jdz s TRP 42 Ca 0.60 -1.80 -0.19 0.00 -0.00 0.00 0.00 56.10 54.71 2jdz s TRP 42 Cb -0.44 -2.02 0.02 0.00 -0.00 0.00 0.00 33.47 31.03 2jdz s TRP 42 CO 0.46 -0.79 1.84 0.09 -0.00 0.00 0.00 176.95 178.56 2jdz n ASN 43 N 4.60 4.31 -4.73 5.86 5.03 -1.26 -4.59 115.26 124.47 2jdz n ASN 43 Ca -0.16 -2.85 -0.42 0.00 0.87 0.00 0.00 54.58 52.02 2jdz n ASN 43 Cb 0.46 -1.71 -0.02 0.00 -1.02 0.00 0.00 39.78 37.48 2jdz n ASN 43 CO 0.00 0.00 0.00 -0.32 -1.83 0.00 0.00 177.26 175.11 2jdz s MET 44 N 4.66 4.16 -0.84 3.52 -2.45 -1.26 -4.95 119.30 122.14 2jdz s MET 44 Ca 0.57 2.51 0.01 0.00 -1.25 0.00 0.00 55.69 57.52 2jdz s MET 44 Cb 0.04 -3.08 0.22 0.00 1.25 0.00 0.00 34.83 33.27 2jdz s MET 44 CO 0.08 -0.64 0.77 0.94 1.05 0.00 0.00 175.02 177.22 2jdz n GLN 45 N 3.19 2.60 -1.73 4.11 -0.06 -1.26 -5.06 117.38 119.16 2jdz n GLN 45 Ca 0.12 -4.52 -0.42 0.00 -2.00 0.00 0.00 57.00 50.18 2jdz n GLN 45 Cb 0.37 -2.37 -0.02 0.00 -4.06 0.00 0.00 30.24 24.16 2jdz n GLN 45 CO 0.00 0.00 0.00 2.41 -0.20 0.00 0.00 177.06 179.27 2jdz n THR 46 N 1.93 0.58 -0.08 1.69 -1.04 -1.26 -1.60 114.28 114.51 2jdz n THR 46 Ca 0.23 -0.15 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 2jdz n THR 46 Cb 0.37 -1.91 0.00 0.00 -1.82 0.00 0.00 70.33 66.97 2jdz n THR 46 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2jdz n GLY 47 N 2.90 1.02 3.66 3.41 0.00 0.22 -4.96 105.19 111.43 2jdz n GLY 47 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 2jdz n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jdz s LYS 48 N -0.63 2.50 -0.05 1.61 -0.14 -0.63 -4.93 119.74 117.47 2jdz s LYS 48 Ca 0.00 -0.84 -0.30 0.00 -1.36 0.00 0.00 55.97 53.47 2jdz s LYS 48 Cb 0.00 -2.51 -0.04 0.00 -1.68 0.00 0.00 37.83 33.60 2jdz s LYS 48 CO 0.00 0.55 1.39 0.08 -0.76 0.00 0.00 175.35 176.61 2jdz s VAL 49 N -1.26 3.87 0.36 3.17 1.01 -1.26 -4.38 120.40 121.91 2jdz s VAL 49 Ca 0.24 1.18 0.07 0.00 0.00 0.00 0.00 61.98 63.47 2jdz s VAL 49 Cb -0.12 -3.76 -0.00 0.00 0.00 0.00 0.00 36.38 32.50 2jdz s VAL 49 CO 0.16 -0.04 0.49 -0.83 0.00 0.00 0.00 175.10 174.88 2jdz s GLY 50 N 2.10 1.69 -0.00 4.51 0.00 -0.04 -4.36 107.32 111.22 2jdz s GLY 50 Ca 0.63 -1.52 0.02 0.00 0.00 0.00 0.00 44.72 43.85 2jdz s GLY 50 CO 0.24 -1.41 -0.06 -1.59 0.00 0.00 0.00 173.10 170.28 2jdz s THR 51 N -2.22 0.49 -0.04 0.90 2.01 -0.61 -2.06 115.64 114.12 2jdz s THR 51 Ca 0.47 -0.30 0.06 0.00 0.31 0.00 0.00 61.69 62.23 2jdz s THR 51 Cb -0.10 -0.42 -0.01 0.00 0.01 0.00 0.00 72.50 71.98 2jdz s THR 51 CO 0.31 0.12 -0.21 0.00 -0.69 0.00 0.00 174.62 174.15 2jdz s ALA 52 N -0.20 1.81 -0.02 7.40 0.00 0.51 -1.78 121.76 129.48 2jdz s ALA 52 Ca 0.02 -0.88 0.02 0.00 0.00 0.00 0.00 51.96 51.12 2jdz s ALA 52 Cb -0.03 -0.55 0.00 0.00 0.00 0.00 0.00 23.12 22.55 2jdz s ALA 52 CO -0.00 0.37 -0.08 -1.58 0.00 0.00 0.00 175.76 174.47 2jdz s HIS 53 N -0.19 0.84 -0.01 0.00 5.04 -0.12 -1.05 115.29 119.79 2jdz s HIS 53 Ca -0.00 -0.20 0.01 0.00 -1.54 0.00 0.00 55.06 53.33 2jdz s HIS 53 Cb -0.11 -0.60 0.01 0.00 0.04 0.00 0.00 32.58 31.91 2jdz s HIS 53 CO 0.02 -0.09 -0.04 0.42 -2.34 0.00 0.00 174.74 172.71 2jdz s ILE 54 N 0.20 0.36 0.07 0.89 1.09 0.38 -0.89 121.20 123.30 2jdz s ILE 54 Ca -0.03 -0.14 -0.13 0.00 -1.10 0.00 0.00 60.65 59.26 2jdz s ILE 54 Cb -0.08 -0.35 0.02 0.00 -1.06 0.00 0.00 42.46 40.99 2jdz s ILE 54 CO 0.00 0.13 0.29 -0.94 -0.10 0.00 0.00 174.94 174.33 2jdz s SER 55 N 0.26 -0.08 -0.17 3.58 1.04 -0.58 -0.62 113.70 117.13 2jdz s SER 55 Ca -0.03 -0.34 -0.26 0.00 0.48 0.00 0.00 55.95 55.81 2jdz s SER 55 Cb -0.06 0.38 0.07 0.00 0.10 0.00 0.00 66.02 66.50 2jdz s SER 55 CO -0.00 -0.69 0.66 -0.47 0.98 0.00 0.00 173.24 173.72 2jdz s TYR 56 N -3.15 -0.69 0.05 5.02 5.04 -0.41 -1.79 117.35 121.42 2jdz s TYR 56 Ca -0.01 1.50 -0.03 0.00 -2.44 0.00 0.00 57.07 56.10 2jdz s TYR 56 Cb 0.01 0.31 -0.03 0.00 0.35 0.00 0.00 41.96 42.60 2jdz s TYR 56 CO -0.07 -0.45 0.02 0.54 -1.34 0.00 0.00 175.55 174.25 2jdz s ASN 57 N -0.28 0.37 0.12 4.32 2.20 -1.26 -1.05 114.94 119.35 2jdz s ASN 57 Ca -0.05 -0.84 0.27 0.00 -0.94 0.00 0.00 52.86 51.30 2jdz s ASN 57 Cb -0.03 0.22 0.85 0.00 -2.00 0.00 0.00 41.25 40.28 2jdz s ASN 57 CO 0.04 -0.58 1.73 -1.54 -2.94 0.00 0.00 177.10 173.81 2jdz n SER 58 N 0.31 0.53 -0.07 3.54 3.41 -0.03 -0.22 113.62 121.10 2jdz n SER 58 Ca -0.16 0.42 -0.13 0.00 -0.26 0.00 0.00 58.87 58.75 2jdz n SER 58 Cb 0.60 -0.49 -0.10 0.00 -0.26 0.00 0.00 64.21 63.97 2jdz n SER 58 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2jdz h VAL 59 N 0.00 1.18 -0.10 -3.33 2.07 -1.91 -3.36 116.25 110.80 2jdz h VAL 59 Ca 0.00 -2.00 -0.12 0.00 0.82 0.00 0.00 66.70 65.40 2jdz h VAL 59 Cb 0.65 2.34 -0.01 0.00 -1.52 0.00 0.00 31.29 32.74 2jdz h VAL 59 CO 0.00 0.40 -0.48 0.00 0.02 0.00 0.00 177.57 177.51 2jdz h ALA 60 N -0.35 1.01 -6.01 1.67 0.00 -1.95 -3.47 119.26 110.16 2jdz h ALA 60 Ca -0.08 -0.46 -0.41 0.00 0.00 0.00 0.00 54.91 53.96 2jdz h ALA 60 Cb 0.88 -0.09 0.07 0.00 0.00 0.00 0.00 17.79 18.65 2jdz h ALA 60 CO -0.05 0.64 -0.79 1.63 0.00 0.00 0.00 179.25 180.68 2jdz n LYS 61 N -3.97 -5.68 -3.66 0.00 5.02 0.70 -4.97 118.16 105.60 2jdz n LYS 61 Ca -0.02 0.68 -0.25 0.00 -2.02 0.00 0.00 58.31 56.71 2jdz n LYS 61 Cb 0.53 -5.45 -0.17 0.00 -0.02 0.00 0.00 35.03 29.92 2jdz n LYS 61 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2jdz s ARG 62 N -5.99 0.20 -0.18 1.97 3.52 -1.26 -1.91 118.95 115.30 2jdz s ARG 62 Ca 0.17 -0.05 -0.21 0.00 -0.13 0.00 0.00 55.73 55.51 2jdz s ARG 62 Cb -0.08 -1.58 -0.03 0.00 -1.56 0.00 0.00 34.95 31.70 2jdz s ARG 62 CO 0.79 -0.57 0.63 -1.17 -0.81 0.00 0.00 175.30 174.17 2jdz s LEU 63 N 2.07 4.17 0.06 -0.88 2.96 -0.59 -4.43 118.68 122.04 2jdz s LEU 63 Ca 0.02 0.87 0.04 0.00 -0.22 0.00 0.00 54.13 54.84 2jdz s LEU 63 Cb -0.15 -2.90 -0.03 0.00 0.50 0.00 0.00 46.19 43.61 2jdz s LEU 63 CO -0.07 -0.24 -0.12 -0.44 -1.32 0.00 0.00 176.35 174.16 2jdz s SER 64 N 1.12 1.39 -0.02 3.68 0.01 -0.74 -1.23 113.70 117.91 2jdz s SER 64 Ca 0.29 -0.58 -0.03 0.00 1.31 0.00 0.00 55.95 56.94 2jdz s SER 64 Cb -0.16 -0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.05 2jdz s SER 64 CO 0.11 -0.11 0.08 0.00 0.41 0.00 0.00 173.24 173.73 2jdz s ALA 65 N -1.26 -0.19 -0.01 1.44 0.00 -0.28 -1.53 121.76 119.93 2jdz s ALA 65 Ca -0.04 0.05 0.02 0.00 0.00 0.00 0.00 51.96 51.99 2jdz s ALA 65 Cb -0.10 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 22.97 2jdz s ALA 65 CO 0.02 -0.09 -0.07 0.54 0.00 0.00 0.00 175.76 176.16 2jdz s VAL 66 N -0.45 0.56 -0.04 0.00 0.11 -0.07 -1.45 120.40 119.05 2jdz s VAL 66 Ca -0.05 -0.27 0.06 0.00 -2.93 0.00 0.00 61.98 58.79 2jdz s VAL 66 Cb -0.03 -0.50 -0.01 0.00 -1.53 0.00 0.00 36.38 34.31 2jdz s VAL 66 CO 0.00 0.17 -0.23 -0.69 -3.33 0.00 0.00 175.10 171.03 2jdz s VAL 67 N 0.06 1.85 0.04 2.04 1.01 -0.43 -0.95 120.40 124.02 2jdz s VAL 67 Ca -0.00 -0.97 -0.13 0.00 0.00 0.00 0.00 61.98 60.88 2jdz s VAL 67 Cb -0.05 -1.56 0.02 0.00 0.00 0.00 0.00 36.38 34.79 2jdz s VAL 67 CO -0.00 0.52 0.28 -0.94 0.00 0.00 0.00 175.10 174.96 2jdz s SER 68 N -0.25 -0.10 0.16 3.32 1.04 -0.73 -0.77 113.70 116.37 2jdz s SER 68 Ca 0.01 -0.21 0.07 0.00 0.48 0.00 0.00 55.95 56.30 2jdz s SER 68 Cb -0.12 0.34 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 2jdz s SER 68 CO 0.02 -0.59 -0.16 -0.31 0.98 0.00 0.00 173.24 173.18 2jdz s TYR 69 N -2.47 1.65 0.10 5.02 2.02 -1.26 -1.57 117.35 120.84 2jdz s TYR 69 Ca -0.06 -0.53 -0.36 0.00 -0.37 0.00 0.00 57.07 55.76 2jdz s TYR 69 Cb -0.01 -0.82 -0.15 0.00 -0.40 0.00 0.00 41.96 40.57 2jdz s TYR 69 CO -0.03 0.27 1.48 0.45 -1.57 0.00 0.00 175.55 176.15 2jdz n SER 70 N 0.22 2.37 -0.78 2.29 2.88 -1.26 -2.13 113.62 117.20 2jdz n SER 70 Ca -0.13 1.10 -0.10 0.00 -1.33 0.00 0.00 58.87 58.41 2jdz n SER 70 Cb 0.58 -1.30 -0.04 0.00 -0.75 0.00 0.00 64.21 62.70 2jdz n SER 70 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jdz n GLY 71 N 3.05 1.15 3.40 0.46 0.00 -1.26 -5.01 105.19 106.98 2jdz n GLY 71 Ca 0.18 -0.48 -0.20 0.00 0.00 0.00 0.00 46.02 45.52 2jdz n GLY 71 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2jdz s THR 72 N -2.34 1.33 0.32 2.61 -1.32 -0.91 -5.13 115.64 110.22 2jdz s THR 72 Ca 0.00 -2.06 -0.29 0.00 -1.21 0.00 0.00 61.69 58.13 2jdz s THR 72 Cb 0.00 -2.51 -0.10 0.00 -1.51 0.00 0.00 72.50 68.38 2jdz s THR 72 CO 0.00 -0.23 1.34 -0.44 -2.21 0.00 0.00 174.62 173.08 2jdz s SER 73 N -3.41 6.71 0.63 8.08 0.01 -1.26 -4.65 113.70 119.81 2jdz s SER 73 Ca 0.31 2.72 -0.11 0.00 1.31 0.00 0.00 55.95 60.18 2jdz s SER 73 Cb 0.06 -2.65 -0.03 0.00 0.21 0.00 0.00 66.02 63.61 2jdz s SER 73 CO 0.12 -0.59 1.03 -0.44 0.41 0.00 0.00 173.24 173.77 2jdz s SER 74 N -0.33 6.05 -0.15 2.44 0.01 -1.26 -4.67 113.70 115.79 2jdz s SER 74 Ca 0.51 1.48 0.01 0.00 1.31 0.00 0.00 55.95 59.26 2jdz s SER 74 Cb -0.41 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.34 2jdz s SER 74 CO 0.53 -0.99 -0.17 -0.89 0.41 0.00 0.00 173.24 172.13 2jdz s THR 75 N -3.10 2.53 0.11 1.44 2.01 0.05 -4.99 115.64 113.69 2jdz s THR 75 Ca 0.56 -0.82 0.10 0.00 0.31 0.00 0.00 61.69 61.84 2jdz s THR 75 Cb -0.12 -2.06 -0.04 0.00 0.01 0.00 0.00 72.50 70.30 2jdz s THR 75 CO 0.52 0.52 -0.23 0.42 -0.69 0.00 0.00 174.62 175.17 2jdz s THR 76 N 0.81 2.51 0.01 -0.82 -4.23 -1.26 -1.32 115.64 111.35 2jdz s THR 76 Ca -0.06 -1.57 0.01 0.00 -1.18 0.00 0.00 61.69 58.89 2jdz s THR 76 Cb -0.15 -2.11 -0.01 0.00 1.34 0.00 0.00 72.50 71.56 2jdz s THR 76 CO -0.00 0.15 -0.03 0.54 -0.54 0.00 0.00 174.62 174.73 2jdz s VAL 77 N -1.05 0.20 0.02 2.29 0.11 -0.53 -4.77 120.40 116.67 2jdz s VAL 77 Ca 0.15 -0.58 0.00 0.00 -2.93 0.00 0.00 61.98 58.62 2jdz s VAL 77 Cb -0.10 -0.27 -0.02 0.00 -1.53 0.00 0.00 36.38 34.46 2jdz s VAL 77 CO 0.07 -0.25 -0.03 -0.55 -3.33 0.00 0.00 175.10 171.01 2jdz s SER 78 N -0.87 0.29 -0.02 3.54 0.15 -1.26 -1.12 113.70 114.40 2jdz s SER 78 Ca -0.08 -0.50 -0.00 0.00 0.70 0.00 0.00 55.95 56.07 2jdz s SER 78 Cb -0.06 0.09 0.03 0.00 -1.71 0.00 0.00 66.02 64.37 2jdz s SER 78 CO -0.00 -0.29 0.03 -0.47 1.20 0.00 0.00 173.24 173.71 2jdz s TYR 79 N -1.44 0.04 -0.22 3.44 5.04 -0.36 -4.88 117.35 118.97 2jdz s TYR 79 Ca -0.15 0.14 -0.29 0.00 -2.44 0.00 0.00 57.07 54.33 2jdz s TYR 79 Cb -0.10 -0.27 -0.01 0.00 0.35 0.00 0.00 41.96 41.93 2jdz s TYR 79 CO -0.01 -0.10 1.27 -0.51 -1.34 0.00 0.00 175.55 174.86 2jdz s ASP 80 N 1.20 6.85 -0.24 4.32 1.11 -1.26 -1.54 116.67 127.10 2jdz s ASP 80 Ca -0.07 1.50 -0.17 0.00 0.18 0.00 0.00 52.55 53.98 2jdz s ASP 80 Cb -0.13 -2.54 0.07 0.00 1.07 0.00 0.00 42.92 41.39 2jdz s ASP 80 CO -0.03 -0.88 0.62 0.54 1.18 0.00 0.00 175.17 176.61 2jdz s VAL 81 N 3.81 -0.00 -0.80 -1.27 0.11 -0.80 -4.99 120.40 116.46 2jdz s VAL 81 Ca 0.55 0.02 -0.23 0.00 -2.93 0.00 0.00 61.98 59.38 2jdz s VAL 81 Cb -0.20 -0.89 0.06 0.00 -1.53 0.00 0.00 36.38 33.83 2jdz s VAL 81 CO 0.17 0.01 1.18 -0.62 -3.33 0.00 0.00 175.10 172.51 2jdz s ASP 82 N 1.08 6.31 0.56 3.54 -1.08 -1.26 -4.25 116.67 121.56 2jdz s ASP 82 Ca -0.06 -1.09 0.33 0.00 -0.52 0.00 0.00 52.55 51.21 2jdz s ASP 82 Cb -0.05 -2.49 1.62 0.00 -1.46 0.00 0.00 42.92 40.54 2jdz s ASP 82 CO -0.10 -1.51 2.11 -0.07 0.52 0.00 0.00 175.17 176.11 2jdz h LEU 83 N 11.97 0.00 0.00 -1.34 3.38 -1.96 -1.50 115.31 125.86 2jdz h LEU 83 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2jdz h LEU 83 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2jdz h LEU 83 CO 1.25 0.07 0.00 -0.46 0.09 0.00 0.00 178.44 179.39 2jdz n ASN 84 N -3.38 0.00 -0.33 -0.43 0.23 -1.26 -1.57 115.26 108.53 2jdz n ASN 84 Ca -0.01 -0.32 0.12 0.00 -0.53 0.00 0.00 54.58 53.83 2jdz n ASN 84 Cb 0.23 -0.19 0.14 0.00 -2.08 0.00 0.00 39.78 37.88 2jdz n ASN 84 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2jdz n ASN 85 N -1.19 1.48 -0.09 0.53 3.02 -0.57 -4.53 115.26 113.92 2jdz n ASN 85 Ca 0.14 -1.17 -0.18 0.00 -0.03 0.00 0.00 54.58 53.35 2jdz n ASN 85 Cb 0.16 0.39 -0.07 0.00 -0.61 0.00 0.00 39.78 39.66 2jdz n ASN 85 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2jdz n VAL 86 N -0.48 0.97 -3.61 2.41 0.31 -0.75 -5.05 118.33 112.13 2jdz n VAL 86 Ca 0.10 -0.26 -0.29 0.00 -0.01 0.00 0.00 64.34 63.87 2jdz n VAL 86 Cb 0.40 -1.66 -0.04 0.00 -0.91 0.00 0.00 33.84 31.64 2jdz n VAL 86 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2jdz s LEU 87 N -6.84 4.21 1.05 7.52 1.43 -0.61 -4.98 118.68 120.46 2jdz s LEU 87 Ca -0.25 0.55 -0.13 0.00 -1.03 0.00 0.00 54.13 53.28 2jdz s LEU 87 Cb 0.09 -3.31 0.22 0.00 0.03 0.00 0.00 46.19 43.22 2jdz s LEU 87 CO 0.32 -0.04 1.08 -2.16 0.23 0.00 0.00 176.35 175.78 2jdz s PRO 88 N -3.10 0.03 0.26 1.29 0.04 -1.26 -4.79 135.00 127.47 2jdz s PRO 88 Ca 0.41 0.53 -0.01 0.00 0.04 0.00 0.00 61.00 61.96 2jdz s PRO 88 Cb -0.11 -1.69 0.35 0.00 0.04 0.00 0.00 34.50 33.09 2jdz s PRO 88 CO 0.27 -3.00 1.76 0.93 0.04 0.00 0.00 177.00 177.00 2jdz h GLU 89 N -2.09 0.76 -5.61 4.56 5.08 -1.94 -3.42 114.58 111.91 2jdz h GLU 89 Ca -0.57 -0.21 -0.66 0.00 -1.00 0.00 0.00 59.36 56.93 2jdz h GLU 89 Cb 1.34 -0.09 -0.20 0.00 0.50 0.00 0.00 28.75 30.30 2jdz h GLU 89 CO 0.56 0.78 -0.68 -1.58 -1.00 0.00 0.00 179.01 177.10 2jdz s TRP 90 N -4.94 3.00 0.14 4.33 0.52 -1.26 -0.57 118.94 120.15 2jdz s TRP 90 Ca -0.09 -0.18 -0.00 0.00 0.02 0.00 0.00 56.10 55.85 2jdz s TRP 90 Cb 0.15 -1.86 -0.04 0.00 -1.15 0.00 0.00 33.47 30.56 2jdz s TRP 90 CO 0.81 0.11 0.03 0.14 0.02 0.00 0.00 176.95 178.06 2jdz s VAL 91 N -0.11 0.28 0.11 4.03 -7.23 -0.55 -4.20 120.40 112.74 