#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vsy s ASP 302 N 0.00 7.38 0.56 -3.46 2.15 -1.26 -4.98 116.67 117.05 1vsy s ASP 302 Ca 0.00 1.83 0.28 0.00 0.43 0.00 0.00 52.55 55.10 1vsy s ASP 302 Cb 0.00 -2.59 1.64 0.00 -0.30 0.00 0.00 42.92 41.67 1vsy s ASP 302 CO 0.00 -0.19 2.17 -0.65 -0.17 0.00 0.00 175.17 176.33 1vsy h PRO 303 N 5.94 0.00 0.00 4.34 0.11 -2.01 -2.55 132.00 137.83 1vsy h PRO 303 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1vsy h PRO 303 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1vsy h PRO 303 CO 0.74 0.06 -0.99 0.43 -0.21 0.00 0.00 178.00 178.02 1vsy n SER 304 N -3.78 0.79 -1.49 -2.05 7.64 -1.26 -4.07 113.62 109.40 1vsy n SER 304 Ca -0.02 0.25 -0.07 0.00 1.01 0.00 0.00 58.87 60.03 1vsy n SER 304 Cb 0.15 0.49 0.22 0.00 -1.01 0.00 0.00 64.21 64.06 1vsy n SER 304 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1vsy n SER 305 N -2.54 3.28 -0.08 6.43 7.64 -0.98 -4.31 113.62 123.06 1vsy n SER 305 Ca 0.00 -3.56 -0.12 0.00 1.01 0.00 0.00 58.87 56.20 1vsy n SER 305 Cb 0.53 -0.69 -0.06 0.00 -1.01 0.00 0.00 64.21 62.98 1vsy n SER 305 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1vsy n ILE 306 N -0.92 1.47 -0.11 0.44 5.41 -1.10 -4.75 119.36 119.80 1vsy n ILE 306 Ca 0.39 0.11 -0.23 0.00 1.00 0.00 0.00 62.75 64.02 1vsy n ILE 306 Cb 1.21 -2.25 -0.11 0.00 -0.71 0.00 0.00 39.64 37.79 1vsy n ILE 306 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1vsy n ASN 307 N -4.54 1.88 0.00 4.38 5.03 -1.21 -1.43 115.26 119.37 1vsy n ASN 307 Ca -0.18 0.41 0.00 0.00 0.87 0.00 0.00 54.58 55.68 1vsy n ASN 307 Cb 0.44 -0.94 0.00 0.00 -1.02 0.00 0.00 39.78 38.26 1vsy n ASN 307 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1vsy n GLY 308 N 1.40 -0.30 0.00 7.41 0.00 -1.25 -2.74 105.19 109.71 1vsy n GLY 308 Ca -0.37 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 43.80 1vsy n GLY 308 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vsy n GLY 3001N -0.38 3.09 3.17 -0.02 0.00 -1.19 -4.53 105.19 105.32 1vsy n GLY 3001Ca 0.00 -2.00 -0.12 0.00 0.00 0.00 0.00 46.02 43.90 1vsy n GLY 3001CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1vsy s ILE 3002N -2.55 0.78 -0.03 -0.61 -4.36 -1.26 -2.23 121.20 110.94 1vsy s ILE 3002Ca 0.00 -1.82 -0.04 0.00 -0.26 0.00 0.00 60.65 58.52 1vsy s ILE 3002Cb 0.00 -1.55 0.01 0.00 1.25 0.00 0.00 42.46 42.17 1vsy s ILE 3002CO 0.00 -0.76 0.11 -0.69 0.24 0.00 0.00 174.94 173.84 1vsy s VAL 3003N -3.19 0.02 -0.01 8.37 1.01 0.25 -3.14 120.40 123.72 1vsy s VAL 3003Ca 0.09 -0.16 -0.02 0.00 0.00 0.00 0.00 61.98 61.90 1vsy s VAL 3003Cb 0.02 -0.22 -0.00 0.00 0.00 0.00 0.00 36.38 36.18 1vsy s VAL 3003CO -0.03 -0.09 0.05 0.54 0.00 0.00 0.00 175.10 175.57 1vsy s VAL 3004N -0.24 0.04 -0.03 2.92 0.11 -0.52 -1.73 120.40 120.95 1vsy s VAL 3004Ca -0.03 -0.30 -0.03 0.00 -2.93 0.00 0.00 61.98 58.69 1vsy s VAL 3004Cb -0.02 -0.17 0.01 0.00 -1.53 0.00 0.00 36.38 34.66 1vsy s VAL 3004CO 0.00 -0.16 0.08 0.00 -3.33 0.00 0.00 175.10 171.69 1vsy s ALA 3005N -0.49 -0.19 0.16 1.54 0.00 -0.22 -1.29 121.76 121.27 1vsy s ALA 3005Ca -0.06 0.23 0.02 0.00 0.00 0.00 0.00 51.96 52.16 1vsy s ALA 3005Cb -0.04 -0.14 -0.05 0.00 0.00 0.00 0.00 23.12 22.90 1vsy s ALA 3005CO 0.00 -0.04 -0.01 -1.64 0.00 0.00 0.00 175.76 174.06 1vsy s MET 3006N 0.09 1.07 0.20 0.00 -1.94 -0.03 -1.05 119.30 117.63 1vsy s MET 3006Ca -0.00 -1.50 0.08 0.00 -1.71 0.00 0.00 55.69 52.55 1vsy s MET 3006Cb -0.01 -0.28 -0.04 0.00 2.01 0.00 0.00 34.83 36.50 1vsy s MET 3006CO -0.00 -0.10 -0.01 0.95 -0.01 0.00 0.00 175.02 175.85 1vsy s THR 3007N -3.63 3.61 0.00 2.05 -4.23 -1.12 -1.61 115.64 110.70 1vsy s THR 3007Ca 0.22 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 59.17 1vsy s THR 3007Cb 0.06 -2.84 0.00 0.00 1.34 0.00 0.00 72.50 71.06 1vsy s THR 3007CO 0.02 -0.17 0.00 0.61 -0.54 0.00 0.00 174.62 174.54 1vsy n GLY 3008N -0.29 5.28 3.61 3.99 0.00 -0.74 -4.37 105.19 112.67 1vsy n GLY 3008Ca -0.09 -1.37 -0.43 0.00 0.00 0.00 0.00 46.02 44.13 1vsy n GLY 3008CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vsy s LYS 3009N 1.24 3.54 -1.54 1.61 2.47 -0.25 -3.85 119.74 122.96 1vsy s LYS 3009Ca 0.00 1.25 -0.01 0.00 -1.56 0.00 0.00 55.97 55.65 1vsy s LYS 3009Cb 0.00 -4.08 0.01 0.00 -1.46 0.00 0.00 37.83 32.30 1vsy s LYS 3009CO 0.00 -1.61 0.10 -0.25 0.16 0.00 0.00 175.35 173.75 1vsy n ASP 3010N 9.25 0.62 -3.65 1.43 8.00 -1.26 -4.72 116.55 126.21 1vsy n ASP 3010Ca 0.19 -1.23 -0.06 0.00 0.71 0.00 0.00 54.79 54.40 1vsy n ASP 3010Cb 0.47 -1.85 -0.02 0.00 -0.02 0.00 0.00 41.12 39.71 1vsy n ASP 3010CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1vsy s VAL 3012N -3.36 0.15 -0.00 0.00 -7.23 -0.97 -1.79 120.40 107.20 1vsy s VAL 3012Ca 0.09 -1.27 0.03 0.00 -1.81 0.00 0.00 61.98 59.02 1vsy s VAL 3012Cb -0.02 -1.05 -0.01 0.00 0.56 0.00 0.00 36.38 35.86 1vsy s VAL 3012CO -0.02 -0.70 -0.09 0.00 -0.31 0.00 0.00 175.10 173.98 1vsy s ALA 3013N -3.00 0.72 0.01 1.32 0.00 -0.63 -0.95 121.76 119.23 1vsy s ALA 3013Ca -0.02 -0.40 0.01 0.00 0.00 0.00 0.00 51.96 51.56 1vsy s ALA 3013Cb 0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.95 1vsy s ALA 3013CO -0.06 0.17 -0.05 -1.50 0.00 0.00 0.00 175.76 174.32 1vsy s ILE 3014N -0.26 0.35 0.09 0.00 2.07 -0.97 -0.85 121.20 121.63 1vsy s ILE 3014Ca 0.03 -0.50 -0.18 0.00 -1.41 0.00 0.00 60.65 58.58 1vsy s ILE 3014Cb -0.04 -0.36 0.04 0.00 0.13 0.00 0.00 42.46 42.24 1vsy s ILE 3014CO -0.00 -0.11 0.44 0.00 -1.91 0.00 0.00 174.94 173.36 1vsy s ALA 3015N -0.60 -1.07 0.29 1.50 0.00 -0.41 -1.22 121.76 120.25 1vsy s ALA 3015Ca -0.04 0.19 -0.16 0.00 0.00 0.00 0.00 51.96 51.96 1vsy s ALA 3015Cb -0.05 0.57 0.02 0.00 0.00 0.00 0.00 23.12 23.66 1vsy s ALA 3015CO -0.00 -0.58 0.63 0.00 0.00 0.00 0.00 175.76 175.81 1vsy s ASP 3017N -3.00 6.33 -0.51 0.00 -4.77 -1.19 -1.59 116.67 111.95 1vsy s ASP 3017Ca 0.17 0.30 0.02 0.00 -3.30 0.00 0.00 52.55 49.73 1vsy s ASP 3017Cb -0.04 -1.96 0.56 0.00 -1.09 0.00 0.00 42.92 40.39 1vsy s ASP 3017CO 0.09 -0.12 1.94 0.18 0.70 0.00 0.00 175.17 177.96 1vsy n LEU 3018N -1.23 6.95 -4.78 2.11 4.77 -1.11 -4.42 117.00 119.29 1vsy n LEU 3018Ca -0.06 -3.76 -0.36 0.00 -0.03 0.00 0.00 56.01 51.79 1vsy n LEU 3018Cb 0.56 -0.88 -0.08 0.00 -2.33 0.00 0.00 43.42 40.69 1vsy n LEU 3018CO 0.47 1.18 -0.22 -0.60 -1.33 0.00 0.00 177.39 176.90 1vsy s ARG 3019N -3.33 3.48 -0.09 3.23 3.52 -1.18 -2.87 118.95 121.71 1vsy s ARG 3019Ca 0.57 -0.24 -0.03 0.00 -0.13 0.00 0.00 55.73 55.90 1vsy s ARG 3019Cb 0.47 -3.12 0.05 0.00 -1.56 0.00 0.00 34.95 30.78 1vsy s ARG 3019CO 0.06 0.64 0.11 -1.17 -0.81 0.00 0.00 175.30 174.13 1vsy s LEU 3020N -0.65 0.08 -0.06 -0.88 1.98 -1.03 -4.59 118.68 113.53 1vsy s LEU 3020Ca 0.12 0.04 -0.08 0.00 -2.89 0.00 0.00 54.13 51.32 1vsy s LEU 3020Cb -0.12 0.03 0.02 0.00 0.66 0.00 0.00 46.19 46.78 1vsy s LEU 3020CO 0.02 -0.27 0.20 -0.83 -1.89 0.00 0.00 176.35 173.59 