#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p1i n TYR 48 N 0.00 2.94 0.25 3.17 4.02 -1.26 -4.91 117.16 121.36 2p1i n TYR 48 Ca 0.00 -2.90 0.10 0.00 -0.01 0.00 0.00 57.90 55.09 2p1i n TYR 48 Cb 0.00 -1.34 0.66 0.00 -0.02 0.00 0.00 39.34 38.64 2p1i n TYR 48 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2p1i h PRO 49 N 5.67 0.00 0.09 -0.72 0.13 -2.03 -1.87 132.00 133.27 2p1i h PRO 49 Ca 0.20 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 65.07 2p1i h PRO 49 Cb 0.67 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.80 2p1i h PRO 49 CO 1.26 0.14 -1.16 1.49 -0.23 0.00 0.00 178.00 179.50 2p1i h GLU 50 N 0.00 0.20 -0.64 0.86 4.81 -2.01 -2.94 114.58 114.86 2p1i h GLU 50 Ca -0.00 -0.33 -0.08 0.00 -0.13 0.00 0.00 59.36 58.81 2p1i h GLU 50 Cb 0.33 0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.81 2p1i h GLU 50 CO 0.02 1.15 0.07 0.28 -0.73 0.00 0.00 179.01 179.81 2p1i h VAL 51 N 0.06 1.26 -0.65 0.32 2.07 -1.82 -3.09 116.25 114.40 2p1i h VAL 51 Ca -0.10 -1.06 0.07 0.00 0.82 0.00 0.00 66.70 66.43 2p1i h VAL 51 Cb 1.90 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 32.32 2p1i h VAL 51 CO 0.18 0.39 0.43 -0.25 0.02 0.00 0.00 177.57 178.34 2p1i h TRP 52 N 0.99 0.63 -0.03 1.57 2.91 -1.28 -2.45 115.95 118.29 2p1i h TRP 52 Ca 0.19 0.02 -0.10 0.00 1.13 0.00 0.00 58.89 60.13 2p1i h TRP 52 Cb 0.47 -0.21 -0.01 0.00 -0.51 0.00 0.00 29.16 28.89 2p1i h TRP 52 CO 0.03 0.33 -0.45 -0.91 -1.03 0.00 0.00 178.44 176.42 2p1i h ASN 53 N 0.62 0.07 0.27 2.65 -0.26 -1.43 -2.15 115.58 115.35 2p1i h ASN 53 Ca 0.28 -0.03 -0.17 0.00 -0.56 0.00 0.00 56.30 55.82 2p1i h ASN 53 Cb 0.31 -0.02 -0.01 0.00 -1.06 0.00 0.00 38.32 37.55 2p1i h ASN 53 CO -0.09 0.51 -0.68 -0.26 -1.06 0.00 0.00 177.43 175.85 2p1i h PHE 54 N 0.06 0.50 -0.15 1.19 -1.00 -1.48 -2.45 116.94 113.60 2p1i h PHE 54 Ca 0.00 -0.21 -0.18 0.00 2.81 0.00 0.00 57.97 60.39 2p1i h PHE 54 Cb 0.81 -0.08 0.01 0.00 3.61 0.00 0.00 35.95 40.30 2p1i h PHE 54 CO 0.00 0.94 -0.60 -0.92 -1.61 0.00 0.00 178.31 176.13 2p1i h TYR 55 N 0.26 0.89 0.00 -0.55 5.03 -1.40 -1.33 116.97 119.87 2p1i h TYR 55 Ca -0.02 -0.38 -0.04 0.00 2.58 0.00 0.00 58.73 60.87 2p1i h TYR 55 Cb 1.24 -0.14 -0.01 0.00 1.55 0.00 0.00 36.73 39.37 2p1i h TYR 55 CO 0.04 1.18 -0.18 -0.22 -1.32 0.00 0.00 178.16 177.66 2p1i h LYS 56 N 0.35 0.00 0.00 1.82 1.63 -1.44 0.85 116.57 119.78 2p1i h LYS 56 Ca -0.03 0.00 -0.23 0.00 -0.85 0.00 0.00 60.65 59.54 2p1i h LYS 56 Cb 1.23 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.83 2p1i h LYS 56 CO 0.13 0.18 -1.26 -0.22 -3.45 0.00 0.00 179.45 174.82 2p1i h LYS 57 N 0.00 0.00 0.20 1.90 3.64 -1.41 -0.37 116.57 120.53 2p1i h LYS 57 Ca -0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2p1i h LYS 57 Cb 0.58 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 2p1i h LYS 57 CO 0.02 0.72 -0.10 0.00 -2.27 0.00 0.00 179.45 177.83 2p1i h ALA 58 N 1.07 -0.27 -0.60 5.00 0.00 -0.88 -2.91 119.26 120.67 2p1i h ALA 58 Ca -0.12 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 2p1i h ALA 58 Cb 1.82 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.69 2p1i h ALA 58 CO 0.10 -0.42 0.36 1.49 0.00 0.00 0.00 179.25 180.77 2p1i h GLU 59 N -0.72 0.82 0.00 0.00 4.81 -0.94 -0.90 114.58 117.65 2p1i h GLU 59 Ca -0.03 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 2p1i h GLU 59 Cb 0.50 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.71 2p1i h GLU 59 CO 0.04 0.59 0.00 0.00 -0.73 0.00 0.00 179.01 178.92 2p1i n ALA 60 N -2.29 2.50 -0.15 2.92 0.00 -0.15 -2.42 120.51 120.92 2p1i n ALA 60 Ca 0.04 -0.15 0.01 0.00 0.00 0.00 0.00 53.44 53.34 2p1i n ALA 60 Cb 0.06 -1.38 0.02 0.00 0.00 0.00 0.00 19.45 18.14 2p1i n ALA 60 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2p1i n SER 61 N -0.93 1.98 -4.77 0.00 2.88 -0.42 -5.01 113.62 107.36 2p1i n SER 61 Ca 0.18 -2.10 -0.39 0.00 -1.33 0.00 0.00 58.87 55.23 2p1i n SER 61 Cb 0.08 -0.05 -0.01 0.00 -0.75 0.00 0.00 64.21 63.49 2p1i n SER 61 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 2p1i s PHE 62 N -1.18 2.85 0.11 0.66 2.19 -0.72 -4.99 117.98 116.90 2p1i s PHE 62 Ca 0.04 1.46 -0.14 0.00 0.33 0.00 0.00 56.93 58.62 2p1i s PHE 62 Cb 0.03 -3.57 0.02 0.00 -1.31 0.00 0.00 43.02 38.20 2p1i s PHE 62 CO 0.00 -1.87 0.34 1.67 1.83 0.00 0.00 175.22 177.19 2p1i s TRP 63 N -1.34 -0.10 0.15 10.12 1.48 -1.26 -5.09 118.94 122.90 2p1i s TRP 63 Ca 0.59 -0.26 0.04 0.00 -1.06 0.00 0.00 56.10 55.41 2p1i s TRP 63 Cb -0.35 0.16 -0.04 0.00 -1.16 0.00 0.00 33.47 32.08 2p1i s TRP 63 CO 0.44 -0.65 -0.09 -0.08 -4.06 0.00 0.00 176.95 172.51 2p1i s THR 64 N -3.82 1.09 -0.87 0.66 -1.32 -1.26 -5.00 115.64 105.11 2p1i s THR 64 Ca 0.03 -2.04 0.07 0.00 -1.21 0.00 0.00 61.69 58.54 2p1i s THR 64 Cb 0.03 -1.86 0.07 0.00 -1.51 0.00 0.00 72.50 69.22 2p1i s THR 64 CO -0.12 -0.73 1.22 0.00 -2.21 0.00 0.00 174.62 172.78 2p1i n ALA 65 N -0.19 1.18 0.09 11.08 0.00 -1.26 -0.88 120.51 130.54 2p1i n ALA 65 Ca -0.10 0.02 0.02 0.00 0.00 0.00 0.00 53.44 53.38 2p1i n ALA 65 Cb 0.61 -1.11 0.39 0.00 0.00 0.00 0.00 19.45 19.34 2p1i n ALA 65 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2p1i h GLU 66 N 0.00 0.30 0.00 0.00 4.39 -2.00 -3.24 114.58 114.04 2p1i h GLU 66 Ca 0.00 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.64 2p1i h GLU 66 Cb 0.07 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 2p1i h GLU 66 CO 0.00 0.39 0.00 0.39 -1.16 0.00 0.00 179.01 178.63 2p1i n GLU 67 N -4.30 0.47 -0.09 2.33 4.71 -0.06 -4.12 120.64 119.57 2p1i n GLU 67 Ca -0.00 0.02 -0.18 0.00 -0.01 0.00 0.00 57.16 56.99 2p1i n GLU 67 Cb 0.24 -1.50 -0.06 0.00 -1.01 0.00 0.00 31.44 29.11 2p1i n GLU 67 CO 0.00 0.00 0.00 -0.89 0.09 0.00 0.00 177.13 176.33 2p1i n ILE 68 N -1.05 1.24 -3.14 -3.67 2.08 -1.22 -5.07 119.36 108.53 2p1i n ILE 68 Ca 0.12 -0.16 -0.22 0.00 0.56 0.00 0.00 62.75 63.05 2p1i n ILE 68 Cb 0.07 -1.90 0.02 0.00 -0.75 0.00 0.00 39.64 37.08 2p1i n ILE 68 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 2p1i n ASP 69 N -4.03 -6.88 -0.21 4.38 10.43 -1.26 -4.77 116.55 114.20 2p1i n ASP 69 Ca -0.33 0.22 0.00 0.00 2.57 0.00 0.00 54.79 57.25 2p1i n ASP 69 Cb 0.68 -3.76 0.00 0.00 1.84 0.00 0.00 41.12 39.88 2p1i n ASP 69 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2p1i n LEU 70 N -0.28 0.04 -0.15 0.64 -0.00 -1.26 -4.35 117.00 111.64 2p1i n LEU 70 Ca 0.03 -0.02 0.14 0.00 -0.00 0.00 0.00 56.01 56.15 2p1i n LEU 70 Cb 0.56 -0.02 0.48 0.00 -0.00 0.00 0.00 43.42 44.44 2p1i n LEU 70 CO 0.52 0.01 1.21 0.77 -0.00 0.00 0.00 177.39 179.89 2p1i h SER 71 N 0.39 0.42 0.12 1.45 4.64 -1.91 -3.31 113.55 115.36 2p1i h SER 71 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2p1i h SER 71 Cb 0.02 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 2p1i h SER 71 CO 0.00 0.23 -1.66 -1.20 -0.87 0.00 0.00 176.83 173.33 2p1i n SER 72 N -4.48 0.29 -3.26 4.97 7.64 -1.26 -4.66 113.62 112.86 2p1i n SER 72 Ca 0.13 -0.16 -0.25 0.00 1.01 0.00 0.00 58.87 59.61 2p1i n SER 72 Cb 0.47 1.59 -0.08 0.00 -1.01 0.00 0.00 64.21 65.18 2p1i n SER 72 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2p1i n ASP 73 N -2.14 -0.05 -0.00 6.43 8.00 -1.25 -4.61 116.55 122.93 2p1i n ASP 73 Ca -0.02 -2.58 0.09 0.00 0.71 0.00 0.00 54.79 52.99 2p1i n ASP 73 Cb 0.52 -0.61 -0.11 0.00 -0.02 0.00 0.00 41.12 40.89 2p1i n ASP 73 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2p1i n LEU 74 N 1.92 0.81 -0.24 0.64 7.94 -1.26 -4.10 117.00 122.70 2p1i n LEU 74 Ca 0.24 -0.44 -0.05 0.00 -1.11 0.00 0.00 56.01 54.64 2p1i n LEU 74 Cb 0.51 0.00 0.09 0.00 0.53 0.00 0.00 43.42 44.55 2p1i n LEU 74 CO 0.15 0.20 1.01 0.07 -1.11 0.00 0.00 177.39 177.70 2p1i h LYS 75 N 0.00 1.10 -0.47 1.96 2.10 -1.94 0.02 116.57 119.33 2p1i h LYS 75 Ca 0.00 -0.22 -0.13 0.00 -2.00 0.00 0.00 60.65 58.30 2p1i h LYS 75 Cb 0.51 -0.17 -0.01 0.00 -0.90 0.00 0.00 32.23 31.66 2p1i h LYS 75 CO 0.00 0.93 -0.22 -0.44 -2.00 0.00 0.00 179.45 177.71 2p1i h ASP 76 N 1.06 1.02 0.35 7.07 3.32 -1.87 0.69 116.42 128.05 2p1i h ASP 76 Ca 0.23 -0.40 -0.10 0.00 0.02 0.00 0.00 57.03 56.78 2p1i h ASP 76 Cb 0.28 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 2p1i h ASP 76 CO -0.01 1.19 -0.45 0.15 -1.72 0.00 0.00 179.24 178.40 2p1i h PHE 77 N 0.84 0.15 0.00 4.55 3.04 -1.66 0.38 116.94 124.24 2p1i h PHE 77 Ca 0.11 -0.04 -0.17 0.00 3.98 0.00 0.00 57.97 61.85 2p1i h PHE 77 Cb 0.80 -0.03 -0.03 0.00 2.56 0.00 0.00 35.95 39.26 2p1i h PHE 77 CO 0.05 0.55 -0.91 0.93 -2.02 0.00 0.00 178.31 176.91 2p1i h GLU 78 N 0.10 0.00 0.00 1.11 4.39 -0.89 -3.23 114.58 116.06 2p1i h GLU 78 Ca 0.01 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.61 2p1i h GLU 78 Cb 0.83 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.47 2p1i h GLU 78 CO 0.06 0.66 -0.46 -0.22 -1.16 0.00 0.00 179.01 177.89 2p1i h LYS 79 N 0.00 0.00 0.00 2.33 3.64 -0.27 -3.44 116.57 118.83 2p1i h LYS 79 Ca -0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2p1i h LYS 79 Cb 1.61 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.43 2p1i h LYS 79 CO 0.09 0.46 0.00 -0.11 -2.27 0.00 0.00 179.45 177.62 2p1i n LEU 80 N -3.74 0.00 -4.46 5.20 7.94 0.13 -5.07 117.00 117.01 2p1i n LEU 80 Ca -0.01 0.00 -0.24 0.00 -1.11 0.00 0.00 56.01 54.65 2p1i n LEU 80 Cb 0.53 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.40 2p1i n LEU 80 CO 0.39 -0.75 -0.16 0.54 -1.11 0.00 0.00 177.39 176.30 2p1i s ASN 81 N -2.02 2.55 0.18 1.96 2.20 -1.26 -5.00 114.94 113.55 2p1i s ASN 81 Ca 0.00 -1.74 -0.25 0.00 -0.94 0.00 0.00 52.86 49.93 2p1i s ASN 81 Cb 0.00 0.58 0.05 0.00 -2.00 0.00 0.00 41.25 39.88 2p1i s ASN 81 CO 0.00 -1.01 1.56 -0.37 -2.94 0.00 0.00 177.10 174.34 2p1i h VAL 82 N 1.84 0.05 0.07 3.54 -1.51 -1.97 -1.18 116.25 117.09 2p1i h VAL 82 Ca -0.32 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.15 2p1i h VAL 82 Cb 1.26 0.05 0.00 0.00 -2.13 0.00 0.00 31.29 30.47 2p1i h VAL 82 CO 0.49 0.00 -0.03 0.78 -1.23 0.00 0.00 177.57 177.58 2p1i h ASN 83 N -0.15 -0.08 0.98 4.19 2.35 -1.96 -2.99 115.58 117.92 2p1i h ASN 83 Ca 0.20 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2p1i h ASN 83 Cb 0.54 0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.93 2p1i h ASN 83 CO -0.79 0.16 0.00 -0.62 -1.65 0.00 0.00 177.43 174.53 2p1i n GLU 84 N -5.03 0.18 -0.12 0.81 1.02 -1.13 -3.75 120.64 112.63 2p1i n GLU 84 Ca -0.08 0.30 -0.25 0.00 -0.02 0.00 0.00 57.16 57.10 2p1i n GLU 84 Cb 0.16 -1.78 -0.11 0.00 -0.02 0.00 0.00 31.44 29.69 2p1i n GLU 84 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2p1i n LYS 85 N -2.10 0.60 0.09 3.49 2.85 -0.46 -3.82 118.16 118.81 2p1i n LYS 85 Ca 0.04 0.38 0.10 0.00 -1.05 0.00 0.00 58.31 57.78 2p1i n LYS 85 Cb 0.30 -1.61 0.44 0.00 -0.65 0.00 0.00 35.03 33.51 2p1i n LYS 85 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 177.40 178.93 2p1i n HIS 86 N -4.20 0.58 0.28 5.58 -0.00 -1.14 -1.06 115.22 115.27 2p1i n HIS 86 Ca -0.44 0.23 -0.15 0.00 0.46 0.00 0.00 57.72 57.82 2p1i n HIS 86 Cb 0.83 -0.87 -0.08 0.00 -0.12 0.00 0.00 29.99 29.74 2p1i n HIS 86 CO 0.00 0.00 0.00 0.35 0.46 0.00 0.00 176.34 177.15 2p1i h PHE 87 N 0.00 -0.67 -0.31 1.57 -0.00 -1.74 -2.23 116.94 113.56 2p1i h PHE 87 Ca 0.00 -0.02 0.05 0.00 -0.00 0.00 0.00 57.97 58.00 2p1i h PHE 87 Cb 0.32 0.22 -0.04 0.00 -0.00 0.00 0.00 35.95 36.45 2p1i h PHE 87 CO 0.00 -0.35 0.05 0.82 -0.00 0.00 0.00 178.31 178.84 2p1i h ILE 88 N -0.97 0.84 -0.81 1.41 2.04 -1.30 0.42 117.51 119.14 2p1i h ILE 88 Ca -0.07 -0.06 0.15 0.00 1.00 0.00 0.00 64.86 65.88 2p1i h ILE 88 Cb 0.63 0.66 -0.06 0.00 -0.74 0.00 0.00 36.82 37.31 2p1i h ILE 88 CO 0.12 0.03 0.53 0.11 0.00 0.00 0.00 178.15 178.95 2p1i h LYS 89 N 0.16 0.47 0.17 2.37 1.57 -1.16 -0.80 116.57 119.35 2p1i h LYS 89 Ca 0.15 -0.03 -0.35 0.00 -1.87 0.00 0.00 60.65 58.55 2p1i h LYS 89 Cb 0.17 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2p1i h LYS 89 CO -0.20 0.31 -1.81 0.45 -0.57 0.00 0.00 179.45 177.63 2p1i h HIS 90 N 0.49 0.64 -0.51 -1.35 3.86 -0.71 -3.06 115.15 114.52 2p1i h HIS 90 Ca 0.40 -0.47 0.03 0.00 -1.16 0.00 0.00 60.37 59.17 2p1i h HIS 90 Cb 0.85 -0.03 -0.04 0.00 1.06 0.00 0.00 27.41 29.26 2p1i h HIS 90 CO -0.00 1.69 0.29 0.28 0.86 0.00 0.00 177.93 181.04 2p1i h VAL 91 N 0.10 1.02 -0.03 2.45 2.07 0.35 0.97 116.25 123.17 2p1i h VAL 91 Ca -0.36 -0.20 -0.12 0.00 0.82 0.00 0.00 66.70 66.84 2p1i h VAL 91 Cb 2.08 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 2p1i h VAL 91 CO 0.15 0.10 -0.56 -0.07 0.02 0.00 0.00 177.57 177.22 2p1i h LEU 92 N 0.57 0.11 -1.11 2.57 3.38 -1.32 0.04 115.31 119.56 2p1i h LEU 92 Ca 0.21 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 2p1i h LEU 92 Cb 0.05 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2p1i h LEU 92 CO -0.11 0.64 -0.41 0.00 0.09 0.00 0.00 178.44 178.65 2p1i h ALA 93 N 1.36 1.16 0.19 1.53 0.00 -1.36 -2.84 119.26 119.30 2p1i h ALA 93 Ca -0.00 -0.37 -0.32 0.00 0.00 0.00 0.00 54.91 54.22 2p1i h ALA 93 Cb 1.01 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 18.77 2p1i h ALA 93 CO 0.08 0.51 -1.36 0.35 0.00 0.00 0.00 179.25 178.83 2p1i h PHE 94 N 0.00 1.01 -0.24 0.00 -0.00 0.07 -3.17 116.94 114.61 2p1i h PHE 94 Ca -0.00 -0.68 0.07 0.00 -0.00 0.00 0.00 57.97 57.35 2p1i h PHE 94 Cb 0.80 -0.06 -0.01 0.00 -0.00 0.00 0.00 35.95 36.68 2p1i h PHE 94 CO 0.00 1.52 0.18 0.74 -0.00 0.00 0.00 178.31 180.75 2p1i h PHE 95 N 0.20 0.00 -2.82 0.41 0.04 -1.02 -3.27 116.94 110.49 2p1i h PHE 95 Ca -0.22 0.00 -0.81 0.00 2.80 0.00 0.00 57.97 59.74 2p1i h PHE 95 Cb 2.05 0.00 -0.28 0.00 2.20 0.00 0.00 35.95 39.92 2p1i h PHE 95 CO 0.12 0.00 0.84 0.00 -0.60 0.00 0.00 178.31 178.68 2p1i n ALA 96 N -2.58 5.27 0.00 2.45 0.00 -1.07 -4.31 120.51 120.27 2p1i n ALA 96 Ca 0.03 -4.78 0.00 0.00 0.00 0.00 0.00 53.44 48.69 2p1i n ALA 96 Cb 0.33 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.42 2p1i n ALA 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2p1i n ALA 97 N 1.26 0.98 -2.60 0.00 0.00 -1.23 -4.95 120.51 113.97 2p1i n ALA 97 Ca 0.28 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.28 2p1i n ALA 97 Cb 0.33 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.68 2p1i n ALA 97 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2p1i s SER 98 N -2.53 6.13 0.00 0.00 0.15 -1.26 -5.15 113.70 111.05 2p1i s SER 98 Ca 0.00 -1.03 0.00 0.00 0.70 0.00 0.00 55.95 55.62 2p1i s SER 98 Cb 0.00 -2.17 0.00 0.00 -1.71 0.00 0.00 66.02 62.14 2p1i s SER 98 CO 0.00 -0.53 0.00 1.21 1.20 0.00 0.00 173.24 175.12 2p1i n GLU 104 N 5.22 0.00 -3.54 5.44 0.00 -1.26 -5.14 120.64 121.37 2p1i n GLU 104 Ca -0.11 0.00 -0.37 0.00 0.00 0.00 0.00 57.16 56.68 2p1i n GLU 104 Cb 0.46 0.00 -0.07 0.00 0.00 0.00 0.00 31.44 31.83 2p1i n GLU 104 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.13 176.33 2p1i s ASN 105 N 0.00 6.49 0.00 4.31 0.02 -1.26 -4.94 114.94 119.55 2p1i s ASN 105 Ca 0.00 0.57 0.00 0.00 -1.02 0.00 0.00 52.86 52.41 2p1i s ASN 105 Cb 0.00 -2.19 0.00 0.00 0.02 0.00 0.00 41.25 39.08 2p1i s ASN 105 CO 0.00 0.13 0.00 -0.11 0.02 0.00 0.00 177.10 177.14 2p1i n LEU 106 N 3.32 0.00 -0.13 0.60 0.00 -1.26 -4.85 117.00 114.67 2p1i n LEU 106 Ca -0.12 0.00 0.14 0.00 0.00 0.00 0.00 56.01 56.02 2p1i n LEU 106 Cb 0.52 0.00 0.50 0.00 0.00 0.00 0.00 43.42 44.44 2p1i n LEU 106 CO 0.39 0.00 1.20 0.00 0.00 0.00 0.00 177.39 178.98 2p1i h ALA 107 N 0.55 2.06 0.00 1.96 0.00 -1.93 -0.80 119.26 121.10 2p1i h ALA 107 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2p1i h ALA 107 Cb 0.00 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2p1i h ALA 107 CO 0.00 -0.23 -0.09 1.03 0.00 0.00 0.00 179.25 179.97 2p1i h SER 108 N 0.43 0.00 0.01 0.00 0.87 -1.91 0.33 113.55 113.28 2p1i h SER 108 Ca 0.33 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.79 2p1i h SER 108 Cb 0.70 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.64 2p1i h SER 108 CO -0.10 0.09 -0.28 0.11 -0.53 0.00 0.00 176.83 176.12 2p1i h LYS 109 N 0.00 0.41 0.04 2.24 1.79 -1.47 -3.02 116.57 116.57 2p1i h LYS 109 Ca -0.00 -0.16 -0.26 0.00 -2.18 0.00 0.00 60.65 58.04 2p1i h LYS 109 Cb 0.80 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.40 2p1i h LYS 109 CO 0.01 0.66 -1.37 0.74 -1.08 0.00 0.00 179.45 178.41 2p1i h PHE 110 N 0.36 0.17 -0.73 -1.35 -1.00 -1.29 -3.20 116.94 109.90 2p1i h PHE 110 Ca 0.05 -0.12 0.16 0.00 2.81 0.00 0.00 57.97 60.87 2p1i h PHE 110 Cb 0.68 -0.01 -0.11 0.00 3.61 0.00 0.00 35.95 40.13 2p1i h PHE 110 CO 0.02 1.14 0.16 1.25 -1.61 0.00 0.00 178.31 179.27 2p1i h LEU 111 N 0.03 -0.01 -0.14 1.54 6.46 -0.30 0.61 115.31 123.50 2p1i h LEU 111 Ca -0.16 0.15 -0.23 0.00 -0.12 0.00 0.00 57.88 57.52 2p1i h LEU 111 Cb 1.92 0.20 -0.00 0.00 -0.73 0.00 0.00 40.66 42.05 2p1i h LEU 111 CO 0.13 -0.04 -0.99 -0.09 -0.62 0.00 0.00 178.44 176.83 2p1i h ARG 112 N 0.26 0.30 0.11 1.25 2.43 -1.65 -3.39 114.38 113.69 2p1i h ARG 112 Ca 0.41 -0.36 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 2p1i h ARG 112 Cb 0.70 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 2p1i h ARG 112 CO -0.51 1.08 -0.05 0.93 -1.51 0.00 0.00 179.97 179.90 2p1i h GLU 113 N 0.15 -0.15 -5.91 0.20 5.08 -1.44 -3.44 114.58 109.08 2p1i h GLU 113 Ca -0.08 0.01 -0.53 0.00 -1.00 0.00 0.00 59.36 57.76 2p1i h GLU 113 Cb 1.65 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.92 2p1i h GLU 113 CO 0.16 -0.10 1.49 0.08 -1.00 0.00 0.00 179.01 179.65 2p1i s VAL 114 N -1.99 3.12 -0.13 3.13 1.01 0.17 -4.87 120.40 120.84 2p1i s VAL 114 Ca -0.02 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.07 2p1i s VAL 114 Cb 0.00 -3.22 0.15 0.00 0.00 0.00 0.00 36.38 33.31 2p1i s VAL 114 CO 0.07 -0.18 1.49 -0.62 0.00 0.00 0.00 175.10 175.86 2p1i n GLU 115 N 8.84 1.35 -4.24 2.72 -0.58 -1.26 -4.56 120.64 122.92 2p1i n GLU 115 Ca 0.30 -0.78 -0.31 0.00 -0.42 0.00 0.00 57.16 55.95 2p1i n GLU 