#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmm h PRO 2 N 0.00 0.00 -6.42 0.03 0.13 -2.03 -3.48 132.00 120.24 2jmm h PRO 2 Ca 0.00 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.64 2jmm h PRO 2 Cb 0.00 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.07 2jmm h PRO 2 CO 0.00 0.15 -0.84 1.63 -0.23 0.00 0.00 178.00 178.71 2jmm n LYS 3 N -3.42 -4.01 -0.50 0.86 5.02 -1.26 -3.98 118.16 110.88 2jmm n LYS 3 Ca -0.01 0.48 0.07 0.00 -2.02 0.00 0.00 58.31 56.83 2jmm n LYS 3 Cb 0.34 -4.94 0.16 0.00 -0.02 0.00 0.00 35.03 30.57 2jmm n LYS 3 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2jmm n ASP 4 N -2.91 1.79 0.00 4.39 8.00 -1.25 -4.15 116.55 122.42 2jmm n ASP 4 Ca -0.17 -3.43 0.00 0.00 0.71 0.00 0.00 54.79 51.90 2jmm n ASP 4 Cb 0.62 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.25 2jmm n ASP 4 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2jmm n ASN 5 N -1.05 0.00 -4.27 -2.24 2.85 -0.04 -4.08 115.26 106.42 2jmm n ASN 5 Ca 0.16 0.00 -0.21 0.00 -0.11 0.00 0.00 54.58 54.42 2jmm n ASN 5 Cb 0.71 0.00 -0.12 0.00 1.24 0.00 0.00 39.78 41.61 2jmm n ASN 5 CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 2jmm s THR 6 N 0.00 1.56 -0.04 -0.44 -4.23 0.28 -4.92 115.64 107.85 2jmm s THR 6 Ca 0.00 -1.66 0.06 0.00 -1.18 0.00 0.00 61.69 58.92 2jmm s THR 6 Cb 0.00 -1.56 -0.02 0.00 1.34 0.00 0.00 72.50 72.26 2jmm s THR 6 CO 0.00 -0.24 -0.23 0.26 -0.54 0.00 0.00 174.62 173.87 2jmm s TRP 7 N -1.67 2.44 -0.05 3.99 0.52 0.66 0.13 118.94 124.97 2jmm s TRP 7 Ca 0.08 -0.46 0.06 0.00 0.02 0.00 0.00 56.10 55.81 2jmm s TRP 7 Cb -0.08 -1.56 -0.01 0.00 -1.15 0.00 0.00 33.47 30.67 2jmm s TRP 7 CO 0.04 -0.04 -0.25 -0.47 0.02 0.00 0.00 176.95 176.25 2jmm s TYR 8 N -0.50 2.38 -0.28 -1.98 6.14 0.55 -0.01 117.35 123.65 2jmm s TYR 8 Ca 0.06 -0.65 -0.19 0.00 0.64 0.00 0.00 57.07 56.93 2jmm s TYR 8 Cb -0.11 -1.56 0.10 0.00 0.42 0.00 0.00 41.96 40.81 2jmm s TYR 8 CO 0.01 -0.18 0.82 -0.08 0.64 0.00 0.00 175.55 176.76 2jmm s THR 9 N -0.25 0.00 0.00 4.34 -1.32 0.23 -0.53 115.64 118.11 2jmm s THR 9 Ca -0.01 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.47 2jmm s THR 9 Cb -0.13 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.86 2jmm s THR 9 CO 0.03 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.05 2jmm n GLY 10 N 3.54 0.66 3.05 6.08 0.00 0.19 0.10 105.19 118.81 2jmm n GLY 10 Ca -0.17 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 44.84 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 1.15 0.02 4.61 0.00 0.09 -0.03 121.76 126.60 2jmm s ALA 11 Ca 0.00 -0.47 0.03 0.00 0.00 0.00 0.00 51.96 51.52 2jmm s ALA 11 Cb 0.00 -0.42 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 2jmm s ALA 11 CO 0.00 0.19 -0.09 0.15 0.00 0.00 0.00 175.76 176.01 2jmm s LYS 12 N 0.20 0.62 0.03 0.00 1.02 -0.20 -1.07 119.74 120.35 2jmm s LYS 12 Ca -0.05 -0.53 0.06 0.00 0.02 0.00 0.00 55.97 55.47 2jmm s LYS 12 Cb -0.11 -0.54 -0.03 0.00 -0.52 0.00 0.00 37.83 36.63 2jmm s LYS 12 CO 0.01 0.13 -0.14 -0.48 -0.92 0.00 0.00 175.35 173.96 2jmm s LEU 13 N -0.87 2.83 -0.31 3.17 0.05 0.58 -0.63 118.68 123.51 2jmm s LEU 13 Ca -0.02 -0.33 -0.03 0.00 0.05 0.00 0.00 54.13 53.80 2jmm s LEU 13 Cb -0.06 -1.64 0.04 0.00 -2.05 0.00 0.00 46.19 42.48 2jmm s LEU 13 CO 0.00 0.26 0.02 -0.83 -0.55 0.00 0.00 176.35 175.25 2jmm s GLY 14 N -1.50 1.77 -0.02 -3.48 0.00 -0.24 -0.91 107.32 102.93 2jmm s GLY 14 Ca 0.16 -1.73 0.07 0.00 0.00 0.00 0.00 44.72 43.22 2jmm s GLY 14 CO 0.07 0.70 -0.23 0.86 0.00 0.00 0.00 173.10 174.50 2jmm s TRP 15 N 1.30 2.41 -0.66 1.90 -0.00 0.50 -4.27 118.94 120.11 2jmm s TRP 15 Ca -0.04 -0.38 -0.19 0.00 -0.00 0.00 0.00 56.10 55.49 2jmm s TRP 15 Cb -0.19 -1.52 0.11 0.00 -0.00 0.00 0.00 33.47 31.86 2jmm s TRP 15 CO -0.00 0.03 0.82 -1.54 -0.00 0.00 0.00 176.95 176.26 2jmm s SER 16 N -0.70 6.27 0.00 5.86 1.04 -1.26 -0.37 113.70 124.53 2jmm s SER 16 Ca 0.11 -1.48 0.00 0.00 0.48 0.00 0.00 55.95 55.05 2jmm s SER 16 Cb -0.10 -2.34 0.00 0.00 0.10 0.00 0.00 66.02 63.68 2jmm s SER 16 CO -0.00 -1.15 0.00 1.67 0.98 0.00 0.00 173.24 174.73 2jmm n GLN 17 N 6.54 0.00 -3.51 4.02 -0.06 -1.23 -1.98 117.38 121.16 2jmm n GLN 17 Ca -0.03 0.00 -0.27 0.00 -2.00 0.00 0.00 57.00 54.71 2jmm n GLN 17 Cb 0.44 0.00 -0.10 0.00 -4.06 0.00 0.00 30.24 26.52 2jmm n GLN 17 CO 0.00 0.00 0.00 0.98 -0.20 0.00 0.00 177.06 177.84 2jmm n TYR 18 N -0.71 1.01 -3.63 3.69 9.36 -1.26 -5.09 117.16 120.52 2jmm n TYR 18 Ca 0.00 -3.76 -0.11 0.00 3.32 0.00 0.00 57.90 57.35 2jmm n TYR 18 Cb 0.00 -0.21 -0.07 0.00 -0.63 0.00 0.00 39.34 38.43 2jmm n TYR 18 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2jmm s SER 19 N -0.94 -0.56 -1.23 2.98 0.15 -0.84 -5.08 113.70 108.19 2jmm s SER 19 Ca 0.32 1.05 -0.12 0.00 0.70 0.00 0.00 55.95 57.90 2jmm s SER 19 Cb 0.05 1.05 0.18 0.00 -1.71 0.00 0.00 66.02 65.59 2jmm s SER 19 CO -0.15 -0.21 1.57 -1.14 1.20 0.00 0.00 173.24 174.51 2jmm n ARG 20 N 2.28 3.48 0.00 5.44 0.63 -1.26 -4.46 116.66 122.77 2jmm n ARG 20 Ca -0.13 -3.78 0.00 0.00 -0.92 0.00 0.00 57.85 53.01 2jmm n ARG 20 Cb 0.56 -2.98 0.00 0.00 0.45 0.00 0.00 32.46 30.49 2jmm n ARG 20 