A0A087YM90_POEFO Loading...

Pseudouridylate synthase RPUSD4, mitochondrial

AlphaFold DB , UniProt , Accession A0A087YM90, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 380 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.2	Very low	28.2	Very low	249 Å²	249	167.6 Å²	167.6	100%	1.227	84%	0.835	S	S	*	*				0	110.8	0	-104.1	-178.3	-176.4	0	0	108.6
2	F	26.3	Very low	28	Very low	198 Å²	198	164.7 Å²	164.7	87%	0.868	84%	0.84	S	S	*	*			trans	-62.6	148.9	168.9	-96	-108.5	0	0	0	110.9
3	F	25.3	Very low	27.9	Very low	195 Å²	195	169.6 Å²	169.6	86%	0.855	84%	0.841	S	S	*	*			trans	168	145.5	142.4	-104.6	-84.7	0	0	0	107.6
4	L	26.7	Very low	27.8	Very low	129 Å²	129	175.6 Å²	175.6	68%	0.675	85%	0.85	S	S	*	*			cis	-164.1	147	-42.1	-147.1	123.3	0	0	0	105.1
5	L	28.7	Very low	27.9	Very low	141 Å²	141	175.1 Å²	175.1	74%	0.738	85%	0.852	S	S	*	*			trans	-73.5	128.6	177.2	-156.5	92.2	0	0	0	110.3
6	V	28.9	Very low	28.4	Very low	134 Å²	134	172.1 Å²	172.1	81%	0.812	85%	0.85	S	S	*	*			trans	-131.6	107	161.8	-178.7	0	0	0	0	110.5
7	K	28.8	Very low	28.5	Very low	177 Å²	177	166.6 Å²	166.6	77%	0.77	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-78.6	133.3	162.1	-77.1	172.7	172.7	171.4	0	108.1
8	S	27.3	Very low	28.5	Very low	115 Å²	115	165.2 Å²	165.2	80%	0.804	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-103	118.8	162.7	-163.2	0	0	0	0	109.6
9	R	28.5	Very low	28.5	Very low	224 Å²	224	161.3 Å²	161.3	85%	0.845	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-99.3	131.9	169.4	-84.6	179	165.7	178.8	-3.8	107.1
10	T	29.3	Very low	28.8	Very low	141 Å²	141	159.5 Å²	159.5	87%	0.865	84%	0.842	S	S	*	*			trans	-111.1	121.2	162.1	-36.4	0	0	0	0	108.6
11	I	28.5	Very low	28.9	Very low	141 Å²	141	158.4 Å²	158.4	72%	0.723	84%	0.842	S	S	*	*			trans	-87.2	138.4	179.9	-70.1	162.4	0	0	0	108.1
12	C	25.4	Very low	28.8	Very low	132 Å²	132	154.5 Å²	154.5	89%	0.892	83%	0.825	S	S	*	*			trans	-139.6	117.8	159	-151.3	0	0	0	0	109.2
13	R	26.4	Very low	28.9	Very low	229 Å²	229	150.1 Å²	150.1	86%	0.864	82%	0.819	S	S	*	*			trans	-90.2	143.9	176.6	-80.8	179.2	169.4	-179.3	-3	109.9
14	R	26.4	Very low	29.1	Very low	253 Å²	253	152.8 Å²	152.8	96%	0.955	82%	0.823	S	S	*	*			trans	-158	134.7	143.3	-100.7	176.5	-162.6	-161.7	3.5	109.5