1vsy s GLY 3021N 2.22 -0.13 -0.44 7.98 0.00 -1.11 -0.96 107.32 114.89 1vsy s GLY 3021Ca 0.04 0.46 -0.29 0.00 0.00 0.00 0.00 44.72 44.94 1vsy s GLY 3021CO -0.06 0.37 1.25 -0.45 0.00 0.00 0.00 173.10 174.21 1vsy s SER 3022N -0.19 6.53 0.76 1.64 0.15 -0.89 -3.36 113.70 118.34 1vsy s SER 3022Ca -0.03 0.67 0.00 0.00 0.70 0.00 0.00 55.95 57.29 1vsy s SER 3022Cb -0.03 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 1vsy s SER 3022CO 0.01 -1.30 0.00 0.00 1.20 0.00 0.00 173.24 173.14 1vsy n GLN 3023N 7.87 0.00 -0.00 5.44 1.13 -0.51 -1.69 117.38 129.62 1vsy n GLN 3023Ca 0.14 0.00 -0.00 0.00 -1.94 0.00 0.00 57.00 55.20 1vsy n GLN 3023Cb 0.48 0.00 0.30 0.00 0.11 0.00 0.00 30.24 31.13 1vsy n GLN 3023CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1vsy h SER 3024N 0.00 0.49 -3.00 1.08 4.64 -1.90 -3.43 113.55 111.42 1vsy h SER 3024Ca 0.00 -0.09 -0.57 0.00 -0.47 0.00 0.00 61.79 60.66 1vsy h SER 3024Cb 0.00 -0.13 -0.04 0.00 -0.31 0.00 0.00 62.40 61.92 1vsy h SER 3024CO 0.00 0.56 0.93 -0.22 -0.87 0.00 0.00 176.83 177.23 1vsy s LEU 3025N -9.06 4.06 0.06 5.97 2.96 -0.68 -5.01 118.68 116.97 1vsy s LEU 3025Ca -0.08 1.50 -0.30 0.00 -0.22 0.00 0.00 54.13 55.03 1vsy s LEU 3025Cb 0.15 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.26 1vsy s LEU 3025CO 0.76 -0.89 0.99 -0.83 -1.32 0.00 0.00 176.35 175.07 1vsy s GLY 3026N 2.29 2.91 -0.16 7.98 0.00 -1.26 -2.08 107.32 117.00 1vsy s GLY 3026Ca 0.55 0.59 -0.04 0.00 0.00 0.00 0.00 44.72 45.82 1vsy s GLY 3026CO 0.18 1.62 -0.17 -0.62 0.00 0.00 0.00 173.10 174.10 1vsy n VAL 3027N 3.40 0.89 -4.38 1.40 0.31 -0.14 -4.96 118.33 114.84 1vsy n VAL 3027Ca 0.05 -0.28 -0.20 0.00 -0.01 0.00 0.00 64.34 63.90 1vsy n VAL 3027Cb 0.50 -1.40 -0.14 0.00 -0.91 0.00 0.00 33.84 31.89 1vsy n VAL 3027CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1vsy s SER 3028N -6.00 1.46 -0.22 4.52 0.15 -0.94 -5.04 113.70 107.64 1vsy s SER 3028Ca -0.22 -0.36 0.12 0.00 0.70 0.00 0.00 55.95 56.19 1vsy s SER 3028Cb 0.07 -0.11 0.43 0.00 -1.71 0.00 0.00 66.02 64.71 1vsy s SER 3028CO 0.32 0.06 1.30 -0.46 1.20 0.00 0.00 173.24 175.66 1vsy n ASN 3029N 2.22 2.23 -0.99 5.45 2.04 -1.25 -2.46 115.26 122.49 1vsy n ASN 3029Ca -0.17 -3.66 0.01 0.00 -0.44 0.00 0.00 54.58 50.32 1vsy n ASN 3029Cb 0.55 -0.55 0.00 0.00 -2.53 0.00 0.00 39.78 37.25 1vsy n ASN 3029CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 1vsy n LYS 3030N -1.13 0.00 -3.34 -3.83 5.02 -1.14 -4.76 118.16 108.99 1vsy n LYS 3030Ca 0.23 -1.34 -0.46 0.00 -2.02 0.00 0.00 58.31 54.72 1vsy n LYS 3030Cb 0.81 -0.12 -0.03 0.00 -0.02 0.00 0.00 35.03 35.67 1vsy n LYS 3030CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1vsy s PHE 3031N 0.00 3.59 0.32 2.13 5.36 -1.18 -5.05 117.98 123.15 1vsy s PHE 3031Ca 0.15 -1.79 -0.27 0.00 -0.96 0.00 0.00 56.93 54.05 1vsy s PHE 3031Cb 0.17 -3.79 -0.09 0.00 -0.34 0.00 0.00 43.02 38.97 1vsy s PHE 3031CO -0.07 -1.00 1.03 -1.21 -1.46 0.00 0.00 175.22 172.51 1vsy s GLU 3032N 0.63 4.51 0.00 10.12 2.02 -1.26 -4.15 118.70 130.57 1vsy s GLU 3032Ca 0.13 1.57 0.18 0.00 0.02 0.00 0.00 54.97 56.87 1vsy s GLU 3032Cb -0.17 -2.92 0.32 0.00 0.10 0.00 0.00 34.13 31.47 1vsy s GLU 3032CO -0.05 0.16 1.25 1.63 0.02 0.00 0.00 175.26 178.27 1vsy n LYS 3033N 0.71 2.17 -4.62 1.61 5.02 -1.26 -4.92 118.16 116.87 1vsy n LYS 3033Ca 0.01 -2.00 -0.33 0.00 -2.02 0.00 0.00 58.31 53.97 1vsy n LYS 3033Cb 0.48 -1.40 -0.16 0.00 -0.02 0.00 0.00 35.03 33.92 1vsy n LYS 3033CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1vsy s ILE 3034N -1.28 2.20 0.19 -0.18 1.01 -1.26 -1.32 121.20 120.56 1vsy s ILE 3034Ca 0.30 -0.93 0.11 0.00 0.00 0.00 0.00 60.65 60.13 1vsy s ILE 3034Cb 0.18 -1.89 -0.04 0.00 0.01 0.00 0.00 42.46 40.71 1vsy s ILE 3034CO 0.25 0.54 -0.23 -0.36 0.00 0.00 0.00 174.94 175.14 1vsy s PHE 3035N 0.84 2.20 0.08 3.97 0.08 -0.00 -4.99 117.98 120.16 1vsy s PHE 3035Ca -0.06 -0.38 0.07 0.00 0.12 0.00 0.00 56.93 56.68 1vsy s PHE 3035Cb -0.15 -1.09 -0.03 0.00 -0.57 0.00 0.00 43.02 41.17 1vsy s PHE 3035CO -0.02 0.47 -0.19 -3.38 -0.10 0.00 0.00 175.22 171.99 1vsy s HIS 3036N -1.73 1.68 -0.42 0.36 -3.43 -1.26 -0.89 115.29 109.60 1vsy s HIS 3036Ca 0.20 -0.41 0.02 0.00 -0.80 0.00 0.00 55.06 54.06 1vsy s HIS 3036Cb -0.08 -0.94 0.13 0.00 -1.43 0.00 0.00 32.58 30.27 1vsy s HIS 3036CO 0.09 0.15 0.23 0.71 -2.00 0.00 0.00 174.74 173.92 1vsy s TYR 3037N -1.08 1.70 0.00 0.38 2.02 -0.02 -5.02 117.35 115.34 1vsy s TYR 3037Ca 0.05 -2.23 0.00 0.00 -0.37 0.00 0.00 57.07 54.52 1vsy s TYR 3037Cb -0.10 -1.68 0.00 0.00 -0.40 0.00 0.00 41.96 39.79 1vsy s TYR 3037CO 0.03 -0.80 0.00 0.41 -1.57 0.00 0.00 175.55 173.63 1vsy n GLY 3038N 3.70 2.39 0.90 0.71 0.00 -1.26 -2.95 105.19 108.68 1vsy n GLY 3038Ca 0.09 -0.38 0.09 0.00 0.00 0.00 0.00 46.02 45.82 1vsy n GLY 3038CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1vsy n HIS 3039N 12.43 0.51 -3.92 1.61 1.44 -1.26 -4.92 115.22 121.12 1vsy n HIS 3039Ca 0.00 -0.36 -0.35 0.00 -2.01 0.00 0.00 57.72 55.00 1vsy n HIS 3039Cb 0.00 -0.01 -0.11 0.00 0.12 0.00 0.00 29.99 29.99 1vsy n HIS 3039CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1vsy s VAL 3040N -1.12 4.57 -0.00 0.61 1.01 -1.15 -4.23 120.40 120.09 1vsy s VAL 3040Ca 0.31 -0.10 -0.01 0.00 0.00 0.00 0.00 61.98 62.18 1vsy s VAL 3040Cb 0.17 -3.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.42 1vsy s VAL 3040CO 0.24 0.40 0.12 -0.36 0.00 0.00 0.00 175.10 175.50 1vsy s PHE 3041N 0.96 3.39 -0.08 5.22 0.40 -0.45 -0.84 117.98 126.58 1vsy s PHE 3041Ca 0.04 0.26 -0.03 0.00 -0.60 0.00 0.00 56.93 56.60 1vsy s PHE 3041Cb -0.14 -1.77 0.04 0.00 0.51 0.00 0.00 43.02 41.66 1vsy s PHE 3041CO 0.03 0.59 0.06 -1.17 0.70 0.00 0.00 175.22 175.43 1vsy s LEU 3042N -1.86 0.27 -0.08 -0.37 2.96 -0.06 -1.33 118.68 118.19 1vsy s LEU 3042Ca 0.25 -0.13 -0.05 0.00 -0.22 0.00 0.00 54.13 53.98 1vsy s LEU 3042Cb -0.12 -0.21 -0.04 0.00 0.50 0.00 0.00 46.19 46.32 1vsy s LEU 3042CO 0.16 -0.27 0.13 -0.83 -1.32 0.00 0.00 176.35 174.23 1vsy s GLY 3043N 2.13 2.12 -0.03 7.98 0.00 -0.11 -0.82 107.32 118.59 1vsy s GLY 3043Ca 0.04 -0.70 -0.00 0.00 0.00 0.00 0.00 44.72 44.06 1vsy s GLY 3043CO -0.05 -0.48 0.02 -0.42 0.00 0.00 0.00 173.10 172.17 1vsy s ILE 3044N -1.09 0.06 0.31 0.90 1.01 -0.43 0.19 121.20 122.15 1vsy s ILE 3044Ca 0.18 0.20 0.10 0.00 0.00 0.00 0.00 60.65 61.13 1vsy s ILE 3044Cb -0.12 -0.21 -0.05 0.00 0.01 0.00 0.00 42.46 42.09 1vsy s ILE 3044CO 0.08 0.14 -0.06 0.42 0.00 0.00 0.00 174.94 175.52 1vsy s THR 3045N 1.35 2.73 0.00 2.92 -4.23 -1.25 -4.82 115.64 112.35 1vsy s THR 3045Ca -0.05 -2.10 0.00 0.00 -1.18 0.00 0.00 61.69 58.36 1vsy s THR 3045Cb -0.13 -2.66 0.00 0.00 1.34 0.00 0.00 72.50 71.05 1vsy s THR 3045CO -0.03 -0.29 0.00 0.61 -0.54 0.00 0.00 174.62 174.37 1vsy n GLY 3046N -0.83 0.24 3.71 3.99 0.00 -1.26 -1.15 105.19 109.88 1vsy n GLY 3046Ca -0.05 -1.17 -0.39 0.00 0.00 0.00 0.00 46.02 44.41 1vsy n GLY 3046CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1vsy s LEU 3047N 0.00 4.27 0.07 0.99 2.96 -0.68 -3.74 118.68 122.55 1vsy s LEU 3047Ca 0.00 1.05 -0.23 0.00 -0.22 0.00 0.00 54.13 54.72 1vsy s LEU 3047Cb 0.00 -2.97 -0.15 0.00 0.50 0.00 0.00 46.19 43.57 1vsy s LEU 3047CO 0.00 -0.13 1.65 0.00 -1.32 0.00 0.00 176.35 176.55 1vsy h ALA 3048N 6.89 0.02 0.00 5.97 0.00 -1.92 0.26 119.26 130.49 1vsy h ALA 3048Ca -0.39 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1vsy h ALA 3048Cb 1.