#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wt2 s VAL 64 N 0.00 2.62 0.43 3.17 -7.23 -1.26 -4.99 120.40 113.14 1wt2 s VAL 64 Ca 0.00 0.38 -0.22 0.00 -1.81 0.00 0.00 61.98 60.32 1wt2 s VAL 64 Cb 0.00 -3.13 -0.09 0.00 0.56 0.00 0.00 36.38 33.72 1wt2 s VAL 64 CO 0.00 -0.09 1.03 -0.94 -0.31 0.00 0.00 175.10 174.79 1wt2 s SER 65 N -1.64 6.65 0.64 4.85 1.04 -1.26 -5.03 113.70 118.96 1wt2 s SER 65 Ca 0.77 1.95 -0.15 0.00 0.48 0.00 0.00 55.95 59.00 1wt2 s SER 65 Cb -0.30 -2.57 -0.01 0.00 0.10 0.00 0.00 66.02 63.24 1wt2 s SER 65 CO 0.34 -0.56 1.10 -0.76 0.98 0.00 0.00 173.24 174.34 1wt2 s LEU 66 N -2.98 3.42 0.82 2.42 1.43 -1.26 -5.04 118.68 117.49 1wt2 s LEU 66 Ca 0.61 1.97 -0.10 0.00 -1.03 0.00 0.00 54.13 55.59 1wt2 s LEU 66 Cb -0.18 -4.55 0.14 0.00 0.03 0.00 0.00 46.19 41.62 1wt2 s LEU 66 CO 0.23 -1.53 1.15 -2.16 0.23 0.00 0.00 176.35 174.27 1wt2 s PRO 67 N -4.07 1.42 0.31 1.29 0.04 -1.26 -5.00 135.00 127.73 1wt2 s PRO 67 Ca 0.66 -0.49 -0.29 0.00 0.04 0.00 0.00 61.00 60.92 1wt2 s PRO 67 Cb -0.20 -2.06 -0.11 0.00 0.04 0.00 0.00 34.50 32.18 1wt2 s PRO 67 CO 0.40 -1.80 1.47 0.50 0.04 0.00 0.00 177.00 177.61 1wt2 s ARG 68 N -5.51 4.20 0.00 4.56 3.52 -1.26 -5.00 118.95 119.45 1wt2 s ARG 68 Ca 0.67 2.44 -0.01 0.00 -0.13 0.00 0.00 55.73 58.70 1wt2 s ARG 68 Cb -0.07 -3.04 -0.01 0.00 -1.56 0.00 0.00 34.95 30.28 1wt2 s ARG 68 CO 0.48 -0.47 0.02 -1.64 -0.81 0.00 0.00 175.30 172.89 1wt2 s MET 69 N -1.20 0.19 -0.20 5.12 -1.94 -1.26 -5.14 119.30 114.87 1wt2 s MET 69 Ca 0.56 -0.26 -0.02 0.00 -1.71 0.00 0.00 55.69 54.27 1wt2 s MET 69 Cb -0.44 0.07 0.00 0.00 2.01 0.00 0.00 34.83 36.47 1wt2 s MET 69 CO 0.52 -0.03 -0.11 0.08 -0.01 0.00 0.00 175.02 175.47 1wt2 s VAL 70 N -0.72 2.85 0.05 -6.03 1.01 -1.26 -5.09 120.40 111.21 1wt2 s VAL 70 Ca -0.08 -0.68 -0.25 0.00 0.00 0.00 0.00 61.98 60.98 1wt2 s VAL 70 Cb -0.05 -2.26 0.06 0.00 0.00 0.00 0.00 36.38 34.13 1wt2 s VAL 70 CO -0.00 0.48 0.58 -0.72 0.00 0.00 0.00 175.10 175.43 1wt2 s TYR 71 N 1.29 -0.50 0.55 5.22 -0.85 -1.26 -5.15 117.35 116.64 1wt2 s TYR 71 Ca 0.03 0.60 -0.21 0.00 -0.52 0.00 0.00 57.07 56.97 1wt2 s TYR 71 Cb -0.14 0.40 -0.06 0.00 0.38 0.00 0.00 41.96 42.55 1wt2 s TYR 71 CO -0.06 -0.68 1.12 -2.30 -1.52 0.00 0.00 175.55 172.12 1wt2 n PRO 72 N 0.36 1.28 -2.66 -3.49 -0.02 -1.26 -4.97 135.00 124.24 1wt2 n PRO 72 Ca -0.18 0.48 -0.36 0.00 -2.02 0.00 0.00 63.50 61.41 1wt2 n PRO 72 Cb 0.61 -2.30 -0.05 0.00 -0.02 0.00 0.00 33.50 31.73 1wt2 n PRO 72 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1wt2 s GLN 73 N -2.68 4.32 -0.15 -0.52 0.74 -1.26 -5.03 119.66 115.08 1wt2 s GLN 73 Ca 0.72 1.40 -0.18 0.00 0.05 0.00 0.00 55.36 57.35 1wt2 s GLN 73 Cb -0.44 -2.58 -0.04 0.00 1.10 0.00 0.00 33.01 31.05 1wt2 s GLN 73 CO 0.49 0.02 0.47 -1.12 -0.55 0.00 0.00 175.29 174.60 1wt2 s SER 74 N -1.66 6.62 -0.20 6.67 0.01 -1.26 -5.04 113.70 118.84 1wt2 s SER 74 Ca 0.56 0.73 -0.29 0.00 1.31 0.00 0.00 55.95 58.26 1wt2 s SER 74 Cb -0.19 -2.28 0.00 0.00 0.21 0.00 0.00 66.02 63.76 1wt2 s SER 74 CO 0.24 -0.05 1.04 -0.54 0.41 0.00 0.00 173.24 174.35 1wt2 s LYS 75 N 0.95 4.30 0.43 12.44 1.02 -1.26 -4.92 119.74 132.69 1wt2 s LYS 75 Ca 0.24 1.39 0.11 0.00 0.02 0.00 0.00 55.97 57.73 1wt2 s LYS 75 Cb -0.15 -3.62 0.93 0.00 -0.52 0.00 0.00 37.83 34.47 1wt2 s LYS 75 CO 0.10 -0.56 2.00 0.28 -0.92 0.00 0.00 175.35 176.25 1wt2 h VAL 76 N 5.36 1.12 -0.65 3.17 2.07 -2.02 -2.44 116.25 122.86 1wt2 h VAL 76 Ca -0.22 -0.48 -0.23 0.00 0.82 0.00 0.00 66.70 66.59 1wt2 h VAL 76 Cb 1.08 1.04 -0.14 0.00 -1.52 0.00 0.00 31.29 31.76 1wt2 h VAL 76 CO 0.95 0.15 0.29 0.18 0.02 0.00 0.00 177.57 179.16 1wt2 n LEU 77 N -4.38 5.47 -3.66 2.57 4.77 -1.26 -4.79 117.00 115.72 1wt2 n LEU 77 Ca -0.01 -2.86 -0.23 0.00 -0.03 0.00 0.00 56.01 52.89 1wt2 n LEU 77 Cb 0.19 -0.72 -0.18 0.00 -2.33 0.00 0.00 43.42 40.38 1wt2 n LEU 77 CO 0.36 0.77 -0.34 -0.89 -1.33 0.00 0.00 177.39 175.96 1wt2 s THR 78 N -2.54 -0.01 0.65 -5.08 2.01 -0.92 -5.14 115.64 104.61 1wt2 s THR 78 Ca 0.45 0.13 -0.16 0.00 0.31 0.00 0.00 61.69 62.42 1wt2 s THR 78 Cb 0.36 -0.39 -0.00 0.00 0.01 0.00 0.00 72.50 72.47 1wt2 s THR 78 CO 0.11 0.01 1.15 -2.84 -0.69 0.00 0.00 174.62 172.35 1wt2 s PRO 79 N 2.12 2.72 0.07 4.92 0.02 -1.26 -4.72 135.00 138.87 1wt2 s PRO 79 Ca 0.04 1.58 -0.00 0.00 0.02 0.00 0.00 61.00 62.63 1wt2 s PRO 79 Cb -0.14 -1.92 -0.26 0.00 0.02 0.00 0.00 34.50 32.20 1wt2 s PRO 79 CO -0.06 -1.34 1.11 0.00 -0.33 0.00 0.00 177.00 176.38 1wt2 s ARG 81 N -2.66 0.56 0.00 0.00 1.81 -1.26 -4.94 118.95 112.46 1wt2 s ARG 81 Ca -0.04 0.06 0.17 0.00 -1.72 0.00 0.00 55.73 54.21 1wt2 s ARG 81 Cb 0.08 -0.80 0.28 0.00 -0.45 0.00 0.00 34.95 34.06 1wt2 s ARG 81 CO 0.86 -0.21 1.20 0.36 -0.68 0.00 0.00 175.30 176.83 1wt2 n LYS 82 N 4.62 1.99 0.00 3.54 -0.00 -1.26 -4.38 118.16 122.67 1wt2 n LYS 82 Ca -0.16 -1.88 0.07 0.00 -0.00 0.00 0.00 58.31 56.34 1wt2 n LYS 82 Cb 0.50 -1.37 -0.05 0.00 -0.00 0.00 0.00 35.03 34.11 1wt2 n LYS 82 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1wt2 n ASP 83 N 1.04 1.02 -3.96 -5.58 3.85 -1.26 -5.03 116.55 106.63 1wt2 n ASP 83 Ca 0.14 -1.01 -0.09 0.00 -0.71 0.00 0.00 54.79 53.12 1wt2 n ASP 83 Cb 0.48 0.79 -0.08 0.00 -1.35 0.00 0.00 41.12 40.96 1wt2 n ASP 83 CO 0.00 0.00 0.00 0.68 -1.01 0.00 0.00 177.20 176.87 1wt2 s VAL 84 N -2.13 0.14 -0.13 2.12 -7.23 -1.26 -5.06 120.40 106.84 1wt2 s VAL 84 Ca 0.08 -1.44 -0.28 0.00 -1.81 0.00 0.00 61.98 58.53 1wt2 s VAL 84 Cb 0.11 -1.57 -0.01 0.00 0.56 0.00 0.00 36.38 35.47 1wt2 s VAL 84 CO 0.50 -0.62 0.96 -0.22 -0.31 0.00 0.00 175.10 175.41 1wt2 s LEU 85 N -2.92 4.22 0.00 1.32 2.96 -1.26 -4.89 118.68 118.11 1wt2 s LEU 85 Ca 0.10 1.42 0.12 0.00 -0.22 0.00 0.00 54.13 55.55 1wt2 s LEU 85 Cb 0.05 -3.46 0.25 0.00 0.50 0.00 0.00 46.19 43.54 1wt2 s LEU 85 CO -0.07 -0.45 1.15 1.33 -1.32 0.00 0.00 176.35 176.99 1wt2 n VAL 86 N 4.65 0.67 -3.71 1.68 0.24 -1.26 -4.76 118.33 115.84 1wt2 n VAL 86 Ca 0.08 -0.84 -0.12 0.00 -2.04 0.00 0.00 64.34 61.42 1wt2 n VAL 86 Cb 0.49 0.75 -0.10 0.00 -1.47 0.00 0.00 33.84 33.50 1wt2 n VAL 86 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1wt2 s VAL 87 N -1.00 -0.01 0.75 3.34 0.11 -1.26 -1.26 120.40 121.07 1wt2 s VAL 87 Ca 0.21 0.02 -0.09 0.00 -2.93 0.00 0.00 61.98 59.20 1wt2 s VAL 87 Cb 0.12 -0.65 0.07 0.00 -1.53 0.00 0.00 36.38 34.40 1wt2 s VAL 87 CO 0.16 0.01 1.08 0.42 -3.33 0.00 0.00 175.10 173.45 1wt2 s THR 88 N 0.58 2.16 0.25 5.04 -4.23 0.15 -4.90 115.64 114.69 1wt2 s THR 88 Ca -0.03 -0.17 0.36 0.00 -1.18 0.00 0.00 61.69 60.67 1wt2 s THR 88 Cb -0.05 -2.99 0.37 0.00 1.34 0.00 0.00 72.50 71.17 1wt2 s THR 88 CO -0.03 0.00 2.08 -0.65 -0.54 0.00 0.00 174.62 175.48 1wt2 h PRO 89 N -0.80 0.00 -0.52 3.99 0.11 -2.02 -0.85 132.00 131.90 1wt2 h PRO 89 Ca -0.45 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 1wt2 h PRO 89 Cb 1.32 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.41 1wt2 h PRO 89 CO 0.61 0.00 0.03 -2.67 -0.21 0.00 0.00 178.00 175.76 1wt2 n TRP 90 N -2.84 1.88 -2.55 0.65 2.14 -1.26 -4.95 117.44 110.51 1wt2 n TRP 90 Ca -0.01 -0.82 -0.18 0.00 2.07 0.00 0.00 57.50 58.56 1wt2 n TRP 90 Cb 0.13 -0.49 0.01 0.00 -0.81 0.00 0.00 31.31 30.15 1wt2 n TRP 90 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 1wt2 n LEU 91 N 0.28 -2.08 -4.79 5.67 4.77 -0.33 -5.02 117.00 115.51 1wt2 n LEU 91 Ca 0.28 -0.10 -0.37 0.00 -0.03 0.00 0.00 56.01 55.79 1wt2 n LEU 91 Cb 1.16 -2.58 -0.06 0.00 -2.33 0.00 0.00 43.42 39.61 1wt2 n LEU 91 CO 0.30 -0.04 -0.01 0.00 -1.33 0.00 0.00 177.39 176.31 1wt2 s ALA 92 N -2.96 3.69 0.56 -1.18 0.00 -1.26 -4.84 121.76 115.77 1wt2 s ALA 92 Ca 0.10 -0.42 -0.18 0.00 0.00 0.00 0.00 51.96 51.45 1wt2 s ALA 92 Cb -0.04 -2.30 -0.05 0.00 0.00 0.00 0.00 23.12 20.73 1wt2 s ALA 92 CO 0.12 0.33 1.10 -1.25 0.00 0.00 0.00 175.76 176.06 1wt2 s PRO 93 N -0.34 3.33 -0.29 0.00 0.04 -1.26 -0.67 135.00 135.81 1wt2 s PRO 93 Ca 0.18 1.47 -0.06 0.00 0.04 0.00 0.00 61.00 62.63 1wt2 s PRO 93 Cb -0.14 -2.02 0.01 0.00 0.04 0.00 0.00 34.50 32.40 1wt2 s PRO 93 CO 0.07 -0.84 0.06 0.42 0.04 0.00 0.00 177.00 176.75 1wt2 s ILE 94 N -2.01 3.78 -0.50 0.56 1.01 -0.39 -1.21 121.20 122.44 1wt2 s ILE 94 Ca 0.69 -0.79 -0.28 0.00 0.00 0.00 0.00 60.65 60.27 1wt2 s ILE 94 Cb -0.21 -2.97 0.01 0.00 0.01 0.00 0.00 42.46 39.31 1wt2 s ILE 94 CO 0.30 0.07 1.40 -0.69 0.00 0.00 0.00 174.94 176.01 1wt2 s VAL 95 N 1.46 3.86 0.16 2.92 1.01 0.47 -4.70 120.40 125.58 1wt2 s VAL 95 Ca 0.02 0.80 0.09 0.00 0.00 0.00 0.00 61.98 62.88 1wt2 s VAL 95 Cb -0.17 -4.36 -0.04 0.00 0.00 0.00 0.00 36.38 31.80 1wt2 s VAL 95 CO 0.01 -1.01 -0.19 0.26 0.00 0.00 0.00 175.10 174.18 1wt2 s TRP 96 N 5.74 1.84 0.26 5.22 0.52 -1.26 -2.02 118.94 129.24 1wt2 s TRP 96 Ca 0.55 -0.46 -0.30 0.00 0.02 0.00 0.00 56.10 55.91 1wt2 s TRP 96 Cb -0.11 -0.93 -0.11 0.00 -1.15 0.00 0.00 33.47 31.17 1wt2 s TRP 96 CO 0.28 0.33 1.53 -2.00 0.02 0.00 0.00 176.95 177.11 1wt2 s GLU 97 N -2.71 4.19 0.00 4.98 2.56 -1.26 -1.94 118.70 124.53 1wt2 