#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jmx s GLN 3 N 0.00 3.77 0.13 3.49 -1.52 -1.26 -4.97 119.66 119.30 1jmx s GLN 3 Ca 0.00 0.44 -0.22 0.00 -1.95 0.00 0.00 55.36 53.62 1jmx s GLN 3 Cb 0.00 -2.41 -0.02 0.00 -0.22 0.00 0.00 33.01 30.36 1jmx s GLN 3 CO 0.00 -0.02 1.66 0.78 -0.25 0.00 0.00 175.29 177.46 1jmx h GLY 4 N 1.28 -0.11 0.69 3.09 0.00 -1.99 -2.55 103.07 103.48 1jmx h GLY 4 Ca -0.47 0.20 0.08 0.00 0.00 0.00 0.00 47.33 47.14 1jmx h GLY 4 CO 0.64 -0.16 0.64 -0.56 0.00 0.00 0.00 176.54 177.10 1jmx h PRO 5 N -0.21 1.09 -0.09 4.80 0.13 -1.96 -0.81 132.00 134.94 1jmx h PRO 5 Ca 0.09 -0.07 -0.21 0.00 -0.87 0.00 0.00 66.00 64.95 1jmx h PRO 5 Cb 0.34 -0.25 0.00 0.00 0.13 0.00 0.00 31.00 31.23 1jmx h PRO 5 CO -0.25 0.72 -0.78 0.66 -0.23 0.00 0.00 178.00 178.12 1jmx h SER 6 N 1.12 0.68 -0.21 1.44 4.64 -1.94 -2.84 113.55 116.44 1jmx h SER 6 Ca 0.44 -0.46 -0.12 0.00 -0.47 0.00 0.00 61.79 61.19 1jmx h SER 6 Cb 0.24 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 1jmx h SER 6 CO -0.19 1.23 -0.27 -0.07 -0.87 0.00 0.00 176.83 176.66 1jmx h LEU 7 N 0.37 0.71 -0.59 5.97 3.38 -1.15 -0.86 115.31 123.14 1jmx h LEU 7 Ca -0.05 -0.27 0.06 0.00 0.09 0.00 0.00 57.88 57.71 1jmx h LEU 7 Cb 1.39 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.89 1jmx h LEU 7 CO 0.15 0.94 0.30 -0.07 0.09 0.00 0.00 178.44 179.85 1jmx h LEU 8 N 0.60 0.43 -0.01 1.67 3.38 -1.08 -1.19 115.31 119.10 1jmx h LEU 8 Ca 0.08 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 1jmx h LEU 8 Cb 0.76 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1jmx h LEU 8 CO 0.06 0.28 -0.12 -0.61 0.09 0.00 0.00 178.44 178.15 1jmx h GLN 9 N 0.57 0.10 -0.15 1.13 4.15 -1.32 -2.05 115.11 117.55 1jmx h GLN 9 Ca 0.27 -0.09 -0.01 0.00 0.77 0.00 0.00 58.65 59.59 1jmx h GLN 9 Cb 0.19 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 1jmx h GLN 9 CO -0.19 0.80 0.06 -0.91 -1.93 0.00 0.00 178.83 176.67 1jmx h ASN 10 N -0.57 0.18 0.00 -0.69 4.21 -1.07 -2.67 115.58 114.96 1jmx h ASN 10 Ca -0.01 -0.01 -0.06 0.00 1.21 0.00 0.00 56.30 57.43 1jmx h ASN 10 Cb 0.84 -0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 37.98 1jmx h ASN 10 CO 0.02 0.17 -1.69 0.29 -1.29 0.00 0.00 177.43 174.93 1jmx n LYS 11 N -4.48 0.80 -0.06 0.81 4.76 -0.46 -4.76 118.16 114.77 1jmx n LYS 11 Ca -0.01 -0.10 -0.06 0.00 -2.87 0.00 0.00 58.31 55.27 1jmx n LYS 11 Cb 0.11 -1.33 -0.09 0.00 -1.84 0.00 0.00 35.03 31.88 1jmx n LYS 11 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1jmx n MET 13 N -2.51 0.27 0.00 0.00 0.00 -1.01 -1.39 117.12 112.48 1jmx n MET 13 Ca -0.20 0.16 0.00 0.00 0.00 0.00 0.00 57.70 57.66 1jmx n MET 13 Cb 0.87 -2.39 0.00 0.00 0.00 0.00 0.00 33.22 31.70 1jmx n MET 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1jmx n GLY 14 N 0.68 3.11 0.03 -5.12 0.00 -1.26 -4.55 105.19 98.08 1jmx n GLY 14 Ca 0.13 -0.93 -0.04 0.00 0.00 0.00 0.00 46.02 45.19 1jmx n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jmx s HIS 16 N -2.15 3.13 0.03 0.00 3.76 -0.48 -5.04 115.29 114.53 1jmx s HIS 16 Ca -0.06 -0.16 -0.26 0.00 -0.15 0.00 0.00 55.06 54.43 1jmx s HIS 16 Cb 0.02 -2.05 -0.05 0.00 1.11 0.00 0.00 32.58 31.61 1jmx s HIS 16 CO 0.22 -0.01 0.80 0.96 -0.85 0.00 0.00 174.74 175.87 1jmx s ILE 17 N 0.56 4.78 0.22 0.60 -5.25 -1.26 -4.15 121.20 116.70 1jmx s ILE 17 Ca 0.01 1.70 -0.30 0.00 -0.99 0.00 0.00 60.65 61.06 1jmx s ILE 17 Cb -0.14 -4.15 -0.10 0.00 2.95 0.00 0.00 42.46 41.03 1jmx s ILE 17 CO 0.02 0.31 1.42 -2.84 -1.79 0.00 0.00 174.94 172.06 1jmx s PRO 18 N 0.25 4.29 0.00 0.37 0.02 -1.26 -0.78 135.00 137.90 1jmx s PRO 18 Ca 0.41 2.23 0.03 0.00 0.02 0.00 0.00 61.00 63.69 1jmx s PRO 18 Cb -0.20 -3.14 0.03 0.00 0.02 0.00 0.00 34.50 31.20 1jmx s PRO 18 CO 0.23 -0.40 0.65 0.39 -0.33 0.00 0.00 177.00 177.54 1jmx n GLU 19 N 2.70 -0.12 0.00 5.54 1.02 0.00 -4.90 120.64 124.89 1jmx n GLU 19 Ca 0.08 -0.79 0.00 0.00 -0.02 0.00 0.00 57.16 56.42 1jmx n GLU 19 Cb 0.41 -1.05 0.00 0.00 -0.02 0.00 0.00 31.44 30.78 1jmx n GLU 19 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1jmx n GLY 20 N 0.08 3.64 1.61 0.62 0.00 -1.24 -4.93 105.19 104.97 1jmx n GLY 20 Ca 0.02 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1jmx n GLY 20 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1jmx n ASN 21 N 0.00 0.00 -1.37 1.61 2.04 -1.26 -0.07 115.26 116.21 1jmx n ASN 21 Ca 0.00 0.00 -0.17 0.00 -0.44 0.00 0.00 54.58 53.97 1jmx n ASN 21 Cb 0.00 0.00 -0.06 0.00 -2.53 0.00 0.00 39.78 37.19 1jmx n ASN 21 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 1jmx n ASP 22 N 0.40 -5.00 -4.62 0.53 8.00 -1.26 -5.01 116.55 109.59 1jmx n ASP 22 Ca 0.00 0.35 -0.33 0.00 0.71 0.00 0.00 54.79 55.52 1jmx n ASP 22 Cb 0.00 -3.99 -0.10 0.00 -0.02 0.00 0.00 41.12 37.00 1jmx n ASP 22 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1jmx s THR 23 N -2.65 3.86 0.14 -3.53 -4.23 0.90 -5.02 115.64 105.10 1jmx s THR 23 Ca 0.00 -0.59 0.04 0.00 -1.18 0.00 0.00 61.69 59.96 1jmx s THR 23 Cb 0.00 -2.65 -0.04 0.00 1.34 0.00 0.00 72.50 71.14 1jmx s THR 23 CO 0.00 0.47 -0.09 -0.31 -0.54 0.00 0.00 174.62 174.16 1jmx s TYR 24 N -0.95 1.20 0.44 3.99 2.02 -1.26 -0.81 117.35 121.98 1jmx s TYR 24 Ca 0.16 -0.81 -0.25 0.00 -0.37 0.00 0.00 57.07 55.80 1jmx s TYR 24 Cb -0.11 -0.63 -0.08 0.00 -0.40 0.00 0.00 41.96 40.74 1jmx s TYR 24 CO 0.06 0.02 1.36 -1.54 -1.57 0.00 0.00 175.55 173.87 1jmx s SER 25 N -3.15 5.99 0.00 2.29 1.04 0.04 -2.51 113.70 117.40 1jmx s SER 25 Ca 0.16 2.77 0.00 0.00 0.48 0.00 0.00 55.95 59.36 1jmx s SER 25 Cb 0.03 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.51 1jmx s SER 25 CO -0.00 -1.08 0.00 0.54 0.98 0.00 0.00 173.24 173.68 1jmx n ARG 26 N -0.18 0.00 -0.24 4.02 5.12 -1.26 -4.53 116.66 119.59 1jmx n ARG 26 Ca 0.05 0.00 0.04 0.00 -1.93 0.00 0.00 57.85 56.02 1jmx n ARG 26 Cb 0.43 0.00 0.16 0.00 -1.16 0.00 0.00 32.46 31.89 1jmx n ARG 26 CO 0.00 0.00 0.00 0.82 -1.93 0.00 0.00 177.63 176.52 1jmx h ILE 27 N 0.00 0.50 -0.30 0.55 2.04 -1.96 -1.77 117.51 116.57 1jmx h ILE 27 Ca 0.00 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.78 1jmx h ILE 27 Cb 0.00 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 36.33 1jmx h ILE 27 CO 0.00 0.04 0.00 -1.20 0.00 0.00 0.00 178.15 176.99 1jmx n SER 28 N -5.19 3.17 -0.54 1.72 7.64 -1.05 -3.94 113.62 115.43 1jmx n SER 28 Ca 0.13 -2.40 0.05 0.00 1.01 0.00 0.00 58.87 57.66 1jmx n SER 28 Cb 0.44 -0.55 0.09 0.00 -1.01 0.00 0.00 64.21 63.18 1jmx n SER 28 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1jmx n HIS 29 N 0.35 0.00 -3.85 1.43 8.25 -0.67 -4.99 115.22 115.74 1jmx n HIS 29 Ca 0.14 -0.68 -0.12 0.00 -0.26 0.00 0.00 57.72 56.80 1jmx n HIS 29 Cb 0.67 -0.13 -0.11 0.00 1.12 0.00 0.00 29.99 31.53 1jmx n HIS 29 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1jmx s GLN 30 N -1.53 0.40 -0.07 -0.41 -0.21 -1.25 -4.23 119.66 112.36 1jmx s GLN 30 Ca 0.23 -0.20 0.03 0.00 0.02 0.00 0.00 55.36 55.43 1jmx s GLN 30 Cb 0.22 0.17 0.01 0.00 1.00 0.00 0.00 33.01 34.41 1jmx s GLN 30 CO -0.03 -0.09 -0.15 1.03 -2.12 0.00 0.00 175.29 173.93 1jmx s ARG 31 N -0.93 1.97 0.27 2.91 0.52 -0.58 -4.86 118.95 118.25 1jmx s ARG 31 Ca -0.10 -0.52 0.00 0.00 -0.52 0.00 0.00 55.73 54.59 1jmx s ARG 31 Cb -0.06 -1.59 -0.03 0.00 0.52 0.00 0.00 34.95 33.80 1jmx s ARG 31 CO 0.01 0.08 0.28 0.15 0.02 0.00 0.00 175.30 175.84 1jmx s LYS 32 N 0.53 1.55 0.81 3.54 1.02 -0.97 -1.28 119.74 124.93 1jmx s LYS 32 Ca -0.14 -1.74 -0.12 0.00 0.02 0.00 0.00 55.97 53.98 1jmx s LYS 32 Cb -0.16 0.34 0.08 0.00 -0.52 0.00 0.00 37.83 37.57 1jmx s LYS 32 CO 0.05 -0.57 1.17 0.95 -0.92 0.00 0.00 175.35 176.02 1jmx s THR 33 N -3.71 2.12 0.24 2.17 -4.23 -1.24 -4.14 115.64 106.84 1jmx s THR 33 Ca 0.36 0.04 -0.06 0.00 -1.18 0.00 0.00 61.69 60.85 1jmx s THR 33 Cb 0.03 -3.02 0.20 0.00 1.34 0.00 0.00 72.50 71.05 1jmx s THR 33 CO 0.18 -0.05 1.83 -0.65 -0.54 0.00 0.00 174.62 175.39 1jmx h PRO 34 N -1.06 0.83 0.00 3.99 0.11 -1.93 -0.95 132.00 133.00 1jmx h PRO 34 Ca -0.46 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 1jmx h PRO 34 Cb 1.32 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1jmx h PRO 34 CO 0.66 0.55 -0.08 1.05 -0.21 0.00 0.00 178.00 179.96 1jmx h GLU 35 N 0.85 0.00 -0.15 1.05 9.09 -1.97 -2.17 114.58 121.28 1jmx h GLU 35 Ca 0.36 0.00 -0.08 0.00 0.05 0.00 0.00 59.36 59.70 1jmx h GLU 35 Cb 0.23 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.33 1jmx h GLU 35 CO -0.20 0.08 -0.20 0.78 0.05 0.00 0.00 179.01 179.52 1jmx h GLY 36 N 2.80 0.44 1.00 1.06 0.00 -1.57 -1.66 103.07 105.13 1jmx h GLY 36 Ca -0.00 -0.48 -0.02 0.00 0.00 0.00 0.00 47.33 46.83 1jmx h GLY 36 CO 0.01 0.43 0.31 1.49 0.00 0.00 0.00 176.54 178.78 1jmx h TRP 37 N 0.02 0.90 -0.94 5.60 4.06 -1.10 -1.67 115.95 122.82 1jmx h TRP 37 Ca 0.02 -0.04 0.01 0.00 2.06 0.00 0.00 58.89 60.94 1jmx h TRP 37 Cb 0.76 -0.28 -0.05 0.00 -1.00 0.00 0.00 29.16 28.59 1jmx h TRP 37 CO 0.09 0.68 0.62 1.25 -3.56 0.00 0.00 178.44 177.52 1jmx h LEU 38 N 0.87 1.09 -0.92 -4.49 5.85 -1.36 -2.27 115.31 114.07 1jmx h LEU 38 Ca 0.22 -0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.83 1jmx h LEU 38 Cb 0.10 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 1jmx h LEU 38 CO -0.03 0.80 -0.08 0.24 -0.34 0.00 0.00 178.44 179.03 1jmx h MET 39 N 1.28 0.70 -0.27 1.25 2.86 -0.71 -0.70 114.93 119.36 1jmx h MET 39 Ca 0.35 -0.21 -0.08 0.00 -2.06 0.00 0.00 59.70 57.70 1jmx h MET 39 Cb -0.14 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.44 1jmx h MET 39 CO -0.07 0.77 -0.13 0.77 1.06 0.00 0.00 176.91 179.31 1jmx h SER 40 N 0.65 0.58 -0.49 1.22 0.02 -0.88 -1.92 113.55 112.73 1jmx h SER 40 Ca 0.12 -0.41 -0.10 0.00 -0.84 0.00 0.00 61.79 60.56 1jmx h SER 40 Cb 0.52 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 1jmx h SER 40 CO 0.03 0.86 -0.06 0.40 -1.14 0.00 0.00 176.83 176.91 1jmx h ILE 41 N 0.29 1.26 -0.30 3.27 2.04 -1.33 -2.14 117.51 120.61 1jmx h ILE 41 Ca 0.06 -1.18 -0.05 0.00 1.00 0.00 0.00 64.86 64.69 1jmx h ILE 41 Cb 0.64 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 1jmx h ILE 41 CO 0.04 0.42 -0.02 0.00 0.00 0.00 0.00 178.15 178.58 1jmx h ALA 42 N 1.06 1.41 -0.26 1.87 0.00 -1.08 -1.56 119.26 120.71 1jmx h ALA 42 Ca 0.15 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1jmx h ALA 42 Cb 0.59 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1jmx h ALA 42 CO 0.04 0.41 -0.28 0.00 0.00 0.00 0.00 179.25 179.42 1jmx h ARG 43 N 0.44 0.51 -0.47 0.00 3.08 -0.83 -1.67 114.38 115.45 1jmx h ARG 43 Ca 0.10 -0.21 -0.03 0.00 0.07 0.00 0.00 59.98 59.90 1jmx h ARG 43 Cb 0.33 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 1jmx h ARG 43 CO 0.01 0.75 0.15 0.52 -1.07 0.00 0.00 179.97 180.33 1jmx h MET 44 N 0.45 0.68 -0.00 0.04 2.86 -0.67 0.11 114.93 118.39 1jmx h MET 44 Ca 0.06 -0.11 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 1jmx h MET 44 Cb 0.73 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.27 1jmx h MET 44 CO 0.06 0.59 -0.16 1.96 1.06 0.00 0.00 176.91 180.41 1jmx h GLN 45 N 0.67 0.11 -0.16 1.72 4.20 -1.09 -1.61 115.11 118.95 1jmx h GLN 45 Ca 0.16 -0.12 -0.08 0.00 0.06 0.00 0.00 58.65 58.67 1jmx h GLN 45 Cb 0.19 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.00 1jmx h GLN 45 CO -0.01 0.87 -0.20 0.28 -0.67 0.00 0.00 178.83 179.10 1jmx h VAL 46 N -0.59 1.35 0.11 -0.54 2.07 -1.25 -3.05 116.25 114.35 1jmx h VAL 46 Ca -0.02 -1.40 -0.34 0.00 0.82 0.00 0.00 66.70 65.77 1jmx h VAL 46 Cb 0.92 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 32.56 1jmx h VAL 46 CO 0.03 0.42 -1.81 0.24 0.02 0.00 0.00 177.57 176.46 1jmx h MET 47 N 0.06 0.24 -0.40 1.57 2.86 -0.94 -3.41 114.93 114.90 1jmx h MET 47 Ca 0.02 -0.41 0.00 0.00 -2.06 0.00 0.00 59.70 57.25 1jmx h MET 47 Cb 0.76 0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.57 1jmx h MET 47 CO 0.05 1.20 0.00 0.72 1.06 0.00 0.00 176.91 179.94 1jmx n HIS 48 N -3.68 0.60 -1.12 -0.22 8.25 -0.68 -5.01 115.22 113.36 1jmx n HIS 48 Ca -0.31 -0.53 -0.04 0.00 -0.26 0.00 0.00 57.72 56.58 1jmx n HIS 48 Cb 0.98 -0.05 -0.02 0.00 1.12 0.00 0.00 29.99 32.03 1jmx n HIS 48 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jmx n GLY 49 N 0.61 0.65 3.70 -1.41 0.00 -0.85 -4.92 105.19 102.97 1jmx n GLY 49 Ca 0.14 -0.28 -0.44 0.00 0.00 0.00 0.00 46.02 45.45 1jmx n GLY 49 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1jmx n LEU 50 N -0.48 3.61 -4.47 0.99 0.00 -0.75 -4.94 117.00 110.96 1jmx n LEU 50 Ca -0.04 1.12 -0.39 0.00 0.00 0.00 0.00 56.01 56.70 1jmx n LEU 50 Cb 0.26 -1.50 -0.11 0.00 0.00 0.00 0.00 43.42 42.06 1jmx n LEU 50 CO 0.06 -0.16 -0.18 -1.10 0.00 0.00 0.00 177.39 176.02 1jmx s GLN 51 N 0.06 3.39 -0.24 1.96 -1.52 -1.26 -4.46 119.66 117.58 1jmx s GLN 51 Ca 0.70 -0.69 -0.16 0.00 -1.95 0.00 0.00 55.36 53.25 1jmx s GLN 51 Cb -0.59 -3.64 0.07 0.00 -0.22 0.00 0.00 33.01 28.63 1jmx s GLN 51 CO 0.44 -0.42 0.61 -1.50 -0.25 0.00 0.00 175.29 174.17 1jmx s ILE 52 N 1.65 -0.01 0.81 1.08 2.07 -1.26 -5.04 121.20 120.51 1jmx s ILE 52 Ca 0.05 0.02 -0.11 0.00 -1.41 0.00 0.00 60.65 59.20 1jmx s ILE 52 Cb -0.17 -0.88 0.08 0.00 0.13 0.00 0.00 42.46 41.62 1jmx s ILE 52 CO 0.08 0.01 1.09 -0.94 -1.91 0.00 0.00 174.94 173.27 1jmx s SER 53 N 1.20 4.32 0.28 4.50 1.04 -1.26 -4.87 113.70 118.91 1jmx s SER 53 Ca -0.07 1.37 -0.01 0.00 0.48 0.00 0.00 55.95 57.72 1jmx s SER 53 Cb -0.06 -2.10 0.41 0.00 0.10 0.00 0.00 66.02 64.38 1jmx s SER 53 CO -0.12 -2.09 1.81 0.44 0.98 0.00 0.00 173.24 174.26 1jmx h ASP 54 N -1.17 0.72 0.21 7.02 3.32 -2.02 -1.24 116.42 123.26 1jmx h ASP 54 Ca -0.47 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 56.42 1jmx h ASP 54 Cb 1.27 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.63 1jmx h ASP 54 CO 0.58 0.75 -0.10 0.44 -1.72 0.00 0.00 179.24 179.19 1jmx h ASP 55 N 0.72 -0.24 0.21 6.45 3.45 -1.99 -0.78 116.42 124.25 1jmx h ASP 55 Ca 0.15 -0.08 -0.06 0.00 0.43 0.00 0.00 57.03 57.47 1jmx h ASP 55 Cb 0.37 0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 39.19 1jmx h ASP 55 CO 0.01 -0.07 -0.26 0.44 -1.57 0.00 0.00 179.24 177.78 1jmx h ASP 56 N -0.39 0.10 -0.39 6.45 3.45 -1.91 -1.69 116.42 122.03 1jmx h ASP 56 Ca -0.03 -0.03 -0.09 0.00 0.43 0.00 0.00 57.03 57.32 1jmx h ASP 56 Cb 0.30 -0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 39.03 1jmx h ASP 56 CO 0.05 0.37 -0.10 -0.09 -1.57 0.00 0.00 179.24 177.90 1jmx h ARG 57 N 0.09 0.76 -0.62 3.56 2.43 -1.05 -1.54 114.38 118.02 1jmx h ARG 57 Ca 0.01 -0.29 -0.01 0.00 -0.81 0.00 0.00 59.98 58.88 1jmx h ARG 57 Cb 0.52 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.00 1jmx h ARG 57 CO 0.04 0.90 0.34 0.00 -1.51 0.00 0.00 179.97 179.74 1jmx h ARG 58 N 0.57 0.85 -0.23 0.20 3.08 -0.63 -1.04 114.38 117.18 1jmx h ARG 58 Ca 0.10 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 1jmx h ARG 58 Cb 0.62 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 1jmx h ARG 58 CO 0.04 0.62 0.01 1.15 -1.07 0.00 0.00 179.97 180.72 1jmx h THR 59 N 0.86 1.25 -0.62 2.04 2.02 -0.99 -2.39 112.91 115.08 1jmx h THR 59 Ca 0.22 -0.86 -0.08 0.00 0.77 0.00 0.00 66.41 66.46 1jmx h THR 59 Cb 0.02 1.