#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jdm n THR 2 N 0.00 1.34 -4.20 0.00 -1.04 -1.26 -5.00 114.28 104.11 2jdm n THR 2 Ca 0.00 -0.33 -0.15 0.00 -2.04 0.00 0.00 64.05 61.53 2jdm n THR 2 Cb 0.00 -0.99 -0.11 0.00 -1.82 0.00 0.00 70.33 67.41 2jdm n THR 2 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2jdm s GLN 3 N -0.84 0.91 -0.47 -2.82 -1.52 -1.26 -4.83 119.66 108.82 2jdm s GLN 3 Ca 0.67 -1.23 0.00 0.00 -1.95 0.00 0.00 55.36 52.85 2jdm s GLN 3 Cb -0.76 -0.59 0.00 0.00 -0.22 0.00 0.00 33.01 31.44 2jdm s GLN 3 CO 0.55 0.09 0.00 0.41 -0.25 0.00 0.00 175.29 176.09 2jdm n GLY 4 N 0.40 0.72 3.18 3.09 0.00 -1.26 -4.91 105.19 106.41 2jdm n GLY 4 Ca -0.15 -0.77 -0.32 0.00 0.00 0.00 0.00 46.02 44.78 2jdm n GLY 4 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jdm s VAL 5 N -2.15 2.03 0.03 1.61 1.01 -1.26 -0.89 120.40 120.80 2jdm s VAL 5 Ca 0.00 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.04 2jdm s VAL 5 Cb 0.00 -1.79 -0.02 0.00 0.00 0.00 0.00 36.38 34.57 2jdm s VAL 5 CO 0.00 0.55 -0.11 -0.36 0.00 0.00 0.00 175.10 175.18 2jdm s PHE 6 N 0.69 0.93 -0.31 5.22 0.08 0.09 -5.02 117.98 119.66 2jdm s PHE 6 Ca -0.10 -0.36 -0.09 0.00 0.12 0.00 0.00 56.93 56.50 2jdm s PHE 6 Cb -0.16 -0.55 0.00 0.00 -0.57 0.00 0.00 43.02 41.74 2jdm s PHE 6 CO 0.01 -0.01 0.13 0.99 -0.10 0.00 0.00 175.22 176.25 2jdm s THR 7 N -0.92 4.41 0.46 0.64 2.01 -1.26 -1.19 115.64 119.79 2jdm s THR 7 Ca -0.02 -0.54 0.02 0.00 0.31 0.00 0.00 61.69 61.46 2jdm s THR 7 Cb -0.08 -3.27 0.01 0.00 0.01 0.00 0.00 72.50 69.17 2jdm s THR 7 CO 0.01 0.05 0.67 -0.76 -0.69 0.00 0.00 174.62 173.89 2jdm s LEU 8 N 1.57 3.58 0.51 4.42 1.02 0.69 -5.01 118.68 125.45 2jdm s LEU 8 Ca 0.04 0.08 -0.23 0.00 0.02 0.00 0.00 54.13 54.03 2jdm s LEU 8 Cb -0.17 -2.98 -0.06 0.00 0.02 0.00 0.00 46.19 43.00 2jdm s LEU 8 CO 0.05 -0.80 1.38 -2.16 0.02 0.00 0.00 176.35 174.84 2jdm s PRO 9 N -4.55 3.37 0.49 1.29 0.04 -1.26 -4.43 135.00 129.95 2jdm s PRO 9 Ca 0.51 2.29 -0.23 0.00 0.04 0.00 0.00 61.00 63.62 2jdm s PRO 9 Cb -0.10 -2.42 -0.06 0.00 0.04 0.00 0.00 34.50 31.96 2jdm s PRO 9 CO 0.37 -1.03 1.25 0.00 0.04 0.00 0.00 177.00 177.63 2jdm s ALA 10 N -1.27 2.93 -1.40 8.56 0.00 -1.26 -3.80 121.76 125.53 2jdm s ALA 10 Ca 0.67 1.11 -0.07 0.00 0.00 0.00 0.00 51.96 53.67 2jdm s ALA 10 Cb -0.41 -3.46 0.04 0.00 0.00 0.00 0.00 23.12 19.28 2jdm s ALA 10 CO 0.51 -0.95 0.91 0.09 0.00 0.00 0.00 175.76 176.32 2jdm n ASN 11 N -0.66 -3.44 -4.18 0.00 3.02 0.01 -4.90 115.26 105.11 2jdm n ASN 11 Ca 0.08 -0.75 -0.27 0.00 -0.03 0.00 0.00 54.58 53.62 2jdm n ASN 11 Cb 0.47 -4.23 -0.16 0.00 -0.61 0.00 0.00 39.78 35.25 2jdm n ASN 11 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2jdm s THR 12 N -3.45 1.56 0.31 3.41 2.01 -1.25 -4.88 115.64 113.35 2jdm s THR 12 Ca 0.35 -0.81 -0.28 0.00 0.31 0.00 0.00 61.69 61.26 2jdm s THR 12 Cb -0.17 -1.32 -0.09 0.00 0.01 0.00 0.00 72.50 70.92 2jdm s THR 12 CO 0.80 0.44 1.11 -0.13 -0.69 0.00 0.00 174.62 176.16 2jdm s ARG 13 N -0.16 4.51 0.04 4.92 0.52 -1.26 -1.00 118.95 126.52 2jdm s ARG 13 Ca 0.00 1.80 -0.03 0.00 -0.52 0.00 0.00 55.73 56.98 2jdm s ARG 13 Cb -0.10 -3.05 -0.02 0.00 0.52 0.00 0.00 34.95 32.29 2jdm s ARG 13 CO 0.01 0.09 0.02 -0.59 0.02 0.00 0.00 175.30 174.86 2jdm s PHE 14 N -1.25 0.32 0.08 -0.53 -0.71 -0.12 -4.28 117.98 111.49 2jdm s PHE 14 Ca 0.48 -0.69 -0.08 0.00 -1.04 0.00 0.00 56.93 55.59 2jdm s PHE 14 Cb -0.31 -0.23 -0.06 0.00 -1.21 0.00 0.00 43.02 41.21 2jdm s PHE 14 CO 0.40 -0.32 0.38 0.20 -1.34 0.00 0.00 175.22 174.53 2jdm s GLY 15 N -2.20 2.31 -0.03 1.99 0.00 -0.28 -1.12 107.32 107.98 2jdm s GLY 15 Ca -0.04 -0.44 0.01 0.00 0.00 0.00 0.00 44.72 44.25 2jdm s GLY 15 CO -0.05 -0.25 -0.04 0.54 0.00 0.00 0.00 173.10 173.30 2jdm s VAL 16 N -1.43 0.45 -0.02 1.40 0.11 -0.50 -1.24 120.40 