#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j3t s VAL 3 N 0.00 4.09 0.00 1.08 1.01 -0.54 -2.48 120.40 123.55 2j3t s VAL 3 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 61.98 60.68 2j3t s VAL 3 Cb 0.00 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.93 2j3t s VAL 3 CO 0.00 -0.40 0.68 1.41 0.00 0.00 0.00 175.10 176.80 2j3t n HIS 4 N 4.88 0.00 -4.00 5.22 -0.00 -0.46 -3.44 115.22 117.42 2j3t n HIS 4 Ca -0.10 0.00 -0.10 0.00 -0.00 0.00 0.00 57.72 57.51 2j3t n HIS 4 Cb 0.44 -0.41 -0.04 0.00 -0.00 0.00 0.00 29.99 29.98 2j3t n HIS 4 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 2j3t s ASN 5 N -2.15 0.16 -0.01 0.41 4.22 -1.25 -0.31 114.94 116.02 2j3t s ASN 5 Ca 0.00 -1.09 0.01 0.00 -2.14 0.00 0.00 52.86 49.64 2j3t s ASN 5 Cb 0.00 0.63 0.01 0.00 1.28 0.00 0.00 41.25 43.17 2j3t s ASN 5 CO 0.00 -1.23 -0.02 -0.22 -2.04 0.00 0.00 177.10 173.59 2j3t s LEU 6 N -3.08 1.75 -0.02 3.54 0.20 0.59 -2.58 118.68 119.08 2j3t s LEU 6 Ca 0.24 -0.05 0.06 0.00 0.69 0.00 0.00 54.13 55.07 2j3t s LEU 6 Cb -0.01 -0.18 -0.01 0.00 -0.43 0.00 0.00 46.19 45.56 2j3t s LEU 6 CO 0.12 -0.00 -0.20 -0.31 -0.29 0.00 0.00 176.35 175.67 2j3t s TYR 7 N 0.26 1.78 -0.16 5.38 1.51 0.19 -1.44 117.35 124.88 2j3t s TYR 7 Ca -0.02 -0.34 0.01 0.00 -1.01 0.00 0.00 57.07 55.71 2j3t s TYR 7 Cb -0.05 -1.15 0.01 0.00 -0.11 0.00 0.00 41.96 40.66 2j3t s TYR 7 CO -0.01 -0.03 -0.19 -0.51 -1.11 0.00 0.00 175.55 173.70 2j3t s LEU 8 N -0.45 2.24 0.16 -1.29 1.02 -0.15 -0.75 118.68 119.45 2j3t s LEU 8 Ca 0.07 -0.58 0.11 0.00 0.02 0.00 0.00 54.13 53.76 2j3t s LEU 8 Cb -0.08 -1.50 -0.04 0.00 0.02 0.00 0.00 46.19 44.59 2j3t s LEU 8 CO -0.01 0.05 -0.25 -0.36 0.02 0.00 0.00 176.35 175.81 2j3t s PHE 9 N 0.98 2.33 0.89 0.29 0.40 0.35 -0.77 117.98 122.45 2j3t s PHE 9 Ca -0.03 -0.36 -0.11 0.00 -0.60 0.00 0.00 56.93 55.84 2j3t s PHE 9 Cb -0.15 -1.21 0.19 0.00 0.51 0.00 0.00 43.02 42.36 2j3t s PHE 9 CO -0.05 0.42 1.22 0.34 0.70 0.00 0.00 175.22 177.86 2j3t s ASP 10 N -2.37 3.41 0.00 1.36 3.68 -0.49 -0.30 116.67 121.96 2j3t s ASP 10 Ca 0.18 -0.04 0.30 0.00 2.13 0.00 0.00 52.55 55.12 2j3t s ASP 10 Cb -0.09 -0.06 1.71 0.00 -1.45 0.00 0.00 42.92 43.03 2j3t s ASP 10 CO 0.08 -2.52 2.11 -2.11 0.13 0.00 0.00 175.17 172.87 2j3t n ARG 11 N -3.48 0.78 -0.03 4.34 1.85 -1.19 -3.20 116.66 115.73 2j3t n ARG 11 Ca 0.16 0.00 0.05 0.00 -1.00 0.00 0.00 57.85 57.06 2j3t n ARG 11 Cb 0.60 -1.50 0.07 0.00 -1.05 0.00 0.00 32.46 30.57 2j3t n ARG 11 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2j3t n ASN 12 N -1.09 2.16 0.00 2.89 5.03 -1.26 -4.98 115.26 118.01 2j3t n ASN 12 Ca 0.20 -2.51 0.00 0.00 0.87 0.00 0.00 54.58 53.14 2j3t n ASN 12 Cb 0.15 -0.20 0.00 0.00 -1.02 0.00 0.00 39.78 38.70 2j3t n ASN 12 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2j3t n GLY 13 N -0.94 2.20 3.68 7.41 0.00 -1.19 -5.00 105.19 111.34 2j3t n GLY 13 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 2j3t n GLY 13 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2j3t n VAL 14 N -2.00 0.47 -2.28 1.61 0.31 -1.26 -4.68 118.33 110.48 2j3t n VAL 14 Ca 0.00 -0.08 -0.34 0.00 -0.01 0.00 0.00 64.34 63.91 2j3t n VAL 14 Cb 0.00 -2.08 -0.04 0.00 -0.91 0.00 0.00 33.84 30.81 2j3t n VAL 14 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2j3t h LEU 16 N 15.55 0.70 -7.00 0.00 3.38 -1.23 -3.39 115.31 123.31 2j3t h LEU 16 Ca 0.22 0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.27 2j3t h LEU 16 Cb 0.96 -0.03 -0.21 0.00 0.09 0.00 0.00 40.66 41.47 2j3t h LEU 16 CO 1.32 0.23 0.26 -2.28 0.09 0.00 0.00 178.44 178.06 2j3t s HIS 17 N -5.76 -0.63 -0.05 1.13 5.04 -1.13 -0.54 115.29 113.34 2j3t s HIS 17 Ca -0.11 1.30 -0.01 0.00 -1.54 0.00 0.00 55.06 54.70 2j3t s HIS 17 Cb 0.25 0.37 0.03 0.00 0.04 0.00 0.00 32.58 33.26 2j3t s HIS 17 CO 0.80 -0.45 0.01 -0.47 -2.34 0.00 0.00 174.74 172.29 2j3t s TYR 18 N -0.52 0.47 0.03 3.88 5.04 -1.26 -0.98 117.35 124.02 2j3t s TYR 18 Ca -0.04 -0.05 0.07 0.00 -2.44 0.00 0.00 57.07 54.60 2j3t s TYR 18 Cb -0.02 -0.64 -0.02 0.00 0.35 0.00 0.00 41.96 41.63 2j3t s TYR 18 CO 0.04 -0.24 -0.19 0.45 -1.34 0.00 0.00 175.55 174.27 2j3t s SER 19 N 1.70 2.26 -0.04 4.32 0.15 -0.52 -5.00 113.70 116.58 2j3t s SER 19 Ca 0.00 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.17 2j3t s SER 19 Cb -0.13 -0.19 0.03 0.00 -1.71 0.00 0.00 66.02 64.02 2j3t s SER 19 CO -0.04 0.14 -0.00 -0.70 1.20 0.00 0.00 173.24 173.85 2j3t s GLU 20 N -1.07 0.39 0.02 5.44 2.12 -1.26 -0.30 118.70 124.03 2j3t s GLU 20 Ca 0.06 0.08 -0.03 0.00 0.36 0.00 0.00 54.97 55.44 2j3t s GLU 20 Cb -0.08 -0.60 -0.01 0.00 0.26 0.00 0.00 34.13 33.70 2j3t s GLU 20 CO 0.01 -0.16 -0.06 0.91 -0.54 0.00 0.00 175.26 175.42 2j3t n TRP 21 N 4.34 0.00 -3.88 5.30 8.01 0.58 -4.96 117.44 126.83 2j3t n TRP 21 Ca -0.22 0.00 -0.29 0.00 -1.31 0.00 0.00 