#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xbr n LEU 40 N 0.00 1.29 -3.73 4.31 7.94 -1.25 -4.48 117.00 121.08 1xbr n LEU 40 Ca 0.00 1.16 -0.16 0.00 -1.11 0.00 0.00 56.01 55.90 1xbr n LEU 40 Cb 0.00 -0.90 -0.16 0.00 0.53 0.00 0.00 43.42 42.89 1xbr n LEU 40 CO 0.00 -0.81 -0.31 -0.54 -1.11 0.00 0.00 177.39 174.63 1xbr s LYS 41 N 3.16 -0.01 -0.23 1.96 -0.14 -0.09 -4.96 119.74 119.43 1xbr s LYS 41 Ca 1.05 0.31 -0.01 0.00 -1.36 0.00 0.00 55.97 55.96 1xbr s LYS 41 Cb -1.47 -0.29 0.02 0.00 -1.68 0.00 0.00 37.83 34.41 1xbr s LYS 41 CO 0.80 -0.22 -0.10 0.08 -0.76 0.00 0.00 175.35 175.15 1xbr s VAL 42 N 1.47 2.64 0.02 3.17 1.01 -1.26 -0.94 120.40 126.51 1xbr s VAL 42 Ca -0.05 -0.98 0.05 0.00 0.00 0.00 0.00 61.98 61.01 1xbr s VAL 42 Cb -0.12 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.95 1xbr s VAL 42 CO -0.04 0.31 -0.11 -0.44 0.00 0.00 0.00 175.10 174.82 1xbr s SER 43 N 1.32 4.27 -0.11 3.32 0.01 0.58 -4.95 113.70 118.14 1xbr s SER 43 Ca 0.02 -0.27 -0.26 0.00 1.31 0.00 0.00 55.95 56.74 1xbr s SER 43 Cb -0.16 -0.88 -0.02 0.00 0.21 0.00 0.00 66.02 65.18 1xbr s SER 43 CO -0.07 0.27 0.85 -0.22 0.41 0.00 0.00 173.24 174.48 1xbr s LEU 44 N -1.45 4.25 0.42 2.44 2.96 -1.26 -0.54 118.68 125.50 1xbr s LEU 44 Ca 0.16 1.32 -0.14 0.00 -0.22 0.00 0.00 54.13 55.25 1xbr s LEU 44 Cb -0.11 -3.31 -0.08 0.00 0.50 0.00 0.00 46.19 43.20 1xbr s LEU 44 CO 0.07 -0.32 0.83 -1.61 -1.32 0.00 0.00 176.35 174.00 1xbr s GLU 45 N 1.63 3.91 -1.40 1.98 0.41 0.37 -4.09 118.70 121.51 1xbr s GLU 45 Ca 0.42 0.69 -0.08 0.00 -0.41 0.00 0.00 54.97 55.59 1xbr s GLU 45 Cb -0.18 -2.32 0.04 0.00 -1.78 0.00 0.00 34.13 29.89 1xbr s GLU 45 CO 0.17 -0.05 1.00 0.39 -0.49 0.00 0.00 175.26 176.28 1xbr n GLU 46 N -1.10 -6.33 -0.33 1.61 1.02 -1.26 -4.67 120.64 109.58 1xbr n GLU 46 Ca 0.04 0.70 0.02 0.00 -0.02 0.00 0.00 57.16 57.91 1xbr n GLU 46 Cb 0.54 -5.60 0.16 0.00 -0.02 0.00 0.00 31.44 26.52 1xbr n GLU 46 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1xbr h ARG 47 N -2.23 0.97 -0.04 3.49 2.43 -1.97 -2.26 114.38 114.77 1xbr h ARG 47 Ca -0.58 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 58.54 1xbr h ARG 47 Cb 1.37 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 30.68 1xbr h ARG 47 CO 0.60 0.64 -0.06 -0.44 -1.51 0.00 0.00 179.97 179.20 1xbr h ASP 48 N 1.00 -0.18 -0.42 -3.80 5.19 -1.94 0.84 116.42 117.11 1xbr h ASP 48 Ca 0.41 0.03 -0.04 0.00 -0.62 0.00 0.00 57.03 56.81 1xbr h ASP 48 Cb 0.23 0.09 -0.02 0.00 0.18 0.00 0.00 39.33 39.81 1xbr h ASP 48 CO -0.19 -0.09 0.10 0.25 -3.12 0.00 0.00 179.24 176.19 1xbr h LEU 49 N -0.09 0.64 -0.89 1.55 5.85 -1.89 -2.31 115.31 118.18 1xbr h LEU 49 Ca 0.04 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 1xbr h LEU 49 Cb 0.14 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 1xbr h LEU 49 CO -0.09 0.71 0.50 -0.50 -0.34 0.00 0.00 178.44 178.72 1xbr h TRP 50 N 0.55 1.21 -0.79 1.25 4.06 -1.17 -2.19 115.95 118.87 1xbr h TRP 50 Ca 0.13 -0.02 -0.01 0.00 2.06 0.00 0.00 58.89 61.04 1xbr h TRP 50 Cb 0.32 -0.39 -0.04 0.00 -1.00 0.00 0.00 29.16 28.05 1xbr h TRP 50 CO 0.02 0.83 0.44 1.15 -3.56 0.00 0.00 178.44 177.31 1xbr h THR 51 N 1.24 1.23 -0.46 1.49 2.02 -0.62 0.38 112.91 118.19 1xbr h THR 51 Ca 0.31 -0.58 -0.06 0.00 0.77 0.00 0.00 66.41 66.85 1xbr h THR 51 Cb 0.01 0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 66.58 1xbr h THR 51 CO -0.05 0.26 0.02 -0.09 0.37 0.00 0.00 175.52 176.03 1xbr h ARG 52 N 1.09 0.75 -0.39 6.66 9.65 -1.00 -0.62 114.38 130.53 1xbr h ARG 52 Ca 0.28 -0.19 -0.12 0.00 -1.10 0.00 0.00 59.98 58.85 1xbr h ARG 52 Cb 0.03 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.50 1xbr h ARG 52 CO -0.05 0.75 -0.25 0.74 2.80 0.00 0.00 179.97 183.97 1xbr h PHE 53 N 0.71 0.99 -0.18 2.20 0.04 -0.79 -3.10 116.94 116.81 1xbr h PHE 53 Ca 0.14 -0.26 0.03 0.00 2.80 0.00 0.00 57.97 60.68 1xbr h PHE 53 Cb 0.40 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 38.30 1xbr h PHE 53 CO 0.02 1.04 -0.04 -0.22 -0.60 0.00 0.00 178.31 178.52 1xbr h LYS 54 N 0.66 0.01 -0.91 1.51 1.63 -0.32 -1.53 116.57 117.62 1xbr h LYS 54 Ca 0.08 -0.00 0.22 0.00 -0.85 0.00 0.00 60.65 60.10 1xbr h LYS 54 Cb 0.81 -0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 32.38 1xbr h LYS 54 CO 0.07 0.01 0.61 0.93 -3.45 0.00 0.00 179.45 177.61 1xbr h GLU 55 N 0.01 0.31 -0.02 1.90 5.08 -1.08 0.92 114.58 121.71 1xbr h GLU 55 Ca 0.08 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1xbr h GLU 55 Cb 0.12 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1xbr h GLU 55 CO -0.17 0.21 -0.16 1.28 -1.00 0.00 0.00 179.01 179.16 1xbr n LEU 56 N -4.47 2.05 -2.04 1.33 4.77 -0.89 -5.00 117.00 112.75 1xbr n LEU 56 Ca 0.20 -0.69 -0.00 0.00 -0.03 0.00 0.00 56.01 55.48 1xbr n LEU 56 Cb 0.76 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.83 1xbr n LEU 56 CO 0.32 0.36 -0.19 0.41 -1.33 0.00 0.00 177.39 176.95 1xbr n THR 57 N 0.38 -6.37 -1.72 -5.08 -1.04 0.32 -4.96 114.28 95.81 1xbr n THR 57 Ca 0.14 0.77 -0.42 0.00 -2.04 0.00 0.00 64.05 62.50 1xbr n THR 57 Cb 0.46 -5.31 0.00 0.00 -1.82 0.00 0.00 70.33 63.67 1xbr n THR 57 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1xbr n ASN 58 N 0.23 2.92 -4.24 8.00 2.85 -0.76 -4.89 115.26 119.37 1xbr n ASN 58 Ca 0.01 1.17 -0.30 0.00 -0.11 0.00 0.00 54.58 55.35 1xbr n ASN 58 Cb 0.02 -1.52 -0.16 0.00 1.24 0.00 0.00 39.78 39.36 1xbr n ASN 58 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 1xbr s GLU 59 N -2.06 2.31 -0.16 1.20 2.02 -1.26 -1.04 118.70 119.70 1xbr s GLU 59 Ca 0.57 -0.83 0.01 0.00 0.02 0.00 0.00 54.97 54.74 1xbr s GLU 59 Cb -0.52 -1.99 0.02 0.00 0.10 0.00 0.00 34.13 31.73 1xbr s GLU 59 CO 0.61 0.37 -0.19 -1.64 0.02 0.00 0.00 175.26 174.42 1xbr s MET 60 N -0.16 2.81 0.29 1.61 -1.94 -0.69 -4.90 119.30 116.32 1xbr s MET 60 Ca -0.02 -0.77 -0.29 0.00 -1.71 0.00 0.00 55.69 52.90 1xbr s MET 60 Cb -0.13 -2.41 -0.10 0.00 2.01 0.00 0.00 34.83 34.21 1xbr s MET 60 CO 0.03 -0.17 1.18 0.42 -0.01 0.00 0.00 175.02 176.47 1xbr s ILE 61 N 1.21 3.20 -0.04 2.53 -1.09 -1.25 -0.65 121.20 125.12 1xbr s ILE 61 Ca 0.02 1.21 0.02 0.00 -2.23 0.00 0.00 60.65 59.67 1xbr s ILE 61 Cb -0.14 -3.77 0.01 0.00 -1.58 0.00 0.00 42.46 36.98 1xbr s ILE 61 CO -0.10 0.28 -0.09 0.68 -1.23 0.00 0.00 174.94 174.49 1xbr s VAL 62 N -1.11 0.81 0.30 2.92 -7.23 -0.11 -4.69 120.40 111.29 1xbr s VAL 62 Ca 0.46 -0.34 0.08 0.00 -1.81 0.00 0.00 61.98 60.37 1xbr s VAL 62 Cb -0.35 -0.74 -0.06 0.00 0.56 0.00 0.00 36.38 35.79 1xbr s VAL 62 CO 0.45 0.26 -0.07 0.42 -0.31 0.00 0.00 175.10 175.85 1xbr s THR 63 N 0.40 1.84 0.64 5.32 -4.23 -1.23 -4.46 115.64 113.92 1xbr s THR 63 Ca -0.07 -2.16 0.38 0.00 -1.18 0.00 0.00 61.69 58.67 1xbr s THR 63 Cb -0.11 -2.50 0.40 0.00 1.34 0.00 0.00 72.50 71.63 1xbr s THR 63 CO 0.01 -0.27 2.29 0.50 -0.54 0.00 0.00 174.62 176.61 1xbr h LYS 64 N 2.20 0.00 -0.00 3.99 3.64 -1.96 -2.09 116.57 122.35 1xbr h LYS 64 Ca -0.41 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 1xbr h LYS 64 Cb 1.