#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmm s PRO 2 N 0.00 4.20 0.46 0.03 0.04 -1.26 -4.94 135.00 133.53 2jmm s PRO 2 Ca 0.00 1.47 0.00 0.00 0.04 0.00 0.00 61.00 62.51 2jmm s PRO 2 Cb 0.00 -2.54 0.00 0.00 0.04 0.00 0.00 34.50 32.00 2jmm s PRO 2 CO 0.00 -0.10 0.00 1.17 0.04 0.00 0.00 177.00 178.11 2jmm n LYS 3 N -0.06 -2.63 -2.20 4.56 4.81 -1.26 -5.05 118.16 116.31 2jmm n LYS 3 Ca 0.05 2.09 -0.02 0.00 -0.87 0.00 0.00 58.31 59.56 2jmm n LYS 3 Cb 0.50 -3.10 0.00 0.00 0.02 0.00 0.00 35.03 32.45 2jmm n LYS 3 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2jmm n ASP 4 N -3.92 -5.35 -2.67 3.14 8.00 -1.20 -4.44 116.55 110.11 2jmm n ASP 4 Ca -0.06 0.62 -0.16 0.00 0.71 0.00 0.00 54.79 55.90 2jmm n ASP 4 Cb 0.55 -3.44 0.06 0.00 -0.02 0.00 0.00 41.12 38.27 2jmm n ASP 4 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2jmm n ASN 5 N 0.11 -4.47 -4.87 -2.24 3.02 -0.45 -4.96 115.26 101.41 2jmm n ASN 5 Ca 0.02 -0.39 -0.37 0.00 -0.03 0.00 0.00 54.58 53.81 2jmm n ASN 5 Cb 0.09 -3.68 -0.06 0.00 -0.61 0.00 0.00 39.78 35.53 2jmm n ASN 5 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2jmm s THR 6 N -3.23 5.38 -0.14 3.41 -4.23 -0.52 -4.92 115.64 111.39 2jmm s THR 6 Ca 0.33 0.38 -0.02 0.00 -1.18 0.00 0.00 61.69 61.19 2jmm s THR 6 Cb -0.15 -3.49 -0.02 0.00 1.34 0.00 0.00 72.50 70.18 2jmm s THR 6 CO 0.51 0.61 -0.06 0.86 -0.54 0.00 0.00 174.62 175.99 2jmm s TRP 7 N -1.05 2.97 -0.07 3.99 -0.11 -1.26 -0.89 118.94 122.51 2jmm s TRP 7 Ca 0.17 -0.34 0.04 0.00 1.22 0.00 0.00 56.10 57.19 2jmm s TRP 7 Cb -0.13 -1.90 0.00 0.00 -1.50 0.00 0.00 33.47 29.94 2jmm s TRP 7 CO 0.07 -0.03 -0.19 0.71 -4.62 0.00 0.00 176.95 172.89 2jmm s TYR 8 N 0.22 2.02 -0.05 5.86 2.02 0.10 -0.74 117.35 126.78 2jmm s TYR 8 Ca -0.04 -0.75 0.04 0.00 -0.37 0.00 0.00 57.07 55.95 2jmm s TYR 8 Cb -0.14 -1.38 0.00 0.00 -0.40 0.00 0.00 41.96 40.04 2jmm s TYR 8 CO 0.03 -0.31 -0.15 -0.08 -1.57 0.00 0.00 175.55 173.47 2jmm s THR 9 N 0.37 1.33 0.00 -0.71 -1.32 0.10 -0.05 115.64 115.36 2jmm s THR 9 Ca -0.14 -0.63 0.00 0.00 -1.21 0.00 0.00 61.69 59.71 2jmm s THR 9 Cb -0.16 -1.16 0.00 0.00 -1.51 0.00 0.00 72.50 69.67 2jmm s THR 9 CO 0.06 0.39 0.00 0.61 -2.21 0.00 0.00 174.62 173.47 2jmm n GLY 10 N 3.38 1.84 3.18 6.08 0.00 -0.24 0.04 105.19 119.47 2jmm n GLY 10 Ca -0.20 -0.20 -0.19 0.00 0.00 0.00 0.00 46.02 45.44 2jmm n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jmm s ALA 11 N -1.00 1.21 0.02 4.61 0.00 0.11 -0.02 121.76 126.69 2jmm s ALA 11 Ca 0.00 -1.02 0.07 0.00 0.00 0.00 0.00 51.96 51.02 2jmm s ALA 11 Cb 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 2jmm s ALA 11 CO 0.00 0.17 -0.22 -1.59 0.00 0.00 0.00 175.76 174.12 2jmm s LYS 12 N -1.77 1.60 -0.04 0.00 0.00 0.25 -0.63 119.74 119.16 2jmm s LYS 12 Ca -0.01 -0.91 0.04 0.00 0.00 0.00 0.00 55.97 55.09 2jmm s LYS 12 Cb -0.10 -1.66 -0.03 0.00 0.00 0.00 0.00 37.83 36.04 2jmm s LYS 12 CO 0.02 0.44 -0.14 -1.17 0.00 0.00 0.00 175.35 174.50 2jmm s LEU 13 N -0.93 2.75 -0.15 2.77 2.96 0.13 -0.81 118.68 125.40 2jmm s LEU 13 Ca 0.09 -0.20 -0.01 0.00 -0.22 0.00 0.00 54.13 53.79 2jmm s LEU 13 Cb -0.09 -1.56 -0.01 0.00 0.50 0.00 0.00 46.19 45.03 2jmm s LEU 13 CO 0.01 0.34 -0.12 -0.83 -1.32 0.00 0.00 176.35 174.42 2jmm s GLY 14 N -0.79 1.53 -0.01 7.98 0.00 -1.26 -0.79 107.32 113.98 2jmm s GLY 14 Ca 0.12 -0.97 0.07 0.00 0.00 0.00 0.00 44.72 43.94 2jmm s GLY 14 CO 0.01 -0.05 -0.23 0.86 0.00 0.00 0.00 173.10 173.69 2jmm s TRP 15 N 0.62 2.43 -0.40 1.90 -0.11 0.77 -4.90 118.94 119.25 2jmm s TRP 15 Ca -0.07 -0.36 -0.07 0.00 1.22 0.00 0.00 56.10 56.82 2jmm s TRP 15 Cb -0.15 -1.51 0.08 0.00 -1.50 0.00 0.00 33.47 30.38 2jmm s TRP 15 CO 0.03 0.06 0.21 0.45 -4.62 0.00 0.00 176.95 173.08 2jmm s SER 16 N -0.81 5.47 0.24 5.86 0.15 -1.26 -0.78 113.70 122.57 2jmm s SER 16 Ca 0.11 -1.52 -0.05 0.00 0.70 0.00 0.00 55.95 55.19 2jmm s SER 16 Cb -0.10 -1.92 0.41 0.00 -1.71 0.00 0.00 66.02 62.70 2jmm s SER 16 CO 0.00 -0.49 1.75 -0.61 1.20 0.00 0.00 173.24 175.10 2jmm h GLN 17 N 8.29 0.50 -0.06 5.44 -0.00 -1.93 -2.80 115.11 124.55 2jmm h GLN 17 Ca -0.21 -0.03 -0.01 0.00 -0.00 0.00 0.00 58.65 58.40 2jmm h GLN 17 Cb 1.08 -0.11 -0.00 0.00 0.00 0.00 0.00 27.48 28.44 2jmm h GLN 17 CO 0.71 0.33 0.00 -0.92 0.00 0.00 0.00 178.83 178.96 2jmm h TYR 18 N 0.52 0.10 -3.58 3.99 3.20 -1.93 -3.39 116.97 115.87 2jmm h TYR 18 Ca 0.39 -0.02 -0.77 0.00 3.14 0.00 0.00 58.73 61.48 2jmm h TYR 18 Cb 0.53 -0.03 -0.30 0.00 1.54 0.00 0.00 36.73 38.47 2jmm h TYR 18 CO -0.14 0.35 0.18 0.45 -1.64 0.00 0.00 178.16 177.36 2jmm s SER 19 N -5.57 6.73 0.00 -2.11 0.15 -1.06 -4.99 113.70 106.86 2jmm s SER 19 Ca -0.14 -3.33 0.00 0.00 0.70 0.00 0.00 55.95 53.18 2jmm s SER 19 Cb 0.04 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 62.23 2jmm s SER 19 CO 0.68 -0.35 0.00 -1.14 1.20 0.00 0.00 173.24 173.64 2jmm n ARG 20 N 3.02 0.00 -3.83 5.44 0.63 -1.25 -3.91 116.66 116.76 2jmm n ARG 20 Ca 0.19 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.83 2jmm n ARG 20 Cb 0.41 0.00 -0.14 0.00 0.45 0.00 0.00 32.46 33.18 2jmm n ARG 20 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 2jmm s GLU 21 N -0.25 1.50 -0.58 -0.14 