#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jt3 n ASP 2 N 0.00 2.34 -2.66 7.83 5.68 -1.26 -5.02 116.55 123.46 2jt3 n ASP 2 Ca 0.00 1.05 -0.05 0.00 -0.50 0.00 0.00 54.79 55.29 2jt3 n ASP 2 Cb 0.00 -1.50 0.01 0.00 -1.14 0.00 0.00 41.12 38.49 2jt3 n ASP 2 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2jt3 n ASP 3 N -0.09 0.89 -0.02 -1.12 9.92 -1.26 -5.05 116.55 119.82 2jt3 n ASP 3 Ca 0.08 -1.39 0.01 0.00 -0.53 0.00 0.00 54.79 52.96 2jt3 n ASP 3 Cb 0.41 -0.06 -0.13 0.00 -0.64 0.00 0.00 41.12 40.71 2jt3 n ASP 3 CO 0.00 0.00 0.00 2.30 0.13 0.00 0.00 177.20 179.63 2jt3 n ILE 4 N -1.07 0.87 0.12 0.53 -5.35 -1.26 -3.60 119.36 109.60 2jt3 n ILE 4 Ca 0.02 -0.68 -0.06 0.00 -0.27 0.00 0.00 62.75 61.76 2jt3 n ILE 4 Cb 0.14 -0.42 -0.03 0.00 -1.74 0.00 0.00 39.64 37.59 2jt3 n ILE 4 CO 0.00 0.00 0.00 1.88 -1.76 0.00 0.00 176.55 176.67 2jt3 h TYR 5 N 0.00 -0.35 0.00 4.28 0.05 -1.98 -1.95 116.97 117.02 2jt3 h TYR 5 Ca -0.23 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.55 2jt3 h TYR 5 Cb 1.59 0.12 0.00 0.00 1.01 0.00 0.00 36.73 39.44 2jt3 h TYR 5 CO 0.00 -0.22 0.00 1.57 -1.05 0.00 0.00 178.16 178.46 2jt3 h LYS 6 N -1.03 0.00 0.18 4.88 2.10 -2.00 -0.30 116.57 120.39 2jt3 h LYS 6 Ca -0.04 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 58.30 2jt3 h LYS 6 Cb 0.29 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.64 2jt3 h LYS 6 CO 0.06 0.00 -1.44 0.00 -2.00 0.00 0.00 179.45 176.07 2jt3 h ALA 7 N 2.03 0.05 0.00 0.07 0.00 -1.62 -3.33 119.26 116.47 2jt3 h ALA 7 Ca 0.00 -0.95 -0.13 0.00 0.00 0.00 0.00 54.91 53.82 2jt3 h ALA 7 Cb 0.21 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2jt3 h ALA 7 CO 0.00 0.92 -0.75 0.00 0.00 0.00 0.00 179.25 179.42 2jt3 h ALA 8 N 0.37 0.63 -0.01 0.00 0.00 -0.74 -3.26 119.26 116.25 2jt3 h ALA 8 Ca -0.22 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.09 2jt3 h ALA 8 Cb 2.07 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.84 2jt3 h ALA 8 CO 0.22 0.77 0.07 -0.24 0.00 0.00 0.00 179.25 180.07 2jt3 h VAL 9 N 0.00 0.04 0.00 0.00 3.04 -1.17 0.26 116.25 118.42 2jt3 h VAL 9 Ca -0.04 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.65 2jt3 h VAL 9 Cb 1.48 0.93 0.00 0.00 -2.01 0.00 0.00 31.29 31.69 2jt3 h VAL 9 CO 0.07 0.00 -0.61 -0.62 -1.01 0.00 0.00 177.57 175.40 2jt3 n GLU 10 N -3.11 0.27 0.16 4.17 -0.58 -1.23 -3.74 120.64 116.59 2jt3 n GLU 10 Ca -0.03 0.08 0.05 0.00 -0.42 0.00 0.00 57.16 56.84 2jt3 n GLU 10 Cb 0.14 -1.67 0.13 0.00 -0.57 0.00 0.00 31.44 29.47 2jt3 n GLU 10 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 2jt3 h GLN 11 N 0.00 0.00 -6.42 3.49 4.20 -0.64 -3.43 115.11 112.31 2jt3 h GLN 11 Ca 0.00 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.15 2jt3 h GLN 11 Cb 0.72 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.46 2jt3 h GLN 11 CO 0.00 0.40 1.15 -0.51 -0.67 0.00 0.00 178.83 179.20 2jt3 s LEU 12 N -6.54 3.52 1.05 1.46 1.43 -1.20 -4.99 118.68 113.41 2jt3 s LEU 12 Ca 0.03 0.85 -0.12 0.00 -1.03 0.00 0.00 54.13 53.87 2jt3 s LEU 12 Cb 0.08 -3.41 0.22 0.00 0.03 0.00 0.00 46.19 43.10 2jt3 s LEU 12 CO 0.72 -1.60 1.08 0.42 0.23 0.00 0.00 176.35 177.20 2jt3 s THR 13 N 6.11 2.10 0.21 5.49 -4.23 -1.26 -4.71 115.64 119.34 2jt3 s THR 13 Ca 0.65 0.03 -0.06 0.00 -1.18 0.00 0.00 61.69 61.13 2jt3 s THR 13 Cb -0.15 -2.11 0.08 0.00 1.34 0.00 0.00 72.50 71.65 2jt3 s THR 13 CO 0.31 -0.04 1.68 -0.08 -0.54 0.00 0.00 174.62 175.95 2jt3 h GLU 14 N -2.25 0.96 0.00 3.99 4.81 -1.97 -0.82 114.58 119.29 2jt3 h GLU 14 Ca -0.53 -0.30 -0.10 0.00 -0.13 0.00 0.00 59.36 58.29 2jt3 h GLU 14 Cb 1.30 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 2jt3 h GLU 14 CO 0.47 0.96 -0.50 0.93 -0.73 0.00 0.00 179.01 180.15 2jt3 h GLU 15 N 0.88 0.00 0.02 1.92 5.08 -1.99 -0.84 114.58 119.64 2jt3 h GLU 15 Ca 0.16 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2jt3 h GLU 15 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2jt3 h GLU 15 CO 0.03 0.50 -0.01 1.96 -1.00 0.00 0.00 179.01 180.49 2jt3 h GLN 16 N 0.00 -0.02 0.00 2.33 1.08 -1.83 -3.29 115.11 113.38 2jt3 h GLN 16 Ca -0.00 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.14 2jt3 h GLN 16 Cb 1.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.43 2jt3 h GLN 16 CO 0.06 0.73 -0.28 1.57 -0.95 0.00 0.00 178.83 179.97 2jt3 h LYS 17 N -0.83 0.00 -0.94 1.46 5.09 -1.20 -3.03 116.57 117.12 2jt3 h LYS 17 Ca -0.00 0.00 0.13 0.00 0.09 0.00 0.00 60.65 60.87 2jt3 h LYS 17 Cb 0.76 0.00 -0.09 0.00 0.10 0.00 0.00 32.23 33.00 2jt3 h LYS 17 CO 0.00 0.28 0.56 -0.97 -2.09 0.00 0.00 179.45 177.23 2jt3 h ASN 18 N 0.00 0.79 0.13 7.07 -1.24 -1.21 0.16 115.58 121.27 2jt3 h ASN 18 Ca -0.00 0.06 -0.05 0.00 0.71 0.00 0.00 56.30 57.02 2jt3 h ASN 18 Cb 0.69 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 39.64 2jt3 h ASN 18 CO 0.04 0.39 -0.19 -0.33 -1.29 0.00 0.00 177.43 176.05 2jt3 h GLU 19 N 0.86 0.13 0.00 6.67 4.39 -1.63 -2.31 114.58 122.69 2jt3 h GLU 19 Ca 0.48 -0.03 -0.13 0.00 0.34 0.00 0.00 59.36 60.02 2jt3 h GLU 19 Cb 0.55 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.16 2jt3 h GLU 19 CO -0.30 0.33 -0.71 0.74 -1.16 0.00 0.00 179.01 177.92 2jt3 h PHE 20 N 0.13 0.00 0.00 4.33 -1.00 -0.94 -3.20 116.94 116.26 2jt3 h PHE 20 Ca 0.02 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.80 2jt3 h PHE 20 Cb 0.42 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.98 2jt3 h PHE 20 CO 0.00 0.59 0.00 0.87 -1.61 0.00 0.00 178.31 178.16 2jt3 h LYS 21 N 0.00 0.00 0.51 1.51 1.57 -0.28 -3.19 116.57 116.69 2jt3 h LYS 21 Ca -0.03 