115 Cb 0.49 -1.30 -0.16 0.00 -0.57 0.00 0.00 31.44 29.90 2p1i n GLU 115 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 2p1i s ILE 116 N -0.96 1.84 0.26 -3.67 -5.25 -1.26 -5.03 121.20 107.14 2p1i s ILE 116 Ca 0.15 -0.82 -0.01 0.00 -0.99 0.00 0.00 60.65 58.99 2p1i s ILE 116 Cb 0.12 -1.67 0.25 0.00 2.95 0.00 0.00 42.46 44.11 2p1i s ILE 116 CO 0.02 0.50 1.74 0.40 -1.79 0.00 0.00 174.94 175.81 2p1i h ILE 117 N 5.96 0.66 -0.69 8.37 2.04 -2.00 0.66 117.51 132.50 2p1i h ILE 117 Ca -0.39 -0.18 0.14 0.00 1.00 0.00 0.00 64.86 65.43 2p1i h ILE 117 Cb 1.15 0.08 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 2p1i h ILE 117 CO 0.57 0.10 0.47 -0.33 0.00 0.00 0.00 178.15 178.96 2p1i h GLU 118 N 0.53 0.34 0.14 2.37 3.07 -1.95 -1.21 114.58 117.87 2p1i h GLU 118 Ca 0.47 -0.02 -0.32 0.00 -0.50 0.00 0.00 59.36 59.00 2p1i h GLU 118 Cb 0.74 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.57 2p1i h GLU 118 CO -0.41 0.22 -1.63 0.00 -1.40 0.00 0.00 179.01 175.80 2p1i h ALA 119 N 1.67 0.21 -0.73 3.43 0.00 -0.07 -3.02 119.26 120.75 2p1i h ALA 119 Ca 0.33 -1.16 0.06 0.00 0.00 0.00 0.00 54.91 54.14 2p1i h ALA 119 Cb 0.82 0.52 -0.04 0.00 0.00 0.00 0.00 17.79 19.08 2p1i h ALA 119 CO -0.09 0.97 0.48 0.87 0.00 0.00 0.00 179.25 181.48 2p1i h LYS 120 N -0.12 0.77 -0.69 0.00 1.57 -1.04 0.23 116.57 117.30 2p1i h LYS 120 Ca -0.34 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.37 2p1i h LYS 120 Cb 1.91 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 34.02 2p1i h LYS 120 CO 0.10 0.51 0.33 -0.22 -0.57 0.00 0.00 179.45 179.59 2p1i h LYS 121 N 0.79 1.00 -0.36 3.15 1.63 -1.26 0.21 116.57 121.73 2p1i h LYS 121 Ca 0.31 -0.15 -0.13 0.00 -0.85 0.00 0.00 60.65 59.83 2p1i h LYS 121 Cb 0.21 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 31.66 2p1i h LYS 121 CO -0.10 0.79 -0.27 0.35 -3.45 0.00 0.00 179.45 176.77 2p1i h PHE 122 N 0.96 0.96 -0.21 1.91 3.04 -1.12 -2.78 116.94 119.71 2p1i h PHE 122 Ca 0.24 -0.27 -0.02 0.00 3.98 0.00 0.00 57.97 61.90 2p1i h PHE 122 Cb 0.13 -0.21 -0.01 0.00 2.56 0.00 0.00 35.95 38.42 2p1i h PHE 122 CO 0.01 1.04 0.05 1.88 -2.02 0.00 0.00 178.31 179.27 2p1i h TYR 123 N 0.61 0.35 -0.23 0.41 0.05 -0.67 -1.16 116.97 116.32 2p1i h TYR 123 Ca 0.07 -0.04 0.03 0.00 0.05 0.00 0.00 58.73 58.84 2p1i h TYR 123 Cb 0.85 -0.10 -0.01 0.00 1.01 0.00 0.00 36.73 38.48 2p1i h TYR 123 CO 0.06 0.44 0.16 0.66 -1.05 0.00 0.00 178.16 178.43 2p1i h SER 124 N 0.16 0.15 1.24 3.88 4.64 -0.65 0.46 113.55 123.42 2p1i h SER 124 Ca 0.07 -0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.27 2p1i h SER 124 Cb 0.27 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 2p1i h SER 124 CO 0.00 0.11 -0.54 0.15 -0.87 0.00 0.00 176.83 175.67 2p1i h PHE 125 N 0.18 0.00 -0.14 4.77 3.57 -1.36 -3.28 116.94 120.68 2p1i h PHE 125 Ca 0.10 0.00 -0.21 0.00 3.53 0.00 0.00 57.97 61.38 2p1i h PHE 125 Cb 0.17 0.00 0.01 0.00 2.79 0.00 0.00 35.95 38.91 2p1i h PHE 125 CO -0.00 0.54 -0.76 0.37 -2.23 0.00 0.00 178.31 176.23 2p1i h GLN 126 N 0.00 0.71 -0.47 1.11 4.15 0.38 -2.27 115.11 118.72 2p1i h GLN 126 Ca -0.01 -0.58 -0.06 0.00 0.77 0.00 0.00 58.65 58.78 2p1i h GLN 126 Cb 1.31 0.12 -0.02 0.00 0.21 0.00 0.00 27.48 29.10 2p1i h GLN 126 CO 0.07 1.19 0.03 0.82 -1.93 0.00 0.00 178.83 179.01 2p1i h ILE 127 N 0.48 1.23 0.27 2.39 2.04 -1.58 -0.89 117.51 121.46 2p1i h ILE 127 Ca -0.05 -0.92 -0.01 0.00 1.00 0.00 0.00 64.86 64.88 2p1i h ILE 127 Cb 1.38 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 38.30 2p1i h ILE 127 CO 0.15 0.33 -0.13 0.00 0.00 0.00 0.00 178.15 178.50 2p1i h ALA 128 N 1.32 -0.36 0.00 1.87 0.00 -1.60 -0.92 119.26 119.56 2p1i h ALA 128 Ca 0.15 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2p1i h ALA 128 Cb 0.39 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 2p1i h ALA 128 CO 0.01 -0.62 -0.00 0.28 0.00 0.00 0.00 179.25 178.92 2p1i h VAL 129 N -0.53 0.01 0.06 0.00 2.07 -1.36 -1.97 116.25 114.52 2p1i h VAL 129 Ca -0.04 -0.46 -0.23 0.00 0.82 0.00 0.00 66.70 66.79 2p1i h VAL 129 Cb 0.39 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 2p1i h VAL 129 CO 0.06 0.00 -1.06 -0.33 0.02 0.00 0.00 177.57 176.26 2p1i h GLU 130 N 0.00 0.19 -0.27 1.57 5.08 -0.97 -1.76 114.58 118.42 2p1i h GLU 130 Ca -0.00 -0.27 -0.10 0.00 -1.00 0.00 0.00 59.36 57.98 2p1i h GLU 130 Cb 0.45 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 2p1i h GLU 130 CO 0.00 1.08 -0.27 -0.91 -1.00 0.00 0.00 179.01 177.92 2p1i h ASN 131 N 0.07 0.55 -0.86 1.42 4.21 -0.80 -1.93 115.58 118.23 2p1i h ASN 131 Ca -0.07 -0.19 0.03 0.00 1.21 0.00 0.00 56.30 57.27 2p1i h ASN 131 Cb 1.77 -0.15 -0.05 0.00 -1.12 0.00 0.00 38.32 38.77 2p1i h ASN 131 CO 0.16 0.80 0.57 0.40 -1.29 0.00 0.00 177.43 178.07 2p1i h ILE 132 N 0.47 1.17 -0.31 2.81 2.04 -1.04 -1.38 117.51 121.28 2p1i h ILE 132 Ca 0.07 -0.38 -0.03 0.00 1.00 0.00 0.00 64.86 65.52 2p1i h ILE 132 Cb 0.71 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 2p1i h ILE 132 CO 0.05 0.20 0.09 0.45 0.00 0.00 0.00 178.15 178.95 2p1i h HIS 133 N 1.11 0.50 -0.34 1.37 3.86 -1.02 -2.54 115.15 118.09 2p1i h HIS 133 Ca 0.33 -0.05 0.06 0.00 -1.16 0.00 0.00 60.37 59.56 2p1i h HIS 133 Cb -0.03 -0.14 -0.06 0.00 1.06 0.00 0.00 27.41 28.24 2p1i h HIS 133 CO -0.00 0.52 -0.02 1.03 0.86 0.00 0.00 177.93 180.31 2p1i h SER 134 N 0.34 -0.19 0.28 2.45 0.87 -0.93 -1.95 113.55 114.41 2p1i h SER 134 Ca 0.10 0.09 -0.09 0.00 -1.23 0.00 0.00 61.79 60.66 2p1i h SER 134 Cb 0.26 0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.37 2p1i h SER 134 CO -0.00 -0.06 -0.37 1.05 -0.53 0.00 0.00 176.83 176.92 2p1i h GLU 135 N 0.07 0.13 -0.56 2.24 4.11 -1.20 -0.42 114.58 118.95 2p1i h GLU 135 Ca 0.17 -0.05 0.07 0.00 0.07 0.00 0.00 59.36 59.62 2p1i h GLU 135 Cb 0.24 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.42 2p1i h GLU 135 CO -0.30 0.48 0.24 1.15 0.07 0.00 0.00 179.01 180.65 2p1i h THR 136 N 0.11 0.85 -0.13 -1.06 2.02 -1.01 0.24 112.91 113.93 2p1i h THR 136 Ca 0.01 -0.15 -0.17 0.00 0.77 0.00 0.00 66.41 66.87 2p1i h THR 136 Cb 0.70 0.37 0.01 0.00 -1.74 0.00 0.00 68.15 67.49 2p1i h THR 136 CO 0.05 0.08 -0.57 1.88 0.37 0.00 0.00 175.52 177.34 2p1i h TYR 137 N 0.45 0.82 -0.62 3.16 0.05 -0.77 -0.22 116.97 119.83 2p1i h TYR 137 Ca 0.27 -0.35 -0.01 0.00 0.05 0.00 0.00 58.73 58.68 2p1i h TYR 137 Cb 0.27 -0.13 -0.03 0.00 1.01 0.00 0.00 36.73 37.85 2p1i h TYR 137 CO -0.14 1.15 0.34 1.03 -1.05 0.00 0.00 178.16 179.49 2p1i h SER 138 N 0.26 0.76 -0.67 3.88 0.87 -0.91 0.47 113.55 118.20 2p1i h SER 138 Ca -0.03 -0.06 -0.04 0.00 -1.23 0.00 0.00 61.79 60.43 2p1i h SER 138 Cb 1.20 -0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.94 2p1i h SER 138 CO 0.12 0.61 0.25 0.25 -0.53 0.00 0.00 176.83 177.53 2p1i h LEU 139 N 0.86 0.94 -0.10 2.23 5.85 -0.41 -1.06 115.31 123.63 2p1i h LEU 139 Ca 0.22 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 2p1i h LEU 139 Cb 0.02 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.80 2p1i h LEU 139 CO -0.04 0.87 -0.02 -0.07 -0.34 0.00 0.00 178.44 178.84 2p1i h LEU 140 N 0.96 0.19 -1.96 2.25 4.07 -0.25 -1.92 115.31 118.65 2p1i h LEU 140 Ca 0.22 -0.37 0.19 0.00 0.08 0.00 0.00 57.88 58.00 2p1i h LEU 140 Cb 0.24 -0.05 -0.03 0.00 1.08 0.00 0.00 40.66 41.89 2p1i h LEU 140 CO -0.01 0.51 0.47 0.40 -1.08 0.00 0.00 178.44 178.73 2p1i h ILE 141 N -0.13 0.68 0.00 1.22 2.04 -0.10 0.60 117.51 121.82 2p1i h ILE 141 Ca 0.03 -0.01 -0.07 0.00 1.00 0.00 0.00 64.86 65.80 2p1i h ILE 141 Cb 0.43 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 2p1i h ILE 141 CO 0.01 0.01 -0.35 -0.78 0.00 0.00 0.00 178.15 177.04 2p1i h ASP 142 N 0.03 0.00 0.00 1.72 -0.00 -0.39 -2.94 116.42 114.84 2p1i h ASP 142 Ca 0.32 0.00 -0.32 0.00 -0.00 0.00 0.00 57.03 57.02 2p1i h ASP 142 Cb 1.22 0.00 -0.06 0.00 -0.00 0.00 0.00 39.33 40.49 2p1i h ASP 142 CO -0.01 0.35 -2.22 0.59 -0.00 0.00 0.00 179.24 177.94 2p1i n ASN 143 N -3.55 2.28 0.22 2.28 3.02 0.05 -3.60 115.26 115.95 2p1i n ASN 143 Ca -0.00 -0.11 0.11 0.00 -0.03 0.00 0.00 54.58 54.54 2p1i n ASN 143 Cb 0.48 -0.30 0.35 0.00 -0.61 0.00 0.00 39.78 39.71 2p1i n ASN 143 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 2p1i h TYR 144 N 0.00 0.00 -1.26 3.10 0.99 -1.29 -3.28 116.97 115.23 2p1i h TYR 144 Ca -0.48 0.00 -0.46 0.00 2.00 0.00 0.00 58.73 59.79 2p1i h TYR 144 Cb 1.75 0.00 -0.41 0.00 1.00 0.00 0.00 36.73 39.08 2p1i h TYR 144 CO 0.02 0.18 -0.99 -0.89 -0.00 0.00 0.00 178.16 176.48 2p1i n ILE 145 N -3.23 1.60 -0.16 -2.88 5.41 -1.11 -4.99 119.36 114.00 2p1i n ILE 145 Ca 0.02 -3.92 -0.03 0.00 1.00 0.00 0.00 62.75 59.81 2p1i n ILE 145 Cb 0.49 -0.21 0.03 0.00 -0.71 0.00 0.00 39.64 39.24 2p1i n ILE 145 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 2p1i h LYS 146 N 2.82 -0.05 -6.21 0.38 1.57 -1.63 -3.42 116.57 110.02 2p1i h LYS 146 Ca 0.08 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.30 2p1i h