#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g4p s ILE 33 N 0.00 4.33 0.59 3.57 1.01 -1.26 -5.02 121.20 124.42 3g4p s ILE 33 Ca 0.00 1.98 -0.16 0.00 0.00 0.00 0.00 60.65 62.47 3g4p s ILE 33 Cb 0.00 -4.28 -0.03 0.00 0.01 0.00 0.00 42.46 38.16 3g4p s ILE 33 CO 0.00 0.43 1.06 -0.94 0.00 0.00 0.00 174.94 175.49 3g4p s SER 34 N -0.66 5.73 0.26 3.58 1.04 -1.26 -4.93 113.70 117.47 3g4p s SER 34 Ca 0.42 1.85 -0.04 0.00 0.48 0.00 0.00 55.95 58.66 3g4p s SER 34 Cb -0.24 -2.54 0.51 0.00 0.10 0.00 0.00 66.02 63.86 3g4p s SER 34 CO 0.30 -1.20 1.63 -1.28 0.98 0.00 0.00 173.24 173.67 3g4p h SER 35 N 0.46 -0.27 -0.88 7.02 0.87 -2.00 -2.40 113.55 116.35 3g4p h SER 35 Ca -0.47 0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 3g4p h SER 35 Cb 1.22 0.33 -0.04 0.00 -0.44 0.00 0.00 62.40 63.48 3g4p h SER 35 CO 0.57 -0.18 0.55 -0.61 -0.53 0.00 0.00 176.83 176.63 3g4p h GLN 36 N 0.13 1.17 -0.26 2.24 4.15 -1.99 0.66 115.11 121.20 3g4p h GLN 36 Ca 0.45 -0.09 -0.11 0.00 0.77 0.00 0.00 58.65 59.67 3g4p h GLN 36 Cb 0.84 -0.25 -0.00 0.00 0.21 0.00 0.00 27.48 28.27 3g4p h GLN 36 CO -0.68 0.80 -0.27 0.37 -1.93 0.00 0.00 178.83 177.13 3g4p h GLN 37 N 1.20 0.65 -0.31 1.69 4.15 -1.85 -0.67 115.11 119.95 3g4p h GLN 37 Ca 0.32 -0.35 0.03 0.00 0.77 0.00 0.00 58.65 59.43 3g4p h GLN 37 Cb -0.09 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.58 3g4p h GLN 37 CO -0.06 0.95 0.11 0.45 -1.93 0.00 0.00 178.83 178.35 3g4p h HIS 38 N 0.38 0.20 -0.81 3.99 3.86 -0.95 -0.72 115.15 121.09 3g4p h HIS 38 Ca 0.04 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.25 3g4p h HIS 38 Cb 0.83 -0.04 -0.04 0.00 1.06 0.00 0.00 27.41 29.22 3g4p h HIS 38 CO 0.07 0.09 0.45 0.93 0.86 0.00 0.00 177.93 180.33 3g4p h GLU 39 N 0.25 1.13 -0.16 2.45 5.08 -0.74 -0.62 114.58 121.96 3g4p h GLU 39 Ca 0.14 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 3g4p h GLU 39 Cb 0.11 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 3g4p h GLU 39 CO -0.14 0.82 0.03 -0.22 -1.00 0.00 0.00 179.01 178.50 3g4p h LYS 40 N 1.12 0.26 -0.38 2.33 3.64 -0.81 -0.52 116.57 122.21 3g4p h LYS 40 Ca 0.29 -0.07 0.07 0.00 -1.27 0.00 0.00 60.65 59.67 3g4p h LYS 40 Cb 0.02 -0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 31.75 3g4p h LYS 40 CO -0.05 0.43 0.02 0.00 -2.27 0.00 0.00 179.45 177.58 3g4p h ALA 41 N 0.82 0.37 0.02 5.00 0.00 -0.98 -1.72 119.26 122.78 3g4p h ALA 41 Ca 0.05 0.10 -0.21 0.00 0.00 0.00 0.00 54.91 54.85 3g4p h ALA 41 Cb 0.29 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3g4p h ALA 41 CO 0.00 -0.38 -0.96 0.82 0.00 0.00 0.00 179.25 178.74 3g4p h ILE 42 N 0.13 1.52 -0.44 0.00 2.04 -0.98 -1.40 117.51 118.39 3g4p h ILE 42 Ca 0.19 -2.79 0.04 0.00 1.00 0.00 0.00 64.86 63.29 3g4p h ILE 42 Cb 0.25 2.59 -0.02 0.00 -0.74 0.00 0.00 36.82 38.90 3g4p h ILE 42 CO -0.29 0.81 0.29 0.50 0.00 0.00 0.00 178.15 179.46 3g4p h LYS 43 N 0.09 0.44 -0.32 2.37 3.64 -1.03 -2.67 116.57 119.09 3g4p h LYS 43 Ca -0.06 -0.03 -0.14 0.00 -1.27 0.00 0.00 60.65 59.16 3g4p h LYS 43 Cb 1.62 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.33 3g4p h LYS 43 CO 0.15 0.29 -0.35 0.66 -2.27 0.00 0.00 179.45 177.92 3g4p h SER 44 N 0.45 0.75 -0.68 4.20 4.64 -0.31 -1.75 113.55 120.86 3g4p h SER 44 Ca 0.18 -0.32 0.12 0.00 -0.47 0.00 0.00 61.79 61.30 3g4p h SER 44 Cb 0.15 -0.21 -0.09 0.00 -0.31 0.00 0.00 62.40 61.95 3g4p h SER 44 CO -0.04 1.03 0.24 1.88 -0.87 0.00 0.00 176.83 179.07 3g4p h TYR 45 N 0.60 0.40 -0.44 4.77 0.05 -1.12 0.46 116.97 121.70 3g4p h TYR 45 Ca 0.06 0.03 -0.11 0.00 0.05 0.00 0.00 58.73 58.76 3g4p h TYR 45 Cb 0.88 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 38.53 3g4p h TYR 45 CO 0.04 0.05 -0.16 0.74 -1.05 0.00 0.00 178.16 177.78 3g4p h PHE 46 N 0.39 1.00 -0.68 4.88 -1.00 -1.42 -3.10 116.94 117.01 3g4p h PHE 46 Ca 0.36 -0.23 -0.03 0.00 2.81 0.00 0.00 57.97 60.88 3g4p h PHE 46 Cb 0.52 -0.24 -0.03 0.00 3.61 0.00 0.00 35.95 39.81 3g4p h PHE 46 CO -0.19 1.01 0.30 -0.44 -1.61 0.00 0.00 178.31 177.38 3g4p h ASP 47 N 0.71 0.92 -0.22 2.17 3.32 -0.38 -2.55 116.42 120.39 3g4p h ASP 47 Ca 0.10 -0.15 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 3g4p h ASP 47 Cb 0.71 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.01 3g4p h ASP 47 CO 0.05 0.82 0.04 -0.33 -1.72 0.00 0.00 179.24 178.10 3g4p h GLU 48 N 0.96 0.47 -0.01 3.56 5.08 -0.16 -0.69 114.58 123.79 3g4p h GLU 48 Ca 0.23 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3g4p h GLU 48 Cb 0.17 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3g4p h GLU 48 CO -0.02 0.47 0.00 0.00 -1.00 0.00 0.00 179.01 178.45 3g4p n ALA 49 N -2.48 2.64 -3.99 3.43 0.00 -0.98 -4.88 120.51 114.26 3g4p n ALA 49 Ca 0.01 -0.18 -0.32 0.00 0.00 0.00 0.00 53.44 52.96 3g4p n ALA 49 Cb 0.20 -1.38 0.01 0.00 0.00 0.00 0.00 19.45 18.29 3g4p n ALA 49 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3g4p n GLN 50 N -0.80 -4.98 -4.47 0.00 6.02 -0.27 -4.97 117.38 107.90 3g4p n GLN 50 Ca 0.18 0.55 -0.24 0.00 -0.01 0.00 0.00 57.00 57.48 3g4p n GLN 50 Cb 0.10 -5.40 -0.09 0.00 1.02 0.00 0.00 30.24 25.88 3g4p n GLN 50 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 3g4p s THR 51 N -3.30 0.73 -0.08 5.09 -1.32 -1.12 -5.05 115.64 110.59 3g4p s THR 51 Ca 0.68 -2.00 0.05 0.00 -1.21 0.00 0.00 61.69 59.20 3g4p s THR 51 Cb -0.35 -2.49 -0.01 0.00 -1.51 0.00 0.00 72.50 68.14 3g4p s THR 51 CO 0.85 0.00 -0.22 -1.10 -2.21 0.00 0.00 174.62 171.94 3g4p s GLN 52 N -3.79 2.77 0.10 7.08 1.11 -1.26 -4.51 119.66 121.16 3g4p s GLN 52 Ca 0.29 -0.85 -0.27 0.00 0.01 0.00 0.00 55.36 54.53 3g4p s GLN 52 Cb 0.05 -2.27 0.08 0.00 -1.01 0.00 0.00 33.01 29.85 3g4p s GLN 52 CO 0.15 0.33 1.04 0.20 0.01 0.00 0.00 175.29 177.02 3g4p s GLY 53 N -0.02 -0.29 0.06 3.09 0.00 -1.26 -0.53 107.32 108.36 3g4p s GLY 53 Ca -0.07 0.35 0.04 0.00 0.00 0.00 0.00 44.72 45.04 3g4p s GLY 53 CO 0.05 0.06 -0.12 0.54 0.00 0.00 0.00 173.10 173.63 3g4p s VAL 54 N -3.04 0.89 -0.09 1.40 0.11 0.46 -1.74 120.40 118.38 3g4p s VAL 54 Ca 0.12 -1.24 0.03 0.00 -2.93 0.00 0.00 61.98 57.96 3g4p s VAL 54 Cb 0.00 -0.92 0.01 0.00 -1.53 0.00 0.00 36.38 33.94 3g4p s VAL 54 CO -0.00 -0.30 -0.18 -0.51 -3.33 0.00 0.00 175.10 170.77 3g4p s ILE 55 N -1.38 1.64 -0.20 7.04 2.07 0.32 -0.99 121.20 129.70 3g4p s ILE 55 Ca -0.05 -0.76 -0.09 0.00 -1.41 0.00 0.00 60.65 58.34 3g4p s ILE 55 Cb -0.10 -1.45 -0.05 0.00 0.13 0.00 0.00 42.46 41.00 3g4p s ILE 55 CO 0.01 0.47 0.10 -0.63 -1.91 0.00 0.00 174.94 172.99 3g4p s ILE 56 N 0.59 5.09 -0.02 2.00 1.01 -0.34 -0.87 121.20 128.66 3g4p s ILE 56 Ca -0.15 0.08 0.03 0.00 0.00 0.00 0.00 60.65 60.61 3g4p s ILE 56 Cb -0.17 -3.32 -0.03 0.00 0.01 0.00 0.00 42.46 38.95 3g4p s ILE 56 CO 0.05 0.43 -0.08 -0.63 0.00 0.00 0.00 174.94 174.71 3g4p s ILE 57 N 0.55 3.60 -0.07 2.92 -1.09 -0.11 -1.21 121.20 125.80 3g4p s ILE 57 Ca 0.06 -0.69 0.03 0.00 -2.23 0.00 0.00 60.65 57.82 3g4p s ILE 57 Cb -0.12 -2.52 0.01 0.00 -1.58 0.00 0.00 42.46 38.24 3g4p s ILE 57 CO 0.00 0.47 -0.16 -0.75 -1.23 0.00 0.00 174.94 173.27 3g4p s LYS 58 N -1.18 2.06 -0.19 2.79 2.20 -0.64 0.71 119.74 125.49 3g4p s LYS 58 Ca 0.15 -0.57 0.00 0.00 -0.36 0.00 0.00 55.97 55.19 3g4p s LYS 58 Cb -0.11 -1.66 0.05 0.00 -1.51 0.00 0.00 37.83 34.59 3g4p s LYS 58 CO 0.05 0.11 -0.07 -1.21 -0.36 0.00 0.00 175.35 173.87 3g4p s GLU 59 N 0.45 1.72 4.13 4.03 2.02 -0.06 -3.56 118.70 127.44 3g4p s GLU 59 Ca -0.14 -0.74 0.00 0.00 0.02 0.00 0.00 54.97 54.12 3g4p s GLU 59 Cb -0.15 -2.29 0.00 0.00 0.10 0.00 0.00 34.13 31.79 3g4p s GLU 59 CO 0.05 -0.46 0.00 0.41 0.02 0.00 0.00 175.26 175.28 3g4p n GLY 60 N 4.76 2.63 0.34 -1.39 0.00 -1.26 -0.43 105.19 109.84 3g4p n GLY 60 Ca -0.13 0.34 0.12 0.00 0.00 0.00 0.00 46.02 46.35 3g4p n GLY 60 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3g4p n LYS 61 N 8.08 0.97 -3.56 1.61 5.02 -1.26 -4.95 118.16 124.07 3g4p n LYS 61 Ca 0.00 -0.69 -0.37 0.00 -2.02 0.00 0.00 58.31 55.23 3g4p n LYS 61 Cb 0.00 -1.49 -0.08 0.00 -0.02 0.00 0.00 35.03 33.44 3g4p n LYS 61 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3g4p s ASN 62 N -2.50 6.26 -0.08 4.39 2.47 0.42 -5.07 114.94 120.83 3g4p s ASN 62 Ca 0.22 0.30 -0.19 0.00 0.42 0.00 0.00 52.86 53.61 3g4p s ASN 62 Cb 0.19 -2.15 -0.04 0.00 -1.45 0.00 0.00 41.25 37.79 3g4p s ASN 62 CO 0.55 0.03 0.52 -0.76 -3.72 0.00 0.00 177.10 173.71 3g4p s LEU 63 N 1.02 4.32 -0.12 3.21 1.43 -1.26 -0.88 