#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3l6t h ASN -1 N 0.00 0.41 -3.75 4.04 7.08 -1.98 -3.45 115.58 117.93 3l6t h ASN -1 Ca 0.00 -0.32 -0.51 0.00 -3.08 0.00 0.00 56.30 52.40 3l6t h ASN -1 Cb 0.00 -0.12 0.01 0.00 -2.08 0.00 0.00 38.32 36.13 3l6t h ASN -1 CO 0.00 1.10 0.48 0.00 -2.08 0.00 0.00 177.43 176.93 3l6t s ALA 0 N -3.31 3.40 0.12 4.14 0.00 -1.26 -4.95 121.76 119.90 3l6t s ALA 0 Ca -0.05 0.89 -0.23 0.00 0.00 0.00 0.00 51.96 52.57 3l6t s ALA 0 Cb 0.10 -3.34 -0.05 0.00 0.00 0.00 0.00 23.12 19.83 3l6t s ALA 0 CO 0.85 -0.18 1.67 1.98 0.00 0.00 0.00 175.76 180.08 3l6t h MET 1 N 4.11 -0.22 -3.59 0.00 -1.53 -1.87 -3.33 114.93 108.50 3l6t h MET 1 Ca -0.46 0.01 -0.45 0.00 -3.44 0.00 0.00 59.70 55.36 3l6t h MET 1 Cb 1.21 0.05 -0.39 0.00 -0.55 0.00 0.00 31.60 31.92 3l6t h MET 1 CO 0.68 -0.14 -0.76 -1.17 0.14 0.00 0.00 176.91 175.66 3l6t s LEU 2 N -10.36 0.65 -0.01 3.39 2.96 -1.26 -0.85 118.68 113.20 3l6t s LEU 2 Ca -0.14 -0.25 0.00 0.00 -0.22 0.00 0.00 54.13 53.52 3l6t s LEU 2 Cb 0.09 -0.43 -0.04 0.00 0.50 0.00 0.00 46.19 46.31 3l6t s LEU 2 CO 0.67 -0.23 0.05 -0.62 -1.32 0.00 0.00 176.35 174.90 3l6t s ASP 3 N 1.98 5.47 -0.15 3.68 2.15 -0.57 -4.95 116.67 124.27 3l6t s ASP 3 Ca 0.04 0.10 0.00 0.00 0.43 0.00 0.00 52.55 53.12 3l6t s ASP 3 Cb -0.13 -1.53 0.03 0.00 -0.30 0.00 0.00 42.92 40.99 3l6t s ASP 3 CO -0.06 0.28 -0.10 -0.63 -0.17 0.00 0.00 175.17 174.50 3l6t s ILE 4 N -1.13 1.37 -0.20 4.11 1.01 -1.26 -0.71 121.20 124.38 3l6t s ILE 4 Ca 0.21 -0.63 -0.01 0.00 0.00 0.00 0.00 60.65 60.21 3l6t s ILE 4 Cb -0.12 -1.39 0.01 0.00 0.01 0.00 0.00 42.46 40.97 3l6t s ILE 4 CO 0.12 0.31 -0.13 -0.89 0.00 0.00 0.00 174.94 174.34 3l6t s THR 5 N 1.55 2.66 -0.16 2.92 2.01 -0.52 -4.95 115.64 119.16 3l6t s THR 5 Ca 0.03 -0.74 -0.29 0.00 0.31 0.00 0.00 61.69 61.00 3l6t s THR 5 Cb -0.14 -2.17 -0.01 0.00 0.01 0.00 0.00 72.50 70.20 3l6t s THR 5 CO -0.09 0.49 1.09 -0.89 -0.69 0.00 0.00 174.62 174.52 3l6t s THR 6 N 1.35 4.60 -0.19 -0.82 2.01 -1.26 -0.88 115.64 120.44 3l6t s THR 6 Ca 0.05 1.90 -0.13 0.00 0.31 0.00 0.00 61.69 63.82 3l6t s THR 6 Cb -0.14 -4.23 -0.05 0.00 0.01 0.00 0.00 72.50 68.10 3l6t s THR 6 CO -0.08 -0.09 0.26 -0.63 -0.69 0.00 0.00 174.62 173.39 3l6t s ILE 7 N 2.76 5.31 0.41 1.82 -1.09 0.58 -4.99 121.20 126.00 3l6t s ILE 7 Ca 0.49 0.46 0.02 0.00 -2.23 0.00 0.00 60.65 59.38 3l6t s ILE 7 Cb -0.18 -3.60 -0.01 0.00 -1.58 0.00 0.00 42.46 37.09 3l6t s ILE 7 CO 0.13 0.36 0.07 0.35 -1.23 0.00 0.00 174.94 174.62 3l6t n THR 8 N 3.86 0.00 -0.11 2.92 -2.24 -1.26 0.23 114.28 117.68 3l6t n THR 8 Ca -0.12 -2.17 0.06 0.00 -2.27 0.00 0.00 64.05 59.55 3l6t n THR 8 Cb 0.52 0.62 0.39 0.00 -2.10 0.00 0.00 70.33 69.76 3l6t n THR 8 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 3l6t h ARG 9 N 0.00 0.64 -0.80 -0.78 2.47 -1.58 -1.68 114.38 112.65 3l6t h ARG 9 Ca -0.33 -0.04 0.12 0.00 -1.26 0.00 0.00 59.98 58.47 3l6t h ARG 9 Cb 1.13 -0.15 -0.06 0.00 -1.65 0.00 0.00 29.97 29.25 3l6t h ARG 9 CO 0.54 0.43 0.52 1.96 0.56 0.00 0.00 179.97 183.98 3l6t h GLN 10 N 0.66 0.61 0.00 0.04 7.50 -1.90 -3.23 115.11 118.80 3l6t h GLN 10 Ca 0.25 -0.04 0.00 0.00 0.50 0.00 0.00 58.65 59.37 3l6t h GLN 10 Cb 0.17 -0.14 0.00 0.00 0.05 0.00 0.00 27.48 27.56 3l6t h GLN 10 CO -0.07 0.41 -0.16 0.27 -1.50 0.00 0.00 178.83 177.77 3l6t n ASN 11 N -4.51 1.46 0.23 1.46 6.94 -1.01 -4.85 115.26 114.97 3l6t n ASN 11 Ca 0.14 -2.58 0.06 0.00 -0.02 0.00 0.00 54.58 52.19 3l6t n ASN 11 Cb 0.41 -0.31 0.55 0.00 -2.36 0.00 0.00 39.78 38.08 3l6t n ASN 11 CO 0.00 0.00 0.00 1.62 -1.03 0.00 0.00 177.26 177.85 3l6t h VAL 12 N 2.42 1.07 0.00 3.53 3.04 -1.33 -1.38 116.25 123.60 3l6t h VAL 12 Ca 0.00 -0.34 0.00 0.00 -1.01 0.00 0.00 66.70 65.35 3l6t h VAL 12 Cb 1.10 1.15 0.00 0.00 -2.01 0.00 0.00 31.29 31.53 3l6t h VAL 12 CO 0.00 0.10 0.00 0.35 -1.01 0.00 0.00 177.57 177.01 3l6t n THR 13 N -4.42 0.89 0.86 3.17 -2.24 -1.26 -1.66 114.28 109.62 3l6t n THR 13 Ca -0.02 0.22 0.12 0.00 -2.27 0.00 0.00 64.05 62.10 3l6t n THR 13 Cb 0.17 -1.00 0.32 0.00 -2.10 0.00 0.00 70.33 67.71 3l6t n THR 13 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3l6t n SER 14 N -1.70 0.47 -4.77 3.42 3.41 -0.52 -4.92 113.62 109.02 3l6t n SER 14 Ca 0.03 0.06 -0.39 0.00 -0.26 0.00 0.00 58.87 58.31 3l6t n SER 14 Cb 0.20 -0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.12 3l6t n SER 14 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3l6t s VAL 15 N -3.05 3.19 0.32 -3.33 0.11 -0.66 -4.96 120.40 112.01 3l6t s VAL 15 Ca 0.10 1.10 -0.29 0.00 -2.93 0.00 0.00 61.98 59.96 3l6t s VAL 15 Cb 0.16 -3.66 -0.11 0.00 -1.53 0.00 0.00 36.38 31.25 3l6t s VAL 15 CO 0.66 0.19 1.47 -0.69 -3.33 0.00 0.00 175.10 173.40 3l6t s VAL 16 N -1.29 2.32 0.00 2.04 1.01 -1.26 -2.62 120.40 120.61 3l6t s VAL 16 Ca 0.51 0.30 0.00 0.00 0.00 0.00 0.00 61.98 62.79 3l6t s VAL 16 Cb -0.33 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 32.86 3l6t s VAL 16 CO 0.42 0.06 0.00 0.61 0.00 0.00 0.00 175.10 176.19 3l6t n GLY 17 N 1.32 0.98 0.35 4.51 0.00 -1.26 -4.93 105.19 106.15 3l6t n GLY 17 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 3l6t n GLY 17 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3l6t h TYR 18 N 0.00 1.22 -2.94 1.61 3.20 -1.84 -3.43 116.97 114.78 3l6t h TYR 18 Ca 0.00 -0.07 -0.62 0.00 3.14 0.00 0.00 58.73 61.18 3l6t h TYR 18 Cb 0.00 -0.37 -0.05 0.00 1.54 0.00 0.00 36.73 37.85 3l6t h TYR 18 CO 0.00 0.90 -0.51 0.71 -1.64 0.00 0.00 178.16 177.61 3l6t s TYR 19 N -5.64 3.47 0.22 -3.82 2.02 -1.26 -5.03 117.35 107.31 3l6t s TYR 19 Ca -0.12 0.22 -0.16 0.00 -0.37 0.00 0.00 57.07 56.64 3l6t s TYR 19 Cb 0.16 -1.74 0.01 0.00 -0.40 0.00 0.00 41.96 40.00 3l6t s TYR 19 CO 0.84 0.58 0.51 -1.54 -1.57 0.00 0.00 175.55 174.37 3l6t s SER 20 N -2.50 -0.18 -0.13 2.29 1.04 -1.26 -5.09 113.70 107.86 3l6t s SER 20 Ca 0.34 -0.66 -0.21 0.00 0.48 0.00 0.00 55.95 55.90 3l6t s SER 20 Cb -0.13 0.59 -0.03 0.00 0.10 0.00 0.00 66.02 66.54 3l6t s SER 20 CO 0.27 -1.10 0.62 -1.81 0.98 0.00 0.00 173.24 172.20 3l6t s ASP 21 N -2.93 6.80 0.50 7.02 1.01 -1.26 -4.97 116.67 122.83 3l6t s ASP 21 Ca 0.14 0.96 0.16 0.00 0.71 0.00 0.00 52.55 54.52 3l6t s ASP 21 Cb -0.01 -2.36 1.20 0.00 1.01 0.00 0.00 42.92 42.76 3l6t s ASP 21 CO 0.02 -0.15 2.10 0.00 0.21 0.00 0.00 175.17 177.35 3l6t h ALA 22 N 7.02 2.03 0.00 5.23 0.00 -2.01 -1.30 119.26 130.24 3l6t h ALA 22 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3l6t h ALA 22 Cb 1.17 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3l6t h ALA 22 CO 0.76 -0.07 0.00 0.36 0.00 0.00 0.00 179.25 180.30 3l6t n LYS 23 N -4.50 0.13 -4.61 0.00 2.85 -1.26 -4.76 118.16 106.02 3l6t n LYS 23 Ca 0.01 0.22 -0.34 0.00 -1.05 0.00 0.00 58.31 57.16 3l6t n LYS 23 Cb 0.19 -1.69 -0.12 0.00 -0.65 0.00 0.00 35.03 32.76 3l6t n LYS 23 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 3l6t s ASP 24 N -3.82 4.60 0.11 -5.58 1.01 -0.49 -5.00 116.67 107.50 3l6t s ASP 24 Ca 0.09 -0.08 0.06 0.00 0.71 0.00 0.00 52.55 53.34 3l6t s ASP 24 Cb 0.13 -1.31 -0.22 0.00 1.01 0.00 0.00 42.92 42.53 3l6t s ASP 24 CO 0.47 0.31 1.24 0.44 0.21 0.00 0.00 175.17 177.84 3l6t h ASP 25 N 5.66 0.03 -3.68 0.27 3.32 -1.85 -3.44 116.42 116.73 3l6t h ASP 25 Ca -0.43 -0.03 -0.67 0.00 0.02 0.00 0.00 57.03 55.91 3l6t h ASP 25 Cb 1.18 -0.01 -0.19 0.00 0.22 0.00 0.00 39.33 40.53 3l6t h ASP 25 CO 0.55 1.03 -0.81 -0.31 -1.72 0.00 0.00 179.24 177.97 3l6t s TYR 26 N -2.70 2.49 0.05 4.55 2.02 -1.26 -1.43 117.35 121.07 3l6t s TYR 26 Ca 0.00 -0.28 -0.21 0.00 -0.37 0.00 0.00 57.07 56.21 3l6t s TYR 26 Cb 0.10 -1.31 -0.13 0.00 -0.40 0.00 0.00 41.96 40.21 3l6t s TYR 26 CO 0.82 0.39 1.43 1.88 -1.57 0.00 0.00 175.55 178.51 3l6t h TYR 27 N 3.67 0.34 -2.00 2.71 0.05 -1.91 -3.41 116.97 116.43 3l6t h TYR 27 Ca -0.50 -0.07 -0.53 0.00 0.05 0.00 0.00 58.73 57.68 