#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jc3 n ASN 2 N 0.00 0.33 -4.89 6.12 0.23 -1.26 -4.71 115.26 111.08 2jc3 n ASN 2 Ca 0.00 -1.12 -0.23 0.00 -0.53 0.00 0.00 54.58 52.70 2jc3 n ASN 2 Cb 0.00 -0.17 -0.01 0.00 -2.08 0.00 0.00 39.78 37.52 2jc3 n ASN 2 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 2jc3 s THR 3 N -1.41 2.16 0.52 5.53 -4.23 -1.26 -4.99 115.64 111.97 2jc3 s THR 3 Ca 0.00 -1.40 0.21 0.00 -1.18 0.00 0.00 61.69 59.32 2jc3 s THR 3 Cb 0.00 -2.56 0.34 0.00 1.34 0.00 0.00 72.50 71.63 2jc3 s THR 3 CO 0.00 0.00 2.06 0.25 -0.54 0.00 0.00 174.62 176.39 2jc3 h LEU 4 N 0.86 0.03 -1.91 4.79 5.85 -1.99 -1.26 115.31 121.68 2jc3 h LEU 4 Ca -0.38 0.00 0.15 0.00 0.84 0.00 0.00 57.88 58.48 2jc3 h LEU 4 Cb 1.28 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 2jc3 h LEU 4 CO 0.57 0.02 0.40 -0.08 -0.34 0.00 0.00 178.44 179.00 2jc3 h GLU 5 N 0.03 0.09 0.00 1.25 4.81 -1.94 0.21 114.58 119.03 2jc3 h GLU 5 Ca 0.16 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 2jc3 h GLU 5 Cb 0.58 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.94 2jc3 h GLU 5 CO -0.01 0.06 0.00 1.04 -0.73 0.00 0.00 179.01 179.37 2jc3 n GLN 6 N -4.40 0.64 -0.24 1.92 3.00 -0.47 -2.65 117.38 115.17 2jc3 n GLN 6 Ca 0.10 0.01 0.09 0.00 -0.01 0.00 0.00 57.00 57.19 2jc3 n GLN 6 Cb 0.57 -1.50 0.24 0.00 0.00 0.00 0.00 30.24 29.56 2jc3 n GLN 6 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 2jc3 n THR 7 N -1.17 0.63 -3.45 5.09 -2.24 0.72 -4.87 114.28 109.00 2jc3 n THR 7 Ca 0.18 -0.67 -0.38 0.00 -2.27 0.00 0.00 64.05 60.91 2jc3 n THR 7 Cb 0.18 0.41 -0.06 0.00 -2.10 0.00 0.00 70.33 68.76 2jc3 n THR 7 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2jc3 s ILE 8 N -1.37 5.13 0.00 2.28 1.01 -1.08 -4.18 121.20 122.98 2jc3 s ILE 8 Ca 0.35 0.83 0.00 0.00 0.00 0.00 0.00 60.65 61.83 2jc3 s ILE 8 Cb 0.18 -3.73 0.00 0.00 0.01 0.00 0.00 42.46 38.92 2jc3 s ILE 8 CO 0.25 0.47 0.00 0.61 0.00 0.00 0.00 174.94 176.26 2jc3 n GLY 9 N 2.54 -2.38 3.88 6.18 0.00 -1.26 -4.96 105.19 109.19 2jc3 n GLY 9 Ca -0.11 -1.58 -0.27 0.00 0.00 0.00 0.00 46.02 44.05 2jc3 n GLY 9 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2jc3 n ASN 10 N -0.26 -2.98 -4.83 1.61 3.02 -1.26 -4.95 115.26 105.61 2jc3 n ASN 10 Ca 0.00 -0.84 -0.32 0.00 -0.03 0.00 0.00 54.58 53.39 2jc3 n ASN 10 Cb 0.00 -3.75 -0.02 0.00 -0.61 0.00 0.00 39.78 35.40 2jc3 n ASN 10 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2jc3 s THR 11 N -3.50 4.29 0.53 3.41 -4.23 -1.26 -5.02 115.64 109.86 2jc3 s THR 11 Ca 0.38 1.08 -0.19 0.00 -1.18 0.00 0.00 61.69 61.77 2jc3 s THR 11 Cb -0.19 -3.61 -0.07 0.00 1.34 0.00 0.00 72.50 69.97 2jc3 s THR 11 CO 0.84 -0.65 1.09 -2.16 -0.54 0.00 0.00 174.62 173.20 2jc3 s PRO 12 N -4.13 3.51 -0.25 3.99 0.04 -1.26 -4.78 135.00 132.13 2jc3 s PRO 12 Ca 0.60 1.48 0.01 0.00 0.04 0.00 0.00 61.00 63.13 2jc3 s PRO 12 Cb -0.12 -2.04 0.04 0.00 0.04 0.00 0.00 34.50 32.42 2jc3 s PRO 12 CO 0.34 -0.69 -0.10 -1.17 0.04 0.00 0.00 177.00 175.42 2jc3 s LEU 13 N -3.75 3.16 0.18 -3.56 2.96 -1.26 -0.85 118.68 115.56 2jc3 s LEU 13 Ca 0.70 -1.10 0.10 0.00 -0.22 0.00 0.00 54.13 53.61 2jc3 s LEU 13 Cb -0.20 -1.58 -0.04 0.00 0.50 0.00 0.00 46.19 44.86 2jc3 s LEU 13 CO 0.25 -0.14 -0.22 0.68 -1.32 0.00 0.00 176.35 175.60 2jc3 s VAL 14 N 1.21 2.13 -0.12 1.68 -7.23 -0.33 -4.90 120.40 112.83 2jc3 s VAL 14 Ca -0.03 -1.95 -0.16 0.00 -1.81 0.00 0.00 61.98 58.03 2jc3 s VAL 14 Cb -0.18 -1.99 -0.05 0.00 0.56 0.00 0.00 36.38 34.73 2jc3 s VAL 14 CO -0.06 -0.17 0.39 -0.75 -0.31 0.00 0.00 175.10 174.19 2jc3 s LYS 15 N -2.64 4.25 0.34 4.82 2.20 -1.26 -0.25 119.74 127.20 2jc3 s LYS 15 Ca 0.18 0.29 -0.29 0.00 -0.36 0.00 0.00 55.97 55.79 2jc3 s LYS 15 Cb -0.07 -3.40 -0.11 0.00 -1.51 0.00 0.00 37.83 32.74 2jc3 s LYS 15 CO 0.08 0.26 1.38 -0.51 -0.36 0.00 0.00 175.35 176.20 2jc3 s LEU 16 N 0.34 4.39 -0.07 5.43 1.43 -0.39 -4.94 118.68 124.87 2jc3 s LEU 16 Ca 0.22 2.82 0.21 0.00 -1.03 0.00 0.00 54.13 56.35 2jc3 s LEU 16 Cb -0.14 -3.65 -0.31 0.00 0.03 0.00 0.00 46.19 42.11 2jc3 s LEU 16 CO 0.08 -0.67 0.38 0.00 0.23 0.00 0.00 176.35 176.37 2jc3 n GLN 17 N 0.75 0.67 0.00 1.70 6.02 -1.26 -4.80 117.38 120.46 2jc3 n GLN 17 Ca 0.01 -0.15 0.00 0.00 -0.01 0.00 0.00 57.00 56.84 2jc3 n GLN 17 Cb 0.41 -1.51 0.00 0.00 1.02 0.00 0.00 30.24 30.15 2jc3 n GLN 17 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2jc3 n ARG 18 N -2.37 0.00 -1.79 -1.09 1.74 -1.26 -5.06 116.66 106.83 2jc3 n ARG 18 Ca -0.11 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.66 2jc3 n ARG 18 Cb 0.70 -0.79 0.03 0.00 -1.02 0.00 0.00 32.46 31.38 2jc3 n ARG 18 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 2jc3 s ILE 19 N -1.69 4.30 0.00 0.55 -4.36 -1.26 -4.94 121.20 113.80 2jc3 s ILE 19 Ca 0.00 0.75 0.00 0.00 -0.26 0.00 0.00 60.65 61.14 2jc3 s ILE 19 Cb 0.00 -3.67 0.00 0.00 1.25 0.00 0.00 42.46 40.04 2jc3 s ILE 19 CO 0.00 -0.98 0.00 0.61 0.24 0.00 0.00 174.94 174.81 2jc3 n GLY 20 N -2.59 2.21 3.72 6.27 0.00 -1.26 -4.98 105.19 108.56 2jc3 n GLY 20 Ca 0.07 -1.69 -0.35 0.00 0.00 0.00 0.00 46.02 44.04 2jc3 n GLY 20 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jc3 s PRO 21 N -4.27 2.18 -0.95 1.61 0.04 -1.26 -4.94 135.00 127.41 2jc3 s PRO 21 Ca 0.00 1.84 -0.01 0.00 0.04 0.00 0.00 61.00 62.87 2jc3 s PRO 21 Cb 0.00 -1.83 0.33 0.00 0.04 0.00 0.00 34.50 33.04 2jc3 s PRO 21 CO 0.00 -1.82 1.87 -3.47 0.04 0.00 0.00 177.00 173.62 2jc3 n ASP 22 N -2.57 7.33 -0.80 6.66 2.03 -1.26 -4.61 116.55 123.32 2jc3 n ASP 22 Ca 0.14 -3.74 0.02 0.00 0.52 0.00 0.00 54.79 51.73 2jc3 n ASP 22 Cb 0.50 -1.11 0.20 0.00 -0.72 0.00 0.00 41.12 39.99 2jc3 n ASP 22 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 2jc3 n ASN 23 N -0.23 2.34 0.00 1.67 2.04 -1.26 -4.96 115.26 114.86 2jc3 n ASN 23 Ca 0.49 -3.65 0.00 0.00 -0.44 0.00 0.00 54.58 50.97 2jc3 n ASN 23 Cb 0.26 -0.56 0.00 0.00 -2.53 0.00 0.00 39.78 36.94 2jc3 n ASN 23 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2jc3 n GLY 24 N -1.10 2.40 3.87 4.83 0.00 -1.26 -2.04 105.19 111.88 2jc3 n GLY 24 Ca 0.25 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.96 2jc3 n GLY 24 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jc3 s SER 25 N -3.28 6.34 0.05 1.61 1.04 -1.26 -3.88 113.70 114.31 2jc3 s SER 25 Ca 0.00 1.40 0.06 0.00 0.48 0.00 0.00 55.95 57.89 2jc3 s SER 25 Cb 0.00 -2.46 -0.02 0.00 0.10 0.00 0.00 66.02 63.64 2jc3 s SER 25 CO 0.00 -0.76 -0.16 -1.61 0.98 0.00 0.00 173.24 171.69 2jc3 s GLU 26 N -4.83 1.02 -0.19 4.02 2.02 0.80 -4.87 118.70 116.66 2jc3 s GLU 26 Ca 0.55 -0.87 0.01 0.00 0.02 0.00 0.00 54.97 54.68 2jc3 s GLU 26 Cb -0.11 -1.08 0.03 0.00 0.10 0.00 0.00 34.13 33.08 2jc3 s GLU 26 CO 0.47 0.26 -0.14 0.42 0.02 0.00 0.00 175.26 176.29 2jc3 s ILE 27 N -0.95 1.82 -0.01 -1.63 1.01 -1.26 -1.32 121.20 118.86 2jc3 s ILE 27 Ca 0.03 -0.97 0.03 0.00 0.00 0.00 0.00 60.65 59.73 2jc3 s ILE 27 Cb -0.09 -1.77 -0.03 0.00 0.01 0.00 0.00 42.46 40.58 2jc3 s ILE 27 CO 0.02 0.33 -0.07 0.26 0.00 0.00 0.00 174.94 175.48 2jc3 s TRP 28 N 1.35 2.89 -0.05 3.97 0.52 0.59 -1.26 118.94 126.96 2jc3 s TRP 28 Ca 0.01 -0.03 0.07 0.00 0.02 0.00 0.00 56.10 56.17 2jc3 s TRP 28 Cb -0.15 -1.63 -0.01 0.00 -1.15 0.00 0.00 33.47 30.53 2jc3 s TRP 28 CO -0.10 0.36 -0.25 0.14 0.02 0.00 0.00 176.95 177.12 2jc3 s VAL 29 N -0.96 2.03 -0.41 4.03 -7.23 0.66 -1.01 120.40 117.52 2jc3 s VAL 29 Ca 0.16 -1.07 -0.18 0.00 -1.81 0.00 0.00 61.98 59.08 2jc3 s VAL 29 Cb -0.11 -1.71 0.02 0.00 0.56 0.00 0.00 36.38 35.14 2jc3 s VAL 29 CO 0.06 0.57 0.48 -0.75 -0.31 0.00 0.00 175.10 175.15 2jc3 s LYS 30 N -0.30 3.23 -1.36 4.82 2.47 -0.63 -1.19 119.74 126.79 2jc3 s LYS 30 Ca 0.01 -0.58 -0.15 0.00 -1.56 0.00 0.00 55.97 53.68 2jc3 s LYS 30 Cb -0.12 -3.93 0.08 0.00 -1.46 0.00 0.00 37.83 32.39 2jc3 s LYS 30 CO 0.02 -0.83 1.93 1.28 0.16 0.00 0.00 175.35 177.91 2jc3 n LEU 31 N 5.74 5.99 0.04 5.43 4.77 -0.03 -0.99 117.00 137.94 2jc3 n LEU 31 Ca -0.06 -4.16 0.06 0.00 -0.03 0.00 0.00 56.01 51.82 2jc3 n LEU 31 Cb 0.48 -1.67 0.25 0.00 -2.33 0.00 0.00 43.42 40.15 2jc3 n LEU 31 CO 0.47 0.76 0.67 -0.62 -1.33 0.00 0.00 177.39 177.35 2jc3 n GLU 32 N 6.59 0.04 0.00 3.23 -0.58 -0.35 -1.17 120.64 128.41 2jc3 n GLU 32 Ca 0.48 0.41 0.09 0.00 -0.42 0.00 0.00 57.16 57.71 2jc3 n GLU 32 Cb 0.42 -1.60 0.38 0.00 -0.57 0.00 0.00 31.44 30.06 2jc3 n GLU 32 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jc3 n GLY 33 N -0.70 -1.11 0.15 0.62 0.00 -1.25 -2.49 105.19 100.41 2jc3 n GLY 33 Ca 0.01 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.11 2jc3 n GLY 33 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2jc3 h ASN 34 N 0.00 0.00 -3.77 1.61 4.21 -1.45 -3.37 115.58 112.81 2jc3 h ASN 34 Ca 0.00 0.00 -0.55 0.00 1.21 0.00 0.00 56.30 56.96 2jc3 h ASN 34 Cb 0.31 0.00 0.18 0.00 -1.12 0.00 0.00 38.32 37.68 2jc3 h ASN 34 CO 0.00 0.00 0.11 0.59 -1.29 0.00 0.00 177.43 176.84 2jc3 n ASN 35 N -2.44 0.50 -0.30 5.81 4.13 -1.04 -4.84 115.26 117.07 2jc3 n ASN 35 Ca 0.03 0.67 0.14 0.00 1.68 0.00 0.00 54.58 57.11 2jc3 n ASN 35 Cb 0.33 -1.41 0.32 0.00 -1.54 0.00 0.00 39.78 37.48 2jc3 n ASN 35 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2jc3 h PRO 36 N -0.21 0.23 -0.64 3.52 0.13 -1.89 -0.12 132.00 133.02 2jc3 h PRO 36 Ca -0.47 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2jc3 h PRO 36 Cb 1.33 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2jc3 h PRO 36 CO 0.47 0.15 0.00 0.00 -0.23 0.00 0.00 178.00 178.39 2jc3 n ALA 37 N -2.64 3.17 -1.02 -0.56 0.00 -1.26 -4.95 120.51 113.24 2jc3 n ALA 37 Ca 0.23 -1.40 -0.01 0.00 0.00 0.00 0.00 53.44 52.26 2jc3 n ALA 37 Cb 0.72 -1.05 -0.00 0.00 0.00 0.00 0.00 19.45 19.12 2jc3 n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jc3 n GLY 38 N 0.91 0.46 3.52 0.00 0.00 -0.06 -4.87 105.19 105.15 2jc3 n GLY 38 Ca 0.22 -0.85 -0.10 0.00 0.00 0.00 0.00 46.02 45.29 2jc3 n GLY 38 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jc3 s SER 39 N -2.80 -0.39 0.62 1.61 1.04 -1.23 -3.43 113.70 109.12 2jc3 s SER 39 Ca 0.00 -0.28 0.35 0.00 0.48 0.00 