2.02 -1.26 -4.87 118.70 115.13 2jmm s GLU 21 Ca 0.00 -2.12 -0.01 0.00 0.02 0.00 0.00 54.97 52.85 2jmm s GLU 21 Cb 0.00 -2.75 0.15 0.00 0.10 0.00 0.00 34.13 31.63 2jmm s GLU 21 CO 0.00 -1.10 0.37 -0.80 0.02 0.00 0.00 175.26 173.75 2jmm s ASN 22 N 0.30 5.05 -1.00 -0.19 -0.87 -1.25 -5.03 114.94 111.96 2jmm s ASN 22 Ca 0.16 -2.78 -0.24 0.00 -1.57 0.00 0.00 52.86 48.43 2jmm s ASN 22 Cb -0.24 -1.80 -0.02 0.00 -0.02 0.00 0.00 41.25 39.16 2jmm s ASN 22 CO -0.03 -0.36 1.82 -1.58 -2.57 0.00 0.00 177.10 174.38 2jmm s GLN 23 N 0.04 2.87 -0.18 -0.60 0.74 -1.26 -4.59 119.66 116.67 2jmm s GLN 23 Ca 0.16 -0.71 -0.00 0.00 0.05 0.00 0.00 55.36 54.85 2jmm s GLN 23 Cb -0.21 -5.19 -0.11 0.00 1.10 0.00 0.00 33.01 28.60 2jmm s GLN 23 CO -0.03 -3.14 -0.17 1.28 -0.55 0.00 0.00 175.29 172.68 2jmm n LEU 24 N 12.55 2.75 0.00 3.68 7.99 -1.26 -5.16 117.00 137.56 2jmm n LEU 24 Ca 0.40 -0.05 0.00 0.00 -0.01 0.00 0.00 56.01 56.35 2jmm n LEU 24 Cb 0.48 -0.61 0.00 0.00 -0.11 0.00 0.00 43.42 43.18 2jmm n LEU 24 CO 0.63 0.74 0.00 0.61 -1.51 0.00 0.00 177.39 177.87 2jmm n GLY 25 N 2.54 0.18 3.21 -0.72 0.00 -1.26 -5.05 105.19 104.08 2jmm n GLY 25 Ca -0.32 -2.05 -0.21 0.00 0.00 0.00 0.00 46.02 43.44 2jmm n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jmm s ALA 26 N -2.00 1.41 0.00 4.61 0.00 -1.26 -4.14 121.76 120.38 2jmm s ALA 26 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 50.92 2jmm s ALA 26 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.94 2jmm s ALA 26 CO 0.00 0.26 0.00 0.41 0.00 0.00 0.00 175.76 176.43 2jmm n GLY 27 N 1.42 4.30 3.67 0.00 0.00 0.01 -4.93 105.19 109.65 2jmm n GLY 27 Ca -0.20 -2.13 -0.35 0.00 0.00 0.00 0.00 46.02 43.34 2jmm n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jmm s ALA 28 N -2.00 3.50 -0.22 4.61 0.00 -0.22 -0.58 121.76 126.85 2jmm s ALA 28 Ca 0.00 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.25 2jmm s ALA 28 Cb 0.00 -2.00 0.05 0.00 0.00 0.00 0.00 23.12 21.17 2jmm s ALA 28 CO 0.00 0.18 -0.12 0.12 0.00 0.00 0.00 175.76 175.94 2jmm s PHE 29 N 0.36 2.81 -0.35 0.00 5.36 0.97 -0.16 117.98 126.97 2jmm s PHE 29 Ca 0.05 -1.90 -0.10 0.00 -0.96 0.00 0.00 56.93 54.01 2jmm s PHE 29 Cb -0.12 -1.80 0.02 0.00 -0.34 0.00 0.00 43.02 40.78 2jmm s PHE 29 CO -0.01 -0.81 0.18 0.20 -1.46 0.00 0.00 175.22 173.33 2jmm s GLY 30 N 1.26 1.90 -0.03 13.12 0.00 0.52 -1.08 107.32 123.02 2jmm s GLY 30 Ca -0.04 -1.61 0.00 0.00 0.00 0.00 0.00 44.72 43.08 2jmm s GLY 30 CO -0.08 0.79 -0.01 -0.32 0.00 0.00 0.00 173.10 173.49 2jmm s GLY 31 N 1.56 1.85 -0.03 0.20 0.00 0.93 -0.08 107.32 111.75 2jmm s GLY 31 Ca 0.03 -0.90 -0.01 0.00 0.00 0.00 0.00 44.72 43.83 2jmm s GLY 31 CO 0.06 -0.73 0.06 -0.47 0.00 0.00 0.00 173.10 172.02 2jmm s TYR 32 N -1.00 -0.03 -0.44 1.90 5.04 -0.20 0.01 117.35 122.63 2jmm s TYR 32 Ca 0.17 0.21 0.04 0.00 -2.44 0.00 0.00 57.07 55.04 2jmm s TYR 32 Cb -0.11 -0.14 0.12 0.00 0.35 0.00 0.00 41.96 42.18 2jmm s TYR 32 CO 0.07 -0.09 0.17 -1.14 -1.34 0.00 0.00 175.55 173.22 2jmm s GLN 33 N 0.82 1.68 -0.00 4.97 -0.44 -0.07 -0.43 119.66 126.18 2jmm s GLN 33 Ca -0.07 -2.23 -0.15 0.00 -2.50 0.00 0.00 55.36 50.42 2jmm s GLN 33 Cb -0.09 -3.13 -0.08 0.00 -1.64 0.00 0.00 33.01 28.06 2jmm s GLN 33 CO -0.03 -1.05 0.81 -0.24 0.50 0.00 0.00 175.29 175.28 2jmm h VAL 34 N 5.92 0.00 -3.50 1.34 3.04 -1.83 -0.87 116.25 120.36 2jmm h VAL 34 Ca -0.06 -0.28 -0.17 0.00 -1.01 0.00 0.00 66.70 65.18 2jmm h VAL 34 Cb 0.95 0.00 -0.24 0.00 -2.01 0.00 0.00 31.29 29.99 2jmm h VAL 34 CO 0.60 0.00 -0.54 0.20 -1.01 0.00 0.00 177.57 176.82 2jmm s ASN 35 N -3.89 -0.04 -0.90 3.17 0.01 -1.25 -2.33 114.94 109.71 2jmm s ASN 35 Ca -0.08 0.01 -0.25 0.00 -0.71 0.00 0.00 52.86 51.84 2jmm s ASN 35 Cb 0.01 0.23 -0.07 0.00 0.41 0.00 0.00 41.25 41.83 2jmm s ASN 35 CO 0.23 -0.20 2.03 -2.16 -1.51 0.00 0.00 177.10 175.49 2jmm s PRO 36 N -0.65 2.37 0.00 -0.60 0.04 -1.26 -2.02 135.00 132.89 2jmm s PRO 36 Ca -0.07 -0.19 0.00 0.00 0.04 0.00 0.00 61.00 60.77 2jmm s PRO 36 Cb -0.04 -5.02 0.00 0.00 0.04 0.00 0.00 34.50 29.47 2jmm s PRO 36 CO 0.01 -3.62 0.00 0.98 0.04 0.00 0.00 177.00 174.41 2jmm n TYR 37 N 14.89 0.00 -4.07 0.56 4.19 -1.16 -4.89 117.16 126.68 2jmm n TYR 37 Ca 0.42 0.00 -0.24 0.00 3.31 0.00 0.00 57.90 61.38 2jmm n TYR 37 Cb 0.46 0.00 -0.17 0.00 0.49 0.00 0.00 39.34 40.12 2jmm n TYR 37 CO 0.00 0.00 0.00 0.08 0.91 0.00 0.00 176.86 177.85 2jmm s VAL 38 N 0.00 0.82 0.08 2.97 1.01 -0.85 -0.27 120.40 124.16 2jmm s VAL 38 Ca 0.00 -0.21 0.08 0.00 0.00 0.00 0.00 61.98 61.85 2jmm s VAL 38 Cb 0.00 -0.85 -0.03 0.00 0.00 0.00 0.00 36.38 35.50 2jmm s VAL 38 CO 0.00 0.32 -0.21 -0.83 0.00 0.00 0.00 175.10 174.37 2jmm s GLY 39 N 1.38 1.23 -0.08 4.51 0.00 -0.55 -3.89 107.32 109.93 2jmm s GLY 39 Ca -0.02 -1.21 0.01 0.00 0.00 0.00 0.00 44.72 43.50 2jmm s GLY 39 CO -0.03 -1.18 -0.11 -1.36 0.00 0.00 0.00 173.10 170.41 2jmm s PHE 40 N -1.03 2.81 -0.16 1.90 0.08 0.43 0.26 117.98 122.27 2jmm s PHE 40 Ca 0.08 -0.24 -0.02 0.00 0.12 0.00 0.00 56.93 56.87 2jmm s PHE 40 Cb -0.10 -1.73 0.05 0.00 -0.57 0.00 0.00 43.02 40.67 2jmm s PHE 40 CO 0.04 0.11 -0.01 -1.21 -0.10 0.00 0.00 175.22 174.04 2jmm s GLU 41 N -0.39 0.95 -0.19 0.44 2.02 