#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 2.60 -4.07 3.13 0.00 -1.26 -5.09 120.51 115.83 2jmx n ALA 2 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 2jmx n ALA 2 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.29 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 -1.46 2.54 -0.03 0.00 2.47 -1.26 -5.11 119.74 116.88 2jmx s LYS 3 Ca 0.00 -0.90 -0.02 0.00 -1.56 0.00 0.00 55.97 53.49 2jmx s LYS 3 Cb 0.00 -2.53 0.02 0.00 -1.46 0.00 0.00 37.83 33.85 2jmx s LYS 3 CO 0.00 -0.33 0.09 -0.51 0.16 0.00 0.00 175.35 174.75 2jmx s LEU 4 N 1.30 1.45 -0.03 5.43 1.43 -1.26 -5.07 118.68 121.94 2jmx s LEU 4 Ca 0.01 0.17 -0.05 0.00 -1.03 0.00 0.00 54.13 53.23 2jmx s LEU 4 Cb -0.15 0.25 -0.03 0.00 0.03 0.00 0.00 46.19 46.29 2jmx s LEU 4 CO -0.10 -0.06 -0.10 0.52 0.23 0.00 0.00 176.35 176.84 2jmx n VAL 5 N 3.38 0.92 -2.86 -1.59 0.31 -1.26 -5.10 118.33 112.13 2jmx n VAL 5 Ca -0.17 0.13 -0.00 0.00 -0.01 0.00 0.00 64.34 64.29 2jmx n VAL 5 Cb 0.57 -1.72 -0.00 0.00 -0.91 0.00 0.00 33.84 31.78 2jmx n VAL 5 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2jmx n ARG 6 N -3.59 -2.56 -1.42 5.55 0.63 -1.26 -4.96 116.66 109.05 2jmx n ARG 6 Ca -0.09 2.20 -0.29 0.00 -0.92 0.00 0.00 57.85 58.75 2jmx n ARG 6 Cb 0.36 -4.01 0.13 0.00 0.45 0.00 0.00 32.46 29.38 2jmx n ARG 6 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2jmx s PRO 7 N -1.39 1.40 -0.02 -0.14 0.04 -1.26 -4.99 135.00 128.63 2jmx s PRO 7 Ca -0.01 0.56 -0.23 0.00 0.04 0.00 0.00 61.00 61.36 2jmx s PRO 7 Cb 0.00 -1.85 -0.21 0.00 0.04 0.00 0.00 34.50 32.48 2jmx s PRO 7 CO 0.54 -2.08 1.13 -1.00 0.04 0.00 0.00 177.00 175.63 2jmx h PRO 8 N -1.42 0.26 -2.78 0.56 0.13 -2.08 -3.46 132.00 123.21 2jmx h PRO 8 Ca -0.50 -0.23 -0.13 0.00 -0.87 0.00 0.00 66.00 64.27 2jmx h PRO 8 Cb 1.30 0.05 -0.26 0.00 0.13 0.00 0.00 31.00 32.23 2jmx h PRO 8 CO 0.59 0.90 -0.30 0.14 -0.23 0.00 0.00 178.00 179.10 2jmx s VAL 9 N -3.47 -0.01 -0.23 1.56 -7.23 -1.26 -5.14 120.40 104.62 2jmx s VAL 9 Ca -0.15 0.04 -0.03 0.00 -1.81 0.00 0.00 61.98 60.03 2jmx s VAL 9 Cb 0.02 -0.54 0.12 0.00 0.56 0.00 0.00 36.38 36.54 2jmx s VAL 9 CO 0.76 0.02 0.35 -1.58 -0.31 0.00 0.00 175.10 174.33 2jmx s GLN 10 N 0.69 0.31 -0.09 4.82 0.74 -1.26 -5.05 119.66 119.83 2jmx s GLN 10 Ca -0.04 0.51 -0.06 0.00 0.05 0.00 0.00 55.36 55.81 2jmx s GLN 10 Cb -0.05 -0.56 0.02 0.00 1.10 0.00 0.00 33.01 33.53 2jmx s GLN 10 CO -0.05 -0.61 0.13 -0.89 -0.55 0.00 0.00 175.29 173.32 2jmx n ILE 11 N 5.36-11.14 -3.11 -2.34 -0.00 -1.26 -5.04 119.36 101.83 2jmx n ILE 11 Ca -0.04 2.49 -0.05 0.00 -0.00 0.00 0.00 62.75 65.15 2jmx n ILE 11 Cb 0.50 -5.68 -0.02 0.00 -0.00 0.00 0.00 39.64 34.44 2jmx n ILE 11 CO 0.00 0.00 0.00 -0.72 -0.00 0.00 0.00 176.55 175.83 2jmx s TYR 12 N -0.53 -1.31 0.00 1.39 1.13 -1.26 -5.11 117.35 111.66 2jmx s TYR 12 Ca -0.15 -0.32 0.00 0.00 -1.41 0.00 0.00 57.07 55.19 2jmx s TYR 12 Cb 0.01 0.13 0.00 0.00 -1.10 0.00 0.00 41.96 41.00 2jmx s TYR 12 CO 0.39 -1.16 0.00 0.41 -2.51 0.00 0.00 175.55 172.69 2jmx n GLY 13 N 3.84 3.36 0.51 5.49 0.00 -1.26 -4.80 105.19 112.33 2jmx n GLY 13 Ca 0.14 -0.98 0.36 0.00 0.00 0.00 0.00 46.02 45.55 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 0.25 -0.87 -0.61 6.09 -2.01 0.39 117.51 120.76 2jmx h ILE 14 Ca 0.00 -0.04 0.19 0.00 -1.37 0.00 0.00 64.86 63.64 2jmx h ILE 14 Cb 0.00 0.12 -0.06 0.00 0.47 0.00 0.00 36.82 37.35 2jmx h ILE 14 CO 0.00 0.02 0.58 -0.33 -3.07 0.00 0.00 178.15 175.35 2jmx h GLU 15 N 0.12 0.39 -0.44 2.19 5.08 -1.97 0.16 114.58 120.10 2jmx h GLU 15 Ca 0.74 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 58.93 2jmx h GLU 15 Cb 2.48 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 31.63 2jmx h GLU 15 CO -0.23 0.26 -0.29 0.78 -1.00 0.00 0.00 179.01 178.52 2jmx h GLY 16 N 0.40 1.06 1.43 -3.84 0.00 -0.48 -2.79 103.07 98.86 2jmx h GLY 16 Ca 0.44 -1.00 0.08 0.00 0.00 0.00 0.00 47.33 46.85 2jmx h GLY 16 CO -0.16 0.91 0.21 -0.09 0.00 0.00 0.00 176.54 177.41 2jmx h ARG 17 N 0.82 0.00 -0.95 