2jdz s VAL 91 Ca 0.02 -1.92 0.07 0.00 -1.81 0.00 0.00 61.98 58.34 2jdz s VAL 91 Cb -0.13 -2.03 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 2jdz s VAL 91 CO 0.03 -0.50 -0.12 -0.13 -0.31 0.00 0.00 175.10 174.07 2jdz s ARG 92 N -4.00 2.05 -0.01 4.82 0.52 -0.06 -0.87 118.95 121.41 2jdz s ARG 92 Ca 0.23 -1.06 0.04 0.00 -0.52 0.00 0.00 55.73 54.42 2jdz s ARG 92 Cb 0.07 -2.26 -0.03 0.00 0.52 0.00 0.00 34.95 33.25 2jdz s ARG 92 CO 0.02 0.50 -0.11 0.14 0.02 0.00 0.00 175.30 175.86 2jdz s VAL 93 N -1.20 3.29 0.29 3.52 -7.23 -1.26 -1.33 120.40 116.48 2jdz s VAL 93 Ca 0.21 -0.82 -0.11 0.00 -1.81 0.00 0.00 61.98 59.44 2jdz s VAL 93 Cb -0.11 -2.38 0.01 0.00 0.56 0.00 0.00 36.38 34.46 2jdz s VAL 93 CO 0.13 0.46 0.53 -0.83 -0.31 0.00 0.00 175.10 175.07 2jdz s GLY 94 N -1.17 0.69 0.04 2.32 0.00 -0.22 -1.32 107.32 107.66 2jdz s GLY 94 Ca 0.14 -0.97 0.08 0.00 0.00 0.00 0.00 44.72 43.97 2jdz s GLY 94 CO 0.04 -0.64 -0.22 1.08 0.00 0.00 0.00 173.10 173.37 2jdz s LEU 95 N -3.07 2.42 0.10 0.66 1.43 -0.19 -0.64 118.68 119.40 2jdz s LEU 95 Ca 0.23 -0.49 0.03 0.00 -1.03 0.00 0.00 54.13 52.87 2jdz s LEU 95 Cb -0.01 -1.42 -0.04 0.00 0.03 0.00 0.00 46.19 44.75 2jdz s LEU 95 CO 0.12 0.26 -0.09 -0.94 0.23 0.00 0.00 176.35 175.92 2jdz s SER 96 N -1.33 1.42 0.12 2.29 1.04 -0.30 -0.94 113.70 116.00 2jdz s SER 96 Ca 0.13 -0.88 -0.15 0.00 0.48 0.00 0.00 55.95 55.54 2jdz s SER 96 Cb -0.10 0.02 0.03 0.00 0.10 0.00 0.00 66.02 66.07 2jdz s SER 96 CO 0.04 -0.32 0.36 0.00 0.98 0.00 0.00 173.24 174.30 2jdz s ALA 97 N -2.81 -0.78 0.06 5.32 0.00 -0.36 -0.28 121.76 122.91 2jdz s ALA 97 Ca 0.08 -0.16 -0.01 0.00 0.00 0.00 0.00 51.96 51.87 2jdz s ALA 97 Cb -0.00 0.64 -0.04 0.00 0.00 0.00 0.00 23.12 23.72 2jdz s ALA 97 CO -0.01 -0.61 -0.02 0.95 0.00 0.00 0.00 175.76 176.07 2jdz s THR 98 N -3.78 0.22 0.34 0.00 -4.23 -1.11 -2.22 115.64 104.86 2jdz s THR 98 Ca 0.03 -1.83 0.06 0.00 -1.18 0.00 0.00 61.69 58.77 2jdz s THR 98 Cb 0.02 -1.60 -0.07 0.00 1.34 0.00 0.00 72.50 72.19 2jdz s THR 98 CO -0.12 -0.92 0.01 0.42 -0.54 0.00 0.00 174.62 173.48 2jdz s THR 99 N -3.93 1.58 0.00 3.99 -4.23 -0.13 -0.64 115.64 112.28 2jdz s THR 99 Ca 0.10 -2.04 0.00 0.00 -1.18 0.00 0.00 61.69 58.57 2jdz s THR 99 Cb 0.08 -2.78 0.00 0.00 1.34 0.00 0.00 72.50 71.14 2jdz s THR 99 CO -0.08 -0.07 0.00 0.61 -0.54 0.00 0.00 174.62 174.53 2jdz n GLY 100 N -0.75 4.10 0.24 3.99 0.00 -1.26 -3.21 105.19 108.30 2jdz n GLY 100 Ca -0.04 -0.51 -0.14 0.00 0.00 0.00 0.00 46.02 45.33 2jdz n GLY 100 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2jdz h LEU 101 N 0.00 0.92-10.08 0.99 5.85 -1.97 0.44 115.31 111.46 2jdz h LEU 101 Ca 0.00 -0.51 -0.53 0.00 0.84 0.00 0.00 57.88 57.68 2jdz h LEU 101 Cb 0.00 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.75 2jdz h LEU 101 CO 0.00 1.30 -0.40 -0.31 -0.34 0.00 0.00 178.44 178.69 2jdz s TYR 102 N -4.04 3.48 0.20 1.25 1.51 -1.26 -4.87 117.35 113.62 2jdz s TYR 102 Ca -0.10 0.20 -0.04 0.00 -1.01 0.00 0.00 57.07 56.12 2jdz s TYR 102 Cb 0.10 -1.74 -0.03 0.00 -0.11 0.00 0.00 41.96 40.18 2jdz s TYR 102 CO 0.89 0.44 0.22 -1.59 -1.11 0.00 0.00 175.55 174.39 2jdz s LYS 103 N -3.38 1.26 -0.16 -0.62 -2.85 -1.24 -4.30 119.74 108.45 2jdz s LYS 103 Ca 0.36 -1.50 -0.33 0.00 -1.00 0.00 0.00 55.97 53.51 2jdz s LYS 103 Cb -0.11 0.32 0.14 0.00 -2.06 0.00 0.00 37.83 36.12 2jdz s LYS 103 CO 0.29 -0.45 1.14 -1.83 0.10 0.00 0.00 175.35 174.60 2jdz s GLU 104 N -4.11 0.41 0.34 1.78 -1.05 -1.09 -3.48 118.70 111.52 2jdz s GLU 104 Ca 0.33 -0.09 -0.26 0.00 -0.15 0.00 0.00 54.97 54.80 2jdz s GLU 104 Cb 0.05 0.19 -0.09 0.00 -0.44 0.00 0.00 34.13 33.84 2jdz s GLU 104 CO 0.10 -0.17 1.02 0.95 0.95 0.00 0.00 175.26 178.12 2jdz s THR 105 N -2.17 3.82 -0.60 1.83 -4.23 -0.16 -4.71 115.64 109.42 2jdz s THR 105 Ca 0.07 1.54 0.06 0.00 -1.18 0.00 0.00 61.69 62.18 2jdz s THR 105 Cb -0.01 -3.86 0.24 0.00 1.34 0.00 0.00 72.50 70.21 2jdz s THR 105 CO -0.05 0.14 0.69 0.59 -0.54 0.00 0.00 174.62 175.45 2jdz n ASN 106 N 0.45 3.06 -4.65 3.99 3.02 -1.26 -4.08 115.26 115.79 2jdz n ASN 106 Ca 0.03 -3.29 -0.39 0.00 -0.03 0.00 0.00 54.58 50.90 2jdz n ASN 106 Cb 0.49 -0.67 -0.07 0.00 -0.61 0.00 0.00 39.78 38.91 2jdz n ASN 106 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2jdz s THR 107 N -2.15 5.15 -0.24 3.41 2.01 -1.10 -2.07 115.64 120.64 2jdz s THR 107 Ca 0.38 0.80 -0.09 0.00 0.31 0.00 0.00 61.69 63.08 2jdz s THR 107 Cb 0.14 -3.78 -0.04 0.00 0.01 0.00 0.00 72.50 68.83 2jdz s THR 107 CO -0.04 0.19 0.13 -0.63 -0.69 0.00 0.00 174.62 173.58 2jdz s ILE 108 N 1.65 4.99 -0.13 1.82 -1.09 0.18 -0.57 121.20 128.05 2jdz s ILE 108 Ca 0.20 0.05 0.18 0.00 -2.23 0.00 0.00 60.65 58.86 2jdz s ILE 108 Cb -0.15 -3.33 -0.23 0.00 -1.58 0.00 0.00 42.46 37.18 2jdz s ILE 108 CO 0.09 0.35 0.47 0.18 -1.23 0.00 0.00 174.94 174.79 2jdz n LEU 109 N 4.44 0.38 -3.50 2.97 7.99 0.65 -0.71 117.00 129.22 2jdz n LEU 109 Ca -0.15 0.17 -0.13 0.00 -0.01 0.00 0.00 56.01 55.88 2jdz n LEU 109 Cb 0.52 0.22 -0.04 0.00 -0.11 0.00 0.00 43.42 44.02 2jdz n LEU 109 CO 0.34 0.27 0.35 -0.94 -1.51 0.00 0.00 177.39 175.89 2jdz s SER 110 N -5.45 -0.51 -0.21 -1.43 1.04 -1.23 -4.36 113.70 101.54 2jdz s SER 110 Ca -0.07 0.13 -0.14 0.00 0.48 0.00 0.00 55.95 56.36 2jdz s SER 110 Cb 0.09 0.55 0.06 0.00 0.10 0.00 0.00 66.02 66.82 2jdz s SER 110 CO 0.84 -0.83 0.53 0.86 0.98 0.00 0.00 173.24 175.62 2jdz s TRP 111 N -2.98 -0.75 0.04 5.02 -0.00 0.42 -2.16 118.94 118.53 2jdz s TRP 111 Ca -0.02 1.60 -0.01 0.00 -0.00 0.00 0.00 56.10 57.66 2jdz s TRP 111 Cb -0.00 0.37 -0.03 0.00 -0.00 0.00 0.00 33.47 33.81 2jdz s TRP 111 CO -0.06 -0.39 -0.01 -1.54 -0.00 0.00 0.00 176.95 174.94 2jdz s SER 112 N 1.23 0.35 -0.23 5.86 1.04 -0.01 0.05 113.70 122.00 2jdz s SER 112 Ca -0.08 -0.75 -0.19 0.00 0.48 0.00 0.00 55.95 55.41 2jdz s SER 112 Cb -0.06 0.16 0.06 0.00 0.10 0.00 0.00 66.02 66.28 2jdz s SER 112 CO -0.12 -0.47 0.59 0.12 0.98 0.00 0.00 173.24 174.34 2jdz s PHE 113 N -2.80 -0.70 -0.03 5.02 5.36 -0.53 -1.16 117.98 123.14 2jdz s PHE 113 Ca -0.03 1.63 0.01 0.00 -0.96 0.00 0.00 56.93 57.58 2jdz s PHE 113 Cb -0.00 0.27 0.01 0.00 -0.34 0.00 0.00 43.02 42.96 2jdz s PHE 113 CO -0.06 -0.34 -0.04 0.99 -1.46 0.00 0.00 175.22 174.31 2jdz s THR 114 N 0.55 0.46 -0.04 0.12 2.01 0.75 -1.57 115.64 117.91 2jdz s THR 114 Ca -0.02 -0.14 0.05 0.00 0.31 0.00 0.00 61.69 61.89 2jdz s THR 114 Cb -0.05 -0.46 -0.01 0.00 0.01 0.00 0.00 72.50 72.00 2jdz s THR 114 CO -0.03 0.18 -0.20 -0.55 -0.69 0.00 0.00 174.62 173.34 2jdz s SER 115 N 0.53 2.45 -0.02 3.53 0.15 0.90 -0.84 113.70 120.40 2jdz s SER 115 Ca -0.06 -0.40 0.02 0.00 0.70 0.00 0.00 55.95 56.20 2jdz s SER 115 Cb -0.10 -0.62 0.00 0.00 -1.71 