#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h3x h ARG 30 N 0.00 -0.43 -6.05 0.54 9.65 -2.14 -3.43 114.38 112.52 2h3x h ARG 30 Ca 0.00 0.03 -0.59 0.00 -1.10 0.00 0.00 59.98 58.32 2h3x h ARG 30 Cb 0.00 0.10 -0.11 0.00 -1.39 0.00 0.00 29.97 28.57 2h3x h ARG 30 CO 0.00 -0.29 -0.64 -1.21 2.80 0.00 0.00 179.97 180.63 2h3x s GLU 31 N -5.59 2.04 -0.00 0.20 2.02 -1.26 -5.15 118.70 110.96 2h3x s GLU 31 Ca -0.14 -1.73 0.00 0.00 0.02 0.00 0.00 54.97 53.12 2h3x s GLU 31 Cb 0.08 -1.92 -0.00 0.00 0.10 0.00 0.00 34.13 32.39 2h3x s GLU 31 CO 0.60 0.18 -0.01 0.08 0.02 0.00 0.00 175.26 176.13 2h3x s VAL 32 N -2.51 0.05 0.03 2.63 1.01 -1.26 -5.13 120.40 115.22 2h3x s VAL 32 Ca 0.34 -0.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.98 2h3x s VAL 32 Cb -0.01 -0.05 -0.04 0.00 0.00 0.00 0.00 36.38 36.28 2h3x s VAL 32 CO 0.19 0.01 1.08 -0.22 0.00 0.00 0.00 175.10 176.16 2h3x s LEU 33 N -0.03 4.37 0.20 3.92 2.96 -1.26 -5.03 118.68 123.82 2h3x s LEU 33 Ca 0.00 1.83 0.10 0.00 -0.22 0.00 0.00 54.13 55.83 2h3x s LEU 33 Cb -0.00 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.07 2h3x s LEU 33 CO -0.00 -0.36 -0.19 0.42 -1.32 0.00 0.00 176.35 174.90 2h3x s THR 34 N 1.03 2.05 0.00 3.68 -4.23 -1.26 -5.15 115.64 111.77 2h3x s THR 34 Ca 0.55 -2.11 0.00 0.00 -1.18 0.00 0.00 61.69 58.95 2h3x s THR 34 Cb -0.25 -2.04 0.00 0.00 1.34 0.00 0.00 72.50 71.55 2h3x s THR 34 CO 0.29 -0.36 0.00 0.61 -0.54 0.00 0.00 174.62 174.62 2h3x n GLY 35 N -0.06 5.45 2.32 3.99 0.00 -1.26 -4.89 105.19 110.75 2h3x n GLY 35 Ca -0.10 -1.74 -0.05 0.00 0.00 0.00 0.00 46.02 44.13 2h3x n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h3x n GLY 36 N 1.97 0.74 3.87 -0.02 0.00 -1.26 -5.00 105.19 105.49 2h3x n GLY 36 Ca 0.00 -0.37 -0.31 0.00 0.00 0.00 0.00 46.02 45.34 2h3x n GLY 36 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2h3x s HIS 37 N -2.02 3.56 0.34 1.61 3.76 -1.26 -5.06 115.29 116.22 2h3x s HIS 37 Ca 0.00 1.22 0.07 0.00 -0.15 0.00 0.00 55.06 56.20 2h3x s HIS 37 Cb 0.00 -2.64 -0.01 0.00 1.11 0.00 0.00 32.58 31.04 2h3x s HIS 37 CO 0.00 -0.49 0.42 -1.12 -0.85 0.00 0.00 174.74 172.70 2h3x s SER 38 N -3.82 5.74 0.14 1.40 0.01 -1.26 -4.68 113.70 111.23 2h3x s SER 38 Ca 0.54 -0.30 -0.34 0.00 1.31 0.00 0.00 55.95 57.17 2h3x s SER 38 Cb -0.11 -1.12 -0.13 0.00 0.21 0.00 0.00 66.02 64.87 2h3x s SER 38 CO 0.45 -0.42 1.64 0.52 0.41 0.00 0.00 173.24 175.84 2h3x n VAL 39 N -1.57 0.08 -0.00 3.43 0.31 0.12 -4.89 118.33 115.81 2h3x n VAL 39 Ca -0.00 -0.01 -0.11 0.00 -0.01 0.00 0.00 64.34 64.20 2h3x n VAL 39 Cb 0.59 -1.65 -0.06 0.00 -0.91 0.00 0.00 33.84 31.81 2h3x n VAL 39 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2h3x h SER 40 N 6.49 0.11 -4.07 4.52 4.64 -1.91 -3.44 113.55 119.89 2h3x h SER 40 Ca -0.45 -0.03 -0.46 0.00 -0.47 0.00 0.00 61.79 60.38 2h3x h SER 40 Cb 1.25 -0.03 0.01 0.00 -0.31 0.00 0.00 62.40 63.32 2h3x h SER 40 CO 0.91 0.10 0.37 0.00 -0.87 0.00 0.00 176.83 177.34 2h3x s ALA 41 N -6.08 2.93 0.44 5.18 0.00 -1.26 -5.03 121.76 117.93 2h3x s ALA 41 Ca -0.13 0.53 -0.23 0.00 0.00 0.00 0.00 51.96 52.13 2h3x s ALA 41 Cb 0.07 -3.22 -0.08 0.00 0.00 0.00 0.00 23.12 19.89 2h3x s ALA 41 CO 0.68 -0.18 1.13 -1.25 0.00 0.00 0.00 175.76 176.14 2h3x s PRO 42 N -3.24 3.89 0.30 0.00 0.04 -1.26 -4.93 135.00 129.79 2h3x s PRO 42 Ca 0.65 1.71 0.04 0.00 0.04 0.00 0.00 61.00 63.44 2h3x s PRO 42 Cb -0.14 -2.46 0.79 0.00 0.04 0.00 0.00 34.50 32.73 2h3x s PRO 42 CO 0.18 -0.42 1.62 1.96 0.04 0.00 0.00 177.00 180.38 2h3x h GLN 43 N 2.21 0.14 0.00 4.56 4.20 -1.95 0.11 115.11 124.37 2h3x h GLN 43 Ca -0.49 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.21 2h3x h GLN 43 Cb 1.24 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.99 2h3x h GLN 43 CO 0.61 0.09 0.06 -0.85 -0.67 0.00 0.00 178.83 178.07 2h3x n GLU 44 N -5.29 0.00 -0.00 1.46 0.28 -1.26 -1.07 120.64 114.76 2h3x n GLU 44 Ca 0.23 0.31 0.06 0.00 -0.16 0.00 0.00 57.16 57.61 2h3x n GLU 44 Cb 0.76 -1.56 -0.07 0.00 1.43 0.00 0.00 31.44 32.00 2h3x n GLU 44 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2h3x n ASN 45 N -1.29 0.76 -4.79 -1.84 4.13 0.37 -4.99 115.26 107.60 2h3x n ASN 45 Ca 0.00 -0.68 -0.38 0.00 1.68 0.00 0.00 54.58 55.20 2h3x n ASN 45 Cb 0.06 1.07 -0.06 0.00 -1.54 0.00 0.00 39.78 39.31 2h3x n ASN 45 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2h3x s ARG 46 N -2.20 4.42 0.11 3.52 0.52 -0.23 -0.42 118.95 124.68 2h3x s ARG 46 Ca 0.03 1.03 0.05 0.00 -0.52 0.00 0.00 55.73 56.32 2h3x s ARG 46 Cb 0.09 -3.07 -0.04 0.00 0.52 0.00 0.00 34.95 32.45 2h3x s ARG 46 CO 0.49 0.49 -0.11 0.96 0.02 0.00 0.00 175.30 177.14 2h3x s ILE 47 N -1.33 1.11 -0.14 1.52 -4.36 0.05 -1.23 121.20 116.82 2h3x s ILE 47 Ca 0.39 -1.74 0.02 0.00 -0.26 0.00 0.00 60.65 59.06 2h3x s ILE 47 Cb -0.20 -1.50 0.01 0.00 1.25 0.00 0.00 42.46 42.02 2h3x s ILE 47 CO 0.23 -0.55 -0.20 -0.31 0.24 0.00 0.00 174.94 174.35 2h3x s TYR 48 N -2.51 2.56 -0.30 1.37 1.51 0.27 -1.69 117.35 118.56 2h3x s TYR 48 Ca 0.09 -1.33 -0.08 0.00 -1.01 0.00 0.00 57.07 54.74 2h3x s TYR 48 Cb -0.03 -1.76 0.01 0.00 -0.11 0.00 0.00 41.96 40.07 2h3x s TYR 48 CO 0.01 -0.63 0.10 0.08 -1.11 0.00 0.00 175.55 174.00 2h3x s VAL 49 N 0.96 4.11 -0.77 0.71 1.01 -0.14 -0.78 120.40 125.51 2h3x s VAL 49 Ca -0.04 -0.66 -0.25 0.00 0.00 0.00 0.00 61.98 61.03 2h3x s VAL 49 Cb -0.15 -3.13 0.05 0.00 0.00 0.00 0.00 36.38 33.15 2h3x s VAL 49 CO -0.04 0.05 1.21 -0.32 0.00 0.00 0.00 175.10 176.00 2h3x s MET 50 N 1.52 3.24 -0.53 2.72 1.75 -0.73 -0.70 119.30 126.57 2h3x s MET 50 Ca 0.03 -0.60 -0.23 0.00 -1.25 0.00 0.00 55.69 53.64 2h3x s MET 50 Cb -0.17 -4.39 0.04 0.00 2.84 0.00 0.00 34.83 33.15 2h3x s MET 50 CO 0.03 -2.05 0.86 0.34 -0.65 0.00 0.00 175.02 173.56 2h3x s ASP 51 N 3.88 6.32 0.45 1.11 -1.08 0.22 -4.09 116.67 123.49 2h3x s ASP 51 Ca 0.33 -0.44 0.24 0.00 -0.52 0.00 0.00 52.55 52.16 2h3x s ASP 51 Cb -0.09 -2.40 1.02 0.00 -1.46 0.00 0.00 42.92 39.99 2h3x s ASP 51 CO 0.09 -1.13 1.87 0.77 0.52 0.00 0.00 175.17 177.30 2h3x h SER 52 N 9.21 0.00 -6.56 -0.34 4.64 -1.35 -0.43 113.55 118.72 2h3x h SER 52 Ca -0.26 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.55 2h3x h SER 52 Cb 1.08 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.10 2h3x h SER 52 CO 1.05 0.21 -0.90 0.52 -0.87 0.00 0.00 176.83 176.85 2h3x n VAL 53 N -3.46 -2.89 -0.24 0.95 0.31 -1.24 -4.11 118.33 107.65 2h3x n VAL 53 Ca -0.00 -0.51 0.32 0.00 -0.01 0.00 0.00 64.34 64.14 2h3x n VAL 53 Cb 0.39 -2.50 0.72 0.00 -0.91 0.00 0.00 33.84 31.54 2h3x n VAL 53 CO 0.00 0.00 0.00 2.19 -1.32 0.00 0.00 176.83 177.70 2h3x h PHE 54 N -1.84 0.00 0.00 3.52 -5.15 -1.91 0.52 116.94 112.09 2h3x h PHE 54 Ca -0.63 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 57.10 2h3x h PHE 54 Cb 1.38 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.54 2h3x h PHE 54 CO 0.49 0.00 -0.15 0.52 -2.00 0.00 0.00 178.31 177.17 2h3x h MET 55 N 0.00 0.00 -1.60 6.09 2.86 -1.99 -3.16 114.93 117.13 2h3x h MET 55 Ca 0.50 0.00 -0.43 0.00 -2.06 0.00 0.00 59.70 57.71 2h3x h MET 55 Cb 2.18 0.00 -0.35 0.00 0.06 0.00 0.00 31.60 33.49 2h3x h MET 55 CO -0.01 0.15 -1.05 0.72 1.06 0.00 0.00 176.91 177.79 2h3x n HIS 56 N -3.72 -0.44 0.28 -0.22 8.25 0.17 -4.98 115.22 114.55 2h3x n HIS 56 Ca -0.02 -3.48 0.11 0.00 -0.26 0.00 0.00 57.72 54.07 2h3x n HIS 56 Cb 0.26 -0.00 0.49 0.00 1.12 0.00 0.00 29.99 31.85 2h3x n HIS 56 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2h3x h LEU 57 N 3.01 0.00 0.00 2.41 5.85 -1.11 0.32 115.31 125.79 2h3x h LEU 57 Ca 0.06 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2h3x h LEU 57 Cb 1.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.03 2h3x h LEU 57 CO 0.43 0.00 0.00 0.35 -0.34 0.00 0.00 178.44 178.88 2h3x n THR 58 N -2.83 0.47 -2.22 1.05 -2.24 -1.26 -2.00 114.28 105.25 2h3x n THR 58 Ca 0.01 0.12 -0.19 0.00 -2.27 0.00 0.00 64.05 61.72 2h3x n THR 58 Cb 0.70 -0.75 0.03 0.00 -2.10 0.00 0.00 70.33 68.20 2h3x n THR 58 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2h3x n GLU 59 N -1.43 3.18 -1.04 -0.78 2.13 0.11 -3.45 120.64 119.36 2h3x n GLU 59 Ca 0.07 -4.04 -0.31 0.00 0.66 0.00 0.00 57.16 53.55 2h3x n GLU 59 Cb 0.22 -2.13 0.13 0.00 0.27 0.00 0.00 31.44 29.94 2h3x n GLU 59 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 2h3x s SER 60 N -3.63 3.63 0.34 4.31 1.04 -0.47 -4.85 113.70 114.06 2h3x s SER 60 Ca 0.46 1.84 -0.18 0.00 0.48 0.00 0.00 55.95 58.55 2h3x s SER 60 Cb 0.39 -2.45 0.05 0.00 0.10 0.00 0.00 66.02 64.11 2h3x s SER 60 CO 0.01 -2.60 0.81 0.00 0.98 0.00 0.00 173.24 172.44 2h3x s ARG 61 N -4.81 2.04 -0.21 4.02 3.03 -0.17 -1.88 118.95 120.98 2h3x s ARG 61 Ca 0.64 -1.28 -0.01 0.00 2.03 0.00 0.00 55.73 57.11 2h3x s ARG 61 Cb -0.19 0.59 0.01 0.00 -1.03 0.00 0.00 34.95 34.33 2h3x s ARG 61 CO 0.57 -0.95 -0.12 0.08 -1.13 0.00 0.00 175.30 173.75 2h3x s VAL 62 N -2.62 2.62 -0.15 4.99 1.01 -0.49 -0.61 120.40 125.15 2h3x s VAL 62 Ca 0.15 -0.83 -0.15 0.00 0.00 0.00 0.00 61.98 61.16 2h3x s VAL 62 Cb -0.05 -2.19 -0.05 0.00 0.00 0.00 0.00 36.38 34.10 2h3x s VAL 62 CO 0.10 0.43 0.33 -1.00 0.00 0.00 0.00 175.10 174.96 2h3x s HIS 63 N 1.35 3.47 -0.26 5.22 3.76 0.13 -1.79 115.29 127.17 2h3x s HIS 63 Ca 0.04 0.65 -0.09 0.00 -0.15 0.00 0.00 55.06 55.51 2h3x s HIS 63 Cb -0.14 -2.38 -0.04 0.00 1.11 0.00 0.00 32.58 31.13 2h3x s HIS 63 CO -0.08 0.22 0.12 0.08 -0.85 0.00 0.00 174.74 174.23 2h3x s VAL 64 N 0.51 4.81 0.31 -0.90 1.01 -0.05 -0.96 120.40 125.13 2h3x s VAL 64 Ca 0.18 -0.00 0.11 0.00 0.00 0.00 0.00 61.98 62.27 2h3x s VAL 64 Cb -0.13 -3.26 -0.06 0.00 0.00 0.00 0.00 36.38 32.93 2h3x s VAL 64 CO 0.05 0.31 -0.15 -0.31 0.00 0.00 0.00 175.10 175.00 2h3x s TYR 65 N 1.55 2.35 -0.39 5.22 1.51 -0.68 0.12 117.35 127.03 2h3x s TYR 65 Ca 0.06 -0.41 -0.13 0.00 -1.01 0.00 0.00 57.07 55.59 2h3x s TYR 65 Cb -0.15 -1.18 0.02 0.00 -0.11 0.00 0.00 41.96 40.54 2h3x s TYR 65 CO 0.06 0.65 0.24 0.34 -1.11 0.00 0.00 175.55 175.74 2h3x s ASP 66 N -3.56 5.88 0.01 2.29 -1.08 -0.50 -0.77 116.67 118.94 2h3x s ASP 66 Ca 0.31 -0.93 0.13 0.00 -0.52 0.00 0.00 52.55 51.54 2h3x s ASP 66 Cb -0.01 -2.08 0.55 0.00 -1.46 0.00 0.00 42.92 39.92 2h3x s ASP 66 CO 0.16 -0.40 1.41 0.00 0.52 0.00 0.00 175.17 176.86 2h3x n TYR 67 N 5.06 0.02 0.04 -5.34 0.18 0.44 -0.34 117.16 117.22 2h3x n TYR 67 Ca -0.12 0.01 -0.09 0.00 1.88 0.00 0.00 57.90 59.59 2h3x n TYR 67 Cb 0.47 -0.52 -0.13 0.00 -0.38 0.00 0.00 39.34 38.78 2h3x n TYR 67 CO 0.00 0.00 0.00 1.79 -2.08 0.00 0.00 176.86 176.57 2h3x h THR 68 N 0.00 1.39 0.00 -3.48 1.35 -1.94 -3.39 112.91 106.85 2h3x h THR 68 Ca 0.00 -3.14 0.00 0.00 -0.55 0.00 0.00 66.41 62.72 2h3x h THR 68 Cb 0.22 2.71 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 2h3x h THR 68 CO 0.00 0.81 0.00 -0.46 -0.25 0.00 0.00 175.52 175.62 2h3x n ASN 69 N -3.27 0.64 -1.26 5.36 0.23 -1.14 -5.01 115.26 110.81 2h3x n ASN 69 Ca -0.07 -1.17 -0.15 0.00 -0.53 0.00 0.00 54.58 52.65 2h3x n ASN 69 Cb 0.99 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.63 2h3x n ASN 69 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2h3x n GLY 70 N -0.09 1.35 3.76 4.83 0.00 0.53 -4.98 105.19 110.60 2h3x n GLY 70 Ca 0.00 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.34 2h3x n GLY 70 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2h3x s LYS 71 N -3.49 4.62 -0.09 1.61 2.20 -1.22 -4.81 119.74 118.56 2h3x s LYS 71 Ca 0.00 1.23 -0.30 0.00 -0.36 0.00 0.00 55.97 56.54 2h3x s LYS 71 Cb 0.00 -3.30 -0.03 0.00 -1.51 0.00 0.00 37.83 32.99 2h3x s LYS 71 CO 0.00 0.46 1.23 0.12 -0.36 0.00 0.00 175.35 176.79 2h3x s PHE 72 N -0.77 3.07 -0.17 4.03 5.36 -1.26 -1.42 117.98 126.82 2h3x s PHE 72 Ca 0.39 1.14 0.18 0.00 -0.96 0.00 0.00 56.93 57.67 2h3x s PHE 72 Cb -0.23 -3.45 -0.25 0.00 -0.34 0.00 0.00 43.02 38.75 2h3x s PHE 72 CO 0.27 -1.47 0.11 1.28 -1.46 0.00 0.00 175.22 173.95 2h3x n LEU 73 N 5.65 0.00 0.00 6.12 4.77 0.12 -4.97 117.00 128.69 2h3x n LEU 73 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 2h3x n LEU 73 Cb 0.46 0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.98 2h3x n LEU 73 CO 0.55 0.43 0.00 0.61 -1.33 0.00 0.00 177.39 177.65 2h3x n GLY 74 N 1.76 -1.00 3.59 -0.72 0.00 -1.15 -4.80 105.19 102.87 2h3x n GLY 74 Ca -0.29 -1.09 -0.07 0.00 0.00 0.00 0.00 46.02 44.57 