s GLU 97 Ca 0.15 2.44 0.00 0.00 0.00 0.00 0.00 54.97 57.56 1wt2 s GLU 97 Cb -0.06 -3.07 0.00 0.00 2.00 0.00 0.00 34.13 32.99 1wt2 s GLU 97 CO 0.07 -0.54 0.00 0.41 -0.56 0.00 0.00 175.26 174.64 1wt2 n GLY 98 N 2.35 3.05 0.18 -1.50 0.00 -1.26 -4.92 105.19 103.09 1wt2 n GLY 98 Ca 0.08 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.21 1wt2 n GLY 98 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1wt2 h THR 99 N 0.00 0.07 -3.62 2.61 1.35 -1.75 -3.47 112.91 108.09 1wt2 h THR 99 Ca 0.00 -1.11 -0.45 0.00 -0.55 0.00 0.00 66.41 64.30 1wt2 h THR 99 Cb 0.00 1.89 -0.19 0.00 -1.73 0.00 0.00 68.15 68.12 1wt2 h THR 99 CO 0.00 0.04 -0.77 0.72 -0.25 0.00 0.00 175.52 175.26 1wt2 s PHE 100 N -3.23 1.51 -0.42 4.73 -0.12 -1.26 -5.05 117.98 114.14 1wt2 s PHE 100 Ca 0.04 -0.51 -0.11 0.00 -0.05 0.00 0.00 56.93 56.30 1wt2 s PHE 100 Cb 0.07 -0.79 0.06 0.00 -0.63 0.00 0.00 43.02 41.72 1wt2 s PHE 100 CO 0.71 0.18 0.27 1.21 -0.05 0.00 0.00 175.22 177.54 1wt2 s ASN 101 N -2.33 5.79 0.53 1.98 3.84 -1.26 -4.96 114.94 118.54 1wt2 s ASN 101 Ca 0.08 -1.28 0.28 0.00 0.21 0.00 0.00 52.86 52.15 1wt2 s ASN 101 Cb -0.06 -2.05 1.51 0.00 -0.55 0.00 0.00 41.25 40.10 1wt2 s ASN 101 CO 0.04 -0.51 2.10 -0.29 -2.79 0.00 0.00 177.10 175.65 1wt2 h ILE 102 N 5.93 0.55 -0.48 -5.21 6.09 -1.99 -2.59 117.51 119.82 1wt2 h ILE 102 Ca -0.25 -0.45 -0.13 0.00 -1.37 0.00 0.00 64.86 62.67 1wt2 h ILE 102 Cb 1.10 1.29 -0.01 0.00 0.47 0.00 0.00 36.82 39.66 1wt2 h ILE 102 CO 0.75 0.10 -0.20 0.44 -3.07 0.00 0.00 178.15 176.17 1wt2 h ASP 103 N 0.00 1.01 -0.16 2.19 3.32 -1.99 0.16 116.42 120.95 1wt2 h ASP 103 Ca -0.00 -0.39 -0.04 0.00 0.02 0.00 0.00 57.03 56.62 1wt2 h ASP 103 Cb 0.28 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1wt2 h ASP 103 CO 0.01 1.17 -0.06 0.40 -1.72 0.00 0.00 179.24 179.04 1wt2 h ILE 104 N 0.84 1.30 -0.70 0.35 2.04 -1.90 -2.37 117.51 117.07 1wt2 h ILE 104 Ca 0.11 -1.07 -0.05 0.00 1.00 0.00 0.00 64.86 64.85 1wt2 h ILE 104 Cb 0.77 1.67 -0.03 0.00 -0.74 0.00 0.00 36.82 38.49 1wt2 h ILE 104 CO 0.06 0.32 0.25 -0.07 0.00 0.00 0.00 178.15 178.71 1wt2 h LEU 105 N 0.02 0.99 -0.73 1.44 3.38 -1.43 -1.80 115.31 117.18 1wt2 h LEU 105 Ca 0.04 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.82 1wt2 h LEU 105 Cb 0.52 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 1wt2 h LEU 105 CO 0.02 0.92 0.48 0.78 0.09 0.00 0.00 178.44 180.72 1wt2 h ASN 106 N 1.01 0.84 0.11 -0.43 2.35 -0.64 -1.54 115.58 117.28 1wt2 h ASN 106 Ca 0.23 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.95 1wt2 h ASN 106 Cb 0.26 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.41 1wt2 h ASN 106 CO -0.01 0.61 -0.08 -0.33 -1.65 0.00 0.00 177.43 175.97 1wt2 h GLU 107 N 0.98 -0.19 -0.41 0.81 4.39 -1.09 0.46 114.58 119.54 1wt2 h GLU 107 Ca 0.27 0.01 0.06 0.00 0.34 0.00 0.00 59.36 60.04 1wt2 h GLU 107 Cb -0.11 0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 28.53 1wt2 h GLU 107 CO -0.06 -0.13 0.10 1.96 -1.16 0.00 0.00 179.01 179.72 1wt2 h GLN 108 N -0.20 0.23 0.00 2.33 4.20 -0.99 -0.99 115.11 119.69 1wt2 h GLN 108 Ca -0.01 -0.01 -0.16 0.00 0.06 0.00 0.00 58.65 58.53 1wt2 h GLN 108 Cb 0.18 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 1wt2 h GLN 108 CO -0.00 0.15 -0.77 0.74 -0.67 0.00 0.00 178.83 178.28 1wt2 h PHE 109 N 0.24 0.00 -0.22 2.96 -1.00 -1.17 -3.14 116.94 114.61 1wt2 h PHE 109 Ca 0.20 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 60.79 1wt2 h PHE 109 Cb 0.23 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.79 1wt2 h PHE 109 CO -0.19 0.77 -0.60 0.00 -1.61 0.00 0.00 178.31 176.68 1wt2 h ARG 110 N 0.00 0.74 0.00 1.51 2.47 -0.65 -2.33 114.38 116.12 1wt2 h ARG 110 Ca -0.01 -0.50 0.00 0.00 -1.26 0.00 0.00 59.98 58.21 1wt2 h ARG 110 Cb 1.37 0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.76 1wt2 h ARG 110 CO 0.10 1.12 0.00 -0.07 0.56 0.00 0.00 179.97 181.68 1wt2 h LEU 111 N 0.55 0.00 -0.60 3.04 3.38 -1.20 0.13 115.31 120.61 1wt2 h LEU 111 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wt2 h LEU 111 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1wt2 h LEU 111 CO 0.12 0.00 -0.45 0.00 0.09 0.00 0.00 178.44 178.21 1wt2 n GLN 112 N -2.81 0.83 -3.63 1.13 1.13 -0.97 -4.82 117.38 108.24 1wt2 n GLN 112 Ca -0.01 -0.60 -0.22 0.00 -1.94 0.00 0.00 57.00 54.22 1wt2 n GLN 112 Cb 0.14 -1.49 0.06 0.00 0.11 0.00 0.00 30.24 29.06 1wt2 n GLN 112 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1wt2 n ASN 113 N -0.56 -3.02 -4.75 1.08 3.02 0.45 -4.90 115.26 106.59 1wt2 n ASN 113 Ca 0.10 -0.70 -0.41 0.00 -0.03 0.00 0.00 54.58 53.53 1wt2 n ASN 113 Cb 0.39 -4.55 -0.02 0.00 -0.61 0.00 0.00 39.78 34.99 1wt2 n ASN 113 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1wt2 s THR 114 N -3.45 2.74 -0.14 3.41 2.01 -0.92 -4.98 115.64 114.32 1wt2 s THR 114 Ca 0.22 0.63 0.01 0.00 0.31 0.00 0.00 61.69 62.86 1wt2 s THR 114 Cb -0.10 -3.40 0.00 0.00 0.01 0.00 0.00 72.50 69.00 1wt2 s THR 114 CO 0.77 0.10 -0.18 -0.89 -0.69 0.00 0.00 174.62 173.74 1wt2 s THR 115 N -0.07 2.46 -0.16 -0.82 2.01 -1.26 -3.41 115.64 114.39 1wt2 s THR 115 Ca 0.58 -0.85 -0.03 0.00 0.31 0.00 0.00 61.69 61.70 1wt2 s THR 115 Cb -0.41 -2.01 -0.02 0.00 0.01 0.00 0.00 72.50 70.07 1wt2 s THR 115 CO 0.43 0.53 -0.06 -0.63 -0.69 0.00 0.00 174.62 174.20 1wt2 s ILE 116 N 0.71 3.60 -0.11 1.82 1.09 -0.08 -0.98 121.20 127.25 1wt2 s ILE 116 Ca -0.08 -0.46 -0.11 0.00 -1.10 0.00 0.00 60.65 58.90 1wt2 s ILE 116 Cb -0.16 -2.57 -0.05 0.00 -1.06 0.00 0.00 42.46 38.62 1wt2 s ILE 116 CO 0.01 0.49 0.24 -0.83 -0.10 0.00 0.00 174.94 174.76 1wt2 s GLY 117 N 0.51 2.24 -0.20 6.18 0.00 0.12 -1.16 107.32 115.00 1wt2 s GLY 117 Ca -0.05 -0.49 0.02 0.00 0.00 0.00 0.00 44.72 44.19 1wt2 s GLY 117 CO 0.03 0.01 -0.16 -2.27 0.00 0.00 0.00 173.10 170.71 1wt2 s LEU 118 N -0.52 2.50 -0.08 0.66 2.96 -0.29 -0.34 118.68 123.57 1wt2 s LEU 118 Ca 0.17 -0.88 -0.01 0.00 -0.22 0.00 0.00 54.13 53.19 1wt2 s LEU 118 Cb -0.13 -1.47 -0.03 0.00 0.50 0.00 0.00 46.19 45.06 1wt2 s LEU 118 CO 0.06 -0.07 -0.01 0.42 -1.32 0.00 0.00 176.35 175.43 1wt2 s THR 119 N 1.25 4.23 -0.02 3.68 -4.23 0.19 -0.59 115.64 120.15 1wt2 s THR 119 Ca 0.00 -0.28 -0.09 0.00 -1.18 0.00 0.00 61.69 60.14 1wt2 s THR 119 Cb -0.15 -2.77 0.01 0.00 1.34 0.00 0.00 72.50 70.92 1wt2 s THR 119 CO -0.10 0.60 0.19 0.68 -0.54 0.00 0.00 174.62 175.45 1wt2 s VAL 120 N -0.88 0.06 -0.12 2.29 -7.23 -0.62 -2.46 120.40 111.43 1wt2 s VAL 120 Ca 0.13 -0.47 -0.01 0.00 -1.81 0.00 0.00 61.98 59.83 1wt2 s VAL 120 Cb -0.11 -0.44 -0.02 0.00 0.56 0.00 0.00 36.38 36.36 1wt2 s VAL 120 CO 0.02 -0.26 -0.09 -0.36 -0.31 0.00 0.00 175.10 174.11 1wt2 s PHE 121 N -0.98 2.90 -0.40 2.82 0.40 -1.26 -1.14 117.98 120.32 1wt2 s PHE 121 Ca -0.11 -0.35 0.02 0.00 -0.60 0.00 0.00 56.93 55.89 1wt2 s PHE 121 Cb -0.06 -1.84 0.15 0.00 0.51 0.00 0.00 43.02 41.78 1wt2 s PHE 121 CO 0.02 -0.01 0.27 0.00 0.70 0.00 0.00 175.22 176.19 1wt2 s ALA 122 N 0.04 1.45 0.11 5.36 0.00 0.51 -4.45 121.76 124.79 1wt2 s ALA 122 Ca -0.02 -2.27 0.03 0.00 0.00 0.00 0.00 51.96 49.70 1wt2 s ALA 122 Cb -0.14 -1.69 -0.04 0.00 0.00 0.00 0.00 23.12 21.25 1wt2 s ALA 122 CO 0.03 -2.06 0.11 0.42 0.00 0.00 0.00 175.76 174.26 1wt2 s ILE 123 N 0.52 4.59 0.00 0.00 1.09 -1.26 -3.89 121.20 122.24 1wt2 s ILE 123 Ca 0.22 -0.84 0.00 0.00 -1.10 0.00 0.00 60.65 58.93 1wt2 s ILE 123 Cb -0.15 -3.26 0.00 0.00 -1.06 0.00 0.00 42.46 37.99 1wt2 s ILE 123 CO -0.06 0.05 0.00 0.29 -0.10 0.00 0.00 174.94 175.12 1wt2 n LYS 124 N 0.16 0.00 0.26 2.79 5.02 -1.26 -1.68 118.16 123.46 1wt2 n LYS 124 Ca -0.08 0.00 0.18 0.00 -2.02 0.00 0.00 58.31 56.38 1wt2 n LYS 124 Cb 0.53 0.00 0.82 0.00 -0.02 0.00 0.00 35.03 36.36 1wt2 n LYS 124 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 1wt2 h LYS 125 N 0.00 0.00 0.00 1.97 -0.00 -2.05 -3.09 116.57 113.41 1wt2 h LYS 125 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.65 1wt2 h LYS 125 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.23 1wt2 h LYS 125 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 179.45 180.11 1wt2 n TYR 126 N -2.86 0.00 0.27 0.07 4.02 -0.68 -2.32 117.16 115.67 1wt2 n TYR 126 Ca -0.01 0.00 0.15 0.00 -0.01 0.00 0.00 57.90 58.03 1wt2 n TYR 126 Cb 0.18 -0.48 0.72 0.00 -0.02 0.00 0.00 39.34 39.75 1wt2 n TYR 126 CO 0.00 0.00 0.00 -0.39 -1.01 0.00 0.00 176.86 175.46 1wt2 h VAL 127 N 0.00 0.31 0.00 -0.72 -1.51 -1.72 -2.25 116.25 110.36 1wt2 h VAL 127 Ca 0.00 -0.59 0.00 0.00 -1.23 0.00 0.00 66.70 64.88 1wt2 h VAL 127 Cb 0.18 1.45 0.00 0.00 -2.13 0.00 0.00 31.29 30.78 1wt2 h VAL 127 CO 0.00 0.09 0.00 0.00 -1.23 0.00 0.00 177.57 176.43 1wt2 n ALA 128 N -2.18 1.51 0.76 5.19 0.00 -0.98 -2.37 120.51 122.45 1wt2 n ALA 128 Ca -0.01 0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.62 1wt2 n ALA 128 Cb 0.28 -1.33 0.13 0.00 0.00 0.00 0.00 19.45 18.53 1wt2 n ALA 128 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1wt2 n PHE 129 N -2.07 0.21 -0.22 0.00 3.01 -0.85 -4.44 117.46 113.10 