#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmx n ALA 2 N 0.00 2.65 -3.53 3.13 0.00 -1.26 -5.06 120.51 116.45 2jmx n ALA 2 Ca 0.00 -2.41 -0.21 0.00 0.00 0.00 0.00 53.44 50.82 2jmx n ALA 2 Cb 0.00 -0.87 -0.14 0.00 0.00 0.00 0.00 19.45 18.44 2jmx n ALA 2 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2jmx s LYS 3 N -3.01 0.16 0.14 0.00 2.36 -1.26 -5.15 119.74 112.98 2jmx s LYS 3 Ca 0.23 0.06 0.02 0.00 -2.55 0.00 0.00 55.97 53.74 2jmx s LYS 3 Cb 0.35 -1.37 -0.04 0.00 -1.05 0.00 0.00 37.83 35.71 2jmx s LYS 3 CO -0.06 -0.70 -0.03 -1.17 1.55 0.00 0.00 175.35 174.94 2jmx s LEU 4 N 2.26 2.30 -0.33 5.43 2.96 -1.26 -5.08 118.68 124.95 2jmx s LEU 4 Ca 0.06 -1.09 0.16 0.00 -0.22 0.00 0.00 54.13 53.03 2jmx s LEU 4 Cb -0.16 -0.08 0.46 0.00 0.50 0.00 0.00 46.19 46.91 2jmx s LEU 4 CO -0.13 -0.51 0.99 0.55 -1.32 0.00 0.00 176.35 175.93 2jmx n VAL 5 N -0.16 1.24 -4.25 1.68 3.14 -1.26 -5.09 118.33 113.64 2jmx n VAL 5 Ca -0.09 -3.34 -0.19 0.00 -2.96 0.00 0.00 64.34 57.76 2jmx n VAL 5 Cb 0.62 0.40 -0.12 0.00 -1.06 0.00 0.00 33.84 33.68 2jmx n VAL 5 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 2jmx s ARG 6 N -3.24 0.87 0.07 1.45 3.00 -1.26 -5.12 118.95 114.72 2jmx s ARG 6 Ca 0.31 -0.88 -0.31 0.00 0.00 0.00 0.00 55.73 54.85 2jmx s ARG 6 Cb 0.44 -0.89 -0.06 0.00 0.00 0.00 0.00 34.95 34.44 2jmx s ARG 6 CO -0.00 0.21 1.23 -1.25 0.00 0.00 0.00 175.30 175.49 2jmx s PRO 7 N -1.50 4.41 1.02 3.54 0.04 -1.26 -5.03 135.00 136.23 2jmx s PRO 7 Ca -0.00 1.82 -0.17 0.00 0.04 0.00 0.00 61.00 62.68 2jmx s PRO 7 Cb -0.09 -3.34 0.25 0.00 0.04 0.00 0.00 34.50 31.36 2jmx s PRO 7 CO 0.02 -0.29 1.10 -0.35 0.04 0.00 0.00 177.00 177.52 2jmx n PRO 8 N 3.97 -2.15 -3.36 0.56 -0.04 -1.26 -5.08 135.00 127.64 2jmx n PRO 8 Ca 0.09 -1.73 -0.11 0.00 -0.04 0.00 0.00 63.50 61.71 2jmx n PRO 8 Cb 0.46 -1.39 -0.08 0.00 -0.04 0.00 0.00 33.50 32.45 2jmx n PRO 8 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2jmx s VAL 9 N -3.21 -0.56 0.02 0.52 -7.23 -1.26 -5.04 120.40 103.64 2jmx s VAL 9 Ca 0.67 -0.18 -0.02 0.00 -1.81 0.00 0.00 61.98 60.64 2jmx s VAL 9 Cb -0.04 -0.86 -0.01 0.00 0.56 0.00 0.00 36.38 36.02 2jmx s VAL 9 CO 0.49 -0.21 -0.05 0.00 -0.31 0.00 0.00 175.10 175.02 2jmx n GLN 10 N 5.35 0.08 -4.62 4.82 6.02 -1.26 -5.07 117.38 122.70 2jmx n GLN 10 Ca -0.03 0.03 -0.27 0.00 -0.01 0.00 0.00 57.00 56.73 2jmx n GLN 10 Cb 0.49 -0.64 -0.14 0.00 1.02 0.00 0.00 30.24 30.97 2jmx n GLN 10 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.06 174.55 2jmx s ILE 11 N -2.11 1.84 -0.42 5.09 1.10 -1.26 -4.94 121.20 120.50 2jmx s ILE 11 Ca -0.05 -1.35 0.06 0.00 -0.51 0.00 0.00 60.65 58.79 2jmx s ILE 11 Cb 0.01 -1.61 0.17 0.00 0.15 0.00 0.00 42.46 41.19 2jmx s ILE 11 CO 0.07 0.19 0.53 -0.72 -2.11 0.00 0.00 174.94 172.90 2jmx s TYR 12 N -0.88 -0.87 0.00 3.50 1.13 -1.26 -5.10 117.35 113.87 2jmx s TYR 12 Ca 0.09 -0.63 0.00 0.00 -1.41 0.00 0.00 57.07 55.12 2jmx s TYR 12 Cb -0.09 -0.08 0.00 0.00 -1.10 0.00 0.00 41.96 40.69 2jmx s TYR 12 CO 0.03 -1.09 0.00 0.41 -2.51 0.00 0.00 175.55 172.39 2jmx n GLY 13 N 3.81 3.40 0.48 5.49 0.00 -1.26 -4.89 105.19 112.21 2jmx n GLY 13 Ca 0.15 -0.41 0.30 0.00 0.00 0.00 0.00 46.02 46.06 2jmx n GLY 13 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2jmx h ILE 14 N 0.00 0.43 -0.74 -0.61 -0.00 -2.02 0.32 117.51 114.88 2jmx h ILE 14 Ca 0.00 -0.06 0.12 0.00 -0.00 0.00 0.00 64.86 64.92 2jmx h ILE 14 Cb 0.00 0.24 -0.05 0.00 -0.00 0.00 0.00 36.82 37.01 2jmx h ILE 14 CO 0.00 0.03 0.49 -0.08 -0.00 0.00 0.00 178.15 178.59 2jmx h GLU 15 N 0.17 0.53 -0.77 2.19 4.81 -1.97 -0.02 114.58 119.53 2jmx h GLU 15 Ca 0.60 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.83 2jmx h GLU 15 Cb 2.00 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 31.21 2jmx h GLU 15 CO -0.16 0.35 0.50 0.78 -0.73 0.00 0.00 179.01 179.75 2jmx h GLY 16 N 0.55 1.07 1.47 1.92 0.00 -0.65 -1.30 103.07 106.13 2jmx h GLY 16 Ca 0.35 -0.37 0.07 0.00 0.00 0.00 0.00 47.33 47.38 2jmx h GLY 16 CO -0.12 0.33 0.19 3.21 0.00 0.00 0.00 176.54 180.15 2jmx h ARG 17 N 0.95 0.00 -0.93 4.80 3.08 -1.09 -1.34 114.38 119.86 2jmx h ARG 17 Ca 0.30 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.48 2jmx h ARG 17 Cb 0.02 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 29.99 2jmx h ARG 17 CO -0.08 0.00 0.59 1.88 -1.07 0.00 0.00 179.97 181.29 2jmx h TYR 18 N 0.00 0.95 -0.19 3.04 -1.99 -1.29 1.04 116.97 118.53 2jmx h TYR 18 Ca 0.12 0.03 -0.22 0.00 2.00 0.00 0.00 58.73 60.66 2jmx h TYR 18 Cb 0.50 -0.30 0.01 0.00 2.00 0.00 0.00 36.73 38.94 2jmx h TYR 18 CO 0.00 0.37 -0.73 0.00 -0.00 0.00 0.00 178.16 177.80 2jmx h ALA 19 N 1.58 0.35 -0.02 3.88 0.00 -1.39 -2.23 119.26 121.42 2jmx h ALA 19 Ca 0.46 -0.58 -0.19 0.00 0.00 0.00 0.00 54.91 54.61 2jmx h ALA 19 Cb 0.61 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2jmx h ALA 19 CO -0.23 0.68 -0.80 1.79 0.00 0.00 0.00 179.25 180.70 2jmx h THR 20 N 0.57 1.45 0.00 0.00 1.35 -1.11 0.24 112.91 115.41 2jmx h THR 20 Ca -0.04 -2.40 0.00 0.00 -0.55 0.00 0.00 66.41 63.43 2jmx h THR 20 Cb 1.35 2.31 0.00 0.00 -1.73 0.00 0.00 68.15 70.08 2jmx h THR 20 CO 0.15 0.70 0.00 0.00 -0.25 0.00 0.00 175.52 176.13 2jmx h ALA 21 N 1.00 1.00 0.00 6.62 0.00 0.10 0.25 119.26 128.24 2jmx h ALA 21 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 54.91 54.44 2jmx h ALA 21 Cb 1.39 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 19.11 2jmx h ALA 21 CO 0.13 0.00 -2.45 -0.11 0.00 0.00 0.00 179.25 176.82 2jmx n LEU 22 N -2.53 2.22 0.18 0.00 7.94 -0.84 -4.22 117.00 119.74 2jmx n LEU 22 Ca 0.03 0.22 0.14 0.00 -1.11 0.00 0.00 56.01 55.30 2jmx n LEU 22 Cb 0.36 -0.86 0.51 0.00 0.53 0.00 0.00 43.42 43.97 2jmx n LEU 22 CO 0.27 0.66 0.90 0.10 -1.11 0.00 0.00 177.39 178.20 2jmx h TYR 23 N -0.73 0.00 -0.99 1.96 -0.00 -0.61 -3.03 116.97 113.57 2jmx h TYR 23 Ca -0.65 0.00 0.23 0.00 0.00 0.00 0.00 58.73 58.31 2jmx h TYR 23 Cb 1.68 0.00 -0.09 0.00 0.00 0.00 0.00 36.73 38.32 2jmx h TYR 23 CO -0.05 0.00 0.63 1.03 -0.00 0.00 0.00 178.16 179.78 2jmx h SER 24 N 0.00 0.52 0.20 0.10 0.87 -0.67 1.34 113.55 115.92 2jmx h SER 24 Ca 0.00 0.08 -0.31 0.00 -1.23 0.00 0.00 61.79 60.33 2jmx h SER 24 Cb 0.51 -0.01 0.03 0.00 -0.44 0.00 0.00 62.40 62.48 2jmx h SER 24 CO 0.00 0.16 -1.31 0.00 -0.53 0.00 0.00 176.83 175.15 2jmx h ALA 25 N 1.62 -0.04 -0.72 6.23 0.00 -1.77 -3.22 119.26 121.37 2jmx h ALA 25 Ca 0.56 -0.80 0.02 0.00 0.00 0.00 0.00 54.91 54.68 2jmx h ALA 25 Cb 1.26 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 19.13 2jmx h ALA 25 CO -0.28 0.71 0.48 0.00 0.00 0.00 0.00 179.25 180.15 2jmx h ALA 26 N 0.28 1.53 -0.93 0.00 0.00 0.06 -1.87 119.26 118.33 2jmx h ALA 26 Ca -0.20 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.74 2jmx h ALA 26 Cb 1.99 -0.27 -0.07 0.00 0.00 0.00 0.00 17.79 19.44 2jmx h ALA 26 CO 0.25 0.41 0.59 0.66 0.00 0.00 0.00 179.25 181.16 2jmx h SER 27 N 0.93 0.92 -0.68 0.00 4.64 0.14 0.89 113.55 120.39 2jmx h SER 27 Ca 0.28 0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.57 2jmx h SER 27 Cb -0.03 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 61.85 2jmx h SER 27 CO -0.07 0.57 0.27 0.11 -0.87 0.00 0.00 176.83 176.84 2jmx h LYS 28 N 1.04 1.04 -0.01 4.77 6.56 -1.40 -2.33 116.57 126.24 2jmx h LYS 28 Ca 0.42 -0.18 0.00 0.00 -1.06 0.00 0.00 60.65 59.82 2jmx h LYS 28 Cb 0.23 -0.17 0.00 0.00 -0.57 0.00 0.00 32.23 31.71 2jmx h LYS 28 CO -0.19 0.86 -0.18 1.04 -2.06 0.00 0.00 179.45 178.92 2jmx n GLN 29 N -4.29 1.05 -3.06 3.15 6.02 -0.29 -4.95 117.38 115.02 2jmx n GLN 29 Ca 0.06 -0.60 -0.13 0.00 -0.01 0.00 0.00 57.00 56.32 2jmx n GLN 29 Cb 0.19 -1.49 0.05 0.00 1.02 0.00 0.00 30.24 30.01 2jmx n GLN 29 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2jmx n ASN 30 N -0.45 -4.01 -0.93 1.08 5.15 0.29 -4.95 115.26 111.46 2jmx n ASN 30 Ca 0.14 -0.31 0.07 0.00 -0.60 0.00 0.00 54.58 53.88 2jmx n ASN 30 Cb 0.35 -3.06 0.23 0.00 -0.53 0.00 0.00 39.78 36.77 2jmx n ASN 30 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2jmx n LYS 31 N -2.98 3.07 -0.26 1.20 5.02 -0.19 -4.64 118.16 119.38 2jmx n LYS 31 Ca -0.03 -2.50 0.28 0.00 -2.02 0.00 0.00 58.31 54.04 2jmx n LYS 31 Cb 0.55 -1.59 0.65 0.00 -0.02 0.00 