#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 4.13 -2.92 3.13 0.00 -1.26 -5.06 120.51 118.53 2jmx n ALA 2 Ca 0.00 -3.47 -0.11 0.00 0.00 0.00 0.00 53.44 49.86 2jmx n ALA 2 Cb 0.00 -0.57 -0.11 0.00 0.00 0.00 0.00 19.45 18.76 2jmx n ALA 2 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2jmx s LYS 3 N -3.62 0.38 0.23 0.00 1.02 -1.26 -5.17 119.74 111.32 2jmx s LYS 3 Ca 0.41 -0.61 0.03 0.00 0.02 0.00 0.00 55.97 55.81 2jmx s LYS 3 Cb 0.38 -0.08 -0.05 0.00 -0.52 0.00 0.00 37.83 37.57 2jmx s LYS 3 CO -0.01 -0.00 0.02 -0.51 -0.92 0.00 0.00 175.35 173.92 2jmx s LEU 4 N -1.37 2.08 -0.73 3.17 1.43 -1.26 -5.11 118.68 116.90 2jmx s LEU 4 Ca -0.12 -1.24 0.03 0.00 -1.03 0.00 0.00 54.13 51.77 2jmx s LEU 4 Cb -0.09 -0.18 0.18 0.00 0.03 0.00 0.00 46.19 46.13 2jmx s LEU 4 CO -0.00 -0.56 0.54 -0.69 0.23 0.00 0.00 176.35 175.86 2jmx s VAL 5 N -3.52 3.26 -0.30 -1.59 1.01 -1.26 -5.01 120.40 112.99 2jmx s VAL 5 Ca 0.29 -4.02 -0.03 0.00 0.00 0.00 0.00 61.98 58.22 2jmx s VAL 5 Cb 0.06 -3.11 0.10 0.00 0.00 0.00 0.00 36.38 33.43 2jmx s VAL 5 CO 0.09 -1.00 0.12 -0.13 0.00 0.00 0.00 175.10 174.18 2jmx s ARG 6 N -1.25 0.38 0.30 2.72 0.52 -1.26 -5.12 118.95 115.24 2jmx s ARG 6 Ca 0.24 -0.74 -0.29 0.00 -0.52 0.00 0.00 55.73 54.42 2jmx s ARG 6 Cb -0.08 -1.46 -0.10 0.00 0.52 0.00 0.00 34.95 33.83 2jmx s ARG 6 CO -0.13 -1.01 1.16 -1.25 0.02 0.00 0.00 175.30 174.08 2jmx s PRO 7 N 1.91 4.54 0.16 3.54 0.04 -1.26 -5.04 135.00 138.88 2jmx s PRO 7 Ca 0.09 1.92 -0.03 0.00 0.04 0.00 0.00 61.00 63.02 2jmx s PRO 7 Cb -0.17 -3.13 0.04 0.00 0.04 0.00 0.00 34.50 31.28 2jmx s PRO 7 CO -0.32 0.08 0.17 -0.35 0.04 0.00 0.00 177.00 176.62 2jmx n PRO 8 N 1.03 -0.79 -3.08 0.56 -0.04 -1.26 -5.03 135.00 126.38 2jmx n PRO 8 Ca -0.01 -0.27 -0.21 0.00 -0.04 0.00 0.00 63.50 62.97 2jmx n PRO 8 Cb 0.44 -0.22 -0.03 0.00 -0.04 0.00 0.00 33.50 33.65 2jmx n PRO 8 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2jmx n VAL 9 N -2.57 1.12 -5.03 0.52 0.24 -1.26 -5.08 118.33 106.27 2jmx n VAL 9 Ca 0.02 -4.96 -0.29 0.00 -2.04 0.00 0.00 64.34 57.08 2jmx n VAL 9 Cb 0.08 -0.69 -0.16 0.00 -1.47 0.00 0.00 33.84 31.59 2jmx n VAL 9 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 2jmx s GLN 10 N -2.85 2.34 -0.08 7.34 -0.21 -1.26 -4.96 119.66 119.98 2jmx s GLN 10 Ca 0.43 -0.74 -0.06 0.00 0.02 0.00 0.00 55.36 55.02 2jmx s GLN 10 Cb 0.32 -1.91 0.02 0.00 1.00 0.00 0.00 33.01 32.45 2jmx s GLN 10 CO -0.10 0.23 0.12 -0.89 -2.12 0.00 0.00 175.29 172.53 2jmx n ILE 11 N 3.29-10.92 -3.12 1.08 -0.00 -1.26 -5.04 119.36 103.39 2jmx n ILE 11 Ca -0.19 2.44 -0.05 0.00 -0.00 0.00 0.00 62.75 64.95 2jmx n ILE 11 Cb 0.52 -5.59 -0.02 0.00 -0.00 0.00 0.00 39.64 34.56 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 -1.29 0.00 1.39 1.13 -1.26 -5.11 117.35 111.69 2jmx s TYR 12 Ca -0.14 -0.31 0.00 0.00 -1.41 0.00 0.00 57.07 55.21 2jmx s TYR 12 Cb 0.01 0.12 0.00 0.00 -1.10 0.00 0.00 41.96 40.99 2jmx s TYR 12 CO 0.36 -1.15 0.00 0.41 -2.51 0.00 0.00 175.55 172.66 2jmx n GLY 13 N 3.87 3.41 0.52 5.49 0.00 -1.26 -4.82 105.19 112.40 2jmx n GLY 13 Ca 0.14 -0.92 0.36 0.00 0.00 0.00 0.00 46.02 45.60 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 0.29 -0.93 -0.61 6.09 -2.01 0.31 117.51 120.65 2jmx h ILE 14 Ca 0.00 -0.04 0.21 0.00 -1.37 0.00 0.00 64.86 63.66 2jmx h ILE 14 Cb 0.00 0.17 -0.07 0.00 0.47 0.00 0.00 36.82 37.39 2jmx h ILE 14 CO 0.00 0.02 0.61 -0.33 -3.07 0.00 0.00 178.15 175.38 2jmx h GLU 15 N 0.11 0.42 -0.51 2.19 5.08 -1.98 0.18 114.58 120.07 2jmx h GLU 15 Ca 0.71 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.94 2jmx h GLU 15 Cb 2.46 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 31.60 2jmx h GLU 15 CO -0.18 0.28 -0.08 0.78 -1.00 0.00 0.00 179.01 178.81 2jmx h GLY 16 N 0.43 1.04 1.48 -3.84 0.00 -0.65 -2.71 103.07 98.82 2jmx h GLY 16 Ca 0.49 -0.83 0.06 0.00 0.00 0.00 0.00 47.33 47.06 2jmx h GLY 16 CO -0.20 0.76 0.21 3.21 0.00 0.00 0.00 176.54 180.51 2jmx h ARG 17 N 0.82 0.13 -0.92 4.80 