#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h5x s ILE 22 N 0.00 2.20 0.24 2.46 1.01 -1.26 -4.75 121.20 121.09 1h5x s ILE 22 Ca 0.00 0.17 0.06 0.00 0.00 0.00 0.00 60.65 60.88 1h5x s ILE 22 Cb 0.00 -3.11 -0.03 0.00 0.01 0.00 0.00 42.46 39.33 1h5x s ILE 22 CO 0.00 0.03 0.24 0.42 0.00 0.00 0.00 174.94 175.63 1h5x s THR 23 N 0.03 4.74 -0.22 2.92 -4.23 -0.63 -4.99 115.64 113.26 1h5x s THR 23 Ca 0.63 -1.22 -0.04 0.00 -1.18 0.00 0.00 61.69 59.88 1h5x s THR 23 Cb -0.47 -3.55 -0.01 0.00 1.34 0.00 0.00 72.50 69.82 1h5x s THR 23 CO 0.46 -0.31 -0.04 -1.83 -0.54 0.00 0.00 174.62 172.36 1h5x s GLU 24 N -3.79 3.37 -0.50 3.99 -1.05 -1.26 -1.29 118.70 118.17 1h5x s GLU 24 Ca 0.33 -0.63 -0.19 0.00 -0.15 0.00 0.00 54.97 54.34 1h5x s GLU 24 Cb -0.09 -3.00 0.06 0.00 -0.44 0.00 0.00 34.13 30.66 1h5x s GLU 24 CO 0.26 -0.20 0.60 1.21 0.95 0.00 0.00 175.26 178.08 1h5x s ASN 25 N 1.48 6.21 0.37 0.83 3.84 0.77 -4.92 114.94 123.52 1h5x s ASN 25 Ca 0.06 -0.99 0.09 0.00 0.21 0.00 0.00 52.86 52.23 1h5x s ASN 25 Cb -0.14 -2.28 0.72 0.00 -0.55 0.00 0.00 41.25 39.01 1h5x s ASN 25 CO -0.03 -0.87 1.87 0.00 -2.79 0.00 0.00 177.10 175.28 1h5x h THR 26 N 5.85 1.21 0.00 -5.21 1.03 -1.87 -2.98 112.91 110.93 1h5x h THR 26 Ca -0.28 -0.97 -0.01 0.00 -0.01 0.00 0.00 66.41 65.15 1h5x h THR 26 Cb 1.10 1.36 -0.00 0.00 -1.07 0.00 0.00 68.15 69.53 1h5x h THR 26 CO 0.96 0.29 -0.04 0.28 -0.01 0.00 0.00 175.52 177.00 1h5x h SER 27 N 0.19 0.00 0.20 0.00 0.02 -1.96 -2.43 113.55 109.56 1h5x h SER 27 Ca 0.03 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.90 1h5x h SER 27 Cb 0.49 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 1h5x h SER 27 CO 0.03 0.04 -0.32 -0.50 -1.14 0.00 0.00 176.83 174.95 1h5x h TRP 28 N 0.00 0.21 -0.02 3.45 6.55 -1.92 -2.78 115.95 121.44 1h5x h TRP 28 Ca -0.00 -0.04 0.01 0.00 0.95 0.00 0.00 58.89 59.80 1h5x h TRP 28 Cb 0.11 -0.05 -0.00 0.00 -0.86 0.00 0.00 29.16 28.36 1h5x h TRP 28 CO 0.00 0.49 0.07 -0.91 -1.05 0.00 0.00 178.44 177.04 1h5x h ASN 29 N 0.17 0.00 0.37 -3.49 -0.26 -1.61 -0.64 115.58 110.12 1h5x h ASN 29 Ca 0.02 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.72 1h5x h ASN 29 Cb 0.65 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.90 1h5x h ASN 29 CO 0.05 0.00 -0.23 0.11 -1.06 0.00 0.00 177.43 176.30 1h5x h LYS 30 N 0.00 0.00 0.00 0.81 1.57 -1.66 0.28 116.57 117.57 1h5x h LYS 30 Ca 0.01 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.66 1h5x h LYS 30 Cb 0.15 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 1h5x h LYS 30 CO -0.00 0.23 -0.60 0.93 -0.57 0.00 0.00 179.45 179.43 1h5x h GLU 31 N 0.00 0.00 0.10 3.15 4.39 -1.30 -1.61 114.58 119.31 1h5x h GLU 31 Ca -0.00 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.56 1h5x h GLU 31 Cb 0.47 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.14 1h5x h GLU 31 CO 0.03 0.60 -0.62 0.74 -1.16 0.00 0.00 179.01 178.60 1h5x h PHE 32 N 0.00 0.43 -0.94 4.33 -1.00 -1.41 -3.32 116.94 115.03 1h5x h PHE 32 Ca -0.01 -0.31 0.06 0.00 2.81 0.00 0.00 57.97 60.52 1h5x h PHE 32 Cb 1.09 -0.02 -0.06 0.00 3.61 0.00 0.00 35.95 40.57 1h5x h PHE 32 CO 0.00 1.22 0.61 0.77 -1.61 0.00 0.00 178.31 179.30 1h5x h SER 33 N -0.47 0.97 -0.46 2.17 0.02 -0.95 -0.06 113.55 114.76 1h5x h SER 33 Ca -0.10 0.00 0.12 0.00 -0.84 0.00 0.00 61.79 60.96 1h5x h SER 33 Cb 1.47 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.78 1h5x h SER 33 CO 0.12 0.63 0.32 0.00 -1.14 0.00 0.00 176.83 176.76 1h5x h ALA 34 N 1.48 2.31 -0.24 3.77 0.00 -1.39 -1.35 119.26 123.84 1h5x h ALA 34 Ca 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1h5x h ALA 34 Cb 0.14 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1h5x h ALA 34 CO -0.14 -0.43 0.00 0.39 0.00 0.00 0.00 179.25 179.06 1h5x n GLU 35 N -4.43 2.43 -3.81 0.00 -0.58 -0.68 -4.98 120.64 108.59 1h5x n GLU 35 Ca 0.08 -1.80 -0.23 0.00 -0.42 0.00 0.00 57.16 54.78 1h5x n GLU 35 Cb 0.47 -1.22 0.01 0.00 -0.57 0.00 0.00 31.44 30.14 1h5x n GLU 35 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1h5x n ALA 36 N 0.39 -1.96 -2.55 0.62 0.00 -0.17 -4.96 120.51 111.86 1h5x n ALA 36 Ca 0.09 -0.18 -0.33 0.00 0.00 0.00 0.00 53.44 53.01 1h5x n ALA 36 Cb 0.37 -1.93 -0.12 0.00 0.00 0.00 0.00 19.45 17.77 1h5x n ALA 36 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1h5x s VAL 37 N -3.75 3.52 -0.31 0.00 1.01 -0.40 -5.02 120.40 115.46 1h5x s VAL 37 Ca 0.05 -0.56 -0.09 0.00 0.00 0.00 0.00 61.98 61.37 1h5x s VAL 37 Cb -0.03 -2.43 -0.00 0.00 0.00 0.00 0.00 36.38 33.92 1h5x s VAL 37 CO 0.84 0.59 0.14 0.20 0.00 0.00 0.00 175.10 176.87 1h5x s ASN 38 N -0.82 5.50 0.03 3.32 0.01 -1.26 -4.53 114.94 117.18 1h5x s ASN 38 Ca 0.12 -0.57 -0.04 0.00 -0.71 0.00 0.00 52.86 51.66 1h5x s ASN 38 Cb -0.11 -1.99 0.01 0.00 0.41 0.00 0.00 41.25 39.58 1h5x s ASN 38 CO 0.01 -0.20 0.20 0.61 -1.51 0.00 0.00 177.10 176.21 1h5x n GLY 39 N 4.97 1.10 3.00 0.66 0.00 -1.26 -1.32 105.19 112.34 1h5x n GLY 39 Ca -0.14 -0.95 -0.10 0.00 0.00 0.00 0.00 46.02 44.83 1h5x n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h5x s VAL 40 N -2.44 0.07 -0.06 1.61 0.11 -0.12 -4.89 120.40 114.69 1h5x s VAL 40 Ca 0.04 -0.61 0.03 0.00 -2.93 0.00 0.00 61.98 58.51 1h5x s VAL 40 Cb -0.00 -0.26 0.01 0.00 -1.53 0.00 0.00 36.38 34.59 1h5x s VAL 40 CO 0.01 -0.33 -0.13 0.12 -3.33 0.00 0.00 175.10 171.44 1h5x s PHE 41 N -1.04 1.49 -0.14 1.54 5.36 -1.26 -1.83 117.98 122.10 1h5x s PHE 41 Ca -0.11 -0.52 0.02 0.00 -0.96 0.00 0.00 56.93 55.35 1h5x s PHE 41 Cb -0.07 -1.07 0.02 0.00 -0.34 0.00 0.00 43.02 41.56 1h5x s PHE 41 CO -0.00 -0.25 -0.18 0.08 -1.46 0.00 0.00 175.22 173.41 1h5x s VAL 42 N 0.54 1.78 -0.06 3.12 1.01 0.13 -3.20 120.40 123.72 1h5x s VAL 42 Ca -0.13 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.08 1h5x s VAL 42 Cb -0.15 -1.61 0.02 0.00 0.00 0.00 0.00 36.38 34.64 1h5x s VAL 42 CO 0.03 0.49 -0.08 -0.22 0.00 0.00 0.00 175.10 175.33 1h5x s LEU 43 N 1.06 1.46 0.04 3.92 2.96 -0.49 -1.10 118.68 126.53 1h5x s LEU 43 Ca -0.03 -0.22 0.06 0.00 -0.22 0.00 0.00 54.13 53.72 1h5x s LEU 43 Cb -0.14 -0.65 -0.02 0.00 0.50 0.00 0.00 46.19 45.87 1h5x s LEU 43 CO -0.05 -0.02 -0.18 0.00 -1.32 0.00 0.00 176.35 174.78 1h5x s LYS 45 N -1.08 3.65 0.00 0.00 2.20 -0.74 -0.95 119.74 122.82 1h5x s LYS 45 Ca 0.05 -0.51 0.00 0.00 -0.36 0.00 0.00 55.97 55.16 1h5x s LYS 45 Cb -0.08 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.17 1h5x s LYS 45 CO 0.01 0.05 0.00 0.43 -0.36 0.00 0.00 175.35 175.49 1h5x n SER 46 N 4.12 0.00 -3.47 1.43 7.64 0.49 -4.54 113.62 119.29 1h5x n SER 46 Ca -0.17 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.62 1h5x n SER 46 Cb 0.52 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.71 1h5x n SER 46 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1h5x s SER 47 N 0.00 -0.03 0.00 6.43 1.04 -1.26 -4.90 113.70 114.99 1h5x s SER 47 Ca 0.00 -0.94 0.14 0.00 0.48 0.00 0.00 55.95 55.63 1h5x s SER 47 Cb 0.00 0.75 0.84 0.00 0.10 0.00 0.00 66.02 67.71 1h5x s SER 47 CO 0.00 -1.44 1.40 -1.54 0.98 0.00 0.00 173.24 172.64 1h5x n SER 48 N -0.89 0.00 -0.17 7.02 3.41 -1.26 -2.27 113.62 119.46 1h5x n SER 48 Ca -0.05 -1.17 0.12 0.00 -0.26 0.00 0.00 58.87 57.51 1h5x n SER 48 Cb 0.60 0.00 0.27 0.00 -0.26 0.00 0.00 64.21 64.82 1h5x n SER 48 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1h5x n LYS 49 N -0.77 0.53 -3.23 4.33 4.76 -1.26 -4.36 118.16 118.15 1h5x n LYS 49 Ca 0.11 -0.34 -0.25 0.00 -2.87 0.00 0.00 58.31 54.96 1h5x n LYS 49 Cb 0.05 -1.49 -0.06 0.00 -1.84 0.00 0.00 35.03 31.68 1h5x n LYS 49 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1h5x n SER 50 N -0.94 2.15 -4.69 4.39 2.88 -0.96 -4.15 113.62 112.30 1h5x n SER 50 Ca 0.09 -3.15 -0.26 0.00 -1.33 0.00 0.00 58.87 54.22 1h5x n SER 50 Cb 0.35 -0.64 -0.07 0.00 -0.75 0.00 0.00 64.21 63.10 1h5x n SER 50 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h5x s ALA 52 N -1.77 0.78 0.13 0.00 0.00 -0.26 -1.60 121.76 119.04 1h5x s ALA 52 Ca 0.28 -0.95 -0.18 0.00 0.00 0.00 0.00 51.96 51.11 1h5x s ALA 52 Cb -0.09 0.05 0.04 0.00 0.00 0.00 0.00 23.12 23.12 1h5x s ALA 52 CO 0.20 -0.04 0.45 -0.08 0.00 0.00 0.00 175.76 176.29 1h5x s THR 53 N -1.92 0.05 -0.84 