LYS 146 Cb 1.06 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.35 2p1i h LYS 146 CO 0.66 -0.03 0.99 0.34 -0.57 0.00 0.00 179.45 180.83 2p1i s ASP 147 N -5.19 6.77 0.00 0.86 2.15 -1.26 -4.92 116.67 115.08 2p1i s ASP 147 Ca -0.14 1.79 0.00 0.00 0.43 0.00 0.00 52.55 54.63 2p1i s ASP 147 Cb 0.17 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.25 2p1i s ASP 147 CO 0.72 -0.90 0.40 -0.62 -0.17 0.00 0.00 175.17 174.60 2p1i n GLU 148 N 6.95 0.00 0.04 4.34 -0.58 -1.26 -2.69 120.64 127.44 2p1i n GLU 148 Ca 0.15 0.07 -0.11 0.00 -0.42 0.00 0.00 57.16 56.86 2p1i n GLU 148 Cb 0.44 -1.57 0.02 0.00 -0.57 0.00 0.00 31.44 29.76 2p1i n GLU 148 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 2p1i h LYS 149 N 0.00 0.44 0.22 3.49 2.10 -1.92 -3.35 116.57 117.55 2p1i h LYS 149 Ca 0.00 -0.37 -0.01 0.00 -2.00 0.00 0.00 60.65 58.27 2p1i h LYS 149 Cb 0.13 0.08 0.00 0.00 -0.90 0.00 0.00 32.23 31.54 2p1i h LYS 149 CO 0.00 1.00 -0.11 0.93 -2.00 0.00 0.00 179.45 179.28 2p1i h GLU 150 N 0.30 -0.28 -0.22 0.07 5.08 -1.85 -2.64 114.58 115.04 2p1i h GLU 150 Ca -0.03 0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.43 2p1i h GLU 150 Cb 1.32 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.60 2p1i h GLU 150 CO 0.13 0.03 0.11 -2.13 -1.00 0.00 0.00 179.01 176.14 2p1i n ARG 151 N -4.97 -0.01 -0.03 2.33 0.63 -1.26 0.16 116.66 113.51 2p1i n ARG 151 Ca -0.06 0.30 -0.20 0.00 -0.92 0.00 0.00 57.85 56.97 2p1i n ARG 151 Cb 0.22 -0.54 -0.13 0.00 0.45 0.00 0.00 32.46 32.46 2p1i n ARG 151 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 2p1i h LEU 152 N 0.00 0.21 -3.32 6.15 3.38 -1.68 -2.41 115.31 117.64 2p1i h LEU 152 Ca 0.18 -0.80 -0.08 0.00 0.09 0.00 0.00 57.88 57.26 2p1i h LEU 152 Cb 0.47 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 2p1i h LEU 152 CO -0.17 1.43 -0.05 -3.20 0.09 0.00 0.00 178.44 176.54 2p1i n ASN 153 N -4.22 5.44 0.00 -0.43 2.85 0.43 -2.46 115.26 116.87 2p1i n ASN 153 Ca -0.23 -2.50 0.00 0.00 -0.11 0.00 0.00 54.58 51.74 2p1i n ASN 153 Cb 0.75 -1.20 0.00 0.00 1.24 0.00 0.00 39.78 40.57 2p1i n ASN 153 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2p1i n LEU 154 N 1.63 0.00 0.23 1.20 7.94 -0.87 -4.47 117.00 122.65 2p1i n LEU 154 Ca 0.14 0.00 0.13 0.00 -1.11 0.00 0.00 56.01 55.17 2p1i n LEU 154 Cb 0.61 0.28 0.24 0.00 0.53 0.00 0.00 43.42 45.08 2p1i n LEU 154 CO 0.07 -0.35 0.83 -0.26 -1.11 0.00 0.00 177.39 176.57 2p1i h PHE 155 N 0.00 0.00 -0.00 1.96 -1.00 -1.35 0.50 116.94 117.05 2p1i h PHE 155 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2p1i h PHE 155 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 2p1i h PHE 155 CO 0.00 0.00 -0.09 0.72 -1.61 0.00 0.00 178.31 177.33 2p1i n HIS 156 N -3.09 0.00 0.45 -0.55 8.25 -1.03 -2.95 115.22 116.30 2p1i n HIS 156 Ca 0.04 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.62 2p1i n HIS 156 Cb 0.50 0.00 0.24 0.00 1.12 0.00 0.00 29.99 31.85 2p1i n HIS 156 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2p1i h ALA 157 N 0.77 0.83 0.10 -1.41 0.00 -1.69 -3.31 119.26 114.55 2p1i h ALA 157 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.57 2p1i h ALA 157 Cb 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2p1i h ALA 157 CO 0.00 0.00 -1.88 0.82 0.00 0.00 0.00 179.25 178.19 2p1i h ILE 158 N 0.00 0.74 -0.95 0.00 5.03 -0.14 -3.44 117.51 118.75 2p1i h ILE 158 Ca 0.00 -2.47 0.29 0.00 -0.12 0.00 0.00 64.86 62.56 2p1i h ILE 158 Cb 0.83 2.53 -0.15 0.00 -3.03 0.00 0.00 36.82 37.00 2p1i h ILE 158 CO 0.00 0.81 0.41 -0.08 -0.68 0.00 0.00 178.15 178.60 2p1i h GLU 159 N 0.06 0.24 -4.12 2.37 4.57 -1.62 -3.07 114.58 113.01 2p1i h GLU 159 Ca -0.37 -0.01 -0.66 0.00 -1.18 0.00 0.00 59.36 57.13 2p1i h GLU 159 Cb 2.04 -0.05 -0.40 0.00 -0.16 0.00 0.00 28.75 30.17 2p1i h GLU 159 CO 0.10 0.16 -0.66 0.54 -1.18 0.00 0.00 179.01 177.97 2p1i s ASN 160 N -4.96 4.65 -0.09 1.04 6.03 -1.26 -4.97 114.94 115.38 2p1i s ASN 160 Ca -0.11 -2.51 -0.04 0.00 -1.03 0.00 0.00 52.86 49.17 2p1i s ASN 160 Cb 0.29 -1.66 0.05 0.00 -3.03 0.00 0.00 41.25 36.89 2p1i s ASN 160 CO 0.78 -0.33 0.19 -0.63 -2.03 0.00 0.00 177.10 175.08 2p1i s ILE 161 N 0.41 -0.14 0.37 0.54 -1.09 -1.16 -5.02 121.20 115.11 2p1i s ILE 161 Ca 0.13 0.22 0.21 0.00 -2.23 0.00 0.00 60.65 58.99 2p1i s ILE 161 Cb -0.22 -0.32 0.36 0.00 -1.58 0.00 0.00 42.46 40.70 2p1i s ILE 161 CO -0.04 0.09 1.59 -0.65 -1.23 0.00 0.00 174.94 174.69 2p1i h PRO 162 N 7.61 0.02 -0.89 2.79 0.11 -1.93 2.10 132.00 141.80 2p1i h PRO 162 Ca -0.32 -0.00 0.19 0.00 0.11 0.00 0.00 66.00 65.98 2p1i h PRO 162 Cb 1.14 -0.00 -0.11 0.00 0.11 0.00 0.00 31.00 32.13 2p1i h PRO 162 CO 0.31 0.01 0.44 0.00 -0.21 0.00 0.00 178.00 178.55 2p1i h ALA 163 N 1.97 1.42 0.00 -0.75 0.00 -1.93 -0.58 119.26 119.39 2p1i h ALA 163 Ca 0.84 0.13 -0.19 0.00 0.00 0.00 0.00 54.91 55.69 2p1i h ALA 163 Cb 2.24 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 20.07 2p1i h ALA 163 CO -0.75 -0.23 -0.96 0.82 0.00 0.00 0.00 179.25 178.14 2p1i h ILE 164 N 0.52 1.42 -0.50 0.00 2.04 0.31 0.23 117.51 121.54 2p1i h ILE 164 Ca 0.53 -3.06 0.06 0.00 1.00 0.00 0.00 64.86 63.39 2p1i h ILE 164 Cb 0.92 2.70 -0.09 0.00 -0.74 0.00 0.00 36.82 39.60 2p1i h ILE 164 CO -0.45 0.81 -0.55 0.50 0.00 0.00 0.00 178.15 178.46 2p1i h LYS 165 N 0.00 -0.32 0.47 2.37 3.64 -1.20 0.11 116.57 121.64 2p1i h LYS 165 Ca -0.04 0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 2p1i h LYS 165 Cb 1.70 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.60 2p1i h LYS 165 CO 0.11 -0.21 -0.23 -0.91 -2.27 0.00 0.00 179.45 175.94 2p1i h ASN 166 N -0.33 -0.54 -0.76 4.20 2.35 -1.01 -2.27 115.58 117.23 2p1i h ASN 166 Ca 0.09 -0.05 0.15 0.00 -0.55 0.00 0.00 56.30 55.94 2p1i h ASN 166 Cb 0.57 0.14 -0.10 0.00 0.05 0.00 0.00 38.32 38.98 2p1i h ASN 166 CO -0.65 -0.28 0.30 0.50 -1.65 0.00 0.00 177.43 175.65 2p1i h LYS 167 N -0.77 0.42 -0.01 0.81 3.64 -0.51 -2.40 116.57 117.75 2p1i h LYS 167 Ca -0.06 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 2p1i h LYS 167 Cb 0.55 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 2p1i h LYS 167 CO 0.11 0.28 -0.04 0.00 -2.27 0.00 0.00 179.45 177.52 2p1i h ALA 168 N 1.56 0.02 -0.60 5.00 0.00 -0.74 -2.41 119.26 122.08 2p1i h ALA 168 Ca 0.42 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2p1i h ALA 168 Cb 0.65 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 2p1i h ALA 168 CO -0.41 -0.12 0.28 -0.07 0.00 0.00 0.00 179.25 178.93 2p1i h LEU 169 N -0.60 0.77 -1.00 0.00 3.38 -1.36 0.18 115.31 116.67 2p1i h LEU 169 Ca -0.00 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 2p1i h LEU 169 Cb 0.71 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 2p1i h LEU 169 CO 0.01 0.66 0.01 -0.25 0.09 0.00 0.00 178.44 178.96 2p1i h TRP 170 N 0.85 0.77 -0.11 1.13 7.01 -1.51 -0.98 115.95 123.11 2p1i h TRP 170 Ca 0.21 -0.10 -0.08 0.00 2.11 0.00 0.00 58.89 61.03 2p1i h TRP 170 Cb 0.10 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 26.93 2p1i h TRP 170 CO 0.01 0.72 -0.31 0.00 -2.79 0.00 0.00 178.44 176.07 2p1i h ALA 171 N 1.32 1.29 0.02 2.65 0.00 -0.48 -1.81 119.26 122.24 2p1i h ALA 171 Ca 0.14 -0.33 -0.20 0.00 0.00 0.00 0.00 54.91 54.52 2p1i h ALA 171 Cb 0.41 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2p1i h ALA 171 CO 0.02 0.49 -0.93 0.00 0.00 0.00 0.00 179.25 178.83 2p1i h ALA 172 N 1.51 0.48 0.17 0.00 0.00 -0.29 -2.56 119.26 118.56 2p1i h ALA 172 Ca 0.03 -0.79 -0.30 0.00 0.00 0.00 0.00 54.91 53.85 2p1i h ALA 172 Cb 0.64 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.35 2p1i h ALA 172 CO 0.05 1.02 -1.31 0.87 0.00 0.00 0.00 179.25 179.87 2p1i h LYS 173 N 0.05 0.45 0.00 0.00 1.57 -1.00 -3.44 116.57 114.21 2p1i h LYS 173 Ca -0.04 -0.71 -0.13 0.00 -1.87 0.00 0.00 60.65 57.90 2p1i h LYS 173 Cb 1.59 0.26 -0.02 0.00 0.08 0.00 0.00 32.23 34.14 2p1i h LYS 173 CO 0.13 1.33 -1.36 0.91 -0.57 0.00 0.00 179.45 179.89 2p1i n TRP 174 N -3.67 0.00 -1.88 -1.35 7.02 -0.70 -5.01 117.44 111.85 2p1i n TRP 174 Ca -0.12 0.00 -0.06 0.00 -1.02 0.00 0.00 57.50 56.29 2p1i n TRP 174 Cb 1.04 -0.30 0.04 0.00 -2.42 0.00 0.00 31.31 29.66 2p1i n TRP 174 CO 0.00 0.00 0.00 0.44 -2.02 0.00 0.00 177.69 176.11 2p1i n ILE 175 N -3.44 0.00 -2.95 -0.99 -5.35 -0.96 -4.33 119.36 101.33 2p1i n ILE 175 Ca -0.16 -0.31 -0.14 0.00 -0.27 0.00 0.00 62.75 61.86 2p1i n ILE 175 Cb 0.57 -1.51 -0.03 0.00 -1.74 0.00 0.00 39.64 36.93 2p1i n ILE 175 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 2p1i n ASN 176 N -3.07 -1.13 -4.73 7.28 3.02 -1.25 -4.50 115.26 110.88 2p1i n ASN 176 Ca 0.04 -0.16 -0.25 0.00 -0.03 0.00 0.00 54.58 54.18 2p1i n ASN 176 Cb 0.14 -1.05 -0.08 0.00 -0.61 0.00 0.00 39.78 38.18 2p1i n ASN 176 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2p1i s ASP 177 N -2.18 4.38 -0.50 6.41 2.15 -1.26 -5.03 116.67 120.63 2p1i s ASP 177 Ca 0.28 -1.11 0.08 0.00 0.43 0.00 0.00 52.55 52.23 2p1i s ASP 