0.00 55.95 56.50 2jc3 s SER 39 Cb 0.00 0.60 2.01 0.00 0.10 0.00 0.00 66.02 68.73 2jc3 s SER 39 CO 0.00 -1.05 2.25 1.62 0.98 0.00 0.00 173.24 177.04 2jc3 h VAL 40 N 2.09 0.29 -0.01 5.02 3.04 -1.13 -2.68 116.25 122.88 2jc3 h VAL 40 Ca -0.30 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.38 2jc3 h VAL 40 Cb 1.28 0.95 -0.00 0.00 -2.01 0.00 0.00 31.29 31.51 2jc3 h VAL 40 CO 0.36 0.00 -0.04 0.11 -1.01 0.00 0.00 177.57 176.99 2jc3 h LYS 41 N 0.00 0.01 -0.80 4.17 1.79 -1.88 -2.55 116.57 117.31 2jc3 h LYS 41 Ca 0.01 -0.00 0.23 0.00 -2.18 0.00 0.00 60.65 58.72 2jc3 h LYS 41 Cb 0.13 -0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.75 2jc3 h LYS 41 CO -0.00 0.05 0.61 -0.44 -1.08 0.00 0.00 179.45 178.59 2jc3 h ASP 42 N 0.01 0.00 -0.15 0.86 5.19 -1.80 0.09 116.42 120.62 2jc3 h ASP 42 Ca 0.00 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.35 2jc3 h ASP 42 Cb 0.08 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.59 2jc3 h ASP 42 CO 0.01 0.00 -0.15 0.03 -3.12 0.00 0.00 179.24 176.00 2jc3 h ARG 43 N 0.00 0.37 -0.27 3.56 3.08 -1.70 -1.94 114.38 117.47 2jc3 h ARG 43 Ca 0.38 -0.20 -0.16 0.00 0.07 0.00 0.00 59.98 60.07 2jc3 h ARG 43 Cb 1.60 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.66 2jc3 h ARG 43 CO -0.00 0.75 -0.45 0.00 -1.07 0.00 0.00 179.97 179.20 2jc3 h ALA 44 N 0.61 0.42 0.19 0.04 0.00 -1.33 -0.81 119.26 118.38 2jc3 h ALA 44 Ca 0.02 -0.48 0.01 0.00 0.00 0.00 0.00 54.91 54.47 2jc3 h ALA 44 Cb 0.69 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 2jc3 h ALA 44 CO 0.04 0.57 -0.26 0.00 0.00 0.00 0.00 179.25 179.59 2jc3 h ALA 45 N 0.67 -0.50 0.11 0.00 0.00 -1.09 0.34 119.26 118.79 2jc3 h ALA 45 Ca 0.02 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2jc3 h ALA 45 Cb 1.05 0.41 -0.03 0.00 0.00 0.00 0.00 17.79 19.22 2jc3 h ALA 45 CO 0.10 -0.82 -0.21 1.25 0.00 0.00 0.00 179.25 179.57 2jc3 h LEU 46 N -0.52 -0.58 -0.66 0.00 5.85 -1.30 -2.30 115.31 115.80 2jc3 h LEU 46 Ca 0.01 0.07 0.07 0.00 0.84 0.00 0.00 57.88 58.87 2jc3 h LEU 46 Cb 0.51 0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.70 2jc3 h LEU 46 CO -0.11 -0.29 0.34 -1.28 -0.34 0.00 0.00 178.44 176.76 2jc3 h SER 47 N -0.39 0.47 -0.83 1.25 0.87 -0.73 0.27 113.55 114.46 2jc3 h SER 47 Ca 0.03 0.05 -0.03 0.00 -1.23 0.00 0.00 61.79 60.60 2jc3 h SER 47 Cb 0.41 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 62.30 2jc3 h SER 47 CO -0.12 0.29 0.39 0.24 -0.53 0.00 0.00 176.83 177.10 2jc3 h MET 48 N 0.61 1.20 -0.00 2.24 2.86 -0.13 -1.40 114.93 120.30 2jc3 h MET 48 Ca 0.31 -0.18 -0.02 0.00 -2.06 0.00 0.00 59.70 57.75 2jc3 h MET 48 Cb 0.27 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 31.72 2jc3 h MET 48 CO -0.22 0.93 -0.06 0.82 1.06 0.00 0.00 176.91 179.43 2jc3 h ILE 49 N 1.18 1.58 -0.43 -1.22 2.04 -0.82 -2.77 117.51 117.08 2jc3 h ILE 49 Ca 0.28 -1.79 0.04 0.00 1.00 0.00 0.00 64.86 64.40 2jc3 h ILE 49 Cb 0.13 2.76 -0.04 0.00 -0.74 0.00 0.00 36.82 38.93 2jc3 h ILE 49 CO -0.03 0.47 0.18 0.58 0.00 0.00 0.00 178.15 179.35 2jc3 h VAL 50 N -0.67 0.91 -0.74 1.67 2.07 -0.47 -1.06 116.25 117.96 2jc3 h VAL 50 Ca -0.01 -0.13 -0.06 0.00 0.82 0.00 0.00 66.70 67.33 2jc3 h VAL 50 Cb 0.81 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 2jc3 h VAL 50 CO 0.01 0.07 0.25 -0.33 0.02 0.00 0.00 177.57 177.59 2jc3 h GLU 51 N 0.37 1.14 -0.63 1.57 4.39 -1.36 -1.19 114.58 118.87 2jc3 h GLU 51 Ca 0.19 -0.24 -0.04 0.00 0.34 0.00 0.00 59.36 59.62 2jc3 h GLU 51 Cb 0.15 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 28.60 2jc3 h GLU 51 CO -0.17 0.96 0.24 0.00 -1.16 0.00 0.00 179.01 178.88 2jc3 h ALA 52 N 1.13 1.23 -0.27 3.43 0.00 -1.15 -2.33 119.26 121.30 2jc3 h ALA 52 Ca 0.24 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2jc3 h ALA 52 Cb 0.29 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2jc3 h ALA 52 CO -0.01 0.56 0.10 0.93 0.00 0.00 0.00 179.25 180.82 2jc3 h GLU 53 N 0.91 0.42 0.00 0.00 5.08 -0.76 -1.29 114.58 118.94 2jc3 h GLU 53 Ca 0.21 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2jc3 h GLU 53 Cb 0.20 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2jc3 h GLU 53 CO -0.02 0.47 0.00 1.63 -1.00 0.00 0.00 179.01 180.09 2jc3 n LYS 54 N -4.74 0.03 -0.22 2.33 5.02 -0.49 -0.59 118.16 119.50 2jc3 n LYS 54 Ca -0.03 0.50 0.08 0.00 -2.02 0.00 0.00 58.31 56.84 2jc3 n LYS 54 Cb 0.15 -1.61 0.20 0.00 -0.02 0.00 0.00 35.03 33.75 2jc3 n LYS 54 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2jc3 n ARG 55 N -1.68 2.67 -0.72 1.97 1.74 -0.57 -4.95 116.66 115.11 2jc3 n ARG 55 Ca 0.00 -2.18 0.00 0.00 -0.77 0.00 0.00 57.85 54.90 2jc3 n ARG 55 Cb 0.03 -1.36 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 2jc3 n ARG 55 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jc3 n GLY 56 N 0.90 0.34 0.23 -0.13 0.00 0.24 -4.82 105.19 101.95 2jc3 n GLY 56 Ca 0.15 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.23 2jc3 n GLY 56 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2jc3 h GLU 57 N 1.01 0.00 -4.02 1.61 5.08 -1.55 -3.45 114.58 113.26 2jc3 h GLU 57 Ca 0.00 -0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 2jc3 h GLU 57 Cb 0.08 -0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.19 2jc3 h GLU 57 CO 0.00 0.16 -0.52 0.96 -1.00 0.00 0.00 179.01 178.60 2jc3 s ILE 58 N -4.70 0.18 0.06 3.13 -4.36 -1.23 -5.02 121.20 109.26 2jc3 s ILE 58 Ca -0.04 -1.48 -0.09 0.00 -0.26 0.00 0.00 60.65 58.78 2jc3 s ILE 58 Cb 0.16 -1.42 0.00 0.00 1.25 0.00 0.00 42.46 42.45 2jc3 s ILE 58 CO 0.69 -0.82 0.18 -0.54 0.24 0.00 0.00 174.94 174.70 2jc3 s LYS 59 N -3.86 0.73 0.39 0.37 -0.14 -1.26 -4.38 119.74 111.59 2jc3 s LYS 59 Ca 0.06 -0.76 -0.24 0.00 -1.36 0.00 0.00 55.97 53.67 2jc3 s LYS 59 Cb 0.06 0.30 -0.12 0.00 -1.68 0.00 0.00 37.83 36.39 2jc3 s LYS 59 CO -0.10 -0.22 0.87 -2.30 -0.76 0.00 0.00 175.35 172.84 2jc3 n PRO 60 N 0.44 1.08 0.00 -1.68 -0.02 -1.26 -1.52 135.00 132.04 2jc3 n PRO 60 Ca -0.17 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2jc3 n PRO 60 Cb 0.60 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.25 2jc3 n PRO 60 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jc3 n GLY 61 N 1.38 3.00 3.69 -1.23 0.00 0.94 -4.98 105.19 107.99 2jc3 n GLY 61 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 2jc3 n GLY 61 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jc3 s ASP 62 N -0.23 3.15 -0.13 1.61 -0.00 -0.57 -4.50 116.67 116.00 2jc3 s ASP 62 Ca 0.00 1.53 -0.11 0.00 -0.00 0.00 0.00 52.55 53.97 2jc3 s ASP 62 Cb 0.00 -2.20 -0.05 0.00 -0.00 0.00 0.00 42.92 40.68 2jc3 s ASP 62 CO 0.00 -2.85 0.22 -0.69 -0.00 0.00 0.00 175.17 171.85 2jc3 s VAL 63 N -2.87 5.36 -0.03 -1.27 1.01 -1.26 -0.45 120.40 120.89 2jc3 s VAL 63 Ca 0.64 0.40 0.06 0.00 0.00 0.00 0.00 61.98 63.08 2jc3 s VAL 63 Cb -0.19 -3.53 -0.02 0.00 0.00 0.00 0.00 36.38 32.64 2jc3 s VAL 63 CO 0.58 0.51 -0.21 -0.76 0.00 0.00 0.00 175.10 175.22 2jc3 s LEU 64 N -0.32 2.36 0.00 3.92 1.02 0.26 -1.64 118.68 124.29 2jc3 s LEU 64 Ca 0.15 -0.36 0.05 0.00 0.02 0.00 0.00 54.13 53.99 2jc3 s LEU 64 Cb -0.13 -1.43 -0.02 0.00 0.02 0.00 0.00 46.19 44.63 2jc3 s LEU 64 CO 0.04 0.32 -0.17 -0.63 0.02 0.00 0.00 176.35 175.94 2jc3 s ILE 65 N -0.68 1.31 -0.26 -0.59 1.01 -0.04 -0.10 121.20 121.85 2jc3 s ILE 65 Ca 0.11 -0.81 -0.26 0.00 0.00 0.00 0.00 60.65 59.69 2jc3 s ILE 65 Cb -0.10 -1.11 0.10 0.00 0.01 0.00 0.00 42.46 41.36 2jc3 s ILE 65 CO 0.00 0.29 0.89 -0.70 0.00 0.00 0.00 174.94 175.42 2jc3 s GLU 66 N -0.61 0.67 -0.26 2.79 2.56 -0.94 -1.78 118.70 121.13 2jc3 s GLU 66 Ca 0.06 0.71 -0.14 0.00 0.00 0.00 0.00 54.97 55.60 2jc3 s GLU 66 Cb -0.07 0.32 -0.04 0.00 2.00 0.00 0.00 34.13 36.34 2jc3 s GLU 66 CO -0.00 -0.10 0.31 0.00 -0.56 0.00 0.00 175.26 174.91 2jc3 s ALA 67 N 0.14 3.56 0.00 6.30 0.00 -1.26 -1.20 121.76 129.30 2jc3 s ALA 67 Ca 0.01 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.13 2jc3 s ALA 67 Cb -0.04 -2.59 0.00 0.00 0.00 0.00 0.00 23.12 20.48 2jc3 s ALA 67 CO -0.02 -0.51 0.00 -2.37 0.00 0.00 0.00 175.76 172.86 2jc3 n THR 68 N 4.85 0.00 -1.70 0.00 5.66 -0.49 -4.90 114.28 117.71 2jc3 n THR 68 Ca -0.11 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.89 2jc3 n THR 68 Cb 0.51 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.29 2jc3 n THR 68 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 2jc3 n SER 69 N 0.00 0.00 0.00 1.09 3.41 -1.26 -4.38 113.62 112.48 2jc3 n SER 69 Ca 0.00 -0.77 0.00 0.00 -0.26 0.00 0.00 58.87 57.84 2jc3 n SER 69 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2jc3 n SER 69 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jc3 n GLY 70 N 0.00 3.57 0.36 5.00 0.00 -1.26 -4.81 105.19 108.04 2jc3 n GLY 70 Ca 0.00 -1.75 0.12 0.00 0.00 0.00 0.00 46.02 44.38 2jc3 n GLY 70 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2jc3 h ASN 71 N 0.00 0.42 -0.62 1.61 2.35 -1.99 -0.11 115.58 117.24 2jc3 h ASN 71 Ca 0.00 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 2jc3 h ASN 71 Cb 0.00 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.26 2jc3 h ASN 71 CO 0.00 0.25 0.33 0.74 -1.65 0.00 0.00 177.43 177.10 2jc3 h THR 72 N 0.46 1.20 0.28 2.81 2.02 -1.94 0.22 112.91 117.97 2jc3 h THR 72 Ca 0.30 -0.53 -0.01 0.00 0.77 0.00 0.00 66.41 66.94 2jc3 h THR 72 Cb 0.54 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 67.37 2jc3 h THR 72 CO -0.09 0.22 -0.16 1.23 0.37 0.00 0.00 175.52 177.10 2jc3 h GLY 73 N 0.84 -0.43 0.50 2.16 0.00 -1.36 -0.14 103.07 104.65 2jc3 h GLY 73 Ca 0.22 0.17 0.05 0.00 0.00 0.00 0.00 47.33 47.77 2jc3 h GLY 73 CO -0.03 -0.16 -0.09 -2.22 0.00 0.00 0.00 176.54 174.03 2jc3 h ILE 74 N -0.42 0.70 -0.92 2.60 2.04 -1.08 0.28 117.51 120.72 2jc3 h ILE 74 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 2jc3 h ILE 74 Cb 0.34 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 2jc3 h ILE 74 CO 0.04 0.00 0.59 0.00 0.00 0.00 0.00 178.15 178.78 2jc3 h ALA 75 N 1.10 1.16 -0.14 1.87 0.00 -0.40 -0.09 119.26 122.75 2jc3 h ALA 75 Ca 0.11 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 2jc3 h ALA 75 Cb 0.23 