#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmd s PRO 2 N 0.00 3.70 0.11 1.61 0.04 -1.26 -4.98 135.00 134.22 2jmd s PRO 2 Ca 0.00 1.37 -0.19 0.00 0.04 0.00 0.00 61.00 62.22 2jmd s PRO 2 Cb 0.00 -2.08 -0.07 0.00 0.04 0.00 0.00 34.50 32.40 2jmd s PRO 2 CO 0.00 -0.52 1.67 1.25 0.04 0.00 0.00 177.00 179.44 2jmd h LEU 3 N 1.39 0.33 0.00 -3.56 5.85 -2.10 -3.47 115.31 113.75 2jmd h LEU 3 Ca -0.49 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.09 2jmd h LEU 3 Cb 1.22 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.17 2jmd h LEU 3 CO 0.59 0.37 0.00 0.61 -0.34 0.00 0.00 178.44 179.67 2jmd n GLY 4 N -0.80 3.36 2.76 3.75 0.00 -1.26 -4.30 105.19 108.70 2jmd n GLY 4 Ca -0.03 -0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 2jmd n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jmd s SER 5 N -4.00 1.44 0.40 1.61 0.01 -1.26 -5.15 113.70 106.75 2jmd s SER 5 Ca 0.00 -0.05 0.04 0.00 1.31 0.00 0.00 55.95 57.24 2jmd s SER 5 Cb 0.00 -0.38 -0.04 0.00 0.21 0.00 0.00 66.02 65.81 2jmd s SER 5 CO 0.00 -0.20 0.07 -1.59 0.41 0.00 0.00 173.24 171.93 2jmd s LYS 6 N 1.94 1.88 -0.36 12.44 -2.85 -1.26 -5.04 119.74 126.48 2jmd s LYS 6 Ca 0.04 -2.11 0.07 0.00 -1.00 0.00 0.00 55.97 52.97 2jmd s LYS 6 Cb -0.12 -0.97 0.59 0.00 -2.06 0.00 0.00 37.83 35.27 2jmd s LYS 6 CO -0.05 -0.31 1.68 0.66 0.10 0.00 0.00 175.35 177.44 2jmd n TYR 7 N -0.89 2.04 -3.64 1.78 4.01 -1.26 -4.87 117.16 114.33 2jmd n TYR 7 Ca -0.07 -1.69 -0.37 0.00 -0.16 0.00 0.00 57.90 55.61 2jmd n TYR 7 Cb 0.66 -0.70 -0.06 0.00 -0.31 0.00 0.00 39.34 38.92 2jmd n TYR 7 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 2jmd s GLU 8 N -3.26 3.88 -0.51 -0.72 2.12 -1.26 -3.38 118.70 115.57 2jmd s GLU 8 Ca 0.51 0.13 -0.24 0.00 0.36 0.00 0.00 54.97 55.72 2jmd s GLU 8 Cb 0.44 -3.28 0.04 0.00 0.26 0.00 0.00 34.13 31.59 2jmd s GLU 8 CO 0.05 0.57 0.91 0.00 -0.54 0.00 0.00 175.26 176.25 2jmd h PRO 10 N 9.19 0.00 -0.40 0.00 0.11 -1.92 0.36 132.00 139.34 2jmd h PRO 10 Ca -0.25 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.80 2jmd h PRO 10 Cb 1.08 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2jmd h PRO 10 CO 1.05 0.01 0.01 0.82 -0.21 0.00 0.00 178.00 179.68 2jmd h ILE 11 N 0.00 1.26 0.00 4.15 2.04 -1.96 -3.26 117.51 119.73 2jmd h ILE 11 Ca -0.00 -0.98 -0.04 0.00 1.00 0.00 0.00 64.86 64.84 2jmd h ILE 11 Cb 0.17 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 2jmd h ILE 11 CO 0.00 0.33 -1.99 0.00 0.00 0.00 0.00 178.15 176.50 2jmd n LEU 13 N -2.28 -1.61 0.00 0.00 4.77 