0.26 -1.04 118.70 120.76 2jmm s GLU 41 Ca 0.05 -0.35 -0.07 0.00 0.02 0.00 0.00 54.97 54.61 2jmm s GLU 41 Cb -0.12 -1.83 -0.04 0.00 0.10 0.00 0.00 34.13 32.24 2jmm s GLU 41 CO 0.02 -0.49 0.06 1.41 0.02 0.00 0.00 175.26 176.29 2jmm s MET 42 N 1.79 3.93 -0.30 1.61 -2.45 0.89 -0.61 119.30 124.16 2jmm s MET 42 Ca 0.01 -0.36 -0.06 0.00 -1.25 0.00 0.00 55.69 54.02 2jmm s MET 42 Cb -0.15 -3.22 0.02 0.00 1.25 0.00 0.00 34.83 32.72 2jmm s MET 42 CO -0.07 0.21 0.07 0.20 1.05 0.00 0.00 175.02 176.48 2jmm s GLY 43 N 0.53 1.78 -0.31 2.11 0.00 0.27 -0.36 107.32 111.34 2jmm s GLY 43 Ca 0.03 -1.50 -0.03 0.00 0.00 0.00 0.00 44.72 43.23 2jmm s GLY 43 CO 0.01 0.65 0.03 -0.47 0.00 0.00 0.00 173.10 173.32 2jmm s TYR 44 N 1.47 3.28 -0.14 1.90 6.14 0.78 -0.14 117.35 130.63 2jmm s TYR 44 Ca 0.02 -1.82 0.02 0.00 0.64 0.00 0.00 57.07 55.93 2jmm s TYR 44 Cb -0.17 -2.20 0.01 0.00 0.42 0.00 0.00 41.96 40.02 2jmm s TYR 44 CO 0.02 -0.80 -0.20 0.34 0.64 0.00 0.00 175.55 175.55 2jmm s ASP 45 N 1.31 2.97 0.05 4.32 -1.08 0.24 -1.05 116.67 123.42 2jmm s ASP 45 Ca -0.04 -0.57 0.07 0.00 -0.52 0.00 0.00 52.55 51.49 2jmm s ASP 45 Cb -0.20 -1.37 -0.03 0.00 -1.46 0.00 0.00 42.92 39.87 2jmm s ASP 45 CO -0.00 0.05 -0.20 -1.66 0.52 0.00 0.00 175.17 173.87 2jmm s TRP 46 N 0.95 1.76 -0.61 -5.34 1.48 -1.26 -0.83 118.94 115.09 2jmm s TRP 46 Ca -0.05 -0.37 -0.26 0.00 -1.06 0.00 0.00 56.10 54.36 2jmm s TRP 46 Cb -0.15 -1.05 -0.03 0.00 -1.16 0.00 0.00 33.47 31.09 2jmm s TRP 46 CO -0.04 0.09 1.94 -1.17 -4.06 0.00 0.00 176.95 173.72 2jmm s LEU 47 N -1.21 3.30 -0.46 -4.66 2.96 -1.26 -4.89 118.68 112.46 2jmm s LEU 47 Ca 0.07 0.40 -0.16 0.00 -0.22 0.00 0.00 54.13 54.22 2jmm s LEU 47 Cb -0.09 -2.53 -0.15 0.00 0.50 0.00 0.00 46.19 43.92 2jmm s LEU 47 CO 0.02 -2.47 1.70 0.61 -1.32 0.00 0.00 176.35 174.89 2jmm n GLY 48 N 5.79 2.03 0.00 7.98 0.00 -1.26 -2.88 105.19 116.84 2jmm n GLY 48 Ca 0.23 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.42 2jmm n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jmm n ARG 49 N 6.17 0.00 -3.82 1.61 5.12 -1.26 -5.06 116.66 119.42 2jmm n ARG 49 Ca 0.38 0.00 -0.30 0.00 -1.93 0.00 0.00 57.85 56.00 2jmm n ARG 49 Cb 0.26 0.00 -0.14 0.00 -1.16 0.00 0.00 32.46 31.42 2jmm n ARG 49 CO 0.00 0.00 0.00 -1.64 -1.93 0.00 0.00 177.63 174.06 2jmm s MET 50 N 0.47 1.39 0.47 5.56 -1.94 -1.25 -5.00 119.30 119.00 2jmm s MET 50 Ca 0.00 -1.99 0.32 0.00 -1.71 0.00 0.00 55.69 52.31 2jmm s MET 50 Cb 0.00 -2.66 1.45 0.00 2.01 0.00 0.00 34.83 35.63 2jmm s MET 50 CO 0.00 -1.09 1.95 -1.00 -0.01 0.00 0.00 175.02 174.87 2jmm h PRO 51 N 7.03 0.00 0.00 2.03 0.13 -1.87 -3.47 132.00 135.85 2jmm h PRO 51 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2jmm h PRO 51 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 2jmm h PRO 51 CO 0.54 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.85 2jmm n ARG 52 N -2.76 0.00 -1.51 0.86 1.74 -1.26 -0.67 116.66 113.07 2jmm n ARG 52 Ca 0.00 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 56.91 2jmm n ARG 52 Cb 0.21 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.58 2jmm n ARG 52 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2jmm n LYS 53 N 0.00 -1.38 -3.53 5.56 5.02 -1.26 -4.92 118.16 117.65 2jmm n LYS 53 Ca 0.00 1.00 -0.29 0.00 -2.02 0.00 0.00 58.31 57.00 2jmm n LYS 53 Cb 0.00 -5.32 -0.12 0.00 -0.02 0.00 0.00 35.03 29.58 2jmm n LYS 53 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jmm s ALA 54 N -2.44 1.53 0.19 7.82 0.00 0.16 -4.06 121.76 124.95 2jmm s ALA 54 Ca 0.00 -2.31 0.09 0.00 0.00 0.00 0.00 51.96 49.74 2jmm s ALA 54 Cb 0.00 -1.71 -0.04 0.00 0.00 0.00 0.00 23.12 21.37 2jmm s ALA 54 CO 0.00 -2.06 -0.12 1.14 0.00 0.00 0.00 175.76 174.72 2jmm s GLN 55 N 0.49 1.98 -0.22 0.00 0.00 -1.26 -4.56 119.66 116.08 2jmm s GLN 55 Ca 0.22 -1.33 -0.02 0.00 -0.00 0.00 0.00 55.36 54.23 2jmm s GLN 55 Cb -0.16 -2.10 0.01 0.00 0.00 0.00 0.00 33.01 30.76 2jmm s GLN 55 CO -0.05 0.42 -0.08 0.20 0.00 0.00 0.00 175.29 175.78 2jmm s GLY 56 N -2.87 1.57 -0.10 2.60 0.00 -0.01 -0.69 107.32 107.81 2jmm s GLY 56 Ca 0.25 -1.28 0.03 0.00 0.00 0.00 0.00 44.72 43.72 2jmm s GLY 56 CO 0.15 0.43 -0.20 0.54 0.00 0.00 0.00 173.10 174.02 2jmm s VAL 57 N 1.39 1.78 -0.03 1.40 0.11 0.32 -0.59 120.40 124.79 2jmm s VAL 57 Ca 0.04 -0.84 0.06 0.00 -2.93 0.00 0.00 61.98 58.31 2jmm s VAL 57 Cb -0.15 -1.57 -0.02 0.00 -1.53 0.00 0.00 36.38 33.11 2jmm s VAL 57 CO -0.05 0.50 -0.19 0.00 -3.33 0.00 0.00 175.10 172.02 2jmm s GLN 58 N 0.64 2.29 -0.24 1.54 1.03 0.80 -0.31 119.66 125.40 2jmm s GLN 58 Ca -0.13 -0.82 0.02 0.00 0.04 0.00 0.00 55.36 54.47 2jmm s GLN 58 Cb -0.16 -2.23 0.06 0.00 0.03 0.00 0.00 33.01 30.70 2jmm s GLN 58 CO 0.04 0.59 -0.10 -0.51 -2.54 0.00 0.00 175.29 172.77 2jmm s LEU 59 N -0.80 2.97 -0.05 2.60 2.01 0.11 -0.57 118.68 124.96 2jmm s LEU 59 Ca 0.11 -1.23 0.05 0.00 0.01 0.00 0.00 54.13 53.07 2jmm s LEU 59 Cb -0.10 -1.40 -0.00 0.00 0.01 0.00 0.00 46.19 44.70 2jmm s LEU 59 CO 0.01 -0.19 -0.19 0.28 1.01 0.00 0.00 176.35 177.27 2jmm s THR 60 N 1.23 1.57 -0.17 5.49 -1.32 0.22 -0.55 115.64 122.11 2jmm s THR 60 Ca -0.06 -0.79 0.00 0.00 -1.21 0.00 0.00 61.69 59.63 2jmm s THR 60 Cb -0.19 -1.35 0.00 0.00 -1.51 0.00 0.00 72.50 69.46 2jmm s THR 60 CO -0.06 0.45 -0.16 0.00 -2.21 0.00 0.00 174.62 172.64 2jmm s ALA 61 N 0.05 2.47 -0.06 11.08 0.00 0.59 -0.57 121.76 135.31 2jmm s ALA 61 Ca -0.05 -1.12 -0.26 0.00 0.00 0.00 0.00 51.96 50.54 2jmm s ALA 61 Cb -0.12 -1.25 -0.03 0.00 0.00 0.00 0.00 23.12 21.71 2jmm s ALA 61 CO 0.03 -0.17 0.81 0.21 0.00 0.00 0.00 175.76 176.63 2jmm s LYS 62 N 1.04 4.46 -0.29 0.00 2.20 0.14 -0.91 119.74 126.37 2jmm s LYS 62 Ca -0.01 1.07 -0.06 0.00 -0.36 0.00 0.00 55.97 56.61 2jmm s LYS 62 Cb -0.15 -3.47 0.01 0.00 -1.51 0.00 0.00 37.83 32.72 2jmm s LYS 62 CO -0.04 -0.02 0.07 -1.17 -0.36 0.00 0.00 175.35 173.82 2jmm s LEU 63 N 1.05 3.82 0.00 5.43 2.96 0.03 -1.48 118.68 130.49 2jmm s LEU 63 Ca 0.42 -0.74 0.00 0.00 -0.22 0.00 0.00 54.13 53.59 2jmm s LEU 63 Cb -0.19 -1.86 0.00 0.00 0.50 0.00 0.00 46.19 44.64 2jmm s LEU 63 CO 0.20 -0.19 0.00 0.61 -1.32 0.00 0.00 176.35 175.65 2jmm n GLY 64 N 4.85 0.38 0.00 7.98 0.00 0.63 -2.53 105.19 116.50 2jmm n GLY 64 Ca -0.15 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.06 2jmm n GLY 64 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2jmm n TYR 65 N 2.64 0.00 0.00 1.61 9.36 -0.94 -3.00 117.16 126.83 2jmm n TYR 65 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2jmm n TYR 65 Cb 0.00 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.71 2jmm n TYR 65 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2jmm n PRO 66 N 0.00 3.24 -2.96 2.98 -0.04 -1.23 -1.10 135.00 135.89 2jmm n PRO 66 Ca 0.00 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.37 2jmm n PRO 66 Cb 0.00 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.47 2jmm n PRO 66 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2jmm n LYS 67 N 0.00 -2.39 0.00 0.54 4.81 -1.26 -2.34 118.16 117.52 2jmm n LYS 67 Ca 0.00 2.05 0.00 0.00 -0.87 0.00 0.00 58.31 59.49 2jmm n LYS 67 Cb 0.00 -4.34 0.00 0.00 0.02 0.00 0.00 35.03 30.71 2jmm n LYS 67 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2jmm n LEU 68 N 0.28 0.00 -3.31 3.14 4.32 -1.26 -4.88 117.00 115.29 2jmm n LEU 68 Ca 0.03 0.00 -0.26 0.00 -0.02 0.00 0.00 56.01 55.76 2jmm n LEU 68 Cb 0.35 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.11 2jmm n LEU 68 CO 0.41 0.00 1.85 0.61 -1.22 0.00 0.00 177.39 179.05 2jmm n GLY 69 N -0.57 2.25 2.12 -0.72 0.00 -0.99 -4.30 105.19 102.98 2jmm n GLY 69 Ca 0.00 -0.78 -0.08 0.00 0.00 0.00 0.00 46.02 45.15 2jmm n GLY 69 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2jmm n THR 70 N 5.29 1.73 0.09 2.61 -1.04 -1.26 -4.14 114.28 117.57 2jmm n THR 70 Ca 0.36 -3.26 0.00 0.00 -2.04 0.00 0.00 64.05 59.11 2jmm n THR 70 Cb 0.22 0.14 0.00 0.00 -1.82 0.00 0.00 70.33 68.87 2jmm n THR 70 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2jmm n ASP 71 N -0.58 -1.70 -0.05 8.00 -0.08 -1.26 -4.99 116.55 115.89 2jmm n ASP 71 Ca 0.23 0.48 -0.08 0.00 -1.51 0.00 0.00 54.79 53.90 2jmm n ASP 71 Cb 0.89 1.80 -0.02 0.00 2.34 0.00 0.00 41.12 46.13 2jmm n ASP 71 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 2jmm h ASP 72 N 0.00 -0.09 0.00 1.67 5.19 -1.86 -3.49 116.42 117.84 2jmm h ASP 72 Ca 0.00 0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 2jmm h ASP 72 Cb 0.00 0.09 0.00 0.00 0.18 0.00 0.00 39.33 39.60 2jmm h ASP 72 CO 0.00 -0.02 0.00 -0.11 -3.12 0.00 0.00 179.24 175.99 2jmm n LEU 73 N -5.15 0.00 -4.16 1.55 -0.00 -1.16 -2.92 117.00 105.16 2jmm n LEU 73 Ca -0.02 0.00 -0.36 0.00 -0.00 0.00 0.00 56.01 55.63 2jmm n LEU 73 Cb 0.12 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.41 2jmm n LEU 73 CO 0.26 0.00 -0.26 -1.81 -0.00 0.00 0.00 177.39 175.58 2jmm s ASP 74 N -4.00 5.11 -0.25 1.96 1.11 -0.54 -4.55 116.67 115.51 2jmm s ASP 74 Ca 0.00 -1.61 0.03 0.00 0.18 0.00 0.00 52.55 51.15 2jmm s ASP 74 Cb 0.00 -1.79 0.06 0.00 1.07 0.00 0.00 42.92 42.26 2jmm s ASP 74 CO 0.00 -0.40 -0.12 0.27 1.18 0.00 0.00 175.17 176.11 2jmm s ILE 75 N 1.22 2.18 0.03 0.77 -5.25 -0.26 -0.49 121.20 119.40 2jmm s ILE 75 Ca 0.02 -1.56 -0.04 0.00 -0.99 0.00 0.00 60.65 58.07 2jmm s ILE 75 Cb -0.21 -2.25 0.01 0.00 2.95 0.00 0.00 42.46 42.96 2jmm s ILE 75 CO -0.02 0.02 0.18 -1.22 -1.79 0.00 0.00 174.94 172.12 2jmm n TYR 76 N 4.45 -0.68 -4.45 1.37 4.02 -0.55 -2.20 117.16 119.12 2jmm n TYR 76 Ca -0.15 -0.22 -0.35 0.00 -0.01 0.00 0.00 57.90 57.18 2jmm n TYR 76 Cb 0.43 0.11 -0.10 0.00 -0.02 0.00 0.00 39.34 39.75 2jmm n TYR 76 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 2jmm s THR 77 N -2.46 4.10 -0.03 -0.72 -1.32 -1.05 -1.87 115.64 112.30 2jmm s THR 77 Ca 0.04 -0.32 0.07 0.00 -1.21 0.00 0.00 61.69 60.27 2jmm s THR 77 Cb -0.00 -2.71 -0.02 0.00 -1.51 0.00 0.00 72.50 68.25 2jmm s THR 77 CO 0.01 0.60 -0.24 0.00 -2.21 0.00 0.00 174.62 172.78 2jmm s ARG 78 N -0.80 2.21 0.03 7.08 1.70 0.14 -0.79 118.95 128.52 2jmm s ARG 78 Ca 0.12 -0.89 0.07 0.00 -0.47 0.00 0.00 55.73 54.56 2jmm s ARG 78 Cb -0.11 -2.11 -0.02 0.00 -0.57 0.00 0.00 34.95 32.14 2jmm s ARG 78 CO 0.02 0.56 -0.20 -0.48 -1.08 0.00 0.00 175.30 174.12 2jmm s LEU 79 N -0.60 2.13 0.00 -1.89 0.05 -0.09 -0.58 118.68 117.70 2jmm s LEU 79 Ca 0.09 -0.47 0.00 0.00 0.05 0.00 0.00 54.13 53.81 2jmm s LEU 79 