1wt2 n PHE 129 Ca 0.02 0.06 -0.02 0.00 1.01 0.00 0.00 57.45 58.51 1wt2 n PHE 129 Cb 0.17 -0.38 0.09 0.00 -0.01 0.00 0.00 39.48 39.35 1wt2 n PHE 129 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1wt2 h LEU 130 N 0.00 0.52 0.33 4.37 3.38 -1.61 -2.29 115.31 120.01 1wt2 h LEU 130 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1wt2 h LEU 130 Cb 0.63 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 1wt2 h LEU 130 CO 0.00 0.34 -0.44 0.50 0.09 0.00 0.00 178.44 178.93 1wt2 h LYS 131 N 0.66 -0.79 -0.82 1.13 3.64 -1.80 -0.14 116.57 118.45 1wt2 h LYS 131 Ca 0.28 0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.71 1wt2 h LYS 131 Cb 0.17 0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 32.13 1wt2 h LYS 131 CO -0.17 -0.52 0.47 1.25 -2.27 0.00 0.00 179.45 178.20 1wt2 h LEU 132 N -0.82 1.01 0.49 5.20 5.85 -1.85 -0.10 115.31 125.10 1wt2 h LEU 132 Ca -0.02 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.59 1wt2 h LEU 132 Cb 0.75 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 1wt2 h LEU 132 CO -0.13 0.81 -0.33 0.15 -0.34 0.00 0.00 178.44 178.60 1wt2 h PHE 133 N 1.14 -0.87 -0.57 1.25 3.57 -1.15 -0.98 116.94 119.34 1wt2 h PHE 133 Ca 0.29 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.71 1wt2 h PHE 133 Cb 0.00 0.31 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 1wt2 h PHE 133 CO 0.00 -0.49 0.07 -0.07 -2.23 0.00 0.00 178.31 175.59 1wt2 h LEU 134 N -0.79 0.93 -0.45 0.59 3.38 -0.93 -1.04 115.31 117.02 1wt2 h LEU 134 Ca -0.05 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 1wt2 h LEU 134 Cb 0.65 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1wt2 h LEU 134 CO 0.04 0.97 0.27 -0.33 0.09 0.00 0.00 178.44 179.48 1wt2 h GLU 135 N 0.86 0.61 -0.01 1.13 5.08 -0.95 -1.13 114.58 120.17 1wt2 h GLU 135 Ca 0.17 -0.06 -0.13 0.00 -1.00 0.00 0.00 59.36 58.35 1wt2 h GLU 135 Cb 0.45 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1wt2 h GLU 135 CO 0.02 0.45 -0.59 1.79 -1.00 0.00 0.00 179.01 179.68 1wt2 h THR 136 N 0.59 1.42 -0.44 1.13 1.35 -1.11 -2.84 112.91 113.02 1wt2 h THR 136 Ca 0.16 -2.02 -0.07 0.00 -0.55 0.00 0.00 66.41 63.93 1wt2 h THR 136 Cb 0.00 2.08 -0.02 0.00 -1.73 0.00 0.00 68.15 68.48 1wt2 h THR 136 CO -0.03 0.58 -0.02 0.00 -0.25 0.00 0.00 175.52 175.79 1wt2 h ALA 137 N 1.39 1.14 0.00 6.62 0.00 -0.74 -0.98 119.26 126.70 1wt2 h ALA 137 Ca -0.01 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 1wt2 h ALA 137 Cb 1.05 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 1wt2 h ALA 137 CO 0.08 0.55 -0.13 0.93 0.00 0.00 0.00 179.25 180.68 1wt2 h GLU 138 N 0.68 0.00 0.00 0.00 4.39 -0.97 0.31 114.58 118.98 1wt2 h GLU 138 Ca 0.13 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.71 1wt2 h GLU 138 Cb 0.45 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.08 1wt2 h GLU 138 CO 0.02 0.13 -1.43 1.17 -1.16 0.00 0.00 179.01 177.74 1wt2 n LYS 139 N -3.92 0.63 0.00 2.33 0.00 -0.74 -4.69 118.16 111.77 1wt2 n LYS 139 Ca -0.02 0.13 0.00 0.00 0.00 0.00 0.00 58.31 58.42 1wt2 n LYS 139 Cb 0.22 -1.76 0.00 0.00 0.00 0.00 0.00 35.03 33.49 1wt2 n LYS 139 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1wt2 n HIS 140 N -2.75 0.00 -3.30 5.64 8.25 -0.45 -4.93 115.22 117.68 1wt2 n HIS 140 Ca -0.08 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.96 1wt2 n HIS 140 Cb 0.75 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.78 1wt2 n HIS 140 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1wt2 s PHE 141 N -0.90 3.17 -1.38 4.41 5.36 0.11 -1.53 117.98 127.22 1wt2 s PHE 141 Ca 0.00 -0.09 -0.11 0.00 -0.96 0.00 0.00 56.93 55.77 1wt2 s PHE 141 Cb 0.00 -2.88 0.08 0.00 -0.34 0.00 0.00 43.02 39.89 1wt2 s PHE 141 CO 0.00 -0.59 0.59 -1.33 -1.46 0.00 0.00 175.22 172.43 1wt2 n MET 142 N 5.64 -3.65 -1.71 10.12 2.81 -0.16 -4.82 117.12 125.35 1wt2 n MET 142 Ca -0.07 0.49 -0.42 0.00 -1.81 0.00 0.00 57.70 55.89 1wt2 n MET 142 Cb 0.48 -5.23 -0.03 0.00 -0.71 0.00 0.00 33.22 27.74 1wt2 n MET 142 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1wt2 s VAL 143 N -3.03 2.65 0.00 2.03 1.01 -1.26 -1.32 120.40 120.48 1wt2 s VAL 143 Ca 0.48 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.50 1wt2 s VAL 143 Cb -0.25 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.10 1wt2 s VAL 143 CO 0.59 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.30 1wt2 n GLY 144 N 4.30 2.41 3.81 4.51 0.00 -1.26 -5.08 105.19 113.89 1wt2 n GLY 144 Ca 0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.98 1wt2 n GLY 144 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1wt2 s HIS 145 N -2.41 2.78 -0.02 1.61 4.02 -0.43 -5.07 115.29 115.78 1wt2 s HIS 145 Ca 0.00 -0.38 -0.30 0.00 1.02 0.00 0.00 55.06 55.39 1wt2 s HIS 145 Cb 0.00 -1.84 -0.04 0.00 -1.02 0.00 0.00 32.58 29.69 1wt2 s HIS 145 CO 0.00 0.17 1.13 1.03 1.02 0.00 0.00 174.74 178.09 1wt2 s ARG 146 N -3.97 4.42 -0.02 1.40 0.52 -1.22 -4.80 118.95 115.29 1wt2 s ARG 146 Ca 0.41 1.62 0.05 0.00 -0.52 0.00 0.00 55.73 57.29 1wt2 s ARG 146 Cb -0.04 -3.47 -0.01 0.00 0.52 0.00 0.00 34.95 31.95 1wt2 s ARG 146 CO 0.25 -0.30 -0.16 0.08 0.02 0.00 0.00 175.30 175.20 1wt2 s VAL 147 N 1.61 1.25 -0.20 3.52 1.01 -1.04 -0.90 120.40 125.65 1wt2 s VAL 147 Ca 0.55 -0.66 -0.00 0.00 0.00 0.00 0.00 61.98 61.87 1wt2 s VAL 147 Cb -0.25 -1.05 0.05 0.00 0.00 0.00 0.00 36.38 35.14 1wt2 s VAL 147 CO 0.25 0.36 -0.04 -2.28 0.00 0.00 0.00 175.10 173.38 1wt2 s HIS 148 N -0.26 1.94 0.05 5.22 2.46 -0.31 -1.07 115.29 123.31 1wt2 s HIS 148 Ca 0.04 -1.36 -0.21 0.00 0.47 0.00 0.00 55.06 53.99 1wt2 s HIS 148 Cb -0.07 -1.40 -0.06 0.00 -0.13 0.00 0.00 32.58 30.91 1wt2 s HIS 148 CO -0.00 -0.69 0.64 0.71 -2.47 0.00 0.00 174.74 172.93 1wt2 s TYR 149 N 1.55 3.76 -0.25 3.88 1.51 0.39 -1.14 117.35 127.05 1wt2 s TYR 149 Ca -0.02 1.32 0.02 0.00 -1.01 0.00 0.00 57.07 57.38 1wt2 s TYR 149 Cb -0.17 -2.63 0.06 0.00 -0.11 0.00 0.00 41.96 39.11 1wt2 s TYR 149 CO -0.07 0.43 -0.07 0.71 -1.11 0.00 0.00 175.55 175.44 1wt2 s TYR 150 N -0.58 2.84 -0.38 2.71 1.51 0.24 -0.36 117.35 123.35 1wt2 s TYR 150 Ca 0.32 -2.08 -0.10 0.00 -1.01 0.00 0.00 57.07 54.20 1wt2 s TYR 150 Cb -0.20 -1.82 0.03 0.00 -0.11 0.00 0.00 41.96 39.87 1wt2 s TYR 150 CO 0.20 -0.83 0.20 0.08 -1.11 0.00 0.00 175.55 174.09 1wt2 s VAL 151 N 1.24 4.47 -0.28 0.71 1.01 -0.39 -1.60 120.40 125.57 1wt2 s VAL 151 Ca -0.06 -0.94 -0.18 0.00 0.00 0.00 0.00 61.98 60.80 1wt2 s VAL 151 Cb -0.19 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.64 1wt2 s VAL 151 CO -0.06 -0.26 0.54 -0.36 0.00 0.00 0.00 175.10 174.96 1wt2 s PHE 152 N 1.53 3.25 0.09 5.22 0.40 -0.29 -0.52 117.98 127.66 1wt2 s PHE 152 Ca 0.02 0.58 -0.08 0.00 -0.60 0.00 0.00 56.93 56.84 1wt2 s PHE 152 Cb -0.20 -2.80 -0.00 0.00 0.51 0.00 0.00 43.02 40.53 1wt2 s PHE 152 CO 0.06 -0.35 0.19 -0.08 0.70 0.00 0.00 175.22 175.73 1wt2 s THR 153 N 2.39 0.14 -2.58 0.64 -1.32 -0.07 -0.36 115.64 114.48 1wt2 s THR 153 Ca 0.22 -1.24 0.23 0.00 -1.21 0.00 0.00 61.69 59.69 1wt2 s THR 153 Cb -0.15 -1.40 0.38 0.00 -1.51 0.00 0.00 72.50 69.81 1wt2 s THR 153 CO 0.10 -0.63 1.40 -0.90 -2.21 0.00 0.00 174.62 172.38 1wt2 n ASP 154 N -0.07 3.11 -3.25 8.08 5.75 -1.25 -1.29 116.55 127.63 1wt2 n ASP 154 Ca -0.14 -1.95 -0.25 0.00 -0.01 0.00 0.00 54.79 52.44 1wt2 n ASP 154 Cb 0.62 -0.17 -0.07 0.00 -1.03 0.00 0.00 41.12 40.47 1wt2 n ASP 154 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1wt2 n GLN 155 N 1.30 1.08 -0.26 0.11 6.02 -1.26 -4.94 117.38 119.43 1wt2 n GLN 155 Ca 0.18 -3.53 0.06 0.00 -0.01 0.00 0.00 57.00 53.70 1wt2 n GLN 155 Cb 0.57 -1.46 0.20 0.00 1.02 0.00 0.00 30.24 30.57 1wt2 n GLN 155 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 1wt2 h PRO 156 N 4.11 0.42 0.00 -1.09 0.11 -1.95 -0.02 132.00 133.58 1wt2 h PRO 156 Ca 0.11 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1wt2 h PRO 156 Cb 0.83 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.85 1wt2 h PRO 156 CO 0.54 0.28 0.00 0.00 -0.21 0.00 0.00 178.00 178.60 1wt2 n ALA 157 N -2.52 1.70 1.11 -0.75 0.00 -1.26 -2.59 120.51 116.21 1wt2 n ALA 157 Ca 0.15 -0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.69 1wt2 n ALA 157 Cb 0.44 -1.29 0.24 0.00 0.00 0.00 0.00 19.45 18.85 1wt2 n ALA 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wt2 n ALA 158 N -1.57 3.45 -2.12 0.00 0.00 -0.02 -4.89 120.51 115.36 1wt2 n ALA 158 Ca 0.03 -0.44 -0.42 0.00 0.00 0.00 0.00 53.44 52.61 1wt2 n ALA 158 Cb 0.20 -1.05 -0.03 0.00 0.00 0.00 0.00 19.45 18.57 1wt2 n ALA 158 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1wt2 s VAL 159 N -2.70 3.56 0.51 0.00 1.01 -1.07 -4.96 120.40 116.75 1wt2 s VAL 159 Ca 0.18 0.89 -0.22 0.00 0.00 0.00 0.00 61.98 62.83 1wt2 s VAL 159 Cb 0.18 -3.58 -0.06 0.00 0.00 0.00 0.00 36.38 32.93 1wt2 s VAL 159 CO 0.62 -0.02 1.27 -2.84 0.00 0.00 0.00 175.10 174.12 1wt2 s PRO 160 N 2.87 3.41 -0.72 2.72 0.02 -1.26 -4.95 135.00 137.10 1wt2 s PRO 160 Ca 0.68 2.03 -0.23 0.00 0.02 0.00 0.00 61.00 63.49 1wt2 s PRO 160 Cb -0.33 -2.32 0.07 0.00 0.02 0.00 0.00 34.50 31.93 1wt2 s PRO 160 CO 0.28 -0.91 1.07 0.50 -0.33 0.00 0.00 177.00 177.61 1wt2 s ARG 161 N -2.82 3.19 -0.12 5.54 6.06 -1.26 -4.97 118.95 124.57 1wt2 s ARG 161 Ca 0.68 -0.79 -0.09 0.00 -2.50 0.00 0.00 55.73 53.03 1wt2 s ARG 161 Cb -0.35 -4.33 -0.04 0.00 0.06 0.00 0.00 34.95 30.29 1wt2 s ARG 161 CO 0.42 -1.91 0.18 0.08 -2.50 0.00 0.00 175.30 171.58 1wt2 s VAL 162 N 4.37 5.42 -0.09 7.11 1.01 -1.26 -5.06 120.40 131.89 1wt2 s VAL 162 Ca 0.27 0.31 -0.30 0.00 0.00 0.00 0.00 61.98 62.27 1wt2 s VAL 162 Cb -0.13 -3.47 -0.02 0.00 0.00 0.00 0.00 36.38 32.76 1wt2 s VAL 162 CO 0.09 0.58 1.06 -0.89 0.00 0.00 0.00 175.10 175.93 1wt2 s THR 163 N -0.78 4.64 -0.00 3.92 2.01 -1.26 -5.03 115.64 119.14 1wt2 s THR 163 Ca 0.15 1.92 0.02 0.00 0.31 0.00 0.00 61.69 64.09 1wt2 s THR 163 Cb -0.13 -4.23 -0.04 0.00 0.01 0.00 0.00 72.50 68.11 1wt2 s THR 163 CO 0.05 0.01 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.22 1wt2 s LEU 164 N 2.02 3.47 0.99 4.42 1.43 -1.26 -5.00 118.68 124.74 1wt2 s LEU 164 Ca 0.51 -0.03 -0.12 0.00 -1.03 0.00 0.00 54.13 53.45 1wt2 s LEU 164 Cb -0.20 -1.99 0.18 0.00 0.03 0.00 0.00 46.19 44.21 1wt2 s LEU 164 CO 0.19 0.28 1.10 -0.83 0.23 0.00 0.00 176.35 177.32 1wt2 s GLY 165 N -1.53 1.57 0.56 -3.19 0.00 -1.26 -4.94 107.32 98.51 1wt2 s GLY 165 Ca 0.19 -0.38 -0.20 0.00 0.00 0.00 0.00 44.72 44.32 1wt2 s GLY 165 CO 0.10 0.22 1.25 -1.08 0.00 0.00 0.00 173.10 173.60 1wt2 s THR 166 N -3.01 2.49 0.00 0.90 -1.32 -1.26 -2.89 115.64 110.55 1wt2 s THR 166 Ca 0.65 0.34 0.00 0.00 -1.21 0.00 0.00 61.69 61.47 1wt2 s THR 166 Cb -0.18 -3.15 0.00 0.00 -1.51 0.00 0.00 72.50 67.66 1wt2 s THR 166 CO 0.57 -0.04 0.00 0.61 -2.21 0.00 0.00 174.62 173.55 1wt2 n GLY 167 N 0.60 0.65 3.22 6.08 0.00 -1.26 -4.97 105.19 109.52 1wt2 n GLY 167 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1wt2 n GLY 167 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wt2 s ARG 168 N -0.10 2.12 0.15 1.61 0.52 -1.14 -2.48 118.95 119.63 1wt2 s ARG 168 Ca 0.00 -0.79 0.02 0.00 -0.52 0.00 0.00 55.73 54.44 1wt2 s ARG 168 Cb 0.00 -1.87 -0.04 0.00 0.52 0.00 0.00 34.95 33.56 1wt2 s ARG 168 CO 0.00 0.37 -0.02 1.14 0.02 0.00 0.00 175.30 176.82 1wt2 s GLN 169 N -0.21 1.03 -0.04 3.54 -2.07 -0.23 -4.79 119.66 116.88 1wt2 s GLN 169 Ca -0.00 -1.48 0.02 0.00 -1.82 0.00 0.00 55.36 52.08 1wt2 s GLN 169 Cb -0.12 -0.24 0.01 0.00 -1.09 0.00 0.00 33.01 31.57 1wt2 s GLN 169 CO 0.02 -0.10 -0.09 -1.17 -1.32 0.00 0.00 175.29 172.62 1wt2 s LEU 170 N -3.14 1.64 -0.10 2.60 2.96 -1.26 -0.46 118.68 120.92 1wt2 s LEU 170 Ca 0.21 -0.21 0.03 0.00 -0.22 0.00 0.00 54.13 53.93 1wt2 s LEU 170 Cb 0.06 -0.63 -0.01 0.00 0.50 0.00 0.00 46.19 46.11 1wt2 s LEU 170 CO 0.02 0.03 -0.19 -0.44 -1.32 0.00 0.00 176.35 174.45 1wt2 s SER 171 N 0.50 3.57 -0.25 3.68 0.01 0.52 -4.95 113.70 116.78 1wt2 s SER 171 Ca -0.09 -0.42 -0.09 0.00 1.31 0.00 0.00 55.95 56.66 1wt2 s SER 171 Cb -0.12 -1.35 -0.04 0.00 0.21 0.00 0.00 66.02 64.71 1wt2 s SER 171 CO 0.01 0.19 0.13 -0.69 0.41 0.00 0.00 173.24 173.30 1wt2 s VAL 172 N 0.16 4.90 -0.23 3.43 1.01 -1.26 -1.26 120.40 127.15 1wt2 s VAL 172 Ca -0.10 0.03 -0.03 0.00 0.00 0.00 0.00 61.98 61.88 1wt2 s VAL 172 Cb -0.16 -3.30 0.01 0.00 0.00 0.00 0.00 36.38 32.93 1wt2 s VAL 172 CO 0.06 0.31 -0.06 -0.76 0.00 0.00 0.00 175.10 174.65 1wt2 s LEU 173 N 1.49 2.97 0.18 3.92 2.01 0.32 -4.97 118.68 124.60 1wt2 s LEU 173 Ca 0.06 -0.62 -0.27 0.00 0.01 0.00 0.00 54.13 53.31 1wt2 s LEU 173 Cb -0.15 -1.69 -0.08 0.00 0.01 0.00 0.00 46.19 44.28 1wt2 s LEU 173 CO 0.07 -0.07 0.85 -0.70 1.01 0.00 0.00 176.35 177.51 1wt2 s GLU 174 N 1.40 4.67 0.00 1.70 2.12 -1.26 -0.89 118.70 126.45 1wt2 s GLU 174 Ca 0.03 1.29 0.06 0.00 0.36 0.00 0.00 54.97 56.72 1wt2 s GLU 174 Cb -0.15 -3.29 -0.02 0.00 0.26 0.00 0.00 34.13 30.94 1wt2 s GLU 174 CO -0.05 0.50 -0.20 0.14 -0.54 0.00 0.00 175.26 175.12 1wt2 s VAL 175 N -0.98 1.58 0.00 3.70 -7.23 -0.41 -4.87 120.40 112.20 1wt2 s VAL 175 Ca 0.39 -0.94 0.00 0.00 -1.81 0.00 0.00 61.98 59.61 1wt2 s VAL 175 Cb -0.24 -1.33 0.00 0.00 0.56 0.00 0.00 36.38 35.37 1wt2 s VAL 175 CO 0.28 0.37 0.00 0.00 -0.31 0.00 0.00 175.10 175.44 1wt2 n GLU 197 N 0.00 0.01 -0.09 0.00 4.71 -1.26 -0.89 120.64 123.12 1wt2 n GLU 197 Ca 0.00 0.92 0.01 0.00 -0.01 0.00 0.00 57.16 58.08 1wt2 n GLU 197 Cb 0.00 -2.20 0.30 0.00 -1.01 0.00 0.00 31.44 28.54 1wt2 n GLU 197 CO 0.00 0.00 0.00 0.07 0.09 0.00 0.00 177.13 177.29 1wt2 h ARG 198 N 0.00 0.74 -0.34 3.49 0.11 -2.04 -2.74 114.38 113.60 1wt2 h ARG 198 Ca 0.66 -0.08 -0.08 0.00 0.10 0.00 0.00 59.98 60.58 1wt2 h ARG 198 Cb 3.00 -0.15 -0.02 0.00 1.11 0.00 0.00 29.97 33.91 1wt2 h ARG 198 CO -0.01 0.55 -0.12 0.07 0.10 0.00 0.00 179.97 180.57 1wt2 h ARG 199 N 0.74 0.58 -0.26 0.08 0.11 -1.45 -2.85 114.38 111.34 1wt2 h ARG 199 Ca 0.19 -0.18 0.01 0.00 0.10 0.00 0.00 59.98 60.11 1wt2 h ARG 199 Cb 0.04 -0.06 -0.02 0.00 1.11 0.00 0.00 29.97 31.05 1wt2 h ARG 199 CO -0.03 0.69 0.14 0.74 0.10 0.00 0.00 179.97 181.61 1wt2 h PHE 200 N 0.54 0.26 -0.06 4.08 0.05 -1.65 0.73 116.94 120.89 1wt2 h PHE 200 Ca 0.10 0.01 0.02 0.00 3.82 0.00 0.00 57.97 61.91 1wt2 h PHE 200 Cb 0.52 -0.08 -0.00 0.00 2.00 0.00 0.00 35.95 38.39 1wt2 h PHE 200 CO 0.02 0.15 0.06 -0.07 -0.18 0.00 0.00 178.31 178.29 1wt2 h LEU 201 N 0.29 0.00 0.00 1.54 3.38 -1.49 -1.71 115.31 117.31 1wt2 h LEU 201 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1wt2 h LEU 201 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1wt2 h LEU 201 CO -0.06 0.00 -1.39 -0.24 0.09 0.00 0.00 178.44 176.84 1wt2 n SER 202 N -4.07 0.52 -0.04 -0.43 2.88 -0.59 -4.57 113.62 107.32 1wt2 n SER 202 Ca -0.02 0.19 0.00 0.00 -1.33 0.00 0.00 58.87 57.72 1wt2 n SER 202 Cb 0.15 1.06 -0.11 0.00 -0.75 0.00 0.00 64.21 64.56 1wt2 n SER 202 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1wt2 n GLU 203 N -2.50 1.12 -4.18 -1.46 1.02 0.15 -5.05 120.64 109.73 1wt2 n GLU 203 Ca -0.02 -0.07 -0.11 0.00 -0.02 0.00 0.00 57.16 56.94 1wt2 n GLU 203 Cb 0.56 -1.35 -0.10 0.00 -0.02 0.00 0.00 31.44 30.53 1wt2 n GLU 203 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1wt2 s VAL 204 N -2.67 0.61 -0.17 2.62 -7.23 -0.69 -4.93 120.40 107.93 1wt2 s VAL 204 Ca -0.06 -1.94 0.07 0.00 -1.81 0.00 0.00 61.98 58.24 1wt2 s VAL 204 Cb 0.07 -1.83 -0.22 0.00 0.56 0.00 0.00 36.38 34.96 1wt2 s VAL 204 CO 0.58 -0.73 0.14 0.47 -0.31 0.00 0.00 175.10 175.25 1wt2 n ASP 205 N -0.10 1.25 -4.16 4.85 10.43 -0.15 -4.63 116.55 124.04 1wt2 n ASP 205 Ca -0.10 0.07 -0.17 0.00 2.57 0.00 0.00 54.79 57.17 1wt2 n ASP 205 Cb 0.62 -0.04 -0.11 0.00 1.84 0.00 0.00 41.12 43.42 1wt2 n ASP 205 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 1wt2 s TYR 206 N -2.53 1.11 -0.06 1.24 1.51 -1.09 -3.19 117.35 114.34 1wt2 s TYR 206 Ca -0.20 -0.52 0.05 0.00 -1.01 0.00 0.00 57.07 55.39 1wt2 s TYR 206 Cb 0.07 -0.62 -0.01 0.00 -0.11 0.00 0.00 41.96 41.30 1wt2 s TYR 206 CO 0.74 0.03 -0.23 -0.51 -1.11 0.00 0.00 175.55 174.48 1wt2 s LEU 207 N -1.96 2.02 -0.14 -1.29 1.43 0.08 0.11 118.68 118.94 1wt2 s LEU 207 Ca -0.00 -0.48 0.02 0.00 -1.03 0.00 0.00 54.13 52.64 1wt2 s LEU 207 Cb -0.08 -1.27 0.01 0.00 0.03 0.00 0.00 46.19 44.89 1wt2 s LEU 207 CO 0.02 0.20 -0.19 -0.69 0.23 0.00 0.00 176.35 175.92 1wt2 s VAL 208 N -0.00 1.87 -0.20 -1.59 1.01 0.54 -1.33 120.40 120.69 1wt2 s VAL 208 Ca -0.07 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 1wt2 s VAL 208 Cb -0.14 -1.68 0.00 0.00 0.00 0.00 0.00 36.38 34.57 1wt2 s VAL 208 CO 0.04 0.51 -0.11 0.00 0.00 0.00 0.00 175.10 175.55 1wt2 s VAL 210 N 1.39 0.22 0.40 0.00 -7.23 -1.03 -2.40 120.40 111.76 1wt2 s VAL 210 Ca 0.05 -1.98 -0.18 0.00 -1.81 0.00 0.00 61.98 58.06 1wt2 s VAL 210 Cb -0.14 -2.44 -0.10 0.00 0.56 0.00 0.00 36.38 34.27 1wt2 s VAL 210 CO -0.07 -0.11 0.87 -1.81 -0.31 0.00 0.00 175.10 173.66 1wt2 s ASP 211 N -3.19 6.81 0.16 4.85 1.01 -1.12 -4.45 116.67 120.74 1wt2 s ASP 211 Ca 0.35 1.49 0.14 0.00 0.71 0.00 0.00 52.55 55.24 1wt2 s ASP 211 Cb 0.07 -2.46 -0.07 0.00 1.01 0.00 0.00 42.92 41.47 1wt2 s ASP 211 CO 0.10 -0.34 1.16 1.62 0.21 0.00 0.00 175.17 177.93 1wt2 h VAL 212 N 1.75 0.89 -0.16 -1.27 3.04 -1.94 -3.38 116.25 115.17 1wt2 h VAL 212 Ca -0.48 -2.38 -0.67 0.00 -1.01 0.00 0.00 66.70 62.15 1wt2 h VAL 212 Cb 1.18 2.37 0.01 0.00 -2.01 0.00 0.00 31.29 32.83 1wt2 h VAL 212 CO 0.63 0.51 3.59 -0.90 -1.01 0.00 0.00 177.57 180.38 1wt2 n ASP 213 N -3.13 8.62 -3.64 3.17 5.75 -1.26 -4.67 116.55 121.39 1wt2 n ASP 213 Ca -0.03 -2.65 -0.13 0.00 -0.01 0.00 0.00 54.79 51.96 1wt2 n ASP 213 Cb 0.82 -1.53 -0.06 0.00 -1.03 0.00 0.00 41.12 39.32 1wt2 n ASP 213 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 1wt2 s MET 214 N 1.68 1.65 -0.06 0.11 -1.94 -1.26 -3.44 119.30 116.05 1wt2 s MET 214 Ca 0.68 -1.64 -0.13 0.00 -1.71 0.00 0.00 55.69 52.89 1wt2 s MET 214 Cb 0.18 0.40 0.03 0.00 2.01 0.00 0.00 34.83 37.45 1wt2 s MET 214 CO -0.06 -0.65 0.30 -1.83 -0.01 0.00 0.00 175.02 172.76 1wt2 s GLU 215 N -3.56 