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1vsy h ALA 3048CO 0.76 -0.43 0.00 -2.37 0.00 0.00 0.00 179.25 177.21 1vsy n THR 3049N -5.03 1.15 -0.09 0.00 5.66 -1.26 -0.26 114.28 114.46 1vsy n THR 3049Ca -0.07 0.29 -0.10 0.00 -3.05 0.00 0.00 64.05 61.12 1vsy n THR 3049Cb 0.07 -1.11 -0.12 0.00 -1.55 0.00 0.00 70.33 67.63 1vsy n THR 3049CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1vsy n ASP 3050N -1.45 1.49 -0.17 1.09 9.92 -0.67 -3.04 116.55 123.73 1vsy n ASP 3050Ca 0.03 -0.04 -0.08 0.00 -0.53 0.00 0.00 54.79 54.18 1vsy n ASP 3050Cb 0.11 0.50 0.02 0.00 -0.64 0.00 0.00 41.12 41.11 1vsy n ASP 3050CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 1vsy h VAL 3051N 0.00 1.18 -0.01 2.53 2.07 0.29 -1.34 116.25 120.97 1vsy h VAL 3051Ca -0.44 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 66.63 1vsy h VAL 3051Cb 1.90 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 32.21 1vsy h VAL 3051CO -0.01 0.19 -0.00 0.74 0.02 0.00 0.00 177.57 178.51 1vsy h THR 3052N 0.68 1.26 -0.96 2.57 2.02 -0.81 -2.59 112.91 115.08 1vsy h THR 3052Ca 0.18 -0.78 0.10 0.00 0.77 0.00 0.00 66.41 66.68 1vsy h THR 3052Cb 0.05 1.77 -0.07 0.00 -1.74 0.00 0.00 68.15 68.16 1vsy h THR 3052CO -0.03 0.20 0.61 0.74 0.37 0.00 0.00 175.52 177.42 1vsy h THR 3053N -0.31 0.97 -0.13 3.16 2.02 -1.48 -1.39 112.91 115.75 1vsy h THR 3053Ca 0.00 -0.33 -0.16 0.00 0.77 0.00 0.00 66.41 66.68 1vsy h THR 3053Cb 0.33 -0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.64 1vsy h THR 3053CO 0.00 0.18 -0.61 -0.07 0.37 0.00 0.00 175.52 175.39 1vsy h LEU 3054N 0.98 0.50 1.01 2.58 3.38 -1.18 -0.94 115.31 121.64 1vsy h LEU 3054Ca 0.45 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 1vsy h LEU 3054Cb 0.40 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.02 1vsy h LEU 3054CO -0.21 0.99 -0.49 -1.13 0.09 0.00 0.00 178.44 177.70 1vsy h ASN 3055N 0.33 -1.15 -1.20 -0.43 -1.24 -1.00 0.97 115.58 111.86 1vsy h ASN 3055Ca -0.01 0.04 0.35 0.00 0.71 0.00 0.00 56.30 57.40 1vsy h ASN 3055Cb 1.15 0.30 -0.10 0.00 0.73 0.00 0.00 38.32 40.39 1vsy h ASN 3055CO 0.11 -0.82 0.79 -0.33 -1.29 0.00 0.00 177.43 175.89 1vsy h GLU 3056N -1.37 0.20 0.12 6.67 5.08 -1.24 -0.49 114.58 123.55 1vsy h GLU 3056Ca -0.14 -0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.05 1vsy h GLU 3056Cb 1.04 -0.05 0.02 0.00 0.50 0.00 0.00 28.75 30.26 1vsy h GLU 3056CO 0.23 0.13 -0.69 1.98 -1.00 0.00 0.00 179.01 179.66 1vsy h MET 3057N 0.21 0.25 0.00 2.33 4.05 -0.88 -3.17 114.93 117.72 1vsy h MET 3057Ca 0.69 -0.43 -0.04 0.00 -0.28 0.00 0.00 59.70 59.64 1vsy h MET 3057Cb 2.09 0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 33.05 1vsy h MET 3057CO -0.30 1.21 -0.21 0.74 0.23 0.00 0.00 176.91 178.58 1vsy h PHE 3058N -0.47 0.00 0.84 1.39 0.04 0.09 -0.59 116.94 118.24 1vsy h PHE 3058Ca -0.12 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.61 1vsy h PHE 3058Cb 1.54 0.00 0.01 0.00 2.20 0.00 0.00 35.95 39.70 1vsy h PHE 3058CO 0.21 0.21 -0.41 -0.09 -0.60 0.00 0.00 178.31 177.63 1vsy h ARG 3059N 0.00 -1.09 -0.18 1.51 2.43 -1.23 -0.74 114.38 115.08 1vsy h ARG 3059Ca -0.00 0.07 0.02 0.00 -0.81 0.00 0.00 59.98 59.27 1vsy h ARG 3059Cb 0.81 0.25 -0.04 0.00 -0.42 0.00 0.00 29.97 30.56 1vsy h ARG 3059CO 0.03 -0.73 -0.31 -0.92 -1.51 0.00 0.00 179.97 176.52 1vsy h TYR 3060N -1.13 -0.95 -0.61 2.20 5.03 -1.47 0.15 116.97 120.17 1vsy h TYR 3060Ca -0.12 0.04 0.12 0.00 2.58 0.00 0.00 58.73 61.36 1vsy h TYR 3060Cb 0.87 0.44 -0.09 0.00 1.55 0.00 0.00 36.73 39.50 1vsy h TYR 3060CO -0.01 -0.29 0.09 0.87 -1.32 0.00 0.00 178.16 177.49 1vsy h LYS 3061N -0.26 0.20 0.00 1.82 1.57 -1.14 -2.63 116.57 116.13 1vsy h LYS 3061Ca 0.03 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.70 1vsy h LYS 3061Cb 0.35 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1vsy h LYS 3061CO -0.31 0.13 -0.49 1.79 -0.57 0.00 0.00 179.45 180.00 1vsy h THR 3062N 0.20 0.97 -0.71 -0.16 1.35 -0.91 -2.40 112.91 111.25 1vsy h THR 3062Ca 0.32 -1.99 -0.06 0.00 -0.55 0.00 0.00 66.41 64.13 1vsy h THR 3062Cb 0.51 2.21 -0.03 0.00 -1.73 0.00 0.00 68.15 69.11 1vsy h THR 3062CO -0.45 0.48 0.19 0.78 -0.25 0.00 0.00 175.52 176.27 1vsy h ASN 3063N 0.00 1.06 0.18 5.36 4.21 -0.37 -2.42 115.58 123.61 1vsy h ASN 3063Ca -0.00 -0.22 -0.17 0.00 1.21 0.00 0.00 56.30 57.11 1vsy h ASN 3063Cb 1.17 -0.28 -0.01 0.00 -1.12 0.00 0.00 38.32 38.09 1vsy h ASN 3063CO 0.06 1.01 -0.66 -0.07 -1.29 0.00 0.00 177.43 176.48 1vsy h LEU 3064N 1.06 0.52 -0.59 1.61 3.38 -1.37 -2.66 115.31 117.26 1vsy h LEU 3064Ca 0.23 -0.32 0.08 0.00 0.09 0.00 0.00 57.88 57.96 1vsy h LEU 3064Cb 0.34 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 40.87 1vsy h LEU 3064CO -0.00 1.04 0.23 0.22 0.09 0.00 0.00 178.44 180.02 1vsy h TYR 3065N 0.32 0.40 -0.03 1.13 5.03 -1.38 0.99 116.97 123.44 1vsy h TYR 3065Ca -0.02 0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.32 1vsy h TYR 3065Cb 1.22 -0.09 -0.00 0.00 1.55 0.00 0.00 36.73 39.41 1vsy h TYR 3065CO 0.04 0.12 0.02 -0.22 -1.32 0.00 0.00 178.16 176.81 1vsy h LYS 3066N 0.42 0.04 -0.45 1.82 3.64 -1.24 0.32 116.57 121.13 1vsy h LYS 3066Ca 0.29 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.58 1vsy h LYS 3066Cb 0.33 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 1vsy h LYS 3066CO -0.28 0.07 -0.04 -0.07 -2.27 0.00 0.00 179.45 176.86 1vsy h LEU 3067N 0.00 0.81 -0.01 5.20 3.38 -1.25 -1.44 115.31 122.01 1vsy h LEU 3067Ca 0.01 -0.33 -0.24 0.00 0.09 0.00 0.00 57.88 57.41 1vsy h LEU 3067Cb 0.04 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1vsy h LEU 3067CO -0.00 0.95 -1.09 0.50 0.09 0.00 0.00 178.44 178.89 1vsy h LYS 3068N 0.66 0.19 -0.01 1.13 3.64 -0.72 -3.33 116.57 118.13 1vsy h LYS 3068Ca 0.12 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1vsy h LYS 3068Cb 0.56 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 1vsy h LYS 3068CO 0.03 1.10 -0.51 0.39 -2.27 0.00 0.00 179.45 178.19 1vsy n GLU 3069N -3.52 0.98 -0.94 1.90 -0.58 0.11 -4.95 120.64 113.64 1vsy n GLU 3069Ca -0.05 -0.78 0.00 0.00 -0.42 0.00 0.00 57.16 55.91 1vsy n GLU 3069Cb 0.95 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 30.33 1vsy n GLU 3069CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1vsy n GLU 3070N -0.33 -0.67 -4.13 3.49 -0.58 -0.55 -4.96 120.64 112.90 1vsy n GLU 3070Ca 0.09 0.17 -0.11 0.00 -0.42 0.00 0.00 57.16 