#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmm n PRO 2 N 0.00 2.58 -1.95 0.03 -0.04 -1.26 -4.73 135.00 129.63 2jmm n PRO 2 Ca 0.00 -1.50 -0.01 0.00 -0.04 0.00 0.00 63.50 61.95 2jmm n PRO 2 Cb 0.00 -2.37 -0.00 0.00 -0.04 0.00 0.00 33.50 31.09 2jmm n PRO 2 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2jmm n LYS 3 N 3.26 -2.23 -4.21 0.54 0.00 -1.26 -4.91 118.16 109.35 2jmm n LYS 3 Ca 0.55 0.05 -0.17 0.00 -0.00 0.00 0.00 58.31 58.74 2jmm n LYS 3 Cb 0.45 -4.38 -0.15 0.00 -0.00 0.00 0.00 35.03 30.96 2jmm n LYS 3 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 2jmm s ASP 4 N -1.66 0.75 -1.54 -5.58 -4.77 -1.26 -2.01 116.67 100.60 2jmm s ASP 4 Ca 0.00 -0.11 -0.06 0.00 -3.30 0.00 0.00 52.55 49.07 2jmm s ASP 4 Cb 0.00 -0.12 0.05 0.00 -1.09 0.00 0.00 42.92 41.76 2jmm s ASP 4 CO 0.00 0.06 0.45 0.59 0.70 0.00 0.00 175.17 176.97 2jmm n ASN 5 N 3.07 -0.98 -4.54 2.11 3.02 0.33 -4.94 115.26 113.33 2jmm n ASN 5 Ca -0.15 -1.07 -0.41 0.00 -0.03 0.00 0.00 54.58 52.93 2jmm n ASN 5 Cb 0.57 -2.64 -0.10 0.00 -0.61 0.00 0.00 39.78 37.00 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 -3.82 5.21 -0.14 3.41 -4.23 -0.48 -4.86 115.64 110.73 2jmm s THR 6 Ca 0.25 -0.07 -0.16 0.00 -1.18 0.00 0.00 61.69 60.52 2jmm s THR 6 Cb -0.14 -3.79 -0.04 0.00 1.34 0.00 0.00 72.50 69.87 2jmm s THR 6 CO 0.93 -0.07 0.38 0.26 -0.54 0.00 0.00 174.62 175.57 2jmm s TRP 7 N 1.90 3.49 -0.18 3.99 0.52 -1.26 -0.37 118.94 127.03 2jmm s TRP 7 Ca 0.09 0.74 -0.04 0.00 0.02 0.00 0.00 56.10 56.91 2jmm s TRP 7 Cb -0.17 -2.43 0.08 0.00 -1.15 0.00 0.00 33.47 29.80 2jmm s TRP 7 CO 0.11 0.22 0.17 -0.47 0.02 0.00 0.00 176.95 177.01 2jmm s TYR 8 N 0.48 -0.12 0.47 -1.98 5.04 0.30 -0.98 117.35 120.56 2jmm s TYR 8 Ca 0.21 0.11 0.04 0.00 -2.44 0.00 0.00 57.07 54.99 2jmm s TYR 8 Cb -0.14 -0.45 -0.03 0.00 0.35 0.00 0.00 41.96 41.69 2jmm s TYR 8 CO 0.07 -0.53 0.08 0.95 -1.34 0.00 0.00 175.55 174.77 2jmm s THR 9 N 2.27 1.65 -5.00 4.34 -4.23 0.25 -0.40 115.64 114.51 2jmm s THR 9 Ca 0.05 -1.90 0.00 0.00 -1.18 0.00 0.00 61.69 58.66 2jmm s THR 9 Cb -0.15 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.14 2jmm s THR 9 CO -0.10 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.59 2jmm n GLY 10 N -1.22 0.02 2.92 3.99 0.00 1.00 0.26 105.19 112.14 2jmm n GLY 10 Ca -0.10 -1.36 -0.13 0.00 0.00 0.00 0.00 46.02 44.42 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 -0.21 0.04 4.61 0.00 -0.40 -0.55 121.76 124.25 2jmm s ALA 11 Ca 0.00 0.52 0.01 0.00 0.00 0.00 0.00 51.96 52.49 2jmm s ALA 11 Cb 0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 23.12 22.75 2jmm s ALA 11 CO 0.00 -0.12 -0.06 -1.59 0.00 0.00 0.00 175.76 173.99 2jmm s LYS 12 N 0.85 0.47 0.01 0.00 -2.85 -0.51 -0.90 119.74 116.82 2jmm s LYS 12 Ca -0.07 -0.74 0.05 0.00 -1.00 0.00 0.00 55.97 54.22 2jmm s LYS 12 Cb -0.09 -0.16 -0.03 0.00 -2.06 0.00 0.00 37.83 35.49 2jmm s LYS 12 CO -0.04 0.01 -0.14 -0.48 0.10 0.00 0.00 175.35 174.81 2jmm s LEU 13 N -1.61 2.79 -0.27 2.77 0.05 0.75 -0.37 118.68 122.78 2jmm s LEU 13 Ca -0.11 -0.29 -0.09 0.00 0.05 0.00 0.00 54.13 53.69 2jmm s LEU 13 Cb -0.09 -1.61 -0.03 0.00 -2.05 0.00 0.00 46.19 42.40 2jmm s LEU 13 CO -0.00 0.29 0.14 -0.83 -0.55 0.00 0.00 176.35 175.39 2jmm s GLY 14 N -1.26 1.85 -0.03 -3.48 0.00 0.49 -0.57 107.32 104.33 2jmm s GLY 14 Ca 0.15 -1.17 0.05 0.00 0.00 0.00 0.00 44.72 43.74 2jmm s GLY 14 CO 0.05 0.61 -0.16 0.86 0.00 0.00 0.00 173.10 174.47 2jmm s TRP 15 N 1.67 2.66 -0.37 1.90 -0.11 0.56 -3.04 118.94 122.21 2jmm s TRP 15 Ca 0.06 -0.19 0.03 0.00 1.22 0.00 0.00 56.10 57.22 2jmm s TRP 15 Cb -0.16 -1.59 0.11 0.00 -1.50 0.00 0.00 33.47 30.33 2jmm s TRP 15 CO 0.07 0.19 0.10 -1.12 -4.62 0.00 0.00 176.95 171.57 2jmm s SER 16 N -0.88 4.54 -0.22 5.86 0.01 -1.26 -1.21 113.70 120.54 2jmm s SER 16 Ca 0.12 -2.23 -0.04 0.00 1.31 0.00 0.00 55.95 55.11 2jmm s SER 16 Cb -0.11 -1.49 -0.07 0.00 0.21 0.00 0.00 66.02 64.56 2jmm s SER 16 CO 0.02 -0.36 3.04 0.00 0.41 0.00 0.00 173.24 176.35 2jmm n GLN 17 N 4.13 2.10 -0.66 12.44 1.13 -1.26 -3.65 117.38 131.61 2jmm n GLN 17 Ca 0.03 -1.56 -0.03 0.00 -1.94 0.00 0.00 57.00 53.50 2jmm n GLN 17 Cb 0.40 -1.97 -0.03 0.00 0.11 0.00 0.00 30.24 28.75 2jmm n GLN 17 CO 0.00 0.00 0.00 2.48 -1.44 0.00 0.00 177.06 178.10 2jmm n TYR 18 N 1.58 0.00 -3.66 1.08 4.11 -1.26 -5.07 117.16 113.94 2jmm n TYR 18 Ca 0.42 -0.21 -0.15 0.00 -0.00 0.00 0.00 57.90 57.96 2jmm n TYR 18 Cb 0.71 0.35 -0.08 0.00 -0.00 0.00 0.00 39.34 40.32 2jmm n TYR 18 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 2jmm s SER 19 N -0.43 -0.52 -1.00 9.48 0.15 -1.24 -5.10 113.70 115.04 2jmm s SER 19 Ca 0.00 0.83 -0.23 0.00 0.70 0.00 0.00 55.95 57.25 2jmm s SER 19 Cb 0.00 0.84 0.06 0.00 -1.71 0.00 0.00 66.02 65.20 2jmm s SER 19 CO 0.00 -0.34 1.41 -0.60 1.20 0.00 0.00 173.24 174.91 2jmm s ARG 20 N -0.36 3.58 -1.63 5.44 3.52 -1.26 -4.33 118.95 123.90 2jmm s ARG 20 Ca -0.05 -1.15 0.00 0.00 -0.13 0.00 0.00 55.73 54.40 2jmm s ARG 20 Cb -0.03 -5.28 0.00 0.00 -1.56 0.00 0.00 34.95 28.08 2jmm s ARG 20 CO 0.04 -2.17 0.00 0.39 -0.81 0.00 0.00 175.30 172.75 2jmm n GLU 21 N 8.69 -1.78 -4.88 5.12 1.02 -1.26 -4.96 120.64 122.59 2jmm n GLU 21 Ca 0.31 0.92 -0.33 0.00 -0.02 0.00 0.00 57.16 58.05 2jmm n GLU 21 Cb 0.51 -5.53 -0.14 0.00 -0.02 0.00 0.00 31.44 26.25 2jmm n GLU 21 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2jmm s ASN 22 N -2.11 3.90 -0.17 1.62 0.01 -1.26 -4.87 114.94 112.06 2jmm s ASN 22 Ca 0.00 -0.30 -0.03 0.00 -0.71 0.00 0.00 52.86 51.81 2jmm s ASN 22 Cb 0.00 -1.27 0.01 0.00 0.41 0.00 0.00 41.25 40.40 2jmm s ASN 22 CO 0.00 0.24 0.06 0.00 -1.51 0.00 0.00 177.10 175.89 2jmm n GLN 23 N 3.04 -2.82 -3.69 -0.60 1.13 -1.26 -4.86 117.38 108.32 2jmm n GLN 23 Ca -0.18 2.34 -0.12 0.00 -1.94 0.00 0.00 57.00 57.10 2jmm n GLN 23 Cb 0.52 -3.79 -0.09 0.00 0.11 0.00 0.00 30.24 27.00 2jmm n GLN 23 CO 0.00 0.00 0.00 -0.48 -1.44 0.00 0.00 177.06 175.14 2jmm s LEU 24 N -1.05 -0.07 0.00 1.08 0.05 -1.26 -4.39 118.68 113.04 2jmm s LEU 24 Ca -0.07 1.05 0.00 0.00 0.05 0.00 0.00 54.13 55.15 2jmm s LEU 24 Cb 0.00 1.74 0.00 0.00 -2.05 0.00 0.00 46.19 45.88 2jmm s LEU 24 CO 0.52 -0.19 0.00 0.61 -0.55 0.00 0.00 176.35 176.74 2jmm n GLY 25 N 3.21 -1.36 3.24 -3.48 0.00 -1.17 -5.03 105.19 100.60 2jmm n GLY 25 Ca -0.16 -1.18 -0.26 0.00 0.00 0.00 0.00 46.02 44.41 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 -1.00 1.74 0.06 4.61 0.00 -1.26 -0.38 121.76 125.53 2jmm s ALA 26 Ca 0.00 -0.98 0.09 0.00 0.00 0.00 0.00 51.96 51.07 2jmm s ALA 26 Cb 0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 23.12 22.70 2jmm s ALA 26 CO 0.00 0.41 -0.24 0.20 0.00 0.00 0.00 175.76 176.13 2jmm s GLY 27 N -0.86 1.31 -0.25 0.00 0.00 0.50 -4.89 107.32 103.14 2jmm s GLY 27 Ca 0.08 -1.22 -0.08 0.00 0.00 0.00 0.00 44.72 43.50 2jmm s GLY 27 CO 0.01 -1.15 0.09 0.00 0.00 0.00 0.00 173.10 172.05 2jmm s ALA 28 N -0.88 3.26 0.12 3.20 0.00 -0.59 -1.42 121.76 125.46 2jmm s ALA 28 Ca 0.10 -1.07 0.07 0.00 0.00 0.00 0.00 51.96 51.06 2jmm s ALA 28 Cb -0.10 -2.14 -0.04 0.00 0.00 0.00 0.00 23.12 20.85 2jmm s ALA 28 CO 0.03 -0.42 -0.17 -0.59 0.00 0.00 0.00 175.76 174.61 2jmm s PHE 29 N 1.49 1.59 -0.23 0.00 -0.71 0.29 0.03 117.98 120.43 2jmm s PHE 29 Ca 0.06 -0.48 -0.29 0.00 -1.04 0.00 0.00 56.93 55.18 2jmm s PHE 29 Cb -0.15 -0.84 0.16 0.00 -1.21 0.00 0.00 43.02 40.98 2jmm s PHE 29 CO 0.05 0.20 1.20 0.20 -1.34 0.00 0.00 175.22 175.53 2jmm s GLY 30 N -2.26 -0.05 0.00 1.99 0.00 0.26 -0.00 107.32 107.25 2jmm s GLY 30 Ca 0.08 2.53 0.00 0.00 0.00 0.00 0.00 44.72 47.34 2jmm s GLY 30 CO 0.04 1.14 0.00 0.61 0.00 0.00 0.00 173.10 174.89 2jmm n GLY 31 N 0.71 -0.87 3.48 0.20 0.00 0.46 -0.21 105.19 108.96 2jmm n GLY 31 Ca -0.05 -0.19 -0.17 0.00 0.00 0.00 0.00 46.02 45.61 2jmm n GLY 31 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2jmm s TYR 32 N -4.00 -0.59 -0.49 1.61 1.13 0.21 -0.54 117.35 114.68 2jmm s TYR 32 Ca 0.00 1.03 -0.01 0.00 -1.41 0.00 0.00 57.07 56.68 2jmm s TYR 32 Cb 0.00 0.36 0.13 0.00 -1.10 0.00 0.00 41.96 41.35 2jmm s TYR 32 CO 0.00 -0.57 0.28 -1.14 -2.51 0.00 0.00 175.55 171.61 2jmm s GLN 33 N -1.14 2.14 0.13 -3.49 0.74 0.50 -0.63 119.66 117.90 2jmm s GLN 33 Ca -0.11 -2.20 -0.19 0.00 0.05 0.00 0.00 55.36 52.92 2jmm s GLN 33 Cb -0.01 -3.56 -0.03 0.00 1.10 0.00 0.00 33.01 30.52 2jmm s GLN 33 CO 0.09 -1.10 1.76 0.28 -0.55 0.00 0.00 175.29 175.77 2jmm h VAL 34 N 5.88 0.97 -3.17 1.34 2.07 -1.85 0.10 116.25 121.59 2jmm h VAL 34 Ca -0.07 -0.08 -0.60 0.00 0.82 0.00 0.00 66.70 66.77 2jmm h VAL 34 Cb 0.99 0.72 -0.18 0.00 -1.52 0.00 0.00 31.29 31.30 2jmm h VAL 34 CO 0.68 0.04 -0.80 0.20 0.02 0.00 0.00 177.57 177.71 2jmm s ASN 35 N -5.34 3.15 -0.26 0.57 -0.87 -1.26 -0.51 114.94 110.41 2jmm s ASN 35 Ca -0.13 -0.87 -0.03 0.00 -1.57 0.00 0.00 52.86 50.25 2jmm s ASN 35 Cb 0.10 -0.22 -0.10 0.00 -0.02 0.00 0.00 41.25 41.01 2jmm s ASN 35 CO 0.70 0.06 1.97 -0.81 -2.57 0.00 0.00 177.10 176.44 2jmm n PRO 36 N 0.23 1.22 0.00 -0.60 -0.04 -0.85 -3.74 135.00 131.22 2jmm n PRO 36 Ca -0.12 -0.75 0.00 0.00 -0.04 0.00 0.00 63.50 62.58 2jmm n PRO 36 Cb 0.57 -1.95 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 2jmm n PRO 36 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 2jmm n TYR 37 N 3.29 0.00 -4.51 0.54 4.19 -1.26 -5.12 117.16 114.29 2jmm n TYR 37 Ca 0.26 0.00 -0.21 0.00 3.31 0.00 0.00 57.90 61.26 2jmm n TYR 37 Cb 0.33 0.00 -0.14 0.00 0.49 0.00 0.00 39.34 40.01 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 1.14 0.32 2.97 1.01 -1.25 -4.71 120.40 119.88 2jmm s VAL 38 Ca 0.00 -0.81 0.06 0.00 0.00 0.00 0.00 61.98 61.23 2jmm s VAL 38 Cb 0.00 -0.99 -0.06 0.00 0.00 0.00 0.00 36.38 35.33 2jmm s VAL 38 CO 0.00 0.17 -0.02 -0.83 0.00 0.00 0.00 175.10 174.41 2jmm s GLY 39 N -0.74 2.04 -0.03 4.51 0.00 0.48 -4.14 107.32 109.44 2jmm s GLY 39 Ca 0.04 -2.03 0.08 0.00 0.00 0.00 0.00 44.72 42.80 2jmm s GLY 39 CO 0.00 -1.90 -0.26 -1.36 0.00 0.00 0.00 173.10 169.58 2jmm s PHE 40 N -2.98 2.35 -0.02 1.90 0.08 0.19 0.13 117.98 119.64 2jmm s PHE 40 Ca 0.32 -0.48 0.02 0.00 0.12 0.00 0.00 56.93 56.92 2jmm s PHE 40 Cb 0.06 -1.51 0.00 0.00 -0.57 0.00 0.00 43.02 41.00 2jmm s PHE 40 CO 0.14 -0.06 -0.06 -1.21 -0.10 0.00 0.00 175.22 173.93 2jmm s GLU 41 N -0.55 0.66 -0.05 0.44 2.02 0.30 -0.62 118.70 120.89 