0.00 -1.32 -0.41 -1.40 115.64 109.80 1h5x s THR 53 Ca -0.03 -0.42 0.26 0.00 -1.21 0.00 0.00 61.69 60.29 1h5x s THR 53 Cb -0.06 -1.12 0.18 0.00 -1.51 0.00 0.00 72.50 69.99 1h5x s THR 53 CO -0.00 -0.23 1.67 -0.46 -2.21 0.00 0.00 174.62 173.39 1h5x n ASN 54 N -0.26 0.49 -3.16 8.08 6.94 -1.19 -0.16 115.26 125.98 1h5x n ASN 54 Ca -0.16 0.33 0.03 0.00 -0.02 0.00 0.00 54.58 54.75 1h5x n ASN 54 Cb 0.64 -0.34 -0.01 0.00 -2.36 0.00 0.00 39.78 37.71 1h5x n ASN 54 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1h5x s ASN 55 N -3.75 -1.41 0.39 0.53 3.04 -1.26 -4.79 114.94 107.69 1h5x s ASN 55 Ca 0.11 0.34 0.06 0.00 0.04 0.00 0.00 52.86 53.41 1h5x s ASN 55 Cb 0.15 2.00 0.80 0.00 -1.54 0.00 0.00 41.25 42.66 1h5x s ASN 55 CO 0.62 -0.29 2.02 -0.07 -3.04 0.00 0.00 177.10 176.34 1h5x h LEU 56 N 8.01 0.56 -0.46 3.21 -0.00 -1.93 -1.52 115.31 123.18 1h5x h LEU 56 Ca -0.08 -0.01 -0.07 0.00 -0.00 0.00 0.00 57.88 57.73 1h5x h LEU 56 Cb 1.18 -0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 41.69 1h5x h LEU 56 CO 0.19 0.39 0.02 0.00 -0.00 0.00 0.00 178.44 179.04 1h5x h ALA 57 N 1.68 0.62 0.00 1.53 0.00 -2.01 -3.15 119.26 117.93 1h5x h ALA 57 Ca 0.21 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1h5x h ALA 57 Cb 0.05 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1h5x h ALA 57 CO -0.05 0.40 -0.66 -0.09 0.00 0.00 0.00 179.25 178.85 1h5x h ARG 58 N 0.65 0.00 -0.68 0.00 2.43 -1.89 -3.26 114.38 111.63 1h5x h ARG 58 Ca 0.13 0.00 0.12 0.00 -0.81 0.00 0.00 59.98 59.42 1h5x h ARG 58 Cb 0.47 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.98 1h5x h ARG 58 CO 0.02 0.51 0.45 0.00 -1.51 0.00 0.00 179.97 179.44 1h5x h ALA 59 N 1.46 2.01 -0.00 2.80 0.00 -1.24 -1.00 119.26 123.29 1h5x h ALA 59 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1h5x h ALA 59 Cb 1.44 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1h5x h ALA 59 CO 0.07 -0.18 -0.50 0.43 0.00 0.00 0.00 179.25 179.07 1h5x n SER 60 N -4.48 0.85 -4.69 0.00 7.64 -1.23 -2.32 113.62 109.39 1h5x n SER 60 Ca 0.12 -0.65 -0.42 0.00 1.01 0.00 0.00 58.87 58.92 1h5x n SER 60 Cb 0.42 0.34 -0.03 0.00 -1.01 0.00 0.00 64.21 63.94 1h5x n SER 60 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1h5x s LYS 61 N -2.81 4.36 0.11 1.43 2.47 -0.38 -4.73 119.74 120.19 1h5x s LYS 61 Ca 0.15 1.73 -0.28 0.00 -1.56 0.00 0.00 55.97 56.01 1h5x s LYS 61 Cb 0.18 -3.51 -0.06 0.00 -1.46 0.00 0.00 37.83 32.97 1h5x s LYS 61 CO 0.66 -0.42 0.88 -1.21 0.16 0.00 0.00 175.35 175.42 1h5x s GLU 62 N 1.97 4.64 0.14 4.03 2.02 -1.26 -4.13 118.70 126.10 1h5x s GLU 62 Ca 0.57 1.31 0.04 0.00 0.02 0.00 0.00 54.97 56.91 1h5x s GLU 62 Cb -0.27 -3.35 -0.04 0.00 0.10 0.00 0.00 34.13 30.57 1h5x s GLU 62 CO 0.24 0.30 -0.10 0.71 0.02 0.00 0.00 175.26 176.43 1h5x s TYR 63 N -0.24 1.20 0.05 1.61 1.51 -0.17 -4.67 117.35 116.64 1h5x s TYR 63 Ca 0.43 -0.77 -0.34 0.00 -1.01 0.00 0.00 57.07 55.38 1h5x s TYR 63 Cb -0.23 -0.62 -0.13 0.00 -0.11 0.00 0.00 41.96 40.87 1h5x s TYR 63 CO 0.28 0.04 1.72 -0.11 -1.11 0.00 0.00 175.55 176.36 1h5x n LEU 64 N -0.11 3.27 0.21 -1.29 7.94 -1.26 -1.00 117.00 124.76 1h5x n LEU 64 Ca -0.11 1.03 0.07 0.00 -1.11 0.00 0.00 56.01 55.89 1h5x n LEU 64 Cb 0.60 -1.41 0.46 0.00 0.53 0.00 0.00 43.42 43.60 1h5x n LEU 64 CO 0.31 -0.18 0.78 1.55 -1.11 0.00 0.00 177.39 178.75 1h5x h PRO 65 N 7.42 0.00 0.00 1.96 0.13 -1.75 -3.47 132.00 136.29 1h5x h PRO 65 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1h5x h PRO 65 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1h5x h PRO 65 CO 0.92 0.29 0.00 0.00 -0.23 0.00 0.00 178.00 178.98 1h5x n ALA 66 N -2.33 0.00 0.28 -0.56 0.00 -0.70 -1.86 120.51 115.33 1h5x n ALA 66 Ca -0.01 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.48 1h5x n ALA 66 Cb 0.40 0.00 0.23 0.00 0.00 0.00 0.00 19.45 20.08 1h5x n ALA 66 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1h5x n SER 67 N 0.66 0.11 0.10 0.00 7.64 -1.26 -2.00 113.62 118.87 1h5x n SER 67 Ca 0.00 0.54 0.11 0.00 1.01 0.00 0.00 58.87 60.53 1h5x n SER 67 Cb 0.00 -0.56 0.45 0.00 -1.01 0.00 0.00 64.21 63.09 1h5x n SER 67 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1h5x n THR 68 N -1.63 0.82 0.47 0.44 -2.24 -0.78 -1.68 114.28 109.69 1h5x n THR 68 Ca 0.02 0.19 0.11 0.00 -2.27 0.00 0.00 64.05 62.10 1h5x n THR 68 Cb 0.10 -1.07 0.46 0.00 -2.10 0.00 0.00 70.33 67.72 1h5x n THR 68 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1h5x n PHE 69 N -2.08 0.67 0.31 4.78 7.35 -0.85 -2.55 117.46 125.09 1h5x n PHE 69 Ca 0.03 0.25 0.19 0.00 -0.76 0.00 0.00 57.45 57.16 1h5x n PHE 69 Cb 0.24 -0.90 1.04 0.00 0.35 0.00 0.00 39.48 40.21 1h5x n PHE 69 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 1h5x h LYS 70 N 0.00 0.00 0.56 -4.13 1.57 -1.55 -1.31 116.57 111.72 1h5x h LYS 70 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1h5x h LYS 70 Cb 0.41 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.72 1h5x h LYS 70 CO 0.00 0.01 -0.27 0.82 -0.57 0.00 0.00 179.45 179.44 1h5x h ILE 71 N 0.00 0.00 -0.14 1.86 2.04 -1.72 0.24 117.51 119.78 1h5x h ILE 71 Ca -0.00 -0.39 -0.06 0.00 1.00 0.00 0.00 64.86 65.42 1h5x h ILE 71 Cb 0.07 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.14 1h5x h ILE 71 CO 0.00 0.00 -0.18 1.55 0.00 0.00 0.00 178.15 179.53 1h5x h PRO 72 N -1.14 0.24 -0.86 2.37 0.13 -1.74 -2.39 132.00 128.61 1h5x h PRO 72 Ca -0.08 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1h5x h PRO 72 Cb 0.58 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 31.64 1h5x h PRO 72 CO 0.13 0.42 0.55 1.03 -0.23 0.00 0.00 178.00 179.89 1h5x h SER 73 N 0.22 1.01 -0.46 1.44 0.87 -1.24 0.18 113.55 115.57 1h5x h SER 73 Ca 0.04 -0.05 -0.07 0.00 -1.23 0.00 0.00 61.79 60.49 1h5x h SER 73 Cb 0.45 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.14 1h5x h SER 73 CO 0.03 0.75 0.03 0.00 -0.53 0.00 0.00 176.83 177.11 1h5x h ALA 74 N 1.30 0.61 -0.39 6.23 0.00 -0.46 0.19 119.26 126.74 1h5x h ALA 74 Ca 0.31 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1h5x h ALA 74 Cb -0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1h5x h ALA 74 CO -0.06 0.38 0.06 0.82 0.00 0.00 0.00 179.25 180.44 1h5x h ILE 75 N 0.64 1.24 -0.56 0.00 2.04 -1.04 -1.40 117.51 118.43 1h5x h ILE 75 Ca 0.13 -0.87 -0.07 0.00 1.00 0.00 0.00 64.86 65.05 1h5x h ILE 75 Cb 0.46 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 1h5x h ILE 75 CO 0.02 0.30 0.07 0.40 0.00 0.00 0.00 178.15 178.93 1h5x h ILE 76 N 0.48 1.26 -0.80 -0.67 2.04 -0.52 0.12 117.51 119.42 1h5x h ILE 76 Ca 0.12 -1.00 -0.00 0.00 1.00 0.00 0.00 64.86 64.97 1h5x h ILE 76 Cb 0.37 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 37.23 1h5x h ILE 76 CO 0.01 0.36 0.49 1.23 0.00 0.00 0.00 178.15 180.24 1h5x h GLY 77 N 0.83 1.14 0.88 5.37 0.00 -0.41 0.69 103.07 111.57 1h5x h GLY 77 Ca 0.17 -0.46 -0.17 0.00 0.00 0.00 0.00 47.33 46.86 1h5x h GLY 77 CO 0.01 0.45 -0.64 1.41 0.00 0.00 0.00 176.54 177.78 1h5x h LEU 78 N 1.09 0.63 -1.43 3.11 3.38 -0.96 0.29 115.31 121.42 1h5x h LEU 78 Ca 0.29 -0.72 -0.04 0.00 0.09 0.00 0.00 57.88 57.50 1h5x h LEU 78 Cb -0.06 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1h5x h LEU 78 CO -0.06 1.25 -0.07 -0.08 0.09 0.00 0.00 178.44 179.57 1h5x h GLU 79 N 0.05 0.28 -0.01 1.13 4.57 -0.45 -1.90 114.58 118.25 1h5x h GLU 79 Ca -0.07 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.06 1h5x h GLU 79 Cb 1.32 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 1h5x h GLU 79 CO 0.13 0.37 -0.16 0.25 -1.18 0.00 0.00 179.01 178.42 1h5x n THR 80 N -4.31 0.00 0.00 0.32 -2.24 0.21 -4.92 114.28 103.34 1h5x n THR 80 Ca -0.00 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1h5x n THR 80 Cb 0.24 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 1h5x n THR 80 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h5x n GLY 81 N 1.28 2.31 0.37 3.38 0.00 -0.71 -4.87 105.19 106.94 1h5x n GLY 81 Ca 0.15 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.31 1h5x n GLY 81 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1h5x h VAL 82 N 0.00 0.73 -3.70 1.61 2.07 -1.28 -3.29 116.25 112.39 1h5x h VAL 82 Ca 0.00 -0.24 -0.67 0.00 0.82 0.00 0.00 66.70 66.61 1h5x