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2jt3 h LYS 21 Cb 1.48 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.76 2jt3 h LYS 21 CO 0.07 0.00 -0.50 0.00 -0.57 0.00 0.00 179.45 178.45 2jt3 h ALA 22 N 2.15 -1.16 0.00 3.86 0.00 -1.54 0.25 119.26 122.83 2jt3 h ALA 22 Ca 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2jt3 h ALA 22 Cb 0.27 0.73 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 2jt3 h ALA 22 CO 0.00 -1.18 -0.01 0.00 0.00 0.00 0.00 179.25 178.05 2jt3 h ALA 23 N -0.93 1.35 0.02 0.00 0.00 -1.79 -2.47 119.26 115.43 2jt3 h ALA 23 Ca -0.06 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2jt3 h ALA 23 Cb 0.87 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2jt3 h ALA 23 CO -0.06 0.01 -0.01 0.35 0.00 0.00 0.00 179.25 179.55 2jt3 h PHE 24 N 0.00 -0.02 0.00 0.00 3.04 -1.38 -2.70 116.94 115.88 2jt3 h PHE 24 Ca -0.00 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 2jt3 h PHE 24 Cb 0.04 0.01 0.00 0.00 2.56 0.00 0.00 35.95 38.55 2jt3 h PHE 24 CO 0.00 0.69 0.00 0.22 -2.02 0.00 0.00 178.31 177.20 2jt3 h ASP 25 N -0.78 0.00 0.00 0.41 3.58 -0.13 -2.78 116.42 116.73 2jt3 h ASP 25 Ca -0.00 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.43 2jt3 h ASP 25 Cb 0.72 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.77 2jt3 h ASP 25 CO 0.00 0.00 -0.16 0.40 -2.88 0.00 0.00 179.24 176.60 2jt3 h ILE 26 N 0.00 0.49 -0.92 2.25 2.04 -1.43 -3.34 117.51 116.59 2jt3 h ILE 26 Ca 0.00 -1.40 0.27 0.00 1.00 0.00 0.00 64.86 64.73 2jt3 h ILE 26 Cb 0.09 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 2jt3 h ILE 26 CO 0.00 0.16 0.66 -0.26 0.00 0.00 0.00 178.15 178.72 2jt3 h PHE 27 N -1.00 0.03 -3.69 1.37 -1.00 -1.29 -3.31 116.94 108.05 2jt3 h PHE 27 Ca -0.02 0.00 -0.67 0.00 2.81 0.00 0.00 57.97 60.08 2jt3 h PHE 27 Cb 0.40 -0.01 -0.37 0.00 3.61 0.00 0.00 35.95 39.58 2jt3 h PHE 27 CO 0.04 0.01 -0.69 0.14 -1.61 0.00 0.00 178.31 176.19 2jt3 s VAL 28 N -4.99 2.64 -0.07 -0.55 -7.23 -1.07 -4.91 120.40 104.22 2jt3 s VAL 28 Ca -0.05 -1.95 0.15 0.00 -1.81 0.00 0.00 61.98 58.32 2jt3 s VAL 28 Cb 0.22 -2.75 -0.22 0.00 0.56 0.00 0.00 36.38 34.19 2jt3 s VAL 28 CO 0.78 -0.41 0.24 0.18 -0.31 0.00 0.00 175.10 175.58 2jt3 n LEU 29 N 4.44 0.00 -0.84 1.32 4.77 -1.25 -4.71 117.00 120.74 2jt3 n LEU 29 Ca -0.04 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.90 2jt3 n LEU 29 Cb 0.42 0.13 -0.04 0.00 -2.33 0.00 0.00 43.42 41.61 2jt3 n LEU 29 CO 0.25 0.13 0.29 0.61 -1.33 0.00 0.00 177.39 177.34 2jt3 n GLY 30 N 1.78 0.71 0.61 -0.72 0.00 -1.26 -5.14 105.19 101.17 2jt3 n GLY 30 Ca -0.10 -0.06 -0.06 0.00 0.00 0.00 0.00 46.02 45.79 2jt3 n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jt3 n ALA 31 N 0.04 -1.00 -0.01 4.61 0.00 -1.26 -5.01 120.51 117.87 2jt3 n ALA 31 Ca -0.14 -0.29 -0.02 0.00 0.00 0.00 0.00 53.44 52.99 2jt3 n ALA 31 Cb 0.66 -0.03 -0.02 0.00 0.00 0.00 0.00 19.45 20.07 2jt3 n ALA 31 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2jt3 n GLU 32 N -2.72 2.76 -0.00 0.00 0.28 -1.26 -4.72 120.64 114.98 2jt3 n GLU 32 Ca 0.03 0.00 0.07 0.00 -0.16 0.00 0.00 57.16 57.10 2jt3 n GLU 32 Cb 0.11 -1.07 -0.10 0.00 1.43 0.00 0.00 31.44 31.82 2jt3 n GLU 32 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2jt3 n ASP 33 N -2.22 1.23 -2.22 -1.84 9.92 -1.26 -4.99 116.55 115.17 2jt3 n ASP 33 Ca -0.05 -0.36 -0.20 0.00 -0.53 0.00 0.00 54.79 53.65 2jt3 n ASP 33 Cb 0.58 1.38 -0.02 0.00 -0.64 0.00 0.00 41.12 42.42 2jt3 n ASP 33 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jt3 n GLY 34 N 1.53 -0.19 3.87 0.44 0.00 -1.26 -4.93 105.19 104.65 2jt3 n GLY 34 Ca -0.00 -0.03 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 2jt3 n GLY 34 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jt3 s SER 35 N -2.17 6.56 -0.00 1.61 0.01 -1.26 -4.64 113.70 113.81 2jt3 s SER 35 Ca 0.00 0.65 -0.12 0.00 1.31 0.00 0.00 55.95 57.80 2jt3 s SER 35 Cb 0.00 -2.13 0.01 0.00 0.21 0.00 0.00 66.02 64.12 2jt3 s SER 35 CO 0.00 0.25 0.24 -0.63 0.41 0.00 0.00 173.24 173.51 2jt3 s ILE 36 N -1.29 0.07 -0.02 1.44 1.01 -0.90 -4.96 121.20 116.55 2jt3 s ILE 36 Ca 0.28 -0.58 -0.28 0.00 0.00 0.00 0.00 60.65 60.07 2jt3 s ILE 36 Cb -0.14 -0.56 0.09 0.00 0.01 0.00 0.00 42.46 41.87 2jt3 s ILE 36 CO 0.16 -0.32 0.81 -0.94 0.00 0.00 0.00 174.94 174.65 2jt3 s SER 37 N -1.39 -0.47 -0.08 3.58 1.04 -1.26 -4.56 113.70 110.56 2jt3 s SER 37 Ca -0.14 0.26 -0.07 0.00 0.48 0.00 0.00 55.95 56.49 2jt3 s SER 37 Cb -0.06 0.44 -0.04 0.00 0.10 0.00 0.00 66.02 66.46 2jt3 s SER 37 CO 0.03 -0.62 0.27 0.71 0.98 0.00 0.00 173.24 174.61 2jt3 h THR 38 N 2.36 0.06 0.00 2.02 1.35 -1.99 -3.36 112.91 113.35 2jt3 h THR 38 Ca -0.25 -0.88 -0.12 0.00 -0.55 0.00 0.00 66.41 64.61 2jt3 h THR 38 Cb 1.21 0.10 -0.02 0.00 -1.73 0.00 0.00 68.15 67.71 2jt3 h THR 38 CO 0.34 0.02 -1.51 2.29 -0.25 0.00 0.00 175.52 176.40 2jt3 n LYS 39 N -4.91 2.31 0.00 4.72 2.85 -1.26 -4.49 118.16 117.37 2jt3 n LYS 39 Ca -0.03 -0.02 0.08 0.00 -1.05 0.00 0.00 58.31 57.30 2jt3 n LYS 39 Cb 0.10 -1.20 0.38 0.00 -0.65 0.00 0.00 35.03 33.65 2jt3 n LYS 39 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2jt3 n GLU 40 N -2.21 0.05 0.30 -1.58 4.07 -1.26 -3.14 120.64 116.87 2jt3 n GLU 40 Ca -0.11 0.19 0.16 0.00 -0.06 0.00 0.00 57.16 57.34 2jt3 n GLU 40 Cb 0.67 -1.50 0.80 0.00 -0.06 0.00 0.00 31.44 31.35 2jt3 n GLU 40 CO 0.00 0.00 0.00 1.37 -0.06 0.00 0.00 177.13 178.44 2jt3 h LEU 41 N 0.00 0.00 -1.83 4.31 -0.00 -1.79 -1.00 115.31 115.00 2jt3 h LEU 41 Ca 0.00 0.00 0.21 0.00 -0.00 0.00 0.00 57.88 58.09 2jt3 h LEU 41 Cb 0.27 