# 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 M C C 107.98 5.92 11.22 18.78 116.58 -138.18 -91.14 135.73 99.94 0.05 0.01 99.84 0.11 0.02 0.00 0.00 0.00 0.02 0.01 1 P C C 103.63 2.80 9.98 14.55 109.98 -112.30 -72.97 138.45 94.24 1.64 4.13 89.58 1.05 4.52 1.27 1.94 0.00 0.83 0.80 2 F C C 142.38 4.35 7.63 13.78 112.89 -150.45 -94.66 122.64 84.05 5.46 10.50 58.33 13.26 11.94 3.29 7.46 0.00 3.20 2.51 3 K C C 150.44 2.20 10.25 14.03 113.74 -151.72 -96.00 127.92 74.82 7.34 17.83 51.51 13.08 10.28 5.33 12.64 0.01 4.92 2.24 4 S C C 71.54 5.99 8.47 16.06 115.30 -159.33 -96.47 132.85 73.61 6.91 19.48 51.98 12.39 9.40 6.05 13.48 0.01 4.83 1.87 5 T C C 97.91 3.20 11.14 16.09 112.93 -162.66 -99.95 119.94 73.65 10.03 16.32 51.90 12.11 9.71 6.39 9.90 0.01 7.01 2.98 6 V C C 98.25 5.31 9.51 16.62 114.19 -159.23 -97.36 126.98 78.81 9.87 11.32 49.58 14.78 14.94 5.25 5.76 0.02 6.55 3.10 7 G C C 42.73 5.08 11.04 17.62 120.77 152.04 -107.62 171.27 87.05 6.44 6.51 46.33 26.40 14.90 2.62 3.65 0.00 3.98 2.11 8 D C C 98.48 3.15 12.55 16.83 109.75 -86.90 -88.41 119.93 93.26 3.39 3.35 72.24 17.22 3.78 1.76 1.56 0.00 1.97 1.47 9 Y C T 134.08 7.78 9.63 18.55 98.13 -147.45 -69.59 -20.25 73.00 1.80 25.20 24.20 12.17 37.55 11.81 12.35 0.02 0.97 0.92 10 Q C T 127.95 2.94 12.43 16.61 98.80 62.58 -81.44 -3.11 70.27 1.83 27.90 19.30 13.12 38.56 13.75 13.29 0.04 0.98 0.97 11 T C C 78.80 4.91 11.71 18.10 104.86 84.15 -87.91 13.15 66.30 4.36 29.34 37.11 15.77 13.91 15.19 13.83 0.03 2.38 1.79 12 V C C 83.22 7.34 11.63 20.15 105.19 78.77 -87.04 36.22 65.87 8.26 25.87 44.86 11.82 8.82 18.96 7.63 0.04 5.18 2.69 13 A C C 60.67 7.88 12.58 21.58 105.57 92.37 -83.54 30.35 69.29 9.30 21.41 50.58 9.95 8.03 16.27 6.10 0.02 6.85 2.21 14 T C C 80.67 6.42 14.54 22.17 111.16 58.15 -99.07 105.45 69.93 12.77 17.30 51.56 9.15 8.25 13.02 5.21 0.02 9.75 3.03 15 L C C 77.60 10.90 12.96 24.41 115.61 63.61 -99.62 128.40 72.58 14.47 12.95 52.64 11.45 7.55 9.91 3.98 0.03 10.58 3.87 16 E C C 103.27 8.37 16.08 25.12 109.06 -145.89 -86.72 103.36 77.14 11.47 11.39 50.15 16.83 10.10 7.26 4.48 0.02 8.56 2.60 17 T C C 56.10 9.63 17.09 27.44 120.92 60.86 -109.78 143.01 76.03 11.77 12.20 52.86 14.93 7.91 5.78 6.69 0.02 7.13 4.68 18 F H G 58.04 18.10 12.90 29.94 96.76 -140.15 -73.05 -15.35 46.63 4.62 48.75 21.73 9.14 17.04 3.17 44.90 0.01 2.89 1.11 19 G C G 43.05 7.02 16.91 24.99 93.82 79.36 -67.99 -16.89 50.19 1.83 47.98 6.92 8.56 33.31 1.93 47.61 0.01 1.18 0.48 20 F C G 128.36 5.25 17.41 23.59 97.25 53.27 -94.59 2.00 50.32 2.36 47.32 11.35 11.10 27.57 1.76 46.16 0.01 1.36 0.70 21 L C S 34.91 18.73 9.94 28.06 118.96 106.58 -82.73 143.29 96.90 2.73 0.37 38.15 58.38 0.60 0.13 0.18 0.00 0.93 1.63 22 P C C 67.65 5.75 17.95 24.66 116.35 -103.92 -65.71 152.54 98.87 0.77 0.36 77.78 17.09 4.03 0.07 0.32 0.00 0.42 0.30 23 P C C 102.03 4.29 16.87 22.94 112.13 -96.26 -66.28 139.63 98.49 1.07 0.44 81.38 12.57 4.48 0.11 0.36 0.00 0.51 0.59 24 M C C 37.37 18.41 9.14 26.59 122.02 -146.03 -103.08 147.88 94.68 5.04 0.28 87.62 5.89 0.25 0.16 0.09 0.00 1.15 4.85 25 T C C 72.08 2.21 20.63 21.34 121.71 -121.97 -81.73 163.59 98.90 0.83 0.28 97.56 1.40 0.13 0.18 0.04 0.00 0.27 0.42 26 Q H H 101.57 9.97 12.42 23.29 91.64 -105.13 -57.80 -38.85 2.16 0.00 97.84 0.33 0.34 1.34 97.42 0.56 0.00 0.00 0.00 27 D H H 107.99 1.32 17.43 17.84 91.86 52.48 -64.75 -39.12 1.23 0.00 98.76 0.14 0.10 0.86 98.25 0.63 0.00 0.00 0.00 28 E H H 85.98 5.15 17.37 23.52 91.93 49.05 -66.19 -39.67 0.72 0.00 99.27 0.14 0.06 0.44 98.61 0.74 0.00 0.00 0.00 29 I H H 11.49 20.85 13.79 34.75 91.82 50.96 -63.19 -43.72 0.28 0.00 99.72 0.06 0.02 0.16 99.65 0.12 0.00 0.00 0.00 30 Y H H 82.54 12.03 19.07 31.30 91.48 50.50 -62.54 -42.25 0.10 0.00 99.90 0.02 0.00 0.05 99.90 0.02 0.00 0.00 0.00 31 D H H 89.37 1.90 24.12 24.19 91.69 49.94 -64.12 -41.48 0.08 0.00 99.92 0.01 0.00 0.05 99.92 0.02 0.00 0.00 0.00 32 Q H H 47.38 12.62 21.01 33.85 91.97 49.67 -64.60 -42.27 0.09 0.00 99.91 0.00 0.00 0.06 99.92 0.02 0.00 0.00 0.00 33 I H H 5.52 24.69 17.64 42.39 91.68 49.26 -63.93 -42.90 0.07 0.00 99.93 0.00 0.00 0.05 99.93 0.01 0.00 0.00 0.00 34 A H H 43.74 7.87 21.88 30.42 91.23 51.92 -62.30 -41.17 0.07 0.00 99.93 0.00 0.00 0.05 99.93 0.01 0.00 0.00 0.00 35 Y H H 104.67 3.66 23.06 26.32 91.50 50.70 -63.94 -42.29 0.10 0.00 99.90 0.00 0.00 0.08 99.88 0.03 0.00 0.00 0.00 36 I H H 12.26 18.21 16.84 35.73 91.91 49.80 -64.13 -43.25 0.13 0.00 99.87 0.01 0.00 0.11 99.81 0.07 0.00 0.00 0.00 37 I H H 37.38 17.64 15.87 33.03 91.84 49.73 -64.12 -41.13 0.35 0.00 