0.12 -4.88 117.00 113.12 2jmd n LEU 13 Ca -0.07 0.39 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 2jmd n LEU 13 Cb 0.61 -2.87 0.00 0.00 -2.33 0.00 0.00 43.42 38.83 2jmd n LEU 13 CO 0.43 -0.88 0.00 0.23 -1.33 0.00 0.00 177.39 175.84 2jmd n MET 14 N -2.54 0.00 -1.63 3.23 2.81 -1.25 -4.96 117.12 112.77 2jmd n MET 14 Ca -0.22 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.69 2jmd n MET 14 Cb 0.68 -0.44 0.00 0.00 -0.71 0.00 0.00 33.22 32.75 2jmd n MET 14 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2jmd n ALA 15 N -2.31 0.00 -2.63 3.04 0.00 -1.26 -4.81 120.51 112.55 2jmd n ALA 15 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 2jmd n ALA 15 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 2jmd n ALA 15 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2jmd s LEU 16 N 0.00 5.06 0.04 0.00 1.43 -1.22 -3.46 118.68 120.53 2jmd s LEU 16 Ca 0.00 -0.88 -0.24 0.00 -1.03 0.00 0.00 54.13 51.98 2jmd s LEU 16 Cb 0.00 -2.35 -0.17 0.00 0.03 0.00 0.00 46.19 43.71 2jmd s LEU 16 CO 0.00 -0.66 1.50 -0.09 0.23 0.00 0.00 176.35 177.34 2jmd h ARG 17 N 8.79 0.04 0.00 1.70 9.65 -1.95 -3.37 114.38 129.24 2jmd h ARG 17 Ca -0.27 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.60 2jmd h ARG 17 Cb 1.11 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.68 2jmd h ARG 17 CO 0.85 0.28 -0.80 0.39 2.80 0.00 0.00 179.97 183.48 2jmd n GLU 18 N -4.94 2.28 -3.18 0.20 -0.58 -1.26 -5.00 120.64 108.15 2jmd n GLU 18 Ca -0.07 -0.02 -0.15 0.00 -0.42 0.00 0.00 57.16 56.49 2jmd n GLU 18 Cb 0.15 -0.94 0.01 0.00 -0.57 0.00 0.00 31.44 30.09 2jmd n GLU 18 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2jmd n ALA 19 N -1.43 -2.70 -2.94 0.62 0.00 -1.22 -4.92 120.51 107.92 2jmd n ALA 19 Ca -0.00 0.50 -0.38 0.00 0.00 0.00 0.00 53.44 53.56 2jmd n ALA 19 Cb 0.09 -2.45 -0.12 0.00 0.00 0.00 0.00 19.45 16.98 2jmd n ALA 19 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2jmd s VAL 20 N -2.51 4.49 0.00 0.00 -7.23 -0.02 -4.91 120.40 110.21 2jmd s VAL 20 Ca 0.18 -0.35 -0.30 0.00 -1.81 0.00 0.00 61.98 59.70 2jmd s VAL 20 Cb -0.04 -3.23 -0.05 0.00 0.56 0.00 0.00 36.38 33.62 2jmd s VAL 20 CO 0.81 0.15 1.34 -1.58 -0.31 0.00 0.00 175.10 175.51 2jmd s GLN 21 N 1.61 4.31 0.41 4.82 2.00 -1.26 -2.30 119.66 129.25 2jmd s GLN 21 Ca 0.05 1.90 -0.04 0.00 -2.00 0.00 0.00 55.36 55.27 2jmd s GLN 21 Cb -0.16 -3.53 -0.04 0.00 0.80 0.00 0.00 33.01 30.08 2jmd s GLN 21 CO 0.05 -0.52 0.69 0.95 -0.50 0.00 0.00 175.29 175.97 2jmd s THR 22 N 2.17 4.96 0.43 -0.34 -4.23 