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 1xbr h LYS 64 CO 0.68 0.00 -0.55 0.09 -2.27 0.00 0.00 179.45 177.40 1xbr n ASN 65 N -3.38 0.83 0.00 4.20 3.02 -1.26 -4.78 115.26 113.88 1xbr n ASN 65 Ca -0.03 -0.91 0.00 0.00 -0.03 0.00 0.00 54.58 53.61 1xbr n ASN 65 Cb 0.11 0.88 0.00 0.00 -0.61 0.00 0.00 39.78 40.16 1xbr n ASN 65 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xbr n GLY 66 N 1.26 2.10 3.19 7.41 0.00 -0.79 -5.01 105.19 113.36 1xbr n GLY 66 Ca 0.03 -1.48 -0.21 0.00 0.00 0.00 0.00 46.02 44.36 1xbr n GLY 66 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1xbr s ARG 67 N -5.04 1.02 0.51 1.61 6.06 0.82 -4.73 118.95 119.20 1xbr s ARG 67 Ca 0.00 -0.91 -0.09 0.00 -2.50 0.00 0.00 55.73 52.23 1xbr s ARG 67 Cb 0.00 -1.10 -0.05 0.00 0.06 0.00 0.00 34.95 33.87 1xbr s ARG 67 CO 0.00 0.27 0.87 1.03 -2.50 0.00 0.00 175.30 174.97 1xbr s ARG 68 N -1.42 3.64 0.40 5.12 0.52 -1.26 0.16 118.95 126.11 1xbr s ARG 68 Ca 0.03 0.48 -0.15 0.00 -0.52 0.00 0.00 55.73 55.57 1xbr s ARG 68 Cb -0.09 -2.27 -0.09 0.00 0.52 0.00 0.00 34.95 33.03 1xbr s ARG 68 CO 0.02 -0.29 0.83 -1.64 0.02 0.00 0.00 175.30 174.24 1xbr s MET 69 N -4.64 3.99 -0.16 3.54 -1.94 -1.26 -4.89 119.30 113.94 1xbr s MET 69 Ca 0.51 0.76 -0.07 0.00 -1.71 0.00 0.00 55.69 55.19 1xbr s MET 69 Cb -0.10 -2.32 0.07 0.00 2.01 0.00 0.00 34.83 34.49 1xbr s MET 69 CO 0.44 -0.00 0.35 0.12 -0.01 0.00 0.00 175.02 175.91 1xbr s PHE 70 N -2.23 -0.57 0.99 -0.03 5.36 -1.26 -3.95 117.98 116.28 1xbr s PHE 70 Ca 0.56 1.20 -0.12 0.00 -0.96 0.00 0.00 56.93 57.61 1xbr s PHE 70 Cb -0.10 0.16 0.18 0.00 -0.34 0.00 0.00 43.02 42.92 1xbr s PHE 70 CO 0.22 -0.38 1.09 -1.25 -1.46 0.00 0.00 175.22 173.44 1xbr s PRO 71 N 2.08 0.50 0.21 10.12 0.04 -1.26 -4.96 135.00 141.73 1xbr s PRO 71 Ca -0.04 0.60 -0.30 0.00 0.04 0.00 0.00 61.00 61.30 1xbr s PRO 71 Cb -0.11 -1.74 -0.08 0.00 0.04 0.00 0.00 34.50 32.61 1xbr s PRO 71 CO -0.11 -2.70 1.19 0.08 0.04 0.00 0.00 177.00 175.50 1xbr s VAL 72 N -2.93 3.49 -0.44 -0.36 1.01 -1.25 -4.98 120.40 114.94 1xbr s VAL 72 Ca 0.65 1.30 -0.26 0.00 0.00 0.00 0.00 61.98 63.67 1xbr s VAL 72 Cb -0.19 -3.83 0.03 0.00 0.00 0.00 0.00 36.38 32.39 1xbr s VAL 72 CO 0.58 0.23 0.98 -0.22 0.00 0.00 0.00 175.10 176.66 1xbr s LEU 73 N -0.51 3.92 -0.00 3.92 2.96 -1.26 -4.97 118.68 122.74 1xbr s LEU 73 Ca 0.51 0.31 0.05 0.00 -0.22 0.00 0.00 54.13 54.79 1xbr s LEU 73 Cb -0.33 -3.29 -0.01 0.00 0.50 0.00 0.00 46.19 43.05 1xbr s LEU 73 CO 0.38 -1.05 -0.17 -0.54 -1.32 0.00 0.00 176.35 173.65 1xbr s LYS 74 N 3.85 1.31 0.02 1.98 1.02 -1.26 -1.18 119.74 125.48 1xbr s LYS 74 Ca 0.40 -0.64 0.01 0.00 0.02 0.00 0.00 55.97 55.75 1xbr s LYS 74 Cb -0.10 -1.29 -0.01 0.00 -0.52 0.00 0.00 37.83 35.91 1xbr s LYS 74 CO 0.26 0.35 -0.03 0.14 -0.92 0.00 0.00 175.35 175.14 1xbr s VAL 75 N -0.47 0.18 -0.18 3.17 -7.23 0.22 -0.48 120.40 115.62 1xbr s VAL 75 Ca 0.06 -0.62 -0.14 0.00 -1.81 0.00 0.00 61.98 59.47 1xbr s VAL 75 Cb -0.07 -0.26 -0.04 0.00 0.56 0.00 0.00 36.38 36.57 1xbr s VAL 75 CO -0.00 -0.28 0.32 -0.44 -0.31 0.00 0.00 175.10 174.38 1xbr s SER 76 N -0.95 6.41 0.04 4.85 0.01 0.30 0.05 113.70 124.41 1xbr s SER 76 Ca -0.09 0.48 0.08 0.00 1.31 0.00 0.00 55.95 57.73 1xbr s SER 76 Cb -0.06 -2.19 -0.03 0.00 0.21 0.00 0.00 66.02 63.95 1xbr s SER 76 CO -0.00 0.04 -0.24 0.00 0.41 0.00 0.00 173.24 173.44 1xbr s MET 77 N 0.80 1.64 0.16 12.44 0.23 -1.26 -0.31 119.30 133.00 1xbr s MET 77 Ca 0.17 -1.01 -0.08 0.00 -1.03 0.00 0.00 55.69 53.74 1xbr s MET 77 Cb -0.14 -1.77 -0.01 0.00 -1.53 0.00 0.00 34.83 31.38 1xbr s MET 77 CO 0.05 0.46 0.24 -1.54 -2.03 0.00 0.00 175.02 172.21 1xbr s SER 78 N -1.14 0.09 0.00 -1.18 1.04 -0.12 -4.29 113.70 108.09 1xbr s SER 78 Ca 0.10 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.60 1xbr s SER 78 Cb -0.09 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.44 1xbr s SER 78 CO 0.02 -0.86 0.00 0.61 0.98 0.00 0.00 173.24 173.98 1xbr n GLY 79 N -0.19 0.56 3.96 7.32 0.00 -1.26 -0.91 105.19 114.66 1xbr n GLY 79 Ca -0.07 -0.83 -0.23 0.00 0.00 0.00 0.00 46.02 44.88 1xbr n GLY 79 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xbr s LEU 80 N 0.00 4.30 -0.24 0.99 1.43 -1.26 -3.79 118.68 120.11 1xbr s LEU 80 Ca 0.00 0.15 -0.29 0.00 -1.03 0.00 0.00 54.13 52.96 1xbr s LEU 80 Cb 0.00 -2.93 -0.02 0.00 0.03 0.00 0.00 46.19 43.27 1xbr s LEU 80 CO 0.00 -0.05 1.47 -0.62 0.23 0.00 0.00 176.35 177.38 1xbr s ASP 81 N -3.70 6.54 0.62 2.29 2.15 -1.26 -4.86 116.67 118.44 1xbr s ASP 81 Ca 0.35 1.49 0.30 0.00 0.43 0.00 0.00 52.55 55.12 1xbr s ASP 81 Cb -0.10 -2.54 1.62 0.00 -0.30 0.00 0.00 42.92 41.60 1xbr s ASP 81 CO 0.29 -1.14 1.98 -0.65 -0.17 0.00 0.00 175.17 175.49 1xbr h PRO 82 N 9.95 0.00 0.00 4.34 0.11 -1.96 -1.76 132.00 142.68 1xbr h PRO 82 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1xbr h PRO 82 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1xbr h PRO 82 CO 1.01 0.00 -0.99 0.09 -0.21 0.00 0.00 178.00 177.90 1xbr n ASN 83 N -3.47 0.83 -4.83 -2.05 3.02 -1.26 -1.85 115.26 105.65 1xbr n ASN 83 Ca 0.03 -0.77 -0.32 0.00 -0.03 0.00 0.00 54.58 53.48 1xbr n ASN 83 Cb 0.46 1.13 -0.02 0.00 -0.61 0.00 0.00 39.78 40.74 1xbr n ASN 83 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xbr s ALA 84 N -2.76 2.96 -0.11 5.41 0.00 -0.66 -4.80 121.76 121.80 1xbr s ALA 84 Ca 0.05 0.24 -0.16 0.00 0.00 0.00 0.00 51.96 52.09 1xbr s ALA 84 Cb 0.13 -3.15 -0.05 0.00 0.00 0.00 0.00 23.12 20.05 1xbr s ALA 