#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 2.83 -3.76 3.13 0.00 -1.26 -5.00 120.51 116.46 2jmx n ALA 2 Ca 0.00 -3.80 -0.30 0.00 0.00 0.00 0.00 53.44 49.33 2jmx n ALA 2 Cb 0.00 -0.87 -0.10 0.00 0.00 0.00 0.00 19.45 18.49 2jmx n ALA 2 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2jmx n LYS 3 N 0.15 2.20 -4.15 0.00 4.81 -1.26 -5.06 118.16 114.86 2jmx n LYS 3 Ca 0.27 -4.51 -0.09 0.00 -0.87 0.00 0.00 58.31 53.10 2jmx n LYS 3 Cb 0.57 -2.33 -0.10 0.00 0.02 0.00 0.00 35.03 33.20 2jmx n LYS 3 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2jmx s LEU 4 N -1.59 2.41 -0.15 3.14 1.02 -1.26 -5.15 118.68 117.10 2jmx s LEU 4 Ca 0.28 -1.03 0.02 0.00 0.02 0.00 0.00 54.13 53.41 2jmx s LEU 4 Cb -0.03 0.05 0.01 0.00 0.02 0.00 0.00 46.19 46.25 2jmx s LEU 4 CO -0.14 -0.54 -0.20 -0.69 0.02 0.00 0.00 176.35 174.80 2jmx s VAL 5 N -3.77 2.18 0.28 -1.59 1.01 -1.26 -5.13 120.40 112.13 2jmx s VAL 5 Ca 0.12 -0.94 0.11 0.00 0.00 0.00 0.00 61.98 61.28 2jmx s VAL 5 Cb 0.06 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.51 2jmx s VAL 5 CO -0.05 0.54 -0.17 -0.13 0.00 0.00 0.00 175.10 175.28 2jmx s ARG 6 N 0.85 1.66 0.73 2.72 0.52 -1.26 -5.13 118.95 119.03 2jmx s ARG 6 Ca -0.06 -1.77 -0.11 0.00 -0.52 0.00 0.00 55.73 53.27 2jmx s ARG 6 Cb -0.15 -1.67 0.03 0.00 0.52 0.00 0.00 34.95 33.68 2jmx s ARG 6 CO -0.02 0.28 1.07 -1.25 0.02 0.00 0.00 175.30 175.40 2jmx s PRO 7 N -3.55 2.63 0.22 3.54 0.04 -1.26 -4.99 135.00 131.63 2jmx s PRO 7 Ca 0.29 1.05 -0.30 0.00 0.04 0.00 0.00 61.00 62.09 2jmx s PRO 7 Cb -0.03 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.47 2jmx s PRO 7 CO 0.14 -1.35 1.16 -1.25 0.04 0.00 0.00 177.00 175.74 2jmx s PRO 8 N -4.98 4.55 0.05 0.56 0.04 -1.26 -5.05 135.00 128.91 2jmx s PRO 8 Ca 0.59 1.85 -0.03 0.00 0.04 0.00 0.00 61.00 63.45 2jmx s PRO 8 Cb -0.15 -3.22 -0.02 0.00 0.04 0.00 0.00 34.50 31.14 2jmx s PRO 8 CO 0.55 0.03 0.03 0.14 0.04 0.00 0.00 177.00 177.79 2jmx s VAL 9 N -0.50 0.17 -0.04 -0.36 -7.23 -1.26 -5.16 120.40 106.01 2jmx s VAL 9 Ca 0.49 -1.40 0.05 0.00 -1.81 0.00 0.00 61.98 59.32 2jmx s VAL 9 Cb -0.32 -1.13 -0.02 0.00 0.56 0.00 0.00 36.38 35.47 2jmx s VAL 9 CO 0.39 -0.77 -0.20 -1.10 -0.31 0.00 0.00 175.10 173.11 2jmx s GLN 10 N -3.16 2.39 -0.03 4.82 -0.21 -1.26 -4.95 119.66 117.27 2jmx s GLN 10 Ca -0.00 -0.81 -0.03 0.00 0.02 0.00 0.00 55.36 54.55 2jmx s GLN 10 Cb 0.02 -2.23 0.01 0.00 1.00 0.00 0.00 33.01 31.81 2jmx s GLN 10 CO -0.07 0.56 0.05 -0.89 -2.12 0.00 0.00 175.29 172.82 2jmx n ILE 11 N 2.47-11.42 -3.18 1.08 -0.00 -1.26 -5.03 119.36 102.02 2jmx n ILE 11 Ca -0.17 2.64 -0.14 0.00 -0.00 0.00 0.00 62.75 65.08 2jmx n ILE 11 Cb 0.52 -5.55 -0.05 0.00 -0.00 0.00 0.00 39.64 34.55 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 -0.42 0.00 1.39 1.13 -1.26 -5.09 117.35 112.58 2jmx s TYR 12 Ca -0.06 -1.09 0.00 0.00 -1.41 0.00 0.00 57.07 54.51 2jmx s TYR 12 Cb 0.00 -0.27 0.00 0.00 -1.10 0.00 0.00 41.96 40.59 2jmx s TYR 12 CO 0.16 -1.04 0.00 0.41 -2.51 0.00 0.00 175.55 172.57 2jmx n GLY 13 N 3.46 3.45 0.52 5.49 0.00 -1.26 -4.81 105.19 112.04 2jmx n GLY 13 Ca 0.19 -0.94 0.37 0.00 0.00 0.00 0.00 46.02 45.64 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 0.23 -0.90 -0.61 6.09 -2.00 0.42 117.51 120.74 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 -0.07 0.00 0.47 0.00 0.00 36.82 37.34 2jmx h ILE 14 CO 0.00 0.02 0.59 -0.33 -3.07 0.00 0.00 178.15 175.36 2jmx h GLU 15 N 0.10 0.49 -0.45 2.19 5.08 -1.98 0.21 114.58 120.22 2jmx h GLU 15 Ca 0.75 -0.03 -0.14 0.00 -1.00 0.00 0.00 59.36 58.94 2jmx h GLU 15 Cb 2.55 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 31.68 2jmx h GLU 15 CO -0.23 0.33 -0.27 0.78 -1.00 0.00 0.00 179.01 178.62 2jmx h GLY 16 N 0.51 1.07 1.35 -3.84 0.00 -0.42 -2.78 103.07 98.96 2jmx h GLY 16 Ca 0.47 -1.00 0.09 0.00 0.00 0.00 0.00 47.33 46.90 2jmx h GLY 16 CO -0.20 0.91 0.24 3.21 0.00 0.00 0.00 176.54 180.69 2jmx h ARG 17 N 0.83 0.03 -0.94 4.80 