15	L	30.4	Very low	29.2	Very low	169 Å²	169	152 Å²	152	89%	0.885	83%	0.829	S	S	*	*			trans	-95.6	-171.2	177.5	-66.4	165.1	0	0	0	110.4
16	P	36	Very low	29.3	Very low	127 Å²	127	153.3 Å²	153.3	83%	0.825	83%	0.831	S	S	*	*				-113.1	160.7	-112.6	20.5	5.3	0	0	0	113
17	G	29	Very low	29.3	Very low	79 Å²	79	154.9 Å²	154.9	81%	0.814	83%	0.829	S	S	*	*			trans	-128	131.7	173.1	0	0	0	0	0	110.5
18	T	28.6	Very low	29.4	Very low	140 Å²	140	153.4 Å²	153.4	86%	0.859	84%	0.836	S	S	*	*			trans	-89	158.4	-165.8	41.2	0	0	0	0	115.4
19	A	29.6	Very low	29.5	Very low	92 Å²	92	152.6 Å²	152.6	76%	0.76	84%	0.836	S	S	*	*			trans	85.8	156.9	148.2	0	0	0	0	0	120
20	P	34.3	Very low	29.6	Very low	124 Å²	124	147 Å²	147	81%	0.805	84%	0.837	S	S	*	*			cis	-128.6	167.9	-26.1	25.9	-4.7	0	0	0	114.5
21	V	30.4	Very low	29.7	Very low	137 Å²	137	149.3 Å²	149.3	83%	0.83	84%	0.838	S	S	*	*			trans	-79.2	135.5	172.1	171.9	0	0	0	0	109.8
22	L	29.4	Very low	29.8	Very low	167 Å²	167	154.6 Å²	154.6	87%	0.874	85%	0.849	S	S	*	*			trans	-131.4	115	161.5	-92	165.2	0	0	0	110.5
23	S	29.2	Very low	30	Very low	107 Å²	107	155.7 Å²	155.7	75%	0.748	85%	0.846	S	S	*	*			trans	-62.5	140	171.7	49.6	0	0	0	0	112.2
24	R	28.8	Very low	30.1	Very low	250 Å²	250	149.8 Å²	149.8	94%	0.943	84%	0.84	S	S	*	*			trans	-105.3	117.8	167.5	-154.9	172.7	-175	175.9	0.7	109.4
25	S	30.1	Very low	31	Very low	114 Å²	114	144 Å²	144	80%	0.797	84%	0.835	S	S	*	*			trans	-72.6	160.8	-179.7	50.8	0	0	0	0	113.1
26	Q	30.2	Very low	30.9	Very low	168 Å²	168	139.7 Å²	139.7	79%	0.785	83%	0.832	S	S	*	*			trans	-83.7	160.1	-179.3	-65.8	175.6	-18.1	0	0	113.5
27	H	29.2	Very low	30.5	Very low	166 Å²	166	137.2 Å²	137.2	77%	0.769	83%	0.829	S	S	*	*			trans	57.5	123.9	148.9	-69.9	-62.8	0	0	0	121.1
28	T	30.2	Very low	30.6	Very low	147 Å²	147	139.2 Å²	139.2	90%	0.902	83%	0.831	S	S	*	*				-147.5	129.9	121.6	30.3	0	0	0	0	109.9
29	A	29.7	Very low	31.2	Very low	98 Å²	98	140.4 Å²	140.4	81%	0.81	83%	0.831	S	S	*	*			trans	-96.3	147.6	166	0	0	0	0	0	108.4
30	A	30.7	Very low	31.5	Very low	105 Å²	105	141.9 Å²	141.9	87%	0.868	83%	0.831	S	S	*	*			trans	-159	130.5	154.4	0	0	0	0	0	110
31	E	30.7	Very low	31.9	Very low	191 Å²	191	141 Å²	141	89%	0.893	84%	0.835	S	S	*	*			trans	-71.1	162.2	-175.1	-63.6	158.2	138.1	0	0	113.9