2h3x n GLY 74 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2h3x s MET 75 N -1.59 1.08 -0.15 1.61 0.23 -1.26 -0.88 119.30 118.34 2h3x s MET 75 Ca 0.00 -0.49 -0.01 0.00 -1.03 0.00 0.00 55.69 54.16 2h3x s MET 75 Cb 0.00 0.44 0.04 0.00 -1.53 0.00 0.00 34.83 33.78 2h3x s MET 75 CO 0.00 -0.48 -0.02 0.08 -2.03 0.00 0.00 175.02 172.57 2h3x s VAL 76 N -3.33 0.81 0.35 5.16 1.01 -0.74 -4.97 120.40 118.70 2h3x s VAL 76 Ca 0.07 -0.45 -0.28 0.00 0.00 0.00 0.00 61.98 61.32 2h3x s VAL 76 Cb -0.01 -1.06 -0.10 0.00 0.00 0.00 0.00 36.38 35.20 2h3x s VAL 76 CO -0.05 0.08 1.32 -2.16 0.00 0.00 0.00 175.10 174.29 2h3x s PRO 77 N 1.76 4.24 -0.08 2.72 0.04 -1.26 -1.40 135.00 141.02 2h3x s PRO 77 Ca 0.01 2.24 0.21 0.00 0.04 0.00 0.00 61.00 63.49 2h3x s PRO 77 Cb -0.15 -2.98 0.43 0.00 0.04 0.00 0.00 34.50 31.83 2h3x s PRO 77 CO -0.07 -0.29 1.19 0.25 0.04 0.00 0.00 177.00 178.11 2h3x n THR 78 N 0.60 0.81 -0.71 1.26 -2.24 -0.79 -4.91 114.28 108.30 2h3x n THR 78 Ca 0.01 -1.83 0.00 0.00 -2.27 0.00 0.00 64.05 59.96 2h3x n THR 78 Cb 0.42 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 69.20 2h3x n THR 78 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h3x n ALA 79 N -0.09 0.00 -2.38 6.98 0.00 -1.24 -3.36 120.51 120.42 2h3x n ALA 79 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.12 2h3x n ALA 79 Cb 0.98 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.41 2h3x n ALA 79 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2h3x s PHE 80 N 0.00 2.63 -0.85 0.00 5.36 -1.22 -1.36 117.98 122.54 2h3x s PHE 80 Ca 0.00 0.84 -0.02 0.00 -0.96 0.00 0.00 56.93 56.79 2h3x s PHE 80 Cb 0.00 -3.88 0.00 0.00 -0.34 0.00 0.00 43.02 38.81 2h3x s PHE 80 CO 0.00 -1.86 0.62 -1.71 -1.46 0.00 0.00 175.22 170.81 2h3x n ASN 81 N 7.62 -5.18 -4.89 6.13 5.15 -0.85 -3.80 115.26 119.44 2h3x n ASN 81 Ca 0.15 -0.88 -0.29 0.00 -0.60 0.00 0.00 54.58 52.96 2h3x n ASN 81 Cb 0.46 -2.16 -0.03 0.00 -0.53 0.00 0.00 39.78 37.53 2h3x n ASN 81 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2h3x s GLY 82 N -3.03 1.82 0.20 8.20 0.00 -1.21 -4.73 107.32 108.56 2h3x s GLY 82 Ca 0.04 -0.39 0.11 0.00 0.00 0.00 0.00 44.72 44.48 2h3x s GLY 82 CO 0.88 -0.24 -0.23 0.30 0.00 0.00 0.00 173.10 173.81 2h3x s HIS 83 N -2.34 2.31 0.08 1.90 3.76 0.71 -4.94 115.29 116.77 2h3x s HIS 83 Ca 0.48 -0.35 -0.07 0.00 -0.15 0.00 0.00 55.06 54.96 2h3x s HIS 83 Cb -0.10 -1.14 -0.01 0.00 1.11 0.00 0.00 32.58 32.44 2h3x s HIS 83 CO 0.33 0.51 0.14 0.54 -0.85 0.00 0.00 174.74 175.42 2h3x s VAL 84 N -1.72 0.16 -0.07 -0.90 0.11 -1.26 -1.05 120.40 115.66 2h3x s VAL 84 Ca 0.21 -1.29 -0.30 0.00 -2.93 0.00 0.00 61.98 57.68 2h3x s VAL 84 Cb -0.08 -1.34 0.11 0.00 -1.53 0.00 0.00 36.38 33.54 2h3x s VAL 84 CO 0.10 -0.71 0.94 0.00 -3.33 0.00 0.00 175.10 172.10 2h3x s GLN 85 N -3.77 0.72 -0.13 1.54 -2.07 -0.70 -5.01 119.66 110.24 2h3x s GLN 85 Ca 0.05 -0.15 -0.04 0.00 -1.82 0.00 0.00 55.36 53.39 2h3x s GLN 85 Cb 0.05 0.33 -0.04 0.00 -1.09 0.00 0.00 33.01 32.27 2h3x s GLN 85 CO -0.10 -0.29 0.03 0.08 -1.32 0.00 0.00 175.29 173.69 2h3x s VAL 86 N -2.45 4.56 0.50 3.63 1.01 -1.26 -0.41 120.40 125.98 2h3x s VAL 86 Ca 0.03 -0.14 -0.22 0.00 0.00 0.00 0.00 61.98 61.66 2h3x s VAL 86 Cb -0.01 -2.98 -0.08 0.00 0.00 0.00 0.00 36.38 33.31 2h3x s VAL 86 CO -0.05 0.55 1.02 -1.54 0.00 0.00 0.00 175.10 175.07 2h3x n SER 87 N 2.74 1.20 0.00 3.32 3.41 0.42 -4.82 113.62 119.88 2h3x n SER 87 Ca -0.18 0.95 0.16 0.00 -0.26 0.00 0.00 58.87 59.54 2h3x n SER 87 Cb 0.53 -1.38 0.63 0.00 -0.26 0.00 0.00 64.21 63.72 2h3x n SER 87 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2h3x h ASN 88 N 1.17 0.11 0.49 4.04 2.35 -1.91 0.32 115.58 122.15 2h3x h ASN 88 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 2h3x h ASN 88 Cb 1.34 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.69 2h3x h ASN 88 CO 0.55 0.07 0.00 -0.90 -1.65 0.00 0.00 177.43 175.49 2h3x n ASP 89 N -4.43 0.00 -0.70 5.81 5.68 -1.26 -4.86 116.55 116.79 2h3x n ASP 89 Ca 0.08 -0.13 -0.09 0.00 -0.50 0.00 0.00 54.79 54.16 2h3x n ASP 89 Cb 0.48 -0.28 -0.04 0.00 -1.14 0.00 0.00 41.12 40.15 2h3x n ASP 89 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2h3x n GLY 90 N 1.00 1.05 0.00 6.12 0.00 0.11 -4.89 105.19 108.59 2h3x n GLY 90 Ca 0.13 -0.38 0.07 0.00 0.00 0.00 0.00 46.02 45.84 2h3x n GLY 90 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h3x n LYS 91 N -2.24 2.06 -4.05 1.61 5.02 -1.26 -4.89 118.16 114.40 2h3x n LYS 91 Ca -0.09 -0.01 -0.11 0.00 -2.02 0.00 0.00 58.31 56.08 2h3x n LYS 91 Cb 0.36 -1.20 -0.11 0.00 -0.02 0.00 0.00 35.03 34.07 2h3x n LYS 91 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2h3x s LYS 92 N -2.43 0.51 -0.13 1.97 -0.14 -1.26 -2.73 119.74 115.53 2h3x s LYS 92 Ca 0.04 -0.83 -0.02 0.00 -1.36 0.00 0.00 55.97 53.81 2h3x s LYS 92 Cb 0.11 -0.11 -0.02 0.00 -1.68 0.00 0.00 37.83 36.12 2h3x s LYS 92 CO 0.59 -0.00 -0.06 0.42 -0.76 0.00 0.00 175.35 175.54 2h3x s ILE 93 N -1.91 3.67 -0.14 2.17 1.01 0.23 -0.44 121.20 125.78 2h3x s ILE 93 Ca -0.08 -0.45 -0.03 0.00 0.00 0.00 0.00 60.65 60.10 2h3x s ILE 93 Cb -0.06 -2.57 -0.03 0.00 0.01 0.00 0.00 42.46 39.81 2h3x s ILE 93 CO -0.02 0.52 -0.05 -0.31 0.00 0.00 0.00 174.94 175.09 2h3x s TYR 94 N 0.14 3.01 0.18 3.97 4.12 0.45 -0.02 117.35 129.20 2h3x s TYR 94 Ca -0.03 -0.27 0.08 0.00 0.02 0.00 0.00 57.07 56.87 2h3x s TYR 94 Cb -0.14 -1.92 -0.04 0.00 -1.52 0.00 0.00 41.96 38.34 2h3x s TYR 94 CO 0.03 0.01 -0.15 0.95 0.02 0.00 0.00 175.55 176.41 2h3x s THR 95 N 0.20 1.68 -0.03 -0.71 -4.23 -0.34 -1.72 115.64 110.49 2h3x s THR 95 Ca -0.03 -2.03 0.00 0.00 -1.18 0.00 0.00 61.69 58.46 2h3x s THR 95 Cb -0.14 -1.89 0.03 0.00 1.34 0.00 0.00 72.50 71.84 2h3x s THR 95 CO 0.03 -0.48 -0.00 -0.32 -0.54 0.00 0.00 174.62 173.31 2h3x s MET 96 N -3.21 0.36 0.23 3.99 0.00 -0.22 -0.49 119.30 119.96 2h3x s MET 96 Ca 0.18 0.07 -0.07 0.00 0.00 0.00 0.00 55.69 55.87 2h3x s MET 96 Cb -0.03 -0.55 0.03 0.00 0.00 0.00 0.00 34.83 34.28 2h3x s MET 96 CO 0.06 -0.14 0.42 -2.37 0.00 0.00 0.00 175.02 172.99 2h3x n THR 97 N 4.22 0.00 -4.57 10.11 5.66 -0.81 -0.21 114.28 128.69 2h3x n THR 97 Ca -0.25 -0.72 -0.22 0.00 -3.05 0.00 0.00 64.05 59.82 2h3x n THR 97 Cb 0.50 0.61 -0.15 0.00 -1.55 0.00 0.00 70.33 69.74 2h3x n THR 97 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2h3x s THR 98 N -2.52 1.01 0.25 1.09 2.01 -1.25 -1.75 115.64 114.48 2h3x s THR 98 Ca 0.12 -0.52 0.08 0.00 0.31 0.00 0.00 61.69 61.67 2h3x s THR 98 Cb -0.02 -0.86 -0.05 0.00 0.01 0.00 0.00 72.50 71.57 2h3x s THR 98 CO 0.08 0.29 -0.11 -0.31 -0.69 0.00 0.00 174.62 173.89 2h3x s TYR 99 N -0.12 1.88 -0.07 4.92 1.51 -0.12 -3.79 117.35 121.57 2h3x s TYR 99 Ca 0.02 -0.61 -0.05 0.00 -1.01 0.00 0.00 57.07 55.42 2h3x s TYR 99 Cb -0.07 -0.96 0.02 0.00 -0.11 0.00 0.00 41.96 40.84 2h3x s TYR 99 CO 0.00 0.36 0.17 -1.01 -1.11 0.00 0.00 175.55 173.96 2h3x s HIS 100 N -2.94 -0.20 0.55 2.71 3.76 -1.26 -0.27 115.29 117.64 2h3x s HIS 100 Ca 0.26 0.50 0.41 0.00 -0.15 0.00 0.00 55.06 56.08 2h3x s HIS 100 Cb 0.01 0.03 1.60 0.00 1.11 0.00 0.00 32.58 35.33 2h3x s HIS 100 CO 0.10 -0.12 1.73 0.93 -0.85 0.00 0.00 174.74 176.52 2h3x h GLU 101 N 6.31 0.00 0.00 1.40 5.08 -1.41 0.52 114.58 126.48 2h3x h GLU 101 Ca -0.31 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 57.97 2h3x h GLU 101 Cb 1.18 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 30.24 2h3x h GLU 101 CO 0.40 0.00 -0.71 0.54 -1.00 0.00 0.00 179.01 178.24 2h3x n ARG 102 N -4.08 0.45 0.00 2.33 5.12 -0.56 -5.01 116.66 114.91 2h3x n ARG 102 Ca 0.31 -2.11 0.00 0.00 -1.93 0.00 0.00 57.85 54.13 2h3x n ARG 102 Cb 1.49 -0.58 0.00 0.00 -1.16 0.00 0.00 32.46 32.20 2h3x n ARG 102 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 2h3x n ILE 103 N -0.13 0.00 0.30 0.55 5.41 0.17 -3.54 119.36 122.12 2h3x n ILE 103 Ca 0.08 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.95 2h3x n ILE 103 Cb 0.91 0.00 0.25 0.00 -0.71 0.00 0.00 39.64 40.09 2h3x n ILE 103 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2h3x n THR 104 N 0.00 0.57 -3.73 1.39 -2.24 -1.26 -4.58 114.28 104.43 2h3x n THR 104 Ca 0.00 -0.74 -0.06 0.00 -2.27 0.00 0.00 64.05 60.97 2h3x n THR 104 Cb 0.00 0.79 -0.02 0.00 -2.10 0.00 0.00 70.33 69.00 2h3x n THR 104 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h3x s ARG 105 N -1.43 1.39 0.00 -0.78 1.70 -1.23 -5.16 118.95 113.44 2h3x s ARG 105 Ca 0.40 -0.73 0.00 0.00 -0.47 0.00 0.00 55.73 54.93 2h3x s ARG 105 Cb 0.22 0.50 0.00 0.00 -0.57 0.00 0.00 34.95 35.11 2h3x s ARG 105 CO 0.31 -0.63 0.00 0.41 -1.08 0.00 0.00 175.30 174.31 2h3x n GLY 106 N -0.43 -0.10 3.70 3.88 0.00 -1.26 -1.49 105.19 109.48 2h3x n GLY 106 Ca -0.07 -1.85 -0.43 0.00 0.00 0.00 0.00 46.02 43.67 2h3x n GLY 106 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h3x n LYS 107 N -0.10 2.26 -3.39 1.61 5.02 -1.26 -4.50 118.16 117.80 2h3x n LYS 107 Ca 0.00 0.80 -0.38 0.00 -2.02 0.00 0.00 58.31 56.71 2h3x n LYS 107 Cb 0.00 -2.46 -0.06 0.00 -0.02 0.00 0.00 35.03 32.49 2h3x n LYS 107 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2h3x s ARG 108 N -1.07 4.11 -0.27 1.97 3.52 -1.26 -1.58 118.95 124.38 2h3x s ARG 108 Ca 0.62 0.50 -0.01 0.00 -0.13 0.00 0.00 55.73 56.71 2h3x s ARG 108 Cb -0.58 -3.29 0.08 0.00 -1.56 0.00 0.00 34.95 29.61 2h3x s ARG 108 CO 0.55 0.52 0.06 -1.12 -0.81 0.00 0.00 175.30 174.49 2h3x s SER 109 N -0.58 3.71 0.01 -2.12 0.01 0.63 -4.95 113.70 110.40 2h3x s SER 109 Ca 0.26 -1.35 -0.19 0.00 1.31 0.00 0.00 55.95 55.98 2h3x s SER 109 Cb -0.17 -0.86 -0.06 0.00 0.21 0.00 0.00 66.02 65.15 2h3x s SER 109 CO 0.14 -0.36 0.54 -1.81 0.41 0.00 0.00 173.24 172.16 2h3x s ASP 110 N 1.63 6.94 0.25 2.44 1.11 -1.26 -0.94 116.67 126.84 2h3x s ASP 110 Ca 0.04 1.12 -0.13 0.00 0.18 0.00 0.00 52.55 53.76 2h3x s ASP 110 Cb -0.17 -2.33 -0.00 0.00 1.07 0.00 0.00 42.92 41.48 2h3x s ASP 110 CO -0.17 0.18 0.49 0.68 1.18 0.00 0.00 175.17 177.53 2h3x s VAL 111 N -0.52 0.00 -0.09 -1.27 -7.23 -0.72 -1.42 120.40 109.15 2h3x s VAL 111 Ca 0.29 -1.37 0.03 0.00 -1.81 0.00 0.00 61.98 59.12 2h3x s VAL 111 Cb -0.18 -2.17 0.01 0.00 0.56 0.00 0.00 36.38 34.60 2h3x s VAL 111 CO 0.16 -0.01 -0.19 -0.69 -0.31 0.00 0.00 175.10 174.06 2h3x s VAL 112 N -4.01 1.71 0.04 1.32 1.01 -0.74 -1.92 120.40 117.80 2h3x s VAL 112 Ca 0.21 -0.81 0.08 0.00 0.00 0.00 0.00 61.98 61.46 2h3x s VAL 112 Cb -0.01 -1.50 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 2h3x s VAL 112 CO 0.08 0.48 -0.21 -1.61 0.00 0.00 0.00 175.10 173.85 2h3x s GLU 113 N 0.53 2.00 -0.28 2.72 2.02 0.36 0.12 118.70 126.17 2h3x s GLU 113 Ca -0.16 -1.01 -0.07 0.00 0.02 0.00 0.00 54.97 53.76 2h3x s GLU 113 Cb -0.17 -2.12 0.00 0.00 0.10 0.00 0.00 34.13 31.94 2h3x s GLU 113 CO 0.06 0.54 0.07 0.08 0.02 0.00 0.00 175.26 176.02 2h3x s VAL 114 N -0.86 3.97 -0.05 2.63 1.01 0.56 -1.20 120.40 126.46 2h3x s VAL 114 Ca 0.13 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.55 2h3x s VAL 114 Cb -0.10 -2.99 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 2h3x s VAL 114 CO 0.04 0.16 -0.08 0.26 0.00 0.00 0.00 175.10 175.48 2h3x s TRP 115 N 1.52 2.89 0.01 5.22 0.52 0.97 -0.77 118.94 129.30 2h3x s TRP 115 Ca 0.04 -0.02 -0.30 0.00 0.02 0.00 0.00 56.10 55.84 2h3x s TRP 115 Cb -0.17 -1.67 -0.05 0.00 -1.15 0.00 0.00 33.47 30.44 2h3x s TRP 115 CO 0.02 0.33 1.19 0.34 0.02 0.00 0.00 176.95 178.85 2h3x s ASP 116 N -0.98 7.08 0.34 2.95 -1.08 -0.60 0.77 116.67 125.16 2h3x s ASP 116 Ca 0.14 1.92 0.04 0.00 -0.52 0.00 0.00 52.55 54.12 2h3x s ASP 116 Cb -0.11 -2.57 0.61 0.00 -1.46 0.00 0.00 42.92 39.39 2h3x s ASP 116 CO 0.03 -0.50 1.91 0.00 0.52 0.00 0.00 175.17 177.12 2h3x h ALA 117 N 7.07 1.41 0.07 3.66 0.00 -1.82 0.14 119.26 129.79 2h3x h ALA 117 Ca -0.39 -0.16 -0.31 0.00 0.00 0.00 0.00 54.91 54.06 2h3x h ALA 117 Cb 1.19 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2h3x h ALA 117 CO 0.83 0.43 -1.64 -0.44 0.00 0.00 0.00 179.25 178.43 2h3x h ASP 118 N 0.59 0.23 0.27 0.00 3.32 -1.92 -3.36 116.42 115.55 2h3x h ASP 118 Ca 0.14 -0.39 0.00 0.00 0.02 0.00 0.00 57.03 56.79 2h3x h ASP 118 Cb 0.23 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.70 2h3x h ASP 118 CO -0.00 1.34 -1.00 0.29 -1.72 0.00 0.00 179.24 178.15 2h3x n LYS 119 N -3.31 0.18 -3.88 3.56 4.76 -1.24 