56.89 1vsy n GLU 3070Cb 0.43 -3.79 -0.08 0.00 -0.57 0.00 0.00 31.44 27.43 1vsy n GLU 3070CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 1vsy s ARG 3071N -0.80 1.33 0.23 3.49 1.70 -1.20 -5.04 118.95 118.67 1vsy s ARG 3071Ca 0.00 -1.51 -0.24 0.00 -0.47 0.00 0.00 55.73 53.51 1vsy s ARG 3071Cb 0.00 0.34 -0.09 0.00 -0.57 0.00 0.00 34.95 34.63 1vsy s ARG 3071CO 0.00 -0.48 0.82 0.00 -1.08 0.00 0.00 175.30 174.56 1vsy s ALA 3072N -4.10 3.36 0.34 7.88 0.00 -1.26 -3.80 121.76 124.19 1vsy s ALA 3072Ca 0.34 0.37 -0.27 0.00 0.00 0.00 0.00 51.96 52.39 1vsy s ALA 3072Cb 0.04 -3.00 -0.09 0.00 0.00 0.00 0.00 23.12 20.07 1vsy s ALA 3072CO 0.11 0.26 1.13 -1.50 0.00 0.00 0.00 175.76 175.77 1vsy s ILE 3073N -1.39 3.36 0.53 0.00 2.07 -1.26 -5.03 121.20 119.48 1vsy s ILE 3073Ca 0.42 1.24 -0.10 0.00 -1.41 0.00 0.00 60.65 60.81 1vsy s ILE 3073Cb -0.20 -3.74 -0.05 0.00 0.13 0.00 0.00 42.46 38.60 1vsy s ILE 3073CO 0.24 0.20 0.91 -1.61 -1.91 0.00 0.00 174.94 172.77 1vsy s GLU 3074N -1.92 3.65 0.07 3.50 0.41 -1.26 -4.68 118.70 118.46 1vsy s GLU 3074Ca 0.51 0.55 -0.21 0.00 -0.41 0.00 0.00 54.97 55.41 1vsy s GLU 3074Cb -0.30 -2.23 -0.12 0.00 -1.78 0.00 0.00 34.13 29.70 1vsy s GLU 3074CO 0.39 -0.34 1.53 -1.35 -0.49 0.00 0.00 175.26 175.00 1vsy h PRO 3075N 0.23 0.27 -0.72 0.39 0.11 -1.94 -0.55 132.00 129.79 1vsy h PRO 3075Ca -0.46 -0.07 0.11 0.00 0.11 0.00 0.00 66.00 65.69 1vsy h PRO 3075Cb 1.19 -0.03 -0.08 0.00 0.11 0.00 0.00 31.00 32.19 1vsy h PRO 3075CO 0.62 0.45 0.33 0.93 -0.21 0.00 0.00 178.00 180.12 1vsy h GLU 3076N 0.04 0.52 0.34 1.05 3.07 -1.96 -1.05 114.58 116.59 1vsy h GLU 3076Ca 0.05 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.86 1vsy h GLU 3076Cb 0.32 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.11 1vsy h GLU 3076CO 0.00 0.34 -0.17 1.15 -1.40 0.00 0.00 179.01 178.94 1vsy h THR 3077N 0.54 0.63 -0.95 1.13 2.02 -1.93 -3.03 112.91 111.30 1vsy h THR 3077Ca 0.37 -0.55 0.17 0.00 0.77 0.00 0.00 66.41 67.17 1vsy h THR 3077Cb 0.46 0.89 -0.08 0.00 -1.74 0.00 0.00 68.15 67.68 1vsy h THR 3077CO -0.32 0.10 0.60 0.15 0.37 0.00 0.00 175.52 176.43 1vsy h PHE 3078N -0.79 0.91 0.32 3.16 3.57 -0.92 -0.49 116.94 122.70 1vsy h PHE 3078Ca -0.05 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.48 1vsy h PHE 3078Cb 0.52 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 38.95 1vsy h PHE 3078CO 0.02 0.28 -0.45 1.15 -2.23 0.00 0.00 178.31 177.08 1vsy h THR 3079N 0.71 0.12 -0.07 4.41 2.02 -1.15 0.02 112.91 118.97 1vsy h THR 3079Ca 0.51 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.71 1vsy h THR 3079Cb 0.83 0.12 -0.00 0.00 -1.74 0.00 0.00 68.15 67.36 1vsy h THR 3079CO -0.27 0.00 0.16 1.56 0.37 0.00 0.00 175.52 177.35 1vsy h GLN 3080N -0.82 0.00 0.01 6.66 1.08 -1.01 -0.46 115.11 120.57 1vsy h GLN 3080Ca -0.02 0.00 -0.23 0.00 -1.45 0.00 0.00 58.65 56.95 1vsy h GLN 3080Cb 0.76 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.16 1vsy h GLN 3080CO -0.14 0.00 -1.14 1.25 -0.95 0.00 0.00 178.83 177.85 1vsy h LEU 3081N 0.00 0.03 -0.20 1.46 5.85 -0.21 -2.83 115.31 119.40 1vsy h LEU 3081Ca 0.03 -0.04 -0.15 0.00 0.84 0.00 0.00 57.88 58.57 1vsy h LEU 3081Cb 0.36 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.38 1vsy h LEU 3081CO -0.00 1.03 -0.45 0.58 -0.34 0.00 0.00 178.44 179.26 1vsy h VAL 3082N 0.01 1.32 0.17 1.05 2.07 0.54 -1.28 116.25 120.14 1vsy h VAL 3082Ca -0.07 -1.67 -0.00 0.00 0.82 0.00 0.00 66.70 65.77 1vsy h VAL 3082Cb 1.83 1.86 -0.01 0.00 -1.52 0.00 0.00 31.29 33.45 1vsy h VAL 3082CO 0.13 0.52 -0.19 -1.28 0.02 0.00 0.00 177.57 176.77 1vsy h SER 3083N 0.35 -0.52 -0.83 0.57 0.87 -1.35 0.13 113.55 112.78 1vsy h SER 3083Ca 0.00 0.04 0.08 0.00 -1.23 0.00 0.00 61.79 60.68 1vsy h SER 3083Cb 1.05 0.17 -0.06 0.00 -0.44 0.00 0.00 62.40 63.13 1vsy h SER 3083CO 0.10 -0.24 0.54 0.77 -0.53 0.00 0.00 176.83 177.46 1vsy h SER 3084N -0.36 0.75 -0.65 6.23 4.64 -1.61 -1.02 113.55 121.53 1vsy h SER 3084Ca -0.02 0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.24 1vsy h SER 3084Cb 0.32 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.24 1vsy h SER 3084CO -0.03 0.47 0.13 -1.28 -0.87 0.00 0.00 176.83 175.25 1vsy h SER 3085N 0.84 1.01 -0.18 4.97 0.87 -1.02 -2.04 113.55 118.00 1vsy h SER 3085Ca 0.37 -0.25 -0.15 0.00 -1.23 0.00 0.00 61.79 60.53 1vsy h SER 3085Cb 0.33 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.03 1vsy h SER 3085CO -0.14 1.00 -0.48 -0.07 -0.53 0.00 0.00 176.83 176.61 1vsy h LEU 3086N 0.98 0.74 -0.20 2.23 3.38 0.20 -3.13 115.31 119.51 1vsy h LEU 3086Ca 0.20 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1vsy h LEU 3086Cb 0.40 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1vsy h LEU 3086CO 0.01 1.18 0.00 0.00 0.09 0.00 0.00 178.44 179.72 1vsy n TYR 3087N -4.18 0.26 -0.27 1.13 9.36 -0.48 -2.38 117.16 120.59 1vsy n TYR 3087Ca -0.06 0.10 0.00 0.00 3.32 0.00 0.00 57.90 61.26 1vsy n TYR 3087Cb 0.58 -0.66 0.13 0.00 -0.63 0.00 0.00 39.34 38.76 1vsy n TYR 3087CO 0.00 0.00 0.00 1.49 0.22 0.00 0.00 176.86 178.57 1vsy h GLU 3088N 0.00 0.78 -2.01 2.98 4.81 -1.31 -2.70 114.58 117.13 1vsy h GLU 3088Ca 0.00 -0.05 -0.76 0.00 -0.13 0.00 0.00 59.36 58.42 1vsy h GLU 3088Cb 0.32 -0.18 -0.28 0.00 0.63 0.00 0.00 28.75 29.24 1vsy h GLU 3088CO 0.00 0.52 0.93 0.54 -0.73 0.00 0.00 179.01 180.27 1vsy n ARG 3089N -4.72 3.21 -0.34 1.92 5.12 -1.00 -4.81 116.66 116.04 1vsy n ARG 3089Ca 0.11 -3.77 0.04 0.00 -1.93 0.00 0.00 57.85 52.30 1vsy n ARG 3089Cb 0.20 -2.30 0.22 0.00 -1.16 0.00 0.00 32.46 29.42 1vsy n ARG 3089CO 0.00 0.00 0.00 -0.09 -1.93 0.00 0.00 177.63 175.61 1vsy h ARG 3090N 3.16 1.05 -0.93 5.56 9.65 -1.63 -2.50 114.38 128.74 1vsy h ARG 3090Ca 0.54 -0.06 -0.63 0.00 -1.10 0.00 0.00 59.98 58.73 1vsy h ARG 3090Cb 0.13 -0.24 -0.32 0.00 -1.39 0.00 0.00 29.97 28.16 1vsy h ARG 3090CO 1.36 0.69 0.47 1.19 2.80 0.00 0.00 179.97 186.48 1vsy n PHE 3091N -4.52 3.06 0.00 2.20 3.72 -1.26 -4.44 117.46 116.22 1vsy n PHE 3091Ca 0.16 -2.76 0.00 0.00 -0.05 0.00 0.00 57.45 54.80 1vsy n PHE 3091Cb 0.23 -1.16 0.00 0.00 -0.94 0.00 0.00 39.48 37.61 1vsy n PHE 3091CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1vsy n GLY 3092N -0.89 -1.80 3.82 1.37 0.00 -1.07 -5.17 105.19 101.44 1vsy n GLY 3092Ca 0.58 0.76 -0.31 0.00 0.00 0.00 0.00 46.02 47.05 1vsy n GLY 3092CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1vsy s PRO 3093N 0.00 2.71 -0.09 1.61 0.02 -0.96 -4.85 135.00 133.44 1vsy s PRO 3093Ca 0.00 0.84 -0.27 0.00 0.02 0.00 0.00 61.00 61.59 1vsy s PRO 3093Cb 0.00 -1.97 -0.02 0.00 0.02 0.00 0.00 34.50 32.52 1vsy s PRO 3093CO 0.00 -1.23 0.89 0.71 -0.33 0.00 0.00 177.00 177.04 1vsy s TYR 3094N -3.09 3.54 -1.33 6.54 2.02 -1.26 -4.95 117.35 118.81 1vsy s TYR 3094Ca 0.59 1.46 -0.14 0.00 -0.37 0.00 0.00 57.07 58.60 1vsy s TYR 3094Cb -0.14 -3.05 0.09 0.00 -0.40 0.00 0.00 41.96 38.47 1vsy s TYR 3094CO 0.55 -0.11 1.87 