118.68 126.41 3g4p s LEU 63 Ca 0.12 0.93 0.02 0.00 -1.03 0.00 0.00 54.13 54.18 3g4p s LEU 63 Cb -0.14 -2.77 0.01 0.00 0.03 0.00 0.00 46.19 43.33 3g4p s LEU 63 CO 0.05 0.04 -0.19 -0.44 0.23 0.00 0.00 176.35 176.03 3g4p s SER 64 N 0.34 2.78 -0.19 2.29 0.01 0.22 -4.97 113.70 114.18 3g4p s SER 64 Ca 0.28 -0.51 -0.08 0.00 1.31 0.00 0.00 55.95 56.94 3g4p s SER 64 Cb -0.16 -1.27 -0.04 0.00 0.21 0.00 0.00 66.02 64.75 3g4p s SER 64 CO 0.13 0.07 0.08 -0.89 0.41 0.00 0.00 173.24 173.04 3g4p s THR 65 N 0.78 4.95 0.23 1.44 2.01 -1.26 -0.93 115.64 122.86 3g4p s THR 65 Ca -0.09 0.03 0.01 0.00 0.31 0.00 0.00 61.69 61.94 3g4p s THR 65 Cb -0.16 -3.25 -0.05 0.00 0.01 0.00 0.00 72.50 69.06 3g4p s THR 65 CO 0.00 0.44 0.08 -0.31 -0.69 0.00 0.00 174.62 174.15 3g4p s TYR 66 N 0.46 1.40 0.00 4.92 2.02 -0.05 -4.99 117.35 121.12 3g4p s TYR 66 Ca 0.05 -1.17 0.00 0.00 -0.37 0.00 0.00 57.07 55.58 3g4p s TYR 66 Cb -0.12 -0.80 0.00 0.00 -0.40 0.00 0.00 41.96 40.64 3g4p s TYR 66 CO 0.00 -0.35 0.00 0.41 -1.57 0.00 0.00 175.55 174.04 3g4p n GLY 67 N -0.38 -0.01 0.94 0.71 0.00 -1.26 -0.52 105.19 104.67 3g4p n GLY 67 Ca -0.01 -2.28 0.09 0.00 0.00 0.00 0.00 46.02 43.81 3g4p n GLY 67 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3g4p n ASN 68 N 0.00 3.29 -2.94 1.61 0.23 -0.97 -4.27 115.26 112.22 3g4p n ASN 68 Ca 0.00 -1.96 -0.12 0.00 -0.53 0.00 0.00 54.58 51.97 3g4p n ASN 68 Cb 0.00 -0.31 -0.01 0.00 -2.08 0.00 0.00 39.78 37.38 3g4p n ASN 68 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3g4p n ALA 69 N 1.04 -0.31 -0.14 -2.53 0.00 -0.71 -4.76 120.51 113.09 3g4p n ALA 69 Ca 0.17 -1.81 0.16 0.00 0.00 0.00 0.00 53.44 51.96 3g4p n ALA 69 Cb 0.51 -1.23 0.52 0.00 0.00 0.00 0.00 19.45 19.25 3g4p n ALA 69 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3g4p h LEU 70 N 4.79 0.35 -0.75 0.00 3.38 -1.84 -1.67 115.31 119.57 3g4p h LEU 70 Ca 0.06 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3g4p h LEU 70 Cb 1.02 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.72 3g4p h LEU 70 CO 0.21 0.19 0.00 0.00 0.09 0.00 0.00 178.44 178.92 3g4p n ALA 71 N -2.53 1.39 0.04 1.53 0.00 -1.26 -1.67 120.51 118.01 3g4p n ALA 71 Ca 0.13 0.09 0.01 0.00 0.00 0.00 0.00 53.44 53.67 3g4p n ALA 71 Cb 0.52 -1.30 0.03 0.00 0.00 0.00 0.00 19.45 18.71 3g4p n ALA 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3g4p n ARG 72 N -2.05 0.00 0.14 0.00 1.74 -0.63 -3.55 116.66 112.31 3g4p n ARG 72 Ca 0.01 0.48 -0.01 0.00 -0.77 0.00 0.00 57.85 57.56 3g4p n ARG 72 Cb 0.13 -1.50 0.24 0.00 -1.02 0.00 0.00 32.46 30.31 3g4p n ARG 72 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3g4p h ALA 73 N 2.04 1.12 0.00 7.54 0.00 -1.55 -2.65 119.26 125.77 3g4p h ALA 73 Ca 0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 3g4p h ALA 73 Cb 0.02 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 3g4p h ALA 73 CO 0.00 0.63 -0.42 0.09 0.00 0.00 0.00 179.25 179.55 3g4p n ASN 74 N -3.95 1.67 -4.82 0.00 4.13 -1.23 -2.26 115.26 108.80 3g4p n ASN 74 Ca -0.02 -3.26 -0.37 0.00 1.68 0.00 0.00 54.58 52.62 3g4p n ASN 74 Cb 0.52 -0.44 -0.06 0.00 -1.54 0.00 0.00 39.78 38.26 3g4p n ASN 74 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 3g4p s LYS 75 N -2.44 4.20 0.00 3.52 1.02 -1.00 -4.92 119.74 120.13 3g4p s LYS 75 Ca 0.33 0.78 -0.22 0.00 0.02 0.00 0.00 55.97 56.87 3g4p s LYS 75 Cb 0.32 -2.99 -0.05 0.00 -0.52 0.00 0.00 37.83 34.59 3g4p s LYS 75 CO -0.05 0.47 0.66 -1.21 -0.92 0.00 0.00 175.35 174.30 3g4p s GLU 76 N -1.75 4.39 0.22 1.68 2.02 -1.26 -3.94 118.70 120.05 3g4p s GLU 76 Ca 0.39 0.85 0.00 0.00 0.02 0.00 0.00 54.97 56.23 3g4p s GLU 76 Cb -0.17 -3.36 -0.05 0.00 0.10 0.00 0.00 34.13 30.65 3g4p s GLU 76 CO 0.21 0.31 0.11 0.71 0.02 0.00 0.00 175.26 176.62 3g4p s TYR 77 N -0.04 1.32 0.38 1.61 1.51 -0.13 -4.82 117.35 117.18 3g4p s TYR 77 Ca 0.34 -1.28 -0.24 0.00 -1.01 0.00 0.00 57.07 54.88 3g4p s TYR 77 Cb -0.19 -0.71 -0.10 0.00 -0.11 0.00 0.00 41.96 40.85 3g4p s TYR 77 CO 0.19 -0.50 0.97 0.14 -1.11 0.00 0.00 175.55 175.25 3g4p s VAL 78 N -3.97 4.14 0.36 0.71 -7.23 -1.26 -1.03 120.40 112.12 3g4p s VAL 78 Ca 0.38 1.58 0.24 0.00 -1.81 0.00 0.00 61.98 62.38 3g4p s VAL 78 Cb 0.07 -3.79 0.25 0.00 0.56 0.00 0.00 36.38 33.48 3g4p s VAL 78 CO 0.12 -0.05 2.00 1.55 -0.31 0.00 0.00 175.10 178.41 3g4p h PRO 79 N 2.57 0.00 0.00 4.82 0.13 -1.76 -3.46 132.00 134.30 3g4p h PRO 79 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3g4p h PRO 79 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3g4p h PRO 79 CO 0.63 0.17 0.00 0.00 -0.23 0.00 0.00 178.00 178.57 3g4p n ALA 80 N -2.30 0.00 0.48 -0.56 0.00 -0.29 -0.54 120.51 117.30 3g4p n ALA 80 Ca -0.01 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.49 3g4p n ALA 80 Cb 0.29 0.00 0.28 0.00 0.00 0.00 0.00 19.45 20.03 3g4p n ALA 80 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3g4p n SER 81 N 0.56 0.00 -0.33 0.00 7.64 -1.26 -1.78 113.62 118.45 3g4p n SER 81 Ca 0.00 0.40 0.20 0.00 1.01 0.00 0.00 58.87 60.48 3g4p n SER 81 Cb 0.00 -0.45 0.41 0.00 -1.01 0.00 0.00 64.21 63.16 3g4p n SER 81 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 3g4p h THR 82 N 0.00 0.40 0.00 0.44 1.35 -0.83 -3.39 112.91 110.88 3g4p h THR 82 Ca 0.00 -0.14 -0.10 0.00 -0.55 0.00 0.00 66.41 65.62 3g4p h THR 82 Cb 0.20 -0.04 0.02 0.00 -1.73 0.00 0.00 68.15 66.59 3g4p h THR 82 CO 0.00 0.07 1.20 0.33 -0.25 0.00 0.00 175.52 176.87 3g4p n PHE 83 N -5.02 0.14 0.00 4.73 7.35 -0.73 -4.31 117.46 119.63 3g4p n PHE 83 Ca 0.28 -0.65 0.00 0.00 -0.76 0.00 0.00 57.45 56.32 3g4p n PHE 83 Cb 0.84 -0.72 0.00 0.00 0.35 0.00 0.00 39.48 39.95 3g4p n PHE 83 CO 0.00 0.00 0.00 -1.33 -0.76 0.00 0.00 176.76 174.67 3g4p n MET 85 N 5.25 0.00 0.08 -4.13 2.81 -1.26 -0.88 117.12 118.99 3g4p n MET 85 Ca 0.09 0.00 -0.10 0.00 -1.81 0.00 0.00 57.70 55.88 3g4p n MET 85 Cb 0.06 0.00 -0.07 0.00 -0.71 0.00 0.00 33.22 32.50 3g4p n MET 85 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 3g4p h LEU 86 N 0.00 0.21 -0.45 4.03 5.85 -1.96 -2.77 115.31 120.23 3g4p h LEU 86 Ca 0.00 -0.20 -0.07 0.00 0.84 0.00 0.00 57.88 58.45 3g4p h LEU 86 Cb 0.00 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 3g4p h LEU 86 CO 0.00 1.09 0.01 -1.13 -0.34 0.00 0.00 178.44 178.06 3g4p h ASN 87 N 0.06 0.77 -0.55 1.25 -0.73 -1.37 0.47 115.58 115.49 3g4p h ASN 87 Ca -0.06 -0.30 0.03 0.00 1.87 0.00 0.00 56.30 57.84 3g4p h ASN 87 Cb 1.70 -0.21 -0.04 0.00 0.27 0.00 0.00 38.32 40.04 3g4p h ASN 87 CO 0.15 0.89 0.32 0.00 -0.37 0.00 0.00 177.43 178.41 3g4p h ALA 88 N 0.91 0.71 -0.12 1.57 0.00 -1.80 0.96 119.26 121.50 3g4p h ALA 88 Ca 0.13 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.05 3g4p h ALA 88 Cb 0.49 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3g4p h ALA 88 CO 0.02 0.02 0.05 -0.07 0.00 0.00 0.00 179.25 179.26 3g4p h LEU 89 N 0.62 0.06 -0.58 0.00 3.38 -1.05 -0.49 115.31 117.25 3g4p h LEU 89 Ca 0.23 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.17 3g4p h LEU 89 Cb 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 3g4p h LEU 89 CO -0.12 0.05 0.21 0.40 0.09 0.00 0.00 178.44 179.07 3g4p h ILE 90 N 0.11 1.23 -0.22 1.22 2.04 -0.37 -1.64 117.51 119.88 3g4p h ILE 90 Ca 0.05 -0.76 -0.02 0.00 1.00 0.00 0.00 64.86 65.13 3g4p h ILE 90 Cb 0.02 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 3g4p h ILE 90 CO -0.05 0.29 0.07 1.23 0.00 0.00 0.00 178.15 179.69 3g4p h GLY 91 N 0.81 0.37 1.04 5.37 0.00 -0.56 -1.57 103.07 108.54 3g4p h GLY 91 Ca 0.19 -0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.27 3g4p h GLY 91 CO -0.01 0.20 0.40 1.41 0.00 0.00 0.00 176.54 178.55 3g4p h LEU 92 N 0.19 1.12 -0.04 3.11 3.38 -1.08 0.10 115.31 122.09 3g4p h LEU 92 Ca 0.07 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3g4p h LEU 92 Cb 0.23 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 3g4p h LEU 92 CO -0.00 0.95 -0.01 -0.08 0.09 0.00 0.00 178.44 179.38 3g4p h GLU 93 N 1.21 0.07 -0.20 1.13 4.57 -1.20 -2.87 114.58 117.30 3g4p h GLU 93 Ca 0.29 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.44 3g4p h GLU 93 Cb 0.13 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 3g4p h GLU 93 CO -0.04 0.45 0.00 0.09 -1.18 0.00 0.00 179.01 178.34 3g4p n ASN 94 N -4.84 0.20 -2.41 1.04 3.02 -0.60 -4.93 115.26 106.73 3g4p n ASN 94 Ca -0.08 -1.33 -0.19 0.00 -0.03 0.00 0.00 54.58 52.95 3g4p n ASN 94 Cb 0.23 -0.10 -0.01 0.00 -0.61 0.00 