#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p1y s VAL 4 N 0.00 2.51 -0.02 0.00 1.01 -1.26 -1.03 120.40 121.61 2p1y s VAL 4 Ca 0.00 -1.35 0.03 0.00 0.00 0.00 0.00 61.98 60.66 2p1y s VAL 4 Cb 0.00 -2.37 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 2p1y s VAL 4 CO 0.00 0.08 -0.09 0.42 0.00 0.00 0.00 175.10 175.51 2p1y s THR 5 N 1.21 3.52 0.50 3.92 -4.23 -0.77 -4.44 115.64 115.35 2p1y s THR 5 Ca -0.04 -0.73 0.03 0.00 -1.18 0.00 0.00 61.69 59.77 2p1y s THR 5 Cb -0.18 -2.49 0.03 0.00 1.34 0.00 0.00 72.50 71.20 2p1y s THR 5 CO -0.05 0.46 0.26 0.00 -0.54 0.00 0.00 174.62 174.76 2p1y n GLN 6 N 1.81 0.77 -3.44 3.99 6.02 -1.26 -1.99 117.38 123.27 2p1y n GLN 6 Ca -0.16 -3.29 0.01 0.00 -0.01 0.00 0.00 57.00 53.55 2p1y n GLN 6 Cb 0.53 0.53 -0.05 0.00 1.02 0.00 0.00 30.24 32.26 2p1y n GLN 6 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2p1y s SER 7 N -3.89 -0.39 0.77 1.08 0.15 -0.51 -4.65 113.70 106.25 2p1y s SER 7 Ca 0.20 0.57 -0.11 0.00 0.70 0.00 0.00 55.95 57.31 2p1y s SER 7 Cb -0.02 1.36 0.06 0.00 -1.71 0.00 0.00 66.02 65.71 2p1y s SER 7 CO 0.13 -0.08 1.13 -2.16 1.20 0.00 0.00 173.24 173.46 2p1y s PRO 8 N 1.95 2.24 0.11 5.44 0.04 -1.26 -1.21 135.00 142.30 2p1y s PRO 8 Ca -0.04 0.15 -0.05 0.00 0.04 0.00 0.00 61.00 61.10 2p1y s PRO 8 Cb -0.04 -2.00 -0.17 0.00 0.04 0.00 0.00 34.50 32.33 2p1y s PRO 8 CO -0.16 -1.39 1.24 0.07 0.04 0.00 0.00 177.00 176.80 2p1y h ARG 9 N -0.88 0.38 -5.57 4.56 -0.00 -1.83 -3.41 114.38 107.64 2p1y h ARG 9 Ca -0.46 -0.48 -0.56 0.00 -0.00 0.00 0.00 59.98 58.48 2p1y h ARG 9 Cb 1.31 0.15 -0.30 0.00 -0.00 0.00 0.00 29.97 31.13 2p1y h ARG 9 CO 0.65 1.16 -0.84 -0.80 -0.00 0.00 0.00 179.97 180.14 2p1y s ASN 10 N -7.13 2.17 -0.15 0.08 0.01 -1.26 -1.12 114.94 107.53 2p1y s ASN 10 Ca -0.05 -0.34 -0.08 0.00 -0.71 0.00 0.00 52.86 51.67 2p1y s ASN 10 Cb 0.08 -0.40 0.05 0.00 0.41 0.00 0.00 41.25 41.39 2p1y s ASN 10 CO 0.88 0.19 0.37 -0.75 -1.51 0.00 0.00 177.10 176.28 2p1y s LYS 11 N -0.22 0.35 -0.14 -0.60 2.47 0.07 -4.97 119.74 116.70 2p1y s LYS 11 Ca 0.02 0.71 -0.03 0.00 -1.56 0.00 0.00 55.97 55.11 2p1y s LYS 11 Cb -0.09 -0.04 -0.03 0.00 -1.46 0.00 0.00 37.83 36.21 2p1y s LYS 11 CO 0.01 -0.15 -0.04 0.54 0.16 0.00 0.00 175.35 175.86 2p1y s VAL 12 N 1.30 3.86 0.28 4.02 0.11 -1.26 -0.45 120.40 128.26 2p1y s VAL 12 Ca -0.09 -0.38 0.06 0.00 -2.93 0.00 0.00 61.98 58.64 2p1y s VAL 12 Cb -0.09 -2.66 -0.06 0.00 -1.53 0.00 0.00 36.38 32.04 2p1y s VAL 12 CO -0.11 0.52 -0.04 0.00 -3.33 0.00 0.00 175.10 172.14 2p1y s ALA 13 N 0.09 2.32 0.06 1.54 0.00 0.24 -4.93 121.76 121.08 2p1y s ALA 13 Ca -0.01 -1.92 0.05 0.00 0.00 0.00 0.00 51.96 50.08 2p1y s ALA 13 Cb -0.14 0.27 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 2p1y s ALA 13 CO 0.03 -0.12 -0.05 0.08 0.00 0.00 0.00 175.76 175.70 2p1y s VAL 14 N -3.08 3.75 0.07 0.00 1.01 -1.26 -0.44 120.40 120.45 2p1y s VAL 14 Ca 0.30 -0.97 -0.37 0.00 0.00 0.00 0.00 61.98 60.95 2p1y s VAL 14 Cb 0.05 -2.72 -0.18 0.00 0.00 0.00 0.00 36.38 33.53 2p1y s VAL 14 CO 0.12 0.22 1.16 0.41 0.00 0.00 0.00 175.10 177.02 2p1y n THR 15 N 0.97 0.21 -1.02 3.92 -1.04 -0.48 -1.80 114.28 115.05 2p1y n THR 15 Ca -0.13 -0.05 -0.01 0.00 -2.04 0.00 0.00 64.05 61.82 2p1y n THR 15 Cb 0.52 -0.44 -0.00 0.00 -1.82 0.00 0.00 70.33 68.59 2p1y n THR 15 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2p1y n GLY 16 N 2.00 0.41 3.91 3.41 0.00 0.68 -4.91 105.19 110.69 2p1y n GLY 16 Ca 0.19 -0.08 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 2p1y n GLY 16 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2p1y s GLY 17 N -2.09 1.64 -0.24 -0.02 0.00 -0.75 -4.57 107.32 101.30 2p1y s GLY 17 Ca 0.00 -0.80 -0.05 0.00 0.00 0.00 0.00 44.72 43.87 2p1y s GLY 17 CO 0.00 -0.27 0.00 1.25 0.00 0.00 0.00 173.10 174.08 2p1y s LYS 18 N -5.58 3.41 -0.00 2.90 2.20 -1.26 -0.49 119.74 120.93 2p1y s LYS 18 Ca 0.64 -0.61 0.08 0.00 -0.36 0.00 0.00 55.97 55.72 2p1y s LYS 18 Cb -0.10 -3.13 -0.02 0.00 -1.51 0.00 0.00 37.83 33.07 2p1y s LYS 18 CO 0.49 -0.22 -0.26 0.08 -0.36 0.00 0.00 175.35 175.08 2p1y s VAL 19 N 1.52 2.07 -0.07 4.02 1.01 0.05 -5.02 120.40 123.98 2p1y s VAL 19 Ca 0.06 -1.19 0.03 0.00 0.00 0.00 0.00 61.98 60.87 2p1y s VAL 19 Cb -0.15 -1.73 0.01 0.00 0.00 0.00 0.00 36.38 34.51 2p1y s VAL 19 CO -0.01 0.52 -0.13 -0.89 0.00 0.00 0.00 175.10 174.58 2p1y s THR 20 N -0.67 1.22 -0.16 3.92 2.01 -1.26 -0.03 115.64 120.67 2p1y s THR 20 Ca 0.10 -0.53 -0.02 0.00 0.31 0.00 0.00 61.69 61.55 2p1y s THR 20 Cb -0.10 -1.10 -0.02 0.00 0.01 0.00 0.00 72.50 71.29 2p1y s THR 20 CO -0.00 0.37 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.47 2p1y s LEU 21 N 0.59 2.98 -0.09 4.42 1.43 0.08 -4.69 118.68 123.40 2p1y s LEU 21 Ca -0.14 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 52.71 2p1y s LEU 21 Cb -0.16 -1.71 -0.02 0.00 0.03 0.00 0.00 46.19 44.33 2p1y s LEU 21 CO 0.04 0.12 -0.11 -0.44 0.23 0.00 0.00 176.35 176.19 2p1y s SER 22 N 0.61 4.23 -0.06 2.29 0.01 -0.35 0.11 113.70 120.54 2p1y s SER 22 Ca -0.04 -0.20 0.05 0.00 1.31 0.00 0.00 55.95 57.07 2p1y s SER 22 Cb -0.15 -1.26 -0.01 0.00 0.21 0.00 0.00 66.02 64.82 2p1y s SER 22 CO 0.03 0.27 -0.22 0.00 0.41 0.00 0.00 173.24 173.73 2p1y s ASN 24 N -0.03 4.10 0.05 0.00 2.47 -0.84 -1.67 114.94 119.01 2p1y s ASN 24 Ca -0.05 -0.21 0.07 0.00 0.42 0.00 0.00 52.86 53.09 2p1y s ASN 24 Cb -0.13 -1.08 -0.03 0.00 -1.45 0.00 0.00 41.25 38.56 2p1y s ASN 24 CO 0.04 0.30 -0.19 0.00 -3.72 0.00 0.00 177.10 173.52 2p1y s GLN 25 N -0.46 1.25 -0.06 0.43 -2.07 0.25 -1.85 119.66 117.14 2p1y s GLN 25 Ca 0.06 -0.93 0.19 0.00 -1.82 0.00 0.00 55.36 52.86 2p1y s GLN 25 Cb -0.12 -1.36 0.66 0.00 -1.09 0.00 0.00 33.01 31.10 2p1y s GLN 25 CO 0.02 0.34 1.56 2.41 -1.32 0.00 0.00 175.29 178.30 2p1y n THR 26 N 1.75 1.41 1.01 3.63 -1.04 -0.20 -4.58 114.28 116.26 2p1y n THR 26 Ca -0.18 -1.04 0.10 0.00 -2.04 0.00 0.00 64.05 60.89 2p1y n THR 26 Cb 0.54 0.25 -0.05 0.00 -1.82 0.00 0.00 70.33 69.25 2p1y n THR 26 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2p1y n ASN 27 N 1.27 1.12 -3.68 8.00 3.02 -1.26 -4.96 115.26 118.77 2p1y n ASN 27 Ca 0.24 -1.00 -0.24 0.00 -0.03 0.00 0.00 54.58 53.55 2p1y n ASN 27 Cb 0.75 0.81 0.05 0.00 -0.61 0.00 0.00 39.78 40.78 2p1y n ASN 27 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2p1y n ASN 28 N -1.24 -3.62 -4.87 6.41 5.15 -1.26 -4.99 115.26 110.85 2p1y n ASN 28 Ca 0.05 -0.70 -0.33 0.00 -0.60 0.00 0.00 54.58 53.00 2p1y n ASN 28 Cb 0.35 -4.46 -0.05 0.00 -0.53 0.00 0.00 39.78 35.09 2p1y n ASN 28 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 2p1y s HIS 29 N -3.42 3.47 -0.02 1.20 3.76 -1.26 -5.02 115.29 114.00 2p1y s HIS 29 Ca 0.33 0.93 -0.19 0.00 -0.15 0.00 0.00 55.06 55.98 2p1y s HIS 29 Cb -0.16 -2.29 -0.33 0.00 1.11 0.00 0.00 32.58 30.91 2p1y s HIS 29 CO 0.78 0.31 0.92 -0.91 -0.85 0.00 0.00 174.74 174.99 2p1y h ASN 30 N 2.84 0.63 -3.26 1.40 2.35 -1.86 -3.46 115.58 114.21 2p1y h ASN 30 Ca -0.47 -0.94 -0.59 0.00 -0.55 0.00 0.00 56.30 53.75 2p1y h ASN 30 Cb 1.18 -0.21 -0.08 0.00 0.05 0.00 0.00 38.32 39.26 2p1y h ASN 30 CO 0.68 1.55 -0.21 0.20 -1.65 0.00 0.00 177.43 178.00 2p1y s ASN 31 N -7.24 6.63 0.21 5.81 0.01 -0.81 -3.42 114.94 116.13 2p1y