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 1jmx h THR 59 CO -0.04 0.27 0.08 -0.07 0.37 0.00 0.00 175.52 176.13 1jmx h LEU 60 N 0.18 0.98 -0.31 2.58 3.38 -0.80 -1.58 115.31 119.74 1jmx h LEU 60 Ca 0.07 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 1jmx h LEU 60 Cb 0.39 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1jmx h LEU 60 CO 0.01 0.99 0.17 0.58 0.09 0.00 0.00 178.44 180.28 1jmx h VAL 61 N 0.96 1.13 -0.23 1.22 2.07 -1.17 0.14 116.25 120.36 1jmx h VAL 61 Ca 0.19 -0.35 0.01 0.00 0.82 0.00 0.00 66.70 67.38 1jmx h VAL 61 Cb 0.45 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 1jmx h VAL 61 CO 0.01 0.13 0.12 0.50 0.02 0.00 0.00 177.57 178.36 1jmx h LYS 62 N 0.39 0.24 -0.08 1.57 1.63 -1.25 0.28 116.57 119.35 1jmx h LYS 62 Ca 0.11 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.90 1jmx h LYS 62 Cb 0.06 -0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 31.63 1jmx h LYS 62 CO -0.02 0.16 0.06 -0.92 -3.45 0.00 0.00 179.45 175.28 1jmx h TYR 63 N 0.25 0.11 -0.07 1.91 5.03 -0.98 -2.32 116.97 120.90 1jmx h TYR 63 Ca 0.10 0.00 -0.16 0.00 2.58 0.00 0.00 58.73 61.25 1jmx h TYR 63 Cb 0.02 -0.04 -0.01 0.00 1.55 0.00 0.00 36.73 38.26 1jmx h TYR 63 CO -0.09 0.08 -0.67 -0.07 -1.32 0.00 0.00 178.16 176.09 1jmx h LEU 64 N 0.11 0.33 -1.08 2.82 3.38 -0.52 -2.19 115.31 118.17 1jmx h LEU 64 Ca 0.03 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.71 1jmx h LEU 64 Cb -0.01 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1jmx h LEU 64 CO -0.01 0.90 -0.26 0.00 0.09 0.00 0.00 178.44 179.17 1jmx h ALA 65 N 1.09 1.23 0.04 1.53 0.00 -0.33 0.17 119.26 122.99 1jmx h ALA 65 Ca -0.02 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 1jmx h ALA 65 Cb 1.20 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.90 1jmx h ALA 65 CO 0.11 0.51 -0.26 -0.44 0.00 0.00 0.00 179.25 179.17 1jmx h ASP 66 N 0.30 0.15 -0.13 0.00 5.19 -1.39 -3.13 116.42 117.41 1jmx h ASP 66 Ca 0.05 -0.98 -0.02 0.00 -0.62 0.00 0.00 57.03 55.46 1jmx h ASP 66 Cb 0.62 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 40.07 1jmx h ASP 66 CO 0.04 1.12 0.02 0.11 -3.12 0.00 0.00 179.24 177.41 1jmx h LYS 67 N -0.79 0.22 -2.40 3.56 6.56 -1.35 -3.38 116.57 119.00 1jmx h LYS 67 Ca -0.04 -0.06 -0.60 0.00 -1.06 0.00 0.00 60.65 58.89 1jmx h LYS 67 Cb 1.20 -0.03 -0.41 0.00 -0.57 0.00 0.00 32.23 32.42 1jmx h LYS 67 CO 0.05 0.42 -0.70 1.04 -2.06 0.00 0.00 179.45 178.19 1jmx n GLN 68 N -4.81 1.88 -1.51 3.15 6.02 0.58 -5.07 117.38 117.62 1jmx n GLN 68 Ca -0.05 -4.28 0.00 0.00 -0.01 0.00 0.00 57.00 52.66 1jmx n GLN 68 Cb 0.18 -2.05 0.00 0.00 1.02 0.00 0.00 30.24 29.39 1jmx n GLN 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1jmx n GLY 69 N 1.37 3.56 3.59 1.08 0.00 -1.18 -2.29 105.19 111.32 1jmx n GLY 69 Ca 0.26 -2.17 -0.31 0.00 0.00 0.00 0.00 46.02 43.80 1jmx n GLY 69 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jmx s LEU 70 N 0.00 3.13 0.71 0.99 1.43 -1.26 -4.61 118.68 119.07 1jmx s LEU 70 Ca 0.00 -0.26 -0.13 0.00 -1.03 0.00 0.00 54.13 52.71 1jmx s LEU 70 Cb 0.00 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 44.38 1jmx s LEU 70 CO 0.00 0.22 1.09 0.00 0.23 0.00 0.00 176.35 177.90 1jmx s ALA 71 N -1.13 2.42 0.20 4.21 0.00 -1.26 -4.91 121.76 121.29 1jmx s ALA 71 Ca 0.20 0.37 -0.10 0.00 0.00 0.00 0.00 51.96 52.43 1jmx s ALA 71 Cb -0.11 -3.28 0.27 0.00 0.00 0.00 0.00 23.12 20.00 1jmx s ALA 71 CO 0.11 -1.45 1.71 -1.35 0.00 0.00 0.00 175.76 174.79 1jmx h PRO 72 N -0.51 0.27 0.00 0.00 0.11 -1.96 -1.04 132.00 128.87 1jmx h PRO 72 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1jmx h PRO 72 Cb 1.23 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1jmx h PRO 72 CO 0.53 0.18 0.00 -1.13 -0.21 0.00 0.00 178.00 177.37 1jmx n SER 73 N -5.10 0.57 -0.05 -2.05 3.41 -1.26 -1.28 113.62 107.86 1jmx n SER 73 Ca 0.08 0.70 0.14 0.00 -0.26 0.00 0.00 58.87 59.52 1jmx n SER 73 Cb 0.30 -0.80 0.52 0.00 -0.26 0.00 0.00 64.21 63.97 1jmx n SER 73 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1jmx n GLU 74 N -2.19 0.31 0.00 4.33 1.02 -0.39 -3.29 120.64 120.43 1jmx n GLU 74 Ca 0.00 -0.11 0.08 0.00 -0.02 0.00 0.00 57.16 57.11 1jmx n GLU 74 Cb 0.13 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 29.99 1jmx n GLU 74 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1jmx n THR 75 N -1.25 0.00 -1.70 2.62 -2.24 -0.40 -4.85 114.28 106.46 1jmx n THR 75 Ca 0.10 -0.19 -0.54 0.00 -2.27 0.00 0.00 64.05 61.14 1jmx n THR 75 Cb 0.31 1.06 -0.06 0.00 -2.10 0.00 0.00 70.33 69.54 1jmx n THR 75 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1jmx n ASP 76 N -0.99 2.74 0.00 3.42 8.00 -1.18 -1.59 116.55 126.95 1jmx n ASP 76 Ca 0.04 1.04 0.00 0.00 0.71 0.00 0.00 54.79 56.58 1jmx n ASP 76 Cb 0.27 -1.22 0.00 0.00 -0.02 0.00 0.00 41.12 40.15 1jmx n ASP 76 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1jmx n GLY 77 N 4.25 1.75 0.13 0.44 0.00 -1.26 -4.85 105.19 105.65 1jmx n GLY 77 Ca 0.25 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.33 1jmx n GLY 77 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1jmx n VAL 78 N -2.00 1.34 0.36 1.61 0.24 -0.62 -4.75 118.33 114.50 1jmx n VAL 78 Ca 0.00 -1.58 0.14 0.00 -2.04 0.00 0.00 64.34 60.87 1jmx n VAL 78 Cb 0.00 0.06 0.55 0.00 -1.47 0.00 0.00 33.84 32.98 1jmx n VAL 78 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1jmx h ARG 79 N 0.00 0.00 -0.03 7.34 3.08 -1.87 -3.05 114.38 119.85 1jmx h ARG 79 Ca 0.00 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.06 1jmx h ARG 79 Cb 0.99 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.04 1jmx h ARG 79 CO 0.00 0.00 0.04 0.10 -1.07 0.00 0.00 179.97 179.04 1jmx h TYR 80 N 0.00 0.00 -0.21 3.04 -0.00 -1.92 -1.61 116.97 116.27 1jmx h TYR 80 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 58.73 58.68 1jmx h TYR 80 Cb 0.48 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.20 1jmx h TYR 80 CO 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 178.16 178.09 1jmx h ALA 81 N 1.96 0.29 0.00 0.10 0.00 -1.84 0.26 119.26 120.02 1jmx h ALA 81 Ca 0.02 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 1jmx h ALA 81 Cb 0.09 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1jmx h ALA 81 CO -0.00 0.09 -0.59 0.52 0.00 0.00 0.00 179.25 179.27 1jmx h MET 82 N 0.13 0.00 -0.03 0.00 2.86 -1.64 -2.67 114.93 113.58 1jmx h MET 82 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1jmx h MET 82 Cb 0.53 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.19 1jmx h MET 82 CO 0.02 0.59 0.00 0.39 1.06 0.00 0.00 176.91 178.98 1jmx n GLU 83 N -3.83 1.14 -3.54 1.72 1.02 -0.65 -4.91 120.64 111.58 1jmx n GLU 83 Ca -0.01 -0.21 -0.26 0.00 -0.02 0.00 0.00 57.16 56.66 1jmx n GLU 83 Cb 0.60 -1.34 0.04 0.00 -0.02 0.00 0.00 31.44 30.71 1jmx n GLU 83 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1jmx n ARG 84 N -0.60 -5.65 -2.89 3.49 5.12 -0.76 -4.90 116.66 110.47 1jmx n ARG 84 Ca 0.16 0.71 -0.44 0.00 -1.93 0.00 0.00 57.85 56.35 1jmx n ARG 84 Cb 0.12 -5.61 0.00 0.00 -1.16 0.00 0.00 32.46 25.82 1jmx n ARG 84 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1jmx n ARG 85 N -4.47 3.38 0.00 5.56 1.74 0.01 -4.73 116.66 118.15 1jmx n ARG 85 Ca -0.01 -3.81 0.09 0.00 -0.77 0.00 0.00 57.85 53.34 1jmx n ARG 85 Cb 0.56 -3.04 0.43 0.00 -1.02 0.00 0.00 32.46 29.38 1jmx n ARG 85 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1jmx n LEU 86 N 5.57 0.00 -0.90 0.55 4.32 -1.26 -2.58 117.00 122.70 1jmx n LEU 86 Ca 0.37 0.33 0.11 0.00 -0.02 0.00 0.00 56.01 56.81 1jmx n LEU 86 Cb 0.42 -0.33 0.27 0.00 -1.62 0.00 0.00 43.42 42.16 1jmx n LEU 86 CO 0.64 -0.14 0.73 0.59 -1.22 0.00 0.00 177.39 177.99 1jmx n ASN 87 N -1.33 2.69 -4.71 -1.43 3.02 -1.26 -4.93 115.26 107.30 1jmx n ASN 87 Ca 0.07 -1.88 -0.42 0.00 -0.03 0.00 0.00 54.58 52.33 1jmx n ASN 87 Cb 0.15 -0.17 -0.03 0.00 -0.61 0.00 0.00 39.78 39.12 1jmx n ASN 87 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1jmx s THR 88 N -1.66 2.71 -0.49 3.41 2.01 -1.06 -4.90 115.64 115.66 1jmx s THR 88 Ca 0.35 0.47 -0.21 0.00 0.31 0.00 0.00 61.69 62.62 1jmx s THR 88 Cb 0.20 -3.30 0.04 0.00 0.01 0.00 0.00 72.50 69.45 1jmx s THR 88 CO 0.29 0.03 0.69 -0.69 -0.69 0.00 0.00 174.62 174.26 1jmx s VAL 89 N 1.34 4.77 0.42 3.82 1.01 -1.26 -5.03 120.40 125.46 1jmx s VAL 89 Ca 0.70 -0.10 -0.25 0.00 0.00 0.00 0.00 61.98 62.33 1jmx s VAL 89 Cb -0.43 -4.31 -0.08 0.00 0.00 0.00 0.00 36.38 31.57 1jmx s VAL 89 CO 0.31 -0.78 1.19 -1.61 0.00 0.00 0.00 175.10 174.22 1jmx s GLU 90 N 2.95 3.93 -0.58 2.72 2.02 -1.26 -5.02 118.70 123.46 1jmx s GLU 90 Ca 0.21 1.87 0.04 0.00 0.02 0.00 0.00 54.97 57.11 1jmx s GLU 90 Cb -0.16 -2.59 0.16 0.00 0.10 0.00 0.00 34.13 31.64 1jmx s GLU 90 CO 0.16 -0.43 0.41 -0.65 0.02 0.00 0.00 175.26 174.77 1jmx s GLN 91 N -2.43 1.84 0.39 1.61 -1.52 -1.26 -5.09 119.66 113.21 1jmx s GLN 91 Ca 0.59 -2.81 0.08 0.00 -1.95 0.00 0.00 55.36 51.27 1jmx s GLN 91 Cb -0.31 -2.68 -0.06 0.00 -0.22 0.00 0.00 33.01 29.73 1jmx s GLN 91 CO 0.39 -1.30 0.06 -0.06 -0.25 0.00 0.00 175.29 174.13 1jmx s PHE 92 N -0.77 2.55 0.77 0.91 0.08 -1.26 -5.13 117.98 115.14 1jmx s PHE 92 Ca 0.26 -0.58 -0.12 0.00 0.12 0.00 0.00 56.93 56.61 1jmx s PHE 92 Cb -0.04 -1.75 0.06 0.00 -0.57 0.00 0.00 43.02 40.72 1jmx s PHE 92 CO -0.15 0.37 1.13 0.16 -0.10 0.00 0.00 175.22 176.63 1jmx s ASP 93 N -3.77 4.20 0.27 1.36 -4.77 -1.26 -4.80 116.67 107.90 1jmx s ASP 93 Ca 0.37 2.07 -0.04 0.00 -3.30 0.00 0.00 52.55 51.65 1jmx s ASP 93 Cb 0.05 -2.55 0.35 0.00 -1.09 0.00 0.00 42.92 39.68 1jmx s ASP 93 CO 0.20 -2.24 1.95 0.71 0.70 0.00 0.00 175.17 176.48 1jmx h THR 94 N -0.85 1.23 -0.39 2.11 1.35 -2.00 -1.70 112.91 112.66 1jmx h THR 94 Ca -0.45 -0.43 0.01 0.00 -0.55 0.00 0.00 66.41 65.00 1jmx h THR 94 Cb 1.26 -0.13 -0.02 0.00 -1.73 0.00 0.00 68.15 67.53 1jmx h THR 94 CO 0.49 0.23 0.23 -0.61 -0.25 0.00 0.00 175.52 175.61 1jmx h GLN 95 N 1.24 0.46 -0.26 4.72 4.15 -1.99 0.21 115.11 123.63 1jmx h GLN 95 Ca 0.34 -0.03 -0.13 0.00 0.77 0.00 0.00 58.65 59.60 1jmx h GLN 95 Cb -0.12 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.45 1jmx h GLN 95 CO -0.08 0.30 -0.39 1.25 -1.93 0.00 0.00 178.83 177.99 1jmx h LEU 96 N 0.47 0.64 -0.04 -2.39 7.12 -1.88 -2.04 115.31 117.18 1jmx h LEU 96 Ca 0.15 -0.28 -0.01 0.00 0.13 0.00 0.00 57.88 57.87 1jmx h LEU 96 Cb -0.01 -0.18 -0.00 0.00 -0.53 0.00 0.00 40.66 39.94 1jmx h LEU 96 CO -0.06 0.96 -0.00 0.28 -0.13 0.00 0.00 178.44 179.48 1jmx h SER 97 N 0.50 0.08 -0.25 1.25 0.02 -0.78 0.31 113.55 114.68 1jmx h SER 97 Ca 0.05 -0.33 -0.11 0.00 -0.84 0.00 0.00 61.79 60.55 1jmx h SER 97 Cb 0.89 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.41 1jmx h SER 97 CO 0.08 0.39 -0.27 -0.33 -1.14 0.00 0.00 176.83 175.56 1jmx h GLU 98 N -0.24 0.62 0.02 3.45 5.08 -1.02 -1.14 114.58 121.36 1jmx h GLU 98 Ca 0.01 -0.34 -0.08 0.00 -1.00 0.00 0.00 59.36 57.96 1jmx h GLU 98 Cb 0.35 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.63 1jmx h GLU 98 CO 0.00 0.94 -0.31 1.15 -1.00 0.00 0.00 179.01 179.79 1jmx h THR 99 N 0.34 1.59 -0.00 1.13 2.02 -1.44 -3.40 112.91 113.14 1jmx h THR 99 Ca 0.04 -2.14 0.00 0.00 0.77 0.00 0.00 66.41 65.08 1jmx h THR 99 Cb 0.84 2.96 0.00 0.00 -1.74 0.00 0.00 68.15 70.21 1jmx h THR 99 CO 0.07 0.58 -0.26 0.00 0.37 0.00 0.00 175.52 176.28 1jmx n GLY 101 N 1.09 4.59 0.01 0.00 0.00 -0.51 -4.57 105.19 105.81 1jmx n GLY 101 Ca 0.01 -0.97 0.12 0.00 0.00 0.00 0.00 46.02 45.19 1jmx n GLY 101 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1jmx n ARG 102 N -1.29 0.04 -0.00 1.61 1.85 -0.71 -4.50 116.66 113.67 1jmx n ARG 102 Ca 0.14 -0.02 -0.00 0.00 -1.00 0.00 0.00 57.85 56.96 1jmx n ARG 102 Cb 0.58 -1.50 -0.00 0.00 -1.05 0.00 0.00 32.46 30.49 1jmx n ARG 102 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1jmx s HIS 104 N -1.13 1.46 0.73 0.00 -3.43 -1.26 -5.11 115.29 106.54 1jmx s HIS 104 Ca -0.01 -0.83 -0.13 0.00 -0.80 0.00 0.00 55.06 53.29 1jmx s HIS 104 Cb 0.00 -2.00 0.04 0.00 -1.43 0.00 0.00 32.58 29.19 1jmx s HIS 104 CO 0.02 -0.76 1.12 -1.54 -2.00 0.00 0.00 174.74 171.59 1jmx s SER 105 N -4.44 4.58 0.29 7.38 1.04 -1.22 -4.29 113.70 117.05 1jmx s SER 105 Ca 0.43 2.02 0.25 0.00 0.48 0.00 0.00 55.95 59.14 1jmx s SER 105 Cb -0.03 -2.55 0.73 0.00 0.10 0.00 0.00 66.02 64.27 1jmx s SER 105 CO 0.27 -1.99 1.74 1.23 0.98 0.00 0.00 173.24 175.47 1jmx h GLY 106 N -0.54 0.00 1.91 7.32 0.00 -1.81 -3.17 103.07 106.78 1jmx h GLY 106 Ca -0.46 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.78 1jmx h GLY 106 CO 0.51 0.00 -0.43 0.00 0.00 0.00 0.00 176.54 176.62 1jmx h ALA 107 N 2.33 1.20 -0.14 3.60 0.00 -1.91 -2.41 119.26 121.93 1jmx h ALA 107 Ca 0.00 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1jmx h ALA 107 Cb 0.76 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1jmx h ALA 107 CO 0.00 0.57 -0.00 -0.09 0.00 0.00 0.00 179.25 179.73 1jmx h ARG 108 N 0.08 0.19 0.01 0.00 2.43 -1.76 -0.82 114.38 114.51 1jmx h ARG 108 Ca 0.00 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.11 1jmx h ARG 108 Cb 0.80 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 1jmx h ARG 108 CO 0.06 0.22 -0.15 0.28 -1.51 0.00 0.00 179.97 178.87 1jmx h VAL 109 N 0.19 1.65 0.00 0.20 2.07 -1.64 -3.31 116.25 115.41 1jmx h VAL 109 Ca 0.05 -2.12 0.00 0.00 0.82 0.00 0.00 66.70 65.45 1jmx h VAL 109 Cb 0.14 3.06 0.00 0.00 -1.52 0.00 0.00 31.29 32.97 1jmx h VAL 109 CO 0.00 0.56 0.00 0.00 0.02 0.00 0.00 177.57 178.16 1jmx h ALA 110 N 0.14 1.00 -0.34 1.67 0.00 -1.13 -2.69 119.26 117.90 1jmx h ALA 110 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1jmx h ALA 110 Cb 1.01 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1jmx h ALA 110 CO 0.03 0.00 0.07 1.28 0.00 0.00 0.00 179.25 180.63 1jmx n LEU 111 N -2.50 3.77 -4.02 0.00 4.77 -0.34 -4.85 117.00 113.83 1jmx n LEU 111 Ca 0.00 -1.93 -0.11 0.00 -0.03 0.00 0.00 56.01 53.95 1jmx n LEU 111 Cb 0.18 -0.61 -0.11 0.00 -2.33 0.00 0.00 43.42 40.55 1jmx n LEU 111 CO 0.19 0.52 -0.38 -1.10 -1.33 0.00 0.00 177.39 175.29 1jmx s GLN 112 N -1.87 0.43 -0.10 3.23 -0.21 -1.02 -3.67 119.66 116.45 1jmx s GLN 112 Ca 0.28 -0.71 0.01 0.00 0.02 0.00 0.00 55.36 54.96 1jmx s GLN 112 Cb 0.22 -0.08 0.02 0.00 1.00 0.00 0.00 33.01 34.17 1jmx s GLN 112 CO 0.08 -0.01 -0.11 1.03 -2.12 0.00 0.00 175.29 174.16 1jmx s ARG 113 N -1.63 1.76 0.03 2.91 1.81 -0.40 -4.84 118.95 118.59 1jmx s ARG 113 Ca -0.12 -0.38 -0.12 0.00 -1.72 0.00 0.00 55.73 53.38 1jmx s ARG 113 Cb -0.09 -1.62 0.01 0.00 -0.45 0.00 0.00 34.95 32.81 1jmx s ARG 113 CO -0.01 -0.13 0.27 1.03 -0.68 0.00 0.00 175.30 175.78 1jmx s ARG 114 N 1.21 0.74 0.74 3.54 0.52 -0.51 -1.53 118.95 123.66 1jmx s ARG 114 Ca -0.04 -0.48 -0.12 0.00 -0.52 0.00 0.00 55.73 54.58 1jmx s ARG 114 Cb -0.14 0.32 0.03 0.00 0.52 0.00 0.00 34.95 35.68 1jmx s ARG 114 CO -0.03 -0.22 1.11 -1.25 0.02 0.00 0.00 175.30 174.93 1jmx s PRO 115 N -2.29 2.60 0.31 3.54 0.04 -1.26 -3.25 135.00 134.68 1jmx s PRO 115 Ca -0.07 0.42 0.07 0.00 0.04 0.00 0.00 61.00 61.46 1jmx s PRO 115 Cb -0.02 -1.99 0.77 0.00 0.04 0.00 0.00 34.50 33.29 1jmx s PRO 115 CO -0.02 -1.21 1.76 0.00 0.04 0.00 0.00 177.00 177.57 1jmx h ALA 116 N -0.78 1.68 -0.19 8.56 0.00 -1.89 -1.71 119.26 124.93 1jmx h ALA 116 Ca -0.45 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 1jmx h ALA 116 Cb 1.27 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1jmx h ALA 116 CO 0.64 -0.11 -0.20 -0.22 0.00 0.00 0.00 179.25 179.36 1jmx h LYS 117 N 0.71 0.33 0.00 0.00 1.63 -1.96 0.07 116.57 117.36 1jmx h LYS 117 Ca 0.59 -0.10 -0.10 0.00 -0.85 0.00 0.00 60.65 60.19 1jmx h LYS 117 Cb 0.98 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.56 1jmx h LYS 117 CO -0.41 0.53 -0.49 0.93 -3.45 0.00 0.00 179.45 176.56 1jmx h GLU 118 N 0.30 0.00 0.04 1.90 4.39 -1.67 -0.68 114.58 118.86 1jmx h GLU 118 Ca 0.05 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.53 1jmx h GLU 118 Cb 0.53 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 1jmx h GLU 118 CO 0.04 0.49 -1.01 -1.49 -1.16 0.00 0.00 179.01 175.87 1jmx h TRP 119 N 0.00 0.32 -0.36 4.33 -0.00 -1.01 -2.47 115.95 116.76 1jmx h TRP 119 Ca -0.00 -0.20 -0.16 0.00 -0.00 0.00 0.00 58.89 58.53 1jmx h TRP 119 Cb 1.14 -0.02 -0.01 0.00 -0.00 0.00 0.00 29.16 30.27 1jmx h TRP 119 CO 0.00 1.08 -0.38 1.49 -0.00 0.00 0.00 178.44 180.63 1jmx h GLU 120 N 0.08 0.90 -0.54 0.49 4.81 -0.76 -2.31 114.58 117.24 1jmx h GLU 120 Ca -0.07 -0.48 -0.06 0.00 -0.13 0.00 0.00 59.36 58.62 1jmx h GLU 120 Cb 1.70 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 31.08 1jmx h GLU 120 CO 0.16 1.13 0.09 0.45 -0.73 0.00 0.00 179.01 180.11 1jmx h HIS 121 N 0.71 0.90 -0.48 0.92 3.86 -1.15 -2.55 115.15 117.36 1jmx h HIS 121 Ca 0.05 -0.10 -0.01 0.00 -1.16 0.00 0.00 60.37 59.15 1jmx h HIS 121 Cb 0.98 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 29.17 1jmx h HIS 121 CO 0.07 0.78 0.24 1.25 0.86 0.00 0.00 177.93 181.12 1jmx h LEU 122 N 0.82 0.62 -0.59 2.43 6.46 -1.26 -1.52 115.31 122.26 1jmx h LEU 122 Ca 0.17 -0.12 -0.00 0.00 -0.12 0.00 0.00 57.88 57.81 1jmx h LEU 122 Cb 0.36 -0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 40.10 1jmx h LEU 122 CO 0.01 0.56 0.36 0.58 -0.62 0.00 0.00 178.44 179.33 1jmx h VAL 123 N 0.63 1.17 -0.63 1.05 2.07 -1.14 -2.15 116.25 117.25 1jmx h VAL 123 Ca 0.17 -0.37 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 1jmx h VAL 123 Cb 0.10 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.19 1jmx h VAL 123 CO -0.02 0.17 0.22 0.78 0.02 0.00 0.00 177.57 178.74 1jmx h ASN 124 N 0.80 0.86 -0.66 0.57 2.35 -1.28 -2.61 115.58 115.61 1jmx h ASN 124 Ca 0.21 -0.13 -0.04 0.00 -0.55 0.00 0.00 56.30 55.79 1jmx h ASN 124 Cb -0.03 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.09 1jmx h ASN 124 CO -0.04 0.79 0.25 0.15 -1.65 0.00 0.00 177.43 176.93 1jmx h PHE 125 N 0.91 1.01 0.71 1.19 3.04 -0.87 -0.27 116.94 122.65 1jmx h PHE 125 Ca 0.21 -0.08 -0.03 0.00 3.98 0.00 0.00 57.97 62.05 1jmx h PHE 125 Cb 0.22 -0.30 0.01 0.00 2.56 0.00 0.00 35.95 38.44 1jmx h PHE 125 CO 0.02 0.79 -0.34 0.45 -2.02 0.00 0.00 178.31 177.21 1jmx h HIS 126 N 0.93 -0.88 0.00 0.41 3.86 -1.04 0.20 115.15 118.63 1jmx h HIS 126 Ca 0.22 -0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.37 1jmx h HIS 126 Cb 0.22 0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.98 1jmx h HIS 126 CO 0.01 -0.54 -0.17 1.25 0.86 0.00 0.00 177.93 179.34 1jmx h LEU 127 N -0.98 0.00 0.06 2.43 6.46 -1.51 -0.06 