#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 3.88 -4.82 6.12 6.94 -1.26 -4.81 115.26 121.31 2jc3 n ASN 2 Ca 0.00 -3.30 -0.24 0.00 -0.02 0.00 0.00 54.58 51.02 2jc3 n ASN 2 Cb 0.00 -0.65 -0.04 0.00 -2.36 0.00 0.00 39.78 36.73 2jc3 n ASN 2 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2jc3 s THR 3 N -3.01 2.30 0.61 5.53 -4.23 -1.26 -4.97 115.64 110.61 2jc3 s THR 3 Ca 0.48 -1.52 0.29 0.00 -1.18 0.00 0.00 61.69 59.76 2jc3 s THR 3 Cb 0.40 -2.83 0.35 0.00 1.34 0.00 0.00 72.50 71.77 2jc3 s THR 3 CO 0.08 0.00 1.92 0.25 -0.54 0.00 0.00 174.62 176.34 2jc3 h LEU 4 N 1.14 0.00 -1.76 4.79 5.85 -1.99 0.18 115.31 123.52 2jc3 h LEU 4 Ca -0.41 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.29 2jc3 h LEU 4 Cb 1.27 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.29 2jc3 h LEU 4 CO 0.63 0.00 -0.01 -0.08 -0.34 0.00 0.00 178.44 178.64 2jc3 h GLU 5 N 0.00 0.13 0.00 1.25 4.81 -1.97 -1.37 114.58 117.44 2jc3 h GLU 5 Ca 0.14 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 2jc3 h GLU 5 Cb 0.96 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.31 2jc3 h GLU 5 CO -0.00 0.16 0.00 1.04 -0.73 0.00 0.00 179.01 179.48 2jc3 n GLN 6 N -4.44 0.41 -0.16 1.92 3.00 0.05 -2.79 117.38 115.37 2jc3 n GLN 6 Ca -0.01 0.03 0.08 0.00 -0.01 0.00 0.00 57.00 57.09 2jc3 n GLN 6 Cb 0.14 -1.50 0.26 0.00 0.00 0.00 0.00 30.24 29.14 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 -1.28 0.41 -3.40 5.09 -2.24 -0.51 -4.87 114.28 107.49 2jc3 n THR 7 Ca 0.13 -0.48 -0.38 0.00 -2.27 0.00 0.00 64.05 61.05 2jc3 n THR 7 Cb 0.22 0.36 -0.06 0.00 -2.10 0.00 0.00 70.33 68.74 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 -1.59 5.12 0.00 2.28 1.01 -1.12 -4.22 121.20 122.68 2jc3 s ILE 8 Ca 0.30 0.89 0.00 0.00 0.00 0.00 0.00 60.65 61.84 2jc3 s ILE 8 Cb 0.16 -3.77 0.00 0.00 0.01 0.00 0.00 42.46 38.86 2jc3 s ILE 8 CO 0.22 0.43 0.00 0.61 0.00 0.00 0.00 174.94 176.20 2jc3 n GLY 9 N 2.72 -2.57 3.89 6.18 0.00 -1.26 -4.97 105.19 109.19 2jc3 n GLY 9 Ca -0.10 -1.67 -0.25 0.00 0.00 0.00 0.00 46.02 44.01 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 -0.23 -0.74 -4.85 1.61 3.02 -1.26 -4.94 115.26 107.86 2jc3 n ASN 10 Ca 0.00 -0.95 -0.32 0.00 -0.03 0.00 0.00 54.58 53.28 2jc3 n ASN 10 Cb 0.00 -3.34 -0.04 0.00 -0.61 0.00 0.00 39.78 35.79 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 -3.84 4.63 0.61 3.41 -4.23 -1.26 -5.03 115.64 109.94 2jc3 s THR 11 Ca 0.04 0.99 -0.17 0.00 -1.18 0.00 0.00 61.69 61.37 2jc3 s THR 11 Cb -0.02 -3.69 -0.02 0.00 1.34 0.00 0.00 72.50 70.10 2jc3 s THR 11 CO 0.87 -0.51 1.15 -2.16 -0.54 0.00 0.00 174.62 173.43 2jc3 s PRO 12 N -3.73 2.94 -0.25 3.99 0.04 -1.26 -4.77 135.00 131.97 2jc3 s PRO 12 Ca 0.56 1.61 0.03 0.00 0.04 0.00 0.00 61.00 63.24 2jc3 s PRO 12 Cb -0.10 -1.95 0.05 0.00 0.04 0.00 0.00 34.50 32.55 2jc3 s PRO 12 CO 0.27 -1.18 -0.12 -1.17 0.04 0.00 0.00 177.00 174.84 2jc3 s LEU 13 N -4.36 3.23 0.13 -3.56 2.96 -1.26 -1.07 118.68 114.76 2jc3 s LEU 13 Ca 0.72 -1.29 0.10 0.00 -0.22 0.00 0.00 54.13 53.45 2jc3 s LEU 13 Cb -0.25 -1.53 -0.04 0.00 0.50 0.00 0.00 46.19 44.87 2jc3 s LEU 13 CO 0.35 -0.16 -0.25 0.68 -1.32 0.00 0.00 176.35 175.64 2jc3 s VAL 14 N 1.14 2.14 0.03 1.68 -7.23 -0.59 -4.90 120.40 112.67 2jc3 s VAL 14 Ca -0.07 -1.74 -0.19 0.00 -1.81 0.00 0.00 61.98 58.17 2jc3 s VAL 14 Cb -0.19 -1.91 -0.06 0.00 0.56 0.00 0.00 36.38 34.78 2jc3 s VAL 14 CO -0.06 0.03 0.54 -0.75 -0.31 0.00 0.00 175.10 174.55 2jc3 s LYS 15 N -2.09 4.19 0.23 4.82 2.20 -1.26 -0.10 119.74 127.73 2jc3 s LYS 15 Ca 0.13 0.66 -0.30 0.00 -0.36 0.00 0.00 55.97 56.11 2jc3 s LYS 15 Cb -0.10 -3.27 -0.09 0.00 -1.51 0.00 0.00 37.83 32.87 2jc3 s LYS 15 CO 0.06 0.56 1.19 -0.51 -0.36 0.00 0.00 175.35 176.29 2jc3 s LEU 16 N -0.80 4.48 -0.03 5.43 1.43 -0.29 -4.95 118.68 123.94 2jc3 s LEU 16 Ca 0.28 2.31 0.18 0.00 -1.03 0.00 0.00 54.13 55.87 2jc3 s LEU 16 Cb -0.18 -3.62 -0.21 0.00 0.03 0.00 0.00 46.19 42.21 2jc3 s LEU 16 CO 0.17 -0.33 0.55 0.00 0.23 0.00 0.00 176.35 176.97 2jc3 n GLN 17 N 1.92 0.65 0.00 1.70 6.02 -1.26 -4.80 117.38 121.61 2jc3 n GLN 17 Ca 0.02 0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 2jc3 n GLN 17 Cb 0.44 -1.68 0.00 0.00 1.02 0.00 0.00 30.24 30.02 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 -2.75 0.18 -2.22 -1.09 1.74 -1.26 -5.06 116.66 106.20 2jc3 n ARG 18 Ca -0.16 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.60 2jc3 n ARG 18 Cb 0.89 -0.83 -0.01 0.00 -1.02 0.00 0.00 32.46 31.49 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 -1.65 4.32 0.00 0.55 -4.36 -1.26 -4.93 121.20 113.86 2jc3 s ILE 19 Ca 0.00 1.06 0.00 0.00 -0.26 0.00 0.00 60.65 61.45 2jc3 s ILE 19 Cb 0.00 -3.62 0.00 0.00 1.25 0.00 0.00 42.46 40.09 2jc3 s ILE 19 CO 0.00 -0.68 0.00 0.61 0.24 0.00 0.00 174.94 175.11 2jc3 n GLY 20 N -1.52 2.69 3.72 6.27 0.00 -1.26 -4.97 105.19 110.11 2jc3 n GLY 20 Ca 0.07 -1.67 -0.34 0.00 0.00 0.00 0.00 46.02 44.08 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 -4.41 2.08 -0.98 1.61 0.04 -1.26 -4.95 135.00 127.13 2jc3 s PRO 21 Ca 0.00 1.75 -0.00 0.00 0.04 0.00 0.00 61.00 62.78 2jc3 s PRO 21 Cb 0.00 -1.83 0.32 0.00 0.04 0.00 0.00 34.50 33.03 2jc3 s PRO 21 CO 0.00 -1.88 1.72 -3.47 0.04 0.00 0.00 177.00 173.41 2jc3 n ASP 22 N -2.80 7.01 -0.40 6.66 2.03 -1.26 -4.61 116.55 123.18 2jc3 n ASP 22 Ca 0.13 -3.68 0.07 0.00 0.52 0.00 0.00 54.79 51.84 2jc3 n ASP 22 Cb 0.50 -1.11 0.17 0.00 -0.72 0.00 0.00 41.12 39.96 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 -0.03 1.91 0.00 1.67 2.04 -1.26 -4.96 115.26 114.63 2jc3 n ASN 23 Ca 0.44 -3.43 0.00 0.00 -0.44 0.00 0.00 54.58 51.15 2jc3 n ASN 23 Cb 0.28 -0.47 0.00 0.00 -2.53 0.00 0.00 39.78 37.06 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 -1.17 2.75 3.81 4.83 0.00 -1.26 -2.49 105.19 111.66 2jc3 n GLY 24 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.88 6.16 0.07 1.61 1.04 -1.26 -3.97 113.70 115.46 2jc3 s SER 25 Ca 0.00 1.80 0.09 0.00 0.48 0.00 0.00 55.95 58.32 2jc3 s SER 25 Cb 0.00 -2.54 -0.03 0.00 0.10 0.00 0.00 66.02 63.55 2jc3 s SER 25 CO 0.00 -0.90 -0.24 -1.61 0.98 0.00 0.00 173.24 171.47 2jc3 s GLU 26 N -3.78 1.49 -0.17 4.02 2.02 0.67 -4.86 118.70 118.09 2jc3 s GLU 26 Ca 0.64 -1.12 0.01 0.00 0.02 0.00 0.00 54.97 54.52 2jc3 s GLU 26 Cb -0.15 -1.73 0.03 0.00 0.10 0.00 0.00 34.13 32.38 2jc3 s GLU 26 CO 0.30 0.43 -0.15 0.42 0.02 0.00 0.00 175.26 176.28 2jc3 s ILE 27 N -0.91 1.69 -0.05 -1.63 1.01 -1.26 -1.15 121.20 118.90 2jc3 s ILE 27 Ca 0.10 -0.78 0.02 0.00 0.00 0.00 0.00 60.65 60.00 2jc3 s ILE 27 Cb -0.10 -1.61 -0.03 0.00 0.01 0.00 0.00 42.46 40.74 2jc3 s ILE 27 CO 0.03 0.41 -0.10 0.26 0.00 0.00 0.00 174.94 175.55 2jc3 s TRP 28 N 1.43 2.84 -0.09 3.97 0.52 0.53 -1.14 118.94 126.99 2jc3 s TRP 28 Ca 0.04 -0.05 0.03 0.00 0.02 0.00 0.00 56.10 56.14 2jc3 s TRP 28 Cb -0.14 -1.66 -0.01 0.00 -1.15 0.00 0.00 33.47 30.51 2jc3 s TRP 28 CO -0.11 0.29 -0.20 0.14 0.02 0.00 0.00 176.95 177.09 2jc3 s VAL 29 N -0.81 2.49 -0.46 4.03 -7.23 0.86 -1.48 120.40 117.80 2jc3 s VAL 29 Ca 0.13 -0.89 -0.22 0.00 -1.81 0.00 0.00 61.98 59.19 2jc3 s VAL 29 Cb -0.11 -1.97 0.03 0.00 0.56 0.00 0.00 36.38 34.89 2jc3 s VAL 29 CO 0.02 0.56 0.73 -0.75 -0.31 0.00 0.00 175.10 175.34 2jc3 s LYS 30 N 0.02 3.32 -1.40 4.82 2.47 -0.47 -1.54 119.74 126.95 2jc3 s LYS 30 Ca -0.07 -0.30 -0.15 0.00 -1.56 0.00 0.00 55.97 53.88 2jc3 s LYS 30 Cb -0.15 -3.97 0.05 0.00 -1.46 0.00 0.00 37.83 32.31 2jc3 s LYS 30 CO 0.05 -1.12 2.06 1.28 0.16 0.00 0.00 175.35 177.79 2jc3 n LEU 31 N 6.55 6.26 0.07 5.43 4.77 -0.23 -1.16 117.00 138.68 2jc3 n LEU 31 Ca -0.00 -4.09 0.06 0.00 -0.03 0.00 0.00 56.01 51.95 2jc3 n LEU 31 Cb 0.48 -1.68 0.31 0.00 -2.33 0.00 0.00 43.42 40.20 2jc3 n LEU 31 CO 0.57 0.82 0.70 -0.62 -1.33 0.00 0.00 177.39 177.53 2jc3 n GLU 32 N 6.74 0.07 0.00 3.23 -0.58 -0.37 -1.35 120.64 128.38 2jc3 n GLU 32 Ca 0.51 0.48 0.07 0.00 -0.42 0.00 0.00 57.16 57.80 2jc3 n GLU 32 Cb 0.41 -1.70 0.31 0.00 -0.57 0.00 0.00 31.44 29.89 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 -0.93 -0.98 0.19 0.62 0.00 -1.25 -2.33 105.19 100.51 2jc3 n GLY 33 Ca 0.01 -0.05 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 -3.64 1.61 4.21 -1.48 -3.37 115.58 112.91 2jc3 h ASN 34 Ca 0.00 0.00 -0.57 0.00 1.21 0.00 0.00 56.30 56.94 2jc3 h ASN 34 Cb 0.24 0.00 0.16 0.00 -1.12 0.00 0.00 38.32 37.60 2jc3 h ASN 34 CO 0.00 0.00 0.18 0.59 -1.29 0.00 0.00 177.43 176.91 2jc3 n ASN 35 N -2.76 0.96 -0.32 5.81 4.13 -0.98 -4.85 115.26 117.24 2jc3 n ASN 35 Ca 0.03 0.82 0.18 0.00 1.68 0.00 0.00 54.58 57.29 2jc3 n ASN 35 Cb 0.42 -1.41 0.37 0.00 -1.54 0.00 0.00 39.78 37.62 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 0.53 0.17 -0.63 3.52 0.13 -1.88 -0.45 132.00 133.38 2jc3 h PRO 36 Ca -0.49 -0.01 -0.07 0.00 -0.87 0.00 0.00 66.00 64.56 2jc3 h PRO 36 Cb 1.36 -0.04 -0.04 0.00 0.13 0.00 0.00 31.00 32.41 2jc3 h PRO 36 CO 0.51 0.11 0.09 0.00 -0.23 0.00 0.00 178.00 178.48 2jc3 n ALA 37 N -2.64 4.13 -0.91 -0.56 0.00 -1.26 -4.96 120.51 114.31 2jc3 n ALA 37 Ca 0.26 -2.07 0.00 0.00 0.00 0.00 0.00 53.44 51.63 2jc3 n ALA 37 Cb 0.84 -1.17 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 0.37 0.53 3.70 0.00 0.00 -0.18 -4.85 105.19 104.77 2jc3 n GLY 38 Ca 0.32 -0.08 -0.08 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.07 -0.29 0.67 1.61 1.04 -1.22 -3.32 113.70 110.11 2jc3 s SER 39 Ca 0.00 -0.52 0.43 0.00 0.48 0.00 0.00 55.95 56.33 2jc3 s SER 39 Cb 0.00 0.67 2.34 0.00 0.10 0.00 0.00 66.02 69.13 2jc3 s SER 39 CO 0.00 -1.22 2.33 1.62 0.98 0.00 0.00 173.24 176.95 2jc3 h VAL 40 N 2.06 0.03 0.00 5.02 3.04 -1.00 -2.78 116.25 122.63 2jc3 h VAL 40 Ca -0.24 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.42 2jc3 h VAL 