3.08 -0.63 -1.33 114.38 120.23 2jmx h ARG 17 Ca 0.09 -0.00 0.17 0.00 0.07 0.00 0.00 59.98 60.31 2jmx h ARG 17 Cb 0.86 -0.01 -0.08 0.00 0.08 0.00 0.00 29.97 30.82 2jmx h ARG 17 CO 0.08 0.02 0.60 1.88 -1.07 0.00 0.00 179.97 181.47 2jmx h TYR 18 N 0.03 0.83 -0.06 3.04 -1.99 -1.16 1.03 116.97 118.69 2jmx h TYR 18 Ca 0.16 0.03 -0.24 0.00 2.00 0.00 0.00 58.73 60.67 2jmx h TYR 18 Cb 0.60 -0.26 0.01 0.00 2.00 0.00 0.00 36.73 39.08 2jmx h TYR 18 CO -0.00 0.25 -0.92 0.00 -0.00 0.00 0.00 178.16 177.49 2jmx h ALA 19 N 1.61 0.24 -0.04 3.88 0.00 -1.39 -2.30 119.26 121.25 2jmx h ALA 19 Ca 0.49 -0.66 -0.18 0.00 0.00 0.00 0.00 54.91 54.56 2jmx h ALA 19 Cb 0.88 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2jmx h ALA 19 CO -0.25 0.70 -0.76 1.79 0.00 0.00 0.00 179.25 180.73 2jmx h THR 20 N 0.44 1.42 0.00 0.00 1.35 -0.99 0.30 112.91 115.42 2jmx h THR 20 Ca -0.09 -2.27 0.00 0.00 -0.55 0.00 0.00 66.41 63.50 2jmx h THR 20 Cb 1.56 2.22 0.00 0.00 -1.73 0.00 0.00 68.15 70.20 2jmx h THR 20 CO 0.18 0.67 0.00 0.00 -0.25 0.00 0.00 175.52 176.12 2jmx h ALA 21 N 0.99 1.00 0.01 6.62 0.00 0.98 0.27 119.26 129.13 2jmx h ALA 21 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.47 2jmx h ALA 21 Cb 1.34 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.07 2jmx h ALA 21 CO 0.12 0.00 -2.40 -0.11 0.00 0.00 0.00 179.25 176.87 2jmx n LEU 22 N -2.52 2.55 0.12 0.00 7.94 -0.87 -4.27 117.00 119.94 2jmx n LEU 22 Ca 0.04 0.08 0.13 0.00 -1.11 0.00 0.00 56.01 55.15 2jmx n LEU 22 Cb 0.38 -0.90 0.41 0.00 0.53 0.00 0.00 43.42 43.83 2jmx n LEU 22 CO 0.28 0.77 0.88 0.10 -1.11 0.00 0.00 177.39 178.31 2jmx h TYR 23 N -0.38 0.00 -0.98 1.96 -0.00 -0.47 -3.24 116.97 113.86 2jmx h TYR 23 Ca -0.60 0.00 0.17 0.00 0.00 0.00 0.00 58.73 58.31 2jmx h TYR 23 Cb 1.79 0.00 -0.10 0.00 0.00 0.00 0.00 36.73 38.41 2jmx h TYR 23 CO -0.00 0.00 0.58 1.03 -0.00 0.00 0.00 178.16 179.77 2jmx h SER 24 N 0.00 0.75 -0.08 0.10 0.87 -0.63 1.13 113.55 115.70 2jmx h SER 24 Ca 0.00 0.09 -0.22 0.00 -1.23 0.00 0.00 61.79 60.44 2jmx h SER 24 Cb 0.70 -0.04 0.01 0.00 -0.44 0.00 0.00 62.40 62.63 2jmx h SER 24 CO 0.00 0.29 -0.79 0.00 -0.53 0.00 0.00 176.83 175.79 2jmx h ALA 25 N 1.62 0.20 -0.86 6.23 0.00 -1.80 -3.12 119.26 121.53 2jmx h ALA 25 Ca 0.55 -0.61 0.10 0.00 0.00 0.00 0.00 54.91 54.95 2jmx h ALA 25 Cb 0.81 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.55 2jmx h ALA 25 CO -0.37 0.59 0.56 0.00 0.00 0.00 0.00 179.25 180.02 2jmx h ALA 26 N 0.46 1.70 -0.82 0.00 0.00 -0.31 -1.14 119.26 119.15 2jmx h ALA 26 Ca -0.08 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 54.93 2jmx h ALA 26 Cb 1.44 -0.19 -0.08 0.00 0.00 0.00 0.00 17.79 18.97 2jmx h ALA 26 CO 0.16 0.12 0.45 1.03 0.00 0.00 0.00 179.25 181.02 2jmx h SER 27 N 0.82 0.63 -0.47 0.00 0.87 0.11 0.86 113.55 116.37 2jmx h SER 27 Ca 0.40 0.06 -0.13 0.00 -1.23 0.00 0.00 61.79 60.88 2jmx h SER 27 Cb 0.45 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 2jmx h SER 27 CO -0.17 0.34 -0.22 0.50 -0.53 0.00 0.00 176.83 176.75 2jmx h LYS 28 N 0.74 0.99 -0.00 2.24 1.63 -1.30 -2.59 116.57 118.28 2jmx h LYS 28 Ca 0.41 -0.42 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 2jmx h LYS 28 Cb 0.42 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.02 2jmx h LYS 28 CO -0.27 1.10 -0.01 1.04 -3.45 0.00 0.00 179.45 177.86 2jmx n GLN 29 N -4.11 0.53 -3.14 1.90 6.02 -0.25 -4.91 117.38 113.42 2jmx n GLN 29 Ca 0.00 -0.02 -0.14 0.00 -0.01 0.00 0.00 57.00 56.83 2jmx n GLN 29 Cb 0.46 -1.50 0.05 0.00 1.02 0.00 0.00 30.24 30.27 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 -1.22 -4.47 -1.09 1.08 2.85 0.28 -4.94 115.26 107.75 2jmx n ASN 30 Ca 0.16 -0.33 0.08 0.00 -0.11 0.00 0.00 54.58 54.38 2jmx n ASN 30 Cb 0.23 -3.24 0.27 0.00 1.24 0.00 0.00 39.78 38.27 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 -3.20 3.26 -0.34 1.20 4.01 -0.37 -4.64 118.16 118.07 2jmx n LYS 31 Ca -0.01 -2.63 0.26 0.00 -0.51 0.00 0.00 58.31 55.42 2jmx