h VAL 82 Cb 0.00 -0.03 -0.21 0.00 -1.52 0.00 0.00 31.29 29.53 1h5x h VAL 82 CO 0.00 0.13 -0.54 -0.63 0.02 0.00 0.00 177.57 176.55 1h5x s ILE 83 N -5.74 4.84 0.10 4.57 1.01 0.85 -4.98 121.20 121.85 1h5x s ILE 83 Ca -0.10 -0.26 -0.29 0.00 0.00 0.00 0.00 60.65 60.00 1h5x s ILE 83 Cb 0.24 -3.43 -0.11 0.00 0.01 0.00 0.00 42.46 39.17 1h5x s ILE 83 CO 0.80 0.10 1.47 0.50 0.00 0.00 0.00 174.94 177.80 1h5x h LYS 84 N 8.38 -0.48 0.00 2.79 1.63 -1.87 -3.40 116.57 123.63 1h5x h LYS 84 Ca -0.33 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.50 1h5x h LYS 84 Cb 1.16 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.90 1h5x h LYS 84 CO 0.61 -0.32 0.00 0.27 -3.45 0.00 0.00 179.45 176.56 1h5x n ASN 85 N -4.98 0.00 0.30 4.20 0.23 -1.26 -4.99 115.26 108.76 1h5x n ASN 85 Ca -0.05 -0.79 0.17 0.00 -0.53 0.00 0.00 54.58 53.38 1h5x n ASN 85 Cb 0.32 0.00 0.94 0.00 -2.08 0.00 0.00 39.78 38.96 1h5x n ASN 85 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1h5x h GLU 86 N 0.00 0.00 -0.05 -3.83 4.11 -1.98 -2.00 114.58 110.83 1h5x h GLU 86 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1h5x h GLU 86 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1h5x h GLU 86 CO 0.00 0.03 0.00 0.72 0.07 0.00 0.00 179.01 179.83 1h5x n HIS 87 N -3.49 0.05 -1.61 2.06 8.25 -1.26 -4.64 115.22 114.57 1h5x n HIS 87 Ca -0.02 -0.02 -0.50 0.00 -0.26 0.00 0.00 57.72 56.91 1h5x n HIS 87 Cb 0.14 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.20 1h5x n HIS 87 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 1h5x n GLN 88 N 0.44 1.46 -4.35 -0.41 -0.06 -0.75 -4.96 117.38 108.74 1h5x n GLN 88 Ca 0.18 0.53 -0.33 0.00 -2.00 0.00 0.00 57.00 55.37 1h5x n GLN 88 Cb 0.40 -2.21 -0.09 0.00 -4.06 0.00 0.00 30.24 24.28 1h5x n GLN 88 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 1h5x s VAL 89 N 0.62 4.14 0.22 1.69 1.01 -1.26 -3.86 120.40 122.96 1h5x s VAL 89 Ca 0.83 -0.49 0.11 0.00 0.00 0.00 0.00 61.98 62.43 1h5x s VAL 89 Cb -0.87 -2.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.66 1h5x s VAL 89 CO 0.44 0.47 -0.18 -0.36 0.00 0.00 0.00 175.10 175.47 1h5x s PHE 90 N -1.00 2.40 0.36 5.22 0.40 0.37 -4.95 117.98 120.79 1h5x s PHE 90 Ca 0.17 -0.31 0.09 0.00 -0.60 0.00 0.00 56.93 56.28 1h5x s PHE 90 Cb -0.11 -1.13 -0.06 0.00 0.51 0.00 0.00 43.02 42.22 1h5x s PHE 90 CO 0.07 0.58 -0.00 0.15 0.70 0.00 0.00 175.22 176.72 1h5x s LYS 91 N -3.05 2.00 0.00 0.44 1.02 -1.26 -0.47 119.74 118.41 1h5x s LYS 91 Ca 0.25 -1.89 0.00 0.00 0.02 0.00 0.00 55.97 54.36 1h5x s LYS 91 Cb -0.07 -1.81 0.00 0.00 -0.52 0.00 0.00 37.83 35.43 1h5x s LYS 91 CO 0.13 0.07 0.00 0.94 -0.92 0.00 0.00 175.35 175.57 1h5x n GLN 101 N -0.94 0.00 -3.83 1.68 -0.06 -1.26 -4.80 117.38 108.17 1h5x n GLN 101 Ca -0.04 0.00 -0.36 0.00 -2.00 0.00 0.00 57.00 54.60 1h5x n GLN 101 Cb 0.64 0.00 -0.13 0.00 -4.06 0.00 0.00 30.24 26.69 1h5x n GLN 101 CO 0.00 0.00 0.00 -1.58 -0.20 0.00 0.00 177.06 175.28 1h5x s TRP 102 N 0.00 3.05 0.08 3.69 0.51 -1.26 -5.09 118.94 119.92 1h5x s TRP 102 Ca 0.00 -0.85 -0.26 0.00 -2.12 0.00 0.00 56.10 52.87 1h5x s TRP 102 Cb 0.00 -2.18 -0.06 0.00 -0.81 0.00 0.00 33.47 30.42 1h5x s TRP 102 CO 0.00 -0.52 0.81 -1.21 -0.51 0.00 0.00 176.95 175.52 1h5x s GLU 103 N 1.51 4.55 0.74 4.98 0.41 -1.26 -5.04 118.70 124.60 1h5x s GLU 103 Ca 0.05 1.16 -0.14 0.00 -0.41 0.00 0.00 54.97 55.63 1h5x s GLU 103 Cb -0.15 -3.35 0.05 0.00 -1.78 0.00 0.00 34.13 28.89 1h5x s GLU 103 CO 0.00 0.31 1.16 -0.98 -0.49 0.00 0.00 175.26 175.26 1h5x s ARG 104 N -0.20 2.17 0.96 1.61 1.70 -1.26 -4.98 118.95 118.95 1h5x s ARG 104 Ca 0.40 1.56 -0.12 0.00 -0.47 0.00 0.00 55.73 57.10 1h5x s ARG 104 Cb -0.21 -1.86 0.10 0.00 -0.57 0.00 0.00 34.95 32.41 1h5x s ARG 104 CO 0.25 -1.77 0.70 -0.25 -1.08 0.00 0.00 175.30 173.15 1h5x n ASP 105 N -2.94 -1.16 -4.40 -2.89 8.00 -1.26 -5.00 116.55 106.89 1h5x n ASP 105 Ca 0.12 0.31 -0.29 0.00 0.71 0.00 0.00 54.79 55.64 1h5x n ASP 105 Cb 0.51 -1.30 -0.13 0.00 -0.02 0.00 0.00 41.12 40.18 1h5x n ASP 105 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1h5x s LEU 106 N -3.53 2.38 0.00 0.64 1.43 0.38 -4.93 118.68 115.05 1h5x s LEU 106 Ca 0.61 -0.67 -0.13 0.00 -1.03 0.00 0.00 54.13 52.92 1h5x s LEU 106 Cb -0.22 -1.31 0.19 0.00 0.03 0.00 0.00 46.19 44.89 1h5x s LEU 106 CO 0.64 0.20 1.15 -1.54 0.23 0.00 0.00 176.35 177.03 1h5x n SER 107 N 1.09 0.26 -0.16 2.29 3.41 -1.26 -0.48 113.62 118.76 1h5x n SER 107 Ca -0.17 -1.52 -0.09 0.00 -0.26 0.00 0.00 58.87 56.82 1h5x n SER 107 Cb 0.53 -0.86 0.00 0.00 -0.26 0.00 0.00 64.21 63.61 1h5x n SER 107 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1h5x h LEU 108 N 0.00 0.74 -0.61 1.04 5.85 -1.83 0.11 115.31 120.62 1h5x h LEU 108 Ca -0.37 -0.25 -0.08 0.00 0.84 0.00 0.00 57.88 58.01 1h5x h LEU 108 Cb 1.07 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.88 1h5x h LEU 108 CO 0.28 0.81 0.06 -0.09 -0.34 0.00 0.00 178.44 179.15 1h5x h ARG 109 N 0.65 1.03 -0.51 1.25 2.43 -1.93 -0.84 114.38 116.46 1h5x h ARG 109 Ca 0.14 -0.30 -0.04 0.00 -0.81 0.00 0.00 59.98 58.98 1h5x h ARG 109 Cb 0.38 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1h5x h ARG 109 CO 0.01 0.99 0.18 0.78 -1.51 0.00 0.00 179.97 180.42 1h5x h GLY 110 N 0.94 0.84 1.85 2.80 0.00 -1.84 -2.07 103.07 105.58 1h5x h GLY 110 Ca 0.18 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 46.97 1h5x h GLY 110 CO 0.02 0.45 -0.23 0.00 0.00 0.00 0.00 176.54 176.78 1h5x h ALA 111 N 1.03 1.43 -0.06 3.60 0.00 -0.54 -2.80 119.26 121.92 1h5x h ALA 111 Ca 0.17 -0.26 -0.21 0.00 0.00 0.00 0.00 54.91 54.60 1h5x h ALA 111 Cb 0.24 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1h5x h ALA 111 CO -0.01 0.41 -0.83 0.82 0.00 0.00 0.00 179.25 179.63 1h5x h ILE 112 N 0.17 1.36 0.00 0.00 2.04 -0.86 -3.33 117.51 116.89 1h5x h ILE 112 Ca 0.03 -2.23 -0.14 0.00 1.00 0.00 0.00 64.86 63.52 1h5x h ILE 112 Cb 0.50 2.22 -0.02 0.00 -0.74 0.00 0.00 36.82 38.77 1h5x h ILE 112 CO 0.03 0.68 -0.67 1.56 0.00 0.00 0.00 178.15 179.75 1h5x h GLN 113 N 0.31 0.00 0.00 2.37 4.20 -1.17 -3.46 115.11 117.35 1h5x h GLN 113 Ca -0.06 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.28 1h5x h GLN 113 Cb 1.45 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.23 1h5x h GLN 113 CO 0.15 0.67 -0.08 1.33 -0.67 0.00 0.00 178.83 180.23 1h5x n VAL 114 N -3.51 0.00 0.37 -0.54 0.24 -1.08 -5.04 118.33 108.78 1h5x n VAL 114 Ca -0.00 -1.45 -0.15 0.00 -2.04 0.00 0.00 64.34 60.70 1h5x n VAL 114 Cb 0.72 -0.54 -0.07 0.00 -1.47 0.00 0.00 33.84 32.48 1h5x n VAL 114 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1h5x h SER 115 N 0.16 -0.82 -4.77 -1.34 0.02 -1.90 -3.45 113.55 101.46 1h5x h SER 115 Ca -0.21 0.03 -0.13 0.00 -0.84 0.00 0.00 61.79 60.64 1h5x h SER 115 Cb 0.91 0.21 -0.08 0.00 0.14 0.00 0.00 62.40 63.59 1h5x h SER 115 CO 0.31 -0.58 -0.19 0.00 -1.14 0.00 0.00 176.83 175.23 1h5x n ALA 116 N -2.48 -0.84 -0.33 3.77 0.00 -1.26 -4.76 120.51 114.61 1h5x n ALA 116 Ca -0.12 -0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.41 1h5x n ALA 116 Cb 0.38 -0.83 0.32 0.00 0.00 0.00 0.00 19.45 19.31 1h5x n ALA 116 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1h5x h VAL 117 N -0.18 0.60 -0.17 0.00 3.04 -1.92 0.14 116.25 117.75 1h5x h VAL 117 Ca -0.13 -0.20 -0.03 0.00 -1.01 0.00 0.00 66.70 65.33 1h5x h VAL 117 Cb 0.88 -0.04 -0.01 0.00 -2.01 0.00 0.00 31.29 30.11 1h5x h VAL 117 CO 0.19 0.11 -0.05 1.55 -1.01 0.00 0.00 177.57 178.36 1h5x h PRO 118 N 0.59 0.25 -0.33 4.17 0.13 -1.99 0.43 132.00 135.25 1h5x h PRO 118 Ca 0.57 -0.04 0.01 0.00 -0.87 0.00 0.00 66.00 65.67 1h5x h PRO 118 Cb 0.98 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.05 1h5x h PRO 118 CO -0.44 0.32 0.19 0.28 -0.23 0.00 0.00 178.00 178.12 1h5x h VAL 119 N 0.25 1.03 0.00 1.56 2.07 -1.33 0.62 116.25 120.46 1h5x h VAL 119 Ca 0.06 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 1h5x h VAL 119 Cb 0.26 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 1h5x h VAL 119 CO 0.01 0.07 -0.10 -0.26 0.02 0.00 0.00 177.57 177.31 1h5x h PHE 120 N 0.40 0.00 -0.29 1.57 -1.00 -1.32 -2.44 116.94 113.86 1h5x h PHE 120 Ca 0.13 0.00 -0.17 0.00 2.81 0.00 0.00 57.97 60.74 1h5x h