s ASN 31 Ca -0.12 0.75 0.10 0.00 -0.71 0.00 0.00 52.86 52.87 2p1y s ASN 31 Cb 0.02 -2.25 -0.05 0.00 0.41 0.00 0.00 41.25 39.39 2p1y s ASN 31 CO 0.88 0.09 -0.18 -0.04 -1.51 0.00 0.00 177.10 176.33 2p1y s MET 32 N 0.29 1.43 -0.13 -0.60 -1.94 -0.62 -0.45 119.30 117.29 2p1y s MET 32 Ca 0.23 -1.58 -0.17 0.00 -1.71 0.00 0.00 55.69 52.46 2p1y s MET 32 Cb -0.15 -1.45 0.04 0.00 2.01 0.00 0.00 34.83 35.29 2p1y s MET 32 CO 0.09 0.28 0.45 0.71 -0.01 0.00 0.00 175.02 176.53 2p1y s TYR 33 N -2.41 -0.45 -0.13 -0.03 1.51 0.03 -0.83 117.35 115.04 2p1y s TYR 33 Ca 0.22 1.01 0.01 0.00 -1.01 0.00 0.00 57.07 57.30 2p1y s TYR 33 Cb -0.04 0.18 0.02 0.00 -0.11 0.00 0.00 41.96 42.00 2p1y s TYR 33 CO 0.09 -0.31 -0.14 -1.58 -1.11 0.00 0.00 175.55 172.51 2p1y s TRP 34 N -0.24 2.00 0.32 2.71 0.52 -0.34 -1.23 118.94 122.68 2p1y s TRP 34 Ca -0.04 -1.03 0.10 0.00 0.02 0.00 0.00 56.10 55.15 2p1y s TRP 34 Cb -0.03 -1.47 -0.05 0.00 -1.15 0.00 0.00 33.47 30.76 2p1y s TRP 34 CO 0.02 -0.56 -0.05 0.71 0.02 0.00 0.00 176.95 177.09 2p1y s TYR 35 N 1.26 2.49 0.11 -1.98 2.02 -0.33 -0.53 117.35 120.40 2p1y s TYR 35 Ca -0.01 -0.39 0.08 0.00 -0.37 0.00 0.00 57.07 56.39 2p1y s TYR 35 Cb -0.14 -1.32 -0.04 0.00 -0.40 0.00 0.00 41.96 40.07 2p1y s TYR 35 CO -0.06 0.57 -0.21 -0.98 -1.57 0.00 0.00 175.55 173.30 2p1y s ARG 36 N -3.65 1.15 -0.10 -0.62 1.70 -0.73 -0.63 118.95 116.06 2p1y s ARG 36 Ca 0.33 -1.19 0.03 0.00 -0.47 0.00 0.00 55.73 54.43 2p1y s ARG 36 Cb -0.02 -1.41 0.01 0.00 -0.57 0.00 0.00 34.95 32.96 2p1y s ARG 36 CO 0.18 0.33 -0.20 -1.14 -1.08 0.00 0.00 175.30 173.39 2p1y s GLN 37 N -1.99 2.67 -0.01 3.89 0.74 0.77 -0.67 119.66 125.06 2p1y s GLN 37 Ca 0.08 -0.74 0.00 0.00 0.05 0.00 0.00 55.36 54.75 2p1y s GLN 37 Cb -0.10 -2.11 0.01 0.00 1.10 0.00 0.00 33.01 31.91 2p1y s GLN 37 CO 0.05 0.07 0.00 -0.51 -0.55 0.00 0.00 175.29 174.34 2p1y s ASP 38 N 0.62 0.12 -0.43 6.67 1.01 -0.93 -3.60 116.67 120.14 2p1y s ASP 38 Ca -0.13 -0.00 -0.40 0.00 0.71 0.00 0.00 52.55 52.72 2p1y s ASP 38 Cb -0.16 -0.04 -0.17 0.00 1.01 0.00 0.00 42.92 43.55 2p1y s ASP 38 CO 0.04 -0.03 1.43 0.41 0.21 0.00 0.00 175.17 177.23 2p1y n THR 39 N 3.40 0.00 -0.39 -1.27 -1.04 -1.26 -1.42 114.28 112.29 2p1y n THR 39 Ca -0.17 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.84 2p1y n THR 39 Cb 0.57 -0.43 0.00 0.00 -1.82 0.00 0.00 70.33 68.65 2p1y n THR 39 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2p1y n GLY 40 N 3.80 1.14 0.00 3.41 0.00 -1.26 -4.81 105.19 107.47 2p1y n GLY 40 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.31 2p1y n GLY 40 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2p1y n HIS 41 N -2.00 0.00 -4.32 1.61 -0.00 -0.51 -5.13 115.22 104.87 2p1y n HIS 41 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2p1y n HIS 41 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2p1y n HIS 41 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2p1y n GLY 42 N 2.59 -0.06 3.66 -1.41 0.00 -0.77 -4.64 105.19 104.55 2p1y n GLY 42 Ca 0.00 -0.98 -0.40 0.00 0.00 0.00 0.00 46.02 44.64 2p1y n GLY 42 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2p1y s LEU 43 N 0.00 4.14 -0.09 0.99 1.43 -1.26 -2.18 118.68 121.71 2p1y s LEU 43 Ca 0.00 0.88 0.01 0.00 -1.03 0.00 0.00 54.13 53.98 2p1y s LEU 43 Cb 0.00 -2.95 -0.02 0.00 0.03 0.00 0.00 46.19 43.25 2p1y s LEU 43 CO 0.00 -0.31 -0.10 -0.13 0.23 0.00 0.00 176.35 176.04 2p1y s ARG 44 N 2.03 2.99 -0.26 1.70 0.52 0.16 -4.93 118.95 121.16 2p1y s ARG 44 Ca 0.30 -0.61 -0.25 0.00 -0.52 0.00 0.00 55.73 54.64 2p1y s ARG 44 Cb -0.16 -2.60 0.00 0.00 0.52 0.00 0.00 34.95 32.71 2p1y s ARG 44 CO 0.10 0.48 0.87 -1.17 0.02 0.00 0.00 175.30 175.60 2p1y s LEU 45 N -0.32 4.07 -0.12 2.53 2.96 -1.26 -1.78 118.68 124.77 2p1y s LEU 45 Ca 0.04 1.02 -0.08 0.00 -0.22 0.00 0.00 54.13 54.88 2p1y s LEU 45 Cb -0.13 -3.25 -0.03 0.00 0.50 0.00 0.00 46.19 43.29 2p1y s LEU 45 CO 0.02 -0.59 -0.16 -0.38 -1.32 0.00 0.00 176.35 173.93 2p1y n ILE 46 N 5.36 1.13 -3.99 6.68 5.41 0.31 0.11 119.36 134.38 2p1y n ILE 46 Ca 0.07 0.27 -0.08 0.00 1.00 0.00 0.00 62.75 64.01 2p1y n ILE 46 Cb 0.47 -2.20 -0.09 0.00 -0.71 0.00 0.00 39.64 37.12 2p1y n ILE 46 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 176.55 175.55 2p1y s HIS 47 N -2.07 0.36 0.25 1.39 3.76 -1.20 -0.45 115.29 117.34 2p1y s HIS 47 Ca -0.14 -0.86 -0.06 0.00 -0.15 0.00 0.00 55.06 53.85 2p1y s HIS 47 Cb 0.02 -0.25 0.03 0.00 1.11 0.00 0.00 32.58 33.49 2p1y s HIS 47 CO 0.20 -0.45 0.45 2.48 -0.85 0.00 0.00 174.74 176.57 2p1y n TYR 48 N 0.05 -1.59 -3.58 1.40 0.18 -0.31 -1.20 117.16 112.11 2p1y n TYR 48 Ca -0.15 -1.40 -0.16 0.00 1.88 0.00 0.00 57.90 58.08 2p1y n TYR 48 Cb 0.62 0.52 -0.07 0.00 -0.38 0.00 0.00 39.34 40.03 2p1y n TYR 48 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2p1y s SER 49 N -2.43 -0.68 -0.02 9.48 0.15 -0.01 0.11 113.70 120.30 2p1y s SER 49 Ca 0.14 1.04 0.22 0.00 0.70 0.00 0.00 55.95 58.05 2p1y s SER 49 Cb -0.02 0.97 -0.31 0.00 -1.71 0.00 0.00 66.02 64.95 2p1y s SER 49 CO 0.11 -0.43 0.59 -1.22 1.20 0.00 0.00 173.24 173.49 2p1y n TYR 50 N 1.80 0.00 -3.80 3.44 0.53 -1.26 -1.58 117.16 116.28 2p1y n TYR 50 Ca -0.17 0.00 -0.01 0.00 -1.02 0.00 0.00 57.90 56.70 2p1y n TYR 50 Cb 0.56 -0.37 0.00 0.00 -1.03 0.00 0.00 39.34 38.50 2p1y n TYR 50 CO 0.00 0.00 0.00 0.20 -1.02 0.00 0.00 176.86 176.04 2p1y s GLY 51 N -4.13 -0.15 0.33 2.72 0.00 -1.22 -4.24 107.32 100.63 2p1y s GLY 51 Ca -0.04 0.10 -0.28 0.00 0.00 0.00 0.00 44.72 44.51 2p1y s GLY 51 CO 0.90 1.74 1.15 0.00 0.00 0.00 0.00 173.10 176.89 2p1y n ALA 52 N -0.62 0.56 0.00 3.20 0.00 -1.26 -2.91 120.51 119.48 2p1y n ALA 52 Ca -0.04 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.75 2p1y n ALA 52 Cb 0.60 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.91 2p1y n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2p1y n GLY 53 N 0.99 2.60 3.28 0.00 0.00 0.28 -4.97 105.19 107.38 2p1y n GLY 53 Ca 0.07 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 2p1y n GLY 53 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2p1y s SER 54 N -1.93 1.01 0.06 1.61 1.04 -1.15 -4.92 113.70 109.42 2p1y s SER 54 Ca 0.00 -1.47 -0.10 0.00 0.48 0.00 0.00 55.95 54.86 2p1y s SER 54 Cb 0.00 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.46 2p1y s SER 54 CO 0.00 -0.84 0.21 0.42 0.98 0.00 0.00 173.24 174.01 2p1y s THR 55 N -3.81 0.12 -0.01 2.02 -4.23 -1.26 -4.47 115.64 104.00 2p1y s THR 55 Ca 0.38 -0.96 0.03 0.00 -1.18 0.00 0.00 61.69 59.95 2p1y s THR 55 Cb 0.06 -1.07 -0.01 0.00 1.34 0.00 0.00 72.50 72.83 2p1y s THR 55 CO 0.15 -0.53 -0.10 -1.61 -0.54 0.00 0.00 174.62 171.99 2p1y s GLU 56 N -3.03 0.85 0.23 3.99 0.41 0.12 -4.95 118.70 116.32 2p1y s GLU 56 Ca -0.01 -0.37 -0.31 0.00 -0.41 0.00 0.00 54.97 53.86 2p1y s GLU 56 Cb 0.01 -0.82 -0.12 0.00 -1.78 0.00 0.00 34.13 31.42 2p1y s GLU 56 CO -0.06 0.22 1.69 1.63 -0.49 0.00 0.00 175.26 178.24 2p1y n LYS 57 N 2.86 2.75 0.00 1.61 5.02 -1.26 -1.16 118.16 127.97 2p1y n LYS 57 Ca -0.14 0.99 0.00 0.00 -2.02 0.00 0.00 58.31 57.14 2p1y n LYS 57 Cb 0.56 -2.81 0.00 0.00 -0.02 0.00 0.00 35.03 32.76 2p1y n LYS 57 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2p1y n GLY 58 N 3.43 1.35 0.08 0.72 0.00 0.40 -4.84 105.19 106.34 2p1y n GLY 58 Ca 0.14 -1.37 -0.10 0.00 0.00 0.00 0.00 46.02 44.69 2p1y n GLY 58 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2p1y h ASP 59 N 0.00 0.07 -2.13 1.61 3.32 0.64 -3.40 116.42 116.53 2p1y h ASP 59 Ca 0.00 -0.11 -0.53 0.00 0.02 0.00 0.00 57.03 56.41 2p1y h ASP 59 Cb 0.00 -0.02 -0.41 0.00 0.22 0.00 0.00 39.33 39.12 2p1y h ASP 59 CO 0.00 1.10 -0.93 2.30 -1.72 0.00 0.00 179.24 179.98 2p1y n ILE 60 N -3.19 1.39 0.26 0.35 -5.35 -0.43 -4.94 119.36 107.44 2p1y n ILE 60 Ca -0.13 -5.05 0.13 0.00 -0.27 0.00 0.00 62.75 57.43 2p1y n ILE 60 Cb 1.02 -0.80 0.64 0.00 -1.74 0.00 0.00 39.64 38.77 2p1y n ILE 60 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 2p1y h PRO 61 N 2.99 0.00 -6.86 6.28 0.13 -1.78 -3.43 132.00 129.33 2p1y h PRO 61 Ca 0.11 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.71 2p1y h PRO 61 Cb 0.75 0.00 0.10 0.00 0.13 0.00 0.00 31.00 31.98 2p1y h PRO 61 CO 0.65 0.13 0.83 -0.25 -0.23 0.00 0.00 178.00 179.13 2p1y n ASP 62 N -3.37 3.81 0.00 1.44 9.92 -1.26 -2.13 116.55 124.96 2p1y n ASP 62 Ca -0.01 1.19 0.00 0.00 -0.53 0.00 0.00 54.79 55.44 2p1y n ASP 62 Cb 0.32 -1.60 0.00 0.00 -0.64 0.00 0.00 41.12 39.20 2p1y n ASP 62 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2p1y n GLY 63 N 1.36 0.90 3.16 0.44 0.00 -1.26 -5.04 105.19 104.74 2p1y n GLY 63 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 2p1y n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2p1y s TYR 65 N -3.63 1.30 0.44 1.61 1.51 -0.91 -4.44 117.35 113.23 2p1y s TYR 65 Ca 0.00 -0.36 0.05 0.00 -1.01 0.00 0.00 57.07 55.75 2p1y s TYR 65 Cb 0.00 -0.77 -0.06 0.00 -0.11 0.00 0.00 41.96 41.02 2p1y s TYR 65 CO 0.00 0.04 0.01 0.15 -1.11 0.00 0.00 175.55 174.65 2p1y s LYS 66 N -1.15 2.02 0.06 -0.62 1.02 -0.20 -4.97 119.74 115.89 2p1y s LYS 66 Ca 0.02 -2.19 -0.07 0.00 0.02 0.00 0.00 55.97 53.76 2p1y s LYS 66 Cb -0.08 -1.55 -0.01 0.00 -0.52 0.00 0.00 37.83 35.67 2p1y s LYS 66 CO 0.01 -0.16 0.13 0.00 -0.92 0.00 0.00 175.35 174.41 2p1y s ALA 67 N -2.80 -0.08 -0.06 5.17 0.00 -1.26 -1.16 121.76 121.56 2p1y s ALA 67 Ca 0.26 -0.63 -0.03 0.00 0.00 0.00 0.00 51.96 51.56 2p1y s ALA 67 Cb 0.07 0.34 0.04 0.00 0.00 0.00 0.00 23.12 23.57 2p1y s ALA 67 CO 0.13 -0.40 0.13 0.45 0.00 0.00 0.00 175.76 176.07 2p1y s SER 68 N -2.50 0.43 -0.88 0.00 0.15 -0.73 -4.96 113.70 105.22 2p1y s SER 68 Ca 0.00 0.25 -0.00 0.00 0.70 0.00 0.00 55.95 56.90 2p1y s SER 68 Cb 0.02 0.15 0.25 0.00 -1.71 0.00 0.00 66.02 64.73 2p1y s SER 68 CO -0.08 -0.20 0.94 -1.14 1.20 0.00 0.00 173.24 173.96 2p1y n ARG 69 N 4.81 3.03 0.06 5.44 3.00 -1.26 -1.18 116.66 130.56 2p1y n ARG 69 Ca -0.15 -4.54 0.12 0.00 -0.00 0.00 0.00 57.85 53.28 2p1y n ARG 69 Cb 0.50 -2.40 0.47 0.00 0.00 0.00 0.00 32.46 31.04 2p1y n ARG 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 2p1y n PRO 70 N 1.75 0.12 -3.66 -0.14 -0.04 -1.25 0.10 135.00 131.87 2p1y n PRO 70 Ca 0.25 0.19 -0.10 0.00 -0.04 0.00 0.00 63.50 63.79 2p1y n PRO 70 Cb 0.37 -1.66 -0.05 0.00 -0.04 0.00 0.00 33.50 32.12 2p1y n PRO 70 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2p1y s SER 71 N -3.71 -0.19 0.37 3.54 1.04 -1.26 -4.61 113.70 108.89 2p1y s SER 71 Ca 0.10 -0.36 0.19 0.00 0.48 0.00 0.00 55.95 56.36 2p1y s SER 71 Cb 0.13 0.46 1.18 0.00 0.10 0.00 0.00 66.02 67.89 2p1y s SER 71 CO 0.48 -0.84 1.67 -0.61 0.98 0.00 0.00 173.24 174.92 2p1y h GLN 72 N 2.41 0.26 0.00 4.02 5.75 -1.94 -3.23 115.11 122.38 2p1y h GLN 72 Ca -0.34 -0.02 -0.25 0.00 -0.15 0.00 0.00 58.65 57.90 2p1y h GLN 72 Cb 1.25 -0.06 -0.04 0.00 1.07 0.00 0.00 27.48 29.70 2p1y h GLN 72 CO 0.48 0.17 -1.44 0.93 -2.65 0.00 0.00 178.83 176.32 2p1y h GLU 73 N 0.26 0.00 -6.61 1.69 3.07 -1.90 -3.45 114.58 107.64 2p1y h GLU 73 Ca 0.74 0.00 -0.70 0.00 -0.50 0.00 0.00 59.36 58.90 2p1y h GLU 73 Cb 1.89 0.00 -0.29 0.00 -0.84 0.00 0.00 28.75 29.51 2p1y h GLU 73 CO -0.52 0.59 -0.88 -0.80 -1.40 0.00 0.00 179.01 175.99 2p1y s ASN 74 N -6.21 3.11 -0.22 1.42 -0.87 -1.22 0.85 114.94 111.80 2p1y s ASN 74 Ca -0.03 -0.47 -0.04 0.00 -1.57 0.00 0.00 52.86 50.75 2p1y s ASN 74 Cb 0.09 -0.36 0.11 0.00 -0.02 0.00 0.00 41.25 41.07 2p1y s ASN 74 CO 0.82 0.31 0.38 0.12 -2.57 0.00 0.00 177.10 176.17 2p1y s PHE 75 N -0.64 -0.78 0.15 2.20 5.99 -0.67 -3.92 117.98 120.31 2p1y s PHE 75 Ca 0.10 1.11 0.10 0.00 0.00 0.00 0.00 56.93 58.24 2p1y s PHE 75 Cb -0.10 0.13 -0.04 0.00 0.00 0.00 0.00 43.02 43.01 2p1y s PHE 75 CO -0.01 -0.60 -0.19 -1.54 -0.00 0.00 0.00 175.22 172.89 2p1y s SER 76 N 2.56 3.78 -0.10 6.13 1.04 -0.32 -1.23 113.70 125.57 2p1y s SER 76 Ca 0.06 -0.66 0.02 0.00 0.48 0.00 0.00 55.95 55.85 2p1y s SER 76 Cb -0.14 -0.47 -0.02 0.00 0.10 0.00 0.00 66.02 65.49 2p1y s SER 76 CO -0.14 0.15 -0.16 -0.22 0.98 0.00 0.00 173.24 173.85 2p1y s LEU 77 N -2.41 2.60 -0.18 2.42 2.96 0.30 -1.77 118.68 122.61 2p1y s LEU 77 Ca 0.20 -0.33 0.01 0.00 -0.22 0.00 0.00 54.13 53.78 2p1y s LEU 77 Cb -0.09 -1.55 0.03 0.00 0.50 0.00 0.00 46.19 45.07 2p1y s LEU 77 CO 0.11 0.22 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.57 2p1y s ILE 78 N 0.00 1.81 -0.45 6.68 1.01 -0.31 -0.74 121.20 129.20 2p1y s ILE 78 Ca -0.05 -0.88 -0.05 0.00 0.00 0.00 0.00 60.65 59.67 2p1y s ILE 78 Cb -0.14 -1.72 0.12 0.00 0.01 0.00 0.00 42.46 40.73 2p1y s ILE 78 CO 0.04 0.41 0.27 -0.76 0.00 0.00 0.00 174.94 174.91 2p1y s LEU 79 N 1.37 5.42 0.03 2.97 1.02 0.95 -1.04 118.68 129.41 2p1y s LEU 79 Ca 0.03 -2.05 -0.07 0.00 0.02 0.00 0.00 54.13 52.06 2p1y s LEU 79 Cb -0.14 -1.90 -0.30 0.00 0.02 0.00 0.00 46.19 43.88 2p1y s LEU 79 CO -0.11 -0.59 0.96 -0.33 0.02 0.00 0.00 176.35 176.31 2p1y h GLU 80 N 8.12 0.33 -2.94 1.70 5.08 -1.81 0.18 114.58 125.25 2p1y h GLU 80 Ca -0.15 -0.57 -0.61 0.00 -1.00 0.00 0.00 59.36 57.03 2p1y h GLU 80 Cb 1.05 0.21 -0.40 0.00 0.50 0.00 0.00 28.75 30.11 2p1y h GLU 80 CO 0.76 1.24 -0.73 -1.17 -1.00 0.00 0.00 179.01 178.10 2p1y s LEU 81 N -7.19 3.13 0.24 1.33 2.96 -1.25 -4.05 118.68 113.85 2p1y s LEU 81 Ca -0.08 -3.03 -0.31 0.00 -0.22 0.00 0.00 54.13 50.49 2p1y s LEU 81 Cb 0.06 -1.13 -0.11 0.00 0.50 0.00 0.00 46.19 45.51 2p1y s LEU 81 CO 0.88 -0.20 1.60 0.00 -1.32 0.00 0.00 176.35 177.31 2p1y s ALA 82 N -0.19 3.79 -0.07 5.97 0.00 0.36 -4.68 121.76 126.95 2p1y s ALA 82 Ca 0.22 1.50 0.04 0.00 0.00 0.00 0.00 51.96 53.72 2p1y s ALA 82 Cb -0.15 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.33 2p1y s ALA 82 CO -0.07 -0.89 -0.19 0.95 0.00 0.00 0.00 175.76 175.55 2p1y s THR 83 N 0.56 1.65 0.03 0.00 -4.23 -1.26 -0.23 115.64 112.16 2p1y s THR 83 Ca 0.67 -0.81 -0.01 0.00 -1.18 0.00 0.00 61.69 60.37 2p1y s THR 83 Cb -0.47 -1.43 0.05 0.00 1.34 0.00 0.00 72.50 72.00 2p1y s THR 83 CO 0.39 0.47 0.19 -2.65 -0.54 0.00 0.00 174.62 172.48 2p1y n PRO 84 N 3.39 -0.01 0.15 3.99 -0.02 -1.26 0.50 135.00 141.73 2p1y n PRO 84 Ca -0.19 0.19 0.07 0.00 -2.02 0.00 0.00 63.50 61.55 2p1y n PRO 84 Cb 0.52 -0.29 0.40 0.00 -0.02 0.00 0.00 33.50 34.12 2p1y n PRO 84 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2p1y n SER 85 N -4.20 0.38 -1.19 2.55 3.41 -1.26 -1.46 113.62 111.86 2p1y n SER 85 Ca 0.02 0.60 0.12 0.00 -0.26 0.00 0.00 58.87 59.35 2p1y n SER 85 Cb 0.06 -0.60 0.26 0.00 -0.26 0.00 0.00 64.21 63.67 2p1y n SER 85 