#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c4x n GLU 3 N 0.00 1.56 -1.78 -0.52 -0.58 -1.26 -4.90 120.64 113.17 2c4x n GLU 3 Ca 0.00 0.56 -0.42 0.00 -0.42 0.00 0.00 57.16 56.88 2c4x n GLU 3 Cb 0.00 -2.27 -0.03 0.00 -0.57 0.00 0.00 31.44 28.57 2c4x n GLU 3 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 2c4x s ASN 4 N 1.45 6.46 0.09 1.62 2.47 -1.26 -4.99 114.94 120.78 2c4x s ASN 4 Ca 0.86 2.73 -0.29 0.00 0.42 0.00 0.00 52.86 56.57 2c4x s ASN 4 Cb -0.86 -2.58 -0.06 0.00 -1.45 0.00 0.00 41.25 36.31 2c4x s ASN 4 CO 0.47 -0.96 0.93 -1.10 -3.72 0.00 0.00 177.10 172.72 2c4x s GLN 5 N 2.16 4.65 0.41 0.43 -0.21 -1.26 -5.05 119.66 120.79 2c4x s GLN 5 Ca 0.77 1.38 -0.25 0.00 0.02 0.00 0.00 55.36 57.28 2c4x s GLN 5 Cb -0.46 -3.38 -0.08 0.00 1.00 0.00 0.00 33.01 30.09 2c4x s GLN 5 CO 0.34 0.21 1.19 0.00 -2.12 0.00 0.00 175.29 174.91 2c4x s ALA 6 N 0.05 3.14 0.94 6.09 0.00 -1.26 -4.79 121.76 125.93 2c4x s ALA 6 Ca 0.46 1.01 -0.12 0.00 0.00 0.00 0.00 51.96 53.31 2c4x s ALA 6 Cb -0.23 -3.40 0.15 0.00 0.00 0.00 0.00 23.12 19.65 2c4x s ALA 6 CO 0.29 -0.61 1.09 -1.25 0.00 0.00 0.00 175.76 175.28 2c4x s PRO 7 N -2.34 0.89 -0.22 0.00 0.04 -1.26 -4.79 135.00 127.32 2c4x s PRO 7 Ca 0.58 0.77 -0.09 0.00 0.04 0.00 0.00 61.00 62.30 2c4x s PRO 7 Cb -0.32 -1.77 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 2c4x s PRO 7 CO 0.40 -2.48 0.11 0.15 0.04 0.00 0.00 177.00 175.22 2c4x s LYS 8 N -4.90 3.98 -0.17 4.56 1.02 0.17 -4.32 119.74 120.08 2c4x s LYS 8 Ca 0.64 -0.32 -0.06 0.00 0.02 0.00 0.00 55.97 56.25 2c4x s LYS 8 Cb -0.19 -3.38 -0.04 0.00 -0.52 0.00 0.00 37.83 33.71 2c4x s LYS 8 CO 0.58 0.12 0.03 0.00 -0.92 0.00 0.00 175.35 175.16 2c4x s ALA 9 N 0.84 3.28 -0.08 5.17 0.00 -1.26 -1.53 121.76 128.17 2c4x s ALA 9 Ca 0.06 -0.77 -0.30 0.00 0.00 0.00 0.00 51.96 50.95 2c4x s ALA 9 Cb -0.13 -1.80 0.07 0.00 0.00 0.00 0.00 23.12 21.26 2c4x s ALA 9 CO 0.02 0.19 0.70 -1.50 0.00 0.00 0.00 175.76 175.17 2c4x s ILE 10 N 0.36 0.00 0.09 0.00 2.07 -1.26 -4.52 121.20 117.93 2c4x s ILE 10 Ca 0.01 0.00 -0.12 0.00 -1.41 0.00 0.00 60.65 59.13 2c4x s ILE 10 Cb -0.13 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.47 2c4x s ILE 10 CO 0.01 0.00 0.28 0.72 -1.91 0.00 0.00 174.94 174.04 2c4x s PHE 11 N -0.99 -0.02 0.38 3.50 -0.71 -1.26 -4.15 117.98 114.73 2c4x s PHE 11 Ca -0.09 -0.30 0.06 0.00 -1.04 0.00 0.00 56.93 55.55 2c4x s PHE 11 Cb -0.01 0.07 -0.07 0.00 -1.21 0.00 0.00 43.02 41.80 2c4x s PHE 11 CO 0.09 -0.57 0.02 0.95 -1.34 0.00 0.00 175.22 174.37 2c4x s THR 12 N -3.47 1.73 0.06 -4.49 -4.23 -0.67 -4.97 115.64 99.60 2c4x s THR 12 Ca 0.02 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.48 2c4x s THR 12 Cb 0.02 -2.92 -0.02 0.00 1.34 0.00 0.00 72.50 70.92 2c4x s THR 12 CO -0.09 -0.01 0.05 0.72 -0.54 0.00 0.00 174.62 174.76 2c4x s PHE 13 N -2.91 0.35 -0.09 3.99 -0.12 -1.26 -0.31 117.98 117.62 2c4x s PHE 13 Ca 0.35 -0.80 -0.07 0.00 -0.05 0.00 0.00 56.93 56.36 2c4x s PHE 13 Cb 0.09 -0.24 0.03 0.00 -0.63 0.00 0.00 43.02 42.27 2c4x s PHE 13 CO 0.17 -0.41 0.23 0.45 -0.05 0.00 0.00 175.22 175.61 2c4x s SER 14 N -2.69 -0.24 0.72 1.98 0.15 -0.74 -4.33 113.70 108.55 2c4x s SER 14 Ca 0.03 0.48 -0.11 0.00 0.70 0.00 0.00 55.95 57.05 2c4x s SER 14 Cb 0.05 0.44 0.02 0.00 -1.71 0.00 0.00 66.02 64.82 2c4x s SER 14 CO -0.09 -0.11 1.07 -2.16 1.20 0.00 0.00 173.24 173.15 2c4x s PRO 15 N 0.59 2.72 0.36 5.44 0.04 -1.26 -0.11 135.00 142.79 2c4x s PRO 15 Ca -0.04 0.94 0.08 0.00 0.04 0.00 0.00 61.00 62.02 2c4x s PRO 15 Cb -0.05 -1.97 0.70 0.00 0.04 0.00 0.00 34.50 33.22 2c4x s PRO 15 CO -0.03 -1.25 1.88 0.93 0.04 0.00 0.00 177.00 178.57 2c4x h GLU 16 N -0.83 0.32 -2.16 4.56 4.39 -1.99 -3.35 114.58 115.51 2c4x h GLU 16 Ca -0.44 -0.08 -0.58 0.00 0.34 0.00 0.00 59.36 58.60 2c4x h GLU 16 Cb 1.22 -0.04 -0.41 0.00 -0.10 0.00 0.00 28.75 29.42 2c4x h GLU 16 CO 0.56 0.45 -0.75 -0.40 -1.16 0.00 0.00 179.01 177.71 2c4x n ASP 17 N -4.25 2.99 -4.78 1.42 5.75 -1.26 -4.68 116.55 111.73 2c4x n ASP 17 Ca -0.00 -3.32 -0.32 0.00 -0.01 0.00 0.00 54.79 51.15 2c4x n ASP 17 Cb 0.28 -0.64 0.07 0.00 -1.03 0.00 0.00 41.12 39.80 2c4x n ASP 17 CO 0.00 0.00 0.00 -2.16 -0.11 0.00 0.00 177.20 174.93 2c4x s PRO 18 N -2.43 2.60 0.43 0.11 0.04 -1.25 -4.89 135.00 129.61 2c4x s PRO 18 Ca 0.41 1.18 0.08 0.00 0.04 0.00 0.00 61.00 62.70 2c4x s PRO 18 Cb 0.20 -1.94 -0.00 0.00 0.04 0.00 0.00 34.50 32.80 2c4x s PRO 18 CO -0.06 -1.38 0.46 0.14 0.04 0.00 0.00 177.00 176.20 2c4x s VAL 19 N -2.77 2.68 0.35 -0.36 -7.23 -1.26 -2.18 120.40 109.62 2c4x s VAL 19 Ca 0.62 -1.23 -0.29 0.00 -1.81 0.00 0.00 61.98 59.28 2c4x s VAL 19 Cb -0.17 -2.90 -0.11 0.00 0.56 0.00 0.00 36.38 33.76 2c4x s VAL 19 CO 0.51 0.00 1.52 0.42 -0.31 0.00 0.00 175.10 177.24 2c4x s THR 20 N -2.46 2.04 -0.64 5.32 -4.23 -0.07 -2.21 115.64 113.38 2c4x s THR 20 Ca 0.50 0.03 0.00 0.00 -1.18 0.00 0.00 61.69 61.05 2c4x s THR 20 Cb -0.05 -3.02 0.00 0.00 1.34 0.00 0.00 72.50 70.77 2c4x s THR 20 CO 0.30 0.01 0.00 0.47 -0.54 0.00 0.00 174.62 174.85 2c4x n ASP 21 N 0.97 -4.82 -4.82 3.99 8.00 0.97 -4.54 116.55 116.31 2c4x n ASP 21 Ca 0.03 0.15 -0.38 0.00 0.71 0.00 0.00 54.79 55.30 2c4x n ASP 21 Cb 0.39 -2.85 -0.06 0.00 -0.02 0.00 0.00 41.12 38.58 2c4x n ASP 21 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2c4x s GLU 22 N -2.12 3.93 0.15 -1.24 2.12 -0.94 -4.94 118.70 115.66 2c4x s GLU 22 Ca 0.00 0.29 -0.31 0.00 0.36 0.00 0.00 54.97 55.31 2c4x s GLU 22 Cb 0.00 -3.26 -0.09 0.00 0.26 0.00 0.00 34.13 31.03 2c4x s GLU 22 CO 0.00 0.59 1.49 -0.80 -0.54 0.00 0.00 175.26 176.00 2c4x s ASN 23 N -0.70 6.68 -0.16 -1.70 0.01 -1.26 -4.45 114.94 113.37 2c4x s ASN 23 Ca 0.22 2.50 -0.03 0.00 -0.71 0.00 0.00 52.86 54.84 2c4x s ASN 23 Cb -0.15 -2.59 -0.02 0.00 0.41 0.00 0.00 41.25 38.89 2c4x s ASN 23 CO 0.10 -0.75 -0.04 -0.69 -1.51 0.00 0.00 177.10 174.21 2c4x s VAL 24 N 1.06 3.78 -0.32 1.60 1.01 0.24 -4.47 120.40 123.29 2c4x s VAL 24 Ca 0.67 -0.39 -0.13 0.00 0.00 0.00 0.00 61.98 62.13 2c4x s VAL 24 Cb -0.41 -2.66 -0.03 0.00 0.00 0.00 0.00 36.38 33.28 2c4x s VAL 24 CO 0.31 0.48 0.26 -0.69 0.00 0.00 0.00 175.10 175.47 2c4x s VAL 25 N 0.53 5.26 -0.10 2.92 1.01 0.85 -1.32 120.40 129.55 2c4x s VAL 25 Ca -0.03 -0.00 -0.17 0.00 0.00 0.00 0.00 61.98 61.78 2c4x s VAL 25 Cb -0.14 -3.68 -0.05 0.00 0.00 0.00 0.00 36.38 32.51 2c4x s VAL 25 CO 0.03 0.06 0.44 -0.36 0.00 0.00 0.00 175.10 175.26 2c4x s PHE 26 N 1.81 3.54 -0.29 5.22 0.40 0.37 -1.79 117.98 127.24 2c4x s PHE 26 Ca 0.08 0.86 0.01 0.00 -0.60 0.00 0.00 56.93 57.29 2c4x s PHE 26 Cb -0.17 -2.47 0.09 0.00 0.51 0.00 0.00 43.02 40.98 2c4x s PHE 26 CO 0.11 0.26 0.03 1.21 0.70 0.00 0.00 175.22 177.54 2c4x s ASN 27 N 0.29 4.19 -0.25 1.36 3.84 0.58 -1.80 114.94 123.15 2c4x s ASN 27 Ca 0.24 -1.64 0.10 0.00 0.21 0.00 0.00 52.86 51.76 2c4x s ASN 27 Cb -0.15 -1.20 0.67 0.00 -0.55 0.00 0.00 41.25 40.01 2c4x s ASN 27 CO 0.10 -0.35 1.62 0.00 -2.79 0.00 0.00 177.10 175.68 2c4x n ALA 28 N 4.61 4.06 0.33 1.71 0.00 0.82 -1.67 120.51 130.36 2c4x n ALA 28 Ca -0.03 -1.84 0.14 0.00 0.00 0.00 0.00 53.44 51.71 2c4x n ALA 28 Cb 0.43 -1.18 0.61 0.00 0.00 0.00 0.00 19.45 19.31 2c4x n ALA 28 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2c4x h SER 29 N 2.75 0.00 0.15 0.00 4.64 -1.80 -0.66 113.55 118.63 2c4x h SER 29 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2c4x h SER 29 Cb 1.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.07 2c4x h SER 29 CO 0.55 0.00 -0.08 0.59 -0.87 0.00 0.00 176.83 177.03 2c4x n ASN 30 N -2.53 0.82 -4.76 4.97 5.03 -1.26 -4.85 115.26 112.68 2c4x n ASN 30 Ca 0.01 -1.01 -0.39 0.00 0.87 0.00 0.00 54.58 54.06 2c4x n ASN 30 Cb 0.21 -0.00 0.01 0.00 -1.02 0.00 0.00 39.78 38.98 2c4x n ASN 30 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 2c4x s SER 31 N -2.24 5.88 -0.17 6.41 0.01 -0.26 -4.84 113.70 118.50 2c4x s SER 31 Ca 0.34 2.75 -0.21 0.00 1.31 0.00 0.00 55.95 60.14 2c4x s SER 31 Cb 0.21 -2.64 0.05 0.00 0.21 0.00 0.00 66.02 63.85 2c4x s SER 31 CO 0.42 -1.15 0.57 -0.51 0.41 0.00 0.00 173.24 172.97 2c4x s ILE 32 N -1.28 0.01 -0.26 1.44 2.07 -0.58 -4.98 121.20 117.62 2c4x s ILE 32 Ca 0.63 -0.05 -0.10 0.00 -1.41 0.00 0.00 60.65 59.71 2c4x s ILE 32 Cb -0.40 -0.82 -0.05 0.00 0.13 0.00 0.00 42.46 41.33 2c4x s ILE 32 CO 0.50 -0.03 0.16 -0.62 -1.91 0.00 0.00 174.94 173.04 2c4x s ASP 33 N -0.12 5.97 0.27 4.50 2.15 -1.26 0.46 116.67 128.63 2c4x s ASP 33 Ca -0.03 0.03 0.11 0.00 0.43 0.00 0.00 52.55 53.09 2c4x s ASP 33 Cb -0.03 -2.09 0.33 0.00 -0.30 0.00 0.00 42.92 40.83 2c4x s ASP 33 CO 0.03 0.01 1.59 -0.33 -0.17 0.00 0.00 175.17 176.30 2c4x h GLU 34 N 7.92 0.00 0.00 4.34 4.39 -1.88 -3.31 114.58 126.05 2c4x h GLU 34 Ca -0.37 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.33 2c4x h GLU 34 Cb 1.