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 2jmm n GLU 21 N 4.89 0.00 0.00 -0.14 4.07 -1.26 -5.06 120.64 123.13 2jmm n GLU 21 Ca 0.37 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.47 2jmm n GLU 21 Cb 0.40 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.78 2jmm n GLU 21 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2jmm n ASN 22 N -2.37 0.00 0.00 4.31 4.13 -1.26 -4.83 115.26 115.24 2jmm n ASN 22 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 2jmm n ASN 22 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 2jmm n ASN 22 CO 0.00 0.00 0.00 1.67 0.28 0.00 0.00 177.26 179.21 2jmm n GLN 23 N 0.00 0.00 -2.32 3.52 7.27 -1.26 -4.75 117.38 119.84 2jmm n GLN 23 Ca 0.00 0.00 -0.40 0.00 0.07 0.00 0.00 57.00 56.67 2jmm n GLN 23 Cb 0.00 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 32.62 2jmm n GLN 23 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 2jmm s LEU 24 N 0.00 4.50 0.00 1.69 2.01 -1.26 -4.10 118.68 121.52 2jmm s LEU 24 Ca 0.00 2.45 0.00 0.00 0.01 0.00 0.00 54.13 56.59 2jmm s LEU 24 Cb 0.00 -3.64 0.00 0.00 0.01 0.00 0.00 46.19 42.56 2jmm s LEU 24 CO 0.00 -0.32 0.00 0.61 1.01 0.00 0.00 176.35 177.65 2jmm n GLY 25 N 1.06 0.67 3.31 -3.19 0.00 -1.26 -4.56 105.19 101.22 2jmm n GLY 25 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.55 2.41 0.01 4.61 0.00 -1.26 -1.08 121.76 123.90 2jmm s ALA 26 Ca 0.00 -0.94 0.07 0.00 0.00 0.00 0.00 51.96 51.09 2jmm s ALA 26 Cb 0.00 -0.99 -0.02 0.00 0.00 0.00 0.00 23.12 22.11 2jmm s ALA 26 CO 0.00 0.30 -0.22 0.20 0.00 0.00 0.00 175.76 176.05 2jmm s GLY 27 N 0.23 1.10 -0.26 0.00 0.00 0.20 -4.05 107.32 104.53 2jmm s GLY 27 Ca -0.12 -0.99 -0.09 0.00 0.00 0.00 0.00 44.72 43.52 2jmm s GLY 27 CO 0.06 -0.86 0.14 0.00 0.00 0.00 0.00 173.10 172.44 2jmm s ALA 28 N -0.61 3.40 -0.26 3.20 0.00 0.03 -1.03 121.76 126.49 2jmm s ALA 28 Ca 0.08 -1.06 -0.01 0.00 0.00 0.00 0.00 51.96 50.98 2jmm s ALA 28 Cb -0.09 -2.29 0.04 0.00 0.00 0.00 0.00 23.12 20.79 2jmm s ALA 28 CO 0.00 -0.44 -0.06 -0.06 0.00 0.00 0.00 175.76 175.19 2jmm s PHE 29 N 1.54 3.13 0.01 0.00 0.40 0.96 -0.21 117.98 123.81 2jmm s PHE 29 Ca 0.07 -1.77 -0.00 0.00 -0.60 0.00 0.00 56.93 54.62 2jmm s PHE 29 Cb -0.15 -2.04 -0.01 0.00 0.51 0.00 0.00 43.02 41.33 2jmm s PHE 29 CO 0.07 -0.78 -0.01 0.20 0.70 0.00 0.00 175.22 175.40 2jmm s GLY 30 N 1.27 0.14 0.00 4.36 0.00 0.02 -0.64 107.32 112.47 2jmm s GLY 30 Ca -0.02 -0.34 0.00 0.00 0.00 0.00 0.00 44.72 44.36 2jmm s GLY 30 CO -0.04 -0.38 0.00 0.61 0.00 0.00 0.00 173.10 173.29 2jmm n GLY 31 N 2.19 -0.66 3.19 0.20 0.00 0.31 -0.36 105.19 110.07 2jmm n GLY 31 Ca -0.19 -0.82 -0.24 0.00 0.00 0.00 0.00 46.02 44.76 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 -3.00 1.59 -0.83 1.61 1.13 -0.08 -0.33 117.35 117.44 2jmm s TYR 32 Ca 0.00 -0.33 -0.02 0.00 -1.41 0.00 0.00 57.07 55.32 2jmm s TYR 32 Cb 0.00 -0.99 0.21 0.00 -1.10 0.00 0.00 41.96 40.07 2jmm s TYR 32 CO 0.00 0.02 0.70 -1.14 -2.51 0.00 0.00 175.55 172.61 2jmm s GLN 33 N -0.73 3.09 -0.40 -3.49 0.74 0.12 -0.16 119.66 118.84 2jmm s GLN 33 Ca 0.06 -3.14 0.07 0.00 0.05 0.00 0.00 55.36 52.40 2jmm s GLN 33 Cb -0.07 -3.88 0.23 0.00 1.10 0.00 0.00 33.01 30.39 2jmm s GLN 33 CO 0.00 -1.25 0.50 0.28 -0.55 0.00 0.00 175.29 174.27 2jmm n VAL 34 N 2.53 -0.78 -3.63 1.34 0.31 -1.25 -0.56 118.33 116.28 2jmm n VAL 34 Ca 0.19 -3.79 -0.04 0.00 -0.01 0.00 0.00 64.34 60.68 2jmm n VAL 34 Cb 0.37 -1.77 -0.06 0.00 -0.91 0.00 0.00 33.84 31.47 2jmm n VAL 34 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2jmm s ASN 35 N -0.93 -0.15 -0.55 4.52 2.47 -1.21 -4.91 114.94 114.19 2jmm s ASN 35 Ca 0.34 0.22 -0.32 0.00 0.42 0.00 0.00 52.86 53.53 2jmm s ASN 35 Cb 0.14 0.21 -0.13 0.00 -1.45 0.00 0.00 41.25 40.02 2jmm s ASN 35 CO -0.13 -0.09 2.38 -0.81 -3.72 0.00 0.00 177.10 174.73 2jmm n PRO 36 N 1.18 0.77 0.00 0.43 -0.04 -1.26 -2.25 135.00 133.82 2jmm n PRO 36 Ca -0.07 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 2jmm n PRO 36 Cb 0.58 -2.46 0.00 0.00 -0.04 0.00 0.00 33.50 31.58 2jmm n PRO 36 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2jmm n TYR 37 N 11.59 0.00 -4.29 0.54 4.02 -1.26 -4.91 117.16 122.85 2jmm n TYR 37 Ca 0.47 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 58.05 2jmm n TYR 37 Cb 0.26 -0.12 -0.10 0.00 -0.02 0.00 0.00 39.34 39.36 2jmm n TYR 37 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 2jmm s VAL 38 N -0.31 3.65 0.21 -0.72 -7.23 -0.96 -3.95 120.40 111.09 2jmm s VAL 38 Ca 0.00 -1.00 0.11 0.00 -1.81 0.00 0.00 61.98 59.28 2jmm s VAL 38 Cb 0.00 -2.67 -0.04 0.00 0.56 0.00 0.00 36.38 34.23 2jmm s VAL 38 CO 0.00 0.22 -0.20 -0.83 -0.31 0.00 0.00 175.10 173.99 2jmm s GLY 39 N -1.93 1.74 -0.24 2.32 0.00 0.73 -3.34 107.32 106.61 2jmm s GLY 39 Ca 0.21 -1.64 0.01 0.00 0.00 0.00 0.00 44.72 43.29 2jmm s GLY 39 CO 0.12 -1.68 -0.11 -1.36 0.00 0.00 0.00 173.10 170.08 2jmm s PHE 40 N -1.82 3.08 0.04 1.90 0.08 0.78 0.18 117.98 122.22 2jmm s PHE 40 Ca 0.23 -1.88 0.05 0.00 0.12 0.00 0.00 56.93 55.44 2jmm s PHE 40 Cb -0.08 -1.98 -0.02 0.00 -0.57 0.00 0.00 43.02 40.37 2jmm s PHE 40 CO 0.12 -0.81 -0.13 -1.83 -0.10 0.00 0.00 175.22 172.47 2jmm s GLU 41 N 1.23 