119.17 2jdm s VAL 16 Ca 0.34 -0.11 0.00 0.00 -2.93 0.00 0.00 61.98 59.28 2jdm s VAL 16 Cb -0.13 -0.46 0.03 0.00 -1.53 0.00 0.00 36.38 34.28 2jdm s VAL 16 CO 0.19 0.19 0.02 -0.89 -3.33 0.00 0.00 175.10 171.28 2jdm s THR 17 N 0.70 -0.02 -0.03 5.04 2.01 -0.43 -1.06 115.64 121.86 2jdm s THR 17 Ca -0.09 0.18 0.07 0.00 0.31 0.00 0.00 61.69 62.16 2jdm s THR 17 Cb -0.12 -0.10 -0.02 0.00 0.01 0.00 0.00 72.50 72.27 2jdm s THR 17 CO -0.00 0.09 -0.24 0.00 -0.69 0.00 0.00 174.62 173.78 2jdm s ALA 18 N 0.96 2.25 0.08 7.40 0.00 -0.10 -0.70 121.76 131.65 2jdm s ALA 18 Ca -0.08 -1.09 0.10 0.00 0.00 0.00 0.00 51.96 50.89 2jdm s ALA 18 Cb -0.12 -0.64 -0.03 0.00 0.00 0.00 0.00 23.12 22.33 2jdm s ALA 18 CO -0.03 0.52 -0.26 -0.06 0.00 0.00 0.00 175.76 175.94 2jdm s PHE 19 N -0.59 2.21 -0.01 0.00 0.40 0.75 -0.77 117.98 119.97 2jdm s PHE 19 Ca 0.09 -0.40 0.07 0.00 -0.60 0.00 0.00 56.93 56.10 2jdm s PHE 19 Cb -0.10 -1.27 -0.02 0.00 0.51 0.00 0.00 43.02 42.14 2jdm s PHE 19 CO -0.00 0.21 -0.24 0.00 0.70 0.00 0.00 175.22 175.89 2jdm s ALA 20 N -0.93 2.28 -0.46 5.36 0.00 -0.82 -0.84 121.76 126.35 2jdm s ALA 20 Ca 0.12 -1.12 0.07 0.00 0.00 0.00 0.00 51.96 51.02 2jdm s ALA 20 Cb -0.10 -0.62 0.23 0.00 0.00 0.00 0.00 23.12 22.63 2jdm s ALA 20 CO 0.04 0.54 0.71 0.09 0.00 0.00 0.00 175.76 177.13 2jdm n ASN 21 N 2.29 -1.94 -3.59 0.00 3.02 -0.36 -1.82 115.26 112.86 2jdm n ASN 21 Ca -0.16 -2.98 -0.07 0.00 -0.03 0.00 0.00 54.58 51.34 2jdm n ASN 21 Cb 0.51 0.92 -0.02 0.00 -0.61 0.00 0.00 39.78 40.59 2jdm n ASN 21 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jdm s ALA 22 N 0.16 -1.75 0.20 5.41 0.00 0.37 -3.96 121.76 122.18 2jdm s ALA 22 Ca 0.33 0.67 0.14 0.00 0.00 0.00 0.00 51.96 53.09 2jdm s ALA 22 Cb 0.16 0.52 0.43 0.00 0.00 0.00 0.00 23.12 24.23 2jdm s ALA 22 CO -0.17 -0.82 1.63 0.66 0.00 0.00 0.00 175.76 177.06 2jdm h SER 23 N 2.00 0.00 -2.79 0.00 4.64 -1.97 -3.35 113.55 112.08 2jdm h SER 23 Ca -0.23 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.55 2jdm h SER 23 Cb 1.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.31 2jdm h SER 23 CO 0.29 0.54 -0.35 -0.83 -0.87 0.00 0.00 176.83 175.61 2jdm s GLY 24 N -4.44 1.77 0.06 -0.77 0.00 -1.26 -4.90 107.32 97.78 2jdm s GLY 24 Ca -0.00 -0.86 -0.31 0.00 0.00 0.00 0.00 44.72 43.55 2jdm s GLY 24 CO 0.73 -0.82 1.69 -1.59 0.00 0.00 0.00 173.10 173.12 2jdm s THR 25 N -1.86 3.04 0.01 0.90 2.01 -1.26 -4.68 115.64 113.81 2jdm s THR 25 Ca 0.38 0.43 -0.18 0.00 0.31 0.00 0.00 61.69 62.63 2jdm s THR 25 Cb -0.11 -3.28 -0.06 0.00 0.01 0.00 0.00 72.50 69.07 2jdm s THR 25 CO 0.29 -0.01 0.52 -1.10 -0.69 0.00 0.00 174.62 173.64 2jdm s GLN 26 N 2.94 4.17 -0.22 4.92 -1.52 0.23 -4.17 119.66 126.01 2jdm s GLN 26 Ca 0.76 0.62 0.00 0.00 -1.95 0.00 0.00 55.36 54.79 2jdm s GLN 26 Cb -0.40 -3.28 0.03 0.00 -0.22 0.00 0.00 33.01 29.14 2jdm s GLN 26 CO 0.33 0.53 -0.12 0.99 -0.25 0.00 0.00 175.29 176.78 2jdm s THR 27 N -0.69 2.48 -0.18 -0.19 2.01 0.51 -1.49 115.64 118.10 2jdm s THR 27 Ca 0.28 -1.07 -0.05 0.00 0.31 0.00 0.00 61.69 61.16 2jdm s THR 27 Cb -0.18 -2.22 -0.03 0.00 0.01 0.00 0.00 72.50 70.09 2jdm s THR 27 CO 0.16 0.29 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.69 2jdm s VAL 28 N 1.28 4.03 -0.10 3.82 1.01 0.76 -1.14 120.40 130.06 2jdm s VAL 28 Ca 0.01 -0.30 0.03 0.00 0.00 0.00 0.00 61.98 61.72 2jdm s VAL 28 Cb -0.16 -2.79 -0.01 0.00 0.00 0.00 0.00 36.38 33.42 2jdm s VAL 28 CO -0.08 0.46 -0.20 0.20 0.00 0.00 0.00 175.10 175.48 2jdm s ASN 29 N 0.62 3.42 -0.23 3.32 0.01 -0.10 -1.27 114.94 120.71 2jdm s ASN 29 Ca -0.01 -0.46 -0.03 0.00 -0.71 0.00 0.00 52.86 51.65 2jdm s ASN 29 Cb -0.14 -1.33 0.01 0.00 0.41 0.00 0.00 41.25 40.20 2jdm s ASN 29 CO 0.02 0.19 -0.05 -0.69 -1.51 0.00 0.00 177.10 175.06 2jdm s VAL 30 N 0.18 3.13 -0.14 1.60 1.01 -0.02 -1.21 120.40 