3.08 -0.73 -1.54 114.38 120.01 2jmx h ARG 17 Ca 0.13 -0.01 0.17 0.00 0.07 0.00 0.00 59.98 60.35 2jmx h ARG 17 Cb 0.64 -0.03 -0.08 0.00 0.08 0.00 0.00 29.97 30.58 2jmx h ARG 17 CO 0.04 0.08 0.59 1.88 -1.07 0.00 0.00 179.97 181.50 2jmx h TYR 18 N 0.13 0.80 -0.16 3.04 -1.99 -1.18 0.99 116.97 118.61 2jmx h TYR 18 Ca 0.14 0.02 -0.22 0.00 2.00 0.00 0.00 58.73 60.67 2jmx h TYR 18 Cb 0.38 -0.25 0.01 0.00 2.00 0.00 0.00 36.73 38.87 2jmx h TYR 18 CO -0.00 0.25 -0.76 0.00 -0.00 0.00 0.00 178.16 177.65 2jmx h ALA 19 N 1.61 0.35 -0.08 3.88 0.00 -1.41 -1.95 119.26 121.65 2jmx h ALA 19 Ca 0.48 -0.60 -0.19 0.00 0.00 0.00 0.00 54.91 54.61 2jmx h ALA 19 Cb 0.89 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 2jmx h ALA 19 CO -0.24 0.69 -0.75 1.79 0.00 0.00 0.00 179.25 180.74 2jmx h THR 20 N 0.53 1.36 0.00 0.00 1.35 -0.92 0.48 112.91 115.71 2jmx h THR 20 Ca -0.05 -2.14 0.00 0.00 -0.55 0.00 0.00 66.41 63.68 2jmx h THR 20 Cb 1.38 2.11 0.00 0.00 -1.73 0.00 0.00 68.15 69.92 2jmx h THR 20 CO 0.16 0.65 0.00 0.00 -0.25 0.00 0.00 175.52 176.07 2jmx h ALA 21 N 0.86 1.00 0.00 6.62 0.00 0.90 0.23 119.26 128.87 2jmx h ALA 21 Ca -0.04 0.00 -0.44 0.00 0.00 0.00 0.00 54.91 54.43 2jmx h ALA 21 Cb 1.34 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 19.06 2jmx h ALA 21 CO 0.13 0.00 -2.46 -0.11 0.00 0.00 0.00 179.25 176.82 2jmx n LEU 22 N -2.37 2.17 0.17 0.00 7.94 -0.73 -4.24 117.00 119.94 2jmx n LEU 22 Ca 0.03 0.25 0.13 0.00 -1.11 0.00 0.00 56.01 55.31 2jmx n LEU 22 Cb 0.33 -0.85 0.51 0.00 0.53 0.00 0.00 43.42 43.94 2jmx n LEU 22 CO 0.25 0.64 0.89 0.10 -1.11 0.00 0.00 177.39 178.17 2jmx h TYR 23 N -0.78 0.00 -1.01 1.96 -0.00 -0.11 -3.05 116.97 113.99 2jmx h TYR 23 Ca -0.66 0.00 0.20 0.00 0.00 0.00 0.00 58.73 58.27 2jmx h TYR 23 Cb 1.67 0.00 -0.11 0.00 0.00 0.00 0.00 36.73 38.29 2jmx h TYR 23 CO -0.05 0.00 0.61 1.03 -0.00 0.00 0.00 178.16 179.75 2jmx h SER 24 N 0.00 0.78 -0.13 0.10 0.87 -0.70 1.07 113.55 115.53 2jmx h SER 24 Ca 0.00 0.10 -0.19 0.00 -1.23 0.00 0.00 61.79 60.48 2jmx h SER 24 Cb 0.48 -0.04 0.01 0.00 -0.44 0.00 0.00 62.40 62.42 2jmx h SER 24 CO 0.00 0.26 -0.64 0.00 -0.53 0.00 0.00 176.83 175.92 2jmx h ALA 25 N 1.65 0.25 -1.00 6.23 0.00 -1.78 -3.10 119.26 121.52 2jmx h ALA 25 Ca 0.59 -0.55 0.10 0.00 0.00 0.00 0.00 54.91 55.05 2jmx h ALA 25 Cb 0.93 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.63 2jmx h ALA 25 CO -0.39 0.53 0.64 0.00 0.00 0.00 0.00 179.25 180.03 2jmx h ALA 26 N 0.51 1.47 -0.99 0.00 0.00 -0.04 -0.80 119.26 119.43 2jmx h ALA 26 Ca -0.04 0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.99 2jmx h ALA 26 Cb 1.28 -0.24 -0.08 0.00 0.00 0.00 0.00 17.79 18.75 2jmx h ALA 26 CO 0.13 0.30 0.62 0.66 0.00 0.00 0.00 179.25 180.96 2jmx h SER 27 N 1.05 0.91 -0.04 0.00 4.64 0.95 0.78 113.55 121.84 2jmx h SER 27 Ca 0.48 0.05 -0.18 0.00 -0.47 0.00 0.00 61.79 61.66 2jmx h SER 27 Cb 0.39 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2jmx h SER 27 CO -0.24 0.50 -0.60 0.11 -0.87 0.00 0.00 176.83 175.73 2jmx h LYS 28 N 0.99 0.64 -0.20 4.77 1.57 -1.20 -3.02 116.57 120.13 2jmx h LYS 28 Ca 0.48 -0.43 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2jmx h LYS 28 Cb 0.45 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.82 2jmx h LYS 28 CO -0.26 1.05 0.00 1.04 -0.57 0.00 0.00 179.45 180.72 2jmx n GLN 29 N -3.95 1.72 -3.31 3.15 6.02 -0.36 -4.93 117.38 115.72 2jmx n GLN 29 Ca -0.04 -1.09 -0.18 0.00 -0.01 0.00 0.00 57.00 55.68 2jmx n GLN 29 Cb 0.64 -1.37 0.06 0.00 1.02 0.00 0.00 30.24 30.60 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 0.32 -4.73 -0.97 1.08 5.15 0.24 -4.93 115.26 111.43 2jmx n ASN 30 Ca 0.15 -0.44 0.09 0.00 -0.60 0.00 0.00 54.58 53.78 2jmx n ASN 30 Cb 0.31 -4.07 0.22 0.00 -0.53 0.00 0.00 39.78 35.71 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 -3.91 2.58 -0.34 1.20 4.76 0.40 -4.60 118.16 118.25 2jmx n LYS 31 Ca -0.04 -2.24 0.22 0.00 -2.87 0.00 0.00 58.31 53.37 2jmx n LYS 31 Cb 0.56 -1.41 0.45 