0.00 35.03 34.61 2jmx n LYS 31 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2jmx h LEU 32 N 2.41 0.17 -0.30 -0.35 3.38 -1.92 0.38 115.31 119.08 2jmx h LEU 32 Ca 0.00 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 2jmx h LEU 32 Cb 1.12 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 2jmx h LEU 32 CO 0.12 0.04 -0.19 -0.08 0.09 0.00 0.00 178.44 178.42 2jmx h GLU 33 N 0.16 0.66 0.00 1.13 4.81 -1.97 1.11 114.58 120.47 2jmx h GLU 33 Ca 0.51 -0.31 -0.02 0.00 -0.13 0.00 0.00 59.36 59.41 2jmx h GLU 33 Cb 1.74 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 31.11 2jmx h GLU 33 CO -0.10 0.90 -0.11 1.96 -0.73 0.00 0.00 179.01 180.93 2jmx h GLN 34 N 0.40 0.00 0.01 1.92 1.08 -0.65 -2.09 115.11 115.78 2jmx h GLN 34 Ca 0.06 0.00 -0.39 0.00 -1.45 0.00 0.00 58.65 56.87 2jmx h GLN 34 Cb 0.74 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 28.10 2jmx h GLN 34 CO 0.05 0.11 -2.46 0.28 -0.95 0.00 0.00 178.83 175.87 2jmx n VAL 35 N -3.61 1.50 0.08 -0.54 0.31 -0.42 -3.57 118.33 112.08 2jmx n VAL 35 Ca -0.02 -0.58 -0.00 0.00 -0.01 0.00 0.00 64.34 63.73 2jmx n VAL 35 Cb 0.24 -1.40 0.29 0.00 -0.91 0.00 0.00 33.84 32.06 2jmx n VAL 35 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2jmx h GLU 36 N 0.00 0.30 0.15 5.55 4.81 0.13 -1.14 114.58 124.38 2jmx h GLU 36 Ca -0.57 -0.10 -0.34 0.00 -0.13 0.00 0.00 59.36 58.22 2jmx h GLU 36 Cb 1.92 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 31.27 2jmx h GLU 36 CO -0.08 0.53 -1.71 0.87 -0.73 0.00 0.00 179.01 177.89 2jmx h LYS 37 N 0.27 0.32 -0.43 1.92 1.57 -1.55 -3.28 116.57 115.39 2jmx h LYS 37 Ca 0.04 -0.55 -0.13 0.00 -1.87 0.00 0.00 60.65 58.14 2jmx h LYS 37 Cb 0.58 0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.09 2jmx h LYS 37 CO 0.04 1.21 -0.25 0.93 -0.57 0.00 0.00 179.45 180.81 2jmx h GLU 38 N 0.09 0.93 -0.78 3.15 4.39 -1.60 -2.84 114.58 117.91 2jmx h GLU 38 Ca -0.32 -0.43 0.10 0.00 0.34 0.00 0.00 59.36 59.06 2jmx h GLU 38 Cb 2.07 -0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 30.65 2jmx h GLU 38 CO 0.16 1.09 0.51 -0.07 -1.16 0.00 0.00 179.01 179.54 2jmx h LEU 39 N 0.76 0.61 -1.32 1.33 3.38 -1.34 -0.76 115.31 117.97 2jmx h LEU 39 Ca 0.09 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.16 2jmx h LEU 39 Cb 0.83 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.42 2jmx h LEU 39 CO 0.07 0.36 0.52 0.25 0.09 0.00 0.00 178.44 179.73 2jmx h LEU 40 N 0.67 0.70 -1.10 1.67 6.46 -1.55 -1.38 115.31 120.79 2jmx h LEU 40 Ca 0.37 0.01 0.06 0.00 -0.12 0.00 0.00 57.88 58.20 2jmx h LEU 40 Cb 0.51 -0.14 -0.06 0.00 -0.73 0.00 0.00 40.66 40.25 2jmx h LEU 40 CO -0.14 0.43 0.61 -0.09 -0.62 0.00 0.00 178.44 178.63 2jmx h ARG 41 N 0.79 1.06 -0.83 1.25 2.43 -1.20 -1.31 114.38 116.57 2jmx h ARG 41 Ca 0.36 -0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.51 2jmx h ARG 41 Cb 0.36 -0.24 -0.05 0.00 -0.42 0.00 0.00 29.97 29.63 2jmx h ARG 41 CO -0.13 0.70 0.55 0.28 -1.51 0.00 0.00 179.97 179.85 2jmx h VAL 42 N 1.09 1.11 -0.10 0.20 2.07 -1.31 -1.78 116.25 117.53 2jmx h VAL 42 Ca 0.40 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 2jmx h VAL 42 Cb 0.17 0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 29.96 2jmx h VAL 42 CO -0.15 0.18 0.04 1.23 0.02 0.00 0.00 177.57 178.89 2jmx h GLY 43 N 1.00 0.16 0.89 2.17 0.00 -1.25 -2.63 103.07 103.41 2jmx h GLY 43 Ca 0.34 -0.09 0.05 0.00 0.00 0.00 0.00 47.33 47.63 2jmx h GLY 43 CO -0.10 0.08 0.61 -1.61 0.00 0.00 0.00 176.54 175.51 2jmx h GLN 44 N 0.00 1.08 -0.96 4.80 5.75 -1.19 0.11 115.11 124.70 2jmx h GLN 44 Ca 0.03 -0.06 0.04 0.00 -0.15 0.00 0.00 58.65 58.51 2jmx h GLN 44 Cb 0.17 -0.24 -0.06 0.00 1.07 0.00 0.00 27.48 28.42 2jmx h GLN 44 CO -0.00 0.71 0.63 0.82 -2.65 0.00 0.00 178.83 178.34 2jmx h ILE 45 N 1.11 1.15 0.04 2.39 2.04 -1.03 0.86 117.51 124.06 2jmx h ILE 45 Ca 0.38 -0.41 -0.23 0.00 1.00 0.00 0.00 64.86 65.60 2jmx h ILE 45 Cb 0.11 -0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 36.03 2jmx h ILE 45 CO -0.13 0.22 -1.01 0.25 0.00 0.00 0.00 178.15 177.47 2jmx h LEU 46 N 1.20 0.43 -0.53 1.44 7.12 -0.94 -3.23 115.31 120.79 2jmx h LEU 46 Ca 0.39 -0.38 -0.12 0.00 0.13 0.00 0.00 57.88 57.91 2jmx h LEU 46 Cb 0.04 -0.13 -0.02 0.00 -0.53 0.00 0.00 40.66 40.02 2jmx h LEU 46 CO -0.13 1.21 -0.57 0.50 -0.13 0.00 0.00 178.44 179.32 2jmx h LYS 47 N 0.15 0.00 -6.55 1.25 3.11 -0.08 -3.37 116.57 111.08 2jmx h LYS 47 Ca -0.09 0.00 -0.59 0.00 -2.81 0.00 0.00 60.65 57.16 2jmx h LYS 47 Cb 1.68 0.00 0.08 0.00 -1.00 0.00 0.00 32.23 32.99 2jmx h LYS 47 CO 0.17 0.57 0.59 0.39 -2.81 0.00 0.00 179.45 178.35 2jmx n GLU 48 N -3.49 1.94 0.07 1.90 -0.58 0.29 -4.79 120.64 115.98 2jmx n GLU 48 Ca 0.00 0.69 -0.05 0.00 -0.42 0.00 0.00 57.16 57.38 2jmx n GLU 48 Cb 0.66 -2.34 0.13 0.00 -0.57 0.00 0.00 31.44 29.32 2jmx n GLU 48 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2jmx h PRO 49 N 4.27 0.32 0.07 3.49 0.13 -1.89 0.89 132.00 139.28 2jmx h PRO 49 Ca -0.45 -0.19 -0.24 0.00 -0.87 0.00 0.00 66.00 64.25 2jmx h PRO 49 Cb 1.28 0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.43 2jmx h PRO 49 CO 0.76 0.77 -1.09 0.87 -0.23 0.00 0.00 178.00 179.09 2jmx h LYS 50 N 0.25 0.24 0.00 0.86 1.57 -1.95 -3.31 116.57 114.23 2jmx h LYS 50 Ca 0.01 -0.35 -0.27 0.00 -1.87 0.00 0.00 60.65 58.17 2jmx h LYS 50 Cb 1.02 0.12 -0.04 0.00 0.08 0.00 0.00 32.23 33.41 2jmx h LYS 50 CO 0.09 1.12 -1.50 1.98 -0.57 0.00 0.00 179.45 180.56 2jmx h MET 51 N 0.10 0.00 -0.71 3.15 4.05 -1.80 -3.35 114.93 116.37 2jmx h MET 51 Ca -0.09 0.00 0.08 0.00 -0.28 0.00 0.00 59.70 59.41 2jmx h MET 51 Cb 1.78 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 32.54 2jmx h MET 51 CO 0.17 0.63 0.46 0.00 0.23 0.00 0.00 176.91 178.41 2jmx h ALA 52 N 1.00 1.78 -0.89 0.39 0.00 0.73 -1.57 119.26 120.70 2jmx h ALA 52 Ca -0.21 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.77 2jmx h ALA 52 Cb 1.94 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 19.51 2jmx h ALA 52 CO 0.09 0.09 0.58 0.00 0.00 0.00 0.00 179.25 180.01 2jmx h ALA 53 N 1.63 1.57 0.16 0.00 0.00 -1.69 -0.05 119.26 120.87 2jmx h ALA 53 Ca 0.31 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 2jmx h ALA 53 Cb 0.35 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2jmx h ALA 53 CO -0.11 0.27 -0.07 0.77 0.00 0.00 0.00 179.25 180.11 2jmx h SER 54 N 0.96 -0.18 -0.23 0.00 0.02 -1.50 0.64 113.55 113.27 2jmx h SER 54 Ca 0.40 -0.36 0.07 0.00 -0.84 0.00 0.00 61.79 61.05 2jmx h SER 54 Cb 0.29 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 2jmx h SER 54 CO -0.16 0.36 0.17 -0.07 -1.14 0.00 0.00 176.83 175.99 2jmx h LEU 55 N -0.81 0.00 0.03 5.07 3.38 -1.31 -2.69 115.31 118.98 2jmx h LEU 55 Ca -0.02 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.61 2jmx h LEU 55 Cb 0.53 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.23 2jmx h LEU 55 CO 0.04 0.00 -2.04 -0.11 0.09 0.00 0.00 178.44 176.41 2jmx n LEU 56 N -4.39 1.47 -4.50 1.67 -0.00 -0.05 -4.96 117.00 106.23 2jmx n LEU 56 Ca 0.02 0.19 -0.38 0.00 -0.00 0.00 0.00 56.01 55.85 2jmx n LEU 56 Cb 0.32 -0.26 0.04 0.00 -0.00 0.00 0.00 43.42 43.51 2jmx n LEU 56 CO 0.34 0.62 0.18 0.59 -0.00 0.00 0.00 177.39 179.12 2jmx n ASN 57 N -3.13 -0.58 -0.20 1.96 4.13 0.22 -4.87 115.26 112.80 2jmx n ASN 57 Ca -0.28 0.76 0.12 0.00 1.68 0.00 0.00 54.58 56.85 2jmx n ASN 57 Cb 1.06 -1.22 0.60 0.00 -1.54 0.00 0.00 39.78 38.68 2jmx n ASN 57 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 2jmx n PRO 58 N -0.27 1.27 -0.03 3.52 -0.04 -1.26 -3.84 135.00 134.34 2jmx n PRO 58 Ca 0.12 -0.40 -0.16 0.00 -0.04 0.00 0.00 63.50 63.03 2jmx n PRO 58 Cb 0.47 -1.39 -0.14 0.00 -0.04 0.00 0.00 33.50 32.40 2jmx n PRO 58 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2jmx n TYR 59 N -0.44 0.92 0.15 0.54 4.01 -1.26 -4.13 117.16 116.94 2jmx n TYR 59 Ca 0.18 0.24 0.18 0.00 -0.16 0.00 0.00 57.90 58.34 2jmx n TYR 59 Cb 0.18 -1.14 0.78 0.00 -0.31 0.00 0.00 39.34 38.86 2jmx n TYR 59 CO 0.00 0.00 0.00 -0.39 -0.46 0.00 0.00 176.86 176.01 2jmx h VAL 60 N 0.03 0.47 -1.57 -0.72 -1.51 -1.79 -3.48 116.25 107.70 2jmx h VAL 60 Ca -0.41 0.00 0.06 0.00 -1.23 0.00 0.00 66.70 65.12 2jmx h VAL 60 Cb 2.03 0.77 -0.02 0.00 -2.13 0.00 0.00 