4.80 1.12 -0.75 -1.50 114.38 117.92 2jmx h ARG 17 Ca 0.09 0.00 0.17 0.00 -1.11 0.00 0.00 59.98 59.13 2jmx h ARG 17 Cb 0.88 0.00 -0.08 0.00 -0.01 0.00 0.00 29.97 30.75 2jmx h ARG 17 CO 0.08 0.00 0.60 1.88 -3.11 0.00 0.00 179.97 179.42 2jmx h TYR 18 N 0.00 0.88 -0.10 2.20 -1.99 -1.20 1.02 116.97 117.78 2jmx h TYR 18 Ca 0.13 0.03 -0.23 0.00 2.00 0.00 0.00 58.73 60.66 2jmx h TYR 18 Cb 0.54 -0.27 0.01 0.00 2.00 0.00 0.00 36.73 39.01 2jmx h TYR 18 CO 0.00 0.27 -0.84 0.00 -0.00 0.00 0.00 178.16 177.59 2jmx h ALA 19 N 1.61 0.33 -0.04 3.88 0.00 -1.43 -2.23 119.26 121.38 2jmx h ALA 19 Ca 0.50 -0.63 -0.19 0.00 0.00 0.00 0.00 54.91 54.59 2jmx h ALA 19 Cb 0.85 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2jmx h ALA 19 CO -0.26 0.71 -0.80 1.79 0.00 0.00 0.00 179.25 180.68 2jmx h THR 20 N 0.44 1.41 0.00 0.00 1.35 -0.98 0.38 112.91 115.52 2jmx h THR 20 Ca -0.07 -2.32 0.00 0.00 -0.55 0.00 0.00 66.41 63.48 2jmx h THR 20 Cb 1.46 2.26 0.00 0.00 -1.73 0.00 0.00 68.15 70.14 2jmx h THR 20 CO 0.16 0.69 0.00 0.00 -0.25 0.00 0.00 175.52 176.12 2jmx h ALA 21 N 0.92 1.00 0.01 6.62 0.00 0.96 0.28 119.26 129.04 2jmx h ALA 21 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 54.91 54.45 2jmx h ALA 21 Cb 1.40 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.13 2jmx h ALA 21 CO 0.13 0.00 -2.40 -0.11 0.00 0.00 0.00 179.25 176.88 2jmx n LEU 22 N -2.55 2.33 0.16 0.00 7.94 -0.84 -4.25 117.00 119.79 2jmx n LEU 22 Ca 0.03 0.18 0.13 0.00 -1.11 0.00 0.00 56.01 55.24 2jmx n LEU 22 Cb 0.36 -0.88 0.45 0.00 0.53 0.00 0.00 43.42 43.89 2jmx n LEU 22 CO 0.27 0.69 0.88 0.10 -1.11 0.00 0.00 177.39 178.23 2jmx h TYR 23 N -0.61 0.00 -0.94 1.96 -0.00 -0.31 -3.10 116.97 113.97 2jmx h TYR 23 Ca -0.62 0.00 0.19 0.00 0.00 0.00 0.00 58.73 58.30 2jmx h TYR 23 Cb 1.71 0.00 -0.08 0.00 0.00 0.00 0.00 36.73 38.36 2jmx h TYR 23 CO -0.03 0.00 0.60 0.66 -0.00 0.00 0.00 178.16 179.40 2jmx h SER 24 N 0.00 0.56 -0.01 0.10 4.64 -0.60 1.17 113.55 119.41 2jmx h SER 24 Ca 0.00 0.06 -0.21 0.00 -0.47 0.00 0.00 61.79 61.17 2jmx h SER 24 Cb 0.59 -0.04 0.02 0.00 -0.31 0.00 0.00 62.40 62.65 2jmx h SER 24 CO 0.00 0.22 -0.82 0.00 -0.87 0.00 0.00 176.83 175.36 2jmx h ALA 25 N 1.62 0.12 -0.98 5.18 0.00 -1.78 -3.17 119.26 120.24 2jmx h ALA 25 Ca 0.50 -0.63 0.08 0.00 0.00 0.00 0.00 54.91 54.86 2jmx h ALA 25 Cb 1.04 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.80 2jmx h ALA 25 CO -0.24 0.53 0.63 0.00 0.00 0.00 0.00 179.25 180.17 2jmx h ALA 26 N 0.38 1.47 -0.78 0.00 0.00 -0.11 -1.36 119.26 118.84 2jmx h ALA 26 Ca -0.10 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 54.90 2jmx h ALA 26 Cb 1.50 -0.27 -0.08 0.00 0.00 0.00 0.00 17.79 18.94 2jmx h ALA 26 CO 0.16 0.36 0.42 0.66 0.00 0.00 0.00 179.25 180.85 2jmx h SER 27 N 1.09 0.57 -0.58 0.00 4.64 0.11 0.89 113.55 120.28 2jmx h SER 27 Ca 0.44 0.06 -0.11 0.00 -0.47 0.00 0.00 61.79 61.71 2jmx h SER 27 Cb 0.27 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 2jmx h SER 27 CO -0.19 0.31 -0.06 0.50 -0.87 0.00 0.00 176.83 176.52 2jmx h LYS 28 N 0.69 1.06 -0.00 4.77 3.64 -1.30 -2.52 116.57 122.91 2jmx h LYS 28 Ca 0.39 -0.37 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2jmx h LYS 28 Cb 0.41 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 2jmx h LYS 28 CO -0.27 1.07 -0.02 1.04 -2.27 0.00 0.00 179.45 178.99 2jmx n GLN 29 N -4.16 1.09 -3.19 1.90 6.02 -0.29 -4.92 117.38 113.82 2jmx n GLN 29 Ca 0.02 -0.32 -0.15 0.00 -0.01 0.00 0.00 57.00 56.54 2jmx n GLN 29 Cb 0.38 -1.49 0.06 0.00 1.02 0.00 0.00 30.24 30.20 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 -0.67 -4.43 -1.02 1.08 5.15 0.29 -4.94 115.26 110.72 2jmx n ASN 30 Ca 0.20 -0.37 0.08 0.00 -0.60 0.00 0.00 54.58 53.88 2jmx n ASN 30 Cb 0.22 -3.57 0.25 0.00 -0.53 0.00 0.00 39.78 36.16 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 -3.46 3.19 -0.33 1.20 4.76 0.02 -4.65 118.16 118.89 2jmx n LYS 31 Ca -0.03 -2.61 0.22 0.00 -2.87 0.00 0.00 58.31 53.02 2jmx n LYS 31 Cb 0.55 -1.69 