115.31 121.71 1jmx h LEU 127 Ca -0.10 0.00 -0.20 0.00 -0.12 0.00 0.00 57.88 57.46 1jmx h LEU 127 Cb 0.74 0.00 0.02 0.00 -0.73 0.00 0.00 40.66 40.69 1jmx h LEU 127 CO 0.16 0.17 -0.82 1.23 -0.62 0.00 0.00 178.44 178.56 1jmx h GLY 128 N 0.92 0.50 1.66 3.75 0.00 -0.83 -3.10 103.07 105.97 1jmx h GLY 128 Ca -0.00 -1.00 -0.21 0.00 0.00 0.00 0.00 47.33 46.12 1jmx h GLY 128 CO 0.02 0.88 -0.88 -1.61 0.00 0.00 0.00 176.54 174.95 1jmx h GLN 129 N -0.07 0.31 -2.91 4.80 5.75 -0.46 -3.38 115.11 119.14 1jmx h GLN 129 Ca -0.12 -0.32 -0.61 0.00 -0.15 0.00 0.00 58.65 57.44 1jmx h GLN 129 Cb 1.55 0.09 -0.41 0.00 1.07 0.00 0.00 27.48 29.79 1jmx h GLN 129 CO 0.16 1.01 -0.71 -1.58 -2.65 0.00 0.00 178.83 175.06 1jmx s TRP 130 N -3.29 2.62 0.54 3.99 0.51 -0.05 -4.98 118.94 118.28 1jmx s TRP 130 Ca -0.04 -2.90 0.27 0.00 -2.12 0.00 0.00 56.10 51.31 1jmx s TRP 130 Cb 0.10 -2.12 1.44 0.00 -0.81 0.00 0.00 33.47 32.08 1jmx s TRP 130 CO 0.84 -0.68 1.97 -1.35 -0.51 0.00 0.00 176.95 177.23 1jmx h PRO 131 N 5.80 0.00 0.00 4.98 0.11 -1.73 -1.27 132.00 139.89 1jmx h PRO 131 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1jmx h PRO 131 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1jmx h PRO 131 CO 0.58 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.24 1jmx n SER 132 N -4.22 0.00 -0.21 -2.05 3.41 -1.26 -4.00 113.62 105.28 1jmx n SER 132 Ca 0.11 0.29 -0.02 0.00 -0.26 0.00 0.00 58.87 58.98 1jmx n SER 132 Cb 0.67 -0.41 0.04 0.00 -0.26 0.00 0.00 64.21 64.25 1jmx n SER 132 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1jmx h LEU 133 N 0.00 -0.88 0.00 1.04 6.46 -1.57 -0.84 115.31 119.53 1jmx h LEU 133 Ca 0.00 0.21 0.00 0.00 -0.12 0.00 0.00 57.88 57.97 1jmx h LEU 133 Cb 0.29 0.49 0.00 0.00 -0.73 0.00 0.00 40.66 40.71 1jmx h LEU 133 CO 0.00 -0.26 0.00 -1.84 -0.62 0.00 0.00 178.44 175.72 1jmx n GLU 134 N -5.45 0.71 0.00 1.25 0.28 -1.26 -2.51 120.64 113.67 1jmx n GLU 134 Ca 0.06 0.00 0.06 0.00 -0.16 0.00 0.00 57.16 57.12 1jmx n GLU 134 Cb 0.35 -1.44 -0.04 0.00 1.43 0.00 0.00 31.44 31.75 1jmx n GLU 134 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1jmx n TYR 135 N -0.94 0.00 -1.89 -1.84 4.01 -0.34 -3.07 117.16 113.10 1jmx n TYR 135 Ca 0.15 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.60 1jmx n TYR 135 Cb 0.07 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.18 1jmx n TYR 135 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 1jmx s GLN 136 N -1.88 2.15 0.34 -0.72 -0.21 -1.04 -4.50 119.66 113.80 1jmx s GLN 136 Ca 0.07 0.19 -0.28 0.00 0.02 0.00 0.00 55.36 55.35 1jmx s GLN 136 Cb 0.09 -1.96 -0.12 0.00 1.00 0.00 0.00 33.01 32.02 1jmx s GLN 136 CO 0.41 -1.48 1.39 0.00 -2.12 0.00 0.00 175.29 173.48 1jmx n ALA 137 N -3.26 1.74 -1.55 6.09 0.00 -1.26 -1.55 120.51 120.73 1jmx n ALA 137 Ca 0.08 0.36 -0.10 0.00 0.00 0.00 0.00 53.44 53.78 1jmx n ALA 137 Cb 0.60 -2.33 -0.03 0.00 0.00 0.00 0.00 19.45 17.69 1jmx n ALA 137 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1jmx n GLN 138 N 0.71 -0.70 0.00 0.00 6.02 -1.26 -4.76 117.38 117.38 1jmx n GLN 138 Ca 0.04 0.73 0.00 0.00 -0.01 0.00 0.00 57.00 57.76 1jmx n GLN 138 Cb 0.37 -4.68 0.00 0.00 1.02 0.00 0.00 30.24 26.95 1jmx n GLN 138 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1jmx n ALA 139 N 0.40 2.22 0.44 -1.58 0.00 -0.78 -4.78 120.51 116.43 1jmx n ALA 139 Ca -0.10 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.43 1jmx n ALA 139 Cb 0.40 0.00 0.39 0.00 0.00 0.00 0.00 19.45 20.24 1jmx n ALA 139 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1jmx n ARG 140 N -1.98 0.09 -0.05 0.00 1.85 -0.60 -2.48 116.66 113.49 1jmx n ARG 140 Ca 0.00 0.34 0.12 0.00 -1.00 0.00 0.00 57.85 57.31 1jmx n ARG 140 Cb 0.00 -1.67 0.33 0.00 -1.05 0.00 0.00 32.46 30.06 1jmx n ARG 140 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 1jmx n ASP 141 N -1.84 2.25 -4.00 2.89 5.75 -1.26 -4.96 116.55 115.37 1jmx n ASP 141 Ca 0.03 -1.76 -0.09 0.00 -0.01 0.00 0.00 54.79 52.95 1jmx n ASP 141 Cb 0.19 -0.07 -0.06 0.00 -1.03 0.00 0.00 41.12 40.16 1jmx n ASP 141 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1jmx s ARG 142 N -1.86 1.51 -1.15 0.11 1.70 -1.03 -5.06 118.95 113.17 1jmx s ARG 142 Ca 0.34 -1.26 -0.19 0.00 -0.47 0.00 0.00 55.73 54.16 1jmx s ARG 142 Cb 0.20 0.46 0.09 0.00 -0.57 0.00 0.00 34.95 35.13 1jmx s ARG 142 CO 0.30 -0.62 1.52 -0.51 -1.08 0.00 0.00 175.30 174.91 1jmx s ASP 143 N -3.02 6.75 0.14 -2.89 1.01 -1.26 -4.87 116.67 112.53 1jmx s ASP 143 Ca 0.23 -2.18 -0.24 0.00 0.71 0.00 0.00 52.55 51.07 1jmx s ASP 143 Cb -0.00 -2.52 -0.01 0.00 1.01 0.00 0.00 42.92 41.40 1jmx s ASP 143 CO 0.09 -1.19 1.62 -0.25 0.21 0.00 0.00 175.17 175.65 1jmx h TRP 144 N 8.36 -0.74 0.24 4.23 7.01 -1.92 -2.69 115.95 130.43 1jmx h TRP 144 Ca 0.31 0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.34 1jmx h TRP 144 Cb 0.93 0.35 -0.01 0.00 -2.10 0.00 0.00 29.16 28.34 1jmx h TRP 144 CO 1.29 -0.35 -0.15 1.25 -2.79 0.00 0.00 178.44 177.69 1jmx h LEU 145 N -0.33 -0.39 -0.70 0.65 5.85 -1.95 -0.81 115.31 117.63 1jmx h LEU 145 Ca 0.11 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.91 1jmx h LEU 145 Cb 0.49 0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.59 1jmx h LEU 145 CO -0.34 -0.25 0.41 -0.65 -0.34 0.00 0.00 178.44 177.27 1jmx h PRO 146 N -0.38 0.74 -0.46 5.25 0.11 -1.98 -0.69 132.00 134.58 1jmx h PRO 146 Ca -0.02 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.01 1jmx h PRO 146 Cb 0.32 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.25 1jmx h PRO 146 CO 0.01 0.49 0.15 0.82 -0.21 0.00 0.00 178.00 179.26 1jmx h ILE 147 N 0.76 1.22 -0.53 4.15 2.04 -1.41 0.11 117.51 123.85 1jmx h ILE 147 Ca 0.31 -0.74 -0.09 0.00 1.00 0.00 0.00 64.86 65.35 1jmx h ILE 147 Cb 0.16 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 1jmx h ILE 147 CO -0.17 0.27 -0.01 0.00 0.00 0.00 0.00 178.15 178.24 1jmx h ALA 148 N 1.00 0.98 0.24 1.87 0.00 -0.65 0.12 119.26 122.81 1jmx h ALA 148 Ca 0.15 -0.29 -0.33 0.00 0.00 0.00 0.00 54.91 54.44 1jmx h ALA 148 Cb 0.26 -0.21 0.03 0.00 0.00 0.00 0.00 17.79 17.88 1jmx h ALA 148 CO -0.01 0.62 -1.50 -0.07 0.00 0.00 0.00 179.25 178.30 1jmx h LEU 149 N 0.84 0.78 0.06 0.00 3.38 -1.03 0.57 115.31 119.91 1jmx h LEU 149 Ca 0.15 -0.93 -0.30 0.00 0.09 0.00 0.00 57.88 56.90 1jmx h LEU 149 Cb 0.52 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 1jmx h LEU 149 CO 0.03 1.71 -1.64 1.56 0.09 0.00 0.00 178.44 180.18 1jmx h GLN 150 N 0.10 0.13 0.00 1.13 4.20 -0.80 -3.37 115.11 116.50 1jmx h GLN 150 Ca -0.27 -0.22 -0.26 0.00 0.06 0.00 0.00 58.65 57.96 1jmx h GLN 150 Cb 2.12 0.08 -0.04 0.00 0.30 0.00 0.00 27.48 29.95 1jmx h GLN 150 CO 0.25 0.87 -1.83 1.04 -0.67 0.00 0.00 178.83 178.49 1jmx n GLN 151 N -3.29 0.54 -0.02 1.46 3.00 0.35 -4.62 117.38 114.80 1jmx n GLN 151 Ca -0.18 0.23 -0.13 0.00 -0.01 0.00 0.00 57.00 56.91 1jmx n GLN 151 Cb 1.04 -1.42 -0.09 0.00 0.00 0.00 0.00 30.24 29.77 1jmx n GLN 151 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1jmx h VAL 152 N -0.96 1.33 -0.37 5.09 2.07 -1.29 -3.04 116.25 119.09 1jmx h VAL 152 Ca -0.39 -1.05 0.07 0.00 0.82 0.00 0.00 66.70 66.15 1jmx h VAL 152 Cb 1.32 1.93 -0.06 0.00 -1.52 0.00 0.00 31.29 32.96 1jmx h VAL 152 CO -0.23 0.29 -0.01 0.58 0.02 0.00 0.00 177.57 178.22 1jmx h VAL 153 N -0.29 0.72 -0.04 2.57 2.07 -1.03 0.12 116.25 120.37 1jmx h VAL 153 Ca 0.01 -0.03 -0.05 0.00 0.82 0.00 0.00 66.70 67.45 1jmx h VAL 153 Cb 0.47 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1jmx h VAL 153 CO 0.01 0.02 -0.22 -0.65 0.02 0.00 0.00 177.57 176.74 1jmx h PRO 154 N 0.09 0.06 -0.05 1.57 0.11 -1.77 -1.24 132.00 130.78 1jmx h PRO 154 Ca 0.18 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 66.15 1jmx h PRO 154 Cb 0.25 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 31.36 1jmx h PRO 154 CO -0.31 0.28 -0.45 0.22 -0.21 0.00 0.00 178.00 177.54 1jmx h ASP 155 N 0.06 0.48 -0.66 -2.05 -0.00 -1.24 -2.58 116.42 110.42 1jmx h ASP 155 Ca 0.01 -0.70 -0.00 0.00 -0.00 0.00 0.00 57.03 56.34 1jmx h ASP 155 Cb 0.43 -0.14 -0.03 0.00 -0.00 0.00 0.00 39.33 39.58 1jmx h ASP 155 CO 0.03 1.10 0.41 -0.07 -0.00 0.00 0.00 179.24 180.71 1jmx h LEU 156 N -0.11 0.80 -0.70 2.28 3.38 -0.56 -0.04 115.31 120.36 1jmx h LEU 156 Ca -0.04 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.75 1jmx h LEU 156 Cb 1.13 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 1jmx h LEU 156 CO 0.09 0.61 -0.54 0.00 0.09 0.00 0.00 178.44 178.70 1jmx h ALA 157 N 1.52 0.89 0.13 1.53 0.00 -1.24 0.69 119.26 122.78 1jmx h ALA 157 Ca 0.24 -0.50 -0.30 0.00 0.00 0.00 0.00 54.91 54.35 1jmx h ALA 157 Cb -0.04 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 17.69 1jmx h ALA 157 CO -0.05 0.68 -1.26 -0.22 0.00 0.00 0.00 179.25 178.41 1jmx h LYS 158 N 0.24 0.60 0.04 0.00 3.64 -0.97 -3.01 116.57 117.11 1jmx h LYS 158 Ca 0.01 -0.82 -0.27 0.00 -1.27 0.00 0.00 60.65 58.29 1jmx h LYS 158 Cb 1.02 0.27 0.02 0.00 -0.41 0.00 0.00 32.23 33.14 1jmx h LYS 158 CO 0.09 1.37 -1.10 0.00 -2.27 0.00 0.00 179.45 177.54 1jmx h ARG 159 N 0.26 0.65 -2.11 1.90 3.08 -1.03 -3.39 114.38 113.74 1jmx h ARG 159 Ca -0.19 -0.75 -0.58 0.00 0.07 0.00 0.00 59.98 58.53 1jmx h ARG 159 Cb 1.93 0.22 -0.41 0.00 0.08 0.00 0.00 29.97 31.80 1jmx h ARG 159 CO 0.24 1.32 -0.83 0.66 -1.07 0.00 0.00 179.97 180.29 1jmx n TYR 160 N -3.82 1.95 -2.39 3.04 0.53 0.23 -5.09 117.16 111.61 1jmx n TYR 160 Ca -0.11 -3.90 -0.33 0.00 -1.02 0.00 0.00 57.90 52.54 1jmx n TYR 160 Cb 0.91 -0.47 -0.03 0.00 -1.03 0.00 0.00 39.34 38.73 1jmx n TYR 160 CO 0.00 0.00 0.00 -1.25 -1.02 0.00 0.00 176.86 174.59 1jmx s PRO 161 N -2.06 3.78 0.15 -0.72 0.04 -1.14 -1.42 135.00 133.64 1jmx s PRO 161 Ca 0.39 1.13 -0.15 0.00 0.04 0.00 0.00 61.00 62.41 1jmx s PRO 161 Cb 0.18 -2.10 0.03 0.00 0.04 0.00 0.00 34.50 32.64 1jmx s PRO 161 CO -0.06 -0.42 1.78 1.25 0.04 0.00 0.00 177.00 179.58 1jmx h LEU 162 N 1.06 0.54 -9.46 -3.56 7.12 -1.78 -3.38 115.31 105.85 1jmx h LEU 162 Ca -0.48 -0.07 -0.67 0.00 0.13 0.00 0.00 57.88 56.80 1jmx h LEU 162 Cb 1.20 -0.14 -0.11 0.00 -0.53 0.00 0.00 40.66 41.09 1jmx h LEU 162 CO 0.60 0.45 -0.54 -1.61 -0.13 0.00 0.00 178.44 177.21 1jmx s GLU 163 N -5.94 3.32 0.10 1.25 0.41 -1.26 -4.88 118.70 111.69 1jmx s GLU 163 Ca -0.13 -0.25 -0.22 0.00 -0.41 0.00 0.00 54.97 53.96 1jmx s GLU 163 Cb 0.11 -3.05 0.06 0.00 -1.78 0.00 0.00 34.13 29.47 1jmx s GLU 163 CO 0.74 0.71 0.53 -1.54 -0.49 0.00 0.00 175.26 175.21 1jmx s SER 164 N -0.85 -0.45 0.26 -0.19 1.04 -1.26 -5.04 113.70 107.20 1jmx s SER 164 Ca 0.13 0.03 -0.03 0.00 0.48 0.00 0.00 55.95 56.57 1jmx s SER 164 Cb -0.12 0.53 0.33 0.00 0.10 0.00 0.00 66.02 66.87 1jmx s SER 164 CO 0.03 -0.83 1.80 0.00 0.98 0.00 0.00 173.24 175.22 1jmx h ALA 165 N 2.42 1.15 -0.43 5.32 0.00 -1.99 -2.70 119.26 123.03 1jmx h ALA 165 Ca -0.32 -0.22 0.06 0.00 0.00 0.00 0.00 54.91 54.43 1jmx h ALA 165 Cb 1.25 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 1jmx h ALA 165 CO 0.41 0.57 0.13 0.00 0.00 0.00 0.00 179.25 180.37 1jmx h ALA 166 N 1.29 0.50 -0.45 0.00 0.00 -1.97 0.96 119.26 119.58 1jmx h ALA 166 Ca 0.19 0.07 -0.14 0.00 0.00 0.00 0.00 54.91 55.02 1jmx h ALA 166 Cb 0.32 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1jmx h ALA 166 CO -0.00 -0.27 -0.27 2.35 0.00 0.00 0.00 179.25 181.06 1jmx h TRP 167 N 0.28 1.14 -0.28 0.00 -0.00 -1.93 -1.00 115.95 114.16 1jmx h TRP 167 Ca 0.21 -0.30 -0.02 0.00 -0.00 0.00 0.00 58.89 58.78 1jmx h TRP 167 Cb 0.22 -0.26 -0.01 0.00 -0.00 0.00 0.00 29.16 29.11 1jmx h TRP 167 CO -0.17 1.12 0.09 0.00 -0.00 0.00 0.00 178.44 179.48 1jmx h ALA 168 N 0.85 0.37 0.00 2.65 0.00 -1.11 -1.60 119.26 120.42 1jmx h ALA 168 Ca 0.09 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1jmx h ALA 168 Cb 0.86 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1jmx h ALA 168 CO 0.08 -0.00 0.00 0.93 0.00 0.00 0.00 179.25 180.25 1jmx h GLU 169 N 0.30 0.00 0.24 0.00 5.08 -0.82 -3.02 114.58 116.36 1jmx h GLU 169 Ca 0.09 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.12 1jmx h GLU 169 Cb 0.24 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.52 1jmx h GLU 169 CO -0.00 0.00 -1.47 2.35 -1.00 0.00 0.00 179.01 178.89 1jmx h TRP 170 N 0.00 0.92 -0.01 4.33 2.91 -0.92 -2.37 115.95 120.80 1jmx h TRP 170 Ca 0.00 -0.67 0.00 0.00 1.13 0.00 0.00 58.89 59.35 1jmx h TRP 170 Cb 0.67 -0.04 -0.00 0.00 -0.51 0.00 0.00 29.16 29.29 1jmx h TRP 170 CO 0.00 1.54 0.01 1.96 -1.03 0.00 0.00 178.44 180.92 1jmx h GLN 171 N 0.14 0.00 0.10 2.65 4.20 -1.17 0.11 115.11 121.15 1jmx h GLN 171 Ca -0.25 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.10 1jmx h GLN 171 Cb 2.15 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.90 1jmx h GLN 171 CO 0.27 0.00 -2.05 1.63 -0.67 0.00 0.00 178.83 178.00 1jmx n LYS 172 N -4.11 0.74 -0.09 1.46 4.76 -1.20 -4.36 118.16 115.35 1jmx n LYS 172 Ca -0.03 0.25 0.10 0.00 -2.87 0.00 0.00 58.31 55.76 1jmx n LYS 172 Cb 0.10 -1.69 0.35 0.00 -1.84 0.00 0.00 35.03 31.95 1jmx n LYS 172 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1jmx n ALA 173 N -3.01 2.51 -1.85 7.82 0.00 -0.89 -4.93 120.51 120.15 1jmx n ALA 173 Ca -0.33 -0.56 -0.42 0.00 0.00 0.00 0.00 53.44 52.12 1jmx n ALA 173 Cb 1.04 -1.07 -0.03 0.00 0.00 0.00 0.00 19.45 19.40 1jmx n ALA 173 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1jmx s ARG 174 N -1.76 3.97 0.75 0.00 3.52 0.36 -4.99 118.95 120.80 1jmx s ARG 174 Ca 0.32 2.23 -0.11 0.00 -0.13 0.00 0.00 55.73 58.05 1jmx s ARG 174 Cb 0.17 -4.11 0.04 0.00 -1.56 0.00 0.00 34.95 29.50 1jmx s ARG 174 CO 0.26 -1.12 1.08 -1.25 -0.81 0.00 0.00 175.30 173.45 1jmx s PRO 175 N 4.60 2.45 0.64 5.12 0.04 -1.26 -5.03 135.00 141.56 1jmx s PRO 175 Ca 0.82 1.02 -0.03 0.00 0.04 0.00 0.00 61.00 62.85 1jmx s PRO 175 Cb -0.35 -1.93 0.05 0.00 0.04 0.00 0.00 34.50 32.31 1jmx s PRO 175 CO 0.35 -1.46 0.90 0.21 0.04 0.00 0.00 177.00 177.04 1jmx s LYS 176 N -4.98 2.32 0.15 4.56 2.20 -1.26 -4.56 119.74 118.16 1jmx s LYS 176 Ca 0.60 -0.54 0.23 0.00 -0.36 0.00 0.00 55.97 55.90 1jmx s LYS 176 Cb -0.16 -2.32 0.90 0.00 -1.51 0.00 0.00 37.83 34.74 1jmx s LYS 176 CO 0.56 -1.01 1.71 0.00 -0.36 0.00 0.00 175.35 176.24 1jmx n ALA 177 N -2.65 1.93 0.38 3.13 0.00 -1.26 -2.88 120.51 119.15 1jmx n ALA 177 Ca 0.08 -0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.64 1jmx n ALA 177 Cb 0.60 -1.39 0.49 0.00 0.00 0.00 0.00 19.45 19.15 1jmx n ALA 177 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1jmx n ASP 178 N -1.96 0.63 -0.02 0.00 5.75 -1.26 -2.47 116.55 117.22 1jmx n ASP 178 Ca 0.04 0.66 0.14 0.00 -0.01 0.00 0.00 54.79 55.63 1jmx n ASP 178 Cb 0.29 -0.79 0.62 0.00 -1.03 0.00 0.00 41.12 40.21 1jmx n ASP 178 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1jmx n ALA 179 N -1.76 2.58 -0.07 2.12 0.00 -1.14 -4.19 120.51 118.05 1jmx n ALA 179 Ca 0.02 -0.17 -0.09 0.00 0.00 0.00 0.00 53.44 53.21 1jmx n ALA 179 Cb 0.21 -1.42 -0.15 0.00 0.00 0.00 0.00 19.45 18.09 1jmx n ALA 179 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1jmx n LEU 180 N -1.34 0.31 -4.73 0.00 4.77 -1.03 -4.94 117.00 110.03 1jmx n LEU 180 Ca 0.10 0.15 -0.39 0.00 -0.03 0.00 0.00 56.01 55.84 1jmx n LEU 180 Cb 0.30 0.37 0.04 0.00 -2.33 0.00 0.00 43.42 41.79 1jmx n LEU 180 CO 0.26 0.44 0.95 -2.65 -1.33 0.00 0.00 177.39 175.05 1jmx n PRO 181 N -2.83 1.76 -0.18 3.23 -0.02 -1.26 -4.82 135.00 130.87 1jmx n PRO 181 Ca -0.26 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 1jmx n PRO 181 Cb 1.10 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 1jmx n PRO 181 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jmx n GLY 182 N 0.78 0.90 3.88 -1.23 0.00 -0.20 -4.98 105.19 104.34 1jmx n GLY 182 Ca 0.09 -1.86 -0.36 0.00 0.00 0.00 0.00 46.02 43.89 1jmx n GLY 182 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1jmx s GLN 183 N -2.00 3.50 -0.20 1.61 -1.52 -1.26 -1.39 119.66 118.41 1jmx s GLN 183 Ca 0.00 -0.12 -0.01 0.00 -1.95 0.00 0.00 55.36 53.28 1jmx s GLN 183 Cb 0.00 -3.15 0.06 0.00 -0.22 0.00 0.00 33.01 29.70 1jmx s GLN 183 CO 0.00 0.72 -0.00 -1.58 -0.25 0.00 0.00 175.29 174.18 1jmx s TRP 184 N -1.15 1.50 -0.01 0.91 0.52 0.96 -1.43 118.94 120.24 1jmx s TRP 184 Ca 0.21 -1.11 -0.30 0.00 0.02 0.00 0.00 56.10 54.91 1jmx s TRP 184 Cb -0.13 -1.22 -0.04 0.00 -1.15 0.00 0.00 33.47 30.93 1jmx s TRP 184 CO 0.10 -0.64 1.17 0.00 0.02 0.00 0.00 176.95 177.60 1jmx s ALA 185 N 1.70 3.42 0.20 0.98 0.00 -0.54 -0.05 121.76 127.47 1jmx s ALA 185 Ca -0.02 0.69 0.09 0.00 0.00 0.00 0.00 51.96 52.72 1jmx s ALA 185 Cb -0.17 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.44 1jmx s ALA 185 CO -0.07 -0.58 -0.18 -0.59 0.00 0.00 0.00 175.76 174.35 1jmx s PHE 186 N 1.64 1.88 0.00 0.00 -0.71 0.20 -0.98 117.98 120.01 1jmx s PHE 186 Ca 0.56 -0.48 -0.03 0.00 -1.04 0.00 0.00 56.93 