# 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 69.75 13.90 20.17 33.46 122.04 -162.03 -110.01 134.97 99.72 0.27 0.01 99.71 0.08 0.02 0.00 0.00 0.00 0.16 0.02 1 A C C 18.51 18.67 16.37 34.65 121.05 -156.80 -105.49 139.00 79.82 20.00 0.18 78.36 1.07 0.35 0.06 0.08 0.00 19.01 1.07 2 R E E 112.78 8.35 21.52 30.34 121.13 -149.68 -110.34 131.52 16.58 83.20 0.22 14.60 1.82 0.29 0.10 0.13 0.00 79.43 3.63 3 I E E 13.77 22.56 14.00 36.30 117.21 -166.26 -118.57 120.54 6.58 93.19 0.23 4.09 1.75 0.50 0.16 0.12 0.00 81.10 12.28 4 A C T 41.29 13.66 16.83 30.94 93.52 -20.02 55.08 42.00 98.99 0.66 0.36 0.57 2.66 96.00 0.02 0.24 0.00 0.41 0.09 5 G C T 54.98 3.43 19.43 23.37 94.83 -50.13 80.79 2.69 99.63 0.16 0.21 0.68 3.27 95.74 0.01 0.17 0.00 0.11 0.02 6 I E E 40.92 15.94 12.78 29.23 120.05 116.40 -105.45 132.35 8.81 91.08 0.11 5.30 2.96 0.59 0.06 0.07 0.00 79.85 11.18 7 N E E 95.86 4.75 21.61 27.08 109.65 -134.27 -88.63 116.24 23.92 76.02 0.06 20.17 3.18 0.33 0.02 0.05 0.00 73.57 2.68 8 I C C 13.71 23.26 10.73 33.50 114.82 -159.92 -98.33 122.44 91.93 7.51 0.56 87.92 3.35 0.64 0.12 0.36 0.00 6.93 0.68 9 P C C 61.45 6.93 19.08 26.92 111.00 -120.44 -68.14 148.02 87.29 2.07 10.63 59.61 8.35 17.26 0.99 11.85 0.00 1.32 0.62 10 D C T 96.26 6.65 17.34 24.75 98.16 -103.25 -72.33 4.16 84.94 0.74 14.32 9.37 21.11 53.43 1.02 14.32 0.00 0.43 0.32 11 H C T 96.58 10.80 17.18 28.05 100.73 58.50 -89.99 26.91 79.08 4.92 15.99 26.12 15.85 37.20 1.84 14.45 0.00 3.66 0.88 12 K C C 81.73 13.53 18.51 31.64 104.30 125.60 -83.97 46.97 80.09 15.40 4.50 54.78 22.31 2.88 2.31 2.19 0.00 11.00 4.53 13 H E B 62.83 13.78 24.56 37.41 117.06 -113.51 -83.51 146.56 42.04 55.32 2.65 36.78 2.42 0.44 2.49 0.27 0.00 14.33 43.28 14 A H H 3.74 25.89 20.66 46.62 92.47 -124.22 -61.54 -39.16 2.84 0.02 97.15 0.27 0.27 2.22 96.12 1.10 0.01 0.01 0.00 15 V H H 18.88 21.07 24.31 44.14 91.40 54.73 -63.76 -41.55 0.95 0.01 99.04 0.07 0.06 0.78 97.96 1.12 0.00 0.00 0.00 16 I H H 46.37 11.11 27.82 39.75 91.70 50.56 -64.63 -41.43 0.21 0.00 99.79 0.01 0.01 0.17 98.61 1.19 0.00 0.00 0.00 17 A H H 4.73 22.03 23.62 45.28 91.69 51.12 -64.19 -42.64 0.37 0.00 99.63 0.03 0.02 0.28 98.04 1.62 0.00 0.00 0.00 18 L H H 2.23 26.66 21.53 48.33 91.25 51.33 -65.14 -36.91 1.62 0.02 98.36 0.07 0.09 1.51 92.43 5.88 0.01 0.01 0.00 19 T H H 42.98 15.48 23.19 37.96 