177 Cb -0.16 -0.46 0.29 0.00 -0.30 0.00 0.00 42.92 42.28 2p1i s ASP 177 CO 0.34 -0.54 0.71 0.35 -0.17 0.00 0.00 175.17 175.87 2p1i n THR 178 N -1.22 1.09 0.03 1.71 -2.24 -1.26 -4.93 114.28 107.46 2p1i n THR 178 Ca -0.01 -4.80 0.00 0.00 -2.27 0.00 0.00 64.05 56.96 2p1i n THR 178 Cb 0.65 -1.58 0.00 0.00 -2.10 0.00 0.00 70.33 67.30 2p1i n THR 178 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2p1i n ASN 179 N 0.71 -0.29 -4.03 3.42 5.15 -1.26 -5.15 115.26 113.81 2p1i n ASN 179 Ca 0.26 0.11 -0.22 0.00 -0.60 0.00 0.00 54.58 54.14 2p1i n ASN 179 Cb 0.49 0.45 -0.16 0.00 -0.53 0.00 0.00 39.78 40.03 2p1i n ASN 179 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 2p1i s SER 180 N -3.04 1.45 0.10 1.20 0.01 -1.26 -5.04 113.70 107.12 2p1i s SER 180 Ca 0.00 -0.23 -0.16 0.00 1.31 0.00 0.00 55.95 56.87 2p1i s SER 180 Cb 0.00 -0.42 -0.06 0.00 0.21 0.00 0.00 66.02 65.75 2p1i s SER 180 CO 0.00 0.08 1.50 0.15 0.41 0.00 0.00 173.24 175.38 2p1i h PHE 181 N 6.42 0.70 -0.80 2.43 3.57 -2.00 -3.03 116.94 124.24 2p1i h PHE 181 Ca -0.33 -0.15 0.15 0.00 3.53 0.00 0.00 57.97 61.17 2p1i h PHE 181 Cb 1.17 -0.17 -0.15 0.00 2.79 0.00 0.00 35.95 39.59 2p1i h PHE 181 CO 0.45 0.80 -0.24 0.00 -2.23 0.00 0.00 178.31 177.08 2p1i h ALA 182 N 0.80 0.41 -0.71 2.41 0.00 -1.96 -1.78 119.26 118.42 2p1i h ALA 182 Ca 0.08 0.29 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 2p1i h ALA 182 Cb 0.58 0.69 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 2p1i h ALA 182 CO 0.03 -0.47 0.38 1.49 0.00 0.00 0.00 179.25 180.68 2p1i h GLU 183 N -0.03 1.00 -0.54 0.00 4.81 -1.94 -2.51 114.58 115.37 2p1i h GLU 183 Ca 0.36 -0.12 -0.02 0.00 -0.13 0.00 0.00 59.36 59.45 2p1i h GLU 183 Cb 0.59 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.75 2p1i h GLU 183 CO -0.83 0.76 0.28 0.00 -0.73 0.00 0.00 179.01 178.49 2p1i h ARG 184 N 0.98 0.76 -0.48 1.92 3.08 -1.22 0.81 114.38 120.24 2p1i h ARG 184 Ca 0.25 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.20 2p1i h ARG 184 Cb 0.06 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 2p1i h ARG 184 CO -0.04 0.61 0.31 0.82 -1.07 0.00 0.00 179.97 180.61 2p1i h ILE 185 N 0.72 1.13 -0.01 2.04 1.08 -1.39 0.60 117.51 121.67 2p1i h ILE 185 Ca 0.19 -0.23 -0.00 0.00 -0.39 0.00 0.00 64.86 64.42 2p1i h ILE 185 Cb 0.08 0.43 -0.00 0.00 -3.07 0.00 0.00 36.82 34.26 2p1i h ILE 185 CO -0.03 0.12 0.00 0.58 -0.69 0.00 0.00 178.15 178.14 2p1i h VAL 186 N 0.65 1.13 -0.37 1.67 2.07 -0.98 0.35 116.25 120.76 2p1i h VAL 186 Ca 0.17 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 2p1i h VAL 186 Cb -0.07 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 2p1i h VAL 186 CO -0.04 0.10 0.17 0.00 0.02 0.00 0.00 177.57 177.82 2p1i h ALA 187 N 0.85 1.61 0.00 1.67 0.00 -0.67 -2.03 119.26 120.68 2p1i h ALA 187 Ca 0.00 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 2p1i h ALA 187 Cb 0.16 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2p1i h ALA 187 CO -0.00 0.32 -0.42 -0.97 0.00 0.00 0.00 179.25 178.17 2p1i h ASN 188 N 0.52 0.00 1.17 0.00 -0.73 0.76 -0.94 115.58 116.35 2p1i h ASN 188 Ca 0.13 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.30 2p1i h ASN 188 Cb 0.07 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.66 2p1i h ASN 188 CO -0.02 0.42 0.00 0.00 -0.37 0.00 0.00 177.43 177.47 2p1i n ALA 189 N -2.30 2.12 0.07 1.57 0.00 0.12 -2.13 120.51 119.96 2p1i n ALA 189 Ca -0.00 -0.02 -0.23 0.00 0.00 0.00 0.00 53.44 53.19 2p1i n ALA 189 Cb 0.55 -1.44 -0.15 0.00 0.00 0.00 0.00 19.45 18.41 2p1i n ALA 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2p1i h VAL 191 N 0.00 1.10 -0.75 0.00 2.07 -1.09 0.26 116.25 117.84 2p1i h VAL 191 Ca -0.31 -0.38 -0.43 0.00 0.82 0.00 0.00 66.70 66.40 2p1i h VAL 191 Cb 2.02 -0.11 -0.24 0.00 -1.52 0.00 0.00 31.29 31.44 2p1i h VAL 191 CO 0.17 0.20 0.32 -0.62 0.02 0.00 0.00 177.57 177.66 2p1i n GLU 192 N -4.54 2.28 0.04 1.57 1.02 -0.90 -3.99 120.64 116.13 2p1i n GLU 192 Ca 0.13 -3.22 0.00 0.00 -0.02 0.00 0.00 57.16 54.05 2p1i n GLU 192 Cb 0.15 -2.08 0.00 0.00 -0.02 0.00 0.00 31.44 29.49 2p1i n GLU 192 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2p1i n GLY 193 N -1.07 -0.55 0.10 0.62 0.00 -0.91 -3.77 105.19 99.62 2p1i n GLY 193 Ca 0.50 0.08 -0.21 0.00 0.00 0.00 0.00 46.02 46.39 2p1i n GLY 193 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2p1i h ILE 194 N 0.00 0.99 -3.09 -0.61 2.04 -0.76 -3.40 117.51 112.69 2p1i h ILE 194 Ca 0.00 -2.22 -0.53 0.00 1.00 0.00 0.00 64.86 63.11 2p1i h ILE 194 Cb 0.00 2.39 0.02 0.00 -0.74 0.00 0.00 36.82 38.50 2p1i h ILE 194 CO 0.00 0.41 0.69 -0.76 0.00 0.00 0.00 178.15 178.49 2p1i s LEU 195 N -7.83 4.38 0.00 1.44 1.43 -0.09 -1.80 118.68 116.21 2p1i s LEU 195 Ca -0.27 2.29 0.00 0.00 -1.03 0.00 0.00 54.13 55.12 2p1i s LEU 195 Cb 0.05 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.68 2p1i s LEU 195 CO 0.63 -0.60 0.00 0.49 0.23 0.00 0.00 176.35 177.09 2p1i n PHE 196 N 3.75 0.00 -0.23 0.29 3.72 -1.26 -4.72 117.46 119.00 2p1i n PHE 196 Ca 0.10 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.65 2p1i n PHE 196 Cb 0.43 0.00 0.44 0.00 -0.94 0.00 0.00 39.48 39.41 2p1i n PHE 196 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 2p1i h SER 197 N 0.00 0.53 -0.10 4.37 0.02 -1.57 0.14 113.55 116.93 2p1i h SER 197 Ca 0.00 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 2p1i h SER 197 Cb 0.00 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 62.47 2p1i h SER 197 CO 0.00 0.26 0.01 1.23 -1.14 0.00 0.00 176.83 177.19 2p1i h GLY 198 N 0.55 0.18 1.31 -3.77 0.00 -1.91 -2.48 103.07 96.96 2p1i h GLY 198 Ca 0.43 -0.12 -0.07 0.00 0.00 0.00 0.00 47.33 47.57 2p1i h GLY 198 CO -0.18 0.11 0.03 1.76 0.00 0.00 0.00 176.54 178.27 2p1i h SER 199 N -0.08 0.80 -0.40 0.19 0.02 -1.54 -1.24 113.55 111.30 2p1i h SER 199 Ca 0.03 -0.19 -0.06 0.00 -0.84 0.00 0.00 61.79 60.73 2p1i h SER 199 Cb 0.30 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 2p1i h SER 199 CO 0.00 0.85 -0.00 -0.26 -1.14 0.00 0.00 176.83 176.28 2p1i h PHE 200 N 0.79 0.78 -0.65 3.45 0.05 -0.86 -2.51 116.94 117.98 2p1i h PHE 200 Ca 0.16 -0.14 -0.02 0.00 3.82 0.00 0.00 57.97 61.79 2p1i h PHE 200 Cb 0.43 -0.20 -0.03 0.00 2.00 0.00 0.00 35.95 38.14 2p1i h PHE 200 CO 0.02 0.79 0.32 0.00 -0.18 0.00 0.00 178.31 179.26 2p1i h ALA 202 N 1.15 1.68 -0.06 0.00 0.00 -1.05 -1.63 119.26 119.35 2p1i h ALA 202 Ca 0.22 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 55.00 2p1i h ALA 202 Cb 0.11 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2p1i h ALA 202 CO -0.03 0.13 -0.57 0.82 0.00 0.00 0.00 179.25 179.60 2p1i h ILE 203 N 0.83 1.38 0.00 0.00 2.04 -1.11 -3.05 117.51 117.61 2p1i h ILE 203 Ca 0.40 -1.92 -0.02 0.00 1.00 0.00 0.00 64.86 64.32 2p1i h ILE 203 Cb 0.45 1.98 -0.00 0.00 -0.74 0.00 0.00 36.82 38.50 2p1i h ILE 203 CO -0.17 0.56 -0.11 -0.26 0.00 0.00 0.00 178.15 178.18 2p1i h PHE 204 N 0.14 0.00 -0.44 1.37 -1.00 -1.01 -1.93 116.94 114.06 2p1i h PHE 204 Ca -0.00 0.00 0.13 0.00 2.81 0.00 0.00 57.97 60.91 2p1i h PHE 204 Cb 1.05 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.59 2p1i h PHE 204 CO 0.02 0.11 0.33 2.35 -1.61 0.00 0.00 178.31 179.50 2p1i h TRP 205 N 0.00 0.00 0.05 -0.55 2.91 -1.31 0.19 115.95 117.23 2p1i h TRP 205 Ca -0.00 0.00 -0.29 0.00 1.13 0.00 0.00 58.89 59.73 2p1i h TRP 205 Cb 0.20 0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 28.81 2p1i h TRP 205 CO 0.00 0.00 -1.60 0.74 -1.03 0.00 0.00 178.44 176.55 2p1i h PHE 206 N 0.00 0.17 -0.50 2.65 -1.00 -1.48 -3.27 116.94 113.51 2p1i h PHE 206 Ca 0.21 -0.13 0.06 0.00 2.81 0.00 0.00 57.97 60.92 2p1i h PHE 206 Cb 0.86 -0.01 -0.03 0.00 3.61 0.00 0.00 35.95 40.39 2p1i h PHE 206 CO 0.00 1.20 0.33 -0.22 -1.61 0.00 0.00 178.31 178.01 2p1i h LYS 207 N 0.03 0.43 0.00 1.51 3.64 -0.73 -0.86 116.57 120.59 2p1i h LYS 207 Ca -0.25 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.09 2p1i h LYS 207 Cb 1.98 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 33.70 2p1i h LYS 207 CO 0.11 0.29 -0.04 -0.22 -2.27 0.00 0.00 179.45 177.31 2p1i h LYS 208 N 0.45 0.00 -0.38 1.90 1.63 -0.73 -2.92 116.57 116.52 2p1i h LYS 208 Ca 0.22 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.02 2p1i h LYS 208 Cb 0.28 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.91 2p1i h LYS 208 CO -0.06 0.04 0.00 1.04 -3.45 0.00 0.00 179.45 177.03 2p1i n GLN 209 N -3.47 2.49 -3.75 1.90 6.02 -0.36 -4.96 117.38 115.26 2p1i n GLN 209 Ca -0.02 -2.28 -0.25 0.00 -0.01 0.00 0.00 57.00 54.44 2p1i n GLN 209 Cb 0.16 -1.51 0.04 0.00 1.02 0.00 0.00 30.24 29.95 2p1i n GLN 209 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2p1i n ASN 210 N 1.48 -3.18 -4.36 1.08 4.13 -1.10 -5.00 115.26 108.31 2p1i n ASN 210 Ca 0.19 -0.76 -0.19 0.00 1.68 0.00 0.00 54.58 55.51 2p1i n ASN 210 Cb 0.60 -4.18 -0.10 0.00 -1.54 0.00 0.00 39.78 34.56 2p1i n ASN 210 