#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ny4 s VAL 3002N 0.00 4.57 -0.15 2.62 0.11 -1.26 -3.57 120.40 122.72 2ny4 s VAL 3002Ca 0.00 -0.13 -0.13 0.00 -2.93 0.00 0.00 61.98 58.79 2ny4 s VAL 3002Cb 0.00 -2.99 -0.05 0.00 -1.53 0.00 0.00 36.38 31.81 2ny4 s VAL 3002CO 0.00 0.54 0.27 -1.10 -3.33 0.00 0.00 175.10 171.48 2ny4 s GLN 3003N -0.25 4.15 -0.21 1.54 1.11 0.20 -4.87 119.66 121.32 2ny4 s GLN 3003Ca 0.07 0.07 -0.04 0.00 0.01 0.00 0.00 55.36 55.47 2ny4 s GLN 3003Cb -0.12 -3.39 -0.01 0.00 -1.01 0.00 0.00 33.01 28.48 2ny4 s GLN 3003CO 0.02 0.33 -0.03 -0.51 0.01 0.00 0.00 175.29 175.11 2ny4 s LEU 3004N 0.20 3.00 -0.17 2.90 1.43 -1.26 -0.71 118.68 124.07 2ny4 s LEU 3004Ca 0.16 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 52.94 2ny4 s LEU 3004Cb -0.13 -1.76 0.02 0.00 0.03 0.00 0.00 46.19 44.34 2ny4 s LEU 3004CO 0.04 0.01 -0.20 -0.69 0.23 0.00 0.00 176.35 175.74 2ny4 s VAL 3005N 1.33 2.01 0.40 -1.59 1.01 -0.46 -4.10 120.40 119.01 2ny4 s VAL 3005Ca 0.04 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.12 2ny4 s VAL 3005Cb -0.14 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.41 2ny4 s VAL 3005CO -0.01 0.53 0.60 -1.61 0.00 0.00 0.00 175.10 174.61 2ny4 s GLU 3006N 1.22 3.13 0.97 2.72 2.02 -1.26 -0.58 118.70 126.92 2ny4 s GLU 3006Ca 0.03 -0.61 -0.15 0.00 0.02 0.00 0.00 54.97 54.26 2ny4 s GLU 3006Cb -0.13 -2.64 0.18 0.00 0.10 0.00 0.00 34.13 31.63 2ny4 s GLU 3006CO -0.11 -0.12 1.19 -1.54 0.02 0.00 0.00 175.26 174.69 2ny4 s SER 3007N -4.18 3.02 0.79 -0.19 1.04 -0.47 -4.95 113.70 108.76 2ny4 s SER 3007Ca 0.46 0.70 -0.11 0.00 0.48 0.00 0.00 55.95 57.48 2ny4 s SER 3007Cb -0.10 -1.06 0.08 0.00 0.10 0.00 0.00 66.02 65.03 2ny4 s SER 3007CO 0.36 -2.83 1.16 -0.83 0.98 0.00 0.00 173.24 172.07 2ny4 s GLY 3008N -4.28 1.60 0.47 7.32 0.00 -1.26 -4.67 107.32 106.49 2ny4 s GLY 3008Ca 0.68 -0.68 -0.23 0.00 0.00 0.00 0.00 44.72 44.49 2ny4 s GLY 3008CO 0.53 -0.20 1.02 0.00 0.00 0.00 0.00 173.10 174.45 2ny4 n ALA 3009N -3.26 0.30 -2.40 3.20 0.00 -1.26 -4.82 120.51 112.28 2ny4 n ALA 3009Ca 0.08 0.18 -0.29 0.00 0.00 0.00 0.00 53.44 53.41 2ny4 n ALA 3009Cb 0.61 -2.11 -0.14 0.00 0.00 0.00 0.00 19.45 17.81 2ny4 n ALA 3009CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2ny4 s GLU 3010N -2.21 1.51 -0.08 0.00 0.41 0.03 -4.99 118.70 113.36 2ny4 s GLU 3010Ca 0.66 -1.21 -0.00 0.00 -0.41 0.00 0.00 54.97 54.00 2ny4 s GLU 3010Cb -0.51 -1.84 0.02 0.00 -1.78 0.00 0.00 34.13 30.02 2ny4 s GLU 3010CO 0.55 0.45 -0.05 0.08 -0.49 0.00 0.00 175.26 175.80 2ny4 s VAL 3011N -0.96 0.74 0.07 2.63 1.01 -1.26 -1.13 120.40 121.50 2ny4 s VAL 3011Ca 0.12 -0.14 0.04 0.00 0.00 0.00 0.00 61.98 62.00 2ny4 s VAL 3011Cb -0.10 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 35.45 2ny4 s VAL 3011CO 0.04 0.31 -0.11 -0.54 0.00 0.00 0.00 175.10 174.80 2ny4 s LYS 3012N 1.59 0.73 0.27 2.72 -0.14 0.68 -4.98 119.74 120.62 2ny4 s LYS 3012Ca 0.01 -0.96 -0.18 0.00 -1.36 0.00 0.00 55.97 53.48 2ny4 s LYS 3012Cb -0.13 -0.55 -0.09 0.00 -1.68 0.00 0.00 37.83 35.38 2ny4 s LYS 3012CO -0.05 0.11 0.73 0.15 -0.76 0.00 0.00 175.35 175.53 2ny4 s LYS 3013N -2.05 4.14 0.29 1.68 -0.14 -1.26 -0.79 119.74 121.61 2ny4 s LYS 3013Ca -0.02 0.79 -0.29 0.00 -1.36 0.00 0.00 55.97 55.08 2ny4 s LYS 3013Cb -0.07 -2.68 -0.13 0.00 -1.68 0.00 0.00 37.83 33.26 2ny4 s LYS 3013CO 0.01 0.29 1.27 -2.30 -0.76 0.00 0.00 175.35 173.86 2ny4 n PRO 3014N 0.24 1.90 0.00 -1.68 -0.02 -1.26 -1.70 135.00 132.49 2ny4 n PRO 3014Ca 0.00 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 2ny4 n PRO 3014Cb 0.52 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 2ny4 n PRO 3014CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ny4 n GLY 3015N 1.38 3.38 3.82 -1.23 0.00 0.15 -4.93 105.19 107.76 2ny4 n GLY 3015Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 2ny4 n GLY 3015CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ny4 s SER 3016N -1.04 3.16 0.30 1.61 0.01 -0.69 -4.24 113.70 112.82 2ny4 s SER 3016Ca 0.00 0.67 0.09 0.00 1.31 0.00 0.00 55.95 58.02 2ny4 s SER 3016Cb 0.00 -1.02 -0.05 0.00 0.21 0.00 0.00 66.02 65.17 2ny4 s SER 3016CO 0.00 -2.74 0.03 -0.94 0.41 0.00 0.00 173.24 170.00 2ny4 s SER 3017N -4.37 4.47 0.01 2.44 1.04 -1.26 -0.70 113.70 115.33 2ny4 s SER 3017Ca 0.68 -0.76 -0.00 0.00 0.48 0.00 0.00 55.95 56.34 2ny4 s SER 3017Cb -0.10 -0.73 -0.01 0.00 0.10 0.00 0.00 66.02 65.28 2ny4 s SER 3017CO 0.53 -0.12 -0.01 0.54 0.98 0.00 0.00 173.24 175.15 2ny4 s VAL 3018N -2.40 0.07 -0.14 5.02 0.11 -0.51 -5.01 120.40 117.54 2ny4 s VAL 3018Ca 0.34 -0.55 -0.01 0.00 -2.93 0.00 0.00 61.98 58.82 2ny4 s VAL 3018Cb -0.04 -0.17 0.04 0.00 -1.53 0.00 0.00 36.38 34.68 2ny4 s VAL 3018CO 0.20 -0.30 -0.03 -0.75 -3.33 0.00 0.00 175.10 170.89 2ny4 s LYS 3019N -0.89 1.10 0.19 1.54 2.20 -1.26 -1.32 119.74 121.30 2ny4 s LYS 3019Ca -0.10 -0.29 0.07 0.00 -0.36 0.00 0.00 55.97 55.29 2ny4 s LYS 3019Cb -0.06 -1.68 -0.04 0.00 -1.51 0.00 0.00 37.83 34.54 2ny4 s LYS 3019CO -0.01 -0.41 0.05 0.14 -0.36 0.00 0.00 175.35 174.77 2ny4 s VAL 3020N 1.77 3.92 0.21 4.02 -7.23 -0.22 -4.96 120.40 117.92 2ny4 s VAL 3020Ca 0.02 -1.41 0.05 0.00 -1.81 0.00 0.00 61.98 58.83 2ny4 s VAL 3020Cb -0.14 -3.01 -0.05 0.00 0.56 0.00 0.00 36.38 33.74 2ny4 s VAL 3020CO -0.07 -0.17 -0.06 -0.94 -0.31 0.00 0.00 175.10 173.55 2ny4 s SER 3021N -3.16 2.07 -0.18 4.85 1.04 -1.26 -1.38 113.70 115.68 2ny4 s SER 3021Ca 0.29 -1.13 -0.04 0.00 0.48 0.00 0.00 55.95 55.55 2ny4 s SER 3021Cb -0.09 -0.04 0.09 0.00 0.10 0.00 0.00 66.02 66.07 2ny4 s SER 3021CO 0.20 -0.39 0.24 0.00 0.98 0.00 0.00 173.24 174.27 2ny4 s LYS 3023N 2.36 4.14 -0.23 0.00 2.47 0.25 -0.71 119.74 128.02 2ny4 s LYS 3023Ca 0.06 0.60 -0.13 0.00 -1.56 0.00 0.00 55.97 54.93 2ny4 s LYS 3023Cb -0.15 -3.63 -0.04 0.00 -1.46 0.00 0.00 37.83 32.55 2ny4 s LYS 3023CO -0.11 -0.37 0.27 0.00 0.16 0.00 0.00 175.35 175.30 2ny4 s ALA 3024N 2.36 3.58 0.13 3.13 0.00 -0.01 -1.35 121.76 129.60 2ny4 s ALA 3024Ca 0.27 -0.77 0.08 0.00 0.00 0.00 0.00 51.96 51.54 2ny4 s ALA 3024Cb -0.16 -2.50 -0.04 0.00 0.00 0.00 0.00 23.12 20.43 2ny4 s ALA 3024CO 0.09 -0.33 -0.18 -1.12 0.00 0.00 0.00 175.76 174.22 2ny4 s SER 3025N 1.19 2.48 0.00 0.00 0.01 0.11 -4.80 113.70 112.69 2ny4 s SER 3025Ca 0.12 -0.78 0.00 0.00 1.31 0.00 0.00 55.95 56.60 2ny4 s SER 3025Cb -0.14 -0.13 0.00 0.00 0.21 0.00 0.00 66.02 65.95 2ny4 s SER 3025CO 0.07 -0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.31 2ny4 n GLY 3026N 0.65 0.48 0.28 3.44 0.00 -1.26 0.60 105.19 109.38 2ny4 n GLY 3026Ca -0.16 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.85 2ny4 n GLY 3026CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ny4 n ASP 3027N 0.00 -0.11 -4.58 1.61 4.64 -1.23 -4.34 116.55 112.54 2ny4 n ASP 3027Ca 0.00 -1.16 -0.43 0.00 -1.38 0.00 0.00 54.79 51.82 2ny4 n ASP 3027Cb 0.00 0.20 -0.04 0.00 -1.04 0.00 0.00 41.12 40.25 2ny4 n ASP 3027CO 0.00 0.00 0.00 -0.89 -0.82 0.00 0.00 177.20 175.49 2ny4 s THR 3028N -2.41 4.46 0.21 5.18 2.01 -1.26 -4.95 115.64 118.88 2ny4 s THR 3028Ca 0.03 0.92 -0.11 0.00 0.31 0.00 0.00 61.69 62.84 2ny4 s THR 3028Cb -0.00 -4.44 0.21 0.00 0.01 0.00 0.00 72.50 68.28 2ny4 s THR 3028CO 0.02 -0.79 1.65 0.15 -0.69 0.00 0.00 174.62 174.96 2ny4 h PHE 3029N 8.96 -0.12 0.00 4.92 3.57 -1.96 -1.63 116.94 130.68 2ny4 h PHE 3029Ca -0.24 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.31 2ny4 h PHE 3029Cb 1.07 0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.96 2ny4 