0.52 0.10 2.03 -1.05 -0.47 -4.10 118.70 112.17 1wt2 s GLU 215 Ca 0.32 0.08 -0.23 0.00 -0.15 0.00 0.00 54.97 54.98 1wt2 s GLU 215 Cb 0.01 0.24 -0.07 0.00 -0.44 0.00 0.00 34.13 33.87 1wt2 s GLU 215 CO 0.17 -0.12 0.70 -0.06 0.95 0.00 0.00 175.26 176.90 1wt2 s PHE 216 N -0.66 3.83 0.00 4.83 0.40 -1.26 -1.28 117.98 123.83 1wt2 s PHE 216 Ca -0.08 1.47 0.00 0.00 -0.60 0.00 0.00 56.93 57.73 1wt2 s PHE 216 Cb -0.04 -2.69 0.00 0.00 0.51 0.00 0.00 43.02 40.80 1wt2 s PHE 216 CO 0.02 0.47 0.00 0.54 0.70 0.00 0.00 175.22 176.96 1wt2 n ARG 217 N 1.96 3.14 -3.96 0.44 1.74 0.14 -4.84 116.66 115.29 1wt2 n ARG 217 Ca -0.06 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.91 1wt2 n ARG 217 Cb 0.50 -0.69 -0.02 0.00 -1.02 0.00 0.00 32.46 31.23 1wt2 n ARG 217 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1wt2 s ASP 218 N -1.27 0.24 0.00 0.55 -1.08 -0.91 -4.91 116.67 109.29 1wt2 s ASP 218 Ca 0.00 -1.14 -0.37 0.00 -0.52 0.00 0.00 52.55 50.52 1wt2 s ASP 218 Cb 0.00 0.70 -0.16 0.00 -1.46 0.00 0.00 42.92 42.00 1wt2 s ASP 218 CO 0.00 -1.37 1.50 1.57 0.52 0.00 0.00 175.17 177.39 1wt2 n HIS 219 N -0.49 1.79 -3.65 -5.34 -0.00 -1.26 -4.74 115.22 101.52 1wt2 n HIS 219 Ca -0.03 0.53 -0.29 0.00 -0.00 0.00 0.00 57.72 57.92 1wt2 n HIS 219 Cb 0.61 -2.41 -0.15 0.00 -0.00 0.00 0.00 29.99 28.04 1wt2 n HIS 219 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1wt2 s VAL 220 N 1.44 0.50 0.00 3.57 1.01 -0.58 -4.86 120.40 121.48 1wt2 s VAL 220 Ca 0.87 -1.15 0.00 0.00 0.00 0.00 0.00 61.98 61.70 1wt2 s VAL 220 Cb -0.93 -1.39 0.00 0.00 0.00 0.00 0.00 36.38 34.06 1wt2 s VAL 220 CO 0.50 -0.70 0.00 0.61 0.00 0.00 0.00 175.10 175.51 1wt2 n GLY 221 N 5.00 7.13 0.00 4.51 0.00 -1.26 -0.99 105.19 119.57 1wt2 n GLY 221 Ca -0.03 -1.91 0.02 0.00 0.00 0.00 0.00 46.02 44.09 1wt2 n GLY 221 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1wt2 n VAL 222 N 0.00 1.50 0.30 1.61 0.24 -1.26 -2.39 118.33 118.34 1wt2 n VAL 222 Ca 0.00 0.37 0.20 0.00 -2.04 0.00 0.00 64.34 62.87 1wt2 n VAL 222 Cb 0.00 -1.30 0.99 0.00 -1.47 0.00 0.00 33.84 32.06 1wt2 n VAL 222 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 1wt2 h GLU 223 N 0.00 0.00 0.00 7.34 9.09 -1.95 -1.70 114.58 127.37 1wt2 h GLU 223 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1wt2 h GLU 223 Cb 0.07 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.17 1wt2 h GLU 223 CO 0.00 0.00 -0.68 -0.84 0.05 0.00 0.00 179.01 177.54 1wt2 h ILE 224 N 0.00 0.00 -3.35 -1.06 3.07 -1.89 -3.47 117.51 110.80 1wt2 h ILE 224 Ca 0.00 -0.67 -0.52 0.00 1.55 0.00 0.00 64.86 65.21 1wt2 h ILE 224 Cb 0.12 1.27 0.03 0.00 -0.27 0.00 0.00 36.82 37.98 1wt2 h ILE 224 CO 0.00 0.00 0.67 -0.76 -1.05 0.00 0.00 178.15 177.01 1wt2 s LEU 225 N -4.70 4.41 0.01 0.16 1.43 -0.64 -4.87 118.68 114.47 1wt2 s LEU 225 Ca 0.04 2.43 -0.29 0.00 -1.03 0.00 0.00 54.13 55.27 1wt2 s LEU 225 Cb 0.12 -3.61 0.11 0.00 0.03 0.00 0.00 46.19 42.84 1wt2 s LEU 225 CO 0.74 -0.56 1.25 0.28 0.23 0.00 0.00 176.35 178.29 1wt2 s THR 226 N 0.18 0.00 0.26 5.49 -1.32 -1.26 -5.04 115.64 113.95 1wt2 s THR 226 Ca 0.58 -0.27 -0.02 0.00 -1.21 0.00 0.00 61.69 60.76 1wt2 s THR 226 Cb -0.37 -2.12 0.26 0.00 -1.51 0.00 0.00 72.50 68.76 1wt2 s THR 226 CO 0.38 0.00 1.87 -0.65 -2.21 0.00 0.00 174.62 174.01 1wt2 h PRO 227 N 2.00 1.09 -2.39 7.08 0.11 -1.93 -3.08 132.00 134.87 1wt2 h PRO 227 Ca -0.29 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 65.70 1wt2 h PRO 227 Cb 1.20 -0.25 -0.25 0.00 0.11 0.00 0.00 31.00 31.82 1wt2 h PRO 227 CO 0.29 0.72 -0.25 -1.17 -0.21 0.00 0.00 178.00 177.38 1wt2 s LEU 228 N -10.19 -0.61 0.06 2.35 2.96 -1.26 -0.43 118.68 111.56 1wt2 s LEU 228 Ca -0.12 1.14 0.04 0.00 -0.22 0.00 0.00 54.13 54.96 1wt2 s LEU 228 Cb 0.20 1.66 -0.03 0.00 0.50 0.00 0.00 46.19 48.53 1wt2 s LEU 228 CO 0.81 -0.22 -0.11 0.72 -1.32 0.00 0.00 176.35 176.23 1wt2 s PHE 229 N 2.15 0.98 0.31 5.38 -0.12 0.05 0.22 117.98 126.94 1wt2 s PHE 229 Ca -0.06 -0.49 0.08 0.00 -0.05 0.00 0.00 56.93 56.40 1wt2 s PHE 229 Cb -0.10 -0.56 -0.06 0.00 -0.63 0.00 0.00 43.02 41.67 1wt2 s PHE 229 CO -0.15 -0.01 -0.07 0.20 -0.05 0.00 0.00 175.22 175.15 1wt2 s GLY 230 N -1.74 1.99 -0.07 1.99 0.00 -1.18 -2.61 107.32 105.70 1wt2 s GLY 230 Ca -0.05 -1.99 0.05 0.00 0.00 0.00 0.00 44.72 42.74 1wt2 s GLY 230 CO 0.01 -1.92 -0.22 -1.59 0.00 0.00 0.00 173.10 169.39 1wt2 s THR 231 N -2.87 1.83 -0.01 0.90 2.01 -1.21 -1.24 115.64 115.05 1wt2 s THR 231 Ca 0.31 -0.92 -0.30 0.00 0.31 0.00 0.00 61.69 61.09 1wt2 s THR 231 Cb 0.04 -1.57 -0.06 0.00 0.01 0.00 0.00 72.50 70.91 1wt2 s THR 231 CO 0.14 0.51 1.64 -0.76 -0.69 0.00 0.00 174.62 175.46 1wt2 s LEU 232 N 0.11 4.34 0.16 4.42 1.43 -0.06 -1.14 118.68 127.94 1wt2 s LEU 232 Ca -0.09 2.32 -0.31 0.00 -1.03 0.00 0.00 54.13 55.01 1wt2 s LEU 232 Cb -0.15 -3.55 -0.10 0.00 0.03 0.00 0.00 46.19 42.42 1wt2 s LEU 232 CO 0.05 -0.89 1.68 -2.28 0.23 0.00 0.00 176.35 175.13 1wt2 s HIS 233 N 3.44 2.75 0.63 0.29 5.65 -0.71 -4.01 115.29 123.33 1wt2 s HIS 233 Ca 0.73 0.37 0.37 0.00 0.25 0.00 0.00 55.06 56.78 1wt2 s HIS 233 Cb -0.35 -4.05 2.14 0.00 -1.18 0.00 0.00 32.58 29.13 1wt2 s HIS 233 CO 0.30 -4.05 2.32 -1.00 -0.65 0.00 0.00 174.74 171.66 1wt2 h PRO 234 N 7.36 0.00 -0.01 2.88 0.13 -1.90 -2.51 132.00 137.96 1wt2 h PRO 234 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1wt2 h PRO 234 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1wt2 h PRO 234 CO 0.94 0.00 -0.31 0.41 -0.23 0.00 0.00 178.00 178.81 1wt2 n GLY 235 N -1.20 -0.53 0.00 1.56 0.00 -1.26 -4.47 105.19 99.28 1wt2 n GLY 235 Ca -0.03 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1wt2 n GLY 235 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1wt2 n PHE 236 N -0.59 0.00 0.31 1.61 3.01 -0.97 -4.84 117.46 115.99 1wt2 n PHE 236 Ca 0.11 -0.09 0.18 0.00 1.01 0.00 0.00 57.45 58.67 1wt2 n PHE 236 Cb 0.37 -0.01 1.00 0.00 -0.01 0.00 0.00 39.48 40.83 1wt2 n PHE 236 CO 0.00 0.00 0.00 0.10 1.01 0.00 0.00 176.76 177.87 1wt2 h TYR 237 N 0.00 0.00 -0.35 1.38 -0.00 -1.72 -2.04 116.97 114.23 1wt2 h TYR 237 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1wt2 h TYR 237 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.60 1wt2 h TYR 237 CO 0.00 0.02 0.00 0.41 -0.00 0.00 0.00 178.16 178.59 1wt2 n GLY 238 N -1.00 1.69 3.90 0.10 0.00 -1.26 -5.01 105.19 103.60 1wt2 n GLY 238 Ca -0.03 -0.62 -0.28 0.00 0.00 0.00 0.00 46.02 45.10 1wt2 n GLY 238 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wt2 s SER 239 N -1.28 6.40 0.58 1.61 0.01 -0.77 -5.08 113.70 115.18 1wt2 s SER 239 Ca 0.33 0.92 -0.15 0.00 1.31 0.00 0.00 55.95 58.35 1wt2 s SER 239 Cb 0.19 -2.24 -0.05 0.00 0.21 0.00 0.00 66.02 64.14 1wt2 s SER 239 CO 0.26 -0.41 1.03 -0.44 0.41 0.00 0.00 173.24 174.10 1wt2 s SER 240 N -3.55 6.06 0.46 2.44 0.01 -1.26 -4.95 113.70 112.92 1wt2 s SER 240 Ca 0.47 1.68 0.12 0.00 1.31 0.00 0.00 55.95 59.54 1wt2 s SER 240 Cb -0.10 -2.52 1.06 0.00 0.21 0.00 0.00 66.02 64.67 1wt2 s SER 240 CO 0.36 -0.97 2.09 0.08 0.41 0.00 0.00 173.24 175.20 1wt2 h ARG 241 N 0.42 0.22 0.00 12.44 0.11 -1.93 -1.75 114.38 123.89 1wt2 h ARG 241 Ca -0.46 -0.02 -0.00 0.00 0.10 0.00 0.00 59.98 59.60 1wt2 h ARG 241 Cb 1.20 -0.05 -0.00 0.00 1.11 0.00 0.00 29.97 32.24 1wt2 h ARG 241 CO 0.59 0.17 -0.02 0.93 0.10 0.00 0.00 179.97 181.75 1wt2 h GLU 242 N 0.22 0.00 0.00 0.08 3.07 -1.93 -0.70 114.58 115.32 1wt2 h GLU 242 Ca 0.06 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 1wt2 h GLU 242 Cb 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 1wt2 h GLU 242 CO -0.01 0.02 -0.46 0.00 -1.40 0.00 0.00 179.01 177.16 1wt2 h ALA 243 N 1.98 0.74 -2.34 3.43 0.00 -1.69 -3.47 119.26 117.91 1wt2 h ALA 243 Ca -0.00 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.33 1wt2 h ALA 243 Cb 0.04 0.00 0.10 0.00 0.00 0.00 0.00 17.79 17.93 1wt2 h ALA 243 CO 0.00 0.00 0.48 1.19 0.00 0.00 0.00 179.25 180.92 1wt2 n PHE 244 N -2.53 2.05 -1.09 0.00 0.99 -0.27 -4.83 117.46 111.78 1wt2 n PHE 244 Ca 0.03 0.53 -0.17 0.00 -0.00 0.00 0.00 57.45 57.85 1wt2 n PHE 244 Cb 0.49 -2.40 -0.07 0.00 -1.00 0.00 0.00 39.48 36.50 1wt2 n PHE 244 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1wt2 n THR 245 N 0.96 2.94 -1.00 4.37 -2.24 -1.26 -4.93 114.28 113.12 1wt2 n THR 245 Ca 0.08 -1.93 -0.29 0.00 -2.27 0.00 0.00 64.05 59.64 1wt2 n THR 245 Cb 0.33 -1.66 0.19 0.00 -2.10 0.00 0.00 70.33 67.09 1wt2 n THR 245 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1wt2 s TYR 246 N -0.66 1.93 -0.01 4.78 4.12 -1.26 -4.78 117.35 121.47 1wt2 s TYR 246 Ca 0.48 1.11 -0.30 0.00 0.02 0.00 0.00 57.07 58.38 1wt2 s TYR 246 Cb 0.29 -3.20 -0.04 0.00 -1.52 0.00 0.00 41.96 37.48 1wt2 s TYR 246 CO -0.08 -3.06 1.14 -2.00 0.02 0.00 0.00 175.55 171.56 1wt2 s GLU 247 N -4.82 4.43 0.00 -0.62 2.56 -1.26 -4.92 118.70 114.06 1wt2 s GLU 247 Ca 0.66 1.63 0.17 0.00 0.00 0.00 0.00 54.97 57.43 1wt2 s GLU 247 Cb -0.20 -3.47 0.17 0.00 2.00 0.00 0.00 34.13 32.63 1wt2 s GLU 247 CO 0.59 -0.29 1.07 0.54 -0.56 0.00 