84 CO 0.73 -0.43 0.38 1.41 0.00 0.00 0.00 175.76 177.86 1xbr s MET 85 N -4.09 4.21 0.07 0.00 1.75 -1.26 -0.92 119.30 119.05 1xbr s MET 85 Ca 0.60 0.29 0.03 0.00 -1.25 0.00 0.00 55.69 55.37 1xbr s MET 85 Cb -0.12 -3.38 -0.03 0.00 2.84 0.00 0.00 34.83 34.14 1xbr s MET 85 CO 0.33 0.31 -0.10 0.71 -0.65 0.00 0.00 175.02 175.62 1xbr s TYR 86 N 0.20 0.94 -0.08 4.11 2.02 0.09 -0.76 117.35 123.86 1xbr s TYR 86 Ca 0.22 -0.55 0.04 0.00 -0.37 0.00 0.00 57.07 56.40 1xbr s TYR 86 Cb -0.14 -0.53 0.00 0.00 -0.40 0.00 0.00 41.96 40.88 1xbr s TYR 86 CO 0.08 -0.03 -0.20 0.99 -1.57 0.00 0.00 175.55 174.83 1xbr s THR 87 N -1.75 1.75 -0.16 -0.71 2.01 0.04 -1.11 115.64 115.70 1xbr s THR 87 Ca -0.03 -0.84 -0.06 0.00 0.31 0.00 0.00 61.69 61.08 1xbr s THR 87 Cb -0.07 -1.52 -0.04 0.00 0.01 0.00 0.00 72.50 70.88 1xbr s THR 87 CO 0.01 0.49 0.03 -0.69 -0.69 0.00 0.00 174.62 173.77 1xbr s VAL 88 N 0.40 4.56 0.19 3.82 1.01 -1.26 -0.61 120.40 128.50 1xbr s VAL 88 Ca -0.16 -0.12 0.10 0.00 0.00 0.00 0.00 61.98 61.79 1xbr s VAL 88 Cb -0.17 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 1xbr s VAL 88 CO 0.07 0.50 -0.20 -0.76 0.00 0.00 0.00 175.10 174.71 1xbr s LEU 89 N 0.09 2.46 -0.02 3.92 1.43 0.73 -1.04 118.68 126.25 1xbr s LEU 89 Ca 0.04 -0.90 0.01 0.00 -1.03 0.00 0.00 54.13 52.25 1xbr s LEU 89 Cb -0.13 -0.94 0.01 0.00 0.03 0.00 0.00 46.19 45.17 1xbr s LEU 89 CO 0.01 0.00 -0.02 -0.22 0.23 0.00 0.00 176.35 176.35 1xbr s LEU 90 N -2.82 1.52 0.27 1.79 2.96 0.41 -0.87 118.68 121.94 1xbr s LEU 90 Ca 0.19 -0.06 -0.05 0.00 -0.22 0.00 0.00 54.13 53.99 1xbr s LEU 90 Cb -0.06 -0.26 -0.01 0.00 0.50 0.00 0.00 46.19 46.36 1xbr s LEU 90 CO 0.08 -0.03 0.36 1.51 -1.32 0.00 0.00 176.35 176.95 1xbr s ASP 91 N 0.57 0.40 -0.07 3.68 -4.77 -0.30 -0.11 116.67 116.07 1xbr s ASP 91 Ca -0.06 -1.29 0.04 0.00 -3.30 0.00 0.00 52.55 47.94 1xbr s ASP 91 Cb -0.09 0.55 0.00 0.00 -1.09 0.00 0.00 42.92 42.29 1xbr s ASP 91 CO -0.01 -1.09 -0.19 -0.36 0.70 0.00 0.00 175.17 174.22 1xbr s PHE 92 N -3.73 2.02 -0.09 2.11 0.40 -1.26 0.44 117.98 117.87 1xbr s PHE 92 Ca 0.31 -0.72 0.01 0.00 -0.60 0.00 0.00 56.93 55.93 1xbr s PHE 92 Cb 0.02 -1.37 -0.02 0.00 0.51 0.00 0.00 43.02 42.15 1xbr s PHE 92 CO 0.15 -0.29 -0.11 0.54 0.70 0.00 0.00 175.22 176.21 1xbr s VAL 93 N 0.28 3.35 0.05 -0.44 0.11 -0.51 -2.10 120.40 121.14 1xbr s VAL 93 Ca -0.12 -0.59 -0.31 0.00 -2.93 0.00 0.00 61.98 58.02 1xbr s VAL 93 Cb -0.15 -2.37 -0.10 0.00 -1.53 0.00 0.00 36.38 32.22 1xbr s VAL 93 CO 0.05 0.56 1.89 0.00 -3.33 0.00 0.00 175.10 174.27 1xbr n ALA 94 N 2.74 1.66 0.30 1.54 0.00 -1.26 -0.57 120.51 124.92 1xbr n ALA 94 Ca -0.18 0.27 0.16 0.00 0.00 0.00 0.00 53.44 53.70 1xbr n ALA 94 Cb 0.53 -2.60 0.66 0.00 0.00 0.00 0.00 19.45 18.03 1xbr n ALA 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xbr h ALA 95 N 9.36 1.00 -2.55 0.00 0.00 -1.16 -3.47 119.26 122.44 1xbr h ALA 95 Ca -0.48 0.00 0.16 0.00 0.00 0.00 0.00 54.91 54.58 1xbr h ALA 95 Cb 1.24 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 1xbr h ALA 95 CO 0.94 0.00 0.57 0.16 0.00 0.00 0.00 179.25 180.92 1xbr s ASP 96 N -5.45 0.00 -0.18 0.00 1.47 -1.26 -5.04 116.67 106.21 1xbr s ASP 96 Ca 0.02 -0.69 0.16 0.00 1.18 0.00 0.00 52.55 53.22 1xbr s ASP 96 Cb 0.09 0.51 0.77 0.00 -0.34 0.00 0.00 42.92 43.95 1xbr s ASP 96 CO 0.52 -1.02 1.69 0.59 0.68 0.00 0.00 175.17 177.63 1xbr n ASN 97 N -1.21 5.24 -4.82 2.11 4.13 -1.26 -4.79 115.26 114.65 1xbr n ASN 97 Ca -0.03 -2.71 -0.31 0.00 1.68 0.00 0.00 54.58 53.20 1xbr n ASN 97 Cb 0.59 -0.63 -0.06 0.00 -1.54 0.00 0.00 39.78 38.14 1xbr n ASN 97 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 1xbr s HIS 98 N -2.34 3.32 -0.11 3.10 3.76 -1.26 -2.70 115.29 119.05 1xbr s HIS 98 Ca 0.53 0.17 -0.17 0.00 -0.15 0.00 0.00 55.06 55.43 1xbr s HIS 98 Cb 0.37 -1.70 -0.04 0.00 1.11 0.00 0.00 32.58 32.33 1xbr s HIS 98 CO 0.20 0.55 0.45 0.50 -0.85 0.00 0.00 174.74 175.59 1xbr s ARG 99 N -2.24 4.29 0.22 1.40 3.52 -1.26 -4.50 118.95 120.38 1xbr s ARG 99 Ca 0.29 0.40 0.03 0.00 -0.13 0.00 0.00 55.73 56.33 1xbr s ARG 99 Cb -0.12 -3.41 -0.03 0.00 -1.56 0.00 0.00 34.95 29.82 1xbr s ARG 99 CO 0.21 0.22 0.36 -1.58 -0.81 0.00 0.00 175.30 173.70 1xbr s TRP 100 N 0.44 3.47 -0.06 5.12 0.52 0.38 -1.99 118.94 126.82 1xbr s TRP 100 Ca 0.25 0.09 -0.08 0.00 0.02 0.00 0.00 56.10 56.37 1xbr s TRP 100 Cb -0.15 -1.66 0.02 0.00 -1.15 0.00 0.00 33.47 30.53 1xbr s TRP 100 CO 0.10 0.43 0.22 0.21 0.02 0.00 0.00 176.95 177.93 1xbr s LYS 101 N -3.72 0.34 -0.60 4.98 2.20 -0.23 -4.83 119.74 117.89 1xbr s LYS 101 Ca 0.35 0.15 -0.20 0.00 -0.36 0.00 0.00 55.97 55.91 1xbr s LYS 101 Cb -0.10 0.16 0.08 0.00 -1.51 0.00 0.00 37.83 36.46 1xbr s LYS 101 CO 0.29 -0.06 0.79 -0.47 -0.36 0.00 0.00 175.35 175.55 1xbr s TYR 102 N -0.25 2.88 -0.16 4.03 5.04 -1.26 -0.92 117.35 126.71 1xbr s TYR 102 Ca -0.04 -0.70 -0.01 0.00 -2.44 0.00 0.00 57.07 53.89 1xbr s TYR 102 Cb -0.03 -4.04 -0.01 0.00 0.35 0.00 0.00 41.96 38.24 1xbr s TYR 102 CO 0.01 -1.38 -0.12 0.08 -1.34 0.00 0.00 175.55 172.80 1xbr s VAL 103 N 3.22 2.94 -1.50 3.14 1.01 0.14 -4.69 120.40 124.66 1xbr s VAL 103 Ca 0.17 -0.68 -0.08 0.00 0.00 0.00 0.00 61.98 61.40 1xbr s VAL 103 Cb -0.20 -2.26 0.06 0.00 0.00 0.00 0.00 36.38 33.98 1xbr s VAL 103 CO 0.09 0.50 0.66 0.59 0.00 0.00 0.00 175.10 176.94 1xbr n ASN 104 N 4.01 -2.06 -1.57 3.32 3.02 -1.26 -1.84 115.26 118.89 1xbr n ASN 104 Ca -0.19 -0.94 -0.12 0.00 -0.03 0.00 0.00 54.58 53.30 1xbr n ASN 104 Cb 0.52 -3.26 0.01 0.00 -0.61 0.00 0.00 39.78 36.43 1xbr n ASN 104 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xbr n GLY 105 N -1.73 -0.03 3.37 7.41 0.00 -1.26 -5.02 105.19 107.92 1xbr n GLY 105 Ca -0.14 -0.33 -0.14 0.00 0.00 0.00 0.00 46.02 45.41 1xbr n GLY 105 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xbr s GLU 106 N -4.91 0.60 -0.14 1.61 2.12 -0.77 -5.09 118.70 112.11 1xbr s GLU 106 Ca 0.10 0.54 -0.24 0.00 0.36 0.00 0.00 54.97 55.72 1xbr s GLU 106 Cb -0.04 0.29 -0.02 0.00 0.26 0.00 0.00 34.13 34.61 1xbr s GLU 106 CO 0.12 -0.09 0.78 -1.58 -0.54 0.00 0.00 175.26 173.95 1xbr s TRP 107 N -0.01 3.46 0.02 5.30 0.52 -1.26 0.23 118.94 127.20 1xbr s TRP 107 Ca -0.02 1.23 0.02 0.00 0.02 0.00 0.00 56.10 57.35 1xbr s TRP 