h PHE 3029CO 0.88 -0.20 0.00 0.44 -2.23 0.00 0.00 178.31 177.20 2ny4 n ILE 3030N -5.32 0.55 1.31 1.41 -5.35 -1.26 -1.98 119.36 108.71 2ny4 n ILE 3030Ca 0.09 0.14 0.10 0.00 -0.27 0.00 0.00 62.75 62.80 2ny4 n ILE 3030Cb 0.35 -0.82 0.37 0.00 -1.74 0.00 0.00 39.64 37.81 2ny4 n ILE 3030CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2ny4 n ARG 3031N -1.38 1.63 -4.55 6.28 1.74 -0.61 -4.08 116.66 115.68 2ny4 n ARG 3031Ca 0.07 -0.95 -0.29 0.00 -0.77 0.00 0.00 57.85 55.91 2ny4 n ARG 3031Cb 0.18 -1.36 -0.13 0.00 -1.02 0.00 0.00 32.46 30.13 2ny4 n ARG 3031CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2ny4 s TYR 3032N -1.80 2.35 0.09 -1.55 1.51 -0.84 -0.18 117.35 116.93 2ny4 s TYR 3032Ca 0.30 -0.37 0.05 0.00 -1.01 0.00 0.00 57.07 56.04 2ny4 s TYR 3032Cb 0.16 -1.31 -0.04 0.00 -0.11 0.00 0.00 41.96 40.66 2ny4 s TYR 3032CO 0.24 0.28 0.01 -1.54 -1.11 0.00 0.00 175.55 173.42 2ny4 s SER 3033N -1.79 5.06 0.01 2.29 1.04 -0.75 -3.92 113.70 115.65 2ny4 s SER 3033Ca 0.14 -0.17 0.06 0.00 0.48 0.00 0.00 55.95 56.46 2ny4 s SER 3033Cb -0.10 -1.22 -0.02 0.00 0.10 0.00 0.00 66.02 64.78 2ny4 s SER 3033CO 0.05 0.17 -0.19 -0.36 0.98 0.00 0.00 173.24 173.90 2ny4 s PHE 3034N -1.33 1.64 0.03 5.02 0.40 -0.92 -1.73 117.98 121.10 2ny4 s PHE 3034Ca 0.26 -0.34 0.04 0.00 -0.60 0.00 0.00 56.93 56.30 2ny4 s PHE 3034Cb -0.12 -1.02 -0.02 0.00 0.51 0.00 0.00 43.02 42.37 2ny4 s PHE 3034CO 0.19 0.02 -0.13 0.99 0.70 0.00 0.00 175.22 176.99 2ny4 s THR 3035N -0.61 1.03 -0.13 0.64 2.01 0.13 0.22 115.64 118.93 2ny4 s THR 3035Ca 0.07 -0.91 -0.02 0.00 0.31 0.00 0.00 61.69 61.13 2ny4 s THR 3035Cb -0.08 -0.93 -0.03 0.00 0.01 0.00 0.00 72.50 71.47 2ny4 s THR 3035CO 0.00 0.02 -0.06 0.26 -0.69 0.00 0.00 174.62 174.15 2ny4 s TRP 3036N -0.78 2.97 -0.04 4.92 0.52 -0.67 -0.18 118.94 125.68 2ny4 s TRP 3036Ca 0.01 -0.28 0.03 0.00 0.02 0.00 0.00 56.10 55.88 2ny4 s TRP 3036Cb -0.07 -1.88 0.00 0.00 -1.15 0.00 0.00 33.47 30.37 2ny4 s TRP 3036CO 0.01 0.03 -0.11 0.08 0.02 0.00 0.00 176.95 176.97 2ny4 s VAL 3037N 0.08 0.97 0.32 4.03 1.01 0.11 -0.85 120.40 126.08 2ny4 s VAL 3037Ca -0.01 -0.45 0.10 0.00 0.00 0.00 0.00 61.98 61.62 2ny4 s VAL 3037Cb -0.14 -0.87 -0.06 0.00 0.00 0.00 0.00 36.38 35.32 2ny4 s VAL 3037CO 0.03 0.30 -0.13 0.00 0.00 0.00 0.00 175.10 175.30 2ny4 s ARG 3038N 0.28 1.77 -0.23 2.72 1.70 -0.07 0.35 118.95 125.47 2ny4 s ARG 3038Ca -0.06 -1.87 -0.03 0.00 -0.47 0.00 0.00 55.73 53.30 2ny4 s ARG 3038Cb -0.11 -1.73 0.11 0.00 -0.57 0.00 0.00 34.95 32.65 2ny4 s ARG 3038CO 0.01 0.21 0.26 -1.14 -1.08 0.00 0.00 175.30 173.57 2ny4 s GLN 3039N -3.57 0.25 0.48 3.89 0.74 0.04 -0.48 119.66 121.00 2ny4 s GLN 3039Ca 0.32 0.14 -0.22 0.00 0.05 0.00 0.00 55.36 55.64 2ny4 s GLN 3039Cb -0.00 -0.96 -0.07 0.00 1.10 0.00 0.00 33.01 33.07 2ny4 s GLN 3039CO 0.16 -0.76 1.13 0.00 -0.55 0.00 0.00 175.29 175.27 2ny4 s ALA 3040N 2.36 2.90 -0.18 1.58 0.00 -1.26 -0.99 121.76 126.17 2ny4 s ALA 3040Ca 0.08 0.85 -0.40 0.00 0.00 0.00 0.00 51.96 52.50 2ny4 s ALA 3040Cb -0.15 -3.35 -0.16 0.00 0.00 0.00 0.00 23.12 19.45 2ny4 s ALA 3040CO -0.19 -0.61 1.60 -2.30 0.00 0.00 0.00 175.76 174.26 2ny4 n PRO 3041N -0.71 1.05 -0.97 0.00 -0.02 -1.26 -0.47 135.00 132.63 2ny4 n PRO 3041Ca 0.08 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2ny4 n PRO 3041Cb 0.49 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 2ny4 n PRO 3041CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ny4 n GLY 3042N 3.64 0.97 2.91 -1.23 0.00 -1.26 -5.01 105.19 105.21 2ny4 n GLY 3042Ca 0.24 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 2ny4 n GLY 3042CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ny4 n GLN 3043N -2.00 0.92 -1.73 1.61 1.13 0.38 -5.15 117.38 112.54 2ny4 n GLN 3043Ca 0.00 -2.73 -0.15 0.00 -1.94 0.00 0.00 57.00 52.18 2ny4 n GLN 3043Cb 0.00 0.44 0.08 0.00 0.11 0.00 0.00 30.24 30.87 2ny4 n GLN 3043CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ny4 n GLY 3044N -0.00 0.39 3.73 1.08 0.00 -1.26 -4.67 105.19 104.46 2ny4 n GLY 3044Ca -0.06 -1.96 -0.41 0.00 0.00 0.00 0.00 46.02 43.59 2ny4 n GLY 3044CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ny4 s LEU 3045N 0.00 4.51 -0.18 0.99 1.43 -1.26 -4.29 118.68 119.89 2ny4 s LEU 3045Ca 0.42 1.90 0.01 0.00 -1.03 0.00 0.00 54.13 55.43 2ny4 s LEU 3045Cb -0.02 -3.60 0.03 0.00 0.03 0.00 0.00 46.19 42.63 2ny4 s LEU 3045CO 0.28 -0.09 -0.17 -0.70 0.23 0.00 0.00 176.35 175.91 2ny4 s GLU 3046N -0.25 2.66 0.04 1.70 2.12 0.37 -4.97 118.70 120.37 2ny4 s GLU 3046Ca 0.47 -0.79 -0.31 0.00 0.36 0.00 0.00 54.97 54.71 2ny4 s GLU 3046Cb -0.25 -2.44 -0.06 0.00 0.26 0.00 0.00 34.13 31.63 2ny4 s GLU 3046CO 0.32 -0.26 1.40 -0.46 -0.54 0.00 0.00 175.26 175.71 2ny4 s TRP 3047N 1.34 2.98 -0.25 5.30 -0.00 -1.26 -0.89 118.94 126.17 2ny4 s TRP 3047Ca 0.04 0.86 0.04 0.00 -0.00 0.00 0.00 56.10 57.04 2ny4 s TRP 3047Cb -0.14 -3.67 -0.18 0.00 -0.00 0.00 0.00 33.47 29.49 2ny4 s TRP 3047CO -0.11 -2.43 -0.18 -1.33 -0.00 0.00 0.00 176.95 172.89 2ny4 n MET 3048N 4.86 0.65 0.00 5.86 2.81 -0.03 -4.62 117.12 126.66 2ny4 n MET 3048Ca 0.12 0.13 0.00 0.00 -1.81 0.00 0.00 57.70 56.14 2ny4 n MET 3048Cb 0.43 -1.51 0.00 0.00 -0.71 0.00 0.00 33.22 31.43 2ny4 n MET 3048CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ny4 n GLY 3049N 2.22 0.59 3.15 3.03 0.00 -1.21 -0.57 105.19 112.40 2ny4 n GLY 3049Ca -0.43 -1.06 -0.12 0.00 0.00 0.00 0.00 46.02 44.40 2ny4 n GLY 3049CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ny4 s ARG 3050N -2.00 0.31 -0.16 1.61 3.52 -0.04 -1.67 118.95 120.51 2ny4 s ARG 3050Ca 0.00 0.47 -0.04 0.00 -0.13 0.00 0.00 55.73 56.03 2ny4 s ARG 3050Cb 0.00 0.07 -0.03 0.00 -1.56 0.00 0.00 34.95 33.43 2ny4 s ARG 3050CO 0.00 -0.09 -0.03 -1.50 -0.81 0.00 0.00 175.30 172.88 2ny4 s ILE 3051N 0.58 4.00 -0.79 4.11 2.07 0.13 -1.11 121.20 130.19 2ny4 s ILE 3051Ca -0.03 -0.32 -0.24 0.00 -1.41 0.00 0.00 60.65 58.65 2ny4 s ILE 3051Cb -0.05 -2.76 0.06 0.00 0.13 0.00 0.00 42.46 39.85 2ny4 s ILE 3051CO -0.03 0.49 1.19 -0.63 -1.91 0.00 0.00 174.94 174.05 2ny4 s ILE 3052N 0.32 4.10 0.20 2.00 1.01 0.68 -2.16 121.20 127.35 2ny4 s ILE 3052Ca -0.03 -0.35 -0.11 0.00 0.00 0.00 0.00 60.65 60.17 2ny4 s ILE 3052Cb -0.14 -4.85 0.13 0.00 0.01 0.00 0.00 42.46 37.61 2ny4 s ILE 3052CO 0.03 -1.70 1.84 0.74 0.00 0.00 0.00 174.94 175.85 2ny4 h THR 3053N 6.13 1.08 -0.41 2.92 2.02 -1.85 0.11 112.91 122.91 2ny4 h THR 3053Ca -0.13 -0.27 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 2ny4 h THR 3053Cb 1.05 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 2ny4 h THR 3053CO 1.25 0.14 0.23 -0.29 0.37 0.00 0.00 175.52 177.23 2ny4 h ILE 3054N 0.79 1.13 0.00 3.11 6.09 -1.82 -2.83 117.51 123.97 2ny4 h ILE 3054Ca 0.26 -0.30 0.00 0.00 -1.37 0.00 0.00 64.86 63.45 2ny4 h ILE 3054Cb 0.03 0.56 0.00 0.00 0.47 0.00 0.00 36.82 37.89 2ny4 h ILE 3054CO -0.11 0.13 -1.14 0.18 -3.07 0.00 0.00 178.15 174.14 2ny4 n LEU 3055N -4.44 0.60 -3.00 2.19 4.32 -0.59 -4.97 117.00 111.12 2ny4 n LEU 3055Ca 0.03 -0.10 -0.20 0.00 -0.02 0.00 0.00 56.01 55.72 2ny4 n LEU 3055Cb 0.09 -0.07 0.06 0.00 -1.62 0.00 0.00 43.42 41.88 2ny4 n LEU 3055CO 0.36 0.08 0.15 -0.67 -1.22 0.00 0.00 177.39 176.09 2ny4 n ASP 3056N -1.91 -5.69 -4.07 -1.43 4.64 0.29 -5.00 116.55 103.37 2ny4 n ASP 3056Ca 0.02 -0.40 -0.31 0.00 -1.38 0.00 0.00 54.79 52.72 2ny4 n ASP 3056Cb 0.43 -4.37 -0.16 0.00 -1.04 0.00 0.00 41.12 35.98 2ny4 n ASP 3056CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 2ny4 s VAL 