0.00 -1.84 0.00 0.00 35.03 32.80 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 3.25 0.56 0.01 -0.35 -0.00 -1.91 0.92 115.31 117.79 2jmx h LEU 32 Ca 0.00 0.14 -0.26 0.00 -0.00 0.00 0.00 57.88 57.76 2jmx h LEU 32 Cb 0.85 0.06 0.02 0.00 -0.00 0.00 0.00 40.66 41.59 2jmx h LEU 32 CO 0.00 0.02 -1.00 -0.33 -0.00 0.00 0.00 178.44 177.13 2jmx h GLU 33 N 0.44 0.66 0.00 1.13 5.08 -1.97 0.52 114.58 120.45 2jmx h GLU 33 Ca 0.67 -0.73 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 2jmx h GLU 33 Cb 1.49 0.21 -0.00 0.00 0.50 0.00 0.00 28.75 30.95 2jmx h GLU 33 CO -0.47 1.31 -0.16 0.37 -1.00 0.00 0.00 179.01 179.06 2jmx h GLN 34 N 0.32 0.00 0.01 2.33 5.75 -0.18 -2.67 115.11 120.66 2jmx h GLN 34 Ca -0.13 0.00 -0.39 0.00 -0.15 0.00 0.00 58.65 57.98 2jmx h GLN 34 Cb 1.67 0.00 -0.07 0.00 1.07 0.00 0.00 27.48 30.15 2jmx h GLN 34 CO 0.20 0.16 -2.44 0.28 -2.65 0.00 0.00 178.83 174.38 2jmx n VAL 35 N -4.21 1.50 0.30 2.39 0.31 0.26 -3.75 118.33 115.14 2jmx n VAL 35 Ca -0.02 -0.59 0.18 0.00 -0.01 0.00 0.00 64.34 63.89 2jmx n VAL 35 Cb 0.23 -1.38 0.93 0.00 -0.91 0.00 0.00 33.84 32.71 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 0.03 5.55 4.57 0.04 -1.92 114.58 122.86 2jmx h GLU 36 Ca -0.57 0.00 -0.38 0.00 -1.18 0.00 0.00 59.36 57.24 2jmx h GLU 36 Cb 1.93 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 30.47 2jmx h GLU 36 CO -0.07 0.04 -2.19 1.63 -1.18 0.00 0.00 179.01 177.23 2jmx n LYS 37 N -3.33 0.65 -0.11 1.92 5.02 -1.01 -4.09 118.16 117.21 2jmx n LYS 37 Ca -0.02 0.26 -0.06 0.00 -2.02 0.00 0.00 58.31 56.48 2jmx n LYS 37 Cb 0.17 -1.60 0.13 0.00 -0.02 0.00 0.00 35.03 33.71 2jmx n LYS 37 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2jmx h GLU 38 N -0.34 0.82 -0.86 1.97 4.39 -1.64 -2.59 114.58 116.33 2jmx h GLU 38 Ca -0.53 -0.25 0.11 0.00 0.34 0.00 0.00 59.36 59.02 2jmx h GLU 38 Cb 1.79 -0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 30.30 2jmx h GLU 38 CO -0.13 0.86 0.56 -0.07 -1.16 0.00 0.00 179.01 179.06 2jmx h LEU 39 N 0.75 0.73 -1.48 1.33 4.07 -1.54 -0.39 115.31 118.77 2jmx h LEU 39 Ca 0.13 0.03 0.12 0.00 0.08 0.00 0.00 57.88 58.24 2jmx h LEU 39 Cb 0.53 -0.12 -0.05 0.00 1.08 0.00 0.00 40.66 42.10 2jmx h LEU 39 CO 0.03 0.41 0.50 -0.07 -1.08 0.00 0.00 178.44 178.23 2jmx h LEU 40 N 0.79 0.50 -1.01 1.67 3.38 -1.61 -0.90 115.31 118.14 2jmx h LEU 40 Ca 0.41 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.45 2jmx h LEU 40 Cb 0.49 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.10 2jmx h LEU 40 CO -0.17 0.28 0.66 0.03 0.09 0.00 0.00 178.44 179.32 2jmx h ARG 41 N 0.55 1.21 -0.85 1.13 3.08 -1.15 -1.40 114.38 116.94 2jmx h ARG 41 Ca 0.36 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.34 2jmx h ARG 41 Cb 0.66 -0.27 -0.04 0.00 0.08 0.00 0.00 29.97 30.40 2jmx h ARG 41 CO -0.13 0.80 0.53 0.28 -1.07 0.00 0.00 179.97 180.37 2jmx h VAL 42 N 1.24 1.23 -0.12 2.04 2.07 -1.23 -1.04 116.25 120.44 2jmx h VAL 42 Ca 0.41 -0.47 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 2jmx h VAL 42 Cb 0.06 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 29.84 2jmx h VAL 42 CO -0.14 0.23 0.02 1.23 0.02 0.00 0.00 177.57 178.93 2jmx h GLY 43 N 1.17 0.21 1.14 2.17 0.00 -1.24 -2.82 103.07 103.71 2jmx h GLY 43 Ca 0.31 -0.14 0.03 0.00 0.00 0.00 0.00 47.33 47.52 2jmx h GLY 43 CO -0.06 0.13 0.52 -1.61 0.00 0.00 0.00 176.54 175.51 2jmx h GLN 44 N -0.03 0.96 -0.94 4.80 4.15 -1.00 -0.18 115.11 122.87 2jmx h GLN 44 Ca 0.04 -0.06 0.04 0.00 0.77 0.00 0.00 58.65 59.44 2jmx h GLN 44 Cb 0.29 -0.22 -0.06 0.00 0.21 0.00 0.00 27.48 27.71 2jmx h GLN 44 CO 0.00 0.63 0.61 0.82 -1.93 0.00 0.00 178.83 178.96 2jmx h ILE 45 N 0.98 1.14 0.00 2.39 2.04 -0.96 0.17 117.51 123.27 2jmx h ILE 45 Ca 0.31 -0.40 -0.13 0.00 1.00 0.00 0.00 64.86 65.64 2jmx h ILE 45 Cb 0.00 -0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 35.94 2jmx h ILE 45 CO -0.08 0.21 -0.63 0.25 0.00 0.00 0.00 178.15 177.90 2jmx h LEU 46 N 1.16 0.00 -0.61 1.44 5.85 -1.12 -3.19 115.31 118.84 2jmx h LEU 46 Ca 0.38 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.95 2jmx h LEU 46 Cb 0.04 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 2jmx h LEU 46 CO -0.13 0.63 -0.68 0.50 -0.34 0.00 0.00 178.44 178.42 2jmx h LYS 47 N 0.00 0.09 -6.63 1.25 3.11 0.02 -3.37 116.57 111.04 2jmx h LYS 47 Ca -0.01 -0.07 -0.58 0.00 -2.81 0.00 0.00 60.65 57.18 2jmx h LYS 47 Cb 1.44 0.02 0.09 0.00 -1.00 0.00 0.00 32.23 32.77 2jmx h LYS 47 CO 0.08 0.73 0.61 0.39 -2.81 0.00 0.00 179.45 178.45 2jmx n GLU 48 N -3.77 2.08 0.04 1.90 1.02 0.50 -4.81 120.64 117.61 2jmx n GLU 48 Ca -0.02 0.74 -0.08 0.00 -0.02 0.00 0.00 57.16 57.78 2jmx n GLU 48 Cb 0.67 -2.39 0.07 0.00 -0.02 0.00 0.00 31.44 29.77 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 3.93 0.43 0.11 3.49 0.13 -1.89 0.71 132.00 138.91 2jmx h PRO 49 Ca -0.45 -0.29 -0.27 0.00 -0.87 0.00 0.00 66.00 64.12 2jmx h PRO 49 Cb 1.27 0.04 0.01 0.00 0.13 0.00 0.00 31.00 32.45 2jmx h PRO 49 CO 0.73 0.90 -1.19 -0.22 -0.23 0.00 0.00 178.00 177.99 2jmx h LYS 50 N 0.32 0.35 0.00 0.86 3.64 -1.94 -3.30 116.57 116.50 2jmx h LYS 50 Ca -0.00 -0.52 -0.23 0.00 -1.27 0.00 0.00 60.65 58.63 2jmx h LYS 50 Cb 1.13 0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 33.10 2jmx h LYS 50 CO 0.10 1.22 -1.14 1.98 -2.27 0.00 0.00 179.45 179.35 2jmx h MET 51 N 0.13 0.01 -0.82 1.90 4.05 -1.80 -3.31 114.93 115.08 2jmx h MET 51 Ca -0.14 -0.01 0.07 0.00 -0.28 0.00 0.00 59.70 59.34 2jmx h MET 51 Cb 1.89 0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 32.65 2jmx h MET 51 CO 0.20 0.91 0.54 0.00 0.23 0.00 0.00 176.91 178.79 2jmx h ALA 52 N 0.98 1.63 0.00 0.39 0.00 0.37 -1.50 119.26 121.13 2jmx h ALA 52 Ca -0.07 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2jmx h ALA 52 Cb 1.82 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 19.39 2jmx h ALA 52 CO 0.12 0.23 -0.08 0.00 0.00 0.00 0.00 179.25 179.53 2jmx h ALA 53 N 1.56 1.85 0.17 0.00 0.00 -1.65 -2.95 119.26 118.24 2jmx h ALA 53 Ca 0.36 -0.07 -0.35 0.00 0.00 0.00 0.00 54.91 54.85 2jmx h ALA 53 Cb 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2jmx h ALA 53 CO -0.13 0.10 -1.82 1.03 0.00 0.00 0.00 179.25 178.43 2jmx h SER 54 N 0.00 0.55 -0.74 0.00 0.87 -1.47 -3.05 113.55 109.71 2jmx h SER 54 Ca -0.00 -0.92 0.10 0.00 -1.23 0.00 0.00 61.79 59.74 2jmx h SER 54 Cb 0.14 -0.18 -0.05 0.00 -0.44 0.00 0.00 62.40 61.87 2jmx h SER 54 CO 0.01 1.79 0.49 -0.07 -0.53 0.00 0.00 176.83 178.52 2jmx h LEU 55 N 0.10 0.58 -3.89 2.23 4.07 -1.32 -2.33 115.31 114.74 2jmx h LEU 55 Ca -0.36 0.01 -0.58 0.00 0.08 0.00 0.00 57.88 57.03 2jmx h LEU 55 Cb 2.08 -0.11 -0.40 0.00 1.08 0.00 0.00 40.66 43.32 2jmx h LEU 55 CO 0.15 0.35 -0.43 -0.11 -1.08 0.00 0.00 178.44 177.33 2jmx n LEU 56 N -4.49 5.53 -4.57 1.67 0.00 -1.12 -4.90 117.00 109.12 2jmx n LEU 56 Ca 0.12 -4.70 -0.38 0.00 0.00 0.00 0.00 56.01 51.05 2jmx n LEU 56 Cb 0.33 -0.50 -0.11 0.00 0.00 0.00 0.00 43.42 43.15 2jmx n LEU 56 CO 0.33 1.98 -0.19 0.21 0.00 0.00 0.00 177.39 179.73 2jmx s ASN 57 N -3.18 5.89 -0.00 1.96 3.04 -0.88 -4.95 114.94 116.82 2jmx s ASN 57 Ca 0.54 -0.04 0.03 0.00 0.04 0.00 0.00 52.86 53.43 2jmx s ASN 57 Cb 0.43 -2.09 0.10 0.00 -1.54 0.00 0.00 41.25 38.15 2jmx s ASN 57 CO -0.00 -0.05 1.06 -0.81 -3.04 0.00 0.00 177.10 174.26 2jmx n PRO 58 N 5.04 1.28 0.00 0.43 -0.04 -1.26 -3.74 135.00 136.71 2jmx n PRO 58 Ca -0.14 -0.41 -0.00 0.00 -0.04 0.00 0.00 63.50 62.90 2jmx n PRO 58 Cb 0.52 -1.12 -0.11 0.00 -0.04 0.00 0.00 33.50 32.75 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 -0.15 0.66 -1.18 0.54 4.02 -1.26 -4.25 117.16 115.54 2jmx n TYR 59 Ca 0.04 0.22 -0.26 0.00 -0.01 0.00 0.00 57.90 57.89 2jmx n TYR 59 Cb 0.11 -0.98 0.15 0.00 -0.02 0.00 0.00 39.34 38.60 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 -2.77 3.25 -1.96 -0.72 0.24 -1.25 -5.06 118.33 110.06 2jmx n VAL 60 Ca -0.13 -2.11 0.02 0.00 -2.04 0.00 0.00 64.34 60.08 2jmx n VAL 60 Cb 0.85 -0.68 -0.00 0.00 -1.47 0.00 0.00 