0.87 0.02 0.44 4.04 0.11 -0.90 118.70 124.51 2jmm s GLU 41 Ca -0.02 -0.77 0.05 0.00 0.04 0.00 0.00 54.97 54.27 2jmm s GLU 41 Cb -0.17 -0.86 -0.03 0.00 0.02 0.00 0.00 34.13 33.08 2jmm s GLU 41 CO -0.07 0.21 -0.10 0.00 -1.84 0.00 0.00 175.26 173.46 2jmm s MET 42 N -1.22 2.38 -0.19 -4.83 0.23 0.51 -0.76 119.30 115.42 2jmm s MET 42 Ca 0.00 -0.82 -0.06 0.00 -1.03 0.00 0.00 55.69 53.78 2jmm s MET 42 Cb -0.08 -2.39 -0.03 0.00 -1.53 0.00 0.00 34.83 30.79 2jmm s MET 42 CO 0.01 0.58 0.03 0.20 -2.03 0.00 0.00 175.02 173.81 2jmm s GLY 43 N -1.50 1.81 -0.34 3.16 0.00 0.64 -0.80 107.32 110.30 2jmm s GLY 43 Ca 0.17 -0.86 -0.00 0.00 0.00 0.00 0.00 44.72 44.02 2jmm s GLY 43 CO 0.08 0.13 0.07 -0.47 0.00 0.00 0.00 173.10 172.90 2jmm s TYR 44 N 0.65 3.48 -0.24 1.90 6.14 0.70 -0.85 117.35 129.13 2jmm s TYR 44 Ca 0.01 -2.34 -0.08 0.00 0.64 0.00 0.00 57.07 55.31 2jmm s TYR 44 Cb -0.14 -2.63 -0.03 0.00 0.42 0.00 0.00 41.96 39.58 2jmm s TYR 44 CO 0.02 -0.90 0.09 0.34 0.64 0.00 0.00 175.55 175.74 2jmm s ASP 45 N 1.35 5.38 -0.06 4.32 -1.08 0.68 -0.79 116.67 126.47 2jmm s ASP 45 Ca 0.02 -0.12 -0.03 0.00 -0.52 0.00 0.00 52.55 51.90 2jmm s ASP 45 Cb -0.21 -1.97 -0.04 0.00 -1.46 0.00 0.00 42.92 39.25 2jmm s ASP 45 CO -0.04 -0.00 0.11 0.86 0.52 0.00 0.00 175.17 176.62 2jmm s TRP 46 N 1.45 3.42 -1.73 -5.34 -0.11 -1.26 -0.86 118.94 114.52 2jmm s TRP 46 Ca 0.06 0.34 -0.20 0.00 1.22 0.00 0.00 56.10 57.52 2jmm s TRP 46 Cb -0.15 -1.83 0.19 0.00 -1.50 0.00 0.00 33.47 30.18 2jmm s TRP 46 CO 0.05 0.62 0.69 -0.11 -4.62 0.00 0.00 176.95 173.58 2jmm n LEU 47 N 1.54 -1.32 -4.57 5.86 -0.00 -1.26 -4.82 117.00 112.43 2jmm n LEU 47 Ca -0.16 -1.04 -0.22 0.00 -0.00 0.00 0.00 56.01 54.58 2jmm n LEU 47 Cb 0.54 -1.87 -0.07 0.00 -0.00 0.00 0.00 43.42 42.01 2jmm n LEU 47 CO 0.35 0.20 1.32 -0.83 -0.00 0.00 0.00 177.39 178.44 2jmm s GLY 48 N -3.21 -0.28 0.00 -3.96 0.00 -1.26 -4.48 107.32 94.12 2jmm s GLY 48 Ca 0.76 -1.64 0.00 0.00 0.00 0.00 0.00 44.72 43.84 2jmm s GLY 48 CO 0.93 3.81 0.00 0.54 0.00 0.00 0.00 173.10 178.38 2jmm n ARG 49 N 8.48 0.00 -1.93 2.90 1.74 -1.26 -4.90 116.66 121.69 2jmm n ARG 49 Ca 0.43 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 57.10 2jmm n ARG 49 Cb 0.46 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.87 2jmm n ARG 49 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2jmm s MET 50 N 0.00 3.09 -0.03 5.56 -1.94 -1.26 -4.92 119.30 119.79 2jmm s MET 50 Ca 0.00 1.34 -0.21 0.00 -1.71 0.00 0.00 55.69 55.12 2jmm s MET 50 Cb 0.00 -4.28 -0.14 0.00 2.01 0.00 0.00 34.83 32.42 2jmm s MET 50 CO 0.00 -2.15 0.90 -1.00 -0.01 0.00 0.00 175.02 172.76 2jmm h PRO 51 N 13.99 -0.35 -5.73 2.03 0.13 -1.92 -3.32 132.00 136.84 2jmm h PRO 51 Ca -0.32 0.02 -0.66 0.00 -0.87 0.00 0.00 66.00 64.17 2jmm h PRO 51 Cb 1.18 0.08 -0.11 0.00 0.13 0.00 0.00 31.00 32.28 2jmm h PRO 51 CO 1.07 -0.00 1.69 0.50 -0.23 0.00 0.00 178.00 181.03 2jmm s ARG 52 N -3.70 3.81 0.03 0.86 3.00 -1.26 -4.59 118.95 117.10 2jmm s ARG 52 Ca -0.12 -1.72 0.00 0.00 -1.00 0.00 0.00 55.73 52.89 2jmm s ARG 52 Cb 0.01 -5.35 0.00 0.00 0.00 0.00 0.00 34.95 29.61 2jmm s ARG 52 CO 0.43 -2.13 0.00 1.63 0.00 0.00 0.00 175.30 175.23 2jmm n LYS 53 N 8.05 -3.60 0.00 5.12 5.02 -1.26 -4.39 118.16 127.09 2jmm n LYS 53 Ca 0.39 2.76 0.00 0.00 -2.02 0.00 0.00 58.31 59.44 2jmm n LYS 53 Cb 0.48 -3.37 0.00 0.00 -0.02 0.00 0.00 35.03 32.12 2jmm n LYS 53 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jmm n ALA 54 N 1.26 1.52 -2.55 7.82 0.00 -1.25 -4.30 120.51 123.01 2jmm n ALA 54 Ca 0.00 -0.02 -0.11 0.00 0.00 0.00 0.00 53.44 53.31 2jmm n ALA 54 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.46 2jmm n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jmm n GLN 55 N -1.42 -0.65 -3.40 0.00 10.64 -1.26 -0.72 117.38 120.57 2jmm n GLN 55 Ca 0.00 0.72 -0.44 0.00 -1.83 0.00 0.00 57.00 55.45 2jmm n GLN 55 Cb 0.00 -0.97 -0.05 0.00 -0.86 0.00 0.00 30.24 28.35 2jmm n GLN 55 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 2jmm s GLY 56 N -0.83 2.24 -0.25 2.61 0.00 -0.04 -3.26 107.32 107.79 2jmm s GLY 56 Ca 0.11 -2.77 -0.05 0.00 0.00 0.00 0.00 44.72 42.01 2jmm s GLY 56 CO 0.25 1.19 0.01 0.54 0.00 0.00 0.00 173.10 175.09 2jmm s VAL 57 N 1.10 3.71 -0.26 1.40 0.11 0.42 -0.23 120.40 126.63 2jmm s VAL 57 Ca 0.08 -0.49 -0.05 0.00 -2.93 0.00 0.00 61.98 58.59 2jmm s VAL 57 Cb -0.24 -2.77 0.00 0.00 -1.53 0.00 0.00 36.38 31.85 2jmm s VAL 57 CO -0.01 0.31 0.03 0.00 -3.33 0.00 0.00 175.10 172.10 2jmm s GLN 58 N 1.51 3.20 -0.36 1.54 0.00 -0.03 -0.20 119.66 125.32 2jmm s GLN 58 Ca 0.05 -0.77 -0.17 0.00 -0.00 0.00 0.00 55.36 54.47 2jmm s GLN 58 Cb -0.15 -3.23 -0.00 0.00 0.00 0.00 0.00 33.01 29.63 2jmm s GLN 58 CO -0.00 -0.34 0.47 -1.17 0.00 0.00 0.00 175.29 174.24 2jmm s LEU 59 N 1.49 4.42 0.07 2.60 2.96 -0.06 -0.26 118.68 129.90 2jmm s LEU 59 Ca 0.03 -0.15 0.07 0.00 -0.22 0.00 0.00 54.13 53.86 2jmm s LEU 59 Cb -0.16 -2.51 -0.03 0.00 0.50 0.00 0.00 46.19 43.99 2jmm s LEU 59 CO 0.00 -0.46 -0.18 0.42 -1.32 0.00 0.00 176.35 174.81 2jmm s THR 60 N 2.29 1.45 -0.17 3.68 -4.23 0.06 -1.50 115.64 117.21 2jmm s THR 60 Ca 0.16 -1.33 -0.05 0.00 -1.18 0.00 