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2p1y n GLN 86 N -2.05 2.52 -1.89 4.33 6.02 0.18 -4.83 117.38 121.66 2p1y n GLN 86 Ca -0.01 -2.33 -0.42 0.00 -0.01 0.00 0.00 57.00 54.23 2p1y n GLN 86 Cb 0.21 -1.52 -0.03 0.00 1.02 0.00 0.00 30.24 29.92 2p1y n GLN 86 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2p1y s THR 87 N -1.36 3.36 0.03 5.09 2.01 -0.53 -4.81 115.64 119.43 2p1y s THR 87 Ca 0.42 0.46 -0.09 0.00 0.31 0.00 0.00 61.69 62.78 2p1y s THR 87 Cb 0.23 -3.30 0.03 0.00 0.01 0.00 0.00 72.50 69.48 2p1y s THR 87 CO 0.32 -0.04 0.42 -0.24 -0.69 0.00 0.00 174.62 174.38 2p1y n SER 88 N 7.21 -0.52 -4.34 3.53 2.88 -0.98 -5.02 113.62 116.38 2p1y n SER 88 Ca 0.18 -1.20 -0.33 0.00 -1.33 0.00 0.00 58.87 56.19 2p1y n SER 88 Cb 0.42 0.83 -0.14 0.00 -0.75 0.00 0.00 64.21 64.57 2p1y n SER 88 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2p1y s VAL 89 N -2.24 3.06 -0.19 2.46 1.01 -1.24 -1.13 120.40 122.14 2p1y s VAL 89 Ca 0.10 -0.64 -0.07 0.00 0.00 0.00 0.00 61.98 61.36 2p1y s VAL 89 Cb -0.01 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 2p1y s VAL 89 CO 0.01 0.50 0.06 -0.31 0.00 0.00 0.00 175.10 175.36 2p1y s TYR 90 N 0.64 3.23 -0.14 5.22 2.02 -0.72 -0.16 117.35 127.43 2p1y s TYR 90 Ca -0.06 0.03 0.03 0.00 -0.37 0.00 0.00 57.07 56.69 2p1y s TYR 90 Cb -0.15 -2.09 0.01 0.00 -0.40 0.00 0.00 41.96 39.33 2p1y s TYR 90 CO 0.03 0.11 -0.22 -0.06 -1.57 0.00 0.00 175.55 173.84 2p1y s PHE 91 N 0.48 2.62 0.18 2.71 0.08 0.19 -1.61 117.98 122.64 2p1y s PHE 91 Ca 0.03 -1.31 -0.22 0.00 0.12 0.00 0.00 56.93 55.55 2p1y s PHE 91 Cb -0.13 -1.79 -0.08 0.00 -0.57 0.00 0.00 43.02 40.46 2p1y s PHE 91 CO 0.01 -0.59 0.72 0.00 -0.10 0.00 0.00 175.22 175.26 2p1y s ALA 93 N -1.33 1.78 0.11 0.00 0.00 -0.37 -0.12 121.76 121.84 2p1y s ALA 93 Ca 0.38 -1.68 0.06 0.00 0.00 0.00 0.00 51.96 50.73 2p1y s ALA 93 Cb -0.19 0.24 -0.04 0.00 0.00 0.00 0.00 23.12 23.13 2p1y s ALA 93 CO 0.23 -0.14 -0.15 -1.54 0.00 0.00 0.00 175.76 174.15 2p1y s SER 94 N -3.28 2.07 0.08 0.00 1.04 -0.46 -0.79 113.70 112.36 2p1y s SER 94 Ca 0.24 -0.76 -0.27 0.00 0.48 0.00 0.00 55.95 55.64 2p1y s SER 94 Cb 0.04 -0.08 0.08 0.00 0.10 0.00 0.00 66.02 66.16 2p1y s SER 94 CO 0.06 -0.10 0.95 -0.83 0.98 0.00 0.00 173.24 174.30 2p1y s GLY 95 N -2.27 -0.33 0.00 7.32 0.00 0.41 -1.46 107.32 110.98 2p1y s GLY 95 Ca 0.07 0.49 0.00 0.00 0.00 0.00 0.00 44.72 45.28 2p1y s GLY 95 CO 0.03 0.14 0.00 1.34 0.00 0.00 0.00 173.10 174.61 2p1y n ASP 96 N -0.38 2.27 0.00 1.64 2.03 -1.26 -1.92 116.55 118.92 2p1y n ASP 96 Ca -0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.24 2p1y n ASP 96 Cb 0.61 0.09 0.00 0.00 -0.72 0.00 0.00 41.12 41.10 2p1y n ASP 96 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2p1y n ARG 104 N -1.77 0.00 -3.23 -0.67 1.74 -1.26 -4.97 116.66 106.50 2p1y n ARG 104 Ca 0.00 0.00 0.03 0.00 -0.77 0.00 0.00 57.85 57.11 2p1y n ARG 104 Cb 0.26 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.66 2p1y n ARG 104 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2p1y s LEU 105 N -0.83 -0.21 -0.08 0.55 0.20 -1.26 -5.06 118.68 111.99 2p1y s LEU 105 Ca 0.00 0.28 0.03 0.00 0.69 0.00 0.00 54.13 55.12 2p1y s LEU 105 Cb 0.00 1.24 0.01 0.00 -0.43 0.00 0.00 46.19 47.01 2p1y s LEU 105 CO 0.00 -0.04 -0.15 -0.36 -0.29 0.00 0.00 176.35 175.51 2p1y s PHE 106 N 2.22 1.80 0.05 5.38 0.08 -0.54 -4.85 117.98 122.11 2p1y s PHE 106 Ca -0.01 -0.72 0.01 0.00 0.12 0.00 0.00 56.93 56.33 2p1y s PHE 106 Cb -0.03 -1.28 -0.04 0.00 -0.57 0.00 0.00 43.02 41.10 2p1y s PHE 106 CO -0.16 -0.35 0.12 -0.06 -0.10 0.00 0.00 175.22 174.68 2p1y s PHE 107 N 0.66 3.34 0.36 0.36 0.40 -1.26 -1.35 117.98 120.49 2p1y s PHE 107 Ca -0.14 0.18 -0.06 0.00 -0.60 0.00 0.00 56.93 56.31 2p1y s PHE 107 Cb -0.16 -1.71 0.08 0.00 0.51 0.00 0.00 43.02 41.75 2p1y s PHE 107 CO 0.04 0.56 0.49 0.41 0.70 0.00 0.00 175.22 177.41 2p1y n GLY 108 N 0.64 -1.31 1.02 4.36 0.00 0.83 -4.83 105.19 105.89 2p1y n GLY 108 Ca -0.09 -1.68 0.10 0.00 0.00 0.00 0.00 46.02 44.35 2p1y n GLY 108 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2p1y n HIS 109 N -2.70 0.57 0.00 1.61 8.25 -1.26 -3.80 115.22 117.89 2p1y n HIS 109 Ca 0.06 -0.35 0.00 0.00 -0.26 0.00 0.00 57.72 57.17 2p1y n HIS 109 Cb 0.21 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.32 2p1y n HIS 109 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2p1y n GLY 110 N 1.22 0.05 2.91 -1.41 0.00 -1.26 -4.18 105.19 102.51 2p1y n GLY 110 Ca 0.18 -1.72 -0.28 0.00 0.00 0.00 0.00 46.02 44.19 2p1y n GLY 110 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2p1y s THR 111 N -2.77 1.20 -0.03 2.61 2.01 -0.63 -4.66 115.64 113.36 2p1y s THR 111 Ca 0.00 -0.67 -0.30 0.00 0.31 0.00 0.00 61.69 61.03 2p1y s THR 111 Cb 0.00 -1.34 -0.04 0.00 0.01 0.00 0.00 72.50 71.13 2p1y s THR 111 CO 0.00 0.16 1.31 -1.59 -0.69 0.00 0.00 174.62 173.81 2p1y s LYS 112 N 1.60 4.31 -0.16 4.92 0.00 -0.28 -1.76 119.74 128.37 2p1y s LYS 112 Ca 0.01 1.83 -0.02 0.00 0.00 0.00 0.00 55.97 57.79 2p1y s LYS 112 Cb -0.15 -3.58 -0.02 0.00 0.00 0.00 0.00 37.83 34.09 2p1y s LYS 112 CO -0.08 -0.53 -0.09 -1.17 0.00 0.00 0.00 175.35 173.48 2p1y s LEU 113 N 2.37 2.86 -0.22 2.77 2.96 -0.29 -0.75 118.68 128.38 2p1y s LEU 113 Ca 0.60 -0.30 -0.02 0.00 -0.22 0.00 0.00 54.13 54.18 2p1y s LEU 113 Cb -0.28 -1.67 0.01 0.00 0.50 0.00 0.00 46.19 44.74 2p1y s LEU 113 CO 0.24 0.12 -0.08 -0.55 -1.32 0.00 0.00 176.35 174.77 2p1y s SER 114 N 0.61 4.07 -0.44 3.68 0.15 0.40 -2.31 113.70 119.87 2p1y s SER 114 Ca -0.06 -0.58 -0.15 0.00 0.70 0.00 0.00 55.95 55.86 2p1y s SER 114 Cb -0.15 -1.67 0.05 0.00 -1.71 0.00 0.00 66.02 62.54 2p1y s SER 114 CO 0.03 -0.05 0.35 -0.69 1.20 0.00 0.00 173.24 174.08 2p1y s VAL 115 N 1.40 5.24 0.00 4.45 1.01 -1.26 0.82 120.40 132.06 2p1y s VAL 115 Ca 0.04 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.15 2p1y s VAL 115 Cb -0.15 -4.03 0.00 0.00 0.00 0.00 0.00 36.38 32.21 2p1y s VAL 115 CO -0.06 -0.45 0.49 0.18 0.00 0.00 0.00 175.10 175.27 2p1y n LEU 116 N 5.18 1.39 0.00 3.92 4.32 0.42 -4.35 117.00 127.88 2p1y n LEU 116 Ca -0.12 -0.66 0.00 0.00 -0.02 0.00 0.00 56.01 55.21 2p1y n LEU 116 Cb 0.45 -0.26 0.00 0.00 -1.62 0.00 0.00 43.42 41.99 2p1y n LEU 116 CO 0.44 0.25 0.00 0.61 -1.22 0.00 0.00 177.39 177.47 2p1y n GLY 215 N 1.20 0.80 1.44 -0.72 0.00 -1.26 -1.38 105.19 105.27 2p1y n GLY 215 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2p1y n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2p1y n GLN 302 N 0.00 -0.28 -3.60 1.61 10.64 -1.26 -4.90 117.38 119.59 2p1y n GLN 302 Ca 0.00 -0.83 -0.24 0.00 -1.83 0.00 0.00 57.00 54.10 2p1y n GLN 302 Cb 0.00 -0.44 -0.17 0.00 -0.86 0.00 0.00 30.24 28.77 2p1y n GLN 302 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 2p1y s VAL 303 N -1.81 -0.13 -0.18 -0.39 1.01 -1.26 -3.67 120.40 113.98 2p1y s VAL 303 Ca 0.27 -0.08 -0.07 0.00 0.00 0.00 0.00 61.98 62.10 2p1y s VAL 303 Cb -0.01 -0.53 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 2p1y s VAL 303 CO 0.19 -0.21 0.07 -0.13 0.00 0.00 0.00 175.10 175.01 2p1y s ARG 304 N 2.17 3.95 -0.20 2.72 0.52 -0.24 -4.29 118.95 123.56 2p1y s ARG 304 Ca 0.03 -0.33 -0.07 0.00 -0.52 0.00 0.00 55.73 54.84 2p1y s ARG 304 Cb -0.15 -3.21 -0.04 0.00 0.52 0.00 0.00 34.95 32.07 2p1y s ARG 304 CO -0.09 0.31 0.06 -0.65 0.02 0.00 0.00 175.30 174.95 2p1y s GLN 305 N 0.28 3.83 0.16 3.54 -0.21 -1.26 -1.12 119.66 124.88 2p1y s GLN 305 Ca 0.04 -0.41 0.06 0.00 0.02 0.00 0.00 55.36 55.07 2p1y s GLN 305 Cb -0.12 -3.23 -0.04 0.00 1.00 0.00 0.00 33.01 30.62 2p1y s GLN 305 CO 0.00 0.10 0.07 0.45 -2.12 0.00 0.00 175.29 173.80 2p1y s SER 306 N 0.82 5.20 0.82 5.90 0.15 -0.94 -4.33 113.70 121.32 2p1y s SER 306 Ca 0.03 -0.23 -0.12 0.00 0.70 0.00 0.00 55.95 56.34 2p1y s SER 306 Cb -0.14 -1.26 0.08 0.00 -1.71 0.00 0.00 66.02 62.99 2p1y s SER 306 CO 0.02 0.09 1.10 -2.16 1.20 0.00 0.00 173.24 173.50 2p1y s PRO 307 N -2.95 1.91 0.24 5.44 0.04 -1.26 -1.62 135.00 136.81 2p1y s PRO 307 Ca 0.29 0.58 -0.05 0.00 0.04 0.00 0.00 61.00 61.85 2p1y s PRO 307 Cb -0.10 -1.90 0.33 0.00 0.04 0.00 0.00 34.50 32.87 2p1y s PRO 307 CO 0.21 -1.73 1.86 1.96 0.04 0.00 0.00 177.00 179.35 2p1y h GLN 308 N -1.16 1.01 -3.88 4.56 4.20 -1.84 -3.41 115.11 114.58 2p1y h GLN 308 Ca -0.48 -0.06 -0.14 0.00 0.06 0.00 0.00 58.65 58.03 2p1y h GLN 308 Cb 1.28 -0.23 -0.19 0.00 0.30 0.00 0.00 27.48 28.64 2p1y h GLN 308 CO 0.60 0.67 -0.61 -1.54 -0.67 0.00 0.00 178.83 177.28 2p1y s SER 309 N -5.82 0.22 -0.02 1.46 1.04 -1.26 -0.88 113.70 108.43 2p1y s SER 309 Ca -0.13 -0.53 0.01 0.00 0.48 0.00 0.00 55.95 55.78 2p1y s SER 309 Cb 0.18 0.17 0.02 0.00 0.10 0.00 0.00 66.02 66.49 2p1y s SER 309 CO 0.80 -0.42 -0.03 -0.22 0.98 0.00 0.00 173.24 174.35 2p1y s LEU 310 N -1.86 1.49 -0.18 2.42 2.96 0.36 -4.92 118.68 118.95 2p1y s LEU 310 Ca -0.09 -0.07 0.01 0.00 -0.22 0.00 0.00 54.13 53.76 2p1y s LEU 310 Cb -0.04 -0.28 0.02 0.00 0.50 0.00 0.00 46.19 46.39 2p1y s LEU 310 CO -0.03 -0.04 -0.20 -0.89 -1.32 0.00 0.00 176.35 173.88 2p1y s THR 311 N 0.61 2.10 0.10 3.68 2.01 -1.26 -0.04 115.64 122.84 2p1y s THR 311 Ca -0.07 -0.93 0.07 0.00 0.31 0.00 0.00 61.69 61.08 2p1y s THR 311 Cb -0.10 -1.88 -0.03 0.00 0.01 0.00 0.00 72.50 70.50 2p1y s THR 311 CO -0.01 0.54 -0.19 0.68 -0.69 0.00 0.00 174.62 174.95 2p1y s VAL 312 N 1.28 1.56 0.39 3.82 -7.23 -0.65 -5.00 120.40 114.56 2p1y s VAL 312 Ca 0.05 -1.53 -0.24 0.00 -1.81 0.00 0.00 61.98 58.45 2p1y s VAL 312 Cb -0.13 -1.47 -0.10 0.00 0.56 0.00 0.00 36.38 35.25 2p1y s VAL 312 CO -0.12 -0.14 1.00 0.86 -0.31 0.00 0.00 175.10 176.39 2p1y s TRP 313 N -1.31 3.39 0.30 2.82 -0.11 -1.26 -0.93 118.94 121.83 2p1y s TRP 313 Ca 0.05 1.68 -0.27 0.00 1.22 0.00 0.00 56.10 58.78 2p1y s TRP 313 Cb -0.09 -3.02 -0.14 0.00 -1.50 0.00 0.00 33.47 28.72 2p1y s TRP 313 CO 0.04 -0.30 0.89 -0.85 -4.62 0.00 0.00 176.95 172.10 2p1y n GLU 314 N -0.03 1.07 0.00 5.86 0.28 0.18 -2.27 120.64 125.73 2p1y n GLU 314 Ca 0.05 0.38 0.00 0.00 -0.16 0.00 0.00 57.16 57.42 2p1y n GLU 314 Cb 0.51 -1.69 0.00 0.00 1.43 0.00 0.00 31.44 31.68 2p1y n GLU 314 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2p1y n GLY 315 N 1.39 2.71 3.79 -1.84 0.00 0.72 -4.92 105.19 107.04 2p1y n GLY 315 Ca 0.11 -0.39 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 2p1y n GLY 315 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2p1y s GLU 316 N 0.00 3.26 -0.21 1.61 2.02 -0.96 -4.15 118.70 120.27 2p1y s GLU 316 Ca 0.00 1.28 -0.27 0.00 0.02 0.00 0.00 54.97 56.00 2p1y s GLU 316 Cb 0.00 -2.02 -0.00 0.00 0.10 0.00 0.00 34.13 32.21 2p1y s GLU 316 CO 0.00 -0.86 0.93 0.99 0.02 0.00 0.00 175.26 176.34 2p1y s THR 317 N -2.35 4.78 -0.22 3.63 2.01 -1.26 -1.06 115.64 121.16 2p1y s THR 317 Ca 0.65 1.81 -0.23 0.00 0.31 0.00 0.00 61.69 64.23 2p1y s THR 317 Cb -0.17 -4.22 -0.01 0.00 0.01 0.00 0.00 72.50 68.11 2p1y s THR 317 CO 0.36 -0.09 0.75 0.00 -0.69 0.00 0.00 174.62 174.95 2p1y s ALA 318 N 2.79 3.60 -0.27 7.40 0.00 -0.71 -4.88 121.76 129.69 2p1y s ALA 318 Ca 0.40 -0.18 -0.03 0.00 0.00 0.00 0.00 51.96 52.16 2p1y s ALA 318 Cb -0.16 -3.17 0.03 0.00 0.00 0.00 0.00 23.12 19.82 2p1y s ALA 318 CO 0.09 -0.78 -0.02 0.42 0.00 0.00 0.00 175.76 175.47 2p1y s ILE 319 N 2.46 3.11 -0.17 0.00 1.01 -1.26 -0.13 121.20 126.22 2p1y s ILE 319 Ca 0.33 -1.02 -0.03 0.00 0.00 0.00 0.00 60.65 59.93 2p1y s ILE 319 Cb -0.16 -2.62 -0.02 0.00 0.01 0.00 0.00 42.46 39.68 2p1y s ILE 319 CO 0.09 0.13 -0.06 -0.76 0.00 0.00 0.00 174.94 174.34 2p1y s LEU 320 N 1.35 3.00 -0.15 2.97 1.02 0.53 -4.84 118.68 122.56 2p1y s LEU 320 Ca -0.00 -0.27 -0.07 0.00 0.02 0.00 0.00 54.13 53.81 2p1y s LEU 320 Cb -0.17 -1.73 -0.04 0.00 0.02 0.00 0.00 46.19 44.27 2p1y s LEU 320 CO -0.03 0.10 0.08 0.20 0.02 0.00 0.00 176.35 176.73 2p1y s ASN 321 N 0.76 5.87 0.10 2.29 0.01 -0.64 -0.21 114.94 123.12 2p1y s ASN 321 Ca -0.02 0.23 0.06 0.00 -0.71 0.00 0.00 52.86 52.41 2p1y s ASN 321 Cb -0.15 -1.93 -0.03 0.00 0.41 0.00 0.00 41.25 39.55 2p1y s ASN 321 CO 0.02 0.28 -0.15 0.00 -1.51 0.00 0.00 177.10 175.73 2p1y s SER 323 N -2.10 -0.15 0.31 0.00 1.04 -0.28 -1.39 113.70 111.14 2p1y s SER 323 Ca 0.05 -0.19 0.04 0.00 0.48 0.00 0.00 55.95 56.33 2p1y s SER 323 Cb -0.08 0.38 -0.03 0.00 0.10 0.00 0.00 66.02 66.40 2p1y s SER 323 CO 0.03 -0.65 0.29 -0.72 0.98 0.00 0.00 173.24 173.17 2p1y s TYR 324 N -2.71 1.55 -0.01 5.02 -0.85 -0.95 -1.08 117.35 118.31 2p1y s TYR 324 Ca -0.04 -1.56 0.00 0.00 -0.52 0.00 0.00 57.07 54.96 2p1y s TYR 324 Cb -0.00 -0.58 -0.01 0.00 0.38 0.00 0.00 41.96 41.75 2p1y s TYR 324 CO -0.04 -0.89 -0.01 0.39 -1.52 0.00 0.00 175.55 173.48 2p1y n GLU 325 N -0.56 0.08 -3.05 -3.49 1.02 -1.24 -4.85 120.64 108.54 2p1y n GLU 325 Ca 0.06 0.01 -0.43 0.00 -0.02 0.00 0.00 57.16 56.77 2p1y n GLU 325 Cb 0.63 -1.02 -0.06 0.00 -0.02 0.00 0.00 31.44 30.96 2p1y n GLU 325 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2p1y s ASN 326 N -4.09 6.36 0.00 1.62 2.47 -1.26 -4.92 114.94 115.11 2p1y s ASN 326 Ca -0.01 -0.23 0.00 0.00 0.42 0.00 0.00 52.86 53.04 2p1y s ASN 326 Cb 0.00 -2.35 0.00 0.00 -1.45 0.00 0.00 41.25 37.46 2p1y s ASN 326 CO 0.03 -0.83 0.90 -1.54 -3.72 0.00 0.00 177.10 171.93 2p1y n SER 327 N 6.45 0.00 0.18 -4.21 3.41 -1.26 -2.17 113.62 116.02 2p1y n SER 327 Ca 0.00 0.41 0.02 0.00 -0.26 0.00 0.00 58.87 59.04 2p1y n SER 327 Cb 0.48 -0.41 0.35 0.00 -0.26 0.00 0.00 64.21 64.38 2p1y n SER 327 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2p1y h ALA 328 N 1.86 1.38 -2.65 7.33 0.00 -1.98 -3.45 119.26 121.74 2p1y h ALA 328 Ca 0.00 -0.34 -0.52 0.00 0.00 0.00 0.00 54.91 54.05 2p1y h ALA 328 Cb 0.06 -0.06 0.06 0.00 0.00 0.00 0.00 17.79 17.84 2p1y h ALA 328 CO 0.00 0.47 0.96 -0.06 0.00 0.00 0.00 179.25 180.61 2p1y s PHE 329 N -4.21 2.95 0.00 0.00 0.08 -0.92 -4.82 117.98 111.05 2p1y s PHE 329 Ca -0.03 0.48 0.00 0.00 0.12 0.00 0.00 56.93 57.50 2p1y s PHE 329 Cb 0.14 -4.06 0.00 0.00 -0.57 0.00 0.00 43.02 38.53 2p1y s PHE 329 CO 0.73 -3.95 0.00 -0.40 -0.10 0.00 0.00 175.22 171.50 2p1y n ASP 330 N 3.82 1.82 -3.92 1.36 5.75 0.34 -4.78 116.55 120.94 2p1y n ASP 330 Ca 0.15 -0.19 -0.20 0.00 -0.01 0.00 0.00 54.79 54.54 2p1y n ASP 330 Cb 0.36 0.75 -0.16 0.00 -1.03 0.00 0.00 41.12 41.04 2p1y n ASP 330 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 2p1y s TYR 331 N -1.11 0.77 -0.36 2.11 5.04 -0.99 -0.09 117.35 122.72 2p1y s TYR 331 Ca 0.00 -0.21 -0.00 0.00 -2.44 0.00 0.00 57.07 54.42 2p1y s TYR 331 Cb 0.00 -0.64 