#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i4n n ASN 2 N 0.00 4.75 -2.73 7.83 3.02 -1.26 -4.90 115.26 121.98 3i4n n ASN 2 Ca 0.00 -2.98 0.00 0.00 -0.03 0.00 0.00 54.58 51.57 3i4n n ASN 2 Cb 0.00 -1.58 0.00 0.00 -0.61 0.00 0.00 39.78 37.59 3i4n n ASN 2 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3i4n n VAL 3 N 4.50 0.00 0.00 2.41 0.31 -1.26 -4.84 118.33 119.45 3i4n n VAL 3 Ca 0.44 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.77 3i4n n VAL 3 Cb 0.40 -1.31 0.00 0.00 -0.91 0.00 0.00 33.84 32.02 3i4n n VAL 3 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3i4n n SER 4 N 3.41 0.00 -3.15 4.52 7.64 -1.26 -4.23 113.62 120.55 3i4n n SER 4 Ca 0.00 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.93 3i4n n SER 4 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 3i4n n SER 4 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3i4n s THR 5 N 0.00 -0.34 0.63 0.44 2.01 -1.26 -5.18 115.64 111.94 3i4n s THR 5 Ca 0.00 0.00 -0.08 0.00 0.31 0.00 0.00 61.69 61.92 3i4n s THR 5 Cb 0.00 -0.86 0.01 0.00 0.01 0.00 0.00 72.50 71.66 3i4n s THR 5 CO 0.00 0.00 0.97 -0.94 -0.69 0.00 0.00 174.62 173.96 3i4n s SER 6 N 2.95 5.52 0.00 3.53 1.04 -1.26 -5.10 113.70 120.38 3i4n s SER 6 Ca 0.05 0.83 0.00 0.00 0.48 0.00 0.00 55.95 57.31 3i4n s SER 6 Cb -0.09 -1.75 0.00 0.00 0.10 0.00 0.00 66.02 64.28 3i4n s SER 6 CO -0.14 -1.17 0.00 1.07 0.98 0.00 0.00 173.24 173.98 3i4n n THR 7 N -2.73 0.00 -0.57 2.02 5.66 -1.26 -5.03 114.28 112.37 3i4n n THR 7 Ca 0.05 0.00 0.06 0.00 -3.05 0.00 0.00 64.05 61.12 3i4n n THR 7 Cb 0.58 -1.26 0.17 0.00 -1.55 0.00 0.00 70.33 68.26 3i4n n THR 7 CO 0.00 0.00 0.00 2.22 -3.05 0.00 0.00 175.07 174.24 3i4n n PHE 8 N 0.00 0.51 -4.15 1.09 1.16 -1.26 -4.96 117.46 109.85 3i4n n PHE 8 Ca 0.00 -0.70 -0.25 0.00 -1.87 0.00 0.00 57.45 54.63 3i4n n PHE 8 Cb 0.00 -0.15 -0.17 0.00 -1.61 0.00 0.00 39.48 37.55 3i4n n PHE 8 CO 0.00 0.00 0.00 1.14 -1.87 0.00 0.00 176.76 176.03 3i4n s GLN 9 N -1.91 1.39 -0.24 3.97 -2.07 -1.26 -4.79 119.66 114.74 3i4n s GLN 9 Ca 0.28 -0.25 -0.10 0.00 -1.82 0.00 0.00 55.36 53.47 3i4n s GLN 9 Cb 0.20 -1.35 -0.05 0.00 -1.09 0.00 0.00 33.01 30.72 3i4n s GLN 9 CO 0.09 -0.15 0.15 -0.08 -1.32 0.00 0.00 175.29 173.98 3i4n s THR 10 N 1.27 5.18 -0.20 3.63 -1.32 -1.26 -5.07 115.64 117.87 3i4n s THR 10 Ca -0.04 0.12 0.01 0.00 -1.21 0.00 0.00 61.69 60.57 3i4n s THR 10 Cb -0.14 -3.42 0.03 0.00 -1.51 0.00 0.00 72.50 67.46 3i4n s THR 10 CO -0.03 0.33 -0.16 -0.60 -2.21 0.00 0.00 174.62 171.96 3i4n s ARG 11 N 1.21 2.87 -0.73 7.08 3.52 -1.26 -5.03 118.95 126.61 3i4n s ARG 11 Ca 0.07 -0.92 -0.19 0.00 -0.13 0.00 0.00 55.73 54.56 3i4n s ARG 11 Cb -0.14 -2.71 -0.17 0.00 -1.56 0.00 0.00 34.95 30.37 3i4n s ARG 11 CO 0.05 -0.29 1.76 0.54 -0.81 0.00 0.00 175.30 176.55 3i4n n ARG 12 N 4.61 0.06 -1.25 5.12 5.12 -1.26 -4.81 116.66 124.24 3i4n n ARG 12 Ca -0.19 -1.17 -0.31 0.00 -1.93 0.00 0.00 57.85 54.25 3i4n n ARG 12 Cb 0.48 -3.02 -0.10 0.00 -1.16 0.00 0.00 32.46 28.66 3i4n n ARG 12 CO 0.00 0.00 0.00 2.89 -1.93 0.00 0.00 177.63 178.59 3i4n n ARG 13 N 7.02 0.54 -2.84 5.56 -4.01 -1.26 -4.87 116.66 116.81 3i4n n ARG 13 Ca 0.29 -1.64 -0.43 0.00 -1.04 0.00 0.00 57.85 55.03 3i4n n ARG 13 Cb 0.47 -3.29 -0.02 0.00 -3.04 0.00 0.00 32.46 26.58 3i4n n ARG 13 CO 0.00 0.00 0.00 1.03 -3.04 0.00 0.00 177.63 175.62 3i4n s ARG 14 N 7.16 3.74 0.00 2.89 0.52 -1.26 -4.78 118.95 127.22 3i4n s ARG 14 Ca 0.72 -1.85 0.00 0.00 -0.52 0.00 0.00 55.73 54.08 3i4n s ARG 14 Cb 0.05 -5.08 0.00 0.00 0.52 0.00 0.00 34.95 30.44 3i4n s ARG 14 CO 0.22 -1.89 0.00 -0.11 0.02 0.00 0.00 175.30 173.55 3i4n n LEU 15 N 6.90 0.00 -3.81 2.53 -0.00 -1.26 -4.73 117.00 116.64 3i4n n LEU 15 Ca 0.30 0.00 -0.41 0.00 -0.00 0.00 0.00 56.01 55.90 3i4n n LEU 15 Cb 0.48 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.86 3i4n n LEU 15 CO 0.58 0.00 2.18 2.29 -0.00 0.00 0.00 177.39 182.43 3i4n n LYS 16 N 0.00 1.93 0.00 1.96 2.85 -1.26 -4.68 118.16 118.95 3i4n n LYS 16 Ca 0.00 -2.17 0.05 0.00 -1.05 0.00 0.00 58.31 55.14 3i4n n LYS 16 Cb 0.00 -3.13 0.30 0.00 -0.65 0.00 0.00 35.03 31.55 3i4n n LYS 16 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 3i4n n LYS 17 N 7.01 0.42 -2.32 -1.58 4.81 -1.26 -4.70 118.16 120.53 3i4n n LYS 17 Ca 0.50 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.51 3i4n n LYS 17 Cb 0.41 -1.38 -0.03 0.00 0.02 0.00 0.00 35.03 34.05 3i4n n LYS 17 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 3i4n s VAL 18 N -2.00 3.87 0.00 3.15 -7.23 -1.26 -4.04 120.40 112.89 3i4n s VAL 18 Ca 0.15 1.28 0.00 0.00 -1.81 0.00 0.00 61.98 61.61 3i4n s VAL 18 Cb 0.07 -3.82 0.00 0.00 0.56 0.00 0.00 36.38 33.19 3i4n s VAL 18 CO 0.12 0.04 0.00 1.21 -0.31 0.00 0.00 175.10 176.15 3i4n n GLU 19 N 4.81 0.00 -0.41 4.82 4.07 -1.26 -5.08 120.64 127.58 3i4n n GLU 19 Ca 0.11 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.21 3i4n n GLU 19 Cb 0.45 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.83 3i4n n GLU 19 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 3i4n n GLU 20 N 0.00 0.00 -0.83 5.31 1.02 -1.26 -4.79 120.64 120.10 3i4n n GLU 20 Ca 0.00 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.79 3i4n n GLU 20 Cb 0.00 0.00 0.11 0.00 -0.02 0.00 0.00 31.44 31.53 3i4n n GLU 20 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 3i4n n GLU 21 N 0.39 -0.77 -4.06 3.49 0.00 -1.26 -4.99 120.64 113.44 3i4n n GLU 21 Ca 0.00 -0.21 -0.36 0.00 0.00 0.00 0.00 57.16 56.59 3i4n n GLU 21 Cb 0.00 -1.41 -0.08 0.00 0.00 0.00 0.00 31.44 29.95 3i4n n GLU 21 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.13 175.30 3i4n s GLU 22 N -2.83 3.39 0.45 3.44 1.03 -1.26 -5.02 118.70 117.90 3i4n s GLU 22 Ca 0.48 -0.26 -0.17 0.00 0.03 0.00 0.00 54.97 55.05 3i4n s GLU 22 Cb -0.05 -3.07 -0.09 0.00 -0.80 0.00 0.00 34.13 30.12 3i4n s GLU 22 CO 0.68 0.67 0.92 -0.80 -1.33 0.00 0.00 175.26 175.39 3i4n s ASN 23 N -0.74 6.75 -0.29 0.83 0.01 -1.26 -4.82 114.94 115.41 3i4n s ASN 23 Ca 0.12 1.53 -0.25 0.00 -0.71 0.00 0.00 52.86 53.55 3i4n s ASN 23 Cb -0.12 -2.48 0.18 0.00 0.41 0.00 0.00 41.25 39.24 3i4n s ASN 23 CO 0.03 -0.43 1.40 0.00 -1.51 0.00 0.00 177.10 176.58 3i4n s ALA 24 N -2.35 -2.20 -1.06 0.60 0.00 -0.99 -4.96 121.76 110.81 3i4n s ALA 24 Ca 0.59 1.70 0.00 0.00 0.00 0.00 0.00 51.96 54.25 3i4n s ALA 24 Cb -0.10 -1.73 