0.10 118.16 118.34 2h3x n LYS 119 Ca -0.18 -0.02 -0.26 0.00 -2.87 0.00 0.00 58.31 54.98 2h3x n LYS 119 Cb 1.04 -1.54 0.01 0.00 -1.84 0.00 0.00 35.03 32.70 2h3x n LYS 119 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2h3x n LEU 120 N -1.76 -2.60 -4.40 -0.35 4.77 0.50 -4.92 117.00 108.24 2h3x n LEU 120 Ca 0.03 -0.87 -0.30 0.00 -0.03 0.00 0.00 56.01 54.84 2h3x n LEU 120 Cb 0.40 -2.47 -0.14 0.00 -2.33 0.00 0.00 43.42 38.88 2h3x n LEU 120 CO 0.41 0.42 -0.53 0.42 -1.33 0.00 0.00 177.39 176.77 2h3x s THR 121 N -3.59 2.45 0.24 -5.08 -4.23 -1.22 -4.91 115.64 99.30 2h3x s THR 121 Ca 0.28 -1.34 -0.30 0.00 -1.18 0.00 0.00 61.69 59.15 2h3x s THR 121 Cb -0.14 -2.01 -0.10 0.00 1.34 0.00 0.00 72.50 71.59 2h3x s THR 121 CO 0.85 0.32 1.40 0.12 -0.54 0.00 0.00 174.62 176.77 2h3x s PHE 122 N -0.89 3.08 0.00 3.99 5.36 -1.26 -1.55 117.98 126.71 2h3x s PHE 122 Ca 0.13 1.09 0.00 0.00 -0.96 0.00 0.00 56.93 57.19 2h3x s PHE 122 Cb -0.10 -3.76 0.00 0.00 -0.34 0.00 0.00 43.02 38.82 2h3x s PHE 122 CO 0.04 -2.44 0.00 0.39 -1.46 0.00 0.00 175.22 171.75 2h3x n GLU 123 N 2.39 0.00 -3.84 10.12 1.02 0.05 -4.91 120.64 125.46 2h3x n GLU 123 Ca 0.06 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.09 2h3x n GLU 123 Cb 0.41 -0.57 -0.10 0.00 -0.02 0.00 0.00 31.44 31.17 2h3x n GLU 123 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2h3x s LYS 124 N -1.99 0.53 -0.04 3.49 2.20 -1.04 -4.97 119.74 117.91 2h3x s LYS 124 Ca 0.00 -0.34 0.06 0.00 -0.36 0.00 0.00 55.97 55.33 2h3x s LYS 124 Cb 0.00 0.22 -0.01 0.00 -1.51 0.00 0.00 37.83 36.53 2h3x s LYS 124 CO 0.00 -0.13 -0.24 -2.00 -0.36 0.00 0.00 175.35 172.62 2h3x s GLU 125 N -1.35 2.26 -0.19 4.03 2.12 -1.26 -0.33 118.70 123.99 2h3x s GLU 125 Ca -0.14 -0.85 0.01 0.00 0.36 0.00 0.00 54.97 54.34 2h3x s GLU 125 Cb -0.07 -2.00 0.03 0.00 0.26 0.00 0.00 34.13 32.36 2h3x s GLU 125 CO 0.02 0.41 -0.13 0.42 -0.54 0.00 0.00 175.26 175.44 2h3x s ILE 126 N -0.27 1.73 0.31 -3.70 1.01 0.12 -4.97 121.20 115.44 2h3x s ILE 126 Ca 0.00 -0.93 -0.30 0.00 0.00 0.00 0.00 60.65 59.43 2h3x s ILE 126 Cb -0.12 -1.71 -0.11 0.00 0.01 0.00 0.00 42.46 40.53 2h3x s ILE 126 CO 0.02 0.30 1.59 -0.44 0.00 0.00 0.00 174.94 176.41 2h3x s SER 127 N 1.38 6.34 0.08 3.58 0.01 -1.26 -1.79 113.70 122.04 2h3x s SER 127 Ca 0.01 2.99 0.07 0.00 1.31 0.00 0.00 55.95 60.33 2h3x s SER 127 Cb -0.15 -2.64 -0.03 0.00 0.21 0.00 0.00 66.02 63.41 2h3x s SER 127 CO -0.10 -0.92 -0.18 -0.76 0.41 0.00 0.00 173.24 171.69 2h3x s LEU 128 N -0.82 2.28 0.42 2.44 1.43 -0.51 -4.41 118.68 119.51 2h3x s LEU 128 Ca 0.62 -0.63 -0.26 0.00 -1.03 0.00 0.00 54.13 52.82 2h3x s LEU 128 Cb -0.48 -0.71 -0.09 0.00 0.03 0.00 0.00 46.19 44.94 2h3x s LEU 128 CO 0.51 0.00 1.38 -2.16 0.23 0.00 0.00 176.35 176.32 2h3x s PRO 129 N -1.75 3.89 -0.11 1.29 0.04 -1.26 -4.23 135.00 132.88 2h3x s PRO 129 Ca 0.03 2.32 -0.01 0.00 0.04 0.00 0.00 61.00 63.38 2h3x s PRO 129 Cb -0.10 -2.76 -0.02 0.00 0.04 0.00 0.00 34.50 31.66 2h3x s PRO 129 CO 0.03 -0.61 1.06 -0.35 0.04 0.00 0.00 177.00 177.17 2h3x n PRO 130 N 0.08 0.32 -0.59 0.56 -0.04 -1.26 -3.59 135.00 130.48 2h3x n PRO 130 Ca 0.04 -0.46 -0.00 0.00 -0.04 0.00 0.00 63.50 63.04 2h3x n PRO 130 Cb 0.42 -1.88 -0.00 0.00 -0.04 0.00 0.00 33.50 32.00 2h3x n PRO 130 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2h3x n LYS 131 N 4.10 0.00 -2.02 0.54 2.85 -1.26 -5.01 118.16 117.36 2h3x n LYS 131 Ca 0.07 -0.56 -0.39 0.00 -1.05 0.00 0.00 58.31 56.38 2h3x n LYS 131 Cb 0.05 -0.15 0.01 0.00 -0.65 0.00 0.00 35.03 34.29 2h3x n LYS 131 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 177.40 176.37 2h3x s ARG 132 N 0.00 3.72 0.19 -1.58 1.04 -1.24 -1.01 118.95 120.08 2h3x s ARG 132 Ca 0.02 2.11 -0.33 0.00 -1.04 0.00 0.00 55.73 56.49 2h3x s ARG 132 Cb 0.02 -2.56 -0.13 0.00 -2.04 0.00 0.00 34.95 30.24 2h3x s ARG 132 CO -0.01 -0.68 1.61 1.55 -0.04 0.00 0.00 175.30 177.73 2h3x n VAL 133 N -0.28 0.18 -3.90 4.99 3.14 0.12 -4.66 118.33 117.91 2h3x n VAL 133 Ca 0.06 -0.04 -0.35 0.00 -2.96 0.00 0.00 64.34 61.04 2h3x n VAL 133 Cb 0.45 -1.71 -0.14 0.00 -1.06 0.00 0.00 33.84 31.38 2h3x n VAL 133 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 2h3x s GLN 134 N 0.75 2.60 0.00 1.45 -0.21 -1.26 -5.04 119.66 117.96 2h3x s GLN 134 Ca 0.75 -1.15 0.00 0.00 0.02 0.00 0.00 55.36 54.98 2h3x s GLN 134 Cb -0.60 -3.16 0.00 0.00 1.00 0.00 0.00 33.01 30.25 2h3x s GLN 134 CO 0.38 -0.55 0.00 0.41 -2.12 0.00 0.00 175.29 173.41 2h3x n GLY 135 N 4.67 -1.41 3.46 3.09 0.00 -1.26 -5.15 105.19 108.59 2h3x n GLY 135 Ca -0.14 -1.00 -0.33 0.00 0.00 0.00 0.00 46.02 44.54 2h3x n GLY 135 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2h3x n LEU 136 N 0.00 0.48 -3.70 0.99 4.77 -1.26 -4.87 117.00 113.40 2h3x n LEU 136 Ca 0.00 0.38 -0.42 0.00 -0.03 0.00 0.00 56.01 55.95 2h3x n LEU 136 Cb 0.00 -1.25 -0.00 0.00 -2.33 0.00 0.00 43.42 39.84 2h3x n LEU 136 CO 0.00 -3.34 2.36 0.59 -1.33 0.00 0.00 177.39 175.68 2h3x n ASN 137 N -1.57 5.71 -4.75 -1.43 3.02 -1.26 -4.98 115.26 110.00 2h3x n ASN 137 Ca 0.08 -3.00 -0.40 0.00 -0.03 0.00 0.00 54.58 51.23 2h3x n ASN 137 Cb 0.53 -1.51 -0.05 0.00 -0.61 0.00 0.00 39.78 38.14 2h3x n ASN 137 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2h3x s TYR 138 N 0.95 3.81 0.22 3.10 1.51 -1.26 -4.56 117.35 121.12 2h3x s TYR 138 Ca 0.47 1.81 -0.09 0.00 -1.01 0.00 0.00 57.07 58.25 2h3x s TYR 138 Cb 0.13 -3.11 0.33 0.00 -0.11 0.00 0.00 41.96 39.20 2h3x s TYR 138 CO -0.04 0.01 1.69 -0.44 -1.11 0.00 0.00 175.55 175.66 2h3x h ASP 139 N 4.21 -0.04 0.00 2.29 3.32 -1.93 -2.39 116.42 121.87 2h3x h ASP 139 Ca -0.45 0.13 0.00 0.00 0.02 0.00 0.00 57.03 56.72 2h3x h ASP 139 Cb 1.21 0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.94 2h3x h ASP 139 CO 0.68 -0.02 0.06 0.61 -1.72 0.00 0.00 179.24 178.85 2h3x n GLY 140 N -1.33 -0.25 0.04 2.75 0.00 -1.26 -2.02 105.19 103.12 2h3x n GLY 140 Ca 0.10 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.24 2h3x n GLY 140 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2h3x n LEU 141 N -1.22 0.63 -3.36 0.99 4.77 -0.90 0.12 117.00 118.03 2h3x n LEU 141 Ca 0.00 0.04 -0.17 0.00 -0.03 0.00 0.00 56.01 55.85 2h3x n LEU 141 Cb 0.06 -0.11 -0.08 0.00 -2.33 0.00 0.00 43.42 40.96 2h3x n LEU 141 CO 0.00 0.02 -0.15 0.12 -1.33 0.00 0.00 177.39 176.04 2h3x s PHE 142 N -3.20 -0.31 0.02 -1.77 5.36 -0.86 -2.04 117.98 115.19 2h3x s PHE 142 Ca 0.04 -0.79 0.00 0.00 -0.96 0.00 0.00 56.93 55.22 2h3x s PHE 142 Cb 0.14 -0.41 -0.00 0.00 -0.34 0.00 0.00 43.02 42.41 2h3x s PHE 142 CO 0.78 -0.97 0.00 0.54 -1.46 0.00 0.00 175.22 174.12 2h3x n ARG 143 N 4.29 1.49 -3.81 10.12 5.12 -0.49 -4.83 116.66 128.54 2h3x n ARG 143 Ca 0.11 -0.16 -0.11 0.00 -1.93 0.00 0.00 57.85 55.75 2h3x n ARG 143 Cb 0.45 0.06 -0.08 0.00 -1.16 0.00 0.00 32.46 31.74 2h3x n ARG 143 CO 0.00 0.00 0.00 1.14 -1.93 0.00 0.00 177.63 176.84 2h3x s GLN 144 N -2.08 0.76 0.85 5.56 -2.07 -1.26 -0.95 119.66 120.47 2h3x s GLN 144 Ca 0.00 -0.63 -0.11 0.00 -1.82 0.00 0.00 55.36 52.81 2h3x s GLN 144 Cb 0.00 0.32 0.11 0.00 -1.09 0.00 0.00 33.01 32.34 2h3x s GLN 144 CO 0.00 -0.23 1.10 0.95 -1.32 0.00 0.00 175.29 175.79 2h3x s THR 145 N -2.75 2.81 0.41 3.63 -4.23 -0.11 -4.85 115.64 110.55 2h3x s THR 145 Ca -0.04 0.26 0.10 0.00 -1.18 0.00 0.00 61.69 60.83 2h3x s THR 145 Cb -0.00 -2.62 0.29 0.00 1.34 0.00 0.00 72.50 71.51 2h3x s THR 145 CO -0.05 -0.35 2.01 0.74 -0.54 0.00 0.00 174.62 176.44 2h3x h THR 146 N -1.48 1.01 -0.00 3.99 2.02 -1.73 -0.60 112.91 116.12 2h3x h THR 146 Ca -0.46 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.54 2h3x h THR 146 Cb 1.26 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 2h3x h THR 146 CO 0.50 0.10 0.00 -0.90 0.37 0.00 0.00 175.52 175.58 2h3x n ASP 147 N -4.47 0.01 -0.50 4.18 5.68 -0.64 -4.86 116.55 115.94 2h3x n ASP 147 Ca 0.07 -1.21 -0.07 0.00 -0.50 0.00 0.00 54.79 53.09 2h3x n ASP 147 Cb 0.21 -0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.16 2h3x n ASP 147 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2h3x n GLY 148 N 0.90 0.65 0.11 6.12 0.00 -0.23 -4.84 105.19 107.91 2h3x n GLY 148 Ca 0.19 -0.02 -0.16 0.00 0.00 0.00 0.00 46.02 46.02 2h3x n GLY 148 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2h3x h LYS 149 N 0.04 0.26 -5.86 1.61 1.79 -1.89 -3.47 116.57 109.05 2h3x h LYS 149 Ca -0.13 -0.44 -0.53 0.00 -2.18 0.00 0.00 60.65 57.36 2h3x h LYS 149 Cb 1.05 0.17 -0.24 0.00 -1.58 0.00 0.00 32.23 31.62 2h3x h LYS 149 CO 0.20 1.16 -0.82 -0.06 -1.08 0.00 0.00 179.45 178.85 2h3x s PHE 150 N -2.64 1.62 -0.20 -1.35 0.40 -1.26 -2.83 117.98 111.73 2h3x s PHE 150 Ca -0.06 -0.38 -0.14 0.00 -0.60 0.00 0.00 56.93 55.74 2h3x s PHE 150 Cb 0.07 -0.94 -0.04 0.00 0.51 0.00 0.00 43.02 42.61 2h3x s PHE 150 CO 0.87 0.10 0.32 0.42 0.70 0.00 0.00 175.22 177.63 2h3x s ILE 151 N -0.91 5.26 -0.23 0.64 1.01 0.13 -0.94 121.20 126.16 2h3x s ILE 151 Ca 0.05 0.55 -0.05 0.00 0.00 0.00 0.00 60.65 61.20 2h3x s ILE 151 Cb -0.09 -3.65 -0.01 0.00 0.01 0.00 0.00 42.46 38.72 2h3x s ILE 151 CO 0.02 0.31 -0.01 -0.69 0.00 0.00 0.00 174.94 174.57 2h3x s VAL 152 N 1.02 3.61 0.20 2.92 1.01 -0.13 -1.36 120.40 127.67 2h3x s VAL 152 Ca 0.16 -0.44 0.08 0.00 0.00 0.00 0.00 61.98 61.77 2h3x s VAL 152 Cb -0.14 -2.67 -0.05 0.00 0.00 0.00 0.00 36.38 33.52 2h3x s VAL 152 CO 0.06 0.38 -0.15 -1.48 0.00 0.00 0.00 175.10 173.91 2h3x s LEU 153 N 1.51 2.54 -0.11 3.92 0.05 -0.72 -1.39 118.68 124.47 2h3x s LEU 153 Ca 0.06 -0.99 -0.12 0.00 0.05 0.00 0.00 54.13 53.12 2h3x s LEU 153 Cb -0.15 -0.69 -0.05 0.00 -2.05 0.00 0.00 46.19 43.25 2h3x s LEU 153 CO -0.01 -0.15 0.29 -1.58 -0.55 0.00 0.00 176.35 174.34 2h3x s GLN 154 N -3.49 3.99 0.26 1.48 2.00 -0.87 -1.06 119.66 121.97 2h3x s GLN 154 Ca 0.21 0.12 0.10 0.00 -2.00 0.00 0.00 55.36 53.79 2h3x s GLN 154 Cb -0.02 -3.32 -0.05 0.00 0.80 0.00 0.00 33.01 30.43 2h3x s GLN 154 CO 0.07 0.48 -0.08 -0.80 -0.50 0.00 0.00 175.29 174.45 2h3x s ASN 155 N -0.26 4.19 -0.30 6.67 0.01 0.95 -0.71 114.94 125.50 2h3x s ASN 155 Ca 0.18 -0.77 -0.07 0.00 -0.71 0.00 0.00 52.86 51.49 2h3x s ASN 155 Cb -0.14 -0.65 0.15 0.00 0.41 0.00 0.00 41.25 41.02 2h3x s ASN 155 CO 0.06 0.02 0.63 0.00 -1.51 0.00 0.00 177.10 176.30 2h3x s ALA 156 N -2.32 -2.10 -0.11 0.60 0.00 -0.18 -3.00 121.76 114.66 2h3x s ALA 156 Ca 0.30 2.16 0.01 0.00 0.00 0.00 0.00 51.96 54.43 2h3x s ALA 156 Cb -0.06 -1.90 0.03 0.00 0.00 0.00 0.00 23.12 21.18 2h3x s ALA 156 CO 0.18 -1.06 0.93 -1.13 0.00 0.00 0.00 175.76 174.67 2h3x n SER 157 N 5.44 1.89 0.00 0.00 3.41 -1.26 -4.70 113.62 118.41 2h3x n SER 157 Ca -0.08 -1.81 0.15 0.00 -0.26 0.00 0.00 58.87 56.87 2h3x n SER 157 Cb 0.50 -0.02 0.83 0.00 -0.26 0.00 0.00 64.21 65.26 2h3x n SER 157 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2h3x n PRO 158 N -0.30 0.76 -1.78 4.33 -0.04 -1.26 -5.09 135.00 131.62 2h3x n PRO 158 Ca 0.01 0.01 -0.41 0.00 -0.04 0.00 0.00 63.50 63.06 2h3x n PRO 158 Cb 0.22 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.17 2h3x n PRO 158 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2h3x s ALA 159 N -2.18 3.73 0.19 0.55 0.00 -1.26 -4.94 121.76 117.85 2h3x s ALA 159 Ca 0.39 1.57 -0.07 0.00 0.00 0.00 0.00 51.96 53.84 2h3x s ALA 159 Cb 0.20 -3.64 -0.06 0.00 0.00 0.00 0.00 23.12 19.61 2h3x s ALA 159 CO 0.37 -0.98 0.47 0.95 0.00 0.00 0.00 175.76 176.56 2h3x s THR 160 N -0.08 5.04 0.04 0.00 -4.23 -1.26 -3.97 115.64 111.18 2h3x s THR 160 Ca 0.62 0.27 -0.27 0.00 -1.18 0.00 0.00 61.69 61.13 2h3x s THR 160 Cb -0.48 -3.62 0.09 0.00 1.34 0.00 0.00 72.50 69.84 2h3x s THR 160 CO 0.49 -0.02 0.80 -0.94 -0.54 0.00 0.00 174.62 174.41 2h3x s SER 161 N -2.39 -0.43 -0.20 3.99 1.04 -1.16 -3.27 113.70 111.27 2h3x s SER 161 Ca 0.44 0.02 -0.03 0.00 0.48 0.00 0.00 55.95 56.86 2h3x s SER 161 Cb -0.12 0.45 -0.01 0.00 0.10 0.00 0.00 66.02 66.44 2h3x s SER 161 CO 0.23 -0.72 -0.05 -0.63 0.98 0.00 0.00 173.24 173.04 2h3x s ILE 162 N -3.23 3.41 0.15 -1.02 1.01 -0.93 -0.03 121.20 120.56 2h3x s ILE 162 Ca 0.03 -0.49 -0.07 0.00 0.00 0.00 0.00 60.65 60.13 2h3x s ILE 162 Cb -0.01 -2.53 -0.06 0.00 0.01 0.00 0.00 42.46 39.87 2h3x s ILE 162 CO -0.10 0.44 0.42 -0.83 0.00 0.00 0.00 174.94 174.88 2h3x s GLY 163 N 1.22 2.27 -0.09 6.18 0.00 -0.23 0.02 107.32 116.69 2h3x s GLY 163 Ca 0.03 -0.46 0.04 