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.88 2jt3 h LEU 41 CO 0.00 0.00 0.56 1.23 -0.00 0.00 0.00 178.44 180.23 2jt3 h GLY 42 N 0.00 0.29 2.00 0.17 0.00 -1.90 0.35 103.07 103.99 2jt3 h GLY 42 Ca 0.03 -0.06 -0.17 0.00 0.00 0.00 0.00 47.33 47.12 2jt3 h GLY 42 CO -0.00 0.00 -0.81 0.50 0.00 0.00 0.00 176.54 176.23 2jt3 h LYS 43 N 0.14 0.00 0.00 4.80 6.56 -1.47 -3.26 116.57 123.34 2jt3 h LYS 43 Ca 0.39 0.00 -0.17 0.00 -1.06 0.00 0.00 60.65 59.81 2jt3 h LYS 43 Cb 1.32 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 32.96 2jt3 h LYS 43 CO -0.06 0.81 -0.96 -0.24 -2.06 0.00 0.00 179.45 176.94 2jt3 h VAL 44 N 0.00 1.08 0.00 0.50 3.04 -0.66 -3.26 116.25 116.95 2jt3 h VAL 44 Ca -0.01 -2.63 -0.01 0.00 -1.01 0.00 0.00 66.70 63.04 2jt3 h VAL 44 Cb 1.61 2.50 -0.00 0.00 -2.01 0.00 0.00 31.29 33.39 2jt3 h VAL 44 CO 0.11 0.62 -0.07 -0.03 -1.01 0.00 0.00 177.57 177.18 2jt3 h MET 45 N 0.00 0.00 0.00 4.17 -1.53 -0.53 -1.93 114.93 115.11 2jt3 h MET 45 Ca -0.06 0.00 -0.12 0.00 -3.44 0.00 0.00 59.70 56.08 2jt3 h MET 45 Cb 1.62 0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 32.65 2jt3 h MET 45 CO 0.08 0.07 -0.55 0.00 0.14 0.00 0.00 176.91 176.65 2jt3 h ARG 46 N 0.00 0.00 0.00 0.39 2.47 -1.65 0.84 114.38 116.43 2jt3 h ARG 46 Ca -0.00 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.59 2jt3 h ARG 46 Cb 0.34 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.64 2jt3 h ARG 46 CO 0.01 0.55 -0.61 0.52 0.56 0.00 0.00 179.97 181.00 2jt3 h MET 47 N 0.00 0.00 -0.37 0.04 2.86 -1.50 -3.24 114.93 112.73 2jt3 h MET 47 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2jt3 h MET 47 Cb 1.23 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.89 2jt3 h MET 47 CO 0.07 0.58 0.00 1.28 1.06 0.00 0.00 176.91 179.91 2jt3 n LEU 48 N -3.24 3.69 -2.99 1.22 7.99 -1.11 -5.03 117.00 117.53 2jt3 n LEU 48 Ca 0.01 -2.51 -0.05 0.00 -0.01 0.00 0.00 56.01 53.46 2jt3 n LEU 48 Cb 0.77 -0.43 0.00 0.00 -0.11 0.00 0.00 43.42 43.66 2jt3 n LEU 48 CO 0.42 0.72 -0.42 0.61 -1.51 0.00 0.00 177.39 177.21 2jt3 n GLY 49 N 0.21 -1.96 0.00 -0.72 0.00 -0.51 -4.91 105.19 97.29 2jt3 n GLY 49 Ca 0.18 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.65 2jt3 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jt3 n GLN 50 N 0.73 0.00 0.00 1.61 10.64 0.17 -4.97 117.38 125.56 2jt3 n GLN 50 Ca 0.00 0.34 0.00 0.00 -1.83 0.00 0.00 57.00 55.51 2jt3 n GLN 50 Cb 0.30 -1.00 0.00 0.00 -0.86 0.00 0.00 30.24 28.68 2jt3 n GLN 50 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 2jt3 n ASN 51 N -0.84 0.00 -3.00 2.61 4.05 -1.26 -5.13 115.26 111.68 2jt3 n ASN 51 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 2jt3 n ASN 51 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 2jt3 n ASN 51 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 2jt3 n PRO 52 N 0.00 -0.03 -2.50 1.20 -0.04 -1.26 -4.99 135.00 127.38 2jt3 n PRO 52 Ca 0.00 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.08 2jt3 n PRO 52 Cb 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.42 2jt3 n PRO 52 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2jt3 s THR 53 N -0.51 3.61 -0.80 0.52 -1.32 -1.26 -4.93 115.64 110.95 2jt3 s THR 53 Ca 0.00 1.33 0.18 0.00 -1.21 0.00 0.00 61.69 61.99 2jt3 s THR 53 Cb 0.00 -3.73 0.17 0.00 -1.51 0.00 0.00 72.50 67.43 2jt3 s THR 53 CO 0.00 0.10 1.56 -0.81 -2.21 0.00 0.00 174.62 173.26 2jt3 n PRO 54 N 0.23 0.08 0.12 7.08 -0.04 -1.26 -2.67 135.00 138.54 2jt3 n PRO 54 Ca 0.04 0.32 -0.20 0.00 -0.04 0.00 0.00 63.50 63.62 2jt3 n PRO 54 Cb 0.48 -1.65 -0.15 0.00 -0.04 0.00 0.00 33.50 32.15 2jt3 n PRO 54 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2jt3 h GLU 55 N 0.00 0.38 -0.11 0.54 4.81 -1.99 -2.46 114.58 115.76 2jt3 h GLU 55 Ca 0.00 -0.65 -0.14 0.00 -0.13 0.00 0.00 59.36 58.43 2jt3 h GLU 55 Cb 0.29 0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 2jt3 h GLU 55 CO 0.00 1.31 -0.56 1.05 -0.73 0.00 0.00 179.01 180.08 2jt3 h GLU 56 N 0.10 0.32 0.00 1.92 4.11 -1.91 -2.98 114.58 116.15 2jt3 h GLU 56 Ca -0.20 -0.20 -0.05 0.00 0.07 0.00 0.00 59.36 58.99 2jt3 h GLU 56 Cb 2.06 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 31.33 2jt3 h GLU 56 CO 0.23 0.79 -0.31 1.25 0.07 0.00 0.00 179.01 181.04 2jt3 h LEU 57 N 0.24 0.00 -1.89 3.06 5.85 -1.63 -3.26 115.31 117.68 2jt3 h LEU 57 Ca 0.00 0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.81 2jt3 h LEU 57 Cb 1.06 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.07 2jt3 h LEU 57 CO 0.09 0.21 0.46 -0.61 -0.34 0.00 0.00 178.44 178.26 2jt3 h GLN 58 N 0.00 0.00 -0.96 1.25 4.15 -1.27 -1.26 115.11 117.03 2jt3 h GLN 58 Ca -0.01 0.00 0.26 0.00 0.77 0.00 0.00 58.65 59.67 2jt3 h GLN 58 Cb 1.17 0.00 -0.13 0.00 0.21 0.00 0.00 27.48 28.73 2jt3 h GLN 58 CO 0.03 0.00 0.50 1.49 -1.93 0.00 0.00 178.83 178.92 2jt3 h GLU 59 N 0.00 0.42 -0.09 1.69 4.57 -1.72 0.22 114.58 119.68 2jt3 h GLU 59 Ca 0.15 -0.03 -0.24 0.00 -1.18 0.00 0.00 59.36 58.06 2jt3 h GLU 59 Cb 1.08 -0.09 0.01 0.00 -0.16 0.00 0.00 28.75 29.59 2jt3 h GLU 59 CO -0.00 0.28 -0.89 0.52 -1.18 0.00 0.00 179.01 177.74 2jt3 h MET 60 N 0.43 0.75 0.00 1.92 2.86 -1.52 -3.15 114.93 116.22 2jt3 h MET 60 Ca 0.64 -0.68 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 2jt3 h MET 60 Cb 1.28 0.17 -0.00 0.00 0.06 0.00 0.00 31.60 33.11 2jt3 h MET 60 CO -0.54 1.28 -0.05 0.82 1.06 0.00 0.00 176.91 179.48 2jt3 h ILE 61 N 0.48 0.81 -0.40 -1.22 2.04 -0.76 -1.93 117.51 116.53 2jt3 h ILE 61 Ca -0.08 -0.18 0.11 0.00 1.00 0.00 0.00 64.86 65.71 2jt3 h ILE 61 Cb 1.53 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 38.69 2jt3 h ILE 61 CO 0.18 0.05 0.53 -0.78 0.00 0.00 0.00 178.15 178.12 2jt3 h ASP 62 N 0.00 0.00 -0.08 1.72 3.58 -0.93 0.20 116.42 120.91 2jt3 h ASP 62 Ca -0.00 0.00 0.02 0.00 0.42 0.00 0.00 57.03 57.47 2jt3 h ASP 62 Cb 0.10 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.15 2jt3 h ASP 62 CO 0.01 0.00 0.25 -0.33 -2.88 0.00 0.00 179.24 176.28 2jt3 h GLU 63 N 0.00 0.00 -4.77 0.28 4.39 -1.54 -3.46 114.58 109.48 2jt3 h GLU 63 Ca 0.19 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.89 2jt3 h GLU 63 Cb 1.