0.12 0.00 0.35 0.00 0.00 41.96 41.80 2p1y s TYR 331 CO 0.00 -0.16 0.18 -0.06 -1.34 0.00 0.00 175.55 174.17 2p1y s PHE 332 N 0.67 1.32 0.20 4.97 0.40 0.28 0.17 117.98 125.98 2p1y s PHE 332 Ca -0.09 -1.81 -0.26 0.00 -0.60 0.00 0.00 56.93 54.16 2p1y s PHE 332 Cb -0.12 -1.42 -0.08 0.00 0.51 0.00 0.00 43.02 41.90 2p1y s PHE 332 CO 0.00 -0.83 0.82 -1.25 0.70 0.00 0.00 175.22 174.67 2p1y s PRO 333 N 1.11 4.60 -0.04 0.24 0.04 -1.22 -1.05 135.00 138.69 2p1y s PRO 333 Ca 0.15 1.22 -0.00 0.00 0.04 0.00 0.00 61.00 62.40 2p1y s PRO 333 Cb -0.21 -3.19 -0.04 0.00 0.04 0.00 0.00 34.50 31.11 2p1y s PRO 333 CO -0.10 0.52 0.02 -1.58 0.04 0.00 0.00 177.00 175.90 2p1y s TRP 334 N -1.24 3.17 0.05 0.56 0.52 0.79 -2.37 118.94 120.42 2p1y s TRP 334 Ca 0.39 0.16 0.09 0.00 0.02 0.00 0.00 56.10 56.76 2p1y s TRP 334 Cb -0.23 -1.73 -0.03 0.00 -1.15 0.00 0.00 33.47 30.33 2p1y s TRP 334 CO 0.27 0.49 -0.26 0.71 0.02 0.00 0.00 176.95 178.18 2p1y s TYR 335 N -1.04 2.28 -0.15 -1.98 2.02 -0.53 -0.26 117.35 117.69 2p1y s TYR 335 Ca 0.18 -0.41 0.01 0.00 -0.37 0.00 0.00 57.07 56.48 2p1y s TYR 335 Cb -0.12 -1.36 0.00 0.00 -0.40 0.00 0.00 41.96 40.08 2p1y s TYR 335 CO 0.08 0.13 -0.18 -1.14 -1.57 0.00 0.00 175.55 172.88 2p1y s GLN 336 N -1.27 3.14 -0.26 -0.62 0.74 0.62 -1.23 119.66 120.77 2p1y s GLN 336 Ca 0.12 -0.79 -0.01 0.00 0.05 0.00 0.00 55.36 54.73 2p1y s GLN 336 Cb -0.10 -2.57 0.04 0.00 1.10 0.00 0.00 33.01 31.48 2p1y s GLN 336 CO 0.02 -0.02 -0.05 -1.14 -0.55 0.00 0.00 175.29 173.55 2p1y s GLN 337 N 0.87 2.61 0.36 1.67 0.74 -0.30 -1.52 119.66 124.08 2p1y s GLN 337 Ca -0.05 -1.13 -0.25 0.00 0.05 0.00 0.00 55.36 53.99 2p1y s GLN 337 Cb -0.15 -3.02 -0.10 0.00 1.10 0.00 0.00 33.01 30.84 2p1y s GLN 337 CO -0.02 -0.49 0.97 -0.06 -0.55 0.00 0.00 175.29 175.13 2p1y s PHE 338 N 1.26 3.54 0.35 1.67 0.08 -1.26 -2.61 117.98 121.01 2p1y s PHE 338 Ca -0.03 1.72 -0.27 0.00 0.12 0.00 0.00 56.93 58.48 2p1y s PHE 338 Cb -0.18 -2.95 -0.12 0.00 -0.57 0.00 0.00 43.02 39.20 2p1y s PHE 338 CO -0.04 -0.01 1.13 -2.30 -0.10 0.00 0.00 175.22 173.90 2p1y n PRO 339 N 0.22 1.67 -1.10 0.24 -0.02 -1.26 -0.70 135.00 134.04 2p1y n PRO 339 Ca 0.03 0.59 -0.04 0.00 -2.02 0.00 0.00 63.50 62.07 2p1y n PRO 339 Cb 0.51 -2.11 -0.02 0.00 -0.02 0.00 0.00 33.50 31.86 2p1y n PRO 339 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2p1y n GLY 340 N 1.02 0.42 3.61 -1.23 0.00 -1.26 -5.02 105.19 102.73 2p1y n GLY 340 Ca 0.08 -0.04 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 2p1y n GLY 340 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2p1y s GLU 341 N -2.03 1.97 0.40 1.61 2.02 0.12 -4.94 118.70 117.85 2p1y s GLU 341 Ca 0.00 -1.98 -0.02 0.00 0.02 0.00 0.00 54.97 52.99 2p1y s GLU 341 Cb 0.00 -1.74 -0.04 0.00 0.10 0.00 0.00 34.13 32.45 2p1y s GLU 341 CO 0.00 0.02 0.65 0.20 0.02 0.00 0.00 175.26 176.15 2p1y s GLY 342 N -3.70 1.46 0.53 -1.39 0.00 -1.25 -4.66 107.32 98.31 2p1y s GLY 342 Ca 0.35 -0.70 -0.22 0.00 0.00 0.00 0.00 44.72 44.14 2p1y s GLY 342 CO 0.18 -0.60 1.35 -4.14 0.00 0.00 0.00 173.10 169.90 2p1y s PRO 343 N -4.41 3.24 0.05 2.90 0.02 -1.26 -4.58 135.00 130.96 2p1y s PRO 343 Ca 0.43 2.22 0.07 0.00 0.02 0.00 0.00 61.00 63.74 2p1y s PRO 343 Cb -0.10 -2.31 -0.03 0.00 0.02 0.00 0.00 34.50 32.09 2p1y s PRO 343 CO 0.39 -1.11 -0.19 0.00 -0.33 0.00 0.00 177.00 175.76 2p1y s ALA 344 N -1.31 1.64 0.13 -1.55 0.00 -0.58 -4.24 121.76 115.86 2p1y s ALA 344 Ca 0.70 -1.04 -0.31 0.00 0.00 0.00 0.00 51.96 51.31 2p1y s ALA 344 Cb -0.40 -0.29 -0.09 0.00 0.00 0.00 0.00 23.12 22.34 2p1y s ALA 344 CO 0.48 0.35 1.49 -1.17 0.00 0.00 0.00 175.76 176.91 2p1y s LEU 345 N -1.28 4.37 -0.27 0.00 2.96 -1.26 -0.28 118.68 122.92 2p1y s LEU 345 Ca 0.06 2.46 -0.13 0.00 -0.22 0.00 0.00 54.13 56.30 2p1y s LEU 345 Cb -0.09 -3.59 -0.13 0.00 0.50 0.00 0.00 46.19 42.88 2p1y s LEU 345 CO 0.02 -0.75 -0.29 -0.11 -1.32 0.00 0.00 176.35 173.90 2p1y n LEU 346 N 4.11 2.04 -3.59 -0.68 7.94 0.64 -4.85 117.00 122.61 2p1y n LEU 346 Ca 0.13 0.31 -0.10 0.00 -1.11 0.00 0.00 56.01 55.24 2p1y n LEU 346 Cb 0.40 -0.84 -0.05 0.00 0.53 0.00 0.00 43.42 43.46 2p1y n LEU 346 CO 0.60 0.58 0.81 -0.51 -1.11 0.00 0.00 177.39 177.76 2p1y s ILE 347 N -2.50 0.00 0.24 1.96 2.07 -1.21 -5.02 121.20 116.74 2p1y s ILE 347 Ca -0.38 0.00 -0.07 0.00 -1.41 0.00 0.00 60.65 58.80 2p1y s ILE 347 Cb 0.14 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.71 2p1y s ILE 347 CO 0.51 0.00 0.34 -0.94 -1.91 0.00 0.00 174.94 172.94 2p1y s SER 348 N -0.99 0.13 0.13 4.50 1.04 -1.26 -0.15 113.70 117.10 2p1y s SER 348 Ca -0.00 -1.18 -0.10 0.00 0.48 0.00 0.00 55.95 55.14 2p1y s SER 348 Cb -0.01 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.63 2p1y s SER 348 CO 0.00 -1.04 0.27 -0.51 0.98 0.00 0.00 173.24 172.95 2p1y s ILE 349 N -3.97 0.10 0.12 -1.02 2.07 -0.21 -4.93 121.20 113.35 2p1y s ILE 349 Ca 0.30 -1.12 0.06 0.00 -1.41 0.00 0.00 60.65 58.48 2p1y s ILE 349 Cb 0.02 -1.49 -0.04 0.00 0.13 0.00 0.00 42.46 41.09 2p1y s ILE 349 CO 0.12 -0.45 -0.02 -0.76 -1.91 0.00 0.00 174.94 171.92 2p1y s LEU 350 N -2.89 3.33 0.64 8.50 2.01 -1.26 -0.55 118.68 128.46 2p1y s LEU 350 Ca 0.09 -0.29 0.24 0.00 0.01 0.00 0.00 54.13 54.17 2p1y s LEU 350 Cb 0.04 -2.05 1.19 0.00 0.01 0.00 0.00 46.19 45.38 2p1y s LEU 350 CO -0.07 0.14 1.66 0.28 1.01 0.00 0.00 176.35 179.37 2p1y h SER 351 N 3.20 0.00 1.01 2.29 0.02 -0.80 -1.42 113.55 117.84 2p1y h SER 351 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2p1y h SER 351 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 2p1y h SER 351 CO 0.58 0.00 0.00 1.33 -1.14 0.00 0.00 176.83 177.60 2p1y n VAL 352 N -3.09 0.73 -4.46 2.27 0.24 -1.26 -4.84 118.33 107.93 2p1y n VAL 352 Ca 0.04 0.04 -0.30 0.00 -2.04 0.00 0.00 64.34 62.08 2p1y n VAL 352 Cb 0.72 -0.94 -0.12 0.00 -1.47 0.00 0.00 33.84 32.03 2p1y n VAL 352 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2p1y s SER 353 N -4.33 3.66 0.00 -1.34 0.15 -0.54 -5.06 113.70 106.24 2p1y s SER 353 Ca 0.07 -0.58 0.19 0.00 0.70 0.00 0.00 55.95 56.33 2p1y s SER 353 Cb 0.10 -0.45 0.01 0.00 -1.71 0.00 0.00 66.02 63.98 2p1y s SER 353 CO 0.47 0.20 0.99 -0.90 1.20 0.00 0.00 173.24 175.20 2p1y n ASP 354 N 1.07 1.93 -3.67 5.45 5.68 -1.26 -4.70 116.55 121.05 2p1y n ASP 354 Ca -0.16 -1.47 -0.11 0.00 -0.50 0.00 0.00 54.79 52.55 2p1y n ASP 354 Cb 0.53 0.42 -0.09 0.00 -1.14 0.00 0.00 41.12 40.84 2p1y n ASP 354 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 2p1y s LYS 355 N -2.13 0.59 -0.10 0.11 2.20 -1.26 -0.44 119.74 118.72 2p1y s LYS 355 Ca 0.17 0.91 -0.01 0.00 -0.36 0.00 0.00 55.97 56.68 2p1y s LYS 355 Cb 0.16 0.16 0.03 0.00 -1.51 0.00 0.00 37.83 36.67 2p1y s LYS 355 CO 0.46 -0.12 -0.02 0.21 -0.36 0.00 0.00 175.35 175.51 2p1y s LYS 356 N 1.03 0.96 -0.08 4.03 2.47 -0.59 -5.02 119.74 122.54 2p1y s LYS 356 Ca -0.06 -0.08 0.01 0.00 -1.56 0.00 0.00 55.97 54.28 2p1y s LYS 356 Cb -0.06 -1.30 -0.03 0.00 -1.46 0.00 0.00 37.83 34.98 2p1y s LYS 356 CO -0.09 -0.32 -0.07 -1.83 0.16 0.00 0.00 175.35 173.19 2p1y s GLU 357 N 1.86 2.84 -0.31 4.03 -1.05 -1.26 -1.27 118.70 123.55 2p1y s GLU 357 Ca 0.04 -0.56 -0.02 0.00 -0.15 0.00 0.00 54.97 54.28 2p1y s GLU 357 Cb -0.13 -2.60 0.12 0.00 -0.44 0.00 0.00 34.13 