0.00 61.69 59.29 2jmm s THR 60 Cb -0.16 -1.32 -0.03 0.00 1.34 0.00 0.00 72.50 72.33 2jmm s THR 60 CO 0.13 -0.05 -0.00 0.00 -0.54 0.00 0.00 174.62 174.16 2jmm s ALA 61 N -1.07 3.11 -0.03 3.99 0.00 0.15 -0.71 121.76 127.19 2jmm s ALA 61 Ca 0.04 -0.85 0.07 0.00 0.00 0.00 0.00 51.96 51.22 2jmm s ALA 61 Cb -0.09 -1.71 -0.02 0.00 0.00 0.00 0.00 23.12 21.30 2jmm s ALA 61 CO 0.03 0.11 -0.25 0.21 0.00 0.00 0.00 175.76 175.85 2jmm s LYS 62 N 0.53 2.28 -0.10 0.00 2.20 0.13 -0.82 119.74 123.96 2jmm s LYS 62 Ca -0.01 -0.91 0.02 0.00 -0.36 0.00 0.00 55.97 54.71 2jmm s LYS 62 Cb -0.14 -2.10 -0.01 0.00 -1.51 0.00 0.00 37.83 34.08 2jmm s LYS 62 CO 0.02 0.50 -0.19 -0.51 -0.36 0.00 0.00 175.35 174.81 2jmm s LEU 63 N -0.46 2.40 -0.12 5.43 1.02 0.14 -0.19 118.68 126.91 2jmm s LEU 63 Ca 0.05 -0.43 0.00 0.00 0.02 0.00 0.00 54.13 53.78 2jmm s LEU 63 Cb -0.11 -1.50 -0.02 0.00 0.02 0.00 0.00 46.19 44.58 2jmm s LEU 63 CO 0.01 0.19 -0.13 -0.83 0.02 0.00 0.00 176.35 175.61 2jmm s GLY 64 N 0.20 1.55 -0.37 -3.19 0.00 -1.25 -1.06 107.32 103.20 2jmm s GLY 64 Ca -0.12 -0.90 0.03 0.00 0.00 0.00 0.00 44.72 43.74 2jmm s GLY 64 CO 0.06 -0.28 0.10 -0.19 0.00 0.00 0.00 173.10 172.79 2jmm s TYR 65 N 0.17 3.37 -1.06 1.90 1.51 0.56 -5.01 117.35 118.78 2jmm s TYR 65 Ca -0.07 -2.87 -0.23 0.00 -1.01 0.00 0.00 57.07 52.89 2jmm s TYR 65 Cb -0.15 -2.73 -0.06 0.00 -0.11 0.00 0.00 41.96 38.91 2jmm s TYR 65 CO 0.05 -0.90 1.92 -1.25 -1.11 0.00 0.00 175.55 174.26 2jmm s PRO 66 N 0.77 2.60 0.17 -1.71 0.04 -1.26 -1.57 135.00 134.03 2jmm s PRO 66 Ca 0.12 -0.80 0.11 0.00 0.04 0.00 0.00 61.00 60.48 2jmm s PRO 66 Cb -0.20 -5.17 -0.04 0.00 0.04 0.00 0.00 34.50 29.12 2jmm s PRO 66 CO -0.08 -3.61 -0.25 0.15 0.04 0.00 0.00 177.00 173.25 2jmm s LYS 67 N 6.60 1.47 -1.05 4.56 1.02 -1.26 -5.05 119.74 126.04 2jmm s LYS 67 Ca 0.68 -1.47 -0.24 0.00 0.02 0.00 0.00 55.97 54.96 2jmm s LYS 67 Cb -0.03 -1.84 -0.08 0.00 -0.52 0.00 0.00 37.83 35.35 2jmm s LYS 67 CO 0.06 0.41 1.97 -0.51 -0.92 0.00 0.00 175.35 176.36 2jmm s LEU 68 N -2.49 3.05 -0.07 3.17 2.01 -1.26 -4.61 118.68 118.47 2jmm s LEU 68 Ca 0.19 -1.15 -0.03 0.00 0.01 0.00 0.00 54.13 53.14 2jmm s LEU 68 Cb -0.08 -2.58 -0.04 0.00 0.01 0.00 0.00 46.19 43.50 2jmm s LEU 68 CO 0.09 -3.08 0.09 -0.83 1.01 0.00 0.00 176.35 173.62 2jmm s GLY 69 N 7.43 2.03 -0.80 -3.19 0.00 -1.12 -5.02 107.32 106.64 2jmm s GLY 69 Ca 0.71 -0.76 -0.25 0.00 0.00 0.00 0.00 44.72 44.42 2jmm s GLY 69 CO 0.08 -0.56 2.48 2.41 0.00 0.00 0.00 173.10 177.52 2jmm n THR 70 N 1.74 -0.03 -3.31 0.90 -1.04 -1.26 -1.42 114.28 109.86 2jmm n THR 70 Ca -0.17 -0.41 -0.10 0.00 -2.04 0.00 0.00 64.05 61.32 2jmm n THR 70 Cb 0.54 -1.40 0.00 0.00 -1.82 0.00 0.00 70.33 67.65 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 12.69 -6.73 -0.74 8.00 2.03 -1.26 -4.40 116.55 126.14 2jmm n ASP 71 Ca 0.54 -0.33 -0.01 0.00 0.52 0.00 0.00 54.79 55.51 2jmm n ASP 71 Cb 0.27 -3.95 0.00 0.00 -0.72 0.00 0.00 41.12 36.72 2jmm n ASP 71 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2jmm n ASP 72 N -1.89 -2.20 -4.41 1.67 8.00 -0.51 -4.85 116.55 112.35 2jmm n ASP 72 Ca -0.10 -0.03 -0.38 0.00 0.71 0.00 0.00 54.79 54.98 2jmm n ASP 72 Cb 0.57 -0.75 -0.12 0.00 -0.02 0.00 0.00 41.12 40.80 2jmm n ASP 72 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2jmm s LEU 73 N -1.48 4.05 -0.13 0.64 1.02 -0.71 -1.15 118.68 120.93 2jmm s LEU 73 Ca 0.03 -0.57 -0.04 0.00 0.02 0.00 0.00 54.13 53.56 2jmm s LEU 73 Cb -0.01 -1.97 -0.04 0.00 0.02 0.00 0.00 46.19 44.19 2jmm s LEU 73 CO 0.04 -0.20 0.03 -0.62 0.02 0.00 0.00 176.35 175.63 2jmm s ASP 74 N 1.58 5.46 0.12 2.29 -1.08 0.67 -2.79 116.67 122.93 2jmm s ASP 74 Ca 0.04 0.14 -0.26 0.00 -0.52 0.00 0.00 52.55 51.95 2jmm s ASP 74 Cb -0.17 -1.73 -0.07 0.00 -1.46 0.00 0.00 42.92 39.49 2jmm s ASP 74 CO 0.05 0.30 0.81 -0.63 0.52 0.00 0.00 175.17 176.23 2jmm s ILE 75 N -0.41 4.48 -0.03 4.11 -1.09 -0.61 -0.54 121.20 127.12 2jmm s ILE 75 Ca 0.09 1.77 0.02 0.00 -2.23 0.00 0.00 60.65 60.29 2jmm s ILE 75 Cb -0.12 -4.18 0.01 0.00 -1.58 0.00 0.00 42.46 36.59 2jmm s ILE 75 CO 0.02 0.44 -0.08 -0.31 -1.23 0.00 0.00 174.94 173.78 2jmm s TYR 76 N -0.62 0.84 -0.15 3.97 2.02 0.36 -0.32 117.35 123.44 2jmm s TYR 76 Ca 0.39 -0.21 0.01 0.00 -0.37 0.00 0.00 57.07 56.90 2jmm s TYR 76 Cb -0.23 -0.62 0.01 0.00 -0.40 0.00 0.00 41.96 40.72 2jmm s TYR 76 CO 0.26 -0.10 -0.19 0.99 -1.57 0.00 0.00 175.55 174.94 2jmm s THR 77 N 0.26 2.33 -0.04 -0.71 2.01 -0.23 -1.14 115.64 118.13 2jmm s THR 77 Ca -0.04 -0.88 0.05 0.00 0.31 0.00 0.00 61.69 61.13 2jmm s THR 77 Cb -0.09 -1.96 -0.01 0.00 0.01 0.00 0.00 72.50 70.46 2jmm s THR 77 CO 0.00 0.53 -0.19 -0.60 -0.69 0.00 0.00 174.62 173.68 2jmm s ARG 78 N 0.84 1.92 -0.15 4.92 3.00 0.94 0.27 118.95 130.71 2jmm s ARG 78 Ca -0.06 -0.68 -0.13 0.00 -1.00 0.00 0.00 55.73 53.86 2jmm s ARG 78 Cb -0.15 -1.68 0.04 0.00 0.00 0.00 0.00 34.95 33.16 2jmm s ARG 78 CO -0.02 0.29 0.39 -0.48 0.00 0.00 0.00 175.30 175.48 2jmm s LEU 79 N -0.05 0.50 0.00 -0.88 0.05 0.00 0.03 118.68 118.33 2jmm s LEU 79 Ca -0.03 0.78 0.00 0.00 0.05 0.00 0.00 54.13 54.94 2jmm s LEU 79 Cb -0.12 1.33 0.00 0.00 -2.05 0.00 0.00 46.19 