3l6t h TYR 27 Cb 1.17 -0.08 -0.35 0.00 1.01 0.00 0.00 36.73 38.48 3l6t h TYR 27 CO 0.61 0.58 -0.96 0.43 -1.05 0.00 0.00 178.16 177.77 3l6t n SER 28 N -4.68 -0.61 -4.77 3.88 7.64 -1.26 -5.09 113.62 108.73 3l6t n SER 28 Ca -0.05 -2.58 -0.40 0.00 1.01 0.00 0.00 58.87 56.85 3l6t n SER 28 Cb 0.27 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 3l6t n SER 28 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 3l6t s LYS 29 N -0.29 3.89 -1.26 1.43 0.00 -1.26 -3.40 119.74 118.85 3l6t s LYS 29 Ca 0.33 2.32 -0.05 0.00 0.00 0.00 0.00 55.97 58.57 3l6t s LYS 29 Cb 0.09 -2.76 0.01 0.00 0.00 0.00 0.00 37.83 35.17 3l6t s LYS 29 CO -0.16 -0.62 0.65 -0.25 0.00 0.00 0.00 175.35 174.98 3l6t n ASP 30 N 0.07 -5.48 -3.26 0.03 8.00 -1.26 -4.99 116.55 109.65 3l6t n ASP 30 Ca 0.04 -0.30 -0.14 0.00 0.71 0.00 0.00 54.79 55.10 3l6t n ASP 30 Cb 0.42 -4.25 -0.04 0.00 -0.02 0.00 0.00 41.12 37.23 3l6t n ASP 30 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3l6t s SER 31 N -2.91 0.76 -0.21 -2.24 1.04 -1.22 -5.06 113.70 103.86 3l6t s SER 31 Ca 0.32 -1.42 0.14 0.00 0.48 0.00 0.00 55.95 55.48 3l6t s SER 31 Cb -0.14 0.68 0.48 0.00 0.10 0.00 0.00 66.02 67.13 3l6t s SER 31 CO 0.40 -1.33 1.39 -0.24 0.98 0.00 0.00 173.24 174.44 3l6t n SER 32 N -1.34 3.08 -0.03 7.02 2.88 -1.26 -4.51 113.62 119.45 3l6t n SER 32 Ca -0.00 -3.32 -0.01 0.00 -1.33 0.00 0.00 58.87 54.21 3l6t n SER 32 Cb 0.61 -0.56 0.27 0.00 -0.75 0.00 0.00 64.21 63.79 3l6t n SER 32 CO 0.00 0.00 0.00 -0.26 -1.23 0.00 0.00 175.04 173.55 3l6t h PHE 33 N 1.21 0.62 -3.57 0.66 0.04 -1.92 -3.43 116.94 110.55 3l6t h PHE 33 Ca 0.08 -0.06 -0.65 0.00 2.80 0.00 0.00 57.97 60.14 3l6t h PHE 33 Cb 1.44 -0.18 -0.20 0.00 2.20 0.00 0.00 35.95 39.20 3l6t h PHE 33 CO 0.61 0.57 -0.84 0.95 -0.60 0.00 0.00 178.31 179.01 3l6t s THR 34 N -5.05 2.22 -0.02 -1.55 -4.23 -1.26 0.18 115.64 105.93 3l6t s THR 34 Ca -0.08 -1.87 -0.23 0.00 -1.18 0.00 0.00 61.69 58.33 3l6t s THR 34 Cb 0.16 -2.00 0.05 0.00 1.34 0.00 0.00 72.50 72.04 3l6t s THR 34 CO 0.77 -0.04 0.51 -0.94 -0.54 0.00 0.00 174.62 174.39 3l6t s SER 35 N -2.35 -0.44 0.05 3.99 1.04 -0.86 -4.32 113.70 110.81 3l6t s SER 35 Ca 0.16 0.38 -0.22 0.00 0.48 0.00 0.00 55.95 56.75 3l6t s SER 35 Cb -0.09 0.45 -0.06 0.00 0.10 0.00 0.00 66.02 66.42 3l6t s SER 35 CO 0.07 -0.58 0.66 0.26 0.98 0.00 0.00 173.24 174.64 3l6t s TRP 36 N -1.52 3.76 0.18 5.02 0.52 -0.87 -0.42 118.94 125.60 3l6t s TRP 36 Ca -0.11 1.35 0.00 0.00 0.02 0.00 0.00 56.10 57.37 3l6t s TRP 36 Cb -0.02 -2.66 -0.04 0.00 -1.15 0.00 0.00 33.47 29.60 3l6t s TRP 36 CO 0.05 0.41 0.05 -0.65 0.02 0.00 0.00 176.95 176.84 3l6t s GLN 37 N -0.50 1.12 0.00 4.98 -0.21 0.73 -4.54 119.66 121.25 3l6t s GLN 37 Ca 0.33 -1.56 0.00 0.00 0.02 0.00 0.00 55.36 54.15 3l6t s GLN 37 Cb -0.20 -0.04 0.00 0.00 1.00 0.00 0.00 33.01 33.77 3l6t s GLN 37 CO 0.20 -0.24 0.00 0.41 -2.12 0.00 0.00 175.29 173.55 3l6t n GLY 38 N -0.24 1.77 0.25 3.09 0.00 -1.26 -1.39 105.19 107.40 3l6t n GLY 38 Ca -0.04 -1.66 0.12 0.00 0.00 0.00 0.00 46.02 44.44 3l6t n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3l6t h THR 39 N 0.00 0.53 -0.37 2.61 1.03 -1.87 -2.54 112.91 112.30 3l6t h THR 39 Ca 0.00 -0.77 -0.11 0.00 -0.01 0.00 0.00 66.41 65.52 3l6t h THR 39 Cb 0.00 1.52 -0.01 0.00 -1.07 0.00 0.00 68.15 68.59 3l6t h THR 39 CO 0.00 0.16 -0.20 1.23 -0.01 0.00 0.00 175.52 176.70 3l6t h GLY 40 N 1.36 0.86 0.56 2.99 0.00 -1.16 -1.61 103.07 106.08 3l6t h GLY 40 Ca -0.00 -0.79 0.06 0.00 0.00 0.00 0.00 47.33 46.60 3l6t h GLY 40 CO 0.02 0.72 0.16 0.00 0.00 0.00 0.00 176.54 177.44 3l6t h ALA 41 N 0.79 0.56 -0.91 3.60 0.00 -1.27 -1.74 119.26 120.29 3l6t h ALA 41 Ca 0.08 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 3l6t h ALA 41 Cb 0.75 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 3l6t h ALA 41 CO 0.06 -0.23 0.55 1.49 0.00 0.00 0.00 179.25 181.12 3l6t h GLU 42 N 0.33 1.24 0.00 0.00 4.57 -1.32 0.03 114.58 119.42 3l6t h GLU 42 Ca 0.22 -0.11 -0.00 0.00 -1.18 0.00 0.00 59.36 58.29 3l6t h GLU 42 Cb 0.23 -0.26 -0.00 0.00 -0.16 0.00 0.00 28.75 28.56 3l6t h GLU 42 CO -0.23 0.86 -0.02 0.00 -1.18 0.00 0.00 179.01 178.44 3l6t h ALA 43 N 1.35 1.25 -0.02 2.92 0.00 -0.47 0.57 119.26 124.87 3l6t h ALA 43 Ca 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3l6t h ALA 43 Cb -0.06 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3l6t h ALA 43 CO -0.06 0.03 -0.11 -0.11 0.00 0.00 0.00 179.25 179.00 3l6t n LEU 44 N -3.48 1.98 -0.32 0.00 7.94 -0.15 -4.93 117.00 118.04 3l6t n LEU 44 Ca -0.03 -0.66 -0.03 0.00 -1.11 0.00 0.00 56.01 54.19 3l6t n LEU 44 Cb 0.12 -0.02 -0.01 0.00 0.53 0.00 0.00 43.42 44.04 3l6t n LEU 44 CO 0.25 0.34 -0.04 0.61 -1.11 0.00 0.00 177.39 177.44 3l6t n GLY 45 N 1.29 0.40 3.58 -3.96 0.00 0.19 -5.02 105.19 101.67 3l6t n GLY 45 Ca 0.15 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 3l6t n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3l6t s LEU 46 N -0.85 3.84 0.07 0.99 1.43 -0.37 -5.00 118.68 118.78 3l6t s LEU 46 Ca 0.00 -0.02 -0.15 0.00 -1.03 0.00 0.00 54.13 52.93 3l6t s LEU 46 Cb 0.00 -2.03 0.03 0.00 0.03 0.00 0.00 46.19 44.22 3l6t s LEU 46 CO 0.00 0.03 0.35 -0.94 0.23 0.00 0.00 176.35 176.02 3l6t s SER 47 N 1.26 -0.18 0.08 2.29 1.04 -1.26 -3.94 113.70 112.98 3l6t s SER 47 Ca 0.06 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.27 3l6t s SER 47 Cb -0.14 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.39 3l6t s SER 47 CO 0.05 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.17 3l6t n GLY 48 N 0.25 -0.40 3.64 7.32 0.00 -1.26 -4.83 105.19 109.91 3l6t n GLY 48 Ca -0.17 -1.10 -0.40 0.00 0.00 0.00 0.00 46.02 44.35 3l6t n GLY 48 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3l6t n ASP 49 N 0.60 1.49 -4.60 1.61 8.00 -1.26 -2.06 116.55 120.33 3l6t n ASP 49 Ca 0.00 0.96 -0.42 0.00 0.71 0.00 0.00 54.79 56.05 3l6t n ASP 49 Cb 0.00 -1.42 -0.05 0.00 -0.02 0.00 0.00 41.12 39.63 3l6t n ASP 49 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3l6t s VAL 50 N -1.35 4.79 -0.08 2.53 1.01 -1.26 -4.79 120.40 121.26 3l6t s VAL 50 Ca 0.68 1.07 -0.30 0.00 0.00 0.00 0.00 61.98 63.43 3l6t s VAL 50 Cb -0.48 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 31.72 3l6t s VAL 50 CO 0.53 -0.28 1.28 -0.70 0.00 0.00 0.00 175.10 175.93 3l6t s GLU 51 N 2.95 4.29 0.21 2.72 2.12 -1.26 -3.84 118.70 125.89 3l6t s GLU 51 Ca 0.31 1.75 -0.10 0.00 0.36 0.00 0.00 54.97 57.30 3l6t s GLU 51 Cb -0.14 -3.65 0.21 0.00 0.26 0.00 0.00 34.13 30.81 3l6t s GLU 51 CO 0.13 -0.58 1.83 0.66 -0.54 0.00 0.00 175.26 176.77 3l6t h SER 52 N 7.89 0.65 -0.85 -1.70 4.64 -1.59 -0.86 113.55 121.73 3l6t h SER 52 Ca -0.33 0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.01 3l6t h SER 52 Cb 1.15 -0.12 -0.04 0.00 -0.31 0.00 0.00 62.40 63.07 3l6t h SER 52 CO 0.92 0.44 0.56 0.00 -0.87 0.00 0.00 176.83 177.87 3l6t h ALA 53 N 1.32 1.08 -0.33 5.18 0.00 -1.92 -1.75 119.26 122.83 3l6t h ALA 53 Ca 0.29 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.97 3l6t h ALA 53 Cb 0.09 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 3l6t h ALA 53 CO -0.14 0.49 -0.45 -0.09 0.00 0.00 0.00 179.25 179.06 3l6t h ARG 54 N 1.15 0.86 -0.17 0.00 9.65 -1.75 -1.76 114.38 122.36 3l6t h ARG 54 Ca 0.31 -0.49 0.04 0.00 -1.10 0.00 0.00 59.98 58.74 3l6t h ARG 54 Cb -0.12 0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 28.45 3l6t h ARG 54 CO -0.07 1.13 -0.10 0.35 2.80 0.00 0.00 179.97 184.08 3l6t h PHE 55 N 0.69 -0.25 -0.38 2.20 3.57 -0.88 -1.22 116.94 120.67 3l6t h PHE 55 Ca 0.04 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.53 3l6t h PHE 55 Cb 1.04 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.90 3l6t h PHE 55 CO 0.06 -0.16 0.08 0.87 -2.23 0.00 0.00 178.31 176.94 3l6t h LYS 56 N -0.10 0.56 -0.22 1.11 1.57 -1.20 -0.28 116.57 118.01 3l6t h LYS 56 Ca 