0.00 175.26 176.61 1wt2 n ARG 248 N 4.50 1.48 -3.17 4.30 5.12 -1.26 -1.56 116.66 126.06 1wt2 n ARG 248 Ca 0.09 -1.58 -0.40 0.00 -1.93 0.00 0.00 57.85 54.03 1wt2 n ARG 248 Cb 0.47 -1.33 -0.06 0.00 -1.16 0.00 0.00 32.46 30.38 1wt2 n ARG 248 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1wt2 s ARG 249 N -1.36 4.19 0.66 5.56 0.52 -1.26 -4.87 118.95 122.39 1wt2 s ARG 249 Ca 0.21 0.52 0.39 0.00 -0.52 0.00 0.00 55.73 56.34 1wt2 s ARG 249 Cb 0.14 -3.58 2.16 0.00 0.52 0.00 0.00 34.95 34.20 1wt2 s ARG 249 CO 0.21 -0.22 2.25 -1.35 0.02 0.00 0.00 175.30 176.21 1wt2 h PRO 250 N 7.52 0.00 0.00 3.54 0.11 -1.97 -1.65 132.00 139.55 1wt2 h PRO 250 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1wt2 h PRO 250 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1wt2 h PRO 250 CO 0.76 0.00 0.00 1.96 -0.21 0.00 0.00 178.00 180.51 1wt2 h GLN 251 N 0.00 0.00 -6.32 1.05 7.50 -2.01 -3.45 115.11 111.88 1wt2 h GLN 251 Ca 0.01 0.00 -0.56 0.00 0.50 0.00 0.00 58.65 58.60 1wt2 h GLN 251 Cb 0.19 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 27.68 1wt2 h GLN 251 CO -0.00 0.00 -0.08 0.45 -1.50 0.00 0.00 178.83 177.70 1wt2 s SER 252 N -5.64 6.85 0.56 1.46 0.15 -0.62 -4.96 113.70 111.50 1wt2 s SER 252 Ca 0.03 1.10 0.36 0.00 0.70 0.00 0.00 55.95 58.14 1wt2 s SER 252 Cb 0.08 -2.30 1.62 0.00 -1.71 0.00 0.00 66.02 63.71 1wt2 s SER 252 CO 0.56 0.11 2.06 1.56 1.20 0.00 0.00 173.24 178.74 1wt2 h GLN 253 N 3.63 0.00 -0.15 5.44 1.08 -1.86 -2.31 115.11 120.93 1wt2 h GLN 253 Ca -0.49 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.71 1wt2 h GLN 253 Cb 1.19 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.62 1wt2 h GLN 253 CO 0.66 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 178.54 1wt2 n ALA 254 N -2.06 2.52 -1.65 3.87 0.00 -1.26 -4.97 120.51 116.96 1wt2 n ALA 254 Ca -0.00 -0.54 -0.46 0.00 0.00 0.00 0.00 53.44 52.44 1wt2 n ALA 254 Cb 0.24 -1.08 -0.03 0.00 0.00 0.00 0.00 19.45 18.57 1wt2 n ALA 254 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1wt2 n TYR 255 N 0.39 2.00 -3.63 0.00 9.36 -0.87 -4.24 117.16 120.17 1wt2 n TYR 255 Ca 0.17 0.46 -0.22 0.00 3.32 0.00 0.00 57.90 61.63 1wt2 n TYR 255 Cb 0.35 -2.44 -0.17 0.00 -0.63 0.00 0.00 39.34 36.46 1wt2 n TYR 255 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1wt2 s ILE 256 N 0.08 -0.13 0.91 2.97 1.01 -0.60 -4.99 121.20 120.43 1wt2 s ILE 256 Ca 0.71 0.13 -0.11 0.00 0.00 0.00 0.00 60.65 61.39 1wt2 s ILE 256 Cb -0.70 -0.38 0.14 0.00 0.01 0.00 0.00 42.46 41.53 1wt2 s ILE 256 CO 0.48 -0.05 1.10 -2.16 0.00 0.00 0.00 174.94 174.32 1wt2 s PRO 257 N 2.18 1.14 0.55 2.79 0.04 -1.26 -4.65 135.00 135.80 1wt2 s PRO 257 Ca 0.04 1.18 0.26 0.00 0.04 0.00 0.00 61.00 62.52 1wt2 s PRO 257 Cb -0.14 -1.77 1.46 0.00 0.04 0.00 0.00 34.50 34.09 1wt2 s PRO 257 CO -0.06 -2.42 2.02 0.87 0.04 0.00 0.00 177.00 177.44 1wt2 h LYS 258 N -1.70 0.00 -0.61 4.56 1.79 -1.96 -2.02 116.57 116.62 1wt2 h LYS 258 Ca -0.47 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 1wt2 h LYS 258 Cb 1.27 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.92 1wt2 h LYS 258 CO 0.48 0.00 0.00 -0.40 -1.08 0.00 0.00 179.45 178.45 1wt2 n ASP 259 N -4.16 3.29 -4.51 0.86 5.75 -1.26 -4.25 116.55 112.27 1wt2 n ASP 259 Ca 0.07 -2.00 -0.24 0.00 -0.01 0.00 0.00 54.79 52.60 1wt2 n ASP 259 Cb 0.52 -0.41 -0.10 0.00 -1.03 0.00 0.00 41.12 40.10 1wt2 n ASP 259 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1wt2 s GLU 260 N -1.19 1.81 0.00 0.11 2.02 -0.76 -5.10 118.70 115.59 1wt2 s GLU 260 Ca 0.41 -1.73 0.00 0.00 0.02 0.00 0.00 54.97 53.67 1wt2 s GLU 260 Cb 0.21 -1.83 0.00 0.00 0.10 0.00 0.00 34.13 32.61 1wt2 s GLU 260 CO 0.28 0.31 0.00 0.41 0.02 0.00 0.00 175.26 176.27 1wt2 n GLY 261 N -0.70 3.35 0.11 -1.39 0.00 -1.26 -4.81 105.19 100.48 1wt2 n GLY 261 Ca -0.05 -1.46 -0.16 0.00 0.00 0.00 0.00 46.02 44.34 1wt2 n GLY 261 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wt2 n ASP 262 N 0.00 1.93 -4.06 1.61 8.00 -1.26 -4.96 116.55 117.82 1wt2 n ASP 262 Ca 0.00 0.36 -0.12 0.00 0.71 0.00 0.00 54.79 55.74 1wt2 n ASP 262 Cb 0.00 -0.79 -0.09 0.00 -0.02 0.00 0.00 41.12 40.22 1wt2 n ASP 262 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1wt2 s PHE 263 N -2.70 1.07 -0.36 1.24 0.40 -1.26 -5.00 117.98 111.38 1wt2 s PHE 263 Ca -0.31 -1.29 -0.07 0.00 -0.60 0.00 0.00 56.93 54.66 1wt2 s PHE 263 Cb 0.08 -0.43 0.05 0.00 0.51 0.00 0.00 43.02 43.23 1wt2 s PHE 263 CO 0.44 -0.74 0.14 -0.47 0.70 0.00 0.00 175.22 175.29 1wt2 s TYR 264 N -4.03 3.28 0.35 0.36 5.04 -1.26 -5.04 117.35 116.05 1wt2 s TYR 264 Ca 0.36 -1.45 -0.04 0.00 -2.44 0.00 0.00 57.07 53.51 1wt2 s TYR 264 Cb 0.05 -2.43 -0.04 0.00 0.35 0.00 0.00 41.96 39.88 1wt2 s TYR 264 CO 0.13 -0.75 0.61 0.71 -1.34 0.00 0.00 175.55 174.91 1wt2 s TYR 265 N 1.41 3.50 0.12 4.97 1.51 -1.26 -1.74 117.35 125.86 1wt2 s TYR 265 Ca -0.00 0.61 -0.23 0.00 -1.01 0.00 0.00 57.07 56.43 1wt2 s TYR 265 Cb -0.20 -2.10 -0.07 0.00 -0.11 0.00 0.00 41.96 39.48 1wt2 s TYR 265 CO 0.03 0.04 0.71 -0.51 -1.11 0.00 0.00 175.55 174.71 1wt2 s LEU 266 N -4.07 4.56 0.27 -1.29 1.43 -0.29 -4.75 118.68 114.54 1wt2 s LEU 266 Ca 0.44 1.50 0.25 0.00 -1.03 0.00 0.00 54.13 55.28 1wt2 s LEU 266 Cb -0.10 -3.15 0.54 0.00 0.03 0.00 0.00 46.19 43.51 1wt2 s LEU 266 CO 0.35 0.21 1.62 1.23 0.23 0.00 0.00 176.35 179.99 1wt2 h GLY 267 N 4.54 0.00 -1.14 -3.19 0.00 -1.92 -3.32 103.07 98.04 1wt2 h GLY 267 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1wt2 h GLY 267 CO 0.66 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.81 1wt2 n GLY 268 N 1.24 0.55 3.16 4.60 0.00 -1.26 -4.69 105.19 108.78 1wt2 n GLY 268 Ca 0.04 -0.41 0.03 0.00 0.00 0.00 0.00 46.02 45.68 1wt2 n GLY 268 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1wt2 s PHE 269 N -1.62 -1.66 0.23 1.61 5.99 -1.24 -2.80 117.98 118.48 1wt2 s PHE 269 Ca 0.28 0.61 -0.09 0.00 0.00 0.00 0.00 56.93 57.73 1wt2 s PHE 269 Cb 0.15 0.29 -0.02 0.00 0.00 0.00 0.00 43.02 43.45 1wt2 s PHE 269 CO 0.21 -1.05 0.35 -0.59 -0.00 0.00 0.00 175.22 174.14 1wt2 s PHE 270 N 2.34 0.62 -1.84 10.12 -0.12 -1.01 -3.36 117.98 124.73 1wt2 s PHE 270 Ca 0.14 -0.94 0.00 0.00 -0.05 0.00 0.00 56.93 56.08 1wt2 s PHE 270 Cb -0.06 -0.07 0.00 0.00 -0.63 0.00 0.00 43.02 42.26 1wt2 s PHE 270 CO -0.16 -0.86 0.00 0.41 -0.05 0.00 0.00 175.22 174.55 1wt2 n GLY 271 N -0.33 -0.80 0.00 1.99 0.00 -1.07 -0.85 105.19 104.13 1wt2 n GLY 271 Ca -0.01 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1wt2 n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wt2 n GLY 272 N 0.00 0.45 3.75 -0.02 0.00 -0.44 -0.77 105.19 108.16 1wt2 n GLY 272 Ca 0.00 -1.50 -0.33 0.00 0.00 0.00 0.00 46.02 44.19 1wt2 n GLY 272 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wt2 s SER 273 N -4.00 4.74 0.22 1.61 1.04 0.43 -0.74 113.70 117.00 1wt2 s SER 273 Ca 0.00 2.07 -0.08 0.00 0.48 0.00 0.00 55.95 58.42 1wt2 s SER 273 Cb 0.00 -2.56 0.28 0.00 0.10 0.00 0.00 66.02 63.85 1wt2 s SER 273 CO 0.00 -1.88 1.80 0.58 0.98 0.00 0.00 173.24 174.72 1wt2 h VAL 274 N -0.25 0.93 -0.16 5.02 2.07 -1.87 -0.48 116.25 121.51 1wt2 h VAL 274 Ca -0.46 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 66.84 1wt2 h VAL 274 Cb 1.26 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1wt2 h VAL 274 CO 0.52 0.12 0.04 -0.61 0.02 0.00 0.00 177.57 177.66 1wt2 h GLN 275 N 0.67 0.11 -0.35 1.57 4.15 -1.90 -1.08 115.11 118.28 1wt2 h GLN 275 Ca 0.32 -0.01 -0.12 0.00 0.77 0.00 0.00 58.65 59.62 1wt2 h GLN 275 Cb 0.26 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.91 1wt2 h GLN 275 CO -0.21 0.07 -0.26 0.93 -1.93 0.00 0.00 178.83 177.43 1wt2 h GLU 276 N 0.11 0.71 -0.46 1.69 4.39 -1.69 -2.25 114.58 117.08 1wt2 h GLU 276 Ca 0.07 -0.30 -0.08 0.00 0.34 0.00 0.00 59.36 59.40 1wt2 h GLU 276 Cb 0.06 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1wt2 h GLU 276 CO -0.09 0.90 -0.01 0.28 -1.16 0.00 0.00 179.01 178.93 1wt2 h VAL 277 N 0.61 1.26 -0.08 3.13 2.07 -0.91 -1.66 116.25 120.67 1wt2 h VAL 277 Ca 0.08 -1.08 -0.08 0.00 0.82 0.00 0.00 66.70 66.44 1wt2 h VAL 277 Cb 0.76 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1wt2 h VAL 277 CO 0.06 0.37 -0.33 1.56 0.02 0.00 0.00 177.57 179.26 1wt2 h GLN 278 N 0.67 0.16 -0.28 1.57 4.20 -1.12 -0.83 115.11 119.49 1wt2 h GLN 278 Ca 0.13 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 1wt2 h GLN 278 Cb 0.52 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 1wt2 h GLN 278 CO 0.03 0.47 -0.01 0.00 -0.67 0.00 0.00 178.83 178.65 1wt2 h ARG 279 N 0.14 0.49 0.11 1.46 3.08 -1.14 0.00 114.38 118.53 1wt2 h ARG 279 Ca 0.02 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 1wt2 h ARG 279 Cb 0.65 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1wt2 h ARG 279 CO 0.05 0.65 -0.05 1.25 -1.07 0.00 0.00 179.97 180.80 1wt2 h LEU 280 N 0.27 -0.13 -1.12 3.04 6.46 -0.92 0.10 115.31 123.03 1wt2 h LEU 280 Ca 0.08 -0.07 -0.06 0.00 -0.12 0.00 0.00 57.88 57.71 1wt2 h LEU 280 Cb 0.44 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.38 