0.00 0.00 0.00 0.00 0.00 23.12 21.29 3i4n s ALA 24 CO 0.23 -0.12 0.14 0.00 0.00 0.00 0.00 175.76 176.01 3i4n n ALA 25 N 1.60 1.42 0.69 0.00 0.00 -1.26 -2.28 120.51 120.68 3i4n n ALA 25 Ca -0.10 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.31 3i4n n ALA 25 Cb 0.57 -1.00 0.02 0.00 0.00 0.00 0.00 19.45 19.04 3i4n n ALA 25 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3i4n n THR 26 N 0.32 1.30 -0.97 0.00 -1.04 -1.26 -4.44 114.28 108.19 3i4n n THR 26 Ca 0.00 -0.26 -0.02 0.00 -2.04 0.00 0.00 64.05 61.73 3i4n n THR 26 Cb 0.06 -0.93 -0.01 0.00 -1.82 0.00 0.00 70.33 67.64 3i4n n THR 26 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3i4n n LEU 27 N 0.28 0.71 -4.37 -4.42 4.77 -1.10 -4.90 117.00 107.96 3i4n n LEU 27 Ca 0.08 0.04 -0.45 0.00 -0.03 0.00 0.00 56.01 55.65 3i4n n LEU 27 Cb 0.66 -2.35 -0.03 0.00 -2.33 0.00 0.00 43.42 39.37 3i4n n LEU 27 CO 0.08 -0.92 0.52 -1.10 -1.33 0.00 0.00 177.39 174.65 3i4n s GLN 28 N -1.97 3.33 0.15 3.23 -0.21 -0.97 -5.02 119.66 118.20 3i4n s GLN 28 Ca 0.00 -1.79 0.06 0.00 0.02 0.00 0.00 55.36 53.65 3i4n s GLN 28 Cb 0.00 -4.46 -0.04 0.00 1.00 0.00 0.00 33.01 29.51 3i4n s GLN 28 CO 0.00 -1.50 0.02 -0.51 -2.12 0.00 0.00 175.29 171.18 3i4n s LEU 29 N 1.85 3.44 0.85 2.90 1.43 -1.26 -2.34 118.68 125.55 3i4n s LEU 29 Ca 0.17 -0.28 -0.15 0.00 -1.03 0.00 0.00 54.13 52.84 3i4n s LEU 29 Cb -0.16 -2.11 -0.02 0.00 0.03 0.00 0.00 46.19 43.93 3i4n s LEU 29 CO -0.02 0.11 0.32 0.61 0.23 0.00 0.00 176.35 177.60 3i4n n GLY 30 N 0.05 -2.11 0.33 -3.19 0.00 -1.26 -4.68 105.19 94.33 3i4n n GLY 30 Ca -0.10 -0.58 0.27 0.00 0.00 0.00 0.00 46.02 45.60 3i4n n GLY 30 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3i4n h GLN 31 N -0.96 0.13 0.00 1.61 4.20 -2.00 0.26 115.11 118.36 3i4n h GLN 31 Ca -0.44 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.26 3i4n h GLN 31 Cb 1.32 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.07 3i4n h GLN 31 CO 0.37 0.09 0.00 -1.91 -0.67 0.00 0.00 178.83 176.71 3i4n n GLU 32 N -5.19 0.00 -1.96 1.46 4.07 -1.26 -1.49 120.64 116.26 3i4n n GLU 32 Ca 0.34 0.00 0.01 0.00 -0.06 0.00 0.00 57.16 57.44 3i4n n GLU 32 Cb 1.10 -1.47 0.03 0.00 -0.06 0.00 0.00 31.44 31.03 3i4n n GLU 32 CO 0.00 0.00 0.00 1.19 -0.06 0.00 0.00 177.13 178.26 3i4n n PHE 33 N -0.85 0.18 -1.32 4.31 3.01 0.91 -5.08 117.46 118.63 3i4n n PHE 33 Ca 0.00 -1.13 -0.31 0.00 1.01 0.00 0.00 57.45 57.02 3i4n n PHE 33 Cb 0.00 0.10 0.09 0.00 -0.01 0.00 0.00 39.48 39.65 3i4n n PHE 33 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 3i4n s GLN 34 N -1.17 2.33 0.48 -1.08 -0.21 -0.55 -4.79 119.66 114.67 3i4n s GLN 34 Ca 0.24 1.19 0.19 0.00 0.02 0.00 0.00 55.36 57.00 3i4n s GLN 34 Cb 0.32 -1.90 1.21 0.00 1.00 0.00 0.00 33.01 33.63 3i4n s GLN 34 CO -0.10 -1.59 2.01 1.25 -2.12 0.00 0.00 175.29 174.73 3i4n h LEU 35 N -0.99 0.17 -7.67 2.90 5.85 -1.95 -3.28 115.31 110.35 3i4n h LEU 35 Ca -0.44 0.00 -0.76 0.00 0.84 0.00 0.00 57.88 57.53 3i4n h LEU 35 Cb 1.23 -0.03 -0.30 0.00 0.37 0.00 0.00 40.66 41.93 3i4n h LEU 35 CO 0.52 0.10 0.00 -0.54 -0.34 0.00 0.00 178.44 178.18 3i4n s LYS 36 N -5.19 3.37 -0.02 1.25 1.02 -1.26 -1.45 119.74 117.46 3i4n s LYS 36 Ca -0.06 -2.67 -0.01 0.00 0.02 0.00 0.00 55.97 53.25 3i4n s LYS 36 Cb 0.19 -4.21 -0.04 0.00 -0.52 0.00 0.00 37.83 33.26 3i4n s LYS 36 CO 0.73 -1.25 0.06 1.14 -0.92 0.00 0.00 175.35 175.11 3i4n s GLN 37 N -0.26 3.02 -0.62 1.68 -2.07 -1.14 -4.96 119.66 115.32 3i4n s GLN 37 Ca 0.20 -0.48 -0.24 0.00 -1.82 0.00 0.00 55.36 53.03 3i4n s GLN 37 Cb -0.13 -2.83 0.05 0.00 -1.09 0.00 0.00 33.01 29.01 3i4n s GLN 37 CO -0.08 0.66 1.00 0.42 -1.32 0.00 0.00 175.29 175.98 3i4n s ILE 38 N -1.12 4.26 0.26 3.63 1.01 -1.26 -2.00 121.20 125.97 3i4n s ILE 38 Ca 0.20 0.05 -0.30 0.00 0.00 0.00 0.00 60.65 60.61 3i4n s ILE 38 Cb -0.12 -4.66 -0.14 0.00 0.01 0.00 0.00 42.46 37.56 3i4n s ILE 38 CO 0.11 -1.36 1.20 -3.20 0.00 0.00 0.00 174.94 171.68 3i4n n ASN 39 N 7.85 1.93 0.24 3.58 5.15 0.49 -4.73 115.26 129.76 3i4n n ASN 39 Ca -0.00 1.16 0.11 0.00 -0.60 0.00 0.00 54.58 55.26 3i4n n ASN 39 Cb 0.47 -1.34 0.44 0.00 -0.53 0.00 0.00 39.78 38.82 3i4n n ASN 39 CO 0.00 0.00 0.00 1.12 1.40 0.00 0.00 177.26 179.78 3i4n h HIS 40 N 3.00 0.00 0.00 1.20 2.07 -1.95 1.39 115.15 120.87 3i4n h HIS 40 Ca -0.43 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.09 3i4n h HIS 40 Cb 1.31 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.29 3i4n h HIS 40 CO 0.52 0.00 0.00 1.04 -3.07 0.00 0.00 177.93 176.42 3i4n n GLN 41 N -2.87 0.77 0.00 5.12 1.13 -1.26 -4.81 117.38 115.47 3i4n n GLN 41 Ca 0.03 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.09 3i4n n GLN 41 Cb 0.79 -1.16 0.00 0.00 0.11 0.00 0.00 30.24 29.99 3i4n n GLN 41 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3i4n n GLY 42 N 0.36 2.52 3.75 1.08 0.00 0.48 -4.98 105.19 108.40 3i4n n GLY 42 Ca 0.06 -0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 3i4n n GLY 42 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i4n n GLU 43 N 0.00 1.96 -1.26 1.61 1.02 -1.21 -4.64 120.64 118.12 3i4n n GLU 43 Ca 0.00 0.71 -0.29 0.00 -0.02 0.00 0.00 57.16 57.56 3i4n n GLU 43 Cb 0.00 -2.59 0.18 0.00 -0.02 0.00 0.00 31.44 29.01 3i4n n GLU 43 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3i4n s GLU 44 N -2.66 0.18 -0.30 3.49 2.02 -1.26 -0.38 118.70 119.80 3i4n s GLU 44 Ca 0.66 0.29 -0.16 0.00 0.02 0.00 0.00 54.97 55.78 3i4n s GLU 44 Cb -0.44 -1.73 0.19 0.00 0.10 0.00 0.00 34.13 32.26 3i4n s GLU 44 CO 0.53 -2.85 1.18 -2.00 0.02 0.00 0.00 175.26 172.15 3i4n s GLU 45 N -5.16 0.14 0.55 1.61 2.12 -0.85 -4.52 118.70 112.58 3i4n s GLU 45 Ca 0.67 0.25 -0.20 0.00 0.36 0.00 0.00 54.97 56.05 3i4n s GLU 45 Cb -0.15 0.05 -0.07 0.00 0.26 0.00 0.00 34.13 34.22 3i4n s GLU 45 CO 0.56 -0.03 0.85 -1.91 -0.54 0.00 0.00 175.26 174.19 3i4n n GLU 46 N 3.52 0.89 -0.79 4.30 2.13 -1.26 -2.88 120.64 126.54 3i4n n GLU 46 Ca -0.16 0.34 -0.32 0.00 0.66 0.00 0.00 57.16 57.68 3i4n n GLU 46 Cb 0.56 -2.01 0.10 0.00 0.27 0.00 0.00 31.44 30.37 3i4n n GLU 46 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 3i4n n LEU 47 N -0.14 -2.50 -3.74 4.31 -0.00 -0.53 -4.83 117.00 109.57 3i4n n LEU 47 Ca 0.12 -0.10 -0.30 0.00 -0.00 0.00 0.00 56.01 55.73 3i4n n LEU 47 Cb 0.45 -0.72 -0.14 0.00 -0.00 0.00 0.00 43.42 43.01 3i4n n LEU 47 CO 0.51 -2.79 -0.30 -0.63 -0.00 0.00 0.00 177.39 174.18 3i4n s ILE 48 N -2.11 1.17 -0.16 1.96 -1.09 -1.26 -4.95 121.20 114.76 3i4n s ILE 48 Ca 0.43 -1.93 -0.16 0.00 -2.23 0.00 0.00 60.65 56.75 3i4n s ILE 48 Cb -0.01 -1.85 -0.04 0.00 -1.58 0.00 0.00 42.46 38.97 3i4n s ILE 48 CO 0.59 -0.76 0.41 0.00 -1.23 0.00 0.00 174.94 173.95 3i4n s ALA 49 N 1.06 3.53 -0.11 9.38 0.00 -1.26 -5.07 121.76 129.29 3i4n s ALA 49 Ca 0.13 -0.36 0.01 0.00 0.00 0.00 0.00 51.96 51.73 3i4n s ALA 49 Cb -0.20 -2.59 -0.02 0.00 0.00 0.00 0.00 23.12 20.30 3i4n s ALA 49 CO -0.13 -0.10 -0.12 -0.51 0.00 0.00 0.00 175.76 174.90 3i4n s LEU 50 N 0.86 2.77 -0.10 0.00 1.43 -1.26 -4.86 118.68 117.53 3i4n s LEU 50 Ca 0.22 -0.27 -0.03 0.00 -1.03 0.00 0.00 54.13 53.02 3i4n s LEU 50 Cb -0.14 -1.61 -0.03 0.00 0.03 0.00 0.00 46.19 44.43 3i4n s LEU 50 CO 0.08 0.21 0.01 0.54 0.23 0.00 0.00 176.35 177.42 3i4n s ASN 51 N 0.06 5.25 0.16 2.29 2.20 -1.26 -4.86 114.94 118.78 3i4n s ASN 51 Ca -0.05 0.12 -0.08 0.00 -0.94 0.00 0.00 52.86 51.91 3i4n s ASN 51 Cb -0.14 -1.55 -0.06 0.00 -2.00 0.00 0.00 41.25 37.49 3i4n s ASN 51 CO 0.04 0.34 0.03 0.18 -2.94 0.00 0.00 177.10 174.76 3i4n n LEU 52 N 2.37 -1.13 0.00 3.54 4.77 -1.26 0.12 117.00 125.41 3i4n n LEU 52 Ca -0.18 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 3i4n n LEU 52 Cb 0.53 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 3i4n n LEU 52 CO 0.29 -1.65 0.00 -1.54 -1.33 0.00 0.00 177.39 173.16 3i4n n SER 53 N 0.92 0.00 0.21 -1.43 3.41 -1.26 -4.34 113.62 111.12 3i4n n SER 53 Ca 0.04 0.00 0.16 0.00 -0.26 0.00 0.00 58.87 58.81 3i4n n SER 53 Cb 0.16 0.00 0.80 0.00 -0.26 0.00 0.00 64.21 64.91 3i4n n SER 53 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3i4n h GLU 54 N 0.00 0.00 0.00 4.33 4.81 -0.61 0.20 114.58 123.30 3i4n h GLU 54 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 3i4n h GLU 54 Cb 0.00 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 3i4n h GLU 54 CO 0.00 0.00 -0.07 0.00 -0.73 0.00 0.00 179.01 178.21 3i4n h ALA 55 N 1.84 0.01 -1.09 2.92 0.00 -1.60 -3.13 119.26 118.21 3i4n h ALA 55 Ca 0.08 -0.52 0.30 0.00 0.00 0.00 0.00 54.91 54.77 3i4n h ALA 55 Cb 0.38 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 3i4n h ALA 55 CO -0.00 0.04 0.75 -0.09 0.00 0.00 0.00 179.25 179.95 3i4n h ARG 56 N -1.00 0.17 -0.16 0.00 2.43 -1.27 0.14 114.38 114.69 3i4n h ARG 56 Ca -0.02 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.04 3i4n h ARG 56 Cb 0.98 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.49 3i4n h ARG 56 CO -0.01 0.11 -0.28 -0.07 -1.51 0.00 0.00 179.97 178.21 3i4n h LEU 57 N 0.18 0.53 0.00 3.80 3.38 -0.77 -2.39 115.31 120.04 3i4n h LEU 57 Ca 0.57 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3i4n h LEU 57 Cb 1.87 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.47 3i4n h LEU 57 CO -0.14 0.97 0.00 0.52 0.09 0.00 0.00 178.44 179.87 3i4n n VAL 58 N -4.39 0.00 0.00 1.22 0.31 0.42 -1.06 118.33 114.82 3i4n n VAL 58 Ca -0.06 1.49 0.00 0.00 -0.01 0.00 0.00 64.34 65.75 3i4n n VAL 58 Cb 0.46 -2.36 0.00 0.00 -0.91 0.00 0.00 33.84 31.03 3i4n n VAL 58 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3i4n n ILE 59 N -2.20 0.00 -0.38 2.52 5.41 -0.70 -0.19 119.36 123.81 3i4n n ILE 59 Ca 0.00 1.23 0.30 0.00 1.00 0.00 0.00 62.75 65.29 3i4n n ILE 59 Cb 0.00 -1.68 0.58 0.00 -0.71 0.00 0.00 39.64 37.83 3i4n n ILE 59 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 3i4n h LYS 60 N 0.00 0.21 0.72 0.38 3.64 -1.46 0.30 116.57 120.37 3i4n h LYS 60 Ca 0.00 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 3i4n h LYS 60 Cb 0.00 -0.05 0.01 0.00 -0.41 0.00 0.00 32.23 31.78 3i4n h LYS 60 CO 0.00 0.14 -0.35 1.49 -2.27 0.00 0.00 179.45 178.47 3i4n h GLU 61 N 0.22 -0.93 0.00 1.90 4.81 0.11 -1.65 114.58 119.04 3i4n h GLU 61 Ca 0.72 0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.99 3i4n h GLU 61 Cb 2.08 0.21 -0.00 0.00 0.63 0.00 0.00 28.75 31.67 3i4n h GLU 61 CO -0.38 -0.62 -0.14 0.00 -0.73 0.00 0.00 179.01 177.13 3i4n h ALA 62 N -1.41 1.01 0.00 2.92 0.00 -1.06 -0.38 119.26 120.34 3i4n h ALA 62 Ca -0.10 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3i4n h ALA 62 Cb 0.74 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3i4n h ALA 62 CO 0.16 0.18 0.00 1.25 0.00 0.00 0.00 179.25 180.84 3i4n h LEU 63 N 0.00 0.00 0.00 0.00 7.12 -0.33 0.10 115.31 122.21 3i4n h LEU 63 Ca -0.00 0.00 -0.37 0.00 0.13 0.00 0.00 57.88 57.64 3i4n h LEU 63 Cb 0.68 0.00 -0.06 0.00 -0.53 0.00 0.00 40.66 40.75 3i4n h LEU 63 CO 0.02 0.00 -2.36 0.52 -0.13 0.00 0.00 178.44 176.48 3i4n n VAL 64 N -2.92 1.37 0.27 1.05 0.31 -0.63 -3.99 118.33 113.79 3i4n n VAL 64 Ca 0.01 -0.50 0.17 0.00 -0.01 0.00 0.00 64.34 64.02 3i4n n VAL 64 Cb 0.29 -1.42 0.90 0.00 -0.91 0.00 0.00 33.84 32.70 3i4n n VAL 64 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3i4n h GLU 65 N -0.14 0.00 -0.01 5.55 4.81 -0.96 0.50 114.58 124.33 3i4n h GLU 65 Ca -0.55 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 58.44 3i4n h GLU 65 Cb 1.79 0.00 0.01 0.00 0.63 0.00 0.00 28.75 31.17 3i4n h GLU 65 CO -0.13 0.00 -0.96 -0.09 -0.73 0.00 0.00 179.01 177.10 3i4n h ARG 66 N 0.00 0.54 -0.02 1.92 2.43 -0.95 -3.02 114.38 115.28 3i4n h ARG 66 Ca 0.00 -0.56 0.01 0.00 -0.81 0.00 0.00 59.98 58.61 3i4n h ARG 66 Cb 0.07 0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.77 3i4n h ARG 66 CO 0.00 1.19 0.04 -0.09 -1.51 0.00 0.00 179.97 179.60 3i4n h ARG 67 N 0.31 0.00 0.28 0.20 2.43 -0.11 -2.35 114.38 115.13 3i4n h ARG 67 Ca -0.09 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.06 3i4n h ARG 67 Cb 1.60 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.15 3i4n h ARG 67 CO 0.18 0.00 -0.13 0.00 -1.51 0.00 0.00 179.97 178.50 3i4n h ARG 68 N 0.00 -0.36 0.00 0.20 3.08 -1.43 -3.11 114.38 112.76 3i4n h ARG 68 Ca 0.01 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.09 3i4n h ARG 68 Cb 0.09 0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.22 3i4n h ARG 68 CO -0.00 -0.11 0.00 0.00 -1.07 0.00 0.00 179.97 178.79 3i4n n ALA 69 N -2.68 1.93 0.67 0.04 0.00 -1.06 0.44 120.51 119.85 3i4n n ALA 69 Ca -0.06 -0.04 0.10 0.00 0.00 0.00 0.00 53.44 53.43 3i4n n ALA 69 Cb 0.21 -1.10 0.10 0.00 0.00 0.00 0.00 19.45 18.66 3i4n n ALA 69 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3i4n n PHE 70 N -0.75 0.10 -0.15 0.00 3.01 -0.91 -4.27 117.46 114.48 3i4n n PHE 70 Ca 0.05 -0.06 0.00 0.00 1.01 0.00 0.00 57.45 58.45 3i4n n PHE 70 Cb 0.02 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.49 3i4n n PHE 70 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3i4n n LYS 71 N 1.11 0.29 0.06 -1.08 5.02 0.12 -4.65 118.16 119.04 3i4n n LYS 71 Ca 0.12 -0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.40 3i4n n LYS 71 Cb 0.49 -0.11 0.27 0.00 -0.02 0.00 0.00 35.03 35.67 3i4n n LYS 71 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3i4n h ARG 72 N 0.00 0.37 -0.64 1.97 3.08 -0.19 -2.48 114.38 116.49 3i4n h ARG 72 Ca 0.00 -0.12 -0.43 0.00 0.07 0.00 0.00 59.98 59.50 3i4n h ARG 72 Cb 0.08 -0.03 -0.28 0.00 0.08 0.00 0.00 29.97 29.82 3i4n h ARG 72 CO 0.00 0.57 -0.22 -1.13 -1.07 0.00 0.00 179.97 178.13 3i4n n SER 73 N -4.16 4.51 -0.65 7.04 3.41 -1.26 -4.38 113.62 118.13 3i4n n SER 73 Ca -0.00 -3.78 0.07 0.00 -0.26 0.00 0.00 58.87 54.89 3i4n n SER 73 Cb 0.36 -0.58 0.11 0.00 -0.26 0.00 0.00 64.21 63.84 3i4n n SER 73 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i4n n GLN 74 N -0.91 1.62 -0.00 4.33 6.02 -0.93 -4.11 117.38 123.39 3i4n n GLN 74 Ca 0.43 -1.64 0.02 0.00 -0.01 0.00 0.00 57.00 55.80 3i4n n GLN 74 Cb 0.92 -1.29 -0.04 0.00 1.02 0.00 0.00 30.24 30.85 3i4n n GLN 74 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3i4n n LYS 75 N 0.79 0.38 -0.05 -1.09 5.02 -1.26 -5.07 118.16 116.88 3i4n n LYS 75 Ca 0.10 -0.04 -0.06 0.00 -2.02 0.00 0.00 58.31 56.29 3i4n n LYS 75 Cb 0.39 -1.11 -0.07 0.00 -0.02 0.00 0.00 35.03 34.23 3i4n n LYS 75 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3i4n n LYS 76 N -1.70 1.50 0.00 1.97 5.02 -1.26 -5.20 118.16 118.49 3i4n n LYS 76 Ca -0.01 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 3i4n n LYS 76 Cb 0.16 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 3i4n n LYS 76 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3i4n n SER 116 N -2.58 0.00 -4.90 4.39 3.41 -1.26 -4.88 113.62 107.80 3i4n n SER 116 Ca -0.18 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.14 3i4n n SER 116 Cb 0.78 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.69 3i4n n SER 116 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3i4n s GLU 117 N 0.00 3.65 0.00 4.33 2.02 -1.26 -4.95 118.70 122.49 3i4n s GLU 117 Ca 0.00 0.03 0.00 0.00 0.02 0.00 0.00 54.97 55.02 3i4n s GLU 117 Cb 0.00 -2.66 0.00 0.00 0.10 0.00 0.00 34.13 31.57 3i4n s GLU 117 CO 0.00 0.25 0.40 0.25 0.02 0.00 0.00 175.26 176.17 3i4n n THR 118 N -0.76 0.00 0.00 3.63 -2.24 -1.26 -5.01 114.28 108.63 3i4n n THR 118 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 3i4n n THR 118 Cb 0.54 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 3i4n n THR 118 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3i4n n ARG 119 N 0.00 0.00 0.20 -0.78 0.63 -1.26 -1.23 116.66 114.22 3i4n n ARG 119 Ca -0.04 0.00 0.05 0.00 -0.92 0.00 0.00 57.85 56.94 3i4n n ARG 119 Cb 0.37 0.00 0.41 0.00 0.45 0.00 0.00 32.46 33.69 3i4n n ARG 119 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 3i4n h GLU 120 N 0.00 0.00 -0.25 -0.14 4.81 -1.98 -2.68 114.58 114.34 3i4n h GLU 120 Ca 0.00 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.06 3i4n h GLU 120 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3i4n h GLU 120 CO 0.00 0.34 -0.50 0.87 -0.73 0.00 0.00 179.01 179.00 3i4n h LYS 121 N 0.00 0.79 -0.75 1.92 1.57 -1.58 -3.19 116.57 115.32 3i4n h LYS 121 Ca -0.00 -0.51 -0.03 0.00 -1.87 0.00 0.00 60.65 58.24 3i4n h LYS 121 Cb 0.69 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.03 3i4n h LYS 121 CO 0.04 1.13 0.35 1.49 -0.57 0.00 0.00 179.45 181.90 3i4n h GLU 122 N 0.54 1.09 -0.52 3.15 4.81 -1.70 -1.49 114.58 120.46 3i4n h GLU 122 Ca 0.01 -0.17 0.15 0.00 -0.13 0.00 0.00 59.36 59.22 3i4n h GLU 122 Cb 1.10 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.27 3i4n h GLU 122 CO 0.11 0.86 0.55 -0.07 -0.73 0.00 0.00 179.01 179.73 3i4n h LEU 123 N 1.06 0.00 0.00 1.64 3.38 -1.47 0.53 115.31 120.46 3i4n h LEU 123 Ca 0.26 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.92 3i4n h LEU 123 Cb 0.14 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.83 3i4n h LEU 123 CO -0.03 0.00 -1.98 1.21 0.09 0.00 0.00 178.44 177.73 3i4n n GLU 124 N -3.69 0.66 -0.05 1.13 2.13 -0.72 -3.14 120.64 116.96 3i4n n GLU 124 Ca 0.10 0.14 -0.12 0.00 0.66 0.00 0.00 57.16 57.94 3i4n n GLU 124 Cb 0.75 -1.67 -0.07 0.00 0.27 0.00 0.00 31.44 30.72 3i4n n GLU 124 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 3i4n h SER 125 N 0.00 0.28 0.32 4.31 4.64 0.80 -2.87 113.55 121.02 3i4n h SER 125 Ca -0.38 -0.41 -0.11 0.00 -0.47 0.00 0.00 61.79 60.42 3i4n h SER 125 Cb 2.04 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 64.04 3i4n h SER 125 CO 0.05 0.63 -0.45 0.40 -0.87 0.00 0.00 176.83 176.59 3i4n h ILE 126 N -0.07 1.32 -0.76 0.95 2.04 -0.49 -2.58 117.51 117.93 3i4n h ILE 126 Ca 0.03 -1.59 0.12 0.00 1.00 0.00 0.00 64.86 64.42 3i4n h ILE 126 Cb 0.52 1.77 -0.05 0.00 -0.74 0.00 0.00 36.82 38.32 3i4n h ILE 126 CO 0.02 0.47 0.50 0.44 0.00 0.00 0.00 178.15 179.57 3i4n h ASP 127 N 0.14 0.53 0.09 1.72 3.45 -1.46 -0.44 116.42 120.45 3i4n h ASP 127 Ca 0.01 0.02 -0.15 0.00 0.43 0.00 0.00 57.03 57.34 3i4n h ASP 127 Cb 0.84 -0.09 0.01 0.00 -0.56 0.00 0.00 39.33 39.53 3i4n h ASP 127 CO 0.07 0.30 -0.73 0.58 -1.57 0.00 0.00 179.24 177.89 3i4n h VAL 128 N 0.58 1.46 -1.20 -1.35 2.07 -1.34 -3.02 116.25 113.44 3i4n h VAL 128 Ca 0.36 -2.43 0.34 0.00 0.82 0.00 0.00 66.70 65.79 3i4n h VAL 128 Cb 0.61 3.09 -0.07 0.00 -1.52 0.00 0.00 31.29 33.40 3i4n h VAL 128 CO -0.13 0.65 0.83 0.25 0.02 0.00 0.00 177.57 179.19 3i4n h LEU 129 N -0.59 0.17 0.45 2.57 5.85 -1.02 0.28 115.31 123.02 3i4n h LEU 129 Ca -0.15 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.59 3i4n h LEU 129 Cb 1.45 0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.51 3i4n h LEU 129 CO 0.06 0.01 -0.22 -0.07 -0.34 0.00 0.00 178.44 177.88 3i4n h LEU 130 N 0.13 -0.51 -2.21 2.25 3.38 -1.12 -2.90 115.31 114.33 3i4n h LEU 130 Ca 0.62 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.50 3i4n h LEU 130 Cb 2.14 0.13 0.00 0.00 0.09 0.00 0.00 40.66 43.03 3i4n h LEU 130 CO -0.14 -0.11 0.00 -0.62 0.09 0.00 0.00 178.44 177.66 3i4n n GLU 131 N -5.21 0.05 0.11 1.13 1.02 0.99 -1.74 120.64 116.99 3i4n n GLU 