0.00 39.78 39.29 3g4p n ASN 94 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3g4p n HIS 95 N -0.30 -1.09 1.27 3.10 8.25 -1.04 -4.85 115.22 120.56 3g4p n HIS 95 Ca 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.60 3g4p n HIS 95 Cb 0.05 -3.74 0.57 0.00 1.12 0.00 0.00 29.99 28.00 3g4p n HIS 95 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3g4p n LYS 96 N -2.97 0.44 -3.65 -0.41 4.76 0.33 -4.95 118.16 111.70 3g4p n LYS 96 Ca -0.23 -0.14 -0.02 0.00 -2.87 0.00 0.00 58.31 55.05 3g4p n LYS 96 Cb 0.67 -1.50 -0.01 0.00 -1.84 0.00 0.00 35.03 32.35 3g4p n LYS 96 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3g4p s ALA 97 N -2.66 -1.95 0.32 7.82 0.00 -1.22 -4.98 121.76 119.10 3g4p s ALA 97 Ca 0.23 0.65 0.08 0.00 0.00 0.00 0.00 51.96 52.92 3g4p s ALA 97 Cb 0.19 0.41 -0.06 0.00 0.00 0.00 0.00 23.12 23.66 3g4p s ALA 97 CO 0.52 -0.94 -0.06 0.95 0.00 0.00 0.00 175.76 176.22 3g4p s THR 98 N -2.83 1.91 -1.27 0.00 -4.23 -1.26 -4.47 115.64 103.49 3g4p s THR 98 Ca 0.12 -2.14 0.15 0.00 -1.18 0.00 0.00 61.69 58.63 3g4p s THR 98 Cb 0.01 -2.61 0.21 0.00 1.34 0.00 0.00 72.50 71.45 3g4p s THR 98 CO -0.02 -0.21 1.43 0.35 -0.54 0.00 0.00 174.62 175.62 3g4p n THR 99 N -0.72 0.75 0.24 3.99 -2.24 -1.26 -2.78 114.28 112.26 3g4p n THR 99 Ca -0.05 0.19 0.03 0.00 -2.27 0.00 0.00 64.05 61.94 3g4p n THR 99 Cb 0.64 -0.94 0.01 0.00 -2.10 0.00 0.00 70.33 67.94 3g4p n THR 99 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3g4p n ASN 100 N -1.37 1.24 -4.61 3.42 0.23 -1.26 -4.72 115.26 108.19 3g4p n ASN 100 Ca 0.06 -1.12 -0.45 0.00 -0.53 0.00 0.00 54.58 52.54 3g4p n ASN 100 Cb 0.14 0.19 -0.02 0.00 -2.08 0.00 0.00 39.78 38.01 3g4p n ASN 100 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 3g4p n GLU 101 N 0.04 1.51 -3.75 -3.83 2.13 -1.12 -4.87 120.64 110.76 3g4p n GLU 101 Ca 0.03 0.53 -0.37 0.00 0.66 0.00 0.00 57.16 58.01 3g4p n GLU 101 Cb 0.13 -1.98 -0.12 0.00 0.27 0.00 0.00 31.44 29.74 3g4p n GLU 101 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 3g4p s ILE 102 N -0.85 4.22 -0.31 6.31 1.01 -1.26 -4.10 121.20 126.21 3g4p s ILE 102 Ca 0.61 -0.36 -0.27 0.00 0.00 0.00 0.00 60.65 60.63 3g4p s ILE 102 Cb -0.70 -3.05 0.01 0.00 0.01 0.00 0.00 42.46 38.73 3g4p s ILE 102 CO 0.58 0.23 0.98 -0.36 0.00 0.00 0.00 174.94 176.38 3g4p s PHE 103 N 1.58 3.17 0.26 3.97 0.40 0.73 -4.85 117.98 123.24 3g4p s PHE 103 Ca 0.05 1.07 -0.30 0.00 -0.60 0.00 0.00 56.93 57.15 3g4p s PHE 103 Cb -0.16 -3.53 -0.09 0.00 0.51 0.00 0.00 43.02 39.75 3g4p s PHE 103 CO 0.03 -0.70 1.09 0.15 0.70 0.00 0.00 175.22 176.50 3g4p s LYS 104 N 3.42 4.64 0.23 0.44 -0.14 -1.26 -1.51 119.74 125.56 3g4p s LYS 104 Ca 0.41 1.78 -0.30 0.00 -1.36 0.00 0.00 55.97 56.50 3g4p s LYS 104 Cb -0.13 -3.21 -0.10 0.00 -1.68 0.00 0.00 37.83 32.72 3g4p s LYS 104 CO 0.14 0.20 1.38 -0.46 -0.76 0.00 0.00 175.35 175.85 3g4p s TRP 105 N -0.97 3.11 -1.85 3.18 -0.00 -1.25 -4.91 118.94 116.25 3g4p s TRP 105 Ca 0.45 1.12 0.29 0.00 -0.00 0.00 0.00 56.10 57.96 3g4p s TRP 105 Cb -0.31 -3.73 1.31 0.00 -0.00 0.00 0.00 33.47 30.74 3g4p s TRP 105 CO 0.39 -2.32 1.90 -0.40 -0.00 0.00 0.00 176.95 176.52 3g4p n ASP 106 N 2.38 0.56 0.00 5.86 5.68 -1.26 -4.87 116.55 124.90 3g4p n ASP 106 Ca 0.06 -0.80 0.00 0.00 -0.50 0.00 0.00 54.79 53.55 3g4p n ASP 106 Cb 0.41 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 40.35 3g4p n ASP 106 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3g4p n GLY 107 N 1.22 0.51 3.82 6.12 0.00 -1.26 -5.05 105.19 110.55 3g4p n GLY 107 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 3g4p n GLY 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g4p s LYS 108 N -0.88 4.23 0.33 1.61 1.02 -1.26 -5.02 119.74 119.77 3g4p s LYS 108 Ca 0.00 1.03 -0.29 0.00 0.02 0.00 0.00 55.97 56.73 3g4p s LYS 108 Cb 0.00 -2.37 -0.12 0.00 -0.52 0.00 0.00 37.83 34.83 3g4p s LYS 108 CO 0.00 0.08 1.50 1.17 -0.92 0.00 0.00 175.35 177.18 3g4p n LYS 109 N -0.33 2.55 -4.42 1.68 3.00 -1.26 -4.96 118.16 114.43 3g4p n LYS 109 Ca 0.05 0.90 -0.22 0.00 -0.00 0.00 0.00 58.31 59.04 3g4p n LYS 109 Cb 0.53 -2.62 -0.10 0.00 0.00 0.00 0.00 35.03 32.83 3g4p n LYS 109 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 3g4p s ARG 110 N -1.30 1.52 0.40 1.64 0.52 -1.26 -5.02 118.95 115.45 3g4p s ARG 110 Ca 0.59 -1.67 0.14 0.00 -0.52 0.00 0.00 55.73 54.28 3g4p s ARG 110 Cb -0.51 -1.53 0.99 0.00 0.52 0.00 0.00 34.95 34.42 3g4p s ARG 110 CO 0.56 0.28 1.87 1.15 0.02 0.00 0.00 175.30 179.18 3g4p h THR 111 N 2.50 0.74 -3.93 0.02 2.02 -1.98 -3.40 112.91 108.88 3g4p h THR 111 Ca -0.40 -0.17 -0.48 0.00 0.77 0.00 0.00 66.41 66.13 3g4p h THR 111 Cb 1.24 0.20 -0.31 0.00 -1.74 0.00 0.00 68.15 67.54 3g4p h THR 111 CO 0.59 0.09 -0.81 -0.31 0.37 0.00 0.00 175.52 175.45 3g4p s TYR 112 N -5.51 1.26 0.47 3.16 2.02 -1.26 -5.04 117.35 112.46 3g4p s TYR 112 Ca -0.09 -0.32 0.21 0.00 -0.37 0.00 0.00 57.07 56.51 3g4p s TYR 112 Cb 0.22 -0.86 1.22 0.00 -0.40 0.00 0.00 41.96 42.15 3g4p s TYR 112 CO 0.78 -0.10 1.92 -1.35 -1.57 0.00 0.00 175.55 175.23 3g4p h PRO 113 N 6.21 0.23 0.00 -1.71 0.11 -1.99 -1.45 132.00 133.39 3g4p h PRO 113 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3g4p h PRO 113 Cb 1.17 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3g4p h PRO 113 CO 0.48 0.15 0.00 0.00 -0.21 0.00 0.00 178.00 178.42 3g4p h MET 114 N 0.23 0.00 -0.00 1.05 -0.00 -1.96 -2.20 114.93 112.05 3g4p h MET 114 Ca 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.07 3g4p h MET 114 Cb 1.10 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.70 3g4p h MET 114 CO -0.08 0.00 -0.31 0.91 -0.00 0.00 0.00 176.91 177.43 3g4p n TRP 115 N -2.50 0.00 -2.25 -0.10 8.01 -0.55 -4.57 117.44 115.49 3g4p n TRP 115 Ca 0.02 0.00 -0.42 0.00 -1.31 0.00 0.00 57.50 55.78 3g4p n TRP 115 Cb 0.26 -0.25 0.00 0.00 -2.01 0.00 0.00 31.31 29.31 3g4p n TRP 115 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.69 177.07 3g4p n GLU 116 N -1.22 3.59 -3.53 -0.99 1.02 -0.83 -4.83 120.64 113.85 3g4p n GLU 116 Ca 0.09 -3.42 -0.08 0.00 -0.02 0.00 0.00 57.16 53.73 3g4p n GLU 116 Cb 0.33 -2.95 -0.02 0.00 -0.02 0.00 0.00 31.44 28.78 3g4p n GLU 116 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 3g4p s LYS 117 N 0.60 0.96 0.18 3.49 -2.85 -1.26 -5.01 119.74 115.86 3g4p s LYS 117 Ca 0.41 -0.39 -0.27 0.00 -1.00 0.00 0.00 55.97 54.72 3g4p s LYS 117 Cb 0.11 0.42 -0.08 0.00 -2.06 0.00 0.00 37.83 36.21 3g4p s LYS 117 CO -0.01 -0.43 0.83 -0.51 0.10 0.00 0.00 175.35 175.33 3g4p s ASP 118 N -2.60 7.46 0.05 0.03 1.01 -1.26 -3.84 116.67 117.52 3g4p s ASP 118 Ca 0.06 1.73 -0.26 0.00 0.71 0.00 0.00 52.55 54.78 3g4p s ASP 118 Cb -0.01 -2.53 0.07 0.00 1.01 0.00 0.00 42.92 41.45 3g4p s ASP 118 CO -0.08 0.17 0.62 0.00 0.21 0.00 0.00 175.17 176.09 3g4p s MET 119 N -1.04 1.14 0.61 8.23 0.23 -0.57 -4.92 119.30 122.98 3g4p s MET 119 Ca 0.38 -0.11 -0.08 0.00 -1.03 0.00 0.00 55.69 54.84 3g4p s MET 119 Cb -0.24 0.53 -0.00 0.00 -1.53 0.00 0.00 34.83 33.59 3g4p s MET 119 CO 0.28 -0.42 0.96 0.95 -2.03 0.00 0.00 175.02 174.75 3g4p s THR 120 N -2.40 3.98 0.35 3.16 -4.23 -1.26 -0.19 115.64 115.06 3g4p s THR 120 Ca -0.05 0.31 0.12 0.00 -1.18 0.00 0.00 61.69 60.88 3g4p s THR 120 Cb -0.01 -3.59 0.34 0.00 1.34 0.00 0.00 72.50 70.58 3g4p s THR 120 CO -0.01 -0.68 1.80 -0.07 -0.54 0.00 0.00 174.62 175.12 3g4p h LEU 121 N -0.27 0.61 -0.34 4.79 3.38 -1.85 -0.32 115.31 121.32 3g4p h LEU 121 Ca -0.45 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.55 3g4p h LEU 121 Cb 1.24 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 3g4p h LEU 121 CO 0.62 0.21 0.04 1.23 0.09 0.00 0.00 178.44 180.62 3g4p h GLY 122 N 0.59 0.62 1.00 0.83 0.00 -1.93 0.93 103.07 105.11 3g4p h GLY 122 Ca 0.55 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.46 3g4p h GLY 122 CO -0.31 0.39 0.36 0.83 0.00 0.00 0.00 176.54 177.82 3g4p h GLU 123 N 0.40 0.73 0.00 4.80 5.08 -1.87 -2.51 114.58 121.21 3g4p h GLU 123 Ca 0.10 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.37 3g4p h GLU 123 Cb 0.38 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 3g4p h GLU 123 CO 0.01 0.49 -0.24 0.00 -1.00 0.00 0.00 179.01 178.27 3g4p h ALA 124 N 1.20 1.55 0.02 3.43 0.00 -0.97 -1.21 119.26 123.28 3g4p h ALA 124 Ca 0.20 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3g4p h ALA 124 Cb -0.08 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3g4p h ALA 124 