99.65 0.01 0.01 0.31 99.42 0.24 0.00 0.00 0.00 38 A H H 82.15 2.46 18.82 21.79 90.26 55.14 -65.22 -27.09 5.67 0.00 94.33 0.06 0.11 5.94 93.52 0.36 0.00 0.00 0.00 39 Q C T 106.40 4.75 17.04 22.77 93.47 53.94 -87.86 0.08 82.66 0.02 17.32 0.29 0.89 80.97 17.36 0.46 0.00 0.00 0.02 40 G C T 40.38 5.46 19.54 25.80 100.58 -101.90 89.57 9.99 99.82 0.03 0.14 1.97 1.20 96.74 0.05 0.02 0.00 0.02 0.01 41 W C C 46.17 18.97 13.83 32.39 117.74 149.39 -81.30 142.66 88.35 11.63 0.03 88.07 0.71 0.06 0.00 0.01 0.00 10.68 0.45 42 S E E 44.27 10.83 25.70 36.58 115.15 -154.97 -113.88 114.22 45.97 54.00 0.02 45.19 0.78 0.06 0.00 0.01 0.00 52.95 1.01 43 P E E 12.44 23.77 18.56 42.35 116.59 -133.34 -71.93 144.10 24.03 75.93 0.05 22.69 1.01 0.09 0.01 0.04 0.00 75.29 0.87 44 L E E 28.88 15.98 25.70 41.24 130.45 -172.43 -130.29 148.04 10.63 89.30 0.07 8.75 1.58 0.19 0.02 0.05 0.00 89.11 0.30 45 I E E 24.11 21.42 20.87 41.76 121.86 -146.58 -114.86 131.60 3.30 96.67 0.03 2.88 0.26 0.04 0.01 0.02 0.00 96.61 0.18 46 E E E 43.51 14.87 22.68 37.53 124.26 -170.37 -119.50 137.26 2.68 97.30 0.02 2.33 0.18 0.03 0.01 0.01 0.00 97.32 0.13 47 H E E 51.93 16.09 19.12 35.03 122.86 -163.03 -116.89 135.47 8.63 91.33 0.05 7.69 0.76 0.09 0.01 0.02 0.00 90.93 0.49 48 V E E 35.63 13.37 16.87 31.32 125.72 -168.22 -121.92 142.98 42.81 57.11 0.08 38.91 2.85 0.18 0.02 0.06 0.00 56.64 1.36 49 H C C 81.79 7.58 16.46 25.37 113.64 -119.42 -85.36 134.57 92.51 7.24 0.25 85.18 6.85 0.46 0.09 0.14 0.00 6.54 0.74 50 P C G 73.39 8.31 12.20 21.81 97.14 -115.13 -61.32 -30.70 60.59 1.27 38.14 25.06 10.00 25.95 10.16 27.56 0.01 0.73 0.54 51 S C G 83.93 1.83 13.99 16.05 95.98 58.51 -72.91 -20.20 56.20 1.25 42.55 16.53 10.49 29.14 12.81 29.64 0.03 0.62 0.74 52 R C G 125.83 5.62 11.57 18.57 101.01 54.70 -86.29 -6.33 51.98 2.70 45.31 22.06 12.96 18.42 13.55 30.27 0.04 1.30 1.40 53 S C C 49.80 9.86 9.76 20.40 100.12 72.66 -77.75 -21.24 64.87 3.02 32.11 36.00 11.88 17.20 15.08 16.70 0.02 1.47 1.65 54 M C C 123.81 3.91 12.72 17.80 97.75 72.90 -79.35 -9.88 70.12 2.72 27.16 29.12 17.58 24.47 11.95 14.00 0.04 1.23 1.60 55 A C T 73.49 4.02 12.94 18.18 100.50 64.74 -81.41 -5.70 76.71 1.63 21.66 22.49 25.53 30.08 7.95 12.18 0.02 0.78 0.96 56 T C C 80.77 6.12 12.99 20.39 107.60 47.52 -100.83 