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 2jt3 h GLU 63 CO -0.00 0.00 -0.49 0.28 -1.16 0.00 0.00 179.01 177.63 2jt3 n VAL 64 N -3.20 -9.40 -1.44 3.13 0.31 0.70 -4.78 118.33 103.65 2jt3 n VAL 64 Ca -0.01 0.90 -0.50 0.00 -0.01 0.00 0.00 64.34 64.73 2jt3 n VAL 64 Cb 0.33 -6.54 -0.07 0.00 -0.91 0.00 0.00 33.84 26.64 2jt3 n VAL 64 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2jt3 n ASP 65 N -0.11 2.03 0.05 4.52 2.03 -1.26 -4.81 116.55 119.00 2jt3 n ASP 65 Ca 0.07 0.39 -0.16 0.00 0.52 0.00 0.00 54.79 55.61 2jt3 n ASP 65 Cb 0.27 -1.25 -0.14 0.00 -0.72 0.00 0.00 41.12 39.28 2jt3 n ASP 65 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 2jt3 h GLU 66 N 12.42 0.22 -0.59 -0.67 4.22 -1.99 -3.31 114.58 124.88 2jt3 h GLU 66 Ca -0.26 -0.37 0.17 0.00 0.08 0.00 0.00 59.36 58.98 2jt3 h GLU 66 Cb 1.32 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 30.69 2jt3 h GLU 66 CO 1.03 1.06 0.51 0.38 -2.18 0.00 0.00 179.01 179.81 2jt3 h ASP 67 N 0.06 0.00 0.00 1.04 2.03 -2.00 -3.45 116.42 114.10 2jt3 h ASP 67 Ca -0.25 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.05 2jt3 h ASP 67 Cb 2.01 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 40.51 2jt3 h ASP 67 CO 0.15 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.97 2jt3 n GLY 68 N -1.59 0.33 0.07 7.15 0.00 -1.25 -4.85 105.19 105.06 2jt3 n GLY 68 Ca 0.11 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.25 2jt3 n GLY 68 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jt3 n SER 69 N -0.34 0.63 0.00 1.61 3.41 -1.26 -5.00 113.62 112.68 2jt3 n SER 69 Ca 0.00 0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 2jt3 n SER 69 Cb 0.17 0.75 0.00 0.00 -0.26 0.00 0.00 64.21 64.87 2jt3 n SER 69 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jt3 n GLY 70 N 1.27 2.05 3.63 5.00 0.00 -1.26 -4.90 105.19 110.99 2jt3 n GLY 70 Ca 0.00 -0.30 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 2jt3 n GLY 70 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2jt3 s THR 71 N 0.00 0.90 -0.64 2.61 -1.32 -1.26 -4.74 115.64 111.19 2jt3 s THR 71 Ca 0.00 -2.00 -0.23 0.00 -1.21 0.00 0.00 61.69 58.25 2jt3 s THR 71 Cb 0.00 -2.28 0.06 0.00 -1.51 0.00 0.00 72.50 68.77 2jt3 s THR 71 CO 0.00 0.00 0.97 -0.69 -2.21 0.00 0.00 174.62 172.69 2jt3 s VAL 72 N -3.04 4.30 0.00 5.08 1.01 -1.26 -4.94 120.40 121.55 2jt3 s VAL 72 Ca 0.16 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 61.96 2jt3 s VAL 72 Cb 0.02 -4.66 0.00 0.00 0.00 0.00 0.00 36.38 31.74 2jt3 s VAL 72 CO 0.09 -1.40 0.00 -0.90 0.00 0.00 0.00 175.10 172.89 2jt3 n ASP 73 N 7.74 0.00 -0.35 3.32 5.75 -1.26 -2.12 116.55 129.63 2jt3 n ASP 73 Ca -0.02 -0.70 0.00 0.00 -0.01 0.00 0.00 54.79 54.06 2jt3 n ASP 73 Cb 0.46 0.00 0.16 0.00 -1.03 0.00 0.00 41.12 40.71 2jt3 n ASP 73 CO 0.00 0.00 0.00 2.19 -0.11 0.00 0.00 177.20 179.28 2jt3 h PHE 74 N -0.56 1.20 -0.00 2.11 -0.00 -1.92 0.37 116.94 118.14 2jt3 h PHE 74 Ca 0.00 0.03 -0.00 0.00 -0.00 0.00 0.00 57.97 58.00 2jt3 h PHE 74 Cb 0.00 -0.40 0.00 0.00 -0.00 0.00 0.00 35.95 35.55 2jt3 h PHE 74 CO 0.00 0.70 -0.01 0.22 -0.00 0.00 0.00 178.31 179.23 2jt3 h ASP 75 N 1.25 0.01 0.20 -0.68 3.58 -1.99 -3.19 116.42 115.59 2jt3 h ASP 75 Ca 0.38 -0.63 -0.03 0.00 0.42 0.00 0.00 57.03 57.17 2jt3 h ASP 75 Cb -0.03 -0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.01 2jt3 h ASP 75 CO -0.11 0.64 -0.12 -0.08 -2.88 0.00 0.00 179.24 176.69 2jt3 h GLU 76 N -0.62 0.00 -0.23 0.28 4.81 -1.85 -2.81 114.58 114.16 2jt3 h GLU 76 Ca -0.00 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.27 2jt3 h GLU 76 Cb 0.64 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.98 2jt3 h GLU 76 CO 0.00 0.12 -0.02 0.35 -0.73 0.00 0.00 179.01 178.73 2jt3 h PHE 77 N 0.00 -0.05 -0.67 0.92 3.57 -0.25 0.36 116.94 120.82 2jt3 h PHE 77 Ca -0.00 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.59 2jt3 h PHE 77 Cb 0.26 0.06 -0.06 0.00 2.79 0.00 0.00 35.95 38.99 2jt3 h PHE 77 CO 0.00 -0.06 0.35 -0.07 -2.23 0.00 0.00 178.31 176.30 2jt3 h LEU 78 N 0.05 0.50 -0.76 0.59 3.38 -1.55 -0.19 115.31 117.31 2jt3 h LEU 78 Ca 0.11 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2jt3 h LEU 78 Cb 0.15 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2jt3 h LEU 78 CO -0.21 0.31 0.00 0.58 0.09 0.00 0.00 178.44 179.21 2jt3 h VAL 79 N 0.63 0.00 -0.86 1.22 2.07 -1.45 -3.18 116.25 114.68 2jt3 h VAL 79 Ca 0.31 -0.71 0.11 0.00 0.82 0.00 0.00 66.70 67.23 2jt3 h VAL 79 Cb 0.25 1.70 -0.06 0.00 -1.52 0.00 0.00 31.29 31.65 2jt3 h VAL 79 CO -0.21 0.00 0.56 -0.03 0.02 0.00 0.00 177.57 177.91 2jt3 h MET 80 N 0.00 0.78 0.57 1.57 -1.53 0.16 0.15 114.93 116.64 2jt3 h MET 80 Ca 0.00 -0.05 -0.03 0.00 -3.44 0.00 0.00 59.70 56.18 2jt3 h MET 80 Cb 0.72 -0.18 0.01 0.00 -0.55 0.00 0.00 31.60 31.60 2jt3 h MET 80 CO 0.00 0.52 -0.27 1.98 0.14 0.00 0.00 176.91 179.27 2jt3 h MET 81 N 0.81 -0.74 -0.13 0.39 -1.53 -1.57 0.23 114.93 112.40 2jt3 h MET 81 Ca 0.41 0.05 0.04 0.00 -3.44 0.00 0.00 59.70 