0.49 0.00 -1.84 0.00 0.00 35.03 32.55 2jmx n LYS 31 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2jmx h LEU 32 N 2.50 0.48 -0.04 -0.35 -0.00 -1.92 0.34 115.31 116.32 2jmx h LEU 32 Ca 0.00 0.09 -0.16 0.00 -0.00 0.00 0.00 57.88 57.81 2jmx h LEU 32 Cb 1.24 0.02 0.01 0.00 -0.00 0.00 0.00 40.66 41.93 2jmx h LEU 32 CO 0.17 0.08 -0.61 -0.08 -0.00 0.00 0.00 178.44 177.99 2jmx h GLU 33 N 0.41 0.49 -0.06 1.13 4.57 -1.97 0.88 114.58 120.03 2jmx h GLU 33 Ca 0.61 -0.47 0.02 0.00 -1.18 0.00 0.00 59.36 58.34 2jmx h GLU 33 Cb 1.50 0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 30.20 2jmx h GLU 33 CO -0.33 1.11 0.05 1.96 -1.18 0.00 0.00 179.01 180.62 2jmx h GLN 34 N 0.04 0.00 0.00 1.92 1.08 -0.82 -1.92 115.11 115.41 2jmx h GLN 34 Ca -0.06 0.00 -0.37 0.00 -1.45 0.00 0.00 58.65 56.77 2jmx h GLN 34 Cb 1.29 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 28.66 2jmx h GLN 34 CO 0.12 0.00 -2.34 0.28 -0.95 0.00 0.00 178.83 175.94 2jmx n VAL 35 N -4.32 1.34 0.28 -0.54 0.31 0.73 -3.75 118.33 112.38 2jmx n VAL 35 Ca -0.01 -0.46 0.15 0.00 -0.01 0.00 0.00 64.34 64.01 2jmx n VAL 35 Cb 0.15 -1.48 0.82 0.00 -0.91 0.00 0.00 33.84 32.42 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 -0.28 0.00 0.07 5.55 4.22 0.80 0.28 114.58 125.22 2jmx h GLU 36 Ca -0.55 0.00 -0.37 0.00 0.08 0.00 0.00 59.36 58.51 2jmx h GLU 36 Cb 1.73 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.94 2jmx h GLU 36 CO -0.17 0.07 -2.19 1.17 -2.18 0.00 0.00 179.01 175.71 2jmx n LYS 37 N -3.50 0.71 0.03 1.92 3.00 -0.72 -3.32 118.16 116.28 2jmx n LYS 37 Ca -0.02 0.21 -0.19 0.00 -0.00 0.00 0.00 58.31 58.31 2jmx n LYS 37 Cb 0.21 -1.63 -0.12 0.00 0.00 0.00 0.00 35.03 33.48 2jmx n LYS 37 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2jmx h GLU 38 N 0.04 0.46 -0.53 1.64 3.07 -1.63 -3.18 114.58 114.45 2jmx h GLU 38 Ca -0.49 -0.56 0.01 0.00 -0.50 0.00 0.00 59.36 57.83 2jmx h GLU 38 Cb 1.98 0.17 -0.03 0.00 -0.84 0.00 0.00 28.75 30.04 2jmx h GLU 38 CO 0.02 1.20 0.35 1.25 -1.40 0.00 0.00 179.01 180.43 2jmx h LEU 39 N -0.03 0.58 -1.29 1.33 5.85 -0.64 -1.53 115.31 119.59 2jmx h LEU 39 Ca -0.11 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.63 2jmx h LEU 39 Cb 1.51 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.36 2jmx h LEU 39 CO 0.15 0.41 0.50 0.25 -0.34 0.00 0.00 178.44 179.42 2jmx h LEU 40 N 0.68 0.80 -1.20 2.25 6.46 -1.54 -1.78 115.31 120.97 2jmx h LEU 40 Ca 0.20 -0.01 0.07 0.00 -0.12 0.00 0.00 57.88 58.03 2jmx h LEU 40 Cb -0.02 -0.19 -0.06 0.00 -0.73 0.00 0.00 40.66 39.67 2jmx h LEU 40 CO -0.05 0.55 0.57 -0.09 -0.62 0.00 0.00 178.44 178.80 2jmx h ARG 41 N 0.93 0.91 -0.95 1.25 9.65 -1.28 -1.24 114.38 123.65 2jmx h ARG 41 Ca 0.30 -0.05 0.04 0.00 -1.10 0.00 0.00 59.98 59.17 2jmx h ARG 41 Cb 0.05 -0.21 -0.06 0.00 -1.39 0.00 0.00 29.97 28.37 2jmx h ARG 41 CO -0.09 0.60 0.62 0.28 2.80 0.00 0.00 179.97 184.19 2jmx h VAL 42 N 0.94 1.16 -0.20 0.20 2.07 -1.37 0.35 116.25 119.41 2jmx h VAL 42 Ca 0.38 -0.41 -0.03 0.00 0.82 0.00 0.00 66.70 67.46 2jmx h VAL 42 Cb 0.27 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 29.90 2jmx h VAL 42 CO -0.15 0.22 -0.00 1.23 0.02 0.00 0.00 177.57 178.89 2jmx h GLY 43 N 1.18 0.38 1.19 2.17 0.00 -1.26 -2.68 103.07 104.04 2jmx h GLY 43 Ca 0.38 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.42 2jmx h GLY 43 CO -0.12 0.26 0.47 -1.61 0.00 0.00 0.00 176.54 175.54 2jmx h GLN 44 N 0.10 1.08 -0.69 4.80 4.15 -0.94 -1.51 115.11 122.10 2jmx h GLN 44 Ca 0.06 -0.10 0.03 0.00 0.77 0.00 0.00 58.65 59.41 2jmx h GLN 44 Cb 0.40 -0.23 -0.04 0.00 0.21 0.00 0.00 27.48 27.82 2jmx h GLN 44 CO 0.01 0.76 0.43 0.82 -1.93 0.00 0.00 178.83 178.92 2jmx h ILE 45 N 1.10 1.08 -0.23 2.39 2.04 -0.75 0.79 117.51 123.92 2jmx h ILE 45 Ca 0.28 -0.29 -0.14 0.00 1.00 0.00 0.00 64.86 65.71 2jmx h ILE 45 Cb -0.04 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.21 2jmx h ILE 45 CO -0.05 0.15 -0.45 0.25 0.00 0.00 0.00 178.15 178.05 2jmx h LEU 46 N 0.84 0.64 -0.28 1.44 