PHE 120 Cb 0.00 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.56 1h5x h PHE 120 CO -0.08 0.10 -0.47 1.96 -1.61 0.00 0.00 178.31 178.22 1h5x h GLN 121 N 0.00 0.83 -0.46 1.51 4.20 -0.16 -1.12 115.11 119.91 1h5x h GLN 121 Ca -0.00 -0.51 -0.02 0.00 0.06 0.00 0.00 58.65 58.18 1h5x h GLN 121 Cb 0.94 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.75 1h5x h GLN 121 CO 0.01 1.14 0.22 0.37 -0.67 0.00 0.00 178.83 179.91 1h5x h GLN 122 N 0.60 0.67 -0.25 1.46 5.75 -0.73 -0.84 115.11 121.77 1h5x h GLN 122 Ca 0.02 -0.10 0.03 0.00 -0.15 0.00 0.00 58.65 58.46 1h5x h GLN 122 Cb 1.08 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 29.47 1h5x h GLN 122 CO 0.11 0.57 0.05 0.82 -2.65 0.00 0.00 178.83 177.72 1h5x h ILE 123 N 0.61 0.88 -0.62 2.39 2.04 -1.33 -1.31 117.51 120.16 1h5x h ILE 123 Ca 0.16 -0.05 0.03 0.00 1.00 0.00 0.00 64.86 66.00 1h5x h ILE 123 Cb 0.12 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 1h5x h ILE 123 CO -0.02 0.03 0.38 0.00 0.00 0.00 0.00 178.15 178.53 1h5x h ALA 124 N 1.19 0.81 -0.34 1.87 0.00 -0.81 -0.88 119.26 121.10 1h5x h ALA 124 Ca 0.12 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1h5x h ALA 124 Cb 0.12 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1h5x h ALA 124 CO -0.16 0.11 0.21 0.00 0.00 0.00 0.00 179.25 179.41 1h5x h ARG 125 N 0.74 0.46 0.00 0.00 3.08 -0.70 -1.05 114.38 116.90 1h5x h ARG 125 Ca 0.25 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.19 1h5x h ARG 125 Cb 0.04 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1h5x h ARG 125 CO -0.11 0.34 -0.35 0.93 -1.07 0.00 0.00 179.97 179.71 1h5x h GLU 126 N 0.44 0.00 -0.13 0.04 5.08 -0.88 -2.70 114.58 116.43 1h5x h GLU 126 Ca 0.12 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.40 1h5x h GLU 126 Cb -0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1h5x h GLU 126 CO -0.02 0.35 -0.24 0.28 -1.00 0.00 0.00 179.01 178.38 1h5x h VAL 127 N 0.00 1.37 0.00 3.13 2.07 -0.86 -3.50 116.25 118.45 1h5x h VAL 127 Ca -0.00 -1.49 0.00 0.00 0.82 0.00 0.00 66.70 66.02 1h5x h VAL 127 Cb 0.65 2.02 0.00 0.00 -1.52 0.00 0.00 31.29 32.44 1h5x h VAL 127 CO 0.05 0.44 0.00 0.61 0.02 0.00 0.00 177.57 178.69 1h5x n GLY 128 N 0.39 -0.54 0.43 2.17 0.00 -0.42 -4.36 105.19 102.86 1h5x n GLY 128 Ca -0.07 -1.57 -0.14 0.00 0.00 0.00 0.00 46.02 44.25 1h5x n GLY 128 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1h5x h GLU 129 N 0.00 -0.55 -0.15 1.61 4.57 -1.87 -1.43 114.58 116.75 1h5x h GLU 129 Ca 0.00 0.04 0.04 0.00 -1.18 0.00 0.00 59.36 58.26 1h5x h GLU 129 Cb 0.00 0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 28.67 1h5x h GLU 129 CO 0.00 -0.37 -0.10 0.28 -1.18 0.00 0.00 179.01 177.64 1h5x h VAL 130 N -0.57 0.70 -0.52 0.32 2.07 -2.00 -0.60 116.25 115.65 1h5x h VAL 130 Ca 0.05 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.49 1h5x h VAL 130 Cb 0.67 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 1h5x h VAL 130 CO -0.38 0.00 0.02 0.03 0.02 0.00 0.00 177.57 177.26 1h5x h ARG 131 N -0.10 0.90 -0.15 1.57 3.08 -1.74 -1.79 114.38 116.15 1h5x h ARG 131 Ca 0.09 -0.28 0.02 0.00 0.07 0.00 0.00 59.98 59.88 1h5x h ARG 131 Cb 0.24 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 1h5x h ARG 131 CO -0.22 0.92 0.04 1.98 -1.07 0.00 0.00 179.97 181.62 1h5x h MET 132 N 0.77 0.11 -0.71 0.04 4.05 -1.04 -0.96 114.93 117.19 1h5x h MET 132 Ca 0.15 -0.01 0.07 0.00 -0.28 0.00 0.00 59.70 59.64 1h5x h MET 132 Cb 0.50 -0.02 -0.06 0.00 -0.80 0.00 0.00 31.60 31.21 1h5x h MET 132 CO 0.02 0.07 0.39 0.37 0.23 0.00 0.00 176.91 178.00 1h5x h GLN 133 N 0.11 0.68 -0.21 0.39 5.75 -0.96 -0.53 115.11 120.34 1h5x h GLN 133 Ca 0.06 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.52 1h5x h GLN 133 Cb 0.05 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.43 1h5x h GLN 133 CO -0.07 0.45 0.10 -0.22 -2.65 0.00 0.00 178.83 176.43 1h5x h LYS 134 N 0.70 0.30 -0.66 1.69 3.64 -0.85 -2.12 116.57 119.27 1h5x h LYS 134 Ca 0.33 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.58 1h5x h LYS 134 Cb 0.25 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 1h5x h LYS 134 CO -0.21 0.32 0.09 1.88 -2.27 0.00 0.00 179.45 179.26 1h5x h TYR 135 N 0.20 1.17 0.00 1.91 0.05 -0.68 -0.53 116.97 119.10 1h5x h TYR 135 Ca 0.07 -0.17 -0.05 0.00 0.05 0.00 0.00 58.73 58.63 1h5x h TYR 135 Cb 0.12 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 37.54 1h5x h TYR 135 CO -0.02 0.99 -0.23 -0.07 -1.05 0.00 0.00 178.16 177.78 1h5x h LEU 136 N 1.02 0.00 0.01 3.88 3.38 -1.06 0.29 115.31 122.84 1h5x h LEU 136 Ca 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 1h5x h LEU 136 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1h5x h LEU 136 CO 0.02 0.23 -0.01 0.50 0.09 0.00 0.00 178.44 179.27 1h5x h LYS 137 N 0.00 -0.02 -0.72 1.13 3.64 -0.76 0.89 116.57 120.73 1h5x h LYS 137 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1h5x h LYS 137 Cb 0.64 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.43 1h5x h LYS 137 CO 0.03 0.50 0.47 0.87 -2.27 0.00 0.00 179.45 179.05 1h5x h LYS 138 N -0.54 0.95 -0.00 1.90 1.57 -0.66 -1.29 116.57 118.50 1h5x h LYS 138 Ca -0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1h5x h LYS 138 Cb 0.53 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.62 1h5x h LYS 138 CO 0.00 0.64 -0.02 1.19 -0.57 0.00 0.00 179.45 180.69 1h5x n PHE 139 N -4.42 0.00 -3.97 -1.35 3.72 0.99 -4.78 117.46 107.66 1h5x n PHE 139 Ca 0.08 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.20 1h5x n PHE 139 Cb 0.04 -0.36 -0.01 0.00 -0.94 0.00 0.00 39.48 38.21 1h5x n PHE 139 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1h5x n SER 140 N -1.35 -1.70 -4.49 4.37 7.64 0.18 -4.85 113.62 113.42 1h5x n SER 140 Ca 0.11 -0.95 -0.42 0.00 1.01 0.00 0.00 58.87 58.62 1h5x n SER 140 Cb 0.29 -3.26 -0.03 0.00 -1.01 0.00 0.00 64.21 60.19 1h5x n SER 140 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1h5x s TYR 141 N -3.69 2.59 0.00 1.43 5.04 -0.43 -4.96 117.35 117.33 1h5x s TYR 141 Ca 0.25 -0.51 0.00 0.00 -2.44 0.00 0.00 57.07 54.38 1h5x s TYR 141 Cb -0.13 -4.42 0.00 0.00 0.35 0.00 0.00 41.96 37.76 1h5x s TYR 141 CO 0.88 -1.78 0.00 0.41 -1.34 0.00 0.00 175.55 173.72 1h5x n GLY 142 N 5.47 2.03 0.00 8.97 0.00 -1.26 -2.08 105.19 118.33 1h5x n GLY 142 Ca 0.03 -0.41 0.12 0.00 0.00 0.00 0.00 46.02 45.77 1h5x n GLY 142 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1h5x n ASN 143 N -0.90 0.00 -2.51 1.61 6.94 0.17 -4.89 115.26 115.68 1h5x n ASN 143 Ca 0.00 -0.18 -0.15 0.00 -0.02 0.00 0.00 54.58 54.22 1h5x n ASN 143 Cb 0.00 -0.24 -0.00 0.00 -2.36 0.00 0.00 39.78 37.18 1h5x n ASN 143 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1h5x n GLN 144 N -1.24 -2.29 -3.42 -3.83 6.02 -0.88 -4.93 117.38 106.81 1h5x n GLN 144 Ca 0.13 0.70 -0.44 0.00 -0.01 0.00 0.00 57.00 57.38 1h5x n GLN 144 Cb 0.18 -5.33 -0.08 0.00 1.02 0.00 0.00 30.24 26.03 1h5x n GLN 144 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1h5x s ASN 145 N -2.10 6.05 -0.17 1.08 3.04 -1.26 -4.92 114.94 116.66 1h5x s ASN 145 Ca 0.04 -1.47 0.16 0.00 0.04 0.00 0.00 52.86 51.62 1h5x s ASN 145 Cb -0.02 -2.15 0.63 0.00 -1.54 0.00 0.00 41.25 38.18 1h5x s ASN 145 CO 0.04 -0.67 1.54 2.30 -3.04 0.00 0.00 177.10 177.28 1h5x n ILE 146 N 5.15 2.22 -1.13 -5.21 -5.35 -1.26 -1.80 119.36 111.97 1h5x n ILE 146 Ca -0.12 -1.53 -0.31 0.00 -0.27 0.00 0.00 62.75 60.52 1h5x n ILE 146 Cb 0.43 -0.11 0.11 0.00 -1.74 0.00 0.00 39.64 38.33 1h5x n ILE 146 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1h5x s SER 147 N -1.32 4.02 -0.13 7.28 1.04 -1.26 -4.44 113.70 118.90 1h5x s SER 147 Ca 0.46 1.85 -0.01 0.00 0.48 0.00 0.00 55.95 58.74 1h5x s SER 147 Cb 0.34 -2.49 0.00 0.00 0.10 0.00 0.00 66.02 63.97 1h5x s SER 147 CO 0.15 -2.35 0.11 0.61 0.98 0.00 0.00 173.24 172.74 1h5x n GLY 148 N -0.89 0.61 0.00 7.32 0.00 -1.26 -4.19 105.19 106.78 1h5x n GLY 148 Ca 0.09 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1h5x n GLY 148 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h5x n GLY 149 N -0.81 1.46 0.31 -0.02 0.00 -1.26 -4.60 105.19 100.27 1h5x n GLY 149 Ca -0.01 -0.81 0.16 0.00 0.00 0.00 0.00 46.02 45.36 1h5x n GLY 