40 Cb 1.26 0.97 -0.00 0.00 -2.01 0.00 0.00 31.29 31.51 2jc3 h VAL 40 CO 0.29 0.00 -0.13 0.11 -1.01 0.00 0.00 177.57 176.83 2jc3 h LYS 41 N 0.00 0.00 -0.72 4.17 1.79 -1.88 -2.53 116.57 117.41 2jc3 h LYS 41 Ca 0.00 0.00 0.21 0.00 -2.18 0.00 0.00 60.65 58.68 2jc3 h LYS 41 Cb 0.07 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.69 2jc3 h LYS 41 CO -0.00 0.13 0.53 -0.44 -1.08 0.00 0.00 179.45 178.58 2jc3 h ASP 42 N 0.00 0.00 0.07 0.86 3.32 -1.81 -0.71 116.42 118.16 2jc3 h ASP 42 Ca -0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2jc3 h ASP 42 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.82 2jc3 h ASP 42 CO 0.02 0.00 -0.03 0.03 -1.72 0.00 0.00 179.24 177.53 2jc3 h ARG 43 N 0.00 -0.09 -0.29 3.56 3.08 -1.70 -2.12 114.38 116.82 2jc3 h ARG 43 Ca 0.34 0.01 -0.13 0.00 0.07 0.00 0.00 59.98 60.27 2jc3 h ARG 43 Cb 1.39 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.45 2jc3 h ARG 43 CO -0.00 0.34 -0.35 0.00 -1.07 0.00 0.00 179.97 178.89 2jc3 h ALA 44 N 0.30 0.85 -0.04 0.04 0.00 -1.56 -1.44 119.26 117.41 2jc3 h ALA 44 Ca -0.01 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2jc3 h ALA 44 Cb 0.48 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2jc3 h ALA 44 CO 0.02 0.64 0.02 0.00 0.00 0.00 0.00 179.25 179.93 2jc3 h ALA 45 N 1.07 0.05 -0.22 0.00 0.00 -1.18 0.99 119.26 119.96 2jc3 h ALA 45 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2jc3 h ALA 45 Cb 0.86 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2jc3 h ALA 45 CO 0.07 -0.44 0.15 1.25 0.00 0.00 0.00 179.25 180.28 2jc3 h LEU 46 N 0.02 0.25 -0.50 0.00 5.85 -1.26 -2.43 115.31 117.24 2jc3 h LEU 46 Ca 0.01 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 2jc3 h LEU 46 Cb 0.02 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 2jc3 h LEU 46 CO -0.00 0.18 0.25 -1.28 -0.34 0.00 0.00 178.44 177.25 2jc3 h SER 47 N 0.30 0.65 -0.84 1.25 0.87 -1.02 0.21 113.55 114.97 2jc3 h SER 47 Ca 0.08 -0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.51 2jc3 h SER 47 Cb -0.03 -0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 61.72 2jc3 h SER 47 CO -0.02 0.59 0.48 0.24 -0.53 0.00 0.00 176.83 177.59 2jc3 h MET 48 N 0.67 1.15 -0.02 2.24 2.86 -0.73 -0.76 114.93 120.34 2jc3 h MET 48 Ca 0.17 -0.12 -0.03 0.00 -2.06 0.00 0.00 59.70 57.66 2jc3 h MET 48 Cb 0.10 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.53 2jc3 h MET 48 CO -0.02 0.83 -0.10 0.82 1.06 0.00 0.00 176.91 179.50 2jc3 h ILE 49 N 1.16 1.52 -0.13 -1.22 2.04 -1.13 -2.73 117.51 117.01 2jc3 h ILE 49 Ca 0.30 -1.67 0.02 0.00 1.00 0.00 0.00 64.86 64.51 2jc3 h ILE 49 Cb -0.00 2.58 -0.02 0.00 -0.74 0.00 0.00 36.82 38.64 2jc3 h ILE 49 CO -0.05 0.45 0.01 0.58 0.00 0.00 0.00 178.15 179.13 2jc3 h VAL 50 N -0.54 0.92 -0.48 1.67 2.07 -0.54 -0.55 116.25 118.80 2jc3 h VAL 50 Ca -0.01 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 2jc3 h VAL 50 Cb 0.78 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2jc3 h VAL 50 CO 0.02 0.01 0.19 -0.33 0.02 0.00 0.00 177.57 177.48 2jc3 h GLU 51 N 0.06 0.68 -0.56 1.57 4.39 -1.25 -0.61 114.58 118.86 2jc3 h GLU 51 Ca 0.06 -0.09 -0.08 0.00 0.34 0.00 0.00 59.36 59.59 2jc3 h GLU 51 Cb 0.07 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.57 2jc3 h GLU 51 CO -0.10 0.57 0.04 0.00 -1.16 0.00 0.00 179.01 178.36 2jc3 h ALA 52 N 1.53 0.75 -0.69 3.43 0.00 -1.11 -2.58 119.26 120.59 2jc3 h ALA 52 Ca 0.17 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.81 2jc3 h ALA 52 Cb 0.14 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2jc3 h ALA 52 CO -0.02 0.54 0.45 0.93 0.00 0.00 0.00 179.25 181.15 2jc3 h GLU 53 N 0.85 0.87 0.00 0.00 5.08 -0.32 -1.16 114.58 119.90 2jc3 h GLU 53 Ca 0.16 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2jc3 h GLU 53 Cb 0.49 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2jc3 h GLU 53 CO 0.02 0.58 0.00 0.87 -1.00 0.00 0.00 179.01 179.48 2jc3 h LYS 54 N 0.90 0.00 -0.02 2.33 1.57 -0.79 -1.41 116.57 119.15 2jc3 h LYS 54 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2jc3 h LYS 54 Cb -0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.25 2jc3 h LYS 54 CO -0.07 0.00 -0.23 0.54 -0.57 0.00 0.00 179.45 179.12 2jc3 n ARG 55 N -3.00 1.54 -0.75 3.15 1.74 -0.47 -4.94 116.66 113.92 2jc3 n ARG 55 Ca -0.02 -1.18 0.00 0.00 -0.77 0.00 0.00 57.85 55.89 2jc3 n ARG 55 Cb 0.14 -1.48 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 1.35 0.93 0.23 -0.13 0.00 -0.53 -4.92 105.19 102.12 2jc3 n GLY 56 Ca 0.13 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.17 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 3.42 0.17 -3.97 1.61 5.08 -1.69 -3.45 114.58 115.74 2jc3 h GLU 57 Ca 0.00 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.22 2jc3 h GLU 57 Cb 0.00 -0.02 -0.15 0.00 0.50 0.00 0.00 28.75 29.08 2jc3 h GLU 57 CO 0.00 0.35 -0.50 0.96 -1.00 0.00 0.00 179.01 178.83 2jc3 s ILE 58 N -4.61 0.17 0.04 3.13 -4.36 -1.25 -5.02 121.20 109.30 2jc3 s ILE 58 Ca -0.05 -1.41 -0.17 0.00 -0.26 0.00 0.00 60.65 58.76 2jc3 s ILE 58 Cb 0.15 -1.38 0.03 0.00 1.25 0.00 0.00 42.46 42.51 2jc3 s ILE 58 CO 0.73 -0.78 0.38 -1.59 0.24 0.00 0.00 174.94 173.92 2jc3 s LYS 59 N -3.80 0.88 0.12 0.37 -2.85 -1.26 -4.39 119.74 108.80 2jc3 s LYS 59 Ca 0.05 -0.39 -0.34 0.00 -1.00 0.00 0.00 55.97 54.29 2jc3 s LYS 59 Cb 0.06 0.39 -0.18 0.00 -2.06 0.00 0.00 37.83 36.04 2jc3 s LYS 59 CO -0.10 -0.29 0.89 -2.30 0.10 0.00 0.00 175.35 173.65 2jc3 n PRO 60 N 0.57 0.28 0.00 1.78 -0.02 -1.26 -1.84 135.00 134.51 2jc3 n PRO 60 Ca -0.19 0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 2jc3 n PRO 60 Cb 0.59 -1.42 0.00 0.00 -0.02 0.00 0.00 33.50 32.66 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 1.80 1.81 3.65 -1.23 0.00 0.39 -4.98 105.19 106.62 2jc3 n GLY 61 Ca 0.18 -0.01 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 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 0.07 2.75 -0.07 1.61 -0.00 -0.76 -4.43 116.67 115.84 2jc3 s ASP 62 Ca 0.00 1.83 -0.14 0.00 -0.00 0.00 0.00 52.55 54.24 2jc3 s ASP 62 Cb 0.00 -2.41 -0.05 0.00 -0.00 0.00 0.00 42.92 40.46 2jc3 s ASP 62 CO 0.00 -3.14 0.36 -0.69 -0.00 0.00 0.00 175.17 171.69 2jc3 s VAL 63 N -2.70 5.18 -0.03 -1.27 1.01 -1.26 -1.07 120.40 120.26 2jc3 s VAL 63 Ca 0.66 0.71 0.06 0.00 0.00 0.00 0.00 61.98 63.40 2jc3 s VAL 63 Cb -0.22 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 2jc3 s VAL 63 CO 0.59 0.50 -0.18 -0.76 0.00 0.00 0.00 175.10 175.25 2jc3 s LEU 64 N -0.46 2.51 -0.01 3.92 1.02 0.17 -1.95 118.68 123.88 2jc3 s LEU 64 Ca 0.21 -0.32 0.04 0.00 0.02 0.00 0.00 54.13 54.09 2jc3 s LEU 64 Cb -0.15 -1.48 -0.01 0.00 0.02 0.00 0.00 46.19 44.57 2jc3 s LEU 64 CO 0.09 0.32 -0.14 -0.63 0.02 0.00 0.00 176.35 176.02 2jc3 s ILE 65 N -0.73 1.10 -0.26 -0.59 1.01 0.41 -0.23 121.20 121.92 2jc3 s ILE 65 Ca 0.12 -0.59 -0.25 0.00 0.00 0.00 0.00 60.65 59.92 2jc3 s ILE 65 Cb -0.10 -0.92 0.09 0.00 0.01 0.00 0.00 42.46 41.53 2jc3 s ILE 65 CO 0.01 0.31 0.81 -0.70 0.00 0.00 0.00 174.94 175.37 2jc3 s GLU 66 N -0.29 0.75 -0.31 2.79 2.56 -0.92 -1.60 118.70 121.68 2jc3 s GLU 66 Ca 0.05 0.83 -0.15 0.00 0.00 0.00 0.00 54.97 55.70 2jc3 s GLU 66 Cb -0.06 0.37 -0.02 0.00 2.00 0.00 0.00 34.13 36.41 2jc3 s GLU 66 CO -0.00 -0.10 0.34 0.00 -0.56 0.00 0.00 175.26 174.93 2jc3 s ALA 67 N 0.22 3.52 0.00 6.30 0.00 -1.26 -1.22 121.76 129.33 2jc3 s ALA 67 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 50.88 2jc3 s ALA 67 Cb -0.05 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 20.33 2jc3 s ALA 67 CO -0.01 -0.88 0.00 -2.37 0.00 0.00 0.00 175.76 172.50 2jc3 n THR 68 N 5.18 0.00 -1.77 0.00 5.66 -0.43 -4.90 114.28 118.02 2jc3 n THR 68 Ca -0.10 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.90 2jc3 n THR 68 Cb 0.50 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.28 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 -4.41 113.62 112.45 2jc3 n SER 69 Ca 0.00 -0.80 0.00 0.00 -0.26 0.00 0.00 58.87 57.81 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 1.91 0.27 5.00 0.00 -1.26 -4.81 105.19 106.30 2jc3 n GLY 70 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.61 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 0.47 -0.77 1.61 2.35 -1.99 -1.62 115.58 115.63 2jc3 h ASN 71 Ca 0.00 -0.08 -0.04 0.00 -0.55 0.00 0.00 56.30 55.63 2jc3 h ASN 71 Cb 0.00 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.21 2jc3 h ASN 71 CO 0.00 0.53 0.33 0.74 -1.65 0.00 0.00 177.43 177.38 2jc3 h THR 72 N 0.49 1.25 -0.22 2.81 2.02 -1.93 0.62 112.91 117.96 2jc3 h THR 72 Ca 0.11 -0.77 -0.04 0.00 0.77 0.00 0.00 66.41 66.49 2jc3 h THR 72 Cb 0.29 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.02 2jc3 h THR 72 CO 0.01 0.32 -0.01 1.23 0.37 0.00 0.00 175.52 177.44 2jc3 h GLY 73 N 1.10 0.42 1.00 2.16 0.00 -1.70 0.64 103.07 106.70 2jc3 h GLY 73 Ca 0.26 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2jc3 h GLY 73 CO -0.03 0.29 0.06 -2.22 0.00 0.00 0.00 176.54 174.64 2jc3 h ILE 74 N 0.15 1.02 -0.44 2.60 2.04 -1.01 0.73 117.51 122.60 2jc3 h ILE 74 Ca 0.06 -0.05 0.02 0.00 1.00 0.00 0.00 64.86 65.89 2jc3 h ILE 74 Cb 0.42 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 2jc3 h ILE 74 CO 0.01 0.02 0.27 0.00 0.00 0.00 0.00 178.15 178.46 2jc3 h ALA 75 N 1.03 0.56 -0.50 1.87 0.00 0.38 -0.98 119.26 121.62 2jc3 h ALA 75 Ca 0.03 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2jc3 h ALA 75 Cb -0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2jc3 h ALA 75 CO -0.01 -0.04 -0.01 -0.07 0.00 0.00 0.00 179.25 179.12 2jc3 h LEU 76 N 0.55 0.88 -0.87 0.00 3.38 -0.68 0.13 115.31 118.69 2jc3 h LEU 76 Ca 0.17 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.84 2jc3 h LEU 76 Cb -0.01 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.46 