7.12 -1.09 -3.08 115.31 120.89 2jmx h LEU 46 Ca 0.28 -0.30 -0.19 0.00 0.13 0.00 0.00 57.88 57.80 2jmx h LEU 46 Cb 0.04 -0.18 -0.02 0.00 -0.53 0.00 0.00 40.66 39.97 2jmx h LEU 46 CO -0.12 1.00 -0.87 0.50 -0.13 0.00 0.00 178.44 178.82 2jmx h LYS 47 N 0.47 0.08 -6.72 1.25 3.64 -0.66 -3.35 116.57 111.29 2jmx h LYS 47 Ca 0.03 -0.10 -0.58 0.00 -1.27 0.00 0.00 60.65 58.74 2jmx h LYS 47 Cb 0.98 0.03 0.14 0.00 -0.41 0.00 0.00 32.23 32.97 2jmx h LYS 47 CO 0.09 0.90 0.16 0.39 -2.27 0.00 0.00 179.45 178.71 2jmx n GLU 48 N -3.58 1.22 -0.06 1.90 1.02 0.27 -4.75 120.64 116.66 2jmx n GLU 48 Ca -0.02 0.45 -0.15 0.00 -0.02 0.00 0.00 57.16 57.41 2jmx n GLU 48 Cb 0.82 -2.11 -0.06 0.00 -0.02 0.00 0.00 31.44 30.07 2jmx n GLU 48 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2jmx h PRO 49 N 1.17 0.68 -0.34 3.49 0.13 -1.88 0.24 132.00 135.49 2jmx h PRO 49 Ca -0.46 -0.47 0.03 0.00 -0.87 0.00 0.00 66.00 64.22 2jmx h PRO 49 Cb 1.35 0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.53 2jmx h PRO 49 CO 0.55 1.09 0.23 0.87 -0.23 0.00 0.00 178.00 180.50 2jmx h LYS 50 N 0.38 0.33 0.01 0.86 1.57 -1.92 -2.96 116.57 114.85 2jmx h LYS 50 Ca -0.01 -0.02 -0.34 0.00 -1.87 0.00 0.00 60.65 58.41 2jmx h LYS 50 Cb 1.11 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 33.28 2jmx h LYS 50 CO 0.11 0.22 -2.13 -1.33 -0.57 0.00 0.00 179.45 175.75 2jmx n MET 51 N -4.49 0.67 -0.31 3.15 2.81 -1.18 -4.17 117.12 113.60 2jmx n MET 51 Ca 0.03 0.12 0.13 0.00 -1.81 0.00 0.00 57.70 56.17 2jmx n MET 51 Cb 0.15 -1.63 0.36 0.00 -0.71 0.00 0.00 33.22 31.40 2jmx n MET 51 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2jmx h ALA 52 N 0.89 1.80 -0.01 3.04 0.00 -0.35 0.90 119.26 125.52 2jmx h ALA 52 Ca -0.45 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.38 2jmx h ALA 52 Cb 2.13 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.80 2jmx h ALA 52 CO 0.04 -0.10 -0.55 0.00 0.00 0.00 0.00 179.25 178.64 2jmx h ALA 53 N 1.61 1.07 0.12 0.00 0.00 -1.73 -2.23 119.26 118.09 2jmx h ALA 53 Ca 0.51 -0.50 -0.33 0.00 0.00 0.00 0.00 54.91 54.58 2jmx h ALA 53 Cb 0.83 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2jmx h ALA 53 CO -0.27 0.69 -1.75 0.77 0.00 0.00 0.00 179.25 178.69 2jmx h SER 54 N 0.03 0.40 0.63 0.00 0.02 -0.78 -2.87 113.55 110.98 2jmx h SER 54 Ca -0.00 -0.69 -0.12 0.00 -0.84 0.00 0.00 61.79 60.14 2jmx h SER 54 Cb 0.98 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.38 2jmx h SER 54 CO 0.07 1.59 -0.57 -0.07 -1.14 0.00 0.00 176.83 176.72 2jmx h LEU 55 N 0.07 0.00 0.00 5.07 3.38 0.61 -3.22 115.31 121.21 2jmx h LEU 55 Ca -0.33 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.57 2jmx h LEU 55 Cb 2.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.78 2jmx h LEU 55 CO 0.13 0.57 -1.35 -0.11 0.09 0.00 0.00 178.44 177.77 2jmx n LEU 56 N -3.78 0.69 -4.54 1.67 0.00 -0.84 -4.96 117.00 105.23 2jmx n LEU 56 Ca -0.01 0.28 -0.41 0.00 0.00 0.00 0.00 56.01 55.87 2jmx n LEU 56 Cb 0.59 0.02 0.02 0.00 0.00 0.00 0.00 43.42 44.04 2jmx n LEU 56 CO 0.41 -0.02 0.35 -3.20 0.00 0.00 0.00 177.39 174.93 2jmx n ASN 57 N -2.69 0.25 -0.06 1.96 4.05 -1.08 -4.86 115.26 112.83 2jmx n ASN 57 Ca -0.05 0.95 0.14 0.00 0.45 0.00 0.00 54.58 56.06 2jmx n ASN 57 Cb 0.67 -1.25 0.78 0.00 1.23 0.00 0.00 39.78 41.21 2jmx n ASN 57 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 2jmx n PRO 58 N 0.18 1.09 -0.03 1.20 -0.04 -1.26 -3.70 135.00 132.43 2jmx n PRO 58 Ca 0.11 -0.13 -0.13 0.00 -0.04 0.00 0.00 63.50 63.31 2jmx n PRO 58 Cb 0.40 -1.43 -0.14 0.00 -0.04 0.00 0.00 33.50 32.29 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 -0.79 0.85 -0.08 0.54 4.02 -1.26 -4.15 117.16 116.29 2jmx n TYR 59 Ca 0.20 0.26 0.25 0.00 -0.01 0.00 0.00 57.90 58.60 2jmx n TYR 59 Cb 0.13 -1.14 0.72 0.00 -0.02 0.00 0.00 39.34 39.03 2jmx n TYR 59 CO 0.00 0.00 0.00 -0.39 -1.01 0.00 0.00 176.86 175.46 2jmx h VAL 60 N 0.02 0.49 -1.45 -0.72 -1.51 -1.84 -3.47 116.25 107.77 2jmx h VAL 60 Ca -0.38 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.09 