31.29 31.94 2jmx h VAL 60 CO 0.06 0.00 -0.08 0.29 -1.23 0.00 0.00 177.57 176.61 2jmx n LYS 61 N -3.84 -0.46 -0.11 5.19 4.76 -1.26 -2.15 118.16 120.29 2jmx n LYS 61 Ca 0.04 0.30 -0.23 0.00 -2.87 0.00 0.00 58.31 55.55 2jmx n LYS 61 Cb 0.44 -0.56 -0.08 0.00 -1.84 0.00 0.00 35.03 33.00 2jmx n LYS 61 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2jmx n ARG 62 N -1.76 0.49 -0.32 1.97 5.12 -1.26 -3.57 116.66 117.33 2jmx n ARG 62 Ca 0.00 0.21 -0.03 0.00 -1.93 0.00 0.00 57.85 56.10 2jmx n ARG 62 Cb 0.10 -1.32 0.09 0.00 -1.16 0.00 0.00 32.46 30.17 2jmx n ARG 62 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2jmx h SER 63 N -0.84 0.99 -0.32 0.55 4.64 -1.88 0.21 113.55 116.90 2jmx h SER 63 Ca -0.52 -0.02 -0.14 0.00 -0.47 0.00 0.00 61.79 60.63 2jmx h SER 63 Cb 1.43 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2jmx h SER 63 CO -0.31 0.71 -0.36 0.58 -0.87 0.00 0.00 176.83 176.58 2jmx h VAL 64 N 1.17 1.29 -0.51 0.95 2.07 -1.80 -2.99 116.25 116.42 2jmx h VAL 64 Ca 0.32 -1.54 -0.05 0.00 0.82 0.00 0.00 66.70 66.26 2jmx h VAL 64 Cb -0.12 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 2jmx h VAL 64 CO -0.08 0.50 0.12 0.50 0.02 0.00 0.00 177.57 178.63 2jmx h LYS 65 N 0.58 0.78 -0.95 1.57 1.63 -0.90 -2.43 116.57 116.85 2jmx h LYS 65 Ca 0.05 -0.16 0.04 0.00 -0.85 0.00 0.00 60.65 59.73 2jmx h LYS 65 Cb 0.95 -0.12 -0.06 0.00 -0.60 0.00 0.00 32.23 32.40 2jmx h LYS 65 CO 0.09 0.71 0.62 0.28 -3.45 0.00 0.00 179.45 177.70 2jmx h VAL 66 N 0.75 1.15 -0.54 2.00 2.07 -0.47 -1.48 116.25 119.74 2jmx h VAL 66 Ca 0.17 -0.41 -0.10 0.00 0.82 0.00 0.00 66.70 67.18 2jmx h VAL 66 Cb 0.29 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 29.89 2jmx h VAL 66 CO -0.00 0.22 -0.06 0.11 0.02 0.00 0.00 177.57 177.86 2jmx h LYS 67 N 1.19 0.99 -0.72 1.57 1.57 -1.34 -2.77 116.57 117.06 2jmx h LYS 67 Ca 0.38 -0.34 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 2jmx h LYS 67 Cb 0.03 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.22 2jmx h LYS 67 CO -0.13 1.02 0.48 0.77 -0.57 0.00 0.00 179.45 181.02 2jmx h SER 68 N 0.87 0.81 -0.52 0.86 0.02 -0.91 -2.04 113.55 112.63 2jmx h SER 68 Ca 0.15 -0.02 0.02 0.00 -0.84 0.00 0.00 61.79 61.10 2jmx h SER 68 Cb 0.61 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 2jmx h SER 68 CO 0.04 0.58 0.31 -0.07 -1.14 0.00 0.00 176.83 176.55 2jmx h LEU 69 N 0.95 0.50 -0.53 5.07 4.07 -1.01 0.34 115.31 124.71 2jmx h LEU 69 Ca 0.27 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 58.19 2jmx h LEU 69 Cb -0.07 -0.10 -0.02 0.00 1.08 0.00 0.00 40.66 41.55 2jmx h LEU 69 CO -0.06 0.35 0.14 0.28 -1.08 0.00 0.00 178.44 178.07 2jmx h SER 70 N 0.62 0.80 1.01 -0.43 0.02 -1.36 0.48 113.55 114.69 2jmx h SER 70 Ca 0.21 -0.23 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2jmx h SER 70 Cb 0.02 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.35 2jmx h SER 70 CO -0.10 0.82 -0.02 0.44 -1.14 0.00 0.00 176.83 176.83 2jmx h ASP 71 N 0.74 0.00 0.08 3.07 3.32 -0.81 -1.24 116.42 121.58 2jmx h ASP 71 Ca 0.17 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.94 2jmx h ASP 71 Cb 0.33 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 2jmx h ASP 71 CO 0.00 0.02 -1.49 -0.03 -1.72 0.00 0.00 179.24 176.02 2jmx h MET 72 N 0.00 0.17 -0.81 3.56 4.05 0.32 -3.30 114.93 118.92 2jmx h MET 72 Ca -0.00 -0.29 0.08 0.00 -0.28 0.00 0.00 59.70 59.21 2jmx h MET 72 Cb 0.53 0.11 -0.05 0.00 -0.80 0.00 0.00 31.60 31.38 2jmx h MET 72 CO 0.00 1.14 0.53 1.15 0.23 0.00 0.00 176.91 179.96 2jmx h THR 73 N -0.43 1.01 -0.93 -0.77 2.02 0.03 0.73 112.91 114.57 2jmx h THR 73 Ca -0.34 -0.29 0.04 0.00 0.77 0.00 0.00 66.41 66.59 2jmx h THR 73 Cb 1.68 0.10 -0.05 0.00 -1.74 0.00 0.00 68.15 68.14 2jmx h THR 73 CO -0.02 0.15 0.61 0.00 0.37 0.00 0.00 175.52 176.63 2jmx h ALA 74 N 1.57 1.41 0.09 6.16 0.00 -1.34 -1.67 119.26 125.49 2jmx h ALA 74 Ca 0.36 -0.04 -0.32 0.00 0.00 0.00 0.00 54.91 54.90 2jmx h ALA 74 Cb 0.31 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2jmx h ALA 74 CO -0.13 0.50 -1.70 0.87 0.00 0.00 0.00 179.25 178.78 2jmx h LYS 75 N 1.16 