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 2c4x h GLU 34 CO 0.60 0.63 -0.02 -0.40 -1.16 0.00 0.00 179.01 178.66 2c4x n ASP 35 N -3.73 2.20 0.00 1.42 5.75 -1.26 -5.05 116.55 115.89 2c4x n ASP 35 Ca -0.01 -2.88 0.00 0.00 -0.01 0.00 0.00 54.79 51.89 2c4x n ASP 35 Cb 0.63 -0.36 0.00 0.00 -1.03 0.00 0.00 41.12 40.37 2c4x n ASP 35 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2c4x n GLY 36 N -1.24 2.43 3.17 6.12 0.00 -1.25 -5.00 105.19 109.41 2c4x n GLY 36 Ca 0.13 -0.14 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 2c4x n GLY 36 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2c4x s THR 37 N 0.00 0.82 -0.10 2.61 -4.23 -1.26 -4.64 115.64 108.84 2c4x s THR 37 Ca 0.00 -1.72 -0.27 0.00 -1.18 0.00 0.00 61.69 58.52 2c4x s THR 37 Cb 0.00 -1.44 -0.02 0.00 1.34 0.00 0.00 72.50 72.38 2c4x s THR 37 CO 0.00 -0.68 0.87 -0.63 -0.54 0.00 0.00 174.62 173.64 2c4x s ILE 38 N -2.85 4.90 -0.06 2.99 1.01 -1.26 -0.91 121.20 125.02 2c4x s ILE 38 Ca 0.07 1.76 -0.15 0.00 0.00 0.00 0.00 60.65 62.33 2c4x s ILE 38 Cb -0.00 -4.19 -0.30 0.00 0.01 0.00 0.00 42.46 37.98 2c4x s ILE 38 CO -0.02 0.10 0.71 0.00 0.00 0.00 0.00 174.94 175.74 2c4x h ALA 39 N 7.03 0.07 -2.99 9.38 0.00 -0.39 -3.46 119.26 128.90 2c4x h ALA 39 Ca -0.35 -1.01 0.02 0.00 0.00 0.00 0.00 54.91 53.57 2c4x h ALA 39 Cb 1.17 0.37 -0.09 0.00 0.00 0.00 0.00 17.79 19.24 2c4x h ALA 39 CO 0.80 0.80 0.21 1.52 0.00 0.00 0.00 179.25 182.58 2c4x s TYR 40 N -2.52 -0.34 -0.12 0.00 -0.85 -1.07 -4.66 117.35 107.78 2c4x s TYR 40 Ca -0.16 0.00 0.02 0.00 -0.52 0.00 0.00 57.07 56.42 2c4x s TYR 40 Cb 0.04 0.62 0.01 0.00 0.38 0.00 0.00 41.96 43.01 2c4x s TYR 40 CO 0.83 -1.04 -0.19 0.71 -1.52 0.00 0.00 175.55 174.34 2c4x s TYR 41 N -3.84 2.32 -0.13 -3.49 1.51 0.33 -1.83 117.35 112.22 2c4x s TYR 41 Ca 0.06 -1.12 0.02 0.00 -1.01 0.00 0.00 57.07 55.03 2c4x s TYR 41 Cb -0.03 -1.62 -0.00 0.00 -0.11 0.00 0.00 41.96 40.20 2c4x s TYR 41 CO -0.03 -0.53 -0.19 0.08 -1.11 0.00 0.00 175.55 173.78 2c4x s VAL 42 N 0.84 2.40 -0.07 0.71 1.01 0.38 -1.03 120.40 124.64 2c4x s VAL 42 Ca -0.08 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.06 2c4x s VAL 42 Cb -0.15 -1.98 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 2c4x s VAL 42 CO -0.01 0.54 -0.18 0.26 0.00 0.00 0.00 175.10 175.71 2c4x s TRP 43 N 0.63 2.61 -0.23 5.22 0.52 0.12 -0.58 118.94 127.23 2c4x s TRP 43 Ca -0.10 -0.47 -0.00 0.00 0.02 0.00 0.00 56.10 55.55 2c4x s TRP 43 Cb -0.16 -1.66 0.03 0.00 -1.15 0.00 0.00 33.47 30.53 2c4x s TRP 43 CO 0.03 -0.05 -0.10 0.34 0.02 0.00 0.00 176.95 177.18 2c4x s ASP 44 N -0.30 4.04 0.00 2.95 -1.08 -0.11 -1.21 116.67 120.97 2c4x s ASP 44 Ca 0.01 -0.90 0.29 0.00 -0.52 0.00 0.00 52.55 51.44 2c4x s ASP 44 Cb -0.13 -1.60 1.34 0.00 -1.46 0.00 0.00 42.92 41.07 2c4x s ASP 44 CO 0.03 -0.10 1.93 0.49 0.52 0.00 0.00 175.17 178.03 2c4x n PHE 45 N 4.62 0.00 -0.82 -5.34 3.72 -0.94 -1.45 117.46 117.25 2c4x n PHE 45 Ca -0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 2c4x n PHE 45 Cb 0.47 -0.20 0.00 0.00 -0.94 0.00 0.00 39.48 38.81 2c4x n PHE 45 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2c4x n GLY 46 N 1.27 0.83 0.29 1.37 0.00 -1.20 -4.56 105.19 103.19 2c4x n GLY 46 Ca 0.15 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.20 2c4x n GLY 46 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2c4x n ASP 47 N 0.00 1.77 0.00 1.61 5.75 -1.26 -4.71 116.55 119.71 2c4x n ASP 47 Ca 0.00 -1.43 0.00 0.00 -0.01 0.00 0.00 54.79 53.35 2c4x n ASP 47 Cb 0.00 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 2c4x n ASP 47 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2c4x n GLY 48 N 0.31 2.42 3.86 6.12 0.00 -1.26 -5.11 105.19 111.53 2c4x n GLY 48 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 2c4x n GLY 48 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2c4x s TYR 49 N -2.22 3.36 0.06 1.61 4.12 -1.26 -5.05 117.35 117.97 2c4x s TYR 49 Ca 0.00 0.15 -0.00 0.00 0.02 0.00 0.00 57.07 57.24 2c4x s TYR 49 Cb 0.00 -1.68 -0.04 0.00 -1.52 0.00 0.00 41.96 38.72 2c4x s TYR 49 CO 0.00 0.55 -0.04 -1.21 0.02 0.00 0.00 175.55 174.87 2c4x s GLU 50 N -2.61 0.67 0.16 -0.62 2.02 -1.26 -2.21 118.70 114.85 2c4x s GLU 50 Ca 0.33 -1.24 -0.17 0.00 0.02 0.00 0.00 54.97 53.91 2c4x s GLU 50 Cb -0.12 0.09 0.03 0.00 0.10 0.00 0.00 34.13 34.23 2c4x s GLU 50 CO 0.25 -0.08 0.46 0.20 0.02 0.00 0.00 175.26 176.11 2c4x s GLY 51 N -2.92 -0.18 0.12 -1.39 0.00 -0.35 -4.99 107.32 97.59 2c4x s GLY 51 Ca 0.08 -0.12 0.06 0.00 0.00 0.00 0.00 44.72 44.73 2c4x s GLY 51 CO -0.08 -0.28 -0.14 -0.51 0.00 0.00 0.00 173.10 172.08 2c4x s THR 52 N -3.84 1.30 0.05 0.90 -4.23 -1.26 0.12 115.64 108.68 2c4x s THR 52 Ca 0.06 -1.67 -0.10 0.00 -1.18 0.00 0.00 61.69 58.80 2c4x s THR 52 Cb 0.01 -1.48 0.01 0.00 1.34 0.00 0.00 72.50 72.37 2c4x s THR 52 CO -0.08 -0.39 0.21 -0.55 -0.54 0.00 0.00 174.62 173.27 2c4x s SER 53 N -2.37 0.02 0.00 3.99 0.15 -0.19 -5.00 113.70 110.30 2c4x s SER 53 Ca 0.08 -0.37 0.26 0.00 0.70 0.00 0.00 55.95 56.61 2c4x s SER 53 Cb -0.05 0.31 0.68 0.00 -1.71 0.00 0.00 66.02 65.24 2c4x s SER 53 CO 0.03 -0.59 1.52 0.35 1.20 0.00 0.00 173.24 175.75 2c4x n THR 54 N 0.58 0.00 -4.35 6.45 -2.24 -1.26 -0.51 114.28 112.94 2c4x n THR 54 Ca -0.18 -0.15 -0.27 0.00 -2.27 0.00 0.00 64.05 61.18 2c4x n THR 54 Cb 0.59 0.50 -0.10 0.00 -2.10 0.00 0.00 70.33 69.22 2c4x n THR 54 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2c4x s THR 55 N -2.47 2.80 -1.55 4.28 -4.23 -1.26 -4.81 115.64 108.40 2c4x s THR 55 Ca 0.24 -1.85 0.26 0.00 -1.18 0.00 0.00 61.69 59.16 2c4x s THR 55 Cb 0.19 -2.37 0.52 0.00 1.34 0.00 0.00 72.50 72.17 2c4x s THR 55 CO 0.52 -0.12 1.89 -0.81 -0.54 0.00 0.00 174.62 175.55 2c4x n PRO 56 N 0.11 0.47 -4.21 3.99 -0.04 -1.26 -4.81 135.00 129.24 2c4x n PRO 56 Ca -0.11 0.03 -0.26 0.00 -0.04 0.00 0.00 63.50 63.12 2c4x n PRO 56 Cb 0.56 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.44 2c4x n PRO 56 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2c4x s THR 57 N -2.45 3.74 -0.08 0.52 -4.23 -1.26 -0.13 115.64 111.75 2c4x s THR 57 Ca 0.28 -1.50 -0.23 0.00 -1.18 0.00 0.00 61.69 59.06 2c4x s THR 57 Cb 0.18 -2.91 0.05 0.00 1.34 0.00 0.00 72.50 71.15 2c4x s THR 57 CO 0.38 -0.17 0.54 -0.51 -0.54 0.00 0.00 174.62 174.31 2c4x s ILE 58 N -1.86 0.02 0.09 2.99 2.07 -0.74 -4.98 121.20 118.79 2c4x s ILE 58 Ca 0.29 -0.15 0.08 0.00 -1.41 0.00 0.00 60.65 59.46 2c4x s ILE 58 Cb -0.09 -0.83 -0.04 0.00 0.13 0.00 0.00 42.46 41.63 2c4x s ILE 58 CO 0.19 -0.08 -0.15 0.28 -1.91 0.00 0.00 174.94 173.27 2c4x s THR 59 N -0.88 3.03 -0.04 4.00 -1.32 -1.26 -0.48 115.64 118.69 2c4x s THR 59 Ca -0.09 -1.33 -0.19 0.00 -1.21 0.00 0.00 61.69 58.86 2c4x s THR 59 Cb -0.03 -2.37 0.04 0.00 -1.51 0.00 0.00 72.50 68.63 2c4x s THR 59 CO 0.06 0.17 0.43 -0.47 -2.21 0.00 0.00 174.62 172.60 2c4x s TYR 60 N -1.11 -0.35 -0.05 9.09 5.04 -0.43 -4.96 117.35 124.57 2c4x s TYR 60 Ca 0.18 0.63 0.04 0.00 -2.44 0.00 0.00 57.07 55.48 2c4x s TYR 60 Cb -0.11 0.19 -0.00 0.00 0.35 0.00 0.00 41.96 42.40 2c4x s TYR 60 CO 0.10 -0.43 -0.17 0.15 -1.34 0.00 0.00 175.55 173.86 2c4x s LYS 61 N -1.10 1.84 -0.17 4.97 1.02 -1.26 -0.59 119.74 124.45 2c4x s LYS 61 Ca -0.11 -0.60 -0.09 0.00 0.02 0.00 0.00 55.97 55.19 2c4x s LYS 61 Cb -0.04 -1.58 -0.05 0.00 -0.52 0.00 0.00 37.83 35.65 2c4x s LYS 61 CO 0.05 0.22 0.14 0.71 -0.92 0.00 0.00 175.35 175.55 2c4x s TYR 62 N 0.12 3.48 0.04 3.18 2.02 -1.26 -4.89 117.35 120.04 2c4x s TYR 62 Ca -0.06 0.41 0.09 0.00 -0.37 0.00 0.00 57.07 57.14 2c4x s TYR 62 Cb -0.12 -2.09 -0.22 0.00 -0.40 0.00 0.00 41.96 39.13 2c4x s TYR 62 CO 0.03 0.45 0.98 1.57 -1.57 0.00 0.00 175.55 177.00 2c4x h LYS 63 N 6.07 0.01 -6.70 -0.62 2.10 -1.95 0.28 116.57 115.75 2c4x h LYS 63 Ca -0.46 -0.01 -0.67 0.00 -2.00 0.00 0.00 60.65 57.51 2c4x h LYS 63 Cb 1.18 0.00 -0.18 0.00 -0.90 0.00 0.00 32.23 32.33 2c4x h LYS 63 CO 0.70 0.76 -0.80 -0.80 -2.00 0.00 0.00 179.45 177.31 2c4x s ASN 64 