131 Ca -0.10 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 3i4n n GLU 131 Cb 0.29 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.24 3i4n n GLU 131 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3i4n n GLN 132 N 1.08 0.00 -0.09 3.49 6.02 -1.19 -4.94 117.38 121.75 3i4n n GLN 132 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.07 3i4n n GLN 132 Cb 0.03 0.00 0.12 0.00 1.02 0.00 0.00 30.24 31.40 3i4n n GLN 132 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3i4n n THR 133 N -3.17 0.36 -2.65 5.09 -2.24 -1.10 -5.00 114.28 105.57 3i4n n THR 133 Ca 0.00 -0.68 -0.06 0.00 -2.27 0.00 0.00 64.05 61.04 3i4n n THR 133 Cb 0.00 1.03 0.03 0.00 -2.10 0.00 0.00 70.33 69.28 3i4n n THR 133 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3i4n n THR 134 N 0.87 0.00 0.14 4.28 -1.04 -0.71 -4.99 114.28 112.83 3i4n n THR 134 Ca 0.11 -0.49 0.11 0.00 -2.04 0.00 0.00 64.05 61.75 3i4n n THR 134 Cb 0.42 -1.07 -0.04 0.00 -1.82 0.00 0.00 70.33 67.82 3i4n n THR 134 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3i4n n GLY 135 N 2.91 -1.30 2.71 3.41 0.00 -1.26 -4.99 105.19 106.68 3i4n n GLY 135 Ca 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.73 3i4n n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4n n GLY 136 N 1.23 2.05 0.10 -0.02 0.00 -1.26 -4.41 105.19 102.88 3i4n n GLY 136 Ca -0.01 -0.29 0.04 0.00 0.00 0.00 0.00 46.02 45.75 3i4n n GLY 136 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3i4n n ASN 137 N 3.82 0.30 -1.57 1.61 2.04 -1.26 -4.05 115.26 116.14 3i4n n ASN 137 Ca 0.00 -1.83 -0.01 0.00 -0.44 0.00 0.00 54.58 52.30 3i4n n ASN 137 Cb 0.00 -0.03 -0.01 0.00 -2.53 0.00 0.00 39.78 37.21 3i4n n ASN 137 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 3i4n n ASN 138 N -0.42 4.89 -0.30 0.53 2.85 -1.26 -4.66 115.26 116.89 3i4n n ASN 138 Ca 0.06 -2.30 0.26 0.00 -0.11 0.00 0.00 54.58 52.49 3i4n n ASN 138 Cb 0.07 -1.05 0.44 0.00 1.24 0.00 0.00 39.78 40.48 3i4n n ASN 138 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 3i4n n LYS 139 N 1.59 -0.02 0.00 1.20 3.00 -1.26 -1.20 118.16 121.47 3i4n n LYS 139 Ca 0.02 0.81 0.00 0.00 -0.00 0.00 0.00 58.31 59.14 3i4n n LYS 139 Cb 0.48 -1.59 0.00 0.00 0.00 0.00 0.00 35.03 33.92 3i4n n LYS 139 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 3i4n n ASP 140 N -3.96 0.00 -0.27 3.14 8.00 -1.26 -2.56 116.55 119.64 3i4n n ASP 140 Ca 0.26 0.85 0.24 0.00 0.71 0.00 0.00 54.79 56.85 3i4n n ASP 140 Cb 1.01 -0.38 0.44 0.00 -0.02 0.00 0.00 41.12 42.17 3i4n n ASP 140 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 3i4n n LEU 141 N -1.63 0.22 -0.06 0.64 7.94 -0.34 0.19 117.00 123.96 3i4n n LEU 141 Ca 0.00 1.37 -0.11 0.00 -1.11 0.00 0.00 56.01 56.16 3i4n n LEU 141 Cb 0.00 -0.64 -0.05 0.00 0.53 0.00 0.00 43.42 43.27 3i4n n LEU 141 CO 0.00 -1.51 0.83 0.50 -1.11 0.00 0.00 177.39 176.10 3i4n h LYS 142 N 0.00 0.30 -0.10 1.96 3.64 -1.57 -1.51 116.57 119.30 3i4n h LYS 142 Ca 0.66 -0.07 -0.10 0.00 -1.27 0.00 0.00 60.65 59.88 3i4n h LYS 142 Cb 1.69 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.46 3i4n h LYS 142 CO -0.66 0.41 -0.37 -0.91 -2.27 0.00 0.00 179.45 175.65 3i4n h ASN 143 N 0.14 0.21 1.03 4.20 2.35 0.24 -1.21 115.58 122.54 3i4n h ASN 143 Ca 0.06 -0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 3i4n h ASN 143 Cb 0.23 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.54 3i4n h ASN 143 CO -0.00 0.57 -0.06 0.74 -1.65 0.00 0.00 177.43 177.03 3i4n h THR 144 N 0.18 0.15 0.04 2.81 2.02 0.03 -0.73 112.91 117.41 3i4n h THR 144 Ca 0.02 -0.69 -0.16 0.00 0.77 0.00 0.00 66.41 66.35 3i4n h THR 144 Cb 0.74 1.59 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 3i4n h THR 144 CO 0.06 0.06 -0.84 0.24 0.37 0.00 0.00 175.52 175.41 3i4n h MET 145 N 0.00 0.08 -0.41 6.66 2.86 -0.59 -1.87 114.93 121.66 3i4n h MET 145 Ca -0.00 -0.14 0.02 0.00 -2.06 0.00 0.00 59.70 57.52 3i4n h MET 145 Cb 0.59 0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.27 3i4n h MET 145 CO 0.01 1.07 0.23 1.96 1.06 0.00 0.00 176.91 181.23 3i4n h GLN 146 N -0.78 0.45 -0.28 1.72 4.20 -1.18 1.47 115.11 120.71 3i4n h GLN 146 Ca -0.20 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.47 3i4n h GLN 146 Cb 1.34 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 29.01 3i4n h GLN 146 CO -0.04 0.30 0.14 -0.92 -0.67 0.00 0.00 178.83 177.63 3i4n h TYR 147 N 0.46 0.41 0.00 2.96 3.20 -1.28 -1.06 116.97 121.66 3i4n h TYR 147 Ca 0.17 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.01 3i4n h TYR 147 Cb 0.04 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 38.18 3i4n h TYR 147 CO -0.08 0.37 -0.06 1.25 -1.64 0.00 0.00 178.16 177.99 3i4n h LEU 148 N 0.33 0.00 0.07 2.82 6.46 -0.38 -1.78 115.31 122.82 3i4n h LEU 148 Ca 0.10 0.00 -0.31 0.00 -0.12 0.00 0.00 57.88 57.55 3i4n h LEU 148 Cb 0.11 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.01 3i4n h LEU 148 CO -0.01 0.06 -1.71 0.74 -0.62 0.00 0.00 178.44 176.89 3i4n h THR 149 N 0.00 0.90 0.00 1.05 2.02 0.24 -1.75 112.91 115.38 3i4n h THR 149 Ca -0.00 -2.65 -0.04 0.00 0.77 0.00 0.00 66.41 64.49 3i4n h THR 149 Cb 0.48 2.55 0.00 0.00 -1.74 0.00 0.00 68.15 69.45 3i4n h THR 149 CO 0.01 0.71 -0.16 0.78 0.37 0.00 0.00 175.52 177.23 3i4n h ASN 150 N 0.04 0.13 0.26 4.18 2.35 -1.15 -3.34 115.58 118.05 3i4n h ASN 150 Ca -0.30 -0.81 0.00 0.00 -0.55 0.00 0.00 56.30 54.64 3i4n h ASN 150 Cb 2.01 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 40.34 3i4n h ASN 150 CO 0.11 0.93 -0.15 0.49 -1.65 0.00 0.00 177.43 177.15 3i4n n PHE 151 N -4.57 0.00 -1.66 1.19 3.01 -0.68 -4.92 117.46 109.83 3i4n n PHE 151 Ca -0.10 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 57.97 3i4n n PHE 151 Cb 0.47 -0.13 0.04 0.00 -0.01 0.00 0.00 39.48 39.85 3i4n n PHE 151 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 3i4n n SER 152 N -0.71 1.61 -0.07 4.37 3.41 -0.66 -4.84 113.62 116.73 3i4n n SER 152 Ca 0.14 0.93 -0.05 0.00 -0.26 0.00 0.00 58.87 59.63 3i4n n SER 152 Cb 0.31 -1.45 -0.02 0.00 -0.26 0.00 0.00 64.21 62.79 3i4n n SER 152 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3i4n h ARG 153 N 1.12 0.00 -4.36 4.33 2.43 -1.88 -3.45 114.38 112.57 3i4n h ARG 153 Ca -0.48 0.00 -0.72 0.00 -0.81 0.00 0.00 59.98 57.96 3i4n h ARG 153 Cb 1.33 0.00 -0.28 0.00 -0.42 0.00 0.00 29.97 30.60 3i4n h ARG 153 CO 0.55 