0.87 -4.61 115.64 114.89 2jmd s THR 22 Ca 0.62 0.05 0.34 0.00 -1.18 0.00 0.00 61.69 61.52 2jmd s THR 22 Cb -0.30 -3.83 0.36 0.00 1.34 0.00 0.00 72.50 70.06 2jmd s THR 22 CO 0.26 -0.67 2.15 1.55 -0.54 0.00 0.00 174.62 177.36 2jmd h PRO 23 N 0.66 0.00 0.02 3.99 0.13 -1.88 -2.88 132.00 132.03 2jmd h PRO 23 Ca -0.48 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.55 2jmd h PRO 23 Cb 1.20 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.34 2jmd h PRO 23 CO 0.62 0.06 -0.42 0.00 -0.23 0.00 0.00 178.00 178.03 2jmd n GLY 25 N 1.16 0.37 3.13 0.00 0.00 -1.09 -5.17 105.19 103.59 2jmd n GLY 25 Ca -0.10 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.83 2jmd n GLY 25 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2jmd s HIS 26 N -0.08 0.73 -0.03 1.61 3.76 -1.26 -4.97 115.29 115.05 2jmd s HIS 26 Ca 0.00 -1.17 0.05 0.00 -0.15 0.00 0.00 55.06 53.80 2jmd s HIS 26 Cb 0.00 -0.45 -0.01 0.00 1.11 0.00 0.00 32.58 33.23 2jmd s HIS 26 CO 0.00 -0.46 -0.19 1.03 -0.85 0.00 0.00 174.74 174.27 2jmd s ARG 27 N -3.99 1.77 0.23 1.40 0.52 -1.26 -0.09 118.95 117.53 2jmd s ARG 27 Ca 0.17 -0.68 0.01 0.00 -0.52 0.00 0.00 55.73 54.71 2jmd s ARG 27 Cb 0.08 -1.61 -0.05 0.00 0.52 0.00 0.00 34.95 33.89 2jmd s ARG 27 CO -0.03 0.34 0.09 -0.06 0.02 0.00 0.00 175.30 175.66 2jmd s PHE 28 N -0.23 1.41 0.37 -0.53 0.08 -0.97 -4.39 117.98 113.73 2jmd s PHE 28 Ca 0.02 -1.19 -0.24 0.00 0.12 0.00 0.00 56.93 55.64 2jmd s PHE 28 Cb -0.10 -0.80 -0.10 0.00 -0.57 0.00 0.00 43.02 41.45 2jmd s PHE 28 CO 0.01 -0.37 0.95 0.00 -0.10 0.00 0.00 175.22 175.71 2jmd n LYS 30 N -0.01 0.47 -0.00 0.00 4.81 -1.26 -1.66 118.16 120.50 2jmd n LYS 30 Ca 0.04 0.05 0.04 0.00 -0.87 0.00 0.00 58.31 57.57 2jmd n LYS 30 Cb 0.52 -1.50 -0.06 0.00 0.02 0.00 0.00 35.03 34.01 2jmd n LYS 30 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2jmd n ALA 31 N -1.18 2.41 -0.05 3.14 0.00 -1.26 -4.01 120.51 119.56 2jmd n ALA 31 Ca 0.13 -0.20 -0.19 0.00 0.00 0.00 0.00 53.44 53.18 2jmd n ALA 31 Cb 0.14 -0.28 -0.13 0.00 0.00 0.00 0.00 19.45 19.18 2jmd n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jmd h ILE 33 N -0.78 1.29 -0.64 0.00 6.09 -1.56 -2.84 117.51 119.08 2jmd h ILE 33 Ca -0.21 -1.35 -0.04 0.00 -1.37 0.00 0.00 64.86 61.89 2jmd h ILE 33 Cb 1.35 1.39 -0.03 0.00 0.47 0.00 0.00 36.82 40.00 2jmd h ILE 33 CO -0.05 0.44 0.24 0.40 -3.07 0.00 0.00 178.15 176.11 2jmd h ILE 34 N 0.55 1.24 0.00 2.19 2.04 -1.77 -0.55 117.51 121.21 2jmd h ILE 34 Ca 0.07 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 