2jmm s GLU 41 Ca 0.08 -0.22 -0.04 0.00 0.02 0.00 0.00 54.97 54.82 2jmm s GLU 41 Cb -0.10 -0.64 -0.04 0.00 0.10 0.00 0.00 34.13 33.44 2jmm s GLU 41 CO -0.00 0.09 0.14 0.00 0.02 0.00 0.00 175.26 175.51 2jmm s MET 42 N 0.13 3.35 -0.10 1.61 0.23 0.71 -1.18 119.30 124.04 2jmm s MET 42 Ca -0.01 -0.28 0.04 0.00 -1.03 0.00 0.00 55.69 54.40 2jmm s MET 42 Cb -0.06 -3.07 0.00 0.00 -1.53 0.00 0.00 34.83 30.17 2jmm s MET 42 CO -0.00 0.71 -0.22 0.20 -2.03 0.00 0.00 175.02 173.68 2jmm s GLY 43 N -1.50 1.27 -0.07 3.16 0.00 0.62 -0.58 107.32 110.22 2jmm s GLY 43 Ca 0.21 -0.92 0.05 0.00 0.00 0.00 0.00 44.72 44.06 2jmm s GLY 43 CO 0.11 -0.23 -0.23 -0.47 0.00 0.00 0.00 173.10 172.28 2jmm s TYR 44 N 0.44 2.52 -0.05 1.90 5.04 0.10 -0.51 117.35 126.79 2jmm s TYR 44 Ca -0.17 -0.75 0.04 0.00 -2.44 0.00 0.00 57.07 53.76 2jmm s TYR 44 Cb -0.17 -1.65 -0.00 0.00 0.35 0.00 0.00 41.96 40.49 2jmm s TYR 44 CO 0.07 -0.23 -0.18 0.34 -1.34 0.00 0.00 175.55 174.21 2jmm s ASP 45 N -0.04 2.30 -0.16 4.32 2.15 0.33 -1.53 116.67 124.04 2jmm s ASP 45 Ca -0.07 -0.38 -0.07 0.00 0.43 0.00 0.00 52.55 52.46 2jmm s ASP 45 Cb -0.15 -0.76 -0.04 0.00 -0.30 0.00 0.00 42.92 41.68 2jmm s ASP 45 CO 0.05 0.14 0.08 -1.66 -0.17 0.00 0.00 175.17 173.61 2jmm s TRP 46 N 0.15 3.34 -0.16 -5.34 1.48 -1.26 -0.91 118.94 116.24 2jmm s TRP 46 Ca -0.07 0.23 0.06 0.00 -1.06 0.00 0.00 56.10 55.25 2jmm s TRP 46 Cb -0.13 -2.02 -0.14 0.00 -1.16 0.00 0.00 33.47 30.02 2jmm s TRP 46 CO 0.03 0.35 -0.07 -0.11 -4.06 0.00 0.00 176.95 173.09 2jmm n LEU 47 N 3.00 1.74 0.00 -4.66 7.94 -1.26 -4.95 117.00 118.81 2jmm n LEU 47 Ca -0.17 -0.06 0.00 0.00 -1.11 0.00 0.00 56.01 54.67 2jmm n LEU 47 Cb 0.53 -0.22 0.00 0.00 0.53 0.00 0.00 43.42 44.26 2jmm n LEU 47 CO 0.34 0.61 0.00 0.61 -1.11 0.00 0.00 177.39 177.84 2jmm n GLY 48 N 2.44 1.97 3.71 -3.96 0.00 -1.26 -5.13 105.19 102.96 2jmm n GLY 48 Ca -0.28 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.50 2jmm n GLY 48 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jmm s ARG 49 N -0.68 2.28 0.46 1.61 3.00 -1.26 -5.10 118.95 119.26 2jmm s ARG 49 Ca 0.00 -1.63 -0.21 0.00 0.00 0.00 0.00 55.73 53.89 2jmm s ARG 49 Cb 0.00 -2.09 -0.12 0.00 0.00 0.00 0.00 34.95 32.74 2jmm s ARG 49 CO 0.00 0.10 0.51 -1.33 0.00 0.00 0.00 175.30 174.58 2jmm n MET 50 N -1.11 0.54 -1.22 3.54 2.81 -1.26 -4.76 117.12 115.67 2jmm n MET 50 Ca -0.03 0.20 -0.33 0.00 -1.81 0.00 0.00 57.70 55.74 2jmm n MET 50 Cb 0.62 -1.54 0.11 0.00 -0.71 0.00 0.00 33.22 31.70 2jmm n MET 50 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 2jmm s PRO 51 N -1.68 1.90 -0.19 0.03 0.04 -1.26 -4.46 135.00 129.38 2jmm s PRO 51 Ca 0.64 1.55 -0.03 0.00 0.04 0.00 0.00 61.00 63.20 2jmm s PRO 51 Cb -0.55 -1.83 0.01 0.00 0.04 0.00 0.00 34.50 32.17 2jmm s PRO 51 CO 0.58 -1.97 0.07 -2.13 0.04 0.00 0.00 177.00 173.58 2jmm n ARG 52 N -3.28 -2.77 -2.73 4.56 0.63 -1.26 -4.90 116.66 106.90 2jmm n ARG 52 Ca 0.12 2.30 -0.02 0.00 -0.92 0.00 0.00 57.85 59.33 2jmm n ARG 52 Cb 0.51 -4.02 -0.02 0.00 0.45 0.00 0.00 32.46 29.38 2jmm n ARG 52 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2jmm n LYS 53 N 0.76 -3.59 0.04 -0.14 4.76 -1.26 -5.01 118.16 113.71 2jmm n LYS 53 Ca -0.11 2.83 0.00 0.00 -2.87 0.00 0.00 58.31 58.16 2jmm n LYS 53 Cb 0.17 -4.67 0.00 0.00 -1.84 0.00 0.00 35.03 28.70 2jmm n LYS 53 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2jmm n ALA 54 N 1.27 0.00 -1.56 7.82 0.00 -1.26 -4.80 120.51 121.98 2jmm n ALA 54 Ca -0.17 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.87 2jmm n ALA 54 Cb 0.30 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.78 2jmm n ALA 54 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2jmm n GLN 55 N -2.43 0.92 -2.72 0.00 3.00 -1.26 -2.57 117.38 112.32 2jmm n GLN 55 Ca 0.00 0.34 -0.41 0.00 -0.01 0.00 0.00 57.00 56.92 2jmm n GLN 55 Cb 0.00 -1.92 -0.05 0.00 0.00 0.00 0.00 30.24 28.27 2jmm n GLN 55 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 2jmm s GLY 56 N -1.01 3.02 -0.02 1.08 0.00 -0.09 -4.60 107.32 105.71 2jmm s GLY 56 Ca 0.68 0.60 0.02 0.00 0.00 0.00 0.00 44.72 46.03 2jmm s GLY 56 CO 0.54 1.42 -0.08 0.54 0.00 0.00 0.00 173.10 175.51 2jmm s VAL 57 N -0.27 0.69 -0.01 1.40 0.11 0.07 -0.51 120.40 121.87 2jmm s VAL 57 Ca 0.46 -0.33 0.05 0.00 -2.93 0.00 0.00 61.98 59.23 2jmm s VAL 57 Cb -0.24 -0.61 -0.01 0.00 -1.53 0.00 0.00 36.38 33.98 2jmm s VAL 57 CO 0.31 0.21 -0.17 0.00 -3.33 0.00 0.00 175.10 172.12 2jmm s GLN 58 N 0.07 1.40 -0.25 1.54 0.00 0.33 -0.82 119.66 121.93 2jmm s GLN 58 Ca -0.01 -0.61 0.02 0.00 -0.00 0.00 0.00 55.36 54.77 2jmm s GLN 58 Cb -0.06 -1.35 0.05 0.00 0.00 0.00 0.00 33.01 31.65 2jmm s GLN 58 CO 0.00 0.36 -0.11 -0.48 0.00 0.00 0.00 175.29 175.06 2jmm s LEU 59 N -0.38 3.34 -0.01 2.60 2.34 0.30 -0.28 118.68 126.59 2jmm s LEU 59 Ca 0.06 -1.30 0.06 0.00 0.06 0.00 0.00 54.13 53.02 2jmm s LEU 59 Cb -0.07 -1.56 -0.02 0.00 -0.56 0.00 0.00 46.19 43.99 2jmm s LEU 59 CO -0.01 -0.17 -0.20 -0.89 -1.06 0.00 0.00 176.35 174.02 2jmm s THR 60 N 1.14 1.60 -0.13 5.48 2.01 -0.32 -0.66 115.64 124.76 2jmm s THR 60 Ca -0.07 -0.92 -0.07 0.00 0.31 0.00 0.00 61.69 60.95 2jmm s THR 60 