45.35 2jmm s LEU 79 CO 0.02 -0.14 0.00 0.61 -0.55 0.00 0.00 176.35 176.30 2jmm n GLY 80 N 2.93 -0.75 3.07 -3.48 0.00 0.58 0.31 105.19 107.85 2jmm n GLY 80 Ca -0.14 -0.35 -0.12 0.00 0.00 0.00 0.00 46.02 45.41 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 0.00 0.52 -0.09 -0.02 0.00 -0.57 -0.36 107.32 106.81 2jmm s GLY 81 Ca 0.00 -0.84 0.02 0.00 0.00 0.00 0.00 44.72 43.90 2jmm s GLY 81 CO 0.00 -0.91 -0.14 -3.16 0.00 0.00 0.00 173.10 168.89 2jmm s MET 82 N -1.93 2.90 -0.14 2.90 0.23 -1.23 -0.88 119.30 121.13 2jmm s MET 82 Ca -0.07 -0.70 0.00 0.00 -1.03 0.00 0.00 55.69 53.89 2jmm s MET 82 Cb -0.07 -2.48 0.02 0.00 -1.53 0.00 0.00 34.83 30.77 2jmm s MET 82 CO -0.01 0.43 -0.13 0.08 -2.03 0.00 0.00 175.02 173.36 2jmm s VAL 83 N -0.22 1.48 0.09 5.16 1.01 0.72 -3.99 120.40 124.66 2jmm s VAL 83 Ca 0.01 -0.58 0.06 0.00 0.00 0.00 0.00 61.98 61.46 2jmm s VAL 83 Cb -0.13 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.81 2jmm s VAL 83 CO 0.03 0.44 -0.14 -1.66 0.00 0.00 0.00 175.10 173.77 2jmm s TRP 84 N 1.52 1.31 -1.05 5.22 -2.14 -1.26 -0.44 118.94 122.11 2jmm s TRP 84 Ca 0.05 -0.50 -0.08 0.00 2.66 0.00 0.00 56.10 58.23 2jmm s TRP 84 Cb -0.13 -0.72 0.26 0.00 -3.10 0.00 0.00 33.47 29.79 2jmm s TRP 84 CO -0.10 0.09 1.02 0.50 -2.66 0.00 0.00 176.95 175.80 2jmm s ARG 85 N -2.12 3.98 -0.80 3.25 3.52 0.10 -4.85 118.95 122.03 2jmm s ARG 85 Ca 0.03 -3.18 -0.26 0.00 -0.13 0.00 0.00 55.73 52.19 2jmm s ARG 85 Cb -0.08 -4.43 0.02 0.00 -1.56 0.00 0.00 34.95 28.90 2jmm s ARG 85 CO 0.03 -1.25 1.51 0.00 -0.81 0.00 0.00 175.30 174.78 2jmm s ALA 86 N -1.18 2.50 0.44 6.12 0.00 -1.26 -3.96 121.76 124.42 2jmm s ALA 86 Ca 0.29 -1.47 -0.25 0.00 0.00 0.00 0.00 51.96 50.54 2jmm s ALA 86 Cb -0.10 -4.37 -0.08 0.00 0.00 0.00 0.00 23.12 18.58 2jmm s ALA 86 CO -0.09 -3.66 1.29 0.34 0.00 0.00 0.00 175.76 173.63 2jmm s ASP 87 N 5.38 6.09 -0.48 0.00 -1.08 -1.26 -4.90 116.67 120.42 2jmm s ASP 87 Ca 0.48 2.61 -0.28 0.00 -0.52 0.00 0.00 52.55 54.84 2jmm s ASP 87 Cb -0.07 -2.63 -0.09 0.00 -1.46 0.00 0.00 42.92 38.68 2jmm s ASP 87 CO 0.08 -1.00 2.39 0.41 0.52 0.00 0.00 175.17 177.58 2jmm n THR 88 N -0.21 0.02 -1.83 1.71 -1.04 -1.26 -4.94 114.28 106.74 2jmm n THR 88 Ca 0.06 -0.62 -0.38 0.00 -2.04 0.00 0.00 64.05 61.07 2jmm n THR 88 Cb 0.45 -2.44 0.04 0.00 -1.82 0.00 0.00 70.33 66.56 2jmm n THR 88 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2jmm s SER 89 N 10.80 5.22 0.61 8.00 0.15 -1.26 -5.04 113.70 132.18 2jmm s SER 89 Ca 1.03 2.69 -0.18 0.00 0.70 0.00 0.00 55.95 60.19 2jmm s SER 89 Cb -0.37 -2.63 -0.03 0.00 -1.71 0.00 0.00 66.02 61.28 2jmm s SER 89 CO 0.32 -1.59 1.18 -0.62 1.20 0.00 0.00 173.24 173.73 2jmm s ASP 90 N -1.09 5.16 0.40 5.45 2.15 -1.26 -4.87 116.67 122.61 2jmm s ASP 90 Ca 0.73 2.29 0.00 0.00 0.43 0.00 0.00 52.55 56.00 2jmm s ASP 90 Cb -0.39 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.65 2jmm s ASP 90 CO 0.45 -1.61 0.00 1.17 -0.17 0.00 0.00 175.17 175.01 2jmm n LYS 91 N -1.79 -3.08 0.00 4.34 4.81 -1.26 -5.09 118.16 116.10 2jmm n LYS 91 Ca 0.13 2.35 0.00 0.00 -0.87 0.00 0.00 58.31 59.91 2jmm n LYS 91 Cb 0.50 -2.81 0.00 0.00 0.02 0.00 0.00 35.03 32.75 2jmm n LYS 91 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2jmm n ASP 92 N -1.72 0.00 0.00 3.14 2.03 -1.26 -5.11 116.55 113.62 2jmm n ASP 92 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2jmm n ASP 92 Cb 0.20 0.03 0.00 0.00 -0.72 0.00 0.00 41.12 40.63 2jmm n ASP 92 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jmm n GLY 93 N -0.93 2.05 3.91 0.27 0.00 -1.26 -5.03 105.19 104.20 2jmm n GLY 93 Ca 0.00 -0.70 -0.32 0.00 0.00 0.00 0.00 46.02 45.00 2jmm n GLY 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jmm s ASN 94 N -4.00 6.33 -1.12 1.61 4.22 -1.26 -5.00 114.94 115.72 2jmm s ASN 94 Ca 0.00 0.28 -0.25 0.00 -2.14 0.00 0.00 52.86 50.75 2jmm s ASN 94 Cb 0.00 -1.95 -0.16 0.00 1.28 0.00 0.00 41.25 40.42 2jmm s ASN 94 CO 0.00 0.19 2.04 -0.83 -2.04 0.00 0.00 177.10 176.46 2jmm s GLY 95 N -2.37 -0.51 -0.51 0.45 0.00 -1.26 -4.88 107.32 98.24 2jmm s GLY 95 Ca 0.33 -1.78 -0.00 0.00 0.00 0.00 0.00 44.72 43.27 2jmm s GLY 95 CO 0.26 3.94 0.29 -0.19 0.00 0.00 0.00 173.10 177.40 2jmm s TYR 96 N 14.16 3.45 0.02 1.90 1.51 -1.26 -5.08 117.35 132.05 2jmm s TYR 96 Ca 0.75 -2.78 0.08 0.00 -1.01 0.00 0.00 57.07 54.11 2jmm s TYR 96 Cb -0.03 -3.09 -0.02 0.00 -0.11 0.00 0.00 41.96 38.71 2jmm s TYR 96 CO 0.15 -0.87 -0.23 0.96 -1.11 0.00 0.00 175.55 174.46 2jmm s ILE 97 N 0.32 1.82 0.00 2.71 -4.36 -1.26 -5.06 121.20 115.38 2jmm s ILE 97 Ca 0.14 -1.13 0.00 0.00 -0.26 0.00 0.00 60.65 59.39 2jmm s ILE 97 Cb -0.22 -1.55 0.00 0.00 1.25 0.00 0.00 42.46 41.94 2jmm s ILE 97 CO -0.03 0.38 0.00 -0.24 0.24 0.00 0.00 174.94 175.28 2jmm n SER 98 N 2.14 0.00 -1.35 4.36 2.88 -1.26 -5.19 113.62 115.20 2jmm n SER 98 Ca -0.16 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.41 2jmm n SER 98 Cb 0.52 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.97 2jmm n SER 98 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jmm n ALA 99 N -3.00 -2.13 0.09 -1.46 0.00 -1.26 -5.10 120.51 107.65 2jmm n ALA 99 