Cb -0.10 -0.95 0.00 0.00 -2.05 0.00 0.00 46.19 43.08 2jmm s LEU 79 CO -0.00 0.17 0.00 0.61 -0.55 0.00 0.00 176.35 176.58 2jmm n GLY 80 N 2.08 1.27 3.01 -3.48 0.00 -0.52 -0.30 105.19 107.25 2jmm n GLY 80 Ca -0.17 -0.44 -0.10 0.00 0.00 0.00 0.00 46.02 45.32 2jmm n GLY 80 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jmm s GLY 81 N -0.37 0.33 -0.24 -0.02 0.00 0.28 -0.20 107.32 107.11 2jmm s GLY 81 Ca 0.00 -0.72 -0.01 0.00 0.00 0.00 0.00 44.72 43.99 2jmm s GLY 81 CO 0.00 -0.79 -0.09 1.06 0.00 0.00 0.00 173.10 173.28 2jmm s MET 82 N -1.85 2.79 -0.08 2.90 -1.94 0.11 -0.71 119.30 120.51 2jmm s MET 82 Ca -0.11 -0.99 0.04 0.00 -1.71 0.00 0.00 55.69 52.92 2jmm s MET 82 Cb -0.07 -2.91 -0.01 0.00 2.01 0.00 0.00 34.83 33.85 2jmm s MET 82 CO -0.02 -0.39 -0.23 0.08 -0.01 0.00 0.00 175.02 174.45 2jmm s VAL 83 N 1.29 2.20 -0.01 -6.03 1.01 0.57 -3.74 120.40 115.69 2jmm s VAL 83 Ca -0.00 -0.99 0.08 0.00 0.00 0.00 0.00 61.98 61.07 2jmm s VAL 83 Cb -0.16 -1.83 -0.02 0.00 0.00 0.00 0.00 36.38 34.37 2jmm s VAL 83 CO -0.06 0.56 -0.25 0.86 0.00 0.00 0.00 175.10 176.21 2jmm s TRP 84 N 0.09 2.26 -1.05 5.22 -0.11 -1.26 -0.52 118.94 123.57 2jmm s TRP 84 Ca -0.11 -0.42 -0.23 0.00 1.22 0.00 0.00 56.10 56.56 2jmm s TRP 84 Cb -0.16 -1.44 -0.04 0.00 -1.50 0.00 0.00 33.47 30.34 2jmm s TRP 84 CO 0.06 -0.00 1.87 1.03 -4.62 0.00 0.00 176.95 175.28 2jmm s ARG 85 N -0.73 2.78 -1.17 5.86 1.81 0.13 -4.91 118.95 122.71 2jmm s ARG 85 Ca 0.10 -0.84 -0.21 0.00 -1.72 0.00 0.00 55.73 53.07 2jmm s ARG 85 Cb -0.10 -5.20 0.03 0.00 -0.45 0.00 0.00 34.95 29.23 2jmm s ARG 85 CO -0.00 -3.35 1.71 0.00 -0.68 0.00 0.00 175.30 172.97 2jmm s ALA 86 N 9.30 2.76 0.20 2.13 0.00 -1.26 -4.10 121.76 130.78 2jmm s ALA 86 Ca 0.65 -2.49 0.23 0.00 0.00 0.00 0.00 51.96 50.36 2jmm s ALA 86 Cb -0.03 -4.61 0.95 0.00 0.00 0.00 0.00 23.12 19.42 2jmm s ALA 86 CO 0.04 -3.84 1.85 0.22 0.00 0.00 0.00 175.76 174.02 2jmm h ASP 87 N 8.87 0.00 -3.26 0.00 3.58 -1.92 -3.47 116.42 120.23 2jmm h ASP 87 Ca 0.31 0.00 -0.57 0.00 0.42 0.00 0.00 57.03 57.19 2jmm h ASP 87 Cb 0.93 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.94 2jmm h ASP 87 CO 1.39 0.25 -0.07 0.28 -2.88 0.00 0.00 179.24 178.21 2jmm s THR 88 N -3.75 4.81 -0.16 2.25 -1.32 -1.26 -5.07 115.64 111.14 2jmm s THR 88 Ca -0.00 1.03 -0.32 0.00 -1.21 0.00 0.00 61.69 61.19 2jmm s THR 88 Cb 0.11 -3.81 0.14 0.00 -1.51 0.00 0.00 72.50 67.42 2jmm s THR 88 CO 0.64 0.42 1.11 -0.55 -2.21 0.00 0.00 174.62 174.03 2jmm s SER 89 N -1.38 -0.23 0.02 8.08 0.15 -1.26 -5.20 113.70 113.89 2jmm s SER 89 Ca 0.33 0.11 0.01 0.00 0.70 0.00 0.00 55.95 57.09 2jmm s SER 89 Cb -0.17 0.21 -0.02 0.00 -1.71 0.00 0.00 66.02 64.33 2jmm s SER 89 CO 0.19 -0.30 -0.04 1.51 1.20 0.00 0.00 173.24 175.79 2jmm s ASP 90 N -1.77 0.36 -0.15 5.45 -4.77 -1.26 -5.16 116.67 109.38 2jmm s ASP 90 Ca 0.05 -0.45 -0.01 0.00 -3.30 0.00 0.00 52.55 48.85 2jmm s ASP 90 Cb -0.01 0.07 -0.01 0.00 -1.09 0.00 0.00 42.92 41.88 2jmm s ASP 90 CO -0.04 -0.24 -0.12 -0.75 0.70 0.00 0.00 175.17 174.72 2jmm s LYS 91 N -1.31 3.37 0.18 2.11 2.36 -1.26 -5.11 119.74 120.08 2jmm s LYS 91 Ca -0.13 -0.68 0.08 0.00 -2.55 0.00 0.00 55.97 52.69 2jmm s LYS 91 Cb -0.09 -2.69 -0.04 0.00 -1.05 0.00 0.00 37.83 33.96 2jmm s LYS 91 CO -0.01 0.13 -0.16 0.34 1.55 0.00 0.00 175.35 177.21 2jmm s ASP 92 N 0.56 2.57 -0.61 1.43 -1.08 -1.26 -5.06 116.67 113.22 2jmm s ASP 92 Ca -0.08 -0.92 -0.22 0.00 -0.52 0.00 0.00 52.55 50.81 2jmm s ASP 92 Cb -0.16 -0.14 -0.19 0.00 -1.46 0.00 0.00 42.92 40.98 2jmm s ASP 92 CO 0.03 -0.10 1.85 0.61 0.52 0.00 0.00 175.17 178.08 2jmm n GLY 93 N 0.03 2.20 3.04 2.66 0.00 -1.26 -4.83 105.19 107.04 2jmm n GLY 93 Ca -0.11 -1.13 -0.34 0.00 0.00 0.00 0.00 46.02 44.44 2jmm n GLY 93 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2jmm s ASN 94 N 5.23 4.90 0.00 1.61 -0.87 -1.26 -4.98 114.94 119.57 2jmm s ASN 94 Ca 0.56 -2.70 -0.01 0.00 -1.57 0.00 0.00 52.86 49.14 2jmm s ASN 94 Cb 0.14 -1.76 -0.05 0.00 -0.02 0.00 0.00 41.25 39.56 2jmm s ASN 94 CO 0.14 -0.35 1.23 0.61 -2.57 0.00 0.00 177.10 176.16 2jmm n GLY 95 N 3.63 1.52 1.41 0.66 0.00 -1.26 -3.01 105.19 108.14 2jmm n GLY 95 Ca 0.05 -0.22 -0.02 0.00 0.00 0.00 0.00 46.02 45.82 2jmm n GLY 95 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2jmm n TYR 96 N 2.28 -0.50 -5.02 1.61 0.18 -1.26 -5.15 117.16 109.30 2jmm n TYR 96 Ca 0.08 -0.53 -0.32 0.00 1.88 0.00 0.00 57.90 59.01 2jmm n TYR 96 Cb 0.27 0.71 -0.16 0.00 -0.38 0.00 0.00 39.34 39.78 2jmm n TYR 96 CO 0.00 0.00 0.00 -1.50 -2.08 0.00 0.00 176.86 173.28 2jmm s ILE 97 N 0.03 2.47 0.02 -3.48 1.10 -1.16 -5.09 121.20 115.09 2jmm s ILE 97 Ca 0.02 -0.87 -0.29 0.00 -0.51 0.00 0.00 60.65 59.00 2jmm s ILE 97 Cb 0.11 -1.99 0.10 0.00 0.15 0.00 0.00 42.46 40.83 2jmm s ILE 97 CO -0.03 0.54 1.13 -0.55 -2.11 0.00 0.00 174.94 173.92 2jmm s SER 98 N 0.36 -0.14 -0.24 4.50 0.15 -1.26 -5.12 113.70 111.96 2jmm s SER 98 Ca -0.15 -0.20 -0.04 0.00 0.70 0.00 0.00 55.95 56.26 2jmm s SER 98 Cb -0.17 0.29 0.01 0.00 -1.71 0.00 0.00 66.02 64.44 2jmm s SER 98 CO 0.07 -0.53 0.10 0.00 1.20 0.00 0.00 173.24 174.08 2jmm n ALA 99 N -0.41 -2.95 -3.35 5.45 0.00 -1.26 -5.06 120.51 112.92 