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2jc3 h ALA 75 CO -0.24 0.58 -0.40 -0.07 0.00 0.00 0.00 179.25 179.12 2jc3 h LEU 76 N 1.25 0.60 -0.93 0.00 3.38 -0.63 -0.60 115.31 118.38 2jc3 h LEU 76 Ca 0.33 -0.59 0.11 0.00 0.09 0.00 0.00 57.88 57.82 2jc3 h LEU 76 Cb -0.12 -0.17 -0.08 0.00 0.09 0.00 0.00 40.66 40.38 2jc3 h LEU 76 CO -0.07 1.08 0.57 0.00 0.09 0.00 0.00 178.44 180.11 2jc3 h ALA 77 N 0.53 1.38 0.19 1.53 0.00 -0.13 0.34 119.26 123.10 2jc3 h ALA 77 Ca -0.01 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2jc3 h ALA 77 Cb 1.02 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2jc3 h ALA 77 CO 0.09 0.18 -0.09 1.98 0.00 0.00 0.00 179.25 181.40 2jc3 h MET 78 N 0.91 -0.24 -0.07 0.00 1.85 -0.86 -1.51 114.93 115.00 2jc3 h MET 78 Ca 0.46 0.02 0.02 0.00 -0.61 0.00 0.00 59.70 59.59 2jc3 h MET 78 Cb 0.44 0.05 -0.00 0.00 0.43 0.00 0.00 31.60 32.52 2jc3 h MET 78 CO -0.26 0.08 0.05 0.82 -0.40 0.00 0.00 176.91 177.20 2jc3 h ILE 79 N -0.57 0.90 -0.06 1.77 1.08 -0.74 0.11 117.51 120.00 2jc3 h ILE 79 Ca -0.03 0.00 -0.17 0.00 -0.39 0.00 0.00 64.86 64.28 2jc3 h ILE 79 Cb 0.43 0.96 0.01 0.00 -3.07 0.00 0.00 36.82 35.15 2jc3 h ILE 79 CO 0.04 0.00 -0.62 0.00 -0.69 0.00 0.00 178.15 176.89 2jc3 h ALA 80 N 1.96 0.16 -0.42 1.87 0.00 -0.74 -0.73 119.26 121.36 2jc3 h ALA 80 Ca 0.03 -0.55 -0.08 0.00 0.00 0.00 0.00 54.91 54.31 2jc3 h ALA 80 Cb 0.14 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2jc3 h ALA 80 CO -0.00 0.43 -0.09 0.00 0.00 0.00 0.00 179.25 179.59 2jc3 h ALA 81 N 0.42 1.07 -0.15 0.00 0.00 -0.59 0.31 119.26 120.31 2jc3 h ALA 81 Ca -0.06 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 2jc3 h ALA 81 Cb 1.28 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 2jc3 h ALA 81 CO 0.12 0.57 -0.03 1.25 0.00 0.00 0.00 179.25 181.16 2jc3 h LEU 82 N 0.67 0.30 -0.69 0.00 5.85 -0.76 -3.30 115.31 117.37 2jc3 h LEU 82 Ca 0.12 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 58.47 2jc3 h LEU 82 Cb 0.54 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.49 2jc3 h LEU 82 CO 0.03 0.59 -0.38 0.29 -0.34 0.00 0.00 178.44 178.64 2jc3 n LYS 83 N -4.70 0.96 -1.00 1.25 5.02 -0.28 -5.00 118.16 114.41 2jc3 n LYS 83 Ca -0.05 -0.69 0.00 0.00 -2.02 0.00 0.00 58.31 55.55 2jc3 n LYS 83 Cb 0.26 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 2jc3 n LYS 83 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jc3 n GLY 84 N 1.38 1.15 3.76 0.72 0.00 0.89 -4.76 105.19 108.34 2jc3 n GLY 84 Ca 0.11 -0.37 -0.22 0.00 0.00 0.00 0.00 46.02 45.53 2jc3 n GLY 84 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jc3 s TYR 85 N -2.17 2.85 -0.28 1.61 2.02 -0.11 -0.04 117.35 121.22 2jc3 s TYR 85 Ca 0.00 -0.26 -0.15 0.00 -0.37 0.00 0.00 57.07 56.29 2jc3 s TYR 85 Cb 0.00 -1.50 -0.03 0.00 -0.40 0.00 0.00 41.96 40.02 2jc3 s TYR 85 CO 0.00 0.42 0.38 1.03 -1.57 0.00 0.00 175.55 175.81 2jc3 s ARG 86 N -3.83 3.96 -0.14 -0.62 0.52 0.40 -4.50 118.95 114.74 2jc3 s ARG 86 Ca 0.36 -0.01 -0.03 0.00 -0.52 0.00 0.00 55.73 55.53 2jc3 s ARG 86 Cb -0.05 -3.68 -0.03 0.00 0.52 0.00 0.00 34.95 31.71 2jc3 s ARG 86 CO 0.23 -0.32 -0.04 1.41 0.02 0.00 0.00 175.30 176.61 2jc3 s MET 87 N 2.08 3.53 -0.12 3.54 1.75 -1.26 0.91 119.30 129.72 2jc3 s MET 87 Ca 0.15 -0.51 0.03 0.00 -1.25 0.00 0.00 55.69 54.10 2jc3 s MET 87 Cb -0.16 -2.87 0.01 0.00 2.84 0.00 0.00 34.83 34.65 2jc3 s MET 87 CO 0.10 0.32 -0.21 0.15 -0.65 0.00 0.00 175.02 174.74 2jc3 s LYS 88 N 0.14 2.83 -0.14 4.11 1.02 0.86 -0.48 119.74 128.08 2jc3 s LYS 88 Ca -0.01 -0.79 0.02 0.00 0.02 0.00 0.00 55.97 55.21 2jc3 s LYS 88 Cb -0.14 -2.25 0.01 0.00 -0.52 0.00 0.00 37.83 34.94 2jc3 s LYS 88 CO 0.03 0.04 -0.19 -0.51 -0.92 0.00 0.00 175.35 173.79 2jc3 s LEU 89 N 0.70 1.98 -0.17 3.17 1.43 0.72 -2.21 118.68 124.29 2jc3 s LEU 89 Ca -0.11 -0.56 -0.08 0.00 -1.03 0.00 0.00 54.13 52.35 2jc3 s LEU 89 Cb -0.16 -1.34 -0.04 0.00 0.03 0.00 0.00 46.19 44.68 2jc3 s LEU 89 CO 0.02 0.04 0.12 -0.76 0.23 0.00 0.00 176.35 175.99 2jc3 s LEU 90 N 0.97 4.17 0.09 1.79 1.02 -0.34 -0.65 118.68 125.74 2jc3 s LEU 90 Ca -0.04 0.27 -0.25 0.00 0.02 0.00 0.00 54.13 54.13 2jc3 s LEU 90 Cb -0.15 -2.05 0.07 0.00 0.02 0.00 0.00 46.19 44.09 2jc3 s LEU 90 CO -0.04 0.26 0.65 0.00 0.02 0.00 0.00 176.35 177.24 2jc3 s MET 91 N -0.13 1.18 0.61 1.70 0.23 -1.06 -1.39 119.30 120.43 2jc3 s MET 91 Ca 0.10 -0.29 -0.18 0.00 -1.03 0.00 0.00 55.69 54.28 2jc3 s MET 91 Cb -0.12 0.54 -0.03 0.00 -1.53 0.00 0.00 34.83 33.70 2jc3 s MET 91 CO 0.00 -0.48 1.21 -1.25 -2.03 0.00 0.00 175.02 172.47 2jc3 s PRO 92 N -3.10 2.88 0.00 3.16 0.04 -1.26 -1.77 135.00 134.95 2jc3 s PRO 92 Ca -0.01 1.81 0.00 0.00 0.04 0.00 0.00 61.00 62.84 2jc3 s PRO 92 Cb -0.01 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.61 2jc3 s PRO 92 CO -0.07 -1.27 0.33 -0.40 0.04 0.00 0.00 177.00 175.62 2jc3 n ASP 93 N -1.73 0.76 -1.41 6.66 3.85 0.59 -3.67 116.55 121.60 2jc3 n ASP 93 Ca 0.14 -1.08 -0.11 0.00 -0.71 0.00 0.00 54.79 53.03 2jc3 n ASP 93 Cb 0.50 -0.27 0.13 0.00 -1.35 0.00 0.00 41.12 40.13 2jc3 n ASP 93 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.20 175.73 2jc3 n ASN 94 N 0.33 3.53 -4.75 -1.12 0.23 -1.26 -4.94 115.26 107.28 2jc3 n ASN 94 Ca 0.00 -3.81 -0.38 0.00 -0.53 0.00 0.00 54.58 49.85 2jc3 n ASN 94 Cb 0.16 -0.54 -0.06 0.00 -2.08 0.00 0.00 39.78 37.27 2jc3 n ASN 94 CO 0.00 0.00 0.00 -0.04 -0.93 0.00 0.00 177.26 176.29 2jc3 s MET 95 N -3.42 4.29 1.07 -3.83 -1.94 -1.24 -5.05 119.30 109.18 2jc3 s MET 95 Ca 0.47 0.61 -0.13 0.00 -1.71 0.00 0.00 55.69 54.92 2jc3 s MET 95 Cb 0.41 -3.37 0.17 0.00 2.01 0.00 0.00 34.83 34.05 2jc3 s MET 95 CO -0.01 0.31 0.70 -1.13 -0.01 0.00 0.00 175.02 174.88 2jc3 n SER 96 N 3.04 -1.48 0.28 3.03 3.41 -1.26 -4.81 113.62 115.83 2jc3 n SER 96 Ca -0.07 0.06 -0.14 0.00 -0.26 0.00 0.00 58.87 58.46 2jc3 n SER 96 Cb 0.51 -1.23 -0.07 0.00 -0.26 0.00 0.00 64.21 63.16 2jc3 n SER 96 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2jc3 h GLN 97 N -2.18 -0.70 -0.96 4.33 1.08 -1.99 -2.75 115.11 111.94 2jc3 h GLN 97 Ca -0.53 0.05 0.21 0.00 -1.45 0.00 0.00 58.65 56.94 2jc3 h GLN 97 Cb 1.32 0.16 -0.12 0.00 -0.05 0.00 0.00 27.48 28.79 2jc3 h GLN 97 CO 0.42 -0.40 0.53 0.93 -0.95 0.00 0.00 178.83 179.36 2jc3 h GLU 98 N -1.04 0.57 -0.73 1.46 5.08 -1.98 0.23 114.58 118.16 2jc3 h GLU 98 Ca -0.07 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 2jc3 h GLU 98 Cb 0.63 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 2jc3 h GLU 98 CO 0.12 0.38 0.43 -0.09 -1.00 0.00 0.00 179.01 178.84 2jc3 h ARG 99 N 0.59 1.00 0.00 2.33 2.43 -1.89 -2.06 114.38 116.78 2jc3 h ARG 99 Ca 0.59 -0.10 -0.13 0.00 -0.81 0.00 0.00 59.98 59.53 2jc3 h ARG 99 Cb 1.04 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.36 2jc3 h ARG 99 CO -0.45 0.72 -0.75 0.07 -1.51 0.00 0.00 179.97 178.05 2jc3 h ARG 100 N 1.00 0.00 -1.01 0.20 0.11 -0.83 -3.23 114.38 110.63 2jc3 h ARG 100 Ca 0.26 0.00 0.01 0.00 0.10 0.00 0.00 59.98 60.35 2jc3 h ARG 100 Cb -0.01 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.02 2jc3 h ARG 100 CO -0.05 0.50 0.67 0.00 0.10 0.00 0.00 179.97 181.19 2jc3 h ALA 101 N 1.43 1.28 -0.11 0.08 0.00 -0.17 0.22 119.26 122.00 2jc3 h ALA 101 Ca -0.04 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.83 2jc3 h ALA 101 Cb 1.47 -0.40 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 2jc3 h ALA 101 CO 0.07 0.66 0.12 0.00 0.00 0.00 0.00 179.25 180.09 2jc3 h ALA 102 N 1.37 1.73 0.03 0.00 0.00 -1.40 0.76 119.26 121.75 2jc3 h ALA 102 Ca 0.37 -0.00 -0.38 0.00 0.00 0.00 0.00 54.91 54.89 2jc3 h ALA 102 Cb -0.15 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 2jc3 h ALA 102 CO -0.08 -0.17 -2.30 -1.33 0.00 0.00 0.00 179.25 175.37 2jc3 n MET 103 N -3.88 0.67 0.23 0.00 2.81 -0.40 -4.34 117.12 112.21 2jc3 n MET 103 Ca -0.00 0.22 0.06 0.00 -1.81 0.00 0.00 57.70 56.17 2jc3 n MET 103 Cb 0.22 -1.58 0.53 0.00 -0.71 0.00 0.00 33.22 31.68 2jc3 n MET 103 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2jc3 h ARG 104 N -0.16 0.00 -0.66 0.03 3.08 -0.31 -2.64 114.38 113.72 2jc3 h ARG 104 Ca -0.54 0.00 0.14 0.00 0.07 0.00 0.00 59.98 59.64 2jc3 h ARG 104 Cb 1.87 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.88 2jc3 h ARG 104 CO -0.09 0.20 0.45 0.00 -1.07 0.00 0.00 179.97 179.46 2jc3 h ALA 105 N 1.80 2.18 -0.25 0.04 0.00 -1.05 0.58 119.26 122.57 2jc3 h ALA 105 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2jc3 h ALA 105 Cb 0.38 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2jc3 h ALA 105 CO 0.03 -0.36 0.00 0.66 0.00 0.00 0.00 179.25 179.58 2jc3 n TYR 106 N -4.45 0.33 -0.96 0.00 4.02 -1.00 -4.90 117.16 110.21 2jc3 n TYR 106 Ca 0.12 -0.16 0.00 0.00 -0.01 0.00 0.00 57.90 57.85 2jc3 n TYR 106 Cb 0.51 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.83 2jc3 n TYR 106 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2jc3 n GLY 107 N 0.89 0.50 3.79 2.72 0.00 0.20 -4.57 105.19 108.72 2jc3 n GLY 107 Ca 0.08 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.59 2jc3 n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jc3 s ALA 108 N -2.00 2.55 -0.29 4.61 0.00 -1.22 -4.82 121.76 120.59 2jc3 s ALA 108 Ca 0.00 0.32 -0.11 0.00 0.00 0.00 0.00 51.96 52.17 2jc3 s ALA 108 Cb 0.00 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 2jc3 s ALA 108 CO 0.00 -1.25 0.18 -2.00 0.00 0.00 0.00 175.76 172.69 2jc3 s GLU 109 N -4.53 3.82 -0.25 0.00 2.12 0.37 -4.61 118.70 115.62 2jc3 s GLU 109 Ca 0.62 -0.41 -0.15 0.00 0.36 0.00 0.00 54.97 55.40 2jc3 s GLU 109 Cb -0.17 -3.63 -0.04 0.00 0.26 0.00 0.00 34.13 30.55 2jc3 s GLU 109 CO 0.47 -0.23 0.38 -0.51 -0.54 0.00 0.00 175.26 174.83 2jc3 s LEU 110 N 1.73 4.07 -0.52 2.70 1.43 -1.26 -0.20 118.68 126.63 2jc3 s LEU 110 Ca 0.07 0.35 -0.10 0.00 -1.03 0.00 0.00 54.13 53.42 2jc3 s LEU 110 Cb -0.16 -2.45 0.13 0.00 0.03 0.00 0.00 46.19 43.74 2jc3 s LEU 110 CO 0.10 -0.16 0.41 -0.63 0.23 0.00 0.00 176.35 176.30 2jc3 s ILE 111 N 1.86 4.44 0.24 -0.59 1.01 0.18 -4.95 121.20 123.40 2jc3 s ILE 111 Ca 0.16 -1.87 -0.28 0.00 0.00 0.00 0.00 60.65 58.67 2jc3 s ILE 111 Cb -0.15 -3.90 -0.09 0.00 0.01 0.00 0.00 42.46 38.33 2jc3 s ILE 111 CO 0.09 -0.82 0.90 -0.76 0.00 0.00 0.00 174.94 174.36 2jc3 s LEU 112 N 1.22 4.57 0.47 2.97 1.43 -1.26 -2.58 118.68 125.50 2jc3 s LEU 112 Ca 0.07 1.85 0.05 0.00 -1.03 0.00 0.00 54.13 55.07 2jc3 s LEU 112 Cb -0.25 -3.63 -0.02 0.00 0.03 0.00 0.00 46.19 42.31 2jc3 s LEU 112 CO -0.01 0.12 0.14 0.68 0.23 0.00 0.00 176.35 177.51 2jc3 s VAL 113 N -1.28 1.73 0.67 -1.59 -7.23 -0.73 -4.91 120.40 107.07 2jc3 s VAL 113 Ca 0.42 -1.80 -0.11 0.00 -1.81 0.00 0.00 61.98 58.68 2jc3 s VAL 113 Cb -0.24 -2.53 -0.01 0.00 0.56 0.00 0.00 36.38 34.16 2jc3 s VAL 113 CO 0.29 0.00 1.05 0.42 -0.31 0.00 0.00 175.10 176.55 2jc3 s THR 114 N -2.75 4.19 0.21 5.32 -4.23 -1.26 -0.30 115.64 116.82 2jc3 s THR 114 Ca 0.27 0.71 -0.11 0.00 -1.18 0.00 0.00 61.69 61.38 2jc3 s THR 114 Cb 0.03 -3.63 0.14 0.00 1.34 0.00 0.00 72.50 70.38 2jc3 s THR 114 CO 0.15 -0.93 1.87 0.50 -0.54 0.00 0.00 174.62 175.67 2jc3 h LYS 115 N -0.53 0.92 -0.19 3.99 3.64 -1.93 0.24 116.57 122.71 2jc3 h LYS 115 Ca -0.44 -0.06 0.05 0.00 -1.27 0.00 0.00 60.65 58.94 2jc3 h LYS 115 Cb 1.21 -0.21 -0.07 0.00 -0.41 0.00 0.00 32.23 32.76 2jc3 h LYS 115 CO 0.61 0.61 -0.26 0.93 -2.27 0.00 0.00 179.45 179.07 2jc3 h GLU 116 N 0.95 -0.29 -0.53 1.90 3.07 -2.03 0.16 114.58 117.82 2jc3 h GLU 116 Ca 0.27 0.02 0.07 0.00 -0.50 0.00 0.00 59.36 59.22 2jc3 h GLU 116 Cb -0.08 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 27.87 2jc3 h GLU 116 CO -0.07 -0.19 0.35 1.96 -1.40 0.00 0.00 179.01 179.66 2jc3 h GLN 117 N -0.30 0.43 0.00 2.33 4.20 -1.77 -3.47 115.11 116.53 2jc3 h GLN 117 Ca 0.12 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.80 2jc3 h GLN 117 Cb 0.48 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.16 2jc3 h GLN 117 CO -0.36 0.29 0.00 0.41 -0.67 0.00 0.00 178.83 178.49 2jc3 n GLY 118 N -1.51 -0.01 0.37 3.46 0.00 0.56 0.60 105.19 108.66 2jc3 n GLY 118 Ca 0.07 -0.60 0.09 0.00 0.00 0.00 0.00 46.02 45.58 2jc3 n GLY 118 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2jc3 h MET 119 N 0.00 0.81 -0.11 1.61 2.86 -1.89 -0.68 114.93 117.53 2jc3 h MET 119 Ca 0.00 -0.05 -0.12 0.00 -2.06 0.00 0.00 59.70 57.47 2jc3 h MET 119 Cb 0.00 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.46 2jc3 h MET 119 CO 0.00 0.54 -0.46 1.49 1.06 0.00 0.00 176.91 179.54 2jc3 h GLU 120 N 0.84 0.27 0.01 1.72 4.57 -1.96 -0.75 114.58 119.28 2jc3 h GLU 120 Ca 0.44 -0.14 -0.00 0.00 -1.18 0.00 0.00 59.36 58.48 2jc3 h GLU 120 Cb 0.54 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.13 2jc3 h GLU 120 CO -0.21 0.68 -0.01 0.78 -1.18 0.00 0.00 179.01 179.07 2jc3 h GLY 121 N 1.27 -0.02 0.52 1.92 0.00 0.16 -2.09 103.07 104.83 2jc3 h GLY 121 Ca 0.01 0.01 0.06 0.00 0.00 0.00 0.00 47.33 47.42 2jc3 h GLY 121 CO 0.07 -0.01 0.13 0.00 0.00 0.00 0.00 176.54 176.73 2jc3 h ALA 122 N 0.81 0.52 -0.82 3.60 0.00 -1.08 0.10 119.26 122.38 2jc3 h ALA 122 Ca -0.00 0.07 0.13 0.00 0.00 0.00 0.00 54.91 55.11 2jc3 h ALA 122 Cb 0.17 0.07 -0.09 0.00 0.00 0.00 0.00 17.79 17.95 2jc3 h ALA 122 CO 0.00 -0.27 0.43 0.00 0.00 0.00 0.00 179.25 179.41 2jc3 h ARG 123 N 0.28 0.64 0.59 0.00 2.47 -0.89 0.02 114.38 117.49 2jc3 h ARG 123 Ca 0.21 -0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 58.87 2jc3 h ARG 123 Cb 0.24 -0.14 0.01 0.00 -1.65 0.00 0.00 29.97 28.42 2jc3 h ARG 123 CO -0.25 0.42 -0.28 -0.44 0.56 0.00 0.00 179.97 179.99 2jc3 h ASP 124 N 0.66 -0.67 -0.72 7.04 3.45 -0.58 -1.70 116.42 123.90 2jc3 h ASP 124 Ca 0.43 -0.03 0.14 0.00 0.43 0.00 0.00 57.03 58.00 2jc3 h ASP 124 Cb 0.54 0.17 -0.10 0.00 -0.56 0.00 0.00 39.33 39.38 2jc3 h ASP 124 CO -0.32 -0.32 0.23 0.25 -1.57 0.00 0.00 179.24 177.52 2jc3 h LEU 125 N -1.05 0.15 -0.60 1.55 6.46 -0.52 0.25 115.31 121.55 2jc3 h LEU 125 Ca -0.08 0.12 0.02 0.00 -0.12 0.00 0.00 57.88 57.82 2jc3 h LEU 125 Cb 0.66 0.13 -0.04 0.00 -0.73 0.00 0.00 40.66 40.69 2jc3 h LEU 125 CO 0.13 0.04 0.37 0.00 -0.62 0.00 0.00 178.44 178.37 2jc3 h ALA 126 N 1.56 0.77 -0.26 1.25 0.00 -0.98 -1.76 119.26 119.83 2jc3 h ALA 126 Ca 0.40 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.20 2jc3 h ALA 126 Cb 0.63 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2jc3 h ALA 126 CO -0.44 0.12 -0.21 1.25 0.00 0.00 0.00 179.25 179.97 2jc3 h LEU 127 N 0.74 0.48 0.21 0.00 5.85 0.03 -0.95 115.31 121.67 2jc3 h LEU 127 Ca 0.24 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.81 2jc3 h LEU 127 Cb -0.01 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 2jc3 h LEU 127 CO -0.09 0.71 -0.21 0.00 -0.34 0.00 0.00 178.44 178.51 2jc3 h ALA 128 N 1.34 -0.42 -0.50 1.25 0.00 0.09 -0.46 119.26 120.55 2jc3 h ALA 128 Ca 0.07 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.97 2jc3 h ALA 128 Cb 0.62 0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.66 2jc3 h ALA 128 CO 0.04 -0.77 0.24 0.52 0.00 0.00 0.00 179.25 179.29 2jc3 h MET 129 N -0.45 0.45 -0.22 0.00 2.86 -1.13 0.33 114.93 116.77 2jc3 h MET 129 Ca -0.00 -0.03 0.05 0.00 -2.06 0.00 0.00 59.70 57.67 2jc3 h MET 129 Cb 0.42 -0.10 -0.06 0.00 0.06 0.00 0.00 31.60 31.92 2jc3 h MET 129 CO -0.05 0.30 -0.13 1.03 1.06 0.00 0.00 176.91 179.12 2jc3 h SER 130 N 0.47 -0.43 -0.44 1.22 0.87 -0.69 0.52 113.55 115.05 2jc3 h SER 130 Ca 0.23 0.10 -0.06 0.00 -1.23 0.00 0.00 61.79 60.82 2jc3 h SER 130 Cb 0.16 0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.34 2jc3 h SER 130 CO -0.18 -0.17 0.03 -0.33 -0.53 0.00 0.00 176.83 175.65 2jc3 h GLU 131 N -0.12 0.77 -0.79 2.24 5.08 -0.68 -3.12 114.58 117.97 2jc3 h GLU 131 Ca 0.12 -0.23 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 2jc3 h GLU 131 Cb 0.30 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.44 2jc3 h GLU 131 CO -0.30 0.82 0.41 -0.09 -1.00 0.00 0.00 179.01 178.85 2jc3 h ARG 132 N 0.61 1.11 0.00 2.33 2.43 -0.70 -3.47 114.38 116.69 2jc3 h ARG 132 Ca 0.13 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2jc3 h ARG 132 Cb 0.45 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2jc3 h ARG 132 CO 0.02 0.83 0.00 0.41 -1.51 0.00 0.00 179.97 179.72 2jc3 n GLY 133 N -1.06 1.76 0.00 2.80 0.00 0.09 -5.04 105.19 103.74 2jc3 n GLY 133 Ca 0.07 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.23 2jc3 n GLY 133 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jc3 n GLU 134 N 0.00 0.24 0.00 1.61 1.02 -0.70 -4.96 120.64 117.85 2jc3 n GLU 134 Ca 0.00 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 2jc3 n GLU 134 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 2jc3 n GLU 134 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jc3 n GLY 135 N 1.31 3.06 3.65 0.62 0.00 -1.26 -4.79 105.19 107.78 2jc3 n GLY 135 Ca 0.11 -0.68 -0.43 0.00 0.00 0.00 0.00 46.02 45.02 2jc3 n GLY 135 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jc3 s LYS 136 N -2.00 4.06 0.05 1.61 2.47 -0.65 -4.21 119.74 121.08 2jc3 s LYS 136 Ca 0.00 1.56 -0.29 0.00 -1.56 0.00 0.00 55.97 55.68 2jc3 s LYS 136 Cb 0.00 -3.86 -0.05 0.00 -1.46 0.00 0.00 37.83 32.47 2jc3 s LYS 136 CO 0.00 -0.94 0.95 -1.17 0.16 0.00 0.00 175.35 174.35 2jc3 s LEU 137 N 4.08 4.44 -0.03 5.43 2.96 -1.26 -0.86 118.68 133.44 2jc3 s LEU 137 Ca 0.59 1.70 -0.03 0.00 -0.22 0.00 0.00 54.13 56.17 2jc3 s LEU 137 Cb -0.21 -3.54 -0.27 0.00 0.50 0.00 0.00 46.19 42.66 2jc3 s LEU 137 CO 0.21 -0.14 0.72 -0.07 -1.32 0.00 0.00 176.35 175.74 2jc3 h LEU 138 N 6.13 0.39 -3.01 -0.68 3.38 -1.74 -3.48 115.31 116.30 2jc3 h LEU 138 Ca -0.42 -0.62 -0.23 0.00 0.09 0.00 0.00 57.88 56.70 2jc3 h LEU 138 Cb 1.21 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.84 2jc3 h LEU 138 CO 0.73 1.53 -0.76 -0.67 0.09 0.00 0.00 178.44 179.36 2jc3 n ASP 139 N -3.44 -6.50 0.14 -0.43 4.64 -1.26 -4.43 116.55 105.28 2jc3 n ASP 139 Ca -0.20 -0.12 0.18 0.00 -1.38 0.00 0.00 54.79 53.27 2jc3 n ASP 139 Cb 1.05 -3.42 0.78 0.00 -1.04 0.00 0.00 41.12 38.49 2jc3 n ASP 139 CO 0.00 0.00 0.00 0.06 -0.82 0.00 0.00 177.20 176.44 2jc3 h GLN 140 N 1.25 0.00 0.00 -0.67 3.07 -1.94 -0.32 115.11 116.50 2jc3 h GLN 140 Ca -0.31 0.00 -0.06 0.00 0.09 0.00 0.00 58.65 58.37 2jc3 h GLN 140 Cb 1.22 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.77 2jc3 h GLN 140 CO 0.26 0.00 -0.31 0.74 0.09 0.00 0.00 178.83 179.62 2jc3 h PHE 141 N 0.00 0.00 0.00 0.06 0.04 -1.91 -3.37 116.94 111.76 2jc3 h PHE 141 Ca 0.14 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.91 2jc3 h PHE 141 Cb 0.72 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.87 2jc3 h PHE 141 CO 0.00 0.26 -0.37 0.09 -0.60 0.00 0.00 178.31 177.68 2jc3 n ASN 142 N -3.14 1.23 -4.61 2.17 3.02 -0.80 -1.71 115.26 111.42 2jc3 n ASN 142 Ca 0.03 -0.41 -0.43 0.00 -0.03 0.00 0.00 54.58 53.73 2jc3 n ASN 142 Cb 0.64 1.03 -0.02 0.00 -0.61 0.00 0.00 39.78 40.81 2jc3 n ASN 142 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2jc3 s ASN 143 N -1.50 6.27 0.26 6.41 3.84 -0.20 -4.60 114.94 125.42 2jc3 s ASN 143 Ca 0.00 1.25 0.18 0.00 0.21 0.00 0.00 52.86 54.51 2jc3 s ASN 143 Cb 0.02 -2.53 0.97 0.00 -0.55 0.00 0.00 41.25 39.16 2jc3 s ASN 143 CO 0.10 -1.41 1.56 -2.65 -2.79 0.00 0.00 177.10 171.91 2jc3 n PRO 144 N 7.95 0.12 0.21 0.43 -0.02 -1.26 -1.25 135.00 141.18 2jc3 n PRO 144 Ca 0.19 0.60 0.09 0.00 -2.02 0.00 0.00 63.50 62.35 2jc3 n PRO 144 Cb 0.47 -1.88 0.42 0.00 -0.02 0.00 0.00 33.50 32.49 2jc3 n PRO 144 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2jc3 h ASP 145 N 0.00 0.00 0.43 2.55 3.45 -1.93 -2.15 116.42 118.78 2jc3 h ASP 145 Ca 0.00 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.44 2jc3 h ASP 145 Cb 0.02 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.80 2jc3 h ASP 145 CO 0.00 0.27 -0.21 -1.13 -1.57 0.00 0.00 179.24 176.60 2jc3 h ASN 146 N 0.00 -0.49 0.37 6.45 -0.73 -1.47 -2.67 115.58 117.04 2jc3 h ASN 146 Ca -0.00 0.02 -0.00 0.00 1.87 0.00 0.00 56.30 58.18 2jc3 h ASN 146 Cb 0.79 0.13 -0.00 0.00 0.27 0.00 0.00 38.32 39.51 2jc3 h ASN 146 CO 0.03 -0.34 -0.02 1.55 -0.37 0.00 0.00 177.43 178.28 2jc3 h PRO 147 N -0.60 0.00 -0.60 6.67 0.13 -1.72 -2.47 132.00 133.41 2jc3 h PRO 147 Ca -0.06 