1wt2 h LEU 280 CO 0.02 -0.01 -0.05 0.71 -0.62 0.00 0.00 178.44 178.48 1wt2 h THR 281 N -0.23 1.22 -0.41 1.05 1.35 -1.15 -0.47 112.91 114.27 1wt2 h THR 281 Ca -0.02 -0.91 -0.08 0.00 -0.55 0.00 0.00 66.41 64.85 1wt2 h THR 281 Cb 0.19 1.01 -0.01 0.00 -1.73 0.00 0.00 68.15 67.60 1wt2 h THR 281 CO 0.02 0.31 -0.07 -0.09 -0.25 0.00 0.00 175.52 175.44 1wt2 h ARG 282 N 0.53 0.77 -0.53 4.72 2.43 -0.79 -0.48 114.38 121.03 1wt2 h ARG 282 Ca 0.11 -0.28 -0.05 0.00 -0.81 0.00 0.00 59.98 58.94 1wt2 h ARG 282 Cb 0.41 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 1wt2 h ARG 282 CO 0.02 0.89 0.12 0.00 -1.51 0.00 0.00 179.97 179.49 1wt2 h ALA 283 N 0.86 0.71 -0.14 2.80 0.00 -0.59 -1.99 119.26 120.90 1wt2 h ALA 283 Ca 0.11 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 1wt2 h ALA 283 Cb 0.59 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1wt2 h ALA 283 CO 0.04 0.41 -0.37 0.00 0.00 0.00 0.00 179.25 179.32 1wt2 h HIS 285 N 0.25 0.65 -0.66 0.00 6.17 -0.84 -1.48 115.15 119.24 1wt2 h HIS 285 Ca 0.03 -0.12 -0.09 0.00 0.71 0.00 0.00 60.37 60.90 1wt2 h HIS 285 Cb 0.78 -0.16 -0.03 0.00 2.52 0.00 0.00 27.41 30.52 1wt2 h HIS 285 CO 0.02 0.73 0.08 1.96 0.71 0.00 0.00 177.93 181.43 1wt2 h GLN 286 N 0.37 1.11 -0.47 5.26 4.20 -1.20 -2.29 115.11 122.09 1wt2 h GLN 286 Ca 0.09 -0.31 -0.09 0.00 0.06 0.00 0.00 58.65 58.39 1wt2 h GLN 286 Cb 0.50 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.14 1wt2 h GLN 286 CO 0.02 1.03 -0.08 0.00 -0.67 0.00 0.00 178.83 179.13 1wt2 h ALA 287 N 1.04 0.99 -0.06 3.87 0.00 -1.14 -2.20 119.26 121.76 1wt2 h ALA 287 Ca 0.20 -0.31 -0.13 0.00 0.00 0.00 0.00 54.91 54.67 1wt2 h ALA 287 Cb 0.48 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1wt2 h ALA 287 CO 0.02 0.61 -0.55 0.52 0.00 0.00 0.00 179.25 179.85 1wt2 h MET 288 N 0.75 0.18 -0.23 0.00 2.86 -1.10 -2.25 114.93 115.14 1wt2 h MET 288 Ca 0.13 -0.11 -0.15 0.00 -2.06 0.00 0.00 59.70 57.51 1wt2 h MET 288 Cb 0.56 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 1wt2 h MET 288 CO 0.03 0.68 -0.48 0.52 1.06 0.00 0.00 176.91 178.72 1wt2 h MET 289 N 0.14 0.61 -0.41 1.72 2.07 -1.18 -0.51 114.93 117.37 1wt2 h MET 289 Ca -0.00 -0.35 -0.03 0.00 -2.07 0.00 0.00 59.70 57.25 1wt2 h MET 289 Cb 1.01 0.03 -0.02 0.00 -1.87 0.00 0.00 31.60 30.75 1wt2 h MET 289 CO 0.08 0.96 0.15 0.28 1.07 0.00 0.00 176.91 179.45 1wt2 h VAL 290 N 0.49 1.21 -0.38 -2.22 2.07 -1.23 -0.34 116.25 115.84 1wt2 h VAL 290 Ca 0.03 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 1wt2 h VAL 290 Cb 1.02 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 1wt2 h VAL 290 CO 0.09 0.24 0.20 0.44 0.02 0.00 0.00 177.57 178.56 1wt2 h ASP 291 N 0.52 0.49 -0.48 0.57 5.19 -1.25 -1.56 116.42 119.90 1wt2 h ASP 291 Ca 0.14 -0.11 0.05 0.00 -0.62 0.00 0.00 57.03 56.49 1wt2 h ASP 291 Cb 0.23 -0.12 -0.05 0.00 0.18 0.00 0.00 39.33 39.57 1wt2 h ASP 291 CO -0.01 0.46 0.21 -0.61 -3.12 0.00 0.00 179.24 176.17 1wt2 h GLN 292 N 0.48 0.40 -0.07 3.56 4.15 -0.81 0.02 115.11 122.85 1wt2 h GLN 292 Ca 0.13 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.51 1wt2 h GLN 292 Cb 0.09 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 1wt2 h GLN 292 CO -0.02 0.27 -0.03 0.00 -1.93 0.00 0.00 178.83 177.12 1wt2 h ALA 293 N 1.28 1.83 -0.37 3.38 0.00 -0.77 -0.81 119.26 123.80 1wt2 h ALA 293 Ca 0.22 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1wt2 h ALA 293 Cb 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1wt2 h ALA 293 CO -0.19 0.13 0.00 0.09 0.00 0.00 0.00 179.25 179.29 1wt2 n ASN 294 N -4.44 2.16 -2.55 0.00 3.02 -0.14 -4.94 115.26 108.37 1wt2 n ASN 294 Ca -0.02 -1.95 -0.17 0.00 -0.03 0.00 0.00 54.58 52.41 1wt2 n ASN 294 Cb 0.15 -0.25 0.04 0.00 -0.61 0.00 0.00 39.78 39.11 1wt2 n ASN 294 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wt2 n GLY 295 N 1.17 -0.19 2.96 7.41 0.00 -0.31 -5.03 105.19 111.19 1wt2 n GLY 295 Ca 0.14 -0.04 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 1wt2 n GLY 295 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1wt2 s ILE 296 N -3.12 0.20 -0.15 -0.61 2.07 -0.43 -5.02 121.20 114.15 1wt2 s ILE 296 Ca 0.33 -0.58 -0.00 0.00 -1.41 0.00 0.00 60.65 58.98 1wt2 s ILE 296 Cb -0.14 -0.27 0.03 0.00 0.13 0.00 0.00 42.46 42.21 1wt2 s ILE 296 CO 0.41 -0.25 -0.09 -0.70 -1.91 0.00 0.00 174.94 172.40 1wt2 s GLU 297 N -0.88 1.72 0.31 3.50 2.56 -1.26 -3.62 118.70 121.03 1wt2 s GLU 297 Ca -0.08 -0.46 -0.27 0.00 0.00 0.00 0.00 54.97 54.16 1wt2 s GLU 297 Cb -0.06 -1.91 -0.14 0.00 2.00 0.00 0.00 34.13 34.02 1wt2 s GLU 297 CO -0.00 -0.33 0.96 0.00 -0.56 0.00 0.00 175.26 175.33 1wt2 n ALA 298 N 4.86 -0.36 -0.30 6.30 0.00 -1.26 -4.85 120.51 124.89 1wt2 n ALA 298 Ca -0.13 0.36 0.14 0.00 0.00 0.00 0.00 53.44 53.81 1wt2 n ALA 298 Cb 0.49 -1.99 0.30 0.00 0.00 0.00 0.00 19.45 18.24 1wt2 n ALA 298 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1wt2 h VAL 299 N 1.84 0.26 -0.38 0.00 3.04 -1.93 -1.54 116.25 117.53 1wt2 h VAL 299 Ca -0.40 -0.06 -0.28 0.00 -1.01 0.00 0.00 66.70 64.96 1wt2 h VAL 299 Cb 1.35 0.08 -0.23 0.00 -2.01 0.00 0.00 31.29 30.48 1wt2 h VAL 299 CO 0.60 0.03 -0.67 0.79 -1.01 0.00 0.00 177.57 177.30 1wt2 n TRP 300 N -5.27 1.40 0.00 3.17 7.02 -1.26 -5.06 117.44 117.44 1wt2 n TRP 300 Ca 0.22 -1.86 0.00 0.00 -1.02 0.00 0.00 57.50 54.84 1wt2 n TRP 300 Cb 0.71 -0.29 0.00 0.00 -2.42 0.00 0.00 31.31 29.30 1wt2 n TRP 300 CO 0.00 0.00 0.00 0.72 -2.02 0.00 0.00 177.69 176.39 1wt2 n HIS 301 N -0.89 0.00 -0.22 -5.99 8.25 -0.58 -1.89 115.22 113.90 1wt2 n HIS 301 Ca 0.31 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.80 1wt2 n HIS 301 Cb 0.84 0.00 0.13 0.00 1.12 0.00 0.00 29.99 32.07 1wt2 n HIS 301 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 1wt2 h ASP 302 N 0.00 -0.17 -0.75 0.41 3.32 -1.98 -1.15 116.42 116.10 1wt2 h ASP 302 Ca 0.00 0.15 0.07 0.00 0.02 0.00 0.00 57.03 57.27 1wt2 h ASP 302 Cb 0.00 0.24 -0.05 0.00 0.22 0.00 0.00 39.33 39.74 1wt2 h ASP 302 CO 0.00 -0.08 0.49 -0.08 -1.72 0.00 0.00 179.24 177.85 1wt2 h GLU 303 N 0.17 0.76 -0.62 3.56 4.81 -1.73 0.16 114.58 121.69 1wt2 h GLU 303 Ca 0.35 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.45 1wt2 h GLU 303 Cb 0.58 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 1wt2 h GLU 303 CO -0.52 0.50 0.07 0.77 -0.73 0.00 0.00 179.01 179.11 1wt2 h SER 304 N 0.78 1.01 0.35 1.04 0.02 -1.12 -1.93 113.55 113.69 1wt2 h SER 304 Ca 0.33 -0.27 -0.19 0.00 -0.84 0.00 0.00 61.79 60.81 1wt2 h SER 304 Cb 0.27 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1wt2 h SER 304 CO -0.11 1.03 -0.79 0.45 -1.14 0.00 0.00 176.83 176.27 1wt2 h HIS 305 N 0.95 0.49 -0.69 3.45 3.86 -1.14 -2.81 115.15 119.26 1wt2 h HIS 305 Ca 0.18 -0.23 -0.05 0.00 -1.16 0.00 0.00 60.37 59.12 1wt2 h HIS 305 Cb 0.47 -0.07 -0.03 0.00 1.06 0.00 0.00 27.41 28.84 1wt2 h HIS 305 CO 0.03 1.00 0.25 1.25 0.86 0.00 0.00 177.93 181.33 1wt2 h LEU 306 N 0.22 0.95 -0.89 2.43 6.46 -0.84 -0.32 115.31 123.32 1wt2 h LEU 306 Ca -0.04 -0.15 -0.08 0.00 -0.12 0.00 0.00 57.88 57.48 1wt2 h LEU 306 Cb 1.38 -0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 41.05 1wt2 h LEU 306 CO 0.13 0.87 -0.09 0.78 -0.62 0.00 0.00 178.44 179.51 1wt2 h ASN 307 N 1.00 0.71 -0.48 1.25 2.35 -1.27 -0.76 115.58 118.39 1wt2 h ASN 307 Ca 0.23 -0.20 -0.13 0.00 -0.55 0.00 0.00 56.30 55.65 1wt2 h ASN 307 Cb 0.23 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 1wt2 h ASN 307 CO -0.02 0.83 -0.21 0.50 -1.65 0.00 0.00 177.43 176.89 1wt2 h LYS 308 N 0.66 0.98 -0.29 0.81 1.63 -1.18 -1.75 116.57 117.44 1wt2 h LYS 308 Ca 0.12 -0.42 -0.02 0.00 -0.85 0.00 0.00 60.65 59.47 1wt2 h LYS 308 Cb 0.54 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.13 1wt2 h LYS 308 CO 0.03 1.09 0.09 -0.92 -3.45 0.00 0.00 179.45 176.30 1wt2 h TYR 309 N 0.84 0.47 0.00 1.91 3.20 -0.67 -2.51 116.97 120.20 1wt2 h TYR 309 Ca 0.11 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1wt2 h TYR 309 Cb 0.79 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.92 1wt2 h TYR 309 CO 0.05 0.49 0.00 -0.07 -1.64 0.00 0.00 178.16 176.99 1wt2 h LEU 310 N 0.31 0.00 -0.06 2.82 3.38 -1.11 0.24 115.31 120.89 1wt2 h LEU 310 Ca 0.09 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 1wt2 h LEU 310 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1wt2 h LEU 310 CO -0.00 0.00 -0.30 0.25 0.09 0.00 0.00 178.44 178.47 1wt2 h LEU 311 N 0.00 0.37 0.00 1.67 5.85 -1.01 -3.27 115.31 118.93 1wt2 h LEU 311 Ca 0.00 -0.66 0.00 0.00 0.84 0.00 0.00 57.88 58.06 1wt2 h LEU 311 Cb 0.54 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.46 1wt2 h LEU 311 CO 0.00 0.97 -0.18 0.03 -0.34 0.00 0.00 178.44 178.92 1wt2 h ARG 312 N -0.20 0.00 -3.19 1.25 2.47 -1.18 -3.39 114.38 110.14 1wt2 h ARG 312 Ca -0.02 0.00 -0.60 0.00 -1.26 0.00 0.00 59.98 58.10 1wt2 h ARG 312 Cb 0.96 0.00 -0.40 0.00 -1.65 0.00 0.00 29.97 28.88 1wt2 h ARG 312 CO 0.06 0.00 -0.75 -1.01 0.56 0.00 0.00 179.97 178.83 1wt2 s HIS 313 N -3.22 