31.07 2p1y s GLU 357 CO -0.07 0.60 0.18 0.34 0.95 0.00 0.00 175.26 177.26 2p1y s ASP 358 N -0.64 3.11 1.99 0.83 2.15 0.46 -5.00 116.67 119.57 2p1y s ASP 358 Ca 0.10 -1.48 0.00 0.00 0.43 0.00 0.00 52.55 51.59 2p1y s ASP 358 Cb -0.11 -0.24 0.00 0.00 -0.30 0.00 0.00 42.92 42.26 2p1y s ASP 358 CO 0.02 -0.39 0.00 0.61 -0.17 0.00 0.00 175.17 175.23 2p1y n GLY 359 N 4.90 4.03 0.00 2.66 0.00 -1.26 -1.85 105.19 113.67 2p1y n GLY 359 Ca -0.00 0.04 0.14 0.00 0.00 0.00 0.00 46.02 46.20 2p1y n GLY 359 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2p1y n ARG 361 N 13.97 0.86 -4.25 1.61 1.74 -1.26 -4.79 116.66 124.53 2p1y n ARG 361 Ca 0.00 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.74 2p1y n ARG 361 Cb 0.00 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 29.80 2p1y n ARG 361 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2p1y s PHE 362 N -2.03 2.91 -0.19 -1.55 0.40 -0.77 -0.24 117.98 116.51 2p1y s PHE 362 Ca 0.42 -0.80 0.01 0.00 -0.60 0.00 0.00 56.93 55.95 2p1y s PHE 362 Cb 0.19 -1.99 0.04 0.00 0.51 0.00 0.00 43.02 41.77 2p1y s PHE 362 CO 0.33 -0.39 -0.12 0.99 0.70 0.00 0.00 175.22 176.74 2p1y s THR 363 N 0.97 1.64 -0.07 0.64 2.01 -0.57 -0.40 115.64 119.86 2p1y s THR 363 Ca -0.01 -0.92 -0.30 0.00 0.31 0.00 0.00 61.69 60.78 2p1y s THR 363 Cb -0.15 -1.67 -0.04 0.00 0.01 0.00 0.00 72.50 70.66 2p1y s THR 363 CO -0.00 0.25 1.32 -0.63 -0.69 0.00 0.00 174.62 174.87 2p1y s ILE 364 N 1.41 4.03 -0.20 1.82 1.01 -0.39 -1.11 121.20 127.77 2p1y s ILE 364 Ca 0.00 1.34 -0.04 0.00 0.00 0.00 0.00 60.65 61.95 2p1y s ILE 364 Cb -0.15 -3.86 -0.02 0.00 0.01 0.00 0.00 42.46 38.43 2p1y s ILE 364 CO -0.09 -0.04 -0.02 -0.36 0.00 0.00 0.00 174.94 174.43 2p1y s PHE 365 N 2.78 3.00 -0.08 3.97 0.40 -0.47 -1.54 117.98 126.04 2p1y s PHE 365 Ca 0.60 -0.60 0.04 0.00 -0.60 0.00 0.00 56.93 56.37 2p1y s PHE 365 Cb -0.27 -2.08 0.00 0.00 0.51 0.00 0.00 43.02 41.18 2p1y s PHE 365 CO 0.22 -0.33 -0.22 0.12 0.70 0.00 0.00 175.22 175.71 2p1y s PHE 366 N 1.12 2.31 -0.48 0.36 5.36 0.41 -0.91 117.98 126.15 2p1y s PHE 366 Ca 0.02 -0.89 0.03 0.00 -0.96 0.00 0.00 56.93 55.14 2p1y s PHE 366 Cb -0.14 -1.56 0.14 0.00 -0.34 0.00 0.00 43.02 41.12 2p1y s PHE 366 CO 0.01 -0.35 0.27 1.21 -1.46 0.00 0.00 175.22 174.89 2p1y s ASN 367 N 0.30 3.84 0.22 6.13 3.84 0.14 -4.54 114.94 124.89 2p1y s ASN 367 Ca -0.15 -2.84 -0.07 0.00 0.21 0.00 0.00 52.86 50.01 2p1y s ASN 367 Cb -0.17 -1.23 0.34 0.00 -0.55 0.00 0.00 41.25 39.64 2p1y s ASN 367 CO 0.07 -0.24 1.77 0.50 -2.79 0.00 0.00 177.10 176.41 2p1y h LYS 368 N 6.53 0.56 -0.91 0.43 3.64 -1.90 0.16 116.57 125.07 2p1y h LYS 368 Ca -0.01 -0.03 0.17 0.00 -1.27 0.00 0.00 60.65 59.51 2p1y h LYS 368 Cb 0.90 -0.13 -0.10 0.00 -0.41 0.00 0.00 32.23 32.50 2p1y h LYS 368 CO 0.55 0.37 0.49 -0.09 -2.27 0.00 0.00 179.45 178.50 2p1y h ARG 369 N 0.57 0.62 -0.01 1.90 2.43 -1.95 -1.70 114.38 116.26 2p1y h ARG 369 Ca 0.35 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.48 2p1y h ARG 369 Cb 0.38 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2p1y h ARG 369 CO -0.28 0.41 -0.75 0.39 -1.51 0.00 0.00 179.97 178.24 2p1y n GLU 370 N -4.86 0.53 -3.51 0.20 -0.58 -0.70 -4.96 120.64 106.76 2p1y n GLU 370 Ca 0.20 -0.43 -0.19 0.00 -0.42 0.00 0.00 57.16 56.32 2p1y n GLU 370 Cb 0.51 -1.49 0.07 0.00 -0.57 0.00 0.00 31.44 29.96 2p1y n GLU 370 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2p1y n LYS 371 N -0.86 -6.24 -4.08 3.49 5.02 0.48 -4.93 118.16 111.04 2p1y n LYS 371 Ca 0.06 0.79 -0.13 0.00 -2.02 0.00 0.00 58.31 57.02 2p1y n LYS 371 Cb 0.39 -5.69 -0.11 0.00 -0.02 0.00 0.00 35.03 29.60 2p1y n LYS 371 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2p1y s LYS 372 N -5.58 0.58 0.06 1.97 1.02 -0.73 -2.24 119.74 114.83 2p1y s LYS 372 Ca 0.04 -0.86 -0.12 0.00 0.02 0.00 0.00 55.97 55.05 2p1y s LYS 372 Cb -0.02 -0.28 0.01 0.00 -0.52 0.00 0.00 37.83 37.02 2p1y s LYS 372 CO 0.75 0.04 0.26 -0.48 -0.92 0.00 0.00 175.35 175.01 2p1y s LEU 373 N -1.83 1.06 -0.00 3.17 2.34 -0.48 0.28 118.68 123.21 2p1y s LEU 373 Ca -0.06 -0.34 0.02 0.00 0.06 0.00 0.00 54.13 53.82 2p1y s LEU 373 Cb -0.07 1.24 -0.01 0.00 -0.56 0.00 0.00 46.19 46.79 2p1y s LEU 373 CO -0.00 -0.65 -0.08 -0.44 -1.06 0.00 0.00 176.35 174.12 2p1y s SER 374 N -2.30 0.92 -0.28 1.48 0.01 -0.09 -0.09 113.70 113.36 2p1y s SER 374 Ca -0.02 -0.15 -0.07 0.00 1.31 0.00 0.00 55.95 57.01 2p1y s SER 374 Cb 0.01 -0.10 -0.01 0.00 0.21 0.00 0.00 66.02 66.13 2p1y s SER 374 CO -0.06 0.09 0.09 -0.22 0.41 0.00 0.00 173.24 173.55 2p1y s LEU 375 N -0.23 3.72 -0.22 2.44 2.96 0.71 -1.37 118.68 126.68 2p1y s LEU 375 Ca 0.03 -0.47 -0.10 0.00 -0.22 0.00 0.00 54.13 53.36 2p1y s LEU 375 Cb -0.03 -1.92 -0.05 0.00 0.50 0.00 0.00 46.19 44.69 2p1y s LEU 375 CO -0.00 -0.13 0.15 -1.00 -1.32 0.00 0.00 176.35 174.05 2p1y s HIS 376 N 1.57 3.36 -0.60 5.38 3.76 -0.27 -0.34 115.29 128.15 2p1y s HIS 376 Ca 0.05 0.28 -0.10 0.00 -0.15 0.00 0.00 55.06 55.13 2p1y s HIS 376 Cb -0.16 -2.23 0.15 0.00 1.11 0.00 0.00 32.58 31.45 2p1y s HIS 376 CO 0.03 0.16 0.49 0.42 -0.85 0.00 0.00 174.74 174.99 2p1y s ILE 377 N 0.77 4.62 0.42 0.60 1.01 0.82 -1.52 121.20 127.92 2p1y s ILE 377 Ca 0.08 -2.13 -0.26 0.00 0.00 0.00 0.00 60.65 58.34 2p1y s ILE 377 Cb -0.12 -3.97 -0.09 0.00 0.01 0.00 0.00 42.46 38.28 2p1y s ILE 377 CO 0.02 -0.87 1.44 0.00 0.00 0.00 0.00 174.94 175.52 2p1y n ALA 378 N 4.47 2.09 -3.73 9.38 0.00 0.67 -1.73 120.51 131.66 2p1y n ALA 378 Ca -0.01 0.28 -0.25 0.00 0.00 0.00 0.00 53.44 53.47 2p1y n ALA 378 Cb 0.42 -2.39 0.03 0.00 0.00 0.00 0.00 19.45 17.50 2p1y n ALA 378 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2p1y n ASP 379 N 0.06 -2.56 -4.49 0.00 8.00 -1.25 -4.82 116.55 111.49 2p1y n ASP 379 Ca 0.04 -0.92 -0.40 0.00 0.71 0.00 0.00 54.79 54.22 2p1y n ASP 379 Cb 0.40 -3.69 0.02 0.00 -0.02 0.00 0.00 41.12 37.83 2p1y n ASP 379 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2p1y n SER 380 N -2.94 -0.54 -4.28 -2.24 3.41 -0.23 -4.47 113.62 102.35 2p1y n SER 380 Ca -0.23 0.87 -0.19 0.00 -0.26 0.00 0.00 58.87 59.07 2p1y n SER 380 Cb 0.65 -1.18 -0.11 0.00 -0.26 0.00 0.00 64.21 63.31 2p1y n SER 380 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2p1y s GLN 381 N -1.83 1.13 0.45 4.33 -0.21 -1.26 -0.20 119.66 122.06 2p1y s GLN 381 Ca 0.65 -1.32 0.16 0.00 0.02 0.00 0.00 55.36 54.87 2p1y s GLN 381 Cb -0.54 -1.06 1.09 0.00 1.00 0.00 0.00 33.01 33.50 2p1y s GLN 381 CO 0.56 0.21 1.98 -1.35 -2.12 0.00 0.00 175.29 174.57 2p1y h PRO 382 N 3.37 0.33 0.00 2.91 0.11 -1.82 -1.64 132.00 135.25 2p1y h PRO 382 Ca -0.41 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2p1y h PRO 382 Cb 1.20 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2p1y h PRO 382 CO 0.51 0.22 0.00 0.41 -0.21 0.00 0.00 178.00 178.93 2p1y n GLY 383 N -1.54 -0.67 0.03 -0.55 0.00 -1.26 -1.82 105.19 99.38 2p1y n GLY 383 Ca 0.10 -0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.20 2p1y n GLY 383 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2p1y n ASP 384 N -1.33 0.43 -4.65 1.61 8.00 -0.62 -4.85 116.55 115.14 2p1y n ASP 384 Ca 0.04 0.21 -0.51 0.00 0.71 0.00 0.00 54.79 55.24 2p1y n ASP 384 Cb 0.09 -0.19 -0.06 0.00 -0.02 0.00 0.00 41.12 40.94 