1.19 -1.57 0.00 0.00 175.55 177.47 1vsy n PHE 3095N 4.56 4.06 -4.24 2.71 3.72 -1.26 -4.72 117.46 122.29 1vsy n PHE 3095Ca 0.05 -2.96 -0.13 0.00 -0.05 0.00 0.00 57.45 54.35 1vsy n PHE 3095Cb 0.50 -2.42 -0.10 0.00 -0.94 0.00 0.00 39.48 36.52 1vsy n PHE 3095CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 1vsy s VAL 3096N 2.78 0.63 -0.41 -4.37 -7.23 -1.26 -1.69 120.40 108.85 1vsy s VAL 3096Ca 0.47 -1.98 0.08 0.00 -1.81 0.00 0.00 61.98 58.75 1vsy s VAL 3096Cb 0.07 -2.16 0.26 0.00 0.56 0.00 0.00 36.38 35.11 1vsy s VAL 3096CO -0.00 -0.43 0.55 0.61 -0.31 0.00 0.00 175.10 175.52 1vsy n GLY 3097N -0.25 3.09 3.75 2.32 0.00 -0.30 -3.78 105.19 110.02 1vsy n GLY 3097Ca -0.06 -1.69 -0.38 0.00 0.00 0.00 0.00 46.02 43.89 1vsy n GLY 3097CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1vsy s PRO 3098N -1.38 3.30 -0.09 1.61 0.02 -1.26 -3.89 135.00 133.31 1vsy s PRO 3098Ca 0.36 2.18 0.00 0.00 0.02 0.00 0.00 61.00 63.55 1vsy s PRO 3098Cb 0.18 -2.33 0.02 0.00 0.02 0.00 0.00 34.50 32.40 1vsy s PRO 3098CO -0.10 -1.04 -0.07 0.08 -0.33 0.00 0.00 177.00 175.53 1vsy s VAL 3099N -1.33 0.94 -0.13 3.83 1.01 0.13 -2.06 120.40 122.79 1vsy s VAL 3099Ca 0.69 -0.27 -0.07 0.00 0.00 0.00 0.00 61.98 62.33 1vsy s VAL 3099Cb -0.39 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 1vsy s VAL 3099CO 0.46 0.34 0.12 -0.69 0.00 0.00 0.00 175.10 175.34 1vsy s VAL 3100N 1.48 5.32 -0.20 2.92 1.01 0.65 -0.94 120.40 130.64 1vsy s VAL 3100Ca 0.00 0.14 -0.17 0.00 0.00 0.00 0.00 61.98 61.96 1vsy s VAL 3100Cb -0.13 -3.33 0.05 0.00 0.00 0.00 0.00 36.38 32.97 1vsy s VAL 3100CO -0.05 0.58 0.52 0.00 0.00 0.00 0.00 175.10 176.15 1vsy s ALA 3101N -0.72 -1.30 0.00 5.51 0.00 -0.45 -1.30 121.76 123.51 1vsy s ALA 3101Ca 0.13 1.55 0.00 0.00 0.00 0.00 0.00 51.96 53.64 1vsy s ALA 3101Cb -0.12 -0.91 0.00 0.00 0.00 0.00 0.00 23.12 22.09 1vsy s ALA 3101CO 0.03 -0.26 0.00 0.41 0.00 0.00 0.00 175.76 175.94 1vsy n GLY 3102N 3.13 -2.09 3.08 0.00 0.00 -0.72 -1.34 105.19 107.25 1vsy n GLY 3102Ca -0.15 -1.18 -0.32 0.00 0.00 0.00 0.00 46.02 44.37 1vsy n GLY 3102CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vsy s ILE 3103N -2.14 1.89 -0.25 -0.61 1.01 -1.26 -1.72 121.20 118.13 1vsy s ILE 3103Ca 0.00 -0.88 -0.31 0.00 0.00 0.00 0.00 60.65 59.46 1vsy s ILE 3103Cb 0.00 -1.75 -0.08 0.00 0.01 0.00 0.00 42.46 40.64 1vsy s ILE 3103CO 0.00 0.47 2.18 -3.20 0.00 0.00 0.00 174.94 174.40 1vsy n ASN 3104N 4.66 2.92 0.26 3.58 2.85 -0.86 -4.86 115.26 123.82 1vsy n ASN 3104Ca -0.19 0.34 0.14 0.00 -0.11 0.00 0.00 54.58 54.76 1vsy n ASN 3104Cb 0.50 -1.44 0.67 0.00 1.24 0.00 0.00 39.78 40.74 1vsy n ASN 3104CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 1vsy h SER 3105N 13.65 0.00 0.11 1.20 4.64 -1.95 0.82 113.55 132.03 1vsy h SER 3105Ca -0.37 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.78 1vsy h SER 3105Cb 1.27 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.37 1vsy h SER 3105CO 0.98 0.10 -0.79 0.50 -0.87 0.00 0.00 176.83 176.75 1vsy h LYS 3106N 0.00 0.24 -0.01 4.77 1.63 -1.99 -3.38 116.57 117.82 1vsy h LYS 3106Ca -0.00 -0.40 0.00 0.00 -0.85 0.00 0.00 60.65 59.39 1vsy h LYS 3106Cb 0.50 0.15 0.00 0.00 -0.60 0.00 0.00 32.23 32.28 1vsy h LYS 3106CO 0.01 1.19 -0.50 -1.13 -3.45 0.00 0.00 179.45 175.58 1vsy n SER 3107N -4.18 1.82 0.00 4.20 3.41 -1.12 -4.96 113.62 112.80 1vsy n SER 3107Ca -0.15 -1.41 0.00 0.00 -0.26 0.00 0.00 58.87 57.05 1vsy n SER 3107Cb 0.78 0.54 0.00 0.00 -0.26 0.00 0.00 64.21 65.26 1vsy n SER 3107CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vsy n GLY 3108N 1.36 0.07 3.73 5.00 0.00 0.28 -4.94 105.19 110.70 1vsy n GLY 3108Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1vsy n GLY 3108CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vsy s LYS 3109N -1.45 4.53 0.46 1.61 1.02 -1.23 -4.78 119.74 119.90 1vsy s LYS 3109Ca 0.00 1.73 -0.22 0.00 0.02 0.00 0.00 55.97 57.49 1vsy s LYS 3109Cb 0.00 -3.31 -0.08 0.00 -0.52 0.00 0.00 37.83 33.93 1vsy s LYS 3109CO 0.00 -0.06 1.13 -2.14 -0.92 0.00 0.00 175.35 173.37 1vsy s PRO 3110N 0.21 3.78 -0.12 -1.68 0.02 -1.26 -2.02 135.00 133.93 1vsy s PRO 3110Ca 0.53 1.69 -0.05 0.00 0.02 0.00 0.00 61.00 63.18 1vsy s PRO 3110Cb -0.29 -2.36 0.05 0.00 0.02 0.00 0.00 34.50 31.92 1vsy s PRO 3110CO 0.33 -0.51 0.26 0.12 -0.33 0.00 0.00 177.00 176.86 1vsy s PHE 3111N -1.62 -0.38 0.07 6.54 2.19 -0.70 -4.93 117.98 119.16 1vsy s PHE 3111Ca 0.64 0.88 0.03 0.00 0.33 0.00 0.00 56.93 58.80 1vsy s PHE 3111Cb -0.26 0.02 -0.03 0.00 -1.31 0.00 0.00 43.02 41.44 1vsy s PHE 3111CO 0.32 -0.28 -0.08 0.96 1.83 0.00 0.00 175.22 177.96 1vsy s ILE 3112N 1.70 0.71 -0.02 3.12 -4.36 -1.26 -1.76 121.20 119.34 1vsy s ILE 3112Ca -0.05 -1.45 -0.29 0.00 -0.26 0.00 0.00 60.65 58.60 1vsy s ILE 3112Cb -0.11 -1.10 0.09 0.00 1.25 0.00 0.00 42.46 42.59 1vsy s ILE 3112CO -0.09 -0.54 0.80 0.00 0.24 0.00 0.00 174.94 175.35 1vsy s ALA 3113N -2.22 -1.79 0.25 2.27 0.00 -0.42 -3.63 121.76 116.23 1vsy s ALA 3113Ca -0.00 1.13 0.02 0.00 0.00 0.00 0.00 51.96 53.11 1vsy s ALA 3113Cb -0.04 0.12 -0.05 0.00 0.00 0.00 0.00 23.12 23.15 1vsy s ALA 3113CO -0.01 -0.52 0.05 0.20 0.00 0.00 0.00 175.76 175.48 1vsy s GLY 3114N -1.84 1.69 0.13 0.00 0.00 -0.26 -0.26 107.32 106.79 1vsy s GLY 3114Ca -0.02 -1.85 0.02 0.00 0.00 0.00 0.00 44.72 42.88 1vsy s GLY 3114CO -0.02 -1.65 -0.05 -1.36 0.00 0.00 0.00 173.10 170.03 1vsy s PHE 3115N -3.58 1.07 0.44 1.90 0.40 -0.87 -0.55 117.98 116.79 1vsy s PHE 3115Ca 0.34 -0.92 0.05 0.00 -0.60 0.00 0.00 56.93 55.80 1vsy s PHE 3115Cb 0.07 -0.60 0.01 0.00 0.51 0.00 0.00 43.02 43.02 1vsy s PHE 3115CO 0.12 -0.12 0.62 0.16 0.70 0.00 0.00 175.22 176.69 1vsy s ASP 3116N -3.11 5.62 0.00 1.36 -4.77 -1.21 -4.18 116.67 110.38 1vsy s ASP 3116Ca 0.17 -0.20 0.00 0.00 -3.30 0.00 0.00 52.55 49.22 1vsy s ASP 3116Cb 0.05 -0.90 0.00 0.00 -1.09 0.00 0.00 42.92 40.98 1vsy s ASP 3116CO -0.01 -0.81 0.87 0.00 0.70 0.00 0.00 175.17 175.92 1vsy n LEU 3117N -1.97 0.00 -0.03 2.11 -0.00 -1.25 -0.14 117.00 115.72 1vsy n LEU 3117Ca 0.06 0.38 0.03 0.00 -0.00 0.00 0.00 56.01 56.48 1vsy n LEU 3117Cb 0.59 -0.38 0.04 0.00 -0.00 0.00 0.00 43.42 43.68 1vsy n LEU 3117CO 0.42 -0.38 0.51 2.30 -0.00 0.00 0.00 177.39 180.24 1vsy n ILE 3118N -1.37 1.23 0.00 1.47 -5.35 -1.26 -4.32 119.36 109.75 1vsy n ILE 3118Ca 0.00 -1.34 0.00 0.00 -0.27 0.00 0.00 62.75 61.14 1vsy n ILE 3118Cb 0.03 0.29 0.00 0.00 -1.74 0.00 0.00 39.64 38.21 1vsy n ILE 3118CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1vsy n GLY 3119N -0.77 1.02 3.69 3.28 0.00 0.80 -3.72 105.19 109.49 1vsy n GLY 3119Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1vsy n GLY 3119CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vsy s ILE 3121N 2.49 4.70 -0.65 0.00 1.01 -1.26 -3.36 121.20 124.14 1vsy s ILE 3121Ca 0.74 -0.23 -0.20 0.00 0.00 0.00 0.00 60.65 60.95 1vsy s ILE 3121Cb -0.41 -4.39 0.09 0.00 0.01 