1.82 0.20 3.04 3.76 0.81 -5.10 115.29 116.60 1wt2 s HIS 313 Ca 0.06 -2.13 -0.33 0.00 -0.15 0.00 0.00 55.06 52.52 1wt2 s HIS 313 Cb 0.07 -1.77 -0.13 0.00 1.11 0.00 0.00 32.58 31.86 1wt2 s HIS 313 CO 0.68 -0.82 1.63 1.63 -0.85 0.00 0.00 174.74 177.01 1wt2 n LYS 314 N 4.06 2.47 -2.25 1.40 4.76 -1.23 -4.25 118.16 123.12 1wt2 n LYS 314 Ca 0.05 0.89 -0.36 0.00 -2.87 0.00 0.00 58.31 56.01 1wt2 n LYS 314 Cb 0.37 -2.69 -0.00 0.00 -1.84 0.00 0.00 35.03 30.87 1wt2 n LYS 314 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1wt2 s PRO 315 N 0.79 3.61 0.00 1.97 0.04 -1.26 -4.92 135.00 135.23 1wt2 s PRO 315 Ca 0.75 1.73 0.28 0.00 0.04 0.00 0.00 61.00 63.80 1wt2 s PRO 315 Cb -0.58 -2.28 1.19 0.00 0.04 0.00 0.00 34.50 32.87 1wt2 s PRO 315 CO 0.37 -0.66 1.89 0.25 0.04 0.00 0.00 177.00 178.89 1wt2 n THR 316 N -0.76 0.08 -3.67 1.26 -2.24 0.13 -4.77 114.28 104.32 1wt2 n THR 316 Ca 0.09 0.02 -0.15 0.00 -2.27 0.00 0.00 64.05 61.74 1wt2 n THR 316 Cb 0.49 -0.54 -0.08 0.00 -2.10 0.00 0.00 70.33 68.10 1wt2 n THR 316 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1wt2 s LYS 317 N -3.00 0.77 -0.08 -0.78 1.02 -1.16 -4.08 119.74 112.43 1wt2 s LYS 317 Ca 0.13 0.18 0.02 0.00 0.02 0.00 0.00 55.97 56.32 1wt2 s LYS 317 Cb 0.18 0.36 0.01 0.00 -0.52 0.00 0.00 37.83 37.86 1wt2 s LYS 317 CO 0.51 -0.20 -0.14 0.08 -0.92 0.00 0.00 175.35 174.68 1wt2 s VAL 318 N -0.88 1.31 0.02 3.17 1.01 -0.35 -3.10 120.40 121.58 1wt2 s VAL 318 Ca -0.09 -0.56 -0.19 0.00 0.00 0.00 0.00 61.98 61.14 1wt2 s VAL 318 Cb -0.03 -1.20 -0.06 0.00 0.00 0.00 0.00 36.38 35.09 1wt2 s VAL 318 CO 0.05 0.40 0.53 -0.76 0.00 0.00 0.00 175.10 175.32 1wt2 s LEU 319 N 0.79 4.47 1.01 3.92 1.43 -0.38 -0.40 118.68 129.52 1wt2 s LEU 319 Ca -0.12 1.13 -0.14 0.00 -1.03 0.00 0.00 54.13 53.98 1wt2 s LEU 319 Cb -0.16 -2.82 0.19 0.00 0.03 0.00 0.00 46.19 43.44 1wt2 s LEU 319 CO 0.02 0.22 1.12 -0.94 0.23 0.00 0.00 176.35 177.00 1wt2 s SER 320 N -0.71 2.60 0.00 2.29 1.04 -0.86 -0.88 113.70 117.18 1wt2 s SER 320 Ca 0.28 0.99 0.07 0.00 0.48 0.00 0.00 55.95 57.76 1wt2 s SER 320 Cb -0.18 -1.54 0.32 0.00 0.10 0.00 0.00 66.02 64.72 1wt2 s SER 320 CO 0.16 -3.12 1.10 -2.65 0.98 0.00 0.00 173.24 169.71 1wt2 n PRO 321 N -4.14 0.08 0.13 4.02 -0.02 -1.26 -1.89 135.00 131.91 1wt2 n PRO 321 Ca 0.07 0.26 0.11 0.00 -2.02 0.00 0.00 63.50 61.92 1wt2 n PRO 321 Cb 0.58 -1.50 0.62 0.00 -0.02 0.00 0.00 33.50 33.18 1wt2 n PRO 321 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1wt2 h GLU 322 N 0.00 0.09 0.00 -0.52 5.08 -1.90 -2.39 114.58 114.95 1wt2 h GLU 322 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1wt2 h GLU 322 Cb 0.07 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1wt2 h GLU 322 CO 0.00 0.06 0.00 0.66 -1.00 0.00 0.00 179.01 178.73 1wt2 n TYR 323 N -4.48 0.15 -3.17 4.33 4.02 -0.79 -1.14 117.16 116.08 1wt2 n TYR 323 Ca 0.02 0.04 0.03 0.00 -0.01 0.00 0.00 57.90 57.98 1wt2 n TYR 323 Cb 0.26 -0.57 -0.01 0.00 -0.02 0.00 0.00 39.34 39.00 1wt2 n TYR 323 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1wt2 s LEU 324 N -3.24 -1.53 0.18 7.72 0.20 -0.90 -4.13 118.68 116.98 1wt2 s LEU 324 Ca 0.13 0.22 0.05 0.00 0.69 0.00 0.00 54.13 55.22 1wt2 s LEU 324 Cb 0.18 1.97 -0.05 0.00 -0.43 0.00 0.00 46.19 47.85 1wt2 s LEU 324 CO 0.53 -0.30 -0.09 0.86 -0.29 0.00 0.00 176.35 177.06 1wt2 s TRP 325 N 2.81 1.42 -0.35 5.38 -0.11 -0.12 -4.18 118.94 123.78 1wt2 s TRP 325 Ca 0.11 -0.76 0.00 0.00 1.22 0.00 0.00 56.10 56.67 1wt2 s TRP 325 Cb -0.11 -0.74 0.12 0.00 -1.50 0.00 0.00 33.47 31.24 1wt2 s TRP 325 CO -0.26 0.11 0.16 0.34 -4.62 0.00 0.00 176.95 172.68 1wt2 s ASP 326 N -3.23 3.77 0.35 5.86 -1.08 -1.26 -1.36 116.67 119.72 1wt2 s ASP 326 Ca 0.21 -2.00 0.08 0.00 -0.52 0.00 0.00 52.55 50.32 1wt2 s ASP 326 Cb 0.03 -0.84 0.66 0.00 -1.46 0.00 0.00 42.92 41.31 1wt2 s ASP 326 CO 0.04 -0.36 1.85 -0.61 0.52 0.00 0.00 175.17 176.61 1wt2 h GLN 327 N 7.55 0.29 -0.75 4.34 4.15 -1.89 0.15 115.11 128.95 1wt2 h GLN 327 Ca -0.08 -0.08 -0.06 0.00 0.77 0.00 0.00 58.65 59.20 1wt2 h GLN 327 Cb 0.98 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.61 1wt2 h GLN 327 CO 0.45 0.47 0.24 0.37 -1.93 0.00 0.00 178.83 178.43 1wt2 h GLN 328 N 0.27 1.16 0.01 1.69 4.15 -1.94 0.15 115.11 120.60 1wt2 h GLN 328 Ca 0.05 -0.25 -0.28 0.00 0.77 0.00 0.00 58.65 58.94 1wt2 h GLN 328 Cb 0.48 -0.17 -0.04 0.00 0.21 0.00 0.00 27.48 27.96 1wt2 h GLN 328 CO 0.03 0.98 -1.60 1.25 -1.93 0.00 0.00 178.83 177.56 1wt2 h LEU 329 N 1.11 0.03 -0.92 -2.39 6.46 -1.94 -3.41 115.31 114.25 1wt2 h LEU 329 Ca 0.24 -0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.95 1wt2 h LEU 329 Cb 0.30 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.22 1wt2 h LEU 329 CO -0.01 1.05 -0.01 0.18 -0.62 0.00 0.00 178.44 179.03 1wt2 n LEU 330 N -3.12 0.99 0.00 2.25 4.77 0.50 -5.10 117.00 117.29 1wt2 n LEU 330 Ca -0.15 -0.93 0.00 0.00 -0.03 0.00 0.00 56.01 54.90 1wt2 n LEU 330 Cb 1.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.12 1wt2 n LEU 330 CO 0.45 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 1wt2 n GLY 331 N 0.21 0.88 2.54 -0.72 0.00 0.53 -4.52 105.19 104.12 1wt2 n GLY 331 Ca 0.01 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 45.02 1wt2 n GLY 331 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1wt2 s TRP 332 N 0.00 0.36 0.73 1.61 -0.11 -1.26 -4.41 118.94 115.86 1wt2 s TRP 332 Ca 0.00 -1.57 -0.15 0.00 1.22 0.00 0.00 56.10 55.60 1wt2 s TRP 332 Cb 0.00 -0.66 0.04 0.00 -1.50 0.00 0.00 33.47 31.36 1wt2 s TRP 332 CO 0.00 -0.91 1.20 -2.14 -4.62 0.00 0.00 176.95 170.48 1wt2 s PRO 333 N 0.77 2.13 0.41 5.86 0.02 -1.26 -4.94 135.00 137.99 1wt2 s PRO 333 Ca 0.24 1.72 0.07 0.00 0.02 0.00 0.00 61.00 63.06 1wt2 s PRO 333 Cb -0.09 -1.84 0.85 0.00 0.02 0.00 0.00 34.50 33.44 1wt2 s PRO 333 CO -0.08 -1.84 2.06 0.00 -0.33 0.00 0.00 177.00 176.81 1wt2 h ALA 334 N -0.35 1.70 0.00 -1.55 0.00 -2.01 -1.53 119.26 115.52 1wt2 h ALA 334 Ca -0.47 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1wt2 h ALA 334 Cb 1.29 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1wt2 h ALA 334 CO 0.50 0.28 0.00 1.33 0.00 0.00 0.00 179.25 181.36 1wt2 n VAL 335 N -4.47 1.14 -3.45 0.00 0.24 -1.26 -4.34 118.33 106.19 1wt2 n VAL 335 Ca 0.03 0.37 -0.43 0.00 -2.04 0.00 0.00 64.34 62.27 1wt2 n VAL 335 Cb 0.06 -1.26 -0.08 0.00 -1.47 0.00 0.00 33.84 31.08 1wt2 n VAL 335 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1wt2 s LEU 336 N -3.71 5.51 0.38 1.34 1.43 -0.58 -4.90 118.68 118.14 1wt2 s LEU 336 Ca 0.03 -1.39 0.21 0.00 -1.03 0.00 0.00 54.13 51.96 1wt2 s LEU 336 Cb 0.07 -2.13 0.24 0.00 0.03 0.00 0.00 46.19 44.41 1wt2 s LEU 336 CO 0.24 -0.62 1.51 0.03 0.23 0.00 0.00 176.35 177.74 1wt2 h ARG 337 N 8.66 0.00 -3.29 1.70 3.08 -1.83 -3.45 114.38 119.24 1wt2 h ARG 337 Ca -0.27 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.64 1wt2 h ARG 337 Cb 1.10 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 30.94 1wt2 h ARG 337 CO 0.85 0.11 -0.40 0.15 -1.07 0.00 0.00 179.97 179.60 1wt2 s LYS 338 N -3.17 0.53 -0.36 0.04 1.02 -1.26 -5.10 119.74 111.43 1wt2 s LYS 338 Ca 0.06 -0.23 0.01 0.00 0.02 0.00 0.00 55.97 55.82 1wt2 s LYS 338 Cb 0.06 0.23 0.10 0.00 -0.52 0.00 0.00 37.83 37.70 1wt2 s LYS 338 CO 0.70 -0.13 0.10 -0.51 -0.92 0.00 0.00 175.35 174.58 1wt2 s LEU 339 N -1.18 4.83 -0.08 3.17 1.43 -1.26 -4.62 118.68 120.97 1wt2 s LEU 339 Ca -0.12 -2.01 -0.14 0.00 -1.03 0.00 0.00 54.13 50.82 1wt2 s LEU 339 Cb -0.06 -1.71 -0.29 0.00 0.03 0.00 0.00 46.19 44.16 1wt2 s LEU 339 CO 0.02 -0.42 0.62 0.03 0.23 0.00 0.00 176.35 176.83 1wt2 h ARG 340 N 7.81 0.31 -3.66 1.70 3.08 -1.42 -3.30 114.38 118.89 1wt2 h ARG 340 Ca -0.09 -0.53 -0.41 0.00 0.07 0.00 0.00 59.98 59.02 1wt2 h ARG 340 Cb 1.03 0.20 -0.37 0.00 0.08 0.00 0.00 29.97 30.91 1wt2 h ARG 340 CO 0.59 1.26 -0.76 0.12 -1.07 0.00 0.00 179.97 180.10 1wt2 s PHE 341 N -2.52 0.50 0.13 3.04 5.36 -1.22 0.24 117.98 123.52 1wt2 s PHE 341 Ca -0.18 -0.06 0.02 0.00 -0.96 0.00 0.00 56.93 55.75 1wt2 s PHE 341 Cb 0.05 -0.66 -0.04 0.00 -0.34 0.00 0.00 43.02 42.02 1wt2 s PHE 341 CO 0.81 -0.25 -0.05 0.95 -1.46 0.00 0.00 175.22 175.21 1wt2 s THR 342 N 1.74 0.78 0.52 0.12 -4.23 -0.41 -0.95 115.64 113.22 1wt2 s THR 342 Ca 0.01 -1.98 -0.20 0.00 -1.18 0.00 0.00 61.69 58.35 1wt2 s THR 342 Cb -0.13 -1.87 -0.07 0.00 1.34 0.00 0.00 72.50 71.78 1wt2 s THR 342 CO -0.04 -0.71 1.08 0.00 -0.54 0.00 0.00 174.62 174.41 1wt2 s ALA 343 N -3.58 2.77 -0.11 3.99 0.00 -0.46 -1.37 121.76 123.00 1wt2 s ALA 343 Ca 0.17 0.70 -0.17 0.00 0.00 0.00 0.00 51.96 52.66 1wt2 s ALA 343 Cb 0.05 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 1wt2 s ALA 343 CO -0.01 -0.58 0.44 0.14 0.00 0.00 0.00 175.76 175.75 1wt2 s VAL 344 N -1.91 5.19 -2.00 0.00 -7.23 -1.22 -4.82 120.40 108.42 1wt2 s VAL 344 Ca 0.70 0.87 0.09 0.00 -1.81 0.00 0.00 61.98 61.83 1wt2 s VAL 344 Cb -0.20 -3.77 0.25 0.00 0.56 0.00 0.00 36.38 33.22 1wt2 s VAL 344 CO 0.24 0.36 0.98 -0.81 -0.31 0.00 0.00 175.10 175.57