0.00 0.00 0.00 0.00 44.72 44.32 2h3x s GLY 163 CO -0.01 -0.34 -0.20 -0.42 0.00 0.00 0.00 173.10 172.12 2h3x s ILE 164 N -1.65 2.45 -0.10 0.90 -1.09 0.22 -1.76 121.20 120.17 2h3x s ILE 164 Ca 0.41 -0.90 0.03 0.00 -2.23 0.00 0.00 60.65 57.95 2h3x s ILE 164 Cb -0.12 -1.95 0.01 0.00 -1.58 0.00 0.00 42.46 38.82 2h3x s ILE 164 CO 0.23 0.56 -0.18 -0.69 -1.23 0.00 0.00 174.94 173.63 2h3x s VAL 165 N 0.01 1.63 -0.56 2.92 1.01 -0.46 -0.66 120.40 124.29 2h3x s VAL 165 Ca -0.07 -0.75 -0.23 0.00 0.00 0.00 0.00 61.98 60.93 2h3x s VAL 165 Cb -0.15 -1.46 0.05 0.00 0.00 0.00 0.00 36.38 34.82 2h3x s VAL 165 CO 0.05 0.47 0.90 -0.62 0.00 0.00 0.00 175.10 175.90 2h3x s ASP 166 N 0.71 6.31 0.16 3.32 -1.08 0.79 -0.69 116.67 126.18 2h3x s ASP 166 Ca -0.12 -0.49 -0.19 0.00 -0.52 0.00 0.00 52.55 51.23 2h3x s ASP 166 Cb -0.16 -2.42 0.06 0.00 -1.46 0.00 0.00 42.92 38.95 2h3x s ASP 166 CO 0.03 -1.21 1.66 0.58 0.52 0.00 0.00 175.17 176.75 2h3x h VAL 167 N 5.99 0.57 0.50 1.11 2.07 -1.81 0.49 116.25 125.18 2h3x h VAL 167 Ca -0.27 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.24 2h3x h VAL 167 Cb 1.08 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 2h3x h VAL 167 CO 1.08 0.00 -0.36 0.00 0.02 0.00 0.00 177.57 178.31 2h3x h ALA 168 N 1.22 -0.86 0.00 1.67 0.00 -1.92 -1.85 119.26 117.53 2h3x h ALA 168 Ca 0.17 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2h3x h ALA 168 Cb 0.32 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2h3x h ALA 168 CO -0.38 -1.01 0.00 0.87 0.00 0.00 0.00 179.25 178.74 2h3x h LYS 169 N -0.84 0.00 -5.55 0.00 1.57 -1.91 -3.46 116.57 106.38 2h3x h LYS 169 Ca -0.05 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.39 2h3x h LYS 169 Cb 0.71 0.00 0.16 0.00 0.08 0.00 0.00 32.23 33.17 2h3x h LYS 169 CO 0.02 0.00 -0.72 0.41 -0.57 0.00 0.00 179.45 178.60 2h3x n GLY 170 N -0.22 -0.37 3.14 3.86 0.00 0.17 -5.01 105.19 106.75 2h3x n GLY 170 Ca 0.01 0.12 -0.09 0.00 0.00 0.00 0.00 46.02 46.06 2h3x n GLY 170 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2h3x s ASP 171 N -4.03 0.72 -0.56 1.61 1.11 -0.94 -4.79 116.67 109.79 2h3x s ASP 171 Ca 0.16 -1.05 -0.18 0.00 0.18 0.00 0.00 52.55 51.66 2h3x s ASP 171 Cb -0.07 0.18 0.11 0.00 1.07 0.00 0.00 42.92 44.20 2h3x s ASP 171 CO 0.70 -0.58 0.61 -0.47 1.18 0.00 0.00 175.17 176.61 2h3x s TYR 172 N -3.83 3.10 -1.74 4.23 5.04 -1.26 -0.15 117.35 122.75 2h3x s TYR 172 Ca 0.13 -1.03 0.23 0.00 -2.44 0.00 0.00 57.07 53.96 2h3x s TYR 172 Cb 0.07 -3.84 0.03 0.00 0.35 0.00 0.00 41.96 38.57 2h3x s TYR 172 CO -0.05 -1.15 1.10 1.33 -1.34 0.00 0.00 175.55 175.44 2h3x n VAL 173 N 5.43 0.00 -3.60 3.14 0.24 0.17 -4.98 118.33 118.73 2h3x n VAL 173 Ca -0.11 -0.18 -0.15 0.00 -2.04 0.00 0.00 64.34 61.86 2h3x n VAL 173 Cb 0.42 1.08 -0.07 0.00 -1.47 0.00 0.00 33.84 33.80 2h3x n VAL 173 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2h3x s GLU 174 N -2.62 0.89 -0.36 7.34 2.56 -1.18 -4.71 118.70 120.61 2h3x s GLU 174 Ca 0.16 0.77 0.04 0.00 0.00 0.00 0.00 54.97 55.94 2h3x s GLU 174 Cb 0.18 0.43 0.10 0.00 2.00 0.00 0.00 34.13 36.84 2h3x s GLU 174 CO 0.64 -0.16 0.08 0.34 -0.56 0.00 0.00 175.26 175.59 2h3x s ASP 175 N -0.08 4.69 -1.14 -1.70 -1.08 -1.26 -0.61 116.67 115.49 2h3x s ASP 175 Ca -0.03 -2.26 -0.21 0.00 -0.52 0.00 0.00 52.55 49.53 2h3x s ASP 175 Cb -0.04 -1.61 0.03 0.00 -1.46 0.00 0.00 42.92 39.84 2h3x s ASP 175 CO 0.03 -0.36 1.68 -0.69 0.52 0.00 0.00 175.17 176.35 2h3x s VAL 176 N 0.77 3.90 -0.82 1.11 1.01 0.10 -4.76 120.40 121.71 2h3x s VAL 176 Ca 0.12 -1.19 0.24 0.00 0.00 0.00 0.00 61.98 61.15 2h3x s VAL 176 Cb -0.20 -4.94 0.23 0.00 0.00 0.00 0.00 36.38 31.47 2h3x s VAL 176 CO -0.07 -1.75 1.74 0.35 0.00 0.00 0.00 175.10 175.37 2h3x n THR 177 N 6.92 0.56 0.31 3.92 -2.24 -1.26 -2.18 114.28 120.31 2h3x n THR 177 Ca 0.41 0.03 0.12 0.00 -2.27 0.00 0.00 64.05 62.34 2h3x n THR 177 Cb 0.48 -0.77 0.53 0.00 -2.10 0.00 0.00 70.33 68.46 2h3x n THR 177 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h3x n ALA 178 N -1.63 1.45 1.74 6.98 0.00 -1.26 -1.98 120.51 125.80 2h3x n ALA 178 Ca 0.05 0.13 0.12 0.00 0.00 0.00 0.00 53.44 53.73 2h3x n ALA 178 Cb 0.30 -1.37 0.58 0.00 0.00 0.00 0.00 19.45 18.97 2h3x n ALA 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h3x n ALA 179 N -1.78 2.60 -1.66 0.00 0.00 -1.12 -4.91 120.51 113.64 2h3x n ALA 179 Ca 0.01 -0.28 -0.46 0.00 0.00 0.00 0.00 53.44 52.71 2h3x n ALA 179 Cb 0.16 -1.27 -0.04 0.00 0.00 0.00 0.00 19.45 18.30 2h3x n ALA 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h3x n ALA 180 N -0.42 0.92 -0.69 0.00 0.00 -0.84 -0.22 120.51 119.27 2h3x n ALA 180 Ca 0.17 0.44 0.00 0.00 0.00 0.00 0.00 53.44 54.05 2h3x n ALA 180 Cb 0.18 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.35 2h3x n ALA 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h3x n GLY 181 N 2.70 0.80 3.70 0.00 0.00 -1.26 -4.98 105.19 106.15 2h3x n GLY 181 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 2h3x n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h3x s TRP 183 N -2.56 -0.41 0.30 0.00 -0.11 0.14 -4.85 118.94 111.45 2h3x s TRP 183 Ca 0.38 0.96 0.00 0.00 1.22 0.00 0.00 56.10 58.67 2h3x s TRP 183 Cb 0.02 0.15 0.00 0.00 -1.50 0.00 0.00 33.47 32.14 2h3x s TRP 183 CO 0.21 -0.25 0.00 -1.13 -4.62 0.00 0.00 176.95 171.17 2h3x n SER 184 N 2.60 -4.23 -4.51 5.86 3.41 -1.26 -2.73 113.62 112.76 2h3x n SER 184 Ca -0.14 0.92 -0.34 0.00 -0.26 0.00 0.00 58.87 59.05 2h3x n SER 184 Cb 0.57 -2.14 -0.12 0.00 -0.26 0.00 0.00 64.21 62.26 2h3x n SER 184 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2h3x s VAL 185 N -4.56 3.93 -0.47 -3.33 1.01 0.32 -4.21 120.40 113.10 2h3x s VAL 185 Ca 0.00 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 61.66 2h3x s VAL 185 Cb 0.00 -2.72 0.13 0.00 0.00 0.00 0.00 36.38 33.79 2h3x s VAL 185 CO 0.00 0.49 0.24 -0.63 0.00 0.00 0.00 175.10 175.20 2h3x s ILE 186 N 0.34 1.87 0.52 2.22 1.01 -0.14 -4.39 121.20 122.63 2h3x s ILE 186 Ca -0.04 -2.83 -0.20 0.00 0.00 0.00 0.00 60.65 57.59 2h3x s ILE 186 Cb -0.14 -2.31 -0.09 0.00 0.01 0.00 0.00 42.46 39.93 2h3x s ILE 186 CO 0.03 -0.85 0.73 -2.65 0.00 0.00 0.00 174.94 172.20 2h3x n PRO 187 N 3.42 0.78 -3.47 2.79 -0.02 -1.26 -1.72 135.00 135.51 2h3x n PRO 187 Ca 0.07 0.29 -0.43 0.00 -2.02 0.00 0.00 63.50 61.41 2h3x n PRO 187 Cb 0.34 -1.85 -0.08 0.00 -0.02 0.00 0.00 33.50 31.89 2h3x n PRO 187 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2h3x s GLN 188 N -2.15 2.76 0.34 -0.52 -0.21 -0.67 -4.86 119.66 114.36 2h3x s GLN 188 Ca 0.68 -1.54 0.22 0.00 0.02 0.00 0.00 55.36 54.74 2h3x s GLN 188 Cb -0.49 -4.01 1.18 0.00 1.00 0.00 0.00 33.01 30.69 2h3x s GLN 188 CO 0.54 -1.10 1.65 -1.35 -2.12 0.00 0.00 175.29 172.91 2h3x h PRO 189 N 8.61 0.00 -0.48 2.91 0.11 -1.82 -1.78 132.00 139.55 2h3x h PRO 189 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2h3x h PRO 189 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2h3x h PRO 189 CO 0.87 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.93 2h3x n ASN 190 N -2.28 3.16 -3.95 -2.05 6.94 -1.11 -4.90 115.26 111.07 2h3x n ASN 190 Ca -0.01 -1.96 -0.12 0.00 -0.02 0.00 0.00 54.58 52.47 2h3x n ASN 190 Cb 0.08 -0.31 -0.13 0.00 -2.36 0.00 0.00 39.78 37.06 2h3x n ASN 190 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2h3x s ARG 191 N -1.37 0.26 0.36 -3.83 0.52 -0.67 -5.07 118.95 109.14 2h3x s ARG 191 Ca 0.39 -0.37 0.05 0.00 -0.52 0.00 0.00 55.73 55.29 2h3x s ARG 191 Cb 0.22 -0.06 0.68 0.00 0.52 0.00 0.00 34.95 36.31 2h3x s ARG 191 CO 0.29 0.01 1.95 -1.00 0.02 0.00 0.00 175.30 176.57 2h3x h PRO 192 N 5.33 0.56 -0.49 3.54 0.13 -1.91 -3.39 132.00 135.78 2h3x h PRO 192 Ca -0.29 -0.08 -0.29 0.00 -0.87 0.00 0.00 66.00 64.46 2h3x h PRO 192 Cb 1.21 -0.10 -0.22 0.00 0.13 0.00 0.00 31.00 32.01 2h3x h PRO 192 CO 0.46 0.49 -0.64 2.89 -0.23 0.00 0.00 178.00 180.97 2h3x n ARG 193 N -4.36 1.06 -4.19 0.86 1.85 -1.26 -1.62 116.66 109.00 2h3x n ARG 193 Ca 0.02 -2.32 -0.17 0.00 -1.00 0.00 0.00 57.85 54.38 2h3x n ARG 193 Cb 0.16 -0.95 -0.12 0.00 -1.05 0.00 0.00 32.46 30.50 2h3x n ARG 193 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 2h3x s SER 194 N -1.66 1.45 0.18 2.89 0.01 -1.26 -1.53 113.70 113.77 2h3x s SER 194 Ca 0.26 -0.54 -0.16 0.00 1.31 0.00 0.00 55.95 56.82 2h3x s SER 194 Cb 0.34 -0.05 0.02 0.00 0.21 0.00 0.00 66.02 66.55 2h3x s SER 194 CO -0.06 -0.07 0.46 0.72 0.41 0.00 0.00 173.24 174.70 2h3x s PHE 195 N -1.14 -0.04 0.43 2.43 -0.12 -0.52 -1.67 117.98 117.35 2h3x s PHE 195 Ca -0.03 -0.31 0.05 0.00 -0.05 0.00 0.00 56.93 56.59 2h3x s PHE 195 Cb -0.09 0.29 -0.05 0.00 -0.63 0.00 0.00 43.02 42.53 2h3x s PHE 195 CO 0.02 -0.84 0.02 -1.64 -0.05 0.00 0.00 175.22 172.72 2h3x s MET 196 N -3.88 1.99 -0.19 1.99 -1.94 -0.70 -0.13 119.30 116.45 2h3x s MET 196 Ca 0.10 -2.18 -0.21 0.00 -1.71 0.00 0.00 55.69 51.68 2h3x s MET 196 Cb 0.00 -1.45 0.06 0.00 2.01 0.00 0.00 34.83 35.45 2h3x s MET 196 CO -0.04 -0.19 0.58 -0.08 -0.01 0.00 0.00 175.02 175.28 2h3x s THR 197 N -2.86 0.00 0.01 2.05 -1.32 -0.21 -0.97 115.64 112.33 2h3x s THR 197 Ca 0.25 -0.03 -0.30 0.00 -1.21 0.00 0.00 61.69 60.40 2h3x s THR 197 Cb 0.07 -0.82 -0.04 0.00 -1.51 0.00 0.00 72.50 70.20 2h3x s THR 197 CO 0.13 -0.02 1.06 -0.63 -2.21 0.00 0.00 174.62 172.95 2h3x s ILE 198 N 0.04 4.58 0.26 5.08 1.01 -1.11 -1.10 121.20 129.96 2h3x s ILE 198 Ca -0.02 1.85 0.10 0.00 0.00 0.00 0.00 60.65 62.58 2h3x s ILE 198 Cb -0.04 -4.19 -0.04 0.00 0.01 0.00 0.00 42.46 38.20 2h3x s ILE 198 CO 0.02 0.13 -0.04 0.00 0.00 0.00 0.00 174.94 175.05 2h3x n GLY 200 N -0.78 -0.32 0.82 0.00 0.00 -0.46 -0.95 105.19 103.50 2h3x n GLY 200 Ca -0.07 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.07 2h3x n GLY 200 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2h3x n ASP 201 N -1.28 2.51 0.00 1.61 5.75 -1.26 -4.91 116.55 118.98 2h3x n ASP 201 Ca 0.01 -1.83 0.00 0.00 -0.01 0.00 0.00 54.79 52.96 2h3x n ASP 201 Cb 0.01 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.02 2h3x n ASP 201 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2h3x n GLY 202 N 1.31 0.66 3.86 6.12 0.00 -0.13 -4.82 105.19 112.18 2h3x n GLY 202 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.90 2h3x n GLY 202 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2h3x s GLY 203 N -1.97 2.59 -0.09 -0.02 0.00 -1.24 -0.20 107.32 106.39 2h3x s GLY 203 Ca 0.00 -0.96 0.02 0.00 0.00 0.00 0.00 44.72 43.78 2h3x s GLY 203 CO 0.00 -2.03 -0.15 1.08 0.00 0.00 0.00 173.10 172.00 2h3x s LEU 204 N -4.15 2.62 -0.21 0.66 1.43 -1.26 -0.76 118.68 117.01 2h3x s LEU 204 Ca 0.25 -0.31 -0.07 0.00 -1.03 0.00 0.00 54.13 52.97 2h3x s LEU 204 Cb -0.01 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.62 2h3x s LEU 204 CO 0.15 0.24 0.05 -0.22 0.23 0.00 0.00 176.35 176.80 2h3x s LEU 205 N -0.11 3.53 -0.17 1.79 2.96 -0.25 -1.16 118.68 125.27 2h3x s LEU 205 Ca -0.02 -0.09 -0.06 0.00 -0.22 0.00 0.00 54.13 53.73 2h3x s LEU 205 Cb -0.14 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.61 2h3x s LEU 205 CO 0.04 0.08 0.04 -0.89 -1.32 0.00 0.00 176.35 174.29 2h3x s THR 206 N 0.94 4.59 -0.14 3.68 2.01 0.33 -1.05 115.64 126.01 2h3x s THR 206 Ca 0.03 -0.11 0.01 0.00 0.31 0.00 0.00 61.69 61.93 2h3x s THR 206 Cb -0.14 -3.05 -0.00 0.00 0.01 0.00 0.00 72.50 69.32 2h3x s THR 206 CO 0.02 0.48 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.64 2h3x s ILE 207 N 0.27 2.59 -0.20 1.82 -1.09 0.81 -1.89 121.20 123.51 2h3x s ILE 207 Ca 0.02 -0.81 -0.02 0.00 -2.23 0.00 0.00 60.65 57.62 2h3x s ILE 207 Cb -0.13 -2.07 0.01 0.00 -1.58 0.00 0.00 42.46 38.69 2h3x s ILE 207 CO 0.01 0.53 -0.11 0.20 -1.23 0.00 0.00 174.94 174.34 2h3x s ASN 208 N 0.65 3.81 0.36 3.58 0.01 -0.25 -1.43 114.94 121.65 2h3x s ASN 208 Ca -0.09 -0.52 -0.06 0.00 -0.71 0.00 0.00 52.86 51.48 2h3x s ASN 208 Cb -0.16 -1.63 -0.05 0.00 0.41 0.00 0.00 41.25 39.82 2h3x s ASN 208 CO 0.02 -0.02 0.65 -0.76 -1.51 0.00 0.00 177.10 175.49 2h3x s LEU 209 N 1.39 3.93 0.63 0.60 1.43 -0.58 -0.02 118.68 126.06 2h3x s LEU 209 Ca 0.05 0.83 -0.01 0.00 -1.03 0.00 0.00 54.13 53.97 2h3x s LEU 209 Cb -0.14 -3.69 0.07 0.00 0.03 0.00 0.00 46.19 42.46 2h3x s LEU 209 CO -0.07 -0.32 0.89 -0.83 0.23 0.00 0.00 176.35 176.25 2h3x s GLY 210 N -3.40 1.78 0.48 -3.19 0.00 0.59 -4.63 107.32 