107 Cb -0.03 -2.95 -0.02 0.00 -1.15 0.00 0.00 33.47 29.32 1xbr s TRP 107 CO 0.02 -0.15 -0.06 0.14 0.02 0.00 0.00 176.95 176.91 1xbr s VAL 108 N 1.78 0.44 0.41 4.03 -7.23 -0.10 -4.96 120.40 114.77 1xbr s VAL 108 Ca 0.37 -0.75 -0.17 0.00 -1.81 0.00 0.00 61.98 59.62 1xbr s VAL 108 Cb -0.17 -0.47 -0.09 0.00 0.56 0.00 0.00 36.38 36.21 1xbr s VAL 108 CO 0.14 -0.22 0.88 -2.16 -0.31 0.00 0.00 175.10 173.43 1xbr s PRO 109 N -1.04 4.06 0.33 4.82 0.04 -1.26 -1.06 135.00 140.89 1xbr s PRO 109 Ca -0.06 0.89 -0.18 0.00 0.04 0.00 0.00 61.00 61.69 1xbr s PRO 109 Cb -0.07 -2.26 0.04 0.00 0.04 0.00 0.00 34.50 32.24 1xbr s PRO 109 CO 0.00 -0.03 0.75 0.20 0.04 0.00 0.00 177.00 177.97 1xbr s GLY 110 N -2.48 0.16 0.00 0.56 0.00 -0.84 -4.94 107.32 99.78 1xbr s GLY 110 Ca 0.58 -0.55 0.00 0.00 0.00 0.00 0.00 44.72 44.76 1xbr s GLY 110 CO 0.20 -0.21 0.00 0.61 0.00 0.00 0.00 173.10 173.69 1xbr n GLY 111 N -0.49 -0.89 3.79 0.20 0.00 -1.26 -4.08 105.19 102.45 1xbr n GLY 111 Ca -0.06 -1.04 -0.38 0.00 0.00 0.00 0.00 46.02 44.53 1xbr n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xbr s LYS 112 N 0.00 4.45 0.63 1.61 -2.85 -1.26 -4.95 119.74 117.37 1xbr s LYS 112 Ca 0.00 1.04 -0.16 0.00 -1.00 0.00 0.00 55.97 55.86 1xbr s LYS 112 Cb 0.00 -3.14 -0.01 0.00 -2.06 0.00 0.00 37.83 32.61 1xbr s LYS 112 CO 0.00 0.53 1.10 -2.14 0.10 0.00 0.00 175.35 174.93 1xbr s PRO 113 N -1.39 2.97 0.19 1.78 0.02 -1.26 -4.78 135.00 132.53 1xbr s PRO 113 Ca 0.37 1.36 -0.06 0.00 0.02 0.00 0.00 61.00 62.70 1xbr s PRO 113 Cb -0.21 -1.98 -0.02 0.00 0.02 0.00 0.00 34.50 32.31 1xbr s PRO 113 CO 0.24 -1.11 0.23 -1.83 -0.33 0.00 0.00 177.00 174.20 1xbr s GLU 114 N -4.03 1.21 -0.26 5.54 4.04 -1.10 -5.06 118.70 119.04 1xbr s GLU 114 Ca 0.67 -1.39 -0.21 0.00 0.04 0.00 0.00 54.97 54.08 1xbr s GLU 114 Cb -0.20 0.34 -0.02 0.00 0.02 0.00 0.00 34.13 34.27 1xbr s GLU 114 CO 0.39 -0.43 0.65 -1.25 -1.84 0.00 0.00 175.26 172.78 1xbr s PRO 115 N -4.06 4.08 -0.55 -4.83 0.04 -1.26 -4.70 135.00 123.72 1xbr s PRO 115 Ca 0.27 0.54 -0.15 0.00 0.04 0.00 0.00 61.00 61.70 1xbr s PRO 115 Cb 0.04 -3.66 0.14 0.00 0.04 0.00 0.00 34.50 31.06 1xbr s PRO 115 CO 0.06 -0.45 0.50 -1.14 0.04 0.00 0.00 177.00 176.01 1xbr s GLN 116 N 2.55 2.96 0.75 4.56 2.00 -1.26 -5.07 119.66 126.15 1xbr s GLN 116 Ca 0.27 -1.78 -0.15 0.00 -2.00 0.00 0.00 55.36 51.70 1xbr s GLN 116 Cb -0.15 -4.25 0.02 0.00 0.80 0.00 0.00 33.01 29.42 1xbr s GLN 116 CO 0.09 -1.31 0.93 0.00 -0.50 0.00 0.00 175.29 174.50 1xbr n ALA 117 N 5.10 -0.48 -1.54 1.58 0.00 -1.26 -4.58 120.51 119.32 1xbr n ALA 117 Ca -0.11 -0.24 -0.34 0.00 0.00 0.00 0.00 53.44 52.74 1xbr n ALA 117 Cb 0.41 -2.09 0.05 0.00 0.00 0.00 0.00 19.45 17.82 1xbr n ALA 117 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1xbr s PRO 118 N -3.43 2.68 0.99 0.00 0.04 -1.26 -4.78 135.00 129.24 1xbr s PRO 118 Ca 0.71 1.63 -0.12 0.00 0.04 0.00 0.00 61.00 63.26 1xbr s PRO 118 Cb -0.33 -1.91 0.18 0.00 0.04 0.00 0.00 34.50 32.48 1xbr s PRO 118 CO 0.52 -1.39 1.10 -1.54 0.04 0.00 0.00 177.00 175.73 1xbr s SER 119 N -2.10 2.70 1.00 6.66 1.04 -0.89 -5.01 113.70 117.09 1xbr s SER 119 Ca 0.72 1.19 -0.12 0.00 0.48 0.00 0.00 55.95 58.22 1xbr s SER 119 Cb -0.26 -1.85 0.19 0.00 0.10 0.00 0.00 66.02 64.20 1xbr s SER 119 CO 0.39 -3.08 1.08 0.00 0.98 0.00 0.00 173.24 172.61 1xbr s VAL 121 N -2.77 5.28 -0.21 0.00 1.01 -1.26 -4.62 120.40 117.83 1xbr s VAL 121 Ca 0.66 0.08 -0.04 0.00 0.00 0.00 0.00 61.98 62.68 1xbr s VAL 121 Cb -0.21 -3.59 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 1xbr s VAL 121 CO 0.59 0.27 -0.04 -0.47 0.00 0.00 0.00 175.10 175.46 1xbr s TYR 122 N -1.40 2.96 -0.34 5.22 5.04 0.84 -4.96 117.35 124.72 1xbr s TYR 122 Ca 0.31 -0.80 -0.23 0.00 -2.44 0.00 0.00 57.07 53.91 1xbr s TYR 122 Cb -0.13 -2.08 0.00 0.00 0.35 0.00 0.00 41.96 40.11 1xbr s TYR 122 CO 0.19 -0.45 0.76 0.42 -1.34 0.00 0.00 175.55 175.14 1xbr s ILE 123 N 1.27 4.78 -0.06 3.14 1.01 -1.26 -0.45 121.20 129.63 1xbr s ILE 123 Ca 0.03 0.98 -0.37 0.00 0.00 0.00 0.00 60.65 61.29 1xbr s ILE 123 Cb -0.14 -4.16 -0.15 0.00 0.01 0.00 0.00 42.46 38.02 1xbr s ILE 123 CO -0.01 -0.33 1.65 1.57 0.00 0.00 0.00 174.94 177.81 1xbr n HIS 124 N 6.27 2.03 0.16 3.97 -0.00 -0.21 -4.79 115.22 122.66 1xbr n HIS 124 Ca 0.03 0.37 0.16 0.00 -0.00 0.00 0.00 57.72 58.27 1xbr n HIS 124 Cb 0.48 -2.50 0.54 0.00 -0.00 0.00 0.00 29.99 28.51 1xbr n HIS 124 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1xbr h PRO 125 N 6.84 0.00 -0.00 1.57 0.13 -1.94 -0.99 132.00 137.62 1xbr h PRO 125 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1xbr h PRO 125 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1xbr h PRO 125 CO 0.90 0.00 -0.03 -0.25 -0.23 0.00 0.00 178.00 178.39 1xbr n ASP 126 N -3.08 0.09 -4.76 1.44 9.92 -1.26 -4.88 116.55 114.01 1xbr n ASP 126 Ca 0.06 -0.12 -0.39 0.00 -0.53 0.00 0.00 54.79 53.81 1xbr n ASP 126 Cb 0.81 -0.27 -0.06 0.00 -0.64 0.00 0.00 41.12 40.97 1xbr n ASP 126 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1xbr s SER 127 N -2.63 7.37 0.45 -2.24 0.01 -0.38 -3.92 113.70 112.37 1xbr s SER 127 Ca 0.26 1.99 -0.11 0.00 1.31 0.00 0.00 55.95 59.40 1xbr s SER 127 Cb 0.20 -2.60 -0.06 0.00 0.21 0.00 0.00 66.02 63.77 1xbr s SER 127 CO 0.48 -0.05 0.83 -2.16 0.41 0.00 0.00 173.24 172.75 1xbr s PRO 128 N -1.65 3.78 0.04 12.44 0.04 -1.26 -5.03 135.00 143.36 1xbr s PRO 128 Ca 0.46 0.56 -0.27 0.00 0.04 0.00 0.00 61.00 61.79 1xbr s PRO 128 Cb -0.25 -2.32 0.09 0.00 0.04 0.00 0.00 34.50 32.06 1xbr s PRO 128 CO 0.31 -0.13 0.76 1.21 0.04 0.00 0.00 177.00 179.18 1xbr s ASN 129 N -3.29 -0.49 0.62 6.66 3.84 -0.27 -4.96 114.94 117.06 1xbr s ASN 129 Ca 0.53 0.13 -0.18 0.00 0.21 0.00 0.00 52.86 53.54 1xbr s ASN 129 Cb -0.10 0.48 -0.02 0.00 -0.55 0.00 0.00 41.25 41.06 1xbr s ASN 129 CO 0.34 -0.73 1.25 -0.36 -2.79 0.00 0.00 177.10 174.81 1xbr s PHE 130 N -2.93 2.22 0.34 0.43 0.08 -1.26 -0.73 117.98 116.12 1xbr s PHE 130 Ca 0.01 1.50 0.03 0.00 0.12 0.00 0.00 56.93 58.59 1xbr s PHE 130 Cb -0.01 -3.60 0.64 0.00 -0.57 0.00 0.00 43.02 39.49 1xbr s PHE 130 CO -0.07 -2.60 1.94 0.78 -0.10 0.00 0.00 175.22 175.17 1xbr h GLY 131 N 0.69 1.10 0.78 4.36 0.00 -1.02 -0.81 103.07 108.18 1xbr h GLY 131 Ca -0.51 -0.35 