32	R	30.6	Very low	32.4	Very low	252 Å²	252	142.7 Å²	142.7	95%	0.951	83%	0.833	S	S	*	*			trans	-163.3	142.6	139	-103.4	170	-153.6	-158	5.6	111.3
33	D	29.8	Very low	33.5	Very low	155 Å²	155	143.9 Å²	143.9	83%	0.829	83%	0.832	S	S	*	*			trans	-61.2	142.8	-168.4	-76.4	-56.7	0	0	0	118.7
34	S	28.6	Very low	34.8	Very low	105 Å²	105	144.5 Å²	144.5	73%	0.734	83%	0.833	S	S	*	*			trans	4.8	169.7	137.1	-50.6	0	0	0	0	122.7
35	P	45	Very low	36.1	Very low	130 Å²	130	143.8 Å²	143.8	84%	0.844	83%	0.83	S	S	*	*			cis	-134.5	167.5	-24.8	30.8	-10	0	0	0	114.4
36	G	29.2	Very low	37.8	Very low	80 Å²	80	144 Å²	144	83%	0.825	82%	0.822	S	S	*	*			trans	172.7	115.4	166.5	0	0	0	0	0	112.4
37	G	28.1	Very low	39.9	Very low	74 Å²	74	145.2 Å²	145.2	76%	0.763	82%	0.819	S	S	*	*			trans	-83.5	162.6	-163	0	0	0	0	0	117
38	S	30.8	Very low	41.8	Very low	122 Å²	122	141.4 Å²	141.4	85%	0.853	82%	0.817	S	S	*	*				165.9	141.6	124.3	48.1	0	0	0	0	110.5
39	D	39.8	Very low	44	Very low	164 Å²	164	139.3 Å²	139.3	88%	0.877	80%	0.799	S	S	*	*			trans	-49.3	124.9	-174.9	-77.5	-52.8	0	0	0	115.5
40	T	36.4	Very low	46.4	Very low	124 Å²	124	137.6 Å²	137.6	76%	0.761	78%	0.776	S	S	*	*			trans	-139	120.6	146.4	48.6	0	0	0	0	109.6	E42	T40-E42 PolarHBondContact O-N 2.78Å
41	A	42.2	Very low	48.5	Very low	106 Å²	106	137.2 Å²	137.2	88%	0.876	76%	0.759	S	S	*	*			trans	-67.3	98.2	175.6	0	0	0	0	0	110.4	K43	A41-K43 PolarHBondContact O-N 2.63Å
42	E	42.3	Very low	50.6	Low	171 Å²	171	130.3 Å²	130.3	80%	0.799	73%	0.734	S	S	*	*			trans	-70.3	115.7	173.1	-77.6	-166.1	141.6	0	0	110.8	T40	T40-E42 PolarHBondContact O-N 2.78Å
43	K	52.8	Low	53	Low	193 Å²	193	125.5 Å²	125.5	84%	0.839	72%	0.716	S	S	*	*			trans	-59.7	132.3	166.6	-76.8	175	178.7	171.6	0	109.1	A41 R45	A41-K43 PolarHBondContact O-N 2.63Å; K43-R45 PolarHBondContact O-N 2.73Å
44	P	55.5	Low	55.4	Low	119 Å²	119	124.1 Å²	124.1	77%	0.773	70%	0.703	S	S	*	*			trans	-63.2	124.8	-177.3	22.8	-30.5	0	0	0	110.5	L46	P44-L46 PolarHBondContact O-N 3.03Å
45	R	57.4	Low	57.9	Low	236 Å²	236	122.7 Å²	122.7	89%	0.891	69%	0.686	S	S	*	*			trans	-62.2	105.7	175.2	-76.7	179.5	169.2	164.7	-1.3	109.4	K43 R47	K43-R45 PolarHBondContact O-N 2.73Å; R45-R47 PolarHBondContact O-N 3.44Å
46	L	65.8	Low	59.5	Low	119 Å²	119	125.8 Å²	125.8	62%	0.623	68%	0.681	S	S	*	*			trans	-56.7	124	174.6	-73.8	156.7	0	0	0	109.7	P44 D50	P44-L46 PolarHBondContact O-N 3.03Å; L46-D50 HydrophobicContact CD2-CB 4.49Å