124.95 2jdm s VAL 30 Ca -0.12 -0.73 -0.04 0.00 0.00 0.00 0.00 61.98 61.09 2jdm s VAL 30 Cb -0.16 -2.49 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 2jdm s VAL 30 CO 0.06 0.33 -0.00 -0.76 0.00 0.00 0.00 175.10 174.74 2jdm s LEU 31 N 1.41 3.49 -0.18 3.92 1.02 0.52 0.45 118.68 129.32 2jdm s LEU 31 Ca 0.04 0.00 -0.00 0.00 0.02 0.00 0.00 54.13 54.19 2jdm s LEU 31 Cb -0.15 -1.84 0.01 0.00 0.02 0.00 0.00 46.19 44.22 2jdm s LEU 31 CO -0.04 0.23 -0.14 -0.69 0.02 0.00 0.00 176.35 175.72 2jdm s VAL 32 N 0.00 2.59 -1.49 -1.59 1.01 0.02 -0.99 120.40 119.95 2jdm s VAL 32 Ca 0.03 -0.77 -0.11 0.00 0.00 0.00 0.00 61.98 61.12 2jdm s VAL 32 Cb -0.13 -2.12 0.07 0.00 0.00 0.00 0.00 36.38 34.20 2jdm s VAL 32 CO 0.02 0.50 0.95 -3.20 0.00 0.00 0.00 175.10 173.38 2jdm n ASN 33 N 4.46 -4.34 -0.21 3.32 5.15 -0.16 -2.36 115.26 121.11 2jdm n ASN 33 Ca -0.20 -0.77 -0.03 0.00 -0.60 0.00 0.00 54.58 52.98 2jdm n ASN 33 Cb 0.51 -3.98 -0.01 0.00 -0.53 0.00 0.00 39.78 35.77 2jdm n ASN 33 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2jdm n ASN 34 N -2.88 -4.00 -4.10 1.20 3.02 -1.26 -5.00 115.26 102.24 2jdm n ASN 34 Ca -0.01 0.07 -0.28 0.00 -0.03 0.00 0.00 54.58 54.33 2jdm n ASN 34 Cb 0.55 -1.74 -0.17 0.00 -0.61 0.00 0.00 39.78 37.81 2jdm n ASN 34 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2jdm s GLU 35 N -1.42 2.25 0.15 3.52 0.41 -1.00 -5.07 118.70 117.54 2jdm s GLU 35 Ca 0.00 -0.60 -0.33 0.00 -0.41 0.00 0.00 54.97 53.63 2jdm s GLU 35 Cb 0.00 -1.77 -0.13 0.00 -1.78 0.00 0.00 34.13 30.45 2jdm s GLU 35 CO 0.00 0.08 1.66 2.41 -0.49 0.00 0.00 175.26 178.92 2jdm n THR 36 N 3.71 0.07 0.00 3.63 -1.04 -1.26 -0.80 114.28 118.59 2jdm n THR 36 Ca -0.21 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.78 2jdm n THR 36 Cb 0.52 -1.74 0.00 0.00 -1.82 0.00 0.00 70.33 67.30 2jdm n THR 36 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jdm n ALA 37 N 3.98 2.00 -3.30 2.41 0.00 0.17 -4.86 120.51 120.91 2jdm n ALA 37 Ca 0.17 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.47 2jdm n ALA 37 Cb 0.31 0.07 -0.08 0.00 0.00 0.00 0.00 19.45 19.75 2jdm n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jdm s ALA 38 N -2.00 -0.99 -0.01 0.00 0.00 -1.05 -5.02 121.76 112.69 2jdm s ALA 38 Ca 0.00 0.55 -0.01 0.00 0.00 0.00 0.00 51.96 52.51 2jdm s ALA 38 Cb 0.00 0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.16 2jdm s ALA 38 CO 0.00 -0.28 0.02 -0.08 0.00 0.00 0.00 175.76 175.42 2jdm s THR 39 N -1.25 -0.01 -0.01 0.00 -1.32 -1.26 -0.84 115.64 110.95 2jdm s THR 39 Ca -0.13 0.05 0.03 0.00 -1.21 0.00 0.00 61.69 60.43 2jdm s THR 39 Cb -0.04 -0.05 -0.01 0.00 -1.51 0.00 0.00 72.50 70.89 2jdm s THR 39 CO 0.05 0.02 -0.10 -0.36 -2.21 0.00 0.00 174.62 172.02 2jdm s PHE 40 N 0.25 0.94 0.01 9.09 0.08 -0.40 -5.00 117.98 122.96 2jdm s PHE 40 Ca -0.02 -0.19 0.01 0.00 0.12 0.00 0.00 56.93 56.85 2jdm s PHE 40 Cb -0.03 -0.62 -0.01 0.00 -0.57 0.00 0.00 43.02 41.79 2jdm s PHE 40 CO -0.01 -0.03 -0.03 -1.12 -0.10 0.00 0.00 175.22 173.93 2jdm s SER 41 N -0.16 0.38 0.00 1.36 0.01 -1.26 -0.17 113.70 113.86 2jdm s SER 41 Ca 0.03 -0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.13 2jdm s SER 41 Cb -0.05 -0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.17 2jdm s SER 41 CO -0.00 -0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.23 2jdm n GLY 42 N 2.69 0.92 3.33 3.44 0.00 -0.55 -4.97 105.19 110.04 2jdm n GLY 42 Ca -0.15 -0.78 -0.32 0.00 0.00 0.00 0.00 46.02 44.77 2jdm n GLY 42 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jdm s GLN 43 N -2.00 2.75 -0.16 1.61 -0.44 -1.26 -0.60 119.66 119.55 2jdm s GLN 43 Ca 0.00 -0.82 -0.28 0.00 -2.50 0.00 0.00 55.36 51.76 2jdm s GLN 43 Cb 0.00 -2.31 0.08 0.00 -1.64 0.00 0.00 33.01 29.14 2jdm s GLN 43 CO 0.00 0.38 0.76 0.45 0.50 0.00 0.00 175.29 177.38 2jdm