Cb -0.19 -1.34 -0.04 0.00 0.01 0.00 0.00 72.50 70.94 2jmm s THR 60 CO -0.06 0.41 0.12 0.00 -0.69 0.00 0.00 174.62 174.40 2jmm s ALA 61 N -0.53 3.76 -0.02 7.40 0.00 -0.50 -0.54 121.76 131.33 2jmm s ALA 61 Ca 0.08 -0.67 0.06 0.00 0.00 0.00 0.00 51.96 51.42 2jmm s ALA 61 Cb -0.08 -1.93 -0.01 0.00 0.00 0.00 0.00 23.12 21.10 2jmm s ALA 61 CO -0.00 0.55 -0.19 -1.59 0.00 0.00 0.00 175.76 174.52 2jmm s LYS 62 N -0.80 1.64 -0.13 0.00 0.00 0.12 -2.56 119.74 118.01 2jmm s LYS 62 Ca 0.14 -0.69 0.00 0.00 0.00 0.00 0.00 55.97 55.41 2jmm s LYS 62 Cb -0.12 -1.55 0.02 0.00 0.00 0.00 0.00 37.83 36.18 2jmm s LYS 62 CO 0.03 0.40 -0.11 -0.48 0.00 0.00 0.00 175.35 175.19 2jmm s LEU 63 N -0.38 1.44 -0.05 2.77 0.05 -1.03 -0.39 118.68 121.08 2jmm s LEU 63 Ca 0.06 -0.39 0.05 0.00 0.05 0.00 0.00 54.13 53.91 2jmm s LEU 63 Cb -0.08 -1.00 -0.01 0.00 -2.05 0.00 0.00 46.19 43.05 2jmm s LEU 63 CO -0.00 -0.08 -0.22 -0.83 -0.55 0.00 0.00 176.35 174.66 2jmm s GLY 64 N 1.53 1.18 0.02 -3.48 0.00 -1.26 -1.81 107.32 103.50 2jmm s GLY 64 Ca 0.04 -0.93 0.01 0.00 0.00 0.00 0.00 44.72 43.84 2jmm s GLY 64 CO -0.08 -0.54 -0.05 -0.19 0.00 0.00 0.00 173.10 172.23 2jmm s TYR 65 N -0.08 0.46 -0.91 1.90 2.02 -0.24 -4.95 117.35 115.55 2jmm s TYR 65 Ca -0.04 -0.31 -0.24 0.00 -0.37 0.00 0.00 57.07 56.11 2jmm s TYR 65 Cb -0.13 -0.29 -0.01 0.00 -0.40 0.00 0.00 41.96 41.13 2jmm s TYR 65 CO 0.03 -0.06 1.76 -1.25 -1.57 0.00 0.00 175.55 174.46 2jmm s PRO 66 N -0.88 2.91 0.02 -1.71 0.04 -1.26 -1.35 135.00 132.77 2jmm s PRO 66 Ca -0.06 -0.48 -0.07 0.00 0.04 0.00 0.00 61.00 60.44 2jmm s PRO 66 Cb -0.06 -5.06 -0.00 0.00 0.04 0.00 0.00 34.50 29.41 2jmm s PRO 66 CO -0.00 -2.91 0.13 0.21 0.04 0.00 0.00 177.00 174.47 2jmm s LYS 67 N 6.32 0.54 -0.31 4.56 2.36 -1.26 -4.99 119.74 126.96 2jmm s LYS 67 Ca 0.61 -0.55 -0.07 0.00 -2.55 0.00 0.00 55.97 53.41 2jmm s LYS 67 Cb -0.05 0.22 0.01 0.00 -1.05 0.00 0.00 37.83 36.96 2jmm s LYS 67 CO -0.01 -0.14 0.25 -0.11 1.55 0.00 0.00 175.35 176.89 2jmm n LEU 68 N 1.13 -7.13 0.00 5.43 -0.00 -1.26 -4.29 117.00 110.88 2jmm n LEU 68 Ca -0.21 0.86 0.00 0.00 -0.00 0.00 0.00 56.01 56.66 2jmm n LEU 68 Cb 0.57 -3.04 0.00 0.00 -0.00 0.00 0.00 43.42 40.95 2jmm n LEU 68 CO 0.22 -2.41 0.00 0.61 -0.00 0.00 0.00 177.39 175.81 2jmm n GLY 69 N 0.16 0.56 0.00 -3.96 0.00 -1.26 -4.77 105.19 95.91 2jmm n GLY 69 Ca 0.05 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.33 2jmm n GLY 69 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2jmm n THR 70 N 0.00 0.00 -3.94 2.61 5.66 -1.26 -5.09 114.28 112.27 2jmm n THR 70 Ca 0.00 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.69 2jmm n THR 70 Cb 0.00 -0.03 -0.15 0.00 -1.55 0.00 0.00 70.33 68.60 2jmm n THR 70 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2jmm s ASP 71 N 1.00 4.11 0.00 1.09 1.01 -1.26 -4.72 116.67 117.89 2jmm s ASP 71 Ca 0.00 -1.46 0.00 0.00 0.71 0.00 0.00 52.55 51.80 2jmm s ASP 71 Cb 0.00 -1.25 0.00 0.00 1.01 0.00 0.00 42.92 42.68 2jmm s ASP 71 CO 0.00 -0.29 0.00 -0.67 0.21 0.00 0.00 175.17 174.42 2jmm n ASP 72 N 4.59 0.00 -4.09 0.27 2.03 -1.26 -4.99 116.55 113.10 2jmm n ASP 72 Ca -0.08 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.10 2jmm n ASP 72 Cb 0.43 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.72 2jmm n ASP 72 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 2jmm s LEU 73 N 0.00 2.30 -0.01 -2.67 2.34 -1.26 -1.34 118.68 118.04 2jmm s LEU 73 Ca 0.00 -0.64 0.03 0.00 0.06 0.00 0.00 54.13 53.58 2jmm s LEU 73 Cb 0.00 -0.19 -0.00 0.00 -0.56 0.00 0.00 46.19 45.44 2jmm s LEU 73 CO 0.00 -0.23 -0.09 -1.81 -1.06 0.00 0.00 176.35 173.15 2jmm s ASP 74 N -1.86 1.14 0.03 1.48 1.11 0.37 -4.51 116.67 114.43 2jmm s ASP 74 Ca -0.05 -0.18 -0.22 0.00 0.18 0.00 0.00 52.55 52.29 2jmm s ASP 74 Cb -0.07 -0.18 -0.06 0.00 1.07 0.00 0.00 42.92 43.68 2jmm s ASP 74 CO -0.00 0.10 0.64 -0.51 1.18 0.00 0.00 175.17 176.58 2jmm s ILE 75 N -0.10 4.81 -0.09 0.77 1.10 -0.46 -0.87 121.20 126.37 2jmm s ILE 75 Ca 0.02 1.35 0.03 0.00 -0.51 0.00 0.00 60.65 61.54 2jmm s ILE 75 Cb -0.05 -3.98 0.01 0.00 0.15 0.00 0.00 42.46 38.59 2jmm s ILE 75 CO -0.00 0.43 -0.18 -0.31 -2.11 0.00 0.00 174.94 172.77 2jmm s TYR 76 N -0.34 2.08 -0.05 3.50 2.02 0.60 -1.08 117.35 124.08 2jmm s TYR 76 Ca 0.33 -0.87 -0.01 0.00 -0.37 0.00 0.00 57.07 56.15 2jmm s TYR 76 Cb -0.19 -1.44 0.03 0.00 -0.40 0.00 0.00 41.96 39.95 2jmm s TYR 76 CO 0.19 -0.39 0.02 0.95 -1.57 0.00 0.00 175.55 174.75 2jmm s THR 77 N 0.60 0.20 0.21 -0.71 -4.23 -0.75 -0.26 115.64 110.70 2jmm s THR 77 Ca -0.15 0.19 -0.21 0.00 -1.18 0.00 0.00 61.69 60.35 2jmm s THR 77 Cb -0.17 -0.37 0.04 0.00 1.34 0.00 0.00 72.50 73.34 2jmm s THR 77 CO 0.05 0.21 0.62 -0.13 -0.54 0.00 0.00 174.62 174.83 2jmm s ARG 78 N 1.79 1.48 0.15 3.99 1.81 0.06 -2.47 118.95 125.76 2jmm s ARG 78 Ca 0.01 -0.75 0.07 0.00 -1.72 0.00 0.00 55.73 53.34 2jmm s ARG 78 Cb -0.13 0.58 -0.04 0.00 -0.45 0.00 0.00 34.95 34.91 2jmm s ARG 78 CO -0.04 -0.66 -0.15 -0.48 -0.68 0.00 0.00 175.30 173.30 2jmm s LEU 79 N -2.84 2.45 0.00 2.53 -0.00 -1.06 -0.10 118.68 119.65 2jmm s LEU 79 Ca 0.06 -0.87 -0.13 0.00 -0.00 0.00 0.00 54.13 53.20 