98.95 2h3x s GLY 210 Ca 0.46 -1.35 0.25 0.00 0.00 0.00 0.00 44.72 44.08 2h3x s GLY 210 CO 0.33 -0.96 1.73 0.83 0.00 0.00 0.00 173.10 175.04 2h3x h GLU 211 N -0.25 0.00 -0.46 2.90 5.08 -1.99 -0.23 114.58 119.63 2h3x h GLU 211 Ca -0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 2h3x h GLU 211 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2h3x h GLU 211 CO 0.50 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.11 2h3x n ASP 212 N -2.50 3.35 0.00 1.42 5.68 -1.26 -4.94 116.55 118.30 2h3x n ASP 212 Ca -0.02 -1.97 0.00 0.00 -0.50 0.00 0.00 54.79 52.30 2h3x n ASP 212 Cb 0.23 -0.30 0.00 0.00 -1.14 0.00 0.00 41.12 39.91 2h3x n ASP 212 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2h3x n GLY 213 N 1.50 2.26 3.80 6.12 0.00 -0.10 -4.95 105.19 113.82 2h3x n GLY 213 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 2h3x n GLY 213 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h3x s LYS 214 N -0.55 4.37 -0.01 1.61 1.02 -1.26 -4.68 119.74 120.24 2h3x s LYS 214 Ca 0.00 1.06 -0.35 0.00 0.02 0.00 0.00 55.97 56.70 2h3x s LYS 214 Cb 0.00 -2.79 -0.13 0.00 -0.52 0.00 0.00 37.83 34.38 2h3x s LYS 214 CO 0.00 0.32 1.71 0.28 -0.92 0.00 0.00 175.35 176.74 2h3x n VAL 215 N 0.54 0.30 -0.10 3.17 0.31 -1.26 -0.30 118.33 121.00 2h3x n VAL 215 Ca 0.00 -0.05 -0.23 0.00 -0.01 0.00 0.00 64.34 64.05 2h3x n VAL 215 Cb 0.51 -1.57 -0.12 0.00 -0.91 0.00 0.00 33.84 31.75 2h3x n VAL 215 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2h3x n ALA 216 N 5.01 1.08 -3.43 3.52 0.00 0.97 -4.75 120.51 122.91 2h3x n ALA 216 Ca 0.21 -0.83 -0.09 0.00 0.00 0.00 0.00 53.44 52.73 2h3x n ALA 216 Cb 0.26 -0.28 -0.04 0.00 0.00 0.00 0.00 19.45 19.39 2h3x n ALA 216 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2h3x s SER 217 N -7.01 -0.22 0.11 0.00 1.04 -0.91 -5.02 113.70 101.69 2h3x s SER 217 Ca -0.32 -0.62 -0.14 0.00 0.48 0.00 0.00 55.95 55.35 2h3x s SER 217 Cb 0.09 0.62 0.03 0.00 0.10 0.00 0.00 66.02 66.86 2h3x s SER 217 CO 0.60 -1.16 0.34 0.00 0.98 0.00 0.00 173.24 174.01 2h3x s GLN 218 N -3.92 0.99 -0.17 4.02 -2.07 -1.26 -1.09 119.66 116.16 2h3x s GLN 218 Ca 0.13 -0.74 -0.24 0.00 -1.82 0.00 0.00 55.36 52.69 2h3x s GLN 218 Cb -0.02 0.43 0.06 0.00 -1.09 0.00 0.00 33.01 32.39 2h3x s GLN 218 CO 0.03 -0.37 0.61 -1.54 -1.32 0.00 0.00 175.29 172.70 2h3x s SER 219 N -2.74 -0.61 -0.03 12.60 1.04 -0.79 -4.99 113.70 118.18 2h3x s SER 219 Ca 0.03 1.01 0.01 0.00 0.48 0.00 0.00 55.95 57.47 2h3x s SER 219 Cb 0.02 1.00 -0.03 0.00 0.10 0.00 0.00 66.02 67.11 2h3x s SER 219 CO -0.11 -0.34 -0.01 -0.13 0.98 0.00 0.00 173.24 173.63 2h3x s ARG 220 N -0.22 2.82 0.74 4.02 0.52 -1.26 -0.51 118.95 125.06 2h3x s ARG 220 Ca -0.04 -0.56 -0.03 0.00 -0.52 0.00 0.00 55.73 54.58 2h3x s ARG 220 Cb -0.03 -2.68 0.12 0.00 0.52 0.00 0.00 34.95 32.88 2h3x s ARG 220 CO 0.04 0.65 1.02 -1.54 0.02 0.00 0.00 175.30 175.48 2h3x s SER 221 N -1.30 4.30 0.88 0.23 1.04 -0.31 -4.93 113.70 113.62 2h3x s SER 221 Ca 0.17 -0.18 -0.13 0.00 0.48 0.00 0.00 55.95 56.29 2h3x s SER 221 Cb -0.11 -0.22 0.12 0.00 0.10 0.00 0.00 66.02 65.91 2h3x s SER 221 CO 0.07 -1.89 1.16 -0.54 0.98 0.00 0.00 173.24 173.02 2h3x s LYS 222 N -5.22 1.35 0.11 4.02 1.02 -1.26 -4.57 119.74 115.19 2h3x s LYS 222 Ca 0.66 0.17 -0.31 0.00 0.02 0.00 0.00 55.97 56.51 2h3x s LYS 222 Cb -0.06 -1.87 -0.10 0.00 -0.52 0.00 0.00 37.83 35.28 2h3x s LYS 222 CO 0.45 -2.03 1.76 -1.14 -0.92 0.00 0.00 175.35 173.47 2h3x s GLN 223 N -5.43 4.16 -0.13 1.68 0.74 -1.26 -4.46 119.66 114.95 2h3x s GLN 223 Ca 0.64 2.50 0.02 0.00 0.05 0.00 0.00 55.36 58.56 2h3x s GLN 223 Cb -0.13 -3.58 -0.24 0.00 1.10 0.00 0.00 33.01 30.17 2h3x s GLN 223 CO 0.52 -0.80 0.31 -0.12 -0.55 0.00 0.00 175.29 174.65 2h3x n MET 224 N 5.59 0.70 -3.83 1.67 0.00 0.72 -4.95 117.12 117.03 2h3x n MET 224 Ca 0.17 0.23 -0.10 0.00 -0.00 0.00 0.00 57.70 58.00 2h3x n MET 224 Cb 0.39 -1.68 -0.07 0.00 0.00 0.00 0.00 33.22 31.85 2h3x n MET 224 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 175.97 175.38 2h3x s PHE 225 N -2.56 0.07 -0.34 1.12 -0.12 -0.99 -4.82 117.98 110.35 2h3x s PHE 225 Ca -0.19 -0.41 -0.27 0.00 -0.05 0.00 0.00 56.93 56.01 2h3x s PHE 225 Cb 0.07 -0.01 0.01 0.00 -0.63 0.00 0.00 43.02 42.47 2h3x s PHE 225 CO 0.76 -0.52 0.99 0.45 -0.05 0.00 0.00 175.22 176.85 2h3x s SER 226 N -2.57 6.80 0.11 1.98 0.15 -1.26 -4.41 113.70 114.49 2h3x s SER 226 Ca 0.01 0.82 -0.24 0.00 0.70 0.00 0.00 55.95 57.23 2h3x s SER 226 Cb 0.02 -2.50 -0.10 0.00 -1.71 0.00 0.00 66.02 61.74 2h3x s SER 226 CO -0.08 -0.85 1.69 0.58 1.20 0.00 0.00 173.24 175.77 2h3x h VAL 227 N 5.76 0.70 -0.02 4.45 2.07 -1.90 0.10 116.25 127.41 2h3x h VAL 227 Ca -0.22 0.00 -0.21 0.00 0.82 0.00 0.00 66.70 67.09 2h3x h VAL 227 Cb 1.07 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 31.54 2h3x h VAL 227 CO 1.00 0.00 -0.86 0.07 0.02 0.00 0.00 177.57 177.80 2h3x h LYS 228 N -0.24 0.37 0.00 1.57 2.10 -1.96 -3.25 116.57 115.15 2h3x h LYS 228 Ca 0.03 -0.36 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 2h3x h LYS 228 Cb 0.27 0.10 0.00 0.00 -0.90 0.00 0.00 32.23 31.70 2h3x h LYS 228 CO -0.09 1.03 -1.32 -0.25 -2.00 0.00 0.00 179.45 176.83 2h3x n ASP 229 N -3.76 0.56 -2.75 7.07 8.00 -1.21 -4.75 116.55 119.71 2h3x n ASP 229 Ca -0.05 -0.41 -0.09 0.00 0.71 0.00 0.00 54.79 54.95 2h3x n ASP 229 Cb 0.79 1.23 0.08 0.00 -0.02 0.00 0.00 41.12 43.20 2h3x n ASP 229 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2h3x n ASP 230 N -1.90 -2.44 -4.75 -2.24 2.03 0.01 -5.02 116.55 102.24 2h3x n ASP 230 Ca 0.01 -3.58 -0.41 0.00 0.52 0.00 0.00 54.79 51.32 2h3x n ASP 230 Cb 0.44 1.86 -0.02 0.00 -0.72 0.00 0.00 41.12 42.68 2h3x n ASP 230 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2h3x s PRO 231 N 0.34 4.20 0.31 -0.67 0.04 -1.17 -4.39 135.00 133.66 2h3x s PRO 231 Ca 0.25 2.43 -0.03 0.00 0.04 0.00 0.00 61.00 63.69 2h3x s PRO 231 Cb 0.27 -3.06 -0.04 0.00 0.04 0.00 0.00 34.50 31.71 2h3x s PRO 231 CO -0.11 -0.50 0.54 0.96 0.04 0.00 0.00 177.00 177.93 2h3x s ILE 232 N -0.13 5.07 0.35 0.56 -4.36 -1.26 -0.58 121.20 120.85 2h3x s ILE 232 Ca 0.60 -0.16 -0.25 0.00 -0.26 0.00 0.00 60.65 60.58 2h3x s ILE 232 Cb -0.44 -3.78 -0.10 0.00 1.25 0.00 0.00 42.46 39.38 2h3x s ILE 232 CO 0.47 -0.41 0.97 -0.36 0.24 0.00 0.00 174.94 175.85 2h3x s PHE 233 N -2.17 3.56 0.17 1.37 0.40 1.00 -4.88 117.98 117.43 2h3x s PHE 233 Ca 0.42 1.73 0.28 0.00 -0.60 0.00 0.00 56.93 58.76 2h3x s PHE 233 Cb -0.10 -2.95 1.14 0.00 0.51 0.00 0.00 43.02 41.62 2h3x s PHE 233 CO 0.33 0.01 1.91 -0.84 0.70 0.00 0.00 175.22 177.32 2h3x h ILE 234 N 2.43 0.38 -2.57 0.64 3.07 -1.90 -3.42 117.51 116.15 2h3x h ILE 234 Ca -0.47 -0.85 -0.53 0.00 1.55 0.00 0.00 64.86 64.55 2h3x h ILE 234 Cb 1.19 1.63 0.02 0.00 -0.27 0.00 0.00 36.82 39.39 2h3x h ILE 234 CO 0.64 0.14 1.09 0.00 -1.05 0.00 0.00 178.15 178.97 2h3x s ALA 235 N -3.73 3.67 0.19 0.16 0.00 -1.26 -4.99 121.76 115.80 2h3x s ALA 235 Ca 0.00 1.25 -0.05 0.00 0.00 0.00 0.00 51.96 53.16 2h3x s ALA 235 Cb 0.10 -3.75 -0.06 0.00 0.00 0.00 0.00 23.12 19.41 2h3x s ALA 235 CO 0.60 -1.28 0.44 -1.25 0.00 0.00 0.00 175.76 174.27 2h3x s PRO 236 N 3.28 3.65 -0.99 0.00 0.04 -1.26 -4.67 135.00 135.05 2h3x s PRO 236 Ca 0.79 -0.02 -0.07 0.00 0.04 0.00 0.00 61.00 61.74 2h3x s PRO 236 Cb -0.41 -2.77 0.25 0.00 0.04 0.00 0.00 34.50 31.61 2h3x s PRO 236 CO 0.35 0.39 0.94 0.00 0.04 0.00 0.00 177.00 178.72 2h3x s ALA 237 N -1.78 4.46 0.14 8.56 0.00 0.08 -4.67 121.76 128.55 2h3x s ALA 237 Ca 0.43 -3.76 -0.30 0.00 0.00 0.00 0.00 51.96 48.33 2h3x s ALA 237 Cb -0.12 -3.30 -0.07 0.00 0.00 0.00 0.00 23.12 19.63 2h3x s ALA 237 CO 0.25 -2.19 1.16 -1.17 0.00 0.00 0.00 175.76 173.81 2h3x s LEU 238 N -1.07 4.44 0.00 0.00 2.96 -1.26 -2.12 118.68 121.63 2h3x s LEU 238 Ca 0.28 2.11 0.00 0.00 -0.22 0.00 0.00 54.13 56.30 2h3x s LEU 238 Cb -0.10 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 43.00 2h3x s LEU 238 CO -0.09 -0.34 0.03 -0.67 -1.32 0.00 0.00 176.35 173.96 2h3x n ASP 239 N 2.89 2.32 -0.06 3.68 -0.08 0.62 -4.69 116.55 121.23 2h3x n ASP 239 Ca 0.05 -1.80 -0.12 0.00 -1.51 0.00 0.00 54.79 51.41 2h3x n ASP 239 Cb 0.46 0.10 -0.06 0.00 2.34 0.00 0.00 41.12 43.96 2h3x n ASP 239 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 2h3x h LYS 240 N 0.00 0.39 -0.04 -0.67 1.63 -1.97 -3.36 116.57 112.55 2h3x h LYS 240 Ca -0.15 -0.18 0.00 0.00 -0.85 0.00 0.00 60.65 59.47 2h3x h LYS 240 Cb 0.47 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.09 2h3x h LYS 240 CO 0.25 0.70 0.00 -0.40 -3.45 0.00 0.00 179.45 176.55 2h3x n ASP 241 N -4.58 2.32 -3.53 4.20 5.75 -1.26 -2.74 116.55 116.72 2h3x n ASP 241 Ca -0.05 -2.46 -0.10 0.00 -0.01 0.00 0.00 54.79 52.17 2h3x n ASP 241 Cb 0.32 -0.21 -0.02 0.00 -1.03 0.00 0.00 41.12 40.19 2h3x n ASP 241 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 2h3x s LYS 242 N -1.80 1.20 0.00 0.11 -2.85 -1.26 -0.77 119.74 114.37 2h3x s LYS 242 Ca 0.16 -0.50 0.02 0.00 -1.00 0.00 0.00 55.97 54.65 2h3x s LYS 242 Cb 0.13 0.51 -0.01 0.00 -2.06 0.00 0.00 37.83 36.41 2h3x s LYS 242 CO 0.03 -0.53 -0.07 0.00 0.10 0.00 0.00 175.35 174.88 2h3x s ALA 243 N -3.54 0.58 0.16 0.59 0.00 -0.75 -0.28 121.76 118.51 2h3x s ALA 243 Ca 0.04 -0.35 0.08 0.00 0.00 0.00 0.00 51.96 51.72 2h3x s ALA 243 Cb -0.02 -0.12 -0.04 0.00 0.00 0.00 0.00 23.12 22.94 2h3x s ALA 243 CO -0.08 0.12 -0.05 -1.01 0.00 0.00 0.00 175.76 174.74 2h3x s HIS 244 N -0.30 2.77 0.02 0.00 3.76 -0.90 -0.71 115.29 119.92 2h3x s HIS 244 Ca 0.01 -0.16 0.00 0.00 -0.15 0.00 0.00 55.06 54.77 2h3x s HIS 244 Cb -0.03 -1.37 -0.02 0.00 1.11 0.00 0.00 32.58 32.26 2h3x s HIS 244 CO -0.00 0.49 -0.04 -0.06 -0.85 0.00 0.00 174.74 174.29 2h3x s PHE 245 N -1.59 0.33 0.09 1.40 0.40 0.49 -0.75 117.98 118.35 2h3x s PHE 245 Ca 0.25 -0.49 0.07 0.00 -0.60 0.00 0.00 56.93 56.16 2h3x s PHE 245 Cb -0.10 -0.22 -0.04 0.00 0.51 0.00 0.00 43.02 43.17 2h3x s PHE 245 CO 0.17 -0.16 -0.10 0.14 0.70 0.00 0.00 175.22 175.96 2h3x s VAL 246 N -1.36 3.36 0.48 -0.44 -7.23 -1.26 -0.86 120.40 113.09 2h3x s VAL 246 Ca -0.14 -1.21 0.08 0.00 -1.81 0.00 0.00 61.98 58.90 2h3x s VAL 246 Cb -0.09 -2.55 0.03 0.00 0.56 0.00 0.00 36.38 34.32 2h3x s VAL 246 CO -0.01 0.16 0.55 -0.94 -0.31 0.00 0.00 175.10 174.55 2h3x s SER 247 N -2.07 5.16 0.57 4.85 1.04 -0.18 -0.00 113.70 123.06 2h3x s SER 247 Ca 0.20 -0.77 0.27 0.00 0.48 0.00 0.00 55.95 56.13 2h3x s SER 247 Cb -0.11 -0.19 1.67 0.00 0.10 0.00 0.00 66.02 67.48 2h3x s SER 247 CO 0.12 -0.95 2.21 1.88 0.98 0.00 0.00 173.24 177.49 2h3x h TYR 248 N 0.64 0.00 -0.43 5.02 0.99 -1.15 -2.60 116.97 119.45 2h3x h TYR 248 Ca -0.37 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.36 2h3x h TYR 248 Cb 1.28 0.00 0.00 0.00 1.00 0.00 0.00 36.73 39.01 2h3x h TYR 248 CO 0.53 0.02 0.00 0.66 -0.00 0.00 0.00 178.16 179.37 2h3x n TYR 249 N -3.97 1.20 -0.69 4.88 4.02 -1.26 -4.49 117.16 116.84 2h3x n TYR 249 Ca -0.03 -0.72 0.00 0.00 -0.01 0.00 0.00 57.90 57.14 2h3x n TYR 249 Cb 0.10 -0.28 0.00 0.00 -0.02 0.00 0.00 39.34 39.14 2h3x n TYR 249 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2h3x n GLY 250 N 0.27 0.58 3.94 2.72 0.00 -0.98 -4.96 105.19 106.76 2h3x n GLY 250 Ca 0.22 -0.68 -0.25 0.00 0.00 0.00 0.00 46.02 45.31 2h3x n GLY 250 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2h3x s ASN 251 N -2.62 6.30 -0.13 1.61 0.01 -1.26 -1.63 114.94 117.21 2h3x s ASN 251 Ca 0.00 0.51 0.01 0.00 -0.71 0.00 0.00 52.86 52.67 2h3x s ASN 251 Cb 0.00 -2.06 0.02 0.00 0.41 0.00 0.00 41.25 39.62 2h3x s ASN 251 CO 0.00 -0.31 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.45 2h3x s VAL 252 N -2.33 1.51 0.25 1.60 1.01 0.45 -1.01 120.40 121.87 2h3x s VAL 252 Ca 0.41 -0.61 0.09 0.00 0.00 0.00 0.00 61.98 61.87 2h3x s VAL 252 Cb -0.10 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 2h3x s VAL 252 CO 0.36 0.45 -0.02 -0.31 0.00 0.00 0.00 175.10 175.58 2h3x s TYR 253 N 1.37 2.69 0.02 5.22 1.51 -0.04 -2.55 117.35 125.58 2h3x s TYR 253 Ca 0.02 -0.22 -0.02 0.00 -1.01 0.00 0.00 57.07 55.85 2h3x s TYR 253 Cb -0.13 -1.22 -0.02 0.00 -0.11 0.00 0.00 41.96 40.48 2h3x s TYR 253 CO -0.08 0.60 0.01 -1.54 -1.11 0.00 0.00 175.55 173.42 2h3x s SER 254 N -3.48 0.24 -0.26 2.29 1.04 -0.40 -0.38 113.70 112.75 2h3x s SER 254 Ca 0.30 -0.54 -0.01 