#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmx s ALA 2 N 0.00 3.15 -0.19 4.37 0.00 -1.26 -4.93 121.76 122.91 2jmx s ALA 2 Ca 0.00 -2.12 -0.01 0.00 0.00 0.00 0.00 51.96 49.83 2jmx s ALA 2 Cb 0.00 -0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.01 2jmx s ALA 2 CO 0.00 -0.01 0.03 1.17 0.00 0.00 0.00 175.76 176.95 2jmx n LYS 3 N -0.94 -2.53 -3.85 0.00 4.81 -1.26 -4.99 118.16 109.40 2jmx n LYS 3 Ca -0.04 2.18 -0.30 0.00 -0.87 0.00 0.00 58.31 59.27 2jmx n LYS 3 Cb 0.64 -3.77 -0.15 0.00 0.02 0.00 0.00 35.03 31.77 2jmx n LYS 3 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 2jmx s LEU 4 N -1.25 3.15 -0.03 3.14 2.96 -1.26 -5.11 118.68 120.28 2jmx s LEU 4 Ca -0.03 -1.78 0.04 0.00 -0.22 0.00 0.00 54.13 52.15 2jmx s LEU 4 Cb 0.00 -1.16 -0.01 0.00 0.50 0.00 0.00 46.19 45.53 2jmx s LEU 4 CO 0.51 -0.39 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.31 2jmx s VAL 5 N 1.35 1.25 0.03 1.68 1.01 -1.26 -5.15 120.40 119.31 2jmx s VAL 5 Ca 0.09 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.43 2jmx s VAL 5 Cb -0.18 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 35.12 2jmx s VAL 5 CO -0.17 0.36 -0.04 -0.13 0.00 0.00 0.00 175.10 175.12 2jmx s ARG 6 N -0.13 0.36 -0.17 2.72 0.52 -1.26 -5.11 118.95 115.88 2jmx s ARG 6 Ca 0.01 -0.65 -0.29 0.00 -0.52 0.00 0.00 55.73 54.28 2jmx s ARG 6 Cb -0.08 0.03 -0.02 0.00 0.52 0.00 0.00 34.95 35.39 2jmx s ARG 6 CO 0.01 -0.03 1.40 -1.25 0.02 0.00 0.00 175.30 175.45 2jmx s PRO 7 N -1.53 4.12 1.01 3.54 0.04 -1.26 -5.01 135.00 135.91 2jmx s PRO 7 Ca -0.14 1.73 -0.14 0.00 0.04 0.00 0.00 61.00 62.48 2jmx s PRO 7 Cb -0.10 -3.87 0.20 0.00 0.04 0.00 0.00 34.50 30.77 2jmx s PRO 7 CO -0.01 -0.87 1.14 -1.25 0.04 0.00 0.00 177.00 176.05 2jmx s PRO 8 N 3.86 0.30 -0.18 0.56 0.04 -1.26 -5.05 135.00 133.28 2jmx s PRO 8 Ca 0.61 0.16 -0.01 0.00 0.04 0.00 0.00 61.00 61.80 2jmx s PRO 8 Cb -0.24 -1.75 -0.00 0.00 0.04 0.00 0.00 34.50 32.55 2jmx s PRO 8 CO 0.21 -2.74 -0.12 0.08 0.04 0.00 0.00 177.00 174.46 2jmx s VAL 9 N -3.21 2.82 0.01 -0.36 1.01 -1.26 -5.11 120.40 114.29 2jmx s VAL 9 Ca 0.67 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.96 2jmx s VAL 9 Cb -0.13 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 2jmx s VAL 9 CO 0.55 0.49 -0.05 -1.10 0.00 0.00 0.00 175.10 175.00 2jmx s GLN 10 N 1.06 0.35 -0.02 2.72 -0.21 -1.26 -5.03 119.66 117.27 2jmx s GLN 10 Ca -0.00 -0.33 -0.02 0.00 0.02 0.00 0.00 55.36 55.02 2jmx s GLN 10 Cb -0.15 -0.24 0.01 0.00 1.00 0.00 0.00 33.01 33.63 2jmx s GLN 10 CO -0.03 0.06 0.04 -0.89 -2.12 0.00 0.00 175.29 172.35 2jmx n ILE 11 N 2.47-11.35 -3.19 1.08 -0.00 -1.26 -5.03 119.36 102.08 2jmx n ILE 11 Ca -0.16 2.64 -0.15 0.00 -0.00 0.00 0.00 62.75 65.07 2jmx n ILE 11 Cb 0.57 -5.49 -0.05 0.00 -0.00 0.00 0.00 39.64 34.66 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 -0.52 -0.36 0.00 1.39 1.13 -1.26 -5.08 117.35 112.65 2jmx s TYR 12 Ca -0.05 -1.13 0.00 0.00 -1.41 0.00 0.00 57.07 54.48 2jmx s TYR 12 Cb 0.00 -0.30 0.00 0.00 -1.10 0.00 0.00 41.96 40.56 2jmx s TYR 12 CO 0.12 -1.03 0.00 0.41 -2.51 0.00 0.00 175.55 172.54 2jmx n GLY 13 N 3.46 3.31 0.49 5.49 0.00 -1.26 -4.88 105.19 111.80 2jmx n GLY 13 Ca 0.19 -0.57 0.32 0.00 0.00 0.00 0.00 46.02 45.96 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 0.40 -0.69 -0.61 -0.00 -2.02 0.22 117.51 114.81 2jmx h ILE 14 Ca 0.00 -0.05 0.11 0.00 -0.00 0.00 0.00 64.86 64.91 2jmx h ILE 14 Cb 0.00 0.23 -0.04 0.00 -0.00 0.00 0.00 36.82 37.01 2jmx h ILE 14 CO 0.00 0.03 0.46 -0.08 -0.00 0.00 0.00 178.15 178.55 2jmx h GLU 15 N 0.15 0.50 -0.80 2.19 4.81 -1.97 -0.59 114.58 118.87 2jmx h GLU 15 Ca 0.62 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.83 2jmx h GLU 15 Cb 2.10 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 31.32 2jmx h GLU 15 CO -0.16 0.33 0.53 0.78 -0.73 0.00 0.00 179.01 179.76 2jmx h GLY 16 N 0.51 1.13 1.42 1.92 0.00 -0.83 -1.48 103.07 105.74 2jmx h GLY 16 Ca 0.32 -0.42 0.07 0.00 0.00 0.00 0.00 