0.05 0.00 0.00 0.00 0.00 47.33 46.52 1xbr h GLY 131 CO 0.54 0.27 0.56 0.00 0.00 0.00 0.00 176.54 177.91 1xbr h ALA 132 N 1.56 1.20 -0.42 3.60 0.00 -1.57 -1.37 119.26 122.26 1xbr h ALA 132 Ca 0.34 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 1xbr h ALA 132 Cb 0.20 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1xbr h ALA 132 CO -0.12 0.35 0.13 1.25 0.00 0.00 0.00 179.25 180.87 1xbr h HIS 133 N 1.05 0.67 -0.02 0.00 6.17 -1.45 -1.33 115.15 120.24 1xbr h HIS 133 Ca 0.37 -0.07 -0.07 0.00 0.71 0.00 0.00 60.37 61.32 1xbr h HIS 133 Cb 0.11 -0.19 -0.01 0.00 2.52 0.00 0.00 27.41 29.83 1xbr h HIS 133 CO -0.02 0.61 -0.29 -1.49 0.71 0.00 0.00 177.93 177.45 1xbr h TRP 134 N 0.53 0.04 0.00 5.26 4.06 -0.99 -3.08 115.95 121.78 1xbr h TRP 134 Ca 0.14 -0.01 -0.01 0.00 2.06 0.00 0.00 58.89 61.07 1xbr h TRP 134 Cb 0.25 -0.01 -0.00 0.00 -1.00 0.00 0.00 29.16 28.40 1xbr h TRP 134 CO 0.01 0.33 -1.02 -1.33 -3.56 0.00 0.00 178.44 172.87 1xbr n MET 135 N -4.18 0.61 0.20 0.49 2.81 -0.58 -4.45 117.12 112.01 1xbr n MET 135 Ca -0.02 0.13 -0.15 0.00 -1.81 0.00 0.00 57.70 55.85 1xbr n MET 135 Cb 0.35 -1.83 -0.07 0.00 -0.71 0.00 0.00 33.22 30.96 1xbr n MET 135 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 1xbr h LYS 136 N 0.00 -0.54 -5.59 0.03 3.64 -1.14 -3.45 116.57 109.51 1xbr h LYS 136 Ca -0.01 0.04 -0.45 0.00 -1.27 0.00 0.00 60.65 58.96 1xbr h LYS 136 Cb 1.02 0.12 -0.18 0.00 -0.41 0.00 0.00 32.23 32.78 1xbr h LYS 136 CO 0.00 -0.36 -0.76 -0.51 -2.27 0.00 0.00 179.45 175.54 1xbr s ASP 137 N -4.72 2.25 0.34 4.20 1.01 -1.26 -5.11 116.67 113.38 1xbr s ASP 137 Ca -0.16 -0.84 -0.26 0.00 0.71 0.00 0.00 52.55 52.00 1xbr s ASP 137 Cb 0.06 -0.10 -0.13 0.00 1.01 0.00 0.00 42.92 43.76 1xbr s ASP 137 CO 0.64 -0.11 0.97 -2.65 0.21 0.00 0.00 175.17 174.23 1xbr n PRO 138 N 0.40 1.30 -3.27 8.23 -0.02 -1.26 -4.88 135.00 135.49 1xbr n PRO 138 Ca -0.14 0.46 -0.41 0.00 -2.02 0.00 0.00 63.50 61.39 1xbr n PRO 138 Cb 0.57 -1.88 -0.08 0.00 -0.02 0.00 0.00 33.50 32.09 1xbr n PRO 138 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1xbr s VAL 139 N -1.16 5.06 -0.00 -1.45 1.01 0.11 -4.91 120.40 119.05 1xbr s VAL 139 Ca 0.60 0.45 0.03 0.00 0.00 0.00 0.00 61.98 63.06 1xbr s VAL 139 Cb -0.65 -3.89 -0.03 0.00 0.00 0.00 0.00 36.38 31.81 1xbr s VAL 139 CO 0.59 -0.10 -0.08 -0.55 0.00 0.00 0.00 175.10 174.96 1xbr s SER 140 N 1.70 4.56 -0.42 3.32 0.15 -1.26 -0.61 113.70 121.15 1xbr s SER 140 Ca 0.18 -0.15 0.04 0.00 0.70 0.00 0.00 55.95 56.72 1xbr s SER 140 Cb -0.16 -1.05 0.46 0.00 -1.71 0.00 0.00 66.02 63.57 1xbr s SER 140 CO 0.12 0.29 1.51 0.49 1.20 0.00 0.00 173.24 176.85 1xbr n PHE 141 N 1.64 2.70 0.25 3.44 3.01 -0.32 -4.82 117.46 123.36 1xbr n PHE 141 Ca -0.16 -2.41 0.13 0.00 1.01 0.00 0.00 57.45 56.02 1xbr n PHE 141 Cb 0.53 -0.73 0.62 0.00 -0.01 0.00 0.00 39.48 39.88 1xbr n PHE 141 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1xbr h SER 142 N 1.96 0.00 0.13 4.37 4.64 -1.96 -2.76 113.55 119.94 1xbr h SER 142 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 1xbr h SER 142 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1xbr h SER 142 CO 0.99 0.00 -0.66 0.29 -0.87 0.00 0.00 176.83 176.58 1xbr n LYS 143 N -2.36 0.43 -2.14 4.77 4.76 -1.26 -4.81 118.16 117.55 1xbr n LYS 143 Ca -0.00 -0.32 -0.42 0.00 -2.87 0.00 0.00 58.31 54.69 1xbr n LYS 143 Cb 0.11 -1.49 -0.03 0.00 -1.84 0.00 0.00 35.03 31.77 1xbr n LYS 143 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1xbr s VAL 144 N -2.80 3.19 -0.10 -0.18 0.11 -1.04 -5.01 120.40 114.56 1xbr s VAL 144 Ca 0.14 0.86 -0.03 0.00 -2.93 0.00 0.00 61.98 60.02 1xbr s VAL 144 Cb 0.17 -3.55 -0.03 0.00 -1.53 0.00 0.00 36.38 31.44 1xbr s VAL 144 CO 0.71 0.07 0.02 -0.54 -3.33 0.00 0.00 175.10 172.03 1xbr s LYS 145 N 1.00 3.19 -0.12 1.54 -0.14 -1.26 -4.14 119.74 119.80 1xbr s LYS 145 Ca 0.65 -0.37 -0.02 0.00 -1.36 0.00 0.00 55.97 54.87 1xbr s LYS 145 Cb -0.38 -2.89 -0.03 0.00 -1.68 0.00 0.00 37.83 32.85 1xbr s LYS 145 CO 0.31 0.64 -0.06 -0.51 -0.76 0.00 0.00 175.35 174.96 1xbr s LEU 146 N -0.69 3.13 0.18 3.17 1.43 0.12 -1.41 118.68 124.62 1xbr s LEU 146 Ca 0.11 -0.13 -0.01 0.00 -1.03 0.00 0.00 54.13 53.08 1xbr s LEU 146 Cb -0.12 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 1xbr s LEU 146 CO 0.02 0.23 0.09 0.28 0.23 0.00 0.00 176.35 177.21 1xbr s THR 147 N -0.04 0.13 -0.52 5.49 -1.32 -0.38 -0.13 115.64 118.87 1xbr s THR 147 Ca 0.00 -1.97 0.11 0.00 -1.21 0.00 0.00 61.69 58.63 1xbr s THR 147 Cb -0.13 -2.34 0.32 0.00 -1.51 0.00 0.00 72.50 68.84 1xbr s THR 147 CO 0.03 -0.19 1.25 -0.46 -2.21 0.00 0.00 174.62 173.05 1xbr n ASN 148 N -0.23 3.00 -4.47 8.08 6.94 -1.23 -0.45 115.26 126.91 1xbr n ASN 148 Ca -0.01 -2.36 -0.25 0.00 -0.02 0.00 0.00 54.58 51.94 1xbr n ASN 148 Cb 0.65 -0.30 -0.10 0.00 -2.36 0.00 0.00 39.78 37.67 1xbr n ASN 148 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1xbr s LYS 149 N -1.64 1.68 -0.45 -3.83 -0.14 -1.26 -4.92 119.74 109.18 1xbr s LYS 149 Ca 0.25 -1.67 -0.04 0.00 -1.36 0.00 0.00 55.97 53.16 1xbr s LYS 149 Cb 0.17 -1.83 0.07 0.00 -1.68 0.00 0.00 37.83 34.56 1xbr s LYS 149 CO 0.10 0.35 2.75 -1.33 -0.76 0.00 0.00 175.35 176.47 1xbr n MET 150 N -0.37 2.38 -2.93 1.68 2.81 -1.26 -4.70 117.12 114.73 1xbr n MET 150 Ca -0.07 -2.31 -0.43 0.00 -1.81 0.00 0.00 57.70 53.08 1xbr n MET 150 Cb 0.59 -2.13 -0.05 0.00 -0.71 0.00 0.00 33.22 30.92 1xbr n MET 150 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1xbr s ASN 151 N 0.35 6.50 -1.01 7.83 2.20 -1.26 -4.96 114.94 124.58 1xbr s ASN 151 Ca 0.58 0.15 -0.24 0.00 -0.94 0.00 0.00 52.86 52.42 1xbr s ASN 151 Cb 0.38 -2.40 -0.05 0.00 -2.00 0.00 0.00 41.25 37.17 1xbr s ASN 151 CO -0.21 -0.86 1.91 -0.83 -2.94 0.00 0.00 177.10 174.17 1xbr s GLY 152 N 2.02 0.27 -0.03 0.45 0.00 -1.26 -4.49 107.32 104.29 1xbr s GLY 152 Ca 0.32 -1.80 0.04 0.00 0.00 0.00 0.00 44.72 43.28 1xbr s GLY 152 CO 0.21 3.45 0.92 0.61 0.00 0.00 0.00 173.10 178.28 1xbr n GLY 153 N 6.48 0.89 1.95 0.20 0.00 -1.26 -4.95 105.19 108.49 1xbr n GLY 153 Ca 0.42 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1xbr n GLY 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xbr n GLY 154 N -0.35 0.79 3.82 -0.02 0.00 -1.26 -5.03 105.19 