65.16 2jmd h ILE 34 Cb 0.77 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 2jmd h ILE 34 CO 0.06 0.30 0.00 1.17 0.00 0.00 0.00 178.15 179.68 2jmd n LYS 35 N -4.41 0.69 -0.03 2.37 3.00 -1.19 -0.72 118.16 117.86 2jmd n LYS 35 Ca 0.04 0.01 0.01 0.00 -0.00 0.00 0.00 58.31 58.38 2jmd n LYS 35 Cb 0.18 -1.50 -0.11 0.00 0.00 0.00 0.00 35.03 33.60 2jmd n LYS 35 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 2jmd n SER 36 N -1.10 1.67 -0.02 3.14 7.64 -0.70 -4.68 113.62 119.56 2jmd n SER 36 Ca 0.18 0.00 0.05 0.00 1.01 0.00 0.00 58.87 60.11 2jmd n SER 36 Cb 0.14 1.32 -0.13 0.00 -1.01 0.00 0.00 64.21 64.53 2jmd n SER 36 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 2jmd n ILE 37 N -2.21 0.18 0.56 0.44 -5.35 -0.30 -3.42 119.36 109.26 2jmd n ILE 37 Ca -0.11 -0.42 0.13 0.00 -0.27 0.00 0.00 62.75 62.08 2jmd n ILE 37 Cb 0.62 -0.00 0.39 0.00 -1.74 0.00 0.00 39.64 38.90 2jmd n ILE 37 CO 0.00 0.00 0.00 0.08 -1.76 0.00 0.00 176.55 174.87 2jmd h ARG 38 N 0.00 0.00 0.00 6.28 0.11 -1.17 -3.02 114.38 116.58 2jmd h ARG 38 Ca -0.07 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.01 2jmd h ARG 38 Cb 0.96 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.04 2jmd h ARG 38 CO 0.00 0.00 -0.56 -3.47 0.10 0.00 0.00 179.97 176.05 2jmd n ASP 39 N -2.37 0.37 0.15 0.08 2.03 -1.26 -4.91 116.55 110.64 2jmd n ASP 39 Ca 0.05 0.07 -0.06 0.00 0.52 0.00 0.00 54.79 55.37 2jmd n ASP 39 Cb 0.42 -0.10 -0.03 0.00 -0.72 0.00 0.00 41.12 40.70 2jmd n ASP 39 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jmd h ALA 40 N 0.00 -0.75 -1.43 -1.67 0.00 -1.76 -3.48 119.26 110.17 2jmd h ALA 40 Ca 0.00 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 54.92 2jmd h ALA 40 Cb 0.56 0.16 -0.28 0.00 0.00 0.00 0.00 17.79 18.22 2jmd h ALA 40 CO 0.00 -0.72 0.59 0.20 0.00 0.00 0.00 179.25 179.32 2jmd s GLY 41 N -1.92 0.02 -1.48 0.00 0.00 -1.22 -5.04 107.32 97.69 2jmd s GLY 41 Ca -0.06 2.97 -0.13 0.00 0.00 0.00 0.00 44.72 47.50 2jmd s GLY 41 CO 0.18 1.90 2.42 1.42 0.00 0.00 0.00 173.10 179.02 2jmd n HIS 42 N 2.06 3.14 -3.73 1.90 8.25 -1.14 -4.10 115.22 121.60 2jmd n HIS 42 Ca -0.12 -2.96 -0.11 0.00 -0.26 0.00 0.00 57.72 54.27 2jmd n HIS 42 Cb 0.56 -2.50 -0.07 0.00 1.12 0.00 0.00 29.99 29.10 2jmd n HIS 42 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 2jmd s LYS 43 N 2.98 0.87 0.16 -0.41 -2.85 -1.25 -1.70 119.74 117.53 2jmd s LYS 43 Ca 0.54 -0.53 -0.31 0.00 -1.00 0.00 0.00 55.97 54.66 2jmd s LYS 43 Cb 0.15 0.38 -0.10 0.00 -2.06 0.00 0.00 37.83 36.20 2jmd s LYS 