47.33 47.30 2jmx h GLY 16 CO -0.10 0.40 0.23 3.21 0.00 0.00 0.00 176.54 180.27 2jmx h ARG 17 N 1.07 0.00 -0.88 4.80 2.47 -1.21 -1.69 114.38 118.94 2jmx h ARG 17 Ca 0.30 0.00 0.07 0.00 -1.26 0.00 0.00 59.98 59.08 2jmx h ARG 17 Cb -0.10 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 28.16 2jmx h ARG 17 CO -0.07 0.00 0.54 1.88 0.56 0.00 0.00 179.97 182.89 2jmx h TYR 18 N 0.00 1.01 -0.01 3.04 -1.99 -1.34 1.10 116.97 118.77 2jmx h TYR 18 Ca 0.11 0.03 -0.24 0.00 2.00 0.00 0.00 58.73 60.63 2jmx h TYR 18 Cb 0.56 -0.32 0.01 0.00 2.00 0.00 0.00 36.73 38.97 2jmx h TYR 18 CO 0.00 0.50 -0.96 0.00 -0.00 0.00 0.00 178.16 177.70 2jmx h ALA 19 N 1.42 0.28 -0.05 3.88 0.00 -1.47 -2.64 119.26 120.68 2jmx h ALA 19 Ca 0.39 -0.69 -0.17 0.00 0.00 0.00 0.00 54.91 54.43 2jmx h ALA 19 Cb 0.19 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2jmx h ALA 19 CO -0.18 0.75 -0.71 1.15 0.00 0.00 0.00 179.25 180.26 2jmx h THR 20 N 0.32 1.42 0.00 0.00 2.02 -1.19 0.31 112.91 115.78 2jmx h THR 20 Ca -0.10 -2.20 0.00 0.00 0.77 0.00 0.00 66.41 64.88 2jmx h THR 20 Cb 1.60 2.16 0.00 0.00 -1.74 0.00 0.00 68.15 70.17 2jmx h THR 20 CO 0.18 0.65 0.00 0.00 0.37 0.00 0.00 175.52 176.72 2jmx n ALA 21 N -2.48 2.26 -0.13 6.16 0.00 0.37 -1.53 120.51 125.16 2jmx n ALA 21 Ca -0.03 -0.08 -0.23 0.00 0.00 0.00 0.00 53.44 53.09 2jmx n ALA 21 Cb 0.69 -1.45 -0.11 0.00 0.00 0.00 0.00 19.45 18.58 2jmx n ALA 21 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2jmx n LEU 22 N -1.61 2.53 0.12 0.00 7.94 -1.00 -4.27 117.00 120.72 2jmx n LEU 22 Ca 0.06 0.07 0.13 0.00 -1.11 0.00 0.00 56.01 55.16 2jmx n LEU 22 Cb 0.34 -0.86 0.46 0.00 0.53 0.00 0.00 43.42 43.88 2jmx n LEU 22 CO 0.26 0.78 0.87 0.00 -1.11 0.00 0.00 177.39 178.19 2jmx n TYR 23 N -3.68 0.91 -0.34 1.96 0.18 0.08 -3.23 117.16 113.03 2jmx n TYR 23 Ca -0.49 0.31 0.12 0.00 1.88 0.00 0.00 57.90 59.72 2jmx n TYR 23 Cb 0.94 -1.01 0.31 0.00 -0.38 0.00 0.00 39.34 39.21 2jmx n TYR 23 CO 0.00 0.00 0.00 0.66 -2.08 0.00 0.00 176.86 175.44 2jmx h SER 24 N 0.00 0.73 0.01 9.48 4.64 -1.46 1.19 113.55 128.14 2jmx h SER 24 Ca 0.00 0.10 -0.25 0.00 -0.47 0.00 0.00 61.79 61.17 2jmx h SER 24 Cb 0.54 -0.03 0.02 0.00 -0.31 0.00 0.00 62.40 62.62 2jmx h SER 24 CO 0.00 0.25 -0.97 0.00 -0.87 0.00 0.00 176.83 175.24 2jmx h ALA 25 N 1.64 0.11 -0.82 5.18 0.00 -1.81 -3.16 119.26 120.41 2jmx h ALA 25 Ca 0.57 -0.68 0.10 0.00 0.00 0.00 0.00 54.91 54.90 2jmx h ALA 25 Cb 0.89 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 2jmx h ALA 25 CO -0.39 0.62 0.53 0.00 0.00 0.00 0.00 179.25 180.01 2jmx h ALA 26 N 0.38 1.76 -0.91 0.00 0.00 -0.23 -0.99 119.26 119.27 2jmx h ALA 26 Ca -0.12 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 54.89 2jmx h ALA 26 Cb 1.64 -0.17 -0.08 0.00 0.00 0.00 0.00 17.79 19.19 2jmx h ALA 26 CO 0.19 0.07 0.54 0.66 0.00 0.00 0.00 179.25 180.71 2jmx h SER 27 N 0.74 0.79 -0.20 0.00 4.64 0.12 0.94 113.55 120.58 2jmx h SER 27 Ca 0.38 0.05 -0.19 0.00 -0.47 0.00 0.00 61.79 61.56 2jmx h SER 27 Cb 0.48 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2jmx h SER 27 CO -0.15 0.44 -0.58 0.50 -0.87 0.00 0.00 176.83 176.17 2jmx h LYS 28 N 0.89 0.80 -0.00 4.77 3.64 -1.29 -2.93 116.57 122.45 2jmx h LYS 28 Ca 0.44 -0.53 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2jmx h LYS 28 Cb 0.40 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 2jmx h LYS 28 CO -0.25 1.16 -0.02 1.04 -2.27 0.00 0.00 179.45 179.10 2jmx n GLN 29 N -3.99 0.64 -3.11 1.90 6.02 -0.40 -4.92 117.38 113.52 2jmx n GLN 29 Ca -0.04 -0.06 -0.14 0.00 -0.01 0.00 0.00 57.00 56.74 2jmx n GLN 29 Cb 0.64 -1.50 0.05 0.00 1.02 0.00 0.00 30.24 30.45 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 -1.12 -4.36 -1.10 1.08 2.85 0.31 -4.94 115.26 107.97 2jmx n ASN 30 Ca 0.17 -0.32 0.08 0.00 -0.11 0.00 0.00 54.58 54.40 2jmx n ASN 30 Cb 0.22 -3.14 0.27 0.00 1.24 0.00 0.00 39.78 38.37 2jmx n ASN 30 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2jmx n LYS 31 N -3.10 3.25 -0.34 1.20 4.01 -0.23 -4.63 118.16 118.32 2jmx n LYS 31 Ca -0.01 -2.62 0.22 0.00 -0.51 0.00 0.00 58.31 55.40 2jmx n LYS 31 Cb 0.54 -1.69 0.48 0.00 -0.51 0.00 0.00 35.03 33.85 2jmx n LYS 31 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 2jmx h LEU 32 N 2.80 0.51 -0.04 -0.35 -0.00 -1.93 0.52 115.31 116.82 2jmx h LEU 32 Ca 0.00 0.11 -0.19 0.00 -0.00 0.00 0.00 57.88 57.80 2jmx h LEU 32 Cb 1.23 0.03 0.01 0.00 -0.00 0.00 0.00 40.66 41.93 2jmx h LEU 32 CO 0.16 0.06 -0.73 -0.33 -0.00 0.00 0.00 178.44 177.60 2jmx h GLU 33 N 0.43 0.57 -0.07 1.13 5.08 -1.96 0.84 114.58 120.59 2jmx h GLU 33 Ca 0.64 -0.56 0.02 0.00 -1.00 0.00 0.00 59.36 58.46 2jmx h GLU 33 Cb 1.50 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.89 2jmx h GLU 33 CO -0.38 1.18 0.06 1.96 -1.00 0.00 0.00 179.01 180.82 2jmx h GLN 34 N 0.17 0.00 0.00 2.33 1.08 -0.47 -1.81 115.11 116.40 2jmx h GLN 34 Ca -0.08 0.00 -0.30 0.00 -1.45 0.00 0.00 58.65 56.82 2jmx h GLN 34 Cb 1.40 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.78 2jmx h GLN 34 CO 0.15 0.00 -2.12 0.28 -0.95 0.00 0.00 178.83 176.18 2jmx n VAL 35 N -4.36 1.13 0.21 -0.54 0.31 0.86 -3.97 118.33 111.97 2jmx n VAL 35 Ca -0.01 -0.43 0.07 0.00 -0.01 0.00 0.00 64.34 63.96 2jmx n VAL 35 Cb 0.16 -1.20 0.46 0.00 -0.91 0.00 0.00 33.84 32.35 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 0.00 0.08 5.55 4.22 0.71 -1.68 114.58 123.46 2jmx h GLU 36 Ca -0.44 0.00 -0.34 0.00 0.08 0.00 0.00 59.36 58.66 2jmx h GLU 36 Cb 1.68 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.90 2jmx h GLU 36 CO -0.07 0.29 -1.91 1.17 -2.18 0.00 0.00 179.01 176.32 2jmx n LYS 37 N -3.70 0.71 0.07 1.92 4.81 -0.68 -3.80 118.16 117.48 2jmx n LYS 37 Ca -0.01 0.27 -0.14 0.00 -0.87 0.00 0.00 58.31 57.56 2jmx n LYS 37 Cb 0.40 -1.73 -0.05 0.00 0.02 0.00 0.00 35.03 33.67 2jmx n LYS 37 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2jmx h GLU 38 N 0.04 0.41 -0.63 1.64 3.07 -1.68 -3.12 114.58 114.31 2jmx h GLU 38 Ca -0.38 -0.45 0.07 0.00 -0.50 0.00 0.00 59.36 58.11 2jmx h GLU 38 Cb 2.03 0.13 -0.04 0.00 -0.84 0.00 0.00 28.75 30.03 2jmx h GLU 38 CO 0.08 1.11 0.42 -0.07 -1.40 0.00 0.00 179.01 179.15 2jmx h LEU 39 N 0.23 0.50 -1.54 1.33 3.38 -1.47 -0.94 115.31 116.80 2jmx h LEU 39 Ca -0.08 0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.97 2jmx h LEU 39 Cb 1.58 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 42.19 2jmx h LEU 39 CO 0.16 0.31 0.42 0.25 0.09 0.00 0.00 178.44 179.67 2jmx h LEU 40 N 0.56 0.48 -0.76 1.67 5.85 -1.64 -1.83 115.31 119.65 2jmx h LEU 40 Ca 0.28 0.01 0.03 0.00 0.84 0.00 0.00 57.88 59.03 2jmx h LEU 40 Cb 0.36 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 2jmx h LEU 40 CO -0.08 0.30 0.49 0.03 -0.34 0.00 0.00 178.44 178.84 2jmx h ARG 41 N 0.55 0.93 -0.92 1.25 -0.00 -1.29 -1.27 114.38 113.63 2jmx h ARG 41 Ca 0.28 -0.06 0.01 0.00 -0.50 0.00 0.00 59.98 59.71 2jmx h ARG 41 Cb 0.39 -0.21 -0.05 0.00 0.00 0.00 0.00 29.97 30.10 2jmx h ARG 41 CO -0.09 0.61 0.60 0.28 0.00 0.00 0.00 179.97 181.38 2jmx h VAL 42 N 0.96 1.24 -0.23 2.04 2.07 -1.41 -0.18 116.25 120.73 2jmx h VAL 42 Ca 0.30 -0.45 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 2jmx h VAL 42 Cb -0.01 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.65 2jmx h VAL 42 CO -0.10 0.23 0.02 1.23 0.02 0.00 0.00 177.57 178.97 2jmx h GLY 43 N 1.25 0.42 1.04 2.17 0.00 -1.27 -2.53 103.07 104.15 2jmx h GLY 43 Ca 0.33 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2jmx h GLY 43 CO -0.07 0.27 0.60 1.46 0.00 0.00 0.00 176.54 178.80 2jmx h GLN 44 N 0.18 1.28 -0.99 4.80 4.20 -0.77 -1.94 115.11 121.86 2jmx h GLN 44 Ca 0.07 -0.10 0.03 0.00 0.06 0.00 0.00 58.65 58.71 2jmx h GLN 44 Cb 0.35 -0.28 -0.05 0.00 0.30 0.00 0.00 27.48 27.80 2jmx h GLN 44 CO 0.01 0.88 0.65 0.82 -0.67 0.00 0.00 178.83 180.51 2jmx h ILE 45 N 1.31 1.20 -0.32 2.54 2.04 -0.82 0.43 117.51 123.89 2jmx h ILE 45 Ca 0.35 -0.44 -0.15 0.00 1.00 0.00 0.00 64.86 65.62 2jmx h ILE 45 Cb -0.10 -0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 35.79 2jmx h ILE 45 CO -0.07 0.23 -0.41 0.25 0.00 0.00 0.00 178.15 178.15 2jmx h LEU 46 N 1.27 0.83 -0.33 1.44 7.12 -0.95 -3.11 115.31 121.59 2jmx h LEU 46 Ca 0.38 -0.39 -0.19 0.00 0.13 0.00 0.00 57.88 57.82 2jmx h LEU 46 Cb -0.04 -0.23 -0.02 0.00 -0.53 0.00 0.00 40.66 39.84 2jmx h LEU 46 CO -0.11 1.14 -0.85 0.50 -0.13 0.00 0.00 178.44 178.99 2jmx h LYS 47 N 0.63 0.12 -6.66 1.25 1.63 -0.80 -3.42 116.57 109.32 2jmx h LYS 47 Ca 0.05 -0.13 -0.58 0.00 -0.85 0.00 0.00 60.65 59.14 2jmx h LYS 47 Cb 0.97 0.04 0.11 0.00 -0.60 0.00 0.00 32.23 32.75 2jmx h LYS 47 CO 0.09 0.89 0.38 0.39 -3.45 0.00 0.00 179.45 177.76 2jmx n GLU 48 N -3.63 1.87 -0.02 1.90 1.02 0.15 -4.90 120.64 117.01 2jmx n GLU 48 Ca -0.02 0.65 -0.17 0.00 -0.02 0.00 0.00 57.16 57.60 2jmx n GLU 48 Cb 0.79 -2.17 -0.08 0.00 -0.02 0.00 0.00 31.44 29.97 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 2.35 0.67 -0.72 3.49 0.13 -1.88 -2.65 132.00 133.39 2jmx h PRO 49 Ca -0.44 -0.55 0.09 0.00 -0.87 0.00 0.00 66.00 64.23 2jmx h PRO 49 Cb 1.30 0.12 -0.05 0.00 0.13 0.00 0.00 31.00 32.50 2jmx h PRO 49 CO 0.62 1.16 0.47 -0.22 -0.23 0.00 0.00 178.00 179.81 2jmx h LYS 50 N 0.34 0.63 0.00 0.86 3.64 -1.93 -1.65 116.57 118.46 2jmx h LYS 50 Ca -0.05 -0.04 -0.17 0.00 -1.27 0.00 0.00 60.65 59.13 2jmx h LYS 50 Cb 1.29 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.95 2jmx h LYS 50 CO 0.14 0.42 -0.84 0.52 -2.27 0.00 0.00 179.45 177.41 2jmx h MET 51 N 0.65 0.00 -0.98 1.90 2.86 -1.79 -3.31 114.93 114.26 2jmx h MET 51 Ca 0.33 0.00 0.22 0.00 -2.06 0.00 0.00 59.70 58.19 2jmx h MET 51 Cb 0.42 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 31.99 2jmx h MET 51 CO -0.11 0.76 0.63 0.00 1.06 0.00 0.00 176.91 179.25 2jmx h ALA 52 N 1.21 2.10 -0.36 6.32 0.00 -0.92 0.83 119.26 128.45 2jmx h ALA 52 Ca -0.02 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2jmx h ALA 52 Cb 1.62 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.37 2jmx h ALA 52 CO 0.10 -0.45 0.13 0.00 0.00 0.00 0.00 179.25 179.03 2jmx h ALA 53 N 1.62 1.57 0.01 0.00 0.00 -1.65 -2.61 119.26 118.20 2jmx h ALA 53 Ca 0.54 -0.11 -0.38 0.00 0.00 0.00 0.00 54.91 54.96 2jmx h ALA 53 Cb 1.24 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.81 2jmx h ALA 53 CO -0.26 0.34 -2.41 0.43 0.00 0.00 0.00 179.25 177.35 2jmx n SER 54 N -4.38 1.79 -0.27 0.00 7.64 0.79 -3.60 113.62 115.58 2jmx n SER 54 Ca 0.02 -0.08 0.00 0.00 1.01 0.00 0.00 58.87 59.82 2jmx n SER 54 Cb 0.15 -0.32 0.13 0.00 -1.01 0.00 0.00 64.21 63.16 2jmx n SER 54 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2jmx h LEU 55 N 0.01 0.70 -3.80 -3.43 -0.00 0.46 -2.45 115.31 106.79 2jmx h LEU 55 Ca -0.56 0.03 -0.54 0.00 -0.00 0.00 0.00 57.88 56.81 2jmx h LEU 55 Cb 1.95 -0.11 -0.31 0.00 -0.00 0.00 0.00 40.66 42.19 2jmx h LEU 55 CO -0.06 0.44 0.13 -0.11 -0.00 0.00 0.00 178.44 178.85 2jmx n LEU 56 N -4.71 6.09 -4.57 1.67 0.00 -0.99 -4.97 117.00 109.53 2jmx n LEU 56 Ca 0.11 -4.30 -0.40 0.00 0.00 0.00 0.00 56.01 51.42 2jmx n LEU 56 Cb 0.19 -0.70 -0.10 0.00 0.00 0.00 0.00 43.42 42.82 2jmx n LEU 56 CO 0.30 1.61 -0.00 0.21 0.00 0.00 0.00 177.39 179.51 2jmx s ASN 57 N -2.50 6.17 0.00 1.96 3.84 -0.93 -4.93 114.94 118.55 2jmx s ASN 57 Ca 0.56 -0.02 0.17 0.00 0.21 0.00 0.00 52.86 53.78 2jmx s ASN 57 Cb 0.46 -2.18 0.72 0.00 -0.55 0.00 0.00 41.25 39.69 2jmx s ASN 57 CO 0.02 -0.22 1.53 -0.81 -2.79 0.00 0.00 177.10 174.83 2jmx n PRO 58 N 5.29 0.01 -0.09 0.43 -0.04 -1.26 -2.84 135.00 136.50 2jmx n PRO 58 Ca -0.10 0.21 0.08 0.00 -0.04 0.00 0.00 63.50 63.65 2jmx n PRO 58 Cb 0.50 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.78 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 -1.49 0.23 -1.17 0.54 4.01 -1.26 -4.01 117.16 114.00 2jmx n TYR 59 Ca 0.04 -0.12 -0.04 0.00 -0.16 0.00 0.00 57.90 57.63 2jmx n TYR 59 Cb 0.19 0.00 0.25 0.00 -0.31 0.00 0.00 39.34 39.47 2jmx n TYR 59 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2jmx