0.10 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 3l6t h LYS 56 Cb 0.25 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 3l6t h LYS 56 CO -0.23 0.52 0.07 0.93 -0.57 0.00 0.00 179.45 180.17 3l6t h GLU 57 N 0.55 0.34 -0.27 3.15 5.08 -0.89 -3.16 114.58 119.39 3l6t h GLU 57 Ca 0.13 -0.07 -0.13 0.00 -1.00 0.00 0.00 59.36 58.29 3l6t h GLU 57 Cb 0.22 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 3l6t h GLU 57 CO -0.00 0.43 -0.37 -0.07 -1.00 0.00 0.00 179.01 178.00 3l6t h LEU 58 N 0.19 0.63 -0.77 1.33 3.38 -0.76 0.11 115.31 119.43 3l6t h LEU 58 Ca 0.07 -0.27 0.15 0.00 0.09 0.00 0.00 57.88 57.93 3l6t h LEU 58 Cb 0.22 -0.18 -0.15 0.00 0.09 0.00 0.00 40.66 40.65 3l6t h LEU 58 CO -0.00 0.94 -0.20 -0.07 0.09 0.00 0.00 178.44 179.20 3l6t h LEU 59 N 0.50 -0.74 -2.87 1.67 3.38 -1.05 -0.61 115.31 115.60 3l6t h LEU 59 Ca 0.05 0.23 0.00 0.00 0.09 0.00 0.00 57.88 58.25 3l6t h LEU 59 Cb 0.87 0.48 0.00 0.00 0.09 0.00 0.00 40.66 42.10 3l6t h LEU 59 CO 0.07 -0.26 0.00 1.33 0.09 0.00 0.00 178.44 179.68 3l6t n VAL 60 N -5.50 1.81 -0.97 1.22 0.24 -1.05 -4.69 118.33 109.39 3l6t n VAL 60 Ca 0.10 -1.07 0.00 0.00 -2.04 0.00 0.00 64.34 61.34 3l6t n VAL 60 Cb 0.39 -0.05 0.00 0.00 -1.47 0.00 0.00 33.84 32.71 3l6t n VAL 60 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3l6t n GLY 61 N 0.88 0.41 3.51 7.63 0.00 -0.24 -4.75 105.19 112.64 3l6t n GLY 61 Ca 0.23 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.81 3l6t n GLY 61 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3l6t s GLU 62 N -1.84 3.59 0.12 1.61 2.12 0.34 -0.37 118.70 124.28 3l6t s GLU 62 Ca 0.00 -1.41 -0.17 0.00 0.36 0.00 0.00 54.97 53.75 3l6t s GLU 62 Cb 0.00 -5.15 -0.03 0.00 0.26 0.00 0.00 34.13 29.21 3l6t s GLU 62 CO 0.00 -2.01 1.70 0.82 -0.54 0.00 0.00 175.26 175.23 3l6t h ILE 63 N 6.36 1.16 -3.59 -3.70 1.08 -1.31 -3.36 117.51 114.13 3l6t h ILE 63 Ca 0.18 -0.44 -0.16 0.00 -0.39 0.00 0.00 64.86 64.05 3l6t h ILE 63 Cb 1.02 0.85 -0.04 0.00 -3.07 0.00 0.00 36.82 35.58 3l6t h ILE 63 CO 1.28 0.16 0.03 1.51 -0.69 0.00 0.00 178.15 180.45 3l6t s ASP 64 N -5.68 0.51 0.59 1.72 3.84 -1.12 -4.98 116.67 111.55 3l6t s ASP 64 Ca -0.13 -1.34 0.29 0.00 -0.00 0.00 0.00 52.55 51.37 3l6t s ASP 64 Cb 0.09 0.76 1.72 0.00 -1.38 0.00 0.00 42.92 44.11 3l6t s ASP 64 CO 0.73 -1.49 2.15 0.71 -0.00 0.00 0.00 175.17 177.27 3l6t h THR 65 N 2.05 0.49 -0.08 2.11 1.35 -2.01 -0.08 112.91 116.73 3l6t h THR 65 Ca -0.30 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.56 3l6t h THR 65 Cb 1.24 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 3l6t h THR 65 CO 0.40 0.00 0.00 0.49 -0.25 0.00 0.00 175.52 176.16 3l6t n PHE 66 N -3.81 0.08 -3.56 4.73 3.01 -1.26 -4.82 117.46 111.83 3l6t n PHE 66 Ca -0.00 -0.05 -0.29 0.00 1.01 0.00 0.00 57.45 58.12 3l6t n PHE 66 Cb 0.24 -0.00 -0.12 0.00 -0.01 0.00 0.00 39.48 39.59 3l6t n PHE 66 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 3l6t s THR 67 N -1.66 0.70 -0.23 4.37 2.01 -0.04 -5.09 115.64 115.70 3l6t s THR 67 Ca 0.26 -2.20 -0.07 0.00 0.31 0.00 0.00 61.69 59.98 3l6t s THR 67 Cb 0.18 -1.50 -0.03 0.00 0.01 0.00 0.00 72.50 71.16 3l6t s THR 67 CO 0.26 -0.99 0.07 -1.00 -0.69 0.00 0.00 174.62 172.28 3l6t s HIS 68 N 0.62 3.14 0.43 4.92 3.76 -1.26 -0.94 115.29 125.95 3l6t s HIS 68 Ca 0.20 -0.22 -0.26 0.00 -0.15 0.00 0.00 55.06 54.63 3l6t s HIS 68 Cb -0.20 -2.19 -0.09 0.00 1.11 0.00 0.00 32.58 31.22 3l6t s HIS 68 CO -0.02 -0.17 1.41 -1.64 -0.85 0.00 0.00 174.74 173.46 3l6t s MET 69 N 1.20 3.83 -0.55 1.40 -1.94 0.50 -4.99 119.30 118.74 3l6t s MET 69 Ca 0.05 2.38 -0.10 0.00 -1.71 0.00 0.00 55.69 56.31 3l6t s MET 69 Cb -0.14 -2.74 0.14 0.00 2.01 0.00 0.00 34.83 34.10 3l6t s MET 69 CO 0.04 -0.69 0.44 1.14 -0.01 0.00 0.00 175.02 175.94 3l6t s GLN 70 N -2.33 2.71 -0.32 2.03 -2.07 -1.26 -4.93 119.66 113.49 3l6t s GLN 70 Ca 0.58 -1.98 0.08 0.00 -1.82 0.00 0.00 55.36 52.23 3l6t s GLN 70 Cb -0.43 -4.02 0.51 0.00 -1.09 0.00 0.00 33.01 27.99 3l6t s GLN 70 CO 0.56 -1.22 1.50 0.54 -1.32 0.00 0.00 175.29 175.35 3l6t n ARG 71 N 4.60 1.98 -4.86 9.60 1.74 -1.26 -4.90 116.66 123.56 3l6t n ARG 71 Ca -0.03 -3.25 -0.33 0.00 -0.77 0.00 0.00 57.85 53.48 3l6t n ARG 71 Cb 0.41 -1.88 -0.14 0.00 -1.02 0.00 0.00 32.46 29.83 3l6t n ARG 71 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3l6t s HIS 72 N -3.30 2.74 -0.38 -1.55 3.76 -1.26 -4.74 115.29 110.56 3l6t s HIS 72 Ca 0.47 -0.46 0.10 0.00 -0.15 0.00 0.00 55.06 55.03 3l6t s HIS 72 Cb 0.42 -1.74 0.31 0.00 1.11 0.00 0.00 32.58 32.68 3l6t s HIS 72 CO 0.00 -0.05 0.65 1.55 -0.85 0.00 0.00 174.74 176.04 3l6t n VAL 73 N 2.99 -0.37 0.00 -0.90 3.14 -1.26 -5.09 118.33 116.85 3l6t n VAL 73 Ca -0.18 -4.37 0.00 0.00 -2.96 0.00 0.00 64.34 56.83 3l6t n VAL 73 Cb 0.52 -0.90 0.00 0.00 -1.06 0.00 0.00 33.84 32.40 3l6t n VAL 73 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3l6t n GLY 74 N 0.71 0.45 3.71 7.55 0.00 -1.26 -5.08 105.19 111.26 3l6t n GLY 74 Ca 0.24 -1.22 -0.43 0.00 0.00 0.00 0.00 46.02 44.61 3l6t n GLY 74 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3l6t n ASP 75 N 0.00 3.70 0.20 1.61 3.85 -1.26 -4.89 116.55 119.75 3l6t n ASP 75 Ca 0.00 1.08 0.06 0.00 -0.71 0.00 0.00 54.79 55.22 3l6t n ASP 75 Cb 0.00 -1.53 0.41 0.00 -1.35 0.00 0.00 41.12 38.64 3l6t n ASP 75 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3l6t h ALA 76 N 6.16 1.16 -0.00 2.12 0.00 -2.01 -2.70 119.26 123.99 3l6t h ALA 76 Ca -0.44 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.16 3l6t h ALA 76 Cb 1.22 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3l6t h ALA 76 CO 0.91 0.42 -0.04 0.36 0.00 0.00 0.00 179.25 180.90 3l6t n LYS 77 N -3.73 0.11 0.00 0.00 2.85 -1.26 -3.24 118.16 112.88 3l6t n LYS 77 Ca -0.01 -0.01 0.14 0.00 -1.05 0.00 0.00 58.31 57.38 3l6t n LYS 77 Cb 0.43 -1.50 0.45 0.00 -0.65 0.00 0.00 35.03 33.76 3l6t n LYS 77 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 3l6t n LYS 78 N -1.44 1.68 -1.71 -1.58 4.76 -1.02 -3.46 118.16 115.39 3l6t n LYS 78 Ca 0.09 -1.06 -0.42 0.00 -2.87 0.00 0.00 58.31 54.04 3l6t n LYS 78 Cb 0.32 -1.48 -0.03 0.00 -1.84 0.00 0.00 35.03 32.00 3l6t n LYS 78 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 3l6t n GLU 79 N 0.27 2.78 -2.96 1.97 2.13 -1.20 -4.90 120.64 118.73 3l6t n GLU 79 Ca 0.18 1.00 -0.40 0.00 0.66 0.00 0.00 57.16 58.60 3l6t n GLU 79 Cb 0.39 -2.87 -0.04 0.00 0.27 0.00 0.00 31.44 29.19 3l6t n GLU 79 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3l6t s ARG 80 N 1.66 4.46 -0.08 5.31 0.52 -1.26 -3.28 118.95 126.28 3l6t s ARG 80 Ca 0.77 1.01 0.20 0.00 -0.52 0.00 0.00 55.73 57.20 3l6t s ARG 80 Cb -0.50 -3.45 -0.29 0.00 0.52 0.00 0.00 34.95 31.23 3l6t s ARG 80 CO 0.34 0.03 0.36 1.28 0.02 0.00 0.00 175.30 177.33 3l6t n LEU 81 N 3.83 0.07 0.00 2.53 4.77 0.13 -4.79 117.00 123.54 3l6t n LEU 81 Ca 0.01 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 3l6t n LEU 81 Cb 0.51 0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.79 3l6t n LEU 81 CO 0.48 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 3l6t n GLY 82 N 1.45 -1.08 2.71 -0.72 0.00 -1.17 -2.26 105.19 104.11 3l6t n GLY 82 Ca -0.15 -1.16 -0.22 0.00 0.00 0.00 0.00 46.02 44.49 3l6t n GLY 82 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3l6t s TYR 83 N -3.00 0.36 -0.54 1.61 2.02 0.03 -0.30 117.35 117.53 3l6t s TYR 83 Ca 0.00 -0.01 -0.24 0.00 -0.37 0.00 0.00 57.07 56.45 3l6t s TYR 83 Cb 0.00 -0.65 0.04 0.00 -0.40 0.00 0.00 41.96 40.95 3l6t s TYR 83 CO 0.00 -0.29 0.92 0.34 -1.57 0.00 0.00 175.55 174.95 3l6t s ASP 84 N 2.07 6.35 -0.63 2.29 -1.08 -0.05 -0.46 116.67 125.16 3l6t s ASP 84 Ca 0.04 -0.35 -0.22 0.00 -0.52 0.00 0.00 52.55 51.51 3l6t s ASP 84 Cb -0.13 -2.43 0.07 0.00 -1.46 0.00 0.00 42.92 38.98 3l6t s ASP 84 CO -0.05 -1.19 0.89 -0.76 0.52 0.00 0.00 175.17 174.58 3l6t s LEU 85 N 3.85 