33.84 32.54 2jmx n VAL 60 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2jmx n LYS 61 N -1.01 -0.29 -0.09 7.34 3.00 -1.26 -3.29 118.16 122.56 2jmx n LYS 61 Ca 0.58 0.19 -0.17 0.00 -0.00 0.00 0.00 58.31 58.91 2jmx n LYS 61 Cb 1.37 -0.35 -0.06 0.00 0.00 0.00 0.00 35.03 35.98 2jmx n LYS 61 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 2jmx n ARG 62 N -1.21 0.41 -0.34 1.64 0.63 -1.26 -4.02 116.66 112.51 2jmx n ARG 62 Ca 0.00 0.17 0.02 0.00 -0.92 0.00 0.00 57.85 57.13 2jmx n ARG 62 Cb 0.07 -1.19 0.17 0.00 0.45 0.00 0.00 32.46 31.96 2jmx n ARG 62 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2jmx h SER 63 N -0.71 0.93 -0.61 6.15 4.64 -1.91 -1.21 113.55 120.83 2jmx h SER 63 Ca -0.37 0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 60.93 2jmx h SER 63 Cb 1.24 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 63.13 2jmx h SER 63 CO -0.22 0.58 0.21 0.58 -0.87 0.00 0.00 176.83 177.10 2jmx h VAL 64 N 1.06 1.24 -0.71 0.95 2.07 -1.81 -2.53 116.25 116.52 2jmx h VAL 64 Ca 0.42 -0.80 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 2jmx h VAL 64 Cb 0.22 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 2jmx h VAL 64 CO -0.19 0.31 0.43 0.50 0.02 0.00 0.00 177.57 178.64 2jmx h LYS 65 N 0.86 0.95 -0.94 1.57 3.11 -1.25 -2.10 116.57 118.78 2jmx h LYS 65 Ca 0.20 -0.08 0.04 0.00 -2.81 0.00 0.00 60.65 58.01 2jmx h LYS 65 Cb 0.27 -0.20 -0.06 0.00 -1.00 0.00 0.00 32.23 31.24 2jmx h LYS 65 CO -0.01 0.66 0.61 0.28 -2.81 0.00 0.00 179.45 178.18 2jmx h VAL 66 N 0.97 1.14 -0.94 2.00 2.07 -0.87 -1.77 116.25 118.84 2jmx h VAL 66 Ca 0.25 -0.39 0.04 0.00 0.82 0.00 0.00 66.70 67.42 2jmx h VAL 66 Cb -0.05 -0.11 -0.06 0.00 -1.52 0.00 0.00 31.29 29.55 2jmx h VAL 66 CO -0.05 0.21 0.61 0.50 0.02 0.00 0.00 177.57 178.86 2jmx h LYS 67 N 1.15 1.14 -0.89 1.57 3.64 -1.28 -1.73 116.57 120.16 2jmx h LYS 67 Ca 0.38 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.67 2jmx h LYS 67 Cb 0.06 -0.26 -0.04 0.00 -0.41 0.00 0.00 32.23 31.58 2jmx h LYS 67 CO -0.12 0.75 0.48 0.77 -2.27 0.00 0.00 179.45 179.06 2jmx h SER 68 N 1.17 1.12 -0.77 4.20 0.02 -1.31 -2.46 113.55 115.53 2jmx h SER 68 Ca 0.38 -0.11 0.02 0.00 -0.84 0.00 0.00 61.79 61.24 2jmx h SER 68 Cb 0.03 -0.29 -0.04 0.00 0.14 0.00 0.00 62.40 62.25 2jmx h SER 68 CO -0.13 0.91 0.51 -0.07 -1.14 0.00 0.00 176.83 176.90 2jmx h LEU 69 N 1.25 0.86 -0.76 5.07 3.38 -1.09 -1.87 115.31 122.16 2jmx h LEU 69 Ca 0.31 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 2jmx h LEU 69 Cb 0.04 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 2jmx h LEU 69 CO -0.05 0.62 0.43 -1.28 0.09 0.00 0.00 178.44 178.25 2jmx h SER 70 N 1.02 0.94 0.76 -0.43 0.87 -1.11 0.08 113.55 115.68 2jmx h SER 70 Ca 0.29 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 2jmx h SER 70 Cb -0.08 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 61.64 2jmx h SER 70 CO -0.08 0.75 0.00 -0.78 -0.53 0.00 0.00 176.83 176.19 2jmx h ASP 71 N 1.04 0.00 0.07 6.23 1.82 -1.04 -1.32 116.42 123.23 2jmx h ASP 71 Ca 0.27 0.00 -0.29 0.00 -0.39 0.00 0.00 57.03 56.62 2jmx h ASP 71 Cb 0.01 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.00 2jmx h ASP 71 CO -0.05 0.00 -1.53 -0.03 -1.61 0.00 0.00 179.24 176.03 2jmx h MET 72 N 0.00 0.16 -0.87 0.28 4.05 -0.48 -3.27 114.93 114.80 2jmx h MET 72 Ca 0.00 -0.27 0.03 0.00 -0.28 0.00 0.00 59.70 59.18 2jmx h MET 72 Cb 0.38 0.10 -0.05 0.00 -0.80 0.00 0.00 31.60 31.23 2jmx h MET 72 CO 0.00 1.13 0.57 1.15 0.23 0.00 0.00 176.91 179.99 2jmx h THR 73 N -0.45 1.16 -0.86 -0.77 2.02 -0.90 0.88 112.91 113.99 2jmx h THR 73 Ca -0.36 -0.38 0.01 0.00 0.77 0.00 0.00 66.41 66.45 2jmx h THR 73 Cb 1.67 -0.04 -0.04 0.00 -1.74 0.00 0.00 68.15 68.00 2jmx h THR 73 CO -0.03 0.20 0.57 0.00 0.37 0.00 0.00 175.52 176.63 2jmx h ALA 74 N 1.49 1.39 0.00 6.16 0.00 -1.37 -2.44 119.26 124.49 2jmx h ALA 74 Ca 0.34 -0.06 -0.27 0.00 0.00 0.00 0.00 54.91 54.93 2jmx h ALA 74 Cb -0.01 -0.35 -0.05 0.00 0.00 0.00 0.00 17.79 17.39 