# 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 Q C C 115.71 5.63 16.23 23.22 109.40 -155.49 -88.89 111.83 99.76 0.23 0.01 99.75 0.06 0.03 0.00 0.00 0.00 0.14 0.01 1 S C C 62.94 8.78 14.04 23.70 118.29 -143.93 -96.71 140.13 84.44 14.00 1.55 80.57 1.14 2.46 0.42 0.77 0.00 12.89 1.76 2 A C C 50.13 11.45 15.25 27.04 116.13 -153.37 -102.65 136.83 67.04 31.10 1.87 48.22 14.61 3.98 0.43 1.52 0.00 29.21 2.03 3 L E E 48.02 16.67 14.62 30.92 119.12 -145.80 -101.86 133.90 44.42 54.10 1.48 35.79 6.44 1.76 0.56 1.09 0.00 47.91 6.45 4 T E E 65.69 10.08 19.84 30.34 123.07 -163.80 -115.35 135.65 47.16 52.23 0.61 39.08 5.66 0.91 0.25 0.46 0.00 45.19 8.44 5 Q C C 72.77 14.71 15.70 30.17 124.55 -156.39 -111.37 140.05 76.48 23.41 0.10 63.03 12.36 0.44 0.02 0.09 0.00 22.87 1.19 6 P C C 53.60 10.79 16.96 28.57 115.72 -100.62 -67.08 152.42 83.66 15.99 0.35 73.61 7.70 1.16 0.05 0.33 0.00 16.38 0.78 7 A C S 65.47 8.63 16.70 26.14 95.41 -132.06 -72.38 -28.40 85.41 14.45 0.14 27.19 55.64 1.58 0.01 0.14 0.00 15.02 0.41 8 S E E 59.20 6.54 20.39 27.93 134.06 13.89 -142.54 148.32 24.86 74.98 0.17 18.65 5.66 0.71 0.02 0.17 0.00 74.39 0.42 9 V E E 31.39 20.09 14.18 33.55 131.22 -173.60 -135.58 144.08 3.47 96.52 0.01 3.23 0.21 0.01 0.00 0.01 0.00 96.26 0.27 10 S E E 62.70 6.55 23.26 31.08 128.97 -168.15 -126.46 146.76 2.33 97.66 0.00 2.16 0.14 0.01 0.00 0.00 0.00 97.48 0.20 11 G E E 13.54 15.48 16.65 32.60 142.84 147.95 -166.56 173.71 18.48 81.51 0.01 15.68 2.13 0.08 0.00 0.01 0.00 81.37 0.73 12 S C C 55.42 5.09 23.33 28.49 126.78 -91.98 -110.99 155.13 91.50 8.47 0.03 88.22 3.49 0.13 0.01 0.02 0.00 7.35 0.78 13 P C T 63.98 13.38 14.25 27.79 109.98 -83.19 -59.86 136.70 98.98 0.67 0.35 0.56 4.16 94.47 0.02 0.26 0.00 0.41 0.11 14 G C T 49.88 3.47 19.35 23.55 95.30 22.06 87.40 -5.95 99.38 0.39 0.23 0.73 4.53 94.22 0.01 0.20 0.00 0.28 0.04 15 Q C C 79.28 8.02 17.23 26.46 124.65 117.24 -92.18 154.14 91.24 8.60 0.16 65.79 25.31 0.60 0.03 0.17 0.00 7.12 0.99 16 S C C 63.53 8.19 18.78 28.18 124.64 -131.15 -105.68 144.80 67.77 32.21 0.02 66.50 0.93 0.06 0.00 0.01 0.00 31.98 0.52 17 I E E 16.29 22.05 14.42 36.52 126.88 -165.49 -127.65 139.48 2.28 97.72 0.00 2.26 0.05 0.00 0.00 0.00 0.00 97.59 0.10 