4.62 -0.36 -1.34 1.02 -0.53 -1.43 118.68 124.51 3l6t s LEU 85 Ca 0.30 -1.04 -0.15 0.00 0.02 0.00 0.00 54.13 53.26 3l6t s LEU 85 Cb -0.13 -2.42 -0.01 0.00 0.02 0.00 0.00 46.19 43.65 3l6t s LEU 85 CO 0.19 -1.33 0.34 -0.89 0.02 0.00 0.00 176.35 174.69 3l6t s THR 86 N 3.68 5.19 -0.30 5.49 2.01 0.11 -0.81 115.64 131.00 3l6t s THR 86 Ca 0.20 -0.13 -0.13 0.00 0.31 0.00 0.00 61.69 61.94 3l6t s THR 86 Cb -0.18 -3.84 -0.04 0.00 0.01 0.00 0.00 72.50 68.45 3l6t s THR 86 CO 0.10 -0.15 0.27 -0.36 -0.69 0.00 0.00 174.62 173.79 3l6t s PHE 87 N 1.95 3.23 -0.14 4.92 0.08 -0.56 -1.51 117.98 125.93 3l6t s PHE 87 Ca 0.10 0.10 -0.03 0.00 0.12 0.00 0.00 56.93 57.22 3l6t s PHE 87 Cb -0.17 -2.48 -0.02 0.00 -0.57 0.00 0.00 43.02 39.77 3l6t s PHE 87 CO 0.12 -0.25 -0.06 -1.12 -0.10 0.00 0.00 175.22 173.80 3l6t s SER 88 N 1.72 4.61 0.63 1.36 0.01 -0.03 -1.44 113.70 120.56 3l6t s SER 88 Ca 0.09 -0.17 -0.16 0.00 1.31 0.00 0.00 55.95 57.02 3l6t s SER 88 Cb -0.16 -1.71 -0.02 0.00 0.21 0.00 0.00 66.02 64.34 3l6t s SER 88 CO 0.11 0.18 1.13 0.00 0.41 0.00 0.00 173.24 175.06 3l6t s ALA 89 N 0.29 2.52 0.91 1.44 0.00 -0.23 -4.56 121.76 122.13 3l6t s ALA 89 Ca -0.05 0.67 -0.13 0.00 0.00 0.00 0.00 51.96 52.45 3l6t s ALA 89 Cb -0.14 -3.34 0.05 0.00 0.00 0.00 0.00 23.12 19.68 3l6t s ALA 89 CO 0.04 -1.15 0.59 -2.30 0.00 0.00 0.00 175.76 172.94 3l6t n PRO 90 N -2.07 -0.22 0.08 0.00 -0.02 -1.26 -4.69 135.00 126.82 3l6t n PRO 90 Ca 0.11 -0.01 -0.13 0.00 -2.02 0.00 0.00 63.50 61.45 3l6t n PRO 90 Cb 0.51 -1.98 -0.06 0.00 -0.02 0.00 0.00 33.50 31.96 3l6t n PRO 90 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3l6t h LYS 91 N -1.44 -0.49 -0.54 -0.52 3.64 -1.90 0.05 116.57 115.37 3l6t h LYS 91 Ca -0.44 0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 58.89 3l6t h LYS 91 Cb 1.29 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 33.20 3l6t h LYS 91 CO 0.37 -0.33 0.00 0.78 -2.27 0.00 0.00 179.45 178.01 3l6t h GLY 92 N -0.51 0.99 0.99 5.01 0.00 -1.72 -0.13 103.07 107.69 3l6t h GLY 92 Ca 0.05 -0.69 0.01 0.00 0.00 0.00 0.00 47.33 46.70 3l6t h GLY 92 CO -0.24 0.63 0.27 -2.08 0.00 0.00 0.00 176.54 175.12 3l6t h VAL 93 N 0.85 1.10 -0.67 4.60 2.07 -1.83 -1.45 116.25 120.92 3l6t h VAL 93 Ca 0.16 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.45 3l6t h VAL 93 Cb 0.50 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 3l6t h VAL 93 CO 0.02 0.10 0.26 0.28 0.02 0.00 0.00 177.57 178.26 3l6t h SER 94 N 0.54 0.93 -0.59 0.57 0.02 -0.26 -1.37 113.55 113.39 3l6t h SER 94 Ca 0.15 -0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 60.91 3l6t h SER 94 Cb -0.06 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.22 3l6t h SER 94 CO -0.04 0.85 0.30 -0.03 -1.14 0.00 0.00 176.83 176.77 3l6t h MET 95 N 0.95 0.84 -0.51 3.45 -1.53 -0.85 0.35 114.93 117.62 3l6t h MET 95 Ca 0.22 -0.11 -0.03 0.00 -3.44 0.00 0.00 59.70 56.34 3l6t h MET 95 Cb 0.22 -0.16 -0.02 0.00 -0.55 0.00 0.00 31.60 31.09 3l6t h MET 95 CO -0.02 0.66 0.20 0.37 0.14 0.00 0.00 176.91 178.27 3l6t h GLN 96 N 0.80 0.77 -0.07 0.39 5.75 -1.05 0.18 115.11 121.87 3l6t h GLN 96 Ca 0.20 -0.14 -0.01 0.00 -0.15 0.00 0.00 58.65 58.55 3l6t h GLN 96 Cb 0.09 -0.12 -0.00 0.00 1.07 0.00 0.00 27.48 28.51 3l6t h GLN 96 CO -0.03 0.69 0.01 0.00 -2.65 0.00 0.00 178.83 176.84 3l6t h ALA 97 N 1.05 0.10 0.02 3.38 0.00 -0.95 -2.07 119.26 120.79 3l6t h ALA 97 Ca 0.17 -0.16 -0.37 0.00 0.00 0.00 0.00 54.91 54.55 3l6t h ALA 97 Cb 0.21 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 3l6t h ALA 97 CO -0.01 -0.24 -2.28 1.28 0.00 0.00 0.00 179.25 178.00 3l6t n LEU 98 N -4.87 1.80 0.04 0.00 4.77 0.12 -2.58 117.00 116.28 3l6t n LEU 98 Ca -0.07 0.03 -0.22 0.00 -0.03 0.00 0.00 56.01 55.72 3l6t n LEU 98 Cb 0.18 -0.41 -0.14 0.00 -2.33 0.00 0.00 43.42 40.71 3l6t n LEU 98 CO 0.34 0.73 -0.49 0.40 -1.33 0.00 0.00 177.39 177.05 3l6t h ILE 99 N 0.01 0.97 -0.01 -0.08 1.08 -0.82 -3.35 117.51 115.31 3l6t h ILE 99 Ca -0.51 -2.45 0.00 0.00 -0.39 0.00 0.00 64.86 61.52 3l6t h ILE 99 Cb 2.04 2.73 0.00 0.00 -3.07 0.00 0.00 36.82 38.52 3l6t h ILE 99 CO -0.00 0.78 -0.24 1.41 -0.69 0.00 0.00 178.15 179.41 3l6t n HIS 100 N -3.76 0.00 -3.01 1.37 8.25 -0.85 -4.96 115.22 112.27 3l6t n HIS 100 Ca -0.25 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.02 3l6t n HIS 100 Cb 0.98 -0.09 0.04 0.00 1.12 0.00 0.00 29.99 32.04 3l6t n HIS 100 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3l6t n GLY 101 N 1.32 -0.29 3.55 -1.41 0.00 -1.07 -4.95 105.19 102.35 3l6t n GLY 101 Ca 0.13 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 3l6t n GLY 101 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3l6t s ASP 102 N -2.89 6.40 0.51 1.61 -1.08 -0.80 -4.90 116.67 115.53 3l6t s ASP 102 Ca 0.31 -0.10 0.30 0.00 -0.52 0.00 0.00 52.55 52.53 3l6t s ASP 102 Cb -0.14 -2.49 1.27 0.00 -1.46 0.00 0.00 42.92 40.10 3l6t s ASP 102 CO 0.38 -1.33 1.96 0.11 0.52 0.00 0.00 175.17 176.81 3l6t h LYS 103 N 9.40 0.00 -0.71 4.34 1.79 -1.90 -2.74 116.57 126.75 3l6t h LYS 103 Ca -0.25 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.20 3l6t h LYS 103 Cb 1.07 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.68 3l6t h LYS 103 CO 1.13 0.11 0.39 1.15 -1.08 0.00 0.00 179.45 181.14 3l6t h THR 104 N 0.00 1.22 -0.15 -0.16 2.02 -1.98 -2.09 112.91 111.77 3l6t h THR 104 Ca -0.00 -0.54 -0.14 0.00 0.77 0.00 0.00 66.41 66.50 3l6t h THR 104 Cb 0.55 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 3l6t h THR 104 CO 0.01 0.24 -0.49 -0.29 0.37 0.00 0.00 175.52 175.36 3l6t h ILE 105 N 0.97 1.33 -0.41 3.11 -0.00 -1.88 -0.70 117.51 119.93 3l6t h ILE 105 Ca 0.25 -1.72 0.00 0.00 -0.00 0.00 0.00 64.86 63.40 3l6t h ILE 105 Cb 0.03 1.76 -0.02 0.00 -0.00 0.00 0.00 36.82 38.59 3l6t h ILE 105 CO -0.04 0.52 0.26 0.40 -0.00 0.00 0.00 178.15 179.30 3l6t h ILE 106 N 0.31 1.11 -0.55 2.19 1.08 -1.51 0.28 117.51 120.42 3l6t h ILE 106 Ca 0.02 -0.21 0.00 0.00 -0.39 0.00 0.00 64.86 64.28 3l6t h ILE 106 Cb 0.98 0.52 -0.03 0.00 -3.07 0.00 0.00 36.82 35.22 3l6t h ILE 106 CO 0.08 0.11 0.35 -0.08 -0.69 0.00 0.00 178.15 177.92 3l6t h GLU 107 N 0.55 0.74 -0.45 2.37 4.81 -1.05 -1.48 114.58 120.06 3l6t h GLU 107 Ca 0.15 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 3l6t h GLU 107 Cb -0.05 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.14 3l6t h GLU 107 CO -0.03 0.51 0.27 0.00 -0.73 0.00 0.00 179.01 179.02 3l6t h ALA 108 N 1.19 0.58 -0.57 2.92 0.00 -0.79 -1.13 119.26 121.45 3l6t h ALA 108 Ca 0.20 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.07 3l6t h ALA 108 Cb -0.06 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 3l6t h ALA 108 CO -0.04 0.07 0.35 1.25 0.00 0.00 0.00 179.25 180.88 3l6t h HIS 109 N 0.60 0.66 -0.62 0.00 -0.00 -0.74 -1.02 115.15 114.02 3l6t h HIS 109 Ca 0.16 0.02 -0.07 0.00 -0.00 0.00 0.00 60.37 60.48 3l6t h HIS 109 Cb 0.01 -0.21 -0.03 0.00 -0.00 0.00 0.00 27.41 27.17 3l6t h HIS 109 CO -0.03 0.38 0.12 0.93 -0.00 0.00 0.00 177.93 179.33 3l6t h GLU 110 N 0.70 0.99 -0.64 5.26 5.08 -1.01 -0.68 114.58 124.29 3l6t h GLU 110 Ca 0.23 -0.24 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 3l6t h GLU 110 Cb 0.00 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 3l6t h GLU 110 CO -0.09 0.90 0.12 0.87 -1.00 0.00 0.00 179.01 179.82 3l6t h LYS 111 N 0.94 1.02 -0.43 2.33 1.57 -0.92 -0.74 116.57 120.34 3l6t h LYS 111 Ca 0.19 -0.25 -0.06 0.00 -1.87 0.00 0.00 60.65 58.66 3l6t h LYS 111 Cb 0.38 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 3l6t h LYS 111 CO 0.01 0.93 0.02 0.00 -0.57 0.00 0.00 179.45 179.83 3l6t h ALA 112 N 1.16 0.58 -0.25 3.86 0.00 -0.74 -0.64 119.26 123.24 3l6t h ALA 112 Ca 0.20 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.86 3l6t h ALA 112 Cb 0.39 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 3l6t h ALA 112 CO 0.01 