21.19 76.61 6.05 17.34 34.59 22.11 21.35 5.85 10.53 0.03 3.64 1.90 57 Y C C 108.89 9.19 12.90 23.15 118.50 118.42 -106.16 139.02 67.20 19.76 13.04 41.00 16.27 10.89 5.34 7.88 0.09 14.16 4.37 58 W C C 107.60 11.57 13.77 25.97 116.88 -148.74 -100.60 133.11 56.15 32.36 11.49 37.27 10.83 8.74 5.42 6.17 0.07 27.38 4.12 59 S E E 50.79 10.33 16.66 27.65 118.06 -158.75 -105.51 137.83 44.27 44.43 11.31 30.31 8.72 6.57 5.82 5.91 0.08 37.66 4.92 60 Y C E 98.12 12.60 16.04 28.66 107.41 -157.81 -95.36 61.36 48.57 40.47 10.96 26.59 14.87 10.40 4.36 6.36 0.15 33.87 3.40 61 W C E 75.81 15.02 14.83 29.80 114.33 50.74 -97.03 128.06 53.04 39.48 7.48 32.83 13.52 8.40 2.76 4.66 0.06 33.95 3.80 62 K C C 122.74 6.68 19.55 27.35 111.32 -151.48 -94.46 114.81 68.56 28.99 2.45 51.74 13.08 3.72 0.90 1.72 0.00 24.76 4.07 63 L C C 42.50 18.28 12.84 30.54 118.07 -144.55 -95.92 135.52 87.25 11.42 1.33 70.35 14.69 2.17 0.46 0.93 0.00 9.21 2.20 64 P C C 63.96 7.99 19.34 28.14 113.84 -113.57 -68.25 150.78 85.69 7.06 7.26 51.77 14.41 18.91 0.93 7.36 0.00 5.42 1.20 65 F C C 101.90 12.06 15.85 28.04 110.86 -104.95 -75.62 131.69 76.89 13.07 10.04 39.15 16.30 22.05 1.45 9.17 0.02 9.04 2.84 66 F C C 85.95 13.36 14.53 27.87 107.03 -167.28 -94.17 80.62 68.09 25.01 6.90 38.08 14.73 15.70 1.50 6.01 0.05 16.52 7.41 67 G C C 50.59 4.37 19.01 23.90 98.44 -72.40 86.03 3.04 82.93 15.36 1.71 49.54 19.70 14.31 0.29 1.79 0.00 12.02 2.34 68 E C C 56.27 13.96 11.51 25.90 114.98 132.92 -88.31 132.52 86.25 12.86 0.89 78.60 5.50 1.84 0.32 0.61 0.00 8.93 4.20 69 K C S 146.36 3.86 17.38 22.65 100.14 176.13 -103.94 -7.03 98.35 1.33 0.32 33.75 63.33 1.59 0.11 0.17 0.00 0.69 0.37 70 D C S 83.14 3.68 20.54 24.53 114.96 87.12 -95.35 126.57 96.66 2.46 0.88 44.42 51.82 0.61 0.69 0.16 0.00 0.57 1.74 71 L H H 48.80 18.75 12.46 30.59 92.46 -142.39 -60.61 -37.05 4.48 0.02 95.50 0.68 0.62 3.08 94.48 1.13 0.01 0.01 0.01 72 G H H 42.92 3.84 20.33 24.61 91.45 57.06 -63.36 -39.75 3.40 0.02 96.58 0.53 0.31 2.39 95.78 0.97 0.00 0.01 0.01 73 V H H 64.23 4.97 21.22 26.62 91.66 48.92 -65.68 -40.90 0.68 0.01 99.31 0.21 0.07 0.34 98.90 0.47 0.00 0.01 0.00 74 I H H 4.54 23.53 16.15 40.09 91.42 50.07 -63.31 -44.38 0.17 0.00 99.83 0.04 0.01 0.07 99.83 0.05 0.00 0.00 0.00 75 V H H 26.06 17.29 