N -6.42 3.88 0.76 7.07 0.02 -1.26 -4.67 114.94 114.33 2c4x s ASN 64 Ca -0.02 -0.58 -0.12 0.00 -1.02 0.00 0.00 52.86 51.13 2c4x s ASN 64 Cb 0.09 -0.54 0.06 0.00 0.02 0.00 0.00 41.25 40.88 2c4x s ASN 64 CO 0.82 0.17 1.11 -2.16 0.02 0.00 0.00 177.10 177.06 2c4x s PRO 65 N -2.22 2.21 0.00 -0.60 0.04 -1.26 -4.90 135.00 128.27 2c4x s PRO 65 Ca 0.19 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.51 2c4x s PRO 65 Cb -0.10 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.55 2c4x s PRO 65 CO 0.10 -1.69 0.00 0.41 0.04 0.00 0.00 177.00 175.86 2c4x n GLY 66 N -0.83 -1.04 3.32 0.56 0.00 0.11 -4.97 105.19 102.35 2c4x n GLY 66 Ca 0.10 -1.59 -0.35 0.00 0.00 0.00 0.00 46.02 44.18 2c4x n GLY 66 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2c4x s THR 67 N -1.75 3.46 -0.07 2.61 2.01 -1.26 -0.12 115.64 120.52 2c4x s THR 67 Ca 0.00 -0.51 0.02 0.00 0.31 0.00 0.00 61.69 61.51 2c4x s THR 67 Cb 0.00 -2.60 -0.03 0.00 0.01 0.00 0.00 72.50 69.88 2c4x s THR 67 CO 0.00 0.38 -0.12 -0.31 -0.69 0.00 0.00 174.62 173.88 2c4x s TYR 68 N 1.48 2.78 -0.29 4.92 2.02 0.57 -4.96 117.35 123.88 2c4x s TYR 68 Ca 0.05 -0.18 -0.19 0.00 -0.37 0.00 0.00 57.07 56.39 2c4x s TYR 68 Cb -0.15 -1.68 -0.02 0.00 -0.40 0.00 0.00 41.96 39.72 2c4x s TYR 68 CO -0.02 0.17 0.54 0.15 -1.57 0.00 0.00 175.55 174.82 2c4x s LYS 69 N -0.59 3.93 -0.28 -0.62 1.02 -1.26 -0.68 119.74 121.25 2c4x s LYS 69 Ca 0.09 0.21 -0.09 0.00 0.02 0.00 0.00 55.97 56.19 2c4x s LYS 69 Cb -0.11 -3.71 -0.03 0.00 -0.52 0.00 0.00 37.83 33.47 2c4x s LYS 69 CO 0.01 -0.47 0.14 0.08 -0.92 0.00 0.00 175.35 174.19 2c4x s VAL 70 N 2.41 4.71 -0.19 3.17 1.01 0.85 -3.26 120.40 129.11 2c4x s VAL 70 Ca 0.22 -0.18 -0.05 0.00 0.00 0.00 0.00 61.98 61.96 2c4x s VAL 70 Cb -0.15 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 2c4x s VAL 70 CO 0.11 0.20 0.00 -0.75 0.00 0.00 0.00 175.10 174.66 2c4x s LYS 71 N 1.66 3.69 -0.15 2.72 2.20 -0.53 -1.20 119.74 128.11 2c4x s LYS 71 Ca 0.06 -0.49 -0.05 0.00 -0.36 0.00 0.00 55.97 55.13 2c4x s LYS 71 Cb -0.16 -3.07 -0.03 0.00 -1.51 0.00 0.00 37.83 33.05 2c4x s LYS 71 CO 0.07 0.10 -0.01 -1.17 -0.36 0.00 0.00 175.35 173.98 2c4x s LEU 72 N 0.78 3.44 -0.14 5.43 2.96 0.25 -0.93 118.68 130.47 2c4x s LEU 72 Ca 0.01 -0.04 -0.00 0.00 -0.22 0.00 0.00 54.13 53.87 2c4x s LEU 72 Cb -0.14 -1.84 -0.01 0.00 0.50 0.00 0.00 46.19 44.70 2c4x s LEU 72 CO 0.02 0.19 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.48 2c4x s ILE 73 N 0.22 2.96 -0.14 6.68 1.01 0.26 -1.17 121.20 131.02 2c4x s ILE 73 Ca -0.00 -0.68 -0.02 0.00 0.00 0.00 0.00 60.65 59.94 2c4x s ILE 73 Cb -0.13 -2.25 -0.02 0.00 0.01 0.00 0.00 42.46 40.06 2c4x s ILE 73 CO 0.02 0.52 -0.08 -0.69 0.00 0.00 0.00 174.94 174.71 2c4x s VAL 74 N 0.52 3.55 -0.07 2.92 1.01 -0.41 -0.47 120.40 127.45 2c4x s VAL 74 Ca -0.09 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 61.45 2c4x s VAL 74 Cb -0.16 -2.53 -0.00 0.00 0.00 0.00 0.00 36.38 33.70 2c4x s VAL 74 CO 0.04 0.51 -0.21 -0.89 0.00 0.00 0.00 175.10 174.56 2c4x s THR 75 N 0.26 1.75 0.84 3.92 2.01 -0.76 -1.90 115.64 121.76 2c4x s THR 75 Ca -0.05 -0.86 -0.08 0.00 0.31 0.00 0.00 61.69 61.00 2c4x s THR 75 Cb -0.15 -1.51 0.17 0.00 0.01 0.00 0.00 72.50 71.02 2c4x s THR 75 CO 0.04 0.49 1.16 1.51 -0.69 0.00 0.00 174.62 177.13 2c4x s ASP 76 N 0.23 3.69 0.34 3.53 1.47 -0.12 0.25 116.67 126.06 2c4x s ASP 76 Ca -0.12 -0.13 0.24 0.00 1.18 0.00 0.00 52.55 53.72 2c4x s ASP 76 Cb -0.15 -0.05 1.23 0.00 -0.34 0.00 0.00 42.92 43.61 2c4x s ASP 76 CO 0.05 -2.33 1.73 -0.55 0.68 0.00 0.00 175.17 174.76 2c4x h ASN 77 N -1.08 0.00 -0.33 2.11 -1.07 -1.35 -2.13 115.58 111.73 2c4x h ASN 77 Ca -0.39 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.98 2c4x h ASN 77 Cb 1.25 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.50 2c4x h ASN 77 CO 0.37 0.00 0.00 0.00 0.07 0.00 0.00 177.43 177.87 2c4x n GLN 78 N -2.33 2.34 -0.72 4.14 6.02 -1.26 -4.99 117.38 120.57 2c4x n GLN 78 Ca -0.01 -1.96 0.00 0.00 -0.01 0.00 0.00 57.00 55.02 2c4x n GLN 78 Cb 0.08 -1.32 0.00 0.00 1.02 0.00 0.00 30.24 30.02 2c4x n GLN 78 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2c4x n GLY 79 N 0.78 0.73 3.82 1.08 0.00 -0.80 -5.06 105.19 105.74 2c4x n GLY 79 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 2c4x n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4x s ALA 80 N -2.59 3.27 0.06 4.61 0.00 -1.26 -4.83 121.76 121.02 2c4x s ALA 80 Ca 0.00 0.24 -0.00 0.00 0.00 0.00 0.00 51.96 52.20 2c4x s ALA 80 Cb 0.00 -2.94 -0.04 0.00 0.00 0.00 0.00 23.12 20.14 2c4x s ALA 80 CO 0.00 0.26 -0.04 -1.54 0.00 0.00 0.00 175.76 174.44 2c4x s SER 81 N -1.94 0.60 0.09 0.00 1.04 -1.26 -0.94 113.70 111.30 2c4x s SER 81 Ca 0.52 -0.92 0.03 0.00 0.48 0.00 0.00 55.95 56.05 2c4x s SER 81 Cb -0.14 0.16 -0.04 0.00 0.10 0.00 0.00 66.02 66.11 2c4x s SER 81 CO 0.19 -0.52 -0.09 -0.44 0.98 0.00 0.00 173.24 173.36 2c4x s SER 82 N -2.72 1.30 0.11 7.02 0.01 -0.80 -4.76 113.70 113.86 2c4x s SER 82 Ca 0.05 -0.84 0.08 0.00 1.31 0.00 0.00 55.95 56.54 2c4x s SER 82 Cb 0.05 0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.28 2c4x s SER 82 CO -0.07 -0.32 -0.19 -0.94 0.41 0.00 0.00 173.24 172.12 2c4x s SER 83 N -2.54 2.43 -0.03 2.44 1.04 -1.26 -1.29 113.70 114.49 2c4x s SER 83 Ca 0.06 -0.70 0.00 0.00 0.48 0.00 0.00 55.95 55.79 2c4x s SER 83 Cb -0.01 -0.13 0.03 0.00 0.10 0.00 0.00 66.02 66.01 2c4x s SER 83 CO -0.01 0.02 -0.00 0.12 0.98 0.00 0.00 173.24 174.35 2c4x s PHE 84 N -1.31 0.36 -0.08 5.02 2.19 -0.32 -4.84 117.98 119.00 2c4x s PHE 84 Ca 0.06 -0.02 0.04 0.00 0.33 0.00 0.00 56.93 57.35 2c4x s PHE 84 Cb -0.09 -0.46 -0.00 0.00 -1.31 0.00 0.00 43.02 41.16 2c4x s PHE 84 CO 0.04 -0.15 -0.23 0.99 1.83 0.00 0.00 175.22 177.71 2c4x s THR 85 N 1.09 1.94 0.17 0.12 2.01 -1.26 -0.58 115.64 119.13 2c4x s THR 85 Ca -0.09 -0.96 0.01 0.00 0.31 0.00 0.00 61.69 60.96 2c4x s THR 85 Cb -0.13 -1.67 -0.05 0.00 0.01 0.00 0.00 72.50 70.66 2c4x s THR 85 CO -0.02 0.54 0.01 0.00 -0.69 0.00 0.00 174.62 174.46 2c4x s ALA 86 N 0.23 1.31 -0.09 7.40 0.00 -0.34 -4.97 121.76 125.29 2c4x s ALA 86 Ca -0.14 -1.59 -0.02 0.00 0.00 0.00 0.00 51.96 50.21 2c4x s ALA 86 Cb -0.16 0.60 -0.03 0.00 0.00 0.00 0.00 23.12 23.52 2c4x s ALA 86 CO 0.07 -0.34 0.01 0.99 0.00 0.00 0.00 175.76 176.49 2c4x s THR 87 N -3.70 4.38 -0.06 0.00 2.01 -1.26 -0.10 115.64 116.90 2c4x s THR 87 Ca 0.24 -0.22 0.03 0.00 0.31 0.00 0.00 61.69 62.06 2c4x s THR 87 Cb 0.06 -2.85 0.00 0.00 0.01 0.00 0.00 72.50 69.72 2c4x s THR 87 CO 0.04 0.60 -0.17 -0.51 -0.69 0.00 0.00 174.62 173.89 2c4x s ILE 88 N -0.82 1.45 -0.20 1.82 2.07 0.14 -4.97 121.20 120.70 2c4x s ILE 88 Ca 0.13 -0.69 -0.09 0.00 -1.41 0.00 0.00 60.65 58.59 2c4x s ILE 88 Cb -0.11 -1.27 -0.04 0.00 0.13 0.00 0.00 42.46 41.16 2c4x s ILE 88 CO 0.02 0.42 0.10 -0.75 -1.91 0.00 0.00 174.94 172.83 2c4x s LYS 89 N 0.35 4.04 -0.12 3.50 2.20 -1.26 -0.31 119.74 128.13 2c4x s LYS 89 Ca -0.11 -0.30 0.01 0.00 -0.36 0.00 0.00 55.97 55.21 2c4x s LYS 89 Cb -0.15 -3.35 -0.01 0.00 -1.51 0.00 0.00 37.83 32.81 2c4x s LYS 89 CO 0.04 0.21 -0.16 0.08 -0.36 0.00 0.00 175.35 175.17 2c4x s VAL 90 N 0.57 2.77 0.27 4.02 1.01 0.83 -3.91 120.40 125.97 2c4x s VAL 90 Ca 0.06 -0.76 0.09 0.00 0.00 0.00 0.00 61.98 61.36 2c4x s VAL 90 Cb -0.12 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 2c4x s VAL 90 CO 0.01 0.53 0.09 0.42 0.00 0.00 0.00 175.10 176.15 2c4x s THR 91 N 0.38 3.70 0.25 3.92 -4.23 -0.93 -0.71 115.64 118.03 2c4x s THR 91 Ca -0.13 -1.71 -0.30 0.00 -1.18 0.00 0.00 61.69 58.38 2c4x s THR 91 Cb -0.16 -3.05 -0.10 0.00 1.34 0.00 0.00 72.50 70.53 2c4x s THR 91 CO 0.06 -0.33 1.45 -0.55 -0.54 0.00 0.00 174.62 174.70 2c4x s SER 92 N -3.76 6.64 0.19 3.99 0.15 -1.26 -0.89 113.70 118.75 2c4x s SER 92 Ca 0.33 2.69 -0.06 0.00 0.70 0.00 0.00 55.95 59.60 2c4x s SER 92 Cb -0.06 -2.62 0.11 0.00 -1.71 0.00 0.00 66.02 61.73 2c4x s SER 92 CO 0.22 -0.71 1.56 0.00 1.20 0.00 0.00 173.24 175.51 2c4x h ALA 93 N 4.97 0.76 -2.35 5.45 0.00 -1.91 -3.44 119.26 122.74 2c4x h ALA 93 Ca -0.46 -0.42 -0.26 0.00 0.00 0.00 0.00 54.91 53.77 2c4x h ALA 93 Cb 1.22 -0.13 -0.15 0.00 0.00 0.00 0.00 17.79 18.73 2c4x h ALA 93 CO 0.77 0.66 -0.65 0.95 0.00 0.00 0.00 179.25 180.98 2c4x s THR 94 N -4.45 0.43 0.05 0.00 -4.23 -1.26 -5.02 115.64 101.17 2c4x s THR 94 Ca -0.10 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 