18 T E E 69.96 6.86 24.91 32.39 118.24 -149.50 -106.59 129.82 0.44 99.56 0.00 0.44 0.01 0.00 0.00 0.00 0.00 99.54 0.01 19 I E E 6.98 25.43 15.49 41.63 119.87 -166.64 -114.03 128.09 2.07 97.93 0.00 1.92 0.07 0.00 0.00 0.00 0.00 97.96 0.05 20 S E E 47.74 7.62 26.67 34.83 122.27 -164.25 -111.57 138.45 15.16 84.83 0.02 13.75 0.61 0.04 0.00 0.01 0.00 85.44 0.15 21 C E E 8.54 25.09 14.92 40.03 126.71 -167.75 -127.32 137.84 25.95 74.00 0.05 23.72 1.21 0.12 0.01 0.03 0.00 74.43 0.48 22 T E E 63.90 7.11 25.36 32.89 124.98 -169.43 -120.29 141.93 19.82 80.06 0.12 16.75 2.71 0.36 0.05 0.09 0.00 77.31 2.73 23 G E E 20.40 15.63 17.82 32.94 138.92 106.01 -134.97 -174.04 31.62 68.14 0.24 22.87 9.26 1.08 0.07 0.21 0.00 64.26 2.25 24 T C E 72.98 6.98 21.83 29.61 123.15 -88.47 -110.73 148.21 52.21 47.38 0.41 42.17 8.47 1.26 0.09 0.38 0.00 45.38 2.24 25 S C C 46.93 15.48 15.49 30.32 120.60 -142.40 -105.58 138.01 69.39 28.99 1.62 49.22 15.95 4.41 0.34 1.45 0.00 26.27 2.35 26 Y C C 108.33 9.06 18.59 28.25 123.58 -171.12 -122.28 143.11 70.70 26.78 2.53 47.91 17.29 5.95 0.62 2.12 0.01 22.49 3.60 27 D C C 86.23 7.46 17.68 26.13 110.92 -125.44 -88.30 119.33 73.19 24.05 2.76 55.44 11.62 5.59 0.71 2.28 0.00 20.20 4.17 28 V C C 45.43 15.98 12.37 28.10 103.59 -172.08 -98.10 12.73 67.43 25.79 6.79 42.55 12.70 12.71 1.99 5.00 0.08 16.21 8.75 29 G C T 44.40 4.27 17.71 22.91 110.95 -110.29 72.48 -123.00 86.22 6.08 7.71 13.87 23.22 49.20 1.20 6.56 0.01 4.23 1.71 30 S C T 80.58 3.58 17.98 22.10 99.15 -8.96 -95.62 -0.96 87.13 5.11 7.75 10.83 26.62 50.03 1.00 6.61 0.00 3.86 1.05 31 Y C E 62.54 15.26 15.42 30.73 123.66 75.82 -114.65 142.28 55.55 40.05 4.40 25.86 20.38 12.05 0.96 3.41 0.08 30.71 6.55 32 N C E 48.70 14.40 20.65 35.07 105.18 -160.60 -98.79 35.93 51.92 47.18 0.90 34.99 12.51 4.73 0.16 0.78 0.00 45.61 1.21 33 L E E 26.99 16.73 23.77 40.29 130.43 87.50 -128.71 146.03 20.17 79.65 0.18 16.66 2.93 0.44 0.04 0.13 0.00 78.96 0.83 34 V E E 4.02 25.63 21.95 47.79 123.75 -165.22 -121.27 133.87 5.04 94.93 0.02 4.50 0.36 0.04 0.00 0.01 0.00 94.90 0.17 35 S E E 11.74 18.22 27.17 45.01 128.79 -169.19 -122.18 145.84 1.87 98.12 0.01 1.73 0.08 0.01 0.00 0.00 0.00 98.13 0.04 36 W E E 9.54 24.03 22.66 46.44 