2jc3 h LEU 76 CO -0.07 0.98 0.58 0.00 0.09 0.00 0.00 178.44 180.01 2jc3 h ALA 77 N 0.93 1.11 0.09 1.53 0.00 -0.61 0.62 119.26 122.94 2jc3 h ALA 77 Ca 0.14 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2jc3 h ALA 77 Cb 0.54 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2jc3 h ALA 77 CO 0.03 0.49 -0.04 1.98 0.00 0.00 0.00 179.25 181.71 2jc3 h MET 78 N 1.16 -0.11 -0.56 0.00 1.85 -0.74 -0.27 114.93 116.26 2jc3 h MET 78 Ca 0.33 0.01 0.03 0.00 -0.61 0.00 0.00 59.70 59.46 2jc3 h MET 78 Cb -0.11 0.03 -0.03 0.00 0.43 0.00 0.00 31.60 31.92 2jc3 h MET 78 CO -0.08 0.15 0.37 0.82 -0.40 0.00 0.00 176.91 177.77 2jc3 h ILE 79 N -0.37 1.07 -0.21 1.77 1.08 -0.78 0.19 117.51 120.26 2jc3 h ILE 79 Ca -0.01 -0.22 -0.04 0.00 -0.39 0.00 0.00 64.86 64.20 2jc3 h ILE 79 Cb 0.31 0.37 -0.01 0.00 -3.07 0.00 0.00 36.82 34.42 2jc3 h ILE 79 CO 0.02 0.12 -0.01 0.00 -0.69 0.00 0.00 178.15 177.59 2jc3 h ALA 80 N 1.68 0.28 -0.62 1.87 0.00 -0.55 0.16 119.26 122.08 2jc3 h ALA 80 Ca 0.22 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 2jc3 h ALA 80 Cb 0.09 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2jc3 h ALA 80 CO -0.06 0.01 0.16 0.00 0.00 0.00 0.00 179.25 179.37 2jc3 h ALA 81 N 0.78 0.81 -0.04 0.00 0.00 -0.39 0.20 119.26 120.62 2jc3 h ALA 81 Ca 0.06 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2jc3 h ALA 81 Cb 0.41 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2jc3 h ALA 81 CO 0.01 0.51 0.02 1.25 0.00 0.00 0.00 179.25 181.04 2jc3 h LEU 82 N 0.90 0.06 -0.55 0.00 5.85 -0.48 -3.29 115.31 117.80 2jc3 h LEU 82 Ca 0.20 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2jc3 h LEU 82 Cb 0.33 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.35 2jc3 h LEU 82 CO -0.00 0.23 -0.28 0.29 -0.34 0.00 0.00 178.44 178.34 2jc3 n LYS 83 N -4.96 0.88 -1.38 1.25 5.02 0.53 -5.00 118.16 114.51 2jc3 n LYS 83 Ca -0.07 -0.55 0.00 0.00 -2.02 0.00 0.00 58.31 55.68 2jc3 n LYS 83 Cb 0.12 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 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 1.35 1.00 3.67 0.72 0.00 0.52 -4.75 105.19 107.69 2jc3 n GLY 84 Ca 0.12 -0.44 -0.23 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.39 2.76 -0.32 1.61 2.02 -0.15 -0.47 117.35 120.41 2jc3 s TYR 85 Ca 0.00 -0.21 -0.13 0.00 -0.37 0.00 0.00 57.07 56.36 2jc3 s TYR 85 Cb 0.00 -1.23 -0.03 0.00 -0.40 0.00 0.00 41.96 40.30 2jc3 s TYR 85 CO 0.00 0.60 0.27 1.03 -1.57 0.00 0.00 175.55 175.88 2jc3 s ARG 86 N -3.70 3.65 -0.17 -0.62 0.52 -0.23 -4.48 118.95 113.92 2jc3 s ARG 86 Ca 0.32 -0.47 -0.08 0.00 -0.52 0.00 0.00 55.73 54.98 2jc3 s ARG 86 Cb -0.07 -3.76 -0.04 0.00 0.52 0.00 0.00 34.95 31.60 2jc3 s ARG 86 CO 0.21 -0.39 0.10 1.41 0.02 0.00 0.00 175.30 176.65 2jc3 s MET 87 N 1.82 3.85 -0.20 3.54 1.75 -1.26 0.41 119.30 129.21 2jc3 s MET 87 Ca 0.08 -0.25 0.01 0.00 -1.25 0.00 0.00 55.69 54.28 2jc3 s MET 87 Cb -0.17 -3.25 0.03 0.00 2.84 0.00 0.00 34.83 34.28 2jc3 s MET 87 CO 0.11 0.44 -0.17 0.15 -0.65 0.00 0.00 175.02 174.90 2jc3 s LYS 88 N -0.08 2.85 -0.17 4.11 1.02 0.69 -0.42 119.74 127.75 2jc3 s LYS 88 Ca 0.09 -0.93 -0.02 0.00 0.02 0.00 0.00 55.97 55.13 2jc3 s LYS 88 Cb -0.12 -2.67 -0.01 0.00 -0.52 0.00 0.00 37.83 34.52 2jc3 s LYS 88 CO 0.00 -0.29 -0.10 -0.51 -0.92 0.00 0.00 175.35 173.53 2jc3 s LEU 89 N 1.26 2.75 -0.19 3.17 1.43 0.69 -2.17 118.68 125.62 2jc3 s LEU 89 Ca 0.02 -0.37 -0.08 0.00 -1.03 0.00 0.00 54.13 52.67 2jc3 s LEU 89 Cb -0.15 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.38 2jc3 s LEU 89 CO -0.11 0.08 0.08 -0.76 0.23 0.00 0.00 176.35 175.87 2jc3 s LEU 90 N 0.84 3.89 0.08 1.79 1.02 -0.35 -0.30 118.68 125.66 2jc3 s LEU 90 Ca -0.03 0.11 -0.24 0.00 0.02 0.00 0.00 54.13 53.98 2jc3 s LEU 90 Cb -0.15 -1.99 0.06 0.00 0.02 0.00 0.00 46.19 44.13 2jc3 s LEU 90 CO 0.01 0.17 0.59 0.00 0.02 0.00 0.00 176.35 177.14 2jc3 s MET 91 N 0.38 1.16 0.52 1.70 0.23 -1.11 -1.32 119.30 120.87 2jc3 s MET 91 Ca 0.04 -0.26 -0.21 0.00 -1.03 0.00 0.00 55.69 54.23 2jc3 s MET 91 Cb -0.12 0.53 -0.06 0.00 -1.53 0.00 0.00 34.83 33.66 2jc3 s MET 91 CO -0.00 -0.45 1.24 -1.25 -2.03 0.00 0.00 175.02 172.52 2jc3 s PRO 92 N -2.86 3.35 0.00 3.16 0.04 -1.26 -1.82 135.00 135.61 2jc3 s PRO 92 Ca -0.03 1.94 0.00 0.00 0.04 0.00 0.00 61.00 62.94 2jc3 s PRO 92 Cb -0.01 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2jc3 s PRO 92 CO -0.05 -0.94 0.24 -0.40 0.04 0.00 0.00 177.00 175.90 2jc3 n ASP 93 N -0.96 0.44 -1.88 6.66 3.85 0.08 -3.59 116.55 121.14 2jc3 n ASP 93 Ca 0.10 -0.93 -0.22 0.00 -0.71 0.00 0.00 54.79 53.03 2jc3 n ASP 93 Cb 0.47 -0.22 0.10 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 0.23 4.96 -4.77 -1.12 0.23 -1.26 -4.93 115.26 108.60 2jc3 n ASN 94 Ca 0.00 -3.77 -0.38 0.00 -0.53 0.00 0.00 54.58 49.90 2jc3 n ASN 94 Cb 0.11 -0.66 -0.06 0.00 -2.08 0.00 0.00 39.78 37.09 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 -3.55 4.20 1.12 -3.83 -1.94 -1.24 -5.06 119.30 109.00 2jc3 s MET 95 Ca 0.54 0.53 -0.14 0.00 -1.71 0.00 0.00 55.69 54.91 2jc3 s MET 95 Cb 0.45 -3.33 0.21 0.00 2.01 0.00 0.00 34.83 34.16 2jc3 s MET 95 CO 0.02 0.42 0.71 -1.13 -0.01 0.00 0.00 175.02 175.02 2jc3 n SER 96 N 2.69 -1.71 -0.00 3.03 3.41 -1.26 -4.79 113.62 114.99 2jc3 n SER 96 Ca -0.09 -0.05 -0.13 0.00 -0.26 0.00 0.00 58.87 58.34 2jc3 n SER 96 Cb 0.52 -1.20 -0.10 0.00 -0.26 0.00 0.00 64.21 63.17 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 -2.35 -0.05 -0.94 4.33 1.08 -1.99 -2.65 115.11 112.53 2jc3 h GLN 97 Ca -0.56 0.00 0.18 0.00 -1.45 0.00 0.00 58.65 56.82 2jc3 h GLN 97 Cb 1.33 0.01 -0.10 0.00 -0.05 0.00 0.00 27.48 28.67 2jc3 h GLN 97 CO 0.44 0.48 0.53 0.93 -0.95 0.00 0.00 178.83 180.26 2jc3 h GLU 98 N -0.61 0.66 -0.56 1.46 5.08 -1.98 0.68 114.58 119.31 2jc3 h GLU 98 Ca -0.01 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 2jc3 h GLU 98 Cb 0.55 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 2jc3 h GLU 98 CO 0.01 0.44 0.11 -0.09 -1.00 0.00 0.00 179.01 178.48 2jc3 h ARG 99 N 0.68 0.88 0.00 2.33 2.43 -1.89 -1.66 114.38 117.14 2jc3 h ARG 99 Ca 0.54 -0.19 -0.07 0.00 -0.81 0.00 0.00 59.98 59.44 2jc3 h ARG 99 Cb 0.83 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.25 2jc3 h ARG 99 CO -0.39 0.80 -0.81 0.07 -1.51 0.00 0.00 179.97 178.13 2jc3 h ARG 100 N 0.84 0.00 -0.52 0.20 0.11 -0.67 -3.28 114.38 111.05 2jc3 h ARG 100 Ca 0.18 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 60.20 2jc3 h ARG 100 Cb 0.34 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.39 2jc3 h ARG 100 CO 0.00 0.20 0.09 0.00 0.10 0.00 0.00 179.97 180.36 2jc3 h ALA 101 N 1.72 1.19 -0.31 0.08 0.00 0.83 0.53 119.26 123.30 2jc3 h ALA 101 Ca -0.05 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.67 2jc3 h ALA 101 Cb 1.25 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 2jc3 h ALA 101 CO 0.03 0.55 0.21 0.00 0.00 0.00 0.00 179.25 180.03 2jc3 h ALA 102 N 1.32 1.89 0.12 0.00 0.00 -1.38 -0.47 119.26 120.74 2jc3 h ALA 102 Ca 0.16 -0.02 -0.36 0.00 0.00 0.00 0.00 54.91 54.70 2jc3 h ALA 102 Cb 0.34 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2jc3 h ALA 102 CO 0.00 0.08 -1.93 0.52 0.00 0.00 0.00 179.25 177.93 2jc3 h MET 103 N 0.33 0.26 -0.25 0.00 2.86 -1.54 -3.37 114.93 113.21 2jc3 h MET 103 Ca 0.12 -0.44 -0.07 0.00 -2.06 0.00 0.00 59.70 57.26 2jc3 h MET 103 Cb 0.09 0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 2jc3 h MET 103 CO -0.03 1.16 -0.14 0.00 1.06 0.00 0.00 176.91 178.96 2jc3 h ARG 104 N 0.07 0.41 -1.00 1.72 3.08 -0.71 -2.88 114.38 115.07 2jc3 h ARG 104 Ca -0.40 -0.12 0.23 0.00 0.07 0.00 0.00 59.98 59.77 2jc3 h ARG 104 Cb 2.04 -0.05 -0.10 0.00 0.08 0.00 0.00 29.97 31.95 2jc3 h ARG 104 CO 0.10 0.56 0.63 0.00 -1.07 0.00 0.00 179.97 180.19 2jc3 h ALA 105 N 1.47 2.00 -0.04 0.04 0.00 -1.25 0.88 119.26 122.37 2jc3 h ALA 105 Ca 0.07 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2jc3 h ALA 105 Cb 0.48 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2jc3 h ALA 105 CO 0.03 -0.39 0.00 0.66 0.00 0.00 0.00 179.25 179.55 2jc3 n TYR 106 N -4.68 0.05 -0.99 0.00 4.02 -1.09 -4.89 117.16 109.57 2jc3 n TYR 106 Ca 0.24 -0.02 0.00 0.00 -0.01 0.00 0.00 57.90 58.11 2jc3 n TYR 106 Cb 0.74 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.06 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 0.77 0.41 3.82 2.72 0.00 0.31 -4.55 105.19 108.66 2jc3 n GLY 107 Ca 0.11 -0.87 -0.33 0.00 0.00 0.00 0.00 46.02 44.92 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 2.91 -0.29 4.61 0.00 -1.22 -4.79 121.76 120.98 2jc3 s ALA 108 Ca 0.00 0.38 -0.17 0.00 0.00 0.00 0.00 51.96 52.17 2jc3 s ALA 108 Cb 0.00 -3.19 -0.03 0.00 0.00 0.00 0.00 23.12 19.90 2jc3 s ALA 108 CO 0.00 -0.39 0.45 -2.00 0.00 0.00 0.00 175.76 173.82 2jc3 s GLU 109 N -3.75 3.94 -0.29 0.00 2.12 0.44 -4.61 118.70 116.54 2jc3 s GLU 109 Ca 0.63 0.09 -0.15 0.00 0.36 0.00 0.00 54.97 55.89 2jc3 s GLU 109 Cb -0.13 -3.69 -0.03 0.00 0.26 0.00 0.00 34.13 30.54 2jc3 s GLU 109 CO 0.28 -0.39 0.37 -0.51 -0.54 0.00 0.00 175.26 174.47 2jc3 s LEU 110 N 2.22 4.13 -0.38 2.70 1.43 -1.26 -0.23 118.68 127.30 2jc3 s LEU 110 Ca 0.18 0.15 -0.09 0.00 -1.03 0.00 0.00 54.13 53.34 2jc3 s LEU 110 Cb -0.16 -2.40 0.05 0.00 0.03 0.00 0.00 46.19 43.71 2jc3 s LEU 110 CO 0.10 -0.23 0.19 -0.63 0.23 0.00 0.00 176.35 176.02 2jc3 s ILE 111 N 2.07 4.19 0.15 -0.59 1.01 0.60 -4.95 121.20 123.67 2jc3 s ILE 111 Ca 0.14 -1.14 -0.24 0.00 0.00 0.00 0.00 60.65 59.41 2jc3 s ILE 111 Cb -0.16 -3.43 -0.08 0.00 0.01 0.00 0.00 42.46 38.80 2jc3 s ILE 111 CO 0.11 -0.31 0.75 -0.76 0.00 0.00 0.00 174.94 174.72 2jc3 s LEU 112 N 1.46 4.58 0.54 2.97 1.43 -1.26 -2.73 118.68 125.66 2jc3 s LEU 112 Ca 0.01 1.59 0.04 0.00 -1.03 0.00 0.00 