55.95 1jmx s PHE 186 Cb -0.26 -0.89 -0.01 0.00 -1.21 0.00 0.00 43.02 40.65 1jmx s PHE 186 CO 0.25 0.41 0.04 0.45 -1.34 0.00 0.00 175.22 175.04 1jmx s SER 187 N -3.02 0.10 0.20 1.98 0.15 -0.35 -1.74 113.70 111.02 1jmx s SER 187 Ca 0.21 -0.25 -0.22 0.00 0.70 0.00 0.00 55.95 56.39 1jmx s SER 187 Cb -0.04 0.14 0.07 0.00 -1.71 0.00 0.00 66.02 64.48 1jmx s SER 187 CO 0.08 -0.25 0.99 -0.83 1.20 0.00 0.00 173.24 174.44 1jmx s GLY 188 N -1.04 0.07 -0.12 9.45 0.00 -0.23 -1.59 107.32 113.86 1jmx s GLY 188 Ca -0.11 -0.29 -0.07 0.00 0.00 0.00 0.00 44.72 44.25 1jmx s GLY 188 CO 0.00 1.55 0.29 -1.58 0.00 0.00 0.00 173.10 173.36 1jmx s HIS 189 N -2.43 -0.40 -0.23 1.90 2.46 -1.01 -0.72 115.29 114.86 1jmx s HIS 189 Ca 0.19 0.92 -0.07 0.00 0.47 0.00 0.00 55.06 56.58 1jmx s HIS 189 Cb -0.03 0.11 -0.03 0.00 -0.13 0.00 0.00 32.58 32.51 1jmx s HIS 189 CO 0.05 -0.26 0.05 1.41 -2.47 0.00 0.00 174.74 173.52 1jmx s MET 190 N 1.24 3.65 0.19 2.88 0.00 -0.54 -0.99 119.30 125.73 1jmx s MET 190 Ca -0.09 -0.49 -0.33 0.00 0.00 0.00 0.00 55.69 54.79 1jmx s MET 190 Cb -0.09 -3.25 -0.14 0.00 0.00 0.00 0.00 34.83 31.35 1jmx s MET 190 CO -0.09 -0.12 1.40 -0.11 0.00 0.00 0.00 175.02 176.10 1jmx n LEU 191 N 4.69 2.69 0.00 4.11 7.94 -1.26 -0.57 117.00 134.61 1jmx n LEU 191 Ca -0.17 1.12 0.00 0.00 -1.11 0.00 0.00 56.01 55.86 1jmx n LEU 191 Cb 0.51 -1.37 0.00 0.00 0.53 0.00 0.00 43.42 43.10 1jmx n LEU 191 CO 0.31 -0.63 0.00 0.00 -1.11 0.00 0.00 177.39 175.96 1jmx n ALA 192 N 2.28 0.00 0.00 1.96 0.00 -1.24 -4.70 120.51 118.81 1jmx n ALA 192 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1jmx n ALA 192 Cb 0.28 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.88 1jmx n ALA 192 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1jmx n LYS 193 N -0.91 0.00 0.00 0.00 3.00 -0.25 -4.82 118.16 115.18 1jmx n LYS 193 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1jmx n LYS 193 Cb 0.23 -0.53 0.00 0.00 0.00 0.00 0.00 35.03 34.73 1jmx n LYS 193 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1jmx n GLY 194 N 2.72 0.79 3.74 3.14 0.00 0.27 -4.87 105.19 110.97 1jmx n GLY 194 Ca 0.00 -2.24 -0.33 0.00 0.00 0.00 0.00 46.02 43.45 1jmx n GLY 194 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1jmx s ASP 195 N -0.95 4.30 -0.02 1.61 -0.00 -1.26 -1.47 116.67 118.87 1jmx s ASP 195 Ca 0.00 2.14 -0.08 0.00 -0.00 0.00 0.00 52.55 54.61 1jmx s ASP 195 Cb 0.00 -2.56 0.01 0.00 -0.00 0.00 0.00 42.92 40.37 1jmx s ASP 195 CO 0.00 -2.18 0.18 0.54 -0.00 0.00 0.00 175.17 173.71 1jmx s VAL 196 N -2.33 0.05 0.03 -1.27 0.11 0.11 -0.80 120.40 116.29 1jmx s VAL 196 Ca 0.69 -0.44 -0.23 0.00 -2.93 0.00 0.00 61.98 59.07 1jmx s VAL 196 Cb -0.24 -0.41 0.05 0.00 -1.53 0.00 0.00 36.38 34.26 1jmx s VAL 196 CO 0.48 -0.24 0.54 0.00 -3.33 0.00 0.00 175.10 172.54 1jmx s ARG 197 N -0.89 1.02 0.00 1.54 3.03 -0.78 -1.07 118.95 121.81 1jmx s ARG 197 Ca -0.10 -0.15 0.00 0.00 2.03 0.00 0.00 55.73 57.51 1jmx s ARG 197 Cb -0.05 0.47 0.00 0.00 -1.03 0.00 0.00 34.95 34.34 1jmx s ARG 197 CO 0.01 -0.36 0.00 0.41 -1.13 0.00 0.00 175.30 174.24 1jmx n GLY 198 N 0.53 -0.54 3.00 3.88 0.00 -0.71 -1.80 105.19 109.55 1jmx n GLY 198 Ca -0.19 -0.83 -0.23 0.00 0.00 0.00 0.00 46.02 44.78 1jmx n GLY 198 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jmx s VAL 199 N -3.08 0.95 -0.24 1.61 1.01 0.51 -0.63 120.40 120.53 1jmx s VAL 199 Ca 0.00 -0.39 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 1jmx s VAL 199 Cb 0.00 -0.87 -0.01 0.00 0.00 0.00 0.00 36.38 35.50 1jmx s VAL 199 CO 0.00 0.31 -0.01 -0.32 0.00 0.00 0.00 175.10 175.08 1jmx s MET 200 N 0.57 3.37 -0.27 2.72 1.75 0.93 -0.78 119.30 127.58 1jmx s MET 200 Ca -0.11 -0.64 -0.15 0.00 -1.25 0.00 0.00 55.69 53.54 1jmx s MET 200 Cb -0.14 -3.12 -0.04 0.00 2.84 0.00 0.00 34.83 34.38 1jmx s MET 200 CO 0.02 -0.24 0.37 0.45 -0.65 0.00 0.00 175.02 174.97 1jmx s SER 201 N 1.50 6.25 -0.20 1.11 0.15 0.11 -0.03 113.70 122.59 1jmx s SER 201 Ca 0.05 0.28 -0.04 0.00 0.70 0.00 0.00 55.95 56.94 1jmx s SER 201 Cb -0.15 -2.21 -0.02 0.00 -1.71 0.00 0.00 66.02 61.93 1jmx s SER 201 CO -0.01 -0.18 -0.03 -0.69 1.20 0.00 0.00 173.24 173.53 1jmx s VAL 202 N 2.06 3.66 0.07 4.45 1.01 -0.48 -1.00 120.40 130.17 1jmx s VAL 202 Ca 0.15 -0.41 0.07 0.00 0.00 0.00 0.00 61.98 61.79 1jmx s VAL 202 Cb -0.16 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 1jmx s VAL 202 CO 0.10 0.44 -0.19 0.42 0.00 0.00 0.00 175.10 175.87 1jmx s THR 203 N 1.08 1.53 0.91 3.92 -4.23 -0.72 -1.03 115.64 117.10 1jmx s THR 203 Ca 0.02 -1.31 -0.11 0.00 -1.18 0.00 0.00 61.69 59.10 1jmx s THR 203 Cb -0.15 -1.37 0.14 0.00 1.34 0.00 0.00 72.50 72.46 1jmx s THR 203 CO 0.01 0.02 1.10 -2.16 -0.54 0.00 0.00 174.62 173.04 1jmx s PRO 204 N -1.52 1.09 0.00 3.99 0.04 -1.26 -0.60 135.00 136.74 1jmx s PRO 204 Ca 0.05 1.06 0.00 0.00 0.04 0.00 0.00 61.00 62.15 1jmx s PRO 204 Cb -0.09 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.68 1jmx s PRO 204 CO 0.03 -2.42 0.00 -3.47 0.04 0.00 0.00 177.00 171.17 1jmx n ASP 205 N -4.04 0.00 -4.67 6.66 4.64 -1.10 -4.44 116.55 113.60 1jmx n ASP 205 Ca 0.08 -0.40 -0.44 0.00 -1.38 0.00 0.00 54.79 52.65 1jmx n ASP 205 Cb 0.54 0.00 -0.03 0.00 -1.04 0.00 0.00 41.12 40.58 1jmx n ASP 205 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1jmx n GLN 206 N 0.00 2.68 0.00 -0.67 10.64 -1.26 -4.65 117.38 124.12 1jmx n GLN 206 Ca 0.00 0.98 0.00 0.00 -1.83 0.00 0.00 57.00 56.15 1jmx n GLN 206 Cb 0.00 -2.91 0.00 0.00 -0.86 0.00 0.00 30.24 26.47 1jmx n GLN 206 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1jmx n GLY 207 N 4.49 3.79 1.87 2.61 0.00 -1.26 -2.48 105.19 114.20 1jmx n GLY 207 Ca 0.21 0.09 0.06 0.00 0.00 0.00 0.00 46.02 46.37 1jmx n GLY 207 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jmx n ASP 208 N 9.29 5.63 -4.88 1.61 10.43 -1.26 -4.95 116.55 132.41 1jmx n ASP 208 Ca 0.00 -2.96 -0.21 0.00 2.57 0.00 0.00 54.79 54.18 1jmx n ASP 208 Cb 0.00 -0.69 -0.03 0.00 1.84 0.00 0.00 41.12 42.24 1jmx n ASP 208 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 1jmx s THR 209 N -2.80 4.48 0.14 -3.53 -4.23 -1.04 -1.11 115.64 107.56 1jmx s THR 209 Ca 0.54 -1.25 -0.07 0.00 -1.18 0.00 0.00 61.69 59.74 1jmx s THR 209 Cb 0.42 -3.49 -0.02 0.00 1.34 0.00 0.00 72.50 70.75 1jmx s THR 209 CO 0.15 -0.30 0.21 -0.36 -0.54 0.00 0.00 174.62 173.79 1jmx s PHE 210 N -2.12 0.48 -0.08 3.99 0.08 0.92 -2.71 117.98 118.54 1jmx s PHE 210 Ca 0.36 -0.86 -0.05 0.00 0.12 0.00 0.00 56.93 56.50 1jmx s PHE 210 Cb -0.08 -0.16 -0.04 0.00 -0.57 0.00 0.00 43.02 42.17 1jmx s PHE 210 CO 0.27 -0.64 0.15 0.15 -0.10 0.00 0.00 175.22 175.04 1jmx s LYS 211 N -3.97 3.41 -0.01 0.44 1.02 0.23 -2.00 119.74 118.86 1jmx s LYS 211 Ca 0.17 -0.22 0.04 0.00 0.02 0.00 0.00 55.97 55.98 1jmx s LYS 211 Cb 0.05 -3.13 -0.01 0.00 -0.52 0.00 0.00 37.83 34.21 1jmx s LYS 211 CO -0.01 0.74 -0.12 0.08 -0.92 0.00 0.00 175.35 175.12 1jmx s VAL 212 N -1.13 0.94 -0.08 3.17 1.01 -0.13 -1.75 120.40 122.43 1jmx s VAL 212 Ca 0.19 -0.51 -0.01 0.00 0.00 0.00 0.00 61.98 61.66 1jmx s VAL 212 Cb -0.12 -0.78 0.03 0.00 0.00 0.00 0.00 36.38 35.50 1jmx s VAL 212 CO 0.09 0.27 -0.02 -0.70 0.00 0.00 0.00 175.10 174.74 1jmx s GLU 213 N -0.27 0.87 -0.19 2.72 2.56 -0.17 -1.43 118.70 122.79 1jmx s GLU 213 Ca 0.04 -0.00 -0.06 0.00 0.00 0.00 0.00 54.97 54.95 1jmx s GLU 213 Cb -0.05 -1.13 -0.03 0.00 2.00 0.00 0.00 34.13 34.92 1jmx s GLU 213 CO -0.00 -0.28 0.02 0.08 -0.56 0.00 0.00 175.26 174.52 1jmx s VAL 214 N 1.84 4.24 -0.21 3.70 1.01 0.15 0.10 120.40 131.23 1jmx s VAL 214 Ca 0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 61.98 61.79 1jmx s VAL 214 Cb -0.12 -2.91 0.06 0.00 0.00 0.00 0.00 36.38 33.40 1jmx s VAL 214 CO -0.06 0.44 0.01 -0.54 0.00 0.00 0.00 175.10 174.95 1jmx s LYS 215 N 0.77 0.98 0.00 2.72 3.01 0.04 -0.69 119.74 126.56 1jmx s LYS 215 Ca 0.01 -0.62 0.00 0.00 -1.01 0.00 0.00 55.97 54.36 1jmx s LYS 215 Cb -0.14 -2.28 0.00 0.00 -1.01 0.00 0.00 37.83 34.40 1jmx s LYS 215 CO 0.02 -0.63 0.00 0.41 0.51 0.00 0.00 175.35 175.66 1jmx n GLY 216 N 4.92 1.62 3.64 -3.33 0.00 -0.45 -0.36 105.19 111.24 1jmx n GLY 216 Ca -0.10 -0.54 -0.06 0.00 0.00 0.00 0.00 46.02 45.32 1jmx n GLY 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jmx s ALA 217 N -1.00 -1.73 0.60 4.61 0.00 -0.74 -0.87 121.76 122.63 1jmx s ALA 217 Ca 0.00 0.50 -0.04 0.00 0.00 0.00 0.00 51.96 52.42 1jmx s ALA 217 Cb 0.00 0.55 0.03 0.00 0.00 0.00 0.00 23.12 23.70 1jmx s ALA 217 CO 0.00 -0.89 0.89 0.71 0.00 0.00 0.00 175.76 176.46 1jmx s TYR 218 N -3.21 3.08 0.49 0.00 2.02 0.12 -1.87 117.35 117.98 1jmx s TYR 218 Ca 0.09 0.43 0.30 0.00 -0.37 0.00 0.00 57.07 57.52 1jmx s TYR 218 Cb -0.01 -2.83 1.67 0.00 -0.40 0.00 0.00 41.96 40.39 1jmx s TYR 218 CO -0.03 -0.95 2.16 0.00 -1.57 0.00 0.00 175.55 175.16 1jmx h ALA 219 N -0.20 1.33 -0.08 3.71 0.00 -1.29 -2.21 119.26 120.51 1jmx h ALA 219 Ca -0.45 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1jmx h ALA 219 Cb 1.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1jmx h ALA 219 CO 0.59 0.08 0.00 -0.40 0.00 0.00 0.00 179.25 179.52 1jmx n ASP 220 N -3.63 1.08 0.00 0.00 3.85 -1.26 -4.92 116.55 111.66 1jmx n ASP 220 Ca -0.02 -1.54 0.00 0.00 -0.71 0.00 0.00 54.79 52.52 1jmx n ASP 220 Cb 0.17 -0.05 0.00 0.00 -1.35 0.00 0.00 41.12 39.89 1jmx n ASP 220 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1jmx n GLY 221 N 1.04 0.80 3.72 6.12 0.00 -0.83 -5.05 105.19 110.99 1jmx n GLY 221 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1jmx n GLY 221 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1jmx s THR 222 N -2.23 3.66 0.69 2.61 -1.32 -1.26 -4.81 115.64 112.97 1jmx s THR 222 Ca 0.00 1.24 -0.16 0.00 -1.21 0.00 0.00 61.69 61.56 1jmx s THR 222 Cb 0.00 -3.80 0.02 0.00 -1.51 0.00 0.00 72.50 67.21 1jmx s THR 222 CO 0.00 0.13 1.20 -2.84 -2.21 0.00 0.00 174.62 170.90 1jmx s PRO 223 N 0.68 2.39 -0.41 7.08 0.02 -1.26 -0.70 135.00 142.79 1jmx s PRO 223 Ca 0.59 1.75 0.09 0.00 0.02 0.00 0.00 61.00 63.45 1jmx s PRO 223 Cb -0.33 -1.86 0.29 0.00 0.02 0.00 0.00 34.50 32.61 1jmx s PRO 223 CO 0.32 -1.64 0.62 0.34 -0.33 0.00 0.00 177.00 176.31 1jmx n PHE 224 N -2.43 0.31 -4.84 6.54 7.35 -0.05 -4.73 117.46 119.61 1jmx n PHE 224 Ca 0.13 -3.71 -0.33 0.00 -0.76 0.00 0.00 57.45 52.79 1jmx n PHE 224 Cb 0.50 -0.39 -0.14 0.00 0.35 0.00 0.00 39.48 39.79 1jmx n PHE 224 CO 0.00 0.00 0.00 -0.80 -0.76 0.00 0.00 176.76 175.20 1jmx s ASN 225 N -1.78 3.93 0.26 -2.13 0.01 -1.26 -1.34 114.94 112.63 1jmx s ASN 225 Ca 0.38 -0.33 -0.17 0.00 -0.71 0.00 0.00 52.86 52.03 1jmx s ASN 225 Cb 0.23 -1.49 0.01 0.00 0.41 0.00 0.00 41.25 40.41 1jmx s ASN 225 CO -0.09 0.19 0.58 -0.83 -1.51 0.00 0.00 177.10 175.44 1jmx s GLY 226 N 0.20 0.24 0.01 0.66 0.00 0.13 -3.70 107.32 104.86 1jmx s GLY 226 Ca -0.09 -0.61 0.01 0.00 0.00 0.00 0.00 44.72 44.04 1jmx s GLY 226 CO 0.05 -0.38 -0.04 -0.45 0.00 0.00 0.00 173.10 172.28 1jmx s SER 227 N -2.97 0.46 0.00 1.64 0.15 -1.15 -0.67 113.70 111.16 1jmx s SER 227 Ca 0.17 -0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.65 1jmx s SER 227 Cb -0.03 -0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.26 1jmx s SER 227 CO 0.08 -0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.10 1jmx n GLY 228 N 2.64 1.52 3.36 9.45 0.00 -0.51 -1.47 105.19 120.17 1jmx n GLY 228 Ca -0.15 -0.51 -0.10 0.00 0.00 0.00 0.00 46.02 45.25 1jmx n GLY 228 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jmx s SER 229 N 2.00 0.06 0.08 1.61 1.04 -0.50 -0.95 113.70 117.03 1jmx s SER 229 Ca 0.00 -1.15 -0.17 0.00 0.48 0.00 0.00 55.95 55.11 1jmx s SER 229 Cb 0.00 0.46 0.04 0.00 0.10 0.00 0.00 66.02 66.61 1jmx s SER 229 CO 0.00 -0.95 0.41 0.00 0.98 0.00 0.00 173.24 173.68 1jmx s ALA 230 N -4.08 -0.98 0.16 5.32 0.00 -0.85 -0.70 121.76 120.64 1jmx s ALA 230 Ca 0.29 0.15 0.08 0.00 0.00 0.00 0.00 51.96 52.49 1jmx s ALA 230 Cb 0.04 0.50 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 1jmx s ALA 230 CO 0.09 -0.54 -0.18 0.42 0.00 0.00 0.00 175.76 175.55 1jmx s ILE 231 N -3.06 1.79 -0.18 0.00 1.01 -0.09 -0.05 121.20 120.62 1jmx s ILE 231 Ca -0.02 -1.86 0.01 0.00 0.00 0.00 0.00 60.65 58.78 1jmx s ILE 231 Cb 0.00 -1.80 0.03 0.00 0.01 0.00 0.00 42.46 40.71 1jmx s ILE 231 CO -0.07 -0.29 -0.15 -0.22 0.00 0.00 0.00 174.94 174.22 1jmx s LEU 232 N -2.56 2.05 -0.10 2.97 1.98 -0.27 -1.53 118.68 121.21 1jmx s LEU 232 Ca 0.14 -0.68 -0.05 0.00 -2.89 0.00 0.00 54.13 50.65 1jmx s LEU 232 Cb -0.06 -1.29 -0.04 0.00 0.66 0.00 0.00 46.19 45.46 1jmx s LEU 232 CO 0.06 -0.07 0.09 -0.31 -1.89 0.00 0.00 176.35 174.23 1jmx s TYR 233 N 1.39 3.44 -0.99 5.38 1.51 0.02 -4.59 117.35 123.51 1jmx s TYR 233 Ca 0.03 0.40 -0.02 0.00 -1.01 0.00 0.00 57.07 56.47 1jmx s TYR 233 Cb -0.14 -1.88 0.02 0.00 -0.11 0.00 0.00 41.96 39.84 1jmx s TYR 233 CO -0.10 0.64 0.11 -1.71 -1.11 0.00 0.00 175.55 173.38 1jmx n ASN 234 N 2.00 -3.57 0.00 2.29 5.15 -1.26 -0.46 115.26 119.42 1jmx n ASN 234 Ca -0.19 0.10 0.00 0.00 -0.60 0.00 0.00 54.58 53.89 1jmx n ASN 234 Cb 0.54 -3.03 0.00 0.00 -0.53 0.00 0.00 39.78 36.76 1jmx n ASN 234 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1jmx n GLY 235 N -0.86 1.32 0.00 8.20 0.00 -1.26 -4.55 105.19 108.05 1jmx n GLY 235 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1jmx n GLY 235 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1jmx n TYR 236 N -2.00 0.00 -2.35 1.61 0.18 -0.94 -4.61 117.16 109.06 1jmx n TYR 236 Ca 0.00 0.00 -0.36 0.00 1.88 0.00 0.00 57.90 59.42 1jmx n TYR 236 Cb 0.00 0.00 -0.04 0.00 -0.38 0.00 0.00 39.34 38.92 1jmx n TYR 236 CO 0.00 0.00 0.00 -1.21 -2.08 0.00 0.00 176.86 173.57 1jmx s GLU 237 N -0.59 3.11 -0.16 -3.48 0.41 0.40 -0.51 118.70 117.88 1jmx s GLU 237 Ca 0.00 -0.58 -0.26 0.00 -0.41 0.00 0.00 54.97 53.72 1jmx s GLU 237 Cb 0.00 -5.02 -0.01 0.00 -1.78 0.00 0.00 34.13 27.32 1jmx s GLU 237 CO 0.00 -2.63 0.87 -0.46 -0.49 0.00 0.00 175.26 172.55 1jmx s TRP 238 N 7.10 3.43 -0.15 1.61 -0.11 -0.60 -0.80 118.94 129.43 1jmx s TRP 238 Ca 0.54 1.32 0.00 0.00 1.22 0.00 0.00 56.10 59.18 1jmx s TRP 238 Cb -0.04 -3.05 0.03 0.00 -1.50 0.00 0.00 33.47 28.90 1jmx s TRP 238 CO -0.01 -0.25 -0.10 1.03 -4.62 0.00 0.00 176.95 173.00 1jmx s ARG 239 N 2.17 1.89 0.19 5.86 1.81 -0.58 -1.78 118.95 128.50 1jmx s ARG 239 Ca 0.40 -0.50 0.01 0.00 -1.72 0.00 0.00 55.73 53.91 1jmx s ARG 239 Cb -0.17 -1.98 -0.05 0.00 -0.45 0.00 0.00 34.95 32.30 1jmx s ARG 239 CO 0.13 -0.31 0.06 0.20 -0.68 0.00 0.00 175.30 174.70 1jmx s GLY 240 N 1.56 1.33 -0.06 -3.53 0.00 -0.26 -0.91 107.32 105.45 1jmx s GLY 240 Ca 0.03 -1.65 -0.02 0.00 0.00 0.00 0.00 44.72 43.08 1jmx s GLY 240 CO -0.09 -1.49 0.03 0.21 0.00 0.00 0.00 173.10 171.75 1jmx s ASN 241 N -3.18 1.46 -0.14 1.64 3.84 0.13 -0.19 114.94 118.50 1jmx s ASN 241 Ca 0.30 -0.05 -0.00 0.00 0.21 0.00 0.00 52.86 53.31 1jmx s ASN 241 Cb 0.07 -0.32 0.03 0.00 -0.55 0.00 0.00 41.25 40.48 1jmx s ASN 241 CO 0.07 -0.22 -0.08 -0.69 -2.79 0.00 0.00 177.10 173.39 1jmx s VAL 242 N 2.05 1.20 -0.79 -5.21 1.01 0.50 -1.41 120.40 117.75 1jmx s VAL 242 Ca 0.05 -0.52 -0.26 0.00 0.00 0.00 0.00 61.98 61.25 1jmx s VAL 242 Cb -0.12 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 35.03 1jmx s VAL 242 CO -0.05 0.29 1.44 -0.75 0.00 0.00 0.00 175.10 176.03 1jmx s LYS 243 N 1.62 3.16 -0.46 2.72 2.47 -0.54 -0.98 119.74 127.72 1jmx s LYS 243 Ca 0.03 -0.30 -0.12 0.00 -1.56 0.00 0.00 55.97 54.02 1jmx s LYS 243 Cb -0.14 -4.50 0.09 0.00 -1.46 0.00 0.00 37.83 31.82 1jmx s LYS 243 CO -0.08 -2.31 0.35 0.08 0.16 0.00 0.00 175.35 173.54 1jmx s VAL 244 N 6.30 4.67 0.00 4.02 1.01 -0.12 -2.91 120.40 133.37 1jmx s VAL 244 Ca 0.44 -1.37 0.00 0.00 0.00 0.00 0.00 61.98 61.05 1jmx s VAL 244 Cb -0.07 -3.89 0.00 0.00 0.00 0.00 0.00 36.38 32.42 1jmx s VAL 244 CO 0.10 -0.62 0.00 0.61 0.00 0.00 0.00 175.10 175.19 1jmx n GLY 245 N 5.05 2.59 1.01 4.51 0.00 -1.24 -2.79 105.19 114.32 1jmx n GLY 245 Ca -0.11 -0.36 0.10 0.00 0.00 0.00 0.00 46.02 45.65 1jmx n GLY 245 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jmx n ASP 246 N 8.97 3.27 -4.23 1.61 8.00 -1.26 -4.96 116.55 127.95 1jmx n ASP 246 Ca 0.00 -1.93 -0.27 0.00 0.71 0.00 0.00 54.79 53.29 1jmx n ASP 246 Cb 0.00 -0.26 -0.16 0.00 -0.02 0.00 0.00 41.12 40.69 1jmx n ASP 246 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jmx s ALA 247 N -1.25 1.78 -0.16 2.24 0.00 -1.12 -5.11 121.76 118.15 1jmx s ALA 247 Ca 0.34 -0.94 -0.20 0.00 0.00 0.00 0.00 51.96 51.17 1jmx s ALA 247 Cb 0.20 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.84 1jmx s ALA 247 CO 0.27 0.43 0.57 -0.80 0.00 0.00 0.00 175.76 176.23 1jmx s ASN 248 N -0.57 6.70 -0.13 0.00 0.01 -1.26 -0.95 114.94 118.74 1jmx s ASN 248 Ca 0.08 0.84 -0.01 0.00 -0.71 0.00 0.00 52.86 53.06 1jmx s ASN 248 Cb -0.08 -2.33 -0.02 0.00 0.41 