2jmm s LEU 79 Cb -0.03 -0.63 0.05 0.00 -0.00 0.00 0.00 46.19 45.58 2jmm s LEU 79 CO -0.04 -0.13 0.62 0.61 -0.00 0.00 0.00 176.35 177.41 2jmm n GLY 80 N 0.27 1.03 3.17 -3.48 0.00 -0.40 -1.42 105.19 104.37 2jmm n GLY 80 Ca -0.13 -1.11 -0.22 0.00 0.00 0.00 0.00 46.02 44.55 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 -2.70 0.88 -0.01 -0.02 0.00 0.17 0.10 107.32 105.74 2jmm s GLY 81 Ca 0.13 -0.86 0.07 0.00 0.00 0.00 0.00 44.72 44.06 2jmm s GLY 81 CO 0.05 -0.80 -0.21 -3.16 0.00 0.00 0.00 173.10 168.98 2jmm s MET 82 N -0.97 1.68 0.01 2.90 0.23 -0.02 -0.54 119.30 122.58 2jmm s MET 82 Ca 0.04 -0.79 0.01 0.00 -1.03 0.00 0.00 55.69 53.92 2jmm s MET 82 Cb -0.08 -1.64 -0.01 0.00 -1.53 0.00 0.00 34.83 31.57 2jmm s MET 82 CO 0.01 0.45 -0.03 0.54 -2.03 0.00 0.00 175.02 173.96 2jmm s VAL 83 N -0.54 0.17 0.13 5.16 0.11 0.00 -1.80 120.40 123.63 2jmm s VAL 83 Ca 0.08 -0.45 0.10 0.00 -2.93 0.00 0.00 61.98 58.78 2jmm s VAL 83 Cb -0.08 -0.21 -0.04 0.00 -1.53 0.00 0.00 36.38 34.52 2jmm s VAL 83 CO -0.00 -0.18 -0.23 0.26 -3.33 0.00 0.00 175.10 171.62 2jmm s TRP 84 N -0.63 2.03 0.24 1.54 0.51 -1.26 -0.75 118.94 120.61 2jmm s TRP 84 Ca -0.06 -0.40 0.10 0.00 -2.12 0.00 0.00 56.10 53.61 2jmm s TRP 84 Cb -0.05 -1.08 -0.05 0.00 -0.81 0.00 0.00 33.47 31.49 2jmm s TRP 84 CO -0.00 0.31 -0.16 0.50 -0.51 0.00 0.00 176.95 177.08 2jmm s ARG 85 N -2.18 1.50 4.86 4.98 6.06 -1.06 -4.73 118.95 128.38 2jmm s ARG 85 Ca 0.12 -1.68 0.00 0.00 -2.50 0.00 0.00 55.73 51.67 2jmm s ARG 85 Cb -0.09 -1.41 0.00 0.00 0.06 0.00 0.00 34.95 33.51 2jmm s ARG 85 CO 0.06 0.24 0.00 0.00 -2.50 0.00 0.00 175.30 173.10 2jmm n ALA 86 N -0.50 0.00 -3.82 6.12 0.00 -1.26 -4.62 120.51 116.43 2jmm n ALA 86 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.01 2jmm n ALA 86 Cb 0.60 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.09 2jmm n ALA 86 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2jmm n ASP 87 N -0.68 -4.73 0.00 0.00 2.03 -1.26 -4.95 116.55 106.96 2jmm n ASP 87 Ca 0.00 -1.11 0.00 0.00 0.52 0.00 0.00 54.79 54.20 2jmm n ASP 87 Cb 0.00 -2.81 0.00 0.00 -0.72 0.00 0.00 41.12 37.59 2jmm n ASP 87 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2jmm n THR 88 N -4.48 0.00 -1.49 5.18 -2.24 -1.26 -5.14 114.28 104.85 2jmm n THR 88 Ca -0.11 0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 2jmm n THR 88 Cb 0.59 -1.21 0.00 0.00 -2.10 0.00 0.00 70.33 67.60 2jmm n THR 88 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2jmm n SER 89 N -2.02 -6.09 -3.63 3.42 2.88 -1.26 -5.05 113.62 101.86 2jmm n SER 89 Ca 0.00 0.86 -0.09 0.00 -1.33 0.00 0.00 58.87 58.31 2jmm n SER 89 Cb 0.00 -3.36 -0.07 0.00 -0.75 0.00 0.00 64.21 60.03 2jmm n SER 89 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2jmm s ASP 90 N -0.31 -0.43 0.68 -3.46 2.15 -1.26 -5.06 116.67 108.98 2jmm s ASP 90 Ca 0.00 0.81 -0.14 0.00 0.43 0.00 0.00 52.55 53.65 2jmm s ASP 90 Cb 0.00 0.82 0.01 0.00 -0.30 0.00 0.00 42.92 43.44 2jmm s ASP 90 CO 0.00 -0.16 1.10 -0.54 -0.17 0.00 0.00 175.17 175.41 2jmm s LYS 91 N 0.13 2.73 0.12 4.34 1.02 -1.26 -5.06 119.74 121.75 2jmm s LYS 91 Ca 0.03 1.34 0.09 0.00 0.02 0.00 0.00 55.97 57.45 2jmm s LYS 91 Cb -0.05 -1.94 -0.04 0.00 -0.52 0.00 0.00 37.83 35.28 2jmm s LYS 91 CO -0.06 -1.30 -0.16 -0.51 -0.92 0.00 0.00 175.35 172.40 2jmm s ASP 92 N -2.74 4.00 0.00 2.83 1.01 -1.26 -4.94 116.67 115.57 2jmm s ASP 92 Ca 0.66 -0.53 0.00 0.00 0.71 0.00 0.00 52.55 53.39 2jmm s ASP 92 Cb -0.20 -0.61 0.00 0.00 1.01 0.00 0.00 42.92 43.13 2jmm s ASP 92 CO 0.44 0.17 0.00 0.61 0.21 0.00 0.00 175.17 176.60 2jmm n GLY 93 N 0.72 -1.02 0.34 0.21 0.00 -1.26 -4.97 105.19 99.21 2jmm n GLY 93 Ca -0.15 0.70 0.14 0.00 0.00 0.00 0.00 46.02 46.72 2jmm n GLY 93 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2jmm h ASN 94 N 0.00 0.12 0.00 1.61 4.21 -2.07 -3.48 115.58 115.98 2jmm h ASN 94 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2jmm h ASN 94 Cb 0.00 -0.02 0.00 0.00 -1.12 0.00 0.00 38.32 37.18 2jmm h ASN 94 CO 0.00 0.08 0.00 0.61 -1.29 0.00 0.00 177.43 176.83 2jmm n GLY 95 N -1.58 1.39 3.56 2.83 0.00 -1.26 -5.00 105.19 105.14 2jmm n GLY 95 Ca 0.06 -0.81 -0.30 0.00 0.00 0.00 0.00 46.02 44.98 2jmm n GLY 95 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2jmm s TYR 96 N 0.00 1.78 0.00 1.61 6.14 -1.26 -4.75 117.35 120.87 2jmm s TYR 96 Ca 0.00 0.65 0.00 0.00 0.64 0.00 0.00 57.07 58.36 2jmm s TYR 96 Cb 0.00 -4.07 0.00 0.00 0.42 0.00 0.00 41.96 38.31 2jmm s TYR 96 CO 0.00 -1.90 0.00 1.51 0.64 0.00 0.00 175.55 175.80 2jmm n ILE 97 N 7.68 0.00 0.32 3.14 0.00 -1.26 -4.96 119.36 124.28 2jmm n ILE 97 Ca 0.35 0.00 0.21 0.00 0.00 0.00 0.00 62.75 63.30 2jmm n ILE 97 Cb 0.48 -0.14 1.03 0.00 0.00 0.00 0.00 39.64 41.01 2jmm n ILE 97 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 2jmm h SER 98 N 0.00 0.00 0.00 9.51 0.02 -1.94 -3.47 113.55 117.67 2jmm h SER 98 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2jmm h SER 98 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2jmm h SER 98 CO 0.00 0.01 0.00 0.00 -1.14 0.00 0.00 176.83 175.70 2jmm n ALA 99 N -2.10 0.00 -0.03 3.77 0.00 -1.26 -4.83 120.51 116.06 