3057N -3.22 1.76 0.11 5.18 1.01 -1.09 -4.98 120.40 119.17 2ny4 s VAL 3057Ca 0.43 -0.77 0.08 0.00 0.00 0.00 0.00 61.98 61.73 2ny4 s VAL 3057Cb -0.19 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 2ny4 s VAL 3057CO 0.54 0.49 -0.15 0.00 0.00 0.00 0.00 175.10 175.98 2ny4 s ALA 3058N 1.27 2.77 0.02 5.51 0.00 -1.26 -0.23 121.76 129.85 2ny4 s ALA 3058Ca 0.02 -1.30 0.06 0.00 0.00 0.00 0.00 51.96 50.74 2ny4 s ALA 3058Cb -0.13 -0.74 -0.02 0.00 0.00 0.00 0.00 23.12 22.22 2ny4 s ALA 3058CO -0.09 0.61 -0.18 -1.01 0.00 0.00 0.00 175.76 175.09 2ny4 s HIS 3059N -1.15 1.56 0.19 0.00 3.76 -0.27 -4.98 115.29 114.41 2ny4 s HIS 3059Ca 0.19 -0.34 0.09 0.00 -0.15 0.00 0.00 55.06 54.85 2ny4 s HIS 3059Cb -0.11 -0.95 -0.04 0.00 1.11 0.00 0.00 32.58 32.59 2ny4 s HIS 3059CO 0.11 0.04 -0.18 0.71 -0.85 0.00 0.00 174.74 174.57 2ny4 s TYR 3060N -0.69 1.88 0.36 1.40 1.51 -1.26 -0.86 117.35 119.69 2ny4 s TYR 3060Ca 0.06 -0.47 -0.28 0.00 -1.01 0.00 0.00 57.07 55.37 2ny4 s TYR 3060Cb -0.08 -0.90 -0.10 0.00 -0.11 0.00 0.00 41.96 40.77 2ny4 s TYR 3060CO 0.01 0.40 1.33 0.00 -1.11 0.00 0.00 175.55 176.17 2ny4 s ALA 3061N -2.32 3.43 0.33 3.71 0.00 0.27 -4.86 121.76 122.33 2ny4 s ALA 3061Ca 0.19 1.29 0.02 0.00 0.00 0.00 0.00 51.96 53.47 2ny4 s ALA 3061Cb -0.04 -3.50 0.59 0.00 0.00 0.00 0.00 23.12 20.17 2ny4 s ALA 3061CO 0.08 -0.75 1.97 -1.35 0.00 0.00 0.00 175.76 175.70 2ny4 h PRO 3062N 3.11 0.91 0.00 0.00 0.11 -1.94 -1.44 132.00 132.75 2ny4 h PRO 3062Ca -0.49 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.56 2ny4 h PRO 3062Cb 1.23 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2ny4 h PRO 3062CO 0.64 0.60 0.00 -2.39 -0.21 0.00 0.00 178.00 176.64 2ny4 n HIS 3063N -4.45 0.82 -0.02 0.65 1.44 -1.26 -2.70 115.22 109.70 2ny4 n HIS 3063Ca 0.10 0.34 0.03 0.00 -2.01 0.00 0.00 57.72 56.17 2ny4 n HIS 3063Cb 0.12 -1.04 -0.10 0.00 0.12 0.00 0.00 29.99 29.09 2ny4 n HIS 3063CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2ny4 n LEU 3064N -2.26 0.00 -4.15 2.39 4.32 -0.74 -5.03 117.00 111.53 2ny4 n LEU 3064Ca 0.02 0.00 -0.55 0.00 -0.02 0.00 0.00 56.01 55.46 2ny4 n LEU 3064Cb 0.20 0.09 -0.08 0.00 -1.62 0.00 0.00 43.42 42.01 2ny4 n LEU 3064CO 0.18 0.09 0.58 1.67 -1.22 0.00 0.00 177.39 178.69 2ny4 n GLN 3065N -2.09 0.00 0.00 3.23 -0.06 -0.62 -1.71 117.38 116.13 2ny4 n GLN 3065Ca -0.07 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.93 2ny4 n GLN 3065Cb 0.50 -1.37 0.00 0.00 -4.06 0.00 0.00 30.24 25.30 2ny4 n GLN 3065CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2ny4 n GLY 3066N 1.61 2.85 0.17 1.69 0.00 -1.26 -4.81 105.19 105.45 2ny4 n GLY 3066Ca 0.19 -0.64 0.02 0.00 0.00 0.00 0.00 46.02 45.60 2ny4 n GLY 3066CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2ny4 n ARG 3067N 0.00 1.05 -4.94 1.61 1.85 -0.69 -4.98 116.66 110.55 2ny4 n ARG 3067Ca 0.00 -1.15 -0.32 0.00 -1.00 0.00 0.00 57.85 55.38 2ny4 n ARG 3067Cb 0.00 -1.08 -0.13 0.00 -1.05 0.00 0.00 32.46 30.20 2ny4 n ARG 3067CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2ny4 s VAL 3068N -0.61 2.89 -0.05 8.89 0.11 -1.20 -0.63 120.40 129.79 2ny4 s VAL 3068Ca 0.06 -0.81 0.00 0.00 -2.93 0.00 0.00 61.98 58.30 2ny4 s VAL 3068Cb 0.03 -2.12 0.02 0.00 -1.53 0.00 0.00 36.38 32.79 2ny4 s VAL 3068CO 0.05 0.57 -0.02 -0.89 -3.33 0.00 0.00 175.10 171.48 2ny4 s THR 3069N -0.73 0.42 -0.17 5.04 2.01 -0.19 -4.95 115.64 117.08 2ny4 s THR 3069Ca 0.11 -0.01 -0.04 0.00 0.31 0.00 0.00 61.69 62.07 2ny4 s THR 3069Cb -0.10 -0.50 -0.02 0.00 0.01 0.00 0.00 72.50 71.88 2ny4 s THR 3069CO 0.01 0.22 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.49 2ny4 s ILE 3070N 1.25 3.73 0.25 1.82 1.01 -1.26 -0.51 121.20 127.50 2ny4 s ILE 3070Ca -0.06 -0.40 0.05 0.00 0.00 0.00 0.00 60.65 60.24 2ny4 s ILE 3070Cb -0.14 -2.65 -0.05 0.00 0.01 0.00 0.00 42.46 39.63 2ny4 s ILE 3070CO -0.02 0.47 -0.03 0.42 0.00 0.00 0.00 174.94 175.78 2ny4 s THR 3071N 0.68 1.29 -0.02 2.92 -4.23 -0.45 -4.79 115.64 111.04 2ny4 s THR 3071Ca -0.02 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 58.42 2ny4 s THR 3071Cb -0.14 -2.36 0.02 0.00 1.34 0.00 0.00 72.50 71.36 2ny4 s THR 3071CO 0.02 -0.34 0.01 0.00 -0.54 0.00 0.00 174.62 173.77 2ny4 s ALA 3072N -3.25 0.15 -0.46 3.99 0.00 -1.26 0.28 121.76 121.21 2ny4 s ALA 3072Ca 0.28 0.19 -0.14 0.00 0.00 0.00 0.00 51.96 52.29 2ny4 s ALA 3072Cb 0.05 -0.22 0.08 0.00 0.00 0.00 0.00 23.12 23.03 2ny4 s ALA 3072CO 0.09 -0.07 0.37 0.34 0.00 0.00 0.00 175.76 176.49 2ny4 s ASP 3073N 0.82 6.00 0.41 0.00 3.68 0.11 -4.94 116.67 122.75 2ny4 s ASP 3073Ca -0.07 -1.44 0.14 0.00 2.13 0.00 0.00 52.55 53.31 2ny4 s ASP 3073Cb -0.10 -2.13 0.89 0.00 -1.45 0.00 0.00 42.92 40.12 2ny4 s ASP 3073CO -0.02 -0.64 1.92 0.11 0.13 0.00 0.00 175.17 176.67 2ny4 h LYS 3074N 8.66 0.00 0.00 4.34 1.57 -1.97 -1.01 116.57 128.17 2ny4 h LYS 3074Ca -0.27 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.48 2ny4 h LYS 3074Cb 1.10 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 2ny4 h LYS 3074CO 0.86 0.27 -0.17 0.66 -0.57 0.00 0.00 179.45 180.50 2ny4 h SER 3075N 0.00 0.00 -0.07 0.86 4.64 -1.96 -3.09 113.55 113.93 2ny4 h SER 3075Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ny4 h SER 3075Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2ny4 h SER 3075CO 0.03 0.17 0.00 0.35 -0.87 0.00 0.00 176.83 176.52 2ny4 n THR 3076N -3.37 0.95 -4.20 2.95 -2.24 -1.03 -4.99 114.28 102.35 2ny4 n THR 3076Ca -0.00 -0.97 -0.34 0.00 -2.27 0.00 0.00 64.05 60.46 2ny4 n THR 3076Cb 0.38 0.53 -0.03 0.00 -2.10 0.00 0.00 70.33 69.11 2ny4 n THR 3076CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2ny4 n SER 3077N -0.26 -2.37 -4.23 3.42 7.64 -0.44 -4.79 113.62 112.60 2ny4 n SER 3077Ca 0.02 -1.04 -0.29 0.00 1.01 0.00 0.00 58.87 58.57 2ny4 n SER 3077Cb 0.28 -2.66 -0.16 0.00 -1.01 0.00 0.00 64.21 60.65 2ny4 n SER 3077CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2ny4 s THR 3078N -3.48 1.83 -0.09 0.44 2.01 -0.86 -0.83 115.64 114.66 2ny4 s THR 3078Ca 0.56 -0.95 -0.02 0.00 0.31 0.00 0.00 61.69 61.60 2ny4 s THR 3078Cb -0.31 -1.55 -0.03 0.00 0.01 0.00 0.00 72.50 70.62 2ny4 s THR 3078CO 0.93 0.51 -0.01 -0.69 -0.69 0.00 0.00 174.62 174.68 2ny4 s VAL 3079N -0.14 4.22 0.07 3.82 1.01 0.11 0.04 120.40 129.53 2ny4 s VAL 3079Ca -0.02 -0.28 0.09 0.00 0.00 0.00 0.00 61.98 61.77 2ny4 s VAL 3079Cb -0.13 -2.77 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 2ny4 s VAL 3079CO 0.03 0.60 -0.24 -0.31 0.00 0.00 0.00 175.10 175.18 2ny4 s TYR 3080N -0.79 2.07 -0.13 5.22 2.02 0.14 -0.98 117.35 124.90 2ny4 s TYR 3080Ca 0.12 -0.39 0.01 0.00 -0.37 0.00 0.00 57.07 56.44 2ny4 s TYR 3080Cb -0.11 -1.20 0.02 0.00 -0.40 0.00 0.00 41.96 40.26 2ny4 s TYR 3080CO 0.02 0.16 -0.16 -1.17 -1.57 0.00 0.00 175.55 172.83 2ny4 s LEU 3081N -1.44 1.81 -0.13 -1.29 1.98 -0.48 -1.34 118.68 117.80 2ny4 s LEU 3081Ca 0.10 -0.50 0.01 0.00 -2.89 0.00 0.00 54.13 50.85 2ny4 s LEU 3081Cb -0.10 -1.22 -0.01 0.00 0.66 0.00 0.00 46.19 45.53 2ny4 s LEU 3081CO 0.03 0.00 -0.15 -0.70 -1.89 0.00 0.00 176.35 173.64 2ny4 s GLU 3082N 1.15 3.29 -0.14 1.98 2.12 0.34 -1.05 118.70 126.38 2ny4 s GLU 3082Ca -0.02 -0.73 0.02 0.00 0.36 0.00 0.00 54.97 54.60 2ny4 s GLU 3082Cb -0.14 -2.57 0.01 0.00 0.26 0.00 0.00 34.13 31.69 2ny4 s GLU 3082CO -0.06 0.16 -0.21 -1.17 -0.54 0.00 0.00 175.26 173.44 2ny4 s LEU 3083N 0.46 2.06 0.32 2.70 0.20 -0.44 -1.02 118.68 122.97 2ny4 s LEU 3083Ca -0.11 -0.59 0.07 0.00 0.69 0.00 0.00 54.13 54.19 2ny4 s LEU 3083Cb -0.16 -1.41 -0.03 0.00 -0.43 0.00 0.00 46.19 44.17 2ny4 s LEU 3083CO 0.05 0.06 0.28 -0.13 -0.29 0.00 0.00 176.35 176.32 2ny4 s ARG 3084N 0.89 2.76 -1.34 1.98 0.52 0.20 -1.42 118.95 122.53 2ny4 s ARG 3084Ca -0.06 -1.25 -0.02 0.00 -0.52 0.00 0.00 55.73 53.89 2ny4 s ARG 3084Cb -0.15 -2.50 -0.00 0.00 0.52 0.00 0.00 34.95 32.82 2ny4 s ARG 3084CO -0.03 0.14 0.56 0.09 0.02 0.00 0.00 175.30 176.08 2ny4 n ASN 3085N -1.35 -1.03 -4.76 0.23 5.03 -1.10 -4.83 115.26 107.46 2ny4 n ASN 3085Ca -0.03 -0.93 -0.41 0.00 0.87 0.00 0.00 54.58 54.08 2ny4 n ASN 3085Cb 0.59 -3.50 -0.00 0.00 -1.02 0.00 0.00 39.78 35.85 2ny4 n ASN 3085CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 2ny4 n LEU 3086N -4.32 4.48 -4.58 3.41 4.77 0.12 -4.62 117.00 116.25 2ny4 n LEU 3086Ca -0.29 1.22 -0.26 0.00 -0.03 0.00 0.00 56.01 56.65 2ny4 n LEU 3086Cb 0.68 -1.59 -0.09 0.00 -2.33 0.00 0.00 43.42 40.09 2ny4 n LEU 3086CO 0.72 0.02 -0.39 -0.13 -1.33 0.00 0.00 177.39 176.28 2ny4 s ARG 3087N -1.90 2.10 0.46 3.23 0.52 -1.26 0.32 118.95 122.42 2ny4 s ARG 3087Ca 0.55 -1.33 0.20 0.00 -0.52 0.00 0.00 55.73 54.63 2ny4 s ARG 3087Cb -0.50 -2.14 1.18 0.00 0.52 0.00 0.00 34.95 34.01 2ny4 s ARG 3087CO 0.62 0.41 1.90 0.66 0.02 0.00 0.00 175.30 178.92 2ny4 h SER 3088N 2.63 0.28 0.00 0.23 4.64 -1.96 0.30 113.55 119.67 2ny4 h SER 3088Ca -0.46 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2ny4 h SER 3088Cb 1.22 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2ny4 h SER 3088CO 0.56 0.13 0.00 -0.90 -0.87 0.00 0.00 176.83 175.75 2ny4 n ASP 3089N -4.44 0.00 -0.12 4.97 5.75 -1.26 -1.87 116.55 119.57 2ny4 n ASP 3089Ca 0.16 -0.84 0.14 0.00 -0.01 0.00 0.00 54.79 54.25 2ny4 n ASP 3089Cb 0.66 0.00 0.66 0.00 -1.03 0.00 0.00 41.12 41.42 2ny4 n ASP 3089CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2ny4 n ASP 3090N -0.98 0.47 -4.66 -1.12 10.43 0.10 -4.86 116.55 115.93 2ny4 n ASP 3090Ca 0.18 -0.69 -0.43 0.00 2.57 0.00 0.00 54.79 56.43 2ny4 n ASP 3090Cb 0.08 -0.07 -0.03 0.00 1.84 0.00 0.00 41.12 42.94 2ny4 n ASP 3090CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 177.20 176.54 2ny4 n THR 3091N -0.88 0.76 -3.63 -3.53 -1.04 -0.78 -4.85 114.28 100.34 2ny4 n THR 3091Ca 0.16 -0.14 -0.01 0.00 -2.04 0.00 0.00 64.05 62.02 2ny4 n THR 3091Cb 0.26 -2.29 -0.01 0.00 -1.82 0.00 0.00 70.33 66.46 2ny4 n THR 3091CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ny4 s ALA 3092N 4.46 -2.08 -0.15 2.41 0.00 -0.77 -4.43 121.76 121.20 2ny4 s ALA 3092Ca 0.89 0.86 -0.19 0.00 0.00 0.00 0.00 51.96 53.52 2ny4 s ALA 3092Cb -0.45 0.29 -0.04 0.00 0.00 0.00 0.00 23.12 22.92 2ny4 s ALA 3092CO 0.43 -0.91 0.52 0.08 0.00 0.00 0.00 175.76 175.87 2ny4 s VAL 3093N -2.60 5.14 -0.25 0.00 1.01 -0.16 -0.90 120.40 122.64 2ny4 s VAL 3093Ca 0.12 1.01 -0.09 0.00 0.00 0.00 0.00 61.98 63.02 2ny4 s VAL 3093Cb 0.02 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 2ny4 s VAL 3093CO -0.03 0.26 0.12 -0.31 0.00 0.00 0.00 175.10 175.14 2ny4 s TYR 3094N 1.05 3.17 -0.14 5.22 2.02 0.65 -0.78 117.35 128.54 2ny4 s TYR 3094Ca 0.26 -0.12 -0.04 0.00 -0.37 0.00 0.00 57.07 56.80 2ny4 s TYR 3094Cb -0.15 -2.28 -0.03 0.00 -0.40 0.00 0.00 41.96 39.09 2ny4 s TYR 3094CO 0.11 -0.21 -0.00 -0.06 -1.57 0.00 0.00 175.55 173.82 2ny4 s PHE 3095N 1.52 3.12 -0.03 2.71 0.08 0.15 -0.77 117.98 124.77 2ny4 s PHE 3095Ca 0.06 -0.05 -0.15 0.00 0.12 0.00 0.00 56.93 56.92 2ny4 s PHE 3095Cb -0.15 -1.93 -0.05 0.00 -0.57 0.00 0.00 43.02 40.32 2ny4 s PHE 3095CO 0.06 0.17 0.39 0.00 -0.10 0.00 0.00 175.22 175.75 2ny4 s ALA 3097N -0.79 0.04 0.25 0.00 0.00 0.75 -0.42 121.76 121.59 2ny4 s ALA 3097Ca 0.23 -0.73 -0.10 0.00 0.00 0.00 0.00 51.96 51.36 2ny4 s ALA 3097Cb -0.16 0.31 -0.01 0.00 0.00 0.00 0.00 23.12 23.26 2ny4 s ALA 3097CO 0.12 -0.38 0.41 0.20 0.00 0.00 0.00 175.76 176.11 2ny4 s GLY 3098N -2.50 0.80 -0.12 0.00 0.00 0.27 0.18 107.32 105.95 2ny4 s GLY 3098Ca 0.00 -1.10 -0.19 0.00 0.00 0.00 0.00 44.72 43.43 2ny4 s GLY 3098CO -0.08 -0.81 0.49 0.54 0.00 0.00 0.00 173.10 173.24 2ny4 s VAL 3099N -3.95 0.01 0.18 1.40 0.11 -0.71 -1.59 120.40 115.85 2ny4 s VAL 3099Ca 0.26 -0.11 -0.30 0.00 -2.93 0.00 0.00 61.98 58.90 2ny4 s VAL 3099Cb 0.01 -0.74 -0.08 0.00 -1.53 0.00 0.00 36.38 34.04 2ny4 s VAL 3099CO 0.11 -0.06 1.19 -0.47 -3.33 0.00 0.00 175.10 172.54 2ny4 s TYR 3100N -0.37 3.44 -0.93 1.54 5.04 -1.26 -1.80 117.35 123.00 2ny4 s TYR 3100Ca -0.05 1.43 0.12 0.00 -2.44 0.00 0.00 57.07 56.13 2ny4 s TYR 3100Cb -0.03 -3.42 -0.04 0.00 0.35 0.00 0.00 41.96 38.81 2ny4 s TYR 3100CO 0.03 -1.17 0.64 0.39 -1.34 0.00 0.00 175.55 174.10 2ny4 n GLU 3101N 2.50 2.34 0.00 4.97 -0.58 0.74 -4.83 120.64 125.79 2ny4 n GLU 3101Ca 0.04 -0.46 0.00 0.00 -0.42 0.00 0.00 57.16 56.33 2ny4 n GLU 3101Cb 0.45 -1.12 0.00 0.00 -0.57 0.00 0.00 31.44 30.20 2ny4 n GLU 3101CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ny4 n GLY 3102N 1.08 -0.77 2.91 0.62 0.00 -1.25 -1.15 105.19 106.62 2ny4 n GLY 3102Ca 0.04 -2.20 -0.42 0.00 0.00 0.00 0.00 46.02 43.44 2ny4 n GLY 3102CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ny4 n GLU 3103N -0.07 2.32 -0.09 1.61 1.02 -1.25 -4.70 120.64 119.48 2ny4 n GLU 3103Ca 0.00 -2.33 0.03 0.00 -0.02 0.00 0.00 57.16 54.85 2ny4 n GLU 3103Cb 0.00 -3.16 0.36 0.00 -0.02 0.00 0.00 31.44 28.62 2ny4 n GLU 3103CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ny4 h ALA 3104N 6.83 1.63 0.00 0.62 0.00 -1.75 0.13 119.26 126.72 2ny4 h ALA 3104Ca 0.50 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.38 2ny4 h ALA 3104Cb 0.66 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2ny4 h ALA 3104CO 1.90 0.33 0.00 0.38 0.00 0.00 0.00 179.25 181.86 2ny4 h ASP 3105N 0.73 0.00 -0.40 0.00 2.03 -1.85 -0.46 116.42 116.47 2ny4 h ASP 3105Ca 0.21 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.51 2ny4 h ASP 3105Cb -0.04 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.46 2ny4 h ASP 3105CO -0.05 0.00 0.00 -0.62 -1.03 0.00 0.00 179.24 177.54 2ny4 n GLU 3106N -2.65 3.29 -0.84 4.15 -0.58 0.38 -4.96 120.64 119.42 2ny4 n GLU 3106Ca -0.00 -2.69 0.00 0.00 -0.42 0.00 0.00 57.16 54.05 2ny4 n GLU 3106Cb 0.16 -1.75 0.00 0.00 -0.57 0.00 0.00 31.44 29.28 2ny4 n GLU 3106CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ny4 n GLY 3107N 0.22 0.79 3.69 0.62 0.00 -0.18 -5.03 105.19 105.30 2ny4 n GLY 3107Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 2ny4 n GLY 3107CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ny4 s GLU 3108N -0.16 4.33 -0.21 1.61 2.12 -0.82 -4.95 118.70 120.62 2ny4 s GLU 3108Ca 0.00 0.76 -0.05 0.00 0.36 0.00 0.00 54.97 56.05 2ny4 s GLU 3108Cb 0.00 -3.51 0.10 0.00 0.26 0.00 0.00 34.13 30.98 2ny4 s GLU 3108CO 0.00 -0.10 0.36 -0.47 -0.54 0.00 0.00 175.26 174.52 2ny4 s TYR 3109N 1.39 -0.72 -0.72 5.30 6.14 -1.26 -2.36 117.35 125.13 2ny4 s TYR 3109Ca 0.33 1.07 0.25 0.00 0.64 0.00 0.00 57.07 59.36 2ny4 s TYR 3109Cb -0.17 0.09 0.56 0.00 0.42 0.00 0.00 41.96 42.87 2ny4 s TYR 3109CO 0.14 -0.57 1.52 -0.25 0.64 0.00 0.00 175.55 177.03 2ny4 n ASP 3110N 5.37 0.69 -3.68 4.32 8.00 -0.30 -4.96 116.55 125.98 2ny4 n ASP 3110Ca -0.06 0.27 -0.31 0.00 0.71 0.00 0.00 54.79 55.41 2ny4 n ASP 3110Cb 0.50 -0.20 0.04 0.00 -0.02 0.00 0.00 41.12 41.44 2ny4 n ASP 3110CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2ny4 n ASN 3111N -2.09 -5.39 -4.72 -2.24 5.15 -1.26 -4.93 115.26 99.79 2ny4 n ASN 3111Ca 0.04 -0.99 -0.42 0.00 -0.60 0.00 0.00 54.58 52.61 2ny4 n ASN 3111Cb 0.42 -3.33 -0.03 0.00 -0.53 0.00 0.00 