0.35 0.15 0.28 0.00 0.00 0.00 179.25 180.04 3l6t h VAL 113 N 0.59 1.04 -0.83 0.00 2.07 -1.00 -1.75 116.25 116.37 3l6t h VAL 113 Ca 0.12 -0.11 0.04 0.00 0.82 0.00 0.00 66.70 67.58 3l6t h VAL 113 Cb 0.46 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 3l6t h VAL 113 CO 0.02 0.06 0.53 0.00 0.02 0.00 0.00 177.57 178.19 3l6t h ALA 114 N 1.10 1.10 -0.43 1.67 0.00 -0.90 0.15 119.26 121.95 3l6t h ALA 114 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3l6t h ALA 114 Cb -0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3l6t h ALA 114 CO -0.04 0.33 0.27 0.00 0.00 0.00 0.00 179.25 179.82 3l6t h ALA 115 N 1.35 0.55 -0.71 0.00 0.00 -0.97 -0.70 119.26 118.77 3l6t h ALA 115 Ca 0.34 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.15 3l6t h ALA 115 Cb 0.04 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3l6t h ALA 115 CO -0.13 0.02 0.25 0.00 0.00 0.00 0.00 179.25 179.39 3l6t h ALA 116 N 1.14 1.09 -0.57 0.00 0.00 -0.69 -1.40 119.26 118.83 3l6t h ALA 116 Ca 0.16 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3l6t h ALA 116 Cb -0.03 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 3l6t h ALA 116 CO -0.03 0.63 0.33 0.28 0.00 0.00 0.00 179.25 180.46 3l6t h VAL 117 N 1.05 1.18 -0.29 0.00 2.07 -0.47 0.47 116.25 120.26 3l6t h VAL 117 Ca 0.23 -0.43 0.07 0.00 0.82 0.00 0.00 66.70 67.40 3l6t h VAL 117 Cb 0.26 0.43 -0.08 0.00 -1.52 0.00 0.00 31.29 30.38 3l6t h VAL 117 CO -0.01 0.19 -0.28 0.03 0.02 0.00 0.00 177.57 177.52 3l6t h ARG 118 N 0.77 -0.26 -0.81 1.57 3.08 -0.70 -1.81 114.38 116.22 3l6t h ARG 118 Ca 0.20 0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.31 3l6t h ARG 118 Cb 0.01 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.07 3l6t h ARG 118 CO -0.04 -0.17 0.51 0.93 -1.07 0.00 0.00 179.97 180.14 3l6t h GLU 119 N -0.27 0.95 -0.49 0.04 4.39 -0.75 -1.48 114.58 116.97 3l6t h GLU 119 Ca 0.15 -0.06 0.03 0.00 0.34 0.00 0.00 59.36 59.82 3l6t h GLU 119 Cb 0.50 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 28.91 3l6t h GLU 119 CO -0.44 0.63 0.33 0.00 -1.16 0.00 0.00 179.01 178.37 3l6t h ALA 120 N 1.36 1.77 0.00 3.43 0.00 -0.27 -1.86 119.26 123.67 3l6t h ALA 120 Ca 0.34 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 3l6t h ALA 120 Cb 0.06 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3l6t h ALA 120 CO -0.13 0.18 -0.18 0.93 0.00 0.00 0.00 179.25 180.04 3l6t h GLU 121 N 0.56 0.00 0.00 0.00 5.08 -0.45 -0.09 114.58 119.68 3l6t h GLU 121 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 3l6t h GLU 121 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 3l6t h GLU 121 CO -0.05 0.18 0.00 0.87 -1.00 0.00 0.00 179.01 179.01 3l6t h LYS 122 N 0.00 0.00 -0.04 2.33 1.57 -1.32 -2.25 116.57 116.86 3l6t h LYS 122 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3l6t h LYS 122 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 3l6t h LYS 122 CO 0.02 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.18 3l6t n LEU 123 N -2.86 2.79 -4.74 2.94 4.77 -0.05 -4.85 117.00 115.01 3l6t n LEU 123 Ca -0.02 -0.94 -0.41 0.00 -0.03 0.00 0.00 56.01 54.61 3l6t n LEU 123 Cb 0.12 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.18 3l6t n LEU 123 CO 0.20 0.47 1.05 0.00 -1.33 0.00 0.00 177.39 177.78 3l6t s ALA 124 N -1.98 3.58 0.04 -1.18 0.00 -0.85 -4.40 121.76 116.98 3l6t s ALA 124 Ca 0.30 1.21 -0.08 0.00 0.00 0.00 0.00 51.96 53.38 3l6t s ALA 124 Cb 0.20 -3.52 -0.00 0.00 0.00 0.00 0.00 23.12 19.80 3l6t s ALA 124 CO 0.31 -0.63 0.16 -0.65 0.00 0.00 0.00 175.76 174.94 3l6t s GLN 125 N -0.04 0.68 0.02 0.00 -0.21 -1.26 -2.38 119.66 116.47 3l6t s GLN 125 Ca 0.59 -0.71 -0.01 0.00 0.02 0.00 0.00 55.36 55.26 3l6t s GLN 125 Cb -0.39 0.27 -0.02 0.00 1.00 0.00 0.00 33.01 33.88 3l6t s GLN 125 CO 0.39 -0.19 -0.02 0.00 -2.12 0.00 0.00 175.29 173.35 3l6t s ALA 126 N -2.73 0.12 0.24 6.09 0.00 -0.53 -0.89 121.76 124.05 3l6t s ALA 126 Ca -0.04 -0.61 -0.23 0.00 0.00 0.00 0.00 51.96 51.08 3l6t s ALA 126 Cb -0.00 0.16 -0.09 0.00 0.00 0.00 0.00 23.12 23.19 3l6t s ALA 126 CO -0.05 -0.18 0.80 1.03 0.00 0.00 0.00 175.76 177.36 3l6t s ARG 127 N -1.67 4.43 0.15 0.00 0.52 -1.26 -0.75 118.95 120.37 3l6t s ARG 127 Ca -0.14 1.08 0.00 0.00 -0.52 0.00 0.00 55.73 56.15 3l6t s ARG 127 Cb -0.08 -2.95 -0.04 0.00 0.52 0.00 0.00 34.95 32.39 3l6t s ARG 127 CO -0.02 0.41 0.03 0.95 0.02 0.00 0.00 175.30 176.69 3l6t s THR 128 N -1.46 0.41 -0.23 0.02 -4.23 0.18 -4.91 115.64 105.43 3l6t s THR 128 Ca 0.43 -1.94 0.02 0.00 -1.18 0.00 0.00 61.69 59.02 3l6t s THR 128 Cb -0.19 -2.08 0.05 0.00 1.34 0.00 0.00 72.50 71.62 3l6t s THR 128 CO 0.23 -0.48 -0.13 -0.89 -0.54 0.00 0.00 174.62 172.81 3l6t s THR 129 N -3.84 2.05 -0.00 3.99 2.01 -1.26 -0.16 115.64 118.43 3l6t s THR 129 Ca 0.24 -1.36 0.00 0.00 0.31 0.00 0.00 61.69 60.87 3l6t s THR 129 Cb 0.07 -2.08 -0.00 0.00 0.01 0.00 0.00 72.50 70.49 3l6t s THR 129 CO 0.03 0.14 0.04 0.54 -0.69 0.00 0.00 174.62 174.68 3l6t n ARG 130 N 4.52 6.36 -0.92 4.92 3.00 -1.26 -4.99 116.66 128.29 3l6t n ARG 130 Ca -0.16 -0.04 0.00 0.00 -0.01 0.00 0.00 57.85 57.64 3l6t n ARG 130 Cb 0.45 -0.54 0.00 0.00 0.00 0.00 0.00 32.46 32.37 3l6t n ARG 130 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 3l6t n LYS 133 N -0.92 -1.49 -2.63 5.56 0.00 -1.26 -5.11 118.16 112.31 3l6t n LYS 133 Ca 0.00 1.42 -0.42 0.00 0.00 0.00 0.00 58.31 59.31 3l6t n LYS 133 Cb 0.00 -1.13 -0.03 0.00 0.00 0.00 0.00 35.03 33.87 3l6t n LYS 133 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 3l6t s SER 134 N -0.14 7.26 -0.06 3.14 0.15 -1.26 -4.97 113.70 117.83 3l6t s SER 134 Ca 0.00 1.72 0.02 0.00 0.70 0.00 0.00 55.95 58.39 3l6t s SER 134 Cb 0.00 -2.57 0.02 0.00 -1.71 0.00 0.00 66.02 61.76 3l6t s SER 134 CO 0.00 -0.36 -0.09 -0.69 1.20 0.00 0.00 173.24 173.30 3l6t s VAL 135 N 1.31 0.90 -0.24 4.45 1.01 0.77 -4.97 120.40 123.64 3l6t s VAL 135 Ca 0.53 -0.33 -0.19 0.00 0.00 0.00 0.00 61.98 61.99 3l6t s VAL 135 Cb -0.22 -0.86 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 3l6t s VAL 135 CO 0.26 0.31 0.55 -0.89 0.00 0.00 0.00 175.10 175.32 3l6t s THR 136 N 0.84 5.06 -0.20 3.92 2.01 -1.26 0.49 115.64 126.50 3l6t s THR 136 Ca -0.12 0.97 -0.08 0.00 0.31 0.00 0.00 61.69 62.78 3l6t s THR 136 Cb -0.15 -3.86 -0.04 0.00 0.01 0.00 0.00 72.50 68.46 3l6t s THR 136 CO 0.02 0.10 0.08 -1.58 -0.69 0.00 0.00 174.62 172.54 3l6t s GLN 137 N 2.16 3.97 -0.24 4.92 0.74 0.07 -4.95 119.66 126.33 3l6t s GLN 137 Ca 0.23 -0.34 -0.29 0.00 0.05 0.00 0.00 55.36 55.01 3l6t s GLN 137 Cb -0.16 -3.27 -0.01 0.00 1.10 0.00 0.00 33.01 30.67 3l6t s GLN 137 CO 0.09 0.20 1.31 -0.80 -0.55 0.00 0.00 175.29 175.55 3l6t s ASN 138 N 0.57 6.76 -0.04 6.67 0.01 -1.26 -1.45 114.94 126.20 3l6t s ASN 138 Ca 0.04 1.44 0.16 0.00 -0.71 0.00 0.00 52.86 53.80 3l6t s ASN 138 Cb -0.13 -2.54 -0.25 0.00 0.41 0.00 0.00 41.25 38.74 3l6t s ASN 138 CO 0.01 -0.97 0.33 0.35 -1.51 0.00 0.00 177.10 175.32 3l6t n THR 139 N 5.89 0.12 -3.14 1.60 -2.24 -1.00 -5.00 114.28 110.51 3l6t n THR 139 Ca 0.15 -0.41 -0.21 0.00 -2.27 0.00 0.00 64.05 61.30 3l6t n THR 139 Cb 0.46 0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 3l6t n THR 139 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3l6t n ASN 140 N -2.14 -4.14 -3.75 3.42 2.85 -1.25 -4.95 115.26 105.31 3l6t n ASN 140 Ca -0.06 -0.26 -0.13 0.00 -0.11 0.00 0.00 54.58 54.03 3l6t n ASN 140 Cb 0.50 -3.43 -0.13 0.00 1.24 0.00 0.00 39.78 37.97 3l6t n ASN 140 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 3l6t s ASN 141 N -2.59 -0.24 0.20 1.20 2.20 -1.26 -4.81 114.94 109.64 3l6t s ASN 141 Ca 0.31 0.48 0.08 0.00 -0.94 0.00 0.00 52.86 52.80 3l6t s ASN 141 Cb -0.16 0.41 -0.05 0.00 -2.00 0.00 0.00 41.25 39.45 3l6t s ASN 141 CO 0.38 -0.14 -0.16 -0.76 -2.94 0.00 0.00 177.10 173.48 3l6t s LEU 142 N 0.90 2.53 -0.23 3.54 1.43 -1.26 -4.55 118.68 121.03 