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.10 2jc3 h PRO 147 Cb 0.45 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.54 2jc3 h PRO 147 CO 0.10 0.02 0.40 -0.92 -0.23 0.00 0.00 178.00 177.37 2jc3 h TYR 148 N 0.00 0.69 -0.82 1.56 3.20 -1.07 -0.42 116.97 120.10 2jc3 h TYR 148 Ca -0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2jc3 h TYR 148 Cb 0.21 -0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.21 2jc3 h TYR 148 CO 0.00 0.41 0.52 0.00 -1.64 0.00 0.00 178.16 177.45 2jc3 h ALA 149 N 1.65 1.04 0.00 1.82 0.00 -1.11 -1.12 119.26 121.53 2jc3 h ALA 149 Ca 0.23 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 2jc3 h ALA 149 Cb 0.05 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2jc3 h ALA 149 CO -0.06 0.48 -0.52 0.45 0.00 0.00 0.00 179.25 179.60 2jc3 h HIS 150 N 1.12 0.00 -0.17 0.00 3.86 -1.42 0.22 115.15 118.76 2jc3 h HIS 150 Ca 0.30 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.35 2jc3 h HIS 150 Cb -0.09 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.37 2jc3 h HIS 150 CO -0.01 0.52 -0.55 -0.92 0.86 0.00 0.00 177.93 177.83 2jc3 h TYR 151 N 0.00 0.64 0.00 2.45 3.20 -0.62 -0.10 116.97 122.53 2jc3 h TYR 151 Ca -0.01 -0.23 -0.13 0.00 3.14 0.00 0.00 58.73 61.50 2jc3 h TYR 151 Cb 1.33 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 39.46 2jc3 h TYR 151 CO 0.00 0.95 -1.73 0.25 -1.64 0.00 0.00 178.16 175.99 2jc3 n THR 152 N -3.95 0.78 0.01 1.81 -2.24 -0.47 -4.46 114.28 105.76 2jc3 n THR 152 Ca -0.03 -0.65 -0.00 0.00 -2.27 0.00 0.00 64.05 61.10 2jc3 n THR 152 Cb 0.60 -0.40 -0.00 0.00 -2.10 0.00 0.00 70.33 68.43 2jc3 n THR 152 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2jc3 n THR 153 N -2.64 0.34 -0.03 4.28 -2.24 0.75 -4.68 114.28 110.06 2jc3 n THR 153 Ca -0.11 0.13 -0.14 0.00 -2.27 0.00 0.00 64.05 61.66 2jc3 n THR 153 Cb 0.78 -1.20 -0.09 0.00 -2.10 0.00 0.00 70.33 67.71 2jc3 n THR 153 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2jc3 h THR 154 N -0.02 0.00 0.00 4.28 2.02 -1.62 -0.25 112.91 117.33 2jc3 h THR 154 Ca 0.00 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.21 2jc3 h THR 154 Cb 0.02 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.40 2jc3 h THR 154 CO 0.00 0.00 -0.18 1.23 0.37 0.00 0.00 175.52 176.94 2jc3 h GLY 155 N -0.51 -0.24 1.65 2.16 0.00 -1.28 -0.22 103.07 104.63 2jc3 h GLY 155 Ca 0.04 0.21 0.02 0.00 0.00 0.00 0.00 47.33 47.59 2jc3 h GLY 155 CO -0.43 -0.17 0.20 -2.55 0.00 0.00 0.00 176.54 173.59 2jc3 h PRO 156 N -0.29 0.32 0.02 4.80 0.11 -1.73 -0.14 132.00 135.09 2jc3 h PRO 156 Ca 0.05 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.14 2jc3 h PRO 156 Cb 0.36 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.40 2jc3 h PRO 156 CO -0.17 0.21 -0.01 0.93 -0.21 0.00 0.00 178.00 178.76 2jc3 h GLU 157 N 0.33 -0.02 -0.70 1.05 5.08 -0.27 -0.77 114.58 119.27 2jc3 h GLU 157 Ca 0.12 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.55 2jc3 h GLU 157 Cb 0.07 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.26 2jc3 h GLU 157 CO -0.03 0.27 0.38 0.82 -1.00 0.00 0.00 179.01 179.45 2jc3 h ILE 158 N -0.32 0.92 -0.62 3.13 2.04 -0.43 0.84 117.51 123.08 2jc3 h ILE 158 Ca -0.00 -0.23 -0.05 0.00 1.00 0.00 0.00 64.86 65.57 2jc3 h ILE 158 Cb 0.30 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.55 2jc3 h ILE 158 CO 0.00 0.12 0.18 -0.25 0.00 0.00 0.00 178.15 178.21 2jc3 h TRP 159 N 0.68 1.01 -0.31 1.37 2.91 -0.96 -0.82 115.95 119.83 2jc3 h TRP 159 Ca 0.33 -0.11 -0.11 0.00 1.13 0.00 0.00 58.89 60.13 2jc3 h TRP 159 Cb 0.26 -0.29 -0.01 0.00 -0.51 0.00 0.00 29.16 28.62 2jc3 h TRP 159 CO -0.08 0.84 -0.26 -0.09 -1.03 0.00 0.00 178.44 177.82 2jc3 h ARG 160 N 0.89 0.72 -0.28 2.65 2.43 -0.25 -1.28 114.38 119.27 2jc3 h ARG 160 Ca 0.20 -0.36 -0.12 0.00 -0.81 0.00 0.00 59.98 58.88 2jc3 h ARG 160 Cb 0.31 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 2jc3 h ARG 160 CO -0.00 0.97 -0.33 1.96 -1.51 0.00 0.00 179.97 181.06 2jc3 h GLN 161 N 0.48 0.61 -0.30 0.20 4.20 0.87 -2.59 115.11 118.57 2jc3 h GLN 161 Ca 0.06 -0.28 0.00 0.00 0.06 0.00 0.00 58.65 58.49 2jc3 h GLN 161 Cb 0.82 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.59 2jc3 h GLN 161 CO 0.07 0.86 0.00 0.25 -0.67 0.00 0.00 178.83 179.34 2jc3 n THR 162 N -4.06 0.39 -3.75 -0.54 -2.24 -0.33 -4.91 114.28 98.84 2jc3 n THR 162 Ca -0.01 -0.47 -0.29 0.00 -2.27 0.00 0.00 64.05 61.02 2jc3 n THR 162 Cb 0.48 0.35 0.01 0.00 -2.10 0.00 0.00 70.33 69.07 2jc3 n THR 162 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2jc3 n SER 163 N 0.57 -4.51 0.00 3.42 7.64 -0.98 -0.49 113.62 119.27 2jc3 n SER 163 Ca 0.15 -0.67 0.00 0.00 1.01 0.00 0.00 58.87 59.36 2jc3 n SER 163 Cb 0.35 -3.64 0.00 0.00 -1.01 0.00 0.00 64.21 59.91 2jc3 n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jc3 n GLY 164 N -1.52 0.29 0.18 0.23 0.00 -0.51 -4.86 105.19 99.01 2jc3 n GLY 164 Ca 0.02 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.17 2jc3 n GLY 164 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2jc3 h ARG 165 N 0.67 0.00 -6.51 1.61 3.08 -1.08 -3.46 114.38 108.69 2jc3 h ARG 165 Ca 0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 2jc3 h ARG 165 Cb 0.41 0.00 0.09 0.00 0.08 0.00 0.00 29.97 30.55 2jc3 h ARG 165 CO 0.00 0.00 0.41 1.51 -1.07 0.00 0.00 179.97 180.82 2jc3 n ILE 166 N -2.82 1.23 0.00 2.04 3.06 -1.26 -4.67 119.36 116.95 2jc3 n ILE 166 Ca 0.04 -0.31 0.00 0.00 -2.50 0.00 0.00 62.75 59.98 2jc3 n ILE 166 Cb 0.48 -1.22 0.00 0.00 0.54 0.00 0.00 39.64 39.45 2jc3 n ILE 166 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 2jc3 n THR 167 N 1.32 0.00 -3.87 9.51 -2.24 -0.43 -4.88 114.28 113.68 2jc3 n THR 167 Ca 0.11 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.78 2jc3 n THR 167 Cb 0.30 -0.04 -0.12 0.00 -2.10 0.00 0.00 70.33 68.36 2jc3 n THR 167 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2jc3 s HIS 168 N -1.98 -0.01 -0.10 4.78 3.76 -1.15 -1.35 115.29 119.23 2jc3 s HIS 168 Ca 0.00 0.04 0.02 0.00 -0.15 0.00 0.00 55.06 54.97 2jc3 s HIS 168 Cb 0.00 -0.02 0.01 0.00 1.11 0.00 0.00 32.58 33.69 2jc3 s HIS 168 CO 0.00 -0.09 -0.14 0.12 -0.85 0.00 0.00 174.74 173.77 2jc3 s PHE 169 N -0.38 1.84 -0.11 1.40 5.36 -0.18 -1.59 117.98 124.32 2jc3 s PHE 169 Ca -0.04 -0.82 0.02 0.00 -0.96 0.00 0.00 56.93 55.13 2jc3 s PHE 169 Cb -0.03 -1.34 -0.01 0.00 -0.34 0.00 0.00 43.02 41.31 2jc3 s PHE 169 CO 0.00 -0.42 -0.19 0.08 -1.46 0.00 0.00 175.22 173.23 2jc3 s VAL 170 N 0.92 2.54 -0.07 3.12 1.01 0.29 -0.16 120.40 128.05 2jc3 s VAL 170 Ca -0.09 -0.85 -0.03 0.00 0.00 0.00 0.00 61.98 61.01 2jc3 s VAL 170 Cb -0.15 -2.02 0.04 0.00 0.00 0.00 0.00 36.38 34.24 2jc3 s VAL 170 CO -0.00 0.54 0.16 -0.55 0.00 0.00 0.00 175.10 175.25 2jc3 s SER 171 N 0.34 -0.13 0.15 3.32 0.15 -0.66 -2.40 113.70 114.48 2jc3 s SER 171 Ca -0.15 0.32 -0.30 0.00 0.70 0.00 0.00 55.95 56.52 2jc3 s SER 171 Cb -0.17 0.23 -0.07 0.00 -1.71 0.00 0.00 66.02 64.30 2jc3 s SER 171 CO 0.07 -0.13 1.14 -0.44 1.20 0.00 0.00 173.24 175.08 2jc3 s SER 172 N 1.01 7.18 -0.23 5.45 0.01 -1.26 -1.41 113.70 124.44 2jc3 s SER 172 Ca -0.08 2.10 -0.12 0.00 1.31 0.00 0.00 55.95 59.16 2jc3 s SER 172 Cb -0.10 -2.60 -0.05 0.00 0.21 0.00 0.00 66.02 63.49 2jc3 s SER 172 CO -0.05 -0.31 0.25 -0.04 0.41 0.00 0.00 173.24 173.49 2jc3 s MET 173 N -0.02 4.09 0.00 12.44 1.00 -0.48 -4.87 119.30 131.47 2jc3 s MET 173 Ca 0.52 -0.11 0.00 0.00 0.00 0.00 0.00 55.69 56.10 2jc3 s MET 173 Cb -0.30 -3.56 0.00 0.00 0.00 0.00 0.00 34.83 30.97 2jc3 s MET 173 CO 0.34 -0.01 0.00 0.41 0.00 0.00 0.00 175.02 175.76 2jc3 n GLY 174 N 4.26 0.31 0.14 -0.03 0.00 -1.26 -3.98 105.19 104.64 2jc3 n GLY 174 Ca -0.12 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.92 2jc3 n GLY 174 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2jc3 h THR 175 N 0.00 0.88 0.00 2.61 1.35 -1.92 -3.45 112.91 112.37 2jc3 h THR 175 Ca 0.00 -2.24 0.00 0.00 -0.55 0.00 0.00 66.41 63.62 2jc3 h THR 175 Cb 0.00 2.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.85 2jc3 h THR 175 CO 0.00 0.50 0.00 0.35 -0.25 0.00 0.00 175.52 176.12 2jc3 n THR 176 N -3.22 0.00 -0.07 6.82 -2.24 -1.26 -4.62 114.28 109.68 2jc3 n THR 176 Ca 0.02 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.71 2jc3 n THR 176 Cb 0.74 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.95 2jc3 n THR 176 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2jc3 h GLY 177 N 0.00 0.38 0.95 3.38 0.00 -1.92 0.12 103.07 105.98 2jc3 h GLY 177 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.21 2jc3 h GLY 177 CO 0.00 0.12 -0.02 -0.84 0.00 0.00 0.00 176.54 175.80 2jc3 h THR 178 N 0.34 0.95 -0.44 4.70 2.02 -1.92 0.28 112.91 118.85 2jc3 h THR 178 Ca 0.11 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.15 2jc3 h THR 178 Cb -0.01 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 2jc3 h THR 178 CO -0.04 0.00 -0.25 -0.29 0.37 0.00 0.00 175.52 175.31 2jc3 h ILE 179 N -0.04 1.27 0.39 3.11 2.10 -1.89 -0.84 117.51 121.61 2jc3 h ILE 179 Ca 0.01 -1.41 -0.02 0.00 1.08 0.00 0.00 64.86 64.52 2jc3 h ILE 179 Cb 0.05 1.20 0.00 0.00 -1.09 0.00 0.00 36.82 36.98 2jc3 h ILE 179 CO -0.02 0.48 -0.19 0.74 -1.08 0.00 0.00 178.15 178.08 2jc3 h THR 180 N 0.79 0.62 -0.23 2.19 2.02 -0.78 0.89 112.91 118.41 2jc3 h THR 180 Ca 0.10 -0.03 -0.00 0.00 0.77 0.00 0.00 66.41 67.24 2jc3 h THR 180 Cb 0.82 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 2jc3 h THR 180 CO 0.07 0.01 0.13 1.23 0.37 0.00 0.00 175.52 177.32 2jc3 h GLY 181 N -0.54 0.34 0.99 2.16 0.00 -0.42 -0.38 103.07 105.21 2jc3 h GLY 181 Ca -0.05 -0.15 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 2jc3 h GLY 181 CO 0.09 0.15 0.11 -2.08 0.00 0.00 0.00 176.54 174.80 2jc3 h VAL 182 N 0.26 1.25 0.04 4.60 2.07 -1.14 -2.68 116.25 120.65 2jc3 h VAL 182 Ca 0.08 -0.89 -0.00 0.00 0.82 0.00 0.00 66.70 66.71 2jc3 h VAL 182 Cb 0.06 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 2jc3 h VAL 182 CO -0.01 0.32 -0.02 -1.28 0.02 0.00 0.00 177.57 176.60 2jc3 h SER 183 N 0.71 -0.05 -0.88 0.57 0.87 -0.70 -0.10 113.55 113.97 2jc3 h SER 183 Ca 0.16 -0.03 