0.00 0.00 66.02 63.60 2jdz s SER 115 CO -0.00 0.19 -0.07 -0.54 1.20 0.00 0.00 173.24 174.03 2jdz s LYS 116 N -0.10 0.66 -0.14 5.44 1.02 -0.32 -1.14 119.74 125.16 2jdz s LYS 116 Ca -0.02 -0.22 -0.02 0.00 0.02 0.00 0.00 55.97 55.73 2jdz s LYS 116 Cb -0.12 -0.64 0.04 0.00 -0.52 0.00 0.00 37.83 36.60 2jdz s LYS 116 CO 0.02 0.10 0.01 -1.17 -0.92 0.00 0.00 175.35 173.38 2jdz s LEU 117 N 0.10 1.00 -0.17 3.17 2.96 0.19 -1.09 118.68 124.84 2jdz s LEU 117 Ca -0.01 -0.48 -0.05 0.00 -0.22 0.00 0.00 54.13 53.37 2jdz s LEU 117 Cb -0.06 -0.59 -0.03 0.00 0.50 0.00 0.00 46.19 46.02 2jdz s LEU 117 CO -0.00 -0.24 -0.01 -0.75 -1.32 0.00 0.00 176.35 174.03 2jdz s LYS 118 N 1.87 3.73 0.48 1.98 2.20 -0.22 0.75 119.74 130.52 2jdz s LYS 118 Ca 0.02 -0.48 0.01 0.00 -0.36 0.00 0.00 55.97 55.15 2jdz s LYS 118 Cb -0.15 -3.00 0.01 0.00 -1.51 0.00 0.00 37.83 33.18 2jdz s LYS 118 CO -0.07 0.22 0.06 2.41 -0.36 0.00 0.00 175.35 177.61 2jdz n THR 119 N 3.61 0.00 0.00 3.43 -1.04 -1.26 0.82 114.28 119.84 2jdz n THR 119 Ca -0.17 -2.20 0.00 0.00 -2.04 0.00 0.00 64.05 59.64 2jdz n THR 119 Cb 0.52 0.37 0.00 0.00 -1.82 0.00 0.00 70.33 69.40 2jdz n THR 119 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2jdz n ASN 120 N -1.37 0.00 -4.72 8.00 5.15 -1.26 -4.80 115.26 116.26 2jdz n ASN 120 Ca -0.17 0.00 -0.32 0.00 -0.60 0.00 0.00 54.58 53.49 2jdz n ASN 120 Cb 0.60 0.00 -0.08 0.00 -0.53 0.00 0.00 39.78 39.77 2jdz n ASN 120 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jdz s ALA 123 N 0.00 3.40 0.17 5.20 0.00 -1.26 -5.19 121.76 124.08 2jdz s ALA 123 Ca 0.00 -0.94 -0.03 0.00 0.00 0.00 0.00 51.96 50.99 2jdz s ALA 123 Cb 0.00 -1.42 -0.03 0.00 0.00 0.00 0.00 23.12 21.67 2jdz s ALA 123 CO 0.00 0.67 0.14 0.16 0.00 0.00 0.00 175.76 176.73 2jdz s ASP 124 N -1.71 0.19 0.33 0.00 3.84 -1.26 -5.10 116.67 112.96 2jdz s ASP 124 Ca 0.21 -1.21 -0.29 0.00 -0.00 0.00 0.00 52.55 51.27 2jdz s ASP 124 Cb -0.12 0.36 -0.10 0.00 -1.38 0.00 0.00 42.92 41.68 2jdz s ASP 124 CO 0.13 -0.82 1.31 0.00 -0.00 0.00 0.00 175.17 175.79 2jdz s ALA 125 N -4.08 3.50 0.33 2.11 0.00 -1.26 -4.78 121.76 117.59 2jdz s ALA 125 Ca 0.28 1.26 -0.26 0.00 0.00 0.00 0.00 51.96 53.24 2jdz s ALA 125 Cb 0.06 -3.48 -0.09 0.00 0.00 0.00 0.00 23.12 19.61 2jdz s ALA 125 CO 0.06 -0.64 1.00 -0.80 0.00 0.00 0.00 175.76 175.37 2jdz s ASN 126 N -0.45 7.19 0.07 0.00 0.02 0.23 -4.86 114.94 117.14 2jdz s ASN 126 Ca 0.49 1.99 -0.15 0.00 -1.02 0.00 0.00 52.86 54.17 2jdz s ASN 126 Cb -0.40 -2.59 0.03 0.00 0.02 0.00 0.00 41.25 38.31 2jdz s ASN 126 CO 0.53 -0.18 0.35 -0.94 0.02 0.00 0.00 177.10 176.87 2jdz s SER 127 N -1.42 -0.17 -0.04 -1.22 1.04 -1.26 0.56 113.70 111.18 2jdz s SER 127 Ca 0.50 -0.22 0.01 0.00 0.48 0.00 0.00 55.95 56.72 2jdz s SER 127 Cb -0.23 0.41 0.02 0.00 0.10 0.00 0.00 66.02 66.32 2jdz s SER 127 CO 0.29 -0.71 -0.03 -0.22 0.98 0.00 0.00 173.24 173.55 2jdz s LEU 128 N -2.34 1.31 -0.02 2.42 2.96 -0.29 -5.01 118.68 117.72 2jdz s LEU 128 Ca -0.02 -0.10 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 2jdz s LEU 128 Cb 0.01 -0.39 0.01 0.00 0.50 0.00 0.00 46.19 46.32 2jdz s LEU 128 CO -0.06 -0.06 -0.01 -2.28 -1.32 0.00 0.00 176.35 172.62 2jdz s HIS 129 N 0.90 0.23 0.10 5.38 5.65 -1.26 -0.07 115.29 126.22 2jdz s HIS 129 Ca -0.11 -0.00 0.04 0.00 0.25 0.00 0.00 55.06 55.23 2jdz s HIS 129 Cb -0.14 -0.26 -0.04 0.00 -1.18 0.00 0.00 32.58 30.96 2jdz s HIS 129 CO -0.00 -0.07 -0.11 -0.59 -0.65 0.00 0.00 174.74 173.33 2jdz s PHE 130 N 0.52 1.10 -0.05 3.88 -0.12 -0.61 -5.01 117.98 117.70 2jdz s PHE 130 Ca -0.05 -0.63 -0.06 0.00 -0.05 0.00 0.00 56.93 56.15 2jdz s PHE 130 Cb -0.08 -0.60 0.01 0.00 -0.63 0.00 0.00 43.02 41.73 2jdz s PHE 130 CO -0.01 0.02 0.15 -1.54 -0.05 0.00 0.00 175.22 173.79 2jdz s SER 131 N -2.39 -0.13 -0.18 1.98 1.04 -1.26 -1.46 113.70 111.31 2jdz s SER 131 Ca 0.05 0.24 0.01 0.00 0.48 0.00 0.00 55.95 56.73 2jdz s SER 131 Cb -0.04 0.30 0.02 0.00 0.10 0.00 0.00 66.02 66.40 2jdz s SER 131 CO 0.01 -0.09 -0.20 -0.36 0.98 0.00 0.00 173.24 173.57 2jdz s PHE 132 N -0.12 2.75 -0.63 5.02 0.40 0.11 -4.94 117.98 120.57 2jdz s PHE 132 Ca -0.02 -1.61 0.22 0.00 -0.60 0.00 0.00 56.93 54.92 2jdz s PHE 132 Cb -0.02 -1.90 -0.23 0.00 0.51 0.00 0.00 43.02 41.38 2jdz s PHE 132 CO 0.00 -0.79 0.78 0.43 0.70 0.00 0.00 175.22 176.35 2jdz n SER 133 N 4.57 0.62 -3.65 1.36 7.64 -1.26 -0.43 113.62 122.46 2jdz n SER 133 Ca -0.21 -0.57 -0.14 0.00 1.01 0.00 0.00 58.87 58.96 2jdz n SER 133 Cb 0.50 1.30 -0.07 0.00 -1.01 0.00 0.00 64.21 64.93 2jdz n SER 133 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jdz s GLN 134 N -3.20 0.89 -0.15 1.43 -2.07 -1.26 -4.66 119.66 110.65 2jdz s GLN 134 Ca 0.02 -0.15 -0.01 0.00 -1.82 0.00 0.00 55.36 53.40 2jdz s GLN 134 Cb 0.15 0.41 -0.01 0.00 -1.09 0.00 0.00 33.01 32.47 2jdz s GLN 134 CO 0.87 -0.29 -0.12 -0.06 -1.32 0.00 0.00 175.29 174.38 2jdz s PHE 135 N -1.84 2.84 0.80 9.60 0.40 0.33 -5.04 117.98 125.08 2jdz s PHE 135 Ca -0.09 -0.72 -0.11 0.00 -0.60 0.00 0.00 56.93 55.41 2jdz s PHE 135 Cb -0.02 -1.89 0.07 0.00 0.51 0.00 0.00 43.02 41.69 2jdz s PHE 135 CO 0.02 -0.29 1.09 -1.54 0.70 0.00 0.00 175.22 175.21 2jdz s SER 136 N 0.57 4.37 0.50 1.36 1.04 -1.26 -4.40 113.70 115.88 2jdz s SER 136 Ca -0.07 1.53 -0.23 0.00 0.48 0.00 0.00 55.95 57.66 2jdz s SER 136 Cb -0.15 -2.27 -0.06 0.00 0.10 0.00 0.00 66.02 63.63 2jdz s SER 136 CO 0.03 -2.08 1.31 -1.10 0.98 0.00 0.00 173.24 172.39 2jdz s GLN 137 N -5.01 3.45 -0.99 4.02 1.11 -1.26 -3.47 119.66 117.50 2jdz s GLN 137 Ca 0.61 2.13 -0.13 0.00 0.01 0.00 0.00 55.36 57.98 2jdz s GLN 137 Cb -0.16 -2.40 0.00 0.00 -1.01 0.00 0.00 33.01 29.44 2jdz s GLN 137 CO 0.56 -0.91 0.71 -1.71 0.01 0.00 0.00 175.29 173.95 2jdz n ASN 138 N -0.67 -5.49 -4.67 5.90 4.05 -1.26 -4.85 115.26 108.27 2jdz n ASN 138 Ca 0.08 -0.88 -0.43 0.00 0.45 0.00 0.00 54.58 53.81 2jdz n ASN 138 Cb 0.45 -3.04 -0.02 0.00 1.23 0.00 0.00 39.78 38.40 2jdz n ASN 138 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 2jdz s PRO 139 N -5.36 4.28 0.30 1.20 0.04 -1.23 -4.87 135.00 129.36 2jdz s PRO 139 Ca 0.27 1.58 0.26 0.00 0.04 0.00 0.00 61.00 63.15 2jdz s PRO 139 Cb -0.11 -3.68 0.86 0.00 0.04 0.00 0.00 34.50 31.62 2jdz s PRO 139 CO 0.87 -0.60 1.76 0.87 0.04 0.00 0.00 177.00 179.93 2jdz h LYS 140 N 7.80 0.00 -0.58 4.56 1.57 -1.94 -2.93 116.57 125.05 2jdz h LYS 140 Ca -0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 2jdz h LYS 140 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.42 2jdz h LYS 140 CO 0.94 0.00 0.00 -0.40 -0.57 0.00 0.00 179.45 179.42 2jdz n ASP 141 N -2.49 3.23 -4.32 0.86 5.75 -1.26 -4.88 116.55 113.43 2jdz n ASP 141 Ca 0.04 -2.13 -0.29 0.00 -0.01 0.00 0.00 54.79 52.40 