39.78 36.31 2ny4 n ASN 3111CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 2ny4 s ASN 3112N -3.43 7.13 -0.00 1.20 0.01 -1.26 -4.95 114.94 113.64 2ny4 s ASN 3112Ca 0.45 2.03 0.21 0.00 -0.71 0.00 0.00 52.86 54.84 2ny4 s ASN 3112Cb -0.16 -2.59 -0.20 0.00 0.41 0.00 0.00 41.25 38.71 2ny4 s ASN 3112CO 0.86 -0.40 0.91 0.61 -1.51 0.00 0.00 177.10 177.57 2ny4 n GLY 3113N 2.88 -1.01 3.93 0.66 0.00 -1.26 -4.97 105.19 105.42 2ny4 n GLY 3113Ca 0.07 -0.59 -0.27 0.00 0.00 0.00 0.00 46.02 45.24 2ny4 n GLY 3113CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2ny4 s PHE 3114N -3.01 2.79 -0.25 1.61 -0.71 -1.26 -5.08 117.98 112.07 2ny4 s PHE 3114Ca 0.08 0.47 -0.01 0.00 -1.04 0.00 0.00 56.93 56.43 2ny4 s PHE 3114Cb 0.16 -3.31 0.07 0.00 -1.21 0.00 0.00 43.02 38.74 2ny4 s PHE 3114CO 0.86 -1.57 0.03 -0.51 -1.34 0.00 0.00 175.22 172.69 2ny4 s LEU 3115N -5.35 2.06 -0.09 -1.99 1.43 -1.26 -4.66 118.68 108.83 2ny4 s LEU 3115Ca 0.62 -1.25 -0.16 0.00 -1.03 0.00 0.00 54.13 52.31 2ny4 s LEU 3115Cb -0.10 -0.89 -0.28 0.00 0.03 0.00 0.00 46.19 44.95 2ny4 s LEU 3115CO 0.46 -0.33 0.62 0.50 0.23 0.00 0.00 176.35 177.84 2ny4 h LYS 3116N 8.09 0.28 -5.73 1.70 1.63 -1.82 -3.47 116.57 117.25 2ny4 h LYS 3116Ca -0.15 -0.48 -0.66 0.00 -0.85 0.00 0.00 60.65 58.51 2ny4 h LYS 3116Cb 1.07 0.18 -0.21 0.00 -0.60 0.00 0.00 32.23 32.66 2ny4 h LYS 3116CO 0.41 1.23 -0.70 -1.01 -3.45 0.00 0.00 179.45 175.93 2ny4 s HIS 3117N -2.49 2.94 0.00 1.91 3.76 -0.62 -4.98 115.29 115.82 2ny4 s HIS 3117Ca -0.18 -0.20 0.05 0.00 -0.15 0.00 0.00 55.06 54.58 2ny4 s HIS 3117Cb 0.04 -1.81 -0.01 0.00 1.11 0.00 0.00 32.58 31.90 2ny4 s HIS 3117CO 0.79 0.12 -0.14 -1.58 -0.85 0.00 0.00 174.74 173.07 2ny4 s TRP 3118N -0.22 1.27 1.02 1.40 0.52 -1.26 -0.56 118.94 121.10 2ny4 s TRP 3118Ca 0.03 -0.27 -0.16 0.00 0.02 0.00 0.00 56.10 55.72 2ny4 s TRP 3118Cb -0.13 -0.80 0.21 0.00 -1.15 0.00 0.00 33.47 31.60 2ny4 s TRP 3118CO 0.03 -0.00 1.21 0.20 0.02 0.00 0.00 176.95 178.40 2ny4 s GLY 3119N -0.55 1.67 0.00 0.98 0.00 0.44 -4.53 107.32 105.33 2ny4 s GLY 3119Ca 0.05 -0.95 0.29 0.00 0.00 0.00 0.00 44.72 44.10 2ny4 s GLY 3119CO -0.00 -0.21 1.89 0.61 0.00 0.00 0.00 173.10 175.40 2ny4 n GLN 3120N -4.05 0.15 0.00 2.90 0.00 -1.26 -4.80 117.38 110.32 2ny4 n GLN 3120Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 57.00 57.10 2ny4 n GLN 3120Cb 0.59 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.34 2ny4 n GLN 3120CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2ny4 n GLY 3121N 1.43 0.21 2.94 2.61 0.00 -1.26 -5.03 105.19 106.10 2ny4 n GLY 3121Ca 0.09 -1.56 -0.28 0.00 0.00 0.00 0.00 46.02 44.28 2ny4 n GLY 3121CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ny4 s THR 3122N -2.71 1.20 -0.05 2.61 2.01 0.05 -4.88 115.64 113.86 2ny4 s THR 3122Ca 0.00 -0.40 -0.30 0.00 0.31 0.00 0.00 61.69 61.30 2ny4 s THR 3122Cb 0.00 -1.18 -0.04 0.00 0.01 0.00 0.00 72.50 71.30 2ny4 s THR 3122CO 0.00 0.40 1.25 -0.22 -0.69 0.00 0.00 174.62 175.36 2ny4 s LEU 3123N 1.62 4.28 -0.26 4.42 2.96 -1.26 -0.25 118.68 130.18 2ny4 s LEU 3123Ca 0.04 1.87 0.01 0.00 -0.22 0.00 0.00 54.13 55.84 2ny4 s LEU 3123Cb -0.13 -3.56 0.05 0.00 0.50 0.00 0.00 46.19 43.06 2ny4 s LEU 3123CO -0.09 -0.63 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.54 2ny4 s VAL 3124N 2.36 2.45 -0.23 1.68 1.01 -0.08 -0.79 120.40 126.80 2ny4 s VAL 3124Ca 0.58 -1.44 -0.12 0.00 0.00 0.00 0.00 61.98 60.99 2ny4 s VAL 3124Cb -0.26 -2.38 -0.05 0.00 0.00 0.00 0.00 36.38 33.70 2ny4 s VAL 3124CO 0.22 0.02 0.25 -0.89 0.00 0.00 0.00 175.10 174.71 2ny4 s THR 3125N 1.18 5.29 -0.23 3.92 2.01 -0.29 -1.85 115.64 125.68 2ny4 s THR 3125Ca -0.06 0.37 -0.01 0.00 0.31 0.00 0.00 61.69 62.29 2ny4 s THR 3125Cb -0.19 -3.59 0.02 0.00 0.01 0.00 0.00 72.50 68.75 2ny4 s THR 3125CO -0.05 0.30 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.40 2ny4 s VAL 3126N 1.27 2.79 -0.05 3.82 1.01 -1.26 -0.23 120.40 127.75 2ny4 s VAL 3126Ca 0.11 -0.93 -0.30 0.00 0.00 0.00 0.00 61.98 60.87 2ny4 s VAL 3126Cb -0.14 -2.35 0.09 0.00 0.00 0.00 0.00 36.38 33.97 2ny4 s VAL 3126CO 0.06 0.30 0.76 -0.55 0.00 0.00 0.00 175.10 175.67 2ny4 s SER 3127N 1.34 -0.57 0.18 3.32 0.15 0.03 -4.38 113.70 113.77 2ny4 s SER 3127Ca 0.02 0.53 0.23 0.00 0.70 0.00 0.00 55.95 57.42 2ny4 s SER 3127Cb -0.16 0.48 0.90 0.00 -1.71 0.00 0.00 66.02 65.53 2ny4 s SER 3127CO -0.06 -0.58 1.69 -1.54 1.20 0.00 0.00 173.24 173.95 2ny4 n SER 3128N 0.67 0.51 -4.76 5.45 3.41 -1.26 -4.07 113.62 113.58 2ny4 n SER 3128Ca -0.16 0.60 -0.35 0.00 -0.26 0.00 0.00 58.87 58.71 2ny4 n SER 3128Cb 0.58 -0.72 0.04 0.00 -0.26 0.00 0.00 64.21 63.85 2ny4 n SER 3128CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ny4 s ALA 3129N -3.19 2.47 0.06 7.33 0.00 -1.26 -5.04 121.76 122.12 2ny4 s ALA 3129Ca 0.07 0.82 0.01 0.00 0.00 0.00 0.00 51.96 52.86 2ny4 s ALA 3129Cb 0.11 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.79 2ny4 s ALA 3129CO 0.41 -1.25 0.14 -1.12 0.00 0.00 0.00 175.76 173.94 2ny4 s SER 3130N -1.99 5.95 0.23 0.00 0.01 -1.26 -4.99 113.70 111.65 2ny4 s SER 3130Ca 0.73 0.15 -0.31 0.00 1.31 0.00 0.00 55.95 57.82 2ny4 s SER 3130Cb -0.26 -1.73 -0.13 0.00 0.21 0.00 0.00 66.02 64.11 2ny4 s SER 3130CO 0.36 0.19 1.47 0.41 0.41 0.00 0.00 173.24 176.08 2ny4 n THR 3131N 0.48 0.80 -3.59 1.44 -1.04 -1.26 -4.72 114.28 106.38 2ny4 n THR 3131Ca -0.08 -0.20 -0.14 0.00 -2.04 0.00 0.00 64.05 61.59 2ny4 n THR 3131Cb 0.51 -1.57 -0.06 0.00 -1.82 0.00 0.00 70.33 67.39 2ny4 n THR 3131CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 2ny4 s LYS 3132N -0.20 0.82 0.64 -2.82 -2.85 0.32 -4.95 119.74 110.70 2ny4 s LYS 3132Ca 0.69 0.60 -0.12 0.00 -1.00 0.00 0.00 55.97 56.14 2ny4 s LYS 3132Cb -0.63 0.39 -0.02 0.00 -2.06 0.00 0.00 37.83 35.51 2ny4 s LYS 3132CO 0.47 -0.17 1.05 0.20 0.10 0.00 0.00 175.35 177.00 2ny4 s GLY 3133N -0.30 1.81 0.56 0.59 0.00 -1.26 -1.00 107.32 107.72 2ny4 s GLY 3133Ca -0.03 0.13 -0.16 0.00 0.00 0.00 0.00 44.72 44.66 2ny4 s GLY 3133CO 0.02 0.43 1.02 2.56 0.00 0.00 0.00 173.10 177.14 2ny4 s PRO 3134N -4.76 3.61 0.02 2.90 0.04 -1.26 -4.51 135.00 131.04 2ny4 s PRO 3134Ca 0.59 1.09 -0.19 0.00 0.04 0.00 0.00 61.00 62.53 2ny4 s PRO 3134Cb -0.13 -2.08 -0.06 0.00 0.04 0.00 0.00 34.50 32.27 2ny4 s PRO 3134CO 0.48 -0.56 0.54 -1.12 0.04 0.00 0.00 177.00 176.38 2ny4 s SER 3135N -2.91 6.96 -0.21 6.66 0.01 0.78 -4.88 113.70 120.12 2ny4 s SER 3135Ca 0.61 1.14 0.01 0.00 1.31 0.00 0.00 55.95 59.02 2ny4 s SER 3135Cb -0.13 -2.33 0.03 0.00 0.21 0.00 0.00 66.02 63.79 2ny4 s SER 3135CO 0.34 0.21 -0.16 -0.69 0.41 0.00 0.00 173.24 173.35 2ny4 s VAL 3136N -0.70 2.17 0.05 3.43 1.01 -1.26 -0.06 120.40 125.04 2ny4 s VAL 3136Ca 0.28 -1.11 0.07 0.00 0.00 0.00 0.00 61.98 61.22 2ny4 s VAL 3136Cb -0.18 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 2ny4 s VAL 3136CO 0.17 0.37 -0.18 -0.36 0.00 0.00 0.00 175.10 175.10 2ny4 s PHE 3137N 1.25 2.56 0.35 5.22 0.08 0.17 -4.94 117.98 122.66 2ny4 s PHE 3137Ca 0.01 -0.25 -0.27 0.00 0.12 0.00 0.00 56.93 56.54 2ny4 s PHE 3137Cb -0.15 -1.45 -0.09 0.00 -0.57 0.00 0.00 43.02 40.76 2ny4 s PHE 3137CO -0.10 0.27 1.09 -1.25 -0.10 0.00 0.00 175.22 175.13 2ny4 s PRO 3138N -1.51 4.36 -0.67 0.24 0.04 -1.26 -0.01 135.00 136.18 2ny4 s PRO 3138Ca 0.15 1.70 -0.08 0.00 0.04 0.00 0.00 61.00 62.81 2ny4 s PRO 3138Cb -0.11 -2.85 0.17 0.00 0.04 0.00 0.00 34.50 31.76 2ny4 s PRO 3138CO 0.06 -0.01 0.54 -0.51 0.04 0.00 0.00 177.00 177.12 2ny4 s LEU 3139N -2.08 5.88 0.29 -3.56 