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2p1i s LYS 211 N -6.21 1.37 -1.01 3.52 1.02 -1.04 -4.94 119.74 112.45 2p1i s LYS 211 Ca 0.32 -1.64 -0.00 0.00 0.02 0.00 0.00 55.97 54.66 2p1i s LYS 211 Cb -0.15 -1.03 0.00 0.00 -0.52 0.00 0.00 37.83 36.12 2p1i s LYS 211 CO 0.80 0.11 0.84 1.28 -0.92 0.00 0.00 175.35 177.46 2p1i n LEU 212 N -0.42 -3.67 -0.22 3.17 4.77 -1.26 -4.28 117.00 115.08 2p1i n LEU 212 Ca -0.07 -0.51 0.00 0.00 -0.03 0.00 0.00 56.01 55.40 2p1i n LEU 212 Cb 0.62 -2.68 0.00 0.00 -2.33 0.00 0.00 43.42 39.02 2p1i n LEU 212 CO 0.36 0.33 0.00 0.00 -1.33 0.00 0.00 177.39 176.75 2p1i n HIS 213 N -3.66 0.00 -0.97 -1.77 1.44 -1.26 -0.77 115.22 108.22 2p1i n HIS 213 Ca -0.23 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.48 2p1i n HIS 213 Cb 0.64 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.75 2p1i n HIS 213 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2p1i n GLY 214 N -0.04 0.69 0.29 -1.39 0.00 -1.26 -4.63 105.19 98.84 2p1i n GLY 214 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 2p1i n GLY 214 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2p1i h LEU 215 N 0.00 0.85 0.09 0.99 5.85 -1.32 -2.84 115.31 118.94 2p1i h LEU 215 Ca 0.00 -0.24 -0.35 0.00 0.84 0.00 0.00 57.88 58.13 2p1i h LEU 215 Cb 0.05 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 2p1i h LEU 215 CO 0.00 0.94 -1.98 0.35 -0.34 0.00 0.00 178.44 177.41 2p1i n THR 216 N -4.18 1.73 -0.08 1.05 -2.24 -0.63 -2.70 114.28 107.22 2p1i n THR 216 Ca 0.02 -0.68 -0.14 0.00 -2.27 0.00 0.00 64.05 60.98 2p1i n THR 216 Cb 0.35 -1.56 -0.05 0.00 -2.10 0.00 0.00 70.33 66.97 2p1i n THR 216 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 2p1i h PHE 217 N 0.05 0.87 0.09 4.78 3.57 -1.79 0.37 116.94 124.88 2p1i h PHE 217 Ca -0.41 -0.29 -0.00 0.00 3.53 0.00 0.00 57.97 60.79 2p1i h PHE 217 Cb 2.03 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 40.60 2p1i h PHE 217 CO 0.06 1.06 -0.04 0.66 -2.23 0.00 0.00 178.31 177.82 2p1i h SER 218 N 0.43 -0.10 -0.90 0.41 4.64 -1.67 -2.62 113.55 113.74 2p1i h SER 218 Ca 0.02 -0.25 0.26 0.00 -0.47 0.00 0.00 61.79 61.36 2p1i h SER 218 Cb 0.97 0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 63.05 2p1i h SER 218 CO 0.09 0.20 0.69 -1.13 -0.87 0.00 0.00 176.83 175.81 2p1i h ASN 219 N -0.40 0.00 0.55 4.97 -1.24 -1.36 0.70 115.58 118.79 2p1i h ASN 219 Ca -0.01 0.00 -0.23 0.00 0.71 0.00 0.00 56.30 56.76 2p1i h ASN 219 Cb 0.34 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.39 2p1i h ASN 219 CO 0.02 0.00 -1.03 -0.08 -1.29 0.00 0.00 177.43 175.05 2p1i h GLU 220 N 0.00 0.28 -0.06 6.67 4.81 -0.62 -1.73 114.58 123.93 2p1i h GLU 220 Ca 0.43 -0.36 -0.25 0.00 -0.13 0.00 0.00 59.36 59.05 2p1i h GLU 220 Cb 1.81 0.12 0.02 0.00 0.63 0.00 0.00 28.75 31.33 2p1i h GLU 220 CO -0.00 1.10 -0.94 -0.07 -0.73 0.00 0.00 179.01 178.36 2p1i h LEU 221 N 0.13 0.93 -0.11 1.64 3.38 0.56 -2.08 115.31 119.76 2p1i h LEU 221 Ca -0.08 -0.69 -0.01 0.00 0.09 0.00 0.00 57.88 57.18 2p1i h LEU 221 Cb 1.71 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 42.17 2p1i h LEU 221 CO 0.17 1.49 0.01 0.40 0.09 0.00 0.00 178.44 180.60 2p1i h ILE 222 N 0.46 1.23 -0.32 1.22 2.04 -0.57 -1.40 117.51 120.16 2p1i h ILE 222 Ca -0.10 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 2p1i h ILE 222 Cb 1.58 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 39.15 2p1i h ILE 222 CO 0.19 0.21 0.16 0.77 0.00 0.00 0.00 178.15 179.48 2p1i h SER 223 N -0.06 0.42 -0.75 1.72 4.64 -1.35 0.18 113.55 118.35 2p1i h SER 223 Ca 0.03 -0.12 0.02 0.00 -0.47 0.00 0.00 61.79 61.26 2p1i h SER 223 Cb 0.31 -0.11 -0.04 0.00 -0.31 0.00 0.00 62.40 62.26 2p1i h SER 223 CO 0.00 0.41 0.48 -0.09 -0.87 0.00 0.00 176.83 176.77 2p1i h ARG 224 N 0.39 0.93 0.40 4.77 2.43 -1.42 -0.01 114.38 121.87 2p1i h ARG 224 Ca 0.11 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2p1i h ARG 224 Cb 0.10 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.45 2p1i h ARG 224 CO -0.02 0.62 -0.19 -0.44 -1.51 0.00 0.00 179.97 178.43 2p1i h ASP 225 N 0.96 -0.46 0.35 -3.80 5.19 -0.73 -1.99 116.42 115.94 2p1i h ASP 225 Ca 0.29 -0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.65 2p1i h ASP 225 Cb -0.05 0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.58 2p1i h ASP 225 CO -0.09 -0.24 0.00 -0.62 -3.12 0.00 0.00 179.24 175.18 2p1i n GLU 226 N -5.28 0.13 -0.06 3.56 -0.58 0.57 -0.35 120.64 118.64 2p1i n GLU 226 Ca -0.11 0.50 -0.15 0.00 -0.42 0.00 0.00 57.16 56.98 2p1i n GLU 226 Cb 0.26 -1.83 -0.06 0.00 -0.57 0.00 0.00 31.44 29.24 2p1i n GLU 226 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 2p1i h GLY 227 N 1.18 0.77 1.01 0.62 0.00 -0.29 -2.69 103.07 103.66 2p1i h GLY 227 Ca 0.00 -0.95 0.01 0.00 0.00 0.00 0.00 47.33 46.38 2p1i h GLY 227 CO 0.00 0.85 0.49 -2.00 0.00 0.00 0.00 176.54 175.89 2p1i h LEU 228 N 0.40 0.86 -0.91 3.11 5.85 -0.09 -2.27 115.31 122.25 2p1i h LEU 228 Ca -0.01 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.59 2p1i h LEU 228 Cb 1.12 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.92 2p1i h LEU 228 CO 0.11 0.62 -0.24 0.45 -0.34 0.00 0.00 178.44 179.04 2p1i h HIS 229 N 1.01 0.58 0.55 1.25 -0.00 -1.46 -1.91 115.15 115.17 2p1i h HIS 229 Ca 0.27 -0.12 -0.03 0.00 -0.00 0.00 0.00 60.37 60.50 2p1i h HIS 229 Cb -0.12 -0.14 0.00 0.00 -0.00 0.00 0.00 27.41 27.15 2p1i h HIS 229 CO -0.02 0.72 -0.28 1.15 -0.00 0.00 0.00 177.93 179.50 2p1i h THR 230 N 0.46 0.43 -0.22 2.45 2.02 -1.17 -2.45 112.91 114.43 2p1i h THR 230 Ca 0.07 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.31 2p1i h THR 230 Cb 0.67 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 2p1i h THR 230 CO 0.05 0.00 0.16 0.44 0.37 0.00 0.00 175.52 176.54 2p1i h ASP 231 N -0.76 0.00 0.56 4.18 3.45 -1.24 -2.50 116.42 120.10 2p1i h ASP 231 Ca -0.07 0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.36 2p1i h ASP 231 Cb 0.59 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.37 2p1i h ASP 231 CO 0.11 0.00 -0.27 0.15 -1.57 0.00 0.00 179.24 177.66 2p1i h PHE 232 N 0.00 -0.70 0.00 4.55 3.57 -1.07 -2.48 116.94 120.81 2p1i h PHE 232 Ca 0.10 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2p1i h PHE 232 Cb 0.42 0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.39 2p1i h PHE 232 CO 0.00 -0.37 0.00 0.09 -2.23 0.00 0.00 178.31 175.80 2p1i n ASN 233 N -5.34 0.62 -0.04 0.41 3.02 -0.95 -0.63 115.26 112.36 2p1i n ASN 233 Ca -0.12 0.72 -0.13 0.00 -0.03 0.00 0.00 54.58 55.03 2p1i n ASN 233 Cb 0.33 -0.83 -0.08 0.00 -0.61 0.00 0.00 39.78 38.60 2p1i n ASN 233 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2p1i h LEU 235 N -0.19 0.06 -0.34 0.00 5.85 -0.42 0.34 115.31 120.61 2p1i h LEU 235 Ca 0.02 -0.02 -0.16 0.00 0.84 0.00 0.00 57.88 58.56 2p1i h LEU 235 Cb 0.58 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.59 2p1i h LEU 235 CO 0.02 0.33 -0.41 0.40 -0.34 0.00 0.00 178.44 178.44 2p1i h ILE 236 N 0.06 1.28 -0.16 4.05 2.04 -1.47 -1.22 117.51 122.09 2p1i h ILE 236 Ca 0.01 -1.58 -0.06 0.00 1.00 0.00 0.00 64.86 64.22 2p1i h ILE 236 Cb 0.50 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 38.06 2p1i h ILE 236 CO 0.04 0.52 -0.19 0.22 0.00 0.00 0.00 178.15 178.74 2p1i h TYR 237 N 0.67 0.28 0.00 1.37 5.03 -0.81 -1.92 116.97 121.59 2p1i h TYR 237 Ca 0.05 -0.04 -0.02 0.00 2.58 0.00 0.00 58.73 61.29 2p1i h TYR 237 Cb 1.00 -0.08 -0.00 0.00 1.55 0.00 0.00 36.73 39.20 2p1i h TYR 237 CO 0.07 0.44 -0.11 1.03 -1.32 0.00 0.00 178.16 178.27 2p1i h SER 238 N 0.24 0.00 -0.87 -2.11 0.87 0.11 -3.10 113.55 108.69 2p1i h SER 238 Ca 0.04 0.00 -0.54 0.00 -1.23 0.00 0.00 61.79 60.06 2p1i h SER 238 Cb 0.48 0.00 -0.26 0.00 -0.44 0.00 0.00 62.40 62.18 2p1i h SER 238 CO 0.03 0.11 0.70 0.18 -0.53 0.00 0.00 176.83 177.32 2p1i n LEU 239 N -3.84 7.01 -4.79 2.23 4.77 -0.50 -5.03 117.00 116.85 2p1i n LEU 239 Ca -0.02 -3.80 -0.37 0.00 -0.03 0.00 0.00 56.01 51.79 2p1i n LEU 239 Cb 0.21 -0.93 -0.06 0.00 -2.33 0.00 0.00 43.42 40.31 2p1i n LEU 239 CO 0.31 1.26 0.04 -0.22 -1.33 0.00 0.00 177.39 177.45 2p1i s LEU 240 N -3.17 4.37 0.05 2.23 2.96 -1.18 -4.97 118.68 118.97 2p1i s LEU 240 Ca 0.54 0.74 -0.24 0.00 -0.22 0.00 0.00 54.13 54.95 2p1i s LEU 240 Cb 0.43 -2.47 -0.16 0.00 0.50 0.00 0.00 46.19 44.49 2p1i s LEU 240 CO 0.03 0.22 1.56 -0.33 -1.32 0.00 0.00 176.35 176.51 2p1i h GLU 241 N 5.62 0.03 -2.55 1.98 5.08 -1.93 -3.41 114.58 119.39 2p1i h GLU 241 Ca -0.47 -0.01 -0.43 0.00 -1.00 0.00 0.00 59.36 57.45 2p1i h GLU 241 Cb 1.20 -0.00 -0.37 0.00 0.50 0.00 0.00 28.75 30.07 2p1i h GLU 241 CO 0.67 0.21 -0.71 -0.80 -1.00 0.00 0.00 179.01 177.38 2p1i s ASN 242 N -5.41 2.54 0.67 1.42 -0.87 -1.26 -5.13 114.94 106.90 2p1i s ASN 242 Ca -0.14 -0.93 -0.15 0.00 -1.57 0.00 0.00 52.86 50.07 2p1i s ASN 242 Cb 0.05 0.04 0.00 0.00 -0.02 0.00 0.00 41.25 41.32 2p1i s ASN 242 CO 0.67 -0.40 1.11 -0.54 -2.57 0.00 0.00 177.10 175.37 2p1i s LYS 