2jdz n ASP 141 Cb 0.37 -0.42 -0.15 0.00 -1.03 0.00 0.00 41.12 39.90 2jdz n ASP 141 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2jdz s LEU 142 N -1.19 2.16 -0.40 -2.12 1.43 -1.11 -0.75 118.68 116.70 2jdz s LEU 142 Ca 0.37 -0.57 -0.14 0.00 -1.03 0.00 0.00 54.13 52.76 2jdz s LEU 142 Cb 0.21 -1.22 0.02 0.00 0.03 0.00 0.00 46.19 45.24 2jdz s LEU 142 CO 0.23 0.24 0.28 -0.63 0.23 0.00 0.00 176.35 176.70 2jdz s ILE 143 N -0.80 5.11 -0.20 -0.59 1.01 0.95 -4.85 121.20 121.84 2jdz s ILE 143 Ca 0.11 -0.72 -0.17 0.00 0.00 0.00 0.00 60.65 59.87 2jdz s ILE 143 Cb -0.10 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 2jdz s ILE 143 CO 0.02 -0.30 0.44 -0.76 0.00 0.00 0.00 174.94 174.33 2jdz s LEU 144 N 1.65 4.15 0.06 2.97 1.43 -1.26 -1.29 118.68 126.40 2jdz s LEU 144 Ca 0.04 0.57 0.07 0.00 -1.03 0.00 0.00 54.13 53.78 2jdz s LEU 144 Cb -0.19 -2.57 -0.03 0.00 0.03 0.00 0.00 46.19 43.42 2jdz s LEU 144 CO 0.09 -0.11 -0.16 -1.10 0.23 0.00 0.00 176.35 175.31 2jdz s GLN 145 N 1.39 2.07 7.63 1.70 -0.21 -0.15 -4.93 119.66 127.16 2jdz s GLN 145 Ca 0.21 -1.00 0.00 0.00 0.02 0.00 0.00 55.36 54.58 2jdz s GLN 145 Cb -0.15 -2.22 0.00 0.00 1.00 0.00 0.00 33.01 31.64 2jdz s GLN 145 CO 0.09 0.53 0.00 -1.13 -2.12 0.00 0.00 175.29 172.65 2jdz n SER 146 N 1.28 0.00 -0.42 5.90 3.41 -1.26 -1.38 113.62 121.15 2jdz n SER 146 Ca -0.16 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.57 2jdz n SER 146 Cb 0.52 0.00 0.48 0.00 -0.26 0.00 0.00 64.21 64.95 2jdz n SER 146 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2jdz n ASP 147 N 5.19 1.28 -4.74 4.04 8.00 0.22 -4.93 116.55 125.61 2jdz n ASP 147 Ca 0.00 -1.57 -0.42 0.00 0.71 0.00 0.00 54.79 53.52 2jdz n ASP 147 Cb 0.00 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.02 2jdz n ASP 147 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jdz s ALA 148 N -1.89 3.62 0.14 2.24 0.00 -1.10 -4.45 121.76 120.32 2jdz s ALA 148 Ca 0.34 1.25 -0.11 0.00 0.00 0.00 0.00 51.96 53.44 2jdz s ALA 148 Cb 0.18 -3.54 0.01 0.00 0.00 0.00 0.00 23.12 19.76 2jdz s ALA 148 CO 0.28 -0.68 0.31 0.95 0.00 0.00 0.00 175.76 176.62 2jdz s THR 149 N 0.32 0.08 -0.12 0.00 -4.23 -0.65 -4.72 115.64 106.31 2jdz s THR 149 Ca 0.61 -1.11 -0.07 0.00 -1.18 0.00 0.00 61.69 59.94 2jdz s THR 149 Cb -0.40 -1.56 -0.04 0.00 1.34 0.00 0.00 72.50 71.84 2jdz s THR 149 CO 0.39 -0.37 0.13 -0.89 -0.54 0.00 0.00 174.62 173.33 2jdz s THR 150 N -3.90 5.39 0.60 3.99 2.01 -1.26 0.29 115.64 122.76 2jdz s THR 150 Ca 0.10 0.16 0.08 0.00 0.31 0.00 0.00 61.69 62.35 2jdz s THR 150 Cb 0.03 -3.35 0.10 0.00 0.01 0.00 0.00 72.50 69.29 2jdz s THR 150 CO -0.05 0.60 0.83 1.51 -0.69 0.00 0.00 174.62 176.82 2jdz s ASP 151 N -0.89 4.95 0.64 3.53 3.84 -0.26 -4.87 116.67 123.60 2jdz s ASP 151 Ca 0.14 -0.79 0.41 0.00 -0.00 0.00 0.00 52.55 52.31 2jdz s ASP 151 Cb -0.12 0.29 2.17 0.00 -1.38 0.00 0.00 42.92 43.88 2jdz s ASP 151 CO 0.03 -1.45 2.29 0.77 -0.00 0.00 0.00 175.17 176.81 2jdz h SER 152 N 0.05 0.00 0.32 2.11 4.64 -1.97 -2.37 113.55 116.32 2jdz h SER 152 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2jdz h SER 152 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2jdz h SER 152 CO 0.40 0.01 -0.16 0.47 -0.87 0.00 0.00 176.83 176.67 2jdz n ASP 153 N -3.16 0.68 0.00 4.97 8.00 -1.26 -4.92 116.55 120.86 2jdz n ASP 153 Ca -0.02 -0.69 0.00 0.00 0.71 0.00 0.00 54.79 54.79 2jdz n ASP 153 Cb 0.12 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.22 2jdz n ASP 153 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jdz n GLY 154 N 1.30 0.56 3.78 0.44 0.00 -0.89 -4.95 105.19 105.44 2jdz n GLY 154 Ca 0.14 -0.80 -0.29 0.00 0.00 0.00 0.00 46.02 45.06 2jdz n GLY 154 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2jdz s ASN 155 N -2.73 5.55 -0.25 1.61 0.01 -1.26 -0.51 114.94 117.36 2jdz s ASN 155 Ca 0.00 -0.03 -0.19 0.00 -0.71 0.00 0.00 52.86 51.93 2jdz s ASN 155 Cb 0.00 -1.48 -0.03 0.00 0.41 0.00 0.00 41.25 40.15 2jdz s ASN 155 CO 0.00 0.15 0.54 -0.22 -1.51 0.00 0.00 177.10 176.06 2jdz s LEU 156 N -2.57 4.07 -0.50 0.60 2.96 0.11 -1.11 118.68 122.25 2jdz s LEU 156 Ca 0.30 0.60 -0.14 0.00 -0.22 0.00 0.00 54.13 54.67 2jdz s LEU 156 Cb -0.12 -2.72 0.10 0.00 0.50 0.00 0.00 46.19 43.96 2jdz s LEU 156 CO 0.22 -0.28 0.42 -1.10 -1.32 0.00 0.00 176.35 174.29 2jdz s GLN 157 N 2.21 2.89 0.21 1.98 -1.52 0.15 0.49 119.66 126.06 2jdz s GLN 157 Ca 0.23 -1.56 0.06 0.00 -1.95 0.00 0.00 55.36 52.13 2jdz s GLN 157 Cb -0.16 -4.14 0.14 0.00 -0.22 0.00 0.00 33.01 28.63 2jdz s GLN 157 CO 0.09 -1.17 1.48 -0.07 -0.25 0.00 0.00 175.29 175.37 2jdz h LEU 158 N 8.74 0.17 -9.32 2.90 3.38 -1.63 -1.74 115.31 117.81 2jdz h LEU 158 Ca -0.28 -0.12 -0.61 0.00 0.09 0.00 0.00 57.88 56.96 2jdz h LEU 158 Cb 1.10 -0.05 -0.14 0.00 0.09 0.00 0.00 40.66 41.66 2jdz h LEU 158 CO 0.93 0.85 -0.72 0.42 0.09 0.00 0.00 178.44 180.01 2jdz s THR 159 N -3.42 3.04 0.10 0.22 -4.23 -1.26 -2.87 115.64 107.21 2jdz s THR 159 Ca -0.02 -1.87 -0.36 0.00 -1.18 0.00 0.00 61.69 58.26 2jdz s THR 159 Cb 0.11 -2.54 -0.16 0.00 1.34 0.00 0.00 72.50 71.25 2jdz s THR 159 CO 0.80 -0.21 1.35 0.54 -0.54 0.00 0.00 174.62 176.56 2jdz n ARG 160 N -0.23 1.26 -4.24 3.99 1.74 -1.26 -4.76 116.66 113.16 2jdz n ARG 160 Ca -0.09 0.45 -0.17 0.00 -0.77 0.00 0.00 57.85 57.27 2jdz n ARG 160 Cb 0.57 -2.10 -0.13 0.00 -1.02 0.00 0.00 32.46 29.78 2jdz n ARG 160 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2jdz s VAL 161 N 0.47 0.77 0.86 1.55 1.01 -1.26 -1.91 120.40 121.90 2jdz s VAL 161 Ca 0.83 -0.80 -0.12 0.00 0.00 0.00 0.00 61.98 61.89 2jdz s VAL 161 Cb -0.92 -0.72 0.14 0.00 0.00 0.00 0.00 36.38 34.89 2jdz s VAL 161 CO 0.46 -0.06 1.21 -0.44 0.00 0.00 0.00 175.10 176.28 2jdz s SER 162 N -0.95 3.83 0.25 3.32 0.01 0.10 -4.89 113.70 115.38 2jdz s SER 162 Ca -0.01 0.37 -0.09 0.00 1.31 0.00 0.00 55.95 57.52 2jdz s SER 162 Cb -0.07 -0.64 0.40 0.00 0.21 0.00 0.00 66.02 65.92 2jdz s SER 162 CO 0.01 -2.28 1.60 0.28 0.41 0.00 0.00 173.24 173.26 2jdz h SER 163 N -1.24 -0.65 1.27 2.44 0.02 -2.02 0.01 113.55 113.38 2jdz h SER 163 Ca -0.44 0.24 -0.04 0.00 -0.84 0.00 0.00 61.79 60.71 2jdz h SER 163 Cb 1.27 0.47 -0.01 0.00 0.14 0.00 0.00 62.40 64.28 2jdz h SER 163 CO 0.49 -0.26 -0.19 -2.24 -1.14 0.00 0.00 176.83 173.49 2jdz h ASP 164 N 0.02 0.00 0.00 3.07 3.04 -2.06 -3.47 116.42 117.02 2jdz h ASP 164 Ca 0.41 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.20 2jdz h ASP 164 Cb 0.67 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.96 2jdz h ASP 164 CO -0.81 0.19 0.00 0.61 -2.04 0.00 0.00 179.24 177.19 2jdz n GLY 165 N 0.52 1.26 3.72 7.15 0.00 -0.01 -5.11 105.19 112.72 2jdz n GLY 165 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2jdz