CO -0.04 0.30 -0.01 1.98 0.00 0.00 0.00 179.25 181.47 3g4p h MET 125 N 0.00 -0.03 -0.63 0.00 -1.53 -0.54 -0.04 114.93 112.17 3g4p h MET 125 Ca -0.00 0.00 -0.03 0.00 -3.44 0.00 0.00 59.70 56.23 3g4p h MET 125 Cb 0.43 0.01 -0.03 0.00 -0.55 0.00 0.00 31.60 31.46 3g4p h MET 125 CO 0.03 0.33 0.25 0.00 0.14 0.00 0.00 176.91 177.66 3g4p h ALA 126 N 0.58 1.27 -0.02 0.39 0.00 -1.31 -1.77 119.26 118.40 3g4p h ALA 126 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3g4p h ALA 126 Cb 0.37 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3g4p h ALA 126 CO 0.00 0.54 0.00 1.28 0.00 0.00 0.00 179.25 181.08 3g4p n LEU 127 N -4.32 1.01 -4.04 0.00 4.77 -0.47 -4.93 117.00 109.02 3g4p n LEU 127 Ca 0.05 -0.34 -0.32 0.00 -0.03 0.00 0.00 56.01 55.38 3g4p n LEU 127 Cb 0.17 -0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.25 3g4p n LEU 127 CO 0.39 0.17 -0.01 -0.24 -1.33 0.00 0.00 177.39 176.37 3g4p n SER 128 N -0.20 -3.30 -4.56 -1.43 2.88 -0.45 -4.83 113.62 101.73 3g4p n SER 128 Ca 0.20 -0.91 -0.35 0.00 -1.33 0.00 0.00 58.87 56.48 3g4p n SER 128 Cb 0.27 -3.30 -0.04 0.00 -0.75 0.00 0.00 64.21 60.40 3g4p n SER 128 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3g4p s ALA 129 N -3.42 2.33 0.36 -1.46 0.00 -0.16 -4.84 121.76 114.57 3g4p s ALA 129 Ca 0.56 -2.05 0.13 0.00 0.00 0.00 0.00 51.96 50.59 3g4p s ALA 129 Cb -0.29 -4.56 0.95 0.00 0.00 0.00 0.00 23.12 19.21 3g4p s ALA 129 CO 0.88 -4.15 1.78 0.28 0.00 0.00 0.00 175.76 174.55 3g4p h VAL 130 N 6.78 0.60 0.00 0.00 2.07 -1.88 -2.00 116.25 121.83 3g4p h VAL 130 Ca 0.19 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 3g4p h VAL 130 Cb 0.99 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 3g4p h VAL 130 CO 1.34 0.10 -0.02 -0.65 0.02 0.00 0.00 177.57 178.36 3g4p h PRO 131 N 0.55 0.00 0.05 1.57 0.11 -1.98 0.89 132.00 133.19 3g4p h PRO 131 Ca 0.58 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 66.47 3g4p h PRO 131 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3g4p h PRO 131 CO -0.34 0.02 -1.03 0.28 -0.21 0.00 0.00 178.00 176.71 3g4p h VAL 132 N 0.00 1.55 0.00 3.15 2.07 -1.77 -2.66 116.25 118.59 3g4p h VAL 132 Ca -0.00 -2.97 -0.05 0.00 0.82 0.00 0.00 66.70 64.50 3g4p h VAL 132 Cb 0.04 2.73 -0.01 0.00 -1.52 0.00 0.00 31.29 32.53 3g4p h VAL 132 CO 0.00 0.86 -0.35 1.88 0.02 0.00 0.00 177.57 179.99 3g4p h TYR 133 N 0.07 0.00 -0.05 1.57 -1.99 -1.42 -1.13 116.97 114.02 3g4p h TYR 133 Ca -0.07 0.00 -0.20 0.00 2.00 0.00 0.00 58.73 60.46 3g4p h TYR 133 Cb 1.73 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 40.46 3g4p h TYR 133 CO 0.03 0.23 -0.81 1.96 -0.00 0.00 0.00 178.16 179.58 3g4p h GLN 134 N 0.00 0.43 0.26 4.88 4.20 -0.81 -0.07 115.11 124.00 3g4p h GLN 134 Ca -0.01 -0.39 -0.01 0.00 0.06 0.00 0.00 58.65 58.30 3g4p h GLN 134 Cb 1.19 0.09 0.00 0.00 0.30 0.00 0.00 27.48 29.06 3g4p h GLN 134 CO 0.03 1.03 -0.13 1.49 -0.67 0.00 0.00 178.83 180.59 3g4p h GLU 135 N 0.27 -0.34 -0.53 1.46 4.57 -1.29 0.32 114.58 119.04 3g4p h GLU 135 Ca -0.05 0.02 0.10 0.00 -1.18 0.00 0.00 59.36 58.26 3g4p h GLU 135 Cb 1.41 0.08 -0.09 0.00 -0.16 0.00 0.00 28.75 29.99 3g4p h GLU 135 CO 0.14 -0.17 0.02 1.25 -1.18 0.00 0.00 179.01 179.07 3g4p h LEU 136 N -0.43 -0.20 -0.46 1.64 5.85 -1.13 -0.50 115.31 120.08 3g4p h LEU 136 Ca -0.04 0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.86 3g4p h LEU 136 Cb 0.33 0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.52 3g4p h LEU 136 CO 0.06 -0.07 0.20 0.00 -0.34 0.00 0.00 178.44 178.29 3g4p h ALA 137 N 1.47 0.58 -0.14 1.25 0.00 -0.71 -1.27 119.26 120.44 3g4p h ALA 137 Ca 0.27 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.16 3g4p h ALA 137 Cb 0.41 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3g4p h ALA 137 CO -0.43 -0.17 -0.17 0.00 0.00 0.00 0.00 179.25 178.48 3g4p h ARG 138 N 0.41 0.22 -0.46 0.00 3.08 -0.23 0.00 114.38 117.39 3g4p h ARG 138 Ca 0.21 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 60.11 3g4p h ARG 138 Cb 0.16 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 3g4p h ARG 138 CO -0.18 0.40 -0.06 0.00 -1.07 0.00 0.00 179.97 179.06 3g4p h ARG 139 N 0.21 0.86 -0.39 0.04 3.08 -0.29 -3.09 114.38 114.81 3g4p h ARG 139 Ca 0.04 -0.31 0.01 0.00 0.07 0.00 0.00 59.98 59.79 3g4p h ARG 139 Cb 0.44 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 3g4p h ARG 139 CO 0.03 0.94 0.24 1.15 -1.07 0.00 0.00 179.97 181.26 3g4p h THR 140 N 0.71 1.07 0.00 2.04 2.02 -0.79 -3.50 112.91 114.46 3g4p h THR 140 Ca 0.12 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.14 3g4p h THR 140 Cb 0.59 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 67.54 3g4p h THR 140 CO 0.04 0.09 0.00 0.61 0.37 0.00 0.00 175.52 176.63 3g4p n GLY 141 N -1.20 0.25 0.26 2.16 0.00 -0.06 -4.34 105.19 102.26 3g4p n GLY 141 Ca 0.01 -1.56 -0.02 0.00 0.00 0.00 0.00 46.02 44.44 3g4p n GLY 141 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3g4p h LEU 142 N 0.00 -0.70 -0.26 0.99 5.85 -1.88 -1.15 115.31 118.16 3g4p h LEU 142 Ca 0.00 0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 3g4p h LEU 142 Cb 0.00 0.42 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 3g4p h LEU 142 CO 0.00 -0.23 0.03 -0.08 -0.34 0.00 0.00 178.44 177.82 3g4p h GLU 143 N -0.05 0.43 -0.27 1.25 4.81 -1.99 0.49 114.58 119.24 3g4p h GLU 143 Ca 0.27 -0.12 -0.14 0.00 -0.13 0.00 0.00 59.36 59.24 3g4p h GLU 143 Cb 0.47 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 3g4p h GLU 143 CO -0.63 0.57 -0.42 1.25 -0.73 0.00 0.00 179.01 179.05 3g4p h LEU 144 N 0.23 0.70 -0.26 1.64 5.85 -1.73 -2.42 115.31 119.33 3g4p h LEU 144 Ca 0.08 -0.32 -0.01 0.00 0.84 0.00 0.00 57.88 58.47 3g4p h LEU 144 Cb 0.36 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 3g4p h LEU 144 CO 0.01 1.03 0.14 -0.03 -0.34 0.00 0.00 178.44 179.25 3g4p h MET 145 N 0.54 0.36 -0.84 1.25 4.05 -0.89 -0.42 114.93 118.98 3g4p h MET 145 Ca 0.04 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 3g4p h MET 145 Cb 0.95 -0.07 -0.04 0.00 -0.80 0.00 0.00 31.60 31.64 3g4p h MET 145 CO 0.09 0.33 0.49 0.37 0.23 0.00 0.00 176.91 178.42 3g4p h GLN 146 N 0.30 1.15 -0.75 0.39 5.75 -0.86 -0.99 115.11 120.11 3g4p h GLN 146 Ca 0.09 -0.11 -0.01 0.00 -0.15 0.00 0.00 58.65 58.47 3g4p h GLN 146 Cb 0.07 -0.24 -0.04 0.00 1.07 0.00 0.00 27.48 28.35 3g4p h GLN 146 CO -0.01 0.82 0.43 0.87 -2.65 0.00 0.00 178.83 178.29 3g4p h LYS 147 N 1.16 1.04 0.04 1.69 1.57 -1.31 -2.03 116.57 118.73 3g4p h LYS 147 Ca 0.30 -0.11 -0.26 0.00 -1.87 0.00 0.00 60.65 58.71 3g4p h LYS 147 Cb -0.02 -0.21 0.02 0.00 0.08 0.00 0.00 32.23 32.09 3g4p h LYS 147 CO -0.05 0.76 -1.07 0.93 -0.57 0.00 0.00 179.45 179.45 3g4p h GLU 148 N 1.04 0.55 -0.44 3.15 4.39 -0.75 -0.94 114.58 121.58 3g4p h GLU 148 Ca 0.27 -0.64 0.02 0.00 0.34 0.00 0.00 59.36 59.34 3g4p h GLU 148 Cb 0.00 0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 28.82 3g4p h GLU 148 CO -0.05 1.25 0.27 0.28 -1.16 0.00 0.00 179.01 179.60 3g4p h VAL 149 N 0.29 1.06 -0.17 3.13 2.07 -1.14 -1.90 116.25 119.59 3g4p h VAL 149 Ca -0.13 -0.18 0.05 0.00 0.82 0.00 0.00 66.70 67.26 3g4p h VAL 149 Cb 1.72 0.47 -0.06 0.00 -1.52 0.00 0.00 31.29 31.91 3g4p h VAL 149 CO 0.20 0.10 -0.21 0.11 0.02 0.00 0.00 177.57 177.78 3g4p h LYS 150 N 0.54 -0.24 -0.94 1.57 1.79 -1.41 -1.17 116.57 116.70 3g4p h LYS 150 Ca 0.17 0.02 0.10 0.00 -2.18 0.00 0.00 60.65 58.76 3g4p h LYS 150 Cb -0.00 0.06 -0.07 0.00 -1.58 0.00 0.00 32.23 30.63 3g4p h LYS 150 CO -0.07 -0.16 0.60 -0.09 -1.08 0.00 0.00 179.45 178.65 3g4p h ARG 151 N -0.25 0.92 0.00 3.15 2.43 -0.89 -0.66 114.38 119.08 3g4p h ARG 151 Ca 0.11 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3g4p h ARG 151 Cb 0.42 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 3g4p h ARG 151 CO -0.31 0.61 -0.33 0.28 -1.51 0.00 0.00 179.97 178.71 3g4p h VAL 152 N 0.95 0.00 -5.30 0.20 2.07 -1.30 -3.48 116.25 109.38 3g4p h VAL 152 Ca 0.44 -0.78 -0.32 0.00 0.82 0.00 0.00 66.70 66.85 3g4p h VAL 152 Cb 0.41 1.60 0.14 0.00 -1.52 0.00 0.00 31.29 31.92 3g4p h VAL 152 CO -0.20 0.00 -0.66 -3.20 0.02 0.00 0.00 177.57 173.53 3g4p n ASN 153 N -2.63 -3.67 -4.65 0.57 5.15 -0.25 -4.98 115.26 104.80 3g4p n ASN 153 Ca 0.03 -0.53 -0.42 0.00 -0.60 0.00 0.00 54.58 53.07 3g4p n ASN 153 Cb 0.49 -4.61 -0.04 0.00 -0.53 0.00 0.00 39.78 35.10 3g4p n ASN 153 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 3g4p s PHE 