0.00 0.00 41.25 39.23 1jmx s ASN 248 CO -0.01 -0.15 -0.12 -0.76 -1.51 0.00 0.00 177.10 174.55 1jmx s LEU 249 N 1.33 2.79 0.22 0.60 1.43 -0.16 -1.40 118.68 123.49 1jmx s LEU 249 Ca 0.28 -0.30 -0.19 0.00 -1.03 0.00 0.00 54.13 52.89 1jmx s LEU 249 Cb -0.16 -1.63 -0.08 0.00 0.03 0.00 0.00 46.19 44.35 1jmx s LEU 249 CO 0.11 0.17 0.71 -0.13 0.23 0.00 0.00 176.35 177.44 1jmx s ARG 250 N 0.33 4.23 -0.18 1.70 3.00 0.94 -0.37 118.95 128.60 1jmx s ARG 250 Ca -0.10 0.84 0.01 0.00 0.00 0.00 0.00 55.73 56.48 1jmx s ARG 250 Cb -0.16 -2.88 0.02 0.00 0.00 0.00 0.00 34.95 31.94 1jmx s ARG 250 CO 0.05 0.40 -0.19 -0.65 0.00 0.00 0.00 175.30 174.91 1jmx s GLN 251 N -1.99 2.88 -0.47 3.54 -0.21 0.74 -1.46 119.66 122.70 1jmx s GLN 251 Ca 0.43 -0.85 0.04 0.00 0.02 0.00 0.00 55.36 55.00 1jmx s GLN 251 Cb -0.16 -2.56 0.12 0.00 1.00 0.00 0.00 33.01 31.41 1jmx s GLN 251 CO 0.21 -0.24 0.20 0.08 -2.12 0.00 0.00 175.29 173.42 1jmx s VAL 252 N 1.29 2.50 0.34 1.09 1.01 -0.59 -1.11 120.40 124.93 1jmx s VAL 252 Ca 0.04 -3.03 0.10 0.00 0.00 0.00 0.00 61.98 59.09 1jmx s VAL 252 Cb -0.14 -2.77 -0.06 0.00 0.00 0.00 0.00 36.38 33.41 1jmx s VAL 252 CO -0.12 -0.74 -0.07 -0.36 0.00 0.00 0.00 175.10 173.81 1jmx s PHE 253 N 0.07 2.44 -0.24 5.22 0.08 -0.73 -1.99 117.98 122.82 1jmx s PHE 253 Ca 0.15 -0.46 -0.00 0.00 0.12 0.00 0.00 56.93 56.73 1jmx s PHE 253 Cb -0.24 -1.38 0.03 0.00 -0.57 0.00 0.00 43.02 40.87 1jmx s PHE 253 CO -0.02 0.57 -0.09 0.00 -0.10 0.00 0.00 175.22 175.57 1jmx s ALA 254 N -2.57 2.62 -0.52 5.36 0.00 0.74 -1.55 121.76 125.84 1jmx s ALA 254 Ca 0.33 -1.49 -0.17 0.00 0.00 0.00 0.00 51.96 50.63 1jmx s ALA 254 Cb 0.01 -1.60 0.09 0.00 0.00 0.00 0.00 23.12 21.62 1jmx s ALA 254 CO 0.17 -0.83 0.53 0.00 0.00 0.00 0.00 175.76 175.63 1jmx s ALA 255 N 1.28 3.53 -0.02 0.00 0.00 0.33 -1.65 121.76 125.23 1jmx s ALA 255 Ca -0.01 -2.19 0.01 0.00 0.00 0.00 0.00 51.96 49.76 1jmx s ALA 255 Cb -0.17 -3.27 0.01 0.00 0.00 0.00 0.00 23.12 19.70 1jmx s ALA 255 CO -0.06 -1.98 -0.01 -0.51 0.00 0.00 0.00 175.76 173.20 1jmx s LEU 256 N 2.00 1.52 -1.41 0.00 1.43 -0.09 -4.48 118.68 117.65 1jmx s LEU 256 Ca 0.07 -0.03 -0.09 0.00 -1.03 0.00 0.00 54.13 53.04 1jmx s LEU 256 Cb -0.25 -0.18 0.04 0.00 0.03 0.00 0.00 46.19 45.83 1jmx s LEU 256 CO 0.06 -0.04 1.04 -0.67 0.23 0.00 0.00 176.35 176.97 1jmx n ASP 257 N 3.66 -4.83 -2.66 2.29 2.03 -1.26 -1.81 116.55 113.97 1jmx n ASP 257 Ca -0.21 -0.68 -0.21 0.00 0.52 0.00 0.00 54.79 54.22 1jmx n ASP 257 Cb 0.54 -4.46 0.02 0.00 -0.72 0.00 0.00 41.12 36.49 1jmx n ASP 257 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1jmx n GLY 258 N -1.76 -0.47 2.90 0.27 0.00 -1.26 -4.98 105.19 99.90 1jmx n GLY 258 Ca -0.03 0.04 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1jmx n GLY 258 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jmx s GLU 259 N -5.40 0.06 -0.17 1.61 2.12 -0.75 -1.53 118.70 114.64 1jmx s GLU 259 Ca 0.18 0.18 -0.00 0.00 0.36 0.00 0.00 54.97 55.68 1jmx s GLU 259 Cb -0.08 -0.07 0.00 0.00 0.26 0.00 0.00 34.13 34.25 1jmx s GLU 259 CO 0.22 -0.08 -0.15 -1.64 -0.54 0.00 0.00 175.26 173.07 1jmx s MET 260 N 0.50 3.17 -0.04 4.30 -1.94 -0.80 -0.92 119.30 123.58 1jmx s MET 260 Ca -0.04 -0.76 0.04 0.00 -1.71 0.00 0.00 55.69 53.22 1jmx s MET 260 Cb -0.05 -2.66 -0.00 0.00 2.01 0.00 0.00 34.83 34.13 1jmx s MET 260 CO -0.02 -0.07 -0.15 0.15 -0.01 0.00 0.00 175.02 174.92 1jmx s LYS 261 N 1.03 1.59 0.00 2.03 1.02 -0.66 -0.79 119.74 123.96 1jmx s LYS 261 Ca -0.01 -0.54 0.00 0.00 0.02 0.00 0.00 55.97 55.44 1jmx s LYS 261 Cb -0.15 -1.40 0.00 0.00 -0.52 0.00 0.00 37.83 35.76 1jmx s LYS 261 CO -0.04 0.21 0.00 0.41 -0.92 0.00 0.00 175.35 175.02 1jmx n GLY 262 N 3.18 -0.74 3.01 -3.33 0.00 -0.25 -0.19 105.19 106.86 1jmx n GLY 262 Ca -0.18 -0.33 -0.11 0.00 0.00 0.00 0.00 46.02 45.39 1jmx n GLY 262 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1jmx s ARG 263 N -0.88 0.24 -0.17 1.61 3.52 -0.84 -1.11 118.95 121.32 1jmx s ARG 263 Ca 0.00 -0.11 0.01 0.00 -0.13 0.00 0.00 55.73 55.50 1jmx s ARG 263 Cb 0.00 0.10 0.02 0.00 -1.56 0.00 0.00 34.95 33.51 1jmx s ARG 263 CO 0.00 -0.04 -0.19 1.41 -0.81 0.00 0.00 175.30 175.66 1jmx s MET 264 N -0.53 2.87 0.15 5.12 1.75 -0.79 -1.54 119.30 126.33 1jmx s MET 264 Ca -0.06 -0.79 0.01 0.00 -1.25 0.00 0.00 55.69 53.60 1jmx s MET 264 Cb -0.04 -2.45 -0.04 0.00 2.84 0.00 0.00 34.83 35.13 1jmx s MET 264 CO 0.00 -0.17 0.03 -0.59 -0.65 0.00 0.00 175.02 173.64 1jmx s PHE 265 N 1.22 1.06 0.02 4.11 -0.12 -0.54 -0.51 117.98 123.23 1jmx s PHE 265 Ca 0.02 -1.11 -0.30 0.00 -0.05 0.00 0.00 56.93 55.49 1jmx s PHE 265 Cb -0.13 -0.60 -0.07 0.00 -0.63 0.00 0.00 43.02 41.59 1jmx s PHE 265 CO -0.10 -0.35 1.55 -1.21 -0.05 0.00 0.00 175.22 175.06 1jmx s GLU 266 N -3.97 4.23 0.54 1.99 2.02 -0.34 -0.04 118.70 123.13 1jmx s GLU 266 Ca 0.24 2.16 0.35 0.00 0.02 0.00 0.00 54.97 57.74 1jmx s GLU 266 Cb 0.07 -3.64 1.53 0.00 0.10 0.00 0.00 34.13 32.19 1jmx s GLU 266 CO 0.03 -0.68 1.82 0.00 0.02 0.00 0.00 175.26 176.44 1jmx h ALA 267 N 8.28 3.05 0.00 5.21 0.00 -1.57 -0.14 119.26 134.10 1jmx h ALA 267 Ca -0.40 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.36 1jmx h ALA 267 Cb 1.19 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1jmx h ALA 267 CO 0.92 -1.38 -1.75 0.39 0.00 0.00 0.00 179.25 177.43 1jmx n GLU 268 N -4.18 0.65 -3.63 0.00 4.71 -1.26 -4.80 120.64 112.13 1jmx n GLU 268 Ca 0.24 -0.00 -0.29 0.00 -0.01 0.00 0.00 57.16 57.10 1jmx n GLU 268 Cb 1.18 -1.65 -0.16 0.00 -1.01 0.00 0.00 31.44 29.81 1jmx n GLU 268 CO 0.00 0.00 0.00 -1.01 0.09 0.00 0.00 177.13 176.21 1jmx s HIS 269 N -3.15 0.76 -1.75 -0.32 3.76 -0.06 -4.94 115.29 109.59 1jmx s HIS 269 Ca -0.06 -1.01 0.30 0.00 -0.15 0.00 0.00 55.06 54.14 1jmx s HIS 269 Cb 0.10 -1.09 1.65 0.00 1.11 0.00 0.00 32.58 34.35 1jmx s HIS 269 CO 0.85 -0.76 2.08 -0.40 -0.85 0.00 0.00 174.74 175.65 1jmx n ASP 270 N 5.12 0.00 0.08 1.40 5.75 -1.23 -2.51 116.55 125.16 1jmx n ASP 270 Ca -0.06 -0.58 0.12 0.00 -0.01 0.00 0.00 54.79 54.26 1jmx n ASP 270 Cb 0.44 -0.13 0.18 0.00 -1.03 0.00 0.00 41.12 40.59 1jmx n ASP 270 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1jmx h GLU 271 N 0.00 0.00 -3.86 0.11 3.07 -1.90 -3.41 114.58 108.59 1jmx h GLU 271 Ca 0.00 0.00 -0.78 0.00 -0.50 0.00 0.00 59.36 58.08 1jmx h GLU 271 Cb 0.12 0.00 -0.26 0.00 -0.84 0.00 0.00 28.75 27.77 1jmx h GLU 271 CO 0.00 0.00 0.05 1.03 -1.40 0.00 0.00 179.01 178.69 1jmx s ARG 272 N -3.18 3.51 0.20 2.33 0.52 -1.04 -4.92 118.95 116.36 1jmx s ARG 272 Ca 0.06 -2.38 -0.04 0.00 -0.52 0.00 0.00 55.73 52.85 1jmx s ARG 272 Cb 0.12 -4.40 0.02 0.00 0.52 0.00 0.00 34.95 31.21 1jmx s ARG 272 CO 0.71 -1.29 0.34 0.41 0.02 0.00 0.00 175.30 175.49 1jmx n GLY 273 N 4.11 2.08 2.94 -3.53 0.00 -1.26 -1.20 105.19 108.33 1jmx n GLY 273 Ca 0.10 -1.35 -0.10 0.00 0.00 0.00 0.00 46.02 44.66 1jmx n GLY 273 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1jmx s LEU 274 N 0.00 2.09 0.45 0.99 2.34 0.34 -4.00 118.68 120.88 1jmx s LEU 274 Ca 0.13 -0.26 -0.23 0.00 0.06 0.00 0.00 54.13 53.83 1jmx s LEU 274 Cb -0.01 0.10 -0.08 0.00 -0.56 0.00 0.00 46.19 45.63 1jmx s LEU 274 CO 0.09 -0.17 1.16 -1.81 -1.06 0.00 0.00 176.35 174.56 1jmx s ASP 275 N -0.81 6.25 -0.03 1.48 1.01 -0.16 -1.88 116.67 122.55 1jmx s ASP 275 Ca -0.09 2.30 -0.01 0.00 0.71 0.00 0.00 52.55 55.46 1jmx s ASP 275 Cb -0.06 -2.60 0.03 0.00 1.01 0.00 0.00 42.92 41.30 1jmx s ASP 275 CO -0.00 -0.86 0.04 0.12 0.21 0.00 0.00 175.17 174.67 1jmx s PHE 276 N -1.53 0.08 -0.01 4.23 5.36 -0.27 -2.40 117.98 123.43 1jmx s PHE 276 Ca 0.62 0.15 0.02 0.00 -0.96 0.00 0.00 56.93 56.77 1jmx s PHE 276 Cb -0.29 -0.35 0.00 0.00 -0.34 0.00 0.00 43.02 42.05 1jmx s PHE 276 CO 0.35 -0.13 -0.06 -0.08 -1.46 0.00 0.00 175.22 173.84 1jmx s THR 277 N 1.45 0.53 0.11 0.12 -1.32 -0.62 -1.09 115.64 114.81 1jmx s THR 277 Ca -0.04 -0.25 -0.04 0.00 -1.21 0.00 0.00 61.69 60.15 1jmx s THR 277 Cb -0.13 -0.47 -0.03 0.00 -1.51 0.00 0.00 72.50 70.37 1jmx s THR 277 CO -0.03 0.17 0.10 0.00 -2.21 0.00 0.00 174.62 172.64 1jmx s ALA 278 N 0.08 0.40 -0.01 11.08 0.00 0.03 -1.22 121.76 132.12 1jmx s ALA 278 Ca -0.01 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 50.82 1jmx s ALA 278 Cb -0.05 0.62 0.02 0.00 0.00 0.00 0.00 23.12 23.71 1jmx s ALA 278 CO -0.00 -0.49 0.01 0.08 0.00 0.00 0.00 175.76 175.36 1jmx s VAL 279 N -3.96 0.01 0.33 0.00 1.01 -0.16 -1.90 120.40 115.73 1jmx s VAL 279 Ca 0.14 0.12 -0.27 0.00 0.00 0.00 0.00 61.98 61.97 1jmx s VAL 279 Cb 0.06 -0.09 -0.09 0.00 0.00 0.00 0.00 36.38 36.26 1jmx s VAL 279 CO -0.04 0.07 1.01 -0.75 0.00 0.00 0.00 175.10 175.39 1jmx s LYS 280 N 0.69 4.51 0.66 2.72 2.20 -0.58 -1.46 119.74 128.47 1jmx s LYS 280 Ca -0.06 1.51 -0.18 0.00 -0.36 0.00 0.00 55.97 56.89 1jmx s LYS 280 Cb -0.09 -2.87 -0.01 0.00 -1.51 0.00 0.00 37.83 33.35 1jmx s LYS 280 CO -0.02 0.17 1.20 -0.85 -0.36 0.00 0.00 175.35 175.50 1jmx n GLU 281 N 0.63 0.96 0.00 4.03 0.28 -0.51 -3.69 120.64 122.35 1jmx n GLU 281 Ca 0.02 0.38 0.00 0.00 -0.16 0.00 0.00 57.16 57.40 1jmx n GLU 281 Cb 0.48 -2.44 0.00 0.00 1.43 0.00 0.00 31.44 30.91 1jmx n GLU 281 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1jmx n GLY 282 N 0.98 2.29 3.04 -1.84 0.00 -1.26 -4.95 105.19 103.45 1jmx n GLY 282 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 1jmx n GLY 282 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jmx s LYS 283 N -0.22 1.69 -0.29 1.61 1.02 -1.24 -5.11 119.74 117.20 1jmx s LYS 283 Ca 0.00 -0.44 -0.29 0.00 0.02 0.00 0.00 55.97 55.26 1jmx s LYS 283 Cb 0.00 -1.41 0.00 0.00 -0.52 0.00 0.00 37.83 35.90 1jmx s LYS 283 CO 0.00 0.06 1.30 0.00 -0.92 0.00 0.00 175.35 175.79 1jmx s ALA 284 N 0.54 3.38 0.09 5.17 0.00 -1.26 -4.52 121.76 125.16 1jmx s ALA 284 Ca -0.13 0.12 0.03 0.00 0.00 0.00 0.00 51.96 51.98 1jmx s ALA 284 Cb -0.15 -3.76 -0.04 0.00 0.00 0.00 0.00 23.12 19.17 1jmx s ALA 284 CO 0.03 -1.73 -0.08 1.03 0.00 0.00 0.00 175.76 175.01 1jmx s ARG 285 N 4.12 0.79 -0.36 0.00 1.81 0.58 -4.98 118.95 120.91 1jmx s ARG 285 Ca 0.56 -1.15 0.03 0.00 -1.72 0.00 0.00 55.73 53.45 1jmx s ARG 285 Cb -0.17 -0.37 0.11 0.00 -0.45 0.00 0.00 34.95 34.06 1jmx s ARG 285 CO 0.22 0.04 0.10 -1.17 -0.68 0.00 0.00 175.30 173.81 1jmx s LEU 286 N -2.50 4.05 0.03 2.53 2.96 -1.26 -0.86 118.68 123.62 1jmx s LEU 286 Ca 0.05 -2.19 -0.29 0.00 -0.22 0.00 0.00 54.13 51.47 1jmx s LEU 286 Cb -0.01 -1.43 -0.16 0.00 0.50 0.00 0.00 46.19 45.08 1jmx s LEU 286 CO -0.02 -0.36 1.23 -0.07 -1.32 0.00 0.00 176.35 175.82 1jmx h LEU 287 N 7.51 -0.88 -7.72 -0.68 3.38 -1.50 -3.41 115.31 112.02 1jmx h LEU 287 Ca -0.06 0.02 0.04 0.00 0.09 0.00 0.00 57.88 57.97 1jmx h LEU 287 Cb 1.00 0.23 -0.07 0.00 0.09 0.00 0.00 40.66 41.90 1jmx h LEU 287 CO 0.53 -0.51 0.20 0.00 0.09 0.00 0.00 178.44 178.75 1jmx s ALA 288 N -5.24 -1.28 -0.11 1.53 0.00 -1.03 -4.91 121.76 110.72 1jmx s ALA 288 Ca -0.16 -0.11 0.01 0.00 0.00 0.00 0.00 51.96 51.71 1jmx s ALA 288 Cb 0.02 0.87 -0.02 0.00 0.00 0.00 0.00 23.12 23.99 1jmx s ALA 288 CO 0.47 -0.95 -0.15 0.08 0.00 0.00 0.00 175.76 175.22 1jmx s VAL 289 N -3.87 2.93 -0.22 0.00 1.01 -1.26 -1.07 120.40 117.91 1jmx s VAL 289 Ca 0.09 -0.72 -0.02 0.00 0.00 0.00 0.00 61.98 61.32 1jmx s VAL 289 Cb -0.04 -2.20 0.07 0.00 0.00 0.00 0.00 36.38 34.21 1jmx s VAL 289 CO 0.01 0.54 0.05 -1.10 0.00 0.00 0.00 175.10 174.60 1jmx s GLN 290 N 0.15 0.69 0.92 2.72 -0.21 0.13 -3.33 119.66 120.74 1jmx s GLN 290 Ca -0.08 -0.58 -0.12 0.00 0.02 0.00 0.00 55.36 54.60 1jmx s GLN 290 Cb -0.15 -2.07 0.14 0.00 1.00 0.00 0.00 33.01 31.93 1jmx s GLN 290 CO 0.05 -0.72 1.11 -2.14 -2.12 0.00 0.00 175.29 171.47 1jmx s PRO 291 N 1.80 1.07 -0.28 2.91 0.02 -1.26 -1.37 135.00 137.89 1jmx s PRO 291 Ca 0.01 0.49 0.12 0.00 0.02 0.00 0.00 61.00 61.64 1jmx s PRO 291 Cb -0.17 -1.81 0.73 0.00 0.02 0.00 0.00 34.50 33.27 1jmx s PRO 291 CO -0.13 -2.28 1.73 0.00 -0.33 0.00 0.00 177.00 175.99 1jmx n ALA 292 N -3.86 4.14 -3.14 -1.55 0.00 -1.21 -4.83 120.51 110.06 1jmx n ALA 292 Ca 0.06 -2.25 -0.12 0.00 0.00 0.00 0.00 53.44 51.13 1jmx n ALA 292 Cb 0.58 -1.11 -0.09 0.00 0.00 0.00 0.00 19.45 18.82 1jmx n ALA 292 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1jmx s PHE 293 N -2.92 -0.08 -0.09 0.00 -0.12 -1.26 -1.40 117.98 112.12 1jmx s PHE 293 Ca 0.53 0.06 -0.03 0.00 -0.05 0.00 0.00 56.93 57.43 1jmx s PHE 293 Cb 0.42 0.04 0.05 0.00 -0.63 0.00 0.00 43.02 42.89 1jmx s PHE 293 CO 0.13 -0.37 0.17 -1.50 -0.05 0.00 0.00 175.22 173.60 1jmx s ILE 294 N -1.57 -0.23 0.29 -4.49 1.10 0.43 -4.91 121.20 111.81 1jmx s ILE 294 Ca -0.12 0.31 -0.29 0.00 -0.51 0.00 0.00 60.65 60.03 1jmx s ILE 294 Cb -0.05 -0.30 -0.09 0.00 0.15 0.00 0.00 42.46 42.16 1jmx s ILE 294 CO 0.02 0.13 1.09 -0.75 -2.11 0.00 0.00 174.94 173.32 1jmx s LYS 295 N 2.06 4.61 0.22 3.50 2.20 -1.26 -2.03 119.74 129.04 1jmx s LYS 295 Ca 0.00 1.77 -0.31 0.00 -0.36 0.00 0.00 55.97 57.07 1jmx s LYS 295 Cb -0.12 -3.14 -0.11 0.00 -1.51 0.00 0.00 37.83 32.95 1jmx s LYS 295 CO -0.06 0.19 1.59 0.00 -0.36 0.00 0.00 175.35 176.71 1jmx s ALA 296 N -1.20 3.79 -0.41 3.13 0.00 0.11 -2.03 121.76 125.14 1jmx s ALA 296 Ca 0.45 1.46 -0.01 0.00 0.00 0.00 0.00 51.96 53.87 1jmx s ALA 296 Cb -0.31 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.17 1jmx s ALA 296 CO 0.40 -0.85 0.10 0.41 0.00 0.00 0.00 175.76 175.82 1jmx n GLY 297 N 3.23 0.30 3.44 0.00 0.00 -0.24 -4.70 105.19 107.23 1jmx n GLY 297 Ca 0.12 -0.59 -0.21 0.00 0.00 0.00 0.00 46.02 45.34 1jmx n GLY 297 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jmx s GLY 298 N -2.87 1.98 -0.11 -0.02 0.00 -0.86 -4.82 107.32 100.62 1jmx s GLY 298 Ca 0.05 -2.00 0.03 0.00 0.00 0.00 0.00 44.72 42.80 1jmx s GLY 298 CO 0.06 -1.83 -0.22 -0.54 0.00 0.00 0.00 173.10 170.58 1jmx s GLU 299 N -3.82 2.85 -0.11 2.90 0.41 -1.26 -1.07 118.70 118.60 1jmx s GLU 299 Ca 0.33 -0.80 -0.15 0.00 -0.41 0.00 0.00 54.97 53.94 1jmx s GLU 299 Cb 0.07 -2.22 0.04 0.00 -1.78 0.00 0.00 34.13 30.23 1jmx s GLU 299 CO 0.14 0.09 0.39 0.45 -0.49 0.00 0.00 175.26 175.84 1jmx s SER 300 N 0.55 -0.36 -0.44 -0.19 0.15 -0.18 -4.99 113.70 108.24 1jmx s SER 300 Ca -0.14 0.60 -0.25 0.00 0.70 0.00 0.00 55.95 56.86 1jmx s SER 300 Cb -0.17 0.66 0.02 0.00 -1.71 0.00 0.00 66.02 64.83 1jmx s SER 300 CO 0.05 -0.24 0.91 -0.70 1.20 0.00 0.00 173.24 174.45 1jmx s GLU 301 N -0.28 3.58 -0.07 5.44 -6.30 -1.26 -0.48 118.70 119.33 1jmx s GLU 301 Ca -0.04 0.21 0.02 0.00 -2.50 0.00 0.00 54.97 52.66 1jmx s GLU 301 Cb -0.03 -3.90 -0.03 0.00 0.00 0.00 0.00 34.13 30.17 1jmx s GLU 301 CO 0.02 -1.15 -0.10 0.42 0.02 0.00 0.00 175.26 174.46 1jmx s ILE 302 N 3.64 3.40 -0.06 -3.70 1.01 0.14 -4.45 121.20 121.19 1jmx s ILE 302 Ca 0.36 -0.59 0.04 0.00 0.00 0.00 0.00 60.65 60.47 1jmx s ILE 302 Cb -0.11 -2.38 0.00 0.00 0.01 0.00 0.00 42.46 39.99 1jmx s ILE 302 CO 0.24 0.58 -0.18 0.28 0.00 0.00 0.00 174.94 175.87 1jmx s THR 303 N -0.61 1.55 -0.15 2.92 -1.32 -0.47 -0.56 115.64 116.99 1jmx s THR 303 Ca 0.09 -0.76 -0.10 0.00 -1.21 0.00 0.00 61.69 59.71 1jmx s THR 303 Cb -0.11 -1.35 -0.05 0.00 -1.51 0.00 0.00 72.50 69.48 1jmx s THR 303 CO 0.01 0.45 0.17 -0.76 -2.21 0.00 0.00 174.62 172.28 1jmx s LEU 304 N 0.21 4.29 -0.03 9.08 2.01 0.10 -0.69 118.68 133.65 1jmx s LEU 304 Ca -0.09 0.40 0.04 0.00 0.01 0.00 0.00 54.13 54.48 1jmx s LEU 304 Cb -0.14 -2.15 -0.03 0.00 0.01 0.00 0.00 46.19 43.88 1jmx s LEU 304 CO 0.04 0.26 -0.12 -0.69 1.01 0.00 0.00 176.35 176.84 1jmx s VAL 305 N -0.20 3.22 -1.76 -1.59 1.01 -0.23 -1.25 120.40 119.59 1jmx s VAL 305 Ca 0.13 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.34 1jmx s VAL 305 Cb -0.12 -2.31 0.00 0.00 0.00 0.00 0.00 36.38 33.95 1jmx s VAL 305 CO 0.02 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.25 1jmx n GLY 306 N 2.04 -1.28 3.07 4.51 0.00 -0.99 -1.17 105.19 111.37 1jmx n GLY 306 Ca -0.17 -0.95 -0.25 0.00 0.00 0.00 0.00 46.02 44.65 1jmx n GLY 306 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1jmx s SER 307 N -4.00 1.96 -0.81 1.61 0.15 -0.04 -4.10 113.70 108.47 1jmx s SER 307 Ca 0.00 -0.33 -0.04 0.00 0.70 0.00 0.00 55.95 56.28 1jmx s SER 307 Cb 0.00 -0.81 0.00 0.00 -1.71 0.00 0.00 66.02 63.50 1jmx s SER 307 CO 0.00 0.07 0.70 0.61 1.20 0.00 0.00 173.24 175.82 1jmx n GLY 308 N 3.62 0.00 3.63 9.45 0.00 -1.07 -0.31 105.19 120.52 1jmx n GLY 308 Ca -0.21 -0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.27 1jmx n GLY 308 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jmx s LEU 309 N -4.83 3.90 -0.10 0.99 1.43 0.16 -4.76 118.68 115.47 1jmx s LEU 309 Ca 0.25 0.99 -0.06 0.00 -1.03 0.00 0.00 54.13 54.28 1jmx s LEU 309 Cb -0.11 -3.54 0.04 0.00 0.03 0.00 0.00 46.19 42.60 1jmx s LEU 309 CO 0.45 -0.93 0.23 0.00 0.23 0.00 0.00 176.35 176.34 1jmx s ALA 310 N 3.76 -0.55 0.00 4.21 0.00 -1.26 -4.33 121.76 123.58 