0.23 0.00 -1.23 0.00 0.00 61.79 60.92 2jc3 h SER 183 Cb 0.36 0.01 -0.14 0.00 -0.44 0.00 0.00 62.40 62.20 2jc3 h SER 183 CO 0.01 -0.00 0.27 -0.09 -0.53 0.00 0.00 176.83 176.48 2jc3 h ARG 184 N -0.09 0.24 -0.04 2.24 2.43 -0.96 0.12 114.38 118.31 2jc3 h ARG 184 Ca -0.01 -0.01 -0.24 0.00 -0.81 0.00 0.00 59.98 58.91 2jc3 h ARG 184 Cb 0.07 -0.05 0.01 0.00 -0.42 0.00 0.00 29.97 29.58 2jc3 h ARG 184 CO 0.01 0.16 -0.94 0.35 -1.51 0.00 0.00 179.97 178.03 2jc3 h PHE 185 N 0.24 0.95 -0.40 2.20 3.04 -1.08 -3.28 116.94 118.61 2jc3 h PHE 185 Ca 0.56 -0.48 -0.10 0.00 3.98 0.00 0.00 57.97 61.92 2jc3 h PHE 185 Cb 1.12 -0.12 -0.02 0.00 2.56 0.00 0.00 35.95 39.49 2jc3 h PHE 185 CO -0.23 1.31 -0.16 -0.07 -2.02 0.00 0.00 178.31 177.14 2jc3 h LEU 186 N 0.40 0.74 -1.66 0.59 3.38 0.83 -2.80 115.31 116.80 2jc3 h LEU 186 Ca -0.10 -0.24 0.11 0.00 0.09 0.00 0.00 57.88 57.74 2jc3 h LEU 186 Cb 1.58 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 42.09 2jc3 h LEU 186 CO 0.18 0.91 0.41 0.03 0.09 0.00 0.00 178.44 180.06 2jc3 h ARG 187 N 0.66 0.37 0.00 1.13 2.47 -0.92 0.56 114.38 118.66 2jc3 h ARG 187 Ca 0.11 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 2jc3 h ARG 187 Cb 0.64 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.88 2jc3 h ARG 187 CO 0.04 0.24 0.00 0.39 0.56 0.00 0.00 179.97 181.21 2jc3 n GLU 188 N -4.47 0.24 -3.38 0.04 1.02 -1.05 -4.70 120.64 108.33 2jc3 n GLU 188 Ca 0.10 0.09 -0.29 0.00 -0.02 0.00 0.00 57.16 57.05 2jc3 n GLU 188 Cb 0.40 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.28 2jc3 n GLU 188 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2jc3 s GLN 189 N -2.28 3.64 0.03 3.49 -1.52 0.19 -5.01 119.66 118.20 2jc3 s GLN 189 Ca 0.13 0.01 -0.26 0.00 -1.95 0.00 0.00 55.36 53.28 2jc3 s GLN 189 Cb 0.07 -2.67 -0.15 0.00 -0.22 0.00 0.00 33.01 30.05 2jc3 s GLN 189 CO 0.14 0.25 1.28 1.49 -0.25 0.00 0.00 175.29 178.19 2jc3 h GLU 190 N 1.85 -0.92 -6.38 2.91 4.81 -1.86 -3.43 114.58 111.55 2jc3 h GLU 190 Ca -0.47 0.06 -0.64 0.00 -0.13 0.00 0.00 59.36 58.18 2jc3 h GLU 190 Cb 1.19 0.21 0.07 0.00 0.63 0.00 0.00 28.75 30.85 2jc3 h GLU 190 CO 0.67 -0.61 0.40 1.17 -0.73 0.00 0.00 179.01 179.91 2jc3 n LYS 191 N -4.83 1.39 -2.60 1.92 4.81 -1.26 -4.94 118.16 112.65 2jc3 n LYS 191 Ca -0.12 0.50 -0.34 0.00 -0.87 0.00 0.00 58.31 57.48 2jc3 n LYS 191 Cb 0.38 -2.07 -0.04 0.00 0.02 0.00 0.00 35.03 33.32 2jc3 n LYS 191 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 2jc3 s PRO 192 N -0.16 3.90 -0.09 1.64 0.02 -1.26 -4.96 135.00 134.11 2jc3 s PRO 192 Ca 0.74 1.32 -0.03 0.00 0.02 0.00 0.00 61.00 63.05 2jc3 s PRO 192 Cb -0.82 -2.14 0.05 0.00 0.02 0.00 0.00 34.50 31.61 2jc3 s PRO 192 CO 0.50 -0.34 0.17 0.08 -0.33 0.00 0.00 177.00 177.08 2jc3 s VAL 193 N -2.00 -0.22 -0.03 3.83 1.01 -1.26 -4.84 120.40 116.89 2jc3 s VAL 193 Ca 0.66 0.30 -0.30 0.00 0.00 0.00 0.00 61.98 62.64 2jc3 s VAL 193 Cb -0.15 -0.30 -0.03 0.00 0.00 0.00 0.00 36.38 35.89 2jc3 s VAL 193 CO 0.19 0.12 1.13 -0.89 0.00 0.00 0.00 175.10 175.65 2jc3 s THR 194 N 2.00 4.40 -0.27 3.92 2.01 -0.46 -4.93 115.64 122.32 2jc3 s THR 194 Ca -0.01 1.72 -0.09 0.00 0.31 0.00 0.00 61.69 63.62 2jc3 s THR 194 Cb -0.12 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.25 2jc3 s THR 194 CO -0.06 0.05 0.14 -0.63 -0.69 0.00 0.00 174.62 173.43 2jc3 s ILE 195 N 1.73 4.87 -0.20 1.82 -1.09 -1.26 -1.02 121.20 126.05 2jc3 s ILE 195 Ca 0.54 0.02 -0.01 0.00 -2.23 0.00 0.00 60.65 58.98 2jc3 s ILE 195 Cb -0.24 -3.30 0.01 0.00 -1.58 0.00 0.00 42.46 37.35 2jc3 s ILE 195 CO 0.24 0.29 -0.14 -0.69 -1.23 0.00 0.00 174.94 173.41 2jc3 s VAL 196 N 1.69 2.55 0.15 2.92 1.01 0.77 -1.36 120.40 128.14 2jc3 s VAL 196 Ca 0.07 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.30 2jc3 s VAL 196 Cb -0.16 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 2jc3 s VAL 196 CO 0.08 0.49 0.18 -0.83 0.00 0.00 0.00 175.10 175.02 2jc3 s GLY 197 N 1.36 1.76 0.05 4.51 0.00 0.34 -1.65 107.32 113.68 2jc3 s GLY 197 Ca 0.05 -1.12 0.06 0.00 0.00 0.00 0.00 44.72 43.71 2jc3 s GLY 197 CO -0.09 -1.12 -0.16 1.08 0.00 0.00 0.00 173.10 172.80 2jc3 s LEU 198 N -3.06 2.18 0.04 0.66 1.43 -0.50 -0.84 118.68 118.58 2jc3 s LEU 198 Ca 0.32 -0.50 -0.01 0.00 -1.03 0.00 0.00 54.13 52.92 2jc3 s LEU 198 Cb -0.11 -0.72 -0.03 0.00 0.03 0.00 0.00 46.19 45.36 2jc3 s LEU 198 CO 0.25 0.06 -0.03 0.00 0.23 0.00 0.00 176.35 176.87 2jc3 s GLN 199 N -1.23 0.47 0.50 1.70 -2.07 -0.31 -1.38 119.66 117.34 2jc3 s GLN 199 Ca 0.03 -0.93 -0.21 0.00 -1.82 0.00 0.00 55.36 52.43 2jc3 s GLN 199 Cb -0.08 0.17 -0.07 0.00 -1.09 0.00 0.00 33.01 31.94 2jc3 s GLN 199 CO 0.02 -0.08 1.15 -1.25 -1.32 0.00 0.00 175.29 173.81 2jc3 s PRO 200 N -2.78 3.57 0.66 9.60 0.04 -1.26 -0.88 135.00 143.94 2jc3 s PRO 200 Ca -0.04 1.72 -0.16 0.00 0.04 0.00 0.00 61.00 62.56 2jc3 s PRO 200 Cb -0.00 -2.23 -0.00 0.00 0.04 0.00 0.00 34.50 32.31 2jc3 s PRO 200 CO -0.06 -0.70 1.17 -2.00 0.04 0.00 0.00 177.00 175.46 2jc3 s GLU 201 N -2.95 2.65 0.24 4.56 2.12 -0.24 -4.68 118.70 120.39 2jc3 s GLU 201 Ca 0.68 1.67 -0.31 0.00 0.36 0.00 0.00 54.97 57.36 2jc3 s GLU 201 Cb -0.27 -1.91 -0.13 0.00 0.26 0.00 0.00 34.13 32.09 2jc3 s GLU 201 CO 0.32 -1.42 1.51 0.39 -0.54 0.00 0.00 175.26 175.52 2jc3 n GLU 202 N -2.21 2.31 0.00 4.30 1.02 -1.26 -0.59 120.64 124.22 2jc3 n GLU 202 Ca 0.12 0.83 0.00 0.00 -0.02 0.00 0.00 57.16 58.09 2jc3 n GLU 202 Cb 0.51 -2.55 0.00 0.00 -0.02 0.00 0.00 31.44 29.37 2jc3 n GLU 202 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jc3 n GLY 203 N 2.47 2.80 3.76 0.62 0.00 -1.26 -5.02 105.19 108.56 2jc3 n GLY 203 Ca 0.12 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 2jc3 n GLY 203 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jc3 s SER 204 N 0.61 7.01 -0.26 1.61 0.01 0.25 -5.03 113.70 117.89 2jc3 s SER 204 Ca 0.00 2.37 -0.01 0.00 1.31 0.00 0.00 55.95 59.62 2jc3 s SER 204 Cb 0.00 -2.63 0.04 0.00 0.21 0.00 0.00 66.02 63.64 2jc3 s SER 204 CO 0.00 -0.34 -0.05 -0.55 0.41 0.00 0.00 173.24 172.71 2jc3 s SER 205 N -0.86 4.49 -0.28 2.44 0.15 -1.26 -4.69 113.70 113.69 2jc3 s SER 205 Ca 0.48 -1.06 0.01 0.00 0.70 0.00 0.00 55.95 56.08 2jc3 s SER 205 Cb -0.33 -1.66 0.08 0.00 -1.71 0.00 0.00 66.02 62.40 2jc3 s SER 205 CO 0.43 -0.17 0.00 -0.63 1.20 0.00 0.00 173.24 174.07 2jc3 s ILE 206 N 1.27 1.56 0.03 6.45 1.01 -1.26 -4.83 121.20 125.43 2jc3 s ILE 206 Ca -0.03 -1.53 -0.38 0.00 0.00 0.00 0.00 60.65 58.71 2jc3 s ILE 206 Cb -0.18 -1.98 -0.18 0.00 0.01 0.00 0.00 42.46 40.13 2jc3 s ILE 206 CO -0.04 -0.35 1.29 -2.65 0.00 0.00 0.00 174.94 173.19 2jc3 n PRO 207 N 4.61 0.78 0.00 2.79 -0.02 -1.26 -2.27 135.00 139.63 2jc3 n PRO 207 Ca -0.06 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 2jc3 n PRO 207 Cb 0.43 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 2jc3 n PRO 207 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jc3 n GLY 208 N 2.33 3.01 3.62 -1.23 0.00 -1.26 -4.37 105.19 107.29 2jc3 n GLY 208 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 2jc3 n GLY 208 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2jc3 s ILE 209 N -2.93 0.73 0.09 -0.61 -4.36 -0.96 -4.54 121.20 108.62 2jc3 s ILE 209 Ca 0.00 -2.00 -0.25 0.00 -0.26 0.00 0.00 60.65 58.14 2jc3 s ILE 209 Cb 0.00 -2.21 0.08 0.00 1.25 0.00 0.00 42.46 41.58 2jc3 s ILE 209 CO 0.00 0.00 0.68 0.00 0.24 0.00 0.00 174.94 175.86 2jc3 s ARG 210 N -3.75 1.14 -0.39 0.37 1.70 -1.26 -4.67 118.95 112.08 2jc3 s ARG 210 Ca 0.15 -0.35 -0.25 0.00 -0.47 0.00 0.00 55.73 54.81 2jc3 s ARG 210 Cb 0.01 0.52 0.02 0.00 -0.57 0.00 0.00 34.95 34.93 2jc3 s ARG 210 CO 0.10 -0.48 0.86 0.50 -1.08 0.00 0.00 175.30 175.20 2jc3 s ARG 211 N -3.31 3.70 0.03 3.89 3.52 -1.26 -4.64 118.95 120.88 2jc3 s ARG 211 Ca 0.01 0.33 -0.29 0.00 -0.13 0.00 0.00 55.73 55.66 2jc3 s ARG 211 Cb -0.01 -3.84 -0.04 0.00 -1.56 0.00 0.00 34.95 29.50 2jc3 s ARG 211 CO -0.10 -0.99 0.92 -1.58 -0.81 0.00 0.00 175.30 172.75 2jc3 s TRP 212 N 3.39 3.70 0.12 5.12 0.52 -1.26 -4.98 118.94 125.55 2jc3 s TRP 212 Ca 0.35 1.66 -0.35 0.00 0.02 0.00 0.00 56.10 57.77 2jc3 s TRP 212 Cb -0.12 -3.04 -0.15 0.00 -1.15 0.00 0.00 33.47 29.01 2jc3 s TRP 212 CO 0.20 0.09 1.43 -2.30 0.02 0.00 0.00 176.95 176.39 2jc3 n PRO 213 N 3.46 1.57 -0.15 4.98 -0.02 -1.26 -4.77 135.00 138.81 2jc3 n PRO 213 Ca 0.03 0.56 0.02 0.00 -2.02 0.00 0.00 63.50 62.09 2jc3 n PRO 213 Cb 0.50 -2.25 0.05 0.00 -0.02 0.00 0.00 33.50 31.78 2jc3 n PRO 213 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jc3 n ALA 214 N 2.80 0.06 -1.57 3.55 0.00 -1.26 0.87 120.51 124.96 2jc3 n ALA 214 Ca 0.17 0.43 -0.19 0.00 0.00 0.00 0.00 53.44 53.85 2jc3 n ALA 214 Cb 0.23 -0.24 0.12 0.00 0.00 0.00 0.00 19.45 19.56 2jc3 n ALA 214 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2jc3 n GLU 215 N -4.63 2.59 -1.22 0.00 1.02 -1.26 -4.49 120.64 112.64 2jc3 n GLU 215 Ca 0.06 -3.49 0.04 0.00 -0.02 0.00 0.00 57.16 53.75 2jc3 n GLU 215 Cb 0.19 -2.10 0.04 0.00 -0.02 0.00 0.00 31.44 29.55 2jc3 n GLU 215 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2jc3 n TYR 216 N -0.96 0.00 -1.03 -0.32 4.02 0.25 -5.11 117.16 114.02 2jc3 n TYR 216 Ca 0.46 -0.56 -0.34 0.00 -0.01 0.00 0.00 57.90 57.45 2jc3 n TYR 216 Cb 0.98 -0.15 0.12 0.00 -0.02 0.00 0.00 39.34 40.27 2jc3 n TYR 216 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 176.86 174.52 2jc3 n MET 217 N 0.19 0.05 -1.60 -0.72 2.81 -1.23 -4.58 117.12 112.04 2jc3 n MET 217 Ca 0.07 0.09 -0.34 0.00 -1.81 0.00 0.00 57.70 55.71 2jc3 n MET 217 Cb 1.02 -2.24 0.07 0.00 -0.71 0.00 0.00 33.22 31.36 2jc3 n MET 217 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 2jc3 s PRO 218 N -3.89 2.47 0.25 0.03 0.04 -1.26 -4.90 135.00 127.75 2jc3 s PRO 218 Ca 0.69 1.58 -0.05 0.00 0.04 0.00 0.00 61.00 63.26 2jc3 s PRO 218 Cb -0.28 -1.89 0.49 0.00 0.04 0.00 0.00 34.50 32.86 2jc3 s PRO 218 CO 0.55 -1.54 1.66 0.78 0.04 0.00 0.00 177.00 178.49 2jc3 h GLY 219 N -0.11 1.01 2.00 0.56 0.00 -1.83 -0.82 103.07 103.88 2jc3 h GLY 219 Ca -0.47 0.02 0.00 0.00 0.00 0.00 0.00 47.33 46.88 2jc3 h GLY 219 CO 0.52 -0.26 0.00 0.29 