57.50 55.68 2j3t n TRP 21 Cb 0.50 -0.09 -0.12 0.00 -2.01 0.00 0.00 31.31 29.60 2j3t n TRP 21 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.69 175.67 2j3t s HIS 22 N -1.83 3.58 -0.39 -5.99 3.76 -0.63 -5.03 115.29 108.77 2j3t s HIS 22 Ca -0.05 -3.31 0.04 0.00 -0.15 0.00 0.00 55.06 51.59 2j3t s HIS 22 Cb 0.01 -2.77 0.11 0.00 1.11 0.00 0.00 32.58 31.04 2j3t s HIS 22 CO 0.08 -0.57 0.11 0.50 -0.85 0.00 0.00 174.74 174.01 2j3t s ARG 23 N -1.38 1.56 0.45 1.40 3.52 -1.26 -4.39 118.95 118.84 2j3t s ARG 23 Ca 0.25 -2.03 0.24 0.00 -0.13 0.00 0.00 55.73 54.06 2j3t s ARG 23 Cb -0.06 -3.14 0.56 0.00 -1.56 0.00 0.00 34.95 30.75 2j3t s ARG 23 CO -0.15 -0.99 1.69 0.87 -0.81 0.00 0.00 175.30 175.90 2j3t h LYS 24 N 7.32 0.00 -4.75 5.12 1.57 -1.98 -3.41 116.57 120.43 2j3t h LYS 24 Ca -0.06 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 58.05 2j3t h LYS 24 Cb 0.98 0.00 -0.36 0.00 0.08 0.00 0.00 32.23 32.93 2j3t h LYS 24 CO 0.56 0.07 -0.72 0.21 -0.57 0.00 0.00 179.45 179.00 2j3t s LYS 25 N -3.31 2.07 -0.06 3.15 2.20 -1.26 -5.11 119.74 117.42 2j3t s LYS 25 Ca 0.05 -1.52 -0.16 0.00 -0.36 0.00 0.00 55.97 53.98 2j3t s LYS 25 Cb 0.06 -3.14 -0.05 0.00 -1.51 0.00 0.00 37.83 33.20 2j3t s LYS 25 CO 0.65 -0.74 0.42 -0.65 -0.36 0.00 0.00 175.35 174.67 2j3t s GLN 26 N 1.10 4.12 0.49 4.03 -1.52 -1.26 -5.05 119.66 121.57 2j3t s GLN 26 Ca -0.01 0.38 -0.21 0.00 -1.95 0.00 0.00 55.36 53.58 2j3t s GLN 26 Cb -0.20 -3.33 -0.10 0.00 -0.22 0.00 0.00 33.01 29.16 2j3t s GLN 26 CO -0.05 0.44 0.63 0.00 -0.25 0.00 0.00 175.29 176.06 2j3t n ALA 27 N 2.73 -0.98 0.87 6.09 0.00 -1.26 -4.80 120.51 123.16 2j3t n ALA 27 Ca -0.11 0.08 -0.01 0.00 0.00 0.00 0.00 53.44 53.40 2j3t n ALA 27 Cb 0.52 -1.87 0.01 0.00 0.00 0.00 0.00 19.45 18.12 2j3t n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j3t n GLY 28 N 1.66 2.01 3.18 0.00 0.00 -1.26 -4.86 105.19 105.92 2j3t n GLY 28 Ca 0.11 -0.07 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 2j3t n GLY 28 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2j3t s ILE 29 N -0.44 0.14 0.39 -0.61 -4.36 -1.26 -5.14 121.20 109.92 2j3t s ILE 29 Ca 0.04 -1.95 -0.27 0.00 -0.26 0.00 0.00 60.65 58.21 2j3t s ILE 29 Cb 0.03 -2.22 -0.09 0.00 1.25 0.00 0.00 42.46 41.43 2j3t s ILE 29 CO 0.01 -0.30 1.34 -2.84 0.24 0.00 0.00 174.94 173.38 2j3t s PRO 30 N -4.07 4.02 0.46 0.37 0.02 -1.26 -4.79 135.00 129.75 2j3t s PRO 30 Ca 0.29 2.24 0.17 0.00 0.02 0.00 0.00 61.00 63.73 2j3t s PRO 30 Cb 0.07 -2.83 1.14 0.00 0.02 0.00 0.00 34.50 32.91 2j3t s PRO 30 CO 0.06 -0.48 1.98 0.87 -0.33 0.00 0.00 177.00 179.10 2j3t h LYS 31 N 2.80 0.28 -0.38 5.54 1.57 -1.99 0.78 116.57 125.17 2j3t h LYS 31 Ca -0.50 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.33 2j3t h LYS 31 Cb 1.24 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 2j3t h LYS 31 CO 0.63 0.18 0.26 0.93 -0.57 0.00 0.00 179.45 180.88 2j3t h GLU 32 N 0.29 0.25 0.18 3.15 4.39 -2.01 -1.37 114.58 119.46 2j3t h GLU 32 Ca 0.28 -0.02 -0.34 0.00 0.34 0.00 0.00 59.36 59.63 2j3t h GLU 32 Cb 0.72 -0.06 0.01 0.00 -0.10 0.00 0.00 28.75 29.32 2j3t h GLU 32 CO -0.06 0.17 -1.62 1.49 -1.16 0.00 0.00 179.01 177.82 2j3t h GLU 33 N 0.26 0.39 -0.99 2.33 4.81 -1.25 -3.27 114.58 116.86 2j3t h GLU 33 Ca 0.17 -0.66 0.07 0.00 -0.13 0.00 0.00 59.36 58.80 2j3t h GLU 33 Cb 0.34 0.25 -0.07 0.00 0.63 0.00 0.00 28.75 29.90 2j3t h GLU 33 CO -0.03 1.29 0.63 1.49 -0.73 0.00 0.00 179.01 181.66 2j3t h GLU 34 N 0.11 1.10 -0.53 1.92 4.81 -0.59 0.22 114.58 121.61 2j3t h GLU 34 Ca -0.29 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 2j3t h GLU 34 Cb 2.09 -0.25 -0.03 0.00 0.63 0.00 0.00 28.75 31.20 2j3t h GLU 34 CO 0.20 0.73 0.34 1.88 -0.73 0.00 0.00 179.01 181.43 2j3t h TYR 35 N 1.13 0.68 -0.57 0.92 0.05 -1.39 0.50 116.97 118.29 2j3t h TYR 35 Ca 0.43 0.01 -0.07 0.00 0.05 0.00 0.00 58.73 59.15 2j3t h TYR 35 Cb 0.20 -0.23 -0.02 0.00 1.01 0.00 0.00 36.73 37.69 2j3t h TYR 35 CO -0.01 0.45 0.07 0.87 -1.05 0.00 0.00 178.16 178.49 2j3t h LYS 36 N 0.72 0.96 0.19 4.88 1.57 -1.43 -1.17 116.57 122.29 2j3t h LYS 36 Ca 0.19 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 2j3t h LYS 36 Cb -0.05 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.15 2j3t h LYS 36 CO -0.04 0.93 -0.09 1.25 -0.57 0.00 0.00 179.45 180.93 2j3t h LEU 37 N 0.85 -0.21 -0.28 2.94 6.46 -0.55 -0.52 115.31 123.99 2j3t h LEU 37 Ca 0.17 -0.13 0.06 0.00 -0.12 0.00 0.00 57.88 57.86 2j3t h LEU 37 Cb 0.45 0.06 -0.06 0.00 -0.73 0.00 0.00 40.66 40.37 2j3t h LEU 37 CO 0.02 0.01 -0.12 -0.03 -0.62 0.00 0.00 178.44 177.69 2j3t h MET 38 N -0.43 -0.08 -0.33 1.25 4.05 0.01 -0.71 114.93 118.69 2j3t h MET 38 Ca -0.03 0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.40 2j3t h MET 38 Cb 0.33 0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.14 2j3t h MET 38 CO 0.04 -0.05 0.20 -0.92 0.23 0.00 0.00 176.91 176.41 2j3t h TYR 39 N -0.08 0.44 -0.67 1.39 3.20 -1.16 0.14 116.97 120.23 2j3t h TYR 39 Ca 0.15 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.07 2j3t h TYR 39 Cb 0.30 -0.14 -0.06 0.00 1.54 0.00 0.00 36.73 38.37 2j3t h TYR 39 CO -0.32 0.32 0.37 0.78 -1.64 0.00 0.00 178.16 177.68 2j3t h GLY 40 N 0.43 0.99 0.86 1.82 0.00 -0.75 0.72 103.07 107.14 2j3t h GLY 40 Ca 0.12 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 2j3t h GLY 40 CO -0.02 0.15 0.04 1.98 0.00 0.00 0.00 176.54 178.69 2j3t h MET 41 N 0.69 0.15 -0.91 4.80 1.85 -0.81 -0.50 114.93 120.20 2j3t h MET 41 Ca 0.30 -0.03 0.05 0.00 -0.61 0.00 0.00 59.70 59.41 2j3t h MET 41 Cb 0.20 -0.02 -0.06 0.00 0.43 0.00 0.00 31.60 32.14 2j3t h MET 41 CO -0.19 0.27 0.58 -0.07 -0.40 0.00 0.00 176.91 177.10 2j3t h LEU 42 N 0.01 0.95 -0.63 3.39 4.07 -0.09 -0.90 115.31 122.10 2j3t h LEU 42 Ca 0.03 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.88 2j3t h LEU 42 Cb 0.17 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.69 2j3t h LEU 42 CO -0.00 0.63 -0.19 0.15 -1.08 0.00 0.00 178.44 177.96 2j3t h PHE 43 N 1.10 0.99 -0.74 1.13 3.57 0.62 -2.41 116.94 121.21 2j3t h PHE 43 Ca 0.37 -0.22 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 2j3t h PHE 43 Cb 0.07 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.54 2j3t h PHE 43 CO -0.02 0.99 0.27 0.77 -2.23 0.00 0.00 178.31 178.09 2j3t h SER 44 N 0.77 1.03 -0.80 0.41 0.02 -0.42 -2.38 113.55 112.18 2j3t h SER 44 Ca 0.11 -0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 60.89 2j3t h SER 44 Cb 0.72 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.96 2j3t h SER 44 CO 0.06 0.93 0.49 0.40 -1.14 0.00 0.00 176.83 177.56 2j3t h ILE 45 N 1.08 1.22 -0.59 3.27 2.04 -1.01 0.33 117.51 123.85 2j3t h ILE 45 Ca 0.24 -0.46 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 2j3t h ILE 45 Cb 0.24 0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.38 2j3t h ILE 45 CO -0.02 0.22 0.36 0.03 0.00 0.00 0.00 178.15 178.74 2j3t h ARG 46 N 1.09 0.80 -0.11 2.37 3.08 -1.04 0.10 114.38 120.67 2j3t h ARG 46 Ca 0.29 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.23 2j3t h ARG 46 Cb -0.06 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 29.82 2j3t h ARG 46 CO -0.06 0.58 -0.05 1.03 -1.07 0.00 0.00 179.97 180.41 2j3t h SER 47 N 0.80 0.23 0.38 7.04 0.87 -1.06 -2.85 113.55 118.96 2j3t h SER 47 Ca 0.21 -0.40 -0.00 0.00 -1.23 0.00 0.00 61.79 60.36 2j3t h SER 47 Cb -0.02 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 61.85 2j3t h SER 47 CO -0.04 0.58 -0.48 0.15 -0.53 0.00 0.00 176.83 176.51 2j3t h PHE 48 N -0.12 -1.34 -0.94 2.24 3.57 -0.23 -2.58 116.94 117.54 2j3t h PHE 48 Ca 0.03 0.02 0.18 0.00 3.53 0.00 0.00 57.97 61.72 2j3t h PHE 48 Cb 0.49 0.54 -0.08 0.00 2.79 0.00 0.00 35.95 39.69 2j3t h PHE 48 CO 0.06 -0.62 0.60 0.28 -2.23 0.00 0.00 178.31 176.40 2j3t h VAL 49 N -0.89 0.75 -0.60 1.41 2.07 -1.07 -0.00 116.25 117.91 2j3t h VAL 49 Ca -0.04 -0.22 -0.07 0.00 0.82 0.00 0.00 66.70 67.20 2j3t h VAL 49 Cb 0.81 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2j3t h VAL 49 CO -0.12 0.12 0.10 -1.28 0.02 0.00 0.00 177.57 176.41 2j3t h SER 50 N 0.63 0.93 0.62 0.57 0.87 -1.22 -2.61 113.55 113.34 2j3t h SER 50 Ca 0.50 -0.20 -0.24 0.00 -1.23 0.00 0.00 61.79 60.62 2j3t h SER 50 Cb 0.92 -0.24 -0.04 0.00 -0.44 0.00 0.00 62.40 62.59 2j3t h SER 50 CO -0.25 0.93 -1.53 0.11 -0.53 0.00 0.00 176.83 175.55 2j3t h LYS 51 N 0.92 0.00 -0.09 2.24 1.57 -1.03 -3.38 116.57 116.79 2j3t h LYS 51 Ca 0.19 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.75 2j3t h LYS 51 Cb 0.39 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.71 2j3t h LYS 51 CO 0.01 0.44 -0.82 1.98 -0.57 0.00 0.00 179.45 180.49 2j3t h MET 52 N 0.00 0.63 -6.50 3.15 4.05 -1.05 -3.45 114.93 111.76 2j3t h MET 52 Ca -0.22 -0.55 -0.56 0.00 -0.28 0.00 0.00 59.70 58.09 2j3t h MET 52 Cb 1.83 0.13 0.05 0.00 -0.80 0.00 0.00 31.60 32.80 2j3t h MET 52 CO 0.07 1.17 0.97 0.45 0.23 0.00 0.00 176.91 179.80 2j3t n SER 53 N -3.88 3.58 0.00 1.39 2.88 -0.99 -4.87 113.62 111.74 2j3t n SER 53 Ca -0.07 1.04 0.12 0.00 -1.33 0.00 0.00 58.87 58.62 2j3t n SER 53 Cb 0.77 -1.48 0.61 0.00 -0.75 0.00 0.00 64.21 63.36 2j3t n SER 53 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2j3t n PRO 54 N 4.59 0.38 -4.13 -1.46 -0.04 -1.26 -4.82 135.00 128.26 2j3t n PRO 54 Ca 0.18 0.06 -0.11 0.00 -0.04 0.00 0.00 63.50 63.59 2j3t n PRO 54 Cb 0.32 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.18 2j3t n PRO 54 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2j3t s LEU 55 N -2.51 2.44 0.31 1.53 1.43 -1.26 -5.13 118.68 115.50 2j3t s LEU 55 Ca 0.24 -0.89 -0.29 0.00 -1.03 0.00 0.00 54.13 52.16 2j3t s LEU 55 Cb 0.16 -0.07 -0.10 0.00 0.03 0.00 0.00 46.19 46.21 2j3t s LEU 