0.19 0.00 0.00 1.79 -1.24 -3.32 116.57 115.15 2jmx h LYS 75 Ca 0.37 -0.33 0.00 0.00 -2.18 0.00 0.00 60.65 58.51 2jmx h LYS 75 Cb 0.02 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 30.79 2jmx h LYS 75 CO -0.11 0.99 0.00 1.49 -1.08 0.00 0.00 179.45 180.74 2jmx h GLU 76 N 0.05 0.00 -5.14 3.15 4.57 0.67 -3.46 114.58 114.43 2jmx h GLU 76 Ca -0.30 0.00 -0.32 0.00 -1.18 0.00 0.00 59.36 57.56 2jmx h GLU 76 Cb 2.02 0.00 0.13 0.00 -0.16 0.00 0.00 28.75 30.74 2jmx h GLU 76 CO 0.12 0.00 -0.61 1.17 -1.18 0.00 0.00 179.01 178.51 2jmx n LYS 77 N -3.02 -6.36 -0.06 1.92 4.81 -0.65 -4.99 118.16 109.81 2jmx n LYS 77 Ca -0.02 0.72 -0.06 0.00 -0.87 0.00 0.00 58.31 58.08 2jmx n LYS 77 Cb 0.14 -5.39 0.06 0.00 0.02 0.00 0.00 35.03 29.86 2jmx n LYS 77 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2jmx n PHE 78 N -4.25 -2.17 -3.20 5.64 3.72 -1.24 -5.04 117.46 110.91 2jmx n PHE 78 Ca -0.10 -0.15 0.00 0.00 -0.05 0.00 0.00 57.45 57.15 2jmx n PHE 78 Cb 0.59 -0.29 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 2jmx n PHE 78 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2jmx n SER 79 N -3.16 0.61 0.00 4.37 3.41 -1.26 -4.98 113.62 112.61 2jmx n SER 79 Ca 0.03 -0.90 0.13 0.00 -0.26 0.00 0.00 58.87 57.87 2jmx n SER 79 Cb 0.12 0.00 0.69 0.00 -0.26 0.00 0.00 64.21 64.76 2jmx n SER 79 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2jmx n PRO 80 N -0.62 0.54 -0.08 4.33 -0.04 -1.26 -3.20 135.00 134.66 2jmx n PRO 80 Ca 0.00 0.03 0.07 0.00 -0.04 0.00 0.00 63.50 63.56 2jmx n PRO 80 Cb 0.00 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.05 2jmx n PRO 80 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2jmx n LEU 81 N -1.17 2.03 -0.04 1.53 4.77 -1.26 -4.70 117.00 118.16 2jmx n LEU 81 Ca 0.15 -2.61 0.02 0.00 -0.03 0.00 0.00 56.01 53.54 2jmx n LEU 81 Cb 0.16 -0.29 0.02 0.00 -2.33 0.00 0.00 43.42 40.98 2jmx n LEU 81 CO 0.17 0.61 0.44 0.41 -1.33 0.00 0.00 177.39 177.70 2jmx n THR 82 N -1.08 0.87 -1.80 -5.08 -1.04 -1.19 -4.66 114.28 100.29 2jmx n THR 82 Ca 0.11 -0.93 -0.19 0.00 -2.04 0.00 0.00 64.05 61.00 2jmx n THR 82 Cb 0.55 0.49 0.08 0.00 -1.82 0.00 0.00 70.33 69.63 2jmx n THR 82 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2jmx n SER 83 N -0.51 4.57 0.15 8.00 2.88 -1.26 -4.08 113.62 123.38 2jmx n SER 83 Ca 0.02 -3.78 0.00 0.00 -1.33 0.00 0.00 58.87 53.78 2jmx n SER 83 Cb 0.39 -0.49 0.00 0.00 -0.75 0.00 0.00 64.21 63.36 2jmx n SER 83 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2jmx n ASN 84 N -0.85 -0.96 0.22 -3.46 3.02 -1.26 -4.79 115.26 107.18 2jmx n ASN 84 Ca 0.42 0.55 0.15 0.00 -0.03 0.00 0.00 54.58 55.66 2jmx n ASN 84 Cb 0.90 1.08 0.79 0.00 -0.61 0.00 0.00 39.78 41.94 2jmx n ASN 84 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2jmx h LEU 85 N 0.00 0.00 -1.21 3.41 5.85 -1.83 -0.68 115.31 120.86 2jmx h LEU 85 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2jmx h LEU 85 Cb 0.00 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 2jmx h LEU 85 CO 0.00 0.00 0.51 -0.29 -0.34 0.00 0.00 178.44 178.32 2jmx h ILE 86 N 0.00 1.21 -0.10 4.05 2.10 -1.87 -2.09 117.51 120.81 2jmx h ILE 86 Ca 0.06 -0.40 -0.02 0.00 1.08 0.00 0.00 64.86 65.58 2jmx h ILE 86 Cb 0.29 0.07 -0.00 0.00 -1.09 0.00 0.00 36.82 36.08 2jmx h ILE 86 CO -0.00 0.20 -0.01 0.78 -1.08 0.00 0.00 178.15 178.04 2jmx h ASN 87 N 1.07 0.18 -1.00 2.19 4.21 -1.44 -2.84 115.58 117.96 2jmx h ASN 87 Ca 0.29 -0.34 0.20 0.00 1.21 0.00 0.00 56.30 57.65 2jmx h ASN 87 Cb -0.10 -0.05 -0.11 0.00 -1.12 0.00 0.00 38.32 36.94 2jmx h ASN 87 CO -0.06 0.48 0.60 -0.07 -1.29 0.00 0.00 177.43 177.10 2jmx h LEU 88 N -0.12 0.76 -0.76 1.61 3.38 -1.36 0.77 115.31 119.59 2jmx h LEU 88 Ca 0.03 0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 2jmx h LEU 88 Cb 0.40 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2jmx h LEU 88 CO 0.01 0.25 0.24 -0.07 0.09 0.00 0.00 178.44 178.95 2jmx h LEU 89 N 0.73 1.10 -3.69 1.67 3.38 -1.21 -2.73 115.31 114.56 2jmx h LEU 89 Ca 0.59 -0.21 -0.34 0.00 0.09 0.00 0.00 57.88 58.01 2jmx h LEU 89 Cb 0.94 -0.29 -0.20 0.00 0.09 0.00 0.00 40.66 