2jmm n ALA 99 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.54 2jmm n ALA 99 Cb 0.15 0.00 0.53 0.00 0.00 0.00 0.00 19.45 20.13 2jmm n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jmm h ALA 100 N 0.00 2.04 -3.41 0.00 0.00 -1.97 -3.48 119.26 112.44 2jmm h ALA 100 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2jmm h ALA 100 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2jmm h ALA 100 CO 0.00 -0.15 -0.87 0.39 0.00 0.00 0.00 179.25 178.62 2jmm n GLU 101 N -4.47 -3.91 -2.57 0.00 1.02 -1.26 -4.78 120.64 104.67 2jmm n GLU 101 Ca 0.08 2.99 -0.41 0.00 -0.02 0.00 0.00 57.16 59.80 2jmm n GLU 101 Cb 0.34 -3.61 -0.03 0.00 -0.02 0.00 0.00 31.44 28.12 2jmm n GLU 101 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jmm s ALA 102 N -4.65 2.73 0.37 0.62 0.00 -1.26 -4.99 121.76 114.58 2jmm s ALA 102 Ca 0.00 -2.25 -0.26 0.00 0.00 0.00 0.00 51.96 49.46 2jmm s ALA 102 Cb 0.00 -4.50 -0.09 0.00 0.00 0.00 0.00 23.12 18.53 2jmm s ALA 102 CO 0.00 -3.59 1.10 0.45 0.00 0.00 0.00 175.76 173.72 2jmm s SER 103 N 4.89 6.79 -0.19 0.00 0.15 -1.26 -4.98 113.70 119.10 2jmm s SER 103 Ca 0.45 2.19 -0.01 0.00 0.70 0.00 0.00 55.95 59.29 2jmm s SER 103 Cb -0.00 -2.60 0.01 0.00 -1.71 0.00 0.00 66.02 61.71 2jmm s SER 103 CO -0.09 -0.47 -0.14 -0.69 1.20 0.00 0.00 173.24 173.04 2jmm s VAL 104 N -1.46 2.55 0.01 4.45 1.01 -1.26 -4.36 120.40 121.34 2jmm s VAL 104 Ca 0.54 -0.78 0.08 0.00 0.00 0.00 0.00 61.98 61.82 2jmm s VAL 104 Cb -0.27 -2.11 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 2jmm s VAL 104 CO 0.34 0.50 -0.23 -0.44 0.00 0.00 0.00 175.10 175.27 2jmm s SER 105 N 1.29 2.78 0.40 3.32 0.01 -0.75 -4.96 113.70 115.79 2jmm s SER 105 Ca 0.04 -0.48 -0.22 0.00 1.31 0.00 0.00 55.95 56.60 2jmm s SER 105 Cb -0.14 -0.28 -0.11 0.00 0.21 0.00 0.00 66.02 65.71 2jmm s SER 105 CO -0.08 0.25 0.94 -2.16 0.41 0.00 0.00 173.24 172.60 2jmm s PRO 106 N -0.84 4.30 -0.04 12.44 0.04 -1.26 -0.84 135.00 148.80 2jmm s PRO 106 Ca 0.09 1.16 0.04 0.00 0.04 0.00 0.00 61.00 62.33 2jmm s PRO 106 Cb -0.09 -2.33 -0.00 0.00 0.04 0.00 0.00 34.50 32.12 2jmm s PRO 106 CO 0.00 0.05 -0.15 0.54 0.04 0.00 0.00 177.00 177.48 2jmm s VAL 107 N -2.04 1.28 -0.22 -0.36 0.11 0.11 -4.61 120.40 114.68 2jmm s VAL 107 Ca 0.59 -0.63 -0.06 0.00 -2.93 0.00 0.00 61.98 58.95 2jmm s VAL 107 Cb -0.11 -1.11 -0.03 0.00 -1.53 0.00 0.00 36.38 33.60 2jmm s VAL 107 CO 0.16 0.38 0.03 0.12 -3.33 0.00 0.00 175.10 172.45 2jmm s PHE 108 N 0.11 3.08 -0.20 1.54 2.19 0.14 -1.27 117.98 123.57 2jmm s PHE 108 Ca -0.04 -0.39 -0.00 0.00 0.33 0.00 0.00 56.93 56.82 2jmm s PHE 108 Cb -0.11 -2.14 0.05 0.00 -1.31 0.00 0.00 43.02 39.51 2jmm s PHE 108 CO 0.02 -0.25 -0.05 0.00 1.83 0.00 0.00 175.22 176.77 2jmm s ALA 109 N 1.18 1.70 -0.03 11.12 0.00 0.85 -0.33 121.76 136.25 2jmm s ALA 109 Ca 0.04 -1.08 0.06 0.00 0.00 0.00 0.00 51.96 50.98 2jmm s ALA 109 Cb -0.14 -1.28 -0.01 0.00 0.00 0.00 0.00 23.12 21.69 2jmm s ALA 109 CO 0.02 -0.99 -0.22 0.20 0.00 0.00 0.00 175.76 174.77 2jmm s GLY 110 N 1.53 1.09 0.00 0.00 0.00 -0.42 -0.76 107.32 108.75 2jmm s GLY 110 Ca -0.02 -0.93 0.00 0.00 0.00 0.00 0.00 44.72 43.77 2jmm s GLY 110 CO -0.07 -0.70 0.00 0.61 0.00 0.00 0.00 173.10 172.94 2jmm n GLY 111 N 2.69 -0.68 3.09 0.20 0.00 0.64 0.09 105.19 111.23 2jmm n GLY 111 Ca -0.16 -0.49 -0.08 0.00 0.00 0.00 0.00 46.02 45.29 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 -3.70 0.17 -0.09 1.61 -7.23 0.10 -0.29 120.40 110.96 2jmm s VAL 112 Ca 0.00 -1.40 -0.00 0.00 -1.81 0.00 0.00 61.98 58.76 2jmm s VAL 112 Cb 0.00 -1.13 -0.03 0.00 0.56 0.00 0.00 36.38 35.79 2jmm s VAL 112 CO 0.00 -0.77 -0.06 -1.83 -0.31 0.00 0.00 175.10 172.13 2jmm s GLU 113 N -3.16 3.03 0.02 4.82 4.04 -0.05 -0.91 118.70 126.49 2jmm s GLU 113 Ca -0.00 -0.54 0.03 0.00 0.04 0.00 0.00 54.97 54.50 2jmm s GLU 113 Cb 0.02 -2.68 -0.01 0.00 0.02 0.00 0.00 34.13 31.47 2jmm s GLU 113 CO -0.07 0.54 -0.11 -0.47 -1.84 0.00 0.00 175.26 173.31 2jmm s TYR 114 N -0.45 0.94 0.12 4.83 6.14 0.74 -0.47 117.35 129.20 2jmm s TYR 114 Ca 0.07 -0.28 -0.30 0.00 0.64 0.00 0.00 57.07 57.21 2jmm s TYR 114 Cb -0.12 -0.58 -0.06 0.00 0.42 0.00 0.00 41.96 41.62 2jmm s TYR 114 CO 0.02 -0.01 0.94 0.14 0.64 0.00 0.00 175.55 177.29 2jmm s VAL 115 N -0.62 4.47 0.35 3.14 -7.23 -0.45 -0.48 120.40 119.58 2jmm s VAL 115 Ca 0.01 2.03 0.16 0.00 -1.81 0.00 0.00 61.98 62.37 2jmm s VAL 115 Cb -0.06 -4.31 0.34 0.00 0.56 0.00 0.00 36.38 32.91 2jmm s VAL 115 CO 0.00 0.35 1.64 0.40 -0.31 0.00 0.00 175.10 177.18 2jmm h ILE 116 N 3.93 0.23 0.00 -0.62 2.04 -1.87 -3.41 117.51 117.81 2jmm h ILE 116 Ca -0.43 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.34 2jmm h ILE 116 Cb 1.21 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.25 2jmm h ILE 116 CO 0.71 0.04 0.00 -1.14 0.00 0.00 0.00 178.15 177.77 2jmm n ARG 117 N -5.10 0.00 -2.96 2.37 3.00 -1.26 -5.06 116.66 107.66 2jmm n ARG 117 Ca 0.33 0.00 -0.40 0.00 -0.00 0.00 0.00 57.85 57.78 2jmm n ARG 117 Cb 1.06 0.00 -0.05 0.00 0.00 0.00 0.00 32.46 33.47 2jmm n ARG 117 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 2jmm s ARG 118 N -1.99 4.53 0.44 -0.14 3.52 -1.26 -4.96 118.95 119.09 2jmm s ARG 118 Ca 0.00 1.12 0.19 0.00 -0.13 0.00 0.00 55.73 56.91 2jmm s ARG 118 Cb 0.00 -3.35 1.14 0.00 -1.56 0.00 0.00 34.95 31.19 2jmm s ARG 118 CO 0.00 0.33 1.89 -0.09 -0.81 0.00 0.00 175.30 176.62 2jmm h ARG 119 N 5.42 0.32 -3.66 5.12 2.43 -1.94 -2.87 114.38 119.21 2jmm h ARG 119 Ca -0.44 -0.02 -0.80 0.00 -0.81 0.00 0.00 59.98 57.91 2jmm h ARG 119 Cb 1.21 -0.07 -0.27 0.00 -0.42 0.00 0.00 29.97 30.41 2jmm h ARG 119 CO 0.70 0.21 0.37 -1.50 -1.51 0.00 0.00 179.97 178.24 2jmm s ILE 120 N -5.34 5.89 -0.39 1.20 2.07 -1.26 -4.84 121.20 118.53 2jmm s ILE 120 Ca -0.07 -3.15 0.01 0.00 -1.41 0.00 0.00 60.65 56.02 2jmm s ILE 120 Cb 0.22 -4.57 0.14 0.00 0.13 0.00 0.00 42.46 38.38 2jmm s ILE 120 CO 0.77 -1.15 0.23 -0.89 -1.91 0.00 0.00 174.94 172.00 2jmm s THR 121 N -0.84 0.55 0.76 4.00 2.01 -1.09 -5.07 115.64 115.97 2jmm s THR 121 Ca 0.27 -2.06 -0.13 0.00 0.31 0.00 0.00 61.69 60.08 2jmm s THR 121 Cb -0.10 -1.40 0.18 0.00 0.01 0.00 0.00 72.50 71.19 2jmm s THR 121 CO -0.08 -0.98 0.92 -0.81 -0.69 0.00 0.00 174.62 172.98 2jmm n PRO 122 N 3.77 -1.36 0.00 4.92 -0.04 -1.26 -4.61 135.00 136.42 2jmm n PRO 122 Ca 0.13 -1.44 0.00 0.00 -0.04 0.00 0.00 63.50 62.15 2jmm n PRO 122 Cb 0.37 -1.05 0.00 0.00 -0.04 0.00 0.00 33.50 32.79 2jmm n PRO 122 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2jmm n GLU 123 N -3.28 0.00 -4.00 0.54 1.02 -1.26 -4.76 120.64 108.90 2jmm n GLU 123 Ca 0.12 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 56.92 2jmm n GLU 123 Cb 0.42 0.00 -0.15 0.00 -0.02 0.00 0.00 31.44 31.69 2jmm n GLU 123 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2jmm s ILE 124 N 0.00 2.63 0.10 -3.67 1.01 -1.26 -2.61 121.20 117.40 2jmm s ILE 124 Ca 0.00 -1.11 0.10 0.00 0.00 0.00 0.00 60.65 59.65 2jmm s ILE 124 Cb 0.00 -2.34 -0.04 0.00 0.01 0.00 0.00 42.46 40.10 2jmm s ILE 124 CO 0.00 0.22 -0.27 0.00 0.00 0.00 0.00 174.94 174.89 2jmm s ALA 125 N 1.28 2.33 -0.31 9.38 0.00 0.56 -4.59 121.76 130.41 2jmm s ALA 125 Ca -0.01 -1.40 -0.28 0.00 0.00 0.00 0.00 51.96 50.28 2jmm s ALA 125 Cb -0.17 -0.41 0.01 0.00 0.00 0.00 0.00 23.12 22.56 2jmm s ALA 125 CO -0.06 0.54 1.04 0.99 0.00 0.00 0.00 175.76 178.27 2jmm s THR 126 N -0.97 4.56 -0.27 0.00 2.01 0.37 -0.33 115.64 121.01 2jmm s THR 126 Ca 0.13 1.70 -0.00 0.00 0.31 0.00 0.00 61.69 63.83 2jmm s THR 126 Cb -0.10 -4.38 0.04 0.00 0.01 0.00 0.00 72.50 68.08 2jmm s THR 126 CO 0.05 -0.43 -0.06 -0.60 -0.69 0.00 0.00 174.62 172.88 2jmm s ARG 127 N 3.54 2.52 -0.22 4.92 3.00 0.65 -0.18 118.95 133.17 2jmm s ARG 127 Ca 0.44 -1.19 0.02 0.00 -1.00 0.00 0.00 55.73 54.00 2jmm s ARG 127 Cb -0.13 -3.00 0.05 0.00 0.00 0.00 0.00 34.95 31.88 2jmm s ARG 127 CO 0.14 -0.52 -0.11 -0.48 0.00 0.00 0.00 175.30 174.34 2jmm s LEU 128 N 1.23 2.73 -0.02 -0.88 2.34 -0.09 -1.03 118.68 122.97 2jmm s LEU 128 Ca -0.04 -1.10 0.02 0.00 0.06 0.00 0.00 54.13 53.07 2jmm s LEU 128 Cb -0.19 -1.36 0.00 0.00 -0.56 0.00 0.00 46.19 44.09 2jmm s LEU 128 CO -0.04 -0.16 -0.06 -0.70 -1.06 0.00 0.00 176.35 174.33 2jmm s GLU 129 N 1.28 0.60 -0.15 1.48 2.12 0.68 -0.72 118.70 123.99 2jmm s GLU 129 Ca -0.04 -0.18 -0.12 0.00 0.36 0.00 0.00 54.97 54.99 2jmm s GLU 129 Cb -0.18 -0.60 -0.05 0.00 0.26 0.00 0.00 34.13 33.56 2jmm s GLU 129 CO -0.07 0.06 0.24 0.71 -0.54 0.00 0.00 175.26 175.66 2jmm s TYR 130 N 0.22 3.48 -0.24 5.30 2.02 0.11 -0.75 117.35 127.49 2jmm s TYR 130 Ca -0.02 0.55 -0.03 0.00 -0.37 0.00 0.00 57.07 57.19 2jmm s TYR 130 Cb -0.07 -2.24 0.01 0.00 -0.40 0.00 0.00 41.96 39.26 2jmm s TYR 130 CO -0.00 0.34 -0.04 -0.65 -1.57 0.00 0.00 175.55 173.63 2jmm s GLN 131 N 0.15 3.06 -0.24 -0.62 -0.21 0.12 -1.30 119.66 120.62 2jmm s GLN 131 Ca 0.15 -0.84 0.02 0.00 0.02 0.00 0.00 55.36 54.71 2jmm s GLN 131 Cb -0.13 -3.03 0.05 0.00 1.00 0.00 0.00 33.01 30.91 2jmm s GLN 131 CO 0.03 -0.33 -0.12 -1.58 -2.12 0.00 0.00 175.29 171.17 2jmm s TRP 132 N 1.40 3.07 -0.10 0.91 0.52 0.54 -1.17 118.94 124.12 2jmm s TRP 132 Ca 0.03 -2.13 0.05 0.00 0.02 0.00 0.00 56.10 54.06 2jmm s TRP 132 Cb -0.16 -1.88 -0.10 0.00 -1.15 0.00 0.00 33.47 30.18 2jmm s TRP 132 CO -0.04 -0.85 -0.03 2.41 0.02 0.00 0.00 176.95 178.47 2jmm n THR 133 N 4.49 0.64 -2.53 2.01 -1.04 -1.26 -0.68 114.28 115.91 2jmm n THR 133 Ca -0.15 -0.33 -0.43 0.00 -2.04 0.00 0.00 64.05 61.10 2jmm n THR 133 Cb 0.44 -0.82 -0.02 0.00 -1.82 0.00 0.00 70.33 68.10 2jmm n THR 133 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 2jmm s ASN 134 N -4.55 6.88 0.44 8.00 3.84 -1.26 -4.91 114.94 123.37 2jmm s ASN 134 Ca -0.09 1.28 0.17 0.00 0.21 0.00 0.00 52.86 54.42 2jmm s ASN 134 Cb 0.03 -2.54 1.11 0.00 -0.55 0.00 0.00 41.25 39.30 2jmm s ASN 134 CO 0.33 -0.89 1.94 -1.13 -2.79 0.00 0.00 177.10 174.56 2jmm h ASN 135 N 8.39 0.32 -1.47 -4.21 -1.24 -2.03 -3.38 115.58 111.97 2jmm h ASN 135 Ca -0.23 0.02 -0.50 0.00 0.71 0.00 0.00 56.30 56.29 2jmm h ASN 135 Cb 1.08 -0.05 -0.07 0.00 0.73 0.00 0.00 38.32 40.01 2jmm h ASN 135 CO 1.01 0.17 1.20 0.00 -1.29 0.00 0.00 177.43 178.53 2jmm s ALA 136 N -5.34 2.41 -0.86 1.57 0.00 -1.26 -4.93 121.76 113.35 2jmm s ALA 136 Ca -0.07 -1.64 -0.23 0.00 0.00 0.00 0.00 51.96 50.02 2jmm