56.75 2jt3 h MET 81 Cb 0.48 0.17 -0.01 0.00 -0.55 0.00 0.00 31.60 31.69 2jt3 h MET 81 CO -0.17 -0.49 0.15 -0.24 0.14 0.00 0.00 176.91 176.30 2jt3 h VAL 82 N -0.93 0.46 0.20 -5.77 3.04 -1.67 -1.47 116.25 110.10 2jt3 h VAL 82 Ca -0.08 0.00 -0.28 0.00 -1.01 0.00 0.00 66.70 65.33 2jt3 h VAL 82 Cb 0.59 0.88 0.03 0.00 -2.01 0.00 0.00 31.29 30.78 2jt3 h VAL 82 CO 0.13 0.00 -1.22 -0.09 -1.01 0.00 0.00 177.57 175.38 2jt3 h ARG 83 N 0.00 0.48 -0.42 4.17 2.43 -0.56 -3.26 114.38 117.21 2jt3 h ARG 83 Ca 0.06 -0.78 0.12 0.00 -0.81 0.00 0.00 59.98 58.57 2jt3 h ARG 83 Cb 0.36 0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 30.18 2jt3 h ARG 83 CO -0.00 1.37 0.35 0.66 -1.51 0.00 0.00 179.97 180.83 2jt3 h SER 84 N 0.00 0.00 0.00 -3.80 4.64 0.57 -3.15 113.55 111.81 2jt3 h SER 84 Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 2jt3 h SER 84 Cb 1.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.04 2jt3 h SER 84 CO 0.23 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.42 2jt3 n MET 85 N -4.11 0.00 -1.96 4.77 2.81 -1.14 -4.77 117.12 112.71 2jt3 n MET 85 Ca 0.07 0.01 -0.06 0.00 -1.81 0.00 0.00 57.70 55.91 2jt3 n MET 85 Cb 0.54 -0.97 -0.01 0.00 -0.71 0.00 0.00 33.22 32.07 2jt3 n MET 85 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 2jt3 n LYS 86 N -0.48 -2.04 -1.39 0.03 2.85 -1.19 -4.89 118.16 111.06 2jt3 n LYS 86 Ca 0.00 0.31 -0.29 0.00 -1.05 0.00 0.00 58.31 57.28 2jt3 n LYS 86 Cb 0.00 -4.69 0.13 0.00 -0.65 0.00 0.00 35.03 29.82 2jt3 n LYS 86 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 2jt3 s ASP 87 N -1.82 3.59 1.09 -5.58 1.11 -1.26 -5.01 116.67 108.78 2jt3 s ASP 87 Ca 0.00 1.23 -0.12 0.00 0.18 0.00 0.00 52.55 53.84 2jt3 s ASP 87 Cb 0.00 -1.90 0.24 0.00 1.07 0.00 0.00 42.92 42.34 2jt3 s ASP 87 CO 0.00 -2.53 1.07 1.51 1.18 0.00 0.00 175.17 176.40 2jt3 s ASP 88 N -3.73 1.55 -1.31 0.27 1.47 -1.26 -3.72 116.67 109.94 2jt3 s ASP 88 Ca 0.63 1.78 -0.04 0.00 1.18 0.00 0.00 52.55 56.10 2jt3 s ASP 88 Cb -0.16 -2.42 0.01 0.00 -0.34 0.00 0.00 42.92 40.01 2jt3 s ASP 88 CO 0.55 -3.89 0.98 -0.24 0.68 0.00 0.00 175.17 173.25 2jt3 n SER 89 N -4.73 -3.40 -3.87 2.11 2.88 -1.26 -5.00 113.62 100.35 2jt3 n SER 89 Ca 0.06 -0.66 -0.23 0.00 -1.33 0.00 0.00 58.87 56.70 2jt3 n SER 89 Cb 0.53 -4.70 -0.17 0.00 -0.75 0.00 0.00 64.21 59.13 2jt3 n SER 89 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 2jt3 s LYS 90 N -5.93 1.04 0.00 -1.46 2.20 -1.24 -5.13 119.74 109.22 2jt3 s LYS 90 Ca 0.25 -0.11 0.00 0.00 -0.36 0.00 0.00 55.97 55.75 2jt3 s LYS 90 Cb -0.12 -1.14 0.00 0.00 -1.51 0.00 0.00 37.83 35.06 2jt3 s LYS 90 CO 0.76 -0.19 0.00 0.41 -0.36 0.00 0.00 175.35 175.97 2jt3 n GLY 91 N 4.60 5.66 3.55 5.54 0.00 -1.26 -5.05 105.19 118.22 2jt3 n GLY 91 Ca -0.16 -1.47 -0.32 0.00 0.00 0.00 0.00 46.02 44.07 2jt3 n GLY 91 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jt3 n LYS 92 N 0.00 -0.31 -3.52 1.61 4.76 -1.26 -4.97 118.16 114.47 2jt3 n LYS 92 Ca 0.00 -0.03 -0.38 0.00 -2.87 0.00 0.00 58.31 55.03 2jt3 n LYS 92 Cb 0.00 -2.13 -0.09 0.00 -1.84 0.00 0.00 35.03 30.98 2jt3 n LYS 92 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2jt3 s SER 93 N -2.27 6.24 0.19 4.39 0.01 -1.26 -4.98 113.70 116.02 2jt3 s SER 93 Ca 0.63 0.27 -0.11 0.00 1.31 0.00 0.00 55.95 58.04 2jt3 s SER 93 Cb -0.23 -2.16 0.20 0.00 0.21 0.00 0.00 66.02 64.04 2jt3 s SER 93 CO 0.62 -0.03 1.77 -0.08 0.41 0.00 0.00 173.24 175.93 2jt3 h GLU 94 N 7.62 0.48 -0.65 12.44 4.81 -1.99 -0.44 114.58 136.85 2jt3 h GLU 94 Ca -0.36 -0.03 0.17 0.00 -0.13 0.00 0.00 59.36 59.01 2jt3 h GLU 94 Cb 1.17 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.41 2jt3 h GLU 94 CO 0.67 0.32 0.46 1.05 -0.73 0.00 0.00 179.01 180.77 2jt3 h GLU 95 N 0.49 0.14 0.00 1.92 9.09 -2.00 -0.98 114.58 123.24 2jt3 h GLU 95 Ca 0.26 -0.01 -0.00 0.00 0.05 0.00 0.00 59.36 59.67 2jt3 h GLU 95 Cb 0.23 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 27.30 2jt3 h GLU 95 CO -0.21 0.09 -0.00 1.49 0.05 0.00 0.00 179.01 180.43 2jt3 h GLU 96 N 0.14 -0.00 -0.04 1.06 4.57 -1.50 -3.23 114.58 115.58 2jt3 h GLU 96 Ca 0.32 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.51 2jt3 h GLU 96 Cb 1.05 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.64 2jt3 h GLU 96 CO -0.04 0.84 0.10 -0.07 -1.18 0.00 0.00 179.01 178.66 2jt3 h LEU 97 N -0.84 0.00 -0.17 1.64 4.07 -0.55 -1.09 115.31 118.37 2jt3 h LEU 97 Ca -0.00 0.00 -0.14 0.00 0.08 0.00 0.00 57.88 57.82 2jt3 h LEU 97 Cb 0.84 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.58 2jt3 h LEU 97 CO 0.00 0.00 -0.44 0.77 -1.08 0.00 0.00 178.44 177.69 2jt3 h SER 98 N 0.00 0.68 1.23 -0.43 4.64 -1.23 -3.07 113.55 115.37 2jt3 h SER 98 Ca 0.02 -0.58 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 2jt3 h SER 98 Cb 0.23 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2jt3 h SER 98 CO -0.00 1.13 0.00 0.47 -0.87 0.00 0.00 176.83 177.56 2jt3 n ASP 99 N -4.24 0.40 0.42 4.97 9.92 -0.51 -3.41 116.55 124.11 2jt3 n ASP 99 Ca -0.07 0.54 -0.17 0.00 -0.53 0.00 0.00 54.79 54.56 2jt3 n ASP 99 Cb 0.56 -0.64 -0.08 0.00 -0.64 0.00 0.00 41.12 40.31 2jt3 n ASP 99 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 2jt3 h LEU 100 N 0.00 -0.92 -1.45 0.64 3.38 -1.20 0.29 115.31 116.04 2jt3 h LEU 100 Ca 0.00 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 2jt3 h LEU 100 Cb 0.62 0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 2jt3 h LEU 100 CO 0.00 -0.57 -0.26 2.19 0.09 0.00 0.00 178.44 179.90 2jt3 h PHE 101 N -1.27 0.00 -0.11 1.13 -5.15 -1.68 0.21 116.94 110.08 2jt3 h PHE 