n VAL 60 N 0.14 2.70 -2.00 -0.72 0.31 -1.13 -5.08 118.33 112.54 2jmx n VAL 60 Ca 0.13 -2.05 0.02 0.00 -0.01 0.00 0.00 64.34 62.44 2jmx n VAL 60 Cb 0.25 -0.33 -0.01 0.00 -0.91 0.00 0.00 33.84 32.85 2jmx n VAL 60 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2jmx n LYS 61 N -0.63 -0.30 -0.02 5.55 5.02 -1.26 -3.67 118.16 122.86 2jmx n LYS 61 Ca 0.36 0.20 -0.06 0.00 -2.02 0.00 0.00 58.31 56.78 2jmx n LYS 61 Cb 1.20 -0.36 -0.02 0.00 -0.02 0.00 0.00 35.03 35.82 2jmx n LYS 61 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2jmx n ARG 62 N -1.23 0.21 -0.35 1.97 0.00 -1.26 -4.36 116.66 111.64 2jmx n ARG 62 Ca 0.00 0.09 -0.03 0.00 -0.00 0.00 0.00 57.85 57.91 2jmx n ARG 62 Cb 0.07 -0.87 0.10 0.00 0.00 0.00 0.00 32.46 31.76 2jmx n ARG 62 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.63 178.40 2jmx h SER 63 N -0.38 1.13 -0.84 6.15 0.02 -1.94 -2.18 113.55 115.51 2jmx h SER 63 Ca -0.10 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 2jmx h SER 63 Cb 0.70 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.91 2jmx h SER 63 CO -0.06 0.86 0.53 0.58 -1.14 0.00 0.00 176.83 177.60 2jmx h VAL 64 N 1.30 1.22 -0.89 2.27 2.07 -1.84 -2.12 116.25 118.26 2jmx h VAL 64 Ca 0.34 -0.45 0.06 0.00 0.82 0.00 0.00 66.70 67.46 2jmx h VAL 64 Cb -0.07 0.02 -0.06 0.00 -1.52 0.00 0.00 31.29 29.67 2jmx h VAL 64 CO -0.06 0.23 0.58 0.50 0.02 0.00 0.00 177.57 178.83 2jmx h LYS 65 N 1.15 1.01 -0.65 1.57 3.64 -1.46 -1.81 116.57 120.01 2jmx h LYS 65 Ca 0.30 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.60 2jmx h LYS 65 Cb -0.09 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 31.48 2jmx h LYS 65 CO -0.06 0.67 0.31 0.28 -2.27 0.00 0.00 179.45 178.38 2jmx h VAL 66 N 1.04 1.22 -0.88 2.00 2.07 -1.31 -2.45 116.25 117.94 2jmx h VAL 66 Ca 0.38 -0.62 0.02 0.00 0.82 0.00 0.00 66.70 67.30 2jmx h VAL 66 Cb 0.16 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 30.32 2jmx h VAL 66 CO -0.13 0.26 0.58 0.50 0.02 0.00 0.00 177.57 178.79 2jmx h LYS 67 N 0.89 1.11 -0.71 1.57 3.64 -1.24 -1.83 116.57 120.00 2jmx h LYS 67 Ca 0.22 -0.07 0.06 0.00 -1.27 0.00 0.00 60.65 59.60 2jmx h LYS 67 Cb 0.12 -0.25 -0.04 0.00 -0.41 0.00 0.00 32.23 31.64 2jmx h LYS 67 CO -0.03 0.73 0.47 1.03 -2.27 0.00 0.00 179.45 179.38 2jmx h SER 68 N 1.14 0.66 -0.52 4.20 0.87 -1.07 -2.03 113.55 116.80 2jmx h SER 68 Ca 0.34 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.91 2jmx h SER 68 Cb -0.05 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 61.74 2jmx h SER 68 CO -0.09 0.43 0.33 -0.07 -0.53 0.00 0.00 176.83 176.90 2jmx h LEU 69 N 0.75 0.55 -0.64 2.23 3.38 -1.25 0.11 115.31 120.45 2jmx h LEU 69 Ca 0.30 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.27 2jmx h LEU 69 Cb 0.24 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2jmx h LEU 69 CO -0.10 0.39 0.39 -1.28 0.09 0.00 0.00 178.44 177.94 2jmx h SER 70 N 0.66 0.75 0.77 -0.43 0.87 -1.39 0.83 113.55 115.61 2jmx h SER 70 Ca 0.20 -0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.69 2jmx h SER 70 Cb -0.03 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 61.73 2jmx h SER 70 CO -0.06 0.58 -0.11 -0.78 -0.53 0.00 0.00 176.83 175.93 2jmx h ASP 71 N 0.86 0.00 0.08 6.23 1.82 -1.11 0.71 116.42 125.01 2jmx h ASP 71 Ca 0.23 0.00 -0.27 0.00 -0.39 0.00 0.00 57.03 56.60 2jmx h ASP 71 Cb -0.05 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 39.95 2jmx h ASP 71 CO -0.05 0.11 -1.43 -0.03 -1.61 0.00 0.00 179.24 176.23 2jmx h MET 72 N 0.00 0.16 -0.81 0.28 4.05 0.10 -3.25 114.93 115.45 2jmx h MET 72 Ca -0.00 -0.28 0.04 0.00 -0.28 0.00 0.00 59.70 59.19 2jmx h MET 72 Cb 0.52 0.10 -0.05 0.00 -0.80 0.00 0.00 31.60 31.38 2jmx h MET 72 CO 0.01 1.13 0.53 1.15 0.23 0.00 0.00 176.91 179.97 2jmx h THR 73 N -0.47 1.10 -0.96 -0.77 2.02 0.74 0.85 112.91 115.43 2jmx h THR 73 Ca -0.33 -0.33 0.01 0.00 0.77 0.00 0.00 66.41 66.52 2jmx h THR 73 Cb 1.64 0.05 -0.05 0.00 -1.74 0.00 0.00 68.15 68.06 2jmx h THR 73 CO -0.02 0.18 0.63 0.00 0.37 0.00 0.00 175.52 176.67 2jmx h ALA 74 N 1.54 1.30 0.07 6.16 0.00 -0.97 -1.47 119.26 125.89 2jmx h ALA 74 Ca 0.33 -0.07 -0.29 0.00 0.00 0.00 0.00 54.91 54.88 2jmx h ALA 74 Cb 0.10 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2jmx h ALA 74 CO -0.10 0.64 -1.52 -0.22 0.00 0.00 0.00 179.25 178.05 2jmx h LYS 75 N 1.31 0.15 0.00 0.00 3.64 -1.29 -3.31 116.57 117.07 2jmx h LYS 75 Ca 0.35 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2jmx h LYS 75 Cb -0.13 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 2jmx h LYS 75 CO -0.07 0.96 0.00 -1.91 -2.27 0.00 0.00 179.45 176.15 2jmx n GLU 76 N -3.34 0.14 -3.56 1.90 4.07 0.28 -4.90 120.64 115.23 2jmx n GLU 76 Ca -0.15 0.39 -0.20 0.00 -0.06 0.00 0.00 57.16 57.13 2jmx n GLU 76 Cb 1.03 -1.77 0.07 0.00 -0.06 0.00 0.00 31.44 30.71 2jmx n GLU 76 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 2jmx n LYS 77 N -2.03 -6.39 -0.09 5.31 5.02 -0.57 -4.97 118.16 114.44 2jmx n LYS 77 Ca 0.02 0.77 -0.07 0.00 -2.02 0.00 0.00 58.31 57.01 2jmx n LYS 77 Cb 0.20 -5.68 0.07 0.00 -0.02 0.00 0.00 35.03 29.61 2jmx n LYS 77 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2jmx n PHE 78 N -4.37 -2.14 -3.28 2.13 3.72 -1.23 -5.03 117.46 107.25 2jmx n PHE 78 Ca -0.21 -0.16 -0.11 0.00 -0.05 0.00 0.00 57.45 56.91 2jmx n PHE 78 Cb 0.64 -0.37 0.02 0.00 -0.94 0.00 0.00 39.48 38.83 2jmx n PHE 78 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2jmx n SER 79 N -3.00 1.41 0.07 4.37 7.64 -1.26 -4.97 113.62 117.88 2jmx n SER 79 Ca 0.03 -1.87 0.10 0.00 1.01 0.00 0.00 58.87 58.14 2jmx n SER 79 Cb 0.14 -0.14 0.42 0.00 -1.01 0.00 0.00 64.21 63.62 2jmx n SER 79 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2jmx n PRO 80 N -1.47 0.11 -0.46 1.43 -0.04 -1.26 -2.76 135.00 130.54 2jmx n PRO 80 Ca 0.05 0.31 0.05 0.00 -0.04 0.00 0.00 63.50 63.87 2jmx n PRO 80 Cb 0.32 -1.69 0.20 0.00 -0.04 0.00 0.00 33.50 32.29 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 -1.89 3.35 -0.33 1.53 4.77 -1.26 -4.63 117.00 118.55 2jmx n LEU 81 Ca 0.03 -3.37 0.04 0.00 -0.03 0.00 0.00 56.01 52.68 2jmx n LEU 81 Cb 0.23 -0.54 0.05 0.00 -2.33 0.00 0.00 43.42 40.83 2jmx n LEU 81 CO 0.18 0.94 0.37 0.41 -1.33 0.00 0.00 177.39 177.97 2jmx n THR 82 N -1.02 0.70 -2.08 -5.08 -1.04 -1.11 -4.73 114.28 99.92 2jmx n THR 82 Ca 0.23 -0.84 -0.12 0.00 -2.04 0.00 0.00 64.05 61.28 2jmx n THR 82 Cb 0.83 0.24 0.07 0.00 -1.82 0.00 0.00 70.33 69.65 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 -0.53 3.44 0.16 8.00 3.41 -1.26 -4.32 113.62 122.52 2jmx n SER 83 Ca 0.06 -3.42 0.00 0.00 -0.26 0.00 0.00 58.87 55.25 2jmx n SER 83 Cb 0.67 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 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 -0.71 -1.02 0.18 4.04 3.02 -1.26 -4.79 115.26 114.71 2jmx n ASN 84 Ca 0.30 0.55 0.15 0.00 -0.03 0.00 0.00 54.58 55.56 2jmx n ASN 84 Cb 0.89 1.13 0.75 0.00 -0.61 0.00 0.00 39.78 41.95 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 -1.17 3.41 5.85 -1.85 -0.32 115.31 121.23 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 0.48 -0.29 -0.34 0.00 0.00 178.44 178.29 2jmx h ILE 86 N 0.00 1.21 -0.27 4.05 2.10 -1.87 -1.93 117.51 120.80 2jmx h ILE 86 Ca 0.09 -0.44 -0.08 0.00 1.08 0.00 0.00 64.86 65.51 2jmx h ILE 86 Cb 0.43 0.11 -0.01 0.00 -1.09 0.00 0.00 36.82 36.26 2jmx h ILE 86 CO -0.00 0.22 -0.14 0.78 -1.08 0.00 0.00 178.15 177.93 2jmx h ASN 87 N 1.06 0.60 -0.90 2.19 2.35 -1.37 -2.94 115.58 116.57 2jmx h ASN 87 Ca 0.28 -0.41 0.14 0.00 -0.55 0.00 0.00 56.30 55.76 2jmx h ASN 87 Cb -0.07 -0.17 -0.09 0.00 0.05 0.00 0.00 38.32 38.05 2jmx h ASN 87 CO -0.05 0.88 0.50 -0.07 -1.65 0.00 0.00 177.43 177.03 2jmx h LEU 88 N 0.32 0.65 -0.95 1.61 3.38 -1.24 0.68 115.31 119.76 2jmx h LEU 88 Ca 0.06 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 2jmx h LEU 88 Cb 0.66 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 2jmx h LEU 88 CO 0.04 0.29 0.44 -0.07 0.09 0.00 0.00 178.44 179.23 