149 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1h5x h ILE 150 N 0.00 0.46 -0.52 -0.61 6.09 -1.91 -1.67 117.51 119.34 1h5x h ILE 150 Ca 0.00 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.48 1h5x h ILE 150 Cb 0.00 0.94 -0.00 0.00 0.47 0.00 0.00 36.82 38.23 1h5x h ILE 150 CO 0.00 0.00 0.01 -0.90 -3.07 0.00 0.00 178.15 174.19 1h5x n ASP 151 N -3.76 5.40 -0.09 2.19 5.75 -1.26 -4.54 116.55 120.24 1h5x n ASP 151 Ca -0.02 -2.97 0.00 0.00 -0.01 0.00 0.00 54.79 51.80 1h5x n ASP 151 Cb 0.16 -0.66 0.00 0.00 -1.03 0.00 0.00 41.12 39.58 1h5x n ASP 151 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1h5x n LYS 152 N 0.39 0.00 0.25 0.11 2.85 -0.78 -4.78 118.16 116.19 1h5x n LYS 152 Ca 0.27 0.00 0.09 0.00 -1.05 0.00 0.00 58.31 57.62 1h5x n LYS 152 Cb 1.16 0.00 0.63 0.00 -0.65 0.00 0.00 35.03 36.16 1h5x n LYS 152 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 1h5x h PHE 153 N 0.00 0.00 0.00 5.58 -0.00 -1.57 -0.39 116.94 120.56 1h5x h PHE 153 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 1h5x h PHE 153 Cb 0.75 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.70 1h5x h PHE 153 CO -0.05 0.14 -0.50 -2.67 -0.00 0.00 0.00 178.31 175.23 1h5x n TRP 154 N -4.05 0.25 -0.03 6.09 2.14 -1.26 -1.36 117.44 119.23 1h5x n TRP 154 Ca -0.02 0.07 0.03 0.00 2.07 0.00 0.00 57.50 59.65 1h5x n TRP 154 Cb 0.22 -0.46 -0.11 0.00 -0.81 0.00 0.00 31.31 30.15 1h5x n TRP 154 CO 0.00 0.00 0.00 -0.11 2.07 0.00 0.00 177.69 179.65 1h5x n LEU 155 N -1.77 0.00 0.00 5.67 7.94 -0.82 -1.72 117.00 126.30 1h5x n LEU 155 Ca 0.05 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.95 1h5x n LEU 155 Cb 0.38 0.10 0.00 0.00 0.53 0.00 0.00 43.42 44.43 1h5x n LEU 155 CO 0.35 0.10 0.00 -1.84 -1.11 0.00 0.00 177.39 174.89 1h5x n GLU 156 N -2.17 0.00 0.00 1.96 0.28 -0.22 -4.91 120.64 115.58 1h5x n GLU 156 Ca -0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.91 1h5x n GLU 156 Cb 0.56 -0.10 0.00 0.00 1.43 0.00 0.00 31.44 33.33 1h5x n GLU 156 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1h5x n GLY 157 N 0.00 -0.41 0.96 -1.84 0.00 -0.46 -4.96 105.19 98.48 1h5x n GLY 157 Ca 0.00 -1.39 0.11 0.00 0.00 0.00 0.00 46.02 44.74 1h5x n GLY 157 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1h5x n GLN 158 N 0.00 2.20 -2.04 1.61 1.13 -1.23 -4.93 117.38 114.12 1h5x n GLN 158 Ca 0.00 -1.98 -0.42 0.00 -1.94 0.00 0.00 57.00 52.66 1h5x n GLN 158 Cb 0.00 -1.44 -0.03 0.00 0.11 0.00 0.00 30.24 28.88 1h5x n GLN 158 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1h5x s LEU 159 N -1.62 4.38 -0.00 1.08 2.96 -0.75 -4.70 118.68 120.03 1h5x s LEU 159 Ca 0.30 2.56 -0.02 0.00 -0.22 0.00 0.00 54.13 56.75 1h5x s LEU 159 Cb 0.19 -3.61 -0.00 0.00 0.50 0.00 0.00 46.19 43.27 1h5x s LEU 159 CO 0.28 -0.72 0.04 -0.13 -1.32 0.00 0.00 176.35 174.50 1h5x s ARG 160 N 0.42 0.22 -0.12 1.98 1.81 -1.26 -4.17 118.95 117.83 1h5x s ARG 160 Ca 0.64 -0.24 -0.13 0.00 -1.72 0.00 0.00 55.73 54.27 1h5x s ARG 160 Cb -0.41 0.09 0.03 0.00 -0.45 0.00 0.00 34.95 34.21 1h5x s ARG 160 CO 0.36 -0.04 0.36 -1.50 -0.68 0.00 0.00 175.30 173.80 1h5x s ILE 161 N -0.73 0.01 0.55 1.52 2.07 -0.17 -0.65 121.20 123.79 1h5x s ILE 161 Ca -0.08 -0.04 -0.03 0.00 -1.41 0.00 0.00 60.65 59.08 1h5x s ILE 161 Cb -0.05 -0.52 0.01 0.00 0.13 0.00 0.00 42.46 42.03 1h5x s ILE 161 CO -0.00 -0.02 0.82 -0.94 -1.91 0.00 0.00 174.94 172.89 1h5x s SER 162 N 0.04 5.55 0.26 4.50 1.04 -1.26 -1.00 113.70 122.83 1h5x s SER 162 Ca -0.01 0.46 -0.03 0.00 0.48 0.00 0.00 55.95 56.84 1h5x s SER 162 Cb -0.03 -1.49 0.32 0.00 0.10 0.00 0.00 66.02 64.92 1h5x s SER 162 CO 0.01 -1.01 1.82 0.00 0.98 0.00 0.00 173.24 175.03 1h5x h ALA 163 N -0.00 1.16 -0.62 5.32 0.00 -1.71 -0.90 119.26 122.52 1h5x h ALA 163 Ca -0.45 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.21 1h5x h ALA 163 Cb 1.27 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 1h5x h ALA 163 CO 0.58 0.59 0.16 0.28 0.00 0.00 0.00 179.25 180.86 1h5x h VAL 164 N 0.94 1.25 -0.44 0.00 2.07 -1.83 -1.71 116.25 116.53 1h5x h VAL 164 Ca 0.21 -0.91 -0.06 0.00 0.82 0.00 0.00 66.70 66.76 1h5x h VAL 164 Cb 0.25 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1h5x h VAL 164 CO -0.01 0.34 0.02 -1.13 0.02 0.00 0.00 177.57 176.81 1h5x h ASN 165 N 0.90 0.68 -0.38 0.57 -0.73 -1.72 -0.84 115.58 114.05 1h5x h ASN 165 Ca 0.19 -0.15 -0.00 0.00 1.87 0.00 0.00 56.30 58.21 1h5x h ASN 165 Cb 0.35 -0.18 -0.02 0.00 0.27 0.00 0.00 38.32 38.74 1h5x h ASN 165 CO 0.00 0.74 0.22 1.56 -0.37 0.00 0.00 177.43 179.58 1h5x h GLN 166 N 0.68 0.53 -0.26 6.67 1.08 -0.71 0.08 115.11 123.18 1h5x h GLN 166 Ca 0.14 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.28 1h5x h GLN 166 Cb 0.39 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 1h5x h GLN 166 CO 0.01 0.41 0.15 0.28 -0.95 0.00 0.00 178.83 178.73 1h5x h VAL 167 N 0.50 1.11 -0.61 -0.54 2.07 -0.80 0.44 116.25 118.41 1h5x h VAL 167 Ca 0.14 -0.29 0.05 0.00 0.82 0.00 0.00 66.70 67.42 1h5x h VAL 167 Cb 0.03 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 30.58 1h5x h VAL 167 CO -0.02 0.11 0.34 -0.33 0.02 0.00 0.00 177.57 177.69 1h5x h GLU 168 N 0.31 0.63 -0.21 1.57 5.08 -0.87 0.14 114.58 121.23 1h5x h GLU 168 Ca 0.09 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1h5x h GLU 168 Cb 0.05 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1h5x h GLU 168 CO -0.02 0.41 0.08 0.35 -1.00 0.00 0.00 179.01 178.84 1h5x h PHE 169 N 0.64 0.31 -0.18 4.33 3.57 -0.62 -1.54 116.94 123.47 1h5x h PHE 169 Ca 0.27 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.69 1h5x h PHE 169 Cb 0.14 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 1h5x h PHE 169 CO -0.08 0.35 -0.13 -0.07 -2.23 0.00 0.00 178.31 176.15 1h5x h LEU 170 N 0.18 0.27 -0.36 0.59 3.38 -0.52 -1.20 115.31 117.65 1h5x h LEU 170 Ca 0.07 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1h5x h LEU 170 Cb 0.17 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1h5x h LEU 170 CO -0.01 0.44 0.03 -0.08 0.09 0.00 0.00 178.44 178.91 1h5x h GLU 171 N 0.27 0.62 -0.74 1.13 4.81 -0.46 0.26 114.58 120.47 1h5x h GLU 171 Ca 0.05 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 59.09 1h5x h GLU 171 Cb 0.40 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.68 1h5x h GLU 171 CO 0.02 0.71 0.41 0.77 -0.73 0.00 0.00 179.01 180.19 1h5x h SER 172 N 0.45 0.92 -0.21 1.04 0.02 -0.74 -1.51 113.55 113.51 1h5x h SER 172 Ca 0.11 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 1h5x h SER 172 Cb 0.41 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 1h5x h SER 172 CO 0.01 0.74 0.11 0.25 -1.14 0.00 0.00 176.83 176.80 1h5x h LEU 173 N 1.02 0.27 -1.07 5.07 5.85 -0.99 0.26 115.31 125.72 1h5x h LEU 173 Ca 0.26 -0.10 0.09 0.00 0.84 0.00 0.00 57.88 58.97 1h5x h LEU 173 Cb 0.02 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 40.91 1h5x h LEU 173 CO -0.04 0.29 0.62 0.15 -0.34 0.00 0.00 178.44 179.12 1h5x h PHE 174 N 0.22 1.11 -0.12 1.25 3.57 -0.55 -1.19 116.94 121.23 1h5x h PHE 174 Ca 0.07 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1h5x h PHE 174 Cb 0.09 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 38.47 1h5x h PHE 174 CO -0.03 0.52 0.00 1.28 -2.23 0.00 0.00 178.31 177.84 1h5x n LEU 175 N -4.54 1.52 -2.37 0.59 4.77 -0.60 -4.92 117.00 111.45 1h5x n LEU 175 Ca 0.16 -0.61 -0.20 0.00 -0.03 0.00 0.00 56.01 55.34 1h5x n LEU 175 Cb 0.27 -0.08 -0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1h5x n LEU 175 CO 0.30 0.30 -0.21 0.59 -1.33 0.00 0.00 177.39 177.04 1h5x n ASN 176 N 0.21 -5.73 -0.85 -1.43 3.02 -0.45 -4.89 115.26 105.15 1h5x n ASN 176 Ca 0.17 -0.06 0.11 0.00 -0.03 0.00 0.00 54.58 54.77 1h5x n ASN 176 Cb 0.32 -4.72 0.29 0.00 -0.61 0.00 0.00 39.78 35.05 1h5x n ASN 176 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1h5x n LYS 177 N -3.07 2.12 -2.02 3.52 5.02 0.82 -4.89 118.16 119.66 1h5x n LYS 177 Ca -0.22 -1.68 -0.32 0.00 -2.02 0.00 0.00 58.31 54.07 1h5x n LYS 177 Cb 0.67 -1.45 0.01 0.00 -0.02 0.00 0.00 35.03 34.23 1h5x n LYS 177 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1h5x s LEU 178 N -1.55 3.42 -1.29 -0.35 1.43 -1.24 -4.91 118.68 114.20 1h5x s LEU 178 