54.13 54.74 2jc3 s LEU 112 Cb -0.21 -3.24 0.02 0.00 0.03 0.00 0.00 46.19 42.80 2jc3 s LEU 112 CO 0.04 0.21 0.26 0.68 0.23 0.00 0.00 176.35 177.77 2jc3 s VAL 113 N -1.11 1.45 0.46 -1.59 -7.23 -0.75 -4.90 120.40 106.73 2jc3 s VAL 113 Ca 0.35 -1.67 -0.19 0.00 -1.81 0.00 0.00 61.98 58.65 2jc3 s VAL 113 Cb -0.23 -2.13 -0.10 0.00 0.56 0.00 0.00 36.38 34.49 2jc3 s VAL 113 CO 0.25 0.00 0.96 0.42 -0.31 0.00 0.00 175.10 176.42 2jc3 s THR 114 N -2.82 4.45 0.30 5.32 -4.23 -1.26 -0.75 115.64 116.66 2jc3 s THR 114 Ca 0.23 1.37 0.05 0.00 -1.18 0.00 0.00 61.69 62.16 2jc3 s THR 114 Cb -0.01 -3.65 0.30 0.00 1.34 0.00 0.00 72.50 70.48 2jc3 s THR 114 CO 0.14 -0.46 1.68 0.50 -0.54 0.00 0.00 174.62 175.94 2jc3 h LYS 115 N 1.52 0.33 0.01 3.99 3.64 -1.91 0.11 116.57 124.26 2jc3 h LYS 115 Ca -0.48 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 58.88 2jc3 h LYS 115 Cb 1.18 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 2jc3 h LYS 115 CO 0.61 0.22 -0.00 0.93 -2.27 0.00 0.00 179.45 178.93 2jc3 h GLU 116 N 0.34 -0.01 -0.01 1.90 3.07 -2.02 -0.54 114.58 117.31 2jc3 h GLU 116 Ca 0.58 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.44 2jc3 h GLU 116 Cb 1.15 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.06 2jc3 h GLU 116 CO -0.57 0.03 0.01 1.96 -1.40 0.00 0.00 179.01 179.03 2jc3 h GLN 117 N -0.05 0.00 0.00 2.33 4.20 -1.40 -3.47 115.11 116.72 2jc3 h GLN 117 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2jc3 h GLN 117 Cb 0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.82 2jc3 h GLN 117 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 2jc3 n GLY 118 N -1.50 -0.43 0.38 3.46 0.00 0.20 0.10 105.19 107.40 2jc3 n GLY 118 Ca -0.03 -0.53 0.14 0.00 0.00 0.00 0.00 46.02 45.61 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 0.58 -0.10 1.61 2.86 -1.89 -0.06 114.93 117.93 2jc3 h MET 119 Ca 0.00 -0.04 -0.14 0.00 -2.06 0.00 0.00 59.70 57.46 2jc3 h MET 119 Cb 0.00 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.52 2jc3 h MET 119 CO 0.00 0.39 -0.57 1.49 1.06 0.00 0.00 176.91 179.28 2jc3 h GLU 120 N 0.60 0.31 -0.40 1.72 4.57 -1.96 -0.79 114.58 118.63 2jc3 h GLU 120 Ca 0.46 -0.20 -0.04 0.00 -1.18 0.00 0.00 59.36 58.40 2jc3 h GLU 120 Cb 0.87 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.47 2jc3 h GLU 120 CO -0.21 0.79 0.11 0.78 -1.18 0.00 0.00 179.01 179.30 2jc3 h GLY 121 N 1.35 0.69 0.97 1.92 0.00 0.15 -1.71 103.07 106.44 2jc3 h GLY 121 Ca 0.00 -0.43 0.01 0.00 0.00 0.00 0.00 47.33 46.91 2jc3 h GLY 121 CO 0.09 0.40 0.21 0.00 0.00 0.00 0.00 176.54 177.24 2jc3 h ALA 122 N 0.96 0.42 -0.46 3.60 0.00 -1.08 -0.67 119.26 122.03 2jc3 h ALA 122 Ca 0.13 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.09 2jc3 h ALA 122 Cb 0.30 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 2jc3 h ALA 122 CO -0.00 -0.13 0.13 0.00 0.00 0.00 0.00 179.25 179.24 2jc3 h ARG 123 N 0.43 0.27 0.18 0.00 2.47 -0.92 -0.37 114.38 116.44 2jc3 h ARG 123 Ca 0.13 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.82 2jc3 h ARG 123 Cb -0.03 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.23 2jc3 h ARG 123 CO -0.04 0.18 -0.09 -0.44 0.56 0.00 0.00 179.97 180.14 2jc3 h ASP 124 N 0.28 -0.21 -0.51 7.04 3.45 -0.89 -1.51 116.42 124.07 2jc3 h ASP 124 Ca 0.22 -0.02 0.02 0.00 0.43 0.00 0.00 57.03 57.69 2jc3 h ASP 124 Cb 0.26 0.05 -0.03 0.00 -0.56 0.00 0.00 39.33 39.05 2jc3 h ASP 124 CO -0.26 -0.12 0.30 0.25 -1.57 0.00 0.00 179.24 177.83 2jc3 h LEU 125 N -0.28 0.48 -0.75 1.55 5.85 -0.90 0.21 115.31 121.48 2jc3 h LEU 125 Ca -0.03 0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.79 2jc3 h LEU 125 Cb 0.21 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.08 2jc3 h LEU 125 CO 0.04 0.34 0.41 0.00 -0.34 0.00 0.00 178.44 178.89 2jc3 h ALA 126 N 1.23 1.04 -0.48 1.25 0.00 -0.96 0.07 119.26 121.42 2jc3 h ALA 126 Ca 0.21 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 2jc3 h ALA 126 Cb 0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2jc3 h ALA 126 CO -0.10 0.04 -0.13 1.25 0.00 0.00 0.00 179.25 180.31 2jc3 h LEU 127 N 0.70 0.89 -0.29 0.00 5.85 -0.27 -2.24 115.31 119.95 2jc3 h LEU 127 Ca 0.36 -0.29 0.05 0.00 0.84 0.00 0.00 57.88 58.83 2jc3 h LEU 127 Cb 0.32 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 2jc3 h LEU 127 CO -0.24 1.03 0.02 0.00 -0.34 0.00 0.00 178.44 178.91 2jc3 h ALA 128 N 1.05 0.27 -0.58 1.25 0.00 0.62 -2.08 119.26 119.80 2jc3 h ALA 128 Ca 0.12 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2jc3 h ALA 128 Cb 0.66 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2jc3 h ALA 128 CO 0.05 -0.39 0.36 0.52 0.00 0.00 0.00 179.25 179.78 2jc3 h MET 129 N 0.11 0.78 -0.29 0.00 2.86 -0.80 -1.27 114.93 116.32 2jc3 h MET 129 Ca 0.14 -0.07 -0.07 0.00 -2.06 0.00 0.00 59.70 57.64 2jc3 h MET 129 Cb 0.17 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 2jc3 h MET 129 CO -0.21 0.55 -0.12 0.66 1.06 0.00 0.00 176.91 178.86 2jc3 h SER 130 N 0.78 0.47 0.67 1.22 4.64 -1.05 -0.14 113.55 120.14 2jc3 h SER 130 Ca 0.21 -0.12 -0.14 0.00 -0.47 0.00 0.00 61.79 61.27 2jc3 h SER 130 Cb -0.04 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 61.91 2jc3 h SER 130 CO -0.04 0.62 -0.68 -0.33 -0.87 0.00 0.00 176.83 175.53 2jc3 h GLU 131 N 0.45 0.00 0.00 4.77 5.08 -1.05 -2.85 114.58 120.98 2jc3 h GLU 131 Ca 0.08 -0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.33 2jc3 h GLU 131 Cb 0.48 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 2jc3 h GLU 131 CO 0.03 0.68 -0.54 0.00 -1.00 0.00 0.00 179.01 178.18 2jc3 h ARG 132 N 0.00 0.00 0.00 2.33 3.08 -0.80 -3.48 114.38 115.52 2jc3 h ARG 132 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2jc3 h ARG 132 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.25 2jc3 h ARG 132 CO 0.09 0.54 0.00 0.41 -1.07 0.00 0.00 179.97 179.94 2jc3 n GLY 133 N 0.72 1.34 0.10 0.04 0.00 -0.25 -5.00 105.19 102.13 2jc3 n GLY 133 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.18 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 -1.57 0.97 0.00 1.61 1.02 -0.23 -4.96 120.64 117.48 2jc3 n GLU 134 Ca 0.00 -0.19 0.00 0.00 -0.02 0.00 0.00 57.16 56.95 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 1.12 3.42 3.68 0.62 0.00 -1.26 -4.80 105.19 107.97 2jc3 n GLY 135 Ca 0.20 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.15 4.33 0.01 1.61 2.47 -0.82 -4.14 119.74 121.05 2jc3 s LYS 136 Ca 0.00 1.71 -0.22 0.00 -1.56 0.00 0.00 55.97 55.91 2jc3 s LYS 136 Cb 0.00 -3.59 -0.05 0.00 -1.46 0.00 0.00 37.83 32.73 2jc3 s LYS 136 CO 0.00 -0.50 0.64 -1.17 0.16 0.00 0.00 175.35 174.48 2jc3 s LEU 137 N 2.40 4.43 -0.09 5.43 2.96 -1.26 -0.44 118.68 132.11 2jc3 s LEU 137 Ca 0.57 1.24 -0.07 0.00 -0.22 0.00 0.00 54.13 55.65 2jc3 s LEU 137 Cb -0.25 -3.00 -0.28 0.00 0.50 0.00 0.00 46.19 43.16 2jc3 s LEU 137 CO 0.22 0.09 0.50 -0.07 -1.32 0.00 0.00 176.35 175.76 2jc3 h LEU 138 N 5.60 0.47 -3.03 -0.68 3.38 -1.69 -3.48 115.31 115.88 2jc3 h LEU 138 Ca -0.45 -0.90 -0.23 0.00 0.09 0.00 0.00 57.88 56.39 2jc3 h LEU 138 Cb 1.20 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.81 2jc3 h LEU 138 CO 0.70 1.79 -0.88 -0.67 0.09 0.00 0.00 178.44 179.47 2jc3 n ASP 139 N -3.50 -6.51 0.24 -0.43 4.64 -1.26 -4.44 116.55 105.29 2jc3 n ASP 139 Ca -0.28 0.06 0.13 0.00 -1.38 0.00 0.00 54.79 53.31 2jc3 n ASP 139 Cb 1.06 -3.26 0.77 0.00 -1.04 0.00 0.00 41.12 38.65 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 1.82 0.00 0.00 -0.67 3.07 -1.95 -0.31 115.11 117.07 2jc3 h GLN 140 Ca -0.33 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.41 2jc3 h GLN 140 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.80 2jc3 h GLN 140 CO 0.23 0.00 0.00 0.74 0.09 0.00 0.00 178.83 179.89 2jc3 h PHE 141 N 0.00 0.00 0.00 0.06 0.04 -1.92 -3.37 116.94 111.75 2jc3 h PHE 141 Ca 0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.81 2jc3 h PHE 141 Cb 0.17 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.32 2jc3 h PHE 141 CO 0.00 0.00 -0.81 0.09 -0.60 0.00 0.00 178.31 176.99 2jc3 n ASN 142 N -2.88 4.07 -4.59 2.17 3.02 -0.96 -1.79 115.26 114.29 2jc3 n ASN 142 Ca 0.04 -0.05 -0.42 0.00 -0.03 0.00 0.00 54.58 54.12 2jc3 n ASN 142 Cb 0.49 0.92 -0.03 0.00 -0.61 0.00 0.00 39.78 40.55 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 -1.73 5.65 0.26 6.41 3.84 -0.17 -4.57 114.94 124.63 2jc3 s ASN 143 Ca 0.00 1.34 0.17 0.00 0.21 0.00 0.00 52.86 54.57 2jc3 s ASN 143 Cb 0.00 -2.52 0.90 0.00 -0.55 0.00 0.00 41.25 39.08 2jc3 s ASN 143 CO 0.00 -1.89 1.49 -2.65 -2.79 0.00 0.00 177.10 171.26 2jc3 n PRO 144 N 8.60 0.11 0.20 0.43 -0.02 -1.26 -1.22 135.00 141.84 2jc3 n PRO 144 Ca 0.25 0.60 0.14 0.00 -2.02 0.00 0.00 63.50 62.47 2jc3 n PRO 144 Cb 0.47 -1.89 0.52 0.00 -0.02 0.00 0.00 33.50 32.58 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 0.17 2.55 3.45 -1.93 -2.22 116.42 118.45 2jc3 h ASP 145 Ca 0.00 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.45 2jc3 h ASP 145 Cb 0.08 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.85 2jc3 h ASP 145 CO 0.00 0.00 -0.08 -1.13 -1.57 0.00 0.00 179.24 176.46 2jc3 h ASN 146 N 0.00 -0.20 0.07 6.45 -0.73 -1.45 -2.66 115.58 117.07 2jc3 h ASN 146 Ca 0.00 0.01 -0.01 0.00 1.87 0.00 0.00 56.30 58.17 2jc3 h ASN 146 Cb 0.56 0.05 -0.00 0.00 0.27 0.00 0.00 38.32 39.20 2jc3 h ASN 146 CO 0.00 -0.12 -0.03 1.55 -0.37 0.00 0.00 177.43 178.45 2jc3 h PRO 147 N -0.27 0.00 -1.00 6.67 0.13 -1.73 -1.60 132.00 134.21 2jc3 h PRO 147 Ca -0.02 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 65.24 2jc3 h PRO 147 Cb 0.18 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.22 2jc3 h PRO 147 CO 0.04 0.03 0.63 -0.92 -0.23 0.00 0.00 178.00 177.55 2jc3 h TYR 148 N 0.00 1.12 -0.84 1.56 3.20 -1.28 0.19 