127.57 -160.24 -121.71 143.04 1.27 98.73 0.01 1.14 0.05 0.01 0.00 0.00 0.00 98.76 0.03 37 Y E E 25.98 17.30 23.71 40.96 131.61 -172.35 -130.59 149.67 1.14 98.86 0.01 0.98 0.06 0.01 0.00 0.00 0.00 98.89 0.06 38 Q E E 37.13 14.96 21.34 36.55 122.84 -152.23 -114.89 135.61 5.03 94.96 0.01 4.21 0.46 0.04 0.00 0.01 0.00 95.09 0.19 39 Q E E 61.73 12.81 16.63 30.04 116.52 -141.54 -98.57 128.87 35.57 64.39 0.04 31.08 3.35 0.19 0.01 0.04 0.00 64.21 1.13 40 H C C 72.65 8.85 13.71 24.18 120.20 -155.11 -100.54 144.81 95.75 4.22 0.03 92.51 3.28 0.21 0.01 0.03 0.00 3.26 0.71 41 P C T 106.06 3.21 12.02 16.95 108.95 -85.96 -58.80 134.46 99.51 0.14 0.34 0.64 4.88 94.00 0.01 0.35 0.00 0.09 0.03 42 G C T 68.63 0.34 12.76 10.75 96.20 16.40 83.44 -2.32 99.54 0.11 0.35 0.69 4.89 93.94 0.01 0.38 0.00 0.07 0.02 43 K C S 109.03 4.60 10.69 17.45 129.29 89.00 -117.34 160.00 91.26 8.32 0.42 28.52 60.79 2.18 0.08 0.34 0.00 3.18 4.90 44 A C C 71.89 2.92 16.99 20.31 116.94 -96.99 -69.93 149.79 95.95 4.02 0.02 84.71 11.28 0.17 0.00 0.03 0.00 3.42 0.39 45 P C C 42.06 18.33 11.52 29.11 115.34 -101.30 -65.62 145.00 89.68 10.30 0.02 88.04 1.67 0.09 0.00 0.02 0.00 9.89 0.29 46 K E E 94.99 7.75 21.47 30.02 124.90 -158.75 -121.58 139.55 8.43 91.54 0.03 7.37 0.83 0.06 0.01 0.02 0.00 91.26 0.46 47 L E E 59.14 16.46 17.97 33.92 110.75 -114.59 -74.83 127.59 0.79 99.20 0.00 0.75 0.02 0.00 0.00 0.00 0.00 99.20 0.02 48 M E E 28.40 17.45 21.15 38.67 101.64 175.21 -97.83 -35.08 2.29 97.70 0.00 1.54 0.61 0.01 0.00 0.00 0.00 97.82 0.01 49 I E E 18.28 19.31 21.65 40.94 136.14 5.88 -147.20 143.10 0.36 99.64 0.00 0.30 0.02 0.00 0.00 0.00 0.00 99.67 0.00 50 Y E E 46.60 18.40 20.95 38.58 126.33 -170.87 -129.29 132.91 1.77 98.22 0.01 1.52 0.08 0.01 0.00 0.00 0.00 98.33 0.06 51 E E E 53.00 12.00 22.07 34.52 113.72 -161.30 -109.11 115.35 17.23 82.31 0.46 14.15 2.28 0.68 0.13 0.29 0.00 81.94 0.52 52 V C E 38.75 16.85 15.41 31.90 103.24 -173.52 -88.79 -10.98 59.64 33.32 7.04 29.91 16.62 15.30 1.00 5.70 0.01 30.23 1.22 53 S C S 71.88 5.09 18.48 24.04 98.82 69.23 -85.78 -16.45 81.60 12.81 5.59 24.73 32.47 25.24 0.58 5.02 0.01 10.62 1.33 54 K C C 129.16 3.69 18.28 22.76 115.94 37.08 -117.48 124.13 85.76 9.26 4.98 36.52 35.32 