0.00 0.00 0.00 176.54 177.08 2jc3 n ILE 220 N -5.24 1.39 -2.29 2.60 -5.35 -0.69 -4.77 119.36 105.00 2jc3 n ILE 220 Ca 0.15 0.36 -0.41 0.00 -0.27 0.00 0.00 62.75 62.58 2jc3 n ILE 220 Cb 0.50 -1.22 -0.03 0.00 -1.74 0.00 0.00 39.64 37.16 2jc3 n ILE 220 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 2jc3 s PHE 221 N -3.02 3.33 -0.46 4.28 2.19 -0.31 -4.96 117.98 119.02 2jc3 s PHE 221 Ca 0.04 1.33 0.03 0.00 0.33 0.00 0.00 56.93 58.66 2jc3 s PHE 221 Cb 0.06 -3.52 0.14 0.00 -1.31 0.00 0.00 43.02 38.39 2jc3 s PHE 221 CO 0.16 -1.54 0.27 1.21 1.83 0.00 0.00 175.22 177.15 2jc3 s ASN 222 N 0.17 3.62 0.44 6.13 3.84 -1.26 -4.99 114.94 122.89 2jc3 s ASN 222 Ca 0.54 -2.78 0.38 0.00 0.21 0.00 0.00 52.86 51.22 2jc3 s ASN 222 Cb -0.35 -1.07 1.42 0.00 -0.55 0.00 0.00 41.25 40.71 2jc3 s ASN 222 CO 0.38 -0.24 1.34 0.00 -2.79 0.00 0.00 177.10 175.79 2jc3 n ALA 223 N 3.34 1.48 1.12 1.71 0.00 -1.26 0.11 120.51 127.01 2jc3 n ALA 223 Ca 0.11 0.62 0.13 0.00 0.00 0.00 0.00 53.44 54.30 2jc3 n ALA 223 Cb 0.35 -0.96 0.63 0.00 0.00 0.00 0.00 19.45 19.48 2jc3 n ALA 223 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2jc3 n SER 224 N -3.89 0.00 0.12 0.00 3.41 -1.26 -2.78 113.62 109.21 2jc3 n SER 224 Ca 0.37 0.15 0.09 0.00 -0.26 0.00 0.00 58.87 59.22 2jc3 n SER 224 Cb 1.61 -0.37 0.02 0.00 -0.26 0.00 0.00 64.21 65.21 2jc3 n SER 224 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2jc3 h LEU 225 N 0.00 0.00 -8.56 1.04 3.38 0.40 -3.45 115.31 108.12 2jc3 h LEU 225 Ca 0.00 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.29 2jc3 h LEU 225 Cb 0.33 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 40.86 2jc3 h LEU 225 CO 0.00 0.15 -0.53 -0.69 0.09 0.00 0.00 178.44 177.46 2jc3 s VAL 226 N -3.22 4.76 0.19 1.22 1.01 -1.12 -4.76 120.40 118.48 2jc3 s VAL 226 Ca 0.01 -0.45 -0.06 0.00 0.00 0.00 0.00 61.98 61.48 2jc3 s VAL 226 Cb 0.08 -3.47 -0.01 0.00 0.00 0.00 0.00 36.38 32.99 2jc3 s VAL 226 CO 0.76 -0.00 1.56 0.44 0.00 0.00 0.00 175.10 177.86 2jc3 h ASP 227 N 8.40 0.84 -4.85 3.32 3.32 -1.50 -3.46 116.42 122.48 2jc3 h ASP 227 Ca -0.31 -0.35 -0.14 0.00 0.02 0.00 0.00 57.03 56.25 2jc3 h ASP 227 Cb 1.14 -0.23 -0.21 0.00 0.22 0.00 0.00 39.33 40.25 2jc3 h ASP 227 CO 0.63 1.09 -0.43 -1.61 -1.72 0.00 0.00 179.24 177.20 2jc3 s GLU 228 N -4.44 0.51 -0.17 3.56 2.02 -0.95 -5.01 118.70 114.22 2jc3 s GLU 228 Ca -0.10 -0.27 0.00 0.00 0.02 0.00 0.00 54.97 54.63 2jc3 s GLU 228 Cb 0.12 0.22 0.04 0.00 0.10 0.00 0.00 34.13 34.60 2jc3 s GLU 228 CO 0.85 -0.12 -0.10 0.08 0.02 0.00 0.00 175.26 175.99 2jc3 s VAL 229 N -1.21 1.47 0.18 2.63 1.01 -1.26 -0.51 120.40 122.71 2jc3 s VAL 229 Ca -0.13 -0.77 0.05 0.00 0.00 0.00 0.00 61.98 61.13 2jc3 s VAL 229 Cb -0.06 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 2jc3 s VAL 229 CO 0.02 0.26 0.20 -0.76 0.00 0.00 0.00 175.10 174.82 2jc3 s LEU 230 N 1.49 3.98 -0.05 3.92 1.02 -0.02 -4.98 118.68 124.04 2jc3 s LEU 230 Ca 0.01 -0.06 -0.04 0.00 0.02 0.00 0.00 54.13 54.07 2jc3 s LEU 230 Cb -0.15 -2.56 -0.04 0.00 0.02 0.00 0.00 46.19 43.46 2jc3 s LEU 230 CO -0.09 0.04 0.14 -1.81 0.02 0.00 0.00 176.35 174.66 2jc3 s ASP 231 N -3.30 6.22 -0.07 2.29 1.11 -1.26 -1.16 116.67 120.49 2jc3 s ASP 231 Ca 0.32 0.35 0.02 0.00 0.18 0.00 0.00 52.55 53.42 2jc3 s ASP 231 Cb -0.10 -1.94 0.01 0.00 1.07 0.00 0.00 42.92 41.96 2jc3 s ASP 231 CO 0.25 0.32 -0.13 -0.63 1.18 0.00 0.00 175.17 176.16 2jc3 s ILE 232 N -1.19 1.23 0.21 0.77 -1.09 -0.06 -4.87 121.20 116.19 2jc3 s ILE 232 Ca 0.22 -0.53 -0.26 0.00 -2.23 0.00 0.00 60.65 57.85 2jc3 s ILE 232 Cb -0.12 -1.12 -0.08 0.00 -1.58 0.00 0.00 42.46 39.56 2jc3 s ILE 232 CO 0.12 0.38 0.83 -2.28 -1.23 0.00 0.00 174.94 172.76 2jc3 s HIS 233 N 0.65 3.89 0.20 3.97 5.65 -1.26 -1.08 115.29 127.32 2jc3 s HIS 233 Ca -0.15 1.71 -0.15 0.00 0.25 0.00 0.00 55.06 56.72 2jc3 s HIS 233 Cb -0.16 -2.83 0.20 0.00 -1.18 0.00 0.00 32.58 28.62 2jc3 s HIS 233 CO 0.04 0.46 1.62 0.37 -0.65 0.00 0.00 174.74 176.58 2jc3 h GLN 234 N 4.09 -0.05 -1.00 2.88 4.15 -1.91 -1.11 115.11 122.17 2jc3 h GLN 234 Ca -0.47 0.00 0.03 0.00 0.77 0.00 0.00 58.65 58.98 2jc3 h GLN 234 Cb 1.20 0.01 -0.05 0.00 0.21 0.00 0.00 27.48 28.85 2jc3 h GLN 234 CO 0.66 -0.03 0.66 -0.97 -1.93 0.00 0.00 178.83 177.22 2jc3 h ASN 235 N -0.05 1.11 0.00 -0.69 -0.73 -1.94 -0.40 115.58 112.89 2jc3 h ASN 235 Ca 0.28 -0.02 -0.10 0.00 1.87 0.00 0.00 56.30 58.33 2jc3 h ASN 235 Cb 0.48 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 38.80 2jc3 h ASN 235 CO -0.64 0.78 -0.30 -0.78 -0.37 0.00 0.00 177.43 176.11 2jc3 h ASP 236 N 1.30 0.45 -0.14 1.15 3.58 -1.64 -0.90 116.42 120.23 2jc3 h ASP 236 Ca 0.39 -0.16 -0.10 0.00 0.42 0.00 0.00 57.03 57.57 2jc3 h ASP 236 Cb -0.06 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 40.87 2jc3 h ASP 236 CO -0.11 0.74 -0.32 0.00 -2.88 0.00 0.00 179.24 176.67 2jc3 h ALA 237 N 1.30 0.23 -0.65 -0.78 0.00 -0.45 -1.77 119.26 117.13 2jc3 h ALA 237 Ca 0.05 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 2jc3 h ALA 237 Cb 0.73 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 2jc3 h ALA 237 CO 0.06 0.26 0.36 0.93 0.00 0.00 0.00 179.25 180.86 2jc3 h GLU 238 N 0.07 0.91 -0.26 0.00 5.08 -1.00 0.24 114.58 119.61 2jc3 h GLU 238 Ca -0.00 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 2jc3 h GLU 238 Cb 0.92 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 2jc3 h GLU 238 CO 0.07 0.68 0.12 -0.91 -1.00 0.00 0.00 179.01 177.96 2jc3 h ASN 239 N 0.89 0.35 -0.22 1.42 2.35 -1.12 -0.78 115.58 118.47 2jc3 h ASN 239 Ca 0.23 -0.14 -0.06 0.00 -0.55 0.00 0.00 56.30 55.78 2jc3 h ASN 239 Cb 0.03 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 2jc3 h ASN 239 CO -0.04 0.40 -0.04 0.74 -1.65 0.00 0.00 177.43 176.84 2jc3 h THR 240 N 0.28 1.21 0.29 2.81 2.02 -1.08 0.05 112.91 118.50 2jc3 h THR 240 Ca 0.09 -0.87 -0.01 0.00 0.77 0.00 0.00 66.41 66.38 2jc3 h THR 240 Cb 0.15 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 2jc3 h THR 240 CO -0.01 0.30 -0.15 -0.03 0.37 0.00 0.00 175.52 176.00 2jc3 h MET 241 N 0.51 -0.39 -0.92 6.66 1.85 -0.52 0.78 114.93 122.91 2jc3 h MET 241 Ca 0.11 0.03 0.02 0.00 -0.61 0.00 0.00 59.70 59.24 2jc3 h MET 241 Cb 0.39 0.09 -0.05 0.00 0.43 0.00 0.00 31.60 32.46 2jc3 h MET 241 CO 0.02 -0.26 0.60 0.00 -0.40 0.00 0.00 176.91 176.87 2jc3 h ARG 242 N -0.41 1.16 -0.08 0.39 3.08 -0.78 -2.29 114.38 115.45 2jc3 h ARG 242 Ca -0.04 -0.07 -0.11 0.00 0.07 0.00 0.00 59.98 59.84 2jc3 h ARG 242 Cb 0.32 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 2jc3 h ARG 242 CO 0.05 0.77 -0.44 1.49 -1.07 0.00 0.00 179.97 180.78 2jc3 h GLU 243 N 1.20 0.19 -0.72 0.04 4.81 -0.53 -2.21 114.58 117.36 2jc3 h GLU 243 Ca 0.35 -0.09 -0.03 0.00 -0.13 0.00 0.00 59.36 59.45 2jc3 h GLU 243 Cb -0.07 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.27 2jc3 h GLU 243 CO -0.09 0.60 0.32 -0.07 -0.73 0.00 0.00 179.01 179.04 2jc3 h LEU 244 N 0.16 0.96 -0.15 1.64 3.38 -0.28 0.16 115.31 121.19 2jc3 h LEU 244 Ca 0.01 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 2jc3 h LEU 244 Cb 0.84 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 2jc3 h LEU 244 CO 0.07 0.85 -0.01 0.00 0.09 0.00 0.00 178.44 179.43 2jc3 h ALA 245 N 1.16 0.20 -0.31 1.53 0.00 -1.16 -0.17 119.26 120.51 2jc3 h ALA 245 Ca 0.24 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 2jc3 h ALA 245 Cb 0.16 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2jc3 h ALA 245 CO -0.03 -0.09 -0.17 0.28 0.00 0.00 0.00 179.25 179.24 2jc3 h VAL 246 N 0.00 1.29 0.00 0.00 2.07 -1.26 -1.24 116.25 117.12 2jc3 h VAL 246 Ca 0.04 -1.29 0.00 0.00 0.82 0.00 0.00 66.70 66.27 2jc3 h VAL 246 Cb 0.39 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 2jc3 h VAL 246 CO 0.01 0.42 -1.35 0.54 0.02 0.00 0.00 177.57 177.20 2jc3 n ARG 247 N -4.35 0.27 0.00 1.57 1.74 0.55 -4.52 116.66 111.92 2jc3 n ARG 247 Ca -0.03 -0.07 0.00 0.00 -0.77 0.00 0.00 57.85 56.98 2jc3 n ARG 247 Cb 0.40 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 2jc3 n ARG 247 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2jc3 n GLU 248 N -1.84 4.02 -1.15 5.56 -0.58 -0.17 -4.67 120.64 121.82 2jc3 n GLU 248 Ca 0.01 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.71 2jc3 n GLU 248 Cb 0.43 -0.63 -0.02 0.00 -0.57 0.00 0.00 31.44 30.66 2jc3 n GLU 248 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jc3 n GLY 249 N 1.37 0.66 3.25 0.62 0.00 -0.47 -4.98 105.19 105.66 2jc3 n GLY 249 Ca 0.00 -0.89 -0.39 0.00 0.00 0.00 0.00 46.02 44.74 2jc3 n GLY 249 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jc3 s ILE 250 N -2.15 4.02 -0.59 -0.61 1.01 -0.92 -4.92 121.20 117.04 2jc3 s ILE 250 Ca 0.00 -1.43 -0.21 0.00 0.00 0.00 0.00 60.65 59.02 2jc3 s ILE 250 Cb 0.00 -3.46 0.08 0.00 0.01 0.00 0.00 42.46 39.09 2jc3 s ILE 250 CO 0.00 -0.46 0.79 0.12 0.00 0.00 0.00 174.94 175.38 2jc3 s PHE 251 N 1.39 2.89 0.32 3.97 5.99 -1.26 -2.31 117.98 128.97 2jc3 s PHE 251 Ca 0.03 -0.66 0.04 0.00 0.00 0.00 0.00 56.93 56.34 2jc3 s PHE 251 Cb -0.22 -4.00 -0.02 0.00 0.00 0.00 0.00 43.02 38.78 2jc3 s PHE 251 CO 0.01 -1.35 0.16 0.00 -0.00 0.00 0.00 175.22 174.05 2jc3 s GLY 253 N -3.07 1.76 0.17 0.00 0.00 -1.18 -4.02 107.32 100.99 2jc3 s GLY 253 Ca 0.23 -1.41 -0.14 0.00 0.00 0.00 0.00 44.72 43.40 2jc3 s GLY 253 CO 0.16 -0.87 1.74 -2.08 0.00 0.00 0.00 173.10 172.05 2jc3 h VAL 254 N -0.68 0.82 0.00 1.40 2.07 -1.89 -1.07 116.25 116.90 2jc3 h VAL 254 Ca -0.40 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 2jc3 h VAL 254 Cb 1.28 0.51 -0.00 0.00 -1.52 0.00 0.00 31.29 31.55 2jc3 h VAL 254 CO 0.46 0.05 -0.08 0.77 0.02 0.00 0.00 177.57 178.79 2jc3 h SER 255 N 0.29 0.00 -0.13 0.57 4.64 -1.91 0.11 113.55 117.11 2jc3 h SER 255 Ca 0.21 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.34 2jc3 h SER 255 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 2jc3 h SER 255 CO -0.24 0.08 -0.64 0.28 -0.87 0.00 0.00 176.83 175.44 2jc3 h SER 256 N 0.00 0.86 -0.45 4.97 0.02 -1.52 0.77 113.55 118.19 2jc3 h SER 256 Ca -0.00 -0.50 -0.01 0.00 -0.84 0.00 0.00 61.79 60.44 