2jmx h ALA 74 CO -0.10 0.57 -1.57 -0.22 0.00 0.00 0.00 179.25 177.93 2jmx h LYS 75 N 1.17 0.00 0.00 0.00 3.11 -1.34 -3.33 116.57 116.17 2jmx h LYS 75 Ca 0.32 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 58.16 2jmx h LYS 75 Cb -0.13 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.10 2jmx h LYS 75 CO -0.07 0.53 0.00 0.39 -2.81 0.00 0.00 179.45 177.50 2jmx n GLU 76 N -3.07 0.09 -3.57 1.90 1.02 0.30 -4.90 120.64 112.41 2jmx n GLU 76 Ca -0.14 0.33 -0.20 0.00 -0.02 0.00 0.00 57.16 57.13 2jmx n GLU 76 Cb 1.01 -1.68 0.07 0.00 -0.02 0.00 0.00 31.44 30.82 2jmx n GLU 76 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2jmx n LYS 77 N -1.86 -6.26 -0.04 3.49 5.02 -0.94 -4.97 118.16 112.60 2jmx n LYS 77 Ca 0.03 0.76 -0.03 0.00 -2.02 0.00 0.00 58.31 57.05 2jmx n LYS 77 Cb 0.20 -5.65 0.03 0.00 -0.02 0.00 0.00 35.03 29.60 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 -4.35 -1.91 -4.07 2.13 3.72 -1.24 -5.04 117.46 106.70 2jmx n PHE 78 Ca -0.22 -0.08 -0.28 0.00 -0.05 0.00 0.00 57.45 56.82 2jmx n PHE 78 Cb 0.64 -0.17 -0.01 0.00 -0.94 0.00 0.00 39.48 39.00 2jmx n PHE 78 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2jmx s SER 79 N -1.96 4.52 0.46 4.37 0.01 -1.26 -4.98 113.70 114.86 2jmx s SER 79 Ca 0.07 -1.38 0.32 0.00 1.31 0.00 0.00 55.95 56.27 2jmx s SER 79 Cb -0.01 0.58 1.54 0.00 0.21 0.00 0.00 66.02 68.34 2jmx s SER 79 CO 0.06 -1.13 1.95 1.55 0.41 0.00 0.00 173.24 176.08 2jmx h PRO 80 N 0.80 0.00 -0.47 12.44 0.13 -1.96 -2.13 132.00 140.81 2jmx h PRO 80 Ca -0.37 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.62 2jmx h PRO 80 Cb 1.31 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.36 2jmx h PRO 80 CO 0.59 0.00 0.09 1.28 -0.23 0.00 0.00 178.00 179.73 2jmx n LEU 81 N -2.68 4.78 -0.53 1.56 7.99 -1.26 -4.50 117.00 122.36 2jmx n LEU 81 Ca -0.01 -3.29 0.03 0.00 -0.01 0.00 0.00 56.01 52.73 2jmx n LEU 81 Cb 0.15 -0.64 0.05 0.00 -0.11 0.00 0.00 43.42 42.86 2jmx n LEU 81 CO 0.19 0.87 0.31 0.41 -1.51 0.00 0.00 177.39 177.66 2jmx n THR 82 N -0.55 0.59 -2.53 -5.08 -1.04 -0.80 -4.74 114.28 100.13 2jmx n THR 82 Ca 0.32 -0.87 -0.22 0.00 -2.04 0.00 0.00 64.05 61.24 2jmx n THR 82 Cb 1.12 0.34 0.01 0.00 -1.82 0.00 0.00 70.33 69.98 2jmx n THR 82 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2jmx n SER 83 N -0.35 3.87 0.16 8.00 7.64 -1.25 -4.43 113.62 127.26 2jmx n SER 83 Ca 0.06 -3.46 0.00 0.00 1.01 0.00 0.00 58.87 56.48 2jmx n SER 83 Cb 0.74 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 63.47 2jmx n SER 83 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2jmx n ASN 84 N -0.37 -2.84 0.18 6.43 2.85 -1.26 -4.87 115.26 115.38 2jmx n ASN 84 Ca 0.31 0.64 0.15 0.00 -0.11 0.00 0.00 54.58 55.57 2jmx n ASN 84 Cb 0.70 2.79 0.75 0.00 1.24 0.00 0.00 39.78 45.26 2jmx n ASN 84 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 2jmx h LEU 85 N 0.00 0.00 -0.40 1.20 5.85 -1.85 -0.90 115.31 119.21 2jmx h LEU 85 Ca 0.00 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 2jmx h LEU 85 Cb 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2jmx h LEU 85 CO 0.00 0.00 -0.01 0.40 -0.34 0.00 0.00 178.44 178.49 2jmx h ILE 86 N 0.00 1.26 -0.55 4.05 2.04 -1.90 -1.41 117.51 121.00 2jmx h ILE 86 Ca 0.09 -1.04 -0.00 0.00 1.00 0.00 0.00 64.86 64.91 2jmx h ILE 86 Cb 0.43 1.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 2jmx h ILE 86 CO -0.00 0.35 0.33 -1.13 0.00 0.00 0.00 178.15 177.70 2jmx h ASN 87 N 0.55 0.67 -0.77 1.72 -1.24 -1.52 -2.14 115.58 112.84 2jmx h ASN 87 Ca 0.11 -0.07 0.04 0.00 0.71 0.00 0.00 56.30 57.09 2jmx h ASN 87 Cb 0.50 -0.17 -0.05 0.00 0.73 0.00 0.00 38.32 39.33 2jmx h ASN 87 CO 0.02 0.54 0.48 -0.07 -1.29 0.00 0.00 177.43 177.12 2jmx h LEU 88 N 0.75 0.79 -1.12 0.34 3.38 -1.25 0.38 115.31 118.58 2jmx h LEU 88 Ca 0.20 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.21 2jmx h LEU 88 Cb -0.00 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.53 2jmx h LEU 88 CO -0.04 0.54 0.60 -0.07 0.09 0.00 