101 Ca -0.11 0.00 -0.24 0.00 -0.20 0.00 0.00 57.97 57.42 2jt3 h PHE 101 Cb 0.84 0.00 0.01 0.00 0.22 0.00 0.00 35.95 37.02 2jt3 h PHE 101 CO -0.00 0.26 -0.86 0.00 -2.00 0.00 0.00 178.31 175.71 2jt3 h ARG 102 N 0.00 0.76 0.00 6.09 3.08 -1.55 -2.29 114.38 120.47 2jt3 h ARG 102 Ca -0.00 -0.68 -0.11 0.00 0.07 0.00 0.00 59.98 59.26 2jt3 h ARG 102 Cb 0.57 0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.76 2jt3 h ARG 102 CO 0.03 1.27 -0.75 0.52 -1.07 0.00 0.00 179.97 179.98 2jt3 h MET 103 N 0.50 0.00 0.00 0.04 2.86 -0.17 -3.28 114.93 114.87 2jt3 h MET 103 Ca -0.08 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.41 2jt3 h MET 103 Cb 1.50 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.13 2jt3 h MET 103 CO 0.17 0.37 -0.72 0.35 1.06 0.00 0.00 176.91 178.14 2jt3 h PHE 104 N 0.00 0.00 -1.97 -0.22 3.57 -0.61 -3.45 116.94 114.26 2jt3 h PHE 104 Ca -0.05 0.00 -0.63 0.00 3.53 0.00 0.00 57.97 60.82 2jt3 h PHE 104 Cb 1.38 0.00 0.02 0.00 2.79 0.00 0.00 35.95 40.14 2jt3 h PHE 104 CO 0.00 0.72 1.04 -3.47 -2.23 0.00 0.00 178.31 174.37 2jt3 n ASP 105 N -3.47 3.24 0.05 0.41 -0.08 -0.86 -4.86 116.55 110.97 2jt3 n ASP 105 Ca 0.00 1.00 -0.16 0.00 -1.51 0.00 0.00 54.79 54.12 2jt3 n ASP 105 Cb 0.76 -1.34 -0.14 0.00 2.34 0.00 0.00 41.12 42.74 2jt3 n ASP 105 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2jt3 h LYS 106 N 8.61 0.21 0.00 -0.67 6.56 -1.91 -3.35 116.57 126.02 2jt3 h LYS 106 Ca -0.48 -0.36 0.00 0.00 -1.06 0.00 0.00 60.65 58.75 2jt3 h LYS 106 Cb 1.28 0.14 0.00 0.00 -0.57 0.00 0.00 32.23 33.07 2jt3 h LYS 106 CO 0.94 1.05 -1.06 0.09 -2.06 0.00 0.00 179.45 178.41 2jt3 n ASN 107 N -3.41 0.83 -2.98 0.86 3.02 -1.26 -5.02 115.26 107.31 2jt3 n ASN 107 Ca -0.17 -0.73 -0.13 0.00 -0.03 0.00 0.00 54.58 53.52 2jt3 n ASN 107 Cb 1.04 1.18 0.06 0.00 -0.61 0.00 0.00 39.78 41.45 2jt3 n ASN 107 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jt3 n ALA 108 N -1.58 -1.98 -0.05 5.41 0.00 -1.26 -4.95 120.51 116.11 2jt3 n ALA 108 Ca 0.02 0.06 -0.02 0.00 0.00 0.00 0.00 53.44 53.50 2jt3 n ALA 108 Cb 0.32 -3.88 -0.15 0.00 0.00 0.00 0.00 19.45 15.75 2jt3 n ALA 108 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2jt3 n ASP 109 N -2.87 0.17 0.00 0.00 8.00 -1.26 -5.01 116.55 115.58 2jt3 n ASP 109 Ca -0.13 0.08 0.00 0.00 0.71 0.00 0.00 54.79 55.45 2jt3 n ASP 109 Cb 0.61 1.14 0.00 0.00 -0.02 0.00 0.00 41.12 42.85 2jt3 n ASP 109 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jt3 n GLY 110 N 1.53 2.43 3.83 0.44 0.00 -1.26 -5.09 105.19 107.06 2jt3 n GLY 110 Ca -0.19 -0.72 -0.24 0.00 0.00 0.00 0.00 46.02 44.87 2jt3 n GLY 110 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jt3 s TYR 111 N -0.28 2.37 -0.15 1.61 2.02 -1.26 -4.58 117.35 117.08 2jt3 s TYR 111 Ca 0.00 -0.63 0.02 0.00 -0.37 0.00 0.00 57.07 56.09 2jt3 s TYR 111 Cb 0.00 -2.02 0.02 0.00 -0.40 0.00 0.00 41.96 39.56 2jt3 s TYR 111 CO 0.00 -0.10 -0.19 0.42 -1.57 0.00 0.00 175.55 174.11 2jt3 s ILE 112 N -2.60 1.87 0.37 2.71 -1.09 0.12 -4.68 121.20 117.89 2jt3 s ILE 112 Ca 0.41 -0.84 -0.05 0.00 -2.23 0.00 0.00 60.65 57.94 2jt3 s ILE 112 Cb -0.00 -1.69 0.08 0.00 -1.58 0.00 0.00 42.46 39.27 2jt3 s ILE 112 CO 0.24 0.51 0.50 0.47 -1.23 0.00 0.00 174.94 175.43 2jt3 n ASP 113 N 4.39 0.16 0.02 3.58 9.92 -1.26 -0.30 116.55 133.06 2jt3 n ASP 113 Ca -0.20 -1.26 -0.16 0.00 -0.53 0.00 0.00 54.79 52.65 2jt3 n ASP 113 Cb 0.51 -0.37 -0.05 0.00 -0.64 0.00 0.00 41.12 40.56 2jt3 n ASP 113 CO 0.00 0.00 0.00 0.17 0.13 0.00 0.00 177.20 177.50 2jt3 h LEU 114 N 0.00 0.79 -2.17 0.64 8.10 -1.94 -2.86 115.31 117.87 2jt3 h LEU 114 Ca -0.16 -0.55 0.04 0.00 0.11 0.00 0.00 57.88 57.32 2jt3 h LEU 114 Cb 0.48 -0.24 -0.01 0.00 -0.44 0.00 0.00 40.66 40.46 2jt3 h LEU 114 CO 0.13 1.34 0.13 0.44 -4.11 0.00 0.00 178.44 176.36 2jt3 h ASP 115 N 0.42 0.00 0.00 0.17 3.32 -1.97 0.10 116.42 118.47 2jt3 h ASP 115 Ca -0.06 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 2jt3 h ASP 115 Cb 1.46 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.00 2jt3 h ASP 115 CO 0.16 0.00 -0.12 -0.33 -1.72 0.00 0.00 179.24 177.23 2jt3 h GLU 116 N 0.00 0.00 0.00 3.56 5.08 -1.92 -3.33 114.58 117.98 2jt3 h GLU 116 Ca 0.07 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 2jt3 h GLU 116 Cb 0.33 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 2jt3 h GLU 116 CO -0.00 0.78 -0.04 1.37 -1.00 0.00 0.00 179.01 180.12 2jt3 h LEU 117 N -1.00 0.00 -0.75 1.33 8.10 -1.24 -2.21 115.31 119.54 2jt3 h LEU 117 Ca -0.03 0.00 0.02 0.00 0.11 0.00 0.00 57.88 57.98 2jt3 h LEU 117 Cb 0.82 0.00 -0.04 0.00 -0.44 0.00 0.00 40.66 41.00 2jt3 h LEU 117 CO -0.02 0.04 0.48 0.50 -4.11 0.00 0.00 178.44 175.34 2jt3 h LYS 118 N 0.00 0.94 -0.37 0.17 3.64 -0.91 -1.28 116.57 118.76 2jt3 h LYS 118 Ca -0.00 -0.06 0.11 0.00 -1.27 0.00 0.00 60.65 59.43 2jt3 h LYS 118 Cb 0.09 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 2jt3 h LYS 118 CO 0.01 0.62 0.53 0.82 -2.27 0.00 0.00 179.45 179.15 2jt3 h ILE 119 N 0.96 0.23 -0.20 2.00 2.04 -1.50 0.29 117.51 121.34 2jt3 h ILE 119 Ca 0.29 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.20 2jt3 h ILE 119 Cb -0.05 0.56 -0.06 0.00 -0.74 0.00 0.00 36.82 36.53 2jt3 h ILE 119 CO -0.09 0.00 -0.20 -0.03 0.00 0.00 0.00 178.15 177.83 2jt3 h MET 120 N 0.00 -0.21 -0.22 2.37 4.05 -1.36 -1.15 114.93 118.41 2jt3 h MET 120 Ca 0.18 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.61 2jt3 h MET 120 Cb 1.23 0.05 0.00 0.00 -0.80 0.00 0.00 31.60 32.08 2jt3 h MET 120 CO -0.00 -0.14 0.00 1.47 0.23 0.00 0.00 176.91 178.46 2jt3 n LEU 