116.97 120.93 2jc3 h TYR 148 Ca -0.00 0.03 0.07 0.00 3.14 0.00 0.00 58.73 61.97 2jc3 h TYR 148 Cb 0.08 -0.35 -0.06 0.00 1.54 0.00 0.00 36.73 37.93 2jc3 h TYR 148 CO 0.00 0.41 0.51 0.00 -1.64 0.00 0.00 178.16 177.44 2jc3 h ALA 149 N 1.56 1.16 0.00 1.82 0.00 -0.93 -0.79 119.26 122.08 2jc3 h ALA 149 Ca 0.51 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.38 2jc3 h ALA 149 Cb 0.57 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2jc3 h ALA 149 CO -0.28 0.23 -0.26 0.45 0.00 0.00 0.00 179.25 179.38 2jc3 h HIS 150 N 0.92 0.00 -0.03 0.00 3.86 -1.03 0.26 115.15 119.13 2jc3 h HIS 150 Ca 0.37 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.41 2jc3 h HIS 150 Cb 0.20 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.66 2jc3 h HIS 150 CO -0.04 0.17 -0.74 -0.92 0.86 0.00 0.00 177.93 177.26 2jc3 h TYR 151 N 0.00 0.30 0.00 2.45 3.20 -0.01 0.12 116.97 123.03 2jc3 h TYR 151 Ca -0.01 -0.14 -0.08 0.00 3.14 0.00 0.00 58.73 61.65 2jc3 h TYR 151 Cb 1.14 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 39.35 2jc3 h TYR 151 CO 0.00 0.88 -1.99 0.25 -1.64 0.00 0.00 178.16 175.66 2jc3 n THR 152 N -3.77 0.35 0.01 1.81 -2.24 -0.37 -4.48 114.28 105.59 2jc3 n THR 152 Ca -0.03 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 2jc3 n THR 152 Cb 0.71 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 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 -2.40 0.23 -0.11 4.28 -2.24 0.07 -4.69 114.28 109.42 2jc3 n THR 153 Ca -0.09 0.07 -0.09 0.00 -2.27 0.00 0.00 64.05 61.67 2jc3 n THR 153 Cb 0.69 -1.09 -0.03 0.00 -2.10 0.00 0.00 70.33 67.79 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 0.00 0.17 0.04 4.28 2.02 -1.62 0.45 112.91 118.26 2jc3 h THR 154 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 2jc3 h THR 154 Cb 0.00 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.58 2jc3 h THR 154 CO 0.00 0.00 -0.02 1.23 0.37 0.00 0.00 175.52 177.10 2jc3 h GLY 155 N -0.31 -0.06 0.79 2.16 0.00 -1.03 -1.17 103.07 103.45 2jc3 h GLY 155 Ca 0.15 0.02 0.05 0.00 0.00 0.00 0.00 47.33 47.55 2jc3 h GLY 155 CO -0.54 -0.02 0.57 -2.55 0.00 0.00 0.00 176.54 174.00 2jc3 h PRO 156 N -0.11 1.03 -0.01 4.80 0.11 -1.73 -0.72 132.00 135.37 2jc3 h PRO 156 Ca -0.01 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 66.06 2jc3 h PRO 156 Cb 0.10 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 30.95 2jc3 h PRO 156 CO 0.01 0.68 -0.09 0.93 -0.21 0.00 0.00 178.00 179.33 2jc3 h GLU 157 N 1.06 -0.14 -0.90 1.05 5.08 -0.59 0.07 114.58 120.21 2jc3 h GLU 157 Ca 0.37 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.79 2jc3 h GLU 157 Cb 0.10 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.32 2jc3 h GLU 157 CO -0.15 -0.09 0.58 0.82 -1.00 0.00 0.00 179.01 179.17 2jc3 h ILE 158 N -0.14 1.11 -0.51 3.13 2.04 -0.82 0.56 117.51 122.89 2jc3 h ILE 158 Ca 0.04 -0.38 -0.10 0.00 1.00 0.00 0.00 64.86 65.43 2jc3 h ILE 158 Cb 0.19 -0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.18 2jc3 h ILE 158 CO -0.10 0.20 -0.06 -0.25 0.00 0.00 0.00 178.15 177.94 2jc3 h TRP 159 N 1.09 1.04 -0.27 1.37 2.91 -0.71 -1.51 115.95 119.87 2jc3 h TRP 159 Ca 0.37 -0.20 -0.10 0.00 1.13 0.00 0.00 58.89 60.09 2jc3 h TRP 159 Cb 0.07 -0.26 -0.00 0.00 -0.51 0.00 0.00 29.16 28.46 2jc3 h TRP 159 CO -0.02 0.98 -0.23 -0.09 -1.03 0.00 0.00 178.44 178.05 2jc3 h ARG 160 N 0.80 0.62 -0.23 2.65 2.43 -0.33 -0.85 114.38 119.47 2jc3 h ARG 160 Ca 0.14 -0.31 -0.07 0.00 -0.81 0.00 0.00 59.98 58.92 2jc3 h ARG 160 Cb 0.61 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 2jc3 h ARG 160 CO 0.04 0.91 -0.18 1.96 -1.51 0.00 0.00 179.97 181.19 2jc3 h GLN 161 N 0.35 0.41 -0.61 0.20 4.20 0.22 -2.36 115.11 117.52 2jc3 h GLN 161 Ca 0.05 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.63 2jc3 h GLN 161 Cb 0.78 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.52 2jc3 h GLN 161 CO 0.06 0.58 0.00 0.25 -0.67 0.00 0.00 178.83 179.04 2jc3 n THR 162 N -4.18 1.21 -4.26 -0.54 -2.24 -0.58 -4.91 114.28 98.77 2jc3 n THR 162 Ca -0.00 -0.87 -0.35 0.00 -2.27 0.00 0.00 64.05 60.56 2jc3 n THR 162 Cb 0.34 0.16 -0.05 0.00 -2.10 0.00 0.00 70.33 68.68 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 0.97 -1.78 0.00 3.42 7.64 -0.89 0.62 113.62 123.60 2jc3 n SER 163 Ca 0.20 -1.11 0.00 0.00 1.01 0.00 0.00 58.87 58.97 2jc3 n SER 163 Cb 0.65 -2.37 0.00 0.00 -1.01 0.00 0.00 64.21 61.48 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 -1.61 0.18 0.17 0.23 0.00 -0.35 -4.84 105.19 98.97 2jc3 n GLY 164 Ca -0.05 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.10 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 0.40 0.00 -6.41 1.61 3.08 -0.11 -3.47 114.38 109.49 2jc3 h ARG 165 Ca 0.00 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.42 2jc3 h ARG 165 Cb 0.60 0.00 0.07 0.00 0.08 0.00 0.00 29.97 30.72 2jc3 h ARG 165 CO 0.00 0.00 0.47 1.51 -1.07 0.00 0.00 179.97 180.88 2jc3 n ILE 166 N -2.76 0.57 -0.01 2.04 3.06 -1.26 -4.68 119.36 116.32 2jc3 n ILE 166 Ca 0.05 -0.14 0.01 0.00 -2.50 0.00 0.00 62.75 60.16 2jc3 n ILE 166 Cb 0.49 -1.10 -0.03 0.00 0.54 0.00 0.00 39.64 39.55 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 2.11 0.06 -3.85 9.51 -2.24 -0.45 -4.86 114.28 114.56 2jc3 n THR 167 Ca 0.15 -0.10 -0.12 0.00 -2.27 0.00 0.00 64.05 61.71 2jc3 n THR 167 Cb 0.26 0.05 -0.13 0.00 -2.10 0.00 0.00 70.33 68.40 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 -2.20 -0.08 -0.08 4.78 3.76 -1.11 -1.21 115.29 119.15 2jc3 s HIS 168 Ca -0.01 0.19 0.03 0.00 -0.15 0.00 0.00 55.06 55.12 2jc3 s HIS 168 Cb 0.02 0.02 0.00 0.00 1.11 0.00 0.00 32.58 33.73 2jc3 s HIS 168 CO 0.15 -0.06 -0.19 0.12 -0.85 0.00 0.00 174.74 173.90 2jc3 s PHE 169 N -0.07 2.08 -0.10 1.40 5.36 -0.37 -1.40 117.98 124.87 2jc3 s PHE 169 Ca -0.01 -0.80 0.03 0.00 -0.96 0.00 0.00 56.93 55.18 2jc3 s PHE 169 Cb -0.01 -1.42 0.01 0.00 -0.34 0.00 0.00 43.02 41.25 2jc3 s PHE 169 CO 0.00 -0.34 -0.19 0.08 -1.46 0.00 0.00 175.22 173.32 2jc3 s VAL 170 N 0.42 1.72 -0.05 3.12 1.01 0.73 -0.22 120.40 127.12 2jc3 s VAL 170 Ca -0.16 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.01 2jc3 s VAL 170 Cb -0.17 -1.53 0.03 0.00 0.00 0.00 0.00 36.38 34.72 2jc3 s VAL 170 CO 0.06 0.48 0.10 -0.55 0.00 0.00 0.00 175.10 175.20 2jc3 s SER 171 N 0.70 -0.06 0.03 3.32 0.15 -0.72 -2.38 113.70 114.76 2jc3 s SER 171 Ca -0.12 0.21 -0.30 0.00 0.70 0.00 0.00 55.95 56.44 2jc3 s SER 171 Cb -0.16 0.12 -0.05 0.00 -1.71 0.00 0.00 66.02 64.22 2jc3 s SER 171 CO 0.02 -0.12 1.15 -0.44 1.20 0.00 0.00 173.24 175.05 2jc3 s SER 172 N 0.95 7.15 -0.23 5.45 0.01 -1.26 -1.18 113.70 124.59 2jc3 s SER 172 Ca -0.08 1.91 -0.17 0.00 1.31 0.00 0.00 55.95 58.93 2jc3 s SER 172 Cb -0.10 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.52 2jc3 s SER 172 CO -0.04 -0.43 0.44 -0.04 0.41 0.00 0.00 173.24 173.58 2jc3 s MET 173 N 1.16 4.12 0.00 12.44 1.00 -0.47 -4.88 119.30 132.67 2jc3 s MET 173 Ca 0.57 0.24 0.00 0.00 0.00 0.00 0.00 55.69 56.49 2jc3 s MET 173 Cb -0.27 -3.60 0.00 0.00 0.00 0.00 0.00 34.83 30.96 2jc3 s MET 173 CO 0.28 -0.19 0.00 0.41 0.00 0.00 0.00 175.02 175.52 2jc3 n GLY 174 N 4.20 0.27 0.14 -0.03 0.00 -1.26 -3.97 105.19 104.54 2jc3 n GLY 174 Ca -0.07 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.98 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 0.84 0.00 2.61 1.35 -1.93 -3.45 112.91 112.33 2jc3 h THR 175 Ca 0.00 -2.18 0.00 0.00 -0.55 0.00 0.00 66.41 63.68 2jc3 h THR 175 Cb 0.00 2.41 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 2jc3 h THR 175 CO 0.00 0.48 0.00 0.35 -0.25 0.00 0.00 175.52 176.10 2jc3 n THR 176 N -3.23 0.00 -0.21 6.82 -2.24 -1.26 -4.60 114.28 109.56 2jc3 n THR 176 Ca 0.02 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.73 2jc3 n THR 176 Cb 0.73 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.99 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 0.90 0.86 3.38 0.00 -1.91 -0.57 103.07 105.73 2jc3 h GLY 177 Ca 0.00 -0.45 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 2jc3 h GLY 177 CO 0.00 0.43 0.01 -0.84 0.00 0.00 0.00 176.54 176.14 2jc3 h THR 178 N 0.80 1.13 -0.33 4.70 2.02 -1.92 0.82 112.91 120.13 2jc3 h THR 178 Ca 0.20 -0.37 -0.13 0.00 0.77 0.00 0.00 66.41 66.87 2jc3 h THR 178 Cb 0.12 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 2jc3 h THR 178 CO -0.03 0.10 -0.33 -0.29 0.37 0.00 0.00 175.52 175.34 2jc3 h ILE 179 N -0.09 1.28 0.27 3.11 2.10 -1.91 -1.33 117.51 120.94 2jc3 h ILE 179 Ca 0.01 -1.48 -0.01 0.00 1.08 0.00 0.00 64.86 64.46 2jc3 h ILE 179 Cb 0.15 1.39 0.00 0.00 -1.09 0.00 0.00 36.82 37.27 2jc3 h ILE 179 CO -0.00 0.48 -0.13 0.74 -1.08 0.00 0.00 178.15 178.16 2jc3 h THR 180 N 0.61 0.77 -0.21 2.19 2.02 -1.00 -0.11 112.91 117.18 2jc3 h THR 180 Ca 0.06 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 2jc3 h THR 180 Cb 0.86 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 2jc3 h THR 180 CO 0.07 0.05 0.10 1.23 0.37 0.00 0.00 175.52 177.34 2jc3 h GLY 181 N -0.46 0.32 1.14 2.16 0.00 -0.82 -1.00 103.07 104.41 2jc3 h GLY 181 Ca -0.04 -0.16 -0.07 0.00 0.00 0.00 0.00 47.33 47.06 2jc3 h GLY 181 CO 0.06 0.15 0.12 -2.08 0.00 0.00 0.00 176.54 174.79 2jc3 h VAL 182 N 0.21 1.26 -0.21 4.60 2.07 -1.25 -2.61 116.25 120.32 2jc3 h VAL 182 Ca 0.07 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.57 2jc3 h VAL 182 Cb 0.12 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 2jc3 h VAL 182 CO -0.01 0.38 0.05 -1.28 0.02 0.00 0.00 177.57 176.73 2jc3 h SER 183 N 1.00 0.32 -0.79 0.57 0.87 -0.89 -1.03 113.55 113.60 2jc3 h SER 183 Ca 0.20 -0.23 0.16 0.00 -1.23 0.00 0.00 61.79 60.69 2jc3 h SER 183 Cb 0.41 -0.08 -0.10 0.00 -0.44 0.00 0.00 62.40 62.18 2jc3 h SER 183 CO 0.01 0.47 0.31 -0.09 -0.53 0.00 0.00 