2jmx h VAL 60 Cb 2.05 0.58 0.00 0.00 -2.13 0.00 0.00 31.29 31.78 2jmx h VAL 60 CO 0.06 0.00 0.00 1.17 -1.23 0.00 0.00 177.57 177.57 2jmx n LYS 61 N -4.07 0.00 -0.03 5.19 3.00 -1.26 -1.90 118.16 119.09 2jmx n LYS 61 Ca 0.15 0.00 -0.07 0.00 -0.00 0.00 0.00 58.31 58.39 2jmx n LYS 61 Cb 0.85 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.86 2jmx n LYS 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2jmx n ARG 62 N -1.09 0.29 -0.35 1.64 1.74 -1.26 -3.94 116.66 113.69 2jmx n ARG 62 Ca 0.00 0.12 -0.01 0.00 -0.77 0.00 0.00 57.85 57.19 2jmx n ARG 62 Cb 0.00 -1.00 0.15 0.00 -1.02 0.00 0.00 32.46 30.59 2jmx n ARG 62 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2jmx h SER 63 N -0.53 1.08 -0.27 0.55 0.87 -1.87 0.22 113.55 113.60 2jmx h SER 63 Ca -0.07 -0.02 -0.12 0.00 -1.23 0.00 0.00 61.79 60.35 2jmx h SER 63 Cb 0.68 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.37 2jmx h SER 63 CO -0.04 0.77 -0.31 0.58 -0.53 0.00 0.00 176.83 177.29 2jmx h VAL 64 N 1.27 1.31 -0.48 2.23 2.07 -1.83 -2.85 116.25 117.96 2jmx h VAL 64 Ca 0.37 -1.49 -0.07 0.00 0.82 0.00 0.00 66.70 66.33 2jmx h VAL 64 Cb -0.09 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 2jmx h VAL 64 CO -0.09 0.48 0.03 0.50 0.02 0.00 0.00 177.57 178.50 2jmx h LYS 65 N 0.43 0.77 -0.96 1.57 3.11 -0.85 -2.53 116.57 118.11 2jmx h LYS 65 Ca 0.04 -0.19 0.00 0.00 -2.81 0.00 0.00 60.65 57.69 2jmx h LYS 65 Cb 0.89 -0.10 -0.05 0.00 -1.00 0.00 0.00 32.23 31.97 2jmx h LYS 65 CO 0.08 0.76 0.61 0.28 -2.81 0.00 0.00 179.45 178.37 2jmx h VAL 66 N 0.73 1.26 -0.55 2.00 2.07 -0.47 -2.01 116.25 119.28 2jmx h VAL 66 Ca 0.15 -0.51 -0.09 0.00 0.82 0.00 0.00 66.70 67.07 2jmx h VAL 66 Cb 0.40 -0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.02 2jmx h VAL 66 CO 0.01 0.26 -0.00 0.50 0.02 0.00 0.00 177.57 178.36 2jmx h LYS 67 N 1.31 0.97 -0.70 1.57 1.63 -1.24 -2.75 116.57 117.36 2jmx h LYS 67 Ca 0.35 -0.31 0.02 0.00 -0.85 0.00 0.00 60.65 59.86 2jmx h LYS 67 Cb -0.10 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 31.40 2jmx h LYS 67 CO -0.07 0.98 0.47 1.03 -3.45 0.00 0.00 179.45 178.40 2jmx h SER 68 N 0.85 0.78 -0.36 4.20 0.87 -1.02 -2.38 113.55 116.49 2jmx h SER 68 Ca 0.15 -0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.70 2jmx h SER 68 Cb 0.54 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.29 2jmx h SER 68 CO 0.03 0.55 0.22 -0.07 -0.53 0.00 0.00 176.83 177.03 2jmx h LEU 69 N 0.91 0.43 -0.91 2.23 3.38 -1.08 -0.14 115.31 120.13 2jmx h LEU 69 Ca 0.27 -0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.23 2jmx h LEU 69 Cb -0.04 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 2jmx h LEU 69 CO -0.07 0.35 0.59 0.28 0.09 0.00 0.00 178.44 179.68 2jmx h SER 70 N 0.47 0.98 0.89 -0.43 0.02 -1.34 0.87 113.55 115.01 2jmx h SER 70 Ca 0.13 -0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 61.03 2jmx h SER 70 Cb -0.01 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.31 2jmx h SER 70 CO -0.03 0.67 -0.22 -0.78 -1.14 0.00 0.00 176.83 175.33 2jmx h ASP 71 N 1.14 0.00 0.11 3.07 1.82 -1.09 -1.22 116.42 120.25 2jmx h ASP 71 Ca 0.37 0.00 -0.27 0.00 -0.39 0.00 0.00 57.03 56.73 2jmx h ASP 71 Cb 0.02 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.02 2jmx h ASP 71 CO -0.12 0.22 -1.39 -0.03 -1.61 0.00 0.00 179.24 176.30 2jmx h MET 72 N 0.00 0.24 -0.90 0.28 4.05 0.43 -3.16 114.93 115.87 2jmx h MET 72 Ca -0.00 -0.40 0.09 0.00 -0.28 0.00 0.00 59.70 59.10 2jmx h MET 72 Cb 0.73 0.15 -0.06 0.00 -0.80 0.00 0.00 31.60 31.61 2jmx h MET 72 CO 0.03 1.19 0.58 1.15 0.23 0.00 0.00 176.91 180.09 2jmx h THR 73 N -0.32 1.00 -0.70 -0.77 2.02 0.77 0.90 112.91 115.80 2jmx h THR 73 Ca -0.30 -0.32 -0.07 0.00 0.77 0.00 0.00 66.41 66.49 2jmx h THR 73 Cb 1.75 -0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 68.11 2jmx h THR 73 CO 0.05 0.17 0.17 0.00 0.37 0.00 0.00 175.52 176.28 2jmx h ALA 74 N 1.54 0.93 0.09 6.16 0.00 -1.31 -1.89 119.26 124.77 2jmx h ALA 74 Ca 0.41 -0.25 -0.26 0.00 0.00 0.00 0.00 54.91 54.81 2jmx h ALA 74 Cb 0.33 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2jmx h ALA 74 CO -0.17 0.65 -1.17 -0.22 0.00 0.00 0.00 179.25 178.35 2jmx h LYS 75 N 1.06 0.21 0.00 0.00 3.64 -1.15 -3.23 116.57 117.10 2jmx h LYS 75 Ca 0.22 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 2jmx h LYS 75 Cb 0.38 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 2jmx h LYS 75 CO 0.00 1.16 0.00 0.39 -2.27 0.00 0.00 179.45 178.73 2jmx n GLU 76 N -3.51 0.03 -3.56 1.90 1.02 0.30 -4.91 120.64 111.91 2jmx n GLU 76 Ca -0.06 0.20 -0.20 0.00 -0.02 0.00 0.00 57.16 57.07 2jmx n GLU 76 Cb 0.99 -1.55 0.07 0.00 -0.02 0.00 0.00 31.44 30.93 2jmx n GLU 76 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2jmx n LYS 77 N -1.61 -6.41 -0.09 3.49 3.00 -0.72 -4.97 118.16 110.84 2jmx n LYS 77 Ca 0.04 0.77 -0.07 0.00 -0.00 0.00 0.00 58.31 59.06 2jmx n LYS 77 Cb 0.23 -5.69 0.07 0.00 0.00 0.00 0.00 35.03 29.65 2jmx n LYS 77 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 2jmx n PHE 78 N -4.38 -2.11 -3.18 5.64 3.72 -1.19 -5.03 117.46 110.94 2jmx n PHE 78 Ca -0.21 -0.15 -0.05 0.00 -0.05 0.00 0.00 57.45 56.98 2jmx n PHE 78 Cb 0.64 -0.38 0.01 0.00 -0.94 0.00 0.00 39.48 38.82 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 -2.91 0.78 0.00 4.37 3.41 -1.26 -4.98 113.62 113.03 2jmx n SER 79 Ca 0.03 -1.41 0.12 0.00 -0.26 0.00 0.00 58.87 57.36 2jmx n SER 79 Cb 0.14 -0.08 0.61 0.00 -0.26 0.00 0.00 64.21 64.62 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 -1.17 0.31 -0.03 4.33 -0.04 -1.26 -3.20 135.00 133.93 2jmx n PRO 80 Ca 0.03 0.06 0.04 0.00 -0.04 0.00 0.00 63.50 63.59 2jmx n PRO 80 Cb 0.15 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.17 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 -1.31 2.12 -0.12 1.53 4.77 -1.26 -4.69 117.00 118.04 2jmx n LEU 81 Ca 0.11 -2.45 0.01 0.00 -0.03 0.00 0.00 56.01 53.66 2jmx n LEU 81 Cb 0.20 -0.19 0.02 0.00 -2.33 0.00 0.00 43.42 41.12 2jmx n LEU 81 CO 0.19 0.58 0.35 0.41 -1.33 0.00 0.00 177.39 177.59 2jmx n THR 82 N -0.90 0.23 -1.62 -5.08 -1.04 -1.19 -4.57 114.28 100.10 2jmx n THR 82 Ca 0.07 -0.61 -0.26 0.00 -2.04 0.00 0.00 64.05 61.21 2jmx n THR 82 Cb 0.43 0.93 0.08 0.00 -1.82 0.00 0.00 70.33 69.94 2jmx n THR 82 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2jmx n SER 83 N 0.06 5.68 0.14 8.00 3.41 -1.26 -3.83 113.62 125.82 2jmx n SER 83 Ca 0.02 -3.77 0.00 0.00 -0.26 0.00 0.00 58.87 54.86 2jmx n SER 83 Cb 0.12 -0.67 0.00 0.00 -0.26 0.00 0.00 64.21 63.40 2jmx n SER 83 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2jmx n ASN 84 N -0.88 -0.48 0.22 4.04 4.13 -1.26 -4.78 115.26 116.25 2jmx n ASN 84 Ca 0.51 0.48 0.15 0.00 1.68 0.00 0.00 54.58 57.39 2jmx n ASN 84 Cb 0.88 0.65 0.79 0.00 -1.54 0.00 0.00 39.78 40.57 2jmx n ASN 84 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 2jmx h LEU 85 N 0.00 0.00 -1.25 3.41 5.85 -1.80 -0.45 115.31 121.07 2jmx h LEU 85 Ca 0.00 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.73 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 1.20 -0.17 4.05 2.10 -1.87 -1.61 117.51 121.21 2jmx h ILE 86 Ca 0.06 -0.36 -0.05 0.00 1.08 0.00 0.00 64.86 65.59 2jmx h ILE 86 Cb 0.28 0.06 -0.00 0.00 -1.09 0.00 0.00 36.82 36.07 2jmx h ILE 86 CO -0.00 0.19 -0.08 0.78 -1.08 0.00 0.00 178.15 177.96 2jmx h ASN 87 N 1.04 0.37 -0.94 2.19 2.35 -1.39 -2.96 115.58 116.24 2jmx h ASN 87 Ca 0.28 -0.41 0.14 0.00 -0.55 0.00 0.00 56.30 55.77 2jmx h ASN 87 Cb -0.12 -0.10 -0.09 0.00 0.05 0.00 0.00 38.32 38.06 2jmx h ASN 87 CO -0.06 0.70 0.55 -0.07 -1.65 0.00 0.00 177.43 176.89 2jmx h LEU 88 N 0.04 0.74 -1.09 1.61 3.38 -1.30 0.61 115.31 119.31 2jmx h LEU 88 Ca 0.04 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2jmx h LEU 88 Cb 0.55 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 2jmx h LEU 88 CO 0.02 0.34 0.55 -0.07 0.09 0.00 0.00 178.44 179.37 2jmx h LEU 89 N 0.80 1.02 -3.61 1.67 3.38 -1.17 -2.20 115.31 115.21 2jmx h LEU 89 Ca 0.50 -0.05 -0.30 0.00 0.09 0.00 0.00 57.88 58.12 2jmx h LEU 89 Cb 0.63 -0.26 -0.18 0.00 0.09 0.00 0.00 40.66 40.94 2jmx h LEU 89 CO -0.32 0.77 0.21 0.00 0.09 0.00 0.00 178.44 179.19 2jmx n ALA 90 N -2.40 4.78 -0.13 1.53 0.00 0.09 -1.28 120.51 123.09 2jmx n ALA 90 Ca 0.10 -2.99 -0.23 0.00 0.00 0.00 0.00 53.44 50.31 2jmx n ALA 90 Cb 0.05 -1.03 -0.11 0.00 0.00 0.00 0.00 19.45 18.36 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 -1.07 0.62 -0.71 0.00 2.13 0.19 -4.52 120.64 117.28 2jmx n GLU 91 Ca 0.43 0.20 0.01 0.00 0.66 0.00 0.00 57.16 58.46 2jmx n GLU 91 Cb 1.29 -1.51 0.20 0.00 0.27 0.00 0.00 31.44 31.69 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 -3.70 2.10 -1.39 4.31 3.02 -1.25 -4.94 115.26 113.40 2jmx n ASN 92 Ca -0.50 -3.85 -0.04 0.00 -0.03 0.00 0.00 54.58 50.17 2jmx n ASN 92 Cb 0.94 -0.59 0.02 0.00 -0.61 0.00 0.00 39.78 39.55 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 -1.12 0.36 1.87 7.41 0.00 -1.26 -4.97 105.19 107.48 2jmx n GLY 93 Ca 0.26 -0.39 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 2jmx n GLY 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jmx n ARG 94 N -1.55 2.44 -0.98 1.61 5.12 -0.41 -4.57 116.66 118.32 2jmx n ARG 94 Ca -0.04 -3.33 -0.10 0.00 -1.93 0.00 0.00 57.85 52.44 2jmx n ARG 94 Cb 0.53 -2.10 0.23 0.00 -1.16 0.00 0.00 32.46 29.95 2jmx n ARG 94 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2jmx n LEU 95 N -1.01 5.55 -0.07 0.55 4.77 -1.18 -3.89 117.00 121.72 2jmx n LEU 95 Ca 0.49 -3.49 -0.14 0.00 -0.03 0.00 0.00 56.01 52.85 2jmx n LEU 95 Cb 1.08 -0.73 -0.05 0.00 -2.33 0.00 0.00 43.42 41.40 2jmx n LEU 95 CO 0.49 1.00 -0.84 0.35 -1.33 0.00 0.00 177.39 177.06 2jmx n THR 96 N -0.80 1.10 -1.39 -5.08 -2.24 -1.26 -4.60 114.28 100.01 2jmx n THR 96 Ca 0.43 -0.06 -0.28 0.00 -2.27 0.00 0.00 64.05 61.88 2jmx n THR 96 Cb 1.34 -1.85 0.11 0.00 -2.10 0.00 0.00 70.33 67.84 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 -3.88 5.80 0.10 3.42 3.02 -1.26 -4.68 115.26 117.78 2jmx n ASN 97 Ca -0.24 -3.74 -0.01 0.00 -0.03 0.00 0.00 54.58 50.56 2jmx n ASN 97 Cb 0.58 -0.84 0.26 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 1.13 1.28 -0.53 3.41 1.03 -1.81 -3.10 112.91 114.31 2jmx h THR 98 Ca 0.55 -1.34 -0.08 0.00 -0.01 0.00 0.00 66.41 65.53 2jmx h THR 98 Cb 1.54 1.56 -0.02 0.00 -1.07 0.00 0.00 68.15 70.15 2jmx h THR 98 CO 1.25 0.40 0.00 1.55 -0.01 0.00 0.00 175.52 178.71 2jmx h PRO 99 N 0.21 0.91 -0.40 0.00 0.13 -1.87 -2.38 132.00 128.60 2jmx h PRO 99 Ca 0.03 -0.26 0.10 0.00 -0.87 0.00 0.00 66.00 65.00 2jmx h PRO 99 Cb 0.70 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 31.72 2jmx h PRO 99 CO 0.05 0.90 0.28 0.00 -0.23 0.00 0.00 178.00 179.00 2jmx h ALA 100 N 1.16 2.29 -0.19 -0.56 0.00 -1.91 -0.73 119.26 119.32 2jmx h ALA 100 Ca 0.16 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 2jmx h ALA 100 Cb 0.50 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2jmx h ALA 100 CO 0.02 -0.40 -0.32 0.28 0.00 0.00 0.00 179.25 178.83 2jmx h VAL 101 N 0.06 1.28 -0.04 0.00 2.07 -1.51 -3.07 116.25 115.04 2jmx h VAL 101 Ca 0.19 -1.35 -0.20 0.00 0.82 0.00 0.00 66.70 66.15 2jmx h VAL 101 Cb 0.67 1.49 -0.00 0.00 -1.52 0.00 0.00 31.29 31.92 2jmx h VAL 101 CO -0.01 0.42 -0.82 0.40 0.02 0.00 0.00 177.57 177.57 2jmx h ILE 102 N 0.33 1.39 -0.66 4.57 2.04 -1.17 -3.25 117.51 120.77 2jmx h ILE 102 Ca 0.04 -2.29 0.04 0.00 1.00 0.00 0.00 64.86 63.66 2jmx h ILE 102 Cb 0.72 2.25 -0.05 0.00 -0.74 0.00 0.00 36.82 39.00 2jmx h ILE 102 CO 0.06 0.68 0.39 -1.28 0.00 0.00 0.00 178.15 178.00 2jmx h SER 103 N 0.25 0.60 -0.56 1.72 0.87 -1.40 -1.12 113.55 113.92 2jmx h SER 103 Ca -0.05 0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.55 2jmx h SER 103 Cb 1.42 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 63.25 2jmx h SER 103 CO 0.14 0.41 0.37 0.00 -0.53 0.00 0.00 176.83 177.22 2jmx h ALA 104 N 1.31 1.67 -0.79 6.23 0.00 -1.58 -2.10 119.26 124.00 2jmx h ALA 104 Ca 0.28 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.21 