121 N -5.35 2.74 -0.01 3.39 -0.00 -0.52 -4.05 117.00 113.21 2jt3 n LEU 121 Ca -0.02 -2.19 0.07 0.00 -0.00 0.00 0.00 56.01 53.87 2jt3 n LEU 121 Cb 0.26 -0.22 -0.12 0.00 -0.00 0.00 0.00 43.42 43.35 2jt3 n LEU 121 CO 0.17 0.66 -0.70 1.67 -0.00 0.00 0.00 177.39 179.19 2jt3 n GLN 122 N -0.02 0.53 -0.08 1.47 7.27 0.91 -3.45 117.38 124.02 2jt3 n GLN 122 Ca 0.10 -0.14 -0.09 0.00 0.07 0.00 0.00 57.00 56.95 2jt3 n GLN 122 Cb 0.45 -1.37 -0.10 0.00 2.41 0.00 0.00 30.24 31.62 2jt3 n GLN 122 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2jt3 n ALA 123 N -2.07 1.64 -0.24 1.69 0.00 -0.45 -4.48 120.51 116.61 2jt3 n ALA 123 Ca -0.04 -0.87 0.29 0.00 0.00 0.00 0.00 53.44 52.82 2jt3 n ALA 123 Cb 0.44 -0.01 0.69 0.00 0.00 0.00 0.00 19.45 20.58 2jt3 n ALA 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jt3 h THR 124 N 0.00 0.52 0.00 0.00 1.03 -1.70 -3.45 112.91 109.31 2jt3 h THR 124 Ca -0.39 -0.02 0.00 0.00 -0.01 0.00 0.00 66.41 65.99 2jt3 h THR 124 Cb 1.79 0.44 0.00 0.00 -1.07 0.00 0.00 68.15 69.31 2jt3 h THR 124 CO -0.01 0.01 0.00 0.61 -0.01 0.00 0.00 175.52 176.13 2jt3 n GLY 125 N -1.69 1.69 1.04 2.99 0.00 -1.26 -5.13 105.19 102.83 2jt3 n GLY 125 Ca 0.21 -0.13 -0.08 0.00 0.00 0.00 0.00 46.02 46.02 2jt3 n GLY 125 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2jt3 n GLU 126 N 0.00 -0.70 -3.61 1.61 4.07 -1.26 -5.00 120.64 115.76 2jt3 n GLU 126 Ca 0.00 -0.55 -0.03 0.00 -0.06 0.00 0.00 57.16 56.52 2jt3 n GLU 126 Cb 0.00 -0.40 -0.06 0.00 -0.06 0.00 0.00 31.44 30.92 2jt3 n GLU 126 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 2jt3 s THR 127 N -1.74 -0.22 0.46 6.31 -1.32 -1.22 -4.06 115.64 113.85 2jt3 s THR 127 Ca 0.21 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.71 2jt3 s THR 127 Cb -0.01 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 69.99 2jt3 s THR 127 CO 0.15 0.00 0.67 -0.63 -2.21 0.00 0.00 174.62 172.59 2jt3 s ILE 128 N 1.83 3.46 0.68 5.08 -1.09 -1.26 -5.09 121.20 124.82 2jt3 s ILE 128 Ca -0.08 -0.67 -0.12 0.00 -2.23 0.00 0.00 60.65 57.54 2jt3 s ILE 128 Cb -0.06 -3.26 0.01 0.00 -1.58 0.00 0.00 42.46 37.57 2jt3 s ILE 128 CO -0.18 -0.16 1.07 0.42 -1.23 0.00 0.00 174.94 174.86 2jt3 s THR 129 N -2.55 3.74 0.04 2.92 -4.23 -1.26 -4.91 115.64 109.39 2jt3 s THR 129 Ca 0.52 0.66 0.30 0.00 -1.18 0.00 0.00 61.69 61.98 2jt3 s THR 129 Cb -0.10 -3.26 0.30 0.00 1.34 0.00 0.00 72.50 70.78 2jt3 s THR 129 CO 0.37 -0.65 1.91 -0.33 -0.54 0.00 0.00 174.62 175.37 2jt3 h GLU 130 N -0.41 0.00 0.00 3.99 4.39 -2.00 -0.83 114.58 119.72 2jt3 h GLU 130 Ca -0.45 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.15 2jt3 h GLU 130 Cb 1.22 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.86 2jt3 h GLU 130 CO 0.55 0.00 -0.48 -0.44 -1.16 0.00 0.00 179.01 177.49 2jt3 h ASP 131 N 0.00 0.00 0.02 1.42 3.32 -1.99 -2.38 116.42 116.81 2jt3 h ASP 131 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2jt3 h ASP 131 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 2jt3 h ASP 131 CO 0.00 0.48 -0.01 0.44 -1.72 0.00 0.00 179.24 178.43 2jt3 h ASP 132 N 0.00 -0.02 0.29 6.45 5.19 -1.51 -2.71 116.42 124.12 2jt3 h ASP 132 Ca -0.00 -0.74 -0.04 0.00 -0.62 0.00 0.00 57.03 55.63 2jt3 h ASP 132 Cb 1.11 0.01 -0.01 0.00 0.18 0.00 0.00 39.33 40.62 2jt3 h ASP 132 CO 0.06 0.77 -0.18 0.40 -3.12 0.00 0.00 179.24 177.17 2jt3 h ILE 133 N -0.85 0.89 0.08 0.35 5.03 -1.62 0.38 117.51 121.76 2jt3 h ILE 133 Ca -0.00 -0.67 -0.00 0.00 -0.12 0.00 0.00 64.86 64.06 2jt3 h ILE 133 Cb 0.76 1.39 0.00 0.00 -3.03 0.00 0.00 36.82 35.94 2jt3 h ILE 133 CO 0.00 0.18 -0.04 -0.33 -0.68 0.00 0.00 178.15 177.28 2jt3 h GLU 134 N 0.00 -0.10 -0.03 2.37 5.08 -1.49 -2.85 114.58 117.56 2jt3 h GLU 134 Ca -0.00 0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.20 2jt3 h GLU 134 Cb 0.37 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2jt3 h GLU 134 CO 0.02 0.41 -0.71 0.93 -1.00 0.00 0.00 179.01 178.66 2jt3 h GLU 135 N -0.68 0.19 0.15 2.33 4.39 -1.34 -3.28 114.58 116.35 2jt3 h GLU 135 Ca -0.01 -0.16 0.01 0.00 0.34 0.00 0.00 59.36 59.54 2jt3 h GLU 135 Cb 0.55 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.22 2jt3 h GLU 135 CO 0.02 0.82 -0.17 1.25 -1.16 0.00 0.00 179.01 179.77 2jt3 h LEU 136 N 0.13 -0.47 -1.19 1.33 6.46 -0.31 -2.18 115.31 119.07 2jt3 h LEU 136 Ca -0.02 0.05 0.22 0.00 -0.12 0.00 0.00 57.88 58.00 2jt3 h LEU 136 Cb 1.26 0.17 -0.10 0.00 -0.73 0.00 0.00 40.66 41.26 2jt3 h LEU 136 CO 0.11 -0.26 0.62 -0.03 -0.62 0.00 0.00 178.44 178.26 2jt3 h MET 137 N -0.37 0.57 -0.76 1.25 4.05 -1.56 0.35 114.93 118.47 2jt3 h MET 137 Ca 0.01 -0.03 0.21 0.00 -0.28 0.00 0.00 59.70 59.61 2jt3 h MET 137 Cb 0.36 -0.13 -0.03 0.00 -0.80 0.00 0.00 31.60 31.00 2jt3 h MET 137 CO -0.06 0.38 0.54 1.57 0.23 0.00 0.00 176.91 179.57 2jt3 h LYS 138 N 0.59 0.05 0.03 0.39 2.10 -1.46 0.30 116.57 118.56 2jt3 h LYS 138 Ca 0.57 -0.00 -0.36 0.00 -2.00 0.00 0.00 60.65 58.85 2jt3 h LYS 138 Cb 1.13 -0.01 -0.05 0.00 -0.90 0.00 0.00 32.23 32.40 2jt3 h LYS 138 CO -0.33 0.03 -2.05 -3.47 -2.00 0.00 0.00 179.45 171.63 2jt3 n ASP 139 N -4.34 1.97 0.28 7.07 -0.08 0.10 -4.29 116.55 117.27 2jt3 n ASP 139 Ca 0.15 0.24 0.14 0.00 -1.51 0.00 0.00 54.79 53.82 2jt3 n ASP 139 Cb 0.79 -0.79 0.87 0.00 2.34 0.00 0.00 41.12 44.33 2jt3 n ASP 139 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 2jt3 h GLY 140 N 0.01 0.00 -7.71 0.27 0.00 -0.58 -3.37 103.07 91.69 2jt3 h GLY 140 Ca -0.52 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.12 2jt3 h GLY 140 CO -0.19 0.00 -0.67 -0.35 0.00 0.00 0.00 176.54 175.33 2jt3 