14.40 0.63 4.65 0.00 6.23 2.24 55 R C C 100.33 14.63 12.37 26.48 117.30 -130.57 -92.09 132.85 94.98 4.81 0.21 68.79 25.83 0.81 0.06 0.17 0.00 2.86 1.49 56 P C C 47.33 12.23 12.71 25.90 114.17 -110.68 -66.29 150.52 95.28 2.33 2.39 80.49 6.08 8.22 0.33 2.53 0.00 1.56 0.78 57 S C T 89.99 2.28 15.91 19.12 110.83 -100.20 -72.11 137.40 92.45 3.19 4.35 22.28 20.90 48.92 0.47 4.39 0.00 1.86 1.18 58 G C T 53.00 3.30 16.49 20.62 101.39 25.67 85.37 -4.15 89.31 5.92 4.76 26.38 21.69 41.52 0.51 4.60 0.00 3.78 1.51 59 V C C 35.51 18.41 10.07 27.36 111.82 103.67 -95.55 113.90 84.02 10.88 5.10 66.24 11.30 5.49 1.39 4.09 0.00 6.34 5.14 60 S C C 64.52 7.03 16.44 24.44 111.68 -148.68 -83.72 138.31 78.42 8.89 12.68 40.46 15.36 23.05 2.00 10.84 0.01 5.65 2.62 61 N C T 113.37 4.67 18.52 24.01 97.49 11.90 -59.62 11.73 78.36 5.47 16.17 22.39 23.25 34.05 1.85 13.50 0.02 3.58 1.36 62 R C C 80.47 13.71 17.57 30.98 99.81 85.69 -90.90 -7.97 75.91 12.09 12.00 29.67 28.26 19.31 1.43 9.93 0.01 10.13 1.25 63 F E E 21.06 23.11 13.99 36.52 126.44 52.07 -123.62 137.73 23.19 75.32 1.49 17.74 5.29 1.70 0.62 0.91 0.00 69.65 4.09 64 S E E 53.68 6.91 23.99 31.90 133.44 146.37 -136.53 153.52 12.52 87.32 0.17 11.24 1.12 0.21 0.07 0.08 0.00 86.09 1.20 65 G E E 22.26 19.45 14.70 32.74 141.23 174.77 -152.98 166.33 16.68 83.24 0.09 14.64 1.61 0.23 0.02 0.05 0.00 83.16 0.29 66 S E E 59.28 5.12 23.29 29.57 135.46 -160.43 -143.90 154.78 11.39 88.51 0.09 9.63 1.48 0.23 0.02 0.06 0.00 88.26 0.33 67 K E E 89.46 16.84 12.65 28.60 126.79 -154.33 -128.31 138.99 13.22 86.59 0.18 10.18 2.96 0.60 0.04 0.15 0.00 85.14 0.92 68 S E E 71.34 3.20 19.14 23.00 118.00 173.16 -129.89 115.78 32.43 67.31 0.26 25.47 6.05 1.50 0.06 0.26 0.00 64.80 1.85 69 G C T 48.77 3.15 18.57 22.30 110.05 -48.01 60.84 -129.32 98.88 0.78 0.34 1.38 32.09 65.52 0.01 0.34 0.00 0.58 0.08 70 N C T 66.02 14.12 15.13 29.47 96.66 -16.85 -96.24 7.64 99.13 0.60 0.26 1.23 32.60 65.39 0.01 0.26 0.00 0.46 0.05 71 T E E 45.51 10.36 21.74 33.44 125.28 85.74 -114.09 139.13 17.91 82.06 0.03 13.71 4.17 0.26 0.01 0.03 0.00 80.24 1.58 72 A E E 3.80 24.53 16.67 41.82 127.87 -171.73 -127.21 141.85 4.95 95.04 0.00 4.64 0.16 0.01 0.00 0.00 0.00 94.96 0.24 73 S E E 30.77 10.46 