20.87 37.69 91.30 49.69 -63.37 -42.99 0.06 0.00 99.94 0.01 0.00 0.03 99.95 0.01 0.00 0.00 0.00 76 S H H 60.97 2.37 26.28 27.14 91.36 50.37 -63.36 -42.35 0.04 0.00 99.96 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 77 E H H 49.75 12.49 22.67 35.25 91.96 49.42 -65.06 -41.82 0.05 0.00 99.95 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 78 L H H 1.85 26.95 17.54 45.16 91.06 50.27 -63.47 -42.83 0.07 0.00 99.93 0.00 0.00 0.05 99.94 0.01 0.00 0.00 0.00 79 E H H 87.67 8.57 24.36 33.12 91.33 50.97 -62.58 -41.74 0.09 0.00 99.91 0.00 0.00 0.06 99.93 0.01 0.00 0.00 0.00 80 A H H 47.41 3.18 24.66 27.25 91.24 50.64 -63.53 -42.10 0.13 0.00 99.87 0.01 0.00 0.09 99.88 0.01 0.00 0.00 0.00 81 C H H 7.81 18.82 17.58 37.12 91.79 50.14 -63.87 -42.58 0.15 0.00 99.85 0.01 0.00 0.10 99.85 0.04 0.00 0.00 0.00 82 H H H 46.32 17.85 16.37 33.56 91.72 51.97 -64.38 -38.14 0.42 0.00 99.58 0.02 0.01 0.31 99.55 0.10 0.00 0.00 0.00 83 R H H 174.13 1.22 20.86 20.71 91.75 51.31 -65.64 -37.54 2.50 0.00 97.50 0.04 0.07 2.40 97.30 0.19 0.00 0.00 0.00 84 A H H 63.05 5.09 17.88 23.68 93.69 46.00 -73.23 -30.21 5.57 0.00 94.43 0.08 0.33 5.26 94.18 0.15 0.01 0.00 0.00 85 Y C C 49.85 14.93 11.85 27.21 110.70 26.48 -131.79 70.66 99.59 0.15 0.25 69.61 29.40 0.55 0.20 0.04 0.00 0.03 0.17 86 P C T 82.91 6.64 15.29 23.88 92.82 165.80 -65.32 -22.83 99.67 0.08 0.24 2.35 2.50 94.89 0.02 0.17 0.00 0.04 0.03 87 D C T 107.10 2.80 19.82 23.01 94.27 50.50 -91.15 4.30 99.80 0.07 0.13 0.79 4.86 94.17 0.01 0.12 0.00 0.05 0.01 88 H C S 34.64 17.17 15.73 33.04 128.09 92.24 -104.64 154.15 95.54 4.41 0.05 41.45 53.95 0.43 0.00 0.05 0.00 3.90 0.22 89 H E E 42.22 13.34 24.73 38.35 120.88 -128.22 -99.10 143.91 10.42 89.57 0.01 9.73 0.47 0.03 0.00 0.01 0.00 89.43 0.34 90 V E E 3.02 26.28 19.91 46.98 122.24 -153.74 -115.34 133.83 0.73 99.27 0.00 0.68 0.02 0.00 0.00 0.00 0.00 99.29 0.02 91 R E E 49.48 14.81 28.03 42.73 123.84 -168.19 -120.02 134.99 0.32 99.68 0.00 0.28 0.01 0.00 0.00 0.00 0.00 99.71 0.00 92 L E E 4.97 25.46 21.51 47.25 120.15 -156.25 -111.14 130.19 0.17 99.83 0.00 0.15 0.00 0.00 0.00 0.00 0.00 99.85 0.00 93 V E E 24.94 15.17 26.48 41.70 124.31 -169.75 -120.27 134.54 0.20 99.80 0.00 0.17 0.00 0.00 0.00 0.00 0.00 99.82 0.00 94 G E E 5.23 21.60 21.09 