s ALA 136 Cb 0.21 -4.43 -0.19 0.00 0.00 0.00 0.00 23.12 18.71 2jmm s ALA 136 CO 0.76 -3.84 2.16 0.43 0.00 0.00 0.00 175.76 175.27 2jmm n SER 137 N 10.68 1.01 -0.05 0.00 7.64 -1.26 -4.61 113.62 127.02 2jmm n SER 137 Ca 0.25 -1.81 -0.05 0.00 1.01 0.00 0.00 58.87 58.27 2jmm n SER 137 Cb 0.50 -1.51 -0.07 0.00 -1.01 0.00 0.00 64.21 62.12 2jmm n SER 137 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2jmm n ASP 138 N 16.98 2.65 0.00 6.43 8.00 -1.26 -5.07 116.55 144.27 2jmm n ASP 138 Ca 0.43 -0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.92 2jmm n ASP 138 Cb 0.43 0.64 0.00 0.00 -0.02 0.00 0.00 41.12 42.16 2jmm n ASP 138 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2jmm n ASN 139 N -2.41 0.00 0.00 -2.24 2.85 -1.26 -5.11 115.26 107.09 2jmm n ASN 139 Ca -0.16 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.31 2jmm n ASN 139 Cb 0.81 0.01 0.00 0.00 1.24 0.00 0.00 39.78 41.83 2jmm n ASN 139 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2jmm n GLY 140 N -0.65 0.08 3.33 8.20 0.00 -1.26 -5.07 105.19 109.83 2jmm n GLY 140 Ca 0.00 -2.29 -0.32 0.00 0.00 0.00 0.00 46.02 43.41 2jmm n GLY 140 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2jmm s MET 141 N -0.67 2.71 -0.39 1.61 1.75 -0.31 -4.64 119.30 119.36 2jmm s MET 141 Ca 0.00 -0.82 -0.10 0.00 -1.25 0.00 0.00 55.69 53.52 2jmm s MET 141 Cb 0.00 -2.30 0.04 0.00 2.84 0.00 0.00 34.83 35.41 2jmm s MET 141 CO 0.00 0.39 0.22 -1.17 -0.65 0.00 0.00 175.02 173.81 2jmm s LEU 142 N -0.17 4.82 -0.20 4.11 0.20 -0.35 0.13 118.68 127.23 2jmm s LEU 142 Ca -0.02 -1.13 -0.17 0.00 0.69 0.00 0.00 54.13 53.50 2jmm s LEU 142 Cb -0.14 -2.01 -0.04 0.00 -0.43 0.00 0.00 46.19 43.58 2jmm s LEU 142 CO 0.04 -0.43 0.45 -0.44 -0.29 0.00 0.00 176.35 175.68 2jmm s SER 143 N 1.70 6.50 -0.02 3.68 0.01 0.07 -0.32 113.70 125.30 2jmm s SER 143 Ca 0.02 0.59 0.02 0.00 1.31 0.00 0.00 55.95 57.89 2jmm s SER 143 Cb -0.20 -2.26 0.01 0.00 0.21 0.00 0.00 66.02 63.78 2jmm s SER 143 CO 0.05 -0.11 -0.07 -1.48 0.41 0.00 0.00 173.24 172.05 2jmm s LEU 144 N 1.39 1.71 0.00 2.44 0.05 0.27 -0.23 118.68 124.32 2jmm s LEU 144 Ca 0.21 -0.14 0.00 0.00 0.05 0.00 0.00 54.13 54.25 2jmm s LEU 144 Cb -0.15 -0.44 0.00 0.00 -2.05 0.00 0.00 46.19 43.55 2jmm s LEU 144 CO 0.09 0.03 0.00 0.61 -0.55 0.00 0.00 176.35 176.53 2jmm n GLY 145 N 3.41 0.73 3.31 -3.48 0.00 -0.20 -0.18 105.19 108.79 2jmm n GLY 145 Ca -0.19 -0.65 -0.32 0.00 0.00 0.00 0.00 46.02 44.85 2jmm n GLY 145 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jmm s VAL 146 N -2.05 2.56 0.04 1.61 -7.23 -0.07 -0.25 120.40 115.00 2jmm s VAL 146 Ca 0.00 -0.85 0.05 0.00 -1.81 0.00 0.00 61.98 59.37 2jmm s VAL 146 Cb 0.00 -2.02 -0.03 0.00 0.56 0.00 0.00 36.38 34.89 2jmm s VAL 146 CO 0.00 0.55 -0.11 -0.94 -0.31 0.00 0.00 175.10 174.28 2jmm s SER 147 N 0.21 4.29 0.03 4.85 1.04 0.55 -1.27 113.70 123.39 2jmm s SER 147 Ca -0.12 -0.29 0.07 0.00 0.48 0.00 0.00 55.95 56.09 2jmm s SER 147 Cb -0.16 -0.86 -0.02 0.00 0.10 0.00 0.00 66.02 65.07 2jmm s SER 147 CO 0.06 0.25 -0.21 -0.31 0.98 0.00 0.00 173.24 174.01 2jmm s TYR 148 N -1.02 1.87 -0.02 5.02 1.51 0.14 -0.32 117.35 124.53 2jmm s TYR 148 Ca 0.17 -0.37 -0.11 0.00 -1.01 0.00 0.00 57.07 55.75 2jmm s TYR 148 Cb -0.11 -1.14 -0.05 0.00 -0.11 0.00 0.00 41.96 40.55 2jmm s TYR 148 CO 0.08 0.06 0.32 -0.98 -1.11 0.00 0.00 175.55 173.91 2jmm s ARG 149 N -0.99 3.71 -0.16 -0.62 1.70 -1.07 -0.58 118.95 120.95 2jmm s ARG 149 Ca 0.08 0.16 -0.01 0.00 -0.47 0.00 0.00 55.73 55.48 2jmm s ARG 149 Cb -0.09 -3.16 0.01 0.00 -0.57 0.00 0.00 34.95 31.14 2jmm s ARG 149 CO 0.01 0.69 0.03 1.19 -1.08 0.00 0.00 175.30 176.14 2jmm n PHE 150 N 1.60 -2.26 -2.49 5.89 3.01 -0.15 -4.87 117.46 118.19 2jmm n PHE 150 Ca -0.14 1.08 -0.41 0.00 1.01 0.00 0.00 57.45 58.98 2jmm n PHE 150 Cb 0.53 -2.88 -0.03 0.00 -0.01 0.00 0.00 39.48 37.10 2jmm n PHE 150 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2jmm s GLY 151 N -0.78 0.88 -0.67 1.37 0.00 -1.26 -4.95 107.32 101.90 2jmm s GLY 151 Ca -0.03 -1.11 -0.26 0.00 0.00 0.00 0.00 44.72 43.31 2jmm s GLY 151 CO 0.43 2.70 2.39 1.62 0.00 0.00 0.00 173.10 180.25 2jmm s GLN 152 N 5.66 1.82 -0.67 2.90 0.74 -1.26 -4.90 119.66 123.95 2jmm s GLN 152 Ca 0.41 0.85 -0.26 0.00 0.05 0.00 0.00 55.36 56.41 2jmm s GLN 152 Cb -0.09 -4.70 -0.09 0.00 1.10 0.00 0.00 33.01 29.23 2jmm s GLN 152 CO 0.19 -3.95 2.30 0.20 -0.55 0.00 0.00 175.29 173.48 2jmm s GLY 153 N 11.34 -0.47 -0.08 2.59 0.00 -1.26 -4.28 107.32 115.16 2jmm s GLY 153 Ca 0.94 -0.56 -0.05 0.00 0.00 0.00 0.00 44.72 45.04 2jmm s GLY 153 CO 0.15 4.03 0.11 -2.21 0.00 0.00 0.00 173.10 175.19 2jmm n GLU 154 N 8.93 -2.30 -1.80 2.90 2.13 -1.26 -4.88 120.64 124.37 2jmm n GLU 154 Ca 0.40 1.97 -0.25 0.00 0.66 0.00 0.00 57.16 59.94 2jmm n GLU 154 Cb 0.49 -2.94 -0.05 0.00 0.27 0.00 0.00 31.44 29.21 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 -0.32 1.38 -0.78 4.31 0.00 -1.26 -5.29 121.76 119.81 2jmm s ALA 155 Ca -0.13 -0.87 0.06 0.00 0.00 0.00 0.00 51.96 51.02 2jmm s ALA 155 Cb 0.01 -4.49 0.05 0.00 0.00 0.00 0.00 23.12 18.69 2jmm s ALA 155 CO 0.34 -5.02 0.70 0.00 0.00 0.00 0.00 175.76 171.78