103.14 1xbr n GLY 154 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 1xbr n GLY 154 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xbr s GLN 155 N -0.27 4.10 -0.16 1.61 -0.21 -1.26 -4.77 119.66 118.70 1xbr s GLN 155 Ca 0.00 0.63 -0.24 0.00 0.02 0.00 0.00 55.36 55.77 1xbr s GLN 155 Cb 0.00 -3.14 -0.02 0.00 1.00 0.00 0.00 33.01 30.85 1xbr s GLN 155 CO 0.00 0.60 0.75 0.42 -2.12 0.00 0.00 175.29 174.94 1xbr s ILE 156 N -1.21 4.95 -0.11 1.08 -1.09 -0.50 -4.92 121.20 119.40 1xbr s ILE 156 Ca 0.31 1.47 -0.21 0.00 -2.23 0.00 0.00 60.65 59.99 1xbr s ILE 156 Cb -0.18 -4.07 -0.04 0.00 -1.58 0.00 0.00 42.46 36.60 1xbr s ILE 156 CO 0.18 0.09 0.62 -0.32 -1.23 0.00 0.00 174.94 174.28 1xbr s MET 157 N 1.84 4.37 0.22 2.79 -2.45 -1.26 -1.25 119.30 123.56 1xbr s MET 157 Ca 0.35 0.70 0.08 0.00 -1.25 0.00 0.00 55.69 55.57 1xbr s MET 157 Cb -0.17 -3.47 -0.05 0.00 1.25 0.00 0.00 34.83 32.40 1xbr s MET 157 CO 0.13 0.04 -0.13 -0.51 1.05 0.00 0.00 175.02 175.60 1xbr s LEU 158 N 0.95 2.54 -0.23 4.11 1.43 0.40 -4.71 118.68 123.17 1xbr s LEU 158 Ca 0.32 -1.06 -0.10 0.00 -1.03 0.00 0.00 54.13 52.27 1xbr s LEU 158 Cb -0.17 -0.67 -0.05 0.00 0.03 0.00 0.00 46.19 45.33 1xbr s LEU 158 CO 0.14 -0.20 0.13 0.20 0.23 0.00 0.00 176.35 176.85 1xbr s ASN 159 N -3.35 5.97 0.72 2.29 0.01 -1.26 -4.23 114.94 115.09 1xbr s ASN 159 Ca 0.24 0.09 -0.13 0.00 -0.71 0.00 0.00 52.86 52.36 1xbr s ASN 159 Cb 0.00 -2.07 0.03 0.00 0.41 0.00 0.00 41.25 39.62 1xbr s ASN 159 CO 0.08 0.09 1.10 -0.94 -1.51 0.00 0.00 177.10 175.91 1xbr s SER 160 N 0.92 4.83 -0.93 -1.22 1.04 -1.26 -3.25 113.70 113.84 1xbr s SER 160 Ca 0.07 1.89 0.00 0.00 0.48 0.00 0.00 55.95 58.38 1xbr s SER 160 Cb -0.13 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.46 1xbr s SER 160 CO 0.03 -1.82 0.00 0.18 0.98 0.00 0.00 173.24 172.61 1xbr n LEU 161 N -3.01 -1.22 -4.08 2.42 4.77 0.18 -4.96 117.00 111.11 1xbr n LEU 161 Ca 0.10 0.07 -0.17 0.00 -0.03 0.00 0.00 56.01 55.98 1xbr n LEU 161 Cb 0.53 -1.66 -0.13 0.00 -2.33 0.00 0.00 43.42 39.82 1xbr n LEU 161 CO 0.51 -0.24 -0.43 -1.00 -1.33 0.00 0.00 177.39 174.90 1xbr s HIS 162 N -2.46 0.88 0.01 -1.77 3.76 -1.20 -0.47 115.29 114.04 1xbr s HIS 162 Ca 0.00 -0.34 -0.20 0.00 -0.15 0.00 0.00 55.06 54.37 1xbr s HIS 162 Cb 0.00 -0.53 -0.06 0.00 1.11 0.00 0.00 32.58 33.10 1xbr s HIS 162 CO 0.00 -0.01 0.59 0.21 -0.85 0.00 0.00 174.74 174.67 1xbr s LYS 163 N -1.03 4.29 0.14 1.40 2.20 -1.26 -1.38 119.74 124.11 1xbr s LYS 163 Ca -0.02 0.73 0.02 0.00 -0.36 0.00 0.00 55.97 56.34 1xbr s LYS 163 Cb -0.07 -3.32 -0.04 0.00 -1.51 0.00 0.00 37.83 32.88 1xbr s LYS 163 CO 0.01 0.41 -0.04 0.71 -0.36 0.00 0.00 175.35 176.08 1xbr s TYR 164 N -0.34 1.11 -0.06 4.03 2.02 -0.09 -0.64 117.35 123.38 1xbr s TYR 164 Ca 0.30 -0.94 -0.03 0.00 -0.37 0.00 0.00 57.07 56.04 1xbr s TYR 164 Cb -0.18 -0.63 0.04 0.00 -0.40 0.00 0.00 41.96 40.79 1xbr s TYR 164 CO 0.17 -0.14 0.08 -2.00 -1.57 0.00 0.00 175.55 172.09 1xbr s GLU 165 N -3.86 -0.04 0.64 -0.62 2.12 0.26 -1.71 118.70 115.48 1xbr s GLU 165 Ca 0.19 0.34 -0.18 0.00 0.36 0.00 0.00 54.97 55.68 1xbr s GLU 165 Cb 0.05 -0.66 -0.02 0.00 0.26 0.00 0.00 34.13 33.76 1xbr s GLU 165 CO 0.00 -0.37 1.14 -2.30 -0.54 0.00 0.00 175.26 173.19 1xbr n PRO 166 N 5.30 0.98 -3.71 4.30 -0.02 -1.26 -1.42 135.00 139.17 1xbr n PRO 166 Ca -0.04 0.39 -0.16 0.00 -2.02 0.00 0.00 63.50 61.67 1xbr n PRO 166 Cb 0.50 -2.36 -0.15 0.00 -0.02 0.00 0.00 33.50 31.46 1xbr n PRO 166 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1xbr s ARG 167 N -3.12 0.04 -0.14 -0.52 3.52 0.17 -4.38 118.95 114.51 1xbr s ARG 167 Ca 0.80 0.42 -0.06 0.00 -0.13 0.00 0.00 55.73 56.76 1xbr s ARG 167 Cb -0.39 -0.26 -0.04 0.00 -1.56 0.00 0.00 34.95 32.70 1xbr s ARG 167 CO 0.43 -0.24 0.07 0.42 -0.81 0.00 0.00 175.30 175.18 1xbr s ILE 168 N 1.68 4.89 -0.09 4.11 1.01 -0.45 -1.15 121.20 131.21 1xbr s ILE 168 Ca -0.03 -0.01 0.03 0.00 0.00 0.00 0.00 60.65 60.64 1xbr s ILE 168 Cb -0.12 -3.15 0.01 0.00 0.01 0.00 0.00 42.46 39.21 1xbr s ILE 168 CO -0.05 0.54 -0.18 -1.00 0.00 0.00 0.00 174.94 174.24 1xbr s HIS 169 N -0.32 2.05 -0.25 3.97 3.76 -0.05 -0.43 115.29 124.03 1xbr s HIS 169 Ca 0.09 -0.82 -0.06 0.00 -0.15 0.00 0.00 55.06 54.12 1xbr s HIS 169 Cb -0.12 -1.41 -0.02 0.00 1.11 0.00 0.00 32.58 32.14 1xbr s HIS 169 CO 0.02 -0.36 0.05 0.42 -0.85 0.00 0.00 174.74 174.01 1xbr s ILE 170 N 0.51 4.07 -0.20 0.60 1.01 -0.91 -0.19 121.20 126.09 1xbr s ILE 170 Ca -0.17 -0.29 -0.01 0.00 0.00 0.00 0.00 60.65 60.18 1xbr s ILE 170 Cb -0.17 -2.91 0.01 0.00 0.01 0.00 0.00 42.46 39.40 1xbr s ILE 170 CO 0.06 0.34 -0.13 -0.69 0.00 0.00 0.00 174.94 174.52 1xbr s VAL 171 N 1.58 2.67 -0.32 2.92 1.01 0.22 -2.09 120.40 126.39 1xbr s VAL 171 Ca 0.06 -0.73 -0.29 0.00 0.00 0.00 0.00 61.98 61.02 1xbr s VAL 171 Cb -0.15 -2.18 0.01 0.00 0.00 0.00 0.00 36.38 34.07 1xbr s VAL 171 CO 0.02 0.49 1.11 -0.60 0.00 0.00 0.00 175.10 176.11 1xbr s ARG 172 N 1.37 4.05 -0.18 2.72 3.52 -1.25 -0.78 118.95 128.40 1xbr s ARG 172 Ca 0.05 1.10 -0.29 0.00 -0.13 0.00 0.00 55.73 56.47 1xbr s ARG 172 Cb -0.14 -3.76 -0.05 0.00 -1.56 0.00 0.00 34.95 29.45 1xbr s ARG 172 CO -0.08 -0.93 1.96 0.08 -0.81 0.00 0.00 175.30 175.52 1xbr s VAL 173 N 3.75 3.24 0.00 7.11 1.01 0.06 -0.39 120.40 135.19 1xbr s VAL 173 Ca 0.47 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.72 1xbr s VAL 173 Cb -0.13 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 32.98 1xbr s VAL 173 CO 0.17 -0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.74 1xbr n GLY 174 N 5.19 0.80 0.00 4.51 0.00 -1.26 -4.68 105.19 109.74 1xbr n GLY 174 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1xbr n GLY 174 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xbr n GLY 175 N -2.00 -2.99 0.00 -0.02 0.00 0.48 -5.06 105.19 95.60 1xbr n GLY 175 Ca 0.00 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.70 1xbr n GLY 175 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xbr n THR 176 N -2.00 0.00 0.00 2.61 -2.24 -1.26 -5.01 114.28 106.38 1xbr n THR 176 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1xbr n THR 176 Cb 0.00 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 67.89 1xbr n THR 176 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1xbr