2jmx h ALA 104 Cb 0.10 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 2jmx h ALA 104 CO -0.14 0.29 0.48 0.35 0.00 0.00 0.00 179.25 180.22 2jmx h PHE 105 N 0.69 0.89 -0.51 0.00 3.04 -1.23 0.85 116.94 120.66 2jmx h PHE 105 Ca 0.22 0.03 -0.11 0.00 3.98 0.00 0.00 57.97 62.08 2jmx h PHE 105 Cb 0.01 -0.29 -0.02 0.00 2.56 0.00 0.00 35.95 38.22 2jmx h PHE 105 CO -0.00 0.46 -0.13 0.77 -2.02 0.00 0.00 178.31 177.40 2jmx h SER 106 N 0.89 1.00 0.28 0.41 0.02 -1.28 0.27 113.55 115.14 2jmx h SER 106 Ca 0.34 -0.36 -0.21 0.00 -0.84 0.00 0.00 61.79 60.72 2jmx h SER 106 Cb 0.13 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 62.40 2jmx h SER 106 CO -0.16 1.13 -0.84 0.74 -1.14 0.00 0.00 176.83 176.56 2jmx h THR 107 N 0.86 1.39 -0.10 -2.27 2.02 -1.15 -3.07 112.91 110.58 2jmx h THR 107 Ca 0.13 -2.29 -0.17 0.00 0.77 0.00 0.00 66.41 64.84 2jmx h THR 107 Cb 0.69 2.27 -0.01 0.00 -1.74 0.00 0.00 68.15 69.36 2jmx h THR 107 CO 0.05 0.69 -0.68 0.24 0.37 0.00 0.00 175.52 176.19 2jmx h MET 108 N 0.27 0.42 -0.99 6.66 2.07 0.82 -3.11 114.93 121.07 2jmx h MET 108 Ca -0.06 -0.32 0.03 0.00 -2.07 0.00 0.00 59.70 57.29 2jmx h MET 108 Cb 1.45 0.06 -0.06 0.00 -1.87 0.00 0.00 31.60 31.19 2jmx h MET 108 CO 0.15 0.95 0.65 1.98 1.07 0.00 0.00 176.91 181.70 2jmx h MET 109 N 0.30 1.23 -0.39 1.72 -1.53 -0.44 -0.91 114.93 114.91 2jmx h MET 109 Ca -0.02 -0.07 0.08 0.00 -3.44 0.00 0.00 59.70 56.24 2jmx h MET 109 Cb 1.24 -0.28 -0.02 0.00 -0.55 0.00 0.00 31.60 31.99 2jmx h MET 109 CO 0.12 0.82 0.27 0.77 0.14 0.00 0.00 176.91 179.02 2jmx h SER 110 N 1.27 0.17 0.84 1.39 0.02 -1.46 0.91 113.55 116.70 2jmx h SER 110 Ca 0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 2jmx h SER 110 Cb -0.03 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.47 2jmx h SER 110 CO -0.11 0.11 0.00 0.52 -1.14 0.00 0.00 176.83 176.21 2jmx n VAL 111 N -4.47 0.04 0.08 2.27 0.31 -0.36 -3.16 118.33 113.05 2jmx n VAL 111 Ca 0.05 0.01 0.06 0.00 -0.01 0.00 0.00 64.34 64.45 2jmx n VAL 111 Cb 0.32 -0.52 -0.03 0.00 -0.91 0.00 0.00 33.84 32.70 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 0.05 3.52 -0.00 -0.67 -3.30 115.15 114.75 2jmx h HIS 112 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 60.37 60.05 2jmx h HIS 112 Cb 0.42 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 27.79 2jmx h HIS 112 CO 0.00 0.29 -1.83 -2.13 -0.00 0.00 0.00 177.93 174.26 2jmx n ARG 113 N -2.81 0.68 -1.49 5.12 0.63 -1.17 -4.20 116.66 113.42 2jmx n ARG 113 Ca -0.04 0.28 -0.33 0.00 -0.92 0.00 0.00 57.85 56.83 2jmx n ARG 113 Cb 0.69 -1.76 0.07 0.00 0.45 0.00 0.00 32.46 31.91 2jmx n ARG 113 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2jmx n GLY 114 N 1.72 5.95 2.72 5.14 0.00 -1.19 -4.48 105.19 115.05 2jmx n GLY 114 Ca -0.23 -2.38 -0.01 0.00 0.00 0.00 0.00 46.02 43.40 2jmx n GLY 114 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2jmx n GLU 115 N -0.86 1.48 -3.69 1.61 2.13 -1.24 -4.98 120.64 115.09 2jmx n GLU 115 Ca 0.59 -1.94 -0.29 0.00 0.66 0.00 0.00 57.16 56.19 2jmx n GLU 115 Cb 0.69 -0.22 -0.16 0.00 0.27 0.00 0.00 31.44 32.02 2jmx n GLU 115 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2jmx s VAL 116 N -1.11 0.50 -0.24 6.31 1.01 -1.26 -4.97 120.40 120.63 2jmx s VAL 116 Ca 0.15 -0.90 -0.29 0.00 0.00 0.00 0.00 61.98 60.94 2jmx s VAL 116 Cb 0.41 -1.24 -0.02 0.00 0.00 0.00 0.00 36.38 35.53 2jmx s VAL 116 CO -0.10 -0.50 1.53 -2.16 0.00 0.00 0.00 175.10 173.86 2jmx s PRO 117 N 1.83 3.83 0.28 2.72 0.04 -1.26 -5.00 135.00 137.44 2jmx s PRO 117 Ca 0.05 1.54 0.00 0.00 0.04 0.00 0.00 61.00 62.63 2jmx s PRO 117 Cb -0.17 -3.99 0.00 0.00 0.04 0.00 0.00 34.50 30.38 2jmx s PRO 117 CO -0.21 -1.25 0.02 0.00 0.04 0.00 0.00 177.00 175.60 2jmx s THR 119 N -1.95 1.64 0.00 0.00 2.01 -1.26 -5.31 115.64 110.77 2jmx s THR 119 Ca 0.01 -0.93 0.00 0.00 0.31 0.00 0.00 61.69 61.08 2jmx s THR 119 Cb -0.00 -1.67 0.00 0.00 0.01 0.00 0.00 72.50 70.84 2jmx s THR 119 CO 0.01 0.24 0.02 0.55 -0.69 0.00 0.00 174.62 174.75