58.46 2c4x s THR 94 Cb 0.12 -2.17 0.00 0.00 1.34 0.00 0.00 72.50 71.79 2c4x s THR 94 CO 0.85 -0.40 0.00 0.61 -0.54 0.00 0.00 174.62 175.14 2c4x n GLY 95 N -0.22 -1.38 2.96 3.99 0.00 -1.26 -4.93 105.19 104.35 2c4x n GLY 95 Ca -0.05 -1.48 -0.06 0.00 0.00 0.00 0.00 46.02 44.43 2c4x n GLY 95 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2c4x s ASP 96 N -2.84 -0.08 -0.14 1.61 -1.08 -1.26 -3.16 116.67 109.72 2c4x s ASP 96 Ca 0.00 0.24 0.13 0.00 -0.52 0.00 0.00 52.55 52.40 2c4x s ASP 96 Cb 0.00 1.33 0.61 0.00 -1.46 0.00 0.00 42.92 43.40 2c4x s ASP 96 CO 0.00 -0.30 1.47 0.59 0.52 0.00 0.00 175.17 177.45 2c4x n ASN 97 N 5.38 4.33 -4.70 -0.34 5.03 -1.26 -4.80 115.26 118.88 2c4x n ASN 97 Ca -0.02 -2.55 -0.35 0.00 0.87 0.00 0.00 54.58 52.53 2c4x n ASN 97 Cb 0.50 -0.58 0.10 0.00 -1.02 0.00 0.00 39.78 38.78 2c4x n ASN 97 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 2c4x n SER 98 N 0.67 1.48 -0.25 6.41 7.64 -1.26 -4.92 113.62 123.40 2c4x n SER 98 Ca 0.21 0.70 0.04 0.00 1.01 0.00 0.00 58.87 60.83 2c4x n SER 98 Cb 0.87 -1.53 0.17 0.00 -1.01 0.00 0.00 64.21 62.71 2c4x n SER 98 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2c4x h LYS 99 N -0.24 0.44 -4.66 1.43 1.79 -1.84 -3.28 116.57 110.21 2c4x h LYS 99 Ca -0.48 -0.03 -0.66 0.00 -2.18 0.00 0.00 60.65 57.30 2c4x h LYS 99 Cb 1.32 -0.10 -0.40 0.00 -1.58 0.00 0.00 32.23 31.47 2c4x h LYS 99 CO 0.49 0.29 -0.72 -0.06 -1.08 0.00 0.00 179.45 178.37 2c4x s PHE 100 N -6.04 3.76 -0.02 -1.35 0.08 0.42 -4.94 117.98 109.89 2c4x s PHE 100 Ca -0.13 -3.01 0.09 0.00 0.12 0.00 0.00 56.93 54.00 2c4x s PHE 100 Cb 0.20 -2.93 -0.14 0.00 -0.57 0.00 0.00 43.02 39.58 2c4x s PHE 100 CO 0.76 -0.95 0.20 0.27 -0.10 0.00 0.00 175.22 175.40 2c4x n ASN 101 N 4.23 2.90 -1.14 1.36 0.23 -1.24 -1.87 115.26 119.72 2c4x n ASN 101 Ca 0.04 -0.01 -0.15 0.00 -0.53 0.00 0.00 54.58 53.93 2c4x n ASN 101 Cb 0.42 1.41 -0.06 0.00 -2.08 0.00 0.00 39.78 39.46 2c4x n ASN 101 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 2c4x n PHE 102 N -1.81 0.00 0.73 -2.53 3.72 -1.26 -4.60 117.46 111.70 2c4x n PHE 102 Ca -0.02 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.51 2c4x n PHE 102 Cb 0.23 -2.93 0.49 0.00 -0.94 0.00 0.00 39.48 36.33 2c4x n PHE 102 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2c4x n GLU 103 N -1.73 0.13 -0.00 -1.08 -0.58 -1.26 -2.83 120.64 113.29 2c4x n GLU 103 Ca -0.15 0.16 0.15 0.00 -0.42 0.00 0.00 57.16 56.90 2c4x n GLU 103 Cb 0.59 -1.67 0.66 0.00 -0.57 0.00 0.00 31.44 30.46 2c4x n GLU 103 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 2c4x n ASP 104 N -1.89 1.00 0.00 1.62 5.68 -1.26 -4.92 116.55 116.78 2c4x n ASP 104 Ca 0.05 -1.34 0.00 0.00 -0.50 0.00 0.00 54.79 53.01 2c4x n ASP 104 Cb 0.34 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.32 2c4x n ASP 104 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2c4x n GLY 105 N 1.12 0.82 3.96 6.12 0.00 -1.13 -5.03 105.19 111.04 2c4x n GLY 105 Ca 0.21 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.00 2c4x n GLY 105 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2c4x s THR 106 N -3.19 3.48 -1.07 2.61 2.01 -1.26 -4.71 115.64 113.51 2c4x s THR 106 Ca 0.00 -0.56 0.29 0.00 0.31 0.00 0.00 61.69 61.73 2c4x s THR 106 Cb 0.00 -3.29 0.27 0.00 0.01 0.00 0.00 72.50 69.48 2c4x s THR 106 CO 0.00 -0.20 1.91 0.18 -0.69 0.00 0.00 174.62 175.82 2c4x n LEU 107 N -2.18 0.04 -1.82 4.42 4.77 -1.26 -4.73 117.00 116.24 2c4x n LEU 107 Ca 0.04 0.43 -0.19 0.00 -0.03 0.00 0.00 56.01 56.26 2c4x n LEU 107 Cb 0.58 -0.45 -0.04 0.00 -2.33 0.00 0.00 43.42 41.19 2c4x n LEU 107 CO 0.46 0.01 -0.21 0.61 -1.33 0.00 0.00 177.39 176.93 2c4x n GLY 108 N 1.47 0.56 1.53 -0.72 0.00 -1.26 -2.04 105.19 104.73 2c4x n GLY 108 Ca 0.08 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2c4x n GLY 108 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c4x n GLY 109 N -0.87 1.17 3.76 -0.02 0.00 -1.26 -5.05 105.19 102.92 2c4x n GLY 109 Ca -0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 2c4x n GLY 109 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2c4x s PHE 110 N -2.74 3.20 0.33 1.61 0.40 -0.86 -4.65 117.98 115.27 2c4x s PHE 110 Ca 0.00 1.43 0.03 0.00 -0.60 0.00 0.00 56.93 57.79 2c4x s PHE 110 Cb 0.00 -3.58 -0.04 0.00 0.51 0.00 0.00 43.02 39.90 2c4x s PHE 110 CO 0.00 -1.60 0.11 0.95 0.70 0.00 0.00 175.22 175.38 2c4x s THR 111 N -0.88 0.68 0.18 0.64 -4.23 0.33 -4.93 115.64 107.43 2c4x s THR 111 Ca 0.50 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 59.11 2c4x s THR 111 Cb -0.38 -2.56 -0.04 0.00 1.34 0.00 0.00 72.50 70.86 2c4x s THR 111 CO 0.47 0.00 -0.21 0.42 -0.54 0.00 0.00 174.62 174.76 2c4x s THR 112 N -3.43 2.13 0.24 3.99 -4.23 -1.26 -1.10 115.64 111.97 2c4x s THR 112 Ca 0.33 -1.99 -0.15 0.00 -1.18 0.00 0.00 61.69 58.70 2c4x s THR 112 Cb 0.06 -2.00 0.00 0.00 1.34 0.00 0.00 72.50 71.90 2c4x s THR 112 CO 0.15 -0.20 0.52 -0.94 -0.54 0.00 0.00 174.62 173.61 2c4x s SER 113 N -2.68 -0.14 0.00 3.99 1.04 -0.93 -4.98 113.70 110.01 2c4x s SER 113 Ca 0.19 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.82 2c4x s SER 113 Cb -0.07 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.65 2c4x s SER 113 CO 0.09 -1.15 0.00 0.61 0.98 0.00 0.00 173.24 173.76 2c4x n GLY 114 N -0.38 0.60 2.89 7.32 0.00 -1.26 -0.43 105.19 113.93 2c4x n GLY 114 Ca -0.04 -0.76 -0.20 0.00 0.00 0.00 0.00 46.02 45.03 2c4x n GLY 114 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2c4x s THR 115 N -2.00 0.53 -1.16 2.61 -1.32 -0.21 -4.62 115.64 109.46 2c4x s THR 115 Ca 0.00 -0.12 0.00 0.00 -1.21 0.00 0.00 61.69 60.36 2c4x s THR 115 Cb 0.00 -0.56 0.00 0.00 -1.51 0.00 0.00 72.50 70.43 2c4x s THR 115 CO 0.00 0.22 0.00 -3.20 -2.21 0.00 0.00 174.62 169.43 2c4x n ASN 116 N 4.07 -5.49 -3.64 8.08 4.05 -1.26 -1.80 115.26 119.27 2c4x n ASN 116 Ca -0.24 0.27 -0.15 0.00 0.45 0.00 0.00 54.58 54.90 2c4x n ASN 116 Cb 0.51 -4.09 -0.07 0.00 1.23 0.00 0.00 39.78 37.36 2c4x n ASN 116 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2c4x s ALA 117 N -1.91 -1.33 -0.05 5.20 0.00 -1.26 0.14 121.76 122.55 2c4x s ALA 117 Ca 0.00 0.99 0.03 0.00 0.00 0.00 0.00 51.96 52.99 2c4x s ALA 117 Cb 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 22.99 2c4x s ALA 117 CO 0.00 -0.31 -0.16 0.99 0.00 0.00 0.00 175.76 176.28 2c4x s THR 118 N -0.97 1.36 0.05 0.00 2.01 -0.25 -4.15 115.64 113.69 2c4x s THR 118 Ca -0.10 -0.65 0.06 0.00 0.31 0.00 0.00 61.69 61.32 2c4x s THR 118 Cb -0.03 -1.19 -0.03 0.00 0.01 0.00 0.00 72.50 71.26 2c4x s THR 118 CO 0.06 0.40 -0.14 -0.83 -0.69 0.00 0.00 174.62 173.42 2c4x s GLY 119 N 0.28 1.66 0.03 4.40 0.00 -1.26 -0.71 107.32 111.72 2c4x s GLY 119 Ca -0.09 -1.19 0.06 0.00 0.00 0.00 0.00 44.72 43.51 2c4x s GLY 119 CO 0.03 -1.10 -0.18 0.54 0.00 0.00 0.00 173.10 172.39 2c4x s VAL 120 N -1.02 1.48 -0.04 1.40 0.11 -0.07 -4.83 120.40 117.43 2c4x s VAL 120 Ca 0.17 -1.05 0.03 0.00 -2.93 0.00 0.00 61.98 58.20 2c4x s VAL 120 Cb -0.11 -1.28 0.00 0.00 -1.53 0.00 0.00 36.38 33.46 2c4x s VAL 120 CO 0.08 0.20 -0.12 0.54 -3.33 0.00 0.00 175.10 172.47 2c4x s VAL 121 N -0.72 1.03 0.10 2.04 0.11 -1.26 -0.38 120.40 121.31 2c4x s VAL 121 Ca 0.06 -0.48 0.04 0.00 -2.93 0.00 0.00 61.98 58.67 2c4x s VAL 121 Cb -0.08 -0.91 -0.04 0.00 -1.53 0.00 0.00 36.38 33.83 2c4x s VAL 121 CO 0.01 0.31 -0.11 0.68 -3.33 0.00 0.00 175.10 172.66 2c4x s VAL 122 N 0.24 1.02 -0.10 2.04 -7.23 -0.32 -4.97 120.40 111.09 2c4x s VAL 122 Ca -0.05 -1.62 -0.30 0.00 -1.81 0.00 0.00 61.98 58.20 2c4x s VAL 122 Cb -0.11 -1.36 -0.02 0.00 0.56 0.00 0.00 36.38 35.46 2c4x s VAL 122 CO 0.01 -0.51 1.05 0.21 -0.31 0.00 0.00 175.10 175.56 2c4x s ASN 123 N -2.39 7.20 0.13 4.85 3.84 -1.26 -0.01 114.94 127.30 2c4x s ASN 123 Ca 0.05 1.59 0.07 0.00 0.21 0.00 0.00 52.86 54.78 2c4x s ASN 123 Cb -0.04 -2.56 -0.04 0.00 -0.55 0.00 0.00 41.25 38.07 2c4x s ASN 123 CO 0.01 -0.49 -0.16 0.28 -2.79 0.00 0.00 177.10 173.95 2c4x s THR 124 N 2.11 1.55 -1.87 -5.21 -1.32 0.01 -4.93 115.64 105.99 2c4x s THR 124 Ca 0.50 -1.76 0.15 0.00 -1.21 0.00 0.00 61.69 59.37 2c4x s THR 124 Cb -0.20 -1.64 0.11 0.00 -1.51 0.00 0.00 72.50 69.26 2c4x s THR 124 CO 0.18 -0.34 0.97 0.35 -2.21 0.00 0.00 174.62 173.58 2c4x n THR 125 N 0.52 0.00 -0.13 5.08 -2.24 -1.26 -1.86 114.28 114.38 2c4x n THR 125 Ca -0.15 -0.49 -0.10 0.00 -2.27 0.00 0.00 64.05 61.05 2c4x n THR 