0.05 -0.42 -0.06 -1.51 0.00 0.00 179.97 178.58 3i4n s PHE 154 N -2.20 3.37 -1.27 2.20 0.40 -1.26 -4.38 117.98 114.84 3i4n s PHE 154 Ca -0.15 -1.65 -0.08 0.00 -0.60 0.00 0.00 56.93 54.45 3i4n s PHE 154 Cb 0.02 -3.25 -0.03 0.00 0.51 0.00 0.00 43.02 40.27 3i4n s PHE 154 CO 0.22 -0.92 2.84 0.54 0.70 0.00 0.00 175.22 178.61 3i4n n ARG 155 N 4.94 3.72 -3.64 0.44 1.74 -1.26 -4.74 116.66 117.85 3i4n n ARG 155 Ca -0.09 -2.48 -0.04 0.00 -0.77 0.00 0.00 57.85 54.47 3i4n n ARG 155 Cb 0.42 -2.61 -0.07 0.00 -1.02 0.00 0.00 32.46 29.18 3i4n n ARG 155 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3i4n s ASP 156 N 1.45 -0.62 0.16 0.55 -1.08 -1.26 -4.85 116.67 111.02 3i4n s ASP 156 Ca 0.64 0.99 -0.21 0.00 -0.52 0.00 0.00 52.55 53.45 3i4n s ASP 156 Cb 0.21 1.25 0.06 0.00 -1.46 0.00 0.00 42.92 42.97 3i4n s ASP 156 CO -0.08 -0.16 1.63 -0.61 0.52 0.00 0.00 175.17 176.48 3i4n h GLN 157 N 6.25 -0.19 0.66 4.34 5.75 -2.00 -1.49 115.11 128.44 3i4n h GLN 157 Ca -0.29 0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.20 3i4n h GLN 157 Cb 1.20 0.04 -0.00 0.00 1.07 0.00 0.00 27.48 29.79 3i4n h GLN 157 CO 0.19 -0.12 -0.37 0.93 -2.65 0.00 0.00 178.83 176.80 3i4n h GLU 158 N -0.19 -0.92 -1.10 1.69 5.08 -1.98 -1.16 114.58 116.00 3i4n h GLU 158 Ca 0.16 0.06 0.32 0.00 -1.00 0.00 0.00 59.36 58.90 3i4n h GLU 158 Cb 0.44 0.21 -0.11 0.00 0.50 0.00 0.00 28.75 29.79 3i4n h GLU 158 CO -0.42 -0.61 0.69 1.79 -1.00 0.00 0.00 179.01 179.46 3i4n h THR 159 N -0.96 0.39 -0.05 1.13 1.35 -1.91 0.27 112.91 113.13 3i4n h THR 159 Ca -0.08 -0.11 -0.03 0.00 -0.55 0.00 0.00 66.41 65.64 3i4n h THR 159 Cb 0.76 0.04 -0.00 0.00 -1.73 0.00 0.00 68.15 67.22 3i4n h THR 159 CO 0.11 0.06 -0.08 0.58 -0.25 0.00 0.00 175.52 175.93 3i4n h VAL 160 N 0.32 1.41 -0.93 6.82 2.07 -0.67 -1.56 116.25 123.72 3i4n h VAL 160 Ca 0.68 -1.35 0.01 0.00 0.82 0.00 0.00 66.70 66.86 3i4n h VAL 160 Cb 1.78 2.19 -0.05 0.00 -1.52 0.00 0.00 31.29 33.69 3i4n h VAL 160 CO -0.39 0.37 0.61 1.23 0.02 0.00 0.00 177.57 179.41 3i4n h GLY 161 N -0.34 1.30 0.60 2.17 0.00 0.22 -1.41 103.07 105.61 3i4n h GLY 161 Ca 0.00 -0.48 0.03 0.00 0.00 0.00 0.00 47.33 46.88 3i4n h GLY 161 CO 0.02 0.47 -0.16 0.00 0.00 0.00 0.00 176.54 176.87 3i4n h ALA 162 N 1.43 -0.20 -0.32 3.60 0.00 -0.48 0.13 119.26 123.42 3i4n h ALA 162 Ca 0.34 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.33 3i4n h ALA 162 Cb -0.13 0.29 -0.08 0.00 0.00 0.00 0.00 17.79 17.86 3i4n h ALA 162 CO -0.08 -0.66 -0.32 0.28 0.00 0.00 0.00 179.25 178.48 3i4n h VAL 163 N -0.27 0.25 -0.27 0.00 2.07 -0.36 -1.65 116.25 116.03 3i4n h VAL 163 Ca 0.05 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.55 3i4n h VAL 163 Cb 0.34 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 3i4n h VAL 163 CO -0.16 0.00 0.05 0.40 0.02 0.00 0.00 177.57 177.88 3i4n h ILE 164 N -0.29 1.14 -0.64 4.57 2.04 -0.72 0.36 117.51 123.96 3i4n h ILE 164 Ca 0.15 -0.50 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 3i4n h ILE 164 Cb 0.53 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 3i4n h ILE 164 CO -0.48 0.18 0.30 1.56 0.00 0.00 0.00 178.15 179.70 3i4n h GLN 165 N 0.38 0.91 0.33 2.37 4.20 0.16 0.03 115.11 123.48 3i4n h GLN 165 Ca 0.09 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 3i4n h GLN 165 Cb 0.18 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.79 3i4n h GLN 165 CO -0.00 0.71 -0.16 1.25 -0.67 0.00 0.00 178.83 179.96 3i4n h LEU 166 N 0.90 -0.38 0.00 1.46 5.85 -0.60 -3.40 115.31 119.15 3i4n h LEU 166 Ca 0.22 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.95 3i4n h LEU 166 Cb 0.11 0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.24 3i4n h LEU 166 CO -0.03 -0.05 0.00 0.18 -0.34 0.00 0.00 178.44 178.20 3i4n n LEU 167 N -4.40 0.00 -4.56 2.25 4.77 0.11 -4.10 117.00 111.07 3i4n n LEU 167 Ca -0.06 0.85 -0.15 0.00 -0.03 0.00 0.00 56.01 56.63 3i4n n LEU 167 Cb 0.18 -0.35 -0.07 0.00 -2.33 0.00 0.00 43.42 40.84 3i4n n LEU 167 CO 0.13 -0.35 1.21 -0.54 -1.33 0.00 0.00 177.39 176.51 3i4n s LYS 168 N -2.41 1.62 0.00 3.23 1.02 -0.01 -2.50 119.74 120.69 3i4n s LYS 168 Ca 0.00 0.31 0.00 0.00 0.02 0.00 0.00 55.97 56.30 3i4n s LYS 168 Cb 0.00 -4.83 0.00 0.00 -0.52 0.00 0.00 37.83 32.48 3i4n s LYS 168 CO 0.00 -4.51 0.00 -1.13 -0.92 0.00 0.00 175.35 168.79 3i4n n SER 169 N 18.45 0.00 0.00 2.83 3.41 -1.26 -4.68 113.62 132.38 3i4n n SER 169 Ca 0.46 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.07 3i4n n SER 169 Cb 0.44 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 3i4n n SER 169 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3i4n n THR 170 N 0.00 0.00 -0.39 6.66 -1.04 -1.04 -4.98 114.28 113.48 3i4n n THR 170 Ca 0.00 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 3i4n n THR 170 Cb 0.00 0.62 0.00 0.00 -1.82 0.00 0.00 70.33 69.13 3i4n n THR 170 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3i4n n GLY 171 N 0.92 2.20 3.77 3.41 0.00 -1.26 -4.97 105.19 109.25 3i4n n GLY 171 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3i4n n GLY 171 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i4n s LEU 172 N 0.00 4.29 0.20 0.99 1.43 -1.26 -4.95 118.68 119.38 3i4n s LEU 172 Ca 0.00 2.58 -0.32 0.00 -1.03 0.00 0.00 54.13 55.36 3i4n s LEU 172 Cb 0.00 -3.83 -0.14 0.00 0.03 0.00 0.00 46.19 42.25 3i4n s LEU 172 CO 0.00 -0.68 1.44 1.57 0.23 0.00 0.00 176.35 178.91 3i4n n HIS 173 N 0.38 2.10 -0.22 0.29 -0.00 -1.26 -4.63 115.22 111.89 3i4n n HIS 173 Ca 0.02 0.41 0.31 0.00 -0.00 0.00 0.00 57.72 58.47 3i4n n HIS 173 Cb 0.44 -2.47 0.67 0.00 -0.00 0.00 0.00 29.99 28.63 3i4n n HIS 173 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 3i4n h PRO 174 N 4.69 0.00 -0.61 1.57 0.11 -1.92 0.49 132.00 136.33 3i4n h PRO 174 Ca -0.45 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 3i4n h PRO 174 Cb 1.28 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.36 3i4n h PRO 174 CO 0.79 0.00 0.33 0.35 -0.21 0.00 0.00 178.00 179.26 3i4n h PHE 175 N 0.00 0.85 0.28 0.65 3.57 -1.95 0.17 116.94 120.50 3i4n h PHE 175 Ca 0.48 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.95 3i4n h PHE 175 Cb 2.32 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 40.79 3i4n h PHE 175 CO 0.00 0.61 -0.13 0.93 -2.23 0.00 0.00 178.31 177.49 3i4n h GLU 176 N 0.83 -0.36 -1.66 1.11 5.08 -0.39 -0.79 114.58 118.40 3i4n h GLU 176 Ca 