91.38 58.91 -68.60 -26.05 16.78 0.04 83.18 0.26 0.47 16.87 74.69 7.62 0.04 0.02 0.02 20 S C T 44.41 12.39 23.56 36.06 91.97 60.44 -78.86 -11.99 61.52 0.12 38.35 1.17 2.69 57.95 34.16 3.84 0.03 0.05 0.10 21 I C S 12.71 23.57 17.33 40.62 116.64 86.77 -90.13 134.26 91.76 3.11 5.13 6.57 75.58 8.21 5.19 0.46 0.05 0.65 3.28 22 Y C T 93.56 13.77 23.31 36.01 107.98 -72.85 -72.04 116.62 97.34 0.51 2.15 0.73 13.60 83.66 0.71 0.72 0.00 0.20 0.39 23 G C T 35.76 9.27 22.89 32.44 96.64 -3.14 86.02 -0.50 99.44 0.10 0.45 1.84 16.59 81.14 0.12 0.22 0.00 0.06 0.04 24 V C C 8.64 24.03 12.90 36.98 116.95 116.92 -102.34 127.19 95.80 3.84 0.35 74.03 19.49 0.90 0.23 0.12 0.00 0.79 4.44 25 G C C 27.98 6.19 23.89 30.03 125.04 -153.75 -90.13 166.90 99.43 0.35 0.23 98.16 1.22 0.14 0.15 0.02 0.00 0.09 0.23 26 K H H 108.44 12.46 16.14 28.45 92.01 -100.69 -59.88 -37.92 4.30 0.01 95.69 0.70 0.79 2.24 95.99 0.27 0.00 0.00 0.00 27 T H H 91.38 2.09 23.14 24.23 91.85 52.52 -64.40 -40.94 2.25 0.00 97.74 0.34 0.23 1.38 97.80 0.25 0.00 0.00 0.00 28 R H H 78.80 12.30 21.11 33.13 92.22 48.11 -66.56 -40.49 0.47 0.00 99.53 0.11 0.03 0.23 99.49 0.14 0.00 0.00 0.00 29 S H H 2.18 25.88 15.57 41.90 91.16 51.08 -62.93 -43.06 0.11 0.00 99.89 0.02 0.00 0.04 99.91 0.02 0.00 0.00 0.00 30 K H H 97.63 9.91 23.79 33.71 91.26 51.21 -62.99 -41.23 0.03 0.00 99.97 0.00 0.00 0.02 99.98 0.01 0.00 0.00 0.00 31 A H H 47.61 4.58 25.80 30.55 91.52 50.93 -63.68 -42.60 0.03 0.00 99.97 0.00 0.00 0.01 99.98 0.00 0.00 0.00 0.00 32 I H H 6.92 21.97 20.95 42.80 91.59 48.86 -64.35 -44.08 0.03 0.00 99.97 0.00 0.00 0.02 99.98 0.00 0.00 0.00 0.00 33 L H H 5.92 23.82 18.20 41.97 91.42 49.98 -62.82 -43.36 0.05 0.00 99.95 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 34 A H H 67.49 4.47 22.93 27.90 91.50 50.46 -63.20 -40.89 0.14 0.00 99.86 0.00 0.00 0.11 99.83 0.05 0.00 0.00 0.00 35 A H H 60.75 7.33 20.79 28.85 90.78 52.56 -65.75 -30.64 1.81 0.00 98.19 0.02 0.02 1.93 97.91 0.12 0.00 0.00 0.00 36 A C T 14.87 19.61 14.86 34.66 92.85 49.96 -87.78 -3.69 61.41 0.01 38.58 0.12 0.46 61.57 37.43 0.40 0.00 0.00 0.01 37 G C T 52.75 2.50 23.31 25.80 94.21 -112.19 76.19 20.99 99.90 0.00 0.10 0.81 0.49 98.66 0.03 0.01 0.00 0.00 0.00 38 I C C 13.66 23.12 10.73 33.35 120.31 140.64 -101.39 138.52 99.22 0.70 0.08 96.66 2.39 0.08 0.03 0.02 0.00 0.17 0.65 39 A C C 