125 Cb 0.57 1.31 -0.01 0.00 -2.10 0.00 0.00 70.33 70.09 2c4x n THR 125 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2c4x h GLU 126 N 2.89 0.63 -3.64 -0.78 5.08 -1.96 -3.43 114.58 113.37 2c4x h GLU 126 Ca 0.00 -0.15 -0.23 0.00 -1.00 0.00 0.00 59.36 57.98 2c4x h GLU 126 Cb 0.63 -0.08 -0.28 0.00 0.50 0.00 0.00 28.75 29.51 2c4x h GLU 126 CO 0.00 0.66 -0.68 0.15 -1.00 0.00 0.00 179.01 178.14 2c4x s LYS 127 N -5.28 0.03 0.02 2.33 1.02 -1.26 -5.16 119.74 111.44 2c4x s LYS 127 Ca -0.13 0.06 -0.06 0.00 0.02 0.00 0.00 55.97 55.86 2c4x s LYS 127 Cb 0.10 -0.00 -0.01 0.00 -0.52 0.00 0.00 37.83 37.40 2c4x s LYS 127 CO 0.77 -0.02 0.11 0.00 -0.92 0.00 0.00 175.35 175.29 2c4x s ALA 128 N 0.10 -0.19 -0.07 5.17 0.00 -1.26 -4.14 121.76 121.37 2c4x s ALA 128 Ca -0.01 -0.35 -0.13 0.00 0.00 0.00 0.00 51.96 51.46 2c4x s ALA 128 Cb -0.01 0.19 -0.30 0.00 0.00 0.00 0.00 23.12 23.00 2c4x s ALA 128 CO -0.00 -0.26 0.64 0.35 0.00 0.00 0.00 175.76 176.48 2c4x h PHE 129 N 3.97 0.61 -3.85 0.00 3.57 -1.90 -3.47 116.94 115.87 2c4x h PHE 129 Ca -0.32 -0.45 -0.22 0.00 3.53 0.00 0.00 57.97 60.51 2c4x h PHE 129 Cb 1.19 -0.02 -0.25 0.00 2.79 0.00 0.00 35.95 39.65 2c4x h PHE 129 CO 0.57 1.62 -0.72 0.15 -2.23 0.00 0.00 178.31 177.70 2c4x s LYS 130 N -2.53 0.18 2.34 1.11 1.02 -1.26 -5.09 119.74 115.50 2c4x s LYS 130 Ca -0.17 -0.28 0.00 0.00 0.02 0.00 0.00 55.97 55.54 2c4x s LYS 130 Cb 0.05 -0.02 0.00 0.00 -0.52 0.00 0.00 37.83 37.33 2c4x s LYS 130 CO 0.82 -0.00 0.00 0.41 -0.92 0.00 0.00 175.35 175.66 2c4x n GLY 131 N 2.46 -0.92 0.00 -3.33 0.00 -1.19 -4.33 105.19 97.88 2c4x n GLY 131 Ca -0.17 -1.19 0.10 0.00 0.00 0.00 0.00 46.02 44.76 2c4x n GLY 131 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c4x n GLU 132 N 0.00 0.24 -4.22 1.61 1.02 -1.26 -4.82 120.64 113.20 2c4x n GLU 132 Ca 0.00 -0.07 -0.13 0.00 -0.02 0.00 0.00 57.16 56.94 2c4x n GLU 132 Cb 0.00 -1.51 -0.10 0.00 -0.02 0.00 0.00 31.44 29.81 2c4x n GLU 132 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2c4x s ARG 133 N -3.19 0.99 0.00 3.49 0.52 -1.26 -4.38 118.95 115.11 2c4x s ARG 133 Ca 0.02 -1.40 0.00 0.00 -0.52 0.00 0.00 55.73 53.83 2c4x s ARG 133 Cb 0.15 -0.50 0.00 0.00 0.52 0.00 0.00 34.95 35.12 2c4x s ARG 133 CO 0.88 0.05 0.00 0.41 0.02 0.00 0.00 175.30 176.66 2c4x n GLY 134 N -0.11 2.22 3.88 -3.53 0.00 -0.78 -4.67 105.19 102.21 2c4x n GLY 134 Ca -0.11 -0.85 -0.33 0.00 0.00 0.00 0.00 46.02 44.73 2c4x n GLY 134 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c4x s LEU 135 N 0.00 4.28 -0.21 0.99 1.43 0.84 -0.81 118.68 125.20 2c4x s LEU 135 Ca 0.00 0.30 0.02 0.00 -1.03 0.00 0.00 54.13 53.41 2c4x s LEU 135 Cb 0.00 -2.60 0.04 0.00 0.03 0.00 0.00 46.19 43.66 2c4x s LEU 135 CO 0.00 0.25 -0.14 -0.75 0.23 0.00 0.00 176.35 175.94 2c4x s LYS 136 N -1.99 2.46 -0.30 1.70 2.20 0.99 -1.85 119.74 122.96 2c4x s LYS 136 Ca 0.28 -1.00 -0.01 0.00 -0.36 0.00 0.00 55.97 54.88 2c4x s LYS 136 Cb -0.13 -2.62 0.06 0.00 -1.51 0.00 0.00 37.83 33.63 2c4x s LYS 136 CO 0.19 -0.39 -0.02 -0.46 -0.36 0.00 0.00 175.35 174.31 2c4x s TRP 137 N 1.26 3.29 -0.24 4.03 -0.00 0.11 -1.17 118.94 126.22 2c4x s TRP 137 Ca -0.01 -2.03 -0.07 0.00 -0.00 0.00 0.00 56.10 53.98 2c4x s TRP 137 Cb -0.16 -2.13 -0.03 0.00 -0.00 0.00 0.00 33.47 31.14 2c4x s TRP 137 CO -0.09 -0.83 0.07 0.99 -0.00 0.00 0.00 176.95 177.09 2c4x s THR 138 N 1.20 4.38 -0.14 5.86 2.01 0.49 -0.20 115.64 129.25 2c4x s THR 138 Ca -0.05 -0.15 -0.01 0.00 0.31 0.00 0.00 61.69 61.79 2c4x s THR 138 Cb -0.20 -3.04 -0.02 0.00 0.01 0.00 0.00 72.50 69.25 2c4x s THR 138 CO -0.02 0.35 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.46 2c4x s VAL 139 N 1.43 3.23 -0.36 3.82 1.01 0.11 -0.90 120.40 128.74 2c4x s VAL 139 Ca 0.05 -0.60 -0.05 0.00 0.00 0.00 0.00 61.98 61.39 2c4x s VAL 139 Cb -0.15 -2.37 0.07 0.00 0.00 0.00 0.00 36.38 33.93 2c4x s VAL 139 CO 0.04 0.52 0.13 -0.89 0.00 0.00 0.00 175.10 174.89 2c4x s THR 140 N 0.36 3.51 0.04 3.92 2.01 0.11 -1.34 115.64 124.26 2c4x s THR 140 Ca -0.09 -1.48 -0.06 0.00 0.31 0.00 0.00 61.69 60.36 2c4x s THR 140 Cb -0.16 -3.13 -0.05 0.00 0.01 0.00 0.00 72.50 69.18 2c4x s THR 140 CO 0.05 -0.34 0.30 -0.94 -0.69 0.00 0.00 174.62 172.99 2c4x s SER 141 N 1.59 6.50 0.00 3.53 1.04 -0.11 -1.09 113.70 125.16 2c4x s SER 141 Ca 0.01 0.57 0.17 0.00 0.48 0.00 0.00 55.95 57.18 2c4x s SER 141 Cb -0.21 -2.09 0.25 0.00 0.10 0.00 0.00 66.02 64.07 2c4x s SER 141 CO -0.00 0.20 1.17 -0.62 0.98 0.00 0.00 173.24 174.97 2c4x n GLU 142 N 0.86 1.88 0.00 4.02 -0.58 0.12 -1.97 120.64 124.97 2c4x n GLU 142 Ca -0.09 -1.81 0.00 0.00 -0.42 0.00 0.00 57.16 54.84 2c4x n GLU 142 Cb 0.52 -1.36 0.00 0.00 -0.57 0.00 0.00 31.44 30.03 2c4x n GLU 142 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2c4x n GLY 143 N 1.01 -0.07 3.62 0.62 0.00 -1.24 -4.51 105.19 104.63 2c4x n GLY 143 Ca 0.13 -0.98 -0.43 0.00 0.00 0.00 0.00 46.02 44.75 2c4x n GLY 143 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c4x s GLU 144 N -2.00 3.64 0.00 1.61 2.02 -1.26 -3.72 118.70 118.99 2c4x s GLU 144 Ca 0.00 1.68 0.00 0.00 0.02 0.00 0.00 54.97 56.67 2c4x s GLU 144 Cb 0.00 -4.11 0.00 0.00 0.10 0.00 0.00 34.13 30.12 2c4x s GLU 144 CO 0.00 -1.49 0.00 0.41 0.02 0.00 0.00 175.26 174.20 2c4x n GLY 145 N 4.95 2.06 2.93 -1.39 0.00 -0.72 -4.78 105.19 108.25 2c4x n GLY 145 Ca 0.21 -0.78 -0.11 0.00 0.00 0.00 0.00 46.02 45.33 2c4x n GLY 145 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2c4x s THR 146 N -2.70 0.04 0.00 2.61 2.01 -0.74 -0.31 115.64 116.55 2c4x s THR 146 Ca 0.00 -0.31 0.03 0.00 0.31 0.00 0.00 61.69 61.72 2c4x s THR 146 Cb 0.00 -0.13 -0.01 0.00 0.01 0.00 0.00 72.50 72.37 2c4x s THR 146 CO 0.00 -0.17 -0.09 0.00 -0.69 0.00 0.00 174.62 173.67 2c4x s ALA 147 N -0.50 0.71 0.04 7.40 0.00 -0.44 -1.05 121.76 127.92 2c4x s ALA 147 Ca -0.06 -0.44 0.08 0.00 0.00 0.00 0.00 51.96 51.55 2c4x s ALA 147 Cb -0.04 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.91 2c4x s ALA 147 CO -0.00 0.15 -0.24 -1.21 0.00 0.00 0.00 175.76 174.46 2c4x s GLU 148 N -0.42 1.65 -0.24 0.00 8.01 0.43 -0.79 118.70 127.34 2c4x s GLU 148 Ca 0.02 -1.02 -0.01 0.00 0.01 0.00 0.00 54.97 53.97 2c4x s GLU 148 Cb -0.04 -1.78 0.03 0.00 -4.31 0.00 0.00 34.13 28.02 2c4x s GLU 148 CO -0.00 0.46 -0.08 -1.17 0.01 0.00 0.00 175.26 174.48 2c4x s LEU 149 N -1.14 3.10 0.03 1.80 2.96 -0.06 -2.18 118.68 123.19 2c4x s LEU 149 Ca 0.10 -0.89 -0.01 0.00 -0.22 0.00 0.00 54.13 53.11 2c4x s LEU 149 Cb -0.09 -1.63 -0.03 0.00 0.50 0.00 0.00 46.19 44.94 2c4x s LEU 149 CO 0.02 -0.12 -0.02 -1.59 -1.32 0.00 0.00 176.35 173.31 2c4x s LYS 150 N 1.30 0.43 -0.19 1.98 -2.85 -0.26 -0.51 119.74 119.63 2c4x s LYS 150 Ca -0.00 -0.82 0.01 0.00 -1.00 0.00 0.00 55.97 54.16 2c4x s LYS 150 Cb -0.17 0.15 0.03 0.00 -2.06 0.00 0.00 37.83 35.79 2c4x s LYS 150 CO -0.05 -0.08 -0.14 -1.17 0.10 0.00 0.00 175.35 174.01 2c4x s LEU 151 N -1.99 2.30 -0.24 2.77 0.20 -1.26 -0.51 118.68 119.94 2c4x s LEU 151 Ca -0.08 -0.82 -0.15 0.00 0.69 0.00 0.00 54.13 53.78 2c4x s LEU 151 Cb -0.03 -1.34 -0.04 0.00 -0.43 0.00 0.00 46.19 44.34 2c4x s LEU 151 CO -0.04 -0.09 0.35 -1.81 -0.29 0.00 0.00 176.35 174.47 2c4x s ASP 152 N 1.34 6.29 0.00 3.68 1.01 -1.26 -4.31 116.67 123.41 2c4x s ASP 152 Ca 0.01 0.33 0.00 0.00 0.71 0.00 0.00 52.55 53.60 2c4x s ASP 152 Cb -0.15 -2.20 0.00 0.00 1.01 0.00 0.00 42.92 41.58 2c4x s ASP 152 CO -0.10 -0.12 0.00 0.61 0.21 0.00 0.00 175.17 175.78 2c4x n GLY 153 N 4.40 0.36 0.00 0.21 0.00 -1.20 -5.06 105.19 103.89 2c4x n GLY 153 Ca -0.09 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.20 2c4x n GLY 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c4x n GLY 154 N 0.00 1.27 3.42 -0.02 0.00 -1.25 -4.02 105.19 104.58 2c4x n GLY 154 Ca 0.00 -0.26 -0.44 0.00 0.00 0.00 0.00 46.02 45.32 2c4x n GLY 154 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2c4x s THR 155 N 4.11 5.11 -0.17 2.61 -4.23 -1.26 -0.30 115.64 121.49 2c4x s THR 155 Ca 0.00 -0.81 -0.22 0.00 -1.18 0.00 0.00 61.69 59.48 2c4x s THR 155 Cb 0.00 -4.17 -0.20 0.00 1.34 0.00 0.00 72.50 69.47 2c4x s THR 155 CO 0.00 -0.63 0.38 0.40 -0.54 0.00 0.00 174.62 174.23 2c4x h ILE 156 N 5.78 1.13 -3.86 2.99 2.04 -1.92 -3.48 117.51 120.20 2c4x h ILE 156 Ca -0.28 -2.10 -0.39 0.00 1.00 0.00 0.00 64.86 63.09 2c4x h ILE 156 Cb 1.11 2.39 -0.20 0.00 -0.74 0.00 0.00 36.82 39.37 2c4x h ILE 156 CO 0.90 0.38 -0.77 0.68 0.00 0.00 0.00 178.15 179.34 2c4x s VAL 157 N -2.26 1.09 0.40 1.67 -7.23 -1.26 -5.14 120.40 107.66 2c4x s VAL 157 Ca -0.23 -1.41 -0.24 0.00 -1.81 0.00 0.00 61.98 58.30 2c4x s VAL 157 Cb 0.02 -1.16 -0.09 0.00 0.56 0.00 0.00 36.38 35.71 2c4x s VAL 157 CO 0.57 -0.31 1.02 0.68 -0.31 0.00 0.00 175.10 176.75 2c4x s VAL 158 N -1.58 3.86 0.26 1.32 -7.23 -1.26 -5.00 120.40 110.77 2c4x s VAL 158 Ca 0.00 1.39 -0.30 0.00 -1.81 0.00 0.00 61.98 61.27 2c4x s VAL 158 Cb -0.08 -3.70 -0.14 0.00 0.56 0.00 0.00 36.38 33.02 2c4x s VAL 158 CO 0.02 -0.02 1.17 -2.65 -0.31 0.00 0.00 175.10 173.31 2c4x n PRO 159 N -0.10 1.57 0.00 4.82 -0.02 -1.26 -2.51 135.00 137.49 2c4x n PRO 159 Ca 0.05 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2c4x n PRO 159 Cb 0.50 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 2c4x n PRO 159 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c4x n GLY 160 N 1.55 0.22 3.73 -1.23 0.00 0.22 -4.71 105.19 104.97 2c4x n GLY 160 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2c4x n GLY 160 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2c4x s THR 161 N -2.03 4.22 0.66 2.61 2.01 -1.04 -4.78 115.64 117.28 2c4x s THR 161 Ca 0.00 1.78 0.06 0.00 0.31 0.00 0.00 61.69 63.84 2c4x s THR 161 Cb 0.00 -4.14 0.12 0.00 0.01 0.00 0.00 72.50 68.49 2c4x s THR 161 CO 0.00 0.24 0.91 -0.89 -0.69 0.00 0.00 174.62 174.19 2c4x s THR 162 N 0.25 2.02 -0.29 -0.82 2.01 -1.26 -1.51 115.64 116.03 2c4x s THR 162 Ca 0.51 -0.84 -0.13 0.00 0.31 0.00 0.00 61.69 61.54 2c4x s THR 162 Cb -0.26 -2.18 0.13 0.00 0.01 0.00 0.00 72.50 70.20 2c4x s THR 162 CO 0.31 0.00 0.75 -0.89 -0.69 0.00 0.00 174.62 174.10 2c4x s THR 164 N -2.91 -0.61 -0.01 -0.82 2.01 0.50 -4.50 115.64 109.30 2c4x s THR 164 Ca 0.65 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.65 2c4x s THR 164 Cb -0.05 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.43 2c4x s THR 164 CO 0.42 0.00 0.03 -0.36 -0.69 0.00 0.00 174.62 174.02 2c4x s PHE 165 N 2.42 3.17 -0.18 4.92 0.40 0.45 -1.28 117.98 127.87 2c4x s PHE 165 Ca -0.06 0.15 -0.00 0.00 -0.60 0.00 0.00 56.93 56.41 2c4x s PHE 165 Cb -0.09 -1.71 0.01 0.00 0.51 0.00 0.00 43.02 41.74 2c4x s PHE 165 CO -0.19 0.50 -0.15 1.03 0.70 0.00 0.00 175.22 177.11 2c4x s ARG 166 N -1.53 3.14 -0.09 0.44 3.00 -1.18 -1.15 118.95 121.59 2c4x s ARG 166 Ca 0.20 -0.76 -0.01 0.00 0.00 0.00 0.00 55.73 55.16 2c4x s ARG 166 Cb -0.12 -2.68 0.03 0.00 0.00 0.00 0.00 34.95 32.18 2c4x s ARG 166 CO 0.10 -0.13 -0.04 0.42 0.00 0.00 0.00 175.30 175.65 2c4x s ILE 167 N 1.17 0.71 -0.37 1.52 1.01 -0.09 -1.99 121.20 123.15 2c4x s ILE 167 Ca 0.01 -0.10 -0.22 0.00 0.00 0.00 0.00 60.65 60.35 2c4x s ILE 167 Cb -0.14 -0.79 0.01 0.00 0.01 0.00 0.00 42.46 41.54 2c4x s ILE 167 CO -0.06 0.31 0.71 0.86 0.00 0.00 0.00 174.94 176.76 2c4x s TRP 168 N 1.79 3.11 -0.19 3.97 -0.00 0.98 -0.28 118.94 128.33 2c4x s TRP 168 Ca 0.04 0.37 -0.04 0.00 -0.00 0.00 0.00 56.10 56.48 2c4x s TRP 168 Cb -0.12 -3.30 -0.02 0.00 -0.00 0.00 0.00 33.47 30.02 2c4x s TRP 168 CO -0.06 -0.72 -0.04 0.42 -0.00 0.00 0.00 176.95 176.55 2c4x s ILE 169 N 2.92 3.65 0.53 5.86 1.01 -1.10 -2.02 121.20 132.05 2c4x s ILE 169 Ca 0.27 -0.42 -0.11 0.00 0.00 0.00 0.00 60.65 60.39 2c4x s ILE 169 Cb -0.14 -2.63 -0.05 0.00 0.01 0.00 0.00 42.46 39.65 2c4x s ILE 169 CO 0.17 0.45 0.92 -2.16 0.00 0.00 0.00 174.94 174.32 2c4x s PRO 170 N 0.93 3.71 0.47 2.79 0.04 -1.26 0.12 135.00 141.80 2c4x s PRO 170 Ca -0.00 0.64 -0.05 0.00 0.04 0.00 0.00 61.00 61.62 2c4x s PRO 170 Cb -0.15 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 32.14 2c4x s PRO 170 CO 0.01 -0.32 0.78 -1.54 0.04 0.00 0.00 177.00 175.97 2c4x s SER 171 N -3.70 6.28 -1.28 6.66 1.04 -1.26 -4.30 113.70 117.14 2c4x s SER 171 Ca 0.54 0.93 0.00 0.00 0.48 0.00 0.00 55.95 57.90 2c4x s SER 171 Cb -0.10 -2.25 0.00 0.00 0.10 0.00 0.00 66.02 63.77 2c4x s SER 171 CO 0.42 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.69 2c4x n GLY 172 N -2.18 0.04 3.87 7.32 0.00 -1.26 -5.01 105.19 107.96 2c4x n GLY 172 Ca 0.01 -0.29 -0.33 0.00 0.00 0.00 0.00 46.02 45.40 2c4x n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4x s ALA 173 N -2.69 3.70 -0.56 4.61 0.00 -1.26 -4.99 121.76 120.57 2c4x s ALA 173 Ca 0.00 -0.39 -0.07 0.00 0.00 0.00 0.00 51.96 51.51 2c4x s ALA 173 Cb 0.00 -2.28 -0.19 0.00 0.00 0.00 0.00 23.12 20.65 2c4x s ALA 173 CO 0.00 0.57 3.17 -0.35 0.00 0.00 0.00 175.76 179.16 2c4x n PRO 174 N 0.53 2.43 -4.60 0.00 -0.04 -1.26 -4.89 135.00 127.17 2c4x n PRO 174 Ca -0.05 -1.35 -0.28 0.00 -0.04 0.00 0.00 63.50 61.79 2c4x n PRO 174 Cb 0.52 -2.25 -0.14 0.00 -0.04 0.00 0.00 33.50 31.59 2c4x n PRO 174 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2c4x s ILE 175 N 1.61 1.98 -0.19 0.52 -4.36 -1.26 -0.88 121.20 118.62 2c4x s ILE 175 Ca 0.63 -1.46 -0.04 0.00 -0.26 0.00 0.00 60.65 59.52 2c4x s ILE 175 Cb 0.25 -1.73 -0.22 0.00 1.25 0.00 0.00 42.46 42.01 2c4x s ILE 175 CO -0.02 0.18 0.08 0.00 0.24 0.00 0.00 174.94 175.43 2c4x n ALA 176 N 1.46 1.12 -3.24 2.27 0.00 0.26 -4.75 120.51 117.62 2c4x n ALA 176 Ca -0.18 -0.82 -0.11 0.00 0.00 0.00 0.00 53.44 52.34 2c4x n ALA 176 Cb 0.53 -0.40 -0.03 0.00 0.00 0.00 0.00 19.45 19.54 2c4x n ALA 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c4x s ALA 177 N -2.53 -1.13 0.02 0.00 0.00 -1.24 -0.99 121.76 115.89 2c4x s ALA 177 Ca -0.29 0.04 0.01 0.00 0.00 0.00 0.00 51.96 51.73 2c4x s ALA 177 Cb 0.08 0.81 -0.01 0.00 0.00 0.00 0.00 23.12 23.99 2c4x s ALA 177 CO 0.68 -0.74 -0.05 -1.50 0.00 0.00 0.00 175.76 174.15 2c4x s ILE 178 N -3.81 0.31 -0.24 0.00 2.07 -0.37 -1.37 121.20 117.79 2c4x s ILE 178 Ca 0.05 -0.66 -0.07 0.00 -1.41 0.00 0.00 60.65 58.56 2c4x s ILE 178 Cb -0.00 -0.36 0.11 0.00 0.13 0.00 0.00 42.46 42.34 2c4x s ILE 178 CO -0.09 -0.23 0.50 0.00 -1.91 0.00 0.00 174.94 173.21 2c4x s GLN 179 N -0.94 0.42 0.46 3.50 -2.07 0.64 -1.35 119.66 120.31 2c4x s GLN 179 Ca -0.07 1.13 -0.24 0.00 -1.82 0.00 0.00 55.36 54.35 2c4x s GLN 179 Cb -0.06 0.45 -0.07 0.00 -1.09 0.00 0.00 33.01 32.23 2c4x s GLN 179 CO -0.00 -0.29 1.32 -2.14 -1.32 0.00 0.00 175.29 172.86 2c4x s PRO 180 N 2.71 3.67 0.06 9.60 0.02 -1.25 -0.90 135.00 148.91 2c4x s PRO 180 Ca -0.00 2.17 -0.07 0.00 0.02 0.00 0.00 61.00 63.11 2c4x s PRO 180 Cb -0.12 -2.56 -0.01 0.00 0.02 0.00 0.00 34.50 31.83 2c4x s PRO 180 CO -0.15 -0.74 0.13 1.52 -0.33 0.00 0.00 177.00 177.43 2c4x s TYR 181 N -1.31 0.20 0.31 6.54 -0.85 0.26 -1.39 117.35 121.12 2c4x s TYR 181 Ca 0.62 -0.58 0.04 0.00 -0.52 0.00 0.00 57.07 56.64 2c4x s TYR 181 Cb -0.38 -0.13 -0.02 0.00 0.38 0.00 0.00 41.96 41.82 2c4x s TYR 181 CO 0.48 -0.45 0.15 1.51 -1.52 0.00 0.00 175.55 175.72 2c4x n ILE 182 N 0.33 0.00 -3.58 -3.49 3.06 0.18 -1.31 119.36 114.55 2c4x n ILE 182 Ca -0.17 -1.95 -0.14 0.00 -2.50 0.00 0.00 62.75 58.00 2c4x n ILE 182 Cb 0.60 0.79 -0.06 0.00 0.54 0.00 0.00 39.64 41.51 2c4x n ILE 182 CO 0.00 0.00 0.00 -2.84 -2.50 0.00 0.00 176.55 171.21 2c4x s PRO 184 N -3.21 0.83 0.04 9.51 0.02 -1.22 -2.01 135.00 138.95 2c4x s PRO 184 Ca 0.22 0.46 -0.18 0.00 0.02 0.00 0.00 61.00 61.52 2c4x s PRO 184 Cb 0.01 0.39 0.04 0.00 0.02 0.00 0.00 34.50 34.96 2c4x s PRO 184 CO 0.15 -0.20 0.41 -3.38 -0.33 0.00 0.00 177.00 173.65 2c4x s HIS 185 N -0.59 -0.27 0.63 6.54 -3.43 -0.59 -0.62 115.29 116.96 2c4x s HIS 185 Ca -0.04 0.26 -0.18 0.00 -0.80 0.00 0.00 55.06 54.30 2c4x s HIS 185 Cb -0.02 0.22 -0.02 0.00 -1.43 0.00 0.00 32.58 31.33 2c4x s HIS 185 CO 0.04 -0.56 1.22 0.95 -2.00 0.00 0.00 174.74 174.39 2c4x s THR 186 N -2.33 2.46 0.39 -5.38 -4.23 -0.66 -3.05 115.64 102.84 2c4x s THR 186 Ca -0.06 0.27 0.19 0.00 -1.18 0.00 0.00 61.69 60.91 2c4x s THR 186 Cb -0.01 -3.04 0.39 0.00 1.34 0.00 0.00 72.50 71.18 2c4x s THR 186 CO -0.01 -0.08 1.73 -0.65 -0.54 0.00 0.00 174.62 175.07 2c4x h PRO 187 N 0.57 0.35 -0.31 3.99 0.11 -1.93 0.55 132.00 135.33 2c4x h PRO 187 Ca -0.50 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2c4x h PRO 187 Cb 1.30 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2c4x h PRO 187 CO 0.54 0.23 0.00 -0.40 -0.21 0.00 0.00 178.00 178.16 2c4x n ASP 188 N -4.70 1.99 -0.88 -2.05 5.75 -1.26 -4.94 116.55 110.46 2c4x n ASP 188 Ca 0.28 -1.89 -0.11 0.00 -0.01 0.00 0.00 54.79 53.06 2c4x n ASP 188 Cb 0.97 -0.20 -0.05 0.00 -1.03 0.00 0.00 41.12 40.81 2c4x n ASP 188 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2c4x