# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 E C C 139.02 2.88 17.33 20.94 110.61 -140.25 -87.31 115.64 99.96 0.04 0.00 99.90 0.07 0.01 0.00 0.00 0.00 0.02 0.00 1 F C C 94.77 12.29 11.59 24.11 117.27 -140.38 -98.36 130.90 99.14 0.84 0.02 98.67 0.53 0.13 0.01 0.01 0.00 0.46 0.19 2 P C C 55.45 10.03 14.47 25.73 114.76 -111.60 -68.83 148.49 96.73 3.08 0.19 89.85 4.96 1.71 0.03 0.16 0.00 3.07 0.23 3 S C E 63.52 8.81 17.75 27.20 119.00 -149.76 -104.79 137.64 53.40 46.16 0.44 40.69 10.94 1.74 0.08 0.41 0.00 44.96 1.18 4 A E E 20.38 17.84 15.94 33.54 133.98 -161.50 -140.66 151.93 19.46 80.34 0.20 16.92 2.00 0.30 0.05 0.12 0.00 80.10 0.51 5 T E E 58.07 10.59 23.03 33.80 127.96 -158.68 -128.01 140.29 7.67 92.25 0.08 7.01 0.55 0.08 0.03 0.03 0.00 91.94 0.36 6 A E E 12.81 22.23 16.70 38.44 129.45 -169.12 -128.15 144.32 5.38 94.56 0.06 4.83 0.46 0.07 0.02 0.02 0.00 94.47 0.13 7 K E E 91.19 9.46 24.72 34.72 128.83 -169.18 -132.17 139.13 4.29 95.65 0.06 3.92 0.28 0.05 0.02 0.02 0.00 95.49 0.21 8 A E E 15.28 21.65 15.31 36.39 124.57 -162.24 -115.34 138.66 9.60 90.19 0.21 9.21 0.45 0.11 0.07 0.09 0.00 89.79 0.28 9 R E E 114.23 6.91 22.48 29.92 126.39 -163.83 -118.87 149.12 22.23 77.49 0.28 9.81 11.16 1.69 0.03 0.23 0.00 76.86 0.21 10 Y E E 133.73 6.93 22.40 29.71 95.02 8.43 63.06 42.67 19.77 79.98 0.25 13.15 5.90 1.18 0.04 0.21 0.00 79.20 0.34 11 V E E 15.17 22.75 13.58 36.08 115.15 167.64 -94.21 126.14 21.10 78.70 0.20 19.90 1.28 0.18 0.08 0.10 0.00 77.06 1.40 12 R C C 138.99 4.96 24.73 30.15 108.24 -149.82 -93.22 105.37 59.47 40.40 0.13 44.44 13.99 0.52 0.04 0.09 0.00 39.94 0.97 13 V C C 16.68 21.18 13.30 34.22 133.70 146.58 -133.77 153.83 87.88 11.93 0.18 70.38 18.00 0.34 0.10 0.09 0.00 9.48 1.60 14 S C C 48.93 4.65 22.82 27.19 119.62 -107.34 -74.58 158.00 98.75 1.05 0.20 98.33 0.69 0.08 0.14 0.02 0.00 0.55 0.21 15 A H H 47.05 14.55 14.49 29.00 91.61 -111.78 -58.60 -38.17 3.00 0.01 97.00 0.56 0.43 1.74 96.75 0.50 0.00 0.00 0.00 16 T H H 88.25 2.22 22.11 23.45 91.73 53.68 -63.77 -40.01 1.82 0.00 98.18 0.26 0.17 1.19 97.88 0.49 0.00 0.00 0.00 17 K H H 71.06 10.85 20.42 31.48 92.05 48.44 -66.68 -38.74 0.99 0.01 99.01 0.23 0.09 0.55 98.61 0.51 0.00 0.00 0.00 18 A H H 2.28 25.77 15.07 41.33 90.89 53.01 -62.52 -42.80 0.37 0.00 99.63 