n GLY 165 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jdz s SER 166 N -1.98 7.18 0.63 1.61 1.04 -1.26 -4.63 113.70 116.29 2jdz s SER 166 Ca 0.00 1.96 -0.16 0.00 0.48 0.00 0.00 55.95 58.23 2jdz s SER 166 Cb 0.00 -2.58 -0.01 0.00 0.10 0.00 0.00 66.02 63.52 2jdz s SER 166 CO 0.00 -0.37 1.10 -2.16 0.98 0.00 0.00 173.24 172.79 2jdz s PRO 167 N 0.72 2.98 0.07 4.02 0.04 -1.26 -0.72 135.00 140.85 2jdz s PRO 167 Ca 0.55 1.37 0.09 0.00 0.04 0.00 0.00 61.00 63.05 2jdz s PRO 167 Cb -0.28 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.25 2jdz s PRO 167 CO 0.30 -1.10 -0.22 -0.65 0.04 0.00 0.00 177.00 175.37 2jdz s GLN 168 N -4.01 1.83 0.88 4.56 -0.21 -0.80 -4.87 119.66 117.05 2jdz s GLN 168 Ca 0.67 -1.11 -0.15 0.00 0.02 0.00 0.00 55.36 54.78 2jdz s GLN 168 Cb -0.20 -2.07 0.21 0.00 1.00 0.00 0.00 33.01 31.95 2jdz s GLN 168 CO 0.39 0.51 1.04 0.41 -2.12 0.00 0.00 175.29 175.51 2jdz n GLY 169 N 1.37 -1.89 4.13 3.09 0.00 -1.26 -4.52 105.19 106.12 2jdz n GLY 169 Ca -0.17 -1.63 -0.34 0.00 0.00 0.00 0.00 46.02 43.89 2jdz n GLY 169 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jdz n SER 170 N -4.00 -3.32 -4.42 1.61 7.64 0.16 -4.85 113.62 106.44 2jdz n SER 170 Ca 0.13 -0.96 -0.30 0.00 1.01 0.00 0.00 58.87 58.75 2jdz n SER 170 Cb 0.48 -3.03 -0.13 0.00 -1.01 0.00 0.00 64.21 60.52 2jdz n SER 170 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2jdz s SER 171 N -3.41 3.57 -0.01 6.43 0.15 -1.21 -4.97 113.70 114.25 2jdz s SER 171 Ca 0.65 -0.51 0.03 0.00 0.70 0.00 0.00 55.95 56.81 2jdz s SER 171 Cb -0.35 -0.47 -0.01 0.00 -1.71 0.00 0.00 66.02 63.48 2jdz s SER 171 CO 0.90 0.25 -0.09 0.54 1.20 0.00 0.00 173.24 176.04 2jdz s VAL 172 N -0.91 0.74 -0.08 4.45 0.11 -1.26 -0.96 120.40 122.49 2jdz s VAL 172 Ca 0.14 -0.39 -0.20 0.00 -2.93 0.00 0.00 61.98 58.60 2jdz s VAL 172 Cb -0.10 -0.63 0.04 0.00 -1.53 0.00 0.00 36.38 34.16 2jdz s VAL 172 CO 0.05 0.21 0.47 -0.83 -3.33 0.00 0.00 175.10 171.67 2jdz s GLY 173 N -0.15 -0.34 0.03 6.54 0.00 -0.94 0.70 107.32 113.15 2jdz s GLY 173 Ca 0.03 0.94 -0.04 0.00 0.00 0.00 0.00 44.72 45.64 2jdz s GLY 173 CO -0.00 0.69 0.06 0.50 0.00 0.00 0.00 173.10 174.35 2jdz s ARG 174 N -0.81 0.49 -0.10 2.90 0.52 -0.48 -1.22 118.95 120.25 2jdz s ARG 174 Ca -0.09 -0.66 -0.01 0.00 -0.52 0.00 0.00 55.73 54.46 2jdz s ARG 174 Cb -0.03 0.19 0.03 0.00 0.52 0.00 0.00 34.95 35.65 2jdz s ARG 174 CO 0.05 -0.11 -0.06 0.00 0.02 0.00 0.00 175.30 175.20 2jdz s ALA 175 N -2.09 1.18 0.01 2.13 0.00 -0.11 -0.97 121.76 121.91 2jdz s ALA 175 Ca -0.10 -0.45 0.04 0.00 0.00 0.00 0.00 51.96 51.46 2jdz s ALA 175 Cb -0.05 -0.86 -0.03 0.00 0.00 0.00 0.00 23.12 22.18 2jdz s ALA 175 CO -0.02 -0.41 -0.10 -0.51 0.00 0.00 0.00 175.76 174.72 2jdz s LEU 176 N 1.73 3.03 0.27 0.00 2.01 -0.41 -1.02 118.68 124.28 2jdz s LEU 176 Ca 0.04 -0.22 -0.29 0.00 0.01 0.00 0.00 54.13 53.67 2jdz s LEU 176 Cb -0.13 -1.75 -0.10 0.00 0.01 0.00 0.00 46.19 44.23 2jdz s LEU 176 CO -0.07 0.27 1.25 0.12 1.01 0.00 0.00 176.35 178.93 2jdz s PHE 177 N -0.98 3.26 0.17 0.29 5.36 -0.43 -0.03 117.98 125.61 2jdz s PHE 177 Ca 0.17 1.43 -0.13 0.00 -0.96 0.00 0.00 56.93 57.43 2jdz s PHE 177 Cb -0.11 -3.55 0.07 0.00 -0.34 0.00 0.00 43.02 39.09 2jdz s PHE 177 CO 0.07 -1.50 1.76 -0.92 -1.46 0.00 0.00 175.22 173.16 2jdz h TYR 178 N 4.19 0.80 -3.44 10.12 3.20 -1.27 -3.43 116.97 127.14 2jdz h TYR 178 Ca -0.47 -0.04 -0.54 0.00 3.14 0.00 0.00 58.73 60.83 2jdz h TYR 178 Cb 1.22 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 39.21 2jdz h TYR 178 CO 0.59 0.61 0.31 0.00 -1.64 0.00 0.00 178.16 178.03 2jdz s ALA 179 N -5.73 3.22 0.64 1.82 0.00 -1.26 -5.01 121.76 115.44 2jdz s ALA 179 Ca -0.13 0.47 -0.18 0.00 0.00 0.00 0.00 51.96 52.12 2jdz s ALA 179 Cb 0.12 -3.24 -0.01 0.00 0.00 0.00 0.00 23.12 19.99 2jdz s ALA 179 CO 0.77 -0.14 1.27 -2.14 0.00 0.00 0.00 175.76 175.52 2jdz s PRO 180 N 0.65 2.63 -0.11 0.00 0.02 -1.26 -4.82 135.00 132.11 2jdz s PRO 180 Ca 0.48 1.99 0.01 0.00 0.02 0.00 0.00 61.00 63.50 2jdz s PRO 180 Cb -0.21 -1.86 -0.02 0.00 0.02 0.00 0.00 34.50 32.43 2jdz s PRO 180 CO 0.27 -1.51 -0.13 0.08 -0.33 0.00 0.00 177.00 175.37 2jdz s VAL 181 N -1.47 3.10 -0.63 3.83 1.01 -0.05 -4.93 120.40 121.25 2jdz s VAL 181 Ca 0.81 -0.66 -0.22 0.00 0.00 0.00 0.00 61.98 61.90 2jdz s VAL 181 Cb -0.35 -2.28 0.07 0.00 0.00 0.00 0.00 36.38 33.82 2jdz s VAL 181 CO 0.38 0.54 0.92 -2.28 0.00 0.00 0.00 175.10 174.66 2jdz s HIS 182 N 0.03 2.74 -1.58 5.22 2.46 -1.26 -1.48 115.29 121.42 2jdz s HIS 182 Ca -0.04 -0.55 0.24 0.00 0.47 0.00 0.00 55.06 55.17 2jdz s HIS 182 Cb -0.14 -4.21 0.23 0.00 -0.13 0.00 0.00 32.58 28.32 2jdz s HIS 182 CO 0.04 -1.56 1.22 0.44 -2.47 0.00 0.00 174.74 172.42 2jdz n ILE 183 N 5.89 0.00 -3.53 0.89 -6.64 0.26 -4.75 119.36 111.48 2jdz n ILE 183 Ca -0.04 -0.13 -0.16 0.00 -1.77 0.00 0.00 62.75 60.65 2jdz n ILE 183 Cb 0.45 0.82 -0.05 0.00 -1.44 0.00 0.00 39.64 39.42 2jdz n ILE 183 CO 0.00 0.00 0.00 0.86 -1.77 0.00 0.00 176.55 175.64 2jdz s TRP 184 N -2.68 -0.56 0.07 4.28 -0.11 -1.22 -4.79 118.94 113.93 2jdz s TRP 184 Ca 0.17 0.80 -0.01 0.00 1.22 0.00 0.00 56.10 58.28 2jdz s TRP 184 Cb 0.18 0.40 -0.04 0.00 -1.50 0.00 0.00 33.47 32.51 2jdz s TRP 184 CO 0.64 -0.64 -0.01 -2.00 -4.62 0.00 0.00 176.95 170.32 2jdz s GLU 185 N -1.89 0.67 0.24 5.86 2.56 -1.26 -4.76 118.70 120.12 2jdz s GLU 185 Ca -0.08 -1.26 -0.30 0.00 0.00 0.00 0.00 54.97 53.33 2jdz s GLU 185 Cb -0.01 0.22 -0.10 0.00 2.00 0.00 0.00 34.13 36.24 2jdz s GLU 185 CO 0.03 -0.14 1.40 -1.59 -0.56 0.00 0.00 175.26 174.40 2jdz s LYS 186 N -3.94 4.30 -1.65 4.30 -2.85 -1.26 -2.62 119.74 116.01 2jdz s LYS 186 Ca 0.10 2.24 0.00 0.00 -1.00 0.00 0.00 55.97 57.31 2jdz s LYS 186 Cb 0.08 -3.13 0.00 0.00 -2.06 0.00 0.00 37.83 32.72 2jdz s LYS 186 CO -0.08 -0.36 0.00 0.43 0.10 0.00 0.00 175.35 175.44 2jdz n SER 187 N 2.29 -5.00 -4.77 0.03 7.64 -1.26 -4.99 113.62 107.56 2jdz n SER 187 Ca 0.06 0.25 -0.37 0.00 1.01 0.00 0.00 58.87 59.82 2jdz n SER 187 Cb 0.41 -4.03 0.01 0.00 -1.01 0.00 0.00 64.21 59.58 2jdz n SER 187 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jdz s ALA 188 N -2.71 2.89 -0.12 -0.43 0.00 -1.08 -4.37 121.76 115.95 2jdz s ALA 188 Ca 0.00 1.02 -0.24 0.00 0.00 0.00 0.00 51.96 52.74 2jdz s ALA 188 Cb 0.00 -3.43 -0.26 0.00 0.00 0.00 0.00 23.12 19.43 2jdz s ALA 188 CO 0.00 -0.85 0.67 0.28 0.00 0.00 0.00 175.76 175.85 2jdz h VAL 189 N 1.67 1.44 -1.94 0.00 2.07 0.09 -3.48 116.25 116.10 2jdz h VAL 189 Ca -0.50 -2.38 -0.03 0.00 0.82 0.00 0.00 66.70 64.62 2jdz h VAL 189 Cb 1.26 3.03 -0.21 0.00 -1.52 0.00 0.00 31.29 33.85 2jdz h VAL 189 CO 0.59 0.60 0.21 0.54 0.02 0.00 0.00 177.57 179.53 2jdz s VAL 190 N -2.34 0.00 0.01 2.57 