n TRP 189 N 0.56 0.00 0.23 2.11 7.02 0.18 -4.89 117.44 122.66 2c4x n TRP 189 Ca 0.15 0.00 0.09 0.00 -1.02 0.00 0.00 57.50 56.72 2c4x n TRP 189 Cb 0.34 -2.66 0.58 0.00 -2.42 0.00 0.00 31.31 27.15 2c4x n TRP 189 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 2c4x h SER 190 N 0.00 0.00 -3.54 -0.99 4.64 -1.92 -3.42 113.55 108.32 2c4x h SER 190 Ca -0.23 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.68 2c4x h SER 190 Cb 1.11 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 62.87 2c4x h SER 190 CO 0.34 0.20 -0.77 -1.61 -0.87 0.00 0.00 176.83 174.12 2c4x s GLU 191 N -4.11 0.81 -0.03 4.77 2.02 -1.26 -5.03 118.70 115.87 2c4x s GLU 191 Ca -0.02 -0.14 0.03 0.00 0.02 0.00 0.00 54.97 54.86 2c4x s GLU 191 Cb 0.13 -0.80 -0.00 0.00 0.10 0.00 0.00 34.13 33.56 2c4x s GLU 191 CO 0.63 -0.04 -0.11 0.08 0.02 0.00 0.00 175.26 175.84 2c4x s VAL 192 N 0.72 0.93 -0.11 2.63 1.01 -1.26 -1.65 120.40 122.67 2c4x s VAL 192 Ca -0.10 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.44 2c4x s VAL 192 Cb -0.13 -0.81 -0.02 0.00 0.00 0.00 0.00 36.38 35.43 2c4x s VAL 192 CO 0.00 0.28 -0.14 -0.76 0.00 0.00 0.00 175.10 174.48 2c4x s LEU 193 N 0.07 2.66 -0.25 3.92 1.43 0.21 -5.01 118.68 121.71 2c4x s LEU 193 Ca -0.02 -0.32 -0.06 0.00 -1.03 0.00 0.00 54.13 52.71 2c4x s LEU 193 Cb -0.08 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.55 2c4x s LEU 193 CO 0.01 0.21 0.02 0.86 0.23 0.00 0.00 176.35 177.67 2c4x s TRP 194 N 0.11 3.05 -0.09 0.29 -0.11 -1.26 -3.38 118.94 117.54 2c4x s TRP 194 Ca -0.07 -0.76 0.03 0.00 1.22 0.00 0.00 56.10 56.52 2c4x s TRP 194 Cb -0.15 -2.18 0.01 0.00 -1.50 0.00 0.00 33.47 29.65 2c4x s TRP 194 CO 0.05 -0.48 -0.18 -0.80 -4.62 0.00 0.00 176.95 170.92 2c4x s ASN 195 N 1.53 2.49 0.16 5.86 0.01 -0.85 -5.04 114.94 119.09 2c4x s ASN 195 Ca 0.05 -0.44 -0.15 0.00 -0.71 0.00 0.00 52.86 51.61 2c4x s ASN 195 Cb -0.15 -1.14 0.02 0.00 0.41 0.00 0.00 41.25 40.40 2c4x s ASN 195 CO 0.00 0.08 0.43 -0.94 -1.51 0.00 0.00 177.10 175.16 2c4x s SER 196 N 0.65 -0.19 -0.48 -1.22 1.04 -1.26 -0.65 113.70 111.58 2c4x s SER 196 Ca -0.14 -0.47 0.01 0.00 0.48 0.00 0.00 55.95 55.83 2c4x s SER 196 Cb -0.16 0.51 0.13 0.00 0.10 0.00 0.00 66.02 66.59 2c4x s SER 196 CO 0.04 -0.94 0.25 -0.89 0.98 0.00 0.00 173.24 172.68 2c4x s THR 197 N -3.86 2.97 -0.05 2.02 2.01 -0.48 -5.00 115.64 113.24 2c4x s THR 197 Ca 0.08 -2.74 -0.30 0.00 0.31 0.00 0.00 61.69 59.03 2c4x s THR 197 Cb 0.01 -3.04 -0.04 0.00 0.01 0.00 0.00 72.50 69.44 2c4x s THR 197 CO -0.07 -0.75 1.27 0.86 -0.69 0.00 0.00 174.62 175.24 2c4x s TRP 198 N 0.33 3.03 -0.14 4.92 -0.00 -1.26 -3.94 118.94 121.89 2c4x s TRP 198 Ca 0.14 1.06 0.01 0.00 -0.00 0.00 0.00 56.10 57.31 2c4x s TRP 198 Cb -0.22 -3.51 0.02 0.00 -0.00 0.00 0.00 33.47 29.76 2c4x s TRP 198 CO -0.04 -1.72 -0.15 0.15 -0.00 0.00 0.00 176.95 175.20 2c4x s LYS 199 N 2.45 2.31 0.53 5.86 -0.14 -0.46 -5.03 119.74 125.27 2c4x s LYS 199 Ca 0.58 -0.57 -0.20 0.00 -1.36 0.00 0.00 55.97 54.42 2c4x s LYS 199 Cb -0.26 -2.07 -0.06 0.00 -1.68 0.00 0.00 37.83 33.76 2c4x s LYS 199 CO 0.22 -0.19 1.16 0.20 -0.76 0.00 0.00 175.35 175.99 2c4x s GLY 200 N 1.35 2.70 0.54 -3.33 0.00 -1.26 -1.23 107.32 106.08 2c4x s GLY 200 Ca 0.02 0.91 0.22 0.00 0.00 0.00 0.00 44.72 45.87 2c4x s GLY 200 CO -0.08 1.30 2.17 -1.82 0.00 0.00 0.00 173.10 174.66 2c4x h TYR 201 N 1.36 0.00 0.00 1.90 3.20 -1.35 -3.22 116.97 118.86 2c4x h TYR 201 Ca -0.50 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.28 2c4x h TYR 201 Cb 1.27 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 39.50 2c4x h TYR 201 CO 0.51 0.03 -0.18 0.25 -1.64 0.00 0.00 178.16 177.13 2c4x n THR 202 N -4.16 2.39 -1.42 1.81 -2.24 -1.26 -4.88 114.28 104.52 2c4x n THR 202 Ca -0.03 -0.96 0.00 0.00 -2.27 0.00 0.00 64.05 60.79 2c4x n THR 202 Cb 0.12 -1.73 0.00 0.00 -2.10 0.00 0.00 70.33 66.62 2c4x n THR 202 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2c4x n VAL 204 N 2.03 -3.54 -2.51 2.28 0.31 -1.22 -5.09 118.33 110.59 2c4x n VAL 204 Ca 0.21 1.66 -0.42 0.00 -0.01 0.00 0.00 64.34 65.78 2c4x n VAL 204 Cb 0.68 -2.51 -0.03 0.00 -0.91 0.00 0.00 33.84 31.07 2c4x n VAL 204 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2c4x s LYS 205 N -4.73 3.36 0.43 5.55 1.02 -1.26 -5.02 119.74 119.09 2c4x s LYS 205 Ca 0.00 0.19 -0.21 0.00 0.02 0.00 0.00 55.97 55.97 2c4x s LYS 205 Cb 0.00 -4.09 -0.11 0.00 -0.52 0.00 0.00 37.83 33.11 2c4x s LYS 205 CO 0.00 -1.89 0.96 0.95 -0.92 0.00 0.00 175.35 174.45 2c4x s THR 206 N 5.53 4.31 -1.53 2.17 -4.23 -1.26 -3.63 115.64 117.01 2c4x s THR 206 Ca 0.44 1.47 -0.13 0.00 -1.18 0.00 0.00 61.69 62.29 2c4x s THR 206 Cb -0.09 -3.61 0.09 0.00 1.34 0.00 0.00 72.50 70.23 2c4x s THR 206 CO 0.23 -0.28 0.92 0.47 -0.54 0.00 0.00 174.62 175.42 2c4x n ASP 207 N -0.58 -4.73 -3.65 3.99 8.00 0.33 -4.85 116.55 115.05 2c4x n ASP 207 Ca 0.07 -0.73 -0.10 0.00 0.71 0.00 0.00 54.79 54.73 2c4x n ASP 207 Cb 0.54 -3.79 -0.03 0.00 -0.02 0.00 0.00 41.12 37.81 2c4x n ASP 207 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2c4x s ASP 208 N -3.22 -0.35 0.04 -2.24 -1.08 -1.24 -4.99 116.67 103.59 2c4x s ASP 208 Ca 0.64 -0.34 -0.30 0.00 -0.52 0.00 0.00 52.55 52.03 2c4x s ASP 208 Cb -0.32 0.60 -0.05 0.00 -1.46 0.00 0.00 42.92 41.69 2c4x s ASP 208 CO 0.78 -1.05 1.07 0.26 0.52 0.00 0.00 175.17 176.75 2c4x s TRP 209 N -3.84 3.58 -0.19 -5.34 0.52 -1.26 -2.70 118.94 109.72 2c4x s TRP 209 Ca 0.06 1.55 -0.02 0.00 0.02 0.00 0.00 56.10 57.72 2c4x s TRP 209 Cb -0.01 -3.24 -0.01 0.00 -1.15 0.00 0.00 33.47 29.06 2c4x s TRP 209 CO -0.05 -0.51 -0.09 -0.80 0.02 0.00 0.00 176.95 175.52 2c4x s ASN 210 N 0.87 4.07 -0.37 2.95 0.01 0.62 -4.92 114.94 118.17 2c4x s ASN 210 Ca 0.54 -0.40 -0.17 0.00 -0.71 0.00 0.00 52.86 52.12 2c4x s ASN 210 Cb -0.25 -1.67 0.00 0.00 0.41 0.00 0.00 41.25 39.75 2c4x s ASN 210 CO 0.29 0.04 0.45 -0.70 -1.51 0.00 0.00 177.10 175.67 2c4x s GLU 211 N 1.09 3.46 -0.11 -0.60 2.12 -1.26 -0.91 118.70 122.49 2c4x s GLU 211 Ca 0.01 -0.41 0.02 0.00 0.36 0.00 0.00 54.97 54.95 2c4x s GLU 211 Cb -0.15 -3.85 0.01 0.00 0.26 0.00 0.00 34.13 30.40 2c4x s GLU 211 CO -0.02 -0.67 -0.17 0.42 -0.54 0.00 0.00 175.26 174.28 2c4x s ILE 212 N 2.22 1.63 0.23 -3.70 1.01 -0.30 -4.97 121.20 117.31 2c4x s ILE 212 Ca 0.15 -0.73 0.04 0.00 0.00 0.00 0.00 60.65 60.11 2c4x s ILE 212 Cb -0.16 -1.46 -0.03 0.00 0.01 0.00 0.00 42.46 40.81 2c4x s ILE 212 CO 0.13 0.47 0.36 0.42 0.00 0.00 0.00 174.94 176.32 2c4x s THR 213 N 0.84 5.26 -0.16 2.92 -4.23 -1.26 -0.41 115.64 118.59 2c4x s THR 213 Ca -0.09 -0.87 -0.08 0.00 -1.18 0.00 0.00 61.69 59.46 2c4x s THR 213 Cb -0.16 -3.83 0.06 0.00 1.34 0.00 0.00 72.50 69.91 2c4x s THR 213 CO 0.00 -0.30 0.38 -0.22 -0.54 0.00 0.00 174.62 173.95 2c4x s LEU 214 N -3.84 -0.02 -0.20 4.79 2.96 -1.26 -4.76 118.68 116.35 2c4x s LEU 214 Ca 0.35 0.83 -0.06 0.00 -0.22 0.00 0.00 54.13 55.02 2c4x s LEU 214 Cb -0.09 1.23 -0.03 0.00 0.50 0.00 0.00 46.19 47.80 2c4x s LEU 214 CO 0.29 -0.19 0.04 -0.89 -1.32 0.00 0.00 176.35 174.28 2c4x s THR 215 N 1.42 4.43 -0.24 3.68 2.01 -1.26 -4.31 115.64 121.36 2c4x s THR 215 Ca -0.09 -0.15 -0.29 0.00 0.31 0.00 0.00 61.69 61.46 2c4x s THR 215 Cb -0.09 -3.01 0.00 0.00 0.01 0.00 0.00 72.50 69.42 2c4x s THR 215 CO -0.12 0.43 1.20 -0.22 -0.69 0.00 0.00 174.62 175.23 2c4x s LEU 216 N 0.73 4.03 0.60 4.42 2.96 -0.57 -4.94 118.68 125.92 2c4x s LEU 216 Ca 0.02 1.38 -0.19 0.00 -0.22 0.00 0.00 54.13 55.12 2c4x s LEU 216 Cb -0.14 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.98 2c4x s LEU 216 CO 0.02 -0.86 1.25 -2.65 -1.32 0.00 0.00 176.35 172.79 2c4x n PRO 217 N 6.82 1.28 0.29 0.98 -0.02 -1.26 0.73 135.00 143.81 2c4x n PRO 217 Ca 0.13 0.49 0.15 0.00 -2.02 0.00 0.00 63.50 62.25 2c4x n PRO 217 Cb 0.46 -2.48 0.86 0.00 -0.02 0.00 0.00 33.50 32.33 2c4x n PRO 217 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2c4x h GLU 218 N 0.85 0.00 -0.06 -0.52 4.81 -1.91 -3.02 114.58 114.73 2c4x h GLU 218 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2c4x h GLU 218 Cb 1.