0.08 0.03 0.17 99.64 0.09 0.00 0.00 0.00 19 R H H 104.49 10.42 22.86 33.10 91.14 52.05 -62.65 -40.77 0.19 0.00 99.81 0.03 0.01 0.09 99.84 0.03 0.00 0.00 0.00 20 R H H 114.03 4.64 25.68 30.38 91.62 50.67 -64.03 -41.75 0.18 0.00 99.82 0.02 0.01 0.11 99.84 0.03 0.00 0.00 0.00 21 V H H 4.55 23.96 20.67 44.50 91.80 49.00 -64.13 -43.82 0.17 0.00 99.83 0.01 0.01 0.11 99.82 0.04 0.00 0.00 0.00 22 I H H 8.13 24.44 19.85 43.91 91.36 50.49 -62.87 -41.62 0.20 0.00 99.80 0.01 0.01 0.15 99.71 0.12 0.00 0.00 0.00 23 D H H 87.64 4.62 25.33 30.47 91.20 52.69 -64.39 -35.74 1.28 0.00 98.72 0.03 0.03 1.25 98.04 0.64 0.00 0.00 0.00 24 L H H 55.61 11.50 22.45 34.16 91.77 53.44 -69.34 -28.05 5.45 0.00 94.55 0.05 0.10 5.94 93.01 0.90 0.00 0.00 0.00 25 V H H 2.50 26.07 14.95 42.01 95.64 48.66 -89.87 -14.51 29.66 0.06 70.28 1.10 1.57 26.77 69.00 1.46 0.03 0.02 0.06 26 R C T 106.32 13.02 17.24 30.67 112.67 114.65 -62.38 132.44 97.72 0.09 2.19 0.35 0.68 96.98 1.76 0.14 0.00 0.02 0.08 27 G C T 54.83 2.48 21.07 23.88 94.31 17.46 84.32 -3.00 99.63 0.01 0.36 0.16 0.90 98.60 0.29 0.03 0.00 0.00 0.00 28 K C S 61.38 13.41 15.28 29.32 123.83 123.86 -85.60 153.90 99.69 0.29 0.02 46.59 53.05 0.14 0.00 0.01 0.00 0.10 0.11 29 S E B 41.80 6.11 23.87 30.45 119.16 -107.74 -72.09 155.94 11.41 88.57 0.02 8.95 0.12 0.00 0.02 0.00 0.00 3.53 87.37 30 V H H 10.07 24.11 14.24 38.69 91.04 -111.14 -57.84 -39.42 0.46 0.00 99.54 0.05 0.03 0.31 99.35 0.26 0.00 0.00 0.00 31 E H H 109.81 5.69 22.79 29.29 91.34 53.51 -63.03 -41.04 0.14 0.00 99.86 0.01 0.01 0.10 99.66 0.22 0.00 0.00 0.00 32 E H H 96.01 4.11 24.83 28.68 91.74 47.82 -65.79 -40.20 0.07 0.00 99.93 0.00 0.00 0.04 99.72 0.23 0.00 0.00 0.00 33 A H H 2.83 23.56 16.89 40.90 91.41 51.16 -63.78 -43.05 0.11 0.00 99.89 0.01 0.00 0.06 99.78 0.14 0.00 0.00 0.00 34 L H H 24.55 18.39 20.17 38.12 91.18 50.92 -62.85 -41.92 0.29 0.00 99.71 0.02 0.01 0.22 99.44 0.32 0.00 0.00 0.00 35 D H H 81.97 2.69 25.60 27.21 91.52 51.23 -63.88 -41.17 1.16 0.00 98.84 0.03 0.03 1.12 97.30 1.52 0.00 0.00 0.00 36 I H H 36.42 12.87 20.77 34.21 91.73 49.99 -64.77 -41.63 1.49 0.00 98.51 0.05 0.04 1.30 93.05 5.56 0.00 0.00 0.00 37 L H H 4.33 25.55 14.53 40.35 91.32 52.64 -66.07 -35.46 3.53 0.01 96.46 0.20 0.15 2.96 81.89 14.78 0.00 0.00 0.00 38 R H H 131.32 