154 N -3.31 3.34 0.00 1.20 5.36 -1.10 -4.87 117.98 118.60 3g4p s PHE 154 Ca 0.22 1.23 0.00 0.00 -0.96 0.00 0.00 56.93 57.42 3g4p s PHE 154 Cb -0.10 -3.09 0.00 0.00 -0.34 0.00 0.00 43.02 39.49 3g4p s PHE 154 CO 0.65 -0.39 0.00 0.41 -1.46 0.00 0.00 175.22 174.43 3g4p n GLY 155 N 3.61 2.35 0.00 13.12 0.00 -1.26 -0.58 105.19 122.43 3g4p n GLY 155 Ca 0.07 -0.47 0.09 0.00 0.00 0.00 0.00 46.02 45.71 3g4p n GLY 155 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3g4p n ASN 156 N 0.48 0.00 0.00 1.61 0.23 0.22 -4.90 115.26 112.90 3g4p n ASN 156 Ca 0.00 -1.05 0.00 0.00 -0.53 0.00 0.00 54.58 53.00 3g4p n ASN 156 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 3g4p n ASN 156 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 3g4p n THR 157 N -0.85 0.00 -3.60 5.53 -2.24 0.26 -4.97 114.28 108.40 3g4p n THR 157 Ca 0.14 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.53 3g4p n THR 157 Cb 0.06 -0.81 -0.11 0.00 -2.10 0.00 0.00 70.33 67.37 3g4p n THR 157 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3g4p s ASN 158 N -1.88 5.82 0.00 3.42 2.47 -1.26 -4.42 114.94 119.09 3g4p s ASN 158 Ca 0.00 -0.34 0.15 0.00 0.42 0.00 0.00 52.86 53.09 3g4p s ASN 158 Cb 0.00 -2.07 -0.00 0.00 -1.45 0.00 0.00 41.25 37.72 3g4p s ASN 158 CO 0.00 -0.16 0.82 2.30 -3.72 0.00 0.00 177.10 176.34 3g4p n ILE 159 N 5.04 0.00 -4.34 -5.21 -5.35 -1.26 -2.08 119.36 106.15 3g4p n ILE 159 Ca -0.14 -0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.00 3g4p n ILE 159 Cb 0.50 1.18 0.00 0.00 -1.74 0.00 0.00 39.64 39.58 3g4p n ILE 159 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3g4p n GLY 160 N 1.10 0.34 0.05 3.28 0.00 -1.26 -4.23 105.19 104.47 3g4p n GLY 160 Ca 0.06 -0.90 0.05 0.00 0.00 0.00 0.00 46.02 45.24 3g4p n GLY 160 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3g4p n THR 161 N 0.00 0.00 -3.62 2.61 -2.24 -1.26 -4.92 114.28 104.85 3g4p n THR 161 Ca 0.00 -0.26 -0.40 0.00 -2.27 0.00 0.00 64.05 61.12 3g4p n THR 161 Cb 0.00 1.02 -0.10 0.00 -2.10 0.00 0.00 70.33 69.16 3g4p n THR 161 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3g4p s GLN 162 N -1.95 2.45 0.44 -0.78 -1.52 -1.26 -4.98 119.66 112.05 3g4p s GLN 162 Ca 0.05 -1.64 0.30 0.00 -1.95 0.00 0.00 55.36 52.12 3g4p s GLN 162 Cb 0.09 -3.79 1.52 0.00 -0.22 0.00 0.00 33.01 30.60 3g4p s GLN 162 CO 0.43 -1.06 1.92 -0.24 -0.25 0.00 0.00 175.29 176.08 3g4p h VAL 163 N 6.16 0.00 -0.07 1.09 3.04 -1.91 -3.16 116.25 121.41 3g4p h VAL 163 Ca -0.20 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 65.37 3g4p h VAL 163 Cb 1.07 0.86 0.00 0.00 -2.01 0.00 0.00 31.29 31.21 3g4p h VAL 163 CO 0.78 0.00 0.00 -0.90 -1.01 0.00 0.00 177.57 176.44 3g4p n ASP 164 N -2.60 2.15 0.00 3.17 5.75 -1.26 -4.63 116.55 119.12 3g4p n ASP 164 Ca -0.01 -1.57 0.00 0.00 -0.01 0.00 0.00 54.79 53.20 3g4p n ASP 164 Cb 0.12 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.17 3g4p n ASP 164 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 3g4p n ASN 165 N 0.67 0.00 0.29 -1.12 6.94 -1.20 -4.88 115.26 115.96 3g4p n ASN 165 Ca 0.08 -1.00 0.16 0.00 -0.02 0.00 0.00 54.58 53.80 3g4p n ASN 165 Cb 0.32 0.00 0.89 0.00 -2.36 0.00 0.00 39.78 38.64 3g4p n ASN 165 CO 0.00 0.00 0.00 2.19 -1.03 0.00 0.00 177.26 178.42 3g4p h PHE 166 N 0.00 0.00 -0.00 -2.53 -0.00 -1.75 -1.16 116.94 111.49 3g4p h PHE 166 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 3g4p h PHE 166 Cb 0.97 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.92 3g4p h PHE 166 CO 0.00 0.05 -0.46 -2.67 -0.00 0.00 0.00 178.31 175.23 3g4p n TRP 167 N -3.56 0.00 -0.10 6.09 2.14 -1.26 -2.78 117.44 117.96 3g4p n TRP 167 Ca -0.02 0.00 -0.17 0.00 2.07 0.00 0.00 57.50 59.37 3g4p n TRP 167 Cb 0.15 -0.15 -0.13 0.00 -0.81 0.00 0.00 31.31 30.38 3g4p n TRP 167 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 3g4p n LEU 168 N -1.02 2.58 0.00 5.67 4.77 -0.49 -1.13 117.00 127.39 3g4p n LEU 168 Ca 0.08 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 3g4p n LEU 168 Cb 0.35 -0.78 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 3g4p n LEU 168 CO 0.32 0.87 0.38 1.33 -1.33 0.00 0.00 177.39 178.96 3g4p n VAL 169 N -3.24 0.57 0.00 4.08 0.24 -0.92 -4.57 118.33 114.50 3g4p n VAL 169 Ca -0.42 -0.61 0.00 0.00 -2.04 0.00 0.00 64.34 61.27 3g4p n VAL 169 Cb 1.02 0.75 0.00 0.00 -1.47 0.00 0.00 33.84 34.14 3g4p n VAL 169 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3g4p n GLY 170 N -0.29 1.10 0.59 7.63 0.00 -1.12 -4.93 105.19 108.17 3g4p n GLY 170 Ca 0.00 -1.84 0.10 0.00 0.00 0.00 0.00 46.02 44.28 3g4p n GLY 170 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3g4p n PRO 171 N 1.18 1.77 -2.16 1.61 -0.04 -1.24 -4.34 135.00 131.78 3g4p n PRO 171 Ca 0.00 -1.16 -0.41 0.00 -0.04 0.00 0.00 63.50 61.88 3g4p n PRO 171 Cb 0.00 -1.39 -0.03 0.00 -0.04 0.00 0.00 33.50 32.04 3g4p n PRO 171 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3g4p s LEU 172 N -1.54 4.41 0.05 1.53 2.96 -0.89 -4.78 118.68 120.43 3g4p s LEU 172 Ca 0.32 2.48 -0.09 0.00 -0.22 0.00 0.00 54.13 56.61 3g4p s LEU 172 Cb 0.17 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 43.25 3g4p s LEU 172 CO 0.26 -0.58 0.19 -0.54 -1.32 0.00 0.00 176.35 174.36 3g4p s LYS 173 N -0.14 0.72 -0.12 1.98 1.02 -1.26 -4.36 119.74 117.58 3g4p s LYS 173 Ca 0.58 -0.70 -0.20 0.00 0.02 0.00 0.00 55.97 55.66 3g4p s LYS 173 Cb -0.38 0.30 0.05 0.00 -0.52 0.00 0.00 37.83 37.28 3g4p s LYS 173 CO 0.39 -0.21 0.51 -1.50 -0.92 0.00 0.00 175.35 173.62 3g4p s ILE 174 N -2.84 0.01 0.38 2.17 2.07 -0.20 -0.61 121.20 122.18 3g4p s ILE 174 Ca -0.03 -0.11 -0.01 0.00 -1.41 0.00 0.00 60.65 59.09 3g4p s ILE 174 Cb 0.00 -0.76 -0.04 0.00 0.13 0.00 0.00 42.46 41.80 3g4p s ILE 174 CO -0.05 -0.06 0.61 0.42 -1.91 0.00 0.00 174.94 173.95 3g4p s THR 175 N -0.40 5.05 0.36 4.00 -4.23 -1.26 -0.96 115.64 118.21 3g4p s THR 175 Ca -0.05 -0.25 0.08 0.00 -1.18 0.00 0.00 61.69 60.29 3g4p s THR 175 Cb -0.03 -3.85 0.32 0.00 1.34 0.00 0.00 72.50 70.27 3g4p s THR 175 CO 0.03 -0.62 1.90 -0.65 -0.54 0.00 0.00 174.62 174.75 3g4p h PRO 176 N 0.68 0.67 -0.18 3.99 0.11 -1.68 -2.25 132.00 133.34 3g4p h PRO 176 Ca -0.49 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 65.61 3g4p h PRO 176 Cb 1.21 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 3g4p h PRO 176 CO 0.62 0.45 0.03 0.28 -0.21 0.00 0.00 178.00 179.16 3g4p h VAL 177 N 0.70 0.91 -0.60 3.15 2.07 -1.79 -2.11 116.25 118.57 3g4p h VAL 177 Ca 0.40 -0.04 -0.06 0.00 0.82 0.00 0.00 66.70 67.82 3g4p h VAL 177 Cb 0.57 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 3g4p h VAL 177 CO -0.16 0.02 0.13 1.56 0.02 0.00 0.00 177.57 179.13 3g4p h GLN 178 N 0.10 0.95 0.13 1.57 4.20 -1.81 -1.22 115.11 119.04 3g4p h GLN 178 Ca 0.08 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 3g4p h GLN 178 Cb 0.08 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.73 3g4p h GLN 178 CO -0.12 0.86 -0.06 0.93 -0.67 0.00 0.00 178.83 179.77 3g4p h GLU 179 N 0.91 -0.17 -0.41 1.46 4.39 -1.32 0.22 114.58 119.65 3g4p h GLU 179 Ca 0.19 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.90 3g4p h GLU 179 Cb 0.35 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.02 3g4p h GLU 179 CO 0.00 -0.01 0.26 -0.24 -1.16 0.00 0.00 179.01 177.86 3g4p h VAL 180 N -0.30 1.11 -0.30 3.13 3.04 -1.27 -0.47 116.25 121.19 3g4p h VAL 180 Ca -0.02 -0.22 -0.14 0.00 -1.01 0.00 0.00 66.70 65.32 3g4p h VAL 180 Cb 0.24 0.52 -0.01 0.00 -2.01 0.00 0.00 31.29 30.02 3g4p h VAL 180 CO 0.03 0.11 -0.36 0.78 -1.01 0.00 0.00 177.57 177.12 3g4p h ASN 181 N 0.56 0.73 -0.29 3.17 2.35 -0.93 -1.23 115.58 119.94 3g4p h ASN 181 Ca 0.15 -0.31 -0.00 0.00 -0.55 0.00 0.00 56.30 55.58 3g4p h ASN 181 Cb -0.05 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.10 3g4p h ASN 181 CO -0.03 1.02 0.17 0.15 -1.65 0.00 0.00 177.43 177.09 3g4p h PHE 182 N 0.58 0.38 -0.17 1.19 3.04 -0.19 -1.05 116.94 120.71 3g4p h PHE 182 Ca 0.06 -0.00 -0.05 0.00 3.98 0.00 0.00 57.97 61.95 3g4p h PHE 182 Cb 0.89 -0.12 -0.01 0.00 2.56 0.00 0.00 35.95 39.26 3g4p h PHE 182 CO 0.04 0.29 -0.14 0.00 -2.02 0.00 0.00 178.31 176.48 3g4p h ALA 183 N 1.06 1.46 -0.24 2.41 0.00 -0.90 -1.58 119.26 121.47 3g4p h ALA 183 Ca 0.10 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 3g4p h ALA 183 Cb 0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3g4p h ALA 183 CO -0.02 0.38 -0.14 0.22 0.00 0.00 0.00 179.25 