27.28 38.69 126.21 -163.03 -123.21 140.46 5.15 94.84 0.00 4.38 0.30 0.01 0.00 0.00 0.00 95.26 0.04 74 L E E 3.71 26.15 18.13 45.08 123.38 -168.66 -122.02 131.88 1.11 98.89 0.00 1.03 0.02 0.00 0.00 0.00 0.00 98.94 0.01 75 T E E 48.79 9.09 27.32 37.13 119.89 -163.13 -115.28 128.33 0.25 99.75 0.00 0.27 0.00 0.00 0.00 0.00 0.00 99.71 0.02 76 I E E 6.03 25.08 16.31 42.10 117.89 -166.53 -115.62 123.28 1.71 98.29 0.00 1.79 0.02 0.00 0.00 0.00 0.00 97.81 0.38 77 S C C 52.61 6.48 23.43 30.44 129.06 -170.20 -123.56 151.02 76.59 23.31 0.09 42.21 21.34 10.66 0.01 0.12 0.00 25.23 0.43 78 G C S 45.69 3.27 23.74 27.46 93.71 19.24 71.78 23.81 98.48 1.49 0.03 6.46 78.87 12.97 0.00 0.04 0.00 1.57 0.08 79 L C C 13.49 24.57 9.78 33.71 116.10 -169.17 -74.05 140.15 98.90 1.09 0.01 98.31 0.87 0.03 0.00 0.00 0.00 0.51 0.27 80 Q C C 84.53 4.48 24.08 28.30 130.10 -167.12 -120.58 159.66 98.43 1.52 0.05 98.59 0.26 0.01 0.02 0.01 0.00 0.27 0.85 81 A H G 54.57 12.74 15.04 27.97 91.45 -102.30 -58.85 -34.63 3.13 0.02 96.85 0.21 0.21 1.94 0.46 97.16 0.00 0.01 0.00 82 E H G 131.30 2.86 21.29 24.42 90.23 61.72 -69.87 -17.23 2.65 0.03 97.31 0.13 0.17 1.76 0.37 97.55 0.00 0.03 0.00 83 D H G 18.91 19.93 15.09 35.20 93.65 65.17 -83.48 -3.04 3.80 0.04 96.16 0.62 0.41 1.58 0.53 96.83 0.00 0.03 0.00 84 E C C 75.11 13.68 20.06 33.67 113.44 115.15 -72.74 133.16 97.72 1.82 0.46 94.18 3.46 0.22 0.05 0.41 0.00 1.54 0.16 85 A E E 21.19 14.59 21.64 36.26 145.13 125.57 -163.08 171.52 18.84 81.11 0.06 17.51 1.08 0.09 0.02 0.04 0.00 78.34 2.94 86 D E E 56.27 10.69 25.28 36.29 116.61 -82.29 -94.72 133.64 3.45 96.54 0.01 3.08 0.29 0.02 0.00 0.01 0.00 96.44 0.15 87 Y E E 8.18 25.52 18.45 44.25 126.29 -168.94 -119.60 143.18 1.92 98.07 0.01 1.63 0.18 0.02 0.00 0.01 0.00 98.08 0.07 88 Y E E 38.57 16.17 28.06 44.07 127.52 -169.47 -124.61 143.74 2.47 97.50 0.03 2.06 0.23 0.04 0.00 0.02 0.00 97.51 0.13 89 C E E 2.99 25.92 23.11 48.95 125.33 -165.61 -120.16 140.42 4.71 95.22 0.07 3.82 0.59 0.10 0.01 0.04 0.00 95.30 0.14 90 C E E 12.88 18.80 26.59 44.79 132.70 -174.62 -132.01 149.29 4.01 95.90 0.09 3.34 0.42 0.08 0.02 0.04 0.00 95.97 0.13 91 S E E 12.81 20.46 21.88 41.71 131.00 -165.81 -128.09 147.94 5.14 94.71 0.15 4.09 0.76 