47	R	73.4	Confident	61.7	Low	193 Å²	193	128 Å²	128	73%	0.728	67%	0.67	S	S	*	*			trans	-70.8	146.6	176.4	-72.6	-163.6	-96.7	-165.3	-7.3	109.4	R45 I49 D50 L51	R45-R47 PolarHBondContact O-N 3.44Å; R47-I49 HydrophobicContact CB-CG2 4.17Å; R47-I49 PolarHBondContact O-N 3.15Å; R47-D50 WeakPolarHBondContact O-CB 3.49Å; R47-D50 PolarHBondContact O-N 3.31Å; R47-L51 PolarHBondContact O-N 2.93Å
48	A	68.8	Low	64	Low	86 Å²	86	130.4 Å²	130.4	71%	0.711	66%	0.661	S	S	*	*	H	α-helix	trans	-53.1	-27.7	-177.9	0	0	0	0	0	113.6	A52	A48-A52 WeakPolarHBondContact O-CB 3.5Å; A48-A52 PolarHBondContact O-N 3.36Å; A48-A52 VanDerWaalsContact O-N 3.1Å
49	I	77.4	Confident	66.1	Low	103 Å²	103	131.7 Å²	131.7	53%	0.528	65%	0.651	S	S	.	*	H	α-helix	trans	-68.1	-32.4	177.4	-157.1	162.2	0	0	0	113.2	R47 R53	R47-I49 HydrophobicContact CB-CG2 4.17Å; R47-I49 PolarHBondContact O-N 3.15Å; I49-R53 PolarHBondContact O-N 2.92Å; I49-R53 VanDerWaalsContact O-N 3.13Å
50	D	78.8	Confident	67.5	Low	61 Å²	61	126.6 Å²	126.6	33%	0.326	63%	0.632	S	S	.	*	H	α-helix	trans	-76.5	-36.8	-179.4	-58	-42.2	0	0	0	110.6	L46 R47 R53 K54	L46-D50 HydrophobicContact CD2-CB 4.49Å; R47-D50 WeakPolarHBondContact O-CB 3.49Å; R47-D50 PolarHBondContact O-N 3.31Å; D50-R53 PolarHBondContact O-N 2.75Å; D50-K54 PolarHBondContact O-N 2.9Å; D50-K54 VanDerWaalsContact O-N 3.11Å
51	L	74.4	Confident	68.9	Low	98 Å²	98	127.5 Å²	127.5	51%	0.513	63%	0.625	S	S	.	*	H	α-helix	trans	-64.4	-42.9	172.6	-147.2	105.1	0	0	0	111.1	R47 R53 K54 I55	R47-L51 PolarHBondContact O-N 2.93Å; L51-R53 VanDerWaalsContact C-N 3.34Å; L51-R53 PolarHBondContact O-N 3.16Å; L51-K54 PolarHBondContact O-N 3.42Å; L51-I55 HydrophobicContact CD2-CD1 4.04Å; L51-I55 WeakPolarHBondContact O-CG1 3.36Å; L51-I55 PolarHBondContact O-N 3.46Å
52	A	74.6	Confident	69.7	Low	45 Å²	45	126.2 Å²	126.2	37%	0.372	61%	0.607	S	S	.	*	H	α-helix	trans	-64.2	-35.7	178	0	0	0	0	0	112.8	A48 R56	A48-A52 WeakPolarHBondContact O-CB 3.5Å; A48-A52 PolarHBondContact O-N 3.36Å; A48-A52 VanDerWaalsContact O-N 3.1Å; A52-R56 WeakPolarHBondContact O-CG 3.17Å; A52-R56 PolarHBondContact O-N 3.01Å; A52-R56 VanDerWaalsContact O-N 3.16Å