3l6t s LEU 142 Ca -0.06 -0.98 -0.03 0.00 -1.03 0.00 0.00 54.13 52.03 3l6t s LEU 142 Cb -0.08 -0.76 0.01 0.00 0.03 0.00 0.00 46.19 45.39 3l6t s LEU 142 CO -0.06 -0.11 -0.05 -0.69 0.23 0.00 0.00 176.35 175.68 3l6t s VAL 143 N -2.66 3.18 -0.06 -1.59 1.01 -1.26 -0.63 120.40 118.37 3l6t s VAL 143 Ca 0.21 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.49 3l6t s VAL 143 Cb -0.03 -2.52 0.02 0.00 0.00 0.00 0.00 36.38 33.85 3l6t s VAL 143 CO 0.08 0.32 -0.11 -0.69 0.00 0.00 0.00 175.10 174.70 3l6t s VAL 144 N 1.42 1.02 -0.21 2.92 1.01 -0.48 -0.75 120.40 125.32 3l6t s VAL 144 Ca 0.04 -0.40 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 3l6t s VAL 144 Cb -0.15 -0.95 -0.01 0.00 0.00 0.00 0.00 36.38 35.27 3l6t s VAL 144 CO -0.04 0.33 -0.05 0.00 0.00 0.00 0.00 175.10 175.34 3l6t s ALA 145 N 0.75 2.79 -0.05 5.51 0.00 -0.40 -0.19 121.76 130.17 3l6t s ALA 145 Ca -0.13 -1.13 -0.02 0.00 0.00 0.00 0.00 51.96 50.68 3l6t s ALA 145 Cb -0.15 -1.64 -0.04 0.00 0.00 0.00 0.00 23.12 21.29 3l6t s ALA 145 CO 0.03 -0.35 0.06 0.95 0.00 0.00 0.00 175.76 176.45 3l6t s THR 146 N 1.34 4.69 -0.12 0.00 -4.23 0.44 -0.31 115.64 117.45 3l6t s THR 146 Ca 0.04 -0.25 -0.01 0.00 -1.18 0.00 0.00 61.69 60.29 3l6t s THR 146 Cb -0.14 -3.07 0.03 0.00 1.34 0.00 0.00 72.50 70.66 3l6t s THR 146 CO -0.03 0.49 -0.04 -0.36 -0.54 0.00 0.00 174.62 174.14 3l6t s PHE 147 N -1.05 1.31 -0.05 3.99 0.08 0.27 -2.03 117.98 120.50 3l6t s PHE 147 Ca 0.18 -0.70 -0.22 0.00 0.12 0.00 0.00 56.93 56.31 3l6t s PHE 147 Cb -0.12 -1.13 -0.04 0.00 -0.57 0.00 0.00 43.02 41.16 3l6t s PHE 147 CO 0.08 -0.50 0.64 0.50 -0.10 0.00 0.00 175.22 175.84 3l6t s ARG 148 N 1.76 4.40 -0.17 0.44 3.52 0.13 -0.34 118.95 128.69 3l6t s ARG 148 Ca 0.03 0.78 -0.02 0.00 -0.13 0.00 0.00 55.73 56.40 3l6t s ARG 148 Cb -0.14 -3.41 -0.01 0.00 -1.56 0.00 0.00 34.95 29.83 3l6t s ARG 148 CO -0.07 0.17 -0.09 -1.01 -0.81 0.00 0.00 175.30 173.49 3l6t s HIS 149 N 0.47 2.89 -0.52 5.12 3.76 0.32 -4.93 115.29 122.40 3l6t s HIS 149 Ca 0.34 -0.72 -0.00 0.00 -0.15 0.00 0.00 55.06 54.52 3l6t s HIS 149 Cb -0.18 -1.95 0.14 0.00 1.11 0.00 0.00 32.58 31.70 3l6t s HIS 149 CO 0.17 -0.32 0.30 -1.21 -0.85 0.00 0.00 174.74 172.83 3l6t s GLU 150 N 0.77 2.18 -1.05 1.40 2.02 -1.26 -2.33 118.70 120.42 3l6t s GLU 150 Ca -0.04 -2.33 -0.19 0.00 0.02 0.00 0.00 54.97 52.43 3l6t s GLU 150 Cb -0.15 -3.54 0.10 0.00 0.10 0.00 0.00 34.13 30.64 3l6t s GLU 150 CO 0.02 -1.11 1.37 0.99 0.02 0.00 0.00 175.26 176.54 3l6t s THR 151 N 0.24 4.41 -0.94 3.63 2.01 -0.76 -4.89 115.64 119.34 3l6t s THR 151 Ca 0.14 -1.49 -0.04 0.00 0.31 0.00 0.00 61.69 60.61 3l6t s THR 151 Cb -0.22 -4.96 0.12 0.00 0.01 0.00 0.00 72.50 67.45 3l6t s THR 151 CO -0.03 -1.75 2.49 -1.20 -0.69 0.00 0.00 174.62 173.44 3l6t n SER 152 N 7.49 7.36 -4.86 3.53 7.64 -1.26 -2.10 113.62 131.42 3l6t n SER 152 Ca 0.32 -3.23 -0.36 0.00 1.01 0.00 0.00 58.87 56.61 3l6t n SER 152 Cb 0.48 -1.29 -0.06 0.00 -1.01 0.00 0.00 64.21 62.34 3l6t n SER 152 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3l6t s ARG 153 N -1.71 3.77 0.49 1.43 1.70 -1.26 -4.97 118.95 118.40 3l6t s ARG 153 Ca 0.55 0.21 0.14 0.00 -0.47 0.00 0.00 55.73 56.16 3l6t s ARG 153 Cb 0.27 -3.12 1.16 0.00 -0.57 0.00 0.00 34.95 32.69 3l6t s ARG 153 CO -0.16 0.65 2.10 0.00 -1.08 0.00 0.00 175.30 176.80 3l6t h ALA 154 N 4.29 1.98 -1.92 7.88 0.00 -1.99 -3.13 119.26 126.38 3l6t h ALA 154 Ca -0.51 -0.01 -0.68 0.00 0.00 0.00 0.00 54.91 53.71 3l6t h ALA 154 Cb 1.21 -0.05 -0.18 0.00 0.00 0.00 0.00 17.79 18.78 3l6t h ALA 154 CO 0.63 -0.01 0.62 -1.17 0.00 0.00 0.00 179.25 179.32 3l6t s LEU 155 N -9.17 5.05 -0.31 0.00 1.98 -1.26 -4.55 118.68 110.41 3l6t s LEU 155 Ca -0.06 -1.76 -0.01 0.00 -2.89 0.00 0.00 54.13 49.42 3l6t s LEU 155 Cb 0.18 -2.38 -0.01 0.00 0.66 0.00 0.00 46.19 44.64 3l6t s LEU 155 CO 0.70 -1.13 0.29 -0.67 -1.89 0.00 0.00 176.35 173.65 3l6t n ASP 156 N 6.63 -4.05 -4.71 3.68 2.03 -1.25 -4.98 116.55 113.90 3l6t n ASP 156 Ca 0.12 -0.10 -0.42 0.00 0.52 0.00 0.00 54.79 54.92 3l6t n ASP 156 Cb 0.47 -2.51 -0.00 0.00 -0.72 0.00 0.00 41.12 38.36 3l6t n ASP 156 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 3l6t n PRO 157 N -1.55 2.14 -3.65 -0.67 -0.02 -1.18 -4.80 135.00 125.28 3l6t n PRO 157 Ca -0.01 0.75 -0.27 0.00 -2.02 0.00 0.00 63.50 61.95 3l6t n PRO 157 Cb 0.51 -2.39 -0.16 0.00 -0.02 0.00 0.00 33.50 31.44 3l6t n PRO 157 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3l6t s ASP 158 N -0.35 2.80 -0.23 2.55 -1.08 -0.89 -4.61 116.67 114.85 3l6t s ASP 158 Ca 0.57 -0.84 -0.12 0.00 -0.52 0.00 0.00 52.55 51.64 3l6t s ASP 158 Cb -0.54 -0.42 -0.05 0.00 -1.46 0.00 0.00 42.92 40.46 3l6t s ASP 158 CO 0.61 -0.35 0.23 -0.22 0.52 0.00 0.00 175.17 175.97 3l6t s LEU 159 N 2.00 4.12 0.15 -1.34 2.96 -1.26 -1.82 118.68 123.49 3l6t s LEU 159 Ca 0.02 0.22 -0.16 0.00 -0.22 0.00 0.00 54.13 53.99 3l6t s LEU 159 Cb -0.16 -2.23 0.03 0.00 0.50 0.00 0.00 46.19 44.33 3l6t s LEU 159 CO -0.13 0.01 0.42 -1.38 -1.32 0.00 0.00 176.35 173.95 3l6t s HIS 160 N 1.21 -0.11 -0.06 5.38 -3.43 -0.98 -1.07 115.29 116.23 3l6t s HIS 160 Ca 0.11 -0.22 0.02 0.00 -0.80 0.00 0.00 55.06 54.17 3l6t s HIS 160 Cb -0.14 0.26 0.01 0.00 -1.43 0.00 0.00 32.58 31.28 3l6t s HIS 160 CO 0.06 -0.77 -0.12 0.99 -2.00 0.00 0.00 174.74 172.90 3l6t s THR 161 N -3.84 1.10 -0.37 -5.38 2.01 -0.52 -0.53 115.64 108.11 3l6t s THR 161 Ca 0.06 -0.47 -0.23 0.00 0.31 0.00 0.00 61.69 61.36 3l6t s THR 161 Cb 0.01 -1.00 0.01 0.00 0.01 0.00 0.00 72.50 71.53 3l6t s THR 161 CO -0.08 0.34 0.78 -1.00 -0.69 0.00 0.00 174.62 173.98 3l6t s HIS 162 N 0.60 3.10 -0.59 4.92 3.76 0.54 -1.50 115.29 126.13 3l6t s HIS 162 Ca -0.13 0.51 -0.14 0.00 -0.15 0.00 0.00 55.06 55.15 3l6t s HIS 162 Cb -0.15 -3.43 0.15 0.00 1.11 0.00 0.00 32.58 30.26 3l6t s HIS 162 CO 0.03 -0.76 0.52 0.00 -0.85 0.00 0.00 174.74 173.69 3l6t s ALA 163 N 3.11 3.69 -0.46 -1.40 0.00 0.00 -0.56 121.76 126.14 3l6t s ALA 163 Ca 0.31 -2.72 -0.25 0.00 0.00 0.00 0.00 51.96 49.29 3l6t s ALA 163 Cb -0.13 -3.21 0.03 0.00 0.00 0.00 0.00 23.12 19.80 3l6t s ALA 163 CO 0.17 -2.05 0.92 0.12 0.00 0.00 0.00 175.76 174.92 3l6t s PHE 164 N 1.20 2.92 -0.38 0.00 5.36 0.57 -1.45 117.98 126.20 3l6t s PHE 164 Ca 0.07 0.37 -0.24 0.00 -0.96 0.00 0.00 56.93 56.17 3l6t s PHE 164 Cb -0.25 -3.97 0.01 0.00 -0.34 0.00 0.00 43.02 38.48 3l6t s PHE 164 CO -0.00 -1.10 0.85 0.08 -1.46 0.00 0.00 175.22 173.59 3l6t s VAL 165 N 3.75 4.64 0.59 3.12 1.01 0.39 -1.28 120.40 132.62 3l6t s VAL 165 Ca 0.37 0.96 -0.20 0.00 0.00 0.00 0.00 61.98 63.11 3l6t s VAL 165 Cb -0.10 -4.29 -0.03 0.00 0.00 0.00 0.00 36.38 31.95 3l6t s VAL 165 CO 0.26 -0.54 1.27 -0.04 0.00 0.00 0.00 175.10 176.05 3l6t s MET 166 N 3.33 2.95 -1.43 2.72 1.00 0.07 -0.79 119.30 127.15 3l6t s MET 166 Ca 0.34 1.99 -0.12 0.00 0.00 0.00 0.00 55.69 57.90 3l6t s MET 166 Cb -0.12 -2.02 0.06 0.00 0.00 0.00 0.00 34.83 32.75 3l6t s MET 166 CO 0.19 -1.27 2.22 -1.71 0.00 0.00 0.00 175.02 174.45 3l6t n ASN 167 N -1.46 4.63 -3.47 3.03 5.15 -0.96 -4.70 115.26 117.47 3l6t n ASN 167 Ca 0.13 -2.88 -0.15 0.00 -0.60 0.00 0.00 54.58 51.08 3l6t n ASN 167 Cb 0.48 -1.61 -0.04 0.00 -0.53 0.00 0.00 39.78 38.08 3l6t n ASN 167 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3l6t s MET 168 N 2.40 1.17 -0.12 1.20 0.23 -1.26 -4.08 119.30 118.84 3l6t s MET 168 Ca 0.47 -0.14 -0.27 0.00 -1.03 0.00 0.00 55.69 54.73 3l6t s MET 168 Cb 0.14 0.54 0.06 0.00 -1.53 0.00 0.00 34.83 34.04 3l6t s MET 168 CO -0.07 -0.45 0.64 -0.08 -2.03 0.00 0.00 175.02 173.03 3l6t s THR 169 N -2.57 0.01 -0.19 3.16 -1.32 0.23 -4.43 115.64 110.53 3l6t s THR 169 Ca -0.05 -0.04 -0.23 0.00 -1.21 0.00 0.00 61.69 60.16 3l6t s THR 169 Cb -0.01 -0.94 -0.02 0.00 -1.51 0.00 0.00 72.50 70.03 3l6t s THR 169 CO -0.02 -0.02 0.73 -1.58 -2.21 0.00 0.00 174.62 171.51 3l6t s GLN 170 