55 CO 0.35 -0.41 1.35 -1.81 0.23 0.00 0.00 176.35 176.05 2j3t s ASP 56 N -2.66 6.72 0.32 2.29 1.01 -1.26 -5.01 116.67 118.08 2j3t s ASP 56 Ca 0.06 2.70 0.07 0.00 0.71 0.00 0.00 52.55 56.08 2j3t s ASP 56 Cb 0.02 -2.64 -0.02 0.00 1.01 0.00 0.00 42.92 41.28 2j3t s ASP 56 CO -0.04 -0.59 0.38 -0.04 0.21 0.00 0.00 175.17 175.09 2j3t s MET 57 N -1.47 3.01 -0.01 8.23 -1.94 -1.26 -5.06 119.30 120.80 2j3t s MET 57 Ca 0.51 -1.08 -0.07 0.00 -1.71 0.00 0.00 55.69 53.34 2j3t s MET 57 Cb -0.41 -2.70 -0.02 0.00 2.01 0.00 0.00 34.83 33.72 2j3t s MET 57 CO 0.51 0.13 -0.14 1.17 -0.01 0.00 0.00 175.02 176.69 2j3t n LYS 58 N -1.50 0.21 0.01 2.03 4.81 -1.26 -4.86 118.16 117.60 2j3t n LYS 58 Ca -0.02 0.08 -0.15 0.00 -0.87 0.00 0.00 58.31 57.35 2j3t n LYS 58 Cb 0.59 -0.87 -0.14 0.00 0.02 0.00 0.00 35.03 34.63 2j3t n LYS 58 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 2j3t h ASP 59 N -0.39 0.25 0.00 3.14 3.45 -2.03 -3.50 116.42 117.33 2j3t h ASP 59 Ca 0.00 -0.47 0.00 0.00 0.43 0.00 0.00 57.03 56.99 2j3t h ASP 59 Cb 0.39 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 39.08 2j3t h ASP 59 CO 0.00 1.42 0.00 0.61 -1.57 0.00 0.00 179.24 179.70 2j3t n GLY 60 N 1.73 -0.29 3.69 2.75 0.00 -1.26 -4.87 105.19 106.94 2j3t n GLY 60 Ca -0.22 -1.19 -0.44 0.00 0.00 0.00 0.00 46.02 44.17 2j3t n GLY 60 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2j3t n PHE 61 N 0.98 2.48 -0.05 1.61 7.35 -1.26 -4.91 117.46 123.67 2j3t n PHE 61 Ca 0.00 0.08 -0.05 0.00 -0.76 0.00 0.00 57.45 56.71 2j3t n PHE 61 Cb 0.00 -2.63 -0.07 0.00 0.35 0.00 0.00 39.48 37.12 2j3t n PHE 61 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2j3t n LEU 62 N 4.48 0.44 0.00 -2.13 4.32 -1.26 -4.82 117.00 118.03 2j3t n LEU 62 Ca 0.18 -0.01 0.00 0.00 -0.02 0.00 0.00 56.01 56.16 2j3t n LEU 62 Cb 0.32 0.14 0.00 0.00 -1.62 0.00 0.00 43.42 42.26 2j3t n LEU 62 CO 0.65 0.31 0.00 -1.54 -1.22 0.00 0.00 177.39 175.59 2j3t n SER 63 N -2.44 0.00 -4.12 -1.43 3.41 -1.26 -2.59 113.62 105.19 2j3t n SER 63 Ca -0.17 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.36 2j3t n SER 63 Cb 0.81 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.66 2j3t n SER 63 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2j3t s PHE 64 N -2.00 0.69 -0.01 7.33 -0.12 -0.82 -4.98 117.98 118.06 2j3t s PHE 64 Ca 0.00 -1.09 -0.02 0.00 -0.05 0.00 0.00 56.93 55.77 2j3t s PHE 64 Cb 0.00 -0.44 0.00 0.00 -0.63 0.00 0.00 43.02 41.95 2j3t s PHE 64 CO 0.00 -0.38 0.05 1.14 -0.05 0.00 0.00 175.22 175.99 2j3t s GLN 65 N -3.94 0.14 0.00 1.99 -2.07 -1.26 0.06 119.66 114.57 2j3t s GLN 65 Ca 0.13 -0.06 0.00 0.00 -1.82 0.00 0.00 55.36 53.61 2j3t s GLN 65 Cb 0.07 0.06 0.00 0.00 -1.09 0.00 0.00 33.01 32.05 2j3t s GLN 65 CO -0.06 -0.02 0.00 0.25 -1.32 0.00 0.00 175.29 174.14 2j3t n THR 66 N 2.70 0.00 0.18 3.63 -2.24 -0.22 -5.02 114.28 113.32 2j3t n THR 66 Ca -0.15 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.66 2j3t n THR 66 Cb 0.59 -0.61 0.33 0.00 -2.10 0.00 0.00 70.33 68.54 2j3t n THR 66 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 2j3t h SER 67 N 0.00 0.00 0.00 3.42 0.87 -2.04 -3.37 113.55 112.43 2j3t h SER 67 Ca 0.00 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.45 2j3t h SER 67 Cb 0.00 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 2j3t h SER 67 CO 0.00 0.42 -1.48 0.54 -0.53 0.00 0.00 176.83 175.77 2j3t n ARG 68 N -3.83 2.28 -4.15 2.24 5.12 -1.26 -5.01 116.66 112.05 2j3t n ARG 68 Ca -0.01 -0.02 -0.12 0.00 -1.93 0.00 0.00 57.85 55.77 2j3t n ARG 68 Cb 0.47 -1.19 -0.09 0.00 -1.16 0.00 0.00 32.46 30.50 2j3t n ARG 68 CO 0.00 0.00 0.00 1.52 -1.93 0.00 0.00 177.63 177.22 2j3t s TYR 69 N -2.25 0.98 -0.08 -1.55 -0.85 -1.26 -4.32 117.35 108.01 2j3t s TYR 69 Ca -0.04 -1.22 0.03 0.00 -0.52 0.00 0.00 57.07 55.32 2j3t s TYR 69 Cb 0.03 -0.36 0.01 0.00 0.38 0.00 0.00 41.96 42.01 2j3t s TYR 69 CO 0.31 -0.75 -0.17 0.21 -1.52 0.00 0.00 175.55 173.63 2j3t s LYS 70 N -4.07 2.24 -0.25 -3.49 2.20 0.97 -1.05 119.74 116.29 2j3t s LYS 70 Ca 0.35 -0.60 -0.10 0.00 -0.36 0.00 0.00 55.97 55.26 2j3t s LYS 70 Cb 0.05 -1.77 -0.05 0.00 -1.51 0.00 0.00 37.83 34.55 2j3t s LYS 70 CO 0.12 0.08 0.15 -1.17 -0.36 0.00 0.00 175.35 174.16 2j3t s LEU 71 N 0.56 3.93 -0.21 5.43 0.20 0.11 -0.91 118.68 127.79 2j3t s LEU 71 Ca -0.16 0.00 -0.09 0.00 0.69 0.00 0.00 54.13 54.57 2j3t s LEU 71 Cb -0.17 -2.06 -0.05 0.00 -0.43 0.00 0.00 46.19 43.48 2j3t s LEU 71 CO 0.05 0.01 0.12 -1.00 -0.29 0.00 0.00 176.35 175.25 2j3t s HIS 72 N 1.36 3.32 -0.12 5.38 3.76 0.23 -1.94 115.29 127.28 2j3t s HIS 72 Ca 0.07 0.19 0.01 0.00 -0.15 0.00 0.00 55.06 55.17 2j3t s HIS 72 Cb -0.15 -2.18 0.02 0.00 1.11 0.00 0.00 32.58 31.38 2j3t s HIS 72 CO 0.06 0.15 -0.13 -0.47 -0.85 0.00 0.00 174.74 173.50 2j3t s TYR 73 N 0.66 1.85 -0.08 1.40 5.04 -1.07 -0.50 117.35 124.64 2j3t