0.11 -1.22 -4.90 120.40 114.63 2jdz s VAL 190 Ca -0.20 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 58.86 2jdz s VAL 190 Cb 0.01 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.85 2jdz s VAL 190 CO 0.72 0.00 -0.04 0.00 -3.33 0.00 0.00 175.10 172.45 2jdz s ALA 191 N -0.33 0.27 -0.01 1.54 0.00 -1.26 -1.06 121.76 120.91 2jdz s ALA 191 Ca -0.04 -0.31 -0.19 0.00 0.00 0.00 0.00 51.96 51.41 2jdz s ALA 191 Cb -0.03 -0.00 0.04 0.00 0.00 0.00 0.00 23.12 23.13 2jdz s ALA 191 CO 0.04 0.00 0.41 -1.54 0.00 0.00 0.00 175.76 174.68 2jdz s SER 192 N -0.58 -0.31 0.10 0.00 1.04 -0.25 -0.85 113.70 112.86 2jdz s SER 192 Ca -0.04 0.20 -0.02 0.00 0.48 0.00 0.00 55.95 56.57 2jdz s SER 192 Cb -0.04 0.39 -0.04 0.00 0.10 0.00 0.00 66.02 66.43 2jdz s SER 192 CO -0.00 -0.54 0.04 0.72 0.98 0.00 0.00 173.24 174.44 2jdz s PHE 193 N -1.59 0.70 -0.14 5.02 -0.12 -0.21 -1.18 117.98 120.46 2jdz s PHE 193 Ca -0.11 -1.14 -0.08 0.00 -0.05 0.00 0.00 56.93 55.55 2jdz s PHE 193 Cb -0.03 -0.42 0.05 0.00 -0.63 0.00 0.00 43.02 41.99 2jdz s PHE 193 CO 0.04 -0.48 0.35 0.34 -0.05 0.00 0.00 175.22 175.42 2jdz s ASP 194 N -2.99 -0.41 0.02 1.98 -1.08 -0.02 -1.29 116.67 112.86 2jdz s ASP 194 Ca 0.17 0.75 0.01 0.00 -0.52 0.00 0.00 52.55 52.96 2jdz s ASP 194 Cb 0.07 0.65 -0.01 0.00 -1.46 0.00 0.00 42.92 42.17 2jdz s ASP 194 CO -0.03 -0.17 -0.05 0.00 0.52 0.00 0.00 175.17 175.43 2jdz s ALA 195 N 1.19 0.40 0.00 3.66 0.00 0.21 -0.18 121.76 127.05 2jdz s ALA 195 Ca -0.08 -0.45 0.01 0.00 0.00 0.00 0.00 51.96 51.43 2jdz s ALA 195 Cb -0.08 -0.01 -0.00 0.00 0.00 0.00 0.00 23.12 23.03 2jdz s ALA 195 CO -0.10 0.01 -0.03 0.99 0.00 0.00 0.00 175.76 176.64 2jdz s THR 196 N -0.75 0.18 0.05 0.00 2.01 -0.31 -0.47 115.64 116.35 2jdz s THR 196 Ca -0.05 -0.21 -0.02 0.00 0.31 0.00 0.00 61.69 61.71 2jdz s THR 196 Cb -0.06 -0.18 -0.03 0.00 0.01 0.00 0.00 72.50 72.24 2jdz s THR 196 CO -0.00 -0.02 0.00 0.72 -0.69 0.00 0.00 174.62 174.63 2jdz s PHE 197 N -0.24 0.44 -0.01 4.92 -0.71 -0.21 -0.83 117.98 121.33 2jdz s PHE 197 Ca -0.01 -0.93 0.08 0.00 -1.04 0.00 0.00 56.93 55.03 2jdz s PHE 197 Cb -0.02 -0.32 -0.02 0.00 -1.21 0.00 0.00 43.02 41.45 2jdz s PHE 197 CO -0.00 -0.38 -0.26 0.95 -1.34 0.00 0.00 175.22 174.19 2jdz s THR 198 N -3.64 2.10 0.05 -4.49 -4.23 -0.92 -0.36 115.64 104.15 2jdz s THR 198 Ca 0.04 -1.15 0.02 0.00 -1.18 0.00 0.00 61.69 59.42 2jdz s THR 198 Cb 0.06 -1.74 -0.03 0.00 1.34 0.00 0.00 72.50 72.13 2jdz s THR 198 CO -0.09 0.54 -0.07 0.72 -0.54 0.00 0.00 174.62 175.18 2jdz s PHE 199 N -0.65 0.70 -0.21 3.99 -0.71 -0.87 -0.25 117.98 119.98 2jdz s PHE 199 Ca 0.10 -0.59 0.01 0.00 -1.04 0.00 0.00 56.93 55.42 2jdz s PHE 199 Cb -0.10 -0.42 0.04 0.00 -1.21 0.00 0.00 43.02 41.33 2jdz s PHE 199 CO -0.00 -0.10 -0.13 -1.17 -1.34 0.00 0.00 175.22 172.47 2jdz s LEU 200 N -1.87 2.50 -0.31 -1.99 2.96 0.26 -0.86 118.68 119.37 2jdz s LEU 200 Ca -0.06 -0.94 -0.05 0.00 -0.22 0.00 0.00 54.13 52.86 2jdz s LEU 200 Cb -0.07 -1.37 0.03 0.00 0.50 0.00 0.00 46.19 45.29 2jdz s LEU 200 CO -0.01 -0.12 0.06 -0.63 -1.32 0.00 0.00 176.35 174.34 2jdz s ILE 201 N 1.30 3.61 0.10 6.68 1.01 -1.26 -2.73 121.20 129.91 2jdz s ILE 201 Ca -0.01 -1.05 0.10 0.00 0.00 0.00 0.00 60.65 59.69 2jdz s ILE 201 Cb -0.16 -2.98 -0.04 0.00 0.01 0.00 0.00 42.46 39.29 2jdz s ILE 201 CO -0.09 -0.06 -0.24 -0.54 0.00 0.00 0.00 174.94 174.01 2jdz s LYS 202 N 1.40 1.65 -0.04 2.79 1.02 -1.26 0.69 119.74 125.98 2jdz s LYS 202 Ca -0.01 -1.22 -0.16 0.00 0.02 0.00 0.00 55.97 54.59 2jdz s LYS 202 Cb -0.19 -2.00 0.03 0.00 -0.52 0.00 0.00 37.83 35.16 2jdz s LYS 202 CO 0.01 0.48 0.37 0.45 -0.92 0.00 0.00 175.35 175.74 2jdz s SER 203 N -1.84 -0.28 0.00 2.83 0.15 -1.26 -0.98 113.70 112.32 2jdz s SER 203 Ca 0.14 0.27 0.27 0.00 0.70 0.00 0.00 55.95 57.33 2jdz s SER 203 Cb -0.10 0.42 0.82 0.00 -1.71 0.00 0.00 66.02 65.44 2jdz s SER 203 CO 0.06 -0.42 1.61 -0.81 1.20 0.00 0.00 173.24 174.88 2jdz n PRO 204 N 1.49 1.45 -3.74 5.44 -0.04 -1.26 -4.97 135.00 133.37 2jdz n PRO 204 Ca -0.20 -0.92 -0.33 0.00 -0.04 0.00 0.00 63.50 62.02 2jdz n PRO 204 Cb 0.56 -1.48 -0.05 0.00 -0.04 0.00 0.00 33.50 32.49 2jdz n PRO 204 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2jdz s ASP 205 N -2.18 6.48 0.30 3.54 1.01 -1.26 -5.00 116.67 119.55 2jdz s ASP 205 Ca 0.32 0.54 0.01 0.00 0.71 0.00 0.00 52.55 54.12 2jdz s ASP 205 Cb 0.20 -2.07 0.46 0.00 1.01 0.00 0.00 42.92 42.52 2jdz s ASP 205 CO 0.40 0.16 1.83 0.08 0.21 0.00 0.00 175.17 177.85 2jdz h ARG 206 N 3.38 0.70 -4.78 8.23 0.11 -1.96 -3.37 114.38 116.69 2jdz h ARG 206 Ca -0.48 -0.16 -0.67 0.00 0.10 0.00 0.00 59.98 58.78 2jdz h ARG 206 Cb 1.18 -0.10 -0.38 0.00 1.11 0.00 0.00 29.97 31.78 2jdz h ARG 206 CO 0.70 0.68 -0.76 -0.51 0.10 0.00 0.00 179.97 180.19 2jdz s ASP 207 N -6.65 4.62 0.61 0.08 -0.00 -1.26 -5.12 116.67 108.94 2jdz s ASP 207 Ca -0.09 -1.76 -0.17 0.00 -0.00 0.00 0.00 52.55 50.52 2jdz s ASP 207 Cb 0.15 -1.59 -0.03 0.00 -0.00 0.00 0.00 42.92 41.45 2jdz s ASP 207 CO 0.79 -0.29 1.13 -2.84 -0.00 0.00 0.00 175.17 173.97 2jdz s PRO 208 N 1.01 3.02 0.00 8.23 0.02 -1.26 -4.44 135.00 141.59 2jdz s PRO 208 Ca 0.01 1.55 -0.20 0.00 0.02 0.00 0.00 61.00 62.38 2jdz s PRO 208 Cb -0.20 -1.97 0.04 0.00 0.02 0.00 0.00 34.50 32.40 2jdz s PRO 208 CO -0.06 -1.11 0.43 0.00 -0.33 0.00 0.00 177.00 175.93 2jdz s ALA 209 N -2.00 -1.09 -0.04 -1.55 0.00 -1.23 -3.83 121.76 112.03 2jdz s ALA 209 Ca 0.71 0.52 0.06 0.00 0.00 0.00 0.00 51.96 53.25 2jdz s ALA 209 Cb -0.23 0.18 -0.09 0.00 0.00 0.00 0.00 23.12 22.98 2jdz s ALA 209 CO 0.34 -0.37 0.07 -0.25 0.00 0.00 0.00 175.76 175.55 2jdz n ASP 210 N 0.86 3.46 0.00 0.00 8.00 0.18 -2.67 116.55 126.38 2jdz n ASP 210 Ca -0.20 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.30 2jdz n ASP 210 Cb 0.58 0.88 0.00 0.00 -0.02 0.00 0.00 41.12 42.56 2jdz n ASP 210 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jdz n GLY 211 N 2.44 -0.14 2.98 0.44 0.00 -1.22 -1.59 105.19 108.10 2jdz n GLY 211 Ca -0.07 -1.68 -0.18 0.00 0.00 0.00 0.00 46.02 44.09 2jdz n GLY 211 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jdz s ILE 212 N -1.95 0.57 0.13 -0.61 1.01 -0.57 -2.75 121.20 117.03 2jdz s ILE 212 Ca 0.00 -0.28 0.08 0.00 0.00 0.00 0.00 60.65 60.45 2jdz s ILE 212 Cb 0.00 -0.50 -0.04 0.00 0.01 0.00 0.00 42.46 41.94 2jdz s ILE 212 CO 0.00 0.17 -0.19 0.42 0.00 0.00 0.00 174.94 175.34 2jdz s THR 213 N -0.01 1.71 -0.15 2.92 -4.23 0.62 0.27 115.64 116.76 2jdz s THR 213 Ca 0.01 -1.73 -0.05 0.00 -1.18 0.00 0.00 61.69 58.74 2jdz s THR 213 Cb -0.05 -1.67 -0.03 0.00 1.34 0.00 0.00 72.50 72.09 2jdz s THR 213 CO -0.00 -0.22 0.01 0.12 -0.54 0.00 0.00 174.62 173.99 2jdz s PHE 214 N -1.68 3.14 0.06 