2jmx h LEU 89 N 0.72 1.06 -3.68 1.67 3.38 -1.22 -2.43 115.31 114.82 2jmx h LEU 89 Ca 0.48 -0.11 -0.33 0.00 0.09 0.00 0.00 57.88 58.01 2jmx h LEU 89 Cb 0.63 -0.27 -0.20 0.00 0.09 0.00 0.00 40.66 40.92 2jmx h LEU 89 CO -0.34 0.87 0.29 0.00 0.09 0.00 0.00 178.44 179.36 2jmx n ALA 90 N -2.42 4.87 -0.13 1.53 0.00 0.07 -0.71 120.51 123.73 2jmx n ALA 90 Ca 0.09 -2.91 -0.25 0.00 0.00 0.00 0.00 53.44 50.37 2jmx n ALA 90 Cb 0.12 -1.11 -0.11 0.00 0.00 0.00 0.00 19.45 18.34 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 -1.00 0.62 -0.96 0.00 2.13 0.21 -4.38 120.64 117.26 2jmx n GLU 91 Ca 0.46 0.25 -0.05 0.00 0.66 0.00 0.00 57.16 58.47 2jmx n GLU 91 Cb 1.36 -1.53 0.17 0.00 0.27 0.00 0.00 31.44 31.70 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 -3.86 2.81 -1.35 4.31 3.02 -1.25 -4.93 115.26 114.00 2jmx n ASN 92 Ca -0.49 -3.83 -0.03 0.00 -0.03 0.00 0.00 54.58 50.20 2jmx n ASN 92 Cb 0.92 -0.57 0.02 0.00 -0.61 0.00 0.00 39.78 39.53 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 -1.05 0.39 1.96 7.41 0.00 -1.26 -4.97 105.19 107.67 2jmx n GLY 93 Ca 0.32 -0.41 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.51 2.42 -0.99 1.61 3.00 0.11 -4.55 116.66 116.75 2jmx n ARG 94 Ca -0.04 -3.27 -0.11 0.00 -0.01 0.00 0.00 57.85 54.42 2jmx n ARG 94 Cb 0.53 -2.13 0.23 0.00 0.00 0.00 0.00 32.46 31.09 2jmx n ARG 94 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2jmx n LEU 95 N -1.03 5.65 -0.07 0.55 4.77 -1.17 -3.86 117.00 121.85 2jmx n LEU 95 Ca 0.52 -3.48 -0.14 0.00 -0.03 0.00 0.00 56.01 52.89 2jmx n LEU 95 Cb 1.14 -0.73 -0.05 0.00 -2.33 0.00 0.00 43.42 41.45 2jmx n LEU 95 CO 0.53 0.99 -0.84 0.35 -1.33 0.00 0.00 177.39 177.10 2jmx n THR 96 N -0.77 1.11 -1.41 -5.08 -2.24 -1.26 -4.60 114.28 100.03 2jmx n THR 96 Ca 0.44 -0.06 -0.28 0.00 -2.27 0.00 0.00 64.05 61.88 2jmx n THR 96 Cb 1.36 -1.85 0.11 0.00 -2.10 0.00 0.00 70.33 67.85 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 5.84 0.13 3.42 3.02 -1.26 -4.67 115.26 117.85 2jmx n ASN 97 Ca -0.24 -3.74 -0.01 0.00 -0.03 0.00 0.00 54.58 50.55 2jmx n ASN 97 Cb 0.58 -0.83 0.22 0.00 -0.61 0.00 0.00 39.78 39.14 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 1.15 1.37 -0.28 3.41 1.03 -1.81 -3.18 112.91 114.60 2jmx h THR 98 Ca 0.54 -1.78 -0.13 0.00 -0.01 0.00 0.00 66.41 65.03 2jmx h THR 98 Cb 1.49 1.92 -0.01 0.00 -1.07 0.00 0.00 68.15 70.48 2jmx h THR 98 CO 1.24 0.52 -0.37 1.55 -0.01 0.00 0.00 175.52 178.45 2jmx h PRO 99 N 0.07 0.63 -0.79 0.00 0.13 -1.88 -2.91 132.00 127.25 2jmx h PRO 99 Ca -0.00 -0.31 0.10 0.00 -0.87 0.00 0.00 66.00 64.92 2jmx h PRO 99 Cb 0.94 -0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.01 2jmx h PRO 99 CO 0.07 0.90 0.52 0.00 -0.23 0.00 0.00 178.00 179.26 2jmx h ALA 100 N 1.07 1.78 -0.97 -0.56 0.00 -1.92 -1.05 119.26 117.61 2jmx h ALA 100 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2jmx h ALA 100 Cb 0.88 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.46 2jmx h ALA 100 CO 0.08 0.06 0.61 0.28 0.00 0.00 0.00 179.25 180.27 2jmx h VAL 101 N 0.72 1.26 -0.63 0.00 2.07 -1.59 -2.16 116.25 115.91 2jmx h VAL 101 Ca 0.37 -0.52 -0.04 0.00 0.82 0.00 0.00 66.70 67.33 2jmx h VAL 101 Cb 0.47 -0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.07 2jmx h VAL 101 CO -0.14 0.26 0.22 0.40 0.02 0.00 0.00 177.57 178.33 2jmx h ILE 102 N 1.33 1.23 -0.42 4.57 2.04 -1.25 -2.77 117.51 122.24 2jmx h ILE 102 Ca 0.35 -0.75 0.02 0.00 1.00 0.00 0.00 64.86 65.48 2jmx h ILE 102 Cb -0.10 0.51 -0.03 0.00 -0.74 0.00 0.00 36.82 36.46 2jmx h ILE 102 CO -0.07 0.29 0.25 -1.28 0.00 0.00 0.00 178.15 177.34 2jmx h SER 103 N 0.91 0.41 -0.61 1.72 0.87 -1.19 -1.34 113.55 114.32 2jmx h SER 103 Ca 0.21 0.00 0.11 0.00 -1.23 0.00 0.00 61.79 60.88 2jmx h SER 103 Cb 0.22 -0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 62.06 2jmx h SER 103 CO -0.01 0.29 0.41 0.00 -0.53 0.00 0.00 176.83 176.99 2jmx h ALA 104 N 1.18 2.05 -0.00 6.23 0.00 -1.30 -1.89 119.26 125.54 2jmx h ALA 