1.43 0.84 -4.76 118.68 116.71 2ny4 s LEU 3139Ca 0.52 -2.63 -0.29 0.00 -1.03 0.00 0.00 54.13 50.70 2ny4 s LEU 3139Cb -0.28 -2.01 -0.10 0.00 0.03 0.00 0.00 46.19 43.83 2ny4 s LEU 3139CO 0.35 -0.50 1.19 0.00 0.23 0.00 0.00 176.35 177.62 2ny4 s ALA 3140N 0.27 3.45 1.11 4.21 0.00 -1.26 -1.12 121.76 128.43 2ny4 s ALA 3140Ca 0.15 1.04 -0.06 0.00 0.00 0.00 0.00 51.96 53.09 2ny4 s ALA 3140Cb -0.18 -3.39 0.09 0.00 0.00 0.00 0.00 23.12 19.64 2ny4 s ALA 3140CO -0.05 -0.36 0.21 -0.35 0.00 0.00 0.00 175.76 175.21 2ny4 n PRO 3141N 1.20 -2.64 0.16 0.00 -0.04 -1.25 -4.87 135.00 127.56 2ny4 n PRO 3141Ca -0.00 -0.35 0.01 0.00 -0.04 0.00 0.00 63.50 63.12 2ny4 n PRO 3141Cb 0.44 -0.44 0.03 0.00 -0.04 0.00 0.00 33.50 33.48 2ny4 n PRO 3141CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ny4 n GLY 3149N -1.27 -0.27 3.28 0.55 0.00 -1.26 -4.52 105.19 101.70 2ny4 n GLY 3149Ca 0.03 0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 2ny4 n GLY 3149CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ny4 s THR 3150N -2.98 1.89 0.18 2.61 -4.23 -1.26 -1.48 115.64 110.37 2ny4 s THR 3150Ca -0.00 -1.06 0.10 0.00 -1.18 0.00 0.00 61.69 59.55 2ny4 s THR 3150Cb 0.00 -1.58 -0.04 0.00 1.34 0.00 0.00 72.50 72.22 2ny4 s THR 3150CO 0.01 0.50 -0.16 0.00 -0.54 0.00 0.00 174.62 174.42 2ny4 s ALA 3151N -0.60 2.75 -0.06 3.99 0.00 0.82 -4.75 121.76 123.92 2ny4 s ALA 3151Ca 0.09 -1.54 0.05 0.00 0.00 0.00 0.00 51.96 50.56 2ny4 s ALA 3151Cb -0.09 -0.55 -0.02 0.00 0.00 0.00 0.00 23.12 22.46 2ny4 s ALA 3151CO -0.00 0.46 -0.21 0.00 0.00 0.00 0.00 175.76 176.00 2ny4 s ALA 3152N -1.67 2.36 0.19 0.00 0.00 -1.26 -0.73 121.76 120.64 2ny4 s ALA 3152Ca 0.23 -1.02 -0.06 0.00 0.00 0.00 0.00 51.96 51.11 2ny4 s ALA 3152Cb -0.08 -0.80 -0.02 0.00 0.00 0.00 0.00 23.12 22.21 2ny4 s ALA 3152CO 0.13 0.45 0.24 -0.48 0.00 0.00 0.00 175.76 176.10 2ny4 s LEU 3153N -0.31 0.99 0.00 0.00 0.05 -0.71 -3.83 118.68 114.87 2ny4 s LEU 3153Ca 0.01 -1.11 0.00 0.00 0.05 0.00 0.00 54.13 53.09 2ny4 s LEU 3153Cb -0.13 0.92 0.00 0.00 -2.05 0.00 0.00 46.19 44.94 2ny4 s LEU 3153CO 0.02 -0.91 0.00 0.61 -0.55 0.00 0.00 176.35 175.52 2ny4 n GLY 3154N -0.25 1.03 2.88 -3.48 0.00 -0.27 -0.62 105.19 104.47 2ny4 n GLY 3154Ca -0.03 -0.74 -0.16 0.00 0.00 0.00 0.00 46.02 45.10 2ny4 n GLY 3154CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ny4 s LEU 3156N 0.47 4.09 -0.43 0.00 2.96 0.98 -1.83 118.68 124.92 2ny4 s LEU 3156Ca -0.05 0.63 -0.06 0.00 -0.22 0.00 0.00 54.13 54.43 2ny4 s LEU 3156Cb -0.08 -2.72 0.11 0.00 0.50 0.00 0.00 46.19 43.99 2ny4 s LEU 3156CO -0.01 -0.26 0.26 -0.69 -1.32 0.00 0.00 176.35 174.33 2ny4 s VAL 3157N 2.06 3.78 0.03 1.68 1.01 0.11 -0.66 120.40 128.41 2ny4 s VAL 3157Ca 0.23 -1.82 0.09 0.00 0.00 0.00 0.00 61.98 60.48 2ny4 s VAL 3157Cb -0.16 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 2ny4 s VAL 3157CO 0.09 -0.67 -0.25 -0.75 0.00 0.00 0.00 175.10 173.52 2ny4 s LYS 3158N 1.28 1.77 -0.67 2.72 2.20 0.92 -0.60 119.74 127.35 2ny4 s LYS 3158Ca 0.06 -1.02 -0.02 0.00 -0.36 0.00 0.00 55.97 54.62 2ny4 s LYS 3158Cb -0.24 -1.88 -0.03 0.00 -1.51 0.00 0.00 37.83 34.17 2ny4 s LYS 3158CO -0.02 0.49 0.58 -0.25 -0.36 0.00 0.00 175.35 175.80 2ny4 n ASP 3159N 1.96 -3.88 -4.45 1.43 8.00 0.13 -0.16 116.55 119.57 2ny4 n ASP 3159Ca -0.17 -0.42 -0.22 0.00 0.71 0.00 0.00 54.79 54.70 2ny4 n ASP 3159Cb 0.52 -3.37 -0.10 0.00 -0.02 0.00 0.00 41.12 38.15 2ny4 n ASP 3159CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2ny4 s TYR 3160N -3.23 2.04 -0.28 1.24 -0.85 -0.90 -4.35 117.35 111.02 2ny4 s TYR 3160Ca 0.19 -0.65 -0.25 0.00 -0.52 0.00 0.00 57.07 55.84 2ny4 s TYR 3160Cb -0.02 -1.15 0.10 0.00 0.38 0.00 0.00 41.96 41.27 2ny4 s TYR 3160CO 0.45 0.35 0.92 0.12 -1.52 0.00 0.00 175.55 175.87 2ny4 s PHE 3161N -2.92 -0.59 0.30 -3.49 5.36 -0.17 -0.33 117.98 116.14 2ny4 s PHE 3161Ca 0.30 1.44 -0.02 0.00 -0.96 0.00 0.00 56.93 57.69 2ny4 s PHE 3161Cb 0.03 0.33 0.06 0.00 -0.34 0.00 0.00 43.02 43.11 2ny4 s PHE 3161CO 0.13 -0.29 0.41 -0.35 -1.46 0.00 0.00 175.22 173.66 2ny4 n PRO 3162N 2.44 0.07 -1.26 10.12 -0.04 -1.26 -0.52 135.00 144.54 2ny4 n PRO 3162Ca -0.13 -0.92 -0.33 0.00 -0.04 0.00 0.00 63.50 62.09 2ny4 n PRO 3162Cb 0.56 -0.33 0.10 0.00 -0.04 0.00 0.00 33.50 33.79 2ny4 n PRO 3162CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2ny4 s GLU 3163N -3.61 1.99 0.42 0.54 0.41 -1.26 -4.70 118.70 112.49 2ny4 s GLU 3163Ca 0.25 1.52 0.08 0.00 -0.41 0.00 0.00 54.97 56.42 2ny4 s GLU 3163Cb -0.01 -1.84 0.00 0.00 -1.78 0.00 0.00 34.13 30.50 2ny4 s GLU 3163CO 0.17 -1.90 0.53 -1.25 -0.49 0.00 0.00 175.26 172.32 2ny4 s PRO 3164N -4.33 2.76 0.06 0.39 0.04 -1.26 -4.98 135.00 127.68 2ny4 s PRO 3164Ca 0.68 -1.31 0.09 0.00 0.04 0.00 0.00 61.00 60.50 2ny4 s PRO 3164Cb -0.24 -2.67 -0.03 0.00 0.04 0.00 0.00 34.50 31.60 2ny4 s PRO 3164CO 0.50 -0.26 -0.24 0.54 0.04 0.00 0.00 177.00 177.59 2ny4 s VAL 3165N -2.38 1.92 0.01 -0.36 0.11 -1.26 -4.49 120.40 113.94 2ny4 s VAL 3165Ca 0.53 -1.38 0.06 0.00 -2.93 0.00 0.00 61.98 58.27 2ny4 s VAL 3165Cb -0.08 -1.67 -0.03 0.00 -1.53 0.00 0.00 36.38 33.07 2ny4 s VAL 3165CO 0.32 0.22 -0.18 0.28 -3.33 0.00 0.00 175.10 172.40 2ny4 s THR 3166N -0.88 2.74 -0.06 5.04 -1.32 -0.18 -4.98 115.64 116.00 2ny4 s THR 3166Ca 0.10 -1.05 0.02 0.00 -1.21 0.00 0.00 61.69 59.55 2ny4 s THR 3166Cb -0.10 -2.10 0.02 0.00 -1.51 0.00 0.00 72.50 68.81 2ny4 s THR 3166CO 0.03 0.45 -0.10 -0.69 -2.21 0.00 0.00 174.62 172.10 2ny4 s VAL 3167N -0.82 0.94 0.37 5.08 1.01 -1.26 -0.60 120.40 125.12 2ny4 s VAL 3167Ca 0.13 -0.37 0.04 0.00 0.00 0.00 0.00 61.98 61.78 2ny4 s VAL 3167Cb -0.10 -0.88 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 2ny4 s VAL 3167CO 0.03 0.31 0.06 -0.94 0.00 0.00 0.00 175.10 174.56 2ny4 s SER 3168N 0.70 2.82 -0.04 3.32 1.04 -0.39 -4.98 113.70 116.17 2ny4 s SER 3168Ca -0.13 -1.46 0.05 0.00 0.48 0.00 0.00 55.95 54.89 2ny4 s SER 3168Cb -0.15 0.05 -0.01 0.00 0.10 0.00 0.00 66.02 66.01 2ny4 s SER 3168CO 0.03 -0.68 -0.20 0.26 0.98 0.00 0.00 173.24 173.63 2ny4 s TRP 3169N -3.16 1.89 -1.51 5.02 0.52 -1.26 -0.33 118.94 120.10 2ny4 s TRP 3169Ca 0.31 -0.49 -0.05 0.00 0.02 0.00 0.00 56.10 55.89 2ny4 s TRP 3169Cb 0.07 -1.24 0.04 0.00 -1.15 0.00 0.00 33.47 31.18 2ny4 s TRP 3169CO 0.14 -0.13 0.41 0.09 0.02 0.00 0.00 176.95 177.49 2ny4 n ASN 3170N 2.93 -0.71 -2.34 2.95 3.02 0.39 -1.29 115.26 120.21 2ny4 n ASN 3170Ca -0.17 -1.07 -0.16 0.00 -0.03 0.00 0.00 54.58 53.15 2ny4 n ASN 3170Cb 0.53 -2.66 -0.01 0.00 -0.61 0.00 0.00 39.78 37.02 2ny4 n ASN 3170CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2ny4 n SER 3171N -2.89 -4.84 0.00 6.41 7.64 -1.26 -1.44 113.62 117.24 2ny4 n SER 3171Ca -0.22 0.12 0.00 0.00 1.01 0.00 0.00 58.87 59.78 2ny4 n SER 3171Cb 0.64 -4.08 0.00 0.00 -1.01 0.00 0.00 64.21 59.76 2ny4 n SER 3171CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ny4 n GLY 3172N -0.86 0.31 0.19 0.23 0.00 -0.41 -4.94 105.19 99.71 2ny4 n GLY 3172Ca -0.19 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.90 2ny4 n GLY 3172CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ny4 h ALA 3173N 0.00 0.94 -3.12 4.61 0.00 -1.13 -3.42 119.26 117.13 2ny4 h ALA 3173Ca 0.00 -0.30 -0.67 0.00 0.00 0.00 0.00 54.91 53.95 2ny4 h ALA 3173Cb 0.00 -0.05 -0.32 0.00 0.00 0.00 0.00 17.79 17.42 2ny4 h ALA 3173CO 0.00 0.41 -0.79 -1.17 0.00 0.00 0.00 179.25 177.69 2ny4 s LEU 3174N -6.79 2.64 0.00 0.00 2.96 -1.06 -4.91 118.68 111.51 2ny4 s LEU 3174Ca 0.01 -0.65 0.00 