2jmm n ALA 99 Ca -0.07 0.41 -0.29 0.00 0.00 0.00 0.00 53.44 53.50 2jmm n ALA 99 Cb 0.61 -1.20 -0.17 0.00 0.00 0.00 0.00 19.45 18.70 2jmm n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jmm s ALA 100 N -1.54 1.78 -0.18 0.00 0.00 -1.26 -5.13 121.76 115.44 2jmm s ALA 100 Ca 0.05 -0.74 -0.29 0.00 0.00 0.00 0.00 51.96 50.98 2jmm s ALA 100 Cb -0.01 -0.72 0.11 0.00 0.00 0.00 0.00 23.12 22.50 2jmm s ALA 100 CO 0.56 0.19 0.93 -1.83 0.00 0.00 0.00 175.76 175.62 2jmm s GLU 101 N 0.52 0.67 0.32 0.00 -1.05 -1.26 -5.17 118.70 112.73 2jmm s GLU 101 Ca -0.16 0.33 -0.29 0.00 -0.15 0.00 0.00 54.97 54.70 2jmm s GLU 101 Cb -0.17 0.32 -0.10 0.00 -0.44 0.00 0.00 34.13 33.74 2jmm s GLU 101 CO 0.06 -0.17 1.24 0.00 0.95 0.00 0.00 175.26 177.34 2jmm s ALA 102 N -0.70 3.45 0.24 -0.84 0.00 -1.26 -5.01 121.76 117.63 2jmm s ALA 102 Ca -0.02 1.15 -0.30 0.00 0.00 0.00 0.00 51.96 52.79 2jmm s ALA 102 Cb -0.02 -3.43 -0.09 0.00 0.00 0.00 0.00 23.12 19.58 2jmm s ALA 102 CO 0.01 -0.51 1.11 -1.54 0.00 0.00 0.00 175.76 174.84 2jmm s SER 103 N -0.63 7.25 0.47 0.00 1.04 -1.26 -4.96 113.70 115.61 2jmm s SER 103 Ca 0.48 2.21 0.12 0.00 0.48 0.00 0.00 55.95 59.25 2jmm s SER 103 Cb -0.37 -2.62 1.08 0.00 0.10 0.00 0.00 66.02 64.21 2jmm s SER 103 CO 0.49 -0.19 2.09 -0.37 0.98 0.00 0.00 173.24 176.24 2jmm h VAL 104 N 3.36 1.02 -6.05 5.02 -1.51 -1.96 -3.39 116.25 112.74 2jmm h VAL 104 Ca -0.46 -0.09 -0.14 0.00 -1.23 0.00 0.00 66.70 64.78 2jmm h VAL 104 Cb 1.21 0.72 0.01 0.00 -2.13 0.00 0.00 31.29 31.10 2jmm h VAL 104 CO 0.69 0.05 -0.99 -1.20 -1.23 0.00 0.00 177.57 174.89 2jmm n SER 105 N -4.50 -6.67 -4.74 4.19 7.64 -1.25 -0.84 113.62 107.46 2jmm n SER 105 Ca 0.01 0.39 -0.42 0.00 1.01 0.00 0.00 58.87 59.87 2jmm n SER 105 Cb 0.13 -2.88 -0.02 0.00 -1.01 0.00 0.00 64.21 60.43 2jmm n SER 105 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2jmm s PRO 106 N -1.91 4.20 -0.03 1.43 0.04 -1.26 -0.72 135.00 136.76 2jmm s PRO 106 Ca 0.18 2.42 0.05 0.00 0.04 0.00 0.00 61.00 63.70 2jmm s PRO 106 Cb -0.03 -3.09 -0.01 0.00 0.04 0.00 0.00 34.50 31.41 2jmm s PRO 106 CO 0.58 -0.54 -0.19 0.54 0.04 0.00 0.00 177.00 177.43 2jmm s VAL 107 N 0.27 1.50 -0.09 -0.36 0.11 0.71 -4.80 120.40 117.74 2jmm s VAL 107 Ca 0.63 -0.79 0.03 0.00 -2.93 0.00 0.00 61.98 58.93 2jmm s VAL 107 Cb -0.45 -1.26 0.00 0.00 -1.53 0.00 0.00 36.38 33.14 2jmm s VAL 107 CO 0.42 0.43 -0.20 -0.36 -3.33 0.00 0.00 175.10 172.06 2jmm s PHE 108 N -0.25 2.20 0.04 1.54 0.08 -0.68 -1.44 117.98 119.46 2jmm s PHE 108 Ca 0.03 -0.89 0.03 0.00 0.12 0.00 0.00 56.93 56.22 2jmm s PHE 108 Cb -0.09 -1.50 -0.02 0.00 -0.57 0.00 0.00 43.02 40.84 2jmm s PHE 108 CO 0.01 -0.38 -0.10 0.00 -0.10 0.00 0.00 175.22 174.65 2jmm s ALA 109 N 0.46 0.79 -0.02 5.36 0.00 0.25 0.01 121.76 128.61 2jmm s ALA 109 Ca -0.17 -0.73 0.05 0.00 0.00 0.00 0.00 51.96 51.11 2jmm s ALA 109 Cb -0.17 -0.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 2jmm s ALA 109 CO 0.07 0.09 -0.17 0.20 0.00 0.00 0.00 175.76 175.95 2jmm s GLY 110 N -1.26 0.85 0.00 0.00 0.00 -0.49 0.28 107.32 106.71 2jmm s GLY 110 Ca -0.04 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 43.96 2jmm s GLY 110 CO 0.01 -0.53 0.00 0.61 0.00 0.00 0.00 173.10 173.19 2jmm n GLY 111 N 2.80 -0.58 3.21 0.20 0.00 -0.78 -0.33 105.19 109.71 2jmm n GLY 111 Ca -0.16 -0.65 -0.31 0.00 0.00 0.00 0.00 46.02 44.90 2jmm n GLY 111 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jmm s VAL 112 N -3.19 1.99 -0.14 1.61 -7.23 0.03 -1.48 120.40 112.00 2jmm s VAL 112 Ca 0.00 -0.98 0.03 0.00 -1.81 0.00 0.00 61.98 59.21 2jmm s VAL 112 Cb 0.00 -1.72 0.01 0.00 0.56 0.00 0.00 36.38 35.23 2jmm s VAL 112 CO 0.00 0.55 -0.22 -0.70 -0.31 0.00 0.00 175.10 174.42 2jmm s GLU 113 N 0.30 3.03 -0.08 4.82 -6.30 0.35 -0.79 118.70 120.03 2jmm s GLU 113 Ca -0.17 -0.85 -0.01 0.00 -2.50 0.00 0.00 54.97 51.44 2jmm s GLU 113 Cb -0.17 -2.43 -0.03 0.00 0.00 0.00 0.00 34.13 31.49 2jmm s GLU 113 CO 0.08 0.00 -0.03 -0.47 0.02 0.00 0.00 175.26 174.86 2jmm s TYR 114 N 0.78 3.06 0.04 5.30 5.04 0.70 -1.47 117.35 130.80 2jmm s TYR 114 Ca -0.08 0.09 0.05 0.00 -2.44 0.00 0.00 57.07 54.69 2jmm s TYR 114 Cb -0.16 -1.77 -0.02 0.00 0.35 0.00 0.00 41.96 40.36 2jmm s TYR 114 CO -0.01 0.38 -0.15 0.54 -1.34 0.00 0.00 175.55 174.96 2jmm s VAL 115 N -0.75 1.21 -0.59 3.14 0.11 -1.15 -0.55 120.40 121.82 2jmm s VAL 115 Ca 0.12 -1.04 -0.33 0.00 -2.93 0.00 0.00 61.98 57.80 2jmm s VAL 115 Cb -0.11 -1.09 -0.14 0.00 -1.53 0.00 0.00 36.38 33.51 2jmm s VAL 115 CO 0.02 0.04 2.38 0.00 -3.33 0.00 0.00 175.10 174.21 2jmm n ILE 116 N 1.89 0.05 0.00 7.04 0.00 -0.75 -4.90 119.36 122.69 2jmm n ILE 116 Ca -0.18 -0.27 0.00 0.00 0.00 0.00 0.00 62.75 62.30 2jmm n ILE 116 Cb 0.54 -1.43 0.00 0.00 0.00 0.00 0.00 39.64 38.76 2jmm n ILE 116 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 2jmm n ARG 117 N 8.39 0.00 -3.73 9.51 0.63 -1.26 -4.96 116.66 125.24 2jmm n ARG 117 Ca 0.49 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 57.14 2jmm n ARG 117 Cb 0.21 -0.04 -0.16 0.00 0.45 0.00 0.00 32.46 32.91 2jmm n ARG 117 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 2jmm s ARG 118 N 0.00 0.65 0.05 -0.14 3.00 -1.26 -5.07 118.95 116.19 2jmm s ARG 118 Ca 0.00 -0.48 -0.28 0.00 -1.00 0.00 0.00 55.73 53.97 2jmm s ARG 118 Cb 0.00 -2.08 0.09 0.00 0.00 0.00 0.00 34.95 32.95 2jmm s ARG 118 CO 0.00 -0.68 0.95 0.50 0.00 0.00 0.00 175.30 176.07 2jmm s ARG 119 N 1.84 0.93 0.16 5.12 3.52 -1.26 -5.15 118.95 124.11 2jmm s ARG 119 Ca 0.00 -0.43 -0.34 0.00 -0.13 0.00 0.00 55.73 54.83 2jmm s ARG 119 Cb -0.17 0.37 -0.15 0.00 -1.56 0.00 0.00 34.95 33.44 2jmm s ARG 119 CO -0.10 -0.42 1.45 -0.89 -0.81 0.00 0.00 175.30 174.53 2jmm n ILE 120 N -0.34 0.30 -2.99 4.11 5.41 -1.26 -3.37 119.36 121.21 2jmm n ILE 120 Ca -0.07 -0.07 -0.15 0.00 1.00 0.00 0.00 62.75 63.46 2jmm n ILE 120 Cb 0.61 -1.31 0.02 0.00 -0.71 0.00 0.00 39.64 38.25 2jmm n ILE 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 2jmm n THR 121 N 2.71 -9.60 -2.10 1.39 -1.04 -1.26 -4.81 114.28 99.57 2jmm n THR 121 Ca 0.16 0.71 -0.29 0.00 -2.04 0.00 0.00 64.05 62.59 2jmm n THR 121 Cb 0.27 -6.52 -0.06 0.00 -1.82 0.00 0.00 70.33 62.21 2jmm n THR 121 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2jmm s PRO 122 N -2.59 2.59 0.00 -2.82 0.04 -1.22 -4.17 135.00 126.84 2jmm s PRO 122 Ca 0.27 -1.21 0.00 0.00 0.04 0.00 0.00 61.00 60.10 2jmm s PRO 122 Cb -0.06 -5.26 0.00 0.00 0.04 0.00 0.00 34.50 29.22 2jmm s PRO 122 CO 0.79 -3.86 0.54 -0.85 0.04 0.00 0.00 177.00 173.66 2jmm n GLU 123 N 8.30 0.00 -3.96 4.56 0.28 -1.26 -4.91 120.64 123.65 2jmm n GLU 123 Ca 0.45 -0.21 -0.34 0.00 -0.16 0.00 0.00 57.16 56.91 2jmm n GLU 123 Cb 0.47 0.12 -0.14 0.00 1.43 0.00 0.00 31.44 33.31 2jmm n GLU 123 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2jmm s ILE 124 N 0.00 2.70 -0.02 3.84 1.01 -1.26 -2.42 121.20 125.06 2jmm s ILE 124 Ca 0.00 -1.61 0.03 0.00 0.00 0.00 0.00 60.65 59.06 2jmm s ILE 124 Cb 0.00 -2.63 -0.03 0.00 0.01 0.00 0.00 42.46 39.81 2jmm s ILE 124 CO 0.00 -0.18 -0.07 0.00 0.00 0.00 0.00 174.94 174.69 2jmm s ALA 125 N 1.16 3.02 -0.08 9.38 0.00 0.86 -1.81 121.76 134.28 2jmm s ALA 125 Ca -0.04 -0.98 -0.03 0.00 0.00 0.00 0.00 51.96 50.91 2jmm s ALA 125 Cb -0.20 -1.16 0.04 0.00 0.00 0.00 0.00 23.12 21.80 2jmm s ALA 125 CO -0.03 0.60 0.06 0.99 0.00 0.00 0.00 175.76 177.39 2jmm s THR 126 N -0.95 -0.06 -0.02 0.00 2.01 0.29 -1.01 115.64 115.88 2jmm s THR 126 Ca 0.16 0.22 0.04 0.00 0.31 0.00 0.00 61.69 62.42 2jmm s THR 126 Cb -0.11 -0.31 -0.01 0.00 0.01 0.00 0.00 72.50 72.08 2jmm s THR 126 CO 0.06 0.04 -0.15 0.00 -0.69 0.00 0.00 174.62 173.89 2jmm s ARG 127 N 2.14 1.37 -0.06 4.92 3.03 0.53 -0.22 118.95 130.67 2jmm s ARG 127 Ca 0.04 -0.52 -0.02 0.00 2.03 0.00 0.00 55.73 57.26 2jmm s ARG 127 Cb -0.13 -1.26 0.03 0.00 -1.03 0.00 0.00 34.95 32.56 2jmm s ARG 127 CO -0.05 0.26 0.03 -0.48 -1.13 0.00 0.00 175.30 173.92 2jmm s LEU 128 N -0.12 0.41 0.01 -1.89 2.34 0.03 0.13 118.68 119.59 2jmm s LEU 128 Ca 0.01 -0.02 0.01 0.00 0.06 0.00 0.00 54.13 54.19 2jmm s LEU 128 Cb -0.08 -0.32 -0.01 0.00 -0.56 0.00 0.00 46.19 45.22 2jmm s LEU 128 CO 0.01 -0.22 -0.04 -1.83 -1.06 0.00 0.00 176.35 173.21 2jmm s GLU 129 N 2.05 0.33 -0.38 1.48 1.03 0.48 -0.79 118.70 122.90 2jmm s GLU 129 Ca 0.05 -0.26 -0.16 0.00 0.03 0.00 0.00 54.97 54.63 2jmm s GLU 129 Cb -0.12 -0.25 0.00 0.00 -0.80 0.00 0.00 34.13 32.96 2jmm s GLU 129 CO -0.04 0.06 0.38 0.71 -1.33 0.00 0.00 175.26 175.04 2jmm s TYR 130 N -0.39 3.20 -0.15 4.83 1.51 0.55 -0.59 117.35 126.30 2jmm s TYR 130 Ca -0.02 -0.24 -0.04 0.00 -1.01 0.00 0.00 57.07 55.76 2jmm s TYR 130 Cb -0.03 -2.74 -0.03 0.00 -0.11 0.00 0.00 41.96 39.04 2jmm s TYR 130 CO -0.00 -0.56 -0.02 1.14 -1.11 0.00 0.00 175.55 175.00 2jmm s GLN 131 N 2.01 3.66 -0.17 -0.62 -2.07 0.41 -1.39 119.66 121.50 2jmm s GLN 131 Ca 0.11 -0.48 0.01 0.00 -1.82 0.00 0.00 55.36 53.18 2jmm s GLN 131 Cb -0.17 -2.95 0.02 0.00 -1.09 0.00 0.00 33.01 28.82 2jmm s GLN 131 CO 0.12 0.29 -0.19 -1.58 -1.32 0.00 0.00 175.29 172.61 2jmm s TRP 132 N 0.25 2.70 0.03 9.60 0.51 0.10 -0.17 118.94 131.96 2jmm s TRP 132 Ca -0.01 -1.58 -0.07 0.00 -2.12 0.00 0.00 56.10 52.31 2jmm s TRP 132 Cb -0.14 -1.88 -0.30 0.00 -0.81 0.00 0.00 33.47 30.35 2jmm s TRP 132 CO 0.02 -0.78 0.97 1.79 -0.51 0.00 0.00 176.95 178.44 2jmm h THR 133 N 5.94 1.28 -5.15 2.01 1.35 -1.62 -1.80 112.91 114.92 2jmm h THR 133 Ca -0.44 -2.84 0.01 0.00 -0.55 0.00 0.00 66.41 62.58 2jmm h THR 133 Cb 1.14 2.89 -0.08 0.00 -1.73 0.00 0.00 68.15 70.37 2jmm h THR 133 CO 0.62 0.85 -1.33 -3.20 -0.25 0.00 0.00 175.52 172.21 2jmm n ASN 134 N -3.55 -3.23 0.00 5.36 5.15 -1.26 -4.90 115.26 112.83 2jmm n ASN 134 Ca -0.15 1.33 0.00 0.00 -0.60 0.00 0.00 54.58 55.17 2jmm n ASN 134 Cb 1.05 -4.99 0.00 0.00 -0.53 0.00 0.00 39.78 35.31 2jmm n ASN 134 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2jmm n ASN 135 N 1.45 0.00 -0.86 1.20 3.02 -1.26 -5.08 115.26 113.73 2jmm n ASN 135 Ca -0.27 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.28 2jmm n ASN 135 Cb 0.43 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.60 2jmm n ASN 135 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jmm n ALA 136 N -0.95 0.00 -0.99 5.41 0.00 -1.26 -4.47 120.51 118.25 2jmm n ALA 136 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.11 2jmm n ALA 136 Cb 0.00 