s TYR 73 Ca 0.06 -0.92 0.03 0.00 -2.44 0.00 0.00 57.07 53.80 2j3t s TYR 73 Cb -0.12 -1.39 0.01 0.00 0.35 0.00 0.00 41.96 40.81 2j3t s TYR 73 CO 0.01 -0.52 -0.16 -0.47 -1.34 0.00 0.00 175.55 173.07 2j3t s TYR 74 N 1.29 1.87 -0.09 4.97 5.04 -0.51 -4.59 117.35 125.33 2j3t s TYR 74 Ca -0.01 -0.76 0.01 0.00 -2.44 0.00 0.00 57.07 53.87 2j3t s TYR 74 Cb -0.14 -1.32 0.02 0.00 0.35 0.00 0.00 41.96 40.87 2j3t s TYR 74 CO -0.06 -0.36 -0.11 -2.00 -1.34 0.00 0.00 175.55 171.69 2j3t s GLU 75 N 0.65 1.74 0.47 4.97 2.12 -1.26 -0.34 118.70 127.05 2j3t s GLU 75 Ca -0.14 -0.38 -0.08 0.00 0.36 0.00 0.00 54.97 54.73 2j3t s GLU 75 Cb -0.16 -1.58 -0.05 0.00 0.26 0.00 0.00 34.13 32.60 2j3t s GLU 75 CO 0.04 -0.11 0.81 0.95 -0.54 0.00 0.00 175.26 176.41 2j3t s THR 76 N 1.13 4.84 -0.22 -1.70 -4.23 -0.29 -4.94 115.64 110.23 2j3t s THR 76 Ca -0.05 0.44 0.16 0.00 -1.18 0.00 0.00 61.69 61.06 2j3t s THR 76 Cb -0.14 -3.82 0.16 0.00 1.34 0.00 0.00 72.50 70.05 2j3t s THR 76 CO -0.02 -0.76 1.46 -0.81 -0.54 0.00 0.00 174.62 173.95 2j3t n PRO 77 N -1.96 0.11 -0.26 3.99 -0.04 -1.26 -0.65 135.00 134.93 2j3t n PRO 77 Ca 0.02 0.59 0.09 0.00 -0.04 0.00 0.00 63.50 64.16 2j3t n PRO 77 Cb 0.55 -1.95 0.24 0.00 -0.04 0.00 0.00 33.50 32.30 2j3t n PRO 77 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2j3t n THR 78 N -2.09 0.67 -0.25 0.52 -2.24 -1.26 -4.93 114.28 104.70 2j3t n THR 78 Ca -0.01 -0.70 0.00 0.00 -2.27 0.00 0.00 64.05 61.07 2j3t n THR 78 Cb 0.12 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 2j3t n THR 78 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j3t n GLY 79 N 1.35 1.03 3.72 3.38 0.00 0.17 -4.60 105.19 110.25 2j3t n GLY 79 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2j3t n GLY 79 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2j3t s ILE 80 N -2.71 3.60 -0.17 -0.61 -1.09 -1.26 -3.19 121.20 115.78 2j3t s ILE 80 Ca 0.00 1.22 0.01 0.00 -2.23 0.00 0.00 60.65 59.65 2j3t s ILE 80 Cb 0.00 -3.78 0.02 0.00 -1.58 0.00 0.00 42.46 37.12 2j3t s ILE 80 CO 0.00 0.13 -0.20 -0.54 -1.23 0.00 0.00 174.94 173.10 2j3t s LYS 81 N 0.59 2.92 -0.40 2.79 1.02 0.59 -1.14 119.74 126.12 2j3t s LYS 81 Ca 0.59 -0.81 -0.10 0.00 0.02 0.00 0.00 55.97 55.66 2j3t s LYS 81 Cb -0.33 -2.49 0.05 0.00 -0.52 0.00 0.00 37.83 34.54 2j3t s LYS 81 CO 0.33 -0.17 0.23 0.08 -0.92 0.00 0.00 175.35 174.90 2j3t s VAL 82 N 1.20 4.47 -0.20 3.17 1.01 0.53 -0.49 120.40 130.09 2j3t s VAL 82 Ca 0.02 -1.08 -0.04 0.00 0.00 0.00 0.00 61.98 60.89 2j3t s VAL 82 Cb -0.14 -3.59 -0.01 0.00 0.00 0.00 0.00 36.38 32.64 2j3t s VAL 82 CO -0.10 -0.35 -0.05 -0.69 0.00 0.00 0.00 175.10 173.91 2j3t s VAL 83 N 1.51 3.50 -0.04 2.92 1.01 0.07 -1.42 120.40 127.95 2j3t s VAL 83 Ca 0.02 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.56 2j3t s VAL 83 Cb -0.21 -2.57 0.01 0.00 0.00 0.00 0.00 36.38 33.61 2j3t s VAL 83 CO 0.05 0.44 -0.10 -0.32 0.00 0.00 0.00 175.10 175.17 2j3t s MET 84 N 1.11 1.26 -0.15 2.72 1.75 0.35 -0.64 119.30 125.70 2j3t s MET 84 Ca 0.02 -0.35 -0.07 0.00 -1.25 0.00 0.00 55.69 54.04 2j3t s MET 84 Cb -0.15 -1.12 -0.04 0.00 2.84 0.00 0.00 34.83 36.37 2j3t s MET 84 CO -0.00 0.08 0.09 -0.80 -0.65 0.00 0.00 175.02 173.73 2j3t s ASN 85 N 0.40 5.89 0.33 1.11 0.01 -1.07 0.78 114.94 122.40 2j3t s ASN 85 Ca -0.08 0.24 0.04 0.00 -0.71 0.00 0.00 52.86 52.35 2j3t s ASN 85 Cb -0.12 -1.93 -0.02 0.00 0.41 0.00 0.00 41.25 39.59 2j3t s ASN 85 CO 0.02 0.28 0.34 0.42 -1.51 0.00 0.00 177.10 176.65 2j3t s THR 86 N -0.29 0.00 0.75 1.60 -4.23 -0.09 -1.35 115.64 112.03 2j3t s THR 86 Ca 0.09 -1.87 -0.11 0.00 -1.18 0.00 0.00 61.69 58.63 2j3t s THR 86 Cb -0.12 -2.55 0.04 0.00 1.34 0.00 0.00 72.50 71.21 2j3t s THR 86 CO 0.01 0.00 1.08 1.51 -0.54 0.00 0.00 174.62 176.68 2j3t s ASP 87 N -3.32 4.83 0.60 3.99 -4.77 -1.04 -0.02 116.67 116.94 2j3t s ASP 87 Ca 0.37 1.67 0.34 0.00 -3.30 0.00 0.00 52.55 51.64 2j3t s ASP 87 Cb 0.02 -2.45 1.84 0.00 -1.09 0.00 0.00 42.92 41.23 2j3t s ASP 87 CO 0.25 -1.80 2.03 -0.07 0.70 0.00 0.00 175.17 176.27 2j3t h LEU 88 N -0.97 0.00 -0.72 2.11 3.38 -1.87 -2.88 115.31 114.37 2j3t h LEU 88 Ca -0.44 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.46 2j3t h LEU 88 Cb 1.23 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.95 2j3t h LEU 88 CO 0.54 0.00 0.18 1.23 0.09 0.00 0.00 178.44 180.48 2j3t h GLY 89 N 0.00 1.23 -5.37 0.83 0.00 -1.96 -3.44 103.07 94.36 2j3t h GLY 89 Ca 0.00 -0.77 -0.55 0.00 0.00 0.00 0.00 47.33 46.02 2j3t h GLY 89 CO 0.00 0.72 1.19 -0.62 0.00 0.00 0.00 176.54 177.83 2j3t n VAL 90 N -4.24 0.67 -0.33 4.60 0.31 -1.09 -5.01 118.33 113.25 2j3t n VAL 90 Ca 0.05 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 2j3t n VAL 90 Cb 0.26 -2.21 0.00 0.00 -0.91 0.00 0.00 33.84 30.98 2j3t n VAL 90 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2j3t n GLY 91 N 4.47 -1.84 0.33 2.92 0.00 -1.26 -4.93 105.19 104.88 2j3t n GLY 91 Ca 0.20 -1.50 0.02 0.00 0.00 0.00 0.00 46.02 44.74 2j3t n GLY 91 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2j3t n PRO 92 N -0.66 -0.15 -3.12 1.61 -0.04 -1.26 -4.87 135.00 126.50 2j3t n PRO 92 Ca 0.00 1.38 -0.18 0.00 -0.04 0.00 0.00 63.50 64.66 2j3t n PRO 92 Cb 0.00 -2.05 -0.01 0.00 -0.04 0.00 0.00 33.50 31.40 2j3t n PRO 92 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 2j3t n ILE 93 N -5.37 -0.55 0.01 0.52 -5.35 -1.26 -4.84 119.36 102.52 2j3t n ILE 93 Ca 0.11 0.00 -0.02 0.00 -0.27 0.00 0.00 62.75 62.57 2j3t n ILE 93 Cb 0.40 -1.20 0.23 0.00 -1.74 0.00 0.00 39.64 37.33 2j3t n ILE 93 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 2j3t h ARG 94 N -0.53 0.48 -0.59 6.28 2.47 -2.00 -2.47 114.38 118.01 2j3t h ARG 94 Ca -0.32 -0.16 0.00 0.00 -1.26 0.00 0.00 59.98 58.25 2j3t h ARG 94 Cb 1.22 -0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 29.46 2j3t h ARG 94 CO 0.41 0.65 0.38 0.38 0.56 0.00 0.00 179.97 182.35 2j3t h ASP 95 N 0.44 0.68 -0.20 7.04 -0.00 -1.99 -1.55 116.42 120.83 2j3t h ASP 95 Ca 0.07 -0.02 -0.05 0.00 -0.00 0.00 0.00 57.03 57.04 2j3t h ASP 95 Cb 0.57 -0.17 -0.01 0.00 -0.00 0.00 0.00 39.33 39.72 2j3t h ASP 95 CO 0.04 0.50 -0.06 0.58 -0.00 0.00 0.00 179.24 180.31 2j3t h VAL 96 N 0.80 1.29 -0.72 4.15 2.07 -1.84 -1.29 116.25 120.71 2j3t h VAL 96 Ca 0.22 -1.05 -0.03 0.00 0.82 0.00 0.00 66.70 66.65 2j3t h VAL 96 Cb -0.08 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 2j3t h VAL 96 CO -0.05 0.32 0.31 -0.07 0.02 0.00 0.00 177.57 178.11 2j3t h LEU 97 N 0.12 0.96 -0.98 2.57 3.38 -1.24 -1.71 115.31 118.40 2j3t h LEU 97 Ca 0.05 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 2j3t h LEU 97 Cb 0.51 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2j3t h LEU 97 CO 0.02 0.83 -0.48 -0.74 0.09 0.00 0.00 178.44 178.17 2j3t h HIS 98 N 1.03 0.08 -0.53 1.13 2.76 -1.23 -2.81 115.15 115.58 2j3t h HIS 98 Ca 0.25 -0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.29 2j3t h HIS 98 Cb 0.16 -0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.08 2j3t h HIS 98 CO 0.01 0.54 -0.05 1.25 -1.30 0.00 0.00 177.93 178.38 2j3t h HIS 99 N 0.06 1.08 -0.85 5.26 -0.00 -0.63 0.25 115.15 120.32 2j3t h HIS 99 Ca 0.00 -0.21 -0.01 0.00 -0.00 0.00 0.00 60.37 60.16 2j3t h HIS 99 Cb 0.87 -0.27 -0.04 0.00 -0.00 0.00 0.00 27.41 27.96 2j3t h HIS 99 CO 0.00 1.00 0.51 0.82 -0.00 0.00 0.00 177.93 180.26 2j3t h ILE 100 N 0.85 1.24 -0.05 6.26 2.04 -1.13 0.18 117.51 126.90 2j3t h ILE 100 Ca 0.14 -0.52 -0.07 0.00 1.00 0.00 0.00 64.86 65.41 2j3t h ILE 100 Cb 0.61 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2j3t h ILE 100 CO 0.04 0.25 -0.25 0.22 0.00 0.00 0.00 178.15 178.41 2j3t h TYR 101 N 1.17 0.34 0.14 1.37 3.20 -1.26 -0.73 116.97 121.21 2j3t h TYR 101 Ca 0.30 -0.15 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 2j3t h TYR 101 Cb -0.04 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.18 2j3t h TYR 101 CO 0.01 0.88 -0.07 1.03 -1.64 0.00 0.00 178.16 178.36 2j3t h SER 102 N -0.29 -0.16 1.40 -2.11 0.87 -0.37 -0.25 113.55 112.64 2j3t h SER 102 Ca -0.02 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2j3t h SER 102 Cb 0.91 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.91 2j3t h SER 102 CO 0.05 0.35 0.00 0.00 -0.53 0.00 0.00 176.83 176.70 2j3t n ALA 103 N -2.74 2.26 0.00 6.23 0.00 0.61 -3.28 120.51 123.59 2j3t n ALA 103 Ca -0.03 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2j3t n ALA 103 Cb 0.12 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.10 2j3t n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2j3t n LEU 104 N -2.19 0.39 0.05 0.00 4.77 -1.17 -4.57 117.00 114.29 2j3t n LEU 104 Ca 0.06 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.93 2j3t n LEU 104 Cb 0.41 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.43 2j3t n LEU 104 CO 0.30 0.03 0.38 0.22 -1.33 0.00 0.00 177.39 176.99 2j3t h TYR 105 N 0.00 -0.19 0.07 -1.77 3.20 -1.13 -1.83 116.97 115.32 2j3t h TYR 105 Ca 0.00 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 2j3t h TYR 105 Cb 0.92 0.06 0.00 0.00 1.54 0.00 0.00 36.73 39.26 2j3t h TYR 105 CO 0.00 0.25 -0.03 0.28 -1.64 0.00 0.00 178.16 177.01 2j3t h VAL 106 N -0.87 0.95 -0.70 1.81 2.07 -1.15 0.32 116.25 118.67 2j3t h VAL 106 Ca -0.02 -0.06 -0.05 0.00 0.82 0.00 0.00 66.70 67.38 2j3t h VAL 106 Cb 0.52 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 2j3t h VAL 106 CO 0.03 0.02 0.23 -0.08 0.02 0.00 0.00 177.57 177.79 2j3t h GLU 107 N -0.12 1.07 -0.15 1.57 4.57 -1.68 0.13 114.58 119.96 2j3t h GLU 107 Ca -0.01 -0.22 0.00 0.00 -1.18 0.00 0.00 59.36 57.95 2j3t h GLU 107 Cb 0.10 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.52 2j3t h GLU 107 CO 0.02 0.91 0.00 1.19 -1.18 0.00 0.00 179.01 