n LYS 31 Cb 0.54 -1.70 0.54 0.00 -0.51 0.00 0.00 35.03 33.91 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 2.76 0.39 0.01 -0.35 -0.00 -1.93 0.59 115.31 116.79 2jmx h LEU 32 Ca 0.00 0.09 -0.21 0.00 -0.00 0.00 0.00 57.88 57.76 2jmx h LEU 32 Cb 1.24 0.03 0.02 0.00 -0.00 0.00 0.00 40.66 41.95 2jmx h LEU 32 CO 0.16 0.03 -0.84 -0.33 -0.00 0.00 0.00 178.44 177.46 2jmx h GLU 33 N 0.32 0.56 0.00 1.13 4.39 -1.97 0.74 114.58 119.76 2jmx h GLU 33 Ca 0.63 -0.61 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 2jmx h GLU 33 Cb 1.72 0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 30.54 2jmx h GLU 33 CO -0.31 1.23 -0.03 1.96 -1.16 0.00 0.00 179.01 180.70 2jmx h GLN 34 N 0.15 0.00 0.00 2.33 1.08 -0.34 -1.59 115.11 116.74 2jmx h GLN 34 Ca -0.11 0.00 -0.37 0.00 -1.45 0.00 0.00 58.65 56.73 2jmx h GLN 34 Cb 1.53 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 28.89 2jmx h GLN 34 CO 0.17 0.03 -2.35 0.28 -0.95 0.00 0.00 178.83 176.00 2jmx n VAL 35 N -4.29 1.35 0.19 -0.54 0.31 0.96 -3.76 118.33 112.55 2jmx n VAL 35 Ca -0.03 -0.48 0.03 0.00 -0.01 0.00 0.00 64.34 63.85 2jmx n VAL 35 Cb 0.11 -1.43 0.39 0.00 -0.91 0.00 0.00 33.84 32.01 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 -0.18 0.02 0.10 5.55 4.81 0.50 -1.49 114.58 123.90 2jmx h GLU 36 Ca -0.55 -0.01 -0.33 0.00 -0.13 0.00 0.00 59.36 58.34 2jmx h GLU 36 Cb 1.76 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 31.12 2jmx h GLU 36 CO -0.14 0.33 -1.79 -0.22 -0.73 0.00 0.00 179.01 176.45 2jmx h LYS 37 N 0.02 0.21 -0.20 1.92 1.63 -1.45 -3.33 116.57 115.38 2jmx h LYS 37 Ca 0.00 -0.36 -0.19 0.00 -0.85 0.00 0.00 60.65 59.25 2jmx h LYS 37 Cb 0.55 0.13 0.00 0.00 -0.60 0.00 0.00 32.23 32.32 2jmx h LYS 37 CO 0.04 1.03 -0.62 0.93 -3.45 0.00 0.00 179.45 177.38 2jmx h GLU 38 N 0.06 0.70 -0.82 1.90 3.07 -1.64 -2.98 114.58 114.87 2jmx h GLU 38 Ca -0.34 -0.49 0.14 0.00 -0.50 0.00 0.00 59.36 58.18 2jmx h GLU 38 Cb 2.03 0.07 -0.06 0.00 -0.84 0.00 0.00 28.75 29.96 2jmx h GLU 38 CO 0.11 1.11 0.54 -0.07 -1.40 0.00 0.00 179.01 179.30 2jmx h LEU 39 N 0.52 0.52 -1.70 1.33 4.07 -1.42 0.07 115.31 118.70 2jmx h LEU 39 Ca -0.01 0.03 0.14 0.00 0.08 0.00 0.00 57.88 58.12 2jmx h LEU 39 Cb 1.21 -0.07 -0.04 0.00 1.08 0.00 0.00 40.66 42.84 2jmx h LEU 39 CO 0.13 0.27 0.46 0.25 -1.08 0.00 0.00 178.44 178.46 2jmx h LEU 40 N 0.55 0.28 -0.47 1.67 5.85 -1.62 -1.45 115.31 120.12 2jmx h LEU 40 Ca 0.40 0.01 0.01 0.00 0.84 0.00 0.00 57.88 59.15 2jmx h LEU 40 Cb 0.77 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.73 2jmx h LEU 40 CO -0.16 0.15 0.29 0.03 -0.34 0.00 0.00 178.44 178.42 2jmx h ARG 41 N 0.31 0.57 -0.73 1.25 3.08 -1.10 0.87 114.38 118.63 2jmx h ARG 41 Ca 0.33 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.30 2jmx h ARG 41 Cb 0.85 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.73 2jmx h ARG 41 CO -0.08 0.38 0.30 0.28 -1.07 0.00 0.00 179.97 179.77 2jmx h VAL 42 N 0.59 1.25 -0.22 2.04 2.07 -1.38 -0.05 116.25 120.55 2jmx h VAL 42 Ca 0.18 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 66.91 2jmx h VAL 42 Cb -0.02 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 2jmx h VAL 42 CO -0.07 0.31 0.06 1.23 0.02 0.00 0.00 177.57 179.12 2jmx h GLY 43 N 1.11 0.38 1.00 2.17 0.00 -1.10 -0.67 103.07 105.96 2jmx h GLY 43 Ca 0.25 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.32 2jmx h GLY 43 CO -0.02 0.22 0.34 1.46 0.00 0.00 0.00 176.54 178.54 2jmx h GLN 44 N 0.18 0.90 -0.55 4.80 4.20 -0.54 0.23 115.11 124.33 2jmx h GLN 44 Ca 0.07 -0.11 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 2jmx h GLN 44 Cb 0.27 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.85 2jmx h GLN 44 CO 0.00 0.69 0.28 0.82 -0.67 0.00 0.00 178.83 179.95 2jmx h ILE 45 N 0.87 1.18 -0.09 2.54 2.04 -0.80 0.31 117.51 123.56 2jmx h ILE 45 Ca 0.22 -0.48 -0.23 0.00 1.00 0.00 0.00 64.86 65.37 2jmx h ILE 45 Cb 0.06 0.46 0.01 0.00 -0.74 0.00 0.00 36.82 36.61 2jmx h ILE 45 CO -0.03 