2p1y n ASP 384 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2p1y n SER 385 N -1.76 2.92 -3.58 -2.24 7.64 -0.75 -4.90 113.62 110.95 2p1y n SER 385 Ca 0.06 0.87 0.02 0.00 1.01 0.00 0.00 58.87 60.83 2p1y n SER 385 Cb 0.37 -1.29 -0.01 0.00 -1.01 0.00 0.00 64.21 62.28 2p1y n SER 385 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2p1y s ALA 386 N 4.69 -2.44 -0.12 -0.43 0.00 -0.90 -4.83 121.76 117.73 2p1y s ALA 386 Ca 0.98 1.20 -0.17 0.00 0.00 0.00 0.00 51.96 53.97 2p1y s ALA 386 Cb -0.81 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 2p1y s ALA 386 CO 0.55 -0.93 0.42 0.99 0.00 0.00 0.00 175.76 176.78 2p1y s THR 387 N -2.02 5.21 -0.16 0.00 2.01 -1.07 -0.48 115.64 119.13 2p1y s THR 387 Ca 0.14 0.83 -0.00 0.00 0.31 0.00 0.00 61.69 62.96 2p1y s THR 387 Cb 0.06 -3.75 -0.00 0.00 0.01 0.00 0.00 72.50 68.81 2p1y s THR 387 CO -0.06 0.36 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.79 2p1y s TYR 388 N 0.45 2.81 -0.11 4.92 1.51 -0.36 -1.15 117.35 125.41 2p1y s TYR 388 Ca 0.23 -0.95 -0.00 0.00 -1.01 0.00 0.00 57.07 55.34 2p1y s TYR 388 Cb -0.15 -1.90 -0.02 0.00 -0.11 0.00 0.00 41.96 39.78 2p1y s TYR 388 CO 0.09 -0.43 -0.11 -0.06 -1.11 0.00 0.00 175.55 173.93 2p1y s PHE 389 N 0.79 2.85 -0.17 2.71 0.40 -0.37 -0.90 117.98 123.30 2p1y s PHE 389 Ca -0.05 -0.41 -0.15 0.00 -0.60 0.00 0.00 56.93 55.72 2p1y s PHE 389 Cb -0.15 -1.81 -0.04 0.00 0.51 0.00 0.00 43.02 41.52 2p1y s PHE 389 CO 0.01 -0.05 0.33 0.00 0.70 0.00 0.00 175.22 176.21 2p1y s ALA 391 N 0.67 2.34 -0.30 0.00 0.00 -1.00 0.13 121.76 123.60 2p1y s ALA 391 Ca 0.18 -1.29 -0.06 0.00 0.00 0.00 0.00 51.96 50.79 2p1y s ALA 391 Cb -0.14 -0.51 0.02 0.00 0.00 0.00 0.00 23.12 22.49 2p1y s ALA 391 CO 0.05 0.54 0.06 0.00 0.00 0.00 0.00 175.76 176.41 2p1y s ALA 392 N -0.87 2.99 -0.10 0.00 0.00 -0.48 -3.39 121.76 119.91 2p1y s ALA 392 Ca 0.13 -1.53 -0.07 0.00 0.00 0.00 0.00 51.96 50.48 2p1y s ALA 392 Cb -0.10 -2.09 -0.04 0.00 0.00 0.00 0.00 23.12 20.89 2p1y s ALA 392 CO 0.03 -1.02 0.16 0.42 0.00 0.00 0.00 175.76 175.36 2p1y s ILE 393 N 1.44 5.47 -0.51 0.00 1.01 0.13 -2.03 121.20 126.70 2p1y s ILE 393 Ca 0.01 0.20 -0.06 0.00 0.00 0.00 0.00 60.65 60.80 2p1y s ILE 393 Cb -0.18 -3.44 0.13 0.00 0.01 0.00 0.00 42.46 38.99 2p1y s ILE 393 CO 0.01 0.57 0.35 -0.62 0.00 0.00 0.00 174.94 175.26 2p1y s ASP 394 N -1.17 5.53 0.49 3.58 -1.08 -1.17 -0.50 116.67 122.35 2p1y s ASP 394 Ca 0.17 -2.22 0.24 0.00 -0.52 0.00 0.00 52.55 50.22 2p1y s ASP 394 Cb -0.12 -1.93 1.28 0.00 -1.46 0.00 0.00 42.92 40.69 2p1y s ASP 394 CO 0.07 -0.57 2.02 0.71 0.52 0.00 0.00 175.17 177.92 2p1y h THR 395 N 5.92 0.71 0.11 1.71 1.35 -1.89 -2.38 112.91 118.43 2p1y h THR 395 Ca -0.12 -0.66 -0.17 0.00 -0.55 0.00 0.00 66.41 64.92 2p1y h THR 395 Cb 1.03 1.40 0.02 0.00 -1.73 0.00 0.00 68.15 68.88 2p1y h THR 395 CO 0.77 0.16 -0.72 0.78 -0.25 0.00 0.00 175.52 176.25 2p1y h ASN 396 N 0.00 0.45 0.04 5.36 4.21 -1.95 -3.33 115.58 120.36 2p1y h ASN 396 Ca -0.00 -0.92 0.00 0.00 1.21 0.00 0.00 56.30 56.59 2p1y h ASN 396 Cb 0.39 -0.15 0.00 0.00 -1.12 0.00 0.00 38.32 37.45 2p1y h ASN 396 CO 0.02 1.33 -0.01 0.00 -1.29 0.00 0.00 177.43 177.48 2p1y n ALA 397 N -2.65 2.65 -4.17 -0.83 0.00 -1.14 -4.95 120.51 109.42 2p1y n ALA 397 Ca -0.13 -0.30 -0.35 0.00 0.00 0.00 0.00 53.44 52.67 2p1y n ALA 397 Cb 0.77 -1.37 -0.05 0.00 0.00 0.00 0.00 19.45 18.80 2p1y n ALA 397 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2p1y n TYR 398 N -0.56 -1.39 -4.10 0.00 4.01 -0.93 -5.02 117.16 109.17 2p1y n TYR 398 Ca 0.21 0.47 -0.25 0.00 -0.16 0.00 0.00 57.90 58.16 2p1y n TYR 398 Cb 0.22 -2.97 -0.05 0.00 -0.31 0.00 0.00 39.34 36.23 2p1y n TYR 398 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 2p1y s LYS 399 N -7.21 2.87 -0.22 -0.72 1.02 -0.98 -5.02 119.74 109.48 2p1y s LYS 399 Ca 0.17 -0.93 -0.04 0.00 0.02 0.00 0.00 55.97 55.19 2p1y s LYS 399 Cb -0.09 -2.61 0.11 0.00 -0.52 0.00 0.00 37.83 34.73 2p1y s LYS 399 CO 0.97 0.46 0.32 0.08 -0.92 0.00 0.00 175.35 176.27 2p1y s VAL 400 N -1.84 -0.50 -0.22 3.17 1.01 -1.26 -3.05 120.40 117.71 2p1y s VAL 400 Ca 0.31 -0.03 -0.04 0.00 0.00 0.00 0.00 61.98 62.22 2p1y s VAL 400 Cb -0.09 -0.73 -0.01 0.00 0.00 0.00 0.00 36.38 35.55 2p1y s VAL 400 CO 0.23 -0.11 -0.04 -0.63 0.00 0.00 0.00 175.10 174.55 2p1y s ILE 401 N 2.47 3.41 -0.03 2.22 -1.09 -0.86 -4.99 121.20 122.33 2p1y s ILE 401 Ca 0.09 -0.48 -0.19 0.00 -2.23 0.00 0.00 60.65 57.84 2p1y s ILE 401 Cb -0.15 -2.55 -0.05 0.00 -1.58 0.00 0.00 42.46 38.13 2p1y s ILE 401 CO -0.14 0.42 0.53 -0.36 -1.23 0.00 0.00 174.94 174.17 2p1y s PHE 402 N 1.42 3.64 1.06 3.97 0.40 -1.26 -1.39 117.98 125.83 2p1y s PHE 402 Ca 0.05 1.08 -0.12 0.00 -0.60 0.00 0.00 56.93 57.34 2p1y s PHE 402 Cb -0.14 -2.54 0.23 0.00 0.51 0.00 0.00 43.02 41.08 2p1y s PHE 402 CO -0.03 0.35 1.06 0.20 0.70 0.00 0.00 175.22 177.51 2p1y s GLY 403 N -0.12 1.57 0.15 4.36 0.00 0.34 -4.69 107.32 108.93 2p1y s GLY 403 Ca 0.28 -0.14 0.24 0.00 0.00 0.00 0.00 44.72 45.11 2p1y s GLY 403 CO 0.15 0.50 1.74 1.17 0.00 0.00 0.00 173.10 176.66 2p1y n LYS 404 N -4.52 0.15 0.00 2.90 4.81 -1.26 -4.72 118.16 115.52 2p1y n LYS 404 Ca 0.05 0.24 0.00 0.00 -0.87 0.00 0.00 58.31 57.72 2p1y n LYS 404 Cb 0.55 -1.71 0.00 0.00 0.02 0.00 0.00 35.03 33.89 2p1y n LYS 404 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2p1y n GLY 405 N 0.77 2.16 3.33 3.14 0.00 -1.26 -4.14 105.19 109.19 2p1y n GLY 405 Ca 0.05 -1.56 -0.35 0.00 0.00 0.00 0.00 46.02 44.16 2p1y n GLY 405 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2p1y s THR 406 N -0.94 3.46 -0.29 2.61 2.01 -0.08 -4.70 115.64 117.71 2p1y s THR 406 Ca 0.00 -0.47 -0.29 0.00 0.31 0.00 0.00 61.69 61.24 2p1y s THR 406 Cb 0.00 -2.57 0.01 0.00 0.01 0.00 0.00 72.50 69.95 2p1y s THR 406 CO 0.00 0.42 1.10 -2.28 -0.69 0.00 0.00 174.62 173.17 2p1y s HIS 407 N 1.41 3.12 -0.25 4.92 5.04 -0.06 -1.22 115.29 128.25 2p1y s HIS 407 Ca 0.05 1.20 -0.10 0.00 -1.54 0.00 0.00 55.06 54.67 2p1y s HIS 407 Cb -0.14 -3.63 -0.05 0.00 0.04 0.00 0.00 32.58 28.80 2p1y s HIS 407 CO -0.02 -0.86 0.15 -1.17 -2.34 0.00 0.00 174.74 170.50 2p1y s LEU 408 N 3.64 4.03 -0.20 8.88 2.96 0.37 -0.49 118.68 137.86 2p1y s LEU 408 Ca 0.47 0.06 -0.01 0.00 -0.22 0.00 0.00 54.13 54.43 2p1y s LEU 408 Cb -0.14 -2.09 0.01 0.00 0.50 0.00 0.00 46.19 44.48 2p1y s LEU 408 CO 0.14 0.04 -0.13 -2.28 -1.32 0.00 0.00 176.35 172.81 2p1y s HIS 409 N 1.21 2.89 -0.35 5.38 5.65 0.94 -2.12 115.29 128.89 2p1y s HIS 409 Ca 0.07 -1.39 -0.07 0.00 0.25 0.00 0.00 55.06 53.92 2p1y s HIS 409 Cb -0.14 -2.00 0.05 0.00 -1.18 0.00 0.00 32.58 29.30 2p1y s HIS 409 CO 0.06 -0.71 0.14 0.08 -0.65 0.00 0.00 174.74 173.66 2p1y s VAL 410 N 1.36 3.88 0.79 0.89 1.01 -1.26 -1.64 120.40 125.42 2p1y s VAL 410 Ca 0.04 -1.18 -0.12 0.00 0.00 0.00 0.00 61.98 60.72 2p1y s VAL 410 Cb -0.14 -3.24 0.07 0.00 0.00 0.00 0.00 36.38 33.07 2p1y s VAL 410 CO -0.08 -0.25 1.13 -0.76 0.00 0.00 0.00 175.10 175.14 2p1y s LEU 411 N 1.41 3.10 0.00 3.92 1.43 -0.11 -4.36 118.68 124.06 2p1y s LEU 411 Ca -0.00 2.07 0.25 0.00 -1.03 0.00 0.00 54.13 55.41 2p1y s LEU 411 Cb -0.20 -4.55 1.50 0.00 0.03 0.00 0.00 46.19 42.96 2p1y s LEU 411 CO 0.03 -2.32 1.85 -0.81 0.23 0.00 0.00 176.35 175.33