0.21 0.02 0.48 0.00 -1.00 0.00 0.00 59.36 59.08 3i4n h GLU 176 Cb 0.05 0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.32 3i4n h GLU 176 CO -0.03 -0.01 1.19 0.28 -1.00 0.00 0.00 179.01 179.43 3i4n h VAL 177 N -0.87 0.16 0.01 3.13 2.07 -1.04 0.40 116.25 120.12 3i4n h VAL 177 Ca -0.04 -0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 3i4n h VAL 177 Cb 0.51 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 3i4n h VAL 177 CO 0.06 0.00 -0.01 0.00 0.02 0.00 0.00 177.57 177.65 3i4n h ALA 178 N 1.18 -0.15 -0.77 1.67 0.00 -0.37 -3.24 119.26 117.58 3i4n h ALA 178 Ca 0.79 -0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.87 3i4n h ALA 178 Cb 3.16 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 20.82 3i4n h ALA 178 CO -0.02 -0.15 -0.12 1.96 0.00 0.00 0.00 179.25 180.92 3i4n h GLN 179 N -0.09 0.03 0.00 0.00 1.08 0.56 0.96 115.11 117.65 3i4n h GLN 179 Ca -0.00 -0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3i4n h GLN 179 Cb 0.01 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.44 3i4n h GLN 179 CO 0.00 0.02 -0.00 -0.07 -0.95 0.00 0.00 178.83 177.83 3i4n h LEU 180 N 0.03 0.00 0.00 1.46 3.38 -0.50 -0.22 115.31 119.46 3i4n h LEU 180 Ca 0.39 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 58.16 3i4n h LEU 180 Cb 0.65 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 3i4n h LEU 180 CO -0.76 0.00 -1.11 1.23 0.09 0.00 0.00 178.44 177.89 3i4n h GLY 181 N 0.04 0.00 1.40 0.83 0.00 0.85 -3.39 103.07 102.79 3i4n h GLY 181 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3i4n h GLY 181 CO 0.00 0.00 -0.07 -1.14 0.00 0.00 0.00 176.54 175.33 3i4n n SER 182 N -4.45 0.19 -4.14 0.19 3.41 -0.22 -4.71 113.62 103.88 3i4n n SER 182 Ca -0.30 -0.17 -0.34 0.00 -0.26 0.00 0.00 58.87 57.81 3i4n n SER 182 Cb 0.66 -0.22 -0.14 0.00 -0.26 0.00 0.00 64.21 64.25 3i4n n SER 182 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3i4n s LEU 183 N -2.65 3.68 -0.21 1.04 1.43 -0.11 -4.86 118.68 117.00 3i4n s LEU 183 Ca 0.25 -1.28 -0.29 0.00 -1.03 0.00 0.00 54.13 51.78 3i4n s LEU 183 Cb 0.20 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.72 3i4n s LEU 183 CO 0.50 -0.23 1.93 0.00 0.23 0.00 0.00 176.35 178.78 3i4n s ALA 184 N 1.21 3.03 0.27 4.21 0.00 -1.26 -4.77 121.76 124.44 3i4n s ALA 184 Ca -0.06 0.66 0.11 0.00 0.00 0.00 0.00 51.96 52.66 3i4n s ALA 184 Cb -0.20 -3.97 -0.05 0.00 0.00 0.00 0.00 23.12 18.90 3i4n s ALA 184 CO -0.03 -2.36 -0.17 0.00 0.00 0.00 0.00 175.76 173.20 3i4n n ASP 186 N -0.59 0.35 -4.91 0.00 8.00 -1.26 -4.88 116.55 113.26 3i4n n ASP 186 Ca -0.06 0.05 -0.27 0.00 0.71 0.00 0.00 54.79 55.22 3i4n n ASP 186 Cb 0.61 -0.16 0.02 0.00 -0.02 0.00 0.00 41.12 41.56 3i4n n ASP 186 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3i4n s THR 187 N -1.32 4.22 -0.82 -3.53 2.01 -1.26 -4.89 115.64 110.05 3i4n s THR 187 Ca -0.01 0.12 0.17 0.00 0.31 0.00 0.00 61.69 62.28 3i4n s THR 187 Cb 0.00 -3.64 0.16 0.00 0.01 0.00 0.00 72.50 69.03 3i4n s THR 187 CO 0.02 -0.65 1.54 0.00 -0.69 0.00 0.00 174.62 174.84 3i4n n ALA 188 N -2.45 1.65 0.05 7.40 0.00 -1.26 -1.56 120.51 124.33 3i4n n ALA 188 Ca 0.03 -0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.44 3i4n n ALA 188 Cb 0.56 -1.28 -0.01 0.00 0.00 0.00 0.00 19.45 18.72 3i4n n ALA 188 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 3i4n h ASP 189 N 0.00 -0.14 -1.03 0.00 1.82 -1.94 0.77 116.42 115.89 3i4n h ASP 189 Ca 0.00 0.00 0.27 0.00 -0.39 0.00 0.00 57.03 56.92 3i4n h ASP 189 Cb 0.28 0.04 -0.08 0.00 0.68 0.00 0.00 39.33 40.25 3i4n h ASP 189 CO 0.00 0.05 0.69 -0.08 -1.61 0.00 0.00 179.24 178.29 3i4n h GLU 190 N -0.45 0.28 0.00 0.28 4.81 -1.86 0.10 114.58 117.74 3i4n h GLU 190 Ca -0.02 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3i4n h GLU 190 Cb 0.12 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.44 3i4n h GLU 190 CO 0.03 0.18 0.00 0.00 -0.73 0.00 0.00 179.01 178.49 3i4n n ALA 191 N -2.56 0.00 0.00 2.92 0.00 -0.60 -2.83 120.51 117.44 3i4n n ALA 191 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 3i4n n ALA 191 Cb 0.93 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.38 3i4n n ALA 191 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3i4n n LYS 192 N -0.30 0.00 -0.12 0.00 5.02 0.26 -0.31 118.16 122.71 3i4n n LYS 192 Ca 0.00 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.04 3i4n n LYS 192 Cb 0.00 -1.20 -0.09 0.00 -0.02 0.00 0.00 35.03 33.72 3i4n n LYS 192 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3i4n n THR 193 N -0.62 1.52 0.16 -0.18 -1.04 0.35 -3.75 114.28 110.72 3i4n n THR 193 Ca 0.00 -0.22 0.05 0.00 -2.04 0.00 0.00 64.05 61.83 3i4n n THR 193 Cb 0.00 -1.99 0.10 0.00 -1.82 0.00 0.00 70.33 66.62 3i4n n THR 193 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3i4n h LEU 194 N -1.00 0.00 -5.56 -4.42 3.38 -0.88 -3.30 115.31 103.54 3i4n h LEU 194 Ca -0.52 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 56.84 3i4n h LEU 194 Cb 1.43 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.77 3i4n h LEU 194 CO -0.31 0.41 -0.49 -0.38 0.09 0.00 0.00 178.44 177.76 3i4n n ILE 195 N -3.24 3.22 0.30 1.22 5.41 0.58 -4.90 119.36 121.94 3i4n n ILE 195 Ca 0.02 -5.56 0.17 0.00 1.00 0.00 0.00 62.75 58.38 3i4n n ILE 195 Cb 0.67 -1.55 0.85 0.00 -0.71 0.00 0.00 39.64 38.90 3i4n n ILE 195 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 3i4n h PRO 196 N 3.33 0.00 0.00 0.38 0.13 -1.65 -1.45 132.00 132.75 3i4n h PRO 196 Ca 0.17 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.30 3i4n h PRO 196 Cb 0.52 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.65 3i4n h PRO 196 CO 0.86 0.00 -0.00 0.66 -0.23 0.00 0.00 178.00 179.29 3i4n h SER 197 N 0.00 0.00 0.00 1.44 4.64 -1.88 -3.29 113.55 114.45 3i4n h SER 197 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3i4n h SER 197 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 3i4n h SER 197 CO -0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 3i4n n LEU 198 N -3.20 0.00 0.00 5.97 4.77 -0.54 -4.70 117.00 119.30 3i4n n LEU 198 Ca -0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 3i4n n LEU 198 Cb 0.07 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 3i4n n LEU 198 CO 0.21 0.00 0.00 0.59 -1.33 0.00 0.00 177.39 176.86 3i4n n ASN 199 N 0.00 0.00 -0.02 -1.43 3.02 -1.24 -2.20 115.26 113.39 3i4n n ASN 199 