N -0.62 4.25 0.84 7.08 0.74 -1.26 -1.17 119.66 129.51 3l6t s GLN 170 Ca -0.07 0.81 -0.13 0.00 0.05 0.00 0.00 55.36 56.02 3l6t s GLN 170 Cb -0.02 -3.58 0.10 0.00 1.10 0.00 0.00 33.01 30.61 3l6t s GLN 170 CO 0.06 -0.29 1.20 1.03 -0.55 0.00 0.00 175.29 176.74 3l6t s ARG 171 N 2.06 1.72 0.38 1.67 0.52 0.59 -4.89 118.95 120.99 3l6t s ARG 171 Ca 0.33 0.04 0.09 0.00 -0.52 0.00 0.00 55.73 55.67 3l6t s ARG 171 Cb -0.16 -1.93 0.84 0.00 0.52 0.00 0.00 34.95 34.22 3l6t s ARG 171 CO 0.11 -1.76 1.94 1.49 0.02 0.00 0.00 175.30 177.10 3l6t h GLU 172 N -1.17 0.63 0.00 3.54 4.81 -1.95 -0.70 114.58 119.74 3l6t h GLU 172 Ca -0.46 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 3l6t h GLU 172 Cb 1.32 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.55 3l6t h GLU 172 CO 0.62 0.42 0.00 -0.40 -0.73 0.00 0.00 179.01 178.91 3l6t n ASP 173 N -4.49 0.00 0.00 1.04 5.75 -1.26 -4.84 116.55 112.75 3l6t n ASP 173 Ca 0.12 -1.64 0.00 0.00 -0.01 0.00 0.00 54.79 53.27 3l6t n ASP 173 Cb 0.33 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.42 3l6t n ASP 173 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3l6t n GLY 174 N 0.64 1.41 3.75 6.12 0.00 -0.27 -5.02 105.19 111.82 3l6t n GLY 174 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 3l6t n GLY 174 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3l6t s GLN 175 N -0.28 4.51 -0.13 1.61 -1.52 -1.26 -4.71 119.66 117.88 3l6t s GLN 175 Ca 0.00 1.09 -0.25 0.00 -1.95 0.00 0.00 55.36 54.25 3l6t s GLN 175 Cb 0.00 -3.34 -0.02 0.00 -0.22 0.00 0.00 33.01 29.42 3l6t s GLN 175 CO 0.00 0.34 0.80 -1.58 -0.25 0.00 0.00 175.29 174.60 3l6t s TRP 176 N -0.26 3.48 0.16 0.91 0.52 -1.26 -0.30 118.94 122.18 3l6t s TRP 176 Ca 0.38 1.27 0.01 0.00 0.02 0.00 0.00 56.10 57.79 3l6t s TRP 176 Cb -0.21 -2.96 -0.05 0.00 -1.15 0.00 0.00 33.47 29.11 3l6t s TRP 176 CO 0.24 -0.13 0.00 1.03 0.02 0.00 0.00 176.95 178.11 3l6t s ARG 177 N 1.70 1.07 0.52 4.98 1.81 -0.32 -4.93 118.95 123.78 3l6t s ARG 177 Ca 0.39 -1.51 -0.22 0.00 -1.72 0.00 0.00 55.73 52.66 3l6t s ARG 177 Cb -0.17 -0.21 -0.06 0.00 -0.45 0.00 0.00 34.95 34.06 3l6t s ARG 177 CO 0.15 -0.14 1.32 0.00 -0.68 0.00 0.00 175.30 175.95 3l6t s ALA 178 N -3.70 2.89 0.33 2.13 0.00 -1.26 -0.60 121.76 121.56 3l6t s ALA 178 Ca 0.23 1.25 -0.28 0.00 0.00 0.00 0.00 51.96 53.16 3l6t s ALA 178 Cb 0.06 -3.53 -0.10 0.00 0.00 0.00 0.00 23.12 19.56 3l6t s ALA 178 CO 0.03 -1.19 1.21 -1.17 0.00 0.00 0.00 175.76 174.65 3l6t s LEU 179 N -3.34 4.41 -0.57 0.00 2.96 -1.26 -4.62 118.68 116.26 3l6t s LEU 179 Ca 0.69 2.49 -0.21 0.00 -0.22 0.00 0.00 54.13 56.87 3l6t s LEU 179 Cb -0.38 -3.73 0.07 0.00 0.50 0.00 0.00 46.19 42.65 3l6t s LEU 179 CO 0.45 -0.45 0.81 -0.75 -1.32 0.00 0.00 176.35 175.09 3l6t s LYS 180 N -1.81 3.15 0.00 1.98 2.20 -0.07 -4.93 119.74 120.26 3l6t s LYS 180 Ca 0.49 -0.81 0.31 0.00 -0.36 0.00 0.00 55.97 55.60 3l6t s LYS 180 Cb -0.35 -4.15 1.77 0.00 -1.51 0.00 0.00 37.83 33.58 3l6t s LYS 180 CO 0.46 -1.51 2.14 0.27 -0.36 0.00 0.00 175.35 176.35 3l6t n ASN 181 N 6.93 0.00 -0.09 1.43 0.23 -1.26 -4.34 115.26 118.15 3l6t n ASN 181 Ca -0.04 -0.80 -0.08 0.00 -0.53 0.00 0.00 54.58 53.13 3l6t n ASN 181 Cb 0.45 -0.06 -0.02 0.00 -2.08 0.00 0.00 39.78 38.08 3l6t n ASN 181 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 3l6t h ASP 182 N 0.00 -0.98 -0.49 0.53 5.19 -1.93 0.06 116.42 118.79 3l6t h ASP 182 Ca 0.00 0.17 -0.03 0.00 -0.62 0.00 0.00 57.03 56.55 3l6t h ASP 182 Cb 0.05 0.46 -0.02 0.00 0.18 0.00 0.00 39.33 40.00 3l6t h ASP 182 CO 0.00 -0.31 0.19 -0.33 -3.12 0.00 0.00 179.24 175.67 3l6t h GLU 183 N -0.26 0.74 -0.08 3.56 4.39 -1.84 -2.34 114.58 118.75 3l6t h GLU 183 Ca 0.16 -0.14 0.03 0.00 0.34 0.00 0.00 59.36 59.75 3l6t h GLU 183 Cb 0.52 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.02 3l6t h GLU 183 CO -0.49 0.66 -0.11 1.25 -1.16 0.00 0.00 179.01 179.17 3l6t h LEU 184 N 0.66 -0.33 -1.03 1.33 6.46 -1.64 -2.94 115.31 117.82 3l6t h LEU 184 Ca 0.16 0.06 0.04 0.00 -0.12 0.00 0.00 57.88 58.03 3l6t h LEU 184 Cb 0.20 0.16 -0.06 0.00 -0.73 0.00 0.00 40.66 40.23 3l6t h LEU 184 CO -0.01 -0.15 0.65 0.24 -0.62 0.00 0.00 178.44 178.55 3l6t h MET 185 N -0.14 1.19 -0.03 1.25 2.86 -0.72 -1.74 114.93 117.60 3l6t h MET 185 Ca 0.07 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3l6t h MET 185 Cb 0.24 -0.27 0.00 0.00 0.06 0.00 0.00 31.60 31.63 3l6t h MET 185 CO -0.17 0.79 0.00 2.89 1.06 0.00 0.00 176.91 181.48 3l6t n ARG 186 N -4.45 1.25 -0.51 1.72 1.85 -0.91 -3.73 116.66 111.88 3l6t n ARG 186 Ca 0.14 -0.37 0.05 0.00 -1.00 0.00 0.00 57.85 56.67 3l6t n ARG 186 Cb 0.12 -1.41 0.22 0.00 -1.05 0.00 0.00 32.46 30.34 3l6t n ARG 186 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3l6t n ASN 187 N -0.49 3.15 -0.11 2.89 3.02 -0.66 -4.71 115.26 118.35 3l6t n ASN 187 Ca 0.18 -3.30 -0.08 0.00 -0.03 0.00 0.00 54.58 51.36 3l6t n ASN 187 Cb 0.18 -0.56 -0.00 0.00 -0.61 0.00 0.00 39.78 38.79 3l6t n ASN 187 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 3l6t h LYS 188 N 1.25 0.46 -0.62 3.52 3.64 -1.66 -1.10 116.57 122.06 3l6t h LYS 188 Ca 0.07 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.39 3l6t h LYS 188 Cb 1.44 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 33.13 3l6t h LYS 188 CO 0.24 0.30 0.25 1.98 -2.27 0.00 0.00 179.45 179.95 3l6t h MET 189 N 0.47 0.92 -0.25 1.90 4.05 -1.92 -1.58 114.93 118.52 3l6t h MET 189 Ca 0.14 -0.16 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 3l6t h MET 189 Cb -0.03 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 30.61 3l6t h MET 189 CO -0.05 0.77 0.16 1.25 0.23 0.00 0.00 176.91 179.28 3l6t h HIS 190 N 0.86 0.32 -0.45 1.39 -0.00 -1.82 -1.61 115.15 113.84 3l6t h HIS 190 Ca 0.21 0.00 -0.08 0.00 -0.00 0.00 0.00 60.37 60.50 3l6t h HIS 190 Cb 0.19 -0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 27.48 3l6t h HIS 190 CO 0.01 0.22 -0.06 -0.07 -0.00 0.00 0.00 177.93 178.03 3l6t h LEU 191 N 0.33 0.75 -0.85 0.26 3.38 -1.05 -0.50 115.31 117.63 3l6t h LEU 191 Ca 0.09 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 3l6t h LEU 191 Cb -0.02 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 3l6t h LEU 191 CO -0.02 0.85 0.44 1.23 0.09 0.00 0.00 178.44 181.03 3l6t h GLY 192 N 0.97 1.29 1.85 0.83 0.00 -1.07 -2.08 103.07 104.87 3l6t h GLY 192 Ca 0.13 -0.61 -0.12 0.00 0.00 0.00 0.00 47.33 46.72 3l6t h GLY 192 CO 0.03 0.59 -0.53 -0.55 0.00 0.00 0.00 176.54 176.07 3l6t h ASP 193 N 1.20 0.17 -0.27 0.19 3.32 -0.91 -0.37 116.42 119.75 3l6t h ASP 193 Ca 0.30 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.25 3l6t h ASP 193 Cb 0.07 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 3l6t h ASP 193 CO -0.04 0.67 0.14 0.58 -1.72 0.00 0.00 179.24 178.87 3l6t h VAL 194 N 0.12 1.13 0.01 -1.35 2.07 -0.71 0.13 116.25 117.66 3l6t h VAL 194 Ca 0.00 -0.36 0.01 0.00 0.82 0.00 0.00 66.70 67.17 3l6t h VAL 194 Cb 0.98 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 3l6t h VAL 194 CO 0.08 0.13 -0.05 0.22 0.02 0.00 0.00 177.57 177.97 3l6t h TYR 195 N 0.32 -0.11 0.06 1.57 3.20 -1.21 -0.41 116.97 120.39 3l6t h TYR 195 Ca 0.10 0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.98 3l6t h TYR 195 Cb 0.08 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 3l6t h TYR 195 CO -0.03 -0.07 -0.12 -0.22 -1.64 0.00 0.00 178.16 176.08 3l6t h LYS 196 N -0.09 -0.23 -0.59 1.82 3.64 -0.90 -0.27 116.57 119.95 3l6t h LYS 196 Ca 0.02 0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.36 3l6t h LYS 196 Cb 0.10 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 3l6t h LYS 196 CO -0.04 -0.15 0.15 1.96 -2.27 0.00 0.00 179.45 179.10 3l6t h GLN 197 N -0.24 0.94 -0.34 1.90 4.20 -0.67 -1.84 115.11 119.07 3l6t h GLN 197 Ca 0.02 -0.22 -0.11 0.00 0.06 0.00 0.00 58.65 58.40 3l6t h GLN 197 Cb 0.26 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 