0.00 178.44 179.57 2jmx h LEU 89 N 0.94 0.98 -3.69 1.67 3.38 -0.66 -1.59 115.31 116.34 2jmx h LEU 89 Ca 0.31 -0.01 -0.32 0.00 0.09 0.00 0.00 57.88 57.96 2jmx h LEU 89 Cb 0.04 -0.22 -0.19 0.00 0.09 0.00 0.00 40.66 40.37 2jmx h LEU 89 CO -0.12 0.67 0.30 0.00 0.09 0.00 0.00 178.44 179.38 2jmx n ALA 90 N -2.39 4.82 -0.08 1.53 0.00 -0.55 0.61 120.51 124.44 2jmx n ALA 90 Ca 0.12 -2.83 -0.21 0.00 0.00 0.00 0.00 53.44 50.52 2jmx n ALA 90 Cb 0.11 -1.13 -0.12 0.00 0.00 0.00 0.00 19.45 18.30 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 -0.90 0.67 -1.60 0.00 2.13 0.12 -4.64 120.64 116.42 2jmx n GLU 91 Ca 0.45 0.23 -0.01 0.00 0.66 0.00 0.00 57.16 58.50 2jmx n GLU 91 Cb 1.37 -1.60 0.08 0.00 0.27 0.00 0.00 31.44 31.56 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 -3.54 1.96 -0.95 4.31 3.02 -1.25 -4.96 115.26 113.84 2jmx n ASN 92 Ca -0.41 -2.83 -0.00 0.00 -0.03 0.00 0.00 54.58 51.31 2jmx n ASN 92 Cb 0.97 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 39.74 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 -0.38 0.50 1.24 7.41 0.00 -1.26 -4.99 105.19 107.71 2jmx n GLY 93 Ca 0.16 -0.50 0.02 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.95 2.95 -1.20 1.61 5.12 0.20 -4.55 116.66 119.84 2jmx n ARG 94 Ca -0.00 -2.99 -0.20 0.00 -1.93 0.00 0.00 57.85 52.73 2jmx n ARG 94 Cb 0.50 -1.94 0.15 0.00 -1.16 0.00 0.00 32.46 30.00 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 -0.52 5.90 -0.05 0.55 4.77 -0.74 -4.12 117.00 122.78 2jmx n LEU 95 Ca 0.29 -3.95 -0.12 0.00 -0.03 0.00 0.00 56.01 52.20 2jmx n LEU 95 Cb 1.05 -0.75 -0.04 0.00 -2.33 0.00 0.00 43.42 41.35 2jmx n LEU 95 CO 0.23 1.34 -0.78 0.35 -1.33 0.00 0.00 177.39 177.20 2jmx n THR 96 N -1.04 0.92 -1.32 -5.08 -2.24 -1.26 -4.62 114.28 99.64 2jmx n THR 96 Ca 0.50 -0.06 -0.27 0.00 -2.27 0.00 0.00 64.05 61.96 2jmx n THR 96 Cb 1.16 -1.76 0.14 0.00 -2.10 0.00 0.00 70.33 67.76 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 -3.71 5.21 -0.08 3.42 3.02 -1.26 -4.67 115.26 117.18 2jmx n ASN 97 Ca -0.21 -3.70 0.02 0.00 -0.03 0.00 0.00 54.58 50.66 2jmx n ASN 97 Cb 0.56 -0.86 0.33 0.00 -0.61 0.00 0.00 39.78 39.20 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 1.16 -0.85 3.41 1.03 -1.82 -2.47 112.91 114.41 2jmx h THR 98 Ca 0.59 -0.39 -0.02 0.00 -0.01 0.00 0.00 66.41 66.58 2jmx h THR 98 Cb 1.94 0.45 -0.04 0.00 -1.07 0.00 0.00 68.15 69.43 2jmx h THR 98 CO 1.23 0.17 0.46 1.55 -0.01 0.00 0.00 175.52 178.92 2jmx h PRO 99 N 0.72 1.18 -0.44 0.00 0.13 -1.92 -1.37 132.00 130.30 2jmx h PRO 99 Ca 0.19 -0.14 0.05 0.00 -0.87 0.00 0.00 66.00 65.23 2jmx h PRO 99 Cb 0.01 -0.23 -0.02 0.00 0.13 0.00 0.00 31.00 30.88 2jmx h PRO 99 CO -0.03 0.87 0.30 0.00 -0.23 0.00 0.00 178.00 178.90 2jmx h ALA 100 N 1.32 1.93 0.00 -0.56 0.00 -1.81 -0.63 119.26 119.50 2jmx h ALA 100 Ca 0.30 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 2jmx h ALA 100 Cb 0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2jmx h ALA 100 CO -0.05 0.00 -0.38 0.28 0.00 0.00 0.00 179.25 179.10 2jmx h VAL 101 N 0.38 1.21 0.11 0.00 2.07 -1.21 -3.08 116.25 115.74 2jmx h VAL 101 Ca 0.19 -1.32 -0.27 0.00 0.82 0.00 0.00 66.70 66.12 2jmx h VAL 101 Cb 0.27 1.72 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 2jmx h VAL 101 CO -0.05 0.37 -1.21 0.40 0.02 0.00 0.00 177.57 177.11 2jmx h ILE 102 N 0.00 1.52 -0.25 4.57 2.04 -1.00 -3.24 117.51 121.16 2jmx h ILE 102 Ca -0.00 -3.09 0.02 0.00 1.00 0.00 0.00 64.86 62.78 2jmx h ILE 102 Cb 0.69 2.93 -0.02 0.00 -0.74 0.00 0.00 36.82 39.68 2jmx h ILE 102 CO 0.05 0.90 0.12 -1.28 0.00 0.00 0.00 178.15 177.94 2jmx h SER 103 N 0.07 0.17 -0.40 1.72 0.87 -1.36 -1.04 113.55 113.58 2jmx h SER 103 Ca -0.12 0.01 0.05 0.00 -1.23 0.00 0.00 61.79 60.51 2jmx h SER 103 Cb 1.94 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 63.86 2jmx h SER 103 CO 0.20 0.13 0.27 0.00 -0.53 0.00 0.00 176.83 176.90 2jmx h ALA 104 N 1.13 1.97 -0.90 6.23 0.00 -1.65 -1.72 119.26 124.32 2jmx h ALA 104 Ca 0.10 