8.27 19.78 28.93 90.97 61.91 -65.89 -25.60 32.36 0.03 67.61 0.54 0.71 32.42 54.05 12.23 0.01 0.01 0.03 39 W C T 169.52 3.20 20.42 23.64 94.68 51.00 -90.98 -5.38 54.66 0.06 45.29 1.15 2.37 51.49 36.61 8.29 0.01 0.02 0.06 40 A C S 17.74 19.65 8.90 27.67 116.68 106.54 -77.26 140.06 99.53 0.20 0.27 29.52 69.50 0.54 0.19 0.05 0.00 0.04 0.16 41 P C C 103.01 2.89 19.01 22.19 96.35 -124.13 -71.27 12.90 98.47 0.60 0.94 67.79 26.77 3.82 0.34 0.53 0.00 0.20 0.53 42 Q C S 78.50 10.63 14.36 25.71 123.63 92.97 -100.87 152.17 83.58 2.58 13.84 36.54 39.88 7.59 6.82 5.68 0.01 0.72 2.75 43 A H G 67.27 5.92 20.50 27.10 94.61 -117.03 -63.74 -31.93 40.38 0.53 59.09 6.50 8.26 25.21 11.57 47.85 0.02 0.26 0.33 44 A H G 19.15 18.45 17.60 35.58 93.13 58.46 -72.26 -19.06 37.28 0.62 62.10 8.99 5.45 21.98 15.02 47.89 0.01 0.33 0.33 45 S H H 8.98 22.09 16.77 38.56 92.97 71.02 -72.78 -20.84 23.87 0.41 75.72 13.02 3.35 7.19 41.50 34.57 0.00 0.19 0.18 46 E H H 98.48 7.20 25.03 33.10 92.26 71.30 -62.13 -41.63 2.35 0.00 97.65 0.71 0.31 0.96 97.40 0.62 0.00 0.00 0.00 47 P H H 34.52 12.26 24.66 37.21 91.75 50.34 -64.94 -40.27 0.97 0.00 99.03 0.26 0.07 0.48 98.78 0.41 0.00 0.00 0.00 48 V H H 1.52 27.21 21.53 48.92 91.70 49.79 -64.53 -42.82 0.14 0.00 99.86 0.02 0.01 0.07 99.78 0.12 0.00 0.00 0.00 49 A H H 18.17 18.65 23.62 41.32 91.30 51.63 -62.51 -42.09 0.05 0.00 99.95 0.01 0.00 0.02 99.95 0.02 0.00 0.00 0.00 50 K H H 113.59 3.79 28.38 32.74 91.43 50.45 -64.43 -40.88 0.06 0.00 99.94 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 51 V H H 12.39 19.43 23.97 42.95 91.35 49.46 -64.19 -43.60 0.05 0.00 99.95 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 52 I H H 1.86 27.46 22.42 50.09 91.51 48.74 -64.04 -43.12 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 53 A H H 43.32 10.41 26.88 37.58 91.53 50.68 -63.49 -42.14 0.12 0.00 99.88 0.01 0.00 0.08 99.90 0.01 0.00 0.00 0.00 54 S H H 46.80 5.77 28.17 34.87 91.63 49.53 -64.51 -42.06 0.32 0.00 99.68 0.03 0.01 0.22 99.72 0.03 0.00 0.00 0.00 55 A H H 4.10 22.56 21.95 44.36 91.45 49.66 -64.12 -42.73 0.42 0.00 99.58 0.05 0.02 0.27 99.61 0.05 0.00 0.00 0.00 56 A H H 13.98 19.43 22.44 41.18 91.35 51.11 -62.51 -42.53 0.50 0.00 99.50 0.06 0.03 0.30 99.52 0.08 0.00 0.00 0.00 57 A H H 52.55 3.46 26.42 29.44 