0.00 0.48 0.00 0.00 55.95 56.18 2h3x s SER 254 Cb -0.07 0.14 0.08 0.00 0.10 0.00 0.00 66.02 66.27 2h3x s SER 254 CO 0.19 -0.38 0.04 0.00 0.98 0.00 0.00 173.24 174.07 2h3x s ALA 255 N -1.94 1.60 -0.15 5.32 0.00 0.11 -1.23 121.76 125.47 2h3x s ALA 255 Ca -0.11 -1.38 -0.22 0.00 0.00 0.00 0.00 51.96 50.25 2h3x s ALA 255 Cb -0.06 -1.47 -0.03 0.00 0.00 0.00 0.00 23.12 21.56 2h3x s ALA 255 CO -0.02 -1.41 0.66 0.34 0.00 0.00 0.00 175.76 175.33 2h3x s ASP 256 N 1.57 6.79 -0.24 0.00 -1.08 0.73 -1.82 116.67 122.63 2h3x s ASP 256 Ca 0.03 0.96 0.13 0.00 -0.52 0.00 0.00 52.55 53.14 2h3x s ASP 256 Cb -0.18 -2.37 0.46 0.00 -1.46 0.00 0.00 42.92 39.37 2h3x s ASP 256 CO -0.14 -0.22 1.18 2.22 0.52 0.00 0.00 175.17 178.73 2h3x n PHE 257 N 4.59 1.57 0.13 -5.34 1.16 0.05 -0.05 117.46 119.58 2h3x n PHE 257 Ca -0.01 -1.88 0.03 0.00 -1.87 0.00 0.00 57.45 53.72 2h3x n PHE 257 Cb 0.50 -0.28 0.02 0.00 -1.61 0.00 0.00 39.48 38.11 2h3x n PHE 257 CO 0.00 0.00 0.00 0.66 -1.87 0.00 0.00 176.76 175.55 2h3x h SER 258 N 1.86 0.00 -5.61 5.98 4.64 -1.83 -3.46 113.55 115.12 2h3x h SER 258 Ca 0.14 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 61.07 2h3x h SER 258 Cb 1.39 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 63.53 2h3x h SER 258 CO 0.41 0.49 0.02 0.61 -0.87 0.00 0.00 176.83 177.49 2h3x n GLY 259 N 1.24 1.28 0.23 -0.77 0.00 -1.26 -5.01 105.19 100.89 2h3x n GLY 259 Ca 0.01 -2.11 -0.05 0.00 0.00 0.00 0.00 46.02 43.87 2h3x n GLY 259 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2h3x h ASP 260 N -0.22 0.62 -2.29 1.61 3.32 -1.97 -3.43 116.42 114.06 2h3x h ASP 260 Ca -0.25 -0.01 -0.53 0.00 0.02 0.00 0.00 57.03 56.27 2h3x h ASP 260 Cb 1.02 -0.14 -0.06 0.00 0.22 0.00 0.00 39.33 40.36 2h3x h ASP 260 CO 0.30 0.44 -0.56 -1.61 -1.72 0.00 0.00 179.24 176.09 2h3x s GLU 261 N -6.14 2.76 -0.09 3.56 0.41 -1.26 -5.09 118.70 112.86 2h3x s GLU 261 Ca -0.13 -1.11 -0.25 0.00 -0.41 0.00 0.00 54.97 53.06 2h3x s GLU 261 Cb 0.13 -2.48 -0.03 0.00 -1.78 0.00 0.00 34.13 29.98 2h3x s GLU 261 CO 0.75 0.40 0.80 0.08 -0.49 0.00 0.00 175.26 176.81 2h3x s VAL 262 N -2.11 4.95 -0.38 2.63 1.01 -1.26 -4.74 120.40 120.50 2h3x s VAL 262 Ca 0.32 1.64 -0.14 0.00 0.00 0.00 0.00 61.98 63.80 2h3x s VAL 262 Cb -0.08 -4.13 0.01 0.00 0.00 0.00 0.00 36.38 32.18 2h3x s VAL 262 CO 0.23 0.15 0.26 -0.75 0.00 0.00 0.00 175.10 175.00 2h3x s LYS 263 N 1.31 3.12 0.05 2.72 2.36 0.93 -4.66 119.74 125.58 2h3x s LYS 263 Ca 0.41 -0.91 -0.08 0.00 -2.55 0.00 0.00 55.97 52.84 2h3x s LYS 263 Cb -0.18 -3.88 -0.05 0.00 -1.05 0.00 0.00 37.83 32.67 2h3x s LYS 263 CO 0.18 -0.64 0.34 0.14 1.55 0.00 0.00 175.35 176.92 2h3x s VAL 264 N 1.67 5.18 0.20 4.02 -7.23 -1.26 -0.19 120.40 122.79 2h3x s VAL 264 Ca 0.05 0.31 -0.11 0.00 -1.81 0.00 0.00 61.98 60.43 2h3x s VAL 264 Cb -0.18 -3.61 -0.00 0.00 0.56 0.00 0.00 36.38 33.14 2h3x s VAL 264 CO 0.10 0.31 0.37 -0.62 -0.31 0.00 0.00 175.10 174.95 2h3x s ASP 265 N -1.76 -0.04 0.00 4.85 3.68 -0.36 -5.00 116.67 118.04 2h3x s ASP 265 Ca 0.31 -0.88 0.00 0.00 2.13 0.00 0.00 52.55 54.11 2h3x s ASP 265 Cb -0.14 0.50 0.00 0.00 -1.45 0.00 0.00 42.92 41.84 2h3x s ASP 265 CO 0.18 -1.00 0.00 0.61 0.13 0.00 0.00 175.17 175.09 2h3x n GLY 266 N -0.29 2.82 3.89 2.66 0.00 -1.26 -1.28 105.19 111.72 2h3x n GLY 266 Ca -0.05 -2.02 -0.22 0.00 0.00 0.00 0.00 46.02 43.73 2h3x n GLY 266 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2h3x s PRO 267 N -2.09 2.44 0.02 1.61 0.04 -1.26 -5.02 135.00 130.74 2h3x s PRO 267 Ca 0.00 -1.67 0.02 0.00 0.04 0.00 0.00 61.00 59.40 2h3x s PRO 267 Cb 0.00 -2.32 -0.02 0.00 0.04 0.00 0.00 34.50 32.20 2h3x s PRO 267 CO 0.00 -0.35 -0.08 1.67 0.04 0.00 0.00 177.00 178.28 2h3x s TRP 268 N -2.56 0.70 0.14 0.56 1.48 -1.06 -4.87 118.94 113.33 2h3x s TRP 268 Ca 0.46 -0.30 -0.20 0.00 -1.06 0.00 0.00 56.10 55.00 2h3x s TRP 268 Cb -0.03 -0.43 -0.07 0.00 -1.16 0.00 0.00 33.47 31.78 2h3x s TRP 268 CO 0.27 -0.03 0.64 0.45 -4.06 0.00 0.00 176.95 174.22 2h3x s SER 269 N -0.89 7.08 0.00 -2.66 0.15 -1.26 -0.41 113.70 115.71 2h3x s SER 269 Ca -0.03 1.33 0.28 0.00 0.70 0.00 0.00 55.95 58.24 2h3x s SER 269 Cb -0.06 -2.39 1.12 0.00 -1.71 0.00 0.00 66.02 62.98 2h3x s SER 269 CO 0.00 0.17 1.84 0.18 1.20 0.00 0.00 173.24 176.63 2h3x n LEU 270 N 1.29 0.12 -4.80 3.45 4.77 -0.65 -4.87 117.00 116.31 2h3x n LEU 270 Ca -0.07 0.36 -0.35 0.00 -0.03 0.00 0.00 56.01 55.93 2h3x n LEU 270 Cb 0.51 -0.42 -0.07 0.00 -2.33 0.00 0.00 43.42 41.11 2h3x n LEU 270 CO 0.43 0.03 -0.23 -0.76 -1.33 0.00 0.00 177.39 175.53 2h3x s LEU 271 N -2.94 4.02 0.30 2.23 1.43 -1.26 -4.89 118.68 117.57 2h3x s LEU 271 Ca 0.15 0.27 0.07 0.00 -1.03 0.00 0.00 54.13 53.59 2h3x s LEU 271 Cb 0.19 -2.12 -0.03 0.00 0.03 0.00 0.00 46.19 44.26 2h3x s LEU 271 CO 0.55 0.34 0.32 0.54 0.23 0.00 0.00 176.35 178.34 2h3x s ASN 272 N -1.30 5.67 0.39 2.29 2.20 -1.26 -4.90 114.94 118.03 2h3x s ASN 272 Ca 0.18 -0.27 0.21 0.00 -0.94 0.00 0.00 52.86 52.04 2h3x s ASN 272 Cb -0.12 -1.29 1.19 0.00 -2.00 0.00 0.00 41.25 39.03 2h3x s ASN 272 CO 0.08 -0.24 1.69 0.44 -2.94 0.00 0.00 177.10 176.14 2h3x h ASP 273 N 1.22 0.41 -0.31 3.54 3.45 -1.99 0.23 116.42 122.98 2h3x h ASP 273 Ca -0.47 0.13 -0.01 0.00 0.43 0.00 0.00 57.03 57.11 2h3x h ASP 273 Cb 1.25 0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 40.08 2h3x h ASP 273 CO 0.58 -0.06 0.14 -0.08 -1.57 0.00 0.00 179.24 178.25 2h3x h GLU 274 N 0.29 0.45 -0.45 3.56 4.81 -2.00 -2.20 114.58 119.04 2h3x h GLU 274 Ca 0.70 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.84 2h3x h GLU 274 Cb 1.87 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 31.15 2h3x h GLU 274 CO -0.43 0.44 0.20 -0.44 -0.73 0.00 0.00 179.01 178.05 2h3x h ASP 275 N 0.35 0.61 -0.49 1.04 3.32 -0.97 -2.62 116.42 117.67 2h3x h ASP 275 Ca 0.10 -0.15 0.04 0.00 0.02 0.00 0.00 57.03 57.04 2h3x h ASP 275 Cb 0.15 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.51 2h3x h ASP 275 CO -0.01 0.60 0.33 0.11 -1.72 0.00 0.00 179.24 178.55 2h3x h LYS 276 N 0.59 0.49 -0.62 3.56 1.57 -1.06 -1.42 116.57 119.68 2h3x h LYS 276 Ca 0.15 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.81 2h3x h LYS 276 Cb 0.17 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 2h3x h LYS 276 CO -0.02 0.32 0.02 0.00 -0.57 0.00 0.00 179.45 179.21 2h3x h ALA 277 N 1.72 0.85 0.00 3.86 0.00 -1.02 -1.93 119.26 122.74 2h3x h ALA 277 Ca 0.21 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2h3x h ALA 277 Cb 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2h3x h ALA 277 CO -0.05 0.67 0.00 1.63 0.00 0.00 0.00 179.25 181.50 2h3x n LYS 278 N -4.18 0.01 -3.11 0.00 4.76 -0.69 -4.92 118.16 110.03 2h3x n LYS 278 Ca 0.03 0.07 -0.14 0.00 -2.87 0.00 0.00 58.31 55.40 2h3x n LYS 278 Cb 0.34 -1.51 0.06 0.00 -1.84 0.00 0.00 35.03 32.08 2h3x n LYS 278 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2h3x n ASN 279 N -1.52 -3.71 -4.75 4.39 3.02 -0.62 -0.79 115.26 111.28 2h3x n ASN 279 Ca 0.06 -0.38 -0.41 0.00 -0.03 0.00 0.00 54.58 53.82 2h3x n ASN 279 Cb 0.30 -3.53 -0.04 0.00 -0.61 0.00 0.00 39.78 35.90 2h3x n ASN 279 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2h3x s TRP 280 N -3.22 3.51 0.12 3.10 0.52 -1.02 -0.27 118.94 121.67 2h3x s TRP 280 Ca 0.23 1.60 -0.12 0.00 0.02 0.00 0.00 56.10 57.83 2h3x s TRP 280 Cb -0.10 -3.35 0.01 0.00 -1.15 0.00 0.00 33.47 28.88 2h3x s TRP 280 CO 0.48 -0.81 0.29 0.14 0.02 0.00 0.00 176.95 177.07 2h3x s VAL 281 N -0.76 0.10 0.62 4.03 -7.23 -0.74 -4.79 120.40 111.63 2h3x s VAL 281 Ca 0.47 -0.96 -0.15 0.00 -1.81 0.00 0.00 61.98 59.54 2h3x s VAL 281 Cb -0.32 -1.34 -0.02 0.00 0.56 0.00 0.00 36.38 35.25 2h3x s VAL 281 CO 0.40 -0.46 1.07 -2.84 -0.31 0.00 0.00 175.10 172.96 2h3x s PRO 282 N -3.85 3.14 -0.19 4.82 0.02 -1.26 -1.67 135.00 136.01 2h3x s PRO 282 Ca 0.06 1.20 -0.21 0.00 0.02 0.00 0.00 61.00 62.07 2h3x s PRO 282 Cb 0.03 -2.01 0.06 0.00 0.02 0.00 0.00 34.50 32.60 2h3x s PRO 282 CO -0.10 -0.95 0.57 0.20 -0.33 0.00 0.00 177.00 176.39 2h3x s GLY 283 N -2.91 -0.43 0.00 0.52 0.00 0.07 -4.69 107.32 99.88 2h3x s GLY 283 Ca 0.63 1.52 0.00 0.00 0.00 0.00 0.00 44.72 46.87 2h3x s GLY 283 CO 0.41 1.29 0.00 0.61 0.00 0.00 0.00 173.10 175.41 2h3x n GLY 284 N 2.54 0.90 0.00 0.20 0.00 -0.50 -4.54 105.19 103.79 2h3x n GLY 284 Ca -0.14 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 43.92 2h3x n GLY 284 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2h3x n TYR 285 N 7.50 0.00 -1.99 1.61 4.02 -0.09 -4.47 117.16 123.75 2h3x n TYR 285 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.47 2h3x n TYR 285 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 2h3x n TYR 285 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2h3x n ASN 286 N -0.36 4.94 0.01 7.72 3.02 -1.22 -4.61 115.26 124.75 2h3x n ASN 286 Ca 0.00 -2.96 0.13 0.00 -0.03 0.00 0.00 54.58 51.72 2h3x n ASN 286 Cb 0.00 -1.56 0.43 0.00 -0.61 0.00 0.00 39.78 38.05 2h3x n ASN 286 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2h3x n LEU 287 N 4.70 0.28 -4.45 3.41 -0.00 -1.26 -0.78 117.00 118.90 2h3x n LEU 287 Ca 0.49 0.28 -0.24 0.00 -0.00 0.00 0.00 56.01 56.54 2h3x n LEU 287 Cb 0.36 -0.37 -0.10 0.00 -0.00 0.00 0.00 43.42 43.31 2h3x n LEU 287 CO 0.85 0.04 -0.48 0.68 -0.00 0.00 0.00 177.39 178.48 2h3x s VAL 288 N -3.01 2.41 -0.00 1.47 -7.23 -1.26 -2.78 120.40 109.99 2h3x s VAL 288 Ca 0.12 -2.35 -0.22 0.00 -1.81 0.00 0.00 61.98 57.72 2h3x s VAL 288 Cb 0.18 -2.26 0.05 0.00 0.56 0.00 0.00 36.38 34.91 2h3x s VAL 288 CO 0.61 -0.38 0.49 -0.83 -0.31 0.00 0.00 175.10 174.69 2h3x s GLY 289 N -3.39 -0.37 -0.09 2.32 0.00 -0.85 -4.82 107.32 100.13 2h3x s GLY 289 Ca 0.28 0.70 0.00 0.00 0.00 0.00 0.00 44.72 45.70 2h3x s GLY 289 CO 0.14 0.41 -0.07 -2.27 0.00 0.00 0.00 173.10 171.31 2h3x s LEU 290 N -1.55 1.19 -0.77 0.66 2.96 -1.26 -0.38 118.68 119.54 2h3x s LEU 290 Ca -0.09 -0.24 -0.20 0.00 -0.22 0.00 0.00 54.13 53.37 2h3x s LEU 290 Cb -0.02 -0.72 0.11 0.00 0.50 0.00 0.00 46.19 46.06 2h3x s LEU 290 CO 0.04 -0.09 0.98 -2.28 -1.32 0.00 0.00 176.35 173.67 2h3x s HIS 291 N 1.45 2.96 0.24 5.38 5.65 -0.14 -4.90 115.29 125.95 2h3x s HIS 291 Ca -0.01 -1.04 -0.05 0.00 0.25 0.00 0.00 55.06 54.21 2h3x s HIS 291 Cb -0.13 -4.22 0.46 0.00 -1.18 0.00 0.00 32.58 27.51 2h3x s HIS 291 CO -0.04 -1.49 1.69 0.00 -0.65 0.00 0.00 174.74 174.24 2h3x h ARG 292 N 9.12 0.27 0.00 2.88 3.08 -1.87 0.16 114.38 128.02 2h3x h ARG 292 Ca -0.09 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 2h3x h ARG 292 Cb 1.05 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 31.04 2h3x h ARG 292 CO 1.12 0.18 -0.00 0.00 -1.07 0.00 0.00 179.97 180.20 2h3x h ALA 293 N 1.61 1.10 0.00 0.04 0.00 -1.93 -3.10 119.26 116.98 2h3x h ALA 293 Ca 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 2h3x h ALA 293 Cb 0.70 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2h3x h ALA 293 CO -0.50 0.00 -0.92 -1.13 0.00 0.00 0.00 179.25 176.70 2h3x n SER 294 N -3.23 4.03 0.00 0.00 3.41 -0.70 -5.00 113.62 112.12 2h3x n SER 294 Ca -0.03 -0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 2h3x n SER 294 Cb 0.09 1.05 0.00 0.00 -0.26 0.00 0.00 64.21 65.09 2h3x n SER 294 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2h3x n GLY 295 N 2.22 0.63 3.71 5.00 0.00 0.50 -4.88 105.19 112.37 2h3x n GLY 295 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2h3x n GLY 295 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2h3x s ARG 296 N -0.08 4.58 -0.08 1.61 0.52 -1.19 -1.40 118.95 122.92 2h3x s ARG 296 Ca 0.00 1.44 0.00 0.00 -0.52 0.00 0.00 55.73 56.65 2h3x s ARG 296 Cb 0.00 -3.44 -0.03 0.00 0.52 0.00 0.00 34.95 32.00 2h3x s ARG 296 CO 0.00 -0.00 -0.06 1.41 0.02 0.00 0.00 175.30 176.67 2h3x s MET 297 N 0.79 2.89 -0.10 3.54 -2.45 0.19 -0.96 119.30 123.19 2h3x s MET 297 Ca 0.51 -0.54 -0.01 0.00 -1.25 0.00 0.00 55.69 54.40 2h3x s MET 297 Cb -0.22 -2.64 -0.03 0.00 1.25 0.00 0.00 34.83 33.19 2h3x s MET 297 CO 0.29 0.60 -0.06 0.71 1.05 0.00 0.00 175.02 177.61 2h3x s TYR 298 N -0.64 2.97 -0.01 4.11 1.51 0.49 0.39 117.35 126.17 2h3x s TYR 298 Ca 0.10 -0.13 -0.00 0.00 -1.01 0.00 0.00 57.07 56.02 2h3x s TYR 298 Cb -0.12 -1.81 0.01 0.00 -0.11 0.00 0.00 41.96 39.93 2h3x s TYR 298 CO 0.02 0.17 0.01 0.08 -1.11 0.00 0.00 175.55 174.72 2h3x s VAL 299 N -0.32 -0.02 -0.12 0.71 1.01 0.43 -2.01 120.40 120.09 2h3x s VAL 299 Ca 0.05 0.08 -0.28 0.00 0.00 0.00 0.00 61.98 61.83 2h3x s VAL 299 Cb -0.13 -0.04 -0.02 0.00 0.00 0.00 0.00 36.38 36.20 2h3x s VAL 299 CO 0.02 0.03 0.93 -0.36 0.00 0.00 0.00 175.10 175.73 2h3x s PHE 300 N 0.39 3.50 0.21 5.22 2.99 -1.12 -0.11 117.98 129.05 2h3x s PHE 300 Ca -0.03 1.47 0.06 0.00 0.00 0.00 0.00 56.93 58.43 2h3x s PHE 300 Cb -0.05 -3.11 -0.05 0.00 0.00 0.00 0.00 43.02 39.82 2h3x s PHE 300 CO -0.01 -0.20 -0.10 -1.64 -0.00 0.00 0.00 175.22 173.28 2h3x s MET 301 N 1.92 1.30 -0.05 0.44 -1.94 -0.30 -0.75 119.30 119.92 2h3x s MET 301 Ca 0.45 -1.60 -0.21 0.00 -1.71 0.00 0.00 55.69 52.62 2h3x s MET 301 Cb -0.18 -0.92 0.04 0.00 2.01 0.00 0.00 34.83 35.79 2h3x s MET 301 CO 0.17 0.09 0.46 -3.38 -0.01 0.00 0.00 175.02 172.35 2h3x s HIS 302 N -3.14 -0.39 0.76 -0.03 -3.43 -0.67 0.03 115.29 108.41 2h3x s HIS 302 Ca 0.23 0.70 -0.08 0.00 -0.80 0.00 0.00 55.06 55.10 2h3x s HIS 302 Cb 0.02 0.22 0.09 0.00 -1.43 0.00 0.00 32.58 31.47 2h3x s HIS 302 CO 0.06 -0.45 1.08 -1.25 -2.00 0.00 0.00 174.74 172.18 2h3x s PRO 303 N -1.09 1.91 -1.51 -0.38 0.04 -1.26 -1.79 135.00 130.92 2h3x s PRO 303 Ca -0.11 -0.28 -0.13 0.00 0.04 0.00 0.00 61.00 60.52 2h3x s PRO 303 Cb -0.03 -2.10 0.08 0.00 0.04 0.00 0.00 34.50 32.49 2h3x s PRO 303 CO 0.06 -1.48 0.97 -0.25 0.04 0.00 0.00 177.00 176.34 2h3x n ASP 304 N -3.10 -4.56 -4.76 6.66 8.00 0.03 -4.88 116.55 113.94 2h3x n ASP 304 Ca 0.09 -0.78 -0.33 0.00 0.71 0.00 0.00 54.79 54.49 2h3x n ASP 304 Cb 0.60 -3.92 0.06 0.00 -0.02 0.00 0.00 41.12 37.85 2h3x n ASP 304 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2h3x s GLY 305 N -3.39 2.06 0.02 0.44 0.00 0.63 -5.03 107.32 102.04 2h3x s GLY 305 Ca 0.61 0.52 -0.28 0.00 0.00 0.00 0.00 44.72 45.57 2h3x s GLY 305 CO 0.83 0.88 1.23 -1.59 0.00 0.00 0.00 173.10 174.44 2h3x s LYS 306 N -4.26 0.58 -0.00 2.90 -2.85 -1.26 -4.95 119.74 109.88 2h3x s LYS 306 Ca 0.66 -0.34 -0.37 0.00 -1.00 0.00 0.00 55.97 54.92 2h3x s LYS 306 Cb -0.21 0.18 -0.16 0.00 -2.06 0.00 0.00 37.83 35.59 2h3x s LYS 306 CO 0.45 -0.27 1.50 -1.91 0.10 0.00 0.00 175.35 175.23 2h3x n GLU 307 N -0.62 1.35 -0.31 1.78 4.07 -1.26 -2.02 120.64 123.63 2h3x n GLU 307 Ca -0.05 0.49 0.00 0.00 -0.06 0.00 0.00 57.16 57.54 2h3x n GLU 307 Cb 0.61 -2.17 0.00 0.00 -0.06 0.00 0.00 31.44 29.82 2h3x n GLU 307 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2h3x n GLY 308 N 3.16 0.80 0.40 8.31 0.00 -1.26 -4.96 105.19 111.64 2h3x n GLY 308 Ca 0.20 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.26 2h3x n GLY 308 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2h3x n THR 309 N -2.24 1.09 0.29 2.61 -2.24 -0.86 -4.68 114.28 108.24 2h3x n THR 309 Ca 0.00 -1.08 0.03 0.00 -2.27 0.00 0.00 64.05 60.73 2h3x n THR 309 Cb 0.00 0.44 0.15 0.00 -2.10 0.00 0.00 70.33 68.82 2h3x n THR 309 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h3x n HIS 310 N 0.03 0.00 -0.62 4.78 1.44 -1.26 -1.71 115.22 117.88 2h3x n HIS 310 Ca 0.08 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.82 2h3x n HIS 310 Cb 0.39 -0.22 0.04 0.00 0.12 0.00 0.00 29.99 30.32 2h3x n HIS 310 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 2h3x n LYS 311 N -1.22 1.84 -1.59 -1.40 5.02 -1.26 -1.40 118.16 118.14 2h3x n LYS 311 Ca 0.03 -1.67 -0.34 0.00 -2.02 0.00 0.00 58.31 54.32 2h3x n LYS 311 Cb 0.04 -1.05 0.07 0.00 -0.02 0.00 0.00 35.03 34.07 2h3x n LYS 311 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2h3x s PHE 312 N -1.38 2.31 0.60 2.13 0.40 -0.69 -4.24 117.98 117.10 2h3x s PHE 312 Ca 0.10 1.58 -0.19 0.00 -0.60 0.00 0.00 56.93 57.82 2h3x s PHE 312 Cb 0.09 -3.34 -0.03 0.00 0.51 0.00 0.00 43.02 40.25 2h3x s PHE 312 CO 0.01 -2.19 1.25 -2.14 0.70 0.00 0.00 175.22 172.85 2h3x s PRO 313 N -3.96 2.92 0.05 0.24 0.02 -1.26 -3.50 135.00 129.50 2h3x s PRO 313 Ca 0.71 1.94 -0.31 0.00 0.02 0.00 0.00 61.00 63.36 2h3x s PRO 313 Cb -0.25 -1.97 -0.06 0.00 0.02 0.00 0.00 34.50 32.24 2h3x s PRO 313 CO 0.43 -1.28 1.30 0.00 -0.33 0.00 0.00 177.00 177.12 2h3x s ALA 314 N -1.50 3.50 0.03 -1.55 0.00 -0.04 -4.81 121.76 117.40 2h3x s ALA 314 Ca 0.78 0.90 -0.06 0.00 0.00 0.00 0.00 51.96 53.57 2h3x s ALA 314 Cb -0.33 -3.52 -0.30 0.00 0.00 0.00 0.00 23.12 18.97 2h3x s ALA 314 CO 0.37 -0.65 0.95 0.00 0.00 0.00 0.00 175.76 176.43 2h3x h ALA 315 N 7.15 0.13 -2.71 0.00 0.00 -0.74 -2.45 119.26 120.64 2h3x h ALA 315 Ca -0.40 -1.00 -0.12 0.00 0.00 0.00 0.00 54.91 53.39 2h3x h ALA 315 Cb 1.20 0.19 -0.12 0.00 0.00 0.00 0.00 17.79 19.06 2h3x h ALA 315 CO 0.86 1.00 -0.32 -1.21 0.00 0.00 0.00 179.25 179.57 2h3x s GLU 316 N -2.62 1.35 -0.19 0.00 2.02 -0.80 -0.81 118.70 117.66 2h3x s GLU 316 Ca -0.08 -1.36 -0.00 0.00 0.02 0.00 0.00 54.97 53.55 2h3x s GLU 316 Cb 0.06 0.39 0.01 0.00 0.10 0.00 0.00 34.13 34.69 2h3x s GLU 316 CO 0.88 -0.51 -0.15 0.42 0.02 0.00 0.00 175.26 175.92 2h3x s ILE 317 N -4.05 2.53 -0.10 -1.63 1.01 0.72 -1.15 121.20 118.53 2h3x s ILE 317 Ca 0.26 -0.79 -0.10 0.00 0.00 0.00 0.00 60.65 60.03 2h3x s ILE 317 Cb 0.03 -2.10 -0.05 0.00 0.01 0.00 0.00 42.46 40.36 2h3x s ILE 317 CO 0.08 0.50 0.22 0.26 0.00 0.00 0.00 174.94 176.00 2h3x s TRP 318 N 1.25 3.60 -0.28 3.97 0.52 0.84 -2.07 118.94 126.78 2h3x s TRP 318 Ca 0.03 0.63 -0.03 0.00 0.02 0.00 0.00 56.10 56.75 2h3x s TRP 318 Cb -0.14 -2.08 0.03 0.00 -1.15 0.00 0.00 33.47 30.13 2h3x s TRP 318 CO -0.08 0.64 0.00 0.08 0.02 0.00 0.00 176.95 177.61 2h3x s VAL 319 N -0.80 3.27 0.03 4.03 1.01 0.14 -0.43 120.40 127.64 2h3x s VAL 319 Ca 0.17 -1.02 0.01 0.00 0.00 0.00 0.00 61.98 61.14 2h3x s VAL 319 Cb -0.13 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 2h3x s VAL 319 CO 0.06 0.07 0.05 -0.04 0.00 0.00 0.00 175.10 175.24 2h3x s MET 320 N 1.36 2.89 -0.48 2.72 -1.94 0.16 -0.82 119.30 123.19 2h3x s MET 320 Ca -0.00 -0.61 -0.17 0.00 -1.71 0.00 0.00 55.69 53.20 2h3x s MET 320 Cb -0.18 -2.74 0.06 0.00 2.01 0.00 0.00 34.83 33.98 2h3x s MET 320 CO -0.01 0.61 0.49 0.34 -0.01 0.00 0.00 175.02 176.43 2h3x s ASP 321 N -1.90 6.18 0.60 3.03 -1.08 -0.10 0.54 116.67 123.94 2h3x s ASP 321 Ca 0.24 -1.10 0.34 0.00 -0.52 0.00 0.00 52.55 51.51 2h3x s ASP 321 Cb -0.12 -2.23 1.95 0.00 -1.46 0.00 0.00 42.92 41.06 2h3x s ASP 321 CO 0.15 -0.73 2.26 0.71 0.52 0.00 0.00 175.17 178.08 2h3x h THR 322 N 5.79 0.35 0.27 1.71 1.35 -1.55 0.52 112.91 121.35 2h3x h THR 322 Ca -0.28 -0.10 -0.01 0.00 -0.55 0.00 0.00 66.41 65.47 2h3x h THR 322 Cb 1.10 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 2h3x h THR 322 CO 0.90 0.02 -0.13 0.11 -0.25 0.00 0.00 175.52 176.17 2h3x h LYS 323 N 0.00 -0.35 -0.01 4.72 1.57 -1.91 -3.32 116.57 117.28 2h3x h LYS 323 Ca -0.00 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2h3x h LYS 323 Cb 0.07 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2h3x h LYS 323 CO 0.00 0.00 -0.30 0.25 -0.57 0.00 0.00 179.45 178.83 2h3x n THR 324 N -5.04 0.00 -3.50 -0.16 -2.24 -1.14 -4.97 114.28 97.23 2h3x n THR 324 Ca -0.08 -0.15 -0.23 0.00 -2.27 0.00 0.00 64.05 61.32 2h3x n THR 324 Cb 0.26 0.55 0.07 0.00 -2.10 0.00 0.00 70.33 69.11 2h3x n THR 324 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2h3x n LYS 325 N -0.56 -7.45 -4.18 -0.78 5.02 0.18 -5.01 118.16 105.38 2h3x n LYS 325 Ca 0.11 0.82 -0.19 0.00 -2.02 0.00 0.00 58.31 57.04 2h3x n LYS 325 Cb 0.37 -5.78 -0.12 0.00 -0.02 0.00 0.00 35.03 29.47 2h3x n LYS 325 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2h3x s GLN 326 N -6.21 0.85 -0.11 1.97 -0.21 -1.16 -4.93 119.66 109.85 2h3x s GLN 326 Ca 0.54 -0.98 -0.30 0.00 0.02 0.00 0.00 55.36 54.64 2h3x s GLN 326 Cb -0.24 -0.86 -0.02 0.00 1.00 0.00 0.00 33.01 32.89 2h3x s GLN 326 CO 0.67 0.19 1.15 0.50 -2.12 0.00 0.00 175.29 175.68 2h3x s ARG 327 N -1.81 4.33 -0.01 2.91 3.52 -1.26 -0.92 118.95 125.71 2h3x s ARG 327 Ca -0.01 1.57 0.18 0.00 -0.13 0.00 0.00 55.73 57.35 2h3x s ARG 327 Cb -0.10 -3.61 -0.25 0.00 -1.56 0.00 0.00 34.95 29.44 2h3x s ARG 327 CO 0.02 -0.50 0.57 1.33 -0.81 0.00 0.00 175.30 175.92 2h3x n VAL 328 N 4.85 0.00 -3.52 7.11 0.24 -0.00 -4.95 118.33 122.05 2h3x n VAL 328 Ca 0.11 -0.27 -0.11 0.00 -2.04 0.00 0.00 64.34 62.03 2h3x n VAL 328 Cb 0.46 0.49 -0.04 0.00 -1.47 0.00 0.00 33.84 33.28 2h3x n VAL 328 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2h3x s ALA 329 N -3.04 -1.83 -0.13 2.33 0.00 -1.15 -4.83 121.76 113.11 2h3x s ALA 329 Ca -0.01 1.22 -0.07 0.00 0.00 0.00 0.00 51.96 53.10 2h3x s ALA 329 Cb 0.13 -0.00 0.05 0.00 0.00 0.00 0.00 23.12 23.30 2h3x s ALA 329 CO 0.77 -0.51 0.32 -0.98 0.00 0.00 0.00 175.76 175.35 2h3x s ARG 330 N -2.15 0.29 0.22 0.00 1.70 -1.26 -0.69 118.95 117.06 2h3x s ARG 330 Ca -0.01 0.64 -0.00 0.00 -0.47 0.00 0.00 55.73 55.89 2h3x s ARG 330 Cb -0.01 -0.07 -0.04 0.00 -0.57 0.00 0.00 34.95 34.26 2h3x s ARG 330 CO -0.02 -0.16 0.12 0.96 -1.08 0.00 0.00 175.30 175.12 2h3x s ILE 331 N 1.30 0.16 0.39 4.99 -4.36 -0.88 -4.96 121.20 117.84 2h3x s ILE 331 Ca -0.09 -2.00 -0.26 0.00 -0.26 0.00 0.00 60.65 58.04 2h3x s ILE 331 Cb -0.09 -2.53 -0.11 0.00 1.25 0.00 0.00 42.46 40.98 2h3x s ILE 331 CO -0.10 -0.01 1.25 -2.65 0.24 0.00 0.00 174.94 173.67 2h3x n PRO 332 N -0.32 1.93 0.10 0.37 -0.02 -1.26 -0.20 135.00 135.60 2h3x n PRO 332 Ca 0.01 0.68 0.12 0.00 -2.02 0.00 0.00 63.50 62.30 2h3x n PRO 332 Cb 0.66 -2.32 0.13 0.00 -0.02 0.00 0.00 33.50 31.95 2h3x n PRO 332 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2h3x h GLY 333 N 2.20 0.00 -3.37 -1.23 0.00 -1.12 -3.38 103.07 96.18 2h3x h GLY 333 Ca -0.47 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 46.56 2h3x h GLY 333 CO 0.61 0.00 -0.38 0.54 0.00 0.00 0.00 176.54 177.31 2h3x n ARG 334 N -2.44 -1.99 -1.88 4.80 1.74 -1.25 -1.41 116.66 114.23 2h3x n ARG 334 Ca 0.02 0.74 -0.18 0.00 -0.77 0.00 0.00 57.85 57.67 2h3x n ARG 334 Cb 0.49 -5.34 -0.05 0.00 -1.02 0.00 0.00 32.46 26.55 2h3x n ARG 334 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2h3x n ASP 335 N -1.77 -5.14 -4.73 0.55 8.00 -0.92 -4.85 116.55 107.69 2h3x n ASP 335 Ca -0.18 0.23 -0.32 0.00 0.71 0.00 0.00 54.79 55.24 2h3x n ASP 335 Cb 0.62 -4.21 0.11 0.00 -0.02 0.00 0.00 41.12 37.63 2h3x n ASP 335 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2h3x s ALA 336 N -2.76 2.00 0.00 2.24 0.00 -0.50 -4.19 121.76 118.56 2h3x s ALA 336 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 51.96 52.45 2h3x s ALA 336 Cb 0.00 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.75 2h3x s ALA 336 CO 0.00 -2.06 0.00 1.28 0.00 0.00 0.00 175.76 174.98 2h3x n LEU 337 N -3.52 0.00 -4.00 0.00 4.77 0.66 -0.86 117.00 114.06 2h3x n LEU 337 Ca 0.11 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.00 2h3x n LEU 337 Cb 0.52 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.51 2h3x n LEU 337 CO 0.51 0.00 -0.33 -0.44 -1.33 0.00 0.00 177.39 175.80 2h3x s SER 338 N -1.59 0.30 0.34 -1.43 0.01 -0.80 -0.91 113.70 109.61 2h3x s SER 338 Ca 0.00 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 56.61 2h3x s SER 338 Cb 0.00 0.16 -0.01 0.00 0.21 0.00 0.00 66.02 66.38 2h3x s SER 338 CO 0.00 -0.44 0.42 0.00 0.41 0.00 0.00 173.24 173.63 2h3x s MET 339 N -2.45 1.85 -0.19 12.44 0.23 0.04 0.99 119.30 132.22 2h3x s MET 339 Ca -0.07 -1.82 -0.28 0.00 -1.03 0.00 0.00 55.69 52.49 2h3x s MET 339 Cb -0.03 0.41 0.11 0.00 -1.53 0.00 0.00 34.83 33.79 2h3x s MET 339 CO -0.04 -0.75 0.91 -0.08 -2.03 0.00 0.00 175.02 173.03 2h3x s THR 340 N -3.18 0.00 0.08 3.16 -1.32 -0.22 -4.80 115.64 109.35 2h3x s THR 340 Ca 0.33 0.00 0.07 0.00 -1.21 0.00 0.00 61.69 60.88 2h3x s THR 340 Cb 0.00 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.96 2h3x s THR 340 CO 0.22 0.00 -0.13 -0.63 -2.21 0.00 0.00 174.62 171.87 2h3x s ILE 341 N -0.52 3.18 -0.30 5.08 -1.09 -1.26 -1.04 121.20 125.25 2h3x s ILE 341 Ca -0.02 -1.21 0.03 0.00 -2.23 0.00 0.00 60.65 57.22 2h3x s ILE 341 Cb -0.02 -2.43 0.08 0.00 -1.58 0.00 0.00 42.46 38.50 2h3x s ILE 341 CO 0.01 0.21 -0.03 -0.62 -1.23 0.00 0.00 174.94 173.28 2h3x s ASP 342 N -1.89 4.61 0.15 3.58 -1.08 -0.29 -4.94 116.67 116.81 2h3x s ASP 342 Ca 0.18 -1.77 -0.17 0.00 -0.52 0.00 0.00 52.55 50.28 2h3x s ASP 342 Cb -0.11 -1.59 0.03 0.00 -1.46 0.00 0.00 42.92 39.79 2h3x s ASP 342 CO 0.10 -0.28 1.77 1.56 0.52 0.00 0.00 175.17 178.83 2h3x h GLN 343 N 7.70 