52.38 4.68 23.20 27.62 115.78 -112.01 -72.55 146.16 99.32 0.50 0.18 98.75 0.50 0.20 0.03 0.08 0.00 0.15 0.29 40 E C T 87.99 15.96 13.41 28.74 92.58 -124.31 -63.99 -25.68 99.42 0.21 0.36 1.20 6.06 92.22 0.03 0.29 0.00 0.12 0.08 41 D C T 114.79 1.70 20.55 21.79 94.41 56.30 -90.54 2.24 99.53 0.20 0.27 1.72 5.07 92.72 0.02 0.29 0.00 0.15 0.03 42 V C C 26.45 15.38 13.06 29.68 116.30 122.51 -72.56 140.57 99.21 0.75 0.04 69.46 29.75 0.14 0.01 0.03 0.00 0.33 0.30 43 K E B 86.18 6.08 24.01 30.34 116.09 -120.35 -79.78 143.93 35.76 64.19 0.05 32.21 0.36 0.01 0.03 0.00 0.00 4.41 62.96 44 I H G 9.91 25.04 12.68 38.08 91.14 -118.78 -58.12 -36.57 6.19 0.05 93.76 0.38 0.45 4.16 0.47 94.51 0.00 0.04 0.00 45 S H G 65.12 8.14 19.62 28.64 89.76 62.56 -68.16 -18.84 5.72 0.02 94.27 0.10 0.25 4.41 0.31 94.91 0.00 0.01 0.00 46 E H G 125.87 2.95 21.18 24.20 94.12 55.03 -93.03 -3.37 6.34 0.03 93.63 0.31 0.54 4.02 0.35 94.76 0.00 0.01 0.00 47 L C C 13.59 23.66 7.47 29.36 118.78 108.10 -75.91 141.52 99.07 0.51 0.42 58.32 40.39 0.25 0.17 0.16 0.00 0.09 0.63 48 S C C 59.97 2.30 21.27 22.19 123.01 -126.97 -81.72 165.30 99.32 0.36 0.32 98.12 1.09 0.05 0.27 0.02 0.00 0.06 0.39 49 E H H 134.50 4.80 13.85 20.80 90.96 -100.97 -57.89 -37.61 1.52 0.00 98.48 0.16 0.21 1.03 98.06 0.54 0.00 0.00 0.00 50 G H H 48.05 1.46 18.93 18.95 91.72 53.33 -63.55 -39.76 0.95 0.00 99.05 0.08 0.07 0.71 98.37 0.77 0.00 0.00 0.00 51 Q H H 50.04 13.10 16.78 30.24 92.25 48.92 -66.87 -39.87 0.36 0.00 99.64 0.06 0.03 0.21 99.11 0.58 0.00 0.00 0.00 52 I H H 12.86 20.95 14.60 35.60 91.47 51.45 -62.89 -43.24 0.11 0.00 99.89 0.02 0.01 0.06 99.84 0.07 0.00 0.00 0.00 53 D H H 78.55 3.15 22.91 25.51 91.30 50.97 -63.67 -40.92 0.16 0.00 99.84 0.02 0.01 0.10 99.84 0.04 0.00 0.00 0.00 54 T H H 58.52 5.08 22.10 27.51 91.50 50.32 -64.25 -41.55 0.23 0.00 99.77 0.02 0.01 0.16 99.77 0.05 0.00 0.00 0.00 55 L H H 4.76 24.07 16.09 40.40 91.63 50.29 -64.01 -42.64 0.19 0.00 99.81 0.02 0.01 0.12 99.79 0.06 0.00 0.00 0.00 56 R H H 90.81 14.06 19.97 33.20 91.36 52.28 -61.72 -41.69 0.16 0.00 99.84 0.02 0.01 0.10 99.81 0.07 0.00 0.00 0.00 57 D H H 93.04 1.61 23.54 22.97 91.84 49.77 -64.71 -40.66 0.37 0.00 99.63 0.03 0.01 0.28 99.46 0.22 0.00 0.00 0.00 58 E H H 48.67 11.15 18.82 30.91 92.11 49.59 -65.52 -41.15 0.98 0.00 99.02 0.05 0.04 0.83 98.59 0.50 0.00 0.00 0.00 59 V