176.83 177.00 2jc3 h ARG 184 N 0.15 0.41 -0.28 2.24 2.43 -1.01 0.19 114.38 118.52 2jc3 h ARG 184 Ca 0.07 -0.02 -0.18 0.00 -0.81 0.00 0.00 59.98 59.03 2jc3 h ARG 184 Cb 0.28 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 2jc3 h ARG 184 CO 0.00 0.27 -0.54 0.35 -1.51 0.00 0.00 179.97 178.55 2jc3 h PHE 185 N 0.43 1.08 -0.21 2.20 3.04 -1.17 -3.24 116.94 119.06 2jc3 h PHE 185 Ca 0.45 -0.39 -0.11 0.00 3.98 0.00 0.00 57.97 61.90 2jc3 h PHE 185 Cb 0.73 -0.20 -0.01 0.00 2.56 0.00 0.00 35.95 39.03 2jc3 h PHE 185 CO -0.17 1.21 -0.34 -0.07 -2.02 0.00 0.00 178.31 176.92 2jc3 h LEU 186 N 0.63 0.46 -2.13 0.59 3.38 0.12 -2.84 115.31 115.52 2jc3 h LEU 186 Ca 0.01 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 2jc3 h LEU 186 Cb 1.15 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.77 2jc3 h LEU 186 CO 0.12 0.77 -0.03 0.03 0.09 0.00 0.00 178.44 179.42 2jc3 h ARG 187 N 0.38 0.00 0.00 1.13 2.47 -0.71 -0.76 114.38 116.89 2jc3 h ARG 187 Ca 0.04 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.76 2jc3 h ARG 187 Cb 0.79 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.11 2jc3 h ARG 187 CO 0.06 0.03 0.00 0.39 0.56 0.00 0.00 179.97 181.02 2jc3 n GLU 188 N -4.18 0.27 -3.26 0.04 1.02 -1.07 -4.76 120.64 108.69 2jc3 n GLU 188 Ca -0.03 0.11 -0.29 0.00 -0.02 0.00 0.00 57.16 56.93 2jc3 n GLU 188 Cb 0.12 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.00 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 -2.49 3.69 0.03 3.49 -1.52 -0.29 -5.00 119.66 117.57 2jc3 s GLN 189 Ca 0.17 0.14 -0.28 0.00 -1.95 0.00 0.00 55.36 53.43 2jc3 s GLN 189 Cb 0.11 -2.60 -0.17 0.00 -0.22 0.00 0.00 33.01 30.13 2jc3 s GLN 189 CO 0.24 0.19 1.36 1.49 -0.25 0.00 0.00 175.29 178.32 2jc3 h GLU 190 N 1.76 -0.66 -6.58 2.91 4.81 -1.87 -3.43 114.58 111.52 2jc3 h GLU 190 Ca -0.47 0.04 -0.57 0.00 -0.13 0.00 0.00 59.36 58.23 2jc3 h GLU 190 Cb 1.19 0.15 0.07 0.00 0.63 0.00 0.00 28.75 30.79 2jc3 h GLU 190 CO 0.66 -0.36 0.73 1.17 -0.73 0.00 0.00 179.01 180.48 2jc3 n LYS 191 N -5.31 2.19 -2.27 1.92 4.81 -1.26 -4.95 118.16 113.29 2jc3 n LYS 191 Ca -0.11 0.78 -0.33 0.00 -0.87 0.00 0.00 58.31 57.78 2jc3 n LYS 191 Cb 0.31 -2.51 -0.01 0.00 0.02 0.00 0.00 35.03 32.85 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 0.17 3.53 -0.08 1.64 0.02 -1.26 -4.96 135.00 134.06 2jc3 s PRO 192 Ca 0.72 1.27 -0.03 0.00 0.02 0.00 0.00 61.00 62.98 2jc3 s PRO 192 Cb -0.64 -2.06 0.04 0.00 0.02 0.00 0.00 34.50 31.87 2jc3 s PRO 192 CO 0.44 -0.64 0.17 0.08 -0.33 0.00 0.00 177.00 176.72 2jc3 s VAL 193 N -2.25 -0.13 -0.01 3.83 1.01 -1.26 -4.84 120.40 116.75 2jc3 s VAL 193 Ca 0.65 0.23 -0.30 0.00 0.00 0.00 0.00 61.98 62.56 2jc3 s VAL 193 Cb -0.16 -0.29 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 2jc3 s VAL 193 CO 0.29 0.10 1.00 -0.89 0.00 0.00 0.00 175.10 175.60 2jc3 s THR 194 N 1.58 4.80 -0.26 3.92 2.01 -0.35 -4.95 115.64 122.40 2jc3 s THR 194 Ca -0.05 2.02 -0.08 0.00 0.31 0.00 0.00 61.69 63.88 2jc3 s THR 194 Cb -0.12 -4.29 -0.03 0.00 0.01 0.00 0.00 72.50 68.07 2jc3 s THR 194 CO -0.06 0.14 0.10 -0.63 -0.69 0.00 0.00 174.62 173.48 2jc3 s ILE 195 N 1.12 4.51 -0.24 1.82 -1.09 -1.26 -1.24 121.20 124.81 2jc3 s ILE 195 Ca 0.52 -0.15 -0.01 0.00 -2.23 0.00 0.00 60.65 58.79 2jc3 s ILE 195 Cb -0.21 -3.14 0.03 0.00 -1.58 0.00 0.00 42.46 37.55 2jc3 s ILE 195 CO 0.27 0.29 -0.08 -0.69 -1.23 0.00 0.00 174.94 173.50 2jc3 s VAL 196 N 1.64 2.69 0.09 2.92 1.01 0.69 -0.92 120.40 128.51 2jc3 s VAL 196 Ca 0.06 -1.09 0.01 0.00 0.00 0.00 0.00 61.98 60.96 2jc3 s VAL 196 Cb -0.15 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 2jc3 s VAL 196 CO 0.05 0.21 0.23 -0.83 0.00 0.00 0.00 175.10 174.76 2jc3 s GLY 197 N 1.29 2.05 0.03 4.51 0.00 0.77 -1.75 107.32 114.23 2jc3 s GLY 197 Ca -0.00 -0.90 0.07 0.00 0.00 0.00 0.00 44.72 43.89 2jc3 s GLY 197 CO -0.06 -0.88 -0.22 1.08 0.00 0.00 0.00 173.10 173.03 2jc3 s LEU 198 N -2.72 2.14 0.05 0.66 1.43 -0.32 -0.89 118.68 119.02 2jc3 s LEU 198 Ca 0.35 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.95 2jc3 s LEU 198 Cb -0.12 -1.05 -0.03 0.00 0.03 0.00 0.00 46.19 45.02 2jc3 s LEU 198 CO 0.28 0.20 -0.05 0.00 0.23 0.00 0.00 176.35 177.01 2jc3 s GLN 199 N -1.05 0.53 0.45 1.70 -2.07 -0.42 -1.37 119.66 117.43 2jc3 s GLN 199 Ca 0.08 -0.91 -0.23 0.00 -1.82 0.00 0.00 55.36 52.49 2jc3 s GLN 199 Cb -0.09 -0.04 -0.08 0.00 -1.09 0.00 0.00 33.01 31.72 2jc3 s GLN 199 CO 0.01 -0.03 1.14 -1.25 -1.32 0.00 0.00 175.29 173.85 2jc3 s PRO 200 N -2.43 3.81 0.71 9.60 0.04 -1.26 -1.20 135.00 144.27 2jc3 s PRO 200 Ca -0.05 1.71 -0.16 0.00 0.04 0.00 0.00 61.00 62.55 2jc3 s PRO 200 Cb -0.04 -2.40 0.03 0.00 0.04 0.00 0.00 34.50 32.13 2jc3 s PRO 200 CO -0.03 -0.50 1.22 -1.21 0.04 0.00 0.00 177.00 176.52 2jc3 s GLU 201 N -2.71 2.26 0.24 4.56 2.02 -0.49 -4.68 118.70 119.91 2jc3 s GLU 201 Ca 0.63 1.80 -0.31 0.00 0.02 0.00 0.00 54.97 57.11 2jc3 s GLU 201 Cb -0.27 -1.84 -0.12 0.00 0.10 0.00 0.00 34.13 31.99 2jc3 s GLU 201 CO 0.33 -1.75 1.60 0.39 0.02 0.00 0.00 175.26 175.84 2jc3 n GLU 202 N -2.52 2.55 0.00 1.61 1.02 -1.26 -0.61 120.64 121.42 2jc3 n GLU 202 Ca 0.14 0.91 0.00 0.00 -0.02 0.00 0.00 57.16 58.19 2jc3 n GLU 202 Cb 0.50 -2.69 0.00 0.00 -0.02 0.00 0.00 31.44 29.23 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 2.82 2.83 3.76 0.62 0.00 -1.26 -5.02 105.19 108.94 2jc3 n GLY 203 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 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 0.62 7.04 -0.30 1.61 0.01 0.22 -5.02 113.70 117.87 2jc3 s SER 204 Ca 0.00 2.42 -0.01 0.00 1.31 0.00 0.00 55.95 59.67 2jc3 s SER 204 Cb 0.00 -2.63 0.06 0.00 0.21 0.00 0.00 66.02 63.66 2jc3 s SER 204 CO 0.00 -0.34 0.00 -0.55 0.41 0.00 0.00 173.24 172.76 2jc3 s SER 205 N -0.50 4.86 -0.29 2.44 0.15 -1.26 -4.71 113.70 114.38 2jc3 s SER 205 Ca 0.48 -1.36 0.02 0.00 0.70 0.00 0.00 55.95 55.79 2jc3 s SER 205 Cb -0.35 -1.70 0.08 0.00 -1.71 0.00 0.00 66.02 62.34 2jc3 s SER 205 CO 0.44 -0.27 -0.00 -0.63 1.20 0.00 0.00 173.24 173.98 2jc3 s ILE 206 N 1.22 1.90 0.12 6.45 1.01 -1.26 -4.84 121.20 125.79 2jc3 s ILE 206 Ca -0.04 -1.81 -0.35 0.00 0.00 0.00 0.00 60.65 58.45 2jc3 s ILE 206 Cb -0.20 -2.26 -0.17 0.00 0.01 0.00 0.00 42.46 39.84 2jc3 s ILE 206 CO -0.02 -0.37 1.09 -2.65 0.00 0.00 0.00 174.94 172.99 2jc3 n PRO 207 N 4.47 0.72 0.00 2.79 -0.02 -1.26 -2.15 135.00 139.54 2jc3 n PRO 207 Ca -0.04 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2jc3 n PRO 207 Cb 0.42 -1.72 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 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 1.96 3.09 3.61 -1.23 0.00 -1.26 -4.35 105.19 107.01 2jc3 n GLY 208 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.77 0.75 0.15 -0.61 -4.36 -0.92 -4.52 121.20 108.91 2jc3 s ILE 209 Ca 0.00 -2.00 -0.24 0.00 -0.26 0.00 0.00 60.65 58.15 2jc3 s ILE 209 Cb 0.00 -2.24 0.07 0.00 1.25 0.00 0.00 42.46 41.54 2jc3 s ILE 209 CO 0.00 0.00 0.61 0.00 0.24 0.00 0.00 174.94 175.79 2jc3 s ARG 210 N -3.75 1.26 -0.30 0.37 1.70 -1.25 -4.67 118.95 112.30 2jc3 s ARG 210 Ca 0.16 -0.42 -0.23 0.00 -0.47 0.00 0.00 55.73 54.77 2jc3 s ARG 210 Cb 0.02 0.58 -0.00 0.00 -0.57 0.00 0.00 34.95 34.98 2jc3 s ARG 210 CO 0.10 -0.54 0.74 0.50 -1.08 0.00 0.00 175.30 175.02 2jc3 s ARG 211 N -3.58 3.97 0.05 3.89 3.52 -1.26 -4.59 118.95 120.95 2jc3 s ARG 211 Ca 0.00 0.54 -0.24 0.00 -0.13 0.00 0.00 55.73 55.90 2jc3 s ARG 211 Cb -0.01 -3.72 -0.06 0.00 -1.56 0.00 0.00 34.95 29.61 2jc3 s ARG 211 CO -0.11 -0.63 0.73 -1.58 -0.81 0.00 0.00 175.30 172.89 2jc3 s TRP 212 N 2.84 3.74 0.05 5.12 0.52 -1.26 -4.99 118.94 124.96 2jc3 s TRP 212 Ca 0.30 1.43 -0.35 0.00 0.02 0.00 0.00 56.10 57.50 2jc3 s TRP 212 Cb -0.14 -2.76 -0.14 0.00 -1.15 0.00 0.00 33.47 29.27 2jc3 s TRP 212 CO 0.12 0.32 1.61 -2.30 0.02 0.00 0.00 176.95 176.72 2jc3 n PRO 213 N 2.65 1.87 -0.10 4.98 -0.02 -1.26 -4.75 135.00 138.36 2jc3 n PRO 213 Ca -0.04 0.68 0.03 0.00 -2.02 0.00 0.00 63.50 62.15 2jc3 n PRO 213 Cb 0.50 -2.43 0.06 0.00 -0.02 0.00 0.00 33.50 31.62 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 4.14 0.11 -1.26 3.55 0.00 -1.26 0.23 120.51 126.03 2jc3 n ALA 214 Ca 0.19 0.31 -0.02 0.00 0.00 0.00 0.00 53.44 53.93 2jc3 n ALA 214 Cb 0.26 -0.21 0.22 0.00 0.00 0.00 0.00 19.45 19.72 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 -4.32 2.33 -2.60 0.00 1.02 -1.26 -4.56 120.64 111.26 2jc3 n GLU 215 Ca 0.06 -3.05 -0.08 0.00 -0.02 0.00 0.00 57.16 54.07 2jc3 n GLU 215 Cb 0.19 -1.88 0.04 0.00 -0.02 0.00 0.00 31.44 29.77 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 -0.87 1.71 -2.09 -0.32 4.02 0.64 -5.10 117.16 115.15 2jc3 n TYR 216 Ca 0.32 -2.23 -0.35 0.00 -0.01 0.00 0.00 57.90 55.63 2jc3 n TYR 216 Cb 1.06 -0.26 0.02 0.00 -0.02 0.00 0.00 39.34 40.13 2jc3 n TYR 216 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 176.86 174.21 2jc3 s MET 217 N -3.71 3.14 0.70 -0.72 -1.94 -1.23 -4.38 119.30 111.16 2jc3 s MET 217 Ca 0.34 1.61 -0.16 0.00 -1.71 0.00 0.00 55.69 55.77 2jc3 s MET 217 Cb 0.35 -1.97 0.02 0.00 2.01 0.00 0.00 34.83 35.24 2jc3 s MET 217 CO -0.02 -1.02 1.21 -0.35 -0.01 0.00 0.00 175.02 174.83 2jc3 n PRO 218 N -1.62 0.75 -0.20 2.03 -0.04 -1.26 -4.87 135.00 129.79 2jc3 n PRO 218 Ca 0.12 0.32 0.17 0.00 -0.04 0.00 0.00 63.50 64.07 2jc3 n PRO 218 Cb 0.51 -2.45 0.52 0.00 -0.04 0.00 0.00 33.50 32.03 2jc3 n PRO 218 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2jc3 h GLY 219 N -0.01 0.74 1.76 0.55 0.00 -1.78 -1.11 103.07 103.23 2jc3 h GLY 219 Ca -0.49 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 46.66 2jc3 h GLY 219 CO 0.50 0.03 0.00 0.29 0.00 0.00 0.00 176.54 177.36 2jc3 n ILE 220 N -4.48 0.41 -2.36 2.60 -5.35 -0.74 -4.82 119.36 104.62 2jc3 n ILE 220 Ca 0.16 