Ca 0.35 1.66 -0.17 0.00 -1.03 0.00 0.00 54.13 54.94 1h5x s LEU 178 Cb 0.20 -4.51 0.01 0.00 0.03 0.00 0.00 46.19 41.91 1h5x s LEU 178 CO 0.29 -1.03 2.06 -1.20 0.23 0.00 0.00 176.35 176.69 1h5x n SER 179 N -2.23 3.83 -3.65 2.29 7.64 -1.26 -4.76 113.62 115.49 1h5x n SER 179 Ca 0.08 -2.82 -0.08 0.00 1.01 0.00 0.00 58.87 57.05 1h5x n SER 179 Cb 0.53 -1.59 -0.02 0.00 -1.01 0.00 0.00 64.21 62.12 1h5x n SER 179 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1h5x s ALA 180 N 4.19 -1.50 0.60 -0.43 0.00 -1.26 -5.05 121.76 118.31 1h5x s ALA 180 Ca 0.52 0.20 -0.19 0.00 0.00 0.00 0.00 51.96 52.49 1h5x s ALA 180 Cb 0.11 0.77 -0.03 0.00 0.00 0.00 0.00 23.12 23.97 1h5x s ALA 180 CO -0.00 -0.90 1.22 -1.54 0.00 0.00 0.00 175.76 174.53 1h5x s SER 181 N -2.81 5.12 0.26 0.00 1.04 -1.26 -4.88 113.70 111.17 1h5x s SER 181 Ca 0.07 2.41 -0.05 0.00 0.48 0.00 0.00 55.95 58.86 1h5x s SER 181 Cb -0.03 -2.60 0.30 0.00 0.10 0.00 0.00 66.02 63.79 1h5x s SER 181 CO -0.03 -1.64 1.89 0.50 0.98 0.00 0.00 173.24 174.95 1h5x h LYS 182 N 0.84 1.18 -0.07 4.02 3.64 -1.93 -1.97 116.57 122.28 1h5x h LYS 182 Ca -0.50 -0.12 0.04 0.00 -1.27 0.00 0.00 60.65 58.79 1h5x h LYS 182 Cb 1.30 -0.24 -0.05 0.00 -0.41 0.00 0.00 32.23 32.83 1h5x h LYS 182 CO 0.55 0.85 -0.28 1.49 -2.27 0.00 0.00 179.45 179.78 1h5x h GLU 183 N 1.19 -0.37 -0.24 1.90 4.81 -1.99 0.38 114.58 120.26 1h5x h GLU 183 Ca 0.31 0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.50 1h5x h GLU 183 Cb -0.01 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1h5x h GLU 183 CO -0.05 -0.25 -0.14 -0.91 -0.73 0.00 0.00 179.01 176.93 1h5x h ASN 184 N -0.39 0.38 -0.47 1.04 2.35 -1.85 -0.86 115.58 115.79 1h5x h ASN 184 Ca 0.08 -0.09 -0.09 0.00 -0.55 0.00 0.00 56.30 55.65 1h5x h ASN 184 Cb 0.51 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.76 1h5x h ASN 184 CO -0.29 0.55 -0.06 1.56 -1.65 0.00 0.00 177.43 177.54 1h5x h GLN 185 N 0.37 0.87 -0.78 0.81 4.20 -0.77 -2.31 115.11 117.51 1h5x h GLN 185 Ca 0.07 -0.31 -0.03 0.00 0.06 0.00 0.00 58.65 58.45 1h5x h GLN 185 Cb 0.46 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.14 1h5x h GLN 185 CO 0.03 0.94 0.38 -0.07 -0.67 0.00 0.00 178.83 179.44 1h5x h LEU 186 N 0.71 1.01 -0.23 1.46 3.38 -0.44 -0.87 115.31 120.32 1h5x h LEU 186 Ca 0.12 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1h5x h LEU 186 Cb 0.59 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1h5x h LEU 186 CO 0.04 0.85 0.15 0.40 0.09 0.00 0.00 178.44 179.97 1h5x h ILE 187 N 1.09 1.06 -0.46 1.22 2.04 -1.00 -1.25 117.51 120.21 1h5x h ILE 187 Ca 0.27 -0.11 -0.07 0.00 1.00 0.00 0.00 64.86 65.95 1h5x h ILE 187 Cb 0.11 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 1h5x h ILE 187 CO -0.03 0.06 0.02 0.58 0.00 0.00 0.00 178.15 178.77 1h5x h VAL 188 N 0.32 1.26 -0.92 1.67 2.07 -1.16 -1.43 116.25 118.05 1h5x h VAL 188 Ca 0.09 -1.01 0.06 0.00 0.82 0.00 0.00 66.70 66.66 1h5x h VAL 188 Cb -0.04 1.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.68 1h5x h VAL 188 CO -0.02 0.35 0.58 0.11 0.02 0.00 0.00 177.57 178.61 1h5x h LYS 189 N 0.64 1.02 -0.23 1.57 1.57 -0.96 -1.78 116.57 118.40 1h5x h LYS 189 Ca 0.13 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 1h5x h LYS 189 Cb 0.47 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1h5x h LYS 189 CO 0.02 0.68 0.04 1.49 -0.57 0.00 0.00 179.45 181.11 1h5x h GLU 190 N 1.05 0.37 0.00 3.15 4.57 -0.96 -2.63 114.58 120.12 1h5x h GLU 190 Ca 0.40 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.49 1h5x h GLU 190 Cb 0.18 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 1h5x h GLU 190 CO -0.18 0.50 0.00 0.00 -1.18 0.00 0.00 179.01 178.15 1h5x h ALA 191 N 0.85 1.00 -0.02 2.92 0.00 -0.66 -1.93 119.26 121.43 1h5x h ALA 191 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1h5x h ALA 191 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1h5x h ALA 191 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53 1h5x n LEU 192 N -2.96 1.38 -4.69 0.00 4.77 -0.73 -4.68 117.00 110.10 1h5x n LEU 192 Ca -0.02 -0.47 -0.42 0.00 -0.03 0.00 0.00 56.01 55.07 1h5x n LEU 192 Cb 0.09 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.15 1h5x n LEU 192 CO 0.19 0.23 1.30 -0.69 -1.33 0.00 0.00 177.39 177.10 1h5x s VAL 193 N -1.99 3.14 0.00 4.08 1.01 -0.73 -1.36 120.40 124.55 1h5x s VAL 193 Ca 0.38 0.58 0.00 0.00 0.00 0.00 0.00 61.98 62.94 1h5x s VAL 193 Cb 0.21 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 33.22 1h5x s VAL 193 CO 0.33 -0.00 0.00 0.35 0.00 0.00 0.00 175.10 175.78 1h5x n THR 194 N 4.72 0.00 -3.77 3.92 -2.24 0.18 -4.92 114.28 112.18 1h5x n THR 194 Ca 0.15 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.81 1h5x n THR 194 Cb 0.41 0.32 -0.13 0.00 -2.10 0.00 0.00 70.33 68.82 1h5x n THR 194 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1h5x s GLU 195 N -1.85 0.15 -0.09 -0.78 2.12 -1.16 -5.01 118.70 112.08 1h5x s GLU 195 Ca 0.00 0.35 0.03 0.00 0.36 0.00 0.00 54.97 55.70 1h5x s GLU 195 Cb 0.00 -0.07 0.01 0.00 0.26 0.00 0.00 34.13 34.33 1h5x s GLU 195 CO 0.00 -0.11 -0.17 0.00 -0.54 0.00 0.00 175.26 174.44 1h5x s ALA 196 N 0.79 1.70 0.13 6.30 0.00 -1.26 -0.78 121.76 128.63 1h5x s ALA 196 Ca -0.06 -0.69 0.02 0.00 0.00 0.00 0.00 51.96 51.23 1h5x s ALA 196 Cb -0.07 -0.72 -0.04 0.00 0.00 0.00 0.00 23.12 22.28 1h5x s ALA 196 CO -0.04 0.13 -0.05 0.00 0.00 0.00 0.00 175.76 175.80 1h5x s ALA 197 N 0.62 1.19 0.35 0.00 0.00 -0.25 -5.02 121.76 118.65 1h5x s ALA 197 Ca -0.14 -1.45 0.05 0.00 0.00 0.00 0.00 51.96 50.42 1h5x s ALA 197 Cb -0.16 0.25 0.71 0.00 0.00 0.00 0.00 23.12 23.92 1h5x s ALA 197 CO 0.04 -0.23 1.93 -1.35 0.00 0.00 0.00 175.76 176.15 1h5x h PRO 198 N 2.85 0.78 0.00 0.00 0.11 -2.02 -2.78 132.00 130.93 1h5x h PRO 198 Ca -0.36 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1h5x h PRO 198 Cb 1.18 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1h5x h PRO 198 CO 0.64 0.51 -0.74 0.93 -0.21 0.00 0.00 178.00 179.13 1h5x h GLU 199 N 0.80 0.00 -3.34 1.05 3.07 -1.96 -3.49 114.58 110.71 1h5x h GLU 199 Ca 0.36 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 59.19 1h5x h GLU 199 Cb 0.35 0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 28.16 1h5x h GLU 199 CO -0.14 0.00 0.00 1.52 -1.40 0.00 0.00 179.01 178.99 1h5x s TYR 200 N -3.23 -0.10 -0.10 4.33 -0.85 -1.05 -2.07 117.35 114.28 1h5x s TYR 200 Ca 0.04 -0.24 0.01 0.00 -0.52 0.00 0.00 57.07 56.36 1h5x s TYR 200 Cb 0.12 0.35 0.02 0.00 0.38 0.00 0.00 41.96 42.83 1h5x s TYR 200 CO 0.74 -0.88 -0.10 -1.17 -1.52 0.00 0.00 175.55 172.63 1h5x s LEU 201 N -2.87 1.40 -0.19 -3.49 2.96 0.17 -1.09 118.68 115.57 1h5x s LEU 201 Ca 0.09 -0.31 -0.08 0.00 -0.22 0.00 0.00 54.13 53.61 1h5x s LEU 201 Cb -0.00 -0.86 -0.04 0.00 0.50 0.00 0.00 46.19 45.79 1h5x s LEU 201 CO -0.04 -0.06 0.07 -0.69 -1.32 0.00 0.00 176.35 174.32 1h5x s VAL 202 N 1.29 4.80 -0.17 1.68 1.01 0.04 -1.00 120.40 128.05 1h5x s VAL 202 Ca -0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 1h5x s VAL 202 Cb -0.14 -3.18 -0.01 0.00 0.00 0.00 0.00 36.38 33.06 1h5x s VAL 202 CO -0.04 0.44 -0.11 -1.00 0.00 0.00 0.00 175.10 174.39 1h5x s HIS 203 N 0.57 2.86 0.17 5.22 3.76 -0.36 -0.65 115.29 126.87 1h5x s HIS 203 Ca 0.04 -0.91 -0.13 0.00 -0.15 0.00 0.00 55.06 53.91 1h5x s HIS 203 Cb -0.13 -1.96 0.01 0.00 1.11 0.00 0.00 32.58 31.62 1h5x s HIS 203 CO 0.01 -0.43 0.39 -1.54 -0.85 0.00 0.00 174.74 172.32 1h5x s SER 204 N 0.92 -0.11 -0.11 1.40 1.04 -0.46 -0.56 113.70 115.82 1h5x s SER 204 Ca -0.02 -0.65 -0.05 0.00 0.48 0.00 0.00 55.95 55.71 1h5x s SER 204 Cb -0.15 0.50 0.05 0.00 0.10 0.00 0.00 66.02 66.52 1h5x s SER 204 CO -0.01 -0.95 0.25 -0.75 0.98 0.00 0.00 173.24 172.77 1h5x s LYS 205 N -3.91 0.20 0.53 4.02 2.47 0.75 -4.83 119.74 118.98 1h5x s LYS 205 Ca 0.12 0.56 -0.02 0.00 -1.56 0.00 0.00 55.97 55.08 1h5x s LYS 205 Cb 0.01 -0.11 0.01 0.00 -1.46 0.00 0.00 37.83 36.29 1h5x s LYS 205 CO -0.03 -0.18 0.78 0.95 0.16 0.00 0.00 175.35 177.03 1h5x s THR 206 N 1.41 3.51 -0.06 3.43 -4.23 -1.26 -1.52 115.64 116.92 1h5x s THR 206 Ca -0.08 -0.37 -0.21 0.00 -1.18 0.00 0.00 61.69 59.84 1h5x s THR 206 Cb -0.11 -3.34 0.04 0.00 1.34 0.00 0.00 