0.00 -0.22 0.00 0.00 54.13 53.27 2ny4 s LEU 3174Cb 0.10 -1.60 0.00 0.00 0.50 0.00 0.00 46.19 45.19 2ny4 s LEU 3174CO 0.68 -0.04 0.00 0.35 -1.32 0.00 0.00 176.35 176.01 2ny4 n THR 3175N 4.67 0.00 -2.07 3.68 -2.24 -1.26 -4.02 114.28 113.04 2ny4 n THR 3175Ca -0.19 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.17 2ny4 n THR 3175Cb 0.49 -0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.58 2ny4 n THR 3175CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2ny4 s SER 3176N -1.17 6.72 0.00 3.42 0.15 -1.26 -2.73 113.70 118.83 2ny4 s SER 3176Ca 0.00 2.31 0.00 0.00 0.70 0.00 0.00 55.95 58.96 2ny4 s SER 3176Cb 0.00 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.75 2ny4 s SER 3176CO 0.00 -0.80 0.00 0.61 1.20 0.00 0.00 173.24 174.25 2ny4 n GLY 3177N 3.82 0.67 3.74 9.45 0.00 -1.26 -4.74 105.19 116.86 2ny4 n GLY 3177Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 2ny4 n GLY 3177CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ny4 s VAL 3178N -2.47 4.81 -0.21 1.61 1.01 -1.10 -2.52 120.40 121.52 2ny4 s VAL 3178Ca 0.00 1.64 -0.01 0.00 0.00 0.00 0.00 61.98 63.61 2ny4 s VAL 3178Cb 0.00 -4.12 0.06 0.00 0.00 0.00 0.00 36.38 32.32 2ny4 s VAL 3178CO 0.00 0.32 -0.02 -1.00 0.00 0.00 0.00 175.10 174.40 2ny4 s HIS 3179N 0.23 1.80 -0.37 5.22 3.76 0.99 -4.99 115.29 121.93 2ny4 s HIS 3179Ca 0.40 -1.33 -0.12 0.00 -0.15 0.00 0.00 55.06 53.85 2ny4 s HIS 3179Cb -0.20 -1.34 0.01 0.00 1.11 0.00 0.00 32.58 32.16 2ny4 s HIS 3179CO 0.23 -0.69 0.23 0.99 -0.85 0.00 0.00 174.74 174.65 2ny4 s THR 3180N 1.60 4.93 0.47 1.30 2.01 -1.26 -0.74 115.64 123.94 2ny4 s THR 3180Ca -0.03 -0.59 -0.21 0.00 0.31 0.00 0.00 61.69 61.16 2ny4 s THR 3180Cb -0.18 -3.67 -0.08 0.00 0.01 0.00 0.00 72.50 68.58 2ny4 s THR 3180CO -0.07 -0.16 1.05 -0.36 -0.69 0.00 0.00 174.62 174.39 2ny4 s PHE 3181N 1.64 3.05 0.39 4.92 0.40 -0.37 -5.00 117.98 123.01 2ny4 s PHE 3181Ca 0.04 1.59 -0.26 0.00 -0.60 0.00 0.00 56.93 57.70 2ny4 s PHE 3181Cb -0.18 -3.10 -0.11 0.00 0.51 0.00 0.00 43.02 40.14 2ny4 s PHE 3181CO 0.08 -0.82 1.27 -2.30 0.70 0.00 0.00 175.22 174.15 2ny4 n PRO 3182N -0.74 1.99 -2.09 0.24 -0.02 -1.26 -4.59 135.00 128.53 2ny4 n PRO 3182Ca 0.08 0.71 -0.36 0.00 -2.02 0.00 0.00 63.50 61.91 2ny4 n PRO 3182Cb 0.52 -2.36 0.02 0.00 -0.02 0.00 0.00 33.50 31.66 2ny4 n PRO 3182CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ny4 s ALA 3183N -1.17 2.65 0.08 3.55 0.00 -1.26 -4.85 121.76 120.75 2ny4 s ALA 3183Ca 0.59 0.98 0.05 0.00 0.00 0.00 0.00 51.96 53.58 2ny4 s ALA 3183Cb -0.53 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.12 2ny4 s ALA 3183CO 0.59 -1.02 -0.03 0.14 0.00 0.00 0.00 175.76 175.44 2ny4 s VAL 3184N -1.61 3.83 -0.31 0.00 -7.23 -0.36 -4.95 120.40 109.77 2ny4 s VAL 3184Ca 0.74 -1.00 -0.20 0.00 -1.81 0.00 0.00 61.98 59.72 2ny4 s VAL 3184Cb -0.29 -2.79 -0.01 0.00 0.56 0.00 0.00 36.38 33.85 2ny4 s VAL 3184CO 0.33 0.17 0.61 -0.22 -0.31 0.00 0.00 175.10 175.68 2ny4 s LEU 3185N -2.12 4.16 0.67 1.32 2.96 -1.26 -1.66 118.68 122.75 2ny4 s LEU 3185Ca 0.23 0.38 -0.11 0.00 -0.22 0.00 0.00 54.13 54.41 2ny4 s LEU 3185Cb -0.11 -2.78 -0.01 0.00 0.50 0.00 0.00 46.19 43.78 2ny4 s LEU 3185CO 0.15 -0.47 1.06 -1.10 -1.32 0.00 0.00 176.35 174.67 2ny4 s GLN 3186N 2.58 3.15 0.27 1.98 -0.21 0.00 -4.92 119.66 122.50 2ny4 s GLN 3186Ca 0.24 0.68 0.22 0.00 0.02 0.00 0.00 55.36 56.52 2ny4 s GLN 3186Cb -0.15 -2.03 1.02 0.00 1.00 0.00 0.00 33.01 32.85 2ny4 s GLN 3186CO 0.12 -0.88 1.66 -1.13 -2.12 0.00 0.00 175.29 172.94 2ny4 n SER 3187N -2.94 0.58 0.00 5.90 3.41 -1.26 -0.01 113.62 119.30 2ny4 n SER 3187Ca 0.07 0.70 0.12 0.00 -0.26 0.00 0.00 58.87 59.49 2ny4 n SER 3187Cb 0.55 -0.80 0.56 0.00 -0.26 0.00 0.00 64.21 64.26 2ny4 n SER 3187CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2ny4 n SER 3188N -2.20 0.00 0.00 4.04 3.41 -1.26 -4.88 113.62 112.73 2ny4 n SER 3188Ca 0.00 0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.83 2ny4 n SER 3188Cb 0.13 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 2ny4 n SER 3188CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ny4 n GLY 3189N 0.86 0.59 3.73 5.00 0.00 0.98 -4.98 105.19 111.37 2ny4 n GLY 3189Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 2ny4 n GLY 3189CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ny4 s LEU 3190N 0.00 3.65 0.44 0.99 1.43 -1.25 -4.83 118.68 119.12 2ny4 s LEU 3190Ca 0.00 -0.07 -0.07 0.00 -1.03 0.00 0.00 54.13 52.97 2ny4 s LEU 3190Cb 0.00 -2.33 -0.05 0.00 0.03 0.00 0.00 46.19 43.85 2ny4 s LEU 3190CO 0.00 0.19 0.76 -0.31 0.23 0.00 0.00 176.35 177.21 2ny4 s TYR 3191N -1.33 3.53 -0.12 0.29 2.02 0.55 -0.82 117.35 121.48 2ny4 s TYR 3191Ca 0.27 0.86 -0.11 0.00 -0.37 0.00 0.00 57.07 57.72 2ny4 s TYR 3191Cb -0.12 -2.32 0.03 0.00 -0.40 0.00 0.00 41.96 39.15 2ny4 s TYR 3191CO 0.19 -0.18 0.32 0.45 -1.57 0.00 0.00 175.55 174.77 2ny4 s SER 3192N -3.73 -0.33 0.19 2.29 0.15 -0.67 -0.70 113.70 110.91 2ny4 s SER 3192Ca 0.48 0.63 -0.07 0.00 0.70 0.00 0.00 55.95 57.69 2ny4 s SER 3192Cb -0.10 0.65 -0.02 0.00 -1.71 0.00 0.00 66.02 64.84 2ny4 s SER 3192CO 0.39 -0.12 0.27 -1.48 1.20 0.00 0.00 173.24 173.50 2ny4 s LEU 3193N 0.13 0.94 0.05 3.45 0.05 0.23 -1.23 118.68 122.30 2ny4 s LEU 3193Ca -0.00 -1.04 0.07 0.00 0.05 0.00 0.00 54.13 53.21 2ny4 s LEU 3193Cb -0.02 1.05 -0.03 0.00 -2.05 0.00 0.00 46.19 45.14 2ny4 s LEU 3193CO 0.01 -0.92 -0.21 -0.44 -0.55 0.00 0.00 176.35 174.24 2ny4 s SER 3194N -3.03 2.45 -0.10 1.48 0.01 -1.26 0.06 113.70 113.31 2ny4 s SER 3194Ca 0.24 -0.53 0.03 0.00 1.31 0.00 0.00 55.95 57.00 2ny4 s SER 3194Cb 0.04 -0.20 -0.01 0.00 0.21 0.00 0.00 66.02 66.06 2ny4 s SER 3194CO 0.05 0.15 -0.20 -0.55 0.41 0.00 0.00 173.24 173.10 2ny4 s SER 3195N -1.23 3.46 0.18 2.44 0.15 -0.76 -1.24 113.70 116.69 2ny4 s SER 3195Ca 0.07 -0.45 0.06 0.00 0.70 0.00 0.00 55.95 56.34 2ny4 s SER 3195Cb -0.09 -1.35 -0.05 0.00 -1.71 0.00 0.00 66.02 62.82 2ny4 s SER 3195CO 0.02 0.19 -0.13 0.68 1.20 0.00 0.00 173.24 175.20 2ny4 s VAL 3196N 0.20 1.50 -0.11 4.45 -7.23 0.08 -1.19 120.40 118.09 2ny4 s VAL 3196Ca -0.12 -2.12 -0.09 0.00 -1.81 0.00 0.00 61.98 57.84 2ny4 s VAL 3196Cb -0.16 -1.93 0.03 0.00 0.56 0.00 0.00 36.38 34.88 2ny4 s VAL 3196CO 0.07 -0.64 0.29 0.54 -0.31 0.00 0.00 175.10 175.05 2ny4 s VAL 3197N -3.03 -0.01 -0.14 1.32 0.11 0.21 -0.01 120.40 118.85 2ny4 s VAL 3197Ca 0.19 0.02 -0.10 0.00 -2.93 0.00 0.00 61.98 59.16 2ny4 s VAL 3197Cb 0.00 -0.41 -0.05 0.00 -1.53 0.00 0.00 36.38 34.39 2ny4 s VAL 3197CO 0.04 0.01 0.20 0.42 -3.33 0.00 0.00 175.10 172.44 2ny4 s THR 3198N 0.32 5.39 0.11 5.04 -4.23 -1.05 -1.73 115.64 119.48 2ny4 s THR 3198Ca -0.01 0.34 0.01 0.00 -1.18 0.00 0.00 61.69 60.85 2ny4 s THR 3198Cb -0.03 -3.50 -0.04 0.00 1.34 0.00 0.00 72.50 70.26 2ny4 s THR 3198CO -0.01 0.51 -0.04 0.68 -0.54 0.00 0.00 174.62 175.22 2ny4 s VAL 3199N -0.28 0.60 0.28 2.29 -7.23 0.09 -4.74 120.40 111.41 2ny4 s VAL 3199Ca 0.14 -1.93 -0.30 0.00 -1.81 0.00 0.00 61.98 58.08 2ny4 s VAL 3199Cb -0.12 -1.78 -0.12 0.00 0.56 0.00 0.00 36.38 34.92 2ny4 s VAL 3199CO 0.03 -0.78 1.61 -2.65 -0.31 0.00 0.00 175.10 173.00 2ny4 n PRO 3200N -0.07 2.70 0.25 4.82 -0.02 -1.26 -0.13 135.00 141.29 2ny4 n PRO 3200Ca -0.11 0.96 0.13 0.00 -2.02 0.00 0.00 63.50 62.46 2ny4 n PRO 3200Cb 0.61 -2.75 0.65 0.00 -0.02 0.00 0.00 33.50 31.99 2ny4 n PRO 3200CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2ny4 h SER 3201N 5.01 0.00 0.76 2.55 4.64 -1.55 -1.46 113.55 123.51 2ny4 h SER 