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.71 2c4x h GLU 218 CO 0.54 0.05 0.00 -0.40 -0.73 0.00 0.00 179.01 178.47 2c4x n ASP 219 N -3.70 1.23 -4.76 1.04 5.75 -1.26 -4.71 116.55 110.15 2c4x n ASP 219 Ca -0.02 -1.50 -0.41 0.00 -0.01 0.00 0.00 54.79 52.85 2c4x n ASP 219 Cb 0.15 -0.03 -0.02 0.00 -1.03 0.00 0.00 41.12 40.18 2c4x n ASP 219 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2c4x s VAL 220 N -1.93 2.83 0.01 2.12 1.01 -1.14 -4.96 120.40 118.34 2c4x s VAL 220 Ca 0.37 0.76 -0.30 0.00 0.00 0.00 0.00 61.98 62.80 2c4x s VAL 220 Cb 0.19 -3.48 -0.08 0.00 0.00 0.00 0.00 36.38 33.01 2c4x s VAL 220 CO 0.31 0.15 1.97 -0.62 0.00 0.00 0.00 175.10 176.91 2c4x s ASP 221 N -0.08 6.38 0.28 3.32 -1.08 -1.26 -4.78 116.67 119.45 2c4x s ASP 221 Ca 0.53 2.58 0.23 0.00 -0.52 0.00 0.00 52.55 55.38 2c4x s ASP 221 Cb -0.39 -2.53 1.05 0.00 -1.46 0.00 0.00 42.92 39.58 2c4x s ASP 221 CO 0.47 -1.12 1.71 -0.81 0.52 0.00 0.00 175.17 175.93 2c4x n PRO 222 N 7.62 0.19 0.03 4.34 -0.04 -1.26 -2.59 135.00 143.28 2c4x n PRO 222 Ca 0.21 0.49 0.12 0.00 -0.04 0.00 0.00 63.50 64.27 2c4x n PRO 222 Cb 0.41 -1.91 0.25 0.00 -0.04 0.00 0.00 33.50 32.22 2c4x n PRO 222 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2c4x n THR 223 N -2.27 0.15 -2.33 0.52 -2.24 -1.26 -4.90 114.28 101.95 2c4x n THR 223 Ca 0.01 -0.11 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 2c4x n THR 223 Cb 0.18 0.02 -0.03 0.00 -2.10 0.00 0.00 70.33 68.39 2c4x n THR 223 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 2c4x s TRP 224 N -3.07 3.37 0.74 4.78 0.52 -1.07 -4.97 118.94 119.24 2c4x s TRP 224 Ca 0.09 1.22 -0.15 0.00 0.02 0.00 0.00 56.10 57.27 2c4x s TRP 224 Cb 0.16 -3.51 0.03 0.00 -1.15 0.00 0.00 33.47 29.01 2c4x s TRP 224 CO 0.69 -1.62 1.18 -0.35 0.02 0.00 0.00 176.95 176.87 2c4x n PRO 225 N 3.63 0.57 -4.58 4.98 -0.04 -1.17 -4.71 135.00 133.67 2c4x n PRO 225 Ca 0.09 0.26 -0.22 0.00 -0.04 0.00 0.00 63.50 63.59 2c4x n PRO 225 Cb 0.45 -2.42 -0.15 0.00 -0.04 0.00 0.00 33.50 31.33 2c4x n PRO 225 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2c4x s GLN 226 N -3.69 1.14 0.55 0.54 -0.21 0.58 -1.55 119.66 117.02 2c4x s GLN 226 Ca 0.77 -0.45 0.07 0.00 0.02 0.00 0.00 55.36 55.77 2c4x s GLN 226 Cb -0.33 -1.07 0.05 0.00 1.00 0.00 0.00 33.01 32.66 2c4x s GLN 226 CO 0.47 0.24 0.56 -1.14 -2.12 0.00 0.00 175.29 173.30 2c4x s GLN 227 N -0.14 2.29 0.00 2.91 0.74 -1.26 -3.27 119.66 120.93 2c4x s GLN 227 Ca 0.02 -1.84 0.00 0.00 0.05 0.00 0.00 55.36 53.59 2c4x s GLN 227 Cb -0.07 -2.34 0.00 0.00 1.10 0.00 0.00 33.01 31.71 2c4x s GLN 227 CO 0.00 -0.69 0.00 0.41 -0.55 0.00 0.00 175.29 174.46 2c4x n GLY 229 N -1.95 0.88 3.12 2.59 0.00 -0.43 -4.26 105.19 105.14 2c4x n GLY 229 Ca 0.06 -1.86 -0.27 0.00 0.00 0.00 0.00 46.02 43.95 2c4x n GLY 229 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2c4x s ILE 230 N -2.47 1.53 -0.08 -0.61 1.01 0.33 -0.57 121.20 120.33 2c4x s ILE 230 Ca 0.00 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 59.93 2c4x s ILE 230 Cb 0.00 -1.34 -0.03 0.00 0.01 0.00 0.00 42.46 41.10 2c4x s ILE 230 CO 0.00 0.44 -0.09 -1.58 0.00 0.00 0.00 174.94 173.71 2c4x s GLN 231 N 0.38 2.89 -0.08 2.79 0.74 -0.08 -0.88 119.66 125.43 2c4x s GLN 231 Ca -0.13 -0.60 0.04 0.00 0.05 0.00 0.00 55.36 54.72 2c4x s GLN 231 Cb -0.15 -2.59 -0.01 0.00 1.10 0.00 0.00 33.01 31.36 2c4x s GLN 231 CO 0.05 0.54 -0.20 0.08 -0.55 0.00 0.00 175.29 175.21 2c4x s VAL 232 N -0.48 2.47 -0.24 1.34 1.01 0.03 -0.26 120.40 124.27 2c4x s VAL 232 Ca 0.07 -0.90 -0.14 0.00 0.00 0.00 0.00 61.98 61.01 2c4x s VAL 232 Cb -0.12 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 2c4x s VAL 232 CO 0.02 0.56 0.31 -1.58 0.00 0.00 0.00 175.10 174.42 2c4x s GLN 233 N -0.09 4.07 -0.00 2.72 0.74 -0.47 -1.32 119.66 125.31 2c4x s GLN 233 Ca -0.04 -0.01 -0.02 0.00 0.05 0.00 0.00 55.36 55.33 2c4x s GLN 233 Cb -0.14 -3.59 -0.04 0.00 1.10 0.00 0.00 33.01 30.34 2c4x s GLN 233 CO 0.04 -0.12 0.16 0.95 -0.55 0.00 0.00 175.29 175.77 2c4x s THR 234 N 1.57 5.23 0.00 -0.34 -4.23 0.58 -0.58 115.64 117.88 2c4x s THR 234 Ca 0.14 -0.25 0.00 0.00 -1.18 0.00 0.00 61.69 60.40 2c4x s THR 234 Cb -0.15 -3.44 0.00 0.00 1.34 0.00 0.00 72.50 70.25 2c4x s THR 234 CO 0.08 0.31 0.00 2.30 -0.54 0.00 0.00 174.62 176.78 2c4x n ILE 235 N 0.94 0.00 -3.99 2.99 -5.35 -0.06 -1.75 119.36 112.14 2c4x n ILE 235 Ca -0.11 -0.32 -0.11 0.00 -0.27 0.00 0.00 62.75 61.94 2c4x n ILE 235 Cb 0.52 0.82 -0.04 0.00 -1.74 0.00 0.00 39.64 39.21 2c4x n ILE 235 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2c4x s ASP 236 N -1.33 0.20 0.59 7.28 -1.08 -1.24 -4.16 116.67 116.94 2c4x s ASP 236 Ca 0.00 -1.11 -0.19 0.00 -0.52 0.00 0.00 52.55 50.73 2c4x s ASP 236 Cb 0.00 0.65 -0.03 0.00 -1.46 0.00 0.00 42.92 42.08 2c4x s ASP 236 CO 0.00 -1.27 1.22 -1.61 0.52 0.00 0.00 175.17 174.03 2c4x s GLU 237 N -3.49 2.95 0.00 4.34 2.02 -1.26 -3.70 118.70 119.55 2c4x s GLU 237 Ca 0.23 1.86 0.00 0.00 0.02 0.00 0.00 54.97 57.09 2c4x s GLU 237 Cb -0.01 -1.94 0.00 0.00 0.10 0.00 0.00 34.13 32.28 2c4x s GLU 237 CO 0.12 -1.23 0.00 0.41 0.02 0.00 0.00 175.26 174.58 2c4x n GLY 238 N 0.56 3.71 3.37 -1.39 0.00 -0.83 -4.79 105.19 105.81 2c4x n GLY 238 Ca 0.14 -1.21 -0.32 0.00 0.00 0.00 0.00 46.02 44.63 2c4x n GLY 238 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2c4x s GLU 239 N -2.46 2.86 0.05 1.61 2.12 -1.26 -0.94 118.70 120.68 2c4x s GLU 239 Ca 0.00 -0.76 -0.10 0.00 0.36 0.00 0.00 54.97 54.48 2c4x s GLU 239 Cb 0.00 -2.41 0.00 0.00 0.26 0.00 0.00 34.13 31.98 2c4x s GLU 239 CO 0.00 0.39 0.20 -0.59 -0.54 0.00 0.00 175.26 174.72 2c4x s PHE 240 N -0.13 0.07 -0.13 5.30 -0.71 -0.45 -4.97 117.98 116.96 2c4x s PHE 240 Ca -0.02 -0.34 0.01 0.00 -1.04 0.00 0.00 56.93 55.54 2c4x s PHE 240 Cb -0.14 -0.03 0.02 0.00 -1.21 0.00 0.00 43.02 41.66 2c4x s PHE 240 CO 0.04 -0.46 -0.15 0.99 -1.34 0.00 0.00 175.22 174.29 2c4x s THR 241 N -2.90 1.58 -0.06 -4.49 2.01 -1.26 -0.71 115.64 109.81 2c4x s THR 241 Ca -0.03 -0.66 -0.01 0.00 0.31 0.00 0.00 61.69 61.31 2c4x s THR 241 Cb 0.00 -1.46 -0.03 0.00 0.01 0.00 0.00 72.50 71.02 2c4x s THR 241 CO -0.06 0.46 0.01 -0.63 -0.69 0.00 0.00 174.62 173.71 2c4x s ILE 242 N 1.24 4.30 -0.05 1.82 1.01 0.71 -4.33 121.20 125.91 2c4x s ILE 242 Ca -0.01 -0.35 0.02 0.00 0.00 0.00 0.00 60.65 60.31 2c4x s ILE 242 Cb -0.14 -2.85 -0.03 0.00 0.01 0.00 0.00 42.46 39.45 2c4x s ILE 242 CO -0.06 0.52 -0.08 -0.31 0.00 0.00 0.00 174.94 175.01 2c4x s TYR 243 N -0.96 2.90 -0.03 3.97 1.51 -0.86 0.06 117.35 123.94 2c4x s TYR 243 Ca 0.16 -0.01 0.01 0.00 -1.01 0.00 0.00 57.07 56.22 2c4x s TYR 243 Cb -0.11 -1.67 0.02 0.00 -0.11 0.00 0.00 41.96 40.08 2c4x s TYR 243 CO 0.05 0.33 -0.04 0.08 -1.11 0.00 0.00 175.55 174.87 2c4x s VAL 244 N -0.86 0.43 0.13 0.71 1.01 -0.77 -0.01 120.40 121.04 2c4x s VAL 244 Ca 0.14 -0.10 -0.22 0.00 0.00 0.00 0.00 61.98 61.80 2c4x s VAL 244 Cb -0.11 -0.45 0.06 0.00 0.00 0.00 0.00 36.38 35.88 2c4x s VAL 244 CO 0.03 0.18 0.56 -0.62 0.00 0.00 0.00 175.10 175.26 2c4x s ASP 245 N 0.72 -0.51 -1.33 3.32 2.15 -0.84 -0.11 116.67 120.06 2c4x s ASP 245 Ca -0.09 -0.00 -0.05 0.00 0.43 0.00 0.00 52.55 52.84 2c4x s ASP 245 Cb -0.12 0.57 0.02 0.00 -0.30 0.00 0.00 42.92 43.09 2c4x s ASP 245 CO -0.00 -0.91 0.98 0.00 -0.17 0.00 0.00 175.17 175.06 2c4x n ALA 246 N -0.22 -1.69 -2.23 3.66 0.00 -0.89 -3.08 120.51 116.05 2c4x n ALA 246 Ca -0.17 0.09 -0.42 0.00 0.00 0.00 0.00 53.44 52.94 2c4x n ALA 246 Cb 0.64 -3.54 -0.03 0.00 0.00 0.00 0.00 19.45 16.52 2c4x n ALA 246 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2c4x s ILE 247 N -3.41 3.72 0.01 0.00 1.01 -0.78 -4.42 121.20 117.31 2c4x s ILE 247 Ca 0.29 1.11 -0.09 0.00 0.00 0.00 0.00 60.65 61.96 2c4x s ILE 247 Cb -0.13 -3.71 0.00 0.00 0.01 0.00 0.00 42.46 38.63 2c4x s ILE 247 CO 0.77 0.00 0.17 -0.62 0.00 0.00 0.00 174.94 175.26 2c4x s ASP 248 N 1.81 0.00 0.29 3.58 2.15 -0.41 -0.44 116.67 123.65 2c4x s ASP 248 Ca 0.63 -0.20 -0.19 0.00 0.43 0.00 0.00 52.55 53.23 2c4x s ASP 248 Cb -0.31 0.23 0.02 0.00 -0.30 0.00 0.00 42.92 42.56 2c4x s ASP 248 CO 0.27 -0.41 0.69 -1.66 -0.17 0.00 0.00 175.17 173.89 2c4x s TRP 249 N -1.56 -0.07 0.01 -5.34 -2.14 -1.26 -0.37 118.94 108.22 2c4x s TRP 249 Ca -0.13 -0.40 -0.07 0.00 2.66 0.00 0.00 56.10 58.16 2c4x s TRP 249 Cb -0.06 0.65 -0.05 0.00 -3.10 0.00 0.00 33.47 30.91 2c4x s TRP 249 CO 0.01 -1.25 0.28 -0.51 -2.66 0.00 0.00 176.95 172.83 2c4x s LEU 250 N -2.95 4.37 0.00 -4.66 1.43 -1.26 -4.83 118.68 110.77 2c4x s LEU 250 Ca 0.13 0.59 0.00 0.00 -1.03 0.00 0.00 54.13 53.82 2c4x s LEU 250 Cb -0.05 -2.70 0.00 0.00 0.03 0.00 0.00 46.19 43.47 2c4x s LEU 250 CO 0.08 0.25 0.00 -0.62 0.23 0.00 0.00 176.35 176.29