s SER 44 N -0.14 -0.64 -0.08 6.67 0.15 -1.25 -5.00 113.70 113.40 2jdm s SER 44 Ca -0.03 0.97 0.13 0.00 0.70 0.00 0.00 55.95 57.71 2jdm s SER 44 Cb -0.14 0.89 0.35 0.00 -1.71 0.00 0.00 66.02 65.41 2jdm s SER 44 CO 0.04 -0.41 1.28 0.35 1.20 0.00 0.00 173.24 175.70 2jdm n THR 45 N 1.67 1.59 -1.81 6.45 -2.24 -1.26 -0.48 114.28 118.20 2jdm n THR 45 Ca -0.16 -1.48 0.06 0.00 -2.27 0.00 0.00 64.05 60.20 2jdm n THR 45 Cb 0.56 0.13 0.14 0.00 -2.10 0.00 0.00 70.33 69.06 2jdm n THR 45 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2jdm n ASN 46 N -0.22 1.50 -2.22 3.42 5.03 -1.26 -4.87 115.26 116.63 2jdm n ASN 46 Ca 0.14 -3.21 -0.17 0.00 0.87 0.00 0.00 54.58 52.21 2jdm n ASN 46 Cb 0.61 -0.44 0.01 0.00 -1.02 0.00 0.00 39.78 38.94 2jdm n ASN 46 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 2jdm n ASN 47 N -0.65 -5.10 -4.70 6.41 5.15 -0.75 -4.94 115.26 110.67 2jdm n ASN 47 Ca 0.14 -0.14 -0.41 0.00 -0.60 0.00 0.00 54.58 53.57 2jdm n ASN 47 Cb 0.81 -4.05 0.01 0.00 -0.53 0.00 0.00 39.78 36.02 2jdm n ASN 47 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jdm n ALA 48 N -2.63 1.36 -2.70 5.20 0.00 -1.23 -4.62 120.51 115.90 2jdm n ALA 48 Ca -0.13 0.28 -0.42 0.00 0.00 0.00 0.00 53.44 53.17 2jdm n ALA 48 Cb 0.62 -2.27 -0.03 0.00 0.00 0.00 0.00 19.45 17.76 2jdm n ALA 48 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2jdm s VAL 49 N -1.18 4.12 -0.70 0.00 1.01 -1.26 -1.95 120.40 120.44 2jdm s VAL 49 Ca 0.60 -0.51 0.23 0.00 0.00 0.00 0.00 61.98 62.30 2jdm s VAL 49 Cb -0.52 -4.88 0.24 0.00 0.00 0.00 0.00 36.38 31.22 2jdm s VAL 49 CO 0.59 -1.72 1.71 2.30 0.00 0.00 0.00 175.10 177.98 2jdm n ILE 50 N 6.26 0.69 -3.64 2.22 -5.35 0.05 -4.79 119.36 114.80 2jdm n ILE 50 Ca 0.15 0.06 -0.03 0.00 -0.27 0.00 0.00 62.75 62.66 2jdm n ILE 50 Cb 0.49 -0.89 -0.05 0.00 -1.74 0.00 0.00 39.64 37.44 2jdm n ILE 50 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2jdm s GLY 51 N -3.39 0.15 -0.00 3.28 0.00 -1.23 -4.37 107.32 101.75 2jdm s GLY 51 Ca 0.08 3.02 0.01 0.00 0.00 0.00 0.00 44.72 47.82 2jdm s GLY 51 CO 0.44 1.46 -0.02 -1.08 0.00 0.00 0.00 173.10 173.90 2jdm s THR 52 N -0.56 0.14 0.00 0.90 -1.32 -1.26 -0.92 115.64 112.62 2jdm s THR 52 Ca 0.07 -0.08 -0.20 0.00 -1.21 0.00 0.00 61.69 60.26 2jdm s THR 52 Cb -0.03 -0.12 0.04 0.00 -1.51 0.00 0.00 72.50 70.88 2jdm s THR 52 CO -0.10 0.03 0.45 -1.10 -2.21 0.00 0.00 174.62 171.69 2jdm s GLN 53 N -0.06 0.88 -0.21 7.08 -0.21 -0.22 -5.00 119.66 121.92 2jdm s GLN 53 Ca 0.00 -0.16 -0.12 0.00 0.02 0.00 0.00 55.36 55.11 2jdm s GLN 53 Cb -0.01 0.40 -0.05 0.00 1.00 0.00 0.00 33.01 34.35 2jdm s GLN 53 CO -0.00 -0.28 0.21 0.08 -2.12 0.00 0.00 175.29 173.18 2jdm s VAL 54 N -1.81 5.34 0.35 1.09 1.01 -1.26 -1.41 120.40 123.71 2jdm s VAL 54 Ca -0.09 0.33 0.07 0.00 0.00 0.00 0.00 61.98 62.29 2jdm s VAL 54 Cb -0.02 -3.55 -0.07 0.00 0.00 0.00 0.00 36.38 32.74 2jdm s VAL 54 CO 0.03 0.36 -0.03 -0.76 0.00 0.00 0.00 175.10 174.70 2jdm s LEU 55 N 0.81 2.67 -0.14 3.92 1.43 -0.28 -4.96 118.68 122.14 2jdm s LEU 55 Ca 0.11 -1.28 -0.02 0.00 -1.03 0.00 0.00 54.13 51.91 2jdm s LEU 55 Cb -0.13 -0.82 -0.02 0.00 0.03 0.00 0.00 46.19 45.24 2jdm s LEU 55 CO 0.03 -0.36 -0.08 0.21 0.23 0.00 0.00 176.35 176.38 2jdm s ASN 56 N -3.60 4.46 0.44 2.29 3.84 -1.26 -0.94 114.94 120.17 2jdm s ASN 56 Ca 0.33 -0.20 0.30 0.00 0.21 0.00 0.00 52.86 53.51 2jdm s ASN 56 Cb 0.06 -1.64 1.54 0.00 -0.55 0.00 0.00 41.25 40.65 2jdm s ASN 56 CO 0.16 0.19 1.92 0.77 -2.79 0.00 0.00 177.10 177.35 2jdm h SER 57 N 6.55 0.00 -2.05 -4.21 4.64 -1.37 -3.47 113.55 113.64 2jdm h SER 57 Ca -0.31 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.06 2jdm h SER 57 Cb 1.