43 CO -0.07 -0.29 1.57 0.00 0.10 0.00 0.00 175.35 176.65 2jmd h PRO 45 N 6.92 0.00 0.00 0.00 0.13 -1.93 -1.04 132.00 136.08 2jmd h PRO 45 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2jmd h PRO 45 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2jmd h PRO 45 CO 0.91 0.05 0.00 0.28 -0.23 0.00 0.00 178.00 179.02 2jmd n VAL 46 N -3.29 0.00 0.77 1.56 0.31 -1.26 -4.63 118.33 111.80 2jmd n VAL 46 Ca -0.01 0.27 0.11 0.00 -0.01 0.00 0.00 64.34 64.70 2jmd n VAL 46 Cb 0.23 -0.95 0.28 0.00 -0.91 0.00 0.00 33.84 32.49 2jmd n VAL 46 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2jmd n ASP 47 N -1.53 2.61 -2.85 4.52 5.75 -1.26 -4.95 116.55 118.84 2jmd n ASP 47 Ca 0.00 -1.87 -0.19 0.00 -0.01 0.00 0.00 54.79 52.72 2jmd n ASP 47 Cb 0.00 -0.17 0.01 0.00 -1.03 0.00 0.00 41.12 39.92 2jmd n ASP 47 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2jmd n ASN 48 N 0.95 -4.79 -4.89 -1.12 3.02 -0.39 -4.94 115.26 103.10 2jmd n ASN 48 Ca 0.18 -0.13 -0.29 0.00 -0.03 0.00 0.00 54.58 54.30 2jmd n ASN 48 Cb 0.48 -3.96 -0.03 0.00 -0.61 0.00 0.00 39.78 35.66 2jmd n ASN 48 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2jmd s GLU 49 N -5.50 3.71 -0.10 3.52 0.41 -1.26 -4.68 118.70 114.80 2jmd s GLU 49 Ca 0.20 0.28 -0.29 0.00 -0.41 0.00 0.00 54.97 54.75 2jmd s GLU 49 Cb -0.10 -2.48 -0.05 0.00 -1.78 0.00 0.00 34.13 29.72 2jmd s GLU 49 CO 0.24 0.03 1.76 0.42 -0.49 0.00 0.00 175.26 177.23 2jmd s ILE 50 N -2.31 3.45 -0.14 -1.63 1.09 -1.26 -0.44 121.20 119.95 2jmd s ILE 50 Ca 0.48 0.52 0.01 0.00 -1.10 0.00 0.00 60.65 60.56 2jmd s ILE 50 Cb -0.10 -3.40 0.02 0.00 -1.06 0.00 0.00 42.46 37.92 2jmd s ILE 50 CO 0.32 -0.11 -0.15 -0.22 -0.10 0.00 0.00 174.94 174.68 2jmd s LEU 51 N 4.94 1.73 0.02 2.97 0.20 -0.69 -4.87 118.68 122.98 2jmd s LEU 51 Ca 0.79 -0.48 0.04 0.00 0.69 0.00 0.00 54.13 55.16 2jmd s LEU 51 Cb -0.33 -1.18 -0.03 0.00 -0.43 0.00 0.00 46.19 44.22 2jmd s LEU 51 CO 0.32 -0.03 -0.07 -0.76 -0.29 0.00 0.00 176.35 175.52 2jmd s LEU 52 N 1.34 3.13 0.29 -0.68 1.43 -1.26 -3.83 118.68 119.10 2jmd s LEU 52 Ca 0.02 -0.19 -0.00 0.00 -1.03 0.00 0.00 54.13 52.93 2jmd s LEU 52 Cb -0.13 -1.82 0.42 0.00 0.03 0.00 0.00 46.19 44.69 2jmd s LEU 52 CO -0.08 0.26 1.81 -0.33 0.23 0.00 0.00 176.35 178.24 2jmd h GLU 53 N 4.36 0.74 -0.14 1.70 5.08 -1.97 -2.75 114.58 121.61 2jmd h GLU 53 Ca -0.48 -0.17 -0.06 0.00 -1.00 0.00 0.00 59.36 57.65 2jmd h GLU 53 Cb 1.17 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 2jmd h GLU 53 CO 0.53 0.72 -0.16 -0.91 -1.00 0.00 0.00 