91.28 50.30 -63.21 -42.23 1.13 0.00 98.86 0.12 0.08 0.80 98.81 0.19 0.00 0.00 0.00 58 N H H 54.01 7.91 23.13 31.71 92.03 48.78 -65.63 -40.28 2.64 0.01 97.35 0.25 0.21 1.98 97.16 0.39 0.01 0.00 0.00 59 A H H 5.40 21.33 13.77 35.51 91.98 51.88 -64.36 -41.90 5.22 0.05 94.72 0.86 0.67 3.65 93.80 0.93 0.04 0.02 0.03 60 Q H H 97.20 7.56 17.57 25.92 92.72 49.33 -65.58 -40.53 11.33 0.15 88.52 1.59 1.55 8.43 87.03 1.14 0.11 0.06 0.09 61 N H H 125.30 1.02 17.97 17.41 96.33 41.88 -75.91 -36.05 27.90 0.20 71.90 2.15 3.74 22.46 69.85 1.45 0.15 0.07 0.14 62 N C T 101.64 4.15 15.24 20.38 101.85 30.03 -92.72 -27.64 68.47 0.19 31.35 2.36 8.27 55.77 31.47 1.87 0.04 0.06 0.18 63 E C T 90.09 9.00 13.26 23.17 101.27 22.31 -106.71 -0.50 74.64 0.33 25.03 5.92 18.67 48.85 24.08 2.03 0.03 0.10 0.32 64 G C C 58.54 1.54 19.45 20.11 95.24 -113.87 75.76 18.50 99.60 0.15 0.24 66.54 20.27 12.76 0.05 0.20 0.00 0.07 0.10 65 L C C 25.95 19.89 9.20 28.22 118.90 152.62 -86.56 142.64 99.35 0.61 0.04 90.87 8.18 0.18 0.01 0.02 0.00 0.15 0.59 66 D C C 81.32 3.67 23.91 27.01 108.04 -124.07 -84.23 117.98 99.84 0.14 0.02 99.21 0.63 0.05 0.00 0.00 0.00 0.05 0.05 67 P H G 40.18 20.07 12.43 31.93 91.95 -148.36 -61.99 -26.62 12.72 0.15 87.13 0.85 0.98 8.70 0.35 89.00 0.00 0.11 0.01 68 S H G 77.53 4.18 21.15 26.30 90.46 64.78 -71.23 -15.01 12.81 0.26 86.93 0.41 0.87 9.75 0.28 88.47 0.00 0.22 0.01 69 T H G 50.06 10.31 20.20 31.60 96.07 55.42 -95.69 -1.24 12.14 0.65 87.21 1.33 1.51 7.25 0.34 88.98 0.00 0.57 0.02 70 L E E 5.11 25.99 14.12 40.66 118.46 93.56 -93.25 134.24 25.83 74.11 0.06 22.02 3.63 0.12 0.01 0.05 0.00 73.74 0.43 71 V E E 40.86 10.70 27.41 38.78 123.75 -167.66 -121.12 135.19 1.12 98.88 0.00 0.98 0.05 0.00 0.00 0.00 0.00 98.90 0.06 72 V E E 14.12 23.63 17.42 41.26 109.84 -128.33 -82.75 120.69 0.24 99.76 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.76 0.01 73 A E E 42.54 8.87 22.89 32.61 100.46 175.90 -93.23 -34.73 1.30 98.70 0.00 0.79 0.29 0.01 0.00 0.00 0.00 98.90 0.01 74 T E E 52.21 7.44 25.35 33.84 138.08 1.50 -152.11 147.04 0.55 99.45 0.00 0.37 0.05 0.00 0.00 0.00 0.00 99.57 0.00 75 V E E 16.22 24.50 15.19 39.40 126.27 -169.20 -130.92 132.14 0.34 99.66 0.00 0.28 0.01 0.00 0.00 0.00 0.00 99.70 0.00 76 Y E E 84.04 7.92 26.70 35.33 129.28 -174.06 -131.20 