H H 9.41 23.12 13.17 35.96 92.02 50.42 -66.54 -36.90 4.56 0.01 95.43 0.36 0.29 3.66 94.04 1.64 0.00 0.00 0.00 60 A H H 64.23 6.70 17.48 25.37 90.88 60.27 -67.78 -22.70 39.45 0.07 60.48 1.81 1.49 35.36 58.10 3.13 0.02 0.03 0.05 61 K C T 148.53 1.65 19.33 20.21 94.33 54.07 -83.45 -12.33 65.55 0.15 34.30 3.97 3.63 55.93 32.61 3.68 0.01 0.06 0.10 62 F C C 49.25 17.86 10.96 28.10 116.54 87.05 -96.98 133.15 87.52 3.07 9.41 54.77 23.80 8.66 7.46 2.50 0.01 1.78 1.02 63 V C C 95.91 5.03 19.59 25.92 117.06 -155.49 -104.12 127.17 77.53 20.06 2.42 73.26 2.46 1.71 1.75 0.68 0.00 15.83 4.32 64 V C C 30.97 19.56 10.31 29.04 120.53 -166.14 -110.54 132.45 69.83 28.25 1.91 64.76 3.24 1.11 1.53 0.60 0.00 21.41 7.37 65 E C C 133.90 2.88 18.24 21.94 115.73 -144.35 -96.89 135.39 77.47 17.00 5.53 59.97 11.42 5.38 4.08 1.72 0.02 15.21 2.20 66 G C S 36.90 5.19 16.80 23.11 129.98 44.99 127.96 -174.46 80.86 6.03 13.11 29.75 39.50 11.89 10.65 2.81 0.07 3.78 1.56 67 D C C 83.55 4.56 18.60 23.56 106.60 -44.30 -85.11 101.26 79.92 1.94 18.14 67.50 4.77 6.25 17.56 2.15 0.00 1.05 0.73 68 L H H 33.32 18.93 12.52 31.11 94.39 -167.25 -64.95 -34.45 13.43 0.16 86.40 8.77 1.82 3.47 84.12 1.68 0.00 0.08 0.06 69 R H H 115.48 9.85 17.71 28.05 91.43 56.68 -62.31 -40.83 3.94 0.05 96.01 1.70 0.54 1.73 94.69 1.29 0.00 0.03 0.02 70 R H H 140.70 2.41 20.78 22.71 92.14 49.36 -65.95 -40.05 2.19 0.04 97.77 1.03 0.29 0.93 96.53 1.18 0.00 0.02 0.01 71 E H H 72.71 9.29 19.31 29.25 92.22 50.10 -65.46 -41.27 1.38 0.02 98.60 0.62 0.17 0.59 98.03 0.57 0.00 0.01 0.01 72 I H H 20.15 19.11 16.78 35.78 92.01 49.26 -64.43 -42.76 1.44 0.02 98.54 0.57 0.16 0.66 98.23 0.37 0.00 0.01 0.01 73 S H H 42.63 8.23 20.63 29.57 91.70 51.10 -63.21 -41.83 1.74 0.01 98.25 0.53 0.15 0.89 98.11 0.30 0.00 0.00 0.00 74 M H H 87.09 3.20 23.16 25.69 91.66 50.16 -64.39 -41.42 1.27 0.00 98.72 0.33 0.12 0.71 98.61 0.23 0.00 0.00 0.00 75 S H H 18.08 14.55 19.72 34.82 91.84 50.45 -64.70 -41.62 1.32 0.00 98.67 0.26 0.10 0.82 98.63 0.19 0.00 0.00 0.00 76 I H H 21.33 19.25 18.20 37.11 91.68 50.54 -63.84 -41.91 0.56 0.00 99.44 0.09 0.04 0.34 99.44 0.10 0.00 0.00 0.00 77 K H H 117.30 3.57 23.41 26.93 91.54 51.16 -63.42 -41.57 0.30 0.00 99.70 0.04 0.02 0.17 99.68 0.08 0.00 0.00 0.00 78 R H H 108.24 5.09 22.19 27.50 91.77 49.54 -64.82 -41.08 0.49 0.00 99.50 0.05 0.02 0.34 99.44 