0.00 0.00 42.46 37.77 1vsy s ILE 3121CO 0.32 -0.92 0.86 -0.62 0.00 0.00 0.00 174.94 174.58 1vsy s ASP 3122N 2.76 6.22 0.03 3.58 2.15 0.29 -4.97 116.67 126.73 1vsy s ASP 3122Ca 0.20 -1.30 -0.13 0.00 0.43 0.00 0.00 52.55 51.75 1vsy s ASP 3122Cb -0.17 -2.36 -0.06 0.00 -0.30 0.00 0.00 42.92 40.03 1vsy s ASP 3122CO 0.14 -1.25 0.41 -0.70 -0.17 0.00 0.00 175.17 173.60 1vsy s GLU 3123N 3.28 3.87 -0.18 4.34 2.12 -1.26 -1.11 118.70 129.76 1vsy s GLU 3123Ca 0.18 0.34 -0.16 0.00 0.36 0.00 0.00 54.97 55.69 1vsy s GLU 3123Cb -0.19 -3.14 0.05 0.00 0.26 0.00 0.00 34.13 31.10 1vsy s GLU 3123CO 0.07 0.65 0.47 0.00 -0.54 0.00 0.00 175.26 175.90 1vsy s ALA 3124N -1.19 -1.17 0.10 6.30 0.00 -1.24 -5.03 121.76 119.54 1vsy s ALA 3124Ca 0.27 1.34 -0.08 0.00 0.00 0.00 0.00 51.96 53.49 1vsy s ALA 3124Cb -0.16 -0.78 -0.18 0.00 0.00 0.00 0.00 23.12 22.01 1vsy s ALA 3124CO 0.15 -0.22 1.23 1.57 0.00 0.00 0.00 175.76 178.48 1vsy h LYS 3125N 5.43 0.49 0.00 0.00 2.10 -1.98 -3.41 116.57 119.20 1vsy h LYS 3125Ca -0.27 -0.57 0.00 0.00 -2.00 0.00 0.00 60.65 57.80 1vsy h LYS 3125Cb 1.18 0.18 0.00 0.00 -0.90 0.00 0.00 32.23 32.68 1vsy h LYS 3125CO 0.21 1.21 0.00 -0.40 -2.00 0.00 0.00 179.45 178.47 1vsy n ASP 3126N -3.75 0.00 -3.54 7.07 5.68 -1.26 -4.45 116.55 116.31 1vsy n ASP 3126Ca -0.09 0.13 -0.12 0.00 -0.50 0.00 0.00 54.79 54.21 1vsy n ASP 3126Cb 0.90 -0.14 -0.04 0.00 -1.14 0.00 0.00 41.12 40.69 1vsy n ASP 3126CO 0.00 0.00 0.00 0.72 -1.33 0.00 0.00 177.20 176.59 1vsy s PHE 3127N -0.28 -0.40 -0.04 2.11 -0.12 -1.26 -2.81 117.98 115.18 1vsy s PHE 3127Ca 0.00 0.23 0.03 0.00 -0.05 0.00 0.00 56.93 57.14 1vsy s PHE 3127Cb 0.00 0.39 0.00 0.00 -0.63 0.00 0.00 43.02 42.79 1vsy s PHE 3127CO 0.00 -0.74 -0.12 0.42 -0.05 0.00 0.00 175.22 174.73 1vsy s ILE 3128N -3.37 1.06 0.21 -4.49 -1.09 -0.22 -4.92 121.20 108.38 1vsy s ILE 3128Ca -0.00 -0.50 0.07 0.00 -2.23 0.00 0.00 60.65 57.99 1vsy s ILE 3128Cb 0.00 -0.94 -0.05 0.00 -1.58 0.00 0.00 42.46 39.90 1vsy s ILE 3128CO -0.09 0.32 -0.11 0.68 -1.23 0.00 0.00 174.94 174.51 1vsy s VAL 3129N 0.23 1.56 -0.28 2.92 -7.23 -1.26 -1.05 120.40 115.29 1vsy s VAL 3129Ca -0.05 -2.16 -0.24 0.00 -1.81 0.00 0.00 61.98 57.72 1vsy s VAL 3129Cb -0.11 -2.11 0.13 0.00 0.56 0.00 0.00 36.38 34.85 1vsy s VAL 3129CO 0.02 -0.54 1.08 -0.55 -0.31 0.00 0.00 175.10 174.79 1vsy s SER 3130N -3.31 -0.40 0.00 4.85 0.15 -0.70 -5.01 113.70 109.27 1vsy s SER 3130Ca 0.23 0.76 0.00 0.00 0.70 0.00 0.00 55.95 57.65 1vsy s SER 3130Cb 0.01 0.82 0.00 0.00 -1.71 0.00 0.00 66.02 65.14 1vsy s SER 3130CO 0.07 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 174.99 1vsy n GLY 3131N 2.32 0.71 0.13 9.45 0.00 -1.26 -0.58 105.19 115.95 1vsy n GLY 3131Ca -0.13 -1.74 0.12 0.00 0.00 0.00 0.00 46.02 44.28 1vsy n GLY 3131CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1vsy h THR 3132N 0.00 0.00 -0.93 2.61 1.35 -1.77 -3.12 112.91 111.05 1vsy h THR 3132Ca 0.00 -0.76 -0.62 0.00 -0.55 0.00 0.00 66.41 64.48 1vsy h THR 3132Cb 0.00 1.54 -0.36 0.00 -1.73 0.00 0.00 68.15 67.60 1vsy h THR 3132CO 0.00 0.00 0.01 0.00 -0.25 0.00 0.00 175.52 175.28 1vsy n ALA 3133N -1.99 5.67 -0.30 6.62 0.00 -1.26 -4.75 120.51 124.51 1vsy n ALA 3133Ca 0.03 -3.68 -0.08 0.00 0.00 0.00 0.00 53.44 49.71 1vsy n ALA 3133Cb 0.49 -1.04 -0.04 0.00 0.00 0.00 0.00 19.45 18.86 1vsy n ALA 3133CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1vsy h SER 3134N 2.14 -1.71 0.48 0.00 0.02 -1.82 -2.05 113.55 110.60 1vsy h SER 3134Ca 0.48 0.28 -0.02 0.00 -0.84 0.00 0.00 61.79 61.69 1vsy h SER 3134Cb 1.14 0.79 0.00 0.00 0.14 0.00 0.00 62.40 64.47 1vsy h SER 3134CO 1.16 -0.30 -0.23 0.44 -1.14 0.00 0.00 176.83 176.76 1vsy h ASP 3135N -0.13 -0.55 -0.46 3.07 5.19 -1.90 -2.66 116.42 118.98 1vsy h ASP 3135Ca 0.20 0.01 0.03 0.00 -0.62 0.00 0.00 57.03 56.65 1vsy h ASP 3135Cb 0.53 0.14 -0.04 0.00 0.18 0.00 0.00 39.33 40.15 1vsy h ASP 3135CO -0.81 -0.38 0.25 1.56 -3.12 0.00 0.00 179.24 176.74 1vsy h GLN 3136N -0.66 0.48 -0.70 3.56 7.50 -1.89 -1.81 115.11 121.59 1vsy h GLN 3136Ca -0.07 -0.03 0.02 0.00 0.50 0.00 0.00 58.65 59.08 1vsy h GLN 3136Cb 0.50 -0.11 -0.04 0.00 0.05 0.00 0.00 27.48 27.89 1vsy h GLN 3136CO 0.11 0.32 0.45 -0.07 -1.50 0.00 0.00 178.83 178.13 1vsy h LEU 3137N 0.49 0.75 -1.83 1.46 3.38 -1.41 -1.19 115.31 116.96 1vsy h LEU 3137Ca 0.19 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.19 1vsy h LEU 3137Cb 0.07 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1vsy h LEU 3137CO -0.12 0.53 0.19 -0.26 0.09 0.00 0.00 178.44 178.87 1vsy h PHE 3138N 0.89 0.22 -0.08 1.13 0.04 -1.01 -0.07 116.94 118.06 1vsy h PHE 3138Ca 0.27 0.01 -0.08 0.00 2.80 0.00 0.00 57.97 60.97 1vsy h PHE 3138Cb -0.04 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.04 1vsy h PHE 3138CO -0.03 0.13 -0.25 0.78 -0.60 0.00 0.00 178.31 178.33 1vsy h GLY 3139N 0.22 0.34 0.76 -1.45 0.00 -0.46 -2.41 103.07 100.07 1vsy h GLY 3139Ca 0.12 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 1vsy h GLY 3139CO -0.02 0.39 -0.10 -0.33 0.00 0.00 0.00 176.54 176.49 1vsy h MET 3140N -0.18 -0.26 -0.47 4.80 2.86 -0.80 -3.21 114.93 117.68 1vsy h MET 3140Ca -0.01 0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.69 1vsy h MET 3140Cb 0.88 0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.55 1vsy h MET 3140CO 0.05 0.01 0.21 0.00 1.06 0.00 0.00 176.91 178.24 1vsy h GLU 3142N 0.42 0.00 0.00 0.00 4.57 -1.45 -1.99 114.58 116.13 1vsy h GLU 3142Ca 0.21 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.33 1vsy h GLU 3142Cb 0.15 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.73 1vsy h GLU 3142CO -0.17 0.00 -0.93 0.43 -1.18 0.00 0.00 179.01 177.16 1vsy n SER 3143N -3.82 1.88 0.06 1.04 7.64 -0.75 -4.61 113.62 115.05 1vsy n SER 3143Ca 0.01 0.47 0.09 0.00 1.01 0.00 0.00 58.87 60.46 1vsy n SER 3143Cb 0.29 -0.82 0.40 0.00 -1.01 0.00 0.00 64.21 63.07 1vsy n SER 3143CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1vsy n LEU 3144N -4.51 0.31 -4.79 -3.43 4.77 0.32 -4.82 117.00 104.85 1vsy n LEU 3144Ca -0.16 0.57 -0.39 0.00 -0.03 0.00 0.00 56.01 56.01 1vsy n LEU 3144Cb 0.45 -0.53 -0.06 0.00 -2.33 0.00 0.00 43.42 40.95 1vsy n LEU 3144CO 0.15 -0.37 0.25 -0.47 -1.33 0.00 0.00 177.39 175.62 1vsy s TYR 3145N -3.14 3.75 0.03 -1.77 5.04 -0.76 -4.98 117.35 115.52 1vsy s TYR 3145Ca 0.06 1.20 0.02 0.00 -2.44 0.00 0.00 57.07 55.91 1vsy s TYR 3145Cb 0.10 -2.51 -0.02 0.00 0.35 0.00 0.00 41.96 39.88 1vsy s TYR 3145CO 0.34 0.51 -0.07 -1.83 -1.34 0.00 0.00 175.55 173.15 1vsy s GLU 3146N -0.75 0.51 0.46 4.97 -1.05 -1.26 -5.01 118.70 116.57 1vsy s GLU 3146Ca 0.29 -0.58 -0.17 0.00 -0.15 0.00 0.00 54.97 54.35 1vsy s GLU 3146Cb -0.19 -0.34 -0.09 0.00 -0.44 0.00 0.00 34.13 33.07 1vsy s GLU 3146CO 0.17 0.07 0.94 -1.25 0.95 0.00 0.00 175.26 176.14 1vsy s PRO 3147N -1.13 4.02 -0.28 -4.83 0.05 -1.26 -3.85 135.00 127.72 1vsy s PRO 3147Ca -0.06 0.93 0.00 