179.95 2j3t n PHE 108 N -4.26 0.20 0.08 0.92 3.72 -0.69 -4.26 117.46 113.16 2j3t n PHE 108 Ca 0.06 -0.29 0.00 0.00 -0.05 0.00 0.00 57.45 57.17 2j3t n PHE 108 Cb 0.22 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.74 2j3t n PHE 108 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2j3t n VAL 109 N 0.35 0.83 -0.24 -4.37 0.31 0.02 -4.59 118.33 110.65 2j3t n VAL 109 Ca 0.07 0.27 -0.06 0.00 -0.01 0.00 0.00 64.34 64.61 2j3t n VAL 109 Cb 0.31 -1.24 0.04 0.00 -0.91 0.00 0.00 33.84 32.04 2j3t n VAL 109 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2j3t h VAL 110 N 0.00 1.22 0.00 2.52 2.07 -0.83 -2.05 116.25 119.18 2j3t h VAL 110 Ca 0.00 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 66.94 2j3t h VAL 110 Cb 0.00 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 2j3t h VAL 110 CO 0.00 0.25 0.00 0.29 0.02 0.00 0.00 177.57 178.13 2j3t n LYS 111 N -4.49 0.95 -3.66 1.57 5.02 0.40 -4.47 118.16 113.48 2j3t n LYS 111 Ca 0.05 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.96 2j3t n LYS 111 Cb 0.11 -1.26 -0.08 0.00 -0.02 0.00 0.00 35.03 33.77 2j3t n LYS 111 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2j3t s ASN 112 N -1.54 5.47 0.57 4.39 3.84 -0.77 -4.96 114.94 121.93 2j3t s ASN 112 Ca 0.24 -2.88 0.35 0.00 0.21 0.00 0.00 52.86 50.78 2j3t s ASN 112 Cb 0.11 -1.91 1.45 0.00 -0.55 0.00 0.00 41.25 40.35 2j3t s ASN 112 CO 0.18 -0.39 1.71 1.55 -2.79 0.00 0.00 177.10 177.37 2j3t h PRO 113 N 7.08 0.00 -0.02 0.43 0.13 -1.80 0.74 132.00 138.55 2j3t h PRO 113 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2j3t h PRO 113 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 2j3t h PRO 113 CO 0.72 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.77 2j3t n LEU 114 N -3.87 0.17 -4.18 1.56 4.77 -1.26 -4.59 117.00 109.61 2j3t n LEU 114 Ca 0.23 -0.08 -0.39 0.00 -0.03 0.00 0.00 56.01 55.74 2j3t n LEU 114 Cb 1.25 -0.02 -0.09 0.00 -2.33 0.00 0.00 43.42 42.23 2j3t n LEU 114 CO 0.35 0.04 -0.03 0.00 -1.33 0.00 0.00 177.39 176.42 2j3t s PRO 116 N 1.07 4.11 0.25 0.00 0.02 -1.26 -4.88 135.00 134.30 2j3t s PRO 116 Ca 0.08 2.59 -0.18 0.00 0.02 0.00 0.00 61.00 63.51 2j3t s PRO 116 Cb -0.24 -2.99 -0.08 0.00 0.02 0.00 0.00 34.50 31.20 2j3t s PRO 116 CO -0.02 -0.61 0.73 -0.51 -0.33 0.00 0.00 177.00 176.26 2j3t s LEU 117 N -1.19 4.27 0.00 -5.54 1.02 -1.26 -4.08 118.68 111.90 2j3t s LEU 117 Ca 0.59 1.39 0.00 0.00 0.02 0.00 0.00 54.13 56.13 2j3t s LEU 117 Cb -0.48 -3.71 0.00 0.00 0.02 0.00 0.00 46.19 42.02 2j3t s LEU 117 CO 0.55 -0.03 0.00 0.61 0.02 0.00 0.00 176.35 177.50 2j3t n GLY 118 N 0.45 0.64 3.19 -3.19 0.00 -1.26 -5.06 105.19 99.96 2j3t n GLY 118 Ca -0.01 -0.50 -0.09 0.00 0.00 0.00 0.00 46.02 45.42 2j3t n GLY 118 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2j3t s GLN 119 N -1.01 0.79 -0.06 1.61 -0.21 -1.26 -4.97 119.66 114.55 2j3t s GLN 119 Ca 0.00 -0.88 -0.37 0.00 0.02 0.00 0.00 55.36 54.13 2j3t s GLN 119 Cb 0.00 0.32 -0.15 0.00 1.00 0.00 0.00 33.01 34.18 2j3t s GLN 119 CO 0.00 -0.24 1.63 2.41 -2.12 0.00 0.00 175.29 176.97 2j3t n THR 120 N 0.14 0.23 -1.89 -0.19 -1.04 -1.26 -4.70 114.28 105.58 2j3t n THR 120 Ca -0.16 -0.04 -0.42 0.00 -2.04 0.00 0.00 64.05 61.39 2j3t n THR 120 Cb 0.61 -1.30 -0.03 0.00 -1.82 0.00 0.00 70.33 67.79 2j3t n THR 120 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2j3t s VAL 121 N 2.37 2.55 -0.29 12.58 1.01 0.30 -4.91 120.40 134.01 2j3t s VAL 121 Ca 0.90 0.35 0.20 0.00 0.00 0.00 0.00 61.98 63.44 2j3t s VAL 121 Cb -0.89 -3.23 -0.28 0.00 0.00 0.00 0.00 36.38 31.98 2j3t s VAL 121 CO 0.53 0.02 0.55 0.00 0.00 0.00 0.00 175.10 176.21 2j3t n GLN 122 N 4.20 0.59 -1.59 2.72 1.13 -1.26 -4.98 117.38 118.19 2j3t n GLN 122 Ca 0.15 -0.13 -0.49 0.00 -1.94 0.00 0.00 57.00 54.58 2j3t n GLN 122 Cb 0.38 -1.46 -0.06 0.00 0.11 0.00 0.00 30.24 29.21 2j3t n GLN 122 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2j3t n SER 123 N -1.98 2.87 0.03 1.08 2.88 -1.26 -4.85 113.62 112.39 2j3t n SER 123 Ca -0.02 0.68 0.02 0.00 -1.33 0.00 0.00 58.87 58.23 2j3t n SER 123 Cb 0.46 -1.34 0.36 0.00 -0.75 0.00 0.00 64.21 62.95 2j3t n SER 123 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2j3t h GLU 124 N 10.92 0.45 0.94 -1.46 5.08 -1.97 -2.56 114.58 125.98 2j3t h GLU 124 Ca -0.40 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 57.84 2j3t h GLU 124 Cb 1.29 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 30.47 2j3t h GLU 124 CO 0.98 0.44 -0.45 1.25 -1.00 0.00 0.00 179.01 180.23 2j3t h LEU 125 N 0.44 -1.07 -0.73 1.33 6.46 -1.95 0.15 115.31 119.96 2j3t h LEU 125 Ca 0.10 0.04 0.16 0.00 -0.12 0.00 0.00 57.88 58.06 2j3t h LEU 125 Cb 0.22 0.28 -0.13 0.00 -0.73 0.00 0.00 40.66 40.30 2j3t h LEU 125 CO 0.00 -0.74 -0.03 0.15 -0.62 0.00 0.00 178.44 177.20 2j3t h PHE 126 N -1.30 -0.10 -0.81 1.25 3.57 -1.78 0.13 