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.59 2jmm n ALA 136 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2jmm s SER 137 N -4.00 3.44 0.00 0.00 0.15 -1.26 -3.86 113.70 108.16 2jmm s SER 137 Ca 0.00 2.29 0.00 0.00 0.70 0.00 0.00 55.95 58.94 2jmm s SER 137 Cb 0.00 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 2jmm s SER 137 CO 0.00 -2.77 0.00 0.47 1.20 0.00 0.00 173.24 172.14 2jmm n ASP 138 N -3.58 0.00 0.00 5.45 9.92 -1.26 -4.90 116.55 122.18 2jmm n ASP 138 Ca 0.13 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.39 2jmm n ASP 138 Cb 0.51 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.99 2jmm n ASP 138 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2jmm n ASN 139 N 1.62 0.00 -4.55 -2.24 5.15 -1.25 -3.92 115.26 110.06 2jmm n ASN 139 Ca 0.00 0.00 -0.38 0.00 -0.60 0.00 0.00 54.58 53.60 2jmm n ASN 139 Cb 0.00 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.22 2jmm n ASN 139 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2jmm s GLY 140 N -0.16 0.73 0.08 8.20 0.00 -1.26 -1.76 107.32 113.14 2jmm s GLY 140 Ca 0.00 -1.48 0.07 0.00 0.00 0.00 0.00 44.72 43.32 2jmm s GLY 140 CO 0.00 2.96 -0.19 -0.29 0.00 0.00 0.00 173.10 175.57 2jmm s MET 141 N 6.01 1.14 -0.14 2.90 1.75 0.75 -4.76 119.30 126.96 2jmm s MET 141 Ca 0.50 -1.04 -0.22 0.00 -1.25 0.00 0.00 55.69 53.69 2jmm s MET 141 Cb -0.07 -1.31 -0.03 0.00 2.84 0.00 0.00 34.83 36.27 2jmm s MET 141 CO 0.07 0.31 0.64 -1.17 -0.65 0.00 0.00 175.02 174.23 2jmm s LEU 142 N -1.61 4.23 -0.14 4.11 0.20 0.04 -0.44 118.68 125.06 2jmm s LEU 142 Ca 0.05 0.98 0.03 0.00 0.69 0.00 0.00 54.13 55.87 2jmm s LEU 142 Cb -0.09 -2.95 0.01 0.00 -0.43 0.00 0.00 46.19 42.73 2jmm s LEU 142 CO 0.03 -0.18 -0.22 -0.55 -0.29 0.00 0.00 176.35 175.14 2jmm s SER 143 N 0.96 3.06 -0.12 3.68 0.15 0.24 -0.17 113.70 121.51 2jmm s SER 143 Ca 0.32 -0.59 0.03 0.00 0.70 0.00 0.00 55.95 56.41 2jmm s SER 143 Cb -0.16 -1.42 0.01 0.00 -1.71 0.00 0.00 66.02 62.74 2jmm s SER 143 CO 0.13 0.08 -0.21 -0.22 1.20 0.00 0.00 173.24 174.22 2jmm s LEU 144 N 0.80 2.02 -0.02 3.45 2.96 0.03 -0.39 118.68 127.53 2jmm s LEU 144 Ca -0.08 -0.55 0.05 0.00 -0.22 0.00 0.00 54.13 53.33 2jmm s LEU 144 Cb -0.16 -1.35 -0.01 0.00 0.50 0.00 0.00 46.19 45.17 2jmm s LEU 144 CO -0.01 0.09 -0.16 -0.83 -1.32 0.00 0.00 176.35 174.12 2jmm s GLY 145 N 0.68 0.82 -0.09 7.98 0.00 0.12 0.18 107.32 117.01 2jmm s GLY 145 Ca -0.11 -0.67 0.02 0.00 0.00 0.00 0.00 44.72 43.96 2jmm s GLY 145 CO 0.02 -0.47 -0.16 -1.34 0.00 0.00 0.00 173.10 171.15 2jmm s VAL 146 N -0.20 1.47 0.09 1.40 -7.23 0.20 -0.34 120.40 115.78 2jmm s VAL 146 Ca 0.02 -0.65 0.03 0.00 -1.81 0.00 0.00 61.98 59.57 2jmm s VAL 146 Cb -0.08 -1.33 -0.04 0.00 0.56 0.00 0.00 36.38 35.50 2jmm s VAL 146 CO 0.00 0.43 -0.08 -0.94 -0.31 0.00 0.00 175.10 174.20 2jmm s SER 147 N 0.78 1.22 -0.05 4.85 1.04 -0.18 -0.71 113.70 120.64 2jmm s SER 147 Ca -0.11 -0.82 0.03 0.00 0.48 0.00 0.00 55.95 55.53 2jmm s SER 147 Cb -0.16 0.04 -0.03 0.00 0.10 0.00 0.00 66.02 65.98 2jmm s SER 147 CO 0.02 -0.32 -0.14 -0.31 0.98 0.00 0.00 173.24 173.47 2jmm s TYR 148 N -2.62 2.71 0.71 5.02 1.51 0.11 -0.10 117.35 124.68 2jmm s TYR 148 Ca 0.04 -0.19 -0.13 0.00 -1.01 0.00 0.00 57.07 55.79 2jmm s TYR 148 Cb -0.02 -1.64 0.02 0.00 -0.11 0.00 0.00 41.96 40.21 2jmm s TYR 148 CO -0.02 0.16 1.10 -0.98 -1.11 0.00 0.00 175.55 174.70 2jmm s ARG 149 N -0.66 2.59 0.44 -0.62 1.70 -1.01 0.02 118.95 121.40 2jmm s ARG 149 Ca 0.10 1.26 -0.23 0.00 -0.47 0.00 0.00 55.73 56.39 2jmm s ARG 149 Cb -0.11 -1.93 -0.10 0.00 -0.57 0.00 0.00 34.95 32.23 2jmm s ARG 149 CO 0.01 -1.39 0.92 0.34 -1.08 0.00 0.00 175.30 174.10 2jmm n PHE 150 N -2.91 0.84 -1.54 5.89 -0.00 0.08 -4.80 117.46 115.02 2jmm n PHE 150 Ca 0.10 0.55 -0.42 0.00 -0.00 0.00 0.00 57.45 57.68 2jmm n PHE 150 Cb 0.53 -2.18 -0.05 0.00 -0.00 0.00 0.00 39.48 37.78 2jmm n PHE 150 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2jmm n GLY 151 N 1.30 0.43 3.72 7.13 0.00 -1.26 -4.92 105.19 111.60 2jmm n GLY 151 Ca 0.10 0.79 -0.42 0.00 0.00 0.00 0.00 46.02 46.50 2jmm n GLY 151 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jmm s GLN 152 N 7.36 4.20 0.80 1.61 0.74 -1.26 -5.02 119.66 128.10 2jmm s GLN 152 Ca 1.05 2.41 -0.12 0.00 0.05 0.00 0.00 55.36 58.74 2jmm s GLN 152 Cb -0.46 -3.13 0.08 0.00 1.10 0.00 0.00 33.01 30.60 2jmm s GLN 152 CO 0.36 -0.62 1.15 0.20 -0.55 0.00 0.00 175.29 175.83 2jmm s GLY 153 N 1.06 1.94 0.23 2.59 0.00 -1.26 -4.97 107.32 106.92 2jmm s GLY 153 Ca 0.70 0.62 -0.31 0.00 0.00 0.00 0.00 44.72 45.72 2jmm s GLY 153 CO 0.33 1.01 1.44 -2.21 0.00 0.00 0.00 173.10 173.68 2jmm n GLU 154 N -3.44 2.10 -4.26 2.90 2.13 -1.26 -5.01 120.64 113.80 2jmm n GLU 154 Ca 0.12 0.75 -0.32 0.00 0.66 0.00 0.00 57.16 58.36 2jmm n GLU 154 Cb 0.52 -2.43 -0.09 0.00 0.27 0.00 0.00 31.44 29.71 2jmm n GLU 154 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2jmm s ALA 155 N 0.06 3.29 -1.40 4.31 0.00 -1.26 -5.27 121.76 121.47 2jmm s ALA 155 Ca 0.69 -0.97 0.11 0.00 0.00 0.00 0.00 51.96 51.79 2jmm s ALA 155 Cb -0.64 -1.32 0.09 0.00 0.00 0.00 0.00 23.12 21.25 2jmm s ALA 155 CO 0.48 0.66 0.86 0.00 0.00 0.00 0.00 175.76 177.75