142.70 0.31 99.69 0.00 0.27 0.00 0.00 0.00 0.00 0.00 99.72 0.00 77 A E E 20.23 22.36 14.95 36.54 125.72 -165.61 -122.84 137.29 2.57 97.42 0.00 2.27 0.13 0.01 0.00 0.00 0.00 97.55 0.05 78 D E E 60.47 8.17 22.16 30.68 126.52 -168.57 -122.52 145.20 15.29 84.69 0.02 12.68 1.99 0.11 0.00 0.02 0.00 84.81 0.40 79 E E E 107.94 9.77 17.57 27.86 114.24 -117.97 -84.55 134.42 37.41 62.52 0.07 32.37 4.06 0.27 0.01 0.06 0.00 61.57 1.66 80 G C C 19.23 13.80 12.17 26.34 127.22 -136.48 -87.42 173.88 66.23 33.67 0.10 54.21 10.33 0.59 0.02 0.11 0.00 33.80 0.94 81 P C C 89.65 3.62 17.73 21.80 112.75 -76.98 -68.99 150.25 66.81 32.94 0.26 39.46 24.41 2.39 0.03 0.27 0.00 32.73 0.71 82 T E E 78.46 8.81 12.06 21.97 120.55 -122.04 -101.37 140.13 33.20 66.26 0.54 25.89 6.96 1.26 0.14 0.42 0.00 63.69 1.64 83 A E E 54.76 7.56 11.70 21.01 120.70 -149.63 -108.30 141.61 21.67 78.01 0.32 18.87 2.44 0.43 0.10 0.19 0.00 76.84 1.14 84 K E E 132.35 4.48 12.51 19.09 118.03 -137.98 -101.16 133.38 15.33 84.55 0.13 13.87 1.04 0.17 0.04 0.07 0.00 84.23 0.59 85 R E E 126.70 5.58 11.65 19.15 124.39 -168.36 -117.42 142.65 14.29 85.63 0.08 13.20 0.77 0.10 0.02 0.04 0.00 85.30 0.57 86 I E E 101.02 5.63 9.72 17.41 117.66 -135.68 -100.56 132.31 16.63 83.28 0.09 15.74 0.71 0.10 0.03 0.05 0.00 81.65 1.72 87 R E E 140.95 3.27 11.32 16.48 121.00 -165.42 -114.33 136.73 28.68 71.20 0.12 26.49 1.38 0.16 0.03 0.07 0.00 71.13 0.73 88 P E E 95.91 3.31 8.91 14.23 113.68 -112.40 -71.16 140.92 35.92 61.75 2.33 31.20 3.31 1.50 0.74 1.51 0.00 59.71 2.03 89 R C C 141.21 3.43 7.66 13.02 118.32 -156.21 -100.55 154.98 66.78 19.45 13.77 51.41 8.84 6.57 2.58 11.28 0.00 17.61 1.71 90 A C G 95.51 0.91 7.61 9.21 110.49 -85.07 -73.48 138.07 50.32 14.83 34.84 11.14 14.52 26.96 2.14 31.51 0.07 11.34 2.31 91 Q C T 161.61 0.44 8.75 8.53 99.74 7.32 5.43 29.74 66.25 1.28 32.47 5.32 12.24 46.17 1.42 33.53 0.00 0.77 0.54 92 G C T 63.43 0.87 8.77 10.09 98.73 -67.99 83.31 2.66 81.50 1.59 16.91 9.78 31.03 40.28 1.02 16.36 0.00 0.90 0.63 93 R C C 147.02 2.11 8.45 12.38 120.49 114.31 -101.82 145.87 69.05 28.55 2.40 45.88 16.04 7.85 0.50 2.07 0.00 24.62 3.03 94 A E E 70.40 4.77 8.31 15.13 118.29 -135.04 -98.36 141.40 43.30 55.90 0.80 34.92 7.19 1.81 0.20 0.63 0.00 53.31 1.94 95 F E E 113.73 4.85 10.97 17.85 