0.30 -0.27 4.34 1.08 -1.92 0.12 115.11 126.45 2h3x h GLN 343 Ca -0.12 -0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.09 2h3x h GLN 343 Cb 1.03 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 28.37 2h3x h GLN 343 CO 0.49 0.20 0.09 1.96 -0.95 0.00 0.00 178.83 180.62 2h3x h GLN 344 N 0.31 0.21 -0.02 1.46 1.08 -1.95 -3.03 115.11 113.17 2h3x h GLN 344 Ca 0.14 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.33 2h3x h GLN 344 Cb 0.08 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 2h3x h GLN 344 CO -0.11 0.14 -0.17 0.54 -0.95 0.00 0.00 178.83 178.27 2h3x n ARG 345 N -5.03 1.58 -3.40 1.46 3.00 -1.22 -4.98 116.66 108.08 2h3x n ARG 345 Ca -0.01 -1.17 -0.17 0.00 -0.01 0.00 0.00 57.85 56.49 2h3x n ARG 345 Cb 0.09 -1.48 0.08 0.00 0.00 0.00 0.00 32.46 31.15 2h3x n ARG 345 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2h3x n ASN 346 N 0.31 -3.72 -4.42 0.55 3.02 -0.01 -4.88 115.26 106.11 2h3x n ASN 346 Ca 0.14 -0.68 -0.26 0.00 -0.03 0.00 0.00 54.58 53.75 2h3x n ASN 346 Cb 0.46 -5.02 -0.11 0.00 -0.61 0.00 0.00 39.78 34.49 2h3x n ASN 346 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2h3x s LEU 347 N -6.04 2.47 -0.03 3.41 1.43 -0.97 -0.87 118.68 118.08 2h3x s LEU 347 Ca 0.18 -0.90 0.01 0.00 -1.03 0.00 0.00 54.13 52.39 2h3x s LEU 347 Cb -0.03 -1.12 0.01 0.00 0.03 0.00 0.00 46.19 45.09 2h3x s LEU 347 CO 0.74 0.09 -0.04 -0.32 0.23 0.00 0.00 176.35 177.05 2h3x s MET 348 N -2.87 0.56 -0.12 1.70 -2.45 -0.20 -1.13 119.30 114.79 2h3x s MET 348 Ca 0.22 -0.10 0.01 0.00 -1.25 0.00 0.00 55.69 54.58 2h3x s MET 348 Cb -0.07 -0.60 -0.01 0.00 1.25 0.00 0.00 34.83 35.40 2h3x s MET 348 CO 0.11 -0.02 -0.16 -0.51 1.05 0.00 0.00 175.02 175.49 2h3x s LEU 349 N 0.54 2.56 0.11 4.11 1.43 -0.20 0.02 118.68 127.25 2h3x s LEU 349 Ca -0.06 -0.38 0.08 0.00 -1.03 0.00 0.00 54.13 52.74 2h3x s LEU 349 Cb -0.10 -1.56 -0.04 0.00 0.03 0.00 0.00 46.19 44.52 2h3x s LEU 349 CO -0.00 0.17 -0.15 0.42 0.23 0.00 0.00 176.35 177.01 2h3x s THR 350 N 0.32 3.04 -0.05 5.49 -4.23 -0.71 -1.05 115.64 118.44 2h3x s THR 350 Ca -0.12 -1.42 0.00 0.00 -1.18 0.00 0.00 61.69 58.97 2h3x s THR 350 Cb -0.16 -2.40 0.02 0.00 1.34 0.00 0.00 72.50 71.30 2h3x s THR 350 CO 0.06 0.10 -0.03 -0.22 -0.54 0.00 0.00 174.62 174.00 2h3x s LEU 351 N -2.17 1.12 -0.02 4.79 2.96 0.28 -0.79 118.68 124.85 2h3x s LEU 351 Ca 0.19 -0.11 0.22 0.00 -0.22 0.00 0.00 54.13 54.21 2h3x s LEU 351 Cb -0.11 -0.44 0.65 0.00 0.50 0.00 0.00 46.19 46.79 2h3x s LEU 351 CO 0.11 -0.10 1.54 -0.90 -1.32 0.00 0.00 176.35 175.69 2h3x n ASP 352 N 4.37 3.99 0.00 3.68 5.68 -1.04 -0.24 116.55 132.98 2h3x n ASP 352 Ca -0.20 -2.06 0.00 0.00 -0.50 0.00 0.00 54.79 52.03 2h3x n ASP 352 Cb 0.51 -0.50 0.00 0.00 -1.14 0.00 0.00 41.12 39.99 2h3x n ASP 352 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2h3x n GLY 353 N 1.58 1.84 0.00 6.12 0.00 -1.21 -4.77 105.19 108.75 2h3x n GLY 353 Ca 0.24 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2h3x n GLY 353 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h3x n GLY 354 N 0.00 0.30 3.24 -0.02 0.00 -1.26 -0.24 105.19 107.21 2h3x n GLY 354 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2h3x n GLY 354 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2h3x s ASN 355 N -0.36 2.33 -0.11 1.61 0.01 -1.26 -0.85 114.94 116.31 2h3x s ASN 355 Ca 0.00 -0.57 -0.01 0.00 -0.71 0.00 0.00 52.86 51.58 2h3x s ASN 355 Cb 0.00 -0.16 -0.03 0.00 0.41 0.00 0.00 41.25 41.47 2h3x s ASN 355 CO 0.00 0.10 -0.08 -0.69 -1.51 0.00 0.00 177.10 174.92 2h3x s VAL 356 N -0.94 3.58 -0.14 1.60 1.01 0.05 -2.50 120.40 123.06 2h3x s VAL 356 Ca 0.06 -0.50 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 2h3x s VAL 356 Cb -0.09 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 2h3x s VAL 356 CO 0.02 0.55 -0.08 0.20 0.00 0.00 0.00 175.10 175.80 2h3x s ASN 357 N -0.20 4.46 -0.24 3.32 0.01 0.03 0.32 114.94 122.64 2h3x s ASN 357 Ca 0.02 -0.20 -0.10 0.00 -0.71 0.00 0.00 52.86 51.87 2h3x s ASN 357 Cb -0.13 -1.67 -0.04 0.00 0.41 0.00 0.00 41.25 39.82 2h3x s ASN 357 CO 0.03 0.18 0.14 -0.69 -1.51 0.00 0.00 177.10 175.24 2h3x s VAL 358 N 0.27 5.05 0.12 1.60 1.01 -0.18 -1.74 120.40 126.53 2h3x s VAL 358 Ca -0.06 0.07 0.10 0.00 0.00 0.00 0.00 61.98 62.09 2h3x s VAL 358 Cb -0.15 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 2h3x s VAL 358 CO 0.04 0.33 -0.23 -0.31 0.00 0.00 0.00 175.10 174.93 2h3x s TYR 359 N 1.27 2.03 -0.29 5.22 1.51 0.10 -0.62 117.35 126.56 2h3x s TYR 359 Ca 0.06 -0.40 -0.09 0.00 -1.01 0.00 0.00 57.07 55.63 2h3x s TYR 359 Cb -0.14 -1.10 -0.02 0.00 -0.11 0.00 0.00 41.96 40.59 2h3x s TYR 359 CO 0.06 0.28 0.14 0.34 -1.11 0.00 0.00 175.55 175.26 2h3x s ASP 360 N -2.03 5.54 -0.30 2.29 2.15 0.13 -1.03 116.67 123.43 2h3x s ASP 360 Ca 0.10 -0.39 0.08 0.00 0.43 0.00 0.00 52.55 52.78 2h3x s ASP 360 Cb -0.10 -2.01 0.47 0.00 -0.30 0.00 0.00 42.92 40.99 2h3x s ASP 360 CO 0.05 -0.14 1.38 2.30 -0.17 0.00 0.00 175.17 178.58 2h3x n ILE 361 N 4.98 2.54 0.20 4.11 -5.35 -0.05 -1.51 119.36 124.29 2h3x n ILE 361 Ca -0.14 -3.28 0.06 0.00 -0.27 0.00 0.00 62.75 59.12 2h3x n ILE 361 Cb 0.50 -0.57 0.39 0.00 -1.74 0.00 0.00 39.64 38.22 2h3x n ILE 361 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 2h3x h SER 362 N 1.37 0.00 -2.26 7.28 4.64 -1.90 -3.44 113.55 119.24 2h3x h SER 362 Ca 0.23 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 61.01 2h3x h SER 362 Cb 1.40 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.42 2h3x h SER 362 CO 0.47 0.34 -0.60 -1.10 -0.87 0.00 0.00 176.83 175.07 2h3x s GLN 363 N -3.76 2.55 0.23 4.77 -1.52 -1.26 -5.04 119.66 115.63 2h3x s GLN 363 Ca -0.01 -1.25 -0.11 0.00 -1.95 0.00 0.00 55.36 52.04 2h3x s GLN 363 Cb 0.12 -2.33 0.31 0.00 -0.22 0.00 0.00 33.01 30.88 2h3x s GLN 363 CO 0.68 0.39 1.62 -1.35 -0.25 0.00 0.00 175.29 176.37 2h3x h PRO 364 N 1.81 0.02 -5.70 2.91 0.11 -1.97 -3.37 132.00 125.81 2h3x h PRO 364 Ca -0.46 -0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.06 2h3x h PRO 364 Cb 1.24 -0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.26 2h3x h PRO 364 CO 0.60 0.01 0.08 -2.00 -0.21 0.00 0.00 178.00 176.48 2h3x s GLU 365 N -6.21 4.25 0.89 1.05 2.12 -1.26 -4.76 118.70 114.77 2h3x s GLU 365 Ca -0.14 0.61 -0.12 0.00 0.36 0.00 0.00 54.97 55.68 2h3x s GLU 365 Cb 0.21 -3.55 0.09 0.00 0.26 0.00 0.00 34.13 31.14 2h3x s GLU 365 CO 0.75 -0.16 0.90 -2.30 -0.54 0.00 0.00 175.26 173.91 2h3x n PRO 366 N 4.76 -0.22 -3.77 4.30 -0.02 -1.26 -4.90 135.00 133.90 2h3x n PRO 366 Ca -0.02 -0.00 -0.26 0.00 -2.02 0.00 0.00 63.50 61.20 2h3x n PRO 366 Cb 0.50 -2.20 -0.17 0.00 -0.02 0.00 0.00 33.50 31.61 2h3x n PRO 366 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2h3x s LYS 367 N -4.10 0.72 -0.26 -0.52 2.20 -0.57 -4.95 119.74 112.27 2h3x s LYS 367 Ca 0.65 -0.21 -0.29 0.00 -0.36 0.00 0.00 55.97 55.76 2h3x s LYS 367 Cb -0.25 -1.64 -0.01 0.00 -1.51 0.00 0.00 37.83 34.42 2h3x s LYS 367 CO 0.59 -0.48 1.45 -1.17 -0.36 0.00 0.00 175.35 175.38 2h3x s LEU 368 N 1.88 3.89 -0.21 5.43 2.96 -1.26 -0.69 118.68 130.69 2h3x s LEU 368 Ca 0.02 1.41 -0.21 0.00 -0.22 0.00 0.00 54.13 55.13 2h3x s LEU 368 Cb -0.15 -3.54 -0.19 0.00 0.50 0.00 0.00 46.19 42.81 2h3x s LEU 368 CO -0.07 -1.16 0.20 0.18 -1.32 0.00 0.00 176.35 174.19 2h3x n LEU 369 N 7.99 1.89 -3.69 -0.68 4.77 0.21 -4.99 117.00 122.49 2h3x n LEU 369 Ca 0.17 0.41 -0.09 0.00 -0.03 0.00 0.00 56.01 56.47 2h3x n LEU 369 Cb 0.46 -0.97 -0.02 0.00 -2.33 0.00 0.00 43.42 40.56 2h3x n LEU 369 CO 0.64 0.30 0.44 0.00 -1.33 0.00 0.00 177.39 177.44 2h3x s ARG 370 N -2.37 1.59 -0.06 3.23 1.70 -1.21 -5.02 118.95 116.81 2h3x s ARG 370 Ca -0.29 -0.80 0.02 0.00 -0.47 0.00 0.00 55.73 54.20 2h3x s ARG 370 Cb 0.06 0.60 0.01 0.00 -0.57 0.00 0.00 34.95 35.05 2h3x s ARG 370 CO 0.60 -0.72 -0.12 0.99 -1.08 0.00 0.00 175.30 174.96 2h3x s THR 371 N -3.86 1.13 -0.38 4.99 2.01 -1.26 -1.01 115.64 117.25 2h3x s THR 371 Ca 0.07 -0.48 -0.11 0.00 0.31 0.00 0.00 61.69 61.47 2h3x s THR 371 Cb -0.04 -1.03 0.03 0.00 0.01 0.00 0.00 72.50 71.47 2h3x s THR 371 CO -0.01 0.35 0.22 -0.63 -0.69 0.00 0.00 174.62 173.87 2h3x s ILE 372 N 0.60 4.65 0.15 1.82 1.01 0.15 -4.97 121.20 124.62 2h3x s ILE 372 Ca -0.13 -0.87 -0.15 0.00 0.00 0.00 0.00 60.65 59.50 2h3x s ILE 372 Cb -0.15 -3.61 -0.07 0.00 0.01 0.00 0.00 42.46 38.63 2h3x s ILE 372 CO 0.03 -0.27 0.57 -1.61 0.00 0.00 0.00 174.94 173.66 2h3x s GLU 373 N 1.56 4.02 -1.08 2.79 2.02 -1.26 -0.77 118.70 125.98 2h3x s GLU 373 Ca 0.02 0.54 -0.02 0.00 0.02 0.00 0.00 54.97 55.54 2h3x s GLU 373 Cb -0.19 -2.95 0.00 0.00 0.10 0.00 0.00 34.13 31.09 2h3x s GLU 373 CO 0.07 0.48 0.27 0.41 0.02 0.00 0.00 175.26 176.52 2h3x n GLY 374 N 0.87 -0.14 0.23 -1.39 0.00 -1.09 -4.89 105.19 98.78 2h3x n GLY 374 Ca -0.05 -0.22 0.11 0.00 0.00 0.00 0.00 46.02 45.85 2h3x n GLY 374 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h3x h ALA 375 N 0.66 1.02 -2.82 4.61 0.00 -1.16 -3.47 119.26 118.10 2h3x h ALA 375 Ca -0.34 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 54.48 2h3x h ALA 375 Cb 1.24 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 2h3x h ALA 375 CO 0.38 0.24 0.31 0.00 0.00 0.00 0.00 179.25 180.18 2h3x s ALA 376 N -3.64 -1.26 -0.21 0.00 0.00 -1.08 -4.85 121.76 110.72 2h3x s ALA 376 Ca 0.01 -0.28 -0.17 0.00 0.00 0.00 0.00 51.96 51.51 2h3x s ALA 376 Cb 0.10 0.77 -0.13 0.00 0.00 0.00 0.00 23.12 23.85 2h3x s ALA 376 CO 0.62 -1.03 -0.02 0.39 0.00 0.00 0.00 175.76 175.72 2h3x n GLU 377 N -0.49 0.54 -3.37 0.00 1.02 -1.26 -4.39 120.64 112.70 2h3x n GLU 377 Ca -0.05 0.48 -0.25 0.00 -0.02 0.00 0.00 57.16 57.32 2h3x n GLU 377 Cb 0.60 -1.66 -0.10 0.00 -0.02 0.00 0.00 31.44 30.26 2h3x n GLU 377 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2h3x s ALA 378 N -2.51 0.80 -0.04 0.62 0.00 -1.23 -4.54 121.76 114.85 2h3x s ALA 378 Ca -0.28 -1.96 0.07 0.00 0.00 0.00 0.00 51.96 49.79 2h3x s ALA 378 Cb 0.07 -1.72 -0.01 0.00 0.00 0.00 0.00 23.12 21.45 2h3x s ALA 378 CO 0.48 -2.05 -0.25 0.45 0.00 0.00 0.00 175.76 174.39 2h3x s SER 379 N 0.60 3.01 -0.06 0.00 0.15 0.67 -1.09 113.70 116.97 2h3x s SER 379 Ca 0.26 -0.48 0.09 0.00 0.70 0.00 0.00 55.95 56.52 2h3x s SER 379 Cb -0.07 -0.59 0.14 0.00 -1.71 0.00 0.00 66.02 63.80 2h3x s SER 379 CO -0.10 0.28 1.05 0.18 1.20 0.00 0.00 173.24 175.84 2h3x n LEU 380 N 2.71 1.93 -3.69 3.45 4.77 -1.26 -3.30 117.00 121.61 2h3x n LEU 380 Ca -0.17 -2.37 -0.10 0.00 -0.03 0.00 0.00 56.01 53.34 2h3x n LEU 380 Cb 0.52 -0.21 -0.10 0.00 -2.33 0.00 0.00 43.42 41.29 2h3x n LEU 380 CO 0.24 0.56 0.09 -1.58 -1.33 0.00 0.00 177.39 175.37 2h3x s GLN 381 N -1.81 0.44 0.02 3.23 0.74 -1.26 -4.57 119.66 116.44 2h3x s GLN 381 Ca 0.16 0.81 0.03 0.00 0.05 0.00 0.00 55.36 56.41 2h3x s GLN 381 Cb 0.14 0.03 -0.01 0.00 1.10 0.00 0.00 33.01 34.26 2h3x s GLN 381 CO 0.01 -0.15 -0.10 0.54 -0.55 0.00 0.00 175.29 175.05 2h3x s VAL 382 N 1.27 0.78 -0.02 1.34 0.11 -1.26 -1.78 120.40 120.84 2h3x s VAL 382 Ca -0.08 -0.67 -0.02 0.00 -2.93 0.00 0.00 61.98 58.28 2h3x s VAL 382 Cb -0.07 -0.70 0.01 0.00 -1.53 0.00 0.00 36.38 34.09 2h3x s VAL 382 CO -0.12 0.04 0.06 -1.10 -3.33 0.00 0.00 175.10 170.65 2h3x s GLN 383 N -0.70 0.05 0.53 1.54 -0.21 0.04 -4.65 119.66 116.26 2h3x s GLN 383 Ca 0.01 0.11 -0.17 0.00 0.02 0.00 0.00 55.36 55.33 2h3x s GLN 383 Cb -0.06 -0.02 -0.07 0.00 1.00 0.00 0.00 33.01 33.86 2h3x s GLN 383 CO 0.00 -0.04 1.02 -0.06 -2.12 0.00 0.00 175.29 174.09 2h3x s PHE 384 N 0.26 3.19 0.18 0.91 0.40 -1.26 0.95 117.98 122.61 2h3x s PHE 384 Ca -0.02 1.52 -0.30 0.00 -0.60 0.00 0.00 56.93 57.53 2h3x s PHE 384 Cb -0.03 -2.93 -0.08 0.00 0.51 0.00 0.00 43.02 40.50 2h3x s PHE 384 CO -0.01 -0.68 0.99 -1.58 0.70 0.00 0.00 175.22 174.63 2h3x s HIS 385 N -2.39 3.83 0.39 0.36 5.65 -0.36 -4.85 115.29 117.90 2h3x s HIS 385 Ca 0.62 1.80 -0.27 0.00 0.25 0.00 0.00 55.06 57.47 2h3x s HIS 385 Cb -0.13 -3.08 -0.09 0.00 -1.18 0.00 0.00 32.58 28.09 2h3x s HIS 385 CO 0.29 0.11 1.33 -2.14 -0.65 0.00 0.00 174.74 173.68 2h3x s PRO 386 N -0.62 4.05 0.00 2.88 0.02 -1.26 -4.89 135.00 135.18 2h3x s PRO 386 Ca 0.45 2.24 0.00 0.00 0.02 0.00 0.00 61.00 63.71 2h3x s PRO 386 Cb -0.26 -2.85 0.00 0.00 0.02 0.00 0.00 34.50 31.41 2h3x s PRO 386 CO 0.32 -0.45 0.13 1.33 -0.33 0.00 0.00 177.00 178.00