s ASP 141 N -6.27 5.00 0.55 0.19 2.15 0.10 -4.41 116.67 113.97 2jt3 s ASP 141 Ca -0.05 -1.40 0.31 0.00 0.43 0.00 0.00 52.55 51.83 2jt3 s ASP 141 Cb 0.15 -1.75 1.63 0.00 -0.30 0.00 0.00 42.92 42.66 2jt3 s ASP 141 CO 0.57 -0.32 2.13 0.11 -0.17 0.00 0.00 175.17 177.49 2jt3 h LYS 142 N 8.02 0.00 0.09 4.34 1.79 -1.83 -2.26 116.57 126.72 2jt3 h LYS 142 Ca -0.20 0.00 -0.28 0.00 -2.18 0.00 0.00 60.65 58.00 2jt3 h LYS 142 Cb 1.06 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.70 2jt3 h LYS 142 CO 0.57 0.08 -1.38 -0.97 -1.08 0.00 0.00 179.45 176.67 2jt3 h ASN 143 N 0.00 0.28 -5.09 0.86 -1.24 -1.92 -3.49 115.58 104.99 2jt3 h ASN 143 Ca -0.00 -0.36 -0.28 0.00 0.71 0.00 0.00 56.30 56.37 2jt3 h ASN 143 Cb 0.26 -0.09 0.14 0.00 0.73 0.00 0.00 38.32 39.36 2jt3 h ASN 143 CO 0.01 1.30 -0.65 0.59 -1.29 0.00 0.00 177.43 177.38 2jt3 n ASN 144 N -3.41 -2.10 0.00 1.15 4.13 -0.85 -4.94 115.26 109.24 2jt3 n ASN 144 Ca -0.11 -0.53 0.00 0.00 1.68 0.00 0.00 54.58 55.62 2jt3 n ASN 144 Cb 1.02 -4.43 0.00 0.00 -1.54 0.00 0.00 39.78 34.83 2jt3 n ASN 144 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 2jt3 n ASP 145 N -2.81 4.37 0.00 6.41 5.68 -1.26 -5.04 116.55 123.90 2jt3 n ASP 145 Ca -0.24 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.05 2jt3 n ASP 145 Cb 0.64 0.32 0.00 0.00 -1.14 0.00 0.00 41.12 40.94 2jt3 n ASP 145 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jt3 n GLY 146 N 3.01 1.12 3.44 6.12 0.00 -1.26 -5.15 105.19 112.46 2jt3 n GLY 146 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2jt3 n GLY 146 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2jt3 s ARG 147 N 0.00 0.59 -0.40 1.61 1.70 -1.26 -4.51 118.95 116.69 2jt3 s ARG 147 Ca 0.00 0.83 -0.01 0.00 -0.47 0.00 0.00 55.73 56.08 2jt3 s ARG 147 Cb 0.00 0.21 0.11 0.00 -0.57 0.00 0.00 34.95 34.70 2jt3 s ARG 147 CO 0.00 -0.10 0.17 0.42 -1.08 0.00 0.00 175.30 174.71 2jt3 s ILE 148 N 0.71 3.04 0.00 4.99 -1.09 0.59 -4.77 121.20 124.67 2jt3 s ILE 148 Ca -0.03 -2.15 0.00 0.00 -2.23 0.00 0.00 60.65 56.23 2jt3 s ILE 148 Cb -0.05 -3.11 0.00 0.00 -1.58 0.00 0.00 42.46 37.72 2jt3 s ILE 148 CO -0.05 -0.67 0.00 -0.90 -1.23 0.00 0.00 174.94 172.09 2jt3 n ASP 149 N 4.48 -0.08 0.14 3.58 5.75 -1.26 0.15 116.55 129.31 2jt3 n ASP 149 Ca -0.00 -0.80 -0.11 0.00 -0.01 0.00 0.00 54.79 53.87 2jt3 n ASP 149 Cb 0.41 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.44 2jt3 n ASP 149 CO 0.00 0.00 0.00 0.22 -0.11 0.00 0.00 177.20 177.31 2jt3 h TYR 150 N -0.88 -0.87 -0.52 2.11 5.03 -1.99 0.38 116.97 120.23 2jt3 h TYR 150 Ca 0.00 0.01 0.10 0.00 2.58 0.00 0.00 58.73 61.42 2jt3 h TYR 150 Cb 0.00 0.35 -0.08 0.00 1.55 0.00 0.00 36.73 38.55 2jt3 h TYR 150 CO 0.00 -0.39 0.04 -0.44 -1.32 0.00 0.00 178.16 176.05 2jt3 h ASP 151 N -0.56 -0.14 -0.21 -2.11 3.32 -2.00 0.11 116.42 114.84 2jt3 h ASP 151 Ca -0.03 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2jt3 h ASP 151 Cb 0.50 0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.23 2jt3 h ASP 151 CO -0.08 -0.04 0.14 -0.33 -1.72 0.00 0.00 179.24 177.21 2jt3 h GLU 152 N 0.16 0.26 -0.10 3.56 5.08 -1.82 -1.35 114.58 120.37 2jt3 h GLU 152 Ca 0.27 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 58.48 2jt3 h GLU 152 Cb 0.40 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2jt3 h GLU 152 CO -0.40 0.18 -0.53 2.35 -1.00 0.00 0.00 179.01 179.60 2jt3 h TRP 153 N 0.27 0.36 -0.22 4.33 2.91 0.23 -1.77 115.95 122.07 2jt3 h TRP 153 Ca 0.08 -0.13 -0.09 0.00 1.13 0.00 0.00 58.89 59.88 2jt3 h TRP 153 Cb -0.02 -0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 28.55 2jt3 h TRP 153 CO -0.00 0.77 -0.26 -0.07 -1.03 0.00 0.00 178.44 177.85 2jt3 h LEU 154 N 0.23 0.42 0.14 0.65 -0.00 -0.21 -3.01 115.31 113.53 2jt3 h LEU 154 Ca 0.00 -0.14 -0.30 0.00 -0.00 0.00 0.00 57.88 57.45 2jt3 h LEU 154 Cb 1.02 -0.11 0.02 0.00 -0.00 0.00 0.00 40.66 41.58 2jt3 h LEU 154 CO 0.09 0.68 -1.30 -0.33 -0.00 0.00 0.00 178.44 177.57 2jt3 h GLU 155 N 0.37 0.42 -0.22 1.13 4.39 -1.36 -3.24 114.58 116.08 2jt3 h GLU 155 Ca 0.06 -0.67 0.06 0.00 0.34 0.00 0.00 59.36 59.15 2jt3 h GLU 155 Cb 0.65 0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 29.53 2jt3 h GLU 155 CO 0.05 1.31 0.26 0.35 -1.16 0.00 0.00 179.01 179.81 2jt3 h PHE 156 N 0.14 0.00 -0.73 4.33 3.57 -1.19 -0.49 116.94 122.57 2jt3 h PHE 156 Ca -0.18 0.00 -0.47 0.00 3.53 0.00 0.00 57.97 60.85 2jt3 h PHE 156 Cb 2.00 0.00 -0.21 0.00 2.79 0.00 0.00 35.95 40.53 2jt3 h PHE 156 CO 0.09 0.00 0.61 -0.12 -2.23 0.00 0.00 178.31 176.66 2jt3 n MET 157 N -3.74 2.17 0.08 1.11 1.56 -1.17 -4.31 117.12 112.81 2jt3 n MET 157 Ca 0.03 -2.36 0.01 0.00 -0.27 0.00 0.00 57.70 55.11 2jt3 n MET 157 Cb 0.39 -1.93 -0.03 0.00 2.15 0.00 0.00 33.22 33.80 2jt3 n MET 157 CO 0.00 0.00 0.00 1.57 -0.73 0.00 0.00 175.97 176.81 2jt3 h LYS 158 N 1.52 0.00 0.00 2.12 5.09 -1.28 -3.43 116.57 120.60 2jt3 h LYS 158 Ca 0.45 0.00 -0.10 0.00 0.09 0.00 0.00 60.65 61.09 2jt3 h LYS 158 Cb 1.17 0.00 -0.12 0.00 0.10 0.00 0.00 32.23 33.38 2jt3 h LYS 158 CO 1.09 0.39 -0.04 0.41 -2.09 0.00 0.00 179.45 179.22 2jt3 n GLY 159 N 1.31 -1.40 0.12 0.07 0.00 -1.26 -5.00 105.19 99.03 2jt3 n GLY 159 Ca -0.04 0.83 0.01 0.00 0.00 0.00 0.00 46.02 46.82 2jt3 n GLY 159 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2jt3 h VAL 160 N 1.11 0.92 0.00 1.61 2.07 -1.84 -3.54 116.25 116.58 2jt3 h VAL 160 Ca -0.26 -2.34 0.00 0.00 0.82 0.00 0.00 66.70 64.92 2jt3 h VAL 160 Cb 1.20 2.42 0.00 0.00 -1.52 0.00 0.00 31.29 33.39 2jt3 h VAL 160 CO -0.06 0.52 0.00 -0.62 0.02 0.00 0.00 177.57 177.43