179.69 3g4p h ASP 184 N 0.25 0.54 -0.43 0.00 3.58 -0.80 -0.27 116.42 119.30 3g4p h ASP 184 Ca 0.05 -0.42 -0.02 0.00 0.42 0.00 0.00 57.03 57.06 3g4p h ASP 184 Cb 0.40 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.28 3g4p h ASP 184 CO 0.02 0.85 0.18 0.44 -2.88 0.00 0.00 179.24 177.85 3g4p h ASP 185 N 0.24 0.58 0.35 2.28 3.32 -0.92 -2.40 116.42 119.86 3g4p h ASP 185 Ca 0.05 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 3g4p h ASP 185 Cb 0.65 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.05 3g4p h ASP 185 CO 0.04 0.58 -0.17 0.25 -1.72 0.00 0.00 179.24 178.22 3g4p h LEU 186 N 0.54 -0.39 -1.00 1.55 5.85 -1.26 0.50 115.31 121.10 3g4p h LEU 186 Ca 0.14 -0.05 0.25 0.00 0.84 0.00 0.00 57.88 59.06 3g4p h LEU 186 Cb 0.18 0.10 -0.12 0.00 0.37 0.00 0.00 40.66 41.18 3g4p h LEU 186 CO -0.01 -0.20 0.59 0.00 -0.34 0.00 0.00 178.44 178.48 3g4p h ALA 187 N 0.07 1.79 -0.53 1.25 0.00 -1.04 -1.09 119.26 119.71 3g4p h ALA 187 Ca -0.05 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3g4p h ALA 187 Cb 0.42 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3g4p h ALA 187 CO 0.08 -0.27 0.00 0.72 0.00 0.00 0.00 179.25 179.78 3g4p n HIS 188 N -4.89 0.70 -2.75 0.00 8.25 -0.91 -4.96 115.22 110.67 3g4p n HIS 188 Ca 0.27 -0.40 -0.14 0.00 -0.26 0.00 0.00 57.72 57.19 3g4p n HIS 188 Cb 0.75 -0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.88 3g4p n HIS 188 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3g4p n ASN 189 N 1.38 -4.42 -0.48 0.41 3.02 -0.21 -4.91 115.26 110.05 3g4p n ASN 189 Ca 0.20 -0.19 0.10 0.00 -0.03 0.00 0.00 54.58 54.66 3g4p n ASN 189 Cb 0.57 -3.28 0.00 0.00 -0.61 0.00 0.00 39.78 36.47 3g4p n ASN 189 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3g4p n ARG 190 N -2.81 1.45 -1.32 3.52 1.74 0.16 -4.96 116.66 114.43 3g4p n ARG 190 Ca -0.07 -0.99 -0.32 0.00 -0.77 0.00 0.00 57.85 55.70 3g4p n ARG 190 Cb 0.57 -1.40 0.10 0.00 -1.02 0.00 0.00 32.46 30.71 3g4p n ARG 190 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3g4p s LEU 191 N -2.26 3.17 -1.54 0.55 1.43 -1.23 -4.91 118.68 113.89 3g4p s LEU 191 Ca 0.17 2.11 -0.10 0.00 -1.03 0.00 0.00 54.13 55.28 3g4p s LEU 191 Cb 0.16 -4.56 -0.03 0.00 0.03 0.00 0.00 46.19 41.79 3g4p s LEU 191 CO 0.49 -2.22 2.74 -0.81 0.23 0.00 0.00 176.35 176.77 3g4p n PRO 192 N -3.14 3.74 -4.13 1.29 -0.04 -1.26 -4.84 135.00 126.61 3g4p n PRO 192 Ca 0.11 -2.51 -0.09 0.00 -0.04 0.00 0.00 63.50 60.98 3g4p n PRO 192 Cb 0.52 -2.84 -0.10 0.00 -0.04 0.00 0.00 33.50 31.03 3g4p n PRO 192 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3g4p s PHE 193 N 1.71 0.72 0.61 0.54 0.40 -1.26 -5.05 117.98 115.65 3g4p s PHE 193 Ca 0.63 -0.97 -0.18 0.00 -0.60 0.00 0.00 56.93 55.82 3g4p s PHE 193 Cb 0.17 -0.46 -0.05 0.00 0.51 0.00 0.00 43.02 43.19 3g4p s PHE 193 CO -0.07 -0.25 0.82 1.63 0.70 0.00 0.00 175.22 178.05 3g4p n LYS 194 N 0.08 0.71 -0.36 0.44 5.02 -1.26 -4.80 118.16 117.98 3g4p n LYS 194 Ca -0.13 0.28 -0.00 0.00 -2.02 0.00 0.00 58.31 56.43 3g4p n LYS 194 Cb 0.61 -2.02 0.13 0.00 -0.02 0.00 0.00 35.03 33.72 3g4p n LYS 194 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3g4p h LEU 195 N 0.28 1.08 -0.45 -0.35 4.07 -1.94 -2.23 115.31 115.77 3g4p h LEU 195 Ca -0.48 -0.01 -0.06 0.00 0.08 0.00 0.00 57.88 57.41 3g4p h LEU 195 Cb 1.37 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 42.85 3g4p h LEU 195 CO 0.49 0.74 0.04 -0.08 -1.08 0.00 0.00 178.44 178.56 3g4p h GLU 196 N 1.25 0.76 -0.69 1.13 4.57 -1.99 -0.41 114.58 119.21 3g4p h GLU 196 Ca 0.39 -0.22 0.13 0.00 -1.18 0.00 0.00 59.36 58.48 3g4p h GLU 196 Cb -0.02 -0.08 -0.09 0.00 -0.16 0.00 0.00 28.75 28.40 3g4p h GLU 196 CO -0.12 0.80 0.22 1.15 -1.18 0.00 0.00 179.01 179.88 3g4p h THR 197 N 0.62 0.64 -0.39 0.32 2.02 -1.75 -2.01 112.91 112.36 3g4p h THR 197 Ca 0.13 -0.12 -0.15 0.00 0.77 0.00 0.00 66.41 67.04 3g4p h THR 197 Cb 0.43 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.09 3g4p h THR 197 CO 0.01 0.06 -0.36 1.56 0.37 0.00 0.00 175.52 177.17 3g4p h GLN 198 N 0.35 0.92 -0.40 6.66 4.20 -1.15 -1.98 115.11 123.71 3g4p h GLN 198 Ca 0.37 -0.48 -0.05 0.00 0.06 0.00 0.00 58.65 58.55 3g4p h GLN 198 Cb 0.56 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.33 3g4p h GLN 198 CO -0.41 1.13 0.04 0.93 -0.67 0.00 0.00 178.83 179.85 3g4p h GLU 199 N 0.74 0.63 0.02 1.46 4.39 -0.84 -0.49 114.58 120.49 3g4p h GLU 199 Ca 0.06 -0.13 -0.00 0.00 0.34 0.00 0.00 59.36 59.63 3g4p h GLU 199 Cb 0.95 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 3g4p h GLU 199 CO 0.09 0.62 -0.01 0.93 -1.16 0.00 0.00 179.01 179.48 3g4p h GLU 200 N 0.60 -0.03 -0.69 2.33 4.39 -1.09 -1.55 114.58 118.54 3g4p h GLU 200 Ca 0.13 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.86 3g4p h GLU 200 Cb 0.33 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.94 3g4p h GLU 200 CO 0.01 0.27 0.43 0.28 -1.16 0.00 0.00 179.01 178.84 3g4p h VAL 201 N -0.34 1.09 -0.41 3.13 2.07 -1.25 -2.75 116.25 117.81 3g4p h VAL 201 Ca -0.00 -0.29 0.01 0.00 0.82 0.00 0.00 66.70 67.23 3g4p h VAL 201 Cb 0.32 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 3g4p h VAL 201 CO 0.01 0.15 0.27 0.11 0.02 0.00 0.00 177.57 178.13 3g4p h LYS 202 N 0.85 0.53 0.00 1.57 1.57 -1.02 -0.53 116.57 119.53 3g4p h LYS 202 Ca 0.28 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.98 3g4p h LYS 202 Cb 0.02 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 3g4p h LYS 202 CO -0.11 0.35 -0.21 0.87 -0.57 0.00 0.00 179.45 179.78 3g4p h LYS 203 N 0.54 0.00 0.00 3.15 1.57 -1.00 -1.98 116.57 118.85 3g4p h LYS 203 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3g4p h LYS 203 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 3g4p h LYS 203 CO -0.03 0.21 0.00 -1.33 -0.57 0.00 0.00 179.45 177.73 3g4p n MET 204 N -4.08 0.15 -0.09 3.15 2.81 -0.21 -3.78 117.12 115.05 3g4p n MET 204 Ca -0.02 0.50 0.05 0.00 -1.81 0.00 0.00 57.70 56.42 3g4p n MET 204 Cb 0.28 -1.85 0.10 0.00 -0.71 0.00 0.00 33.22 31.04 3g4p n MET 204 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3g4p n LEU 205 N -2.14 2.42 -4.60 4.03 4.77 -0.74 -4.57 117.00 116.16 3g4p n LEU 205 Ca 0.01 -1.55 -0.43 0.00 -0.03 0.00 0.00 56.01 54.01 3g4p n LEU 205 Cb 0.14 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 3g4p n LEU 205 CO 0.14 0.56 1.45 -0.22 -1.33 0.00 0.00 177.39 177.99 3g4p s LEU 206 N -0.94 3.57 0.00 2.23 2.96 -1.25 -1.66 118.68 123.60 3g4p s LEU 206 Ca 0.17 1.26 0.11 0.00 -0.22 0.00 0.00 54.13 55.45 3g4p s LEU 206 Cb 0.10 -3.53 -0.07 0.00 0.50 0.00 0.00 46.19 43.19 3g4p s LEU 206 CO 0.14 -1.59 0.53 2.30 -1.32 0.00 0.00 176.35 176.41 3g4p n ILE 207 N 7.22 0.00 -3.63 6.68 -5.35 -0.15 -4.97 119.36 119.16 3g4p n ILE 207 Ca 0.21 -0.31 -0.08 0.00 -0.27 0.00 0.00 62.75 62.30 3g4p n ILE 207 Cb 0.47 1.05 -0.07 0.00 -1.74 0.00 0.00 39.64 39.35 3g4p n ILE 207 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 3g4p s LYS 208 N -1.75 0.43 -0.04 6.28 2.20 -1.08 -5.00 119.74 120.77 3g4p s LYS 208 Ca 0.06 0.41 0.06 0.00 -0.36 0.00 0.00 55.97 56.15 3g4p s LYS 208 Cb 0.08 0.21 -0.02 0.00 -1.51 0.00 0.00 37.83 36.59 3g4p s LYS 208 CO 0.36 -0.07 -0.24 -1.21 -0.36 0.00 0.00 175.35 173.83 3g4p s GLU 209 N -0.08 2.40 -0.29 4.03 2.02 -1.26 -0.36 118.70 125.16 3g4p s GLU 209 Ca 0.03 -0.89 0.02 0.00 0.02 0.00 0.00 54.97 54.15 3g4p s GLU 209 Cb -0.04 -2.15 0.16 0.00 0.10 0.00 0.00 34.13 32.20 3g4p s GLU 209 CO -0.07 0.47 0.40 0.54 0.02 0.00 0.00 175.26 176.62 3g4p s VAL 210 N -0.37 -0.61 -0.75 2.63 0.11 -0.20 -4.98 120.40 116.23 3g4p s VAL 210 Ca 0.03 -0.33 -0.02 0.00 -2.93 0.00 0.00 61.98 58.72 3g4p s VAL 210 Cb -0.12 -0.97 -0.03 0.00 -1.53 0.00 0.00 36.38 33.73 3g4p s VAL 210 CO 0.02 -0.31 0.65 0.59 -3.33 0.00 0.00 175.10 172.72 3g4p n ASN 211 N 5.31 -3.90 0.00 3.54 5.03 -1.26 -2.90 115.26 121.07 3g4p n ASN 211 Ca 0.01 -0.46 0.00 0.00 0.87 0.00 0.00 54.58 55.00 3g4p n ASN 211 Cb 0.49 -3.68 0.00 0.00 -1.02 0.00 0.00 39.78 35.57 3g4p n ASN 211 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3g4p n GLY 212 N -1.22 2.46 3.78 7.41 0.00 -1.26 -4.91 105.19 111.45 3g4p n GLY 212 Ca -0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 3g4p n GLY 212 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3g4p s SER 213 N -1.77 7.25 -0.12 1.61 0.01 -1.14 -3.63 113.70 115.91 3g4p s SER 213 Ca 0.00 1.48 -0.00 0.00 1.31 0.00 0.00 55.95 58.74 3g4p s SER 