3l6t h GLN 197 CO -0.08 0.86 -0.23 1.49 -0.67 0.00 0.00 178.83 180.20 3l6t h GLU 198 N 0.85 0.67 -0.18 1.46 4.57 -0.93 -0.64 114.58 120.39 3l6t h GLU 198 Ca 0.19 -0.26 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 3l6t h GLU 198 Cb 0.34 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.89 3l6t h GLU 198 CO 0.00 0.85 0.07 1.25 -1.18 0.00 0.00 179.01 180.00 3l6t h LEU 199 N 0.59 0.25 -0.81 1.64 5.85 -0.86 -0.82 115.31 121.14 3l6t h LEU 199 Ca 0.08 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.64 3l6t h LEU 199 Cb 0.71 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.64 3l6t h LEU 199 CO 0.05 0.35 0.53 0.00 -0.34 0.00 0.00 178.44 179.04 3l6t h ALA 200 N 0.91 1.02 -0.48 1.25 0.00 -1.16 -1.09 119.26 119.71 3l6t h ALA 200 Ca 0.06 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3l6t h ALA 200 Cb 0.18 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3l6t h ALA 200 CO -0.00 0.43 0.22 -0.07 0.00 0.00 0.00 179.25 179.83 3l6t h LEU 201 N 1.09 0.64 -0.39 0.00 3.38 -0.90 -0.41 115.31 118.72 3l6t h LEU 201 Ca 0.30 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.07 3l6t h LEU 201 Cb -0.13 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 3l6t h LEU 201 CO -0.06 0.61 0.04 -0.33 0.09 0.00 0.00 178.44 178.78 3l6t h GLU 202 N 0.64 0.66 -0.75 1.13 4.39 -0.90 -0.07 114.58 119.69 3l6t h GLU 202 Ca 0.17 -0.19 -0.05 0.00 0.34 0.00 0.00 59.36 59.62 3l6t h GLU 202 Cb 0.14 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.69 3l6t h GLU 202 CO -0.02 0.73 0.26 -0.07 -1.16 0.00 0.00 179.01 178.75 3l6t h LEU 203 N 0.50 1.06 -0.58 1.33 3.38 -1.07 -0.72 115.31 119.21 3l6t h LEU 203 Ca 0.12 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 3l6t h LEU 203 Cb 0.40 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3l6t h LEU 203 CO 0.01 0.97 0.15 0.74 0.09 0.00 0.00 178.44 180.41 3l6t h THR 204 N 1.09 1.25 -0.78 0.22 2.02 -0.91 -0.77 112.91 115.03 3l6t h THR 204 Ca 0.24 -0.87 -0.02 0.00 0.77 0.00 0.00 66.41 66.53 3l6t h THR 204 Cb 0.27 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 67.35 3l6t h THR 204 CO -0.01 0.32 0.41 0.50 0.37 0.00 0.00 175.52 177.11 3l6t h LYS 205 N 0.83 1.09 0.00 6.66 3.64 -0.69 -2.00 116.57 126.09 3l6t h LYS 205 Ca 0.18 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3l6t h LYS 205 Cb 0.33 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 3l6t h LYS 205 CO -0.00 0.81 0.00 0.00 -2.27 0.00 0.00 179.45 177.99 3l6t n ALA 206 N -2.42 2.03 0.00 5.00 0.00 -0.31 -4.89 120.51 119.92 3l6t n ALA 206 Ca 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3l6t n ALA 206 Cb 0.11 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.19 3l6t n ALA 206 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3l6t n GLY 207 N 0.83 1.01 3.78 0.00 0.00 -0.75 -5.08 105.19 104.98 3l6t n GLY 207 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 3l6t n GLY 207 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3l6t s TYR 208 N -2.00 3.53 -0.15 1.61 2.02 -0.37 -5.00 117.35 117.00 3l6t s TYR 208 Ca 0.00 1.73 -0.21 0.00 -0.37 0.00 0.00 57.07 58.21 3l6t s TYR 208 Cb 0.00 -3.01 -0.03 0.00 -0.40 0.00 0.00 41.96 38.52 3l6t s TYR 208 CO 0.00 -0.13 0.64 -2.00 -1.57 0.00 0.00 175.55 172.50 3l6t s GLU 209 N -2.19 4.30 0.23 -0.62 2.12 -1.26 -4.43 118.70 116.84 3l6t s GLU 209 Ca 0.53 0.69 0.08 0.00 0.36 0.00 0.00 54.97 56.63 3l6t s GLU 209 Cb -0.20 -3.52 -0.04 0.00 0.26 0.00 0.00 34.13 30.62 3l6t s GLU 209 CO 0.26 -0.11 0.03 -0.51 -0.54 0.00 0.00 175.26 174.39 3l6t s LEU 210 N 1.46 3.34 -0.16 2.70 1.43 -1.26 -0.82 118.68 125.37 3l6t s LEU 210 Ca 0.31 -0.49 0.00 0.00 -1.03 0.00 0.00 54.13 52.93 3l6t s LEU 210 Cb -0.16 -1.91 -0.00 0.00 0.03 0.00 0.00 46.19 44.15 3l6t s LEU 210 CO 0.12 0.03 -0.16 -0.60 0.23 0.00 0.00 176.35 175.98 3l6t s ARG 211 N -3.42 3.20 -0.09 1.70 3.52 0.85 -4.49 118.95 120.22 3l6t s ARG 211 Ca 0.30 -0.76 -0.09 0.00 -0.13 0.00 0.00 55.73 55.05 3l6t s ARG 211 Cb -0.08 -2.62 -0.05 0.00 -1.56 0.00 0.00 34.95 30.65 3l6t s ARG 211 CO 0.20 0.00 0.22 0.71 -0.81 0.00 0.00 175.30 175.63 3l6t s TYR 212 N 0.84 3.63 -0.43 5.12 2.02 -1.26 -1.42 117.35 125.86 3l6t s TYR 212 Ca -0.05 0.66 -0.15 0.00 -0.37 0.00 0.00 57.07 57.17 3l6t s TYR 212 Cb -0.15 -2.05 0.04 0.00 -0.40 0.00 0.00 41.96 39.39 3l6t s TYR 212 CO -0.01 0.69 0.32 1.21 -1.57 0.00 0.00 175.55 176.20 3l6t s ASN 213 N -0.98 6.07 0.31 2.29 3.84 0.22 -4.96 114.94 121.72 3l6t s ASN 213 Ca 0.17 -1.07 0.12 0.00 0.21 0.00 0.00 52.86 52.30 3l6t s ASN 213 Cb -0.13 -2.15 0.47 0.00 -0.55 0.00 0.00 41.25 38.89 3l6t s ASN 213 CO 0.07 -0.51 1.67 0.77 -2.79 0.00 0.00 177.10 176.30 3l6t h SER 214 N 8.64 0.00 -0.06 -4.21 4.64 -1.97 0.18 113.55 120.78 3l6t h SER 214 Ca -0.27 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.04 3l6t h SER 214 Cb 1.11 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.20 3l6t h SER 214 CO 0.77 0.54 0.01 0.50 -0.87 0.00 0.00 176.83 177.78 3l6t h LYS 215 N 0.00 0.10 -0.09 4.77 3.64 -1.96 -3.25 116.57 119.78 3l6t h LYS 215 Ca -0.01 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 3l6t h LYS 215 Cb 0.99 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.80 3l6t h LYS 215 CO 0.07 0.30 0.00 0.27 -2.27 0.00 0.00 179.45 177.83 3l6t n ASN 216 N -4.91 2.90 -3.34 4.20 2.04 -1.21 -4.98 115.26 109.96 3l6t n ASN 216 Ca -0.07 -1.91 -0.18 0.00 -0.44 0.00 0.00 54.58 51.97 3l6t n ASN 216 Cb 0.15 -0.04 0.08 0.00 -2.53 0.00 0.00 39.78 37.44 3l6t n ASN 216 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 3l6t n ASN 217 N 1.25 -3.55 -3.84 0.53 5.15 0.59 -5.02 115.26 110.37 3l6t n ASN 217 Ca 0.14 -0.56 -0.24 0.00 -0.60 0.00 0.00 54.58 53.32 3l6t n ASN 217 Cb 0.55 -4.84 -0.05 0.00 -0.53 0.00 0.00 39.78 34.91 3l6t n ASN 217 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 3l6t n THR 218 N -4.29 0.00 -3.81 -0.44 -2.24 -1.00 -4.96 114.28 97.53 3l6t n THR 218 Ca -0.17 -1.91 -0.09 0.00 -2.27 0.00 0.00 64.05 59.61 3l6t n THR 218 Cb 0.62 0.50 -0.06 0.00 -2.10 0.00 0.00 70.33 69.29 3l6t n THR 218 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 3l6t s PHE 219 N -2.58 0.09 0.35 4.78 -0.71 -1.26 -0.61 117.98 118.03 3l6t s PHE 219 Ca 0.06 -0.47 -0.04 0.00 -1.04 0.00 0.00 56.93 55.45 3l6t s PHE 219 Cb 0.00 0.07 0.01 0.00 -1.21 0.00 0.00 43.02 41.90 3l6t s PHE 219 CO 0.05 -0.67 0.51 0.34 -1.34 0.00 0.00 175.22 174.10 3l6t s ASP 220 N -2.87 0.80 0.39 1.98 -1.08 -0.50 -4.86 116.67 110.52 3l6t s ASP 220 Ca 0.08 -1.44 -0.27 0.00 -0.52 0.00 0.00 52.55 50.40 3l6t s ASP 220 Cb 0.03 0.68 -0.10 0.00 -1.46 0.00 0.00 42.92 42.07 3l6t s ASP 220 CO -0.08 -1.33 1.47 -0.04 0.52 0.00 0.00 175.17 175.71 3l6t s MET 221 N -3.00 4.03 0.33 4.34 -1.94 -1.26 -0.11 119.30 121.69 3l6t s MET 221 Ca 0.29 2.53 0.01 0.00 -1.71 0.00 0.00 55.69 56.81 3l6t s MET 221 Cb -0.01 -2.91 0.57 0.00 2.01 0.00 0.00 34.83 34.50 3l6t s MET 221 CO 0.19 -0.58 1.96 0.00 -0.01 0.00 0.00 175.02 176.58 3l6t h ALA 222 N 2.87 1.45 -2.60 3.03 0.00 -1.20 -3.22 119.26 119.59 3l6t h ALA 222 Ca -0.51 -0.09 -0.60 0.00 0.00 0.00 0.00 54.91 53.71 3l6t h ALA 222 Cb 1.24 -0.24 -0.39 0.00 0.00 0.00 0.00 17.79 18.40 3l6t h ALA 222 CO 0.64 0.46 -0.85 -1.01 0.00 0.00 0.00 179.25 178.48 3l6t s HIS 223 N -5.57 1.82 0.00 0.00 3.76 -1.26 -4.72 115.29 109.33 3l6t s HIS 223 Ca -0.10 -2.60 0.00 0.00 -0.15 0.00 0.00 55.06 52.21 3l6t s HIS 223 Cb 0.17 -1.47 0.00 0.00 1.11 0.00 0.00 32.58 32.39 3l6t s HIS 223 CO 0.77 -0.75 0.00 1.19 -0.85 0.00 0.00 174.74 175.11 3l6t n PHE 224 N 2.65 0.00 0.00 1.40 3.01 -1.25 -5.09 117.46 118.18 3l6t n PHE 224 Ca 0.26 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.72 3l6t n PHE 224 Cb 0.43 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.90 3l6t n PHE 224 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20