1jmx s ALA 310 Ca 0.46 0.85 0.00 0.00 0.00 0.00 0.00 51.96 53.27 1jmx s ALA 310 Cb -0.12 -0.53 0.00 0.00 0.00 0.00 0.00 23.12 22.48 1jmx s ALA 310 CO 0.17 -0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.18 1jmx n GLY 311 N 3.74 0.53 3.66 0.00 0.00 -1.26 -3.86 105.19 108.00 1jmx n GLY 311 Ca -0.21 -2.16 -0.35 0.00 0.00 0.00 0.00 46.02 43.31 1jmx n GLY 311 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1jmx s LYS 312 N -0.78 3.86 0.00 1.61 2.20 -1.26 -4.52 119.74 120.86 1jmx s LYS 312 Ca 0.00 -0.33 -0.30 0.00 -0.36 0.00 0.00 55.97 54.98 1jmx s LYS 312 Cb 0.00 -3.18 -0.05 0.00 -1.51 0.00 0.00 37.83 33.09 1jmx s LYS 312 CO 0.00 0.35 1.31 -2.14 -0.36 0.00 0.00 175.35 174.51 1jmx s PRO 313 N 0.16 4.33 -0.17 4.03 0.02 -1.26 -1.47 135.00 140.64 1jmx s PRO 313 Ca 0.05 1.86 0.01 0.00 0.02 0.00 0.00 61.00 62.93 1jmx s PRO 313 Cb -0.12 -3.51 0.02 0.00 0.02 0.00 0.00 34.50 30.91 1jmx s PRO 313 CO 0.00 -0.47 -0.19 0.34 -0.33 0.00 0.00 177.00 176.35 1jmx s ASP 314 N 1.57 3.00 -0.08 2.53 3.68 0.40 -4.93 116.67 122.84 1jmx s ASP 314 Ca 0.61 -0.60 0.19 0.00 2.13 0.00 0.00 52.55 54.87 1jmx s ASP 314 Cb -0.30 -1.39 0.68 0.00 -1.45 0.00 0.00 42.92 40.46 1jmx s ASP 314 CO 0.26 -0.01 1.58 0.18 0.13 0.00 0.00 175.17 177.31 1jmx n LEU 315 N 4.60 4.41 0.00 -1.34 4.77 -1.26 -1.22 117.00 126.95 1jmx n LEU 315 Ca -0.20 -2.22 0.00 0.00 -0.03 0.00 0.00 56.01 53.56 1jmx n LEU 315 Cb 0.50 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 1jmx n LEU 315 CO 0.25 0.83 0.00 0.61 -1.33 0.00 0.00 177.39 177.75 1jmx n GLY 316 N 1.27 0.00 3.68 -0.72 0.00 -1.26 -4.75 105.19 103.40 1jmx n GLY 316 Ca 0.25 -1.82 -0.47 0.00 0.00 0.00 0.00 46.02 43.98 1jmx n GLY 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jmx n ALA 317 N 0.24 1.13 -0.24 4.61 0.00 -1.26 -2.28 120.51 122.72 1jmx n ALA 317 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1jmx n ALA 317 Cb 0.00 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 16.97 1jmx n ALA 317 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jmx n GLY 318 N 4.14 1.05 3.41 0.00 0.00 -1.26 -4.72 105.19 107.81 1jmx n GLY 318 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 1jmx n GLY 318 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jmx s VAL 319 N -2.70 3.52 -0.16 1.61 1.01 -0.97 -1.54 120.40 121.17 1jmx s VAL 319 Ca 0.00 -0.48 -0.02 0.00 0.00 0.00 0.00 61.98 61.47 1jmx s VAL 319 Cb 0.00 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 1jmx s VAL 319 CO 0.00 0.48 -0.07 -0.70 0.00 0.00 0.00 175.10 174.81 1jmx s GLU 320 N 0.63 3.50 -0.63 2.72 2.12 0.15 -4.66 118.70 122.53 1jmx s GLU 320 Ca -0.04 -0.60 -0.23 0.00 0.36 0.00 0.00 54.97 54.46 1jmx s GLU 320 Cb -0.15 -2.84 0.06 0.00 0.26 0.00 0.00 34.13 31.47 1jmx s GLU 320 CO 0.03 0.13 0.95 0.08 -0.54 0.00 0.00 175.26 175.91 1jmx s VAL 321 N 0.62 4.34 -0.21 3.70 1.01 -1.26 -0.24 120.40 128.37 1jmx s VAL 321 Ca -0.04 -0.20 0.18 0.00 0.00 0.00 0.00 61.98 61.92 1jmx s VAL 321 Cb -0.15 -4.64 0.05 0.00 0.00 0.00 0.00 36.38 31.64 1jmx s VAL 321 CO 0.03 -1.36 1.23 0.71 0.00 0.00 0.00 175.10 175.70 1jmx h THR 322 N 5.98 0.44 -0.66 3.92 1.35 -1.09 -3.46 112.91 119.39 1jmx h THR 322 Ca -0.28 -1.71 0.16 0.00 -0.55 0.00 0.00 66.41 64.03 1jmx h THR 322 Cb 1.07 2.06 -0.21 0.00 -1.73 0.00 0.00 68.15 69.35 1jmx h THR 322 CO 1.15 0.25 -0.10 -0.70 -0.25 0.00 0.00 175.52 175.88 1jmx s GLU 323 N -3.07 0.37 -0.93 4.72 -6.30 -1.16 -4.95 118.70 107.38 1jmx s GLU 323 Ca 0.02 0.61 -0.24 0.00 -2.50 0.00 0.00 54.97 52.85 1jmx s GLU 323 Cb 0.08 0.33 0.02 0.00 0.00 0.00 0.00 34.13 34.55 1jmx s GLU 323 CO 0.76 -0.47 1.58 0.08 0.02 0.00 0.00 175.26 177.23 1jmx s VAL 324 N 2.90 3.74 0.61 3.70 1.01 -1.26 -0.46 120.40 130.64 1jmx s VAL 324 Ca 0.11 -0.45 0.44 0.00 0.00 0.00 0.00 61.98 62.08 1jmx s VAL 324 Cb -0.11 -4.71 0.44 0.00 0.00 0.00 0.00 36.38 32.00 1jmx s VAL 324 CO -0.18 -1.62 2.33 -0.07 0.00 0.00 0.00 175.10 175.57 1jmx h LEU 325 N 14.32 0.00 -7.00 3.92 3.38 -0.81 -3.44 115.31 125.68 1jmx h LEU 325 Ca 0.08 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.20 1jmx h LEU 325 Cb 1.02 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 41.49 1jmx h LEU 325 CO 1.34 0.00 0.73 -0.70 0.09 0.00 0.00 178.44 179.90 1jmx s GLU 326 N -4.10 0.27 -0.37 1.13 2.12 -0.64 -4.92 118.70 112.19 1jmx s GLU 326 Ca -0.05 0.21 0.03 0.00 0.36 0.00 0.00 54.97 55.52 1jmx s GLU 326 Cb 0.13 0.13 0.15 0.00 0.26 0.00 0.00 34.13 34.80 1jmx s GLU 326 CO 0.41 -0.05 0.36 -1.14 -0.54 0.00 0.00 175.26 174.29 1jmx s GLN 327 N -0.34 0.65 0.39 4.30 0.74 -1.26 -0.25 119.66 123.89 1jmx s GLN 327 Ca 0.05 -1.01 0.08 0.00 0.05 0.00 0.00 55.36 54.53 1jmx s GLN 327 Cb -0.03 -0.83 -0.03 0.00 1.10 0.00 0.00 33.01 33.22 1jmx s GLN 327 CO -0.09 -1.21 0.32 0.95 -0.55 0.00 0.00 175.29 174.71 1jmx s THR 328 N 1.28 2.83 0.61 -0.34 -4.23 -0.12 -5.01 115.64 110.67 1jmx s THR 328 Ca 0.18 -1.42 0.39 0.00 -1.18 0.00 0.00 61.69 59.66 1jmx s THR 328 Cb -0.16 -3.04 0.41 0.00 1.34 0.00 0.00 72.50 71.06 1jmx s THR 328 CO -0.02 -0.05 2.31 1.55 -0.54 0.00 0.00 174.62 177.86 1jmx h PRO 329 N 1.17 0.00 -0.00 3.99 0.13 -1.96 -3.06 132.00 132.27 1jmx h PRO 329 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1jmx h PRO 329 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1jmx h PRO 329 CO 0.60 0.01 -0.18 0.25 -0.23 0.00 0.00 178.00 178.44 1jmx n THR 330 N -3.35 0.00 -3.66 1.56 -2.24 -1.26 -0.66 114.28 104.66 1jmx n THR 330 Ca -0.03 -0.41 -0.08 0.00 -2.27 0.00 0.00 64.05 61.27 1jmx n THR 330 Cb 0.09 1.07 -0.09 0.00 -2.10 0.00 0.00 70.33 69.31 1jmx n THR 330 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1jmx s LEU 331 N -1.59 -0.63 -0.24 3.22 0.20 -1.16 -2.33 118.68 116.14 1jmx s LEU 331 Ca 0.06 1.13 0.02 0.00 0.69 0.00 0.00 54.13 56.02 1jmx s LEU 331 Cb 0.06 1.63 0.06 0.00 -0.43 0.00 0.00 46.19 47.50 1jmx s LEU 331 CO 0.20 -0.22 -0.10 -0.69 -0.29 0.00 0.00 176.35 175.25 1jmx s VAL 332 N 2.26 1.94 -0.17 1.68 1.01 -0.38 -0.94 120.40 125.80 1jmx s VAL 332 Ca -0.05 -1.41 -0.09 0.00 0.00 0.00 0.00 61.98 60.42 1jmx s VAL 332 Cb -0.10 -2.06 -0.05 0.00 0.00 0.00 0.00 36.38 34.17 1jmx s VAL 332 CO -0.15 0.01 0.14 -0.13 0.00 0.00 0.00 175.10 174.98 1jmx s ARG 333 N 1.22 3.93 0.12 2.72 0.52 0.65 0.02 118.95 128.12 1jmx s ARG 333 Ca -0.06 -0.17 -0.10 0.00 -0.52 0.00 0.00 55.73 54.87 1jmx s ARG 333 Cb -0.19 -3.34 0.00 0.00 0.52 0.00 0.00 34.95 31.95 1jmx s ARG 333 CO -0.06 0.47 0.27 -0.48 0.02 0.00 0.00 175.30 175.52 1jmx s LEU 334 N -0.14 1.06 -0.16 2.53 0.05 0.28 -0.06 118.68 122.24 1jmx s LEU 334 Ca 0.11 -0.65 -0.06 0.00 0.05 0.00 0.00 54.13 53.58 1jmx s LEU 334 Cb -0.11 1.27 -0.04 0.00 -2.05 0.00 0.00 46.19 45.25 1jmx s LEU 334 CO 0.00 -0.81 0.05 -0.75 -0.55 0.00 0.00 176.35 174.30 1jmx s LYS 335 N -3.88 3.72 0.21 1.48 2.47 0.39 -0.68 119.74 123.45 1jmx s LYS 335 Ca 0.08 -0.34 0.06 0.00 -1.56 0.00 0.00 55.97 54.21 1jmx s LYS 335 Cb 0.04 -3.12 -0.05 0.00 -1.46 0.00 0.00 37.83 33.24 1jmx s LYS 335 CO -0.08 0.41 -0.10 0.00 0.16 0.00 0.00 175.35 175.74 1jmx s ALA 336 N -0.02 1.91 -0.11 3.13 0.00 0.37 -0.45 121.76 126.59 1jmx s ALA 336 Ca 0.06 -1.68 -0.05 0.00 0.00 0.00 0.00 51.96 50.29 1jmx s ALA 336 Cb -0.12 0.07 0.05 0.00 0.00 0.00 0.00 23.12 23.12 1jmx s ALA 336 CO 0.01 -0.04 0.25 0.50 0.00 0.00 0.00 175.76 176.48 1jmx s ARG 337 N -3.71 0.20 -0.11 0.00 3.52 0.67 -1.01 118.95 118.50 1jmx s ARG 337 Ca 0.23 0.57 -0.05 0.00 -0.13 0.00 0.00 55.73 56.35 1jmx s ARG 337 Cb 0.02 -0.11 -0.04 0.00 -1.56 0.00 0.00 34.95 33.26 1jmx s ARG 337 CO 0.06 -0.19 0.10 0.00 -0.81 0.00 0.00 175.30 174.46 1jmx s ALA 338 N 1.49 3.68 0.53 6.12 0.00 -0.23 0.35 121.76 133.70 1jmx s ALA 338 Ca -0.07 -0.69 -0.20 0.00 0.00 0.00 0.00 51.96 51.00 1jmx s ALA 338 Cb -0.11 -1.82 -0.06 0.00 0.00 0.00 0.00 23.12 21.13 1jmx s ALA 338 CO -0.09 0.59 1.12 0.00 0.00 0.00 0.00 175.76 177.39 1jmx s ALA 339 N -0.92 2.72 -0.45 0.00 0.00 -0.59 -1.07 121.76 121.44 1jmx s ALA 339 Ca 0.14 0.81 0.21 0.00 0.00 0.00 0.00 51.96 53.11 1jmx s ALA 339 Cb -0.12 -3.35 0.96 0.00 0.00 0.00 0.00 23.12 20.61 1jmx s ALA 339 CO 0.03 -0.72 1.63 0.00 0.00 0.00 0.00 175.76 176.70 1jmx n ALA 340 N -1.24 1.40 0.76 0.00 0.00 -1.26 -1.28 120.51 118.88 1jmx n ALA 340 Ca 0.11 0.11 0.11 0.00 0.00 0.00 0.00 53.44 53.77 1jmx n ALA 340 Cb 0.51 -1.33 -0.00 0.00 0.00 0.00 0.00 19.45 18.63 1jmx n ALA 340 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1jmx n ASP 341 N -2.14 0.68 -4.68 0.00 2.03 -1.26 -4.65 116.55 106.54 1jmx n ASP 341 Ca 0.01 -0.48 -0.49 0.00 0.52 0.00 0.00 54.79 54.34 1jmx n ASP 341 Cb 0.14 0.86 -0.05 0.00 -0.72 0.00 0.00 41.12 41.35 1jmx n ASP 341 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1jmx n ALA 342 N -1.68 0.69 -1.86 -1.67 0.00 -0.41 -4.90 120.51 110.68 1jmx n ALA 342 Ca 0.03 0.36 -0.41 0.00 0.00 0.00 0.00 53.44 53.41 1jmx n ALA 342 Cb 0.39 -2.39 -0.02 0.00 0.00 0.00 0.00 19.45 17.43 1jmx n ALA 342 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1jmx s LYS 343 N 2.98 4.31 0.24 0.00 -0.14 -1.26 -4.89 119.74 120.98 1jmx s LYS 343 Ca 0.90 2.25 -0.30 0.00 -1.36 0.00 0.00 55.97 57.45 1jmx s LYS 343 Cb -0.77 -3.11 -0.10 0.00 -1.68 0.00 0.00 37.83 32.18 1jmx s LYS 343 CO 0.50 -0.32 1.38 -1.25 -0.76 0.00 0.00 175.35 174.90 1jmx s PRO 344 N -0.85 4.32 0.00 -1.68 0.04 -1.26 -4.84 135.00 130.73 1jmx s PRO 344 Ca 0.55 2.21 0.00 0.00 0.04 0.00 0.00 61.00 63.80 1jmx s PRO 344 Cb -0.40 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.00 1jmx s PRO 344 CO 0.46 -0.33 0.00 0.41 0.04 0.00 0.00 177.00 177.58 1jmx n GLY 345 N 2.08 1.55 3.80 0.56 0.00 0.49 -0.79 105.19 112.88 1jmx n GLY 345 Ca 0.06 -1.27 -0.35 0.00 0.00 0.00 0.00 46.02 44.46 1jmx n GLY 345 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1jmx s GLN 346 N -1.96 4.41 -0.08 1.61 -1.52 -1.26 -0.98 119.66 119.88 1jmx s GLN 346 Ca 0.00 1.21 0.05 0.00 -1.95 0.00 0.00 55.36 54.67 1jmx s GLN 346 Cb 0.00 -2.54 -0.00 0.00 -0.22 0.00 0.00 33.01 30.24 1jmx s GLN 346 CO 0.00 0.16 -0.24 1.03 -0.25 0.00 0.00 175.29 175.99 1jmx s ARG 347 N -2.53 2.78 -0.57 2.91 1.81 0.12 -4.89 118.95 118.59 1jmx s ARG 347 Ca 0.55 -0.86 -0.28 0.00 -1.72 0.00 0.00 55.73 53.41 1jmx s ARG 347 Cb -0.14 -2.19 0.03 0.00 -0.45 0.00 0.00 34.95 32.19 1jmx s ARG 347 CO 0.19 0.25 1.22 -2.00 -0.68 0.00 0.00 175.30 174.29 1jmx s GLU 348 N 0.16 3.50 0.49 3.54 -6.30 -1.26 -1.04 118.70 117.79 1jmx s GLU 348 Ca -0.13 0.31 -0.20 0.00 -2.50 0.00 0.00 54.97 52.45 1jmx s GLU 348 Cb -0.16 -4.02 -0.08 0.00 0.00 0.00 0.00 34.13 29.86 1jmx s GLU 348 CO 0.07 -1.70 1.04 0.08 0.02 0.00 0.00 175.26 174.77 1jmx s VAL 349 N 5.08 3.77 -0.03 3.70 1.01 -0.54 -4.40 120.40 128.99 1jmx s VAL 349 Ca 0.45 1.10 -0.19 0.00 0.00 0.00 0.00 61.98 63.33 1jmx s VAL 349 Cb -0.08 -3.44 0.04 0.00 0.00 0.00 0.00 36.38 32.89 1jmx s VAL 349 CO 0.26 -0.25 0.42 0.00 0.00 0.00 0.00 175.10 175.53 1jmx s ALA 350 N -1.99 -1.07 -0.41 5.51 0.00 -0.36 -3.96 121.76 119.48 1jmx s ALA 350 Ca 0.67 0.65 0.02 0.00 0.00 0.00 0.00 51.96 53.30 1jmx s ALA 350 Cb -0.16 0.01 0.12 0.00 0.00 0.00 0.00 23.12 23.09 1jmx s ALA 350 CO 0.20 -0.29 0.18 0.08 0.00 0.00 0.00 175.76 175.94 1jmx s VAL 351 N -1.20 1.52 0.00 0.00 1.01 -0.38 -0.45 120.40 120.90 1jmx s VAL 351 Ca -0.12 -2.35 0.00 0.00 0.00 0.00 0.00 61.98 59.51 1jmx s VAL 351 Cb -0.04 -2.09 0.00 0.00 0.00 0.00 0.00 36.38 34.25 1jmx s VAL 351 CO 0.06 -0.80 0.00 0.61 0.00 0.00 0.00 175.10 174.97 1jmx n GLY 352 N 3.88 1.20 0.00 4.51 0.00 -0.54 -2.73 105.19 111.51 1jmx n GLY 352 Ca 0.05 -0.60 0.11 0.00 0.00 0.00 0.00 46.02 45.58 1jmx n GLY 352 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jmx n THR 353 N 0.00 0.00 -2.16 2.61 -2.24 -1.26 -4.83 114.28 106.40 1jmx n THR 353 Ca 0.00 -0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 1jmx n THR 353 Cb 0.00 0.52 -0.02 0.00 -2.10 0.00 0.00 70.33 68.72 1jmx n THR 353 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1jmx s LEU 354 N -3.00 4.15 0.52 3.22 1.43 -1.10 -5.01 118.68 118.88 1jmx s LEU 354 Ca 0.10 1.88 0.01 0.00 -1.03 0.00 0.00 54.13 55.09 1jmx s LEU 354 Cb 0.17 -3.53 -0.01 0.00 0.03 0.00 0.00 46.19 42.85 1jmx s LEU 354 CO 0.76 -0.98 0.01 -0.54 0.23 0.00 0.00 176.35 175.83 1jmx s LYS 355 N 4.08 2.21 0.00 1.70 -0.14 -1.26 -1.25 119.74 125.08 1jmx s LYS 355 Ca 0.67 -2.42 0.00 0.00 -1.36 0.00 0.00 55.97 52.87 1jmx s LYS 355 Cb -0.27 -1.53 0.00 0.00 -1.68 0.00 0.00 37.83 34.34 1jmx s LYS 355 CO 0.25 -0.39 0.00 0.41 -0.76 0.00 0.00 175.35 174.87 1jmx n GLY 356 N -1.29 3.78 3.77 -3.33 0.00 -1.25 -4.60 105.19 102.27 1jmx n GLY 356 Ca -0.20 -0.56 -0.26 0.00 0.00 0.00 0.00 46.02 45.01 1jmx n GLY 356 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1jmx s VAL 357 N 0.00 4.31 0.16 1.61 -7.23 -1.26 -5.03 120.40 112.96 1jmx s VAL 357 Ca 0.00 -1.21 0.09 0.00 -1.81 0.00 0.00 61.98 59.05 1jmx s VAL 357 Cb 0.00 -3.21 -0.04 0.00 0.56 0.00 0.00 36.38 33.69 1jmx s VAL 357 CO 0.00 -0.15 -0.12 0.20 -0.31 0.00 0.00 175.10 174.72 1jmx s ASN 358 N -3.18 4.15 -0.16 4.85 0.01 -1.26 -1.47 114.94 117.88 1jmx s ASN 358 Ca 0.31 -0.57 0.01 0.00 -0.71 0.00 0.00 52.86 51.89 1jmx s ASN 358 Cb -0.10 -0.67 0.02 0.00 0.41 0.00 0.00 41.25 40.91 1jmx s ASN 358 CO 0.23 0.13 -0.16 -0.22 -1.51 0.00 0.00 177.10 175.56 1jmx s LEU 359 N -2.63 1.79 -0.27 0.60 2.96 -0.20 -4.85 118.68 116.08 1jmx s LEU 359 Ca 0.23 -0.53 -0.24 0.00 -0.22 0.00 0.00 54.13 53.37 1jmx s LEU 359 Cb -0.09 -1.25 -0.00 0.00 0.50 0.00 0.00 46.19 45.34 1jmx s LEU 359 CO 0.14 -0.04 0.81 0.00 -1.32 0.00 0.00 176.35 175.94 1jmx s ALA 360 N 1.43 3.60 -0.21 5.97 0.00 -0.49 0.15 121.76 132.20 1jmx s ALA 360 Ca 0.05 -0.26 -0.10 0.00 0.00 0.00 0.00 51.96 51.65 1jmx s ALA 360 Cb -0.13 -3.29 -0.05 0.00 0.00 0.00 0.00 23.12 19.65 1jmx s ALA 360 CO -0.11 -1.04 0.13 0.08 0.00 0.00 0.00 175.76 174.81 1jmx s VAL 361 N 2.90 5.23 0.10 0.00 1.01 -0.16 -0.43 120.40 129.05 1jmx s VAL 361 Ca 0.34 0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.47 1jmx s VAL 361 Cb -0.15 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 1jmx s VAL 361 CO 0.10 0.41 -0.07 -0.72 0.00 0.00 0.00 175.10 174.81 1jmx s TYR 362 N 0.66 0.89 -0.21 5.22 -0.85 -0.86 -0.38 117.35 121.82 1jmx s TYR 362 Ca 0.07 -0.89 -0.05 0.00 -0.52 0.00 0.00 57.07 55.68 1jmx s TYR 362 Cb -0.12 -0.51 -0.11 0.00 0.38 0.00 0.00 41.96 41.59 1jmx s TYR 362 CO 0.01 -0.14 -0.23 -0.40 -1.52 0.00 0.00 175.55 173.27 1jmx n ASP 363 N 0.03 1.96 -3.75 -0.18 5.75 -1.26 0.09 116.55 119.19 1jmx n ASP 363 Ca -0.13 0.08 -0.13 0.00 -0.01 0.00 0.00 54.79 54.60 1jmx n ASP 363 Cb 0.60 -0.48 -0.09 0.00 -1.03 0.00 0.00 41.12 40.12 1jmx n ASP 363 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1jmx s LYS 364 N -2.40 0.63 -0.13 0.11 -2.85 -1.26 -4.81 119.74 109.03 1jmx s LYS 364 Ca -0.29 -0.04 -0.21 0.00 -1.00 0.00 0.00 55.97 54.43 1jmx s LYS 364 Cb 0.09 0.28 -0.04 0.00 -2.06 0.00 0.00 37.83 36.11 1jmx s LYS 364 CO 0.42 -0.16 0.60 0.08 0.10 0.00 0.00 175.35 176.39 1jmx s VAL 365 N -1.01 5.09 -0.27 1.79 1.01 -1.26 -4.61 120.40 121.14 1jmx s VAL 365 Ca -0.11 1.18 -0.11 0.00 0.00 0.00 0.00 61.98 62.95 1jmx s VAL 365 Cb -0.05 -3.93 -0.12 0.00 0.00 0.00 0.00 36.38 32.28 1jmx s VAL 365 CO 0.04 0.24 -0.33 1.21 0.00 0.00 0.00 175.10 176.26 1jmx n GLU 366 N 4.12 0.58 -4.34 2.72 2.13 0.18 -4.97 120.64 121.07 1jmx n GLU 366 Ca -0.03 0.23 -0.19 0.00 0.66 0.00 0.00 57.16 57.82 1jmx n GLU 366 Cb 0.51 -1.46 -0.13 0.00 0.27 0.00 0.00 31.44 30.62 1jmx n GLU 366 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 1jmx s GLU 367 N -2.49 0.89 -0.05 5.31 2.56 -0.49 -5.01 118.70 119.42 1jmx s GLU 367 Ca -0.37 -0.71 0.04 0.00 0.00 0.00 0.00 54.97 53.92 1jmx s GLU 367 Cb 0.14 -0.88 0.00 0.00 2.00 0.00 0.00 34.13 35.39 1jmx s GLU 367 CO 0.49 0.22 -0.16 0.08 -0.56 0.00 0.00 175.26 175.33 1jmx s VAL 368 N -0.82 1.39 -0.09 3.70 1.01 -1.26 -0.44 120.40 123.89 1jmx s VAL 368 Ca 0.01 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 61.36 1jmx s VAL 368 Cb -0.08 -1.21 0.00 0.00 0.00 0.00 0.00 36.38 35.09 1jmx s VAL 368 CO 0.01 0.41 -0.22 -0.54 0.00 0.00 0.00 175.10 174.75 1jmx s LYS 369 N 0.22 2.78 -0.05 2.72 1.02 0.32 -4.41 119.74 122.35 1jmx s LYS 369 Ca -0.08 -0.80 -0.26 0.00 0.02 0.00 0.00 55.97 54.85 1jmx s LYS 369 Cb -0.13 -2.13 -0.03 0.00 -0.52 0.00 0.00 37.83 35.01 1jmx s LYS 369 CO 0.03 0.17 0.81 0.08 -0.92 0.00 0.00 175.35 175.52 1jmx s VAL 370 N 0.36 4.97 -0.15 3.17 1.01 -1.26 0.28 120.40 128.78 1jmx s VAL 370 Ca -0.17 1.69 0.02 0.00 0.00 0.00 0.00 61.98 63.52 1jmx s VAL 370 Cb -0.17 -4.15 0.01 0.00 0.00 0.00 0.00 36.38 32.07 1jmx s VAL 370 CO 0.08 0.20 -0.20 -0.69 0.00 0.00 0.00 175.10 174.49 1jmx s VAL 371 N 0.95 1.97 0.51 2.92 1.01 -0.13 -2.37 120.40 125.26 1jmx s VAL 371 Ca 0.43 -0.91 -0.19 0.00 0.00 0.00 0.00 61.98 61.31 1jmx s VAL 371 Cb -0.19 -1.77 -0.08 0.00 0.00 0.00 0.00 36.38 34.35 1jmx s VAL 371 CO 0.22 0.53 1.02 -2.16 0.00 0.00 0.00 175.10 174.71 1jmx s PRO 372 N 1.04 3.78 0.27 2.72 0.04 -1.26 -0.81 135.00 140.78 1jmx s PRO 372 Ca -0.02 1.22 -0.00 0.00 0.04 0.00 0.00 61.00 62.24 1jmx s PRO 372 Cb -0.14 -2.10 0.38 0.00 0.04 0.00 0.00 34.50 32.67 1jmx s PRO 372 CO -0.06 -0.43 1.75 0.00 0.04 0.00 0.00 177.00 178.29 1jmx h ALA 373 N 1.24 1.12 -3.75 8.56 0.00 -1.83 -3.43 119.26 121.17 1jmx h ALA 373 Ca -0.48 -0.29 -0.34 0.00 0.00 0.00 0.00 54.91 53.80 1jmx h ALA 373 Cb 1.21 -0.16 -0.30 0.00 0.00 0.00 0.00 17.79 18.53 1jmx h ALA 373 CO 0.59 0.55 -0.76 0.12 0.00 0.00 0.00 179.25 179.76 1jmx s PHE 374 N -4.81 0.50 0.21 0.00 5.36 -1.26 -0.78 117.98 117.20 1jmx s PHE 374 Ca -0.08 -0.10 -0.17 0.00 -0.96 0.00 0.00 56.93 55.62 1jmx s PHE 374 Cb 0.14 -0.39 0.02 0.00 -0.34 0.00 0.00 43.02 42.45 1jmx s PHE 374 CO 0.80 -0.06 0.52 -1.54 -1.46 0.00 0.00 175.22 173.48 1jmx s SER 375 N 0.28 -0.22 -0.17 6.13 1.04 -1.01 -4.99 113.70 114.76 1jmx s SER 375 Ca -0.03 -0.57 0.01 0.00 0.48 0.00 0.00 55.95 55.84 1jmx s SER 375 Cb -0.07 0.59 0.02 0.00 0.10 0.00 0.00 66.02 66.66 1jmx s SER 375 CO -0.00 -1.09 -0.20 -0.63 0.98 0.00 0.00 173.24 172.30 1jmx s ILE 376 N -3.90 2.11 0.09 -1.02 -1.09 -1.26 -2.56 121.20 113.57 1jmx s ILE 376 Ca 0.12 -0.94 0.03 0.00 -2.23 0.00 0.00 60.65 57.63 1jmx s ILE 376 Cb -0.01 -1.87 -0.04 0.00 -1.58 0.00 0.00 42.46 38.96 1jmx s ILE 376 CO -0.00 0.54 0.09 0.00 -1.23 0.00 0.00 174.94 174.34 1jmx s ALA 377 N 1.13 3.59 -0.01 9.38 0.00 0.02 -4.85 121.76 131.02 1jmx s ALA 377 Ca 0.01 -1.03 0.02 0.00 0.00 0.00 0.00 51.96 50.97 1jmx s ALA 377 Cb -0.14 -1.44 -0.01 0.00 0.00 0.00 0.00 23.12 21.53 1jmx s ALA 377 CO -0.09 0.72 -0.08 1.03 0.00 0.00 0.00 175.76 177.35 1jmx s ARG 378 N -2.48 0.63 0.81 0.00 0.52 -0.40 -0.15 118.95 117.89 1jmx s ARG 378 Ca 0.30 -0.27 -0.11 0.00 -0.52 0.00 0.00 55.73 55.13 1jmx s ARG 378 Cb -0.12 -0.61 0.08 0.00 0.52 0.00 0.00 34.95 34.82 1jmx s ARG 378 CO 0.22 0.16 1.10 0.96 0.02 0.00 0.00 175.30 177.76 1jmx s ILE 379 N -0.17 3.07 0.01 1.52 -4.36 0.40 -1.15 121.20 120.52 1jmx s ILE 379 Ca 0.03 0.35 -0.04 0.00 -0.26 0.00 0.00 60.65 60.72 1jmx s ILE 379 Cb -0.03 -2.77 0.01 0.00 1.25 0.00 0.00 42.46 40.92 1jmx s ILE 379 CO -0.00 -0.45 0.19 0.61 0.24 0.00 0.00 174.94 175.53 1jmx n GLY 380 N -1.02 0.83 7.00 6.27 0.00 -1.22 -4.37 105.19 112.68 1jmx n GLY 380 Ca 0.09 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1jmx n GLY 380 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jmx n GLU 381 N -0.14 0.00 -1.85 1.61 1.02 0.84 -1.13 120.64 120.98 1jmx n GLU 381 Ca 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.01 1jmx n GLU 381 Cb 0.10 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.49 1jmx n GLU 381 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1jmx n ASN 382 N -3.15 -4.28 0.00 1.62 4.05 -1.26 -2.28 115.26 109.97 1jmx n ASN 382 Ca 0.00 0.14 0.00 0.00 0.45 0.00 0.00 54.58 55.17 1jmx n ASN 382 Cb 0.00 -3.22 0.00 0.00 1.23 0.00 0.00 39.78 37.79 1jmx n ASN 382 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1jmx n GLY 383 N -1.19 1.23 3.81 8.20 0.00 -1.26 -4.88 105.19 111.11 1jmx n GLY 383 Ca -0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 1jmx n GLY 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jmx s ALA 384 N -2.15 2.58 -1.89 4.61 0.00 -0.96 -4.95 121.76 118.99 1jmx s ALA 384 Ca 0.00 0.07 0.31 0.00 0.00 0.00 0.00 51.96 52.34 1jmx s ALA 384 Cb 0.00 -3.18 1.78 0.00 0.00 0.00 0.00 23.12 21.72 1jmx s ALA 384 CO 0.00 -1.35 2.14 0.45 0.00 0.00 0.00 175.76 177.00 1jmx n SER 385 N -3.21 0.00 -4.35 0.00 2.88 -1.26 -4.54 113.62 103.13 1jmx n SER 385 Ca 0.08 -0.81 -0.28 0.00 -1.33 0.00 0.00 58.87 56.53 1jmx n SER 385 Cb 0.54 -0.05 -0.13 0.00 -0.75 0.00 0.00 64.21 63.81 1jmx n SER 385 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1jmx s VAL 386 N -2.11 2.09 0.49 2.46 -7.23 -1.26 -5.05 120.40 109.79 1jmx s VAL 386 Ca 0.43 -1.65 -0.03 0.00 -1.81 0.00 0.00 61.98 58.91 1jmx s VAL 386 Cb 0.21 -1.85 -0.01 0.00 0.56 0.00 0.00 36.38 35.29 1jmx s VAL 386 CO 0.37 0.08 0.77 -2.16 -0.31 0.00 0.00 175.10 173.85 1jmx s PRO 387 N -1.92 3.21 0.36 4.82 0.04 -1.26 -0.11 135.00 140.14 1jmx s PRO 387 Ca 0.12 -0.10 -0.26 0.00 0.04 0.00 0.00 61.00 60.80 1jmx s PRO 387 Cb -0.10 -2.42 -0.09 0.00 0.04 0.00 0.00 34.50 31.93 1jmx s PRO 387 CO 0.05 -0.34 1.11 0.15 0.04 0.00 0.00 177.00 178.01 1jmx s LYS 388 N -4.73 4.27 -0.33 4.56 1.02 -1.26 -4.43 119.74 118.84 1jmx s LYS 388 Ca 0.49 1.73 -0.06 0.00 0.02 0.00 0.00 55.97 58.15 1jmx s LYS 388 Cb -0.10 -2.79 0.04 0.00 -0.52 0.00 0.00 37.83 34.45 1jmx s LYS 388 CO 0.42 -0.10 0.10 0.08 -0.92 0.00 0.00 175.35 174.93 1jmx s VAL 389 N -1.41 3.77 0.62 3.17 1.01 -0.30 -4.95 120.40 122.30 1jmx s VAL 389 Ca 0.53 -1.10 -0.14 0.00 0.00 0.00 0.00 61.98 61.27 1jmx s VAL 389 Cb -0.28 -3.12 -0.03 0.00 0.00 0.00 0.00 36.38 32.95 1jmx s VAL 389 CO 0.36 -0.15 1.05 -1.10 0.00 0.00 0.00 175.10 175.26 1jmx s GLN 390 N 1.41 3.26 -0.20 2.72 -0.21 -1.26 -1.27 119.66 124.11 1jmx s GLN 390 Ca -0.01 1.11 -0.10 0.00 0.02 0.00 0.00 55.36 56.38 1jmx s GLN 390 Cb -0.19 -2.03 -0.05 0.00 1.00 0.00 0.00 33.01 31.74 1jmx s GLN 390 CO 0.03 -0.85 0.13 0.20 -2.12 0.00 0.00 175.29 172.68 1jmx s GLY 391 N -3.09 2.04 -0.12 3.09 0.00 -0.78 -4.76 107.32 103.69 1jmx s GLY 391 Ca 0.62 -0.70 0.01 0.00 0.00 0.00 0.00 44.72 44.65 1jmx s GLY 391 CO 0.41 0.14 -0.12 0.50 0.00 0.00 0.00 173.10 174.03 1jmx s ARG 392 N 0.38 2.01 0.27 2.90 0.52 -1.26 -0.39 118.95 123.38 1jmx s ARG 392 Ca 0.08 -0.46 0.08 0.00 -0.52 0.00 0.00 55.73 54.91 1jmx s ARG 392 Cb -0.11 -1.84 -0.06 0.00 0.52 0.00 0.00 34.95 33.46 1jmx s ARG 392 CO -0.02 -0.18 -0.10 -0.06 0.02 0.00 0.00 175.30 174.96 1jmx s PHE 393 N 1.35 2.01 0.01 -0.53 0.40 -0.42 -4.37 117.98 116.43 1jmx s PHE 393 Ca 0.00 -0.59 -0.02 0.00 -0.60 0.00 0.00 56.93 55.72 1jmx s PHE 393 Cb -0.13 -1.07 -0.01 0.00 0.51 0.00 0.00 43.02 42.32 1jmx s PHE 393 CO -0.06 0.40 0.03 -2.00 0.70 0.00 0.00 175.22 174.29 1jmx s GLU 394 N -3.66 0.30 -0.38 0.44 2.56 0.01 -3.61 118.70 114.36 1jmx s GLU 394 Ca 0.28 -0.40 -0.11 0.00 0.00 0.00 0.00 54.97 54.75 1jmx s GLU 394 Cb 0.01 0.12 0.03 0.00 2.00 0.00 0.00 34.13 36.29 1jmx s GLU 394 CO 0.12 -0.06 0.21 0.00 -0.56 0.00 0.00 175.26 174.98 1jmx s ALA 395 N -1.10 3.28 -0.34 6.30 0.00 -1.26 -0.96 121.76 127.68 1jmx s ALA 395 Ca -0.12 -1.77 -0.22 0.00 0.00 0.00 0.00 51.96 49.85 1jmx s ALA 395 Cb -0.07 -2.61 0.00 0.00 0.00 0.00 0.00 23.12 20.45 1jmx s ALA 395 CO -0.00 -1.43 0.73 -2.00 0.00 0.00 0.00 175.76 173.06 1jmx s GLU 396 N 1.54 3.79 0.12 0.00 2.12 0.14 -1.69 118.70 124.73 1jmx s GLU 396 Ca 0.02 0.30 -0.19 0.00 0.36 0.00 0.00 54.97 55.45 1jmx s GLU 396 Cb -0.20 -3.78 -0.07 0.00 0.26 0.00 0.00 34.13 30.34 1jmx s GLU 396 CO 0.06 -0.75 0.62 0.00 -0.54 0.00 0.00 175.26 174.65 1jmx s ALA 397 N 2.91 3.54 0.02 6.30 0.00 0.24 -0.52 121.76 134.25 1jmx s ALA 397 Ca 0.29 0.08 0.03 0.00 0.00 0.00 0.00 51.96 52.36 1jmx s ALA 397 Cb -0.14 -2.70 -0.01 0.00 0.00 0.00 0.00 23.12 20.27 1jmx s ALA 397 CO 0.15 0.38 -0.09 -1.58 0.00 0.00 0.00 175.76 174.62 1jmx s TRP 398 N -1.24 0.77 0.00 0.00 0.52 0.42 -1.19 118.94 118.22 1jmx s TRP 398 Ca 0.34 -0.27 0.00 0.00 0.02 0.00 0.00 56.10 56.18 1jmx s TRP 398 Cb -0.19 -0.47 0.00 0.00 -1.15 0.00 0.00 33.47 31.66 1jmx s TRP 398 CO 0.20 -0.02 0.00 0.41 0.02 0.00 0.00 176.95 177.56 1jmx n GLY 399 N 2.28 4.93 2.95 0.98 0.00 0.50 -0.65 105.19 116.19 1jmx n GLY 399 Ca -0.17 -1.07 -0.15 0.00 0.00 0.00 0.00 46.02 44.63 1jmx n GLY 399 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jmx s LYS 400 N 1.74 0.36 0.63 1.61 1.02 -1.26 -0.64 119.74 123.20 1jmx s LYS 400 Ca 0.00 -0.21 -0.07 0.00 0.02 0.00 0.00 55.97 55.71 1jmx s LYS 400 Cb 0.00 -0.33 0.14 0.00 -0.52 0.00 0.00 37.83 37.12 1jmx s LYS 400 CO 0.00 0.09 0.86 -0.40 -0.92 0.00 0.00 175.35 174.97 1jmx n ASP 401 N 2.84 0.45 0.27 2.83 5.68 0.10 -4.79 116.55 123.93 1jmx n ASP 401 Ca -0.14 -1.55 0.17 0.00 -0.50 0.00 0.00 54.79 52.77 1jmx n ASP 401 Cb 0.58 -0.62 0.92 0.00 -1.14 0.00 0.00 41.12 40.86 1jmx n ASP 401 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1jmx h ALA 402 N -1.31 1.55 -0.41 2.12 0.00 -1.30 -0.81 119.26 119.10 1jmx h ALA 402 Ca -0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1jmx h ALA 402 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1jmx h ALA 402 CO 0.23 -0.12 0.00 0.09 0.00 0.00 0.00 179.25 179.46 1jmx n ASN 403 N -3.70 2.34 0.00 0.00 3.02 -1.26 -4.91 115.26 110.75 1jmx n ASN 403 Ca -0.01 -2.04 0.00 0.00 -0.03 0.00 0.00 54.58 52.50 1jmx n ASN 403 Cb 0.18 -0.30 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 1jmx n ASN 403 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jmx n GLY 404 N 1.11 0.36 3.89 7.41 0.00 -0.31 -5.00 105.19 112.64 1jmx n GLY 404 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 1jmx n GLY 404 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1jmx s GLN 405 N -0.73 3.72 0.42 1.61 2.00 -1.26 -4.81 119.66 120.60 1jmx s GLN 405 Ca 0.00 0.11 -0.26 0.00 -2.00 0.00 0.00 55.36 53.21 1jmx s GLN 405 Cb 0.00 -2.73 -0.10 0.00 0.80 0.00 0.00 33.01 30.98 1jmx s GLN 405 CO 0.00 0.38 1.32 -2.30 -0.50 0.00 0.00 175.29 174.18 1jmx n PRO 406 N -0.08 2.06 -3.88 1.67 -0.02 -1.26 -0.72 135.00 132.77 1jmx n PRO 406 Ca -0.01 0.73 -0.26 0.00 -2.02 0.00 0.00 63.50 61.94 1jmx n PRO 406 Cb 0.52 -2.45 -0.17 0.00 -0.02 0.00 0.00 33.50 31.38 1jmx n PRO 406 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1jmx s LEU 407 N -1.86 1.14 -0.42 2.45 0.20 0.19 -4.71 118.68 115.66 1jmx s LEU 407 Ca 0.60 -0.32 -0.25 0.00 0.69 0.00 0.00 54.13 54.85 1jmx s LEU 407 Cb -0.50 -0.79 0.02 0.00 -0.43 0.00 0.00 46.19 44.50 1jmx s LEU 407 CO 0.59 -0.14 0.89 -0.60 -0.29 0.00 0.00 176.35 176.80 1jmx s ARG 408 N 1.74 3.64 -0.03 1.98 3.52 -1.26 -0.37 118.95 128.17 1jmx s ARG 408 Ca 0.04 0.27 -0.19 0.00 -0.13 0.00 0.00 55.73 55.73 1jmx s ARG 408 Cb -0.13 -3.88 -0.11 0.00 -1.56 0.00 0.00 34.95 29.27 1jmx s ARG 408 CO -0.08 -1.08 0.79 0.82 -0.81 0.00 0.00 175.30 174.94 1jmx h ILE 409 N 5.95 0.23 0.00 4.11 5.03 -1.51 -3.46 117.51 127.86 1jmx h ILE 409 Ca -0.24 -0.66 0.00 0.00 -0.12 0.00 0.00 64.86 63.84 1jmx h ILE 409 Cb 1.08 0.37 0.00 0.00 -3.03 0.00 0.00 36.82 35.24 1jmx h ILE 409 CO 0.99 0.05 0.00 0.61 -0.68 0.00 0.00 178.15 179.12 1jmx n GLY 410 N 0.24 0.12 3.43 5.37 0.00 -1.21 -4.49 105.19 108.65 1jmx n GLY 410 Ca -0.08 -1.35 -0.44 0.00 0.00 0.00 0.00 46.02 44.15 1jmx n GLY 410 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jmx s TYR 411 N -3.31 3.15 0.05 1.61 4.12 -1.26 -0.59 117.35 121.11 1jmx s TYR 411 Ca 0.00 -0.66 -0.07 0.00 0.02 0.00 0.00 57.07 56.36 1jmx s TYR 411 Cb 0.00 -3.28 -0.05 0.00 -1.52 0.00 0.00 41.96 37.11 1jmx s TYR 411 CO 0.00 -0.88 0.31 -0.51 0.02 0.00 0.00 175.55 174.49 1jmx s LEU 412 N 2.16 4.35 0.50 -1.29 1.43 -0.68 -4.96 118.68 120.18 1jmx s LEU 412 Ca 0.10 0.61 -0.23 0.00 -1.03 0.00 0.00 54.13 53.58 1jmx s LEU 412 Cb -0.21 -2.86 -0.07 0.00 0.03 0.00 0.00 46.19 43.08 1jmx s LEU 412 CO 0.10 0.20 1.35 -0.81 0.23 0.00 0.00 176.35 177.42 1jmx n PRO 413 N 0.87 1.89 -3.92 1.29 -0.04 -1.26 -4.38 135.00 129.45 1jmx n PRO 413 Ca -0.09 0.68 -0.08 0.00 -0.04 0.00 0.00 63.50 63.98 1jmx n PRO 413 Cb 0.52 -2.55 -0.03 0.00 -0.04 0.00 0.00 33.50 31.40 1jmx n PRO 413 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1jmx s ALA 414 N -1.25 -0.77 0.06 0.55 0.00 -1.26 -2.11 121.76 116.97 1jmx s ALA 414 Ca 0.67 -0.58 -0.10 0.00 0.00 0.00 0.00 51.96 51.95 1jmx s ALA 414 Cb -0.44 0.94 -0.06 0.00 0.00 0.00 0.00 23.12 23.56 1jmx s ALA 414 CO 0.53 -0.96 0.38 0.45 0.00 0.00 0.00 175.76 176.16 1jmx s SER 415 N -2.97 6.64 -0.02 0.00 0.15 -0.04 -4.88 113.70 112.58 1jmx s SER 415 Ca 0.16 0.78 0.06 0.00 0.70 0.00 0.00 55.95 57.65 1jmx s SER 415 Cb -0.04 -2.17 -0.01 0.00 -1.71 0.00 0.00 66.02 62.09 1jmx s SER 415 CO 0.08 0.20 -0.20 0.26 1.20 0.00 0.00 173.24 174.79 1jmx s TRP 416 N -1.35 1.79 0.21 3.44 0.52 -1.26 -0.90 118.94 121.39 1jmx s TRP 416 Ca 0.31 -0.35 -0.09 0.00 0.02 0.00 0.00 56.10 55.99 1jmx s TRP 416 Cb -0.14 -1.16 -0.01 0.00 -1.15 0.00 0.00 33.47 31.01 1jmx s TRP 416 CO 0.17 -0.04 0.34 -1.59 0.02 0.00 0.00 176.95 175.85 1jmx s LYS 417 N -0.44 1.35 -0.02 4.98 -2.85 -0.35 -4.80 119.74 117.62 1jmx s LYS 417 Ca 0.07 -1.31 0.06 0.00 -1.00 0.00 0.00 55.97 53.79 1jmx s LYS 417 Cb -0.08 0.40 -0.01 0.00 -2.06 0.00 0.00 37.83 36.08 1jmx s LYS 417 CO -0.01 -0.52 -0.19 0.08 0.10 0.00 0.00 175.35 174.81 1jmx s VAL 418 N -4.03 1.54 0.04 1.79 1.01 -1.26 -0.95 120.40 118.53 1jmx s VAL 418 Ca 0.24 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.41 1jmx s VAL 418 Cb 0.02 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 1jmx s VAL 418 CO 0.07 0.44 -0.06 -1.61 0.00 0.00 0.00 175.10 173.93 1jmx s GLU 419 N -0.44 0.50 0.25 2.72 2.02 -0.30 -4.96 118.70 118.48 1jmx s GLU 419 Ca 0.07 -0.80 -0.31 0.00 0.02 0.00 0.00 54.97 53.95 1jmx s GLU 419 Cb -0.08 -0.13 -0.13 0.00 0.10 0.00 0.00 34.13 33.89 1jmx s GLU 419 CO -0.01 0.00 1.48 -2.30 0.02 0.00 0.00 175.26 174.46 1jmx n PRO 420 N 1.27 2.26 0.06 0.39 -0.02 -1.26 -0.02 135.00 137.67 1jmx n PRO 420 Ca -0.22 0.80 -0.11 0.00 -2.02 0.00 0.00 63.50 61.96 1jmx n PRO 420 Cb 0.56 -2.51 -0.01 0.00 -0.02 0.00 0.00 33.50 31.52 1jmx n PRO 420 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1jmx h PHE 421 N 4.59 0.55 -4.51 6.00 3.57 -1.55 -3.42 116.94 122.18 1jmx h PHE 421 Ca -0.45 -0.27 -0.31 0.00 3.53 0.00 0.00 57.97 60.46 1jmx h PHE 421 Cb 1.26 -0.07 -0.12 0.00 2.79 0.00 0.00 35.95 39.80 1jmx h PHE 421 CO 0.58 1.06 -0.43 0.54 -2.23 0.00 0.00 178.31 177.82 1jmx s ASN 422 N -7.01 0.82 0.38 0.41 2.20 -1.26 -4.98 114.94 105.49 1jmx s ASN 422 Ca -0.05 -1.49 0.09 0.00 -0.94 0.00 0.00 52.86 50.46 1jmx s ASN 422 Cb 0.10 0.52 0.84 0.00 -2.00 0.00 0.00 41.25 40.71 1jmx s ASN 422 CO 0.85 -1.05 1.92 1.05 -2.94 0.00 0.00 177.10 176.94 1jmx h GLU 423 N 2.31 0.63 -0.82 3.55 4.11 -2.00 -0.89 114.58 121.48 1jmx h GLU 423 Ca -0.29 -0.04 -0.04 0.00 0.07 0.00 0.00 59.36 59.06 1jmx h GLU 423 Cb 1.24 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 30.31 1jmx h GLU 423 CO 0.42 0.42 0.36 -0.09 0.07 0.00 0.00 179.01 180.19 1jmx h ARG 424 N 0.65 1.20 -0.25 1.06 1.12 -1.99 -1.86 114.38 114.30 1jmx h ARG 424 Ca 0.37 -0.20 -0.08 0.00 -1.11 0.00 0.00 59.98 58.96 1jmx h ARG 424 Cb 0.55 -0.20 -0.01 0.00 -0.01 0.00 0.00 29.97 30.29 1jmx h ARG 424 CO -0.14 0.94 -0.20 0.00 -3.11 0.00 0.00 179.97 177.47 1jmx h ALA 425 N 1.21 1.19 -0.15 2.80 0.00 -1.49 -1.75 119.26 121.07 1jmx h ALA 425 Ca 0.28 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1jmx h ALA 425 Cb 0.17 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1jmx h ALA 425 CO -0.03 0.52 -0.03 0.28 0.00 0.00 0.00 179.25 179.99 1jmx h VAL 426 N 0.41 1.28 -0.89 0.00 2.07 -1.03 -2.21 116.25 115.89 1jmx h VAL 426 Ca 0.07 -0.94 -0.02 0.00 0.82 0.00 0.00 66.70 66.62 1jmx h VAL 426 Cb 0.58 1.61 -0.04 0.00 -1.52 0.00 0.00 31.29 31.92 1jmx h VAL 426 CO 0.04 0.28 0.46 -0.08 0.02 0.00 0.00 177.57 178.29 1jmx h GLU 427 N -0.02 1.25 -0.01 1.57 4.22 -1.13 -2.72 114.58 117.75 1jmx h GLU 427 Ca 0.04 -0.16 0.00 0.00 0.08 0.00 0.00 59.36 59.32 1jmx h GLU 427 Cb 0.44 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1jmx h GLU 427 CO 0.01 0.93 -0.06 -0.25 -2.18 0.00 0.00 179.01 177.46 1jmx n ASP 428 N -4.32 0.68 -3.53 1.04 8.00 -0.68 -4.94 116.55 112.79 1jmx n ASP 428 Ca 0.09 -0.95 -0.20 0.00 0.71 0.00 0.00 54.79 54.44 1jmx n ASP 428 Cb 0.11 -0.02 0.08 0.00 -0.02 0.00 0.00 41.12 41.27 1jmx n ASP 428 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1jmx n GLU 429 N -0.64 -7.00 -0.28 -1.24 1.02 -0.95 -4.89 120.64 106.66 1jmx n GLU 429 Ca 0.18 0.82 -0.04 0.00 -0.02 0.00 0.00 57.16 58.09 1jmx n GLU 429 Cb 0.26 -5.82 0.07 0.00 -0.02 0.00 0.00 31.44 25.93 1jmx n GLU 429 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1jmx h ASP 430 N -2.22 0.90 0.14 1.62 3.32 -1.69 -2.53 116.42 115.97 1jmx h ASP 430 Ca -0.58 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 56.43 1jmx h ASP 430 Cb 1.35 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 40.68 1jmx h ASP 430 CO 0.53 0.67 -0.01 0.58 -1.72 0.00 0.00 179.24 179.30 1jmx h VAL 431 N 1.05 0.10 0.02 -1.35 2.07 -1.91 0.22 116.25 116.45 1jmx h VAL 431 Ca 0.28 -0.09 -0.30 0.00 0.82 0.00 0.00 66.70 67.41 1jmx h VAL 431 Cb -0.09 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 1jmx h VAL 431 CO -0.06 0.01 -1.70 0.50 0.02 0.00 0.00 177.57 176.34 1jmx h LYS 432 N 0.00 0.05 0.00 1.57 3.64 -1.78 -3.41 116.57 116.63 1jmx h LYS 432 Ca -0.00 -0.08 -0.25 0.00 -1.27 0.00 0.00 60.65 59.05 1jmx h LYS 432 Cb 0.08 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.88 1jmx h LYS 432 CO 0.00 0.64 -2.00 1.19 -2.27 0.00 0.00 179.45 177.01 1jmx n PHE 433 N -3.14 0.00 0.03 1.91 3.01 -1.00 -4.64 117.46 113.63 1jmx n PHE 433 Ca -0.18 0.00 0.17 0.00 1.01 0.00 0.00 57.45 58.45 1jmx n PHE 433 Cb 1.05 -0.71 0.65 0.00 -0.01 0.00 0.00 39.48 40.46 1jmx n PHE 433 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1jmx h ALA 434 N 0.79 2.34 0.00 4.37 0.00 -0.74 -3.39 119.26 122.64 1jmx h ALA 434 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1jmx h ALA 434 Cb 1.83 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.63 1jmx h ALA 434 CO 0.02 -0.47 0.00 0.41 0.00 0.00 0.00 179.25 179.21 1jmx n GLY 435 N -1.61 0.37 2.92 0.00 0.00 -1.26 -0.93 105.19 104.69 1jmx n GLY 435 Ca 0.08 -1.57 -0.23 0.00 0.00 0.00 0.00 46.02 44.30 1jmx n GLY 435 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jmx s LYS 436 N -2.00 1.20 -0.17 1.61 -2.85 -0.11 -4.84 119.74 112.59 1jmx s LYS 436 Ca 0.00 -0.21 -0.23 0.00 -1.00 0.00 0.00 55.97 54.53 1jmx s LYS 436 Cb 0.00 -1.16 -0.02 0.00 -2.06 0.00 0.00 37.83 34.59 1jmx s LYS 436 CO 0.00 -0.10 0.74 1.41 0.10 0.00 0.00 175.35 177.50 1jmx s MET 437 N 1.08 4.28 0.36 1.78 -2.45 -1.26 -1.16 119.30 121.92 1jmx s MET 437 Ca -0.08 0.85 -0.01 0.00 -1.25 0.00 0.00 55.69 55.21 1jmx s MET 437 Cb -0.14 -3.56 -0.03 0.00 1.25 0.00 0.00 34.83 32.34 1jmx s MET 437 CO -0.01 -0.25 0.57 -0.65 1.05 0.00 0.00 175.02 175.74 1jmx s GLN 438 N 1.89 3.50 0.35 4.11 -0.21 -0.39 -4.98 119.66 123.93 1jmx s GLN 438 Ca 0.35 -0.25 0.08 0.00 0.02 0.00 0.00 55.36 55.56 1jmx s GLN 438 Cb -0.16 -2.63 0.80 0.00 1.00 0.00 0.00 33.01 32.01 1jmx s GLN 438 CO 0.12 0.12 1.87 0.00 -2.12 0.00 0.00 175.29 175.28 1jmx h ALA 439 N 0.77 1.80 0.00 6.09 0.00 -1.87 -1.93 119.26 124.12 1jmx h ALA 439 Ca -0.49 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1jmx h ALA 439 Cb 1.21 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1jmx h ALA 439 CO 0.62 -0.04 0.00 -0.40 0.00 0.00 0.00 179.25 179.43 1jmx n ASP 440 N -4.56 0.00 0.00 0.00 5.75 -1.26 -4.32 116.55 112.16 1jmx n ASP 440 Ca 0.17 -0.20 0.00 0.00 -0.01 0.00 0.00 54.79 54.75 1jmx n ASP 440 Cb 0.45 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.36 1jmx n ASP 440 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1jmx n GLY 441 N 0.18 0.79 3.45 6.12 0.00 -0.72 -4.74 105.19 110.26 1jmx n GLY 441 Ca 0.10 -0.24 -0.36 0.00 0.00 0.00 0.00 46.02 45.53 1jmx n GLY 441 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jmx s VAL 442 N -2.00 4.29 -0.26 1.61 1.01 -1.25 -1.30 120.40 122.49 1jmx s VAL 442 Ca 0.00 -0.18 -0.13 0.00 0.00 0.00 0.00 61.98 61.67 1jmx s VAL 442 Cb 0.00 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 1jmx s VAL 442 CO 0.00 0.35 0.27 0.12 0.00 0.00 0.00 175.10 175.84 1jmx s PHE 443 N 1.56 3.26 -0.42 5.22 5.36 0.48 -1.27 117.98 132.17 1jmx s PHE 443 Ca 0.06 0.28 -0.12 0.00 -0.96 0.00 0.00 56.93 56.19 1jmx s PHE 443 Cb -0.15 -2.45 0.05 0.00 -0.34 0.00 0.00 43.02 40.14 1jmx s PHE 443 CO 0.03 -0.14 0.29 0.08 -1.46 0.00 0.00 175.22 174.02 1jmx s VAL 444 N 1.74 4.78 0.90 3.12 1.01 -0.31 -1.87 120.40 129.77 1jmx s VAL 444 Ca 0.11 -1.04 -0.11 0.00 0.00 0.00 0.00 61.98 60.94 1jmx s VAL 444 Cb -0.15 -3.79 0.14 0.00 0.00 0.00 0.00 36.38 32.57 1jmx s VAL 444 CO 0.09 -0.42 1.10 -2.16 0.00 0.00 0.00 175.10 173.71 1jmx s PRO 445 N 1.56 1.17 1.13 2.72 0.04 -1.26 -0.93 135.00 139.43 1jmx s PRO 445 Ca 0.03 1.20 -0.17 0.00 0.04 0.00 0.00 61.00 62.10 1jmx s PRO 445 Cb -0.22 -1.77 0.25 0.00 0.04 0.00 0.00 34.50 32.81 1jmx s PRO 445 CO 0.06 -2.41 1.12 0.20 0.04 0.00 0.00 177.00 176.01 1jmx s GLY 446 N -3.01 1.59 0.58 0.56 0.00 -0.11 -4.82 107.32 102.12 1jmx s GLY 446 Ca 0.65 -0.81 -0.17 0.00 0.00 0.00 0.00 44.72 44.39 1jmx s GLY 446 CO 0.58 -0.01 1.07 -0.32 0.00 0.00 0.00 173.10 174.42 1jmx s GLY 447 N -3.86 2.26 1.05 0.20 0.00 -1.26 -3.44 107.32 102.26 1jmx s GLY 447 Ca 0.69 0.52 -0.15 0.00 0.00 0.00 0.00 44.72 45.78 1jmx s GLY 447 CO 0.56 0.85 1.13 0.00 0.00 0.00 0.00 173.10 175.64 1jmx s ALA 448 N -2.26 1.15 0.00 3.20 0.00 -0.29 -4.48 121.76 119.08 1jmx s ALA 448 Ca 0.66 -0.70 0.00 0.00 0.00 0.00 0.00 51.96 51.92 1jmx s ALA 448 Cb -0.18 -2.98 0.00 0.00 0.00 0.00 0.00 23.12 19.96 1jmx s ALA 448 CO 0.34 -2.93 0.00 0.41 0.00 0.00 0.00 175.76 173.58 1jmx n GLY 449 N -1.60 -0.05 3.78 0.00 0.00 -1.26 -4.88 105.19 101.19 1jmx n GLY 449 Ca 0.09 -1.78 -0.36 0.00 0.00 0.00 0.00 46.02 43.97 1jmx n GLY 449 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1jmx s PRO 450 N -2.09 3.79 -0.35 1.61 0.02 -1.26 -4.33 135.00 132.40 1jmx s PRO 450 Ca 0.00 1.66 -0.01 0.00 0.02 0.00 0.00 61.00 62.67 1jmx s PRO 450 Cb 0.00 -2.35 0.08 0.00 0.02 0.00 0.00 34.50 32.25 1jmx s PRO 450 CO 0.00 -0.50 0.09 1.21 -0.33 0.00 0.00 177.00 177.47 1jmx s ASN 451 N -1.52 5.01 0.49 2.53 3.04 0.30 -4.92 114.94 119.88 1jmx s ASN 451 Ca 0.64 -1.71 0.30 0.00 0.04 0.00 0.00 52.86 52.13 1jmx s ASN 451 Cb -0.25 -1.74 1.39 0.00 -1.54 0.00 0.00 41.25 39.11 1jmx s ASN 451 CO 0.31 -0.39 1.80 -0.65 -3.04 0.00 0.00 177.10 175.12 1jmx h PRO 452 N 7.96 0.13 0.00 0.43 0.11 -1.84 0.38 132.00 139.17 1jmx h PRO 452 Ca -0.15 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.95 1jmx h PRO 452 Cb 1.05 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1jmx h PRO 452 CO 0.60 0.09 0.00 0.93 -0.21 0.00 0.00 178.00 179.40 1jmx h GLU 453 N 0.13 0.00 -6.64 1.05 4.39 -1.93 -3.43 114.58 108.15 1jmx h GLU 453 Ca 0.57 0.00 -0.45 0.00 0.34 0.00 0.00 59.36 59.82 1jmx h GLU 453 Cb 1.97 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 30.65 1jmx h GLU 453 CO -0.12 0.00 -0.13 1.03 -1.16 0.00 0.00 179.01 178.63 1jmx s ARG 454 N -3.40 3.00 0.18 2.33 0.52 0.12 -5.02 118.95 116.68 1jmx s ARG 454 Ca 0.04 -0.64 -0.31 0.00 -0.52 0.00 0.00 55.73 54.30 1jmx s ARG 454 Cb 0.09 -2.60 -0.10 0.00 0.52 0.00 0.00 34.95 32.86 1jmx s ARG 454 CO 0.46 -0.27 1.52 0.15 0.02 0.00 0.00 175.30 177.18 1jmx s LYS 455 N -4.51 4.24 -1.75 3.54 1.02 -1.26 -1.86 119.74 119.16 1jmx s LYS 455 Ca 0.49 2.31 0.00 0.00 0.02 0.00 0.00 55.97 58.79 1jmx s LYS 455 Cb -0.10 -3.16 0.00 0.00 -0.52 0.00 0.00 37.83 34.05 1jmx s LYS 455 CO 0.37 -0.55 0.00 -1.33 -0.92 0.00 0.00 175.35 172.92 1jmx n MET 456 N 3.62 -1.43 -3.44 1.68 2.81 -1.26 -2.52 117.12 116.58 1jmx n MET 456 Ca 0.12 1.01 -0.23 0.00 -1.81 0.00 0.00 57.70 56.79 1jmx n MET 456 Cb 0.39 -5.46 -0.02 0.00 -0.71 0.00 0.00 33.22 27.42 1jmx n MET 456 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1jmx n MET 457 N -2.68 -2.62 -1.06 0.03 0.00 -0.78 -4.90 117.12 105.11 1jmx n MET 457 Ca -0.21 0.29 -0.28 0.00 0.00 0.00 0.00 57.70 57.50 1jmx n MET 457 Cb 0.65 -4.92 0.19 0.00 0.00 0.00 0.00 33.22 29.14 1jmx n MET 457 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 175.97 175.89 1jmx s THR 458 N -2.80 2.04 0.86 3.17 -1.32 -1.05 -0.95 115.64 115.60 1jmx s THR 458 Ca 0.41 0.01 -0.12 0.00 -1.21 0.00 0.00 61.69 60.78 1jmx s THR 458 Cb -0.23 -2.43 0.11 0.00 -1.51 0.00 0.00 72.50 68.44 1jmx s THR 458 CO 0.50 -0.01 1.10 0.20 -2.21 0.00 0.00 174.62 174.20 1jmx s ASN 459 N -3.30 3.87 -0.08 8.08 -0.87 -1.26 -0.54 114.94 120.84 1jmx s ASN 459 Ca 0.66 1.30 -0.05 0.00 -1.57 0.00 0.00 52.86 53.20 1jmx s ASN 459 Cb -0.20 -1.99 -0.19 0.00 -0.02 0.00 0.00 41.25 38.85 1jmx s ASN 459 CO 0.59 -2.36 3.37 0.59 -2.57 0.00 0.00 177.10 176.71 1jmx n ASN 460 N -3.69 5.46 -4.94 -1.22 3.02 -1.26 -4.87 115.26 107.76 1jmx n ASN 460 Ca 0.07 -2.60 -0.24 0.00 -0.03 0.00 0.00 54.58 51.78 1jmx n ASN 460 Cb 0.56 -1.37 0.01 0.00 -0.61 0.00 0.00 39.78 38.38 1jmx n ASN 460 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jmx s ALA 461 N 0.46 3.63 -0.08 5.41 0.00 -1.26 -4.13 121.76 125.79 1jmx s ALA 461 Ca 0.61 -0.91 -0.30 0.00 0.00 0.00 0.00 51.96 51.36 1jmx s ALA 461 Cb 0.31 -2.26 0.12 0.00 0.00 0.00 0.00 23.12 21.28 1jmx s ALA 461 CO -0.04 -0.39 0.97 0.20 0.00 0.00 0.00 175.76 176.51 1jmx s GLY 462 N -4.19 -0.38 -0.43 0.00 0.00 -0.45 -4.49 107.32 97.39 1jmx s GLY 462 Ca 0.48 1.41 -0.05 0.00 0.00 0.00 0.00 44.72 46.55 1jmx s GLY 462 CO 0.40 0.57 0.25 0.21 0.00 0.00 0.00 173.10 174.52 1jmx s ASN 463 N -2.03 5.41 0.17 1.64 3.84 -1.26 -0.92 114.94 121.79 1jmx s ASN 463 Ca 0.04 -1.95 0.08 0.00 0.21 0.00 0.00 52.86 51.23 1jmx s ASN 463 Cb -0.01 -1.89 -0.04 0.00 -0.55 0.00 0.00 41.25 38.76 1jmx s ASN 463 CO -0.05 -0.59 -0.03 -0.76 -2.79 0.00 0.00 177.10 172.88 1jmx s LEU 464 N 1.23 3.23 -0.22 3.21 1.43 0.33 -1.52 118.68 126.36 1jmx s LEU 464 Ca 0.07 -0.43 -0.04 0.00 -1.03 0.00 0.00 54.13 52.70 1jmx s LEU 464 Cb -0.24 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.08 1jmx s LEU 464 CO -0.03 0.10 -0.03 -0.75 0.23 0.00 0.00 176.35 175.87 1jmx s LYS 465 N -2.87 3.38 -0.41 1.70 2.20 0.97 -1.17 119.74 123.54 1jmx s LYS 465 Ca 0.27 -0.63 -0.20 0.00 -0.36 0.00 0.00 55.97 55.05 1jmx s LYS 465 Cb -0.09 -3.03 0.02 0.00 -1.51 0.00 0.00 37.83 33.21 1jmx s LYS 465 CO 0.18 -0.20 0.60 0.08 -0.36 0.00 0.00 175.35 175.65 1jmx s VAL 466 N 1.48 4.89 -0.23 4.02 1.01 -0.01 -1.15 120.40 130.40 1jmx s VAL 466 Ca 0.06 0.15 -0.08 0.00 0.00 0.00 0.00 61.98 62.11 1jmx s VAL 466 Cb -0.14 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.06 1jmx s VAL 466 CO -0.03 -0.50 0.08 -0.63 0.00 0.00 0.00 175.10 174.03 1jmx s ILE 467 N 2.68 4.61 -0.10 2.22 -1.09 -0.13 -0.12 121.20 129.27 1jmx s ILE 467 Ca 0.21 -0.08 0.00 0.00 -2.23 0.00 0.00 60.65 58.55 1jmx s ILE 467 Cb -0.15 -3.13 -0.02 0.00 -1.58 0.00 0.00 42.46 37.58 1jmx s ILE 467 CO 0.17 0.37 -0.10 0.00 -1.23 0.00 0.00 174.94 174.15 1jmx s ALA 468 N 1.18 2.80 -0.19 9.38 0.00 -0.45 -1.21 121.76 133.27 1jmx s ALA 468 Ca 0.05 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.12 1jmx s ALA 468 Cb -0.14 -1.24 0.04 0.00 0.00 0.00 0.00 23.12 21.78 1jmx s ALA 468 CO 0.04 0.38 -0.08 0.95 0.00 0.00 0.00 175.76 177.05 1jmx s THR 469 N -0.14 1.43 0.21 0.00 -4.23 -0.08 -0.50 115.64 112.33 1jmx s THR 469 Ca 0.00 -0.87 -0.32 0.00 -1.18 0.00 0.00 61.69 59.32 1jmx s THR 469 Cb -0.13 -1.55 -0.13 0.00 1.34 0.00 0.00 72.50 72.02 1jmx s THR 469 CO 0.03 0.14 1.48 0.18 -0.54 0.00 0.00 174.62 175.91 1jmx n LEU 470 N 4.76 3.15 0.08 4.79 4.32 0.35 -0.86 117.00 133.59 1jmx n LEU 470 Ca -0.13 1.12 -0.02 0.00 -0.02 0.00 0.00 56.01 56.96 1jmx n LEU 470 Cb 0.47 -1.43 0.24 0.00 -1.62 0.00 0.00 43.42 41.08 1jmx n LEU 470 CO 0.19 -0.39 0.70 0.00 -1.22 0.00 0.00 177.39 176.66 1jmx h ALA 471 N 4.87 1.16 -1.66 -1.18 0.00 -1.77 -0.23 119.26 120.46 1jmx h ALA 471 Ca -0.45 -0.37 -0.71 0.00 0.00 0.00 0.00 54.91 53.38 1jmx h ALA 471 Cb 1.27 -0.09 -0.16 0.00 0.00 0.00 0.00 17.79 18.80 1jmx h ALA 471 CO 0.81 0.55 1.28 0.34 0.00 0.00 0.00 179.25 182.22 1jmx s ASP 472 N -6.87 6.88 0.00 0.00 2.15 -1.26 -4.27 116.67 113.30 1jmx s ASP 472 Ca -0.05 -2.57 0.00 0.00 0.43 0.00 0.00 52.55 50.36 1jmx s ASP 472 Cb 0.14 -2.43 0.00 0.00 -0.30 0.00 0.00 42.92 40.33 1jmx s ASP 472 CO 0.77 -0.92 0.00 0.61 -0.17 0.00 0.00 175.17 175.46 1jmx n GLY 473 N 4.80 0.05 2.32 2.66 0.00 -1.26 -4.52 105.19 109.24 1jmx n GLY 473 Ca 0.34 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.24 1jmx n GLY 473 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jmx n GLY 474 N -2.00 1.12 3.73 -0.02 0.00 -0.10 -4.99 105.19 102.93 1jmx n GLY 474 Ca 0.00 -0.50 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 1jmx n GLY 474 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1jmx s GLN 475 N -3.10 4.44 0.18 1.61 1.11 -1.26 -4.56 119.66 118.07 1jmx s GLN 475 Ca 0.00 1.90 -0.00 0.00 0.01 0.00 0.00 55.36 57.27 1jmx s GLN 475 Cb 0.00 -3.26 -0.04 0.00 -1.01 0.00 0.00 33.01 28.70 1jmx s GLN 475 CO 0.00 -0.20 0.35 0.95 0.01 0.00 0.00 175.29 176.41 1jmx s THR 476 N 0.39 5.24 0.03 -0.19 -4.23 -1.26 -0.50 115.64 115.12 1jmx s THR 476 Ca 0.56 -0.40 0.01 0.00 -1.18 0.00 0.00 61.69 60.68 1jmx s THR 476 Cb -0.33 -3.72 -0.02 0.00 1.34 0.00 0.00 72.50 69.77 1jmx s THR 476 CO 0.34 -0.12 -0.06 -0.83 -0.54 0.00 0.00 174.62 173.41 1jmx s GLY 477 N -3.08 0.40 -0.03 3.99 0.00 0.35 -4.26 107.32 104.69 1jmx s GLY 477 Ca 0.38 -0.68 0.05 0.00 0.00 0.00 0.00 44.72 44.46 1jmx s GLY 477 CO 0.29 -0.74 -0.16 -0.54 0.00 0.00 0.00 173.10 171.95 1jmx s GLU 478 N -1.49 1.49 0.32 2.90 2.02 -1.26 -1.35 118.70 121.34 1jmx s GLU 478 Ca -0.12 -0.57 0.03 0.00 0.02 0.00 0.00 54.97 54.33 1jmx s GLU 478 Cb -0.10 -1.37 -0.05 0.00 0.10 0.00 0.00 34.13 32.71 1jmx s GLU 478 CO -0.00 0.29 0.08 0.20 0.02 0.00 0.00 175.26 175.85 1jmx s GLY 479 N -0.16 2.08 -0.11 -1.39 0.00 0.83 -4.32 107.32 104.25 1jmx s GLY 479 Ca 0.01 -1.86 0.01 0.00 0.00 0.00 0.00 44.72 42.88 1jmx s GLY 479 CO 0.01 -1.76 -0.12 -1.58 0.00 0.00 0.00 173.10 169.65 1jmx s HIS 480 N -3.40 1.78 -0.03 1.90 2.46 0.04 -0.83 115.29 117.20 1jmx s HIS 480 Ca 0.35 -0.86 0.03 0.00 0.47 0.00 0.00 55.06 55.05 1jmx s HIS 480 Cb 0.07 -1.34 -0.00 0.00 -0.13 0.00 0.00 32.58 31.18 1jmx s HIS 480 CO 0.15 -0.49 -0.12 1.41 -2.47 0.00 0.00 174.74 173.21 1jmx s MET 481 N 1.26 1.20 -0.15 2.88 0.00 -0.32 -2.41 119.30 121.76 1jmx s MET 481 Ca -0.02 -0.43 0.01 0.00 0.00 0.00 0.00 55.69 55.25 1jmx s MET 481 Cb -0.14 -1.10 0.00 0.00 0.00 0.00 0.00 34.83 33.59 1jmx s MET 481 CO -0.05 0.20 -0.18 0.42 0.00 0.00 0.00 175.02 175.41 1jmx s ILE 482 N 0.01 2.40 -0.35 10.11 1.01 -1.06 -0.52 121.20 132.80 1jmx s ILE 482 Ca -0.01 -0.86 -0.13 0.00 0.00 0.00 0.00 60.65 59.64 1jmx s ILE 482 Cb -0.08 -1.99 -0.01 0.00 0.01 0.00 0.00 42.46 40.39 1jmx s ILE 482 CO 0.01 0.53 0.26 -0.69 0.00 0.00 0.00 174.94 175.05 1jmx s VAL 483 N 0.80 5.27 0.00 2.92 1.01 -0.10 -0.80 120.40 129.51 1jmx s VAL 483 Ca -0.06 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.64 1jmx s VAL 483 Cb -0.15 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.46 1jmx s VAL 483 CO -0.01 -0.08 0.00 0.35 0.00 0.00 0.00 175.10 175.37 1jmx n THR 484 N 5.13 0.00 -1.69 3.92 -2.24 0.79 -1.33 114.28 118.86 1jmx n THR 484 Ca -0.12 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.36 1jmx n THR 484 Cb 0.49 0.00 0.08 0.00 -2.10 0.00 0.00 70.33 68.80 1jmx n THR 484 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1jmx s VAL 485 N -0.45 3.15 0.92 2.28 -7.23 -1.26 -0.46 120.40 117.35 1jmx s VAL 485 Ca 0.00 0.37 -0.14 0.00 -1.81 0.00 0.00 61.98 60.41 1jmx s VAL 485 Cb 0.00 -3.22 0.15 0.00 0.56 0.00 0.00 36.38 33.87 1jmx s VAL 485 CO 0.00 -0.49 1.19 -1.10 -0.31 0.00 0.00 175.10 174.39 1jmx s GLN 486 N -5.25 1.07 -0.03 4.82 1.11 -1.26 -4.70 119.66 115.42 1jmx s GLN 486 Ca 0.60 0.04 -0.01 0.00 0.01 0.00 0.00 55.36 56.00 1jmx s GLN 486 Cb -0.13 -1.85 0.03 0.00 -1.01 0.00 0.00 33.01 30.04 1jmx s GLN 486 CO 0.53 -2.20 0.05 -0.98 0.01 0.00 0.00 175.29 172.71 1jmx s ARG 487 N -5.52 0.00 0.06 2.91 1.70 -1.26 -5.06 118.95 111.78 1jmx s ARG 487 Ca 0.66 0.20 0.22 0.00 -0.47 0.00 0.00 55.73 56.34 1jmx s ARG 487 Cb -0.11 -0.19 -0.19 0.00 -0.57 0.00 0.00 34.95 33.90 1jmx s ARG 487 CO 0.52 -0.14 0.71 0.91 -1.08 0.00 0.00 175.30 176.22 1jmx n TRP 488 N 3.99 0.45 -3.19 5.89 8.01 -1.26 -4.77 117.44 126.56 1jmx n TRP 488 Ca -0.25 0.13 -0.44 0.00 -1.31 0.00 0.00 57.50 55.64 1jmx n TRP 488 Cb 0.52 -0.74 -0.06 0.00 -2.01 0.00 0.00 31.31 29.02 1jmx n TRP 488 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.69 177.89 1jmx s ASN 489 N -4.97 6.22 -0.51 -0.99 3.04 -1.26 -4.97 114.94 111.49 1jmx s ASN 489 Ca -0.05 -0.94 0.05 0.00 0.04 0.00 0.00 52.86 51.96 1jmx s ASN 489 Cb 0.12 -2.28 0.18 0.00 -1.54 0.00 0.00 41.25 37.73 1jmx s ASN 489 CO 0.85 -0.85 0.43 0.59 -3.04 0.00 0.00 177.10 175.09 1jmx n ASN 490 N 6.03 0.86 -4.68 -4.21 5.03 -1.26 -5.12 115.26 111.91 1jmx n ASN 490 Ca -0.07 -2.72 -0.29 0.00 0.87 0.00 0.00 54.58 52.38 1jmx n ASN 490 Cb 0.45 -0.63 0.17 0.00 -1.02 0.00 0.00 39.78 38.76 1jmx n ASN 490 CO 0.00 0.00 0.00 -2.84 -1.83 0.00 0.00 177.26 172.59 1jmx s PRO 491 N -0.68 0.45 0.46 3.52 0.02 -1.26 -4.93 135.00 132.58 1jmx s PRO 491 Ca 0.31 0.51 0.19 0.00 0.02 0.00 0.00 61.00 62.03 1jmx s PRO 491 Cb 0.04 -1.74 1.16 0.00 0.02 0.00 0.00 34.50 33.98 1jmx s PRO 491 CO -0.17 -2.72 1.95 -1.35 -0.33 0.00 0.00 177.00 174.38 1jmx h PRO 492 N -1.88 0.27 -5.51 5.54 0.11 -1.99 -3.39 132.00 125.15 1jmx h PRO 492 Ca -0.54 -0.02 -0.67 0.00 0.11 0.00 0.00 66.00 64.88 1jmx h PRO 492 Cb 1.33 -0.06 -0.28 0.00 0.11 0.00 0.00 31.00 32.10 1jmx h PRO 492 CO 0.58 0.18 -0.80 -0.51 -0.21 0.00 0.00 178.00 177.24 1jmx s LEU 493 N -9.16 2.53 0.00 2.35 1.43 -1.26 -4.80 118.68 109.78 1jmx s LEU 493 Ca -0.07 -0.37 0.18 0.00 -1.03 0.00 0.00 54.13 52.84 1jmx s LEU 493 Cb 0.21 -1.54 1.07 0.00 0.03 0.00 0.00 46.19 45.96 1jmx s LEU 493 CO 0.75 0.19 1.47 -0.81 0.23 0.00 0.00 176.35 178.19