243 N 2.22 2.75 0.61 -0.60 1.02 -1.26 -4.94 119.74 119.54 2p1i s LYS 243 Ca 0.08 1.40 -0.12 0.00 0.02 0.00 0.00 55.97 57.35 2p1i s LYS 243 Cb -0.15 -1.94 -0.04 0.00 -0.52 0.00 0.00 37.83 35.17 2p1i s LYS 243 CO -0.31 -1.29 1.03 -0.51 -0.92 0.00 0.00 175.35 173.35 2p1i s LEU 244 N -4.92 3.29 0.12 3.17 1.43 -1.26 -5.01 118.68 115.49 2p1i s LEU 244 Ca 0.67 1.46 -0.31 0.00 -1.03 0.00 0.00 54.13 54.92 2p1i s LEU 244 Cb -0.21 -4.48 -0.08 0.00 0.03 0.00 0.00 46.19 41.46 2p1i s LEU 244 CO 0.42 -0.86 1.34 -2.84 0.23 0.00 0.00 176.35 174.64 2p1i s PRO 245 N -5.00 4.35 0.62 1.29 0.02 -1.26 -4.87 135.00 130.16 2p1i s PRO 245 Ca 0.56 2.01 0.24 0.00 0.02 0.00 0.00 61.00 63.83 2p1i s PRO 245 Cb -0.11 -3.26 1.08 0.00 0.02 0.00 0.00 34.50 32.24 2p1i s PRO 245 CO 0.51 -0.37 1.55 1.49 -0.33 0.00 0.00 177.00 179.84 2p1i h GLU 246 N 6.53 0.00 -0.35 5.54 4.81 -1.97 0.32 114.58 129.47 2p1i h GLU 246 Ca -0.42 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 58.83 2p1i h GLU 246 Cb 1.21 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.56 2p1i h GLU 246 CO 0.84 0.00 0.17 -0.91 -0.73 0.00 0.00 179.01 178.38 2p1i h ASN 247 N 0.00 0.24 -0.02 1.04 -0.26 -2.00 -2.01 115.58 112.57 2p1i h ASN 247 Ca 0.26 0.02 -0.07 0.00 -0.56 0.00 0.00 56.30 55.95 2p1i h ASN 247 Cb 1.90 -0.03 0.00 0.00 -1.06 0.00 0.00 38.32 39.14 2p1i h ASN 247 CO -0.00 0.18 -0.25 0.58 -1.06 0.00 0.00 177.43 176.88 2p1i h VAL 248 N 0.35 1.49 -0.83 2.81 2.07 -1.31 -3.06 116.25 117.77 2p1i h VAL 248 Ca 0.15 -1.81 0.13 0.00 0.82 0.00 0.00 66.70 65.98 2p1i h VAL 248 Cb 0.06 2.57 -0.09 0.00 -1.52 0.00 0.00 31.29 32.32 2p1i h VAL 248 CO -0.10 0.50 0.44 0.58 0.02 0.00 0.00 177.57 179.01 2p1i h VAL 249 N -0.38 0.79 -0.19 2.57 2.07 -1.50 0.72 116.25 120.33 2p1i h VAL 249 Ca -0.02 -0.23 -0.05 0.00 0.82 0.00 0.00 66.70 67.22 2p1i h VAL 249 Cb 0.95 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 2p1i h VAL 249 CO 0.05 0.12 -0.09 1.56 0.02 0.00 0.00 177.57 179.23 2p1i h GLN 250 N 0.68 0.29 -0.09 1.57 4.20 -1.41 -1.10 115.11 119.25 2p1i h GLN 250 Ca 0.44 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 59.07 2p1i h GLN 250 Cb 0.54 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.28 2p1i h GLN 250 CO -0.32 0.40 0.02 -0.91 -0.67 0.00 0.00 178.83 177.35 2p1i h ASN 251 N 0.28 0.15 -0.48 1.46 2.35 -0.78 0.34 115.58 118.90 2p1i h ASN 251 Ca 0.06 -0.26 0.08 0.00 -0.55 0.00 0.00 56.30 55.64 2p1i h ASN 251 Cb 0.35 -0.04 -0.07 0.00 0.05 0.00 0.00 38.32 38.61 2p1i h ASN 251 CO 0.02 0.37 0.07 0.40 -1.65 0.00 0.00 177.43 176.64 2p1i h ILE 252 N -0.08 0.71 -0.03 2.81 2.04 -1.12 -1.79 117.51 120.04 2p1i h ILE 252 Ca 0.03 -0.07 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 2p1i h ILE 252 Cb 0.28 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 2p1i h ILE 252 CO 0.00 0.04 -0.08 0.58 0.00 0.00 0.00 178.15 178.69 2p1i h VAL 253 N 0.20 1.45 -0.67 1.67 2.07 -1.13 -1.32 116.25 118.52 2p1i h VAL 253 Ca 0.24 -1.45 0.07 0.00 0.82 0.00 0.00 66.70 66.37 2p1i h VAL 253 Cb 0.33 2.33 -0.09 0.00 -1.52 0.00 0.00 31.29 32.34 2p1i h VAL 253 CO -0.33 0.39 -0.53 0.50 0.02 0.00 0.00 177.57 177.61 2p1i h LYS 254 N -0.43 -0.17 -0.11 1.57 3.64 -0.84 0.51 116.57 120.75 2p1i h LYS 254 Ca -0.00 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.36 2p1i h LYS 254 Cb 0.68 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 2p1i h LYS 254 CO 0.02 -0.11 -0.06 0.93 -2.27 0.00 0.00 179.45 177.95 2p1i h GLU 255 N -0.17 0.15 -0.04 1.90 5.08 -1.31 0.37 114.58 120.57 2p1i h GLU 255 Ca 0.11 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.32 2p1i h GLU 255 Cb 0.46 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 2p1i h GLU 255 CO -0.72 0.23 -0.56 0.00 -1.00 0.00 0.00 179.01 176.96 2p1i h ALA 256 N 1.79 1.00 -0.12 3.43 0.00 -0.02 -1.80 119.26 123.54 2p1i h ALA 256 Ca 0.03 -0.51 -0.06 0.00 0.00 0.00 0.00 54.91 54.37 2p1i h ALA 256 Cb 0.22 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2p1i h ALA 256 CO 0.01 0.70 -0.17 0.28 0.00 0.00 0.00 179.25 180.07 2p1i h VAL 257 N 0.08 1.37 -0.43 0.00 2.07 0.10 0.12 116.25 119.57 2p1i h VAL 257 Ca -0.00 -1.41 -0.02 0.00 0.82 0.00 0.00 66.70 66.09 2p1i h VAL 257 Cb 1.01 2.02 -0.02 0.00 -1.52 0.00 0.00 31.29 32.79 2p1i h VAL 257 CO 0.08 0.41 0.17 -0.08 0.02 0.00 0.00 177.57 178.16 2p1i h GLU 258 N -0.10 0.60 -0.10 1.57 4.57 -1.11 -0.74 114.58 119.28 2p1i h GLU 258 Ca 0.01 -0.08 -0.04 0.00 -1.18 0.00 0.00 59.36 58.07 2p1i h GLU 258 Cb 0.74 -0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 29.21 2p1i h GLU 258 CO 0.04 0.50 -0.10 0.28 -1.18 0.00 0.00 179.01 178.55 2p1i h VAL 259 N 0.60 1.36 -0.64 0.32 2.07 -1.07 -2.74 116.25 116.15 2p1i h VAL 259 Ca 0.15 -1.26 0.11 0.00 0.82 0.00 0.00 66.70 66.51 2p1i h VAL 259 Cb 0.13 1.97 -0.12 0.00 -1.52 0.00 0.00 31.29 31.75 2p1i h VAL 259 CO -0.01 0.36 -0.37 -0.08 0.02 0.00 0.00 177.57 177.49 2p1i h GLU 260 N -0.17 -0.15 -0.94 1.57 4.57 -0.73 -3.12 114.58 115.62 2p1i h GLU 260 Ca 0.02 0.01 0.07 0.00 -1.18 0.00 0.00 59.36 58.27 2p1i h GLU 260 Cb 0.62 0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 29.18 2p1i h GLU 260 CO 0.03 -0.10 0.61 0.00 -1.18 0.00 0.00 179.01 178.37 2p1i h ARG 261 N -0.16 1.05 0.00 1.92 3.08 -1.05 -0.67 114.38 118.55 2p1i h ARG 261 Ca 0.23 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2p1i h ARG 261 Cb 0.56 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2p1i h ARG 261 CO -0.72 0.70 0.00 0.45 -1.07 0.00 0.00 179.97 179.32 2p1i n SER 262 N -4.49 0.00 0.00 7.04 2.88 -1.04 -1.49 113.62 116.51 2p1i n SER 262 Ca 0.14 0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 2p1i n SER 262 Cb 0.19 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.40 2p1i n SER 262 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2p1i n PHE 263 N -1.25 0.00 0.20 0.66 0.99 -0.26 -1.63 117.46 116.16 2p1i n PHE 263 Ca 0.05 0.00 0.09 0.00 -0.00 0.00 0.00 57.45 57.58 2p1i n PHE 263 Cb 0.07 -0.20 0.22 0.00 -1.00 0.00 0.00 39.48 38.56 2p1i n PHE 263 CO 0.00 0.00 0.00 -0.84 -0.00 0.00 0.00 176.76 175.92 2p1i h ILE 264 N 0.00 0.42 -0.13 4.37 -0.00 -1.60 1.01 117.51 121.58 2p1i h ILE 264 Ca 0.00 -1.42 0.00 0.00 -0.00 0.00 0.00 64.86 63.44 2p1i h ILE 264 Cb 0.00 2.07 0.00 0.00 -0.00 0.00 0.00 36.82 38.89 2p1i h ILE 264 CO 0.00 0.22 0.00 0.00 -0.00 0.00 0.00 178.15 178.37 2p1i n GLU 266 N 0.49 0.00 0.00 0.00 2.13 -1.18 -4.79 120.64 117.29 2p1i n GLU 266 Ca 0.07 0.00 -0.17 0.00 0.66 0.00 0.00 57.16 57.72 2p1i n GLU 266 Cb 0.31 -0.15 -0.12 0.00 0.27 0.00 0.00 31.44 31.75 2p1i n GLU 266 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 2p1i h SER 267 N 0.00 0.46 -3.45 4.31 0.02 -0.78 -3.38 113.55 110.73 2p1i h SER 267 Ca 0.00 -0.80 -0.61 0.00 -0.84 0.00 0.00 61.79 59.54 2p1i h SER 267 Cb 0.00 -0.14 -0.40 0.00 0.14 0.00 0.00 62.40 62.00 2p1i h SER 267 CO 0.00 1.20 -0.74 -0.22 -1.14 0.00 0.00 176.83 175.93 2p1i s LEU 268 N -8.29 2.86 -0.08 5.07 2.96 0.35 -5.04 118.68 116.51 2p1i s LEU 268 Ca -0.14 -2.25 -0.32 0.00 -0.22 0.00 0.00 54.13 51.20 2p1i s LEU 268 Cb 0.02 -1.08 -0.10 0.00 0.50 0.00 0.00 46.19 45.54 2p1i s LEU 268 CO 0.81 -0.33 1.96 -2.65 -1.32 0.00 0.00 176.35 174.82 2p1i n PRO 269 N 4.05 2.32 0.28 0.98 -0.02 -1.24 -3.86 135.00 137.52 2p1i n PRO 269 Ca 0.04 0.83 0.14 0.00 -2.02 0.00 0.00 63.50 62.49 2p1i n PRO 269 Cb 0.38 -2.81 0.80 0.00 -0.02 0.00 0.00 33.50 31.85 2p1i n PRO 269 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2p1i n ASP 271 N -3.68 0.01 -0.02 0.00 2.03 -1.25 -1.52 116.55 112.11 2p1i n ASP 271 Ca -0.02 -0.20 0.01 0.00 0.52 0.00 0.00 54.79 55.10 2p1i n ASP 271 Cb 0.18 -0.01 -0.01 0.00 -0.72 0.00 0.00 41.12 40.57 2p1i n ASP 271 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 2p1i n LEU 272 N -0.40 0.35 -0.13 -2.67 0.00 -1.05 -4.55 117.00 108.56 2p1i n LEU 272 Ca 0.00 -0.61 0.03 0.00 0.00 0.00 0.00 56.01 55.43 2p1i n LEU 272 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 43.42 43.42 2p1i n LEU 272 CO 0.00 0.08 0.17 2.30 0.00 0.00 0.00 177.39 179.94 2p1i n ILE 273 N -0.78 0.00 0.00 1.96 -5.35 -0.58 -3.89 119.36 110.72 2p1i n ILE 273 Ca 0.01 -0.43 0.00 0.00 -0.27 0.00 0.00 62.75 62.05 2p1i n ILE 273 Cb 0.04 1.07 0.00 0.00 -1.74 0.00 0.00 39.64 39.01 2p1i n ILE 273 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2p1i n GLY 274 N 0.74 0.74 3.92 3.28 0.00 -1.24 -4.96 105.19 107.68 2p1i n GLY 274 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 2p1i n GLY 274 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2p1i s MET 275 N 0.00 2.30 -0.30 1.61 -1.94 -1.16 -5.02 119.30 114.78 2p1i s MET 275 Ca 0.00 -0.16 -0.10 0.00 -1.71 0.00 0.00 55.69 53.72 2p1i s MET 275 Cb 0.00 -2.16 -0.02 0.00 2.01 0.00 0.00 34.83 34.66 2p1i s MET 275 CO 0.00 -1.19 0.16 1.21 -0.01 0.00 0.00 175.02 175.19 2p1i s ASN 276 N -4.49 5.68 0.50 3.03 3.84 -1.26 -3.88 114.94 118.36 2p1i s ASN 