72.50 70.44 1h5x s THR 206 CO -0.09 -0.28 0.48 -0.83 -0.54 0.00 0.00 174.62 173.36 1h5x s GLY 207 N -4.30 -0.35 -0.30 3.99 0.00 -0.63 -3.70 107.32 102.03 1h5x s GLY 207 Ca 0.52 0.90 -0.01 0.00 0.00 0.00 0.00 44.72 46.14 1h5x s GLY 207 CO 0.40 0.64 0.62 -0.12 0.00 0.00 0.00 173.10 174.65 1h5x s PHE 208 N -0.95 -1.58 -0.29 1.90 5.36 -1.26 -0.56 117.98 120.61 1h5x s PHE 208 Ca -0.10 1.62 0.26 0.00 -0.96 0.00 0.00 56.93 57.76 1h5x s PHE 208 Cb -0.03 0.53 0.67 0.00 -0.34 0.00 0.00 43.02 43.85 1h5x s PHE 208 CO 0.06 -0.87 1.73 0.66 -1.46 0.00 0.00 175.22 175.34 1h5x h SER 209 N 8.00 0.00 -4.67 6.13 4.64 -1.54 -3.43 113.55 122.67 1h5x h SER 209 Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1h5x h SER 209 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1h5x h SER 209 CO 0.24 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.81 1h5x n GLY 210 N 0.78 0.56 0.01 -0.77 0.00 -1.26 -4.84 105.19 99.67 1h5x n GLY 210 Ca 0.03 -2.18 0.12 0.00 0.00 0.00 0.00 46.02 43.99 1h5x n GLY 210 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1h5x n VAL 211 N 2.11 0.07 -4.98 1.61 0.24 -1.26 -3.68 118.33 112.44 1h5x n VAL 211 Ca 0.00 -0.06 0.00 0.00 -2.04 0.00 0.00 64.34 62.24 1h5x n VAL 211 Cb 0.00 0.18 0.00 0.00 -1.47 0.00 0.00 33.84 32.55 1h5x n VAL 211 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1h5x n GLY 212 N 1.47 2.01 3.37 7.63 0.00 -1.26 -2.92 105.19 115.48 1h5x n GLY 212 Ca 0.05 -0.49 -0.15 0.00 0.00 0.00 0.00 46.02 45.43 1h5x n GLY 212 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1h5x s THR 213 N 0.00 0.00 0.17 2.61 -4.23 -0.11 -4.86 115.64 109.22 1h5x s THR 213 Ca 0.00 -1.80 -0.26 0.00 -1.18 0.00 0.00 61.69 58.45 1h5x s THR 213 Cb 0.00 -2.53 0.03 0.00 1.34 0.00 0.00 72.50 71.34 1h5x s THR 213 CO 0.00 0.00 1.55 -0.33 -0.54 0.00 0.00 174.62 175.30 1h5x h GLU 214 N 2.23 -0.14 0.00 3.99 5.08 -2.00 -0.87 114.58 122.88 1h5x h GLU 214 Ca -0.28 0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.03 1h5x h GLU 214 Cb 1.24 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 1h5x h GLU 214 CO 0.40 -0.09 -0.25 0.66 -1.00 0.00 0.00 179.01 178.73 1h5x h SER 215 N -0.15 0.00 -2.08 1.42 4.64 -2.01 -3.41 113.55 111.96 1h5x h SER 215 Ca 0.19 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 61.13 1h5x h SER 215 Cb 0.53 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 62.30 1h5x h SER 215 CO -0.80 0.25 -0.69 0.21 -0.87 0.00 0.00 176.83 174.92 1h5x s ASN 216 N -6.22 1.53 1.03 4.97 2.47 -0.36 -5.15 114.94 113.21 1h5x s ASN 216 Ca 0.02 -1.42 -0.12 0.00 0.42 0.00 0.00 52.86 51.76 1h5x s ASN 216 Cb 0.09 0.43 0.20 0.00 -1.45 0.00 0.00 41.25 40.52 1h5x s ASN 216 CO 0.66 -0.30 1.08 -2.16 -3.72 0.00 0.00 177.10 172.66 1h5x s PRO 217 N 1.65 0.19 0.92 0.43 0.04 -1.02 -0.94 135.00 136.28 1h5x s PRO 217 Ca 0.15 0.55 -0.13 0.00 0.04 0.00 0.00 61.00 61.61 1h5x s PRO 217 Cb -0.16 -1.71 0.18 0.00 0.04 0.00 0.00 34.50 32.86 1h5x s PRO 217 CO -0.11 -2.90 1.26 0.20 0.04 0.00 0.00 177.00 175.49 1h5x s GLY 218 N -3.32 1.77 0.01 0.56 0.00 -0.41 -4.71 107.32 101.23 1h5x s GLY 218 Ca 0.66 -1.26 0.07 0.00 0.00 0.00 0.00 44.72 44.18 1h5x s GLY 218 CO 0.59 -0.54 -0.20 0.54 0.00 0.00 0.00 173.10 173.48 1h5x s VAL 219 N -3.76 1.61 -0.00 1.40 0.11 -1.26 -0.71 120.40 117.79 1h5x s VAL 219 Ca 0.72 -1.03 0.08 0.00 -2.93 0.00 0.00 61.98 58.83 1h5x s VAL 219 Cb -0.04 -1.37 -0.02 0.00 -1.53 0.00 0.00 36.38 33.41 1h5x s VAL 219 CO 0.51 0.32 -0.25 0.00 -3.33 0.00 0.00 175.10 172.36 1h5x s ALA 220 N -0.64 2.06 0.19 1.54 0.00 -0.10 -1.26 121.76 123.54 1h5x s ALA 220 Ca 0.07 -1.10 0.05 0.00 0.00 0.00 0.00 51.96 50.99 1h5x s ALA 220 Cb -0.08 -0.50 -0.05 0.00 0.00 0.00 0.00 23.12 22.49 1h5x s ALA 220 CO 0.01 0.50 -0.10 -1.58 0.00 0.00 0.00 175.76 174.59 1h5x s TRP 221 N -0.63 1.49 -0.25 0.00 0.52 0.28 -1.17 118.94 119.19 1h5x s TRP 221 Ca 0.10 -0.72 -0.04 0.00 0.02 0.00 0.00 56.10 55.46 1h5x s TRP 221 Cb -0.10 -0.76 0.14 0.00 -1.15 0.00 0.00 33.47 31.60 1h5x s TRP 221 CO -0.00 0.16 0.46 -0.46 0.02 0.00 0.00 176.95 177.13 1h5x s TRP 222 N -3.21 -1.04 0.12 -1.98 -0.00 -0.55 -1.60 118.94 110.68 1h5x s TRP 222 Ca 0.21 1.30 0.05 0.00 -0.00 0.00 0.00 56.10 57.66 1h5x s TRP 222 Cb 0.02 0.27 -0.04 0.00 -0.00 0.00 0.00 33.47 33.72 1h5x s TRP 222 CO 0.04 -0.70 -0.12 0.14 -0.00 0.00 0.00 176.95 176.31 1h5x s VAL 223 N 2.66 1.18 -4.86 5.86 -7.23 -0.58 -0.83 120.40 116.60 1h5x s VAL 223 Ca 0.10 -1.80 0.00 0.00 -1.81 0.00 0.00 61.98 58.47 1h5x s VAL 223 Cb -0.14 -1.58 0.00 0.00 0.56 0.00 0.00 36.38 35.22 1h5x s VAL 223 CO -0.17 -0.56 0.00 0.61 -0.31 0.00 0.00 175.10 174.68 1h5x n GLY 224 N 0.31 -0.49 3.38 2.32 0.00 -0.38 -0.18 105.19 110.15 1h5x n GLY 224 Ca -0.14 -1.01 -0.12 0.00 0.00 0.00 0.00 46.02 44.75 1h5x n GLY 224 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1h5x s TRP 225 N -3.29 -0.39 -0.12 1.61 -2.14 0.27 -0.68 118.94 114.21 1h5x s TRP 225 Ca 0.00 0.26 0.03 0.00 2.66 0.00 0.00 56.10 59.05 1h5x s TRP 225 Cb 0.00 0.37 0.00 0.00 -3.10 0.00 0.00 33.47 30.74 1h5x s TRP 225 CO 0.00 -0.71 -0.23 0.08 -2.66 0.00 0.00 176.95 173.43 1h5x s VAL 226 N -3.18 2.07 -0.46 -0.66 1.01 0.13 -1.22 120.40 118.09 1h5x s VAL 226 Ca -0.01 -1.00 -0.13 0.00 0.00 0.00 0.00 61.98 60.84 1h5x s VAL 226 Cb 0.00 -1.80 0.08 0.00 0.00 0.00 0.00 36.38 34.66 1h5x s VAL 226 CO -0.08 0.56 0.35 -1.61 0.00 0.00 0.00 175.10 174.32 1h5x s GLU 227 N 0.53 2.81 -0.29 2.72 2.02 -0.17 -0.99 118.70 125.32 1h5x s GLU 227 Ca -0.14 -1.44 0.01 0.00 0.02 0.00 0.00 54.97 53.42 1h5x s GLU 227 Cb -0.17 -4.00 0.06 0.00 0.10 0.00 0.00 34.13 30.13 1h5x s GLU 227 CO 0.05 -1.03 -0.03 0.21 0.02 0.00 0.00 175.26 174.47 1h5x s LYS 228 N 1.54 2.20 7.40 1.61 2.20 -0.74 -0.65 119.74 133.29 1h5x s LYS 228 Ca 0.04 -1.41 0.00 0.00 -0.36 0.00 0.00 55.97 54.23 1h5x s LYS 228 Cb -0.24 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.00 1h5x s LYS 228 CO 0.04 -0.66 0.00 0.41 -0.36 0.00 0.00 175.35 174.78 1h5x n GLY 229 N 4.49 2.82 0.97 5.54 0.00 -0.88 -1.22 105.19 116.91 1h5x n GLY 229 Ca -0.11 -0.26 0.11 0.00 0.00 0.00 0.00 46.02 45.76 1h5x n GLY 229 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1h5x n THR 230 N 0.00 0.49 -3.90 2.61 -2.24 -1.26 -4.93 114.28 105.05 1h5x n THR 230 Ca 0.00 -0.64 -0.21 0.00 -2.27 0.00 0.00 64.05 60.93 1h5x n THR 230 Cb 0.00 0.66 -0.03 0.00 -2.10 0.00 0.00 70.33 68.86 1h5x n THR 230 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1h5x s GLU 231 N -1.51 2.98 0.00 -0.78 2.56 -0.35 -5.12 118.70 116.48 1h5x s GLU 231 Ca 0.37 -1.07 0.01 0.00 0.00 0.00 0.00 54.97 54.27 1h5x s GLU 231 Cb 0.21 -2.63 -0.00 0.00 2.00 0.00 0.00 34.13 33.70 1h5x s GLU 231 CO 0.29 0.26 -0.02 0.54 -0.56 0.00 0.00 175.26 175.77 1h5x s VAL 232 N -2.17 0.15 -0.08 3.70 0.11 -1.26 -1.79 120.40 119.05 1h5x s VAL 232 Ca 0.37 -0.20 0.01 0.00 -2.93 0.00 0.00 61.98 59.24 1h5x s VAL 232 Cb -0.08 -0.15 0.02 0.00 -1.53 0.00 0.00 36.38 34.64 1h5x s VAL 232 CO 0.27 -0.03 -0.11 -0.31 -3.33 0.00 0.00 175.10 171.59 1h5x s TYR 233 N -0.24 1.49 -0.06 1.54 1.51 -0.16 -0.38 117.35 121.04 1h5x s TYR 233 Ca -0.01 -0.61 -0.04 0.00 -1.01 0.00 0.00 57.07 55.39 1h5x s TYR 233 Cb -0.02 -1.13 -0.04 0.00 -0.11 0.00 0.00 41.96 40.66 1h5x s TYR 233 CO -0.00 -0.35 0.12 -0.06 -1.11 0.00 0.00 175.55 174.14 1h5x s PHE 234 N 0.97 3.45 0.01 2.71 0.08 -0.12 0.17 117.98 125.25 1h5x s PHE 234 Ca -0.09 0.37 -0.04 0.00 0.12 0.00 0.00 56.93 57.29 1h5x s PHE 234 Cb -0.15 -1.85 -0.01 0.00 -0.57 0.00 0.00 43.02 40.45 1h5x s PHE 234 CO 0.00 0.64 0.07 -0.59 -0.10 0.00 0.00 175.22 175.23 1h5x s PHE 235 N -1.11 0.14 -0.14 0.36 -0.12 0.15 -0.63 117.98 116.63 1h5x s PHE 235 Ca 0.19 -0.32 -0.06 0.00 -0.05 0.00 0.00 56.93 56.69 1h5x s PHE 235 Cb -0.12 -0.11 0.06 0.00 -0.63 0.00 0.00 43.02 42.22 1h5x s PHE 235 CO 0.09 -0.25 0.30 0.00 -0.05 0.00 0.00 175.22 175.31 1h5x s ALA 236 N -1.50 -0.71 -0.02 1.99 0.00 -0.26 -1.25 121.76 120.01 1h5x s ALA 236 Ca -0.15 1.12 0.04 0.00 0.00 0.00 0.00 51.96 52.97 1h5x s ALA 236 Cb -0.08 -0.95 -0.00 0.00 0.00 0.00 0.00 23.12 22.08 1h5x s ALA 236 CO 0.00 -0.49 -0.13 0.12 0.00 0.00 0.00 175.76 175.27 1h5x s PHE 237 N 2.00 1.22 0.02 