3201Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2ny4 h SER 3201Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2ny4 h SER 3201CO 0.81 0.14 0.00 -1.54 -0.87 0.00 0.00 176.83 175.37 2ny4 n SER 3202N -3.45 0.02 0.13 4.97 3.41 -1.26 -3.05 113.62 114.39 2ny4 n SER 3202Ca -0.01 0.50 0.12 0.00 -0.26 0.00 0.00 58.87 59.22 2ny4 n SER 3202Cb 0.31 -0.51 0.15 0.00 -0.26 0.00 0.00 64.21 63.90 2ny4 n SER 3202CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2ny4 h SER 3203N 0.00 0.00 -3.89 4.04 0.87 -1.63 -3.45 113.55 109.50 2ny4 h SER 3203Ca 0.00 -0.05 -0.52 0.00 -1.23 0.00 0.00 61.79 59.99 2ny4 h SER 3203Cb 0.38 0.00 0.06 0.00 -0.44 0.00 0.00 62.40 62.40 2ny4 h SER 3203CO 0.00 0.03 0.59 -0.76 -0.53 0.00 0.00 176.83 176.15 2ny4 s LEU 3204N -5.22 4.39 0.00 2.23 1.43 -1.17 -0.31 118.68 120.02 2ny4 s LEU 3204Ca 0.05 2.57 0.00 0.00 -1.03 0.00 0.00 54.13 55.72 2ny4 s LEU 3204Cb 0.09 -3.73 0.00 0.00 0.03 0.00 0.00 46.19 42.58 2ny4 s LEU 3204CO 0.71 -0.53 0.00 0.61 0.23 0.00 0.00 176.35 177.37 2ny4 n GLY 3205N 0.82 2.53 0.82 -3.19 0.00 -1.26 -4.74 105.19 100.17 2ny4 n GLY 3205Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 2ny4 n GLY 3205CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ny4 n THR 3206N -2.00 1.20 -2.78 2.61 -2.24 -1.05 -5.02 114.28 105.00 2ny4 n THR 3206Ca 0.00 0.30 -0.41 0.00 -2.27 0.00 0.00 64.05 61.66 2ny4 n THR 3206Cb 0.00 -1.75 -0.03 0.00 -2.10 0.00 0.00 70.33 66.44 2ny4 n THR 3206CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2ny4 s GLN 3207N -2.21 4.55 0.07 -0.78 2.00 0.58 -5.04 119.66 118.82 2ny4 s GLN 3207Ca -0.07 1.31 -0.17 0.00 -2.00 0.00 0.00 55.36 54.43 2ny4 s GLN 3207Cb 0.01 -3.45 -0.06 0.00 0.80 0.00 0.00 33.01 30.31 2ny4 s GLN 3207CO 0.10 0.01 0.52 0.95 -0.50 0.00 0.00 175.29 176.37 2ny4 s THR 3208N 0.85 4.83 -0.16 -0.34 -4.23 -1.26 -4.70 115.64 110.63 2ny4 s THR 3208Ca 0.48 1.05 0.01 0.00 -1.18 0.00 0.00 61.69 62.05 2ny4 s THR 3208Cb -0.21 -3.82 0.02 0.00 1.34 0.00 0.00 72.50 69.83 2ny4 s THR 3208CO 0.26 0.51 -0.16 -0.31 -0.54 0.00 0.00 174.62 174.38 2ny4 s TYR 3209N -1.16 2.38 -0.12 3.99 2.02 -1.26 -4.98 117.35 118.22 2ny4 s TYR 3209Ca 0.29 -1.36 0.02 0.00 -0.37 0.00 0.00 57.07 55.65 2ny4 s TYR 3209Cb -0.18 -1.71 0.01 0.00 -0.40 0.00 0.00 41.96 39.69 2ny4 s TYR 3209CO 0.18 -0.71 -0.18 0.42 -1.57 0.00 0.00 175.55 173.68 2ny4 s ILE 3210N 1.40 1.73 -0.14 2.71 1.09 -1.26 -0.19 121.20 126.53 2ny4 s ILE 3210Ca 0.05 -0.78 -0.18 0.00 -1.10 0.00 0.00 60.65 58.63 2ny4 s ILE 3210Cb -0.13 -1.55 -0.04 0.00 -1.06 0.00 0.00 42.46 39.68 2ny4 s ILE 3210CO -0.11 0.49 0.50 0.00 -0.10 0.00 0.00 174.94 175.71 2ny4 s ASN 3212N 0.76 6.03 -0.14 0.00 -0.87 0.55 -1.32 114.94 119.94 2ny4 s ASN 3212Ca 0.26 0.08 0.02 0.00 -1.57 0.00 0.00 52.86 51.66 2ny4 s ASN 3212Cb -0.15 -2.09 0.01 0.00 -0.02 0.00 0.00 41.25 39.00 2ny4 s ASN 3212CO 0.10 0.06 -0.21 -0.69 -2.57 0.00 0.00 177.10 173.79 2ny4 s VAL 3213N 1.09 2.15 -0.15 1.60 1.01 0.99 -1.26 120.40 125.83 2ny4 s VAL 3213Ca 0.07 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.12 2ny4 s VAL 3213Cb -0.14 -1.86 0.01 0.00 0.00 0.00 0.00 36.38 34.40 2ny4 s VAL 3213CO 0.05 0.55 -0.21 0.21 0.00 0.00 0.00 175.10 175.69 2ny4 s ASN 3214N 0.74 3.15 -0.43 3.32 2.47 0.23 -0.58 114.94 123.85 2ny4 s ASN 3214Ca -0.09 -0.60 0.04 0.00 0.42 0.00 0.00 52.86 52.63 2ny4 s ASN 3214Cb -0.16 -1.46 0.12 0.00 -1.45 0.00 0.00 41.25 38.30 2ny4 s ASN 3214CO -0.00 0.07 0.17 -2.28 -3.72 0.00 0.00 177.10 171.33 2ny4 s HIS 3215N 0.87 3.25 0.20 0.43 5.65 0.46 -1.01 115.29 125.14 2ny4 s HIS 3215Ca -0.05 -2.98 -0.11 0.00 0.25 0.00 0.00 55.06 52.17 2ny4 s HIS 3215Cb -0.15 -2.73 0.17 0.00 -1.18 0.00 0.00 32.58 28.68 2ny4 s HIS 3215CO -0.03 -0.84 1.83 -0.22 -0.65 0.00 0.00 174.74 174.84 2ny4 h LYS 3216N 7.04 0.74 -0.91 2.88 3.64 -1.79 -0.75 116.57 127.42 2ny4 h LYS 3216Ca -0.06 -0.04 0.17 0.00 -1.27 0.00 0.00 60.65 59.44 2ny4 h LYS 3216Cb 0.95 -0.17 -0.07 0.00 -0.41 0.00 0.00 32.23 32.53 2ny4 h LYS 3216CO 0.59 0.49 0.59 -1.35 -2.27 0.00 0.00 179.45 177.50 2ny4 h PRO 3217N 0.76 0.58 -0.21 1.90 0.11 -1.91 0.75 132.00 133.98 2ny4 h PRO 3217Ca 0.26 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.34 2ny4 h PRO 3217Cb 0.04 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.02 2ny4 h PRO 3217CO -0.11 0.38 0.00 -1.13 -0.21 0.00 0.00 178.00 176.93 2ny4 n SER 3218N -4.57 3.11 -3.70 -2.05 3.41 -1.14 -4.96 113.62 103.72 2ny4 n SER 3218Ca 0.19 -1.94 -0.26 0.00 -0.26 0.00 0.00 58.87 56.60 2ny4 n SER 3218Cb 0.56 -0.13 0.06 0.00 -0.26 0.00 0.00 64.21 64.45 2ny4 n SER 3218CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2ny4 n ASN 3219N 1.31 -5.50 -4.59 4.04 5.15 0.26 -4.88 115.26 111.05 2ny4 n ASN 3219Ca 0.16 -0.63 -0.33 0.00 -0.60 0.00 0.00 54.58 53.17 2ny4 n ASN 3219Cb 0.56 -4.62 -0.11 0.00 -0.53 0.00 0.00 39.78 35.08 2ny4 n ASN 3219CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 2ny4 s THR 3220N -3.33 3.70 -0.06 -0.44 -1.32 -0.37 -5.01 115.64 108.82 2ny4 s THR 3220Ca 0.57 -0.54 -0.02 0.00 -1.21 0.00 0.00 61.69 60.49 2ny4 s THR 3220Cb -0.26 -2.53 0.04 0.00 -1.51 0.00 0.00 72.50 68.23 2ny4 s THR 3220CO 0.77 0.55 0.11 -0.75 -2.21 0.00 0.00 174.62 173.09 2ny4 s LYS 3221N -0.94 0.00 -0.04 7.08 2.36 -1.26 -0.40 119.74 126.55 2ny4 s LYS 3221Ca 0.13 0.40 0.05 0.00 -2.55 0.00 0.00 55.97 54.01 2ny4 s LYS 3221Cb -0.11 -0.31 -0.01 0.00 -1.05 0.00 0.00 37.83 36.36 2ny4 s LYS 3221CO 0.03 -0.25 -0.19 0.08 1.55 0.00 0.00 175.35 176.57 2ny4 s VAL 3222N 1.76 1.55 -0.15 4.02 1.01 0.25 -4.98 120.40 123.86 2ny4 s VAL 3222Ca -0.02 -0.80 -0.00 0.00 0.00 0.00 0.00 61.98 61.16 2ny4 s VAL 3222Cb -0.12 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 2ny4 s VAL 3222CO -0.05 0.44 -0.13 -1.81 0.00 0.00 0.00 175.10 173.55 2ny4 s ASP 3223N -0.15 3.88 -0.20 3.32 -0.00 -1.26 -0.00 116.67 122.26 2ny4 s ASP 3223Ca -0.00 -0.40 0.00 0.00 -0.00 0.00 0.00 52.55 52.16 2ny4 s ASP 3223Cb -0.11 -1.60 0.05 0.00 -0.00 0.00 0.00 42.92 41.26 2ny4 s ASP 3223CO 0.01 0.11 -0.06 -0.75 -0.00 0.00 0.00 175.17 174.48 2ny4 s LYS 3224N 0.65 1.65 0.07 8.23 2.47 -0.44 -4.97 119.74 127.40 2ny4 s LYS 3224Ca -0.07 -0.79 -0.31 0.00 -1.56 0.00 0.00 55.97 53.24 2ny4 s LYS 3224Cb -0.16 -2.36 -0.07 0.00 -1.46 0.00 0.00 37.83 33.79 2ny4 s LYS 3224CO 0.02 -0.50 1.35 0.21 0.16 0.00 0.00 175.35 176.59 2ny4 s LYS 3225N 1.48 4.34 -0.33 4.03 2.20 -1.26 -1.61 119.74 128.58 2ny4 s LYS 3225Ca -0.02 1.97 -0.04 0.00 -0.36 0.00 0.00 55.97 57.51 2ny4 s LYS 3225Cb -0.17 -3.37 0.05 0.00 -1.51 0.00 0.00 37.83 32.83 2ny4 s LYS 3225CO -0.07 -0.43 0.08 0.08 -0.36 0.00 0.00 175.35 174.64 2ny4 s VAL 3226N 1.47 3.46 0.18 4.02 1.01 0.73 -4.91 120.40 126.37 2ny4 s VAL 3226Ca 0.63 -1.31 0.08 0.00 0.00 0.00 0.00 61.98 61.38 2ny4 s VAL 3226Cb -0.33 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 2ny4 s VAL 3226CO 0.29 -0.21 -0.04 -1.61 0.00 0.00 0.00 175.10 173.53 2ny4 s GLU 3227N 1.33 2.25 -0.13 2.72 2.02 -1.26 -4.35 118.70 121.27 2ny4 s GLU 3227Ca -0.02 -1.20 -0.29 0.00 0.02 0.00 0.00 54.97 53.48 2ny4 s GLU 3227Cb -0.20 -2.26 -0.06 0.00 0.10 0.00 0.00 34.13 31.71 2ny4 s GLU 3227CO 0.01 0.44 1.97 -2.14 0.02 0.00 0.00 175.26 175.56 2ny4 s PRO 3228N -2.94 3.66 0.00 0.39 0.02 -1.26 -4.46 135.00 130.40 2ny4 s PRO 3228Ca 0.27 2.14 0.00 0.00 0.02 0.00 0.00 61.00 63.43 2ny4 s PRO 3228Cb -0.09 -4.21 0.00 0.00 0.02 0.00 0.00 34.50 30.22 2ny4 s PRO 3228CO 0.17 -1.49 0.00 1.17 -0.33 0.00 0.00 177.00 176.52