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.28 2jdm h SER 57 CO 0.59 0.00 -0.06 0.61 -0.87 0.00 0.00 176.83 177.10 2jdm n GLY 58 N -0.85 -1.35 0.25 -0.77 0.00 -1.26 -2.57 105.19 98.64 2jdm n GLY 58 Ca -0.01 -1.13 0.05 0.00 0.00 0.00 0.00 46.02 44.93 2jdm n GLY 58 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2jdm h SER 59 N -0.14 0.16 0.64 1.61 0.02 -1.95 0.09 113.55 113.99 2jdm h SER 59 Ca 0.00 -0.02 -0.22 0.00 -0.84 0.00 0.00 61.79 60.71 2jdm h SER 59 Cb 0.14 -0.04 -0.04 0.00 0.14 0.00 0.00 62.40 62.60 2jdm h SER 59 CO 0.00 0.24 -1.50 0.77 -1.14 0.00 0.00 176.83 175.20 2jdm h SER 60 N 0.18 0.00 0.00 3.07 4.64 -1.97 -3.45 113.55 116.02 2jdm h SER 60 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2jdm h SER 60 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2jdm h SER 60 CO 0.01 0.77 0.00 0.61 -0.87 0.00 0.00 176.83 177.34 2jdm n GLY 61 N 1.46 1.54 3.63 -0.77 0.00 -1.06 -4.85 105.19 105.14 2jdm n GLY 61 Ca -0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 2jdm n GLY 61 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jdm s LYS 62 N -0.09 3.99 -0.07 1.61 2.20 -1.26 -0.23 119.74 125.89 2jdm s LYS 62 Ca 0.00 1.20 0.05 0.00 -0.36 0.00 0.00 55.97 56.86 2jdm s LYS 62 Cb 0.00 -3.82 -0.00 0.00 -1.51 0.00 0.00 37.83 32.50 2jdm s LYS 62 CO 0.00 -1.01 -0.23 0.08 -0.36 0.00 0.00 175.35 173.83 2jdm s VAL 63 N 4.04 1.90 -0.03 4.02 1.01 -0.33 -0.99 120.40 130.02 2jdm s VAL 63 Ca 0.52 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 61.57 2jdm s VAL 63 Cb -0.15 -1.63 0.01 0.00 0.00 0.00 0.00 36.38 34.60 2jdm s VAL 63 CO 0.20 0.53 -0.08 -1.58 0.00 0.00 0.00 175.10 174.17 2jdm s GLN 64 N 0.13 0.91 -0.16 2.72 0.74 -0.16 -0.73 119.66 123.10 2jdm s GLN 64 Ca -0.11 -0.26 -0.04 0.00 0.05 0.00 0.00 55.36 55.01 2jdm s GLN 64 Cb -0.15 -0.85 -0.03 0.00 1.10 0.00 0.00 33.01 33.08 2jdm s GLN 64 CO 0.06 0.07 -0.04 0.08 -0.55 0.00 0.00 175.29 174.91 2jdm s VAL 65 N 0.31 3.85 0.03 1.34 1.01 -0.06 -0.35 120.40 126.52 2jdm s VAL 65 Ca -0.05 -0.37 0.07 0.00 0.00 0.00 0.00 61.98 61.63 2jdm s VAL 65 Cb -0.09 -2.69 -0.02 0.00 0.00 0.00 0.00 36.38 33.57 2jdm s VAL 65 CO 0.00 0.48 -0.20 -1.10 0.00 0.00 0.00 175.10 174.29 2jdm s GLN 66 N 0.48 1.38 -0.04 2.72 -0.21 -0.35 -4.78 119.66 118.86 2jdm s GLN 66 Ca -0.03 -0.87 0.02 0.00 0.02 0.00 0.00 55.36 54.50 2jdm s GLN 66 Cb -0.14 -1.45 0.01 0.00 1.00 0.00 0.00 33.01 32.42 2jdm s GLN 66 CO 0.03 0.38 -0.10 0.08 -2.12 0.00 0.00 175.29 173.55 2jdm s VAL 67 N -0.73 0.93 0.07 1.09 1.01 -1.26 -0.92 120.40 120.59 2jdm s VAL 67 Ca 0.07 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 61.65 2jdm s VAL 67 Cb -0.08 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 2jdm s VAL 67 CO 0.01 0.29 -0.05 -0.94 0.00 0.00 0.00 175.10 174.42 2jdm s SER 68 N 0.42 0.77 -0.18 3.32 1.04 -0.29 -0.27 113.70 118.51 2jdm s SER 68 Ca -0.08 -1.00 -0.00 0.00 0.48 0.00 0.00 55.95 55.35 2jdm s SER 68 Cb -0.12 0.15 0.05 0.00 0.10 0.00 0.00 66.02 66.20 2jdm s SER 68 CO 0.02 -0.54 -0.06 -0.69 0.98 0.00 0.00 173.24 172.95 2jdm s VAL 69 N -3.78 1.23 -1.78 5.02 1.01 -0.32 -0.37 120.40 121.41 2jdm s VAL 69 Ca 0.09 -0.79 -0.20 0.00 0.00 0.00 0.00 61.98 61.09 2jdm s VAL 69 Cb 0.07 -1.43 0.20 0.00 0.00 0.00 0.00 36.38 35.21 2jdm s VAL 69 CO -0.08 0.08 0.49 0.59 0.00 0.00 0.00 175.10 176.18 2jdm n ASN 70 N 4.82 -1.34 0.00 3.32 3.02 -1.26 -1.76 115.26 122.06 2jdm n ASN 70 Ca -0.12 -1.22 0.00 0.00 -0.03 0.00 0.00 54.58 53.21 2jdm n ASN 70 Cb 0.47 -1.55 0.00 0.00 -0.61 0.00 0.00 39.78 38.09 2jdm n ASN 70 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jdm n GLY 71 N -1.29 1.09 3.59 7.41 0.00 -1.26 -5.07 105.19 109.67 2jdm n GLY 71 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 2jdm n GLY 71 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jdm s ARG 72 N -0.84 3.88 0.28 1.61 3.52 -0.72 -5.03 118.95 121.65 2jdm s ARG 72 Ca 0.00 -0.13 -0.30 0.00 -0.13 0.00 0.00 55.73 55.17 2jdm