3.99 2.19 -0.74 -1.15 117.98 123.80 2jdz s PHE 214 Ca 0.11 -0.05 -0.02 0.00 0.33 0.00 0.00 56.93 57.29 2jdz s PHE 214 Cb -0.07 -1.97 -0.03 0.00 -1.31 0.00 0.00 43.02 39.63 2jdz s PHE 214 CO 0.05 0.15 0.02 -0.59 1.83 0.00 0.00 175.22 176.67 2jdz s PHE 215 N 0.10 0.48 -0.06 10.12 -0.71 0.19 -1.59 117.98 126.51 2jdz s PHE 215 Ca 0.02 -1.00 0.01 0.00 -1.04 0.00 0.00 56.93 54.93 2jdz s PHE 215 Cb -0.13 -0.34 0.02 0.00 -1.21 0.00 0.00 43.02 41.36 2jdz s PHE 215 CO 0.02 -0.42 -0.07 0.42 -1.34 0.00 0.00 175.22 173.83 2jdz s ILE 216 N -3.92 0.77 0.26 -4.49 1.01 0.11 -1.05 121.20 113.88 2jdz s ILE 216 Ca 0.08 -0.25 -0.03 0.00 0.00 0.00 0.00 60.65 60.45 2jdz s ILE 216 Cb 0.07 -0.75 -0.02 0.00 0.01 0.00 0.00 42.46 41.77 2jdz s ILE 216 CO -0.09 0.28 0.31 0.00 0.00 0.00 0.00 174.94 175.44 2jdz s ALA 217 N 0.91 0.84 0.65 9.38 0.00 -0.44 -1.03 121.76 132.07 2jdz s ALA 217 Ca -0.11 -1.52 -0.18 0.00 0.00 0.00 0.00 51.96 50.15 2jdz s ALA 217 Cb -0.15 1.28 -0.01 0.00 0.00 0.00 0.00 23.12 24.24 2jdz s ALA 217 CO 0.01 -0.71 1.30 0.54 0.00 0.00 0.00 175.76 176.90 2jdz s ASN 218 N -3.17 4.59 0.30 0.00 4.22 -1.19 -0.88 114.94 118.81 2jdz s ASN 218 Ca 0.33 2.64 0.03 0.00 -2.14 0.00 0.00 52.86 53.73 2jdz s ASN 218 Cb 0.03 -2.62 0.61 0.00 1.28 0.00 0.00 41.25 40.55 2jdz s ASN 218 CO 0.15 -2.02 1.86 0.71 -2.04 0.00 0.00 177.10 175.76 2jdz h THR 219 N 0.55 0.93 -0.35 0.54 1.35 -1.84 -1.43 112.91 112.65 2jdz h THR 219 Ca -0.51 -0.32 -0.08 0.00 -0.55 0.00 0.00 66.41 64.95 2jdz h THR 219 Cb 1.34 -0.09 -0.05 0.00 -1.73 0.00 0.00 68.15 67.62 2jdz h THR 219 CO 0.53 0.17 0.10 -0.90 -0.25 0.00 0.00 175.52 175.17 2jdz n ASP 220 N -4.58 3.38 -4.62 5.36 5.75 -1.26 -4.72 116.55 115.86 2jdz n ASP 220 Ca 0.18 -2.57 -0.41 0.00 -0.01 0.00 0.00 54.79 51.97 2jdz n ASP 220 Cb 0.35 -0.62 0.01 0.00 -1.03 0.00 0.00 41.12 39.84 2jdz n ASP 220 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 2jdz n THR 221 N 0.12 2.45 -4.07 2.12 5.66 -0.54 -5.02 114.28 114.99 2jdz n THR 221 Ca 0.19 -0.50 -0.09 0.00 -3.05 0.00 0.00 64.05 60.60 2jdz n THR 221 Cb 0.84 -1.21 -0.09 0.00 -1.55 0.00 0.00 70.33 68.32 2jdz n THR 221 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2jdz s SER 222 N -0.70 0.24 -0.15 1.09 1.04 -1.26 -5.11 113.70 108.84 2jdz s SER 222 Ca 0.63 -1.06 -0.29 0.00 0.48 0.00 0.00 55.95 55.71 2jdz s SER 222 Cb -0.56 0.33 -0.03 0.00 0.10 0.00 0.00 66.02 65.86 2jdz s SER 222 CO 0.57 -0.77 1.55 -0.63 0.98 0.00 0.00 173.24 174.94 2jdz s ILE 223 N -4.00 3.79 0.36 -1.02 1.01 -1.26 -4.96 121.20 115.12 2jdz s ILE 223 Ca 0.19 0.93 -0.27 0.00 0.00 0.00 0.00 60.65 61.50 2jdz s ILE 223 Cb 0.06 -3.69 -0.09 0.00 0.01 0.00 0.00 42.46 38.74 2jdz s ILE 223 CO -0.01 -0.19 1.24 -2.84 0.00 0.00 0.00 174.94 173.15 2jdz s PRO 224 N 4.19 4.23 0.21 2.79 0.02 -1.26 -4.97 135.00 140.20 2jdz s PRO 224 Ca 0.68 2.05 -0.32 0.00 0.02 0.00 0.00 61.00 63.44 2jdz s PRO 224 Cb -0.27 -2.92 -0.15 0.00 0.02 0.00 0.00 34.50 31.19 2jdz s PRO 224 CO 0.26 -0.24 1.20 0.43 -0.33 0.00 0.00 177.00 178.33 2jdz n SER 225 N 0.51 1.69 -0.91 2.53 7.64 -1.26 -2.76 113.62 121.06 2jdz n SER 225 Ca 0.02 1.15 -0.10 0.00 1.01 0.00 0.00 58.87 60.94 2jdz n SER 225 Cb 0.44 -1.28 -0.03 0.00 -1.01 0.00 0.00 64.21 62.33 2jdz n SER 225 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jdz n GLY 226 N 1.94 0.78 1.34 0.23 0.00 -1.26 -4.67 105.19 103.54 2jdz n GLY 226 Ca 0.13 -0.53 0.09 0.00 0.00 0.00 0.00 46.02 45.72 2jdz n GLY 226 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jdz n SER 227 N 0.24 3.93 -3.52 1.61 3.41 -1.11 -4.77 113.62 113.40 2jdz n SER 227 Ca -0.11 -2.25 -0.31 0.00 -0.26 0.00 0.00 58.87 55.94 2jdz n SER 227 Cb 0.42 -0.50 0.27 0.00 -0.26 0.00 0.00 64.21 64.14 2jdz n SER 227 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2jdz s GLY 228 N -0.90 1.52 0.00 5.00 0.00 -1.26 -1.16 107.32 110.52 2jdz s GLY 228 Ca 0.44 -1.00 0.00 0.00 0.00 0.00 0.00 44.72 44.16 2jdz s GLY 228 CO 0.24 -0.03 0.00 0.61 0.00 0.00 0.00 173.10 173.92 2jdz n GLY 229 N -0.10 3.28 0.07 0.20 0.00 -1.20 -1.48 105.19 105.97 2jdz n GLY 229 Ca 0.15 0.23 0.07 0.00 0.00 0.00 0.00 46.02 46.47 2jdz n GLY 229 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2jdz n ARG 230 N 14.00 0.08 -0.06 1.61 1.85 -1.26 -2.08 116.66 130.81 2jdz n ARG 230 Ca 0.00 0.49 0.12 0.00 -1.00 0.00 0.00 57.85 57.46 2jdz n ARG 230 Cb 0.00 -1.71 0.32 0.00 -1.05 0.00 0.00 32.46 30.01 2jdz n ARG 230 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2jdz n LEU 231 N -1.87 2.31 -1.41 2.89 4.77 -0.55 -4.97 117.00 118.18 2jdz n LEU 231 Ca 0.01 -0.87 -0.18 0.00 -0.03 0.00 0.00 56.01 54.94 2jdz n LEU 231 Cb 0.08 -0.07 -0.08 0.00 -2.33 0.00 0.00 43.42 41.02 2jdz n LEU 231 CO 0.09 0.43 -0.17 0.18 -1.33 0.00 0.00 177.39 176.59 2jdz n LEU 232 N 0.78 -1.20 0.00 2.23 4.77 -0.88 -1.80 117.00 120.89 2jdz n LEU 232 Ca 0.17 0.45 0.00 0.00 -0.03 0.00 0.00 56.01 56.60 2jdz n LEU 232 Cb 0.46 -2.76 0.00 0.00 -2.33 0.00 0.00 43.42 38.79 2jdz n LEU 232 CO 0.15 -1.05 0.00 0.61 -1.33 0.00 0.00 177.39 175.77 2jdz n GLY 233 N -0.22 0.50 0.07 -0.72 0.00 -0.31 -4.24 105.19 100.26 2jdz n GLY 233 Ca -0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.75 2jdz n GLY 233 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jdz n LEU 234 N 0.00 1.57 -4.24 0.99 4.77 -0.75 -4.45 117.00 114.89 2jdz n LEU 234 Ca 0.00 -0.04 -0.26 0.00 -0.03 0.00 0.00 56.01 55.67 2jdz n LEU 234 Cb 0.06 -0.15 -0.15 0.00 -2.33 0.00 0.00 43.42 40.86 2jdz n LEU 234 CO 0.00 0.55 -0.52 -0.36 -1.33 0.00 0.00 177.39 175.72 2jdz s PHE 235 N -2.31 1.84 -0.51 -1.77 0.08 -1.21 -4.83 117.98 109.27 2jdz s PHE 235 Ca -0.14 -0.37 0.24 0.00 0.12 0.00 0.00 56.93 56.79 2jdz s PHE 235 Cb 0.05 -1.13 0.54 0.00 -0.57 0.00 0.00 43.02 41.91 2jdz s PHE 235 CO 0.43 0.05 1.68 -1.00 -0.10 0.00 0.00 175.22 176.28 2jdz h PRO 236 N 5.13 0.00 -4.30 0.24 0.13 -1.89 -3.36 132.00 127.94 2jdz h PRO 236 Ca -0.41 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.40 2jdz h PRO 236 Cb 1.15 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.19 2jdz h PRO 236 CO 0.45 0.00 -0.27 0.16 -0.23 0.00 0.00 178.00 178.12 2jdz s ASP 237 N -5.64 1.07 -0.12 1.44 1.47 -1.26 -4.68 116.67 108.95 2jdz s ASP 237 Ca 0.08 -1.54 0.16 0.00 1.18 0.00 0.00 52.55 52.42 2jdz s ASP 237 Cb 0.07 0.63 0.60 0.00 -0.34 0.00 0.00 42.92 43.89 2jdz s ASP 237 CO 0.64 -1.24 1.51 0.00 0.68 0.00 0.00 175.17 176.76 2jdz n ALA 238 N -0.57 2.96 1.04 2.11 0.00 -1.26 -4.71 120.51 120.08 2jdz n ALA 238 Ca 0.02 -1.74 0.08 0.00 0.00 0.00 0.00 53.44 51.80 2jdz n ALA 238 Cb 0.62 -0.82 0.49 0.00 0.00 0.00 0.00 19.45 19.74 2jdz n ALA 238 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59