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.08 2jmx h ALA 104 Cb 0.04 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.68 2jmx h ALA 104 CO -0.08 -0.05 0.55 0.35 0.00 0.00 0.00 179.25 180.03 2jmx h PHE 105 N 0.32 1.01 -0.52 0.00 3.04 -1.21 0.47 116.94 120.05 2jmx h PHE 105 Ca 0.17 0.03 -0.10 0.00 3.98 0.00 0.00 57.97 62.06 2jmx h PHE 105 Cb 0.29 -0.32 -0.02 0.00 2.56 0.00 0.00 35.95 38.47 2jmx h PHE 105 CO -0.00 0.46 -0.05 1.03 -2.02 0.00 0.00 178.31 177.72 2jmx h SER 106 N 0.95 0.95 0.17 0.41 0.87 -1.21 0.15 113.55 115.83 2jmx h SER 106 Ca 0.42 -0.33 -0.19 0.00 -1.23 0.00 0.00 61.79 60.45 2jmx h SER 106 Cb 0.30 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.00 2jmx h SER 106 CO -0.22 1.05 -0.74 0.74 -0.53 0.00 0.00 176.83 177.14 2jmx h THR 107 N 0.82 1.36 -0.17 2.23 2.02 -1.30 -3.04 112.91 114.84 2jmx h THR 107 Ca 0.14 -2.11 -0.15 0.00 0.77 0.00 0.00 66.41 65.06 2jmx h THR 107 Cb 0.60 2.08 -0.01 0.00 -1.74 0.00 0.00 68.15 69.09 2jmx h THR 107 CO 0.04 0.64 -0.55 0.24 0.37 0.00 0.00 175.52 176.26 2jmx h MET 108 N 0.33 0.49 -0.87 6.66 2.86 0.03 -3.07 114.93 121.37 2jmx h MET 108 Ca -0.04 -0.31 0.02 0.00 -2.06 0.00 0.00 59.70 57.32 2jmx h MET 108 Cb 1.33 0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.97 2jmx h MET 108 CO 0.13 0.91 0.57 1.98 1.06 0.00 0.00 176.91 181.56 2jmx h MET 109 N 0.38 1.09 -0.49 1.72 -1.53 -0.66 -1.22 114.93 114.22 2jmx h MET 109 Ca 0.01 -0.07 0.09 0.00 -3.44 0.00 0.00 59.70 56.29 2jmx h MET 109 Cb 1.07 -0.25 -0.03 0.00 -0.55 0.00 0.00 31.60 31.85 2jmx h MET 109 CO 0.10 0.72 0.33 0.66 0.14 0.00 0.00 176.91 178.86 2jmx h SER 110 N 1.12 0.25 1.11 1.39 4.64 -1.43 0.76 113.55 121.40 2jmx h SER 110 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 2jmx h SER 110 Cb -0.06 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 2jmx h SER 110 CO -0.10 0.15 0.00 0.52 -0.87 0.00 0.00 176.83 176.54 2jmx n VAL 111 N -4.46 0.43 0.10 0.95 0.31 -0.48 -2.60 118.33 112.58 2jmx n VAL 111 Ca 0.07 -0.06 0.06 0.00 -0.01 0.00 0.00 64.34 64.40 2jmx n VAL 111 Cb 0.36 -0.66 -0.00 0.00 -0.91 0.00 0.00 33.84 32.63 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 0.02 3.52 -0.00 -0.66 -2.44 115.15 115.59 2jmx h HIS 112 Ca 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 60.37 60.02 2jmx h HIS 112 Cb 0.55 0.00 -0.06 0.00 -0.00 0.00 0.00 27.41 27.91 2jmx h HIS 112 CO 0.00 0.28 -2.15 -2.13 -0.00 0.00 0.00 177.93 173.93 2jmx n ARG 113 N -2.90 0.68 -0.05 5.12 0.63 -1.16 -4.52 116.66 114.46 2jmx n ARG 113 Ca -0.02 0.15 -0.12 0.00 -0.92 0.00 0.00 57.85 56.94 2jmx n ARG 113 Cb 0.68 -1.63 -0.14 0.00 0.45 0.00 0.00 32.46 31.82 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 1.84 -0.87 2.55 5.14 0.00 -1.07 -4.44 105.19 108.33 2jmx n GLY 114 Ca -0.31 -0.18 -0.39 0.00 0.00 0.00 0.00 46.02 45.14 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 -3.04 4.66 -2.77 1.61 2.13 -0.92 -4.64 120.64 117.67 2jmx n GLU 115 Ca -0.27 -3.79 -0.20 0.00 0.66 0.00 0.00 57.16 53.56 2jmx n GLU 115 Cb 1.08 -2.53 -0.01 0.00 0.27 0.00 0.00 31.44 30.25 2jmx n GLU 115 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 2jmx n VAL 116 N 0.97 1.60 -1.45 6.31 3.14 -1.26 -4.80 118.33 122.84 2jmx n VAL 116 Ca 0.56 -4.44 -0.29 0.00 -2.96 0.00 0.00 64.34 57.20 2jmx n VAL 116 Cb 0.27 -0.52 0.12 0.00 -1.06 0.00 0.00 33.84 32.65 2jmx n VAL 116 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 2jmx s PRO 117 N -3.18 1.54 -0.32 1.45 0.04 -1.26 -5.07 135.00 128.20 2jmx s PRO 117 Ca 0.40 0.58 0.01 0.00 0.04 0.00 0.00 61.00 62.03 2jmx s PRO 117 Cb 0.38 -1.86 0.14 0.00 0.04 0.00 0.00 34.50 33.20 2jmx s PRO 117 CO -0.09 -1.98 0.31 0.00 0.04 0.00 0.00 177.00 175.28 2jmx n THR 119 N 4.89 1.37 -1.17 0.00 -1.04 -1.26 -5.37 114.28 111.70 2jmx n THR 119 Ca 0.03 -3.28 0.00 0.00 -2.04 0.00 0.00 64.05 58.76 2jmx n THR 119 Cb 0.45 0.58 0.00 0.00 -1.82 0.00 0.00 70.33 69.54 2jmx n THR 119 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98