Ca 0.00 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.57 3i4n n ASN 199 Cb 0.00 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.09 3i4n n ASN 199 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3i4n n ASN 200 N 0.00 2.74 0.18 6.41 3.02 -1.26 -4.74 115.26 121.61 3i4n n ASN 200 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.43 3i4n n ASN 200 Cb 0.00 1.25 -0.07 0.00 -0.61 0.00 0.00 39.78 40.35 3i4n n ASN 200 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 3i4n h LYS 201 N 0.00 -0.63 -5.78 3.52 1.57 -1.72 -3.42 116.57 110.11 3i4n h LYS 201 Ca -0.07 0.04 -0.68 0.00 -1.87 0.00 0.00 60.65 58.07 3i4n h LYS 201 Cb 0.76 0.14 -0.30 0.00 0.08 0.00 0.00 32.23 32.91 3i4n h LYS 201 CO 0.00 -0.42 -0.86 -1.50 -0.57 0.00 0.00 179.45 176.10 3i4n s ILE 202 N -4.94 2.29 0.71 1.86 2.07 -1.26 -5.11 121.20 116.83 3i4n s ILE 202 Ca -0.12 -0.97 -0.16 0.00 -1.41 0.00 0.00 60.65 57.99 3i4n s ILE 202 Cb 0.03 -1.87 -0.04 0.00 0.13 0.00 0.00 42.46 40.71 3i4n s ILE 202 CO 0.41 0.56 0.55 -1.54 -1.91 0.00 0.00 174.94 173.01 3i4n n SER 203 N 3.11 -1.12 -0.23 4.50 3.41 -1.26 -4.69 113.62 117.34 3i4n n SER 203 Ca -0.18 0.60 0.02 0.00 -0.26 0.00 0.00 58.87 59.06 3i4n n SER 203 Cb 0.52 -1.22 0.26 0.00 -0.26 0.00 0.00 64.21 63.51 3i4n n SER 203 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3i4n h ASP 204 N -0.32 0.85 -0.04 4.04 3.32 -1.96 -1.65 116.42 120.66 3i4n h ASP 204 Ca -0.46 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 56.45 3i4n h ASP 204 Cb 1.35 -0.20 0.01 0.00 0.22 0.00 0.00 39.33 40.71 3i4n h ASP 204 CO 0.43 0.59 -0.49 0.44 -1.72 0.00 0.00 179.24 178.49 3i4n h ASP 205 N 0.99 0.50 0.46 6.45 3.32 -1.98 -2.17 116.42 123.99 3i4n h ASP 205 Ca 0.31 -0.71 -0.02 0.00 0.02 0.00 0.00 57.03 56.63 3i4n h ASP 205 Cb 0.01 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 3i4n h ASP 205 CO -0.09 1.14 -0.37 -0.33 -1.72 0.00 0.00 179.24 177.87 3i4n h GLU 206 N -0.10 -0.77 -0.63 3.56 4.39 -1.86 0.52 114.58 119.69 3i4n h GLU 206 Ca -0.05 0.05 0.18 0.00 0.34 0.00 0.00 59.36 59.88 3i4n h GLU 206 Cb 1.18 0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 29.98 3i4n h GLU 206 CO 0.10 -0.52 0.59 1.25 -1.16 0.00 0.00 179.01 179.27 3i4n h LEU 207 N -0.80 0.00 0.28 1.33 6.46 -1.43 0.15 115.31 121.29 3i4n h LEU 207 Ca -0.06 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.69 3i4n h LEU 207 Cb 0.67 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.61 3i4n h LEU 207 CO 0.00 0.00 -0.13 -0.08 -0.62 0.00 0.00 178.44 177.61 3i4n h GLU 208 N 0.00 -0.36 -0.60 1.25 4.57 -0.49 0.25 114.58 119.19 3i4n h GLU 208 Ca 0.30 0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.56 3i4n h GLU 208 Cb 1.48 0.08 -0.08 0.00 -0.16 0.00 0.00 28.75 30.07 3i4n h GLU 208 CO -0.00 -0.05 -0.43 0.00 -1.18 0.00 0.00 179.01 177.35 3i4n h ARG 209 N -0.97 -0.09 -0.36 1.92 3.08 0.27 -0.16 114.38 118.07 3i4n h ARG 209 Ca -0.04 0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.08 3i4n h ARG 209 Cb 0.48 0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.49 3i4n h ARG 209 CO 0.06 -0.06 -0.01 0.82 -1.07 0.00 0.00 179.97 179.72 3i4n h ILE 210 N -0.09 0.73 -1.00 2.04 2.04 -1.31 -1.43 117.51 118.48 3i4n h ILE 210 Ca 0.10 -0.03 0.22 0.00 1.00 0.00 0.00 64.86 66.14 3i4n h ILE 210 Cb 0.35 0.63 -0.11 0.00 -0.74 0.00 0.00 36.82 36.95 3i4n h ILE 210 CO -0.62 0.02 0.61 0.25 0.00 0.00 0.00 178.15 178.41 3i4n h LEU 211 N 0.09 0.69 -0.64 1.44 6.46 0.12 0.54 115.31 124.02 3i4n h LEU 211 Ca 0.17 0.10 -0.15 0.00 -0.12 0.00 0.00 57.88 57.89 3i4n h LEU 211 Cb 0.24 -0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.15 3i4n h LEU 211 CO -0.30 0.20 -0.62 0.11 -0.62 0.00 0.00 178.44 177.21 3i4n h LYS 212 N 0.65 0.22 -0.97 1.25 1.57 -0.10 -2.94 116.57 116.25 3i4n h LYS 212 Ca 0.59 -0.16 0.04 0.00 -1.87 0.00 0.00 60.65 59.26 3i4n h LYS 212 Cb 1.08 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 33.36 3i4n h LYS 212 CO -0.39 0.77 0.63 0.93 -0.57 0.00 0.00 179.45 180.83 3i4n h GLU 213 N 0.16 1.17 -0.44 3.15 4.39 0.99 -2.24 114.58 121.76 3i4n h GLU 213 Ca -0.01 -0.07 -0.09 0.00 0.34 0.00 0.00 59.36 59.53 3i4n h GLU 213 Cb 1.13 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 29.50 3i4n h GLU 213 CO 0.10 0.77 -0.08 -0.07 -1.16 0.00 0.00 179.01 178.57 3i4n h LEU 214 N 1.21 0.76 -1.60 1.33 3.38 -1.20 -1.62 115.31 117.56 3i4n h LEU 214 Ca 0.39 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 3i4n h LEU 214 Cb 0.03 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 3i4n h LEU 214 CO -0.13 0.88 -0.21 0.77 0.09 0.00 0.00 178.44 179.85 3i4n h SER 215 N 0.71 0.00 0.16 -0.43 4.64 -1.40 1.42 113.55 118.65 3i4n h SER 215 Ca 0.12 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 3i4n h SER 215 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 3i4n h SER 215 CO 0.03 0.21 -0.08 0.78 -0.87 0.00 0.00 176.83 176.91 3i4n h ASN 216 N 0.00 -0.18 0.40 4.97 4.21 -1.26 -3.26 115.58 120.46 3i4n h ASN 216 Ca -0.00 -0.19 0.00 0.00 1.21 0.00 0.00 56.30 57.32 3i4n h ASN 216 Cb 0.47 0.05 0.00 0.00 -1.12 0.00 0.00 38.32 37.71 3i4n h ASN 216 CO 0.03 0.36 0.00 -0.07 -1.29 0.00 0.00 177.43 176.46 3i4n h LEU 217 N -1.01 0.00 -8.27 1.61 3.38 -1.12 -3.42 115.31 106.47 3i4n h LEU 217 Ca -0.02 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 3i4n h LEU 217 Cb 0.36 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 3i4n h LEU 217 CO 0.04 0.00 0.68 1.21 0.09 0.00 0.00 178.44 180.46 3i4n n GLU 218 N -2.61 0.46 -1.23 1.13 2.13 0.48 -4.82 120.64 116.17 3i4n n GLU 218 Ca -0.00 -0.55 -0.46 0.00 0.66 0.00 0.00 57.16 56.80 3i4n n GLU 218 Cb 0.15 -2.98 -0.05 0.00 0.27 0.00 0.00 31.44 28.83 3i4n n GLU 218 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 3i4n n THR 219 N 7.93 0.76 0.00 6.31 -1.04 -1.26 -4.93 114.28 122.05 3i4n n THR 219 Ca 0.52 -0.19 0.00 0.00 -2.04 0.00 0.00 64.05 62.34 3i4n n THR 219 Cb 0.36 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.87 3i4n n THR 219 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3i4n n LEU 220 N 1.46 0.00 0.00 -4.42 4.77 -1.26 -4.84 117.00 112.71 3i4n n LEU 220 Ca 0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 3i4n n LEU 220 Cb 0.13 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 3i4n n LEU 220 CO 0.50 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.56