0.00 2.19 -0.01 -0.69 117.98 122.70 1h5x s PHE 237 Ca -0.04 -0.29 -0.06 0.00 0.33 0.00 0.00 56.93 56.87 1h5x s PHE 237 Cb -0.11 -0.82 -0.00 0.00 -1.31 0.00 0.00 43.02 40.77 1h5x s PHE 237 CO -0.10 -0.08 0.11 0.54 1.83 0.00 0.00 175.22 177.52 1h5x s ASN 238 N -0.04 0.09 0.05 6.13 2.20 -0.76 -1.48 114.94 121.12 1h5x s ASN 238 Ca 0.00 -0.33 -0.12 0.00 -0.94 0.00 0.00 52.86 51.46 1h5x s ASN 238 Cb -0.08 0.20 0.01 0.00 -2.00 0.00 0.00 41.25 39.39 1h5x s ASN 238 CO 0.00 -0.41 0.27 0.00 -2.94 0.00 0.00 177.10 174.03 1h5x s MET 239 N -1.77 0.79 0.32 3.55 0.23 -0.31 -0.95 119.30 121.16 1h5x s MET 239 Ca -0.12 -0.57 -0.25 0.00 -1.03 0.00 0.00 55.69 53.71 1h5x s MET 239 Cb -0.06 0.34 -0.10 0.00 -1.53 0.00 0.00 34.83 33.48 1h5x s MET 239 CO -0.01 -0.25 0.93 -0.51 -2.03 0.00 0.00 175.02 173.15 1h5x s ASP 240 N -2.15 7.31 -0.13 -1.18 1.01 -0.43 -0.93 116.67 120.17 1h5x s ASP 240 Ca -0.04 1.80 -0.07 0.00 0.71 0.00 0.00 52.55 54.95 1h5x s ASP 240 Cb -0.00 -2.57 0.05 0.00 1.01 0.00 0.00 42.92 41.41 1h5x s ASP 240 CO -0.04 -0.07 0.30 -0.51 0.21 0.00 0.00 175.17 175.06 1h5x s ILE 241 N -1.63 -0.03 -0.02 0.77 2.07 0.11 -4.68 121.20 117.79 1h5x s ILE 241 Ca 0.50 0.12 0.02 0.00 -1.41 0.00 0.00 60.65 59.89 1h5x s ILE 241 Cb -0.18 -0.45 0.04 0.00 0.13 0.00 0.00 42.46 41.99 1h5x s ILE 241 CO 0.23 0.05 0.94 -0.90 -1.91 0.00 0.00 174.94 173.35 1h5x n ASP 242 N 4.16 1.68 -3.66 4.50 5.68 -1.26 -1.28 116.55 126.38 1h5x n ASP 242 Ca -0.24 -1.98 -0.06 0.00 -0.50 0.00 0.00 54.79 52.01 1h5x n ASP 242 Cb 0.54 -0.06 -0.07 0.00 -1.14 0.00 0.00 41.12 40.39 1h5x n ASP 242 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 1h5x s ASN 243 N -1.09 -0.81 0.46 -1.12 3.04 -1.26 -4.86 114.94 109.31 1h5x s ASN 243 Ca 0.04 1.34 0.24 0.00 0.04 0.00 0.00 52.86 54.52 1h5x s ASN 243 Cb 0.04 1.63 1.32 0.00 -1.54 0.00 0.00 41.25 42.69 1h5x s ASN 243 CO 0.00 -0.22 1.71 -0.33 -3.04 0.00 0.00 177.10 175.22 1h5x h GLU 244 N 7.64 0.00 -0.13 0.43 5.08 -1.95 -1.16 114.58 124.49 1h5x h GLU 244 Ca -0.23 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.16 1h5x h GLU 244 Cb 1.15 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 1h5x h GLU 244 CO 0.15 0.00 0.11 -0.91 -1.00 0.00 0.00 179.01 177.36 1h5x h ASN 245 N 0.00 0.00 0.34 1.42 4.21 -2.03 -1.64 115.58 117.88 1h5x h ASN 245 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1h5x h ASN 245 Cb 0.36 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.56 1h5x h ASN 245 CO 0.00 0.00 -0.30 0.29 -1.29 0.00 0.00 177.43 176.13 1h5x n LYS 246 N -4.13 0.57 -0.26 0.81 4.76 -0.44 -4.46 118.16 115.01 1h5x n LYS 246 Ca 0.00 -0.31 0.07 0.00 -2.87 0.00 0.00 58.31 55.19 1h5x n LYS 246 Cb 0.23 -1.49 0.18 0.00 -1.84 0.00 0.00 35.03 32.11 1h5x n LYS 246 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1h5x h LEU 247 N 0.77 -0.27 -1.87 -0.35 3.38 -1.46 -0.23 115.31 115.28 1h5x h LEU 247 Ca 0.00 0.19 0.19 0.00 0.09 0.00 0.00 57.88 58.35 1h5x h LEU 247 Cb 0.49 0.32 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 1h5x h LEU 247 CO 0.00 -0.17 0.61 -0.65 0.09 0.00 0.00 178.44 178.33 1h5x h PRO 248 N 0.13 0.00 0.00 1.13 0.11 -1.81 -1.04 132.00 130.51 1h5x h PRO 248 Ca 0.44 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.52 1h5x h PRO 248 Cb 0.79 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.90 1h5x h PRO 248 CO -0.66 0.00 -0.15 -0.07 -0.21 0.00 0.00 178.00 176.92 1h5x h LEU 249 N 0.00 0.00 -1.23 2.35 3.38 -1.37 -2.15 115.31 116.29 1h5x h LEU 249 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1h5x h LEU 249 Cb 1.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.28 1h5x h LEU 249 CO -0.00 0.15 0.00 0.08 0.09 0.00 0.00 178.44 178.75 1h5x h ARG 250 N 0.00 0.00 0.00 1.13 -0.00 -1.35 -2.14 114.38 112.02 1h5x h ARG 250 Ca -0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 59.98 59.72 1h5x h ARG 250 Cb 0.37 0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 30.30 1h5x h ARG 250 CO 0.02 0.00 -1.99 1.63 -0.00 0.00 0.00 179.97 179.63 1h5x n LYS 251 N -2.45 0.45 -0.13 0.08 5.02 -1.00 -4.48 118.16 115.66 1h5x n LYS 251 Ca 0.00 0.10 -0.12 0.00 -2.02 0.00 0.00 58.31 56.27 1h5x n LYS 251 Cb 0.17 -1.35 -0.02 0.00 -0.02 0.00 0.00 35.03 33.82 1h5x n LYS 251 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1h5x h SER 252 N 0.00 0.87 0.78 4.39 4.64 -1.33 -1.68 113.55 121.22 1h5x h SER 252 Ca -0.39 -0.41 -0.04 0.00 -0.47 0.00 0.00 61.79 60.48 1h5x h SER 252 Cb 1.60 -0.24 0.01 0.00 -0.31 0.00 0.00 62.40 63.46 1h5x h SER 252 CO -0.06 1.09 -0.38 0.40 -0.87 0.00 0.00 176.83 177.01 1h5x h ILE 253 N 0.65 0.18 -0.26 0.95 2.04 -1.66 -0.19 117.51 119.22 1h5x h ILE 253 Ca 0.09 -0.10 -0.03 0.00 1.00 0.00 0.00 64.86 65.82 1h5x h ILE 253 Cb 0.77 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 1h5x h ILE 253 CO 0.06 0.01 0.05 1.55 0.00 0.00 0.00 178.15 179.82 1h5x h PRO 254 N -1.13 0.37 -0.68 2.37 0.13 -1.78 -1.84 132.00 129.44 1h5x h PRO 254 Ca -0.11 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 64.92 1h5x h PRO 254 Cb 0.82 -0.07 -0.03 0.00 0.13 0.00 0.00 31.00 31.85 1h5x h PRO 254 CO 0.18 0.36 0.22 1.15 -0.23 0.00 0.00 178.00 179.68 1h5x h THR 255 N 0.37 1.25 -0.47 1.56 2.02 -1.15 0.77 112.91 117.27 1h5x h THR 255 Ca 0.09 -0.86 -0.02 0.00 0.77 0.00 0.00 66.41 66.39 1h5x h THR 255 Cb 0.17 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1h5x h THR 255 CO -0.00 0.33 0.20 0.11 0.37 0.00 0.00 175.52 176.53 1h5x h LYS 256 N 0.99 0.69 -0.30 6.66 1.57 -0.47 0.38 116.57 126.10 1h5x h LYS 256 Ca 0.22 -0.12 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 1h5x h LYS 256 Cb 0.28 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1h5x h LYS 256 CO -0.01 0.62 0.11 0.82 -0.57 0.00 0.00 179.45 180.42 1h5x h ILE 257 N 0.61 1.18 -0.21 1.86 2.04 -1.00 0.42 117.51 122.42 1h5x h ILE 257 Ca 0.16 -0.57 -0.14 0.00 1.00 0.00 0.00 64.86 65.31 1h5x h ILE 257 Cb 0.17 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 1h5x h ILE 257 CO -0.01 0.19 -0.45 0.24 0.00 0.00 0.00 178.15 178.12 1h5x h MET 258 N 0.33 0.52 -0.67 2.37 2.86 -0.72 -1.89 114.93 117.73 1h5x h MET 258 Ca 0.10 -0.28 -0.05 0.00 -2.06 0.00 0.00 59.70 57.40 1h5x h MET 258 Cb 0.20 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.84 1h5x h MET 258 CO -0.01 0.87 0.21 0.00 1.06 0.00 0.00 176.91 179.04 1h5x h ALA 259 N 1.09 0.88 -0.33 6.32 0.00 -0.01 -0.54 119.26 126.67 1h5x h ALA 259 Ca 0.03 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 1h5x h ALA 259 Cb 0.95 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1h5x h ALA 259 CO 0.08 0.55 -0.06 0.66 0.00 0.00 0.00 179.25 180.49 1h5x h SER 260 N 0.98 0.50 0.10 0.00 4.64 -0.71 0.05 113.55 119.11 1h5x h SER 260 Ca 0.22 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1h5x h SER 260 Cb 0.30 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1h5x h SER 260 CO -0.01 0.61 0.00 -0.62 -0.87 0.00 0.00 176.83 175.94 1h5x n GLU 261 N -4.24 0.72 -1.04 4.77 -0.58 -0.73 -4.87 120.64 114.67 1h5x n GLU 261 Ca 0.01 0.01 -0.02 0.00 -0.42 0.00 0.00 57.16 56.75 1h5x n GLU 261 Cb 0.28 -1.50 -0.01 0.00 -0.57 0.00 0.00 31.44 29.65 1h5x n GLU 261 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1h5x n GLY 262 N 0.69 0.51 0.11 0.62 0.00 0.00 -4.95 105.19 102.19 1h5x n GLY 262 Ca 0.18 -0.35 -0.16 0.00 0.00 0.00 0.00 46.02 45.69 1h5x n GLY 262 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1h5x h ILE 263 N 0.00 1.50 -3.72 -0.61 2.04 -1.31 -3.48 117.51 111.94 1h5x h ILE 263 Ca -0.03 -2.06 -0.25 0.00 1.00 0.00 0.00 64.86 63.52 1h5x h ILE 263 Cb 0.21 2.75 -0.15 0.00 -0.74 0.00 0.00 36.82 38.90 1h5x h ILE 263 CO 0.05 0.58 -0.70 0.27 0.00 0.00 0.00 178.15 178.34 1h5x s ILE 264 N -3.07 0.80 0.60 -0.67 -4.36 -1.25 -4.96 121.20 108.29 1h5x s ILE 264 Ca -0.15 -1.93 -0.20 0.00 -0.26 0.00 0.00 60.65 58.11 1h5x s ILE 264 Cb 0.02 -1.68 -0.03 0.00 1.25 0.00 0.00 42.46 42.01 1h5x s ILE 264 CO 0.78 -0.83 1.33 -0.83 0.24 0.00 0.00 174.94 175.63 1h5x s GLY 265 N -3.02 2.88 0.00 6.27 0.00 -1.26 -4.14 107.32 108.05 1h5x s GLY 265 Ca 0.12 1.29 0.00 0.00 0.00 0.00 0.00 44.72 46.13 1h5x s GLY 265 CO -0.03 1.76 0.46 0.61 0.00 0.00 0.00 173.10 175.90