0.10 -0.41 0.00 -0.27 0.00 0.00 62.75 62.34 2jc3 n ILE 220 Cb 0.61 -0.73 -0.04 0.00 -1.74 0.00 0.00 39.64 37.74 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 -2.76 3.41 -0.37 4.28 2.19 -0.42 -4.94 117.98 119.36 2jc3 s PHE 221 Ca 0.16 1.57 0.00 0.00 0.33 0.00 0.00 56.93 58.99 2jc3 s PHE 221 Cb 0.14 -3.42 0.13 0.00 -1.31 0.00 0.00 43.02 38.57 2jc3 s PHE 221 CO 0.36 -1.03 0.20 1.21 1.83 0.00 0.00 175.22 177.79 2jc3 s ASN 222 N -0.56 3.39 0.53 6.13 3.84 -1.26 -5.00 114.94 122.01 2jc3 s ASN 222 Ca 0.47 -2.20 0.46 0.00 0.21 0.00 0.00 52.86 51.80 2jc3 s ASN 222 Cb -0.34 -0.68 1.68 0.00 -0.55 0.00 0.00 41.25 41.36 2jc3 s ASN 222 CO 0.43 -0.32 1.58 0.00 -2.79 0.00 0.00 177.10 176.00 2jc3 h ALA 223 N 7.16 3.61 0.00 1.71 0.00 -1.95 0.52 119.26 130.32 2jc3 h ALA 223 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2jc3 h ALA 223 Cb 0.96 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2jc3 h ALA 223 CO 0.38 -2.21 0.00 -1.13 0.00 0.00 0.00 179.25 176.29 2jc3 n SER 224 N -4.14 0.00 0.04 0.00 3.41 -1.26 -2.77 113.62 108.91 2jc3 n SER 224 Ca 0.43 -0.00 0.12 0.00 -0.26 0.00 0.00 58.87 59.16 2jc3 n SER 224 Cb 1.90 -0.32 0.10 0.00 -0.26 0.00 0.00 64.21 65.63 2jc3 n SER 224 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jc3 n LEU 225 N -1.32 0.64 -4.37 1.04 4.77 0.18 -4.80 117.00 113.14 2jc3 n LEU 225 Ca 0.12 0.09 -0.37 0.00 -0.03 0.00 0.00 56.01 55.81 2jc3 n LEU 225 Cb 0.23 -0.14 -0.12 0.00 -2.33 0.00 0.00 43.42 41.06 2jc3 n LEU 225 CO 0.22 0.00 -0.26 -0.69 -1.33 0.00 0.00 177.39 175.33 2jc3 s VAL 226 N -3.17 4.13 0.12 4.08 1.01 -1.11 -4.77 120.40 120.68 2jc3 s VAL 226 Ca 0.05 -0.58 -0.09 0.00 0.00 0.00 0.00 61.98 61.36 2jc3 s VAL 226 Cb 0.14 -3.10 -0.14 0.00 0.00 0.00 0.00 36.38 33.28 2jc3 s VAL 226 CO 0.76 0.11 1.34 0.44 0.00 0.00 0.00 175.10 177.75 2jc3 h ASP 227 N 8.26 0.81 -4.76 3.32 3.32 -1.31 -3.46 116.42 122.59 2jc3 h ASP 227 Ca -0.32 -0.54 -0.16 0.00 0.02 0.00 0.00 57.03 56.02 2jc3 h ASP 227 Cb 1.14 -0.24 -0.22 0.00 0.22 0.00 0.00 39.33 40.23 2jc3 h ASP 227 CO 0.60 1.32 -0.59 -1.61 -1.72 0.00 0.00 179.24 177.24 2jc3 s GLU 228 N -3.70 0.35 -0.12 3.56 2.02 -0.76 -5.00 118.70 115.05 2jc3 s GLU 228 Ca -0.09 -0.39 0.01 0.00 0.02 0.00 0.00 54.97 54.52 2jc3 s GLU 228 Cb 0.09 0.14 0.02 0.00 0.10 0.00 0.00 34.13 34.48 2jc3 s GLU 228 CO 0.89 -0.07 -0.12 0.08 0.02 0.00 0.00 175.26 176.05 2jc3 s VAL 229 N -1.16 1.33 0.14 2.63 1.01 -1.26 -0.16 120.40 122.94 2jc3 s VAL 229 Ca -0.13 -0.50 0.06 0.00 0.00 0.00 0.00 61.98 61.41 2jc3 s VAL 229 Cb -0.07 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 2jc3 s VAL 229 CO 0.00 0.42 0.01 -0.76 0.00 0.00 0.00 175.10 174.77 2jc3 s LEU 230 N 1.38 3.42 -0.08 3.92 1.02 -0.07 -4.97 118.68 123.31 2jc3 s LEU 230 Ca 0.01 -0.29 -0.07 0.00 0.02 0.00 0.00 54.13 53.80 2jc3 s LEU 230 Cb -0.13 -2.09 -0.04 0.00 0.02 0.00 0.00 46.19 43.94 2jc3 s LEU 230 CO -0.07 0.12 0.19 -1.81 0.02 0.00 0.00 176.35 174.80 2jc3 s ASP 231 N -2.73 6.44 -0.08 2.29 1.11 -1.26 -1.30 116.67 121.15 2jc3 s ASP 231 Ca 0.27 0.52 0.03 0.00 0.18 0.00 0.00 52.55 53.55 2jc3 s ASP 231 Cb -0.10 -2.08 0.01 0.00 1.07 0.00 0.00 42.92 41.81 2jc3 s ASP 231 CO 0.19 0.36 -0.17 -0.63 1.18 0.00 0.00 175.17 176.10 2jc3 s ILE 232 N -1.10 1.50 0.10 0.77 -1.09 -0.34 -4.85 121.20 116.18 2jc3 s ILE 232 Ca 0.19 -0.70 -0.28 0.00 -2.23 0.00 0.00 60.65 57.63 2jc3 s ILE 232 Cb -0.13 -1.32 -0.06 0.00 -1.58 0.00 0.00 42.46 39.37 2jc3 s ILE 232 CO 0.08 0.43 0.90 -2.28 -1.23 0.00 0.00 174.94 172.84 2jc3 s HIS 233 N 0.48 3.80 0.25 3.97 5.65 -1.26 -1.39 115.29 126.79 2jc3 s HIS 233 Ca -0.15 1.70 -0.14 0.00 0.25 0.00 0.00 55.06 56.72 2jc3 s HIS 233 Cb -0.16 -2.97 0.33 0.00 -1.18 0.00 0.00 32.58 28.59 2jc3 s HIS 233 CO 0.05 0.25 1.56 0.37 -0.65 0.00 0.00 174.74 176.32 2jc3 h GLN 234 N 5.52 -0.00 -0.94 2.88 4.15 -1.90 0.72 115.11 125.53 2jc3 h GLN 234 Ca -0.43 0.00 0.03 0.00 0.77 0.00 0.00 58.65 59.02 2jc3 h GLN 234 Cb 1.21 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.85 2jc3 h GLN 234 CO 0.71 -0.00 0.61 -0.97 -1.93 0.00 0.00 178.83 177.25 2jc3 h ASN 235 N -0.00 1.03 -0.51 -0.69 -0.73 -1.94 0.55 115.58 113.29 2jc3 h ASN 235 Ca 0.40 -0.01 -0.09 0.00 1.87 0.00 0.00 56.30 58.47 2jc3 h ASN 235 Cb 0.65 -0.24 -0.02 0.00 0.27 0.00 0.00 38.32 38.98 2jc3 h ASN 235 CO -1.00 0.72 -0.01 -0.78 -0.37 0.00 0.00 177.43 175.99 2jc3 h ASP 236 N 1.20 0.93 -0.10 1.15 3.58 -1.29 -0.50 116.42 121.38 2jc3 h ASP 236 Ca 0.37 -0.25 -0.02 0.00 0.42 0.00 0.00 57.03 57.54 2jc3 h ASP 236 Cb -0.03 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 40.76 2jc3 h ASP 236 CO -0.11 0.99 -0.02 0.00 -2.88 0.00 0.00 179.24 177.22 2jc3 h ALA 237 N 1.11 0.14 -0.47 -0.78 0.00 -0.60 -1.52 119.26 117.14 2jc3 h ALA 237 Ca 0.16 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2jc3 h ALA 237 Cb 0.53 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2jc3 h ALA 237 CO 0.03 -0.14 0.17 0.93 0.00 0.00 0.00 179.25 180.24 2jc3 h GLU 238 N -0.11 0.67 -0.17 0.00 5.08 -0.77 -0.26 114.58 119.02 2jc3 h GLU 238 Ca 0.03 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.21 2jc3 h GLU 238 Cb 0.41 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 2jc3 h GLU 238 CO 0.01 0.57 -0.18 -0.91 -1.00 0.00 0.00 179.01 177.50 2jc3 h ASN 239 N 0.67 0.45 -0.36 1.42 2.35 -0.98 -2.12 115.58 117.01 2jc3 h ASN 239 Ca 0.16 -0.49 -0.05 0.00 -0.55 0.00 0.00 56.30 55.38 2jc3 h ASN 239 Cb 0.16 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 2jc3 h ASN 239 CO -0.01 0.85 0.08 0.74 -1.65 0.00 0.00 177.43 177.44 2jc3 h THR 240 N 0.07 1.20 -0.13 2.81 2.02 -1.03 -0.89 112.91 116.96 2jc3 h THR 240 Ca 0.02 -0.75 0.02 0.00 0.77 0.00 0.00 66.41 66.47 2jc3 h THR 240 Cb 0.73 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.91 2jc3 h THR 240 CO 0.04 0.27 0.02 -0.03 0.37 0.00 0.00 175.52 176.20 2jc3 h MET 241 N 0.64 0.07 -0.15 6.66 1.85 -0.90 -0.12 114.93 122.98 2jc3 h MET 241 Ca 0.14 -0.00 -0.07 0.00 -0.61 0.00 0.00 59.70 59.16 2jc3 h MET 241 Cb 0.28 -0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.28 2jc3 h MET 241 CO 0.00 0.05 -0.23 0.00 -0.40 0.00 0.00 176.91 176.33 2jc3 h ARG 242 N 0.08 0.27 -0.17 0.39 3.08 -1.00 -2.65 114.38 114.38 2jc3 h ARG 242 Ca 0.06 -0.09 -0.12 0.00 0.07 0.00 0.00 59.98 59.90 2jc3 h ARG 242 Cb 0.05 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 2jc3 h ARG 242 CO -0.08 0.49 -0.43 1.49 -1.07 0.00 0.00 179.97 180.38 2jc3 h GLU 243 N 0.25 0.41 -0.59 0.04 4.57 -0.57 -1.89 114.58 116.79 2jc3 h GLU 243 Ca 0.04 -0.21 -0.05 0.00 -1.18 0.00 0.00 59.36 57.97 2jc3 h GLU 243 Cb 0.55 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.12 2jc3 h GLU 243 CO 0.04 0.77 0.19 -0.07 -1.18 0.00 0.00 179.01 178.75 2jc3 h LEU 244 N 0.34 0.86 -0.11 1.64 3.38 -0.68 0.24 115.31 120.97 2jc3 h LEU 244 Ca 0.03 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 2jc3 h LEU 244 Cb 0.89 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 2jc3 h LEU 244 CO 0.07 0.84 -0.03 0.00 0.09 0.00 0.00 178.44 179.42 2jc3 h ALA 245 N 1.06 0.16 -0.33 1.53 0.00 -1.19 -0.75 119.26 119.74 2jc3 h ALA 245 Ca 0.19 -0.22 -0.16 0.00 0.00 0.00 0.00 54.91 54.72 2jc3 h ALA 245 Cb 0.28 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2jc3 h ALA 245 CO -0.01 -0.11 -0.42 0.28 0.00 0.00 0.00 179.25 179.00 2jc3 h VAL 246 N -0.10 1.28 0.00 0.00 2.07 -1.21 -2.00 116.25 116.29 2jc3 h VAL 246 Ca 0.03 -1.60 0.00 0.00 0.82 0.00 0.00 66.70 65.95 2jc3 h VAL 246 Cb 0.44 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 2jc3 h VAL 246 CO 0.01 0.52 -1.53 0.54 0.02 0.00 0.00 177.57 177.13 2jc3 n ARG 247 N -4.09 0.35 0.00 1.57 1.74 0.83 -4.57 116.66 112.49 2jc3 n ARG 247 Ca -0.03 -0.11 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 2jc3 n ARG 247 Cb 0.56 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 30.49 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 -1.91 4.74 -1.08 5.56 -0.58 -0.40 -4.71 120.64 122.26 2jc3 n GLU 248 Ca -0.00 0.00 -0.03 0.00 -0.42 0.00 0.00 57.16 56.71 2jc3 n GLU 248 Cb 0.46 -0.55 -0.01 0.00 -0.57 0.00 0.00 31.44 30.77 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 1.17 0.59 3.33 0.62 0.00 -0.51 -4.98 105.19 105.41 2jc3 n GLY 249 Ca 0.00 -0.60 -0.40 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.04 4.42 -0.57 -0.61 1.01 -0.75 -4.91 121.20 117.75 2jc3 s ILE 250 Ca 0.00 -1.10 -0.19 0.00 0.00 0.00 0.00 60.65 59.36 2jc3 s ILE 250 Cb 0.00 -3.57 0.09 0.00 0.01 0.00 0.00 42.46 38.99 2jc3 s ILE 250 CO 0.00 -0.35 0.69 0.12 0.00 0.00 0.00 174.94 175.39 2jc3 s PHE 251 N 1.50 3.00 0.23 3.97 5.99 -1.26 -2.14 117.98 129.27 2jc3 s PHE 251 Ca 0.02 -0.83 0.02 0.00 0.00 0.00 0.00 56.93 56.14 2jc3 s PHE 251 Cb -0.21 -3.88 -0.01 0.00 0.00 0.00 0.00 43.02 38.92 2jc3 s PHE 251 CO 0.05 -1.23 0.09 0.00 -0.00 0.00 0.00 175.22 174.13 2jc3 s GLY 253 N -2.41 1.76 0.16 0.00 0.00 -1.22 -3.87 107.32 101.74 2jc3 s GLY 253 Ca 0.12 -1.75 -0.16 0.00 0.00 0.00 0.00 44.72 42.94 2jc3 s GLY 253 CO 0.09 -1.15 1.79 -2.08 0.00 0.00 0.00 173.10 171.75 2jc3 h VAL 254 N -0.63 1.00 0.00 1.40 2.07 -1.90 -1.57 116.25 116.63 2jc3 h VAL 254 Ca -0.36 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 2jc3 h VAL 254 Cb 1.26 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 2jc3 h VAL 254 CO 0.39 0.08 -0.09 0.77 0.02 0.00 0.00 177.57 178.74 2jc3 h SER 255 N 0.43 0.00 -0.08 0.57 4.64 -1.91 0.10 113.55 117.30 2jc3 h SER 255 Ca 0.17 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.31 2jc3 h SER 255 Cb 0.05 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.15 2jc3 h SER 255 CO -0.10 0.09 -0.65 0.28 -0.87 0.00 0.00 176.83 175.58 2jc3 h SER 256 N 0.00 0.71 -0.83 4.97 0.02 -1.64 0.48 113.55 117.26 2jc3 