104 Ca 0.17 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.07 2jmx h ALA 104 Cb 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2jmx h ALA 104 CO -0.07 -0.19 -0.04 0.35 0.00 0.00 0.00 179.25 179.29 2jmx h PHE 105 N 0.38 -0.10 -0.07 0.00 3.04 -1.11 0.01 116.94 119.09 2jmx h PHE 105 Ca 0.28 0.00 -0.03 0.00 3.98 0.00 0.00 57.97 62.20 2jmx h PHE 105 Cb 0.60 0.05 -0.01 0.00 2.56 0.00 0.00 35.95 39.14 2jmx h PHE 105 CO -0.00 -0.07 -0.11 0.77 -2.02 0.00 0.00 178.31 176.88 2jmx h SER 106 N -0.07 0.10 -0.07 0.41 0.02 -1.24 0.32 113.55 113.02 2jmx h SER 106 Ca 0.02 -0.02 -0.12 0.00 -0.84 0.00 0.00 61.79 60.83 2jmx h SER 106 Cb 0.09 -0.03 0.01 0.00 0.14 0.00 0.00 62.40 62.61 2jmx h SER 106 CO -0.05 0.23 -0.44 0.74 -1.14 0.00 0.00 176.83 176.18 2jmx h THR 107 N 0.11 1.41 -0.02 -2.27 2.02 -0.92 -2.94 112.91 110.30 2jmx h THR 107 Ca 0.02 -1.83 -0.17 0.00 0.77 0.00 0.00 66.41 65.20 2jmx h THR 107 Cb 0.27 2.34 -0.02 0.00 -1.74 0.00 0.00 68.15 69.00 2jmx h THR 107 CO 0.02 0.54 -0.74 -0.03 0.37 0.00 0.00 175.52 175.67 2jmx h MET 108 N -0.05 0.14 -0.98 6.66 1.85 -0.83 -3.05 114.93 118.66 2jmx h MET 108 Ca -0.04 -0.12 0.11 0.00 -0.61 0.00 0.00 59.70 59.04 2jmx h MET 108 Cb 1.10 0.03 -0.08 0.00 0.43 0.00 0.00 31.60 33.08 2jmx h MET 108 CO 0.09 0.82 0.62 1.98 -0.40 0.00 0.00 176.91 180.02 2jmx h MET 109 N 0.09 0.95 -0.27 0.39 -1.53 -0.37 0.21 114.93 114.40 2jmx h MET 109 Ca -0.02 -0.06 0.06 0.00 -3.44 0.00 0.00 59.70 56.24 2jmx h MET 109 Cb 1.31 -0.21 -0.01 0.00 -0.55 0.00 0.00 31.60 32.13 2jmx h MET 109 CO 0.11 0.63 0.19 0.77 0.14 0.00 0.00 176.91 178.75 2jmx h SER 110 N 0.98 0.10 1.05 1.39 0.02 -1.40 0.75 113.55 116.45 2jmx h SER 110 Ca 0.48 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.43 2jmx h SER 110 Cb 0.46 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.98 2jmx h SER 110 CO -0.24 0.07 0.00 0.52 -1.14 0.00 0.00 176.83 176.04 2jmx n VAL 111 N -4.48 0.21 0.11 2.27 0.31 0.73 -3.26 118.33 114.23 2jmx n VAL 111 Ca 0.03 -0.03 0.06 0.00 -0.01 0.00 0.00 64.34 64.39 2jmx n VAL 111 Cb 0.26 -0.57 0.01 0.00 -0.91 0.00 0.00 33.84 32.64 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 0.07 3.52 -0.00 -0.61 -3.27 115.15 114.85 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 0.53 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.91 2jmx h HIS 112 CO 0.00 0.27 -1.77 -0.09 -0.00 0.00 0.00 177.93 176.34 2jmx h ARG 113 N 0.00 0.15 -1.16 5.12 2.43 -1.53 -3.37 114.38 116.02 2jmx h ARG 113 Ca -0.05 -0.25 -0.68 0.00 -0.81 0.00 0.00 59.98 58.20 2jmx h ARG 113 Cb 1.25 0.09 -0.31 0.00 -0.42 0.00 0.00 29.97 30.59 2jmx h ARG 113 CO 0.03 0.89 0.67 0.41 -1.51 0.00 0.00 179.97 180.45 2jmx n GLY 114 N 1.74 5.88 2.68 2.80 0.00 -1.20 -4.57 105.19 112.52 2jmx n GLY 114 Ca -0.22 -2.40 -0.08 0.00 0.00 0.00 0.00 46.02 43.32 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 -0.82 1.12 -4.12 1.61 2.13 -1.23 -4.99 120.64 114.34 2jmx n GLU 115 Ca 0.58 -2.05 -0.15 0.00 0.66 0.00 0.00 57.16 56.21 2jmx n GLU 115 Cb 0.62 -0.57 -0.13 0.00 0.27 0.00 0.00 31.44 31.63 2jmx n GLU 115 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2jmx s VAL 116 N -0.16 0.46 0.18 6.31 0.11 -1.26 -4.93 120.40 121.11 2jmx s VAL 116 Ca 0.23 -0.55 -0.03 0.00 -2.93 0.00 0.00 61.98 58.71 2jmx s VAL 116 Cb 0.36 -0.45 0.04 0.00 -1.53 0.00 0.00 36.38 34.81 2jmx s VAL 116 CO -0.07 -0.07 0.18 -0.81 -3.33 0.00 0.00 175.10 171.00 2jmx n PRO 117 N 2.39 -0.97 -5.06 1.54 -0.04 -1.26 -5.06 135.00 126.54 2jmx n PRO 117 Ca -0.17 -0.28 -0.32 0.00 -0.04 0.00 0.00 63.50 62.69 2jmx n PRO 117 Cb 0.57 -0.24 -0.15 0.00 -0.04 0.00 0.00 33.50 33.64 2jmx n PRO 117 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jmx s THR 119 N -0.06 0.07 0.00 0.00 -4.23 -1.26 -5.36 115.64 104.80 2jmx s THR 119 Ca -0.05 -0.59 0.00 0.00 -1.18 0.00 0.00 61.69 59.87 2jmx s THR 119 Cb -0.14 -0.28 0.00 0.00 1.34 0.00 0.00 72.50 73.41 2jmx s THR 119 CO 0.04 -0.32 0.18 0.55 -0.54 0.00 0.00 174.62 174.53