116.94 117.89 2j3t h PHE 126 Ca -0.13 0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.40 2j3t h PHE 126 Cb 0.97 0.16 -0.04 0.00 2.79 0.00 0.00 35.95 39.83 2j3t h PHE 126 CO -0.00 -0.24 0.38 0.00 -2.23 0.00 0.00 178.31 176.22 2j3t h ARG 127 N 0.09 1.17 0.28 1.11 3.08 -1.27 -0.89 114.38 117.95 2j3t h ARG 127 Ca 0.39 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 2j3t h ARG 127 Cb 0.66 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.51 2j3t h ARG 127 CO -0.66 0.91 -0.14 0.77 -1.07 0.00 0.00 179.97 179.78 2j3t h SER 128 N 1.15 -0.32 -0.75 7.04 0.02 0.11 -2.49 113.55 118.30 2j3t h SER 128 Ca 0.28 -0.14 0.08 0.00 -0.84 0.00 0.00 61.79 61.16 2j3t h SER 128 Cb 0.13 0.08 -0.06 0.00 0.14 0.00 0.00 62.40 62.69 2j3t h SER 128 CO -0.03 -0.03 0.42 0.03 -1.14 0.00 0.00 176.83 176.08 2j3t h ARG 129 N -0.63 0.72 0.99 3.45 -0.00 -0.78 -0.59 114.38 117.53 2j3t h ARG 129 Ca -0.04 -0.04 -0.05 0.00 -0.50 0.00 0.00 59.98 59.35 2j3t h ARG 129 Cb 0.45 -0.16 0.01 0.00 0.00 0.00 0.00 29.97 30.26 2j3t h ARG 129 CO 0.06 0.48 -0.48 1.25 0.00 0.00 0.00 179.97 181.28 2j3t h LEU 130 N 0.74 -1.15 -0.55 3.04 5.85 -1.18 0.10 115.31 122.17 2j3t h LEU 130 Ca 0.35 0.04 0.11 0.00 0.84 0.00 0.00 57.88 59.22 2j3t h LEU 130 Cb 0.28 0.30 -0.09 0.00 0.37 0.00 0.00 40.66 41.52 2j3t h LEU 130 CO -0.22 -0.81 0.04 -0.78 -0.34 0.00 0.00 178.44 176.33 2j3t h ASP 131 N -1.33 -0.15 -0.48 1.25 1.82 -1.30 0.11 116.42 116.34 2j3t h ASP 131 Ca -0.14 0.12 0.01 0.00 -0.39 0.00 0.00 57.03 56.64 2j3t h ASP 131 Cb 1.03 0.20 -0.03 0.00 0.68 0.00 0.00 39.33 41.21 2j3t h ASP 131 CO 0.22 -0.05 0.30 -1.28 -1.61 0.00 0.00 179.24 176.82 2j3t h SER 132 N 0.16 0.51 0.21 2.28 0.87 -1.04 -0.79 113.55 115.75 2j3t h SER 132 Ca 0.28 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.82 2j3t h SER 132 Cb 0.43 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 2j3t h SER 132 CO -0.43 0.37 -0.10 0.22 -0.53 0.00 0.00 176.83 176.36 2j3t h TYR 133 N 0.62 -0.26 -0.57 2.24 3.20 0.68 -2.85 116.97 120.03 2j3t h TYR 133 Ca 0.18 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.06 2j3t h TYR 133 Cb -0.04 0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.28 2j3t h TYR 133 CO -0.05 -0.15 0.36 0.28 -1.64 0.00 0.00 178.16 176.96 2j3t h VAL 134 N -0.30 1.09 0.00 1.81 2.07 -0.75 -0.76 116.25 119.42 2j3t h VAL 134 Ca -0.03 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2j3t h VAL 134 Cb 0.23 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 2j3t h VAL 134 CO 0.05 0.13 0.00 0.54 0.02 0.00 0.00 177.57 178.31 2j3t n ARG 135 N -4.73 0.07 0.07 1.57 1.74 -0.31 -1.79 116.66 113.27 2j3t n ARG 135 Ca 0.05 0.54 -0.21 0.00 -0.77 0.00 0.00 57.85 57.46 2j3t n ARG 135 Cb 0.06 -1.71 -0.15 0.00 -1.02 0.00 0.00 32.46 29.64 2j3t n ARG 135 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 2j3t h SER 136 N 0.00 0.53 -0.96 0.55 0.02 -0.90 -3.47 113.55 109.32 2j3t h SER 136 Ca 0.00 -0.78 -0.75 0.00 -0.84 0.00 0.00 61.79 59.43 2j3t h SER 136 Cb 0.03 -0.17 0.05 0.00 0.14 0.00 0.00 62.40 62.45 2j3t h SER 136 CO 0.00 1.65 0.03 0.18 -1.14 0.00 0.00 176.83 177.55 2j3t n LEU 137 N -3.53 -0.07 -0.16 5.07 4.77 -0.74 -4.81 117.00 117.53 2j3t n LEU 137 Ca -0.22 1.11 0.21 0.00 -0.03 0.00 0.00 56.01 57.08 2j3t n LEU 137 Cb 1.06 -0.88 0.60 0.00 -2.33 0.00 0.00 43.42 41.88 2j3t n LEU 137 CO 0.51 -1.88 1.22 1.55 -1.33 0.00 0.00 177.39 177.46 2j3t h PRO 138 N 2.77 0.21 -0.74 3.23 0.13 -1.92 -1.55 132.00 134.13 2j3t h PRO 138 Ca -0.48 -0.01 -0.14 0.00 -0.87 0.00 0.00 66.00 64.50 2j3t h PRO 138 Cb 1.37 -0.05 -0.08 0.00 0.13 0.00 0.00 31.00 32.37 2j3t h PRO 138 CO 0.62 0.14 0.18 1.97 -0.23 0.00 0.00 178.00 180.68 2j3t n PHE 139 N -4.41 2.12 -0.01 1.56 1.16 -1.26 -4.57 117.46 112.04 2j3t n PHE 139 Ca 0.16 -0.96 -0.13 0.00 -1.87 0.00 0.00 57.45 54.65 2j3t n PHE 139 Cb 0.71 -0.59 -0.10 0.00 -1.61 0.00 0.00 39.48 37.89 2j3t n PHE 139 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 2j3t h PHE 140 N 2.72 0.02 -4.27 2.97 3.57 -1.56 0.26 116.94 120.64 2j3t h PHE 140 Ca 0.17 -0.01 -0.51 0.00 3.53 0.00 0.00 57.97 61.16 2j3t h PHE 140 Cb 2.07 -0.00 0.11 0.00 2.79 0.00 0.00 35.95 40.92 2j3t h PHE 140 CO 1.11 0.49 0.35 0.45 -2.23 0.00 0.00 178.31 178.48 2j3t s SER 141 N -5.71 4.90 0.04 0.41 0.15 -1.26 -1.47 113.70 110.75 2j3t s SER 141 Ca -0.16 1.85 0.22 0.00 0.70 0.00 0.00 55.95 58.57 2j3t s SER 141 Cb 0.02 -2.53 -0.16 0.00 -1.71 0.00 0.00 66.02 61.64 2j3t s SER 141 CO 0.68 -1.77 0.78 0.00 1.20 0.00 0.00 173.24 174.13 2j3t n ALA 142 N -3.02 3.17 0.00 5.45 0.00 -1.26 -2.45 120.51 122.39 2j3t n ALA 142 Ca 0.09 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.08 2j3t n ALA 142 Cb 0.53 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 19.10 2j3t n ALA 142 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39