h SER 256 Ca -0.00 -0.67 0.01 0.00 -0.84 0.00 0.00 61.79 60.29 2jc3 h SER 256 Cb 0.29 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.57 2jc3 h SER 256 CO 0.01 1.28 0.55 1.23 -1.14 0.00 0.00 176.83 178.76 2jc3 h GLY 257 N 0.21 1.17 0.96 -3.77 0.00 -0.34 -0.76 103.07 100.54 2jc3 h GLY 257 Ca -0.06 -0.43 0.02 0.00 0.00 0.00 0.00 47.33 46.86 2jc3 h GLY 257 CO 0.13 0.41 0.51 -1.33 0.00 0.00 0.00 176.54 176.26 2jc3 h GLY 258 N 1.11 1.10 1.07 4.60 0.00 -0.74 0.29 103.07 110.50 2jc3 h GLY 258 Ca 0.31 -0.39 -0.07 0.00 0.00 0.00 0.00 47.33 47.17 2jc3 h GLY 258 CO -0.07 0.37 0.16 0.00 0.00 0.00 0.00 176.54 176.99 2jc3 h ALA 259 N 1.30 0.92 -0.21 3.60 0.00 -0.11 -0.89 119.26 123.87 2jc3 h ALA 259 Ca 0.29 -0.26 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 2jc3 h ALA 259 Cb -0.07 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 2jc3 h ALA 259 CO -0.08 0.66 -0.56 0.28 0.00 0.00 0.00 179.25 179.55 2jc3 h VAL 260 N 1.07 1.31 -0.56 0.00 2.07 -0.62 -0.50 116.25 119.01 2jc3 h VAL 260 Ca 0.22 -1.80 0.08 0.00 0.82 0.00 0.00 66.70 66.02 2jc3 h VAL 260 Cb 0.39 1.75 -0.07 0.00 -1.52 0.00 0.00 31.29 31.85 2jc3 h VAL 260 CO 0.01 0.57 0.21 0.00 0.02 0.00 0.00 177.57 178.37 2jc3 h ALA 261 N 0.88 0.71 -0.79 1.67 0.00 -0.02 0.36 119.26 122.07 2jc3 h ALA 261 Ca 0.01 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2jc3 h ALA 261 Cb 1.13 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 2jc3 h ALA 261 CO 0.11 -0.19 0.37 0.78 0.00 0.00 0.00 179.25 180.32 2jc3 h GLY 262 N 0.40 1.22 1.77 0.00 0.00 -0.81 -1.39 103.07 104.25 2jc3 h GLY 262 Ca 0.28 -0.61 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 2jc3 h GLY 262 CO -0.28 0.58 -0.12 0.00 0.00 0.00 0.00 176.54 176.73 2jc3 h ALA 263 N 1.19 1.46 -0.15 3.60 0.00 0.38 -0.93 119.26 124.81 2jc3 h ALA 263 Ca 0.27 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2jc3 h ALA 263 Cb 0.13 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2jc3 h ALA 263 CO -0.03 0.38 -0.04 -0.07 0.00 0.00 0.00 179.25 179.49 2jc3 h LEU 264 N 0.27 0.30 -0.31 0.00 3.38 0.35 0.85 115.31 120.16 2jc3 h LEU 264 Ca 0.06 -0.37 0.05 0.00 0.09 0.00 0.00 57.88 57.71 2jc3 h LEU 264 Cb 0.39 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 2jc3 h LEU 264 CO 0.02 0.60 0.01 0.03 0.09 0.00 0.00 178.44 179.19 2jc3 h ARG 265 N -0.00 0.10 0.05 1.13 3.08 -0.80 0.92 114.38 118.86 2jc3 h ARG 265 Ca 0.04 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 2jc3 h ARG 265 Cb 0.46 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.49 2jc3 h ARG 265 CO 0.02 0.06 -0.02 0.28 -1.07 0.00 0.00 179.97 179.24 2jc3 h VAL 266 N 0.10 0.96 -0.70 2.04 2.07 -1.09 -1.49 116.25 118.13 2jc3 h VAL 266 Ca 0.15 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 67.68 2jc3 h VAL 266 Cb 0.19 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 2jc3 h VAL 266 CO -0.24 0.01 0.43 0.00 0.02 0.00 0.00 177.57 177.79 2jc3 h ALA 267 N 0.88 0.93 -0.41 1.67 0.00 -0.43 -0.75 119.26 121.14 2jc3 h ALA 267 Ca -0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2jc3 h ALA 267 Cb 0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2jc3 h ALA 267 CO 0.01 0.17 0.18 0.00 0.00 0.00 0.00 179.25 179.61 2jc3 h ARG 268 N 0.82 0.61 0.00 0.00 3.08 -0.66 -2.76 114.38 115.47 2jc3 h ARG 268 Ca 0.29 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.24 2jc3 h ARG 268 Cb 0.08 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.03 2jc3 h ARG 268 CO -0.13 0.56 0.00 0.00 -1.07 0.00 0.00 179.97 179.33 2jc3 n ALA 269 N -2.30 1.94 -3.57 0.04 0.00 -0.58 -4.47 120.51 111.57 2jc3 n ALA 269 Ca 0.00 -0.02 -0.29 0.00 0.00 0.00 0.00 53.44 53.13 2jc3 n ALA 269 Cb 0.14 -1.38 -0.12 0.00 0.00 0.00 0.00 19.45 18.09 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 -3.10 0.75 0.35 0.00 2.01 -0.33 -5.08 115.64 110.23 2jc3 s THR 270 Ca 0.09 -2.18 -0.26 0.00 0.31 0.00 0.00 61.69 59.64 2jc3 s THR 270 Cb 0.12 -1.53 -0.12 0.00 0.01 0.00 0.00 72.50 70.97 2jc3 s THR 270 CO 0.43 -0.97 1.01 -2.65 -0.69 0.00 0.00 174.62 171.75 2jc3 n PRO 271 N 3.71 1.40 -0.54 4.92 -0.02 -1.26 -1.48 135.00 141.72 2jc3 n PRO 271 Ca 0.12 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 2jc3 n PRO 271 Cb 0.37 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 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 1.19 1.70 3.76 -1.23 0.00 -1.04 -4.79 105.19 104.78 2jc3 n GLY 272 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.35 3.01 -0.57 4.61 0.00 -0.55 -4.63 121.76 120.28 2jc3 s ALA 273 Ca 0.00 1.35 -0.02 0.00 0.00 0.00 0.00 51.96 53.29 2jc3 s ALA 273 Cb 0.00 -3.56 0.15 0.00 0.00 0.00 0.00 23.12 19.71 2jc3 s ALA 273 CO 0.00 -1.23 0.38 0.42 0.00 0.00 0.00 175.76 175.33 2jc3 s ILE 274 N -1.28 3.54 -0.01 0.00 -1.09 -1.26 -0.24 121.20 120.86 2jc3 s ILE 274 Ca 0.66 -2.80 -0.17 0.00 -2.23 0.00 0.00 60.65 56.11 2jc3 s ILE 274 Cb -0.41 -3.34 -0.06 0.00 -1.58 0.00 0.00 42.46 37.08 2jc3 s ILE 274 CO 0.50 -0.83 0.47 -0.69 -1.23 0.00 0.00 174.94 173.15 2jc3 s VAL 275 N 0.16 4.99 -0.11 2.92 1.01 -0.30 -1.35 120.40 127.73 2jc3 s VAL 275 Ca 0.15 0.97 0.03 0.00 0.00 0.00 0.00 61.98 63.13 2jc3 s VAL 275 Cb -0.21 -3.79 0.01 0.00 0.00 0.00 0.00 36.38 32.39 2jc3 s VAL 275 CO -0.03 0.51 -0.22 -0.69 0.00 0.00 0.00 175.10 174.67 2jc3 s VAL 276 N -0.66 1.94 0.10 2.92 1.01 -0.49 -0.35 120.40 124.87 2jc3 s VAL 276 Ca 0.26 -0.93 0.09 0.00 0.00 0.00 0.00 61.98 61.40 2jc3 s VAL 276 Cb -0.17 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 2jc3 s VAL 276 CO 0.14 0.53 -0.23 0.00 0.00 0.00 0.00 175.10 175.54 2jc3 s ALA 277 N 0.61 1.97 -0.14 5.51 0.00 -0.55 -0.19 121.76 128.97 2jc3 s ALA 277 Ca -0.13 -1.28 -0.21 0.00 0.00 0.00 0.00 51.96 50.34 2jc3 s ALA 277 Cb -0.17 -0.31 -0.03 0.00 0.00 0.00 0.00 23.12 22.62 2jc3 s ALA 277 CO 0.03 0.42 0.64 0.42 0.00 0.00 0.00 175.76 177.27 2jc3 s ILE 278 N -1.06 5.05 -0.40 0.00 -1.09 -1.00 -1.37 121.20 121.32 2jc3 s ILE 278 Ca 0.09 1.25 -0.14 0.00 -2.23 0.00 0.00 60.65 59.62 2jc3 s ILE 278 Cb -0.10 -3.96 0.03 0.00 -1.58 0.00 0.00 42.46 36.85 2jc3 s ILE 278 CO 0.04 0.19 0.28 -0.63 -1.23 0.00 0.00 174.94 173.58 2jc3 s ILE 279 N 1.37 5.01 0.20 2.92 -1.09 -0.31 -4.75 121.20 124.54 2jc3 s ILE 279 Ca 0.31 -0.78 -0.08 0.00 -2.23 0.00 0.00 60.65 57.88 2jc3 s ILE 279 Cb -0.16 -3.81 0.10 0.00 -1.58 0.00 0.00 42.46 37.00 2jc3 s ILE 279 CO 0.13 -0.31 1.69 0.00 -1.23 0.00 0.00 174.94 175.22 2jc3 n ASP 281 N -4.21 -1.95 -4.95 0.00 3.85 -1.26 -0.80 116.55 107.23 2jc3 n ASP 281 Ca 0.04 -2.37 -0.24 0.00 -0.71 0.00 0.00 54.79 51.52 2jc3 n ASP 281 Cb 0.30 3.25 0.05 0.00 -1.35 0.00 0.00 41.12 43.36 2jc3 n ASP 281 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 2jc3 s ARG 282 N -2.09 2.43 0.00 0.11 0.52 -1.21 -3.37 118.95 115.34 2jc3 s ARG 282 Ca 0.14 -0.48 0.27 0.00 -0.52 0.00 0.00 55.73 55.13 2jc3 s ARG 282 Cb -0.04 -2.33 0.88 0.00 0.52 0.00 0.00 34.95 33.98 2jc3 s ARG 282 CO 0.10 -0.93 1.68 0.41 0.02 0.00 0.00 175.30 176.58 2jc3 n GLY 283 N -2.61 -1.38 0.26 -3.53 0.00 -0.69 -3.89 105.19 93.34 2jc3 n GLY 283 Ca 0.07 -0.22 0.01 0.00 0.00 0.00 0.00 46.02 45.89 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 0.00 -0.58 0.19 1.61 3.32 -1.90 -0.28 116.42 118.79 2jc3 h ASP 284 Ca 0.00 0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2jc3 h ASP 284 Cb 0.51 0.40 0.00 0.00 0.22 0.00 0.00 39.33 40.46 2jc3 h ASP 284 CO 0.00 -0.21 0.00 0.54 -1.72 0.00 0.00 179.24 177.85 2jc3 n ARG 285 N -5.43 0.52 -0.00 3.56 1.74 -1.26 -2.42 116.66 113.36 2jc3 n ARG 285 Ca 0.09 0.04 0.10 0.00 -0.77 0.00 0.00 57.85 57.32 2jc3 n ARG 285 Cb 0.37 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 30.20 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 -1.13 0.01 -0.22 -1.55 4.01 -0.12 -4.53 117.16 113.63 2jc3 n TYR 286 Ca 0.14 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.88 2jc3 n TYR 286 Cb 0.12 -0.10 0.11 0.00 -0.31 0.00 0.00 39.34 39.16 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 0.36 -1.11 7.72 3.38 -1.42 -1.72 115.31 122.53 2jc3 h LEU 287 Ca 0.00 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2jc3 h LEU 287 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 2jc3 h LEU 287 CO 0.00 0.22 0.00 0.77 0.09 0.00 0.00 178.44 179.52 2jc3 h SER 288 N 0.52 0.00 0.24 -0.43 4.64 -1.81 -2.75 113.55 113.96 2jc3 h SER 288 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 2jc3 h SER 288 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 2jc3 h SER 288 CO -0.26 0.00 -0.11 0.35 -0.87 0.00 0.00 176.83 175.94 2jc3 n THR 289 N -2.40 0.00 0.00 2.95 -2.24 -0.65 -4.94 114.28 107.01 2jc3 n THR 289 Ca 0.01 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 2jc3 n THR 289 Cb 0.18 0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 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 1.24 2.85 0.25 3.38 0.00 -1.04 -4.88 105.19 107.01 2jc3 n GLY 290 Ca 0.16 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.31 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 -1.83 -2.43 116.25 112.09 2jc3 h VAL 291 Ca 0.00 0.00 -0.04 0.00 -1.23 0.00 0.00 66.70 65.43 2jc3 h VAL 291 Cb 0.00 0.58 -0.01 0.00 -2.13 0.00 0.00 31.29 29.73 2jc3 h VAL 291 CO 0.00 0.00 -1.13 0.49 -1.23 0.00 0.00 177.57 175.70 2jc3 n PHE 292 N -2.55 0.00 0.00 5.19 3.01 -1.26 -4.95 117.46 116.90 2jc3 n PHE 292 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 2jc3 n PHE 292 Cb 0.24 -0.54 0.00 0.00 -0.01 0.00 0.00 39.48 39.17 2jc3 n PHE 292 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jc3 n GLY 293 N 1.47 0.00 0.00 1.37 0.00 -0.92 -5.15 105.19 101.97 2jc3 n GLY 293 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2jc3 n GLY 293 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11