s ARG 72 Cb 0.00 -3.70 -0.11 0.00 -1.56 0.00 0.00 34.95 29.59 2jdm s ARG 72 CO 0.00 -0.33 1.48 -1.25 -0.81 0.00 0.00 175.30 174.38 2jdm s PRO 73 N 2.02 4.22 0.43 5.12 0.04 -1.26 -1.18 135.00 144.38 2jdm s PRO 73 Ca 0.13 2.41 -0.15 0.00 0.04 0.00 0.00 61.00 63.42 2jdm s PRO 73 Cb -0.16 -3.06 -0.08 0.00 0.04 0.00 0.00 34.50 31.23 2jdm s PRO 73 CO 0.11 -0.47 0.87 -1.12 0.04 0.00 0.00 177.00 176.42 2jdm s SER 74 N 0.26 6.68 0.07 6.66 0.01 0.63 -4.92 113.70 123.09 2jdm s SER 74 Ca 0.59 1.40 -0.30 0.00 1.31 0.00 0.00 55.95 58.95 2jdm s SER 74 Cb -0.44 -2.43 -0.05 0.00 0.21 0.00 0.00 66.02 63.31 2jdm s SER 74 CO 0.48 -0.41 1.07 -0.62 0.41 0.00 0.00 173.24 174.17 2jdm s ASP 75 N -2.77 7.27 0.11 2.44 2.15 -0.81 -4.76 116.67 120.29 2jdm s ASP 75 Ca 0.56 1.87 0.04 0.00 0.43 0.00 0.00 52.55 55.46 2jdm s ASP 75 Cb -0.10 -2.58 -0.04 0.00 -0.30 0.00 0.00 42.92 39.90 2jdm s ASP 75 CO 0.25 -0.30 0.08 -0.76 -0.17 0.00 0.00 175.17 174.27 2jdm s LEU 76 N 0.66 3.72 -0.00 -1.34 1.43 -1.26 -0.93 118.68 120.96 2jdm s LEU 76 Ca 0.53 -0.09 0.02 0.00 -1.03 0.00 0.00 54.13 53.56 2jdm s LEU 76 Cb -0.26 -2.39 -0.00 0.00 0.03 0.00 0.00 46.19 43.57 2jdm s LEU 76 CO 0.30 0.14 -0.05 0.54 0.23 0.00 0.00 176.35 177.50 2jdm s VAL 77 N -1.49 0.43 0.12 -1.59 0.11 -0.36 -4.85 120.40 112.75 2jdm s VAL 77 Ca 0.29 -0.25 -0.20 0.00 -2.93 0.00 0.00 61.98 58.89 2jdm s VAL 77 Cb -0.11 -0.37 0.05 0.00 -1.53 0.00 0.00 36.38 34.42 2jdm s VAL 77 CO 0.22 0.10 0.49 -0.94 -3.33 0.00 0.00 175.10 171.64 2jdm s SER 78 N -0.17 -0.38 0.24 3.54 1.04 -1.26 -0.28 113.70 116.43 2jdm s SER 78 Ca 0.02 -0.11 -0.22 0.00 0.48 0.00 0.00 55.95 56.11 2jdm s SER 78 Cb -0.02 0.52 0.03 0.00 0.10 0.00 0.00 66.02 66.65 2jdm s SER 78 CO -0.00 -0.86 0.78 0.00 0.98 0.00 0.00 173.24 174.14 2jdm s ALA 79 N -3.49 -1.36 0.02 5.32 0.00 -0.92 -4.88 121.76 116.47 2jdm s ALA 79 Ca 0.00 -0.15 0.07 0.00 0.00 0.00 0.00 51.96 51.89 2jdm s ALA 79 Cb 0.00 0.79 -0.02 0.00 0.00 0.00 0.00 23.12 23.89 2jdm s ALA 79 CO -0.10 -1.03 -0.21 -1.14 0.00 0.00 0.00 175.76 173.28 2jdm s GLN 80 N -3.73 1.51 0.02 0.00 0.74 -1.26 -0.84 119.66 116.10 2jdm s GLN 80 Ca 0.11 -0.88 0.05 0.00 0.05 0.00 0.00 55.36 54.69 2jdm s GLN 80 Cb -0.05 -1.57 -0.02 0.00 1.10 0.00 0.00 33.01 32.48 2jdm s GLN 80 CO 0.05 0.41 -0.15 0.54 -0.55 0.00 0.00 175.29 175.59 2jdm s VAL 81 N -0.69 1.17 -0.11 1.34 0.11 -0.19 -5.00 120.40 117.04 2jdm s VAL 81 Ca 0.08 -0.88 0.02 0.00 -2.93 0.00 0.00 61.98 58.27 2jdm s VAL 81 Cb -0.09 -1.03 0.01 0.00 -1.53 0.00 0.00 36.38 33.75 2jdm s VAL 81 CO 0.01 0.14 -0.15 -0.63 -3.33 0.00 0.00 175.10 171.14 2jdm s ILE 82 N -0.66 1.46 -0.09 7.04 1.01 -1.26 -1.20 121.20 127.50 2jdm s ILE 82 Ca 0.04 -0.62 -0.02 0.00 0.00 0.00 0.00 60.65 60.04 2jdm s ILE 82 Cb -0.07 -1.34 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 2jdm s ILE 82 CO 0.01 0.43 0.02 -0.76 0.00 0.00 0.00 174.94 174.63 2jdm s LEU 83 N 0.99 3.66 -1.00 2.97 1.43 -0.24 -4.55 118.68 121.94 2jdm s LEU 83 Ca -0.07 0.17 -0.08 0.00 -1.03 0.00 0.00 54.13 53.12 2jdm s LEU 83 Cb -0.15 -1.84 0.08 0.00 0.03 0.00 0.00 46.19 44.30 2jdm s LEU 83 CO -0.01 0.38 0.31 1.07 0.23 0.00 0.00 176.35 178.33 2jdm n THR 84 N 2.15 -0.46 -1.53 5.49 5.66 -1.26 -1.12 114.28 123.21 2jdm n THR 84 Ca -0.19 0.00 -0.18 0.00 -3.05 0.00 0.00 64.05 60.63 2jdm n THR 84 Cb 0.54 -1.02 -0.08 0.00 -1.55 0.00 0.00 70.33 68.22 2jdm n THR 84 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2jdm n ASN 85 N -2.04 -5.45 0.00 1.09 5.15 -1.26 -4.68 115.26 108.08 2jdm n ASN 85 Ca 0.00 0.45 0.00 0.00 -0.60 0.00 0.00 54.58 54.43 2jdm n ASN 85 Cb 0.52 -4.55 0.00 0.00 -0.53 0.00 0.00 39.78 35.22 2jdm n ASN 85 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 2jdm n GLU 86 N -2.14 0.00 -3.70 1.20 4.07 -0.56 -5.09 120.64 114.42 2jdm n GLU 86 Ca -0.18 