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 53.44 53.96 2jmm n ALA 99 Cb 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.09 2jmm n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jmm n ALA 100 N -2.84 1.02 -2.36 0.00 0.00 -1.26 -5.14 120.51 109.92 2jmm n ALA 100 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.13 2jmm n ALA 100 Cb 0.47 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.76 2jmm n ALA 100 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2jmm s GLU 101 N -1.43 1.83 0.53 0.00 -6.30 -1.26 -5.13 118.70 106.95 2jmm s GLU 101 Ca 0.00 -0.97 -0.21 0.00 -2.50 0.00 0.00 54.97 51.29 2jmm s GLU 101 Cb 0.00 -1.88 -0.05 0.00 0.00 0.00 0.00 34.13 32.20 2jmm s GLU 101 CO 0.00 0.50 1.27 0.00 0.02 0.00 0.00 175.26 177.05 2jmm s ALA 102 N -0.68 2.80 -0.48 6.30 0.00 -1.26 -4.93 121.76 123.51 2jmm s ALA 102 Ca 0.10 1.15 -0.28 0.00 0.00 0.00 0.00 51.96 52.94 2jmm s ALA 102 Cb -0.09 -3.49 -0.01 0.00 0.00 0.00 0.00 23.12 19.52 2jmm s ALA 102 CO 0.00 -1.13 1.69 -1.12 0.00 0.00 0.00 175.76 175.20 2jmm s SER 103 N -1.20 5.80 -1.25 0.00 0.01 -1.26 -4.91 113.70 110.89 2jmm s SER 103 Ca 0.71 0.72 -0.17 0.00 1.31 0.00 0.00 55.95 58.52 2jmm s SER 103 Cb -0.35 -2.53 0.11 0.00 0.21 0.00 0.00 66.02 63.45 2jmm s SER 103 CO 0.41 -1.89 1.61 -0.69 0.41 0.00 0.00 173.24 173.10 2jmm s VAL 104 N 7.22 4.44 0.19 3.43 1.01 -1.26 -4.75 120.40 130.68 2jmm s VAL 104 Ca 0.67 -2.11 -0.31 0.00 0.00 0.00 0.00 61.98 60.23 2jmm s VAL 104 Cb -0.16 -5.09 -0.10 0.00 0.00 0.00 0.00 36.38 31.04 2jmm s VAL 104 CO 0.28 -1.88 1.50 -0.44 0.00 0.00 0.00 175.10 174.56 2jmm s SER 105 N 3.77 6.64 -0.21 3.32 0.01 -1.26 -4.82 113.70 121.14 2jmm s SER 105 Ca 0.49 2.61 -0.29 0.00 1.31 0.00 0.00 55.95 60.07 2jmm s SER 105 Cb 0.01 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.60 2jmm s SER 105 CO 0.04 -0.76 1.79 -2.16 0.41 0.00 0.00 173.24 172.57 2jmm s PRO 106 N 0.51 3.63 -0.19 12.44 0.04 -1.26 -3.52 135.00 146.65 2jmm s PRO 106 Ca 0.65 1.79 -0.01 0.00 0.04 0.00 0.00 61.00 63.47 2jmm s PRO 106 Cb -0.42 -4.14 0.01 0.00 0.04 0.00 0.00 34.50 29.99 2jmm s PRO 106 CO 0.36 -1.50 -0.14 0.08 0.04 0.00 0.00 177.00 175.84 2jmm s VAL 107 N 5.96 2.56 0.04 -0.36 1.01 0.51 -2.72 120.40 127.41 2jmm s VAL 107 Ca 0.80 -0.77 0.08 0.00 0.00 0.00 0.00 61.98 62.09 2jmm s VAL 107 Cb -0.28 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 33.96 2jmm s VAL 107 CO 0.33 0.50 -0.23 0.12 0.00 0.00 0.00 175.10 175.81 2jmm s PHE 108 N 1.34 2.42 -0.04 5.22 5.36 0.40 -0.31 117.98 132.37 2jmm s PHE 108 Ca 0.05 -0.35 -0.01 0.00 -0.96 0.00 0.00 56.93 55.66 2jmm s PHE 108 Cb -0.14 -1.42 0.03 0.00 -0.34 0.00 0.00 43.02 41.15 2jmm s PHE 108 CO -0.09 0.18 0.08 0.00 -1.46 0.00 0.00 175.22 173.93 2jmm s ALA 109 N -0.86 -0.07 -0.08 11.12 0.00 0.10 -0.17 121.76 131.80 2jmm s ALA 109 Ca 0.13 0.43 0.04 0.00 0.00 0.00 0.00 51.96 52.56 2jmm s ALA 109 Cb -0.10 -0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.71 2jmm s ALA 109 CO 0.03 -0.12 -0.20 0.20 0.00 0.00 0.00 175.76 175.67 2jmm s GLY 110 N 1.00 1.14 0.00 0.00 0.00 -0.01 -0.04 107.32 109.41 2jmm s GLY 110 Ca -0.08 -0.79 0.00 0.00 0.00 0.00 0.00 44.72 43.85 2jmm s GLY 110 CO -0.04 -0.20 0.00 0.61 0.00 0.00 0.00 173.10 173.47 2jmm n GLY 111 N 3.57 1.48 3.06 0.20 0.00 -0.29 -0.19 105.19 113.02 2jmm n GLY 111 Ca -0.20 -0.66 -0.17 0.00 0.00 0.00 0.00 46.02 44.99 2jmm n GLY 111 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jmm s VAL 112 N -2.35 0.74 -0.10 1.61 1.01 0.21 -0.49 120.40 121.03 2jmm s VAL 112 Ca 0.00 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.31 2jmm s VAL 112 Cb 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 36.38 35.70 2jmm s VAL 112 CO 0.00 -0.01 -0.22 -0.70 0.00 0.00 0.00 175.10 174.17 2jmm s GLU 113 N -0.79 2.86 -0.19 2.72 2.12 0.30 -1.03 118.70 124.69 2jmm s GLU 113 Ca -0.00 -0.81 -0.10 0.00 0.36 0.00 0.00 54.97 54.42 2jmm s GLU 113 Cb -0.06 -2.20 -0.05 0.00 0.26 0.00 0.00 34.13 32.08 2jmm s GLU 113 CO 0.00 0.12 0.13 -0.47 -0.54 0.00 0.00 175.26 174.50 2jmm s TYR 114 N 0.47 3.42 -0.37 5.30 5.04 0.10 -0.24 117.35 131.07 2jmm s TYR 114 Ca -0.16 0.33 -0.15 0.00 -2.44 0.00 0.00 57.07 54.65 2jmm s TYR 114 Cb -0.17 -2.14 0.00 0.00 0.35 0.00 0.00 41.96 40.00 2jmm s TYR 114 CO 0.06 0.32 0.33 0.14 -1.34 0.00 0.00 175.55 175.07 2jmm s VAL 115 N 0.25 5.20 -0.60 3.14 -7.23 -0.30 -0.84 120.40 120.01 2jmm s VAL 115 Ca 0.08 -0.26 -0.28 0.00 -1.81 0.00 0.00 61.98 59.72 2jmm s VAL 115 Cb -0.11 -3.86 -0.11 0.00 0.56 0.00 0.00 36.38 32.85 2jmm s VAL 115 CO -0.01 -0.19 2.47 0.00 -0.31 0.00 0.00 175.10 177.06 2jmm n ILE 116 N 5.23 -0.04 -0.06 -0.62 0.00 -1.26 -4.77 119.36 117.83 2jmm n ILE 116 Ca -0.10 -0.56 -0.07 0.00 0.00 0.00 0.00 62.75 62.01 2jmm n ILE 116 Cb 0.48 -2.16 -0.09 0.00 0.00 0.00 0.00 39.64 37.88 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 8.83 1.62 0.32 9.51 0.63 -1.26 -4.40 116.66 131.91 2jmm n ARG 117 Ca 0.44 0.02 0.17 0.00 -0.92 0.00 0.00 57.85 57.56 2jmm n ARG 117 Cb 0.40 -1.31 0.88 0.00 0.45 0.00 0.00 32.46 32.88 2jmm n ARG 117 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 2jmm h ARG 118 N 0.00 0.00 -5.64 -0.14 2.43 -1.97 -3.40 114.38 105.66 2jmm h ARG 118 Ca -0.33 0.00 -0.51 0.00 -0.81 0.00 0.00 59.98 58.33 2jmm h ARG 118 Cb 1.68 0.00 -0.26 0.00 -0.42 0.00 0.00 29.97 30.97 2jmm h ARG 118 CO -0.00 0.00 -0.82 0.50 -1.51 0.00 0.00 179.97 178.14 2jmm s ARG 119 N -4.16 1.18 0.30 0.20 3.00 -1.26 -5.13 118.95 113.09 2jmm s ARG 119 Ca -0.04 -0.78 -0.30 0.00 -1.00 0.00 0.00 55.73 53.61 2jmm s ARG 119 Cb 0.10 -1.21 -0.12 0.00 0.00 0.00 0.00 34.95 33.71 2jmm s ARG 119 CO 0.32 0.31 1.48 -0.89 0.00 0.00 0.00 175.30 176.52 2jmm n ILE 120 N 2.05 1.34 -2.39 4.11 -0.00 -1.26 -4.24 119.36 118.98 2jmm n ILE 120 Ca -0.17 -0.34 -0.01 0.00 -0.00 0.00 0.00 62.75 62.24 2jmm n ILE 120 Cb 0.54 -1.78 -0.01 0.00 -0.00 0.00 0.00 39.64 38.39 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 1.48 -9.75 -1.97 1.39 -1.04 -1.26 -4.98 114.28 98.15 2jmm n THR 121 Ca 0.07 1.55 -0.41 0.00 -2.04 0.00 0.00 64.05 63.22 2jmm n THR 121 Cb 0.36 -6.11 -0.02 0.00 -1.82 0.00 0.00 70.33 62.73 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 -1.12 4.24 0.00 -2.82 0.04 -1.26 -4.96 135.00 129.12 2jmm s PRO 122 Ca -0.05 2.35 0.00 0.00 0.04 0.00 0.00 61.00 63.34 2jmm s PRO 122 Cb 0.00 -3.11 0.00 0.00 0.04 0.00 0.00 34.50 31.44 2jmm s PRO 122 CO 0.59 -0.48 0.00 -1.91 0.04 0.00 0.00 177.00 175.24 2jmm n GLU 123 N 2.58 0.00 -4.54 4.56 2.13 -1.26 -5.11 120.64 119.00 2jmm n GLU 123 Ca 0.08 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.60 2jmm n GLU 123 Cb 0.40 0.00 -0.12 0.00 0.27 0.00 0.00 31.44 31.98 2jmm n GLU 123 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 2jmm s ILE 124 N 0.00 2.78 0.11 6.31 1.01 -1.26 -4.87 121.20 125.28 2jmm s ILE 124 Ca 0.00 -1.31 0.04 0.00 0.00 0.00 0.00 60.65 59.38 2jmm s ILE 124 Cb 0.00 -2.21 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 2jmm s ILE 124 CO 0.00 0.25 0.09 0.00 0.00 0.00 0.00 174.94 175.28 2jmm s ALA 125 N -1.00 3.53 -0.26 9.38 0.00 0.73 -4.53 121.76 129.61 2jmm s ALA 125 Ca 0.16 -1.10 -0.11 0.00 0.00 0.00 0.00 51.96 50.92 2jmm s ALA 125 Cb -0.10 -1.37 -0.05 0.00 0.00 0.00 0.00 23.12 21.59 2jmm s ALA 125 CO 0.07 0.66 0.17 0.99 0.00 0.00 0.00 175.76 177.65 2jmm s THR 126 N -1.50 5.28 -0.11 0.00 2.01 -0.02 -0.38 115.64 120.91 2jmm s THR 126 Ca 0.29 0.16 0.03 0.00 0.31 0.00 0.00 61.69 62.48 2jmm s THR 126 Cb -0.11 -3.49 0.01 0.00 0.01 0.00 0.00 72.50 68.91 2jmm s THR 126 CO 0.22 0.30 -0.22 -0.60 -0.69 0.00 0.00 174.62 173.63 2jmm s ARG 127 N 1.39 2.90 -0.12 4.92 3.52 0.43 0.02 118.95 132.01 2jmm s ARG 127 Ca 0.07 -0.82 -0.00 0.00 -0.13 0.00 0.00 55.73 54.85 2jmm s ARG 127 Cb -0.15 -2.27 0.03 0.00 -1.56 0.00 0.00 34.95 31.00 2jmm s ARG 127 CO 0.07 0.09 -0.08 -0.51 -0.81 0.00 0.00 175.30 174.06 2jmm s LEU 128 N 0.57 1.27 0.03 -0.88 1.02 -0.20 -0.86 118.68 119.63 2jmm s LEU 128 Ca -0.14 -0.36 0.03 0.00 0.02 0.00 0.00 54.13 53.69 2jmm s LEU 128 Cb -0.17 -0.88 -0.02 0.00 0.02 0.00 0.00 46.19 45.14 2jmm s LEU 128 CO 0.04 -0.12 -0.09 -1.83 0.02 0.00 0.00 176.35 174.37 2jmm s GLU 129 N 1.68 0.62 -0.26 1.70 -1.05 0.58 -0.62 118.70 121.35 2jmm s GLU 129 Ca 0.05 -0.57 -0.10 0.00 -0.15 0.00 0.00 54.97 54.20 2jmm s GLU 129 Cb -0.13 -0.53 -0.05 0.00 -0.44 0.00 0.00 34.13 32.99 2jmm s GLU 129 CO -0.08 0.13 0.15 0.71 0.95 0.00 0.00 175.26 177.11 2jmm s TYR 130 N -0.81 3.22 -0.20 4.83 1.51 0.74 -0.63 117.35 126.01 2jmm s TYR 130 Ca -0.03 0.05 -0.04 0.00 -1.01 0.00 0.00 57.07 56.05 2jmm s TYR 130 Cb -0.07 -2.30 -0.01 0.00 -0.11 0.00 0.00 41.96 39.47 2jmm s TYR 130 CO 0.00 -0.11 -0.05 -1.14 -1.11 0.00 0.00 175.55 173.14 2jmm s GLN 131 N 1.44 3.43 0.05 -0.62 -0.44 0.84 -0.83 119.66 123.52 2jmm s GLN 131 Ca 0.07 -0.61 0.07 0.00 -2.50 0.00 0.00 55.36 52.39 2jmm s GLN 131 Cb -0.15 -2.96 -0.03 0.00 -1.64 0.00 0.00 33.01 28.23 2jmm s GLN 131 CO 0.07 -0.09 -0.21 -0.46 0.50 0.00 0.00 175.29 175.10 2jmm s TRP 132 N 1.21 1.83 -0.02 1.67 -0.11 0.76 -1.27 118.94 123.01 2jmm s TRP 132 Ca 0.02 -0.38 0.05 0.00 1.22 0.00 0.00 56.10 57.02 2jmm s TRP 132 Cb -0.14 -1.09 -0.01 0.00 -1.50 0.00 0.00 33.47 30.73 2jmm s TRP 132 CO -0.01 0.10 -0.18 -0.08 -4.62 0.00 0.00 176.95 172.16 2jmm s THR 133 N -0.83 1.43 -1.20 5.86 -1.32 -1.26 -0.46 115.64 117.86 2jmm s THR 133 Ca 0.08 -0.76 -0.18 0.00 -1.21 0.00 0.00 61.69 59.62 2jmm s THR 133 Cb -0.09 -1.20 -0.03 0.00 -1.51 0.00 0.00 72.50 69.67 2jmm s THR 133 CO 0.02 0.41 2.01 -3.20 -2.21 0.00 0.00 174.62 171.64 2jmm n ASN 134 N 2.80 3.60 -4.19 8.08 5.15 -1.10 -4.87 115.26 124.73 2jmm n ASN 134 Ca -0.16 -2.79 -0.16 0.00 -0.60 0.00 0.00 54.58 50.87 2jmm n ASN 134 Cb 0.53 -1.53 -0.11 0.00 -0.53 0.00 0.00 39.78 38.14 2jmm n ASN 134 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 2jmm s ASN 135 N 4.33 1.66 -1.08 1.20 3.84 -1.26 -4.84 114.94 118.79 2jmm s ASN 135 Ca 0.54 -0.77 -0.22 0.00 0.21 0.00 0.00 52.86 52.62 2jmm s ASN 135 Cb 0.10 -0.03 -0.01 0.00 -0.55 0.00 0.00 41.25 40.76 2jmm s ASN 135 CO 0.03 -0.19 1.78 0.00 -2.79 0.00 0.00 177.10 175.94 2jmm s ALA 136 N -2.10 2.26 -0.10 1.71 0.00 -1.26 -4.77 121.76 117.50 2jmm s ALA 136 Ca 0.05 -2.12 -0.33 0.00 0.00 0.00 0.00 51.96 49.56 2jmm s ALA 136 Cb -0.05 -4.60 0.12 0.00 