213 Cb 0.00 -2.45 -0.02 0.00 0.21 0.00 0.00 66.02 63.76 3g4p s SER 213 CO 0.00 0.20 -0.11 -0.54 0.41 0.00 0.00 173.24 173.19 3g4p s LYS 214 N -0.94 3.30 -0.27 12.44 1.02 -0.05 -1.03 119.74 134.21 3g4p s LYS 214 Ca 0.34 -0.65 -0.08 0.00 0.02 0.00 0.00 55.97 55.60 3g4p s LYS 214 Cb -0.21 -2.65 -0.02 0.00 -0.52 0.00 0.00 37.83 34.43 3g4p s LYS 214 CO 0.23 0.29 0.10 0.42 -0.92 0.00 0.00 175.35 175.47 3g4p s ILE 215 N 0.16 4.38 -0.20 2.17 1.01 0.52 0.03 121.20 129.26 3g4p s ILE 215 Ca -0.06 -0.29 -0.05 0.00 0.00 0.00 0.00 60.65 60.25 3g4p s ILE 215 Cb -0.15 -3.12 -0.02 0.00 0.01 0.00 0.00 42.46 39.18 3g4p s ILE 215 CO 0.04 0.23 -0.01 -0.31 0.00 0.00 0.00 174.94 174.90 3g4p s TYR 216 N 1.60 3.02 0.20 3.97 1.51 -0.53 -0.98 117.35 126.15 3g4p s TYR 216 Ca 0.05 -0.54 -0.21 0.00 -1.01 0.00 0.00 57.07 55.37 3g4p s TYR 216 Cb -0.16 -2.09 0.04 0.00 -0.11 0.00 0.00 41.96 39.65 3g4p s TYR 216 CO 0.04 -0.29 0.60 0.00 -1.11 0.00 0.00 175.55 174.79 3g4p s ALA 217 N 1.08 -1.28 -0.05 3.71 0.00 -0.66 0.06 121.76 124.62 3g4p s ALA 217 Ca 0.02 0.06 0.05 0.00 0.00 0.00 0.00 51.96 52.09 3g4p s ALA 217 Cb -0.14 0.86 -0.01 0.00 0.00 0.00 0.00 23.12 23.83 3g4p s ALA 217 CO 0.01 -0.84 -0.20 0.21 0.00 0.00 0.00 175.76 174.94 3g4p s LYS 218 N -3.83 2.03 0.80 0.00 2.47 0.42 -4.78 119.74 116.84 3g4p s LYS 218 Ca 0.06 -0.71 -0.09 0.00 -1.56 0.00 0.00 55.97 53.67 3g4p s LYS 218 Cb -0.02 -1.75 0.12 0.00 -1.46 0.00 0.00 37.83 34.72 3g4p s LYS 218 CO -0.05 0.30 1.12 -1.54 0.16 0.00 0.00 175.35 175.34 3g4p s SER 219 N -0.05 4.13 -0.28 1.43 1.04 -1.26 -1.80 113.70 116.91 3g4p s SER 219 Ca -0.03 0.24 -0.20 0.00 0.48 0.00 0.00 55.95 56.44 3g4p s SER 219 Cb -0.12 -0.62 0.09 0.00 0.10 0.00 0.00 66.02 65.47 3g4p s SER 219 CO 0.03 -2.05 0.77 -0.83 0.98 0.00 0.00 173.24 172.14 3g4p s GLY 220 N -4.69 -0.47 -0.23 7.32 0.00 -0.71 -3.40 107.32 105.13 3g4p s GLY 220 Ca 0.66 2.42 -0.04 0.00 0.00 0.00 0.00 44.72 47.76 3g4p s GLY 220 CO 0.48 2.15 0.14 0.86 0.00 0.00 0.00 173.10 176.73 3g4p s TRP 221 N 1.03 0.13 -0.56 1.90 -0.11 -1.26 -0.78 118.94 119.29 3g4p s TRP 221 Ca -0.05 -0.47 -0.23 0.00 1.22 0.00 0.00 56.10 56.57 3g4p s TRP 221 Cb -0.05 -0.72 0.05 0.00 -1.50 0.00 0.00 33.47 31.25 3g4p s TRP 221 CO -0.11 -0.69 0.90 0.20 -4.62 0.00 0.00 176.95 172.62 3g4p s GLY 222 N 2.17 1.46 0.02 5.86 0.00 0.04 -4.75 107.32 112.11 3g4p s GLY 222 Ca 0.06 -1.39 0.24 0.00 0.00 0.00 0.00 44.72 43.63 3g4p s GLY 222 CO -0.23 1.96 1.30 1.03 0.00 0.00 0.00 173.10 177.16 3g4p n MET 223 N 7.30 0.07 -1.25 2.90 0.00 -1.26 -2.84 117.12 122.03 3g4p n MET 223 Ca -0.00 0.01 -0.19 0.00 0.00 0.00 0.00 57.70 57.51 3g4p n MET 223 Cb 0.47 -1.53 0.13 0.00 0.00 0.00 0.00 33.22 32.29 3g4p n MET 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3g4p n GLY 224 N 1.47 5.37 3.00 3.03 0.00 -1.26 -4.87 105.19 111.93 3g4p n GLY 224 Ca 0.05 -1.75 -0.09 0.00 0.00 0.00 0.00 46.02 44.22 3g4p n GLY 224 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g4p s VAL 225 N -3.91 0.11 -0.09 1.61 0.11 -1.26 -4.79 120.40 112.18 3g4p s VAL 225 Ca 0.53 -0.91 0.01 0.00 -2.93 0.00 0.00 61.98 58.68 3g4p s VAL 225 Cb 0.45 -0.32 0.02 0.00 -1.53 0.00 0.00 36.38 34.99 3g4p s VAL 225 CO 0.02 -0.50 -0.12 -0.89 -3.33 0.00 0.00 175.10 170.28 3g4p s THR 226 N -1.53 1.17 0.81 5.04 2.01 -1.26 -3.24 115.64 118.63 3g4p s THR 226 Ca -0.15 -0.46 -0.11 0.00 0.31 0.00 0.00 61.69 61.28 3g4p s THR 226 Cb -0.09 -1.10 0.08 0.00 0.01 0.00 0.00 72.50 71.39 3g4p s THR 226 CO -0.01 0.37 1.09 -2.16 -0.69 0.00 0.00 174.62 173.22 3g4p s PRO 227 N 1.00 2.00 0.55 4.92 0.04 -1.26 -5.12 135.00 137.12 3g4p s PRO 227 Ca -0.08 1.00 -0.17 0.00 0.04 0.00 0.00 61.00 61.79 3g4p s PRO 227 Cb -0.15 -1.88 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 3g4p s PRO 227 CO -0.00 -1.77 1.03 -0.65 0.04 0.00 0.00 177.00 175.64 3g4p s GLN 228 N -4.95 3.61 -0.04 4.56 -0.21 -1.20 -4.97 119.66 116.46 3g4p s GLN 228 Ca 0.61 1.16 0.06 0.00 0.02 0.00 0.00 55.36 57.21 3g4p s GLN 228 Cb -0.17 -2.08 -0.01 0.00 1.00 0.00 0.00 33.01 31.75 3g4p s GLN 228 CO 0.56 -0.57 -0.21 0.54 -2.12 0.00 0.00 175.29 173.50 3g4p s VAL 229 N -2.41 1.72 0.08 1.09 0.11 -1.13 -1.79 120.40 118.07 3g4p s VAL 229 Ca 0.63 -0.89 0.08 0.00 -2.93 0.00 0.00 61.98 58.86 3g4p s VAL 229 Cb -0.14 -1.45 -0.04 0.00 -1.53 0.00 0.00 36.38 33.22 3g4p s VAL 229 CO 0.32 0.49 -0.17 -0.83 -3.33 0.00 0.00 175.10 171.57 3g4p s GLY 230 N -0.18 1.65 0.01 6.54 0.00 0.38 -0.78 107.32 114.94 3g4p s GLY 230 Ca -0.00 -1.27 -0.06 0.00 0.00 0.00 0.00 44.72 43.39 3g4p s GLY 230 CO 0.02 -1.21 0.11 -0.98 0.00 0.00 0.00 173.10 171.04 3g4p s TRP 231 N -1.05 0.08 -0.26 1.90 0.52 0.04 -1.25 118.94 118.91 3g4p s TRP 231 Ca 0.17 -0.20 -0.03 0.00 0.02 0.00 0.00 56.10 56.05 3g4p s TRP 231 Cb -0.11 -0.07 0.10 0.00 -1.15 0.00 0.00 33.47 32.25 3g4p s TRP 231 CO 0.08 -0.28 0.18 -1.17 0.02 0.00 0.00 176.95 175.79 3g4p s LEU 232 N -1.42 0.22 -0.04 2.99 2.96 -0.88 -1.74 118.68 120.77 3g4p s LEU 232 Ca -0.15 -0.91 0.04 0.00 -0.22 0.00 0.00 54.13 52.90 3g4p s LEU 232 Cb -0.08 -0.01 -0.03 0.00 0.50 0.00 0.00 46.19 46.58 3g4p s LEU 232 CO 0.01 -0.40 -0.15 -0.89 -1.32 0.00 0.00 176.35 173.60 3g4p s THR 233 N 2.21 3.01 -1.17 3.68 2.01 -0.75 -0.99 115.64 123.64 3g4p s THR 233 Ca 0.08 -0.80 0.00 0.00 0.31 0.00 0.00 61.69 61.28 3g4p s THR 233 Cb -0.15 -2.19 0.00 0.00 0.01 0.00 0.00 72.50 70.17 3g4p s THR 233 CO -0.29 0.55 0.00 0.61 -0.69 0.00 0.00 174.62 174.81 3g4p n GLY 234 N 2.19 -0.75 3.50 4.40 0.00 -0.36 -0.44 105.19 113.74 3g4p n GLY 234 Ca -0.17 -0.37 -0.12 0.00 0.00 0.00 0.00 46.02 45.36 3g4p n GLY 234 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3g4p s TRP 235 N -4.00 -0.49 -0.13 1.61 -2.14 0.11 -1.40 118.94 112.50 3g4p s TRP 235 Ca 0.00 0.59 -0.11 0.00 2.66 0.00 0.00 56.10 59.24 3g4p s TRP 235 Cb 0.00 0.49 -0.05 0.00 -3.10 0.00 0.00 33.47 30.81 3g4p s TRP 235 CO 0.00 -0.59 0.24 0.08 -2.66 0.00 0.00 176.95 174.02 3g4p s VAL 236 N -2.28 5.33 -0.36 -0.66 1.01 -0.18 -1.45 120.40 121.81 3g4p s VAL 236 Ca -0.02 0.44 -0.12 0.00 0.00 0.00 0.00 61.98 62.29 3g4p s VAL 236 Cb -0.01 -3.55 0.01 0.00 0.00 0.00 0.00 36.38 32.83 3g4p s VAL 236 CO -0.02 0.49 0.22 -0.70 0.00 0.00 0.00 175.10 175.09 3g4p s GLU 237 N -0.20 3.09 0.65 2.72 2.12 0.10 -0.99 118.70 126.18 3g4p s GLU 237 Ca 0.16 -0.91 -0.11 0.00 0.36 0.00 0.00 54.97 54.47 3g4p s GLU 237 Cb -0.13 -3.75 -0.02 0.00 0.26 0.00 0.00 34.13 30.49 3g4p s GLU 237 CO 0.04 -0.60 1.04 -0.65 -0.54 0.00 0.00 175.26 174.56 3g4p s GLN 238 N 1.62 3.27 0.33 4.30 -0.21 -0.18 -0.87 119.66 127.92 3g4p s GLN 238 Ca 0.04 0.57 0.01 0.00 0.02 0.00 0.00 55.36 56.00 3g4p s GLN 238 Cb -0.18 -2.08 0.58 0.00 1.00 0.00 0.00 33.01 32.33 3g4p s GLN 238 CO 0.08 -0.75 2.00 0.00 -2.12 0.00 0.00 175.29 174.50 3g4p h ALA 239 N -0.42 1.51 0.00 6.09 0.00 -1.89 0.96 119.26 125.50 3g4p h ALA 239 Ca -0.45 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3g4p h ALA 239 Cb 1.22 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3g4p h ALA 239 CO 0.63 0.46 0.00 0.27 0.00 0.00 0.00 179.25 180.60 3g4p n ASN 240 N -4.43 0.00 0.00 0.00 0.23 -1.26 -4.88 115.26 104.92 3g4p n ASN 240 Ca 0.07 -0.51 0.00 0.00 -0.53 0.00 0.00 54.58 53.61 3g4p n ASN 240 Cb 0.04 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.74 3g4p n ASN 240 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3g4p n GLY 241 N -0.26 2.30 3.77 4.83 0.00 0.33 -5.03 105.19 111.13 3g4p n GLY 241 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 3g4p n GLY 241 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3g4p s LYS 242 N -0.03 4.38 -0.16 1.61 2.20 -1.26 -4.78 119.74 121.71 3g4p s LYS 242 Ca 0.00 2.18 -0.02 0.00 -0.36 0.00 0.00 55.97 57.77 3g4p s LYS 242 Cb 0.00 -3.08 -0.02 0.00 -1.51 0.00 0.00 37.83 33.22 3g4p s LYS 242 CO 0.00 -0.16 -0.08 0.15 -0.36 0.00 0.00 175.35 174.90 3g4p s LYS 243 N -1.68 3.49 -0.44 4.03 1.02 -1.26 -1.01 119.74 123.88 3g4p s LYS 243 Ca 0.49 -0.61 0.00 0.00 0.02 0.00 0.00 55.97 55.87 3g4p s LYS 243 Cb -0.39 -2.82 0.12 0.00 -0.52 0.00 0.00 37.83 34.22 3g4p s LYS 243 CO 0.51 0.13 0.21 0.42 -0.92 0.00 0.00 175.35 175.70 3g4p s ILE 244 N 0.61 2.95 0.62 2.17 -1.09 -0.16 -4.75 121.20 121.54 3g4p s ILE 244 Ca -0.05 -2.49 -0.18 0.00 -2.23 0.00 0.00 60.65 55.71 3g4p s ILE 244 Cb -0.15 -3.04 -0.02 0.00 -1.58 0.00 0.00 42.46 37.67 3g4p s ILE 244 CO 0.03 -0.71 1.19 -2.84 -1.23 0.00 0.00 174.94 171.37 3g4p s PRO 245 N 0.65 2.83 -0.04 2.79 0.02 -1.23 -1.01 135.00 139.00 3g4p s PRO 245 Ca 0.12 1.73 -0.15 0.00 0.02 0.00 0.00 61.00 62.71 3g4p s PRO 245 Cb -0.22 -1.92 0.03 0.00 0.02 0.00 0.00 34.50 32.41 3g4p s PRO 245 CO -0.05 -1.29 0.34 -0.59 -0.33 0.00 0.00 177.00 175.08 3g4p s PHE 246 N -1.79 -0.25 -0.09 6.54 -0.12 -0.49 -1.62 117.98 120.16 3g4p s PHE 246 Ca 0.75 0.45 -0.01 0.00 -0.05 0.00 0.00 56.93 58.07 3g4p s PHE 246 Cb -0.28 0.12 0.03 0.00 -0.63 0.00 0.00 43.02 42.26 3g4p s PHE 246 CO 0.36 -0.37 -0.01 0.45 -0.05 0.00 0.00 175.22 175.60 3g4p s SER 247 N -1.04 1.83 0.15 1.98 0.15 -0.35 -1.23 113.70 115.21 3g4p s SER 247 Ca -0.11 -0.19 -0.16 0.00 0.70 0.00 0.00 55.95 56.19 3g4p s SER 247 Cb -0.04 -0.55 -0.07 0.00 -1.71 0.00 0.00 66.02 63.64 3g4p s SER 247 CO 0.04 -0.18 0.59 -0.22 1.20 0.00 0.00 173.24 174.67 3g4p s LEU 248 N 1.90 4.36 -0.17 3.45 0.20 -0.16 -1.20 118.68 127.06 3g4p s LEU 248 Ca 0.05 1.18 -0.06 0.00 0.69 0.00 0.00 54.13 55.98 3g4p s LEU 248 Cb -0.13 -3.29 0.08 0.00 -0.43 0.00 0.00 46.19 42.42 3g4p s LEU 248 CO -0.06 0.11 0.36 0.21 -0.29 0.00 0.00 176.35 176.68 3g4p s ASN 249 N -1.62 -0.10 0.16 3.68 3.84 -0.16 -2.08 114.94 118.66 3g4p s ASN 249 Ca 0.38 0.84 -0.05 0.00 0.21 0.00 0.00 52.86 54.24 3g4p s ASN 249 Cb -0.16 1.06 -0.02 0.00 -0.55 0.00 0.00 41.25 41.57 3g4p s ASN 249 CO 0.20 -0.23 0.19 -1.48 -2.79 0.00 0.00 177.10 172.98 3g4p s LEU 250 N 2.38 1.27 -0.19 3.21 0.05 -0.38 -0.41 118.68 124.61 3g4p s LEU 250 Ca -0.02 -1.07 -0.23 0.00 0.05 0.00 0.00 54.13 52.86 3g4p s LEU 250 Cb -0.12 0.78 -0.02 0.00 -2.05 0.00 0.00 46.19 44.78 3g4p s LEU 250 CO -0.11 -0.84 0.73 -0.70 -0.55 0.00 0.00 176.35 174.88 3g4p s GLU 251 N -4.03 4.25 0.10 1.48 2.12 0.31 -0.47 118.70 122.46 3g4p s GLU 251 Ca 0.23 0.81 -0.12 0.00 0.36 0.00 0.00 54.97 56.24 3g4p s GLU 251 Cb 0.05 -3.58 -0.06 0.00 0.26 0.00 0.00 34.13 30.80 3g4p s GLU 251 CO 0.03 -0.29 0.47 -1.64 -0.54 0.00 0.00 175.26 173.29 3g4p s MET 252 N 2.04 3.88 -0.11 4.30 -1.94 -0.74 -4.55 119.30 122.19 3g4p s MET 252 Ca 0.33 0.35 0.01 0.00 -1.71 0.00 0.00 55.69 54.67 3g4p s MET 252 Cb -0.16 -2.99 0.02 0.00 2.01 0.00 0.00 34.83 33.71 3g4p s MET 252 CO 0.11 0.54 -0.11 0.15 -0.01 0.00 0.00 175.02 175.70 3g4p s LYS 253 N -1.84 1.78 0.00 2.03 1.02 -1.26 -3.82 119.74 117.65 3g4p s LYS 253 Ca 0.34 -0.38 0.00 0.00 0.02 0.00 0.00 55.97 55.96 3g4p s LYS 253 Cb -0.15 -1.67 0.00 0.00 -0.52 0.00 0.00 37.83 35.49 3g4p s LYS 253 CO 0.18 -0.17 0.00 0.39 -0.92 0.00 0.00 175.35 174.83 3g4p n GLU 254 N 4.57 0.00 -0.93 1.68 -0.58 -1.26 -0.73 120.64 123.39 3g4p n GLU 254 Ca -0.16 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.58 3g4p n GLU 254 Cb 0.51 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.38 3g4p n GLU 254 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3g4p n GLY 255 N 0.00 0.83 3.81 0.62 0.00 -1.26 -5.05 105.19 104.14 3g4p n GLY 255 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 3g4p n GLY 255 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3g4p s MET 256 N -0.07 4.31 0.29 1.61 0.00 0.09 -5.06 119.30 120.45 3g4p s MET 256 Ca 0.00 1.07 -0.15 0.00 0.00 0.00 0.00 55.69 56.62 3g4p s MET 256 Cb 0.00 -2.52 -0.09 0.00 0.00 0.00 0.00 34.83 32.23 3g4p s MET 256 CO 0.00 0.16 0.70 0.45 0.00 0.00 0.00 175.02 176.33 3g4p s SER 257 N -1.94 6.80 0.36 1.11 0.15 -1.26 -4.94 113.70 113.97 3g4p s SER 257 Ca 0.54 1.24 0.14 0.00 0.70 0.00 0.00 55.95 58.57 3g4p s SER 257 Cb -0.13 -2.36 0.67 0.00 -1.71 0.00 0.00 66.02 62.49 3g4p s SER 257 CO 0.18 -0.14 1.78 1.23 1.20 0.00 0.00 173.24 177.49 3g4p h GLY 258 N 2.52 0.00 1.49 9.45 0.00 -2.00 -2.62 103.07 111.91 3g4p h GLY 258 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 3g4p h GLY 258 CO 0.66 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 176.06 3g4p n SER 259 N -3.94 0.00 0.23 0.19 3.41 -1.26 -2.64 113.62 109.61 3g4p n SER 259 Ca -0.02 -0.02 0.08 0.00 -0.26 0.00 0.00 58.87 58.65 3g4p n SER 259 Cb 0.46 -0.25 0.55 0.00 -0.26 0.00 0.00 64.21 64.71 3g4p n SER 259 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 3g4p h ILE 260 N 0.00 0.93 -0.13 -1.33 6.09 -1.88 -0.01 117.51 121.17 3g4p h ILE 260 Ca 0.00 -0.80 -0.02 0.00 -1.37 0.00 0.00 64.86 62.67 3g4p h ILE 260 Cb 0.13 1.46 -0.00 0.00 0.47 0.00 0.00 36.82 38.87 3g4p h ILE 260 CO 0.00 0.21 -0.01 0.03 -3.07 0.00 0.00 178.15 175.31 3g4p h ARG 261 N 0.00 0.24 0.07 2.19 3.08 -1.74 -0.45 114.38 117.77 3g4p h ARG 261 Ca -0.00 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 3g4p h ARG 261 Cb 0.44 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.47 3g4p h ARG 261 CO 0.03 0.49 -0.03 -0.91 -1.07 0.00 0.00 179.97 178.47 3g4p h ASN 262 N -0.04 -0.08 -0.18 7.04 2.35 -1.68 -2.54 115.58 120.45 3g4p h ASN 262 Ca 0.04 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3g4p h ASN 262 Cb 0.38 0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 3g4p h ASN 262 CO 0.01 -0.00 0.12 -0.33 -1.65 0.00 0.00 177.43 175.57 3g4p h GLU 263 N -0.15 0.24 -0.31 0.81 5.08 -0.85 0.14 114.58 119.54 3g4p h GLU 263 Ca -0.01 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 3g4p h GLU 263 Cb 0.13 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3g4p h GLU 263 CO 0.02 0.16 -0.04 0.82 -1.00 0.00 0.00 179.01 178.96 3g4p h ILE 264 N 0.24 1.20 -0.13 3.13 2.04 -1.16 -1.96 117.51 120.88 3g4p h ILE 264 Ca 0.07 -0.84 -0.03 0.00 1.00 0.00 0.00 64.86 65.06 3g4p h ILE 264 Cb -0.03 1.02 -0.00 0.00 -0.74 0.00 0.00 36.82 37.06 3g4p h ILE 264 CO -0.01 0.28 -0.03 0.74 0.00 0.00 0.00 178.15 179.13 3g4p h THR 265 N 0.46 1.29 -0.36 -0.27 2.02 -0.89 -1.26 112.91 113.90 3g4p h THR 265 Ca 0.10 -0.97 -0.12 0.00 0.77 0.00 0.00 66.41 66.19 3g4p h THR 265 Cb 0.37 1.66 -0.01 0.00 -1.74 0.00 0.00 68.15 68.43 3g4p h THR 265 CO 0.02 0.28 -0.28 1.88 0.37 0.00 0.00 175.52 177.79 3g4p h TYR 266 N -0.05 0.86 -0.55 3.16 0.05 -0.91 -0.71 116.97 118.83 3g4p h TYR 266 Ca 0.03 -0.21 -0.02 0.00 0.05 0.00 0.00 58.73 58.58 3g4p h TYR 266 Cb 0.45 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.96 3g4p h TYR 266 CO 0.05 0.94 0.26 0.87 -1.05 0.00 0.00 178.16 179.23 3g4p h LYS 267 N 0.64 0.79 -0.01 4.88 1.57 -1.28 -1.59 116.57 121.58 3g4p h LYS 267 Ca 0.08 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3g4p h LYS 267 Cb 0.80 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.96 3g4p h LYS 267 CO 0.07 0.65 0.01 0.77 -0.57 0.00 0.00 179.45 180.37 3g4p h SER 268 N 0.74 0.01 -0.77 0.86 0.02 -1.00 0.21 113.55 113.62 3g4p h SER 268 Ca 0.19 -0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 61.03 3g4p h SER 268 Cb 0.12 -0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.63 3g4p h SER 268 CO -0.02 0.07 0.32 -0.07 -1.14 0.00 0.00 176.83 175.99 3g4p h LEU 269 N -0.05 1.05 -0.27 5.07 3.38 -1.11 -2.36 115.31 121.02 3g4p h LEU 269 Ca 0.00 -0.15 -0.16 0.00 0.09 0.00 0.00 57.88 57.66 3g4p h LEU 269 Cb 0.07 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 3g4p h LEU 269 CO -0.00 0.92 -0.44 -0.08 0.09 0.00 0.00 178.44 178.93 3g4p h GLU 270 N 1.12 0.77 -0.99 1.13 4.81 -1.25 0.36 114.58 120.53 3g4p h GLU 270 Ca 0.26 -0.47 0.17 0.00 -0.13 0.00 0.00 59.36 59.19 3g4p h GLU 270 Cb 0.19 0.05 -0.10 0.00 0.63 0.00 0.00 28.75 29.52 3g4p h GLU 270 CO -0.02 1.10 0.60 -0.97 -0.73 0.00 0.00 179.01 178.99 3g4p h ASN 271 N 0.52 0.80 -0.13 1.04 -0.73 -0.42 0.23 115.58 116.89 3g4p h ASN 271 Ca 0.02 0.09 0.00 0.00 1.87 0.00 0.00 56.30 58.28 3g4p h ASN 271 Cb 1.05 -0.06 0.00 0.00 0.27 0.00 0.00 38.32 39.57 3g4p h ASN 271 CO 0.10 0.32 0.00 0.18 -0.37 0.00 0.00 177.43 177.66 3g4p n LEU 272 N -4.74 1.20 -1.30 0.34 4.77 -0.90 -4.93 117.00 111.44 3g4p n LEU 272 Ca 0.22 -0.51 -0.16 0.00 -0.03 0.00 0.00 56.01 55.53 3g4p n LEU 272 Cb 0.51 -0.08 -0.06 0.00 -2.33 0.00 0.00 43.42 41.46 3g4p n LEU 272 CO 0.23 0.26 -0.16 0.61 -1.33 0.00 0.00 177.39 176.99 3g4p n GLY 273 N 1.02 1.34 0.09 -0.72 0.00 0.80 -4.90 105.19 102.81 3g4p n GLY 273 Ca 0.15 -0.26 -0.09 0.00 0.00 0.00 0.00 46.02 45.82 3g4p n GLY 273 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3g4p h ILE 274 N 0.00 1.60 0.00 -0.61 2.04 -1.16 -3.49 117.51 115.90 3g4p h ILE 274 Ca -0.33 -3.07 0.00 0.00 1.00 0.00 0.00 64.86 62.46 3g4p h ILE 274 Cb 1.07 2.72 0.00 0.00 -0.74 0.00 0.00 36.82 39.87 3g4p h ILE 274 CO 0.47 0.88 0.00 2.30 0.00 0.00 0.00 178.15 181.80