0.00 0.05 0.00 0.00 61.00 61.92 1vsy s PRO 3147Cb -0.08 -2.20 0.00 0.00 0.05 0.00 0.00 34.50 32.28 1vsy s PRO 3147CO 0.00 -0.14 0.00 0.09 0.05 0.00 0.00 177.00 177.00 1vsy n ASN 3148N -1.18 -2.28 -4.76 6.66 5.03 -1.26 -4.92 115.26 112.54 1vsy n ASN 3148Ca 0.06 0.02 -0.41 0.00 0.87 0.00 0.00 54.58 55.12 1vsy n ASN 3148Cb 0.54 -1.13 -0.01 0.00 -1.02 0.00 0.00 39.78 38.16 1vsy n ASN 3148CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1vsy s LEU 3149N -0.80 4.34 0.58 3.41 1.43 -1.25 -3.84 118.68 122.55 1vsy s LEU 3149Ca 0.00 2.97 -0.19 0.00 -1.03 0.00 0.00 54.13 55.88 1vsy s LEU 3149Cb 0.00 -3.65 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 1vsy s LEU 3149CO 0.00 -0.88 1.17 -1.61 0.23 0.00 0.00 176.35 175.26 1vsy s GLU 3150N -1.14 3.11 0.12 1.70 0.41 -1.26 -1.09 118.70 120.55 1vsy s GLU 3150Ca 0.59 1.71 -0.27 0.00 -0.41 0.00 0.00 54.97 56.58 1vsy s GLU 3150Cb -0.47 -1.96 -0.07 0.00 -1.78 0.00 0.00 34.13 29.85 1vsy s GLU 3150CO 0.54 -1.07 1.63 -1.35 -0.49 0.00 0.00 175.26 174.52 1vsy h PRO 3151N 0.95 -0.47 0.00 0.39 0.11 -1.94 0.95 132.00 132.00 1vsy h PRO 3151Ca -0.50 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1vsy h PRO 3151Cb 1.28 0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.50 1vsy h PRO 3151CO 0.56 -0.31 0.14 0.93 -0.21 0.00 0.00 178.00 179.11 1vsy h GLU 3152N -0.48 0.00 0.10 1.05 3.07 -2.01 -0.09 114.58 116.22 1vsy h GLU 3152Ca 0.04 0.00 -0.29 0.00 -0.50 0.00 0.00 59.36 58.61 1vsy h GLU 3152Cb 0.53 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.43 1vsy h GLU 3152CO -0.20 0.00 -1.53 -0.44 -1.40 0.00 0.00 179.01 175.44 1vsy h ASP 3153N 0.00 0.34 0.87 1.42 3.32 -1.53 -3.37 116.42 117.47 1vsy h ASP 3153Ca 0.00 -0.83 0.00 0.00 0.02 0.00 0.00 57.03 56.22 1vsy h ASP 3153Cb 0.29 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1vsy h ASP 3153CO 0.00 1.66 0.00 0.25 -1.72 0.00 0.00 179.24 179.43 1vsy h LEU 3154N -0.30 0.00 -0.20 1.55 5.85 0.91 -1.82 115.31 121.29 1vsy h LEU 3154Ca -0.34 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.26 1vsy h LEU 3154Cb 1.77 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.80 1vsy h LEU 3154CO 0.03 0.00 -0.34 0.15 -0.34 0.00 0.00 178.44 177.94 1vsy h PHE 3155N 0.00 0.74 -0.34 1.25 3.57 -1.41 -1.82 116.94 118.93 1vsy h PHE 3155Ca 0.00 -0.26 -0.02 0.00 3.53 0.00 0.00 57.97 61.22 1vsy h PHE 3155Cb 0.43 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 1vsy h PHE 3155CO 0.00 0.99 0.12 0.93 -2.23 0.00 0.00 178.31 178.13 1vsy h GLU 3156N 0.27 0.52 0.15 1.11 4.39 -1.52 -1.39 114.58 118.11 1vsy h GLU 3156Ca 0.01 -0.10 -0.01 0.00 0.34 0.00 0.00 59.36 59.61 1vsy h GLU 3156Cb 0.93 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 1vsy h GLU 3156CO 0.08 0.53 -0.07 1.15 -1.16 0.00 0.00 179.01 179.53 1vsy h THR 3157N 0.40 0.90 -0.23 1.13 2.02 -1.42 -2.00 112.91 113.72 1vsy h THR 3157Ca 0.11 -0.22 -0.09 0.00 0.77 0.00 0.00 66.41 66.98 1vsy h THR 3157Cb 0.21 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 1vsy h THR 3157CO -0.01 0.05 -0.25 -0.29 0.37 0.00 0.00 175.52 175.39 1vsy h ILE 3158N -0.31 1.26 -0.47 3.11 2.10 -1.31 -2.09 117.51 119.80 1vsy h ILE 3158Ca -0.02 -1.24 -0.02 0.00 1.08 0.00 0.00 64.86 64.66 1vsy h ILE 3158Cb 0.24 1.36 -0.02 0.00 -1.09 0.00 0.00 36.82 37.31 1vsy h ILE 3158CO 0.03 0.39 0.22 0.28 -1.08 0.00 0.00 178.15 177.99 1vsy h SER 3159N 0.39 0.62 0.61 2.19 0.02 -1.20 -1.78 113.55 114.39 1vsy h SER 3159Ca 0.06 -0.14 -0.12 0.00 -0.84 0.00 0.00 61.79 60.75 1vsy h SER 3159Cb 0.65 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 1vsy h SER 3159CO 0.05 0.59 -0.56 1.56 -1.14 0.00 0.00 176.83 177.32 1vsy h GLN 3160N 0.62 0.00 -0.26 3.45 1.08 -1.03 0.50 115.11 119.47 1vsy h GLN 3160Ca 0.16 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.27 1vsy h GLN 3160Cb 0.14 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.56 1vsy h GLN 3160CO -0.02 0.56 -0.19 0.00 -0.95 0.00 0.00 178.83 178.24 1vsy h ALA 3161N 1.44 0.37 0.61 3.87 0.00 -1.25 -2.73 119.26 121.56 1vsy h ALA 3161Ca -0.01 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1vsy h ALA 3161Cb 1.02 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.73 1vsy h ALA 3161CO 0.07 0.30 -0.29 1.25 0.00 0.00 0.00 179.25 180.58 1vsy h LEU 3162N 0.30 -0.69 -0.76 0.00 6.46 -1.08 -2.99 115.31 116.55 1vsy h LEU 3162Ca 0.05 0.02 0.11 0.00 -0.12 0.00 0.00 57.88 57.94 1vsy h LEU 3162Cb 0.73 0.18 -0.13 0.00 -0.73 0.00 0.00 40.66 40.71 1vsy h LEU 3162CO 0.05 -0.29 -0.43 -0.07 -0.62 0.00 0.00 178.44 177.08 1vsy h LEU 3163N -1.21 -1.51 -0.21 2.25 4.07 -1.02 -1.87 115.31 115.80 1vsy h LEU 3163Ca -0.08 0.27 0.00 0.00 0.08 0.00 0.00 57.88 58.15 1vsy h LEU 3163Cb 0.63 0.72 0.00 0.00 1.08 0.00 0.00 40.66 43.09 1vsy h LEU 3163CO 0.14 -0.30 0.00 0.59 -1.08 0.00 0.00 178.44 177.78 1vsy n ASN 3164N -5.41 0.41 -0.02 -0.43 3.02 -1.03 -2.29 115.26 109.51 1vsy n ASN 3164Ca 0.05 0.57 -0.20 0.00 -0.03 0.00 0.00 54.58 54.97 1vsy n ASN 3164Cb 0.35 -0.67 -0.13 0.00 -0.61 0.00 0.00 39.78 38.72 1vsy n ASN 3164CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vsy h ALA 3165N 2.54 0.11 0.00 5.41 0.00 -1.21 -3.32 119.26 122.79 1vsy h ALA 3165Ca 0.00 -0.92 -0.00 0.00 0.00 0.00 0.00 54.91 53.99 1vsy h ALA 3165Cb 0.46 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1vsy h ALA 3165CO 0.00 0.54 -0.02 0.00 0.00 0.00 0.00 179.25 179.77 1vsy h ALA 3166N -0.10 1.09 0.00 0.00 0.00 -1.14 -1.67 119.26 117.43 1vsy h ALA 3166Ca -0.22 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.50 1vsy h ALA 3166Cb 1.48 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.24 1vsy h ALA 3166CO 0.01 0.02 -0.87 -0.44 0.00 0.00 0.00 179.25 177.97 1vsy h ASP 3167N 0.00 0.00 -0.32 0.00 3.32 -1.60 -2.68 116.42 115.14 1vsy h ASP 3167Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1vsy h ASP 3167Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1vsy h ASP 3167CO 0.00 0.78 0.00 0.54 -1.72 0.00 0.00 179.24 178.84 1vsy n ARG 3168N -3.26 2.81 -4.38 3.56 5.12 -0.68 -4.86 116.66 114.97 1vsy n ARG 3168Ca -0.01 -1.60 -0.21 0.00 -1.93 0.00 0.00 57.85 54.11 1vsy n ARG 3168Cb 0.86 -1.78 -0.16 0.00 -1.16 0.00 0.00 32.46 30.23 1vsy n ARG 3168CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1vsy s ASP 3169N -0.53 1.24 0.08 0.55 3.68 -0.88 -5.03 116.67 115.77 1vsy s ASP 3169Ca 0.28 -0.19 -0.07 0.00 2.13 0.00 0.00 52.55 54.70 1vsy s ASP 3169Cb 0.20 -0.42 -0.26 0.00 -1.45 0.00 0.00 42.92 40.99 1vsy s ASP 3169CO 0.10 0.04 1.15 0.00 0.13 0.00 0.00 175.17 176.59 1vsy h ALA 3170N 6.63 0.10 -0.24 3.66 0.00 -1.89 -3.27 119.26 124.24 1vsy h ALA 3170Ca -0.34 -0.84 0.00 0.00 0.00 0.00 0.00 54.91 53.73 1vsy h ALA 3170Cb 1.17 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1vsy h ALA 3170CO 0.48 0.88 0.00 1.28 0.00 0.00 0.00 179.25 181.89 1vsy n LEU 3171N -3.62 2.85 -4.30 0.00 4.77 -1.26 -4.90 117.00 110.54 1vsy