0.15 0.00 0.00 0.00 79 L H H 13.05 19.23 15.16 34.73 91.97 50.58 -64.37 -41.71 0.57 0.00 99.43 0.07 0.04 0.37 99.21 0.31 0.00 0.00 0.00 80 M H H 71.73 11.99 16.74 28.95 91.96 51.07 -63.90 -40.77 1.09 0.00 98.91 0.12 0.06 0.77 98.32 0.72 0.00 0.00 0.00 81 D H H 113.69 1.51 20.04 20.80 91.02 52.86 -66.34 -28.42 6.00 0.01 94.00 0.16 0.21 5.54 93.45 0.63 0.00 0.00 0.00 82 L C H 70.84 9.58 15.62 26.24 93.30 53.20 -85.34 -6.99 50.45 0.03 49.51 0.48 1.48 47.85 49.27 0.86 0.02 0.01 0.03 83 G C T 40.81 5.89 20.16 26.86 98.38 -106.31 84.68 13.83 99.30 0.05 0.65 10.36 4.18 84.90 0.42 0.11 0.00 0.02 0.02 84 C C C 21.13 16.97 14.03 31.50 118.88 149.72 -78.56 150.10 96.17 1.50 2.33 88.89 6.21 0.56 2.14 0.26 0.00 0.33 1.62 85 Y H H 102.91 9.98 21.28 31.82 93.11 -124.32 -63.87 -36.85 10.31 0.07 89.61 1.57 2.40 6.73 87.89 1.31 0.04 0.02 0.05 86 R H H 93.08 11.09 21.52 32.38 92.47 54.13 -65.12 -41.69 4.76 0.03 95.21 0.49 0.53 3.65 94.05 1.24 0.01 0.01 0.01 87 G H H 7.88 13.05 17.55 32.33 91.95 51.14 -63.79 -42.29 3.14 0.03 96.82 0.74 0.37 1.91 95.19 1.75 0.01 0.02 0.01 88 L H H 41.73 9.22 19.13 29.83 91.84 50.03 -64.23 -42.18 1.98 0.03 97.99 0.52 0.28 1.09 96.99 1.09 0.00 0.02 0.01 89 R H H 70.16 8.85 17.41 27.61 92.35 50.04 -64.60 -42.17 2.12 0.04 97.84 0.53 0.28 1.25 96.87 1.02 0.01 0.02 0.01 90 H H H 75.10 10.45 15.34 26.57 92.53 49.60 -65.27 -40.87 2.30 0.02 97.68 0.36 0.18 1.60 96.03 1.81 0.01 0.01 0.00 91 R H H 132.39 6.64 15.94 23.85 91.75 50.75 -66.90 -31.86 7.70 0.03 92.27 0.36 0.40 6.85 90.63 1.72 0.02 0.01 0.01 92 R C T 135.21 4.36 15.12 20.54 94.13 48.24 -90.44 1.11 61.81 0.03 38.16 0.50 1.37 60.32 36.04 1.71 0.01 0.01 0.04 93 G C T 57.62 1.92 16.25 18.54 95.21 -108.07 79.77 14.70 99.55 0.01 0.44 2.04 1.48 96.18 0.24 0.05 0.00 0.00 0.00 94 L C C 56.43 10.45 10.53 22.55 116.98 146.09 -87.47 138.81 99.77 0.18 0.04 92.82 6.87 0.09 0.02 0.01 0.00 0.05 0.13 95 P C C 75.83 4.75 17.92 23.39 112.42 -104.94 -65.68 145.21 99.05 0.60 0.36 95.16 3.30 0.62 0.11 0.16 0.00 0.22 0.42 96 V C C 49.98 16.01 11.09 26.44 116.71 -147.71 -96.97 134.88 84.94 12.64 2.42 72.79 8.21 1.93 1.25 1.01 0.00 2.67 12.14 97 R C T 144.26 5.47 15.70 22.19 109.06 -101.95 -71.91 121.27 82.10 3.96 13.94 21.38 25.33 36.33 6.95 5.80 0.05 1.83 2.32 98 G C T 45.03 5.74 14.40 21.07 99.43 13.40 80.41 -1.76 80.63 1.49 17.88 16.57 