124.13 -168.07 -120.01 143.36 25.65 74.11 0.24 21.20 3.56 0.64 0.06 0.16 0.00 73.85 0.54 96 R E E 143.10 4.85 11.70 18.61 115.76 -125.55 -88.01 133.00 14.83 85.09 0.08 13.40 0.87 0.12 0.02 0.04 0.00 85.26 0.29 97 I E E 75.51 8.54 11.57 21.76 121.63 -166.80 -114.01 138.16 8.82 91.14 0.04 8.42 0.32 0.04 0.01 0.01 0.00 90.86 0.34 98 R E E 129.54 6.45 13.59 21.78 119.09 -149.15 -107.90 130.94 9.89 90.08 0.04 9.04 0.52 0.06 0.01 0.02 0.00 89.88 0.48 99 K E E 99.40 8.77 14.83 24.86 123.83 -169.98 -119.10 138.67 23.83 76.12 0.05 21.41 1.55 0.11 0.01 0.03 0.00 76.30 0.60 100 R E E 104.95 10.51 16.11 27.32 119.63 -143.93 -103.13 135.72 34.57 65.38 0.04 32.43 1.40 0.12 0.01 0.03 0.00 65.20 0.81 101 T E E 45.18 12.04 18.42 31.02 125.96 -165.13 -117.17 147.95 36.55 63.40 0.05 34.50 1.50 0.12 0.01 0.04 0.00 62.77 1.06 102 S E E 15.03 18.66 16.57 35.28 127.06 -152.96 -121.52 146.26 23.33 76.64 0.03 20.97 1.69 0.11 0.01 0.02 0.00 76.48 0.71 103 H E E 65.43 10.61 23.34 34.39 121.37 -151.71 -115.65 133.20 10.70 89.29 0.01 9.31 0.92 0.04 0.00 0.01 0.00 89.53 0.20 104 I E E 10.84 23.24 17.55 40.91 121.94 -162.59 -114.46 132.00 2.63 97.36 0.00 2.53 0.07 0.00 0.00 0.00 0.00 97.36 0.04 105 T E E 32.25 10.59 25.72 37.20 121.42 -164.30 -114.89 132.01 0.59 99.41 0.00 0.54 0.02 0.00 0.00 0.00 0.00 99.43 0.01 106 V E E 6.40 24.16 18.47 43.04 119.89 -161.62 -113.41 128.33 0.23 99.77 0.00 0.21 0.00 0.00 0.00 0.00 0.00 99.78 0.00 107 I E E 38.78 9.81 26.32 37.30 118.67 -164.02 -112.44 127.53 0.18 99.82 0.00 0.17 0.00 0.00 0.00 0.00 0.00 99.82 0.00 108 V E E 9.44 23.54 16.71 40.61 120.53 -163.49 -111.09 130.71 0.60 99.40 0.00 0.57 0.01 0.00 0.00 0.00 0.00 99.41 0.01 109 E E E 74.54 7.78 23.55 31.75 128.14 -174.94 -123.59 145.87 3.21 96.78 0.00 2.92 0.15 0.01 0.00 0.00 0.00 96.82 0.10 110 S E E 44.11 14.20 14.49 28.78 115.32 -115.52 -79.22 139.72 21.73 78.25 0.03 18.64 2.35 0.14 0.00 0.02 0.00 77.96 0.88 111 R C C 117.65 7.67 13.92 23.02 120.12 -143.68 -106.91 138.99 81.52 18.46 0.01 73.76 7.10 0.08 0.00 0.01 0.00 18.14 0.90 112 P C C 96.35 3.30 13.34 18.18 114.38 -99.31 -67.05 147.01 99.59 0.41 0.00 99.48 0.22 0.02 0.00 0.00 0.00 0.26 0.03 113 P C C 97.45 4.48 12.65 18.91 111.61 -94.61 -65.89 146.42 99.97 0.02 0.00 99.87 0.09 0.03 0.00 0.00 0.00 0.01 0.00