n LEU 3171Ca -0.10 -1.15 -0.22 0.00 -0.03 0.00 0.00 56.01 54.51 1vsy n LEU 3171Cb 1.00 -0.15 -0.12 0.00 -2.33 0.00 0.00 43.42 41.82 1vsy n LEU 3171CO 0.55 0.58 -0.49 -0.44 -1.33 0.00 0.00 177.39 176.25 1vsy s SER 3172N -1.64 2.55 0.00 -1.43 0.01 -1.24 -3.19 113.70 108.76 1vsy s SER 3172Ca 0.35 -0.79 0.00 0.00 1.31 0.00 0.00 55.95 56.82 1vsy s SER 3172Cb 0.21 -0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.30 1vsy s SER 3172CO 0.30 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.55 1vsy n GLY 3173N 0.62 0.50 2.42 3.44 0.00 -1.26 -4.69 105.19 106.22 1vsy n GLY 3173Ca -0.16 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.17 1vsy n GLY 3173CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1vsy n TRP 3174N 4.35 0.00 0.00 1.61 7.02 -1.26 -3.09 117.44 126.07 1vsy n TRP 3174Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 1vsy n TRP 3174Cb 0.00 -0.59 0.00 0.00 -2.42 0.00 0.00 31.31 28.30 1vsy n TRP 3174CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1vsy n GLY 3175N -1.81 2.44 3.53 6.99 0.00 -1.26 -4.74 105.19 110.34 1vsy n GLY 3175Ca 0.00 -1.59 -0.12 0.00 0.00 0.00 0.00 46.02 44.31 1vsy n GLY 3175CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vsy s ALA 3176N -1.87 -1.84 0.02 4.61 0.00 -1.26 -2.77 121.76 118.66 1vsy s ALA 3176Ca 0.00 1.32 0.01 0.00 0.00 0.00 0.00 51.96 53.29 1vsy s ALA 3176Cb 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 23.12 22.94 1vsy s ALA 3176CO 0.00 -0.44 -0.05 0.54 0.00 0.00 0.00 175.76 175.82 1vsy s VAL 3177N -1.73 0.30 -0.20 0.00 0.11 -0.62 -0.15 120.40 118.10 1vsy s VAL 3177Ca -0.03 -0.77 -0.04 0.00 -2.93 0.00 0.00 61.98 58.21 1vsy s VAL 3177Cb -0.00 -0.37 0.08 0.00 -1.53 0.00 0.00 36.38 34.55 1vsy s VAL 3177CO 0.01 -0.31 0.16 -0.69 -3.33 0.00 0.00 175.10 170.94 1vsy s VAL 3178N -1.06 -0.20 -0.07 2.04 1.01 0.23 -1.83 120.40 120.52 1vsy s VAL 3178Ca -0.09 -0.24 -0.26 0.00 0.00 0.00 0.00 61.98 61.39 1vsy s VAL 3178Cb -0.08 -0.69 -0.03 0.00 0.00 0.00 0.00 36.38 35.59 1vsy s VAL 3178CO -0.00 -0.32 0.84 -0.31 0.00 0.00 0.00 175.10 175.31 1vsy s TYR 3179N 2.22 3.56 -0.21 5.22 1.51 -0.36 -2.27 117.35 127.03 1vsy s TYR 3179Ca 0.05 1.41 -0.04 0.00 -1.01 0.00 0.00 57.07 57.48 1vsy s TYR 3179Cb -0.16 -2.98 -0.02 0.00 -0.11 0.00 0.00 41.96 38.69 1vsy s TYR 3179CO -0.15 -0.05 -0.02 0.42 -1.11 0.00 0.00 175.55 174.64 1vsy s ILE 3180N 1.29 3.66 -0.41 2.71 -1.09 0.38 -2.30 121.20 125.44 1vsy s ILE 3180Ca 0.43 -0.40 -0.01 0.00 -2.23 0.00 0.00 60.65 58.44 1vsy s ILE 3180Cb -0.18 -2.66 0.11 0.00 -1.58 0.00 0.00 42.46 38.15 1vsy s ILE 3180CO 0.20 0.42 0.18 -0.63 -1.23 0.00 0.00 174.94 173.88 1vsy s ILE 3181N 1.25 3.04 0.96 2.92 1.01 -0.13 -1.48 121.20 128.77 1vsy s ILE 3181Ca 0.03 -2.23 -0.15 0.00 0.00 0.00 0.00 60.65 58.31 1vsy s ILE 3181Cb -0.14 -3.11 0.22 0.00 0.01 0.00 0.00 42.46 39.43 1vsy s ILE 3181CO -0.00 -0.68 1.31 0.29 0.00 0.00 0.00 174.94 175.85 1vsy n LYS 3182N 4.39 -1.17 0.32 2.79 5.02 -0.38 -2.30 118.16 126.84 1vsy n LYS 3182Ca 0.00 -2.17 0.22 0.00 -2.02 0.00 0.00 58.31 54.34 1vsy n LYS 3182Cb 0.41 -1.30 1.10 0.00 -0.02 0.00 0.00 35.03 35.22 1vsy n LYS 3182CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1vsy h LYS 3183N 0.00 0.00 0.00 1.97 3.11 -1.97 -3.36 116.57 116.31 1vsy h LYS 3183Ca -0.42 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.42 1vsy h LYS 3183Cb 1.21 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.44 1vsy h LYS 3183CO 0.31 0.00 0.00 -0.40 -2.81 0.00 0.00 179.45 176.55 1vsy n ASP 3184N -3.08 0.00 -4.70 4.20 3.85 -1.26 -5.05 116.55 110.50 1vsy n ASP 3184Ca -0.02 0.00 -0.34 0.00 -0.71 0.00 0.00 54.79 53.72 1vsy n ASP 3184Cb 0.12 0.00 -0.09 0.00 -1.35 0.00 0.00 41.12 39.81 1vsy n ASP 3184CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 1vsy s GLU 3185N 0.00 2.93 -0.17 0.11 2.12 -1.26 -5.12 118.70 117.31 1vsy s GLU 3185Ca 0.00 -0.50 -0.03 0.00 0.36 0.00 0.00 54.97 54.81 1vsy s GLU 3185Cb 0.00 -2.76 0.05 0.00 0.26 0.00 0.00 34.13 31.68 1vsy s GLU 3185CO 0.00 0.66 0.04 0.08 -0.54 0.00 0.00 175.26 175.50 1vsy s VAL 3186N -1.02 0.43 -0.15 3.70 1.01 -1.26 -1.25 120.40 121.87 1vsy s VAL 3186Ca 0.17 -0.40 -0.08 0.00 0.00 0.00 0.00 61.98 61.68 1vsy s VAL 3186Cb -0.12 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 1vsy s VAL 3186CO 0.07 -0.13 0.14 -0.69 0.00 0.00 0.00 175.10 174.49 1vsy s VAL 3187N 1.91 5.47 -0.33 2.92 1.01 -0.55 -4.94 120.40 125.89 1vsy s VAL 3187Ca 0.00 0.20 0.03 0.00 0.00 0.00 0.00 61.98 62.21 1vsy s VAL 3187Cb -0.16 -3.42 0.10 0.00 0.00 0.00 0.00 36.38 32.90 1vsy s VAL 3187CO -0.08 0.56 0.06 -0.75 0.00 0.00 0.00 175.10 174.89 1vsy s LYS 3188N -0.54 1.28 -0.12 2.72 2.20 -1.26 -0.47 119.74 123.55 1vsy s LYS 3188Ca 0.12 -1.62 -0.06 0.00 -0.36 0.00 0.00 55.97 54.05 1vsy s LYS 3188Cb -0.12 -2.85 -0.04 0.00 -1.51 0.00 0.00 37.83 33.32 1vsy s LYS 3188CO 0.02 -0.94 0.11 1.03 -0.36 0.00 0.00 175.35 175.21 1vsy s ARG 3189N 1.12 3.37 0.18 4.03 0.52 -0.96 -4.92 118.95 122.29 1vsy s ARG 3189Ca 0.10 -0.18 -0.05 0.00 -0.52 0.00 0.00 55.73 55.08 1vsy s ARG 3189Cb -0.19 -3.12 -0.06 0.00 0.52 0.00 0.00 34.95 32.11 1vsy s ARG 3189CO -0.13 0.75 0.42 0.71 0.02 0.00 0.00 175.30 177.07 1vsy s TYR 3190N -0.97 3.47 0.24 -0.53 1.51 -1.26 -0.60 117.35 119.21 1vsy s TYR 3190Ca 0.14 0.57 0.09 0.00 -1.01 0.00 0.00 57.07 56.87 1vsy s TYR 3190Cb -0.12 -2.02 -0.04 0.00 -0.11 0.00 0.00 41.96 39.67 1vsy s TYR 3190CO 0.04 0.38 -0.03 -0.51 -1.11 0.00 0.00 175.55 174.31 1vsy s LEU 3191N -2.87 3.12 -0.25 -1.29 1.43 0.78 -4.96 118.68 114.64 1vsy s LEU 3191Ca 0.42 -0.63 -0.12 0.00 -1.03 0.00 0.00 54.13 52.77 1vsy s LEU 3191Cb -0.12 -1.69 -0.05 0.00 0.03 0.00 0.00 46.19 44.37 1vsy s LEU 3191CO 0.25 0.03 0.22 -0.75 0.23 0.00 0.00 176.35 176.34 1vsy s LYS 3192N -3.42 4.03 0.21 1.70 2.20 -1.26 -4.17 119.74 119.04 1vsy s LYS 3192Ca 0.30 -0.20 -0.08 0.00 -0.36 0.00 0.00 55.97 55.62 1vsy s LYS 3192Cb -0.07 -3.60 -0.02 0.00 -1.51 0.00 0.00 37.83 32.64 1vsy s LYS 3192CO 0.18 -0.08 0.32 0.00 -0.36 0.00 0.00 175.35 175.42 1vsy s MET 3193N 1.46 1.35 1.03 4.03 0.23 -1.26 -5.08 119.30 121.05 1vsy s MET 3193Ca 0.09 -1.36 -0.17 0.00 -1.03 0.00 0.00 55.69 53.22 1vsy s MET 3193Cb -0.15 0.38 0.01 0.00 -1.53 0.00 0.00 34.83 33.55 1vsy s MET 3193CO 0.08 -0.51 -0.11 0.54 -2.03 0.00 0.00 175.02 172.99 1vsy n ARG 3194N -0.31 -0.71 -2.66 3.16 1.74 -1.26 -4.91 116.66 111.72 1vsy n ARG 3194Ca -0.02 -0.19 -0.23 0.00 -0.77 0.00 0.00 57.85 56.64 1vsy n ARG 3194Cb 0.63 -1.60 -0.01 0.00 -1.02 0.00 0.00 32.46 30.47 1vsy n ARG 3194CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1vsy n GLN 3195N -0.86 2.85 0.00 5.56 1.13 -1.26 -4.41 117.38 120.39 1vsy n GLN 3195Ca 0.02 -4.30 0.00 0.00 -1.94 0.00 0.00 57.00 50.78 1vsy n GLN 3195Cb 0.59 -2.04 0.00 0.00 0.11 0.00 0.00 30.24 28.90 1vsy n GLN 3195CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22