0.19 0.03 0.09 0.00 94.63 0.21 92 Y E E 70.51 13.08 20.27 33.66 117.58 -145.66 -107.80 127.09 13.62 86.09 0.29 11.43 1.85 0.46 0.08 0.22 0.00 84.90 1.05 93 A C E 48.23 11.52 15.61 27.60 111.04 -169.98 -97.00 107.90 54.80 43.61 1.59 23.49 16.48 15.39 0.10 1.59 0.00 42.22 0.74 94 G C T 51.49 3.13 16.34 19.87 111.80 -29.34 98.18 -7.16 87.32 10.90 1.78 15.22 33.35 38.65 0.09 2.03 0.00 9.85 0.80 95 S C S 73.78 4.31 13.65 19.24 112.68 28.19 -107.26 156.33 96.53 1.51 1.96 14.65 45.18 36.49 0.12 2.20 0.00 0.99 0.35 96 S C S 81.70 4.48 14.89 20.61 100.31 -80.70 -90.85 4.68 95.20 3.74 1.06 11.30 55.82 28.24 0.07 1.07 0.00 3.07 0.44 97 T C E 58.25 9.23 16.80 27.16 122.67 91.42 -110.76 138.64 55.53 44.25 0.22 39.56 13.49 1.43 0.03 0.21 0.00 44.48 0.80 98 V E E 36.75 17.22 16.68 33.81 121.22 -158.10 -111.11 132.60 16.00 83.96 0.04 14.69 0.81 0.08 0.01 0.02 0.00 83.96 0.42 99 V E E 42.94 12.97 22.32 35.72 118.40 -158.69 -110.46 126.24 3.01 96.98 0.01 2.76 0.17 0.02 0.00 0.01 0.00 96.46 0.59 100 F E E 44.62 19.48 18.94 37.37 119.88 -159.16 -101.76 136.69 13.57 86.33 0.10 11.22 1.63 0.38 0.02 0.07 0.00 85.98 0.69 101 G C E 22.71 15.46 20.57 34.75 115.52 -119.63 -69.04 -140.55 68.29 30.42 1.29 22.92 24.38 21.59 0.10 1.34 0.00 28.77 0.92 102 G C T 38.35 10.15 22.66 32.15 100.76 9.39 -68.38 1.93 77.46 20.53 2.00 12.30 31.28 34.64 0.12 1.98 0.00 18.45 1.22 103 G C C 20.24 14.71 20.20 34.17 110.08 -98.45 92.47 2.80 72.01 26.84 1.15 27.79 27.13 16.77 0.07 1.26 0.00 26.18 0.79 104 T E E 20.54 21.06 18.11 38.28 118.22 -73.47 -98.61 136.76 41.17 58.77 0.06 37.85 1.68 0.19 0.01 0.05 0.00 59.82 0.39 105 K E E 93.80 9.27 25.19 34.82 121.08 -154.62 -110.25 131.44 3.12 96.86 0.01 2.84 0.19 0.02 0.00 0.01 0.00 96.73 0.22 106 L E E 11.13 24.42 16.01 40.54 122.42 -164.97 -115.30 134.04 1.73 98.26 0.00 1.65 0.06 0.00 0.00 0.00 0.00 98.21 0.07 107 T E E 56.46 7.26 24.57 32.31 120.88 -162.22 -113.25 131.79 3.78 96.21 0.01 3.65 0.15 0.02 0.00 0.00 0.00 95.91 0.26 108 V E E 26.62 20.13 12.98 32.85 115.26 -148.93 -97.76 125.81 19.62 80.34 0.04 19.69 0.27 0.06 0.01 0.02 0.00 78.73 1.23 109 L C C 79.33 8.03 19.24 27.85 112.18 -154.22 -90.58 125.71 99.48 0.52 0.00 99.54 0.04 0.01 0.00 0.00 0.00 0.41 0.01