n GLN 177 N -0.80 0.00 0.12 -0.78 7.27 -1.26 -4.86 117.38 117.07 1xbr n GLN 177 Ca 0.00 0.00 0.10 0.00 0.07 0.00 0.00 57.00 57.17 1xbr n GLN 177 Cb 0.00 0.00 0.02 0.00 2.41 0.00 0.00 30.24 32.67 1xbr n GLN 177 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1xbr h ARG 178 N 0.00 0.00 -0.02 3.69 3.08 -2.02 -3.26 114.38 115.86 1xbr h ARG 178 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1xbr h ARG 178 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1xbr h ARG 178 CO 0.00 0.06 0.00 -1.33 -1.07 0.00 0.00 179.97 177.63 1xbr n MET 179 N -2.81 1.11 -3.39 0.04 2.81 -1.26 -4.61 117.12 109.01 1xbr n MET 179 Ca -0.00 -0.16 -0.43 0.00 -1.81 0.00 0.00 57.70 55.29 1xbr n MET 179 Cb 0.59 -1.36 -0.09 0.00 -0.71 0.00 0.00 33.22 31.65 1xbr n MET 179 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1xbr s ILE 180 N -1.98 5.17 0.23 2.02 1.01 -1.23 -3.93 121.20 122.49 1xbr s ILE 180 Ca 0.33 -0.53 0.06 0.00 0.00 0.00 0.00 60.65 60.52 1xbr s ILE 180 Cb 0.16 -3.99 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 1xbr s ILE 180 CO 0.26 -0.38 0.19 0.42 0.00 0.00 0.00 174.94 175.43 1xbr s THR 181 N 1.91 4.51 0.08 2.92 -4.23 -0.89 -4.95 115.64 114.99 1xbr s THR 181 Ca 0.08 -1.29 0.07 0.00 -1.18 0.00 0.00 61.69 59.38 1xbr s THR 181 Cb -0.18 -3.40 -0.03 0.00 1.34 0.00 0.00 72.50 70.23 1xbr s THR 181 CO 0.12 -0.28 -0.20 -0.44 -0.54 0.00 0.00 174.62 173.28 1xbr s SER 182 N -3.65 2.38 -0.10 3.99 0.01 -1.26 -2.15 113.70 112.93 1xbr s SER 182 Ca 0.32 -0.63 -0.04 0.00 1.31 0.00 0.00 55.95 56.91 1xbr s SER 182 Cb -0.09 -0.14 0.05 0.00 0.21 0.00 0.00 66.02 66.06 1xbr s SER 182 CO 0.25 0.06 0.20 -1.00 0.41 0.00 0.00 173.24 173.16 1xbr s HIS 183 N -1.09 -0.27 0.11 2.43 3.76 0.43 -4.98 115.29 115.67 1xbr s HIS 183 Ca 0.05 0.72 0.08 0.00 -0.15 0.00 0.00 55.06 55.77 1xbr s HIS 183 Cb -0.10 -0.13 -0.04 0.00 1.11 0.00 0.00 32.58 33.43 1xbr s HIS 183 CO 0.03 -0.28 -0.21 -1.12 -0.85 0.00 0.00 174.74 172.31 1xbr s SER 184 N 2.04 2.62 -0.15 1.40 0.01 -1.26 -1.34 113.70 117.02 1xbr s SER 184 Ca -0.01 -0.71 -0.00 0.00 1.31 0.00 0.00 55.95 56.54 1xbr s SER 184 Cb -0.12 -0.15 0.04 0.00 0.21 0.00 0.00 66.02 66.00 1xbr s SER 184 CO -0.07 0.06 -0.06 -0.36 0.41 0.00 0.00 173.24 173.22 1xbr s PHE 185 N -1.22 1.65 0.67 2.43 0.08 -1.26 -5.03 117.98 115.29 1xbr s PHE 185 Ca 0.08 -1.00 0.43 0.00 0.12 0.00 0.00 56.93 56.56 1xbr s PHE 185 Cb -0.10 -1.30 2.37 0.00 -0.57 0.00 0.00 43.02 43.42 1xbr s PHE 185 CO 0.05 -0.59 2.35 -1.00 -0.10 0.00 0.00 175.22 175.92 1xbr h PRO 186 N 8.13 0.00 0.00 0.24 0.13 -2.00 -1.78 132.00 136.72 1xbr h PRO 186 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1xbr h PRO 186 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1xbr h PRO 186 CO 0.40 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.56 1xbr n GLU 187 N -3.11 0.53 -0.21 0.86 4.71 -1.26 -2.83 120.64 119.33 1xbr n GLU 187 Ca -0.03 0.02 0.11 0.00 -0.01 0.00 0.00 57.16 57.25 1xbr n GLU 187 Cb 0.09 -1.50 0.22 0.00 -1.01 0.00 0.00 31.44 29.24 1xbr n GLU 187 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1xbr n THR 188 N -1.20 0.61 -2.05 2.62 -2.24 -0.67 -4.47 114.28 106.88 1xbr n THR 188 Ca 0.15 -0.81 -0.38 0.00 -2.27 0.00 0.00 64.05 60.75 1xbr n THR 188 Cb 0.18 0.87 0.01 0.00 -2.10 0.00 0.00 70.33 69.29 1xbr n THR 188 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1xbr s GLN 189 N -1.31 3.55 0.18 -0.78 0.74 -1.13 -4.45 119.66 116.46 1xbr s GLN 189 Ca 0.37 2.00 -0.19 0.00 0.05 0.00 0.00 55.36 57.59 1xbr s GLN 189 Cb 0.21 -2.39 0.04 0.00 1.10 0.00 0.00 33.01 31.96 1xbr s GLN 189 CO 0.29 -0.79 0.53 -0.59 -0.55 0.00 0.00 175.29 174.19 1xbr s PHE 190 N -1.42 -0.21 -0.22 1.67 -0.12 -0.69 -4.42 117.98 112.57 1xbr s PHE 190 Ca 0.66 -0.11 -0.06 0.00 -0.05 0.00 0.00 56.93 57.37 1xbr s PHE 190 Cb -0.34 0.42 -0.02 0.00 -0.63 0.00 0.00 43.02 42.45 1xbr s PHE 190 CO 0.41 -0.90 0.02 0.42 -0.05 0.00 0.00 175.22 175.13 1xbr s ILE 191 N -3.84 3.98 0.24 -4.49 1.01 -0.21 -0.91 121.20 116.98 1xbr s ILE 191 Ca 0.07 -0.29 -0.30 0.00 0.00 0.00 0.00 60.65 60.13 1xbr s ILE 191 Cb -0.01 -2.83 -0.09 0.00 0.01 0.00 0.00 42.46 39.54 1xbr s ILE 191 CO -0.05 0.40 1.34 0.00 0.00 0.00 0.00 174.94 176.62 1xbr s ALA 192 N 1.28 3.54 0.04 9.38 0.00 -0.48 -1.71 121.76 133.82 1xbr s ALA 192 Ca 0.04 1.19 -0.06 0.00 0.00 0.00 0.00 51.96 53.12 1xbr s ALA 192 Cb -0.15 -3.50 -0.01 0.00 0.00 0.00 0.00 23.12 19.47 1xbr s ALA 192 CO 0.01 -0.60 0.11 0.14 0.00 0.00 0.00 175.76 175.43 1xbr s VAL 193 N -0.18 0.13 -2.20 0.00 -7.23 0.18 0.51 120.40 111.61 1xbr s VAL 193 Ca 0.56 -1.05 0.24 0.00 -1.81 0.00 0.00 61.98 59.91 1xbr s VAL 193 Cb -0.38 -0.89 0.11 0.00 0.56 0.00 0.00 36.38 35.78 1xbr s VAL 193 CO 0.42 -0.58 1.25 0.35 -0.31 0.00 0.00 175.10 176.23 1xbr n THR 194 N 0.76 0.00 -3.64 5.32 -2.24 -1.26 -0.93 114.28 112.29 1xbr n THR 194 Ca -0.19 -0.28 -0.03 0.00 -2.27 0.00 0.00 64.05 61.28 1xbr n THR 194 Cb 0.58 1.10 -0.07 0.00 -2.10 0.00 0.00 70.33 69.85 1xbr n THR 194 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xbr s ALA 195 N -2.36 -2.27 0.57 6.98 0.00 -1.26 -4.86 121.76 118.55 1xbr s ALA 195 Ca 0.23 2.16 -0.20 0.00 0.00 0.00 0.00 51.96 54.15 1xbr s ALA 195 Cb 0.19 -1.70 -0.06 0.00 0.00 0.00 0.00 23.12 21.55 1xbr s ALA 195 CO 0.50 -0.33 1.03 0.66 0.00 0.00 0.00 175.76 177.62 1xbr n TYR 196 N 3.54 1.10 -0.03 0.00 4.01 -1.26 -4.96 117.16 119.56 1xbr n TYR 196 Ca -0.18 0.45 -0.05 0.00 -0.16 0.00 0.00 57.90 57.96 1xbr n TYR 196 Cb 0.57 -2.19 -0.02 0.00 -0.31 0.00 0.00 39.34 37.40 1xbr n TYR 196 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1xbr n GLN 197 N -0.86 0.12 -3.01 -0.72 1.13 -1.26 -4.95 117.38 107.83 1xbr n GLN 197 Ca 0.13 0.05 -0.43 0.00 -1.94 0.00 0.00 57.00 54.81 1xbr n GLN 197 Cb 0.46 -0.79 -0.06 0.00 0.11 0.00 0.00 30.24 29.96 1xbr n GLN 197 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1xbr s ASN 198 N -5.27 6.41 0.28 1.08 2.47 -1.26 -4.90 114.94 113.74 1xbr s ASN 198 Ca -0.07 -0.07 0.21 0.00 0.42 0.00 0.00 52.86 53.35 1xbr s ASN 198 Cb 0.03 -2.37 1.04 0.00 -1.45 0.00 0.00 41.25 38.50 1xbr s ASN 198 CO 0.10 -0.83 1.64 -1.84 -3.72 0.00 0.00 177.10 172.46 1xbr n GLU 199 N 6.50 0.15 0.07 0.43 0.28 -1.26 -1.03 120.64 125.78 1xbr n GLU 199 Ca 0.01 0.55 -0.06 0.00 -0.16 0.00 0.00 57.16 57.49 1xbr n GLU 199 Cb 0.48 -1.90 0.09 0.00 1.43 0.00 0.00 31.44 31.55 1xbr n GLU 199 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 1xbr h GLU 200 N 0.00 0.30 -0.10 3.44 4.81 -1.99 -1.62 114.58 119.42 1xbr h GLU 200 Ca 0.00 -0.21 -0.09 0.00 -0.13 0.00 0.00 59.36 58.92 1xbr h GLU 200 Cb 0.13 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.55 1xbr h GLU 200 CO 0.00 0.83 -0.29 0.82 -0.73 0.00 0.00 179.01 179.64 1xbr h ILE 201 N 0.22 1.40 -0.96 2.32 5.03 -1.45 -2.74 117.51 121.33 1xbr h ILE 201 Ca -0.01 -1.64 0.14 0.00 -0.12 0.00 0.00 64.86 63.24 1xbr h ILE 201 Cb 1.16 2.19 -0.09 0.00 -3.03 0.00 0.00 36.82 37.05 1xbr h ILE 201 CO 0.10 0.48 0.58 0.74 -0.68 0.00 0.00 178.15 179.36 1xbr h THR 202 N -0.08 0.83 -0.35 -0.27 2.02 -1.44 0.41 112.91 114.03 1xbr h THR 202 Ca -0.01 -0.29 -0.08 0.00 0.77 0.00 0.00 66.41 66.80 1xbr h THR 202 Cb 0.92 -0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 1xbr h THR 202 CO 0.06 0.15 -0.11 0.00 0.37 0.00 0.00 175.52 176.00 1xbr h ALA 203 N 1.56 1.16 -0.07 6.16 0.00 -1.22 -0.89 119.26 125.96 1xbr h ALA 203 Ca 0.51 -0.28 -0.21 0.00 0.00 0.00 0.00 54.91 54.93 1xbr h ALA 203 Cb 0.62 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1xbr h ALA 203 CO -0.31 0.53 -0.81 -0.07 0.00 0.00 0.00 179.25 178.59 1xbr h LEU 204 N 0.55 0.60 -0.36 0.00 3.38 -0.69 -1.29 115.31 117.51 1xbr h LEU 204 Ca 0.10 -0.42 -0.04 0.00 0.09 0.00 0.00 57.88 57.62 1xbr h LEU 204 Cb 0.52 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1xbr h LEU 204 CO 0.03 1.19 0.08 0.11 0.09 0.00 0.00 178.44 179.94 1xbr h LYS 205 N 0.32 0.57 -0.15 1.13 1.79 -0.79 -1.59 116.57 117.85 1xbr h LYS 205 Ca -0.05 -0.14 -0.02 0.00 -2.18 0.00 0.00 60.65 58.26 1xbr h LYS 205 Cb 1.41 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.98 1xbr h LYS 205 CO 0.15 0.62 0.03 0.82 -1.08 0.00 0.00 179.45 179.99 1xbr h ILE 206 N 0.43 1.21 -0.88 1.86 2.04 -1.18 0.35 117.51 121.33 1xbr h ILE 206 Ca 0.11 -0.67 0.04 0.00 1.00 0.00 0.00 64.86 65.34 1xbr h ILE 206 Cb 0.31 1.37 -0.05 0.00 -0.74 0.00 0.00 36.82 37.71 1xbr h ILE 206 CO 0.00 0.20 0.58 0.50 0.00 0.00 0.00 178.15 179.43 1xbr h LYS 207 N 0.03 1.07 0.00 2.37 1.63 -1.16 -3.33 116.57 117.18 1xbr h LYS 207 Ca 0.05 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1xbr h LYS 207 Cb 0.28 -0.24 -0.00 0.00 -0.60 0.00 0.00 32.23 31.67 1xbr h LYS 207 CO 0.00 0.71 -1.73 0.72 -3.45 0.00 0.00 179.45 175.70 1xbr n HIS 208 N -4.44 0.00 -3.14 1.91 8.25 -0.61 -4.92 115.22 112.27 1xbr n HIS 208 Ca 0.12 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.17 1xbr n HIS 208 Cb 0.11 -0.37 -0.07 0.00 1.12 0.00 0.00 29.99 30.78 1xbr n HIS 208 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1xbr s ASN 209 N -3.85 6.48 0.33 0.41 3.84 0.11 -4.95 114.94 117.32 1xbr s ASN 209 Ca -0.06 0.44 0.07 0.00 0.21 0.00 0.00 52.86 53.52 1xbr s ASN 209 Cb 0.10 -2.32 0.75 0.00 -0.55 0.00 0.00 41.25 39.23 1xbr s ASN 209 CO 0.66 -0.44 1.86 -0.65 -2.79 0.00 0.00 177.10 175.74 1xbr h PRO 210 N 8.15 0.75 0.00 0.43 0.11 -1.88 -0.19 132.00 139.38 1xbr h PRO 210 Ca -0.27 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1xbr h PRO 210 Cb 1.12 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1xbr h PRO 210 CO 0.78 0.50 0.00 1.19 -0.21 0.00 0.00 178.00 180.26 1xbr n PHE 211 N -4.58 0.00 -0.48 0.65 3.72 -1.26 -1.61 117.46 113.90 1xbr n PHE 211 Ca 0.18 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.65 1xbr n PHE 211 Cb 0.44 -0.22 0.19 0.00 -0.94 0.00 0.00 39.48 38.95 1xbr n PHE 211 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1xbr n ALA 212 N -1.22 2.49 -0.23 4.37 0.00 -0.08 -4.73 120.51 121.11 1xbr n ALA 212 Ca 0.07 -1.58 0.17 0.00 0.00 0.00 0.00 53.44 52.10 1xbr n ALA 212 Cb 0.09 -0.54 0.49 0.00 0.00 0.00 0.00 19.45 19.48 1xbr n ALA 212 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1xbr h LYS 213 N 1.95 0.44 -0.75 0.00 1.63 -1.36 -1.78 116.57 116.71 1xbr h LYS 213 Ca 0.00 -0.03 0.14 0.00 -0.85 0.00 0.00 60.65 59.92 1xbr h LYS 213 Cb 1.00 -0.10 -0.10 0.00 -0.60 0.00 0.00 32.23 32.44 1xbr h LYS 213 CO 0.09 0.29 0.28 0.00 -3.45 0.00 0.00 179.45 176.66 1xbr h ALA 214 N 1.62 1.04 -0.16 5.00 0.00 -1.85 0.12 119.26 125.03 1xbr h ALA 214 Ca 0.44 0.12 -0.19 0.00 0.00 0.00 0.00 54.91 55.29 1xbr h ALA 214 Cb 1.02 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1xbr h ALA 214 CO -0.17 -0.23 -0.66 0.74 0.00 0.00 0.00 179.25 178.93 1xbr h PHE 215 N 0.41 0.80 -0.06 0.00 0.04 -1.71 -2.16 116.94 114.27 1xbr h PHE 215 Ca 0.41 -0.32 -0.01 0.00 2.80 0.00 0.00 57.97 60.85 1xbr h PHE 215 Cb 0.63 -0.14 -0.00 0.00 2.20 0.00 0.00 35.95 38.65 1xbr h PHE 215 CO -0.18 1.10 -0.00 1.25 -0.60 0.00 0.00 178.31 179.88 1xbr h LEU 216 N 0.45 0.10 -0.80 1.54 5.85 -1.18 -2.79 115.31 118.48 1xbr h LEU 216 Ca -0.02 -0.33 0.11 0.00 0.84 0.00 0.00 57.88 58.49 1xbr h LEU 216 Cb 1.24 -0.03 -0.08 0.00 0.37 0.00 0.00 40.66 42.16 1xbr h LEU 216 CO 0.13 0.41 0.42 0.44 -0.34 0.00 0.00 178.44 179.49 1xbr h ASP 217 N -0.21 0.54 0.00 1.25 3.32 -0.82 0.26 116.42 120.76 1xbr h ASP 217 Ca 0.02 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1xbr h ASP 217 Cb 0.36 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1xbr h ASP 217 CO 0.00 0.28 0.07 0.00 -1.72 0.00 0.00 179.24 177.87 1xbr n ALA 218 N -2.41 0.91 -0.09 3.45 0.00 -0.81 -1.95 120.51 119.61 1xbr n ALA 218 Ca 0.14 0.09 -0.10 0.00 0.00 0.00 0.00 53.44 53.57 1xbr n ALA 218 Cb 0.34 -1.02 -0.12 0.00 0.00 0.00 0.00 19.45 18.65 1xbr n ALA 218 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xbr n LYS 219 N -1.81 1.12 0.00 0.00 5.02 0.87 -4.67 118.16 118.69 1xbr n LYS 219 Ca -0.01 0.03 0.09 0.00 -2.02 0.00 0.00 58.31 56.41 1xbr n LYS 219 Cb 0.08 -1.41 0.55 0.00 -0.02 0.00 0.00 35.03 34.23 1xbr n LYS 219 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1xbr n GLU 220 N -2.74 0.73 0.00 1.97 1.02 -0.82 -5.14 120.64 115.66 1xbr n GLU 220 Ca -0.29 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 56.98 1xbr n GLU 220 Cb 0.99 -1.40 0.35 0.00 -0.02 0.00 0.00 31.44 31.36 1xbr n GLU 220 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85