41.20 2jmx h LEU 89 CO -0.40 1.01 0.30 0.00 0.09 0.00 0.00 178.44 179.44 2jmx n ALA 90 N -2.45 4.92 -0.13 1.53 0.00 0.36 -1.16 120.51 123.59 2jmx n ALA 90 Ca 0.06 -2.95 -0.23 0.00 0.00 0.00 0.00 53.44 50.32 2jmx n ALA 90 Cb 0.23 -1.11 -0.10 0.00 0.00 0.00 0.00 19.45 18.47 2jmx n ALA 90 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2jmx n GLU 91 N -1.05 0.57 -0.67 0.00 2.13 0.24 -4.27 120.64 117.60 2jmx n GLU 91 Ca 0.46 0.20 0.01 0.00 0.66 0.00 0.00 57.16 58.49 2jmx n GLU 91 Cb 1.37 -1.45 0.20 0.00 0.27 0.00 0.00 31.44 31.83 2jmx n GLU 91 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2jmx n ASN 92 N -3.75 2.35 -1.28 4.31 3.02 -1.25 -4.85 115.26 113.80 2jmx n ASN 92 Ca -0.47 -3.71 -0.01 0.00 -0.03 0.00 0.00 54.58 50.36 2jmx n ASN 92 Cb 0.90 -0.58 0.01 0.00 -0.61 0.00 0.00 39.78 39.49 2jmx n ASN 92 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jmx n GLY 93 N -1.10 0.46 1.50 7.41 0.00 -1.26 -4.99 105.19 107.22 2jmx n GLY 93 Ca 0.27 -0.39 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 2jmx n GLY 93 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2jmx n ARG 94 N -1.32 2.27 -0.97 1.61 0.63 -0.31 -4.63 116.66 113.94 2jmx n ARG 94 Ca -0.02 -3.38 -0.10 0.00 -0.92 0.00 0.00 57.85 53.43 2jmx n ARG 94 Cb 0.51 -1.97 0.23 0.00 0.45 0.00 0.00 32.46 31.68 2jmx n ARG 94 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2jmx n LEU 95 N -1.03 5.50 -0.07 6.15 4.77 -1.19 -3.91 117.00 127.22 2jmx n LEU 95 Ca 0.40 -3.51 -0.15 0.00 -0.03 0.00 0.00 56.01 52.73 2jmx n LEU 95 Cb 1.01 -0.73 -0.05 0.00 -2.33 0.00 0.00 43.42 41.32 2jmx n LEU 95 CO 0.31 1.02 -0.88 0.35 -1.33 0.00 0.00 177.39 176.86 2jmx n THR 96 N -0.82 1.11 -1.40 -5.08 -2.24 -1.26 -4.58 114.28 100.00 2jmx n THR 96 Ca 0.43 -0.08 -0.29 0.00 -2.27 0.00 0.00 64.05 61.84 2jmx n THR 96 Cb 1.33 -1.85 0.11 0.00 -2.10 0.00 0.00 70.33 67.82 2jmx n THR 96 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2jmx n ASN 97 N -3.89 6.01 0.10 3.42 3.02 -1.26 -4.67 115.26 117.99 2jmx n ASN 97 Ca -0.26 -3.74 -0.01 0.00 -0.03 0.00 0.00 54.58 50.53 2jmx n ASN 97 Cb 0.61 -0.84 0.24 0.00 -0.61 0.00 0.00 39.78 39.18 2jmx n ASN 97 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jmx h THR 98 N 1.14 1.30 -0.36 3.41 1.03 -1.81 -3.11 112.91 114.52 2jmx h THR 98 Ca 0.56 -1.48 -0.07 0.00 -0.01 0.00 0.00 66.41 65.40 2jmx h THR 98 Cb 1.45 1.68 -0.02 0.00 -1.07 0.00 0.00 68.15 70.19 2jmx h THR 98 CO 1.28 0.44 -0.08 1.55 -0.01 0.00 0.00 175.52 178.70 2jmx h PRO 99 N 0.18 0.60 -0.78 0.00 0.13 -1.93 -2.55 132.00 127.66 2jmx h PRO 99 Ca 0.02 -0.17 0.06 0.00 -0.87 0.00 0.00 66.00 65.04 2jmx h PRO 99 Cb 0.79 -0.07 -0.05 0.00 0.13 0.00 0.00 31.00 31.80 2jmx h PRO 99 CO 0.06 0.68 0.51 0.00 -0.23 0.00 0.00 178.00 179.02 2jmx h ALA 100 N 1.36 1.64 -0.65 -0.56 0.00 -1.91 -1.55 119.26 117.58 2jmx h ALA 100 Ca 0.10 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2jmx h ALA 100 Cb 0.48 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2jmx h ALA 100 CO 0.03 0.24 0.11 0.28 0.00 0.00 0.00 179.25 179.91 2jmx h VAL 101 N 0.84 1.26 -0.68 0.00 2.07 -1.55 -2.52 116.25 115.68 2jmx h VAL 101 Ca 0.33 -1.01 -0.07 0.00 0.82 0.00 0.00 66.70 66.77 2jmx h VAL 101 Cb 0.23 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 2jmx h VAL 101 CO -0.11 0.38 0.14 0.40 0.02 0.00 0.00 177.57 178.40 2jmx h ILE 102 N 0.98 1.26 -0.44 4.57 2.04 -1.25 -2.75 117.51 121.93 2jmx h ILE 102 Ca 0.20 -1.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.06 2jmx h ILE 102 Cb 0.42 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 2jmx h ILE 102 CO 0.01 0.38 0.27 0.77 0.00 0.00 0.00 178.15 179.58 2jmx h SER 103 N 1.04 0.52 -0.59 1.72 4.64 -1.16 -1.84 113.55 117.88 2jmx h SER 103 Ca 0.21 -0.05 0.08 0.00 -0.47 0.00 0.00 61.79 61.56 2jmx h SER 103 Cb 0.40 -0.13 -0.04 0.00 -0.31 0.00 0.00 62.40 62.33 2jmx h SER 103 CO 0.01 0.42 0.39 0.00 -0.87 0.00 0.00 176.83 176.78 2jmx h ALA 104 N 1.13 1.91 -0.90 5.18 0.00 -1.26 -1.26 119.26 124.06 2jmx h ALA 104 Ca 0.16 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.15 2jmx h ALA 