23.79 41.06 9.73 7.15 0.03 0.64 1.02 99 Q C C 98.49 7.06 13.10 21.32 100.08 98.46 -78.23 -18.78 65.68 1.81 32.51 31.00 19.11 16.65 22.81 8.53 0.04 0.74 1.13 100 R C C 142.22 5.08 14.29 20.64 100.05 66.35 -78.59 -16.06 58.51 2.57 38.92 34.04 13.20 12.24 31.59 6.47 0.04 1.19 1.24 101 T C H 62.70 8.47 12.45 22.10 109.98 77.29 -95.60 106.94 48.94 2.39 48.67 30.37 10.75 9.12 41.54 6.00 0.04 1.22 0.95 102 K H H 122.56 5.80 14.52 21.42 99.60 41.56 -75.66 -16.03 44.64 1.71 53.64 25.53 10.30 10.22 46.82 5.54 0.03 0.89 0.66 103 T H H 68.71 6.64 14.29 22.09 104.47 74.69 -82.87 -22.68 45.76 1.28 52.95 25.06 10.36 11.53 46.62 5.24 0.03 0.61 0.56 104 N H H 73.01 7.35 14.30 22.77 99.43 55.01 -75.10 -19.56 47.31 1.12 51.57 27.04 10.03 11.64 44.22 5.99 0.03 0.51 0.55 105 A H H 47.95 9.85 12.23 23.06 95.62 67.62 -69.98 -24.63 45.95 1.14 52.91 23.80 9.59 13.92 42.20 9.37 0.03 0.55 0.54 106 R C H 145.71 4.41 14.23 19.96 97.15 67.34 -75.06 -18.68 50.33 1.66 48.01 25.67 10.92 15.20 37.37 9.20 0.05 0.81 0.78 107 T C C 87.35 4.23 13.30 18.72 100.23 52.33 -88.62 -4.12 59.79 2.50 37.71 32.15 13.47 15.51 28.83 7.58 0.04 1.13 1.29 108 R C C 120.80 7.96 9.87 19.00 115.00 103.17 -86.96 134.73 79.99 2.06 17.95 48.02 20.09 11.67 14.22 3.89 0.01 0.85 1.24 109 K C C 159.31 1.73 12.65 15.37 108.56 -147.70 -88.20 106.70 88.73 2.65 8.61 56.11 22.60 9.88 6.06 2.46 0.00 1.08 1.80 110 G C C 35.96 6.19 10.34 18.10 128.87 -109.83 -110.23 175.95 96.89 1.82 1.30 52.71 41.16 3.20 0.52 0.68 0.00 0.80 0.93 111 P C C 98.91 3.25 12.27 16.96 110.51 -61.11 -69.78 141.94 95.75 1.55 2.71 68.77 16.79 9.99 0.59 2.26 0.00 0.87 0.72 112 R C C 156.04 4.73 9.74 16.41 113.23 -129.83 -89.60 132.62 94.56 3.03 2.41 71.08 17.60 5.55 0.67 1.78 0.00 1.46 1.86 113 K C C 142.72 2.65 11.35 15.76 117.70 -135.72 -93.62 138.34 97.36 2.05 0.59 71.72 24.80 1.03 0.24 0.32 0.00 1.08 0.80 114 P C C 93.43 4.53 10.07 16.55 113.77 -107.38 -66.38 146.40 94.63 3.27 2.09 80.76 9.39 4.47 0.60 1.43 0.00 1.97 1.38 115 I C C 109.27 5.89 7.61 15.09 112.00 -117.98 -84.48 129.70 92.10 5.11 2.79 72.04 12.86 6.85 0.78 2.01 0.00 2.83 2.62 116 K C C 157.19 1.76 9.41 12.73 114.83 -141.18 -94.92 134.01 95.14 3.10 1.76 88.56 2.65 4.50 0.47 0.88 0.00 1.82 1.13 117 K C C 156.14 2.46 10.80 15.00 111.79 -115.15 -82.28 128.95 99.90 0.08 0.02 99.42 0.31 0.21 0.01 0.01 0.00 0.04 0.02