0.00 -0.37 0.00 -0.06 0.00 0.00 57.16 56.55 2jdm n GLU 86 Cb 0.64 -0.41 -0.12 0.00 -0.06 0.00 0.00 31.44 31.49 2jdm n GLU 86 CO 0.00 0.00 0.00 -1.17 -0.06 0.00 0.00 177.13 175.90 2jdm s LEU 87 N -2.06 3.62 -0.06 4.31 2.96 -0.27 -4.48 118.68 122.69 2jdm s LEU 87 Ca 0.00 -0.15 0.02 0.00 -0.22 0.00 0.00 54.13 53.78 2jdm s LEU 87 Cb 0.00 -1.98 -0.03 0.00 0.50 0.00 0.00 46.19 44.68 2jdm s LEU 87 CO 0.00 -0.04 -0.11 0.20 -1.32 0.00 0.00 176.35 175.08 2jdm s ASN 88 N 1.66 4.29 -0.08 3.68 -0.87 0.39 -1.08 114.94 122.93 2jdm s ASN 88 Ca 0.07 -0.13 0.02 0.00 -1.57 0.00 0.00 52.86 51.24 2jdm s ASN 88 Cb -0.15 -1.04 0.01 0.00 -0.02 0.00 0.00 41.25 40.05 2jdm s ASN 88 CO 0.06 0.34 -0.12 -0.36 -2.57 0.00 0.00 177.10 174.44 2jdm s PHE 89 N -0.67 1.58 -0.16 2.20 0.08 -0.34 -2.13 117.98 118.54 2jdm s PHE 89 Ca 0.10 -0.64 -0.02 0.00 0.12 0.00 0.00 56.93 56.48 2jdm s PHE 89 Cb -0.11 -1.17 -0.02 0.00 -0.57 0.00 0.00 43.02 41.15 2jdm s PHE 89 CO 0.01 -0.34 -0.07 0.00 -0.10 0.00 0.00 175.22 174.72 2jdm s ALA 90 N 0.84 2.83 -0.07 5.36 0.00 0.40 -1.02 121.76 130.10 2jdm s ALA 90 Ca -0.11 -0.91 0.05 0.00 0.00 0.00 0.00 51.96 50.99 2jdm s ALA 90 Cb -0.15 -1.47 -0.00 0.00 0.00 0.00 0.00 23.12 21.49 2jdm s ALA 90 CO 0.02 0.10 -0.22 -0.51 0.00 0.00 0.00 175.76 175.14 2jdm s LEU 91 N 0.58 2.01 -0.04 0.00 1.43 -0.02 -0.44 118.68 122.21 2jdm s LEU 91 Ca -0.05 -0.48 0.03 0.00 -1.03 0.00 0.00 54.13 52.61 2jdm s LEU 91 Cb -0.15 -1.26 0.00 0.00 0.03 0.00 0.00 46.19 44.81 2jdm s LEU 91 CO 0.03 0.19 -0.13 -0.69 0.23 0.00 0.00 176.35 175.98 2jdm s VAL 92 N 0.08 1.10 0.26 -1.59 1.01 0.39 -2.16 120.40 119.49 2jdm s VAL 92 Ca -0.09 -0.51 0.11 0.00 0.00 0.00 0.00 61.98 61.49 2jdm s VAL 92 Cb -0.15 -0.97 -0.05 0.00 0.00 0.00 0.00 36.38 35.22 2jdm s VAL 92 CO 0.05 0.33 -0.15 -0.83 0.00 0.00 0.00 175.10 174.50 2jdm s GLY 93 N 0.27 1.80 -0.01 4.51 0.00 0.62 -0.84 107.32 113.68 2jdm s GLY 93 Ca -0.06 -1.76 -0.09 0.00 0.00 0.00 0.00 44.72 42.80 2jdm s GLY 93 CO 0.02 -1.83 0.18 -1.35 0.00 0.00 0.00 173.10 170.11 2jdm s SER 94 N -3.38 -0.03 -0.10 1.64 1.04 -0.85 -1.23 113.70 110.80 2jdm s SER 94 Ca 0.29 -0.11 0.01 0.00 0.48 0.00 0.00 55.95 56.62 2jdm s SER 94 Cb -0.06 0.24 0.02 0.00 0.10 0.00 0.00 66.02 66.32 2jdm s SER 94 CO 0.15 -0.37 -0.13 -0.70 0.98 0.00 0.00 173.24 173.18 2jdm s GLU 95 N -1.28 1.96 0.00 4.02 2.56 -0.10 -2.27 118.70 123.58 2jdm s GLU 95 Ca -0.14 -0.46 0.20 0.00 0.00 0.00 0.00 54.97 54.57 2jdm s GLU 95 Cb -0.07 -1.71 0.18 0.00 2.00 0.00 0.00 34.13 34.53 2jdm s GLU 95 CO 0.02 -0.08 1.14 -0.40 -0.56 0.00 0.00 175.26 175.38 2jdm n ASP 96 N 4.26 2.71 0.00 -1.70 5.68 -1.26 -1.93 116.55 124.30 2jdm n ASP 96 Ca -0.19 -1.83 0.00 0.00 -0.50 0.00 0.00 54.79 52.27 2jdm n ASP 96 Cb 0.51 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.46 2jdm n ASP 96 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jdm n GLY 97 N 1.12 4.88 0.00 6.12 0.00 -1.26 -5.03 105.19 111.02 2jdm n GLY 97 Ca 0.12 -0.63 0.01 0.00 0.00 0.00 0.00 46.02 45.52 2jdm n GLY 97 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jdm n THR 98 N 0.00 0.00 0.70 2.61 -2.24 -1.26 -4.73 114.28 109.37 2jdm n THR 98 Ca 0.00 -0.40 0.13 0.00 -2.27 0.00 0.00 64.05 61.51 2jdm n THR 98 Cb 0.00 0.92 0.36 0.00 -2.10 0.00 0.00 70.33 69.50 2jdm n THR 98 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2jdm n ASP 99 N -1.11 0.62 -3.48 3.42 5.75 -1.26 -4.94 116.55 115.55 2jdm n ASP 99 Ca 0.00 0.36 -0.25 0.00 -0.01 0.00 0.00 54.79 54.89 2jdm n ASP 99 Cb 0.03 -0.37 0.05 0.00 -1.03 0.00 0.00 41.12 39.79 2jdm n ASP 99 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2jdm n ASN 100 N -2.03 -5.83 0.20 -1.12 3.02 -1.26 -4.89 115.26 103.34 2jdm n ASN 100 Ca 0.05 -0.50 0.13 0.00 -0.03 0.00 0.00 54.58 54.22 2jdm n ASN 100 Cb 0.41 -4.65 0.26 0.00 -0.61 0.00 0.00 39.78 35.19 2jdm n ASN 100 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 2jdm h ASP 101 N -2.08 0.00 -2.86 6.41 3.04 -1.93 -3.47 116.42 115.53 2jdm h ASP 101 Ca -0.55 0.00 -0.35 0.00 -3.24 0.00 0.00 57.03 52.89 2jdm h ASP 101 Cb 1.36 0.00 -0.04 0.00 -1.04 0.00 0.00 39.33 39.61 2jdm h ASP 101 CO 0.58 0.00 -0.42 -1.22 -2.04 0.00 0.00 179.24 176.15 2jdm n TYR 102 N -2.91 -0.95 0.00 4.15 4.02 -1.26 -4.82 117.16 115.40 2jdm n TYR 102 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.93 2jdm n TYR 102 Cb 0.49 -3.37 0.00 0.00 -0.02 0.00 0.00 39.34 36.44 2jdm n TYR 102 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 2jdm n ASN 103 N -1.71 1.60 -0.08 7.72 6.94 -1.14 -2.27 115.26 126.31 2jdm n ASN 103 Ca -0.20 -1.57 -0.08 0.00 -0.02 0.00 0.00 54.58 52.71 2jdm n ASN 103 Cb 0.64 -0.01 -0.01 0.00 -2.36 0.00 0.00 39.78 38.04 2jdm n ASN 103 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 2jdm h ASP 104 N 0.08 0.23 -3.70 0.53 3.32 -1.58 -3.24 116.42 112.07 2jdm h ASP 104 Ca 0.00 0.01 -0.55 0.00 0.02 0.00 0.00 57.03 56.51 2jdm h ASP 104 Cb 0.29 -0.03 -0.32 0.00 0.22 0.00 0.00 39.33 39.49 2jdm h ASP 104 CO 0.00 0.17 -0.83 0.00 -1.72 0.00 0.00 179.24 176.86 2jdm s ALA 105 N -6.17 1.49 -0.09 3.45 0.00 -1.25 -1.22 121.76 117.96 2jdm s ALA 105 Ca -0.13 -0.62 0.04 0.00 0.00 0.00 0.00 51.96 51.24 2jdm s ALA 105 Cb 0.10 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 2jdm s ALA 105 CO 0.70 0.23 -0.21 0.08 0.00 0.00 0.00 175.76 176.56 2jdm s VAL 106 N 0.26 2.35 -0.07 0.00 1.01 -0.02 -2.00 120.40 121.93 2jdm s VAL 106 Ca -0.08 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 60.98 2jdm s VAL 106 Cb -0.13 -1.91 0.01 0.00 0.00 0.00 0.00 36.38 34.35 2jdm s VAL 106 CO 0.03 0.56 -0.13 -0.69 0.00 0.00 0.00 175.10 174.87 2jdm s VAL 107 N 0.11 1.18 -0.13 2.92 1.01 -0.02 -0.18 120.40 125.30 2jdm s VAL 107 Ca -0.10 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 61.40 2jdm s VAL 107 Cb -0.16 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.15 2jdm s VAL 107 CO 0.06 0.37 -0.22 -0.69 0.00 0.00 0.00 175.10 174.62 2jdm s VAL 108 N 0.70 2.04 -0.14 2.92 1.01 0.12 -0.46 120.40 126.59 2jdm s VAL 108 Ca -0.14 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 60.84 2jdm s VAL 108 Cb -0.16 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.40 2jdm s VAL 108 CO 0.03 0.55 -0.06 -0.63 0.00 0.00 0.00 175.10 174.99 2jdm s ILE 109 N 0.72 3.66 0.00 2.22 1.01 0.42 -1.31 121.20 127.92 2jdm s ILE 109 Ca -0.10 -0.45 0.03 0.00 0.00 0.00 0.00 60.65 60.14 2jdm s ILE 109 Cb -0.16 -2.57 -0.01 0.00 0.01 0.00 0.00 42.46 39.73 2jdm s ILE 109 CO 0.00 0.51 -0.10 0.54 0.00 0.00 0.00 174.94 175.90 2jdm s ASN 110 N 0.22 1.20 0.15 3.58 4.22 -0.38 -0.46 114.94 123.48 2jdm s ASN 110 Ca -0.04 -0.23 -0.19 0.00 -2.14 0.00 0.00 52.86 50.26 2jdm s ASN 110 Cb -0.14 -0.12 0.05 0.00 1.28 0.00 0.00 41.25 42.32 2jdm s ASN 110 CO 0.03 0.09 0.50 -1.66 -2.04 0.00 0.00 177.10 174.02 2jdm s TRP 111 N -0.37 -0.30 0.84 1.54 -2.14 -0.90 -1.13 118.94 116.47 2jdm s TRP 111 Ca 0.03 0.01 -0.12 0.00 2.66 0.00 0.00 56.10 58.68 2jdm s TRP 111 Cb -0.05 0.39 0.11 0.00 -3.10 0.00 0.00 33.47 30.83 2jdm s TRP 111 CO -0.00 -0.80 1.20 -1.25 -2.66 0.00 0.00 176.95 173.43 2jdm s PRO 112 N -3.80 1.64 0.56 3.25 0.04 -1.26 -0.46 135.00 134.97 2jdm s PRO 112 Ca 0.04 -0.08 0.05 0.00 0.04 0.00 0.00 61.00 61.05 2jdm s PRO 112 Cb 0.00 -1.95 0.04 0.00 0.04 0.00 0.00 34.50 32.63 2jdm s PRO 112 CO -0.10 -1.77 0.39 -0.51 0.04 0.00 0.00 177.00 175.05 2jdm s LEU 113 N -5.62 2.60 0.00 -3.56 1.43 -1.26 -4.98 118.68 107.30 2jdm s LEU 113 Ca 0.65 -1.32 0.00 0.00 -1.03 0.00 0.00 54.13 52.43 2jdm s LEU 113 Cb -0.09 -1.09 0.00 0.00 0.03 0.00 0.00 46.19 45.04 2jdm s LEU 113 CO 0.50 -1.15 0.00 0.61 0.23 0.00 0.00 176.35 176.54