104 Cb -0.02 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 17.59 2jmx h ALA 104 CO -0.03 -0.03 0.58 0.35 0.00 0.00 0.00 179.25 180.12 2jmx h PHE 105 N 0.49 0.98 0.00 0.00 3.04 -1.04 0.55 116.94 120.96 2jmx h PHE 105 Ca 0.26 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.24 2jmx h PHE 105 Cb 0.40 -0.32 0.00 0.00 2.56 0.00 0.00 35.95 38.60 2jmx h PHE 105 CO -0.00 0.45 0.00 0.77 -2.02 0.00 0.00 178.31 177.51 2jmx h SER 106 N 0.91 0.00 0.34 0.41 0.02 -1.22 -2.15 113.55 111.86 2jmx h SER 106 Ca 0.42 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 61.04 2jmx h SER 106 Cb 0.39 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.90 2jmx h SER 106 CO -0.18 0.00 -1.80 0.74 -1.14 0.00 0.00 176.83 174.45 2jmx h THR 107 N 0.00 0.79 -0.03 -2.27 2.02 -0.96 -3.35 112.91 109.12 2jmx h THR 107 Ca 0.00 -2.57 -0.18 0.00 0.77 0.00 0.00 66.41 64.44 2jmx h THR 107 Cb 0.72 2.49 -0.01 0.00 -1.74 0.00 0.00 68.15 69.61 2jmx h THR 107 CO 0.00 0.69 -0.76 0.24 0.37 0.00 0.00 175.52 176.05 2jmx h MET 108 N 0.04 0.20 -0.26 6.66 2.86 -0.98 -3.08 114.93 120.37 2jmx h MET 108 Ca -0.34 -0.18 0.02 0.00 -2.06 0.00 0.00 59.70 57.14 2jmx h MET 108 Cb 2.02 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 33.71 2jmx h MET 108 CO 0.09 0.87 0.17 0.00 1.06 0.00 0.00 176.91 179.11 2jmx h MET 109 N 0.13 0.28 -0.24 1.72 3.00 -1.53 -0.60 114.93 117.69 2jmx h MET 109 Ca -0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 59.70 59.62 2jmx h MET 109 Cb 1.34 -0.06 -0.01 0.00 0.00 0.00 0.00 31.60 32.87 2jmx h MET 109 CO 0.12 0.18 -0.00 0.77 0.00 0.00 0.00 176.91 177.98 2jmx h SER 110 N 0.28 0.32 0.86 -0.10 0.02 -1.66 -1.26 113.55 112.01 2jmx h SER 110 Ca 0.10 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 2jmx h SER 110 Cb 0.06 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.52 2jmx h SER 110 CO -0.02 0.39 0.00 0.52 -1.14 0.00 0.00 176.83 176.57 2jmx n VAL 111 N -4.34 0.11 0.05 2.27 0.31 -0.25 -2.55 118.33 113.93 2jmx n VAL 111 Ca 0.00 0.03 0.01 0.00 -0.01 0.00 0.00 64.34 64.37 2jmx n VAL 111 Cb 0.20 -0.56 -0.06 0.00 -0.91 0.00 0.00 33.84 32.51 2jmx n VAL 111 CO 0.00 0.00 0.00 1.12 -1.32 0.00 0.00 176.83 176.63 2jmx h HIS 112 N 0.00 0.00 0.04 3.52 -0.00 -1.05 -3.32 115.15 114.34 2jmx h HIS 112 Ca 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 60.37 60.02 2jmx h HIS 112 Cb 0.43 0.00 -0.05 0.00 -0.00 0.00 0.00 27.41 27.79 2jmx h HIS 112 CO 0.00 0.53 -2.05 -2.13 -0.00 0.00 0.00 177.93 174.28 2jmx n ARG 113 N -2.93 0.69 -0.30 5.12 0.63 -1.16 -3.80 116.66 114.92 2jmx n ARG 113 Ca -0.07 0.21 -0.04 0.00 -0.92 0.00 0.00 57.85 57.02 2jmx n ARG 113 Cb 0.80 -1.67 0.07 0.00 0.45 0.00 0.00 32.46 32.11 2jmx n ARG 113 CO 0.00 0.00 0.00 0.78 -2.51 0.00 0.00 177.63 175.90 2jmx h GLY 114 N 2.56 1.20 -5.95 5.14 0.00 -1.67 -3.24 103.07 101.11 2jmx h GLY 114 Ca -0.43 -0.52 -0.63 0.00 0.00 0.00 0.00 47.33 45.76 2jmx h GLY 114 CO 0.05 0.50 -0.39 -2.21 0.00 0.00 0.00 176.54 174.49 2jmx n GLU 115 N -4.43 3.14 0.01 4.80 2.13 -1.25 -4.87 120.64 120.16 2jmx n GLU 115 Ca 0.08 -4.73 -0.18 0.00 0.66 0.00 0.00 57.16 52.99 2jmx n GLU 115 Cb 0.07 -2.29 -0.11 0.00 0.27 0.00 0.00 31.44 29.38 2jmx n GLU 115 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2jmx h VAL 116 N 3.07 1.43 -4.18 6.31 2.07 -1.65 -3.46 116.25 119.84 2jmx h VAL 116 Ca 0.20 -2.10 -0.47 0.00 0.82 0.00 0.00 66.70 65.15 2jmx h VAL 116 Cb 0.58 2.62 0.02 0.00 -1.52 0.00 0.00 31.29 32.99 2jmx h VAL 116 CO 0.90 0.61 0.37 -2.16 0.02 0.00 0.00 177.57 177.31 2jmx s PRO 117 N -3.18 3.83 0.15 1.57 0.04 -1.26 -5.08 135.00 131.06 2jmx s PRO 117 Ca -0.13 1.04 0.08 0.00 0.04 0.00 0.00 61.00 62.02 2jmx s PRO 117 Cb 0.03 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 2jmx s PRO 117 CO 0.82 -0.38 -0.18 0.00 0.04 0.00 0.00 177.00 177.31 2jmx s THR 119 N -1.92 2.55 -0.35 0.00 -4.23 -1.26 -5.30 115.64 105.13 2jmx s THR 119 Ca 0.13 -2.06 0.03 0.00 -1.18 0.00 0.00 61.69 58.61 2jmx s THR 119 Cb -0.06 -2.74 0.02 0.00 1.34 0.00 0.00 72.50 71.06 2jmx s THR 119 CO 0.05 -0.46 0.59 0.52 -0.54 0.00 0.00 174.62 174.78