0.20 -0.86 0.25 0.00 0.00 0.00 178.15 177.71 2jmx h LEU 46 N 0.77 0.84 -0.51 1.44 7.12 -0.40 -3.21 115.31 121.36 2jmx h LEU 46 Ca 0.19 -0.60 -0.14 0.00 0.13 0.00 0.00 57.88 57.47 2jmx h LEU 46 Cb 0.06 -0.25 -0.02 0.00 -0.53 0.00 0.00 40.66 39.92 2jmx h LEU 46 CO -0.03 1.39 -0.65 0.50 -0.13 0.00 0.00 178.44 179.52 2jmx h LYS 47 N 0.44 0.00 -6.72 1.25 3.64 -0.59 -3.42 116.57 111.17 2jmx h LYS 47 Ca -0.07 0.00 -0.57 0.00 -1.27 0.00 0.00 60.65 58.74 2jmx h LYS 47 Cb 1.49 0.00 0.11 0.00 -0.41 0.00 0.00 32.23 33.42 2jmx h LYS 47 CO 0.17 0.65 0.47 0.39 -2.27 0.00 0.00 179.45 178.86 2jmx n GLU 48 N -3.55 2.05 -0.04 1.90 1.02 0.11 -4.89 120.64 117.22 2jmx n GLU 48 Ca -0.00 0.72 -0.15 0.00 -0.02 0.00 0.00 57.16 57.71 2jmx n GLU 48 Cb 0.69 -2.28 -0.08 0.00 -0.02 0.00 0.00 31.44 29.75 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 2.48 0.53 -0.84 3.49 0.13 -1.89 -2.15 132.00 133.75 2jmx h PRO 49 Ca -0.46 -0.38 0.07 0.00 -0.87 0.00 0.00 66.00 64.37 2jmx h PRO 49 Cb 1.29 0.06 -0.06 0.00 0.13 0.00 0.00 31.00 32.43 2jmx h PRO 49 CO 0.62 1.00 0.55 0.87 -0.23 0.00 0.00 178.00 180.81 2jmx h LYS 50 N 0.15 0.86 0.00 0.86 1.57 -1.94 -1.73 116.57 116.35 2jmx h LYS 50 Ca -0.01 -0.05 -0.19 0.00 -1.87 0.00 0.00 60.65 58.53 2jmx h LYS 50 Cb 1.03 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 33.12 2jmx h LYS 50 CO 0.09 0.57 -0.88 0.52 -0.57 0.00 0.00 179.45 179.18 2jmx h MET 51 N 0.89 0.00 -0.99 3.15 2.86 -1.79 -3.27 114.93 115.78 2jmx h MET 51 Ca 0.37 -0.00 0.24 0.00 -2.06 0.00 0.00 59.70 58.25 2jmx h MET 51 Cb 0.29 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 31.87 2jmx h MET 51 CO -0.14 0.88 0.65 0.00 1.06 0.00 0.00 176.91 179.37 2jmx h ALA 52 N 1.11 2.26 -0.12 6.32 0.00 -0.62 0.67 119.26 128.89 2jmx h ALA 52 Ca -0.01 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2jmx h ALA 52 Cb 1.57 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 2jmx h ALA 52 CO 0.12 -0.61 -0.19 0.00 0.00 0.00 0.00 179.25 178.56 2jmx h ALA 53 N 1.60 1.46 0.02 0.00 0.00 -1.61 -2.82 119.26 117.92 2jmx h ALA 53 Ca 0.54 -0.24 -0.38 0.00 0.00 0.00 0.00 54.91 54.83 2jmx h ALA 53 Cb 1.40 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 19.05 2jmx h ALA 53 CO -0.23 0.38 -2.36 0.45 0.00 0.00 0.00 179.25 177.49 2jmx n SER 54 N -4.23 1.62 -0.26 0.00 2.88 0.11 -3.57 113.62 110.18 2jmx n SER 54 Ca -0.01 -0.04 -0.02 0.00 -1.33 0.00 0.00 58.87 57.47 2jmx n SER 54 Cb 0.31 -0.22 0.09 0.00 -0.75 0.00 0.00 64.21 63.64 2jmx n SER 54 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2jmx h LEU 55 N 0.01 0.72 -3.85 2.46 -0.00 0.06 -2.51 115.31 112.20 2jmx h LEU 55 Ca -0.54 0.01 -0.57 0.00 -0.00 0.00 0.00 57.88 56.78 2jmx h LEU 55 Cb 1.99 -0.14 -0.31 0.00 -0.00 0.00 0.00 40.66 42.19 2jmx h LEU 55 CO -0.04 0.48 0.22 -0.11 -0.00 0.00 0.00 178.44 178.99 2jmx n LEU 56 N -4.68 6.35 -4.57 1.67 0.00 -1.07 -4.97 117.00 109.74 2jmx n LEU 56 Ca 0.09 -4.32 -0.40 0.00 0.00 0.00 0.00 56.01 51.38 2jmx n LEU 56 Cb 0.12 -0.73 -0.10 0.00 0.00 0.00 0.00 43.42 42.71 2jmx n LEU 56 CO 0.32 1.61 -0.03 0.21 0.00 0.00 0.00 177.39 179.51 2jmx s ASN 57 N -2.43 6.14 -0.00 1.96 2.47 -0.95 -4.94 114.94 117.20 2jmx s ASN 57 Ca 0.58 -0.07 0.04 0.00 0.42 0.00 0.00 52.86 53.82 2jmx s ASN 57 Cb 0.46 -2.17 0.11 0.00 -1.45 0.00 0.00 41.25 38.20 2jmx s ASN 57 CO 0.02 -0.22 1.05 -0.81 -3.72 0.00 0.00 177.10 173.42 2jmx n PRO 58 N 5.26 1.33 0.04 0.43 -0.04 -1.26 -3.74 135.00 137.02 2jmx n PRO 58 Ca -0.11 -0.46 0.08 0.00 -0.04 0.00 0.00 63.50 62.98 2jmx n PRO 58 Cb 0.50 -1.15 -0.08 0.00 -0.04 0.00 0.00 33.50 32.74 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 -0.11 0.62 -1.23 0.54 4.02 -1.26 -4.26 117.16 115.48 2jmx n TYR 59 Ca 0.04 0.19 -0.30 0.00 -0.01 0.00 0.00 57.90 57.82 2jmx n TYR 59 Cb 0.14 -0.85 0.11 0.00 -0.02 0.00 0.00 39.34 38.72 2jmx n TYR 59 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 176.86 177.18 2jmx n VAL 60 N -2.59 3.40 -1.56 -0.72 0.24 -1.25 -5.06 118.33 110.80 2jmx n VAL 60 Ca -0.05 -2.47 0.06 0.00 -2.04 0.00 0.00 64.34 59.85 2jmx n VAL 60 Cb 0.64 -0.94 -0.02 0.00 -1.47 0.00 0.00 33.84 32.06 2jmx n VAL 60 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2jmx n LYS 61 N -0.90 -0.94 -0.02 7.34 4.76 -1.26 -3.54 118.16 123.61 2jmx n LYS 61 Ca 0.59 0.62 -0.06 0.00 -2.87 0.00 0.00 58.31 56.58 2jmx n LYS 61 Cb 0.99 -1.14 -0.02 0.00 -1.84 0.00 0.00 35.03 33.02 2jmx n LYS 61 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 2jmx n ARG 62 N -1.94 0.20 -0.36 1.97 0.00 -1.26 -4.24 116.66 111.04 2jmx n ARG 62 Ca 0.00 0.08 -0.03 0.00 -0.00 0.00 0.00 57.85 57.91 2jmx n ARG 62 Cb 0.21 -0.85 0.10 0.00 0.00 0.00 0.00 32.46 31.92 2jmx n ARG 62 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2jmx h SER 63 N -0.37 1.10 -0.60 6.15 0.87 -1.91 -2.22 113.55 116.58 2jmx h SER 63 Ca -0.10 -0.04 -0.06 0.00 -1.23 0.00 0.00 61.79 60.36 2jmx h SER 63 Cb 0.71 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 62.36 2jmx h SER 63 CO -0.06 0.81 0.15 0.58 -0.53 0.00 0.00 176.83 177.78 2jmx h VAL 64 N 1.29 1.25 -0.54 2.23 2.07 -1.84 -2.50 116.25 118.22 2jmx h VAL 64 Ca 0.35 -0.90 0.06 0.00 0.82 0.00 0.00 66.70 67.02 2jmx h VAL 64 Cb -0.13 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 2jmx h VAL 64 CO -0.07 0.34 0.36 0.50 0.02 0.00 0.00 177.57 178.71 2jmx h LYS 65 N 0.87 0.49 -0.93 1.57 3.11 -1.46 -1.63 116.57 118.60 2jmx h LYS 65 Ca 0.19 -0.03 0.06 0.00 -2.81 0.00 0.00 60.65 58.06 2jmx h LYS 65 Cb 0.35 -0.11 -0.06 0.00 -1.00 0.00 0.00 32.23 31.41 2jmx h LYS 65 CO 0.00 0.33 0.61 0.28 -2.81 0.00 0.00 179.45 177.86 2jmx h VAL 66 N 0.51 1.10 -0.94 2.00 2.07 -1.03 -1.60 116.25 118.35 2jmx h VAL 66 Ca 0.23 -0.38 0.05 0.00 0.82 0.00 0.00 66.70 67.42 2jmx h VAL 66 Cb 0.26 -0.10 -0.06 0.00 -1.52 0.00 0.00 31.29 29.87 2jmx h VAL 66 CO -0.06 0.20 0.61 0.50 0.02 0.00 0.00 177.57 178.84 2jmx h LYS 67 N 1.10 1.10 -0.85 1.57 1.63 -1.33 -1.67 116.57 118.13 2jmx h LYS 67 Ca 0.39 -0.07 0.03 0.00 -0.85 0.00 0.00 60.65 60.16 2jmx h LYS 67 Cb 0.14 -0.25 -0.05 0.00 -0.60 0.00 0.00 32.23 31.47 2jmx h LYS 67 CO -0.14 0.73 0.56 1.03 -3.45 0.00 0.00 179.45 178.17 2jmx h SER 68 N 1.14 0.91 -0.65 4.20 0.87 -1.34 -2.19 113.55 116.50 2jmx h SER 68 Ca 0.39 -0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.95 2jmx h SER 68 Cb 0.09 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 61.80 2jmx h SER 68 CO -0.13 0.63 0.42 -0.07 -0.53 0.00 0.00 176.83 177.15 2jmx h LEU 69 N 1.06 0.71 -0.79 2.23 3.38 -1.25 -1.76 115.31 118.90 2jmx h LEU 69 Ca 0.33 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.29 2jmx h LEU 69 Cb 0.01 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 2jmx h LEU 69 CO -0.10 0.51 0.48 -1.28 0.09 0.00 0.00 178.44 178.14 2jmx h SER 70 N 0.85 0.95 0.76 -0.43 0.87 -1.34 -0.15 113.55 115.07 2jmx h SER 70 Ca 0.25 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 2jmx h SER 70 Cb -0.05 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 61.67 2jmx h SER 70 CO -0.07 0.73 0.00 -0.78 -0.53 0.00 0.00 176.83 176.18 2jmx h ASP 71 N 1.08 0.00 0.08 6.23 3.58 -1.09 -2.15 116.42 124.16 2jmx h ASP 71 Ca 0.28 0.00 -0.28 0.00 0.42 0.00 0.00 57.03 57.45 2jmx h ASP 71 Cb -0.04 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 40.99 2jmx h ASP 71 CO -0.05 0.00 -1.50 -0.03 -2.88 0.00 0.00 179.24 174.78 2jmx h MET 72 N 0.00 0.17 -0.84 0.28 4.05 -0.38 -3.34 114.93 114.86 2jmx h MET 72 Ca 0.00 -0.28 0.10 0.00 -0.28 0.00 0.00 59.70 59.23 2jmx h MET 72 Cb 0.38 0.11 -0.06 0.00 -0.80 0.00 0.00 31.60 31.23 2jmx h MET 72 CO 0.00 1.14 0.54 1.15 0.23 0.00 0.00 176.91 179.97 2jmx h THR 73 N -0.44 0.95 -0.90 -0.77 2.02 -0.94 0.35 112.91 113.19 2jmx h THR 73 Ca -0.35 -0.27 0.10 0.00 0.77 0.00 0.00 66.41 66.66 2jmx h THR 73 Cb 1.67 0.09 -0.07 0.00 -1.74 0.00 0.00 68.15 68.11 2jmx h THR 73 CO -0.02 0.15 0.58 0.00 0.37 0.00 0.00 175.52 176.59 2jmx h ALA 74 N 1.58 1.64 0.04 