179.01 178.20 2jmd h ASN 54 N 0.70 0.22 0.47 1.42 4.21 -2.02 -2.78 115.58 117.80 2jmd h ASN 54 Ca 0.15 -0.05 0.00 0.00 1.21 0.00 0.00 56.30 57.61 2jmd h ASN 54 Cb 0.37 -0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.51 2jmd h ASN 54 CO 0.01 0.40 -0.39 0.00 -1.29 0.00 0.00 177.43 176.16 2jmd n GLN 55 N -4.25 0.22 -2.58 0.81 6.02 -1.05 -4.83 117.38 111.73 2jmd n GLN 55 Ca -0.01 -0.12 -0.39 0.00 -0.01 0.00 0.00 57.00 56.47 2jmd n GLN 55 Cb 0.29 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 30.00 2jmd n GLN 55 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2jmd s LEU 56 N -2.86 4.51 0.40 1.08 1.43 -1.05 -4.83 118.68 117.35 2jmd s LEU 56 Ca 0.15 2.12 -0.25 0.00 -1.03 0.00 0.00 54.13 55.12 2jmd s LEU 56 Cb 0.18 -3.73 -0.09 0.00 0.03 0.00 0.00 46.19 42.59 2jmd s LEU 56 CO 0.64 -0.10 1.11 -0.36 0.23 0.00 0.00 176.35 177.87 2jmd s PHE 57 N -1.27 3.17 0.54 0.29 0.08 -1.26 -4.99 117.98 114.53 2jmd s PHE 57 Ca 0.46 1.60 -0.22 0.00 0.12 0.00 0.00 56.93 58.89 2jmd s PHE 57 Cb -0.28 -3.27 -0.05 0.00 -0.57 0.00 0.00 43.02 38.85 2jmd s PHE 57 CO 0.35 -0.99 1.37 -2.14 -0.10 0.00 0.00 175.22 173.72 2jmd s PRO 58 N -2.36 3.16 0.54 0.24 0.02 -1.26 -4.95 135.00 130.39 2jmd s PRO 58 Ca 0.57 2.28 -0.05 0.00 0.02 0.00 0.00 61.00 63.81 2jmd s PRO 58 Cb -0.27 -2.29 0.12 0.00 0.02 0.00 0.00 34.50 32.08 2jmd s PRO 58 CO 0.34 -1.19 0.73 -0.40 -0.33 0.00 0.00 177.00 176.15 2jmd n ASP 59 N -0.98 0.45 -1.43 2.53 5.68 -1.26 -5.01 116.55 116.54 2jmd n ASP 59 Ca 0.10 -1.51 0.09 0.00 -0.50 0.00 0.00 54.79 52.98 2jmd n ASP 59 Cb 0.45 -0.53 0.33 0.00 -1.14 0.00 0.00 41.12 40.23 2jmd n ASP 59 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2jmd n ASN 60 N -3.25 4.48 -3.97 -1.12 3.02 -1.26 -4.97 115.26 108.20 2jmd n ASN 60 Ca 0.10 -2.42 -0.09 0.00 -0.03 0.00 0.00 54.58 52.14 2jmd n ASN 60 Cb 0.37 -0.54 -0.11 0.00 -0.61 0.00 0.00 39.78 38.89 2jmd n ASN 60 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 2jmd s PHE 61 N -1.78 0.23 -0.00 3.10 -0.12 -1.26 -5.01 117.98 113.14 2jmd s PHE 61 Ca 0.48 -0.48 0.02 0.00 -0.05 0.00 0.00 56.93 56.90 2jmd s PHE 61 Cb 0.31 -0.17 -0.25 0.00 -0.63 0.00 0.00 43.02 42.27 2jmd s PHE 61 CO 0.23 -0.21 0.82 0.00 -0.05 0.00 0.00 175.22 176.02 2jmd h ALA 62 N 4.56 0.42 0.00 1.99 0.00 -2.06 -3.54 119.26 120.63 2jmd h ALA 62 Ca -0.32 -1.20 0.00 0.00 0.00 0.00 0.00 54.91 53.39 2jmd h ALA 62 Cb 1.21 0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.31 2jmd h ALA 62 CO 0.41 1.28 0.00 1.17 0.00 0.00 0.00 179.25 182.12