2jc3 h SER 256 Cb 0.17 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.44 2jc3 h SER 256 CO 0.01 1.28 0.24 1.23 -1.14 0.00 0.00 176.83 178.46 2jc3 h GLY 257 N 0.77 0.68 0.68 -3.77 0.00 -0.28 -0.77 103.07 100.39 2jc3 h GLY 257 Ca -0.01 -0.31 0.06 0.00 0.00 0.00 0.00 47.33 47.06 2jc3 h GLY 257 CO 0.13 0.30 0.36 -1.33 0.00 0.00 0.00 176.54 176.00 2jc3 h GLY 258 N 0.59 0.95 1.02 4.60 0.00 -0.52 0.30 103.07 110.01 2jc3 h GLY 258 Ca 0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 2jc3 h GLY 258 CO -0.02 0.15 0.47 0.00 0.00 0.00 0.00 176.54 177.13 2jc3 h ALA 259 N 1.34 1.05 -0.17 3.60 0.00 -0.24 -0.08 119.26 124.77 2jc3 h ALA 259 Ca 0.29 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.90 2jc3 h ALA 259 Cb 0.18 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2jc3 h ALA 259 CO -0.18 0.55 -0.65 0.28 0.00 0.00 0.00 179.25 179.25 2jc3 h VAL 260 N 1.14 1.32 -0.57 0.00 2.07 -0.56 -0.96 116.25 118.69 2jc3 h VAL 260 Ca 0.29 -1.92 0.07 0.00 0.82 0.00 0.00 66.70 65.97 2jc3 h VAL 260 Cb 0.00 1.88 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 2jc3 h VAL 260 CO -0.05 0.60 0.26 0.00 0.02 0.00 0.00 177.57 178.39 2jc3 h ALA 261 N 0.83 0.74 -0.75 1.67 0.00 0.18 0.25 119.26 122.18 2jc3 h ALA 261 Ca -0.01 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2jc3 h ALA 261 Cb 1.23 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 2jc3 h ALA 261 CO 0.12 -0.12 0.25 0.78 0.00 0.00 0.00 179.25 180.28 2jc3 h GLY 262 N 0.48 1.24 2.00 0.00 0.00 -0.78 -1.85 103.07 104.15 2jc3 h GLY 262 Ca 0.27 -0.72 -0.06 0.00 0.00 0.00 0.00 47.33 46.82 2jc3 h GLY 262 CO -0.23 0.67 -0.29 0.00 0.00 0.00 0.00 176.54 176.70 2jc3 h ALA 263 N 1.15 1.35 -0.18 3.60 0.00 0.01 -1.34 119.26 123.85 2jc3 h ALA 263 Ca 0.24 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 2jc3 h ALA 263 Cb 0.29 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2jc3 h ALA 263 CO -0.01 0.36 -0.38 -0.07 0.00 0.00 0.00 179.25 179.15 2jc3 h LEU 264 N 0.00 0.66 -0.07 0.00 3.38 0.06 0.11 115.31 119.44 2jc3 h LEU 264 Ca -0.00 -0.55 0.03 0.00 0.09 0.00 0.00 57.88 57.44 2jc3 h LEU 264 Cb 0.57 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 2jc3 h LEU 264 CO 0.04 1.09 -0.11 0.03 0.09 0.00 0.00 178.44 179.58 2jc3 h ARG 265 N 0.25 -0.14 -0.04 1.13 3.08 -0.91 0.46 114.38 118.20 2jc3 h ARG 265 Ca 0.00 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.08 2jc3 h ARG 265 Cb 0.99 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.05 2jc3 h ARG 265 CO 0.09 -0.09 -0.08 0.28 -1.07 0.00 0.00 179.97 179.09 2jc3 h VAL 266 N -0.15 0.77 -1.00 2.04 2.07 -1.22 -1.75 116.25 117.01 2jc3 h VAL 266 Ca 0.07 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.61 2jc3 h VAL 266 Cb 0.24 0.77 -0.05 0.00 -1.52 0.00 0.00 31.29 30.73 2jc3 h VAL 266 CO -0.16 0.00 0.66 0.00 0.02 0.00 0.00 177.57 178.09 2jc3 h ALA 267 N 0.89 1.30 -0.36 1.67 0.00 -0.60 -1.20 119.26 120.96 2jc3 h ALA 267 Ca 0.05 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2jc3 h ALA 267 Cb 0.19 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2jc3 h ALA 267 CO -0.12 0.60 0.06 0.00 0.00 0.00 0.00 179.25 179.80 2jc3 h ARG 268 N 1.31 0.60 0.00 0.00 3.08 -0.67 -2.96 114.38 115.74 2jc3 h ARG 268 Ca 0.38 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 60.27 2jc3 h ARG 268 Cb -0.08 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.90 2jc3 h ARG 268 CO -0.10 0.66 0.00 0.00 -1.07 0.00 0.00 179.97 179.46 2jc3 n ALA 269 N -2.35 1.93 -3.57 0.04 0.00 -0.68 -4.45 120.51 111.43 2jc3 n ALA 269 Ca -0.01 0.01 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 2jc3 n ALA 269 Cb 0.22 -1.40 -0.12 0.00 0.00 0.00 0.00 19.45 18.16 2jc3 n ALA 269 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2jc3 s THR 270 N -3.17 0.81 0.28 0.00 2.01 -0.49 -5.09 115.64 109.99 2jc3 s THR 270 Ca 0.08 -2.36 -0.28 0.00 0.31 0.00 0.00 61.69 59.43 2jc3 s THR 270 Cb 0.11 -1.57 -0.14 0.00 0.01 0.00 0.00 72.50 70.92 2jc3 s THR 270 CO 0.45 -1.01 1.03 -2.65 -0.69 0.00 0.00 174.62 171.75 2jc3 n PRO 271 N 3.49 1.35 -0.92 4.92 -0.02 -1.26 -1.59 135.00 140.98 2jc3 n PRO 271 Ca 0.15 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 2jc3 n PRO 271 Cb 0.38 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 2jc3 n PRO 271 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jc3 n GLY 272 N 1.30 0.80 3.76 -1.23 0.00 -0.87 -4.79 105.19 104.16 2jc3 n GLY 272 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 2jc3 n GLY 272 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jc3 s ALA 273 N -3.39 2.95 -0.67 4.61 0.00 -0.62 -4.60 121.76 120.03 2jc3 s ALA 273 Ca 0.00 1.16 -0.00 0.00 0.00 0.00 0.00 51.96 53.11 2jc3 s ALA 273 Cb 0.00 -3.48 0.17 0.00 0.00 0.00 0.00 23.12 19.81 2jc3 s ALA 273 CO 0.00 -1.00 0.49 0.42 0.00 0.00 0.00 175.76 175.67 2jc3 s ILE 274 N -1.40 3.52 0.07 0.00 -1.09 -1.26 -0.14 121.20 120.89 2jc3 s ILE 274 Ca 0.66 -3.42 -0.21 0.00 -2.23 0.00 0.00 60.65 55.45 2jc3 s ILE 274 Cb -0.35 -3.29 -0.06 0.00 -1.58 0.00 0.00 42.46 37.17 2jc3 s ILE 274 CO 0.43 -0.93 0.63 -0.69 -1.23 0.00 0.00 174.94 173.15 2jc3 s VAL 275 N -0.59 4.71 -0.11 2.92 1.01 -0.44 -1.32 120.40 126.58 2jc3 s VAL 275 Ca 0.20 1.35 0.03 0.00 0.00 0.00 0.00 61.98 63.56 2jc3 s VAL 275 Cb -0.16 -3.97 0.01 0.00 0.00 0.00 0.00 36.38 32.26 2jc3 s VAL 275 CO -0.06 0.50 -0.19 -0.69 0.00 0.00 0.00 175.10 174.65 2jc3 s VAL 276 N -0.81 1.79 0.15 2.92 1.01 -0.62 -0.30 120.40 124.55 2jc3 s VAL 276 Ca 0.31 -0.83 0.09 0.00 0.00 0.00 0.00 61.98 61.56 2jc3 s VAL 276 Cb -0.20 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 2jc3 s VAL 276 CO 0.20 0.50 -0.21 0.00 0.00 0.00 0.00 175.10 175.59 2jc3 s ALA 277 N 0.74 2.13 -0.18 5.51 0.00 -0.18 -0.54 121.76 129.24 2jc3 s ALA 277 Ca -0.10 -1.46 -0.18 0.00 0.00 0.00 0.00 51.96 50.21 2jc3 s ALA 277 Cb -0.16 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.67 2jc3 s ALA 277 CO 0.01 0.35 0.52 0.42 0.00 0.00 0.00 175.76 177.06 2jc3 s ILE 278 N -1.62 5.12 -0.44 0.00 -1.09 -1.01 -1.60 121.20 120.56 2jc3 s ILE 278 Ca 0.14 0.97 -0.16 0.00 -2.23 0.00 0.00 60.65 59.38 2jc3 s ILE 278 Cb -0.08 -3.84 0.04 0.00 -1.58 0.00 0.00 42.46 37.00 2jc3 s ILE 278 CO 0.07 0.21 0.36 -0.63 -1.23 0.00 0.00 174.94 173.71 2jc3 s ILE 279 N 1.43 5.22 0.23 2.92 -1.09 -0.17 -4.73 121.20 125.02 2jc3 s ILE 279 Ca 0.25 -0.77 -0.04 0.00 -2.23 0.00 0.00 60.65 57.85 2jc3 s ILE 279 Cb -0.15 -4.02 0.11 0.00 -1.58 0.00 0.00 42.46 36.81 2jc3 s ILE 279 CO 0.10 -0.43 1.73 0.00 -1.23 0.00 0.00 174.94 175.11 2jc3 s ASP 281 N -6.60 -0.05 0.79 0.00 3.84 -1.26 -1.08 116.67 112.31 2jc3 s ASP 281 Ca -0.10 -0.96 -0.10 0.00 -0.00 0.00 0.00 52.55 51.39 2jc3 s ASP 281 Cb 0.14 0.78 0.10 0.00 -1.38 0.00 0.00 42.92 42.57 2jc3 s ASP 281 CO 0.83 -1.52 1.13 -0.13 -0.00 0.00 0.00 175.17 175.48 2jc3 s ARG 282 N -3.03 1.73 0.00 2.11 0.52 -1.22 -3.08 118.95 115.98 2jc3 s ARG 282 Ca 0.15 -0.26 0.25 0.00 -0.52 0.00 0.00 55.73 55.35 2jc3 s ARG 282 Cb -0.05 -2.05 0.57 0.00 0.52 0.00 0.00 34.95 33.94 2jc3 s ARG 282 CO 0.10 -1.63 1.45 0.41 0.02 0.00 0.00 175.30 175.65 2jc3 n GLY 283 N -3.22 -0.92 0.33 -3.53 0.00 -0.63 -3.71 105.19 93.51 2jc3 n GLY 283 Ca 0.10 -0.39 -0.05 0.00 0.00 0.00 0.00 46.02 45.68 2jc3 n GLY 283 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2jc3 h ASP 284 N 0.60 -1.08 0.13 1.61 3.32 -1.90 0.76 116.42 119.86 2jc3 h ASP 284 Ca 0.00 0.22 0.00 0.00 0.02 0.00 0.00 57.03 57.27 2jc3 h ASP 284 Cb 0.51 0.55 0.00 0.00 0.22 0.00 0.00 39.33 40.61 2jc3 h ASP 284 CO 0.00 -0.30 0.00 0.54 -1.72 0.00 0.00 179.24 177.76 2jc3 n ARG 285 N -5.44 0.30 0.00 3.56 1.74 -1.26 -1.89 116.66 113.68 2jc3 n ARG 285 Ca 0.04 0.09 0.11 0.00 -0.77 0.00 0.00 57.85 57.32 2jc3 n ARG 285 Cb 0.35 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.19 2jc3 n ARG 285 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2jc3 n TYR 286 N -1.15 0.06 -0.22 -1.55 4.01 0.25 -4.55 117.16 114.00 2jc3 n TYR 286 Ca 0.08 0.02 0.02 0.00 -0.16 0.00 0.00 57.90 57.86 2jc3 n TYR 286 Cb 0.08 -0.26 0.14 0.00 -0.31 0.00 0.00 39.34 38.98 2jc3 n TYR 286 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 2jc3 h LEU 287 N 0.00 0.18 0.00 7.72 3.38 -1.24 -0.96 115.31 124.39 2jc3 h LEU 287 Ca 0.00 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2jc3 h LEU 287 Cb 0.72 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2jc3 h LEU 287 CO 0.00 0.09 0.00 -1.54 0.09 0.00 0.00 178.44 177.08 2jc3 n SER 288 N -5.03 0.00 -0.33 -0.43 3.41 -1.26 -2.13 113.62 107.84 2jc3 n SER 288 Ca 0.11 0.44 0.13 0.00 -0.26 0.00 0.00 58.87 59.28 2jc3 n SER 288 Cb 0.34 -0.46 0.38 0.00 -0.26 0.00 0.00 64.21 64.20 2jc3 n SER 288 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2jc3 n THR 289 N -1.46 0.00 0.00 6.66 -2.24 -0.37 -4.96 114.28 111.91 2jc3 n THR 289 Ca 0.03 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2jc3 n THR 289 Cb 0.13 0.50 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 2jc3 n THR 289 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jc3 n GLY 290 N 1.31 2.75 0.23 3.38 0.00 -0.91 -4.87 105.19 107.08 2jc3 n GLY 290 Ca 0.13 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.28 2jc3 n GLY 290 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2jc3 h VAL 291 N 0.00 0.00 0.00 1.61 -1.51 -1.82 -3.32 116.25 111.21 2jc3 h VAL 291 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 2jc3 h VAL 291 Cb 0.00 0.52 0.00 0.00 -2.13 0.00 0.00 31.29 29.68 2jc3 h VAL 291 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 177.57 176.83 2jc3 n PHE 292 N -2.46 0.00 0.05 5.19 3.01 -1.26 -4.93 117.46 117.07 2jc3 n PHE 292 Ca -0.02 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.42 2jc3 n PHE 292 Cb 0.24 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.70 2jc3 n PHE 292 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2jc3 h GLY 293 N 0.00 -0.15 0.00 1.37 0.00 -1.88 -3.53 103.07 98.88 2jc3 h GLY 293 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.39 2jc3 h GLY 293 CO 0.00 -0.06 0.00 -2.21 0.00 0.00 0.00 176.54 174.27