0.00 0.00 0.00 23.12 18.60 2jmm s ALA 136 CO 0.01 -4.34 1.17 0.45 0.00 0.00 0.00 175.76 173.05 2jmm s SER 137 N 6.19 -0.15 0.51 0.00 0.15 -1.26 -5.00 113.70 114.13 2jmm s SER 137 Ca 0.61 -0.06 0.23 0.00 0.70 0.00 0.00 55.95 57.43 2jmm s SER 137 Cb -0.02 0.20 1.36 0.00 -1.71 0.00 0.00 66.02 65.85 2jmm s SER 137 CO 0.02 -0.34 2.08 -0.78 1.20 0.00 0.00 173.24 175.42 2jmm h ASP 138 N 2.00 0.00 0.00 5.45 3.58 -1.99 -3.48 116.42 121.98 2jmm h ASP 138 Ca -0.17 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.28 2jmm h ASP 138 Cb 1.19 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.24 2jmm h ASP 138 CO 0.25 0.12 0.00 0.59 -2.88 0.00 0.00 179.24 177.32 2jmm n ASN 139 N -3.95 0.00 -3.19 2.28 3.02 -1.26 -4.93 115.26 107.23 2jmm n ASN 139 Ca -0.02 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.39 2jmm n ASN 139 Cb 0.21 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.39 2jmm n ASN 139 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jmm n GLY 140 N 0.00 -0.74 3.37 7.41 0.00 -1.26 -4.93 105.19 109.04 2jmm n GLY 140 Ca 0.00 0.60 -0.32 0.00 0.00 0.00 0.00 46.02 46.30 2jmm n GLY 140 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2jmm s MET 141 N -1.75 2.37 -0.33 1.61 -1.94 -0.40 -3.51 119.30 115.35 2jmm s MET 141 Ca 0.16 -0.82 -0.04 0.00 -1.71 0.00 0.00 55.69 53.27 2jmm s MET 141 Cb -0.02 -2.21 0.05 0.00 2.01 0.00 0.00 34.83 34.66 2jmm s MET 141 CO 0.49 0.55 0.07 -0.51 -0.01 0.00 0.00 175.02 175.61 2jmm s LEU 142 N -0.56 4.22 -0.19 -0.03 1.02 0.50 -0.11 118.68 123.52 2jmm s LEU 142 Ca 0.08 -1.29 -0.05 0.00 0.02 0.00 0.00 54.13 52.90 2jmm s LEU 142 Cb -0.11 -1.80 -0.02 0.00 0.02 0.00 0.00 46.19 44.28 2jmm s LEU 142 CO 0.00 -0.32 -0.01 -0.44 0.02 0.00 0.00 176.35 175.60 2jmm s SER 143 N 1.39 4.76 -0.06 2.29 0.01 0.20 -0.37 113.70 121.92 2jmm s SER 143 Ca -0.02 -0.21 -0.12 0.00 1.31 0.00 0.00 55.95 56.91 2jmm s SER 143 Cb -0.20 -1.81 0.02 0.00 0.21 0.00 0.00 66.02 64.25 2jmm s SER 143 CO 0.00 0.08 0.28 -1.48 0.41 0.00 0.00 173.24 172.53 2jmm s LEU 144 N 0.92 0.96 0.00 2.44 0.05 -0.09 -0.31 118.68 122.66 2jmm s LEU 144 Ca 0.01 0.28 0.00 0.00 0.05 0.00 0.00 54.13 54.47 2jmm s LEU 144 Cb -0.14 1.06 0.00 0.00 -2.05 0.00 0.00 46.19 45.06 2jmm s LEU 144 CO 0.02 -0.27 0.00 0.61 -0.55 0.00 0.00 176.35 176.15 2jmm n GLY 145 N 2.08 -0.73 3.17 -3.48 0.00 -0.04 -0.30 105.19 105.89 2jmm n GLY 145 Ca -0.18 -0.67 -0.30 0.00 0.00 0.00 0.00 46.02 44.88 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 -3.00 1.81 0.04 1.61 -7.23 -0.23 -0.43 120.40 112.97 2jmm s VAL 146 Ca 0.00 -0.88 0.05 0.00 -1.81 0.00 0.00 61.98 59.34 2jmm s VAL 146 Cb 0.00 -1.58 -0.02 0.00 0.56 0.00 0.00 36.38 35.34 2jmm s VAL 146 CO 0.00 0.51 -0.14 -0.94 -0.31 0.00 0.00 175.10 174.22 2jmm s SER 147 N 0.38 1.63 -0.21 4.85 1.04 0.49 -0.73 113.70 121.14 2jmm s SER 147 Ca -0.17 -0.48 -0.01 0.00 0.48 0.00 0.00 55.95 55.77 2jmm s SER 147 Cb -0.17 -0.09 0.01 0.00 0.10 0.00 0.00 66.02 65.87 2jmm s SER 147 CO 0.07 0.01 -0.11 -0.47 0.98 0.00 0.00 173.24 173.72 2jmm s TYR 148 N -0.91 2.91 -0.20 5.02 5.04 0.11 -0.19 117.35 129.14 2jmm s TYR 148 Ca 0.01 -1.36 -0.00 0.00 -2.44 0.00 0.00 57.07 53.27 2jmm s TYR 148 Cb -0.08 -2.02 0.02 0.00 0.35 0.00 0.00 41.96 40.23 2jmm s TYR 148 CO 0.01 -0.69 -0.15 0.50 -1.34 0.00 0.00 175.55 173.88 2jmm s ARG 149 N 1.37 3.04 0.00 4.97 3.00 -1.26 -0.60 118.95 129.47 2jmm s ARG 149 Ca 0.04 -0.81 0.00 0.00 -1.00 0.00 0.00 55.73 53.96 2jmm s ARG 149 Cb -0.14 -2.71 0.00 0.00 0.00 0.00 0.00 34.95 32.10 2jmm s ARG 149 CO -0.07 -0.23 0.00 0.34 0.00 0.00 0.00 175.30 175.33 2jmm n PHE 150 N 4.66 0.00 0.00 5.12 7.35 0.98 -4.95 117.46 130.61 2jmm n PHE 150 Ca -0.20 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.49 2jmm n PHE 150 Cb 0.50 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.33 2jmm n PHE 150 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2jmm n GLY 151 N 0.00 4.47 2.97 7.13 0.00 -1.26 -0.25 105.19 118.25 2jmm n GLY 151 Ca 0.00 -1.40 -0.20 0.00 0.00 0.00 0.00 46.02 44.42 2jmm n GLY 151 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2jmm n GLN 152 N -1.98 -3.40 -4.57 1.61 6.02 -1.26 -4.96 117.38 108.84 2jmm n GLN 152 Ca 0.00 0.66 -0.34 0.00 -0.01 0.00 0.00 57.00 57.31 2jmm n GLN 152 Cb 0.00 -5.38 -0.12 0.00 1.02 0.00 0.00 30.24 25.76 2jmm n GLN 152 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2jmm s GLY 153 N -2.50 1.69 -0.19 1.08 0.00 -1.26 -5.04 107.32 101.10 2jmm s GLY 153 Ca 0.25 -0.87 -0.15 0.00 0.00 0.00 0.00 44.72 43.94 2jmm s GLY 153 CO 0.30 -0.46 -0.24 -2.21 0.00 0.00 0.00 173.10 170.49 2jmm n GLU 154 N 2.69 0.53 -1.44 2.90 2.13 -1.26 -5.14 120.64 121.05 2jmm n GLU 154 Ca -0.18 0.35 0.18 0.00 0.66 0.00 0.00 57.16 58.17 2jmm n GLU 154 Cb 0.53 -1.55 -0.09 0.00 0.27 0.00 0.00 31.44 30.60 2jmm n GLU 154 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2jmm n ALA 155 N -4.08 -3.77 0.07 4.31 0.00 -1.26 -5.29 120.51 110.50 2jmm n ALA 155 Ca -0.23 0.85 0.01 0.00 0.00 0.00 0.00 53.44 54.07 2jmm n ALA 155 Cb 0.55 -1.53 0.01 0.00 0.00 0.00 0.00 19.45 18.48 2jmm n ALA 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50