6.16 0.00 -1.51 -1.91 119.26 125.26 2jmx h ALA 74 Ca 0.39 -0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.98 2jmx h ALA 74 Cb 0.44 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 2jmx h ALA 74 CO -0.16 0.17 -1.79 1.63 0.00 0.00 0.00 179.25 179.11 2jmx n LYS 75 N -4.53 0.67 0.25 0.00 5.02 -0.30 -3.99 118.16 115.27 2jmx n LYS 75 Ca 0.15 0.29 0.17 0.00 -2.02 0.00 0.00 58.31 56.90 2jmx n LYS 75 Cb 0.32 -1.77 0.82 0.00 -0.02 0.00 0.00 35.03 34.37 2jmx n LYS 75 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2jmx h GLU 76 N 0.02 0.00 -5.81 1.97 4.39 0.07 -3.46 114.58 111.75 2jmx h GLU 76 Ca -0.32 0.00 -0.37 0.00 0.34 0.00 0.00 59.36 59.01 2jmx h GLU 76 Cb 2.02 0.00 0.13 0.00 -0.10 0.00 0.00 28.75 30.80 2jmx h GLU 76 CO 0.08 0.00 -0.76 1.63 -1.16 0.00 0.00 179.01 178.80 2jmx n LYS 77 N -2.75 -6.50 -0.12 2.33 5.02 -0.76 -4.97 118.16 110.42 2jmx n LYS 77 Ca -0.01 0.79 -0.09 0.00 -2.02 0.00 0.00 58.31 56.98 2jmx n LYS 77 Cb 0.15 -5.72 0.09 0.00 -0.02 0.00 0.00 35.03 29.53 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 -4.36 -2.23 -3.17 2.13 3.72 -1.25 -5.03 117.46 107.26 2jmx n PHE 78 Ca -0.22 -0.19 -0.08 0.00 -0.05 0.00 0.00 57.45 56.92 2jmx n PHE 78 Cb 0.64 -0.46 0.02 0.00 -0.94 0.00 0.00 39.48 38.74 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 -3.05 0.99 0.01 4.37 3.41 -1.26 -4.98 113.62 113.11 2jmx n SER 79 Ca 0.04 -1.59 0.09 0.00 -0.26 0.00 0.00 58.87 57.15 2jmx n SER 79 Cb 0.18 -0.12 0.41 0.00 -0.26 0.00 0.00 64.21 64.42 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 -1.33 0.02 -0.54 4.33 -0.04 -1.26 -2.92 135.00 133.26 2jmx n PRO 80 Ca 0.04 0.20 0.04 0.00 -0.04 0.00 0.00 63.50 63.74 2jmx n PRO 80 Cb 0.22 -1.54 0.20 0.00 -0.04 0.00 0.00 33.50 32.34 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 -1.58 3.16 -0.65 1.53 4.77 -1.26 -4.65 117.00 118.32 2jmx n LEU 81 Ca 0.04 -3.62 0.03 0.00 -0.03 0.00 0.00 56.01 52.43 2jmx n LEU 81 Cb 0.23 -0.54 0.04 0.00 -2.33 0.00 0.00 43.42 40.82 2jmx n LEU 81 CO 0.18 1.16 0.27 0.41 -1.33 0.00 0.00 177.39 178.08 2jmx n THR 82 N -1.13 0.49 -2.57 -5.08 -1.04 -1.15 -4.73 114.28 99.07 2jmx n THR 82 Ca 0.23 -0.85 -0.22 0.00 -2.04 0.00 0.00 64.05 61.17 2jmx n THR 82 Cb 0.80 0.43 0.01 0.00 -1.82 0.00 0.00 70.33 69.74 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 -0.22 3.69 0.13 8.00 2.88 -1.26 -4.45 113.62 122.39 2jmx n SER 83 Ca 0.05 -3.42 0.00 0.00 -1.33 0.00 0.00 58.87 54.18 2jmx n SER 83 Cb 0.79 -0.49 0.00 0.00 -0.75 0.00 0.00 64.21 63.76 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 -0.33 -2.35 0.17 -3.46 3.02 -1.26 -4.88 115.26 106.17 2jmx n ASN 84 Ca 0.30 0.56 0.15 0.00 -0.03 0.00 0.00 54.58 55.56 2jmx n ASN 84 Cb 0.69 2.37 0.74 0.00 -0.61 0.00 0.00 39.78 42.98 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 -0.58 3.41 5.85 -1.85 -0.73 115.31 121.41 2jmx h LEU 85 Ca 0.00 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 2jmx h LEU 85 Cb 0.00 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2jmx h LEU 85 CO 0.00 0.00 0.16 0.40 -0.34 0.00 0.00 178.44 178.66 2jmx h ILE 86 N 0.00 1.24 -0.27 4.05 2.04 -1.90 -2.33 117.51 120.35 2jmx h ILE 86 Ca 0.10 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.11 2jmx h ILE 86 Cb 0.46 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 2jmx h ILE 86 CO -0.00 0.32 0.17 -1.13 0.00 0.00 0.00 178.15 177.51 2jmx h ASN 87 N 0.83 0.31 -0.89 1.72 -0.73 -1.49 -2.13 115.58 113.20 2jmx h ASN 87 Ca 0.19 -0.02 0.14 0.00 1.87 0.00 0.00 56.30 58.47 2jmx h ASN 87 Cb 0.32 -0.08 -0.09 0.00 0.27 0.00 0.00 38.32 38.74 2jmx h ASN 87 CO -0.00 0.24 0.50 -0.07 -0.37 0.00 0.00 177.43 177.72 2jmx h LEU 88 N 0.36 0.65 -0.87 0.34 3.38 -1.28 0.86 115.31 118.75 2jmx h LEU 88 Ca 0.10 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 2jmx h LEU 88 Cb -0.03 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 2jmx h LEU 88 CO -0.02 0.30 0.53 -0.07 0.09 0.00 0.00 178.44 179.27 2jmx h LEU 89 