276 Ca 0.59 -0.35 0.17 0.00 0.21 0.00 0.00 52.86 53.49 2p1i s ASN 276 Cb -0.11 -2.04 1.24 0.00 -0.55 0.00 0.00 41.25 39.79 2p1i s ASN 276 CO 0.45 -0.15 2.09 0.77 -2.79 0.00 0.00 177.10 177.47 2p1i h SER 277 N 8.37 0.08 -0.09 -4.21 4.64 -1.91 -0.91 113.55 119.51 2p1i h SER 277 Ca -0.34 -0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.87 2p1i h SER 277 Cb 1.16 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2p1i h SER 277 CO 0.60 0.05 -0.38 0.03 -0.87 0.00 0.00 176.83 176.27 2p1i h ARG 278 N 0.09 0.42 -0.62 4.77 2.47 -1.96 0.38 114.38 119.93 2p1i h ARG 278 Ca 0.11 -0.33 0.09 0.00 -1.26 0.00 0.00 59.98 58.59 2p1i h ARG 278 Cb 0.31 0.06 -0.07 0.00 -1.65 0.00 0.00 29.97 28.62 2p1i h ARG 278 CO -0.01 0.96 0.24 -0.07 0.56 0.00 0.00 179.97 181.65 2p1i h LEU 279 N -0.03 0.26 -0.02 3.04 3.38 -1.93 -1.15 115.31 118.87 2p1i h LEU 279 Ca -0.02 0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.04 2p1i h LEU 279 Cb 1.02 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 2p1i h LEU 279 CO 0.08 0.15 -0.05 -0.03 0.09 0.00 0.00 178.44 178.68 2p1i h MET 280 N 0.43 -0.07 -0.98 1.13 4.05 -1.14 -1.86 114.93 116.49 2p1i h MET 280 Ca 0.31 0.00 0.21 0.00 -0.28 0.00 0.00 59.70 59.94 2p1i h MET 280 Cb 0.38 0.02 -0.09 0.00 -0.80 0.00 0.00 31.60 31.10 2p1i h MET 280 CO -0.30 -0.05 0.62 0.77 0.23 0.00 0.00 176.91 178.18 2p1i h SER 281 N -0.08 0.62 0.87 1.39 0.02 -0.37 -0.01 113.55 116.00 2p1i h SER 281 Ca 0.03 0.08 -0.13 0.00 -0.84 0.00 0.00 61.79 60.93 2p1i h SER 281 Cb 0.11 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 2p1i h SER 281 CO -0.06 0.21 -0.60 -0.61 -1.14 0.00 0.00 176.83 174.63 2p1i h GLN 282 N 0.60 0.00 -0.21 3.45 4.15 -0.74 -2.95 115.11 119.40 2p1i h GLN 282 Ca 0.55 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.85 2p1i h GLN 282 Cb 1.08 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.76 2p1i h GLN 282 CO -0.30 0.60 -0.38 -0.92 -1.93 0.00 0.00 178.83 175.90 2p1i h TYR 283 N 0.00 0.56 -0.08 3.99 3.20 -0.23 -1.87 116.97 122.54 2p1i h TYR 283 Ca -0.01 -0.15 0.01 0.00 3.14 0.00 0.00 58.73 61.72 2p1i h TYR 283 Cb 1.20 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 39.34 2p1i h TYR 283 CO 0.00 0.79 0.03 0.82 -1.64 0.00 0.00 178.16 178.16 2p1i h ILE 284 N 0.40 0.99 -0.67 1.81 1.08 -1.18 -0.09 117.51 119.85 2p1i h ILE 284 Ca 0.04 -0.02 0.13 0.00 -0.39 0.00 0.00 64.86 64.61 2p1i h ILE 284 Cb 0.85 0.91 -0.13 0.00 -3.07 0.00 0.00 36.82 35.38 2p1i h ILE 284 CO 0.07 0.01 -0.22 -0.33 -0.69 0.00 0.00 178.15 177.00 2p1i h GLU 285 N 0.07 -0.04 0.06 2.37 4.39 -1.34 0.43 114.58 120.53 2p1i h GLU 285 Ca 0.03 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.73 2p1i h GLU 285 Cb 0.01 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.67 2p1i h GLU 285 CO -0.03 -0.03 -0.03 0.35 -1.16 0.00 0.00 179.01 178.11 2p1i h PHE 286 N -0.04 -0.09 0.16 4.33 3.57 -0.94 0.31 116.94 124.24 2p1i h PHE 286 Ca 0.31 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.80 2p1i h PHE 286 Cb 0.52 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.29 2p1i h PHE 286 CO -0.58 -0.05 -0.11 0.28 -2.23 0.00 0.00 178.31 175.62 2p1i h VAL 287 N -0.09 0.77 -0.49 1.41 2.07 0.16 -0.05 116.25 120.02 2p1i h VAL 287 Ca -0.01 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.60 2p1i h VAL 287 Cb 0.07 0.77 -0.10 0.00 -1.52 0.00 0.00 31.29 30.51 2p1i h VAL 287 CO 0.01 0.00 -0.35 0.00 0.02 0.00 0.00 177.57 177.25 2p1i h ALA 288 N 0.57 -0.17 -0.25 1.67 0.00 0.21 0.58 119.26 121.87 2p1i h ALA 288 Ca -0.01 0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.08 2p1i h ALA 288 Cb 0.23 0.78 -0.06 0.00 0.00 0.00 0.00 17.79 18.74 2p1i h ALA 288 CO 0.00 -0.73 -0.11 -0.44 0.00 0.00 0.00 179.25 177.97 2p1i h ASP 289 N -0.22 -0.39 -0.98 0.00 3.45 -0.03 -0.54 116.42 117.71 2p1i h ASP 289 Ca 0.19 0.10 0.19 0.00 0.43 0.00 0.00 57.03 57.94 2p1i h ASP 289 Cb 0.55 0.22 -0.11 0.00 -0.56 0.00 0.00 39.33 39.43 2p1i h ASP 289 CO -0.61 -0.15 0.57 -0.09 -1.57 0.00 0.00 179.24 177.39 2p1i h ARG 290 N -0.08 0.69 0.14 3.56 2.43 -0.41 -1.54 114.38 119.17 2p1i h ARG 290 Ca 0.13 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 2p1i h ARG 290 Cb 0.28 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 2p1i h ARG 290 CO -0.31 0.46 -0.07 1.25 -1.51 0.00 0.00 179.97 179.79 2p1i h LEU 291 N 0.71 -0.16 -1.05 3.80 6.46 0.38 -1.32 115.31 124.13 2p1i h LEU 291 Ca 0.57 -0.22 0.23 0.00 -0.12 0.00 0.00 57.88 58.34 2p1i h LEU 291 Cb 0.90 0.04 -0.12 0.00 -0.73 0.00 0.00 40.66 40.76 2p1i h LEU 291 CO -0.40 0.14 0.61 -0.07 -0.62 0.00 0.00 178.44 178.10 2p1i h LEU 292 N -0.46 0.68 -0.22 2.25 -0.00 -0.37 0.27 115.31 117.47 2p1i h LEU 292 Ca -0.02 0.12 0.00 0.00 -0.00 0.00 0.00 57.88 57.98 2p1i h LEU 292 Cb 0.36 0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 41.02 2p1i h LEU 292 CO 0.03 0.15 0.14 -0.33 -0.00 0.00 0.00 178.44 178.43 2p1i h GLU 293 N 0.61 0.27 -0.17 1.13 4.39 -1.01 0.60 114.58 120.41 2p1i h GLU 293 Ca 0.62 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 60.32 2p1i h GLU 293 Cb 1.17 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.75 2p1i h GLU 293 CO -0.43 0.18 0.11 0.00 -1.16 0.00 0.00 179.01 177.72 2p1i n LEU 295 N -4.51 1.39 -2.25 0.00 4.77 0.70 -4.82 117.00 112.28 2p1i n LEU 295 Ca -0.00 -0.48 -0.11 0.00 -0.03 0.00 0.00 56.01 55.38 2p1i n LEU 295 Cb 0.12 -0.02 0.05 0.00 -2.33 0.00 0.00 43.42 41.25 2p1i n LEU 295 CO 0.34 0.24 0.10 0.61 -1.33 0.00 0.00 177.39 177.36 2p1i n GLY 296 N 1.15 0.08 3.18 -0.72 0.00 -0.66 -4.97 105.19 103.26 2p1i n GLY 296 Ca 0.19 -0.17 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 2p1i n GLY 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p1i s SER 298 N -2.82 6.96 1.39 0.00 1.04 -1.26 -3.45 113.70 115.56 2p1i s SER 298 Ca 0.10 1.81 -0.22 0.00 0.48 0.00 0.00 55.95 58.12 2p1i s SER 298 Cb 0.02 -2.56 0.35 0.00 0.10 0.00 0.00 66.02 63.92 2p1i s SER 298 CO -0.02 -0.34 0.82 0.29 0.98 0.00 0.00 173.24 174.96 2p1i n LYS 299 N -0.25 -4.32 0.00 4.02 5.02 -1.26 -4.92 118.16 116.46 2p1i n LYS 299 Ca 0.05 -1.28 0.00 0.00 -2.02 0.00 0.00 58.31 55.07 2p1i n LYS 299 Cb 0.52 -1.89 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 2p1i n LYS 299 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2p1i n VAL 300 N -5.59 0.00 -1.56 -0.18 0.31 -1.26 -4.90 118.33 105.15 2p1i n VAL 300 Ca 0.11 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.49 2p1i n VAL 300 Cb 0.56 0.00 0.07 0.00 -0.91 0.00 0.00 33.84 33.56 2p1i n VAL 300 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 2p1i n PHE 301 N -0.17 0.00 -0.02 3.52 -0.00 -1.26 -5.08 117.46 114.45 2p1i n PHE 301 Ca 0.00 -0.48 0.00 0.00 -0.00 0.00 0.00 57.45 56.97 2p1i n PHE 301 Cb 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 39.48 39.38 2p1i n PHE 301 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.76 177.48 2p1i n HIS 302 N -0.68 0.00 -3.76 -5.13 8.25 -1.26 -4.90 115.22 107.74 2p1i n HIS 302 Ca 0.08 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.40 2p1i n HIS 302 Cb 0.67 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.64 2p1i n HIS 302 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2p1i s SER 303 N 0.00 -0.13 1.15 0.41 1.04 -1.26 -5.12 113.70 109.79 2p1i s SER 303 Ca 0.00 0.31 -0.18 0.00 0.48 0.00 0.00 55.95 56.56 2p1i s SER 303 Cb 0.00 0.22 0.26 0.00 0.10 0.00 0.00 66.02 66.60 2p1i s SER 303 CO 0.00 -0.13 1.14 -0.54 0.98 0.00 0.00 173.24 174.68 2p1i s LYS 304 N 1.01 -0.80 -0.58 4.02 -0.14 -1.26 -4.54 119.74 117.45 2p1i s LYS 304 Ca -0.08 -0.06 -0.26 0.00 -1.36 0.00 0.00 55.97 54.21 2p1i s LYS 304 Cb -0.10 -1.65 -0.06 0.00 -1.68 0.00 0.00 37.83 34.35 2p1i s LYS 304 CO -0.05 -3.43 2.18 -0.80 -0.76 0.00 0.00 175.35 172.49 2p1i s ASN 305 N -3.99 4.73 0.54 2.83 -0.87 -1.26 -4.86 114.94 112.06 2p1i s ASN 305 Ca 0.71 0.62 0.29 0.00 -1.57 0.00 0.00 52.86 52.91 2p1i s ASN 305 Cb -0.10 -2.52 1.55 0.00 -0.02 0.00 0.00 41.25 40.16 2p1i s ASN 305 CO 0.56 -2.78 2.11 -0.65 -2.57 0.00 0.00 177.10 173.77 2p1i h PRO 306 N 16.87 0.00 -3.74 -0.60 0.11 -1.89 -3.39 132.00 139.36 2p1i h PRO 306 Ca -0.21 0.00 -0.41 0.00 0.11 0.00 0.00 66.00 65.49 2p1i h PRO 306 Cb 1.19 0.00 -0.37 0.00 0.11 0.00 0.00 31.00 31.94 2p1i h PRO 306 CO 1.17 0.09 -0.76 -0.06 -0.21 0.00 0.00 178.00 178.23 2p1i s PHE 307 N -4.21 0.58 -0.29 0.65 0.08 -1.26 -5.02 117.98 108.51 2p1i s PHE 307 Ca -0.03 -0.12 0.20 0.00 0.12 0.00 0.00 56.93 57.10 2p1i s PHE 307 Cb 0.13 -0.69 0.17 0.00 -0.57 0.00 0.00 43.02 42.06 2p1i s PHE 307 CO 0.57 -0.26 1.42 -2.95 -0.10 0.00 0.00 175.22 173.90 2p1i h ASN 308 N 7.95 0.00 0.00 1.36 7.08 -2.02 -3.53 115.58 126.42 2p1i h ASN 308 Ca -0.26 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.96 2p1i h ASN 308 Cb 1.13 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.37 2p1i h ASN 308 CO 0.33 0.21 0.00 -2.67 -2.08 0.00 0.00 177.43 173.22