42.13 137.92 162.45 -139.27 158.31 0.20 99.80 0.00 0.17 0.01 0.00 0.00 0.00 0.00 99.82 0.00 95 Y E E 62.84 12.33 21.90 34.92 124.29 -145.28 -121.76 135.06 0.41 99.59 0.00 0.40 0.01 0.00 0.00 0.00 0.00 99.53 0.06 96 D E E 28.16 12.63 15.28 29.87 108.51 -146.92 -96.80 111.74 17.36 82.63 0.01 16.71 0.34 0.02 0.00 0.01 0.00 82.62 0.30 97 A C T 64.90 6.57 14.36 22.83 93.42 -162.54 -68.99 -26.12 99.02 0.14 0.84 0.32 2.96 95.73 0.02 0.85 0.00 0.09 0.03 98 Y C T 180.11 1.12 14.62 15.15 97.03 48.40 -75.28 -40.06 99.00 0.06 0.94 0.24 2.83 95.91 0.02 0.95 0.00 0.03 0.02 99 T C T 80.02 3.29 13.26 17.56 99.63 24.17 -101.57 -11.80 99.20 0.05 0.74 0.67 2.77 95.68 0.03 0.81 0.00 0.03 0.01 100 Q C T 120.49 5.35 13.79 21.24 94.21 -127.32 56.89 40.71 99.07 0.57 0.36 29.91 4.58 64.69 0.09 0.21 0.00 0.44 0.07 101 S E E 39.37 7.66 18.05 27.19 137.44 119.63 -138.37 164.72 32.02 67.87 0.10 26.73 4.13 0.50 0.02 0.11 0.00 67.35 1.15 102 Q E E 72.56 13.96 18.03 31.63 116.04 -106.52 -84.30 138.03 1.72 98.28 0.00 1.62 0.11 0.01 0.00 0.00 0.00 97.99 0.27 103 G E E 15.25 16.43 18.79 34.86 108.60 -165.74 -103.57 -39.47 3.34 96.65 0.01 2.43 0.69 0.04 0.00 0.01 0.00 96.80 0.03 104 A E E 31.07 13.59 22.90 36.43 136.11 -26.05 -141.21 149.95 2.00 98.00 0.00 1.73 0.14 0.01 0.00 0.00 0.00 98.09 0.03 105 C E E 22.84 21.09 18.78 38.88 132.85 -172.69 -137.58 146.44 1.96 98.04 0.00 1.72 0.08 0.00 0.00 0.00 0.00 98.18 0.01 106 F E E 53.78 14.43 24.70 38.75 125.28 -162.84 -123.35 136.23 0.65 99.35 0.00 0.58 0.02 0.00 0.00 0.00 0.00 99.39 0.01 107 V E E 21.06 19.47 21.23 40.39 118.47 -153.43 -108.36 127.15 0.39 99.61 0.00 0.36 0.01 0.00 0.00 0.00 0.00 99.63 0.01 108 V E E 27.37 16.21 22.50 38.66 119.35 -166.90 -113.14 128.79 0.74 99.25 0.00 0.66 0.02 0.00 0.00 0.00 0.00 99.30 0.02 109 F E E 57.94 14.03 20.92 34.95 124.10 -163.21 -117.58 136.52 4.54 95.44 0.01 4.00 0.30 0.03 0.00 0.01 0.00 95.43 0.24 110 E E E 68.03 13.05 17.79 31.01 115.85 -159.26 -104.32 124.38 44.96 54.92 0.13 41.18 2.24 0.33 0.03 0.10 0.00 54.90 1.22 111 G C C 26.95 11.01 14.36 25.85 122.08 -120.47 -79.35 171.69 90.12 9.78 0.10 87.93 1.43 0.62 0.02 0.07 0.00 9.25 0.67 112 R C C 170.91 2.72 17.40 20.75 108.04 -71.36 -82.27 114.45 99.85 0.14 0.01 99.70 0.16 0.05 0.00 0.00 0.00 0.08 0.01