N 0.73 1.05 -3.72 1.67 3.38 -0.85 -2.24 115.31 115.33 2jmx h LEU 89 Ca 0.47 -0.07 -0.34 0.00 0.09 0.00 0.00 57.88 58.03 2jmx h LEU 89 Cb 0.60 -0.27 -0.20 0.00 0.09 0.00 0.00 40.66 40.88 2jmx h LEU 89 CO -0.33 0.81 0.34 0.00 0.09 0.00 0.00 178.44 179.35 2jmx n ALA 90 N -2.37 4.92 -0.10 1.53 0.00 0.08 0.96 120.51 125.54 2jmx n ALA 90 Ca 0.09 -2.86 -0.23 0.00 0.00 0.00 0.00 53.44 50.44 2jmx n ALA 90 Cb 0.06 -1.16 -0.12 0.00 0.00 0.00 0.00 19.45 18.23 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 -0.95 0.65 -1.20 0.00 2.13 0.28 -4.63 120.64 116.90 2jmx n GLU 91 Ca 0.47 0.27 0.01 0.00 0.66 0.00 0.00 57.16 58.57 2jmx n GLU 91 Cb 1.40 -1.59 0.12 0.00 0.27 0.00 0.00 31.44 31.63 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 1.91 -0.84 4.31 3.02 -1.25 -4.96 115.26 113.70 2jmx n ASN 92 Ca -0.43 -3.20 0.00 0.00 -0.03 0.00 0.00 54.58 50.92 2jmx n ASN 92 Cb 0.93 -0.44 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 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 -0.56 0.53 1.13 7.41 0.00 -1.26 -4.99 105.19 107.45 2jmx n GLY 93 Ca 0.18 -0.47 0.03 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.84 2.72 -1.21 1.61 1.74 0.27 -4.57 116.66 116.38 2jmx n ARG 94 Ca 0.00 -2.97 -0.20 0.00 -0.77 0.00 0.00 57.85 53.91 2jmx n ARG 94 Cb 0.46 -1.89 0.14 0.00 -1.02 0.00 0.00 32.46 30.15 2jmx n ARG 94 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2jmx n LEU 95 N -0.65 5.91 -0.06 0.55 4.77 -0.59 -4.15 117.00 122.80 2jmx n LEU 95 Ca 0.28 -3.97 -0.12 0.00 -0.03 0.00 0.00 56.01 52.17 2jmx n LEU 95 Cb 1.01 -0.75 -0.04 0.00 -2.33 0.00 0.00 43.42 41.31 2jmx n LEU 95 CO 0.21 1.35 -0.82 0.41 -1.33 0.00 0.00 177.39 177.21 2jmx n THR 96 N -1.04 0.91 -1.32 -5.08 -1.04 -1.26 -4.61 114.28 100.84 2jmx n THR 96 Ca 0.50 -0.08 -0.28 0.00 -2.04 0.00 0.00 64.05 62.16 2jmx n THR 96 Cb 1.15 -1.76 0.13 0.00 -1.82 0.00 0.00 70.33 68.03 2jmx n THR 96 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2jmx n ASN 97 N -3.71 5.47 -0.03 8.00 3.02 -1.26 -4.67 115.26 122.08 2jmx n ASN 97 Ca -0.22 -3.71 0.01 0.00 -0.03 0.00 0.00 54.58 50.63 2jmx n ASN 97 Cb 0.59 -0.87 0.32 0.00 -0.61 0.00 0.00 39.78 39.21 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 1.04 1.17 -0.74 3.41 1.03 -1.82 -2.68 112.91 114.33 2jmx h THR 98 Ca 0.59 -0.57 -0.01 0.00 -0.01 0.00 0.00 66.41 66.41 2jmx h THR 98 Cb 1.83 0.70 -0.04 0.00 -1.07 0.00 0.00 68.15 69.58 2jmx h THR 98 CO 1.27 0.21 0.41 1.55 -0.01 0.00 0.00 175.52 178.95 2jmx h PRO 99 N 0.60 1.01 -0.63 0.00 0.13 -1.91 -1.47 132.00 129.74 2jmx h PRO 99 Ca 0.14 -0.11 0.01 0.00 -0.87 0.00 0.00 66.00 65.17 2jmx h PRO 99 Cb 0.16 -0.20 -0.03 0.00 0.13 0.00 0.00 31.00 31.06 2jmx h PRO 99 CO -0.01 0.74 0.41 0.00 -0.23 0.00 0.00 178.00 178.92 2jmx h ALA 100 N 1.42 1.56 -0.37 -0.56 0.00 -1.85 -0.99 119.26 118.47 2jmx h ALA 100 Ca 0.26 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 2jmx h ALA 100 Cb 0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2jmx h ALA 100 CO -0.04 0.41 -0.26 0.28 0.00 0.00 0.00 179.25 179.63 2jmx h VAL 101 N 0.84 1.27 -0.17 0.00 2.07 -1.27 -3.07 116.25 115.92 2jmx h VAL 101 Ca 0.23 -1.39 -0.17 0.00 0.82 0.00 0.00 66.70 66.20 2jmx h VAL 101 Cb -0.09 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 2jmx h VAL 101 CO -0.05 0.46 -0.58 0.40 0.02 0.00 0.00 177.57 177.82 2jmx h ILE 102 N 0.66 1.33 -0.43 4.57 2.04 -0.84 -3.17 117.51 121.67 2jmx h ILE 102 Ca 0.08 -1.84 0.02 0.00 1.00 0.00 0.00 64.86 64.13 2jmx h ILE 102 Cb 0.78 1.82 -0.03 0.00 -0.74 0.00 0.00 36.82 38.65 2jmx h ILE 102 CO 0.06 0.57 0.24 0.77 0.00 0.00 0.00 178.15 179.79 2jmx h SER 103 N 0.41 0.38 -0.55 1.72 4.64 -1.13 -1.25 113.55 117.78 2jmx h SER 103 Ca 0.00 0.01 0.07 0.00 -0.47 0.00 0.00 61.79 61.40 2jmx h SER 103 Cb 1.13 -0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 63.12 2jmx h SER 103 CO 0.11 0.27 0.37 0.00 -0.87 0.00 0.00 176.83 176.70 2jmx h ALA 104 N 1.20 1.91 -0.99 5.18 0.00 -1.54 -1.62 119.26 123.40 2jmx h ALA 104 Ca 0.17 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.15 2jmx h ALA 104 Cb 0.04 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 17.64 2jmx h ALA 104 CO -0.09 -0.01 0.63 0.35 0.00 0.00 0.00 179.25 180.13 2jmx h PHE 105 N 0.47 1.17 -0.27 0.00 3.04 -1.20 0.46 116.94 120.60 2jmx h PHE 105 Ca 0.24 0.03 -0.13 0.00 3.98 0.00 0.00 57.97 62.10 2jmx h PHE 105 Cb 0.35 -0.38 -0.01 0.00 2.56 0.00 0.00 35.95 38.47 2jmx h PHE 105 CO -0.00 0.57 -0.36 1.03 -2.02 0.00 0.00 178.31 177.53 2jmx h SER 106 N 1.11 0.63 0.97 0.41 0.87 -1.25 0.31 113.55 116.60 2jmx h SER 106 Ca 0.45 -0.26 -0.21 0.00 -1.23 0.00 0.00 61.79 60.53 2jmx h SER 106 Cb 0.26 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 62.01 2jmx h SER 106 CO -0.20 0.93 -0.99 0.74 -0.53 0.00 0.00 176.83 176.78 2jmx h THR 107 N 0.51 1.70 0.03 2.23 2.02 -1.26 -3.22 112.91 114.91 2jmx h THR 107 Ca 0.05 -3.36 -0.24 0.00 0.77 0.00 0.00 66.41 63.64 2jmx h THR 107 Cb 0.86 2.82 0.00 0.00 -1.74 0.00 0.00 68.15 70.09 2jmx h THR 107 CO 0.07 0.96 -1.00 0.24 0.37 0.00 0.00 175.52 176.16 2jmx h MET 108 N 0.00 0.40 -0.16 6.66 2.07 0.01 -3.19 114.93 120.73 2jmx h MET 108 Ca -0.01 -0.46 -0.02 0.00 -2.07 0.00 0.00 59.70 57.13 2jmx h MET 108 Cb 1.75 0.14 -0.01 0.00 -1.87 0.00 0.00 31.60 31.61 2jmx h MET 108 CO 0.13 1.14 -0.01 0.00 1.07 0.00 0.00 176.91 179.24 2jmx h MET 109 N 0.21 0.23 -0.29 1.72 3.00 -1.00 -1.70 114.93 117.10 2jmx h MET 109 Ca -0.09 -0.03 -0.00 0.00 0.00 0.00 0.00 59.70 59.57 2jmx h MET 109 Cb 1.65 -0.04 -0.01 0.00 0.00 0.00 0.00 31.60 33.20 2jmx h MET 109 CO 0.17 0.26 0.17 0.77 0.00 0.00 0.00 176.91 178.28 2jmx h SER 110 N 0.22 0.33 0.76 -0.10 0.02 -1.56 -0.47 113.55 112.77 2jmx h SER 110 Ca 0.05 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 2jmx h SER 110 Cb 0.18 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.63 2jmx h SER 110 CO 0.00 0.26 0.00 0.52 -1.14 0.00 0.00 176.83 176.47 2jmx n VAL 111 N -4.47 0.09 0.07 2.27 0.31 -0.65 -3.11 118.33 112.84 2jmx n VAL 111 Ca 0.01 0.02 0.05 0.00 -0.01 0.00 0.00 64.34 64.42 2jmx n VAL 111 Cb 0.08 -0.55 -0.04 0.00 -0.91 0.00 0.00 33.84 32.42 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 -1.04 -3.30 115.15 114.38 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 0.38 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 27.75 2jmx h HIS 112 CO 0.00 0.31 -1.84 -2.13 -0.00 0.00 0.00 177.93 174.27 2jmx n ARG 113 N -2.81 0.68 -1.50 5.12 0.63 -1.17 -4.20 116.66 113.41 2jmx n ARG 113 Ca -0.05 0.28 -0.33 0.00 -0.92 0.00 0.00 57.85 56.82 2jmx n ARG 113 Cb 0.70 -1.75 0.07 0.00 0.45 0.00 0.00 32.46 31.93 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 1.73 5.95 2.58 5.14 0.00 -1.18 -4.48 105.19 114.93 2jmx n GLY 114 Ca -0.23 -2.39 -0.02 0.00 0.00 0.00 0.00 46.02 43.38 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 1.32 -4.78 1.61 2.13 -1.24 -4.98 120.64 113.85 2jmx n GLU 115 Ca 0.59 -1.50 -0.31 0.00 0.66 0.00 0.00 57.16 56.60 2jmx n GLU 115 Cb 0.68 0.17 -0.13 0.00 0.27 0.00 0.00 31.44 32.43 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 -0.39 2.67 0.74 6.31 1.01 -1.26 -4.96 120.40 124.51 2jmx s VAL 116 Ca 0.11 -1.15 -0.11 0.00 0.00 0.00 0.00 61.98 60.84 2jmx s VAL 116 Cb 0.41 -2.09 0.03 0.00 0.00 0.00 0.00 36.38 34.73 2jmx s VAL 116 CO -0.11 0.40 1.07 -2.16 0.00 0.00 0.00 175.10 174.30 2jmx s PRO 117 N -1.24 2.58 -0.15 2.72 0.04 -1.26 -5.06 135.00 132.62 2jmx s PRO 117 Ca 0.13 0.98 -0.00 0.00 0.04 0.00 0.00 61.00 62.15 2jmx s PRO 117 Cb -0.10 -1.95 0.04 0.00 0.04 0.00 0.00 34.50 32.53 2jmx s PRO 117 CO 0.04 -1.36 -0.06 0.00 0.04 0.00 0.00 177.00 175.65 2jmx n THR 119 N 4.88 0.92 -1.24 0.00 -1.04 -1.26 -5.35 114.28 111.19 2jmx n THR 119 Ca -0.12 0.20 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 2jmx n THR 119 Cb 0.48 -1.68 0.00 0.00 -1.82 0.00 0.00 70.33 67.32 2jmx n THR 119 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98