53	R	81.6	Confident	70.3	Confident	151 Å²	151	127.5 Å²	127.5	57%	0.57	61%	0.605	S	S	*	*	H	α-helix	trans	-67.4	-44.8	173.9	-84.1	-176.3	-169.9	147.7	0.5	112.1	I49 D50 L51 I55 R56 Q57	I49-R53 PolarHBondContact O-N 2.92Å; I49-R53 VanDerWaalsContact O-N 3.13Å; D50-R53 PolarHBondContact O-N 2.75Å; L51-R53 VanDerWaalsContact C-N 3.34Å; L51-R53 PolarHBondContact O-N 3.16Å; R53-I55 PolarHBondContact O-N 3.25Å; R53-R56 PolarHBondContact O-N 2.74Å; R53-Q57 WeakPolarHBondContact O-CG 3.41Å; R53-Q57 PolarHBondContact O-N 3.06Å
54	K	81.3	Confident	70.2	Confident	126 Å²	126	121.7 Å²	121.7	55%	0.548	59%	0.588	S	S	.	*	H	α-helix	trans	-58	-47.8	176.3	-83.5	-174.9	174.2	-178.5	0	111.8	D50 L51 R56 Q57 E58	D50-K54 PolarHBondContact O-N 2.9Å; D50-K54 VanDerWaalsContact O-N 3.11Å; L51-K54 PolarHBondContact O-N 3.42Å; K54-R56 VanDerWaalsContact C-N 3.29Å; K54-R56 PolarHBondContact O-N 2.79Å; K54-Q57 PolarHBondContact O-N 2.76Å; K54-Q57 VanDerWaalsContact O-N 3.14Å; K54-E58 WeakPolarHBondContact O-CG 3.47Å; K54-E58 PolarHBondContact O-N 3.23Å
55	I	80.3	Confident	70.1	Confident	76 Å²	76	121.9 Å²	121.9	39%	0.39	58%	0.579	S	S	.	*	H	α-helix	trans	-61.4	-37.6	178.6	-66.6	167.1	0	0	0	111.7	L51 R53 K59	L51-I55 HydrophobicContact CD2-CD1 4.04Å; L51-I55 WeakPolarHBondContact O-CG1 3.36Å; L51-I55 PolarHBondContact O-N 3.46Å; R53-I55 PolarHBondContact O-N 3.25Å; I55-K59 HydrophobicContact CG2-CD 4.43Å; I55-K59 WeakPolarHBondContact O-CB 3.03Å; I55-K59 WeakPolarHBondContact O-CG 3.31Å; I55-K59 PolarHBondContact O-N 3.25Å
56	R	78.3	Confident	69.5	Low	195 Å²	195	114.2 Å²	114.2	74%	0.736	56%	0.558	S	S	*	*	H	α-helix	trans	-68.9	-39	176.7	-77.8	179.4	-179.4	177.9	1.7	112.4	A52 R53 K54 A60	A52-R56 WeakPolarHBondContact O-CG 3.17Å; A52-R56 PolarHBondContact O-N 3.01Å; A52-R56 VanDerWaalsContact O-N 3.16Å; R53-R56 PolarHBondContact O-N 2.74Å; K54-R56 VanDerWaalsContact C-N 3.29Å; K54-R56 PolarHBondContact O-N 2.79Å; R56-A60 WeakPolarHBondContact O-CB 3.21Å; R56-A60 PolarHBondContact O-N 3.37Å
57	Q	76.5	Confident	68.6	Low	127 Å²	127	119.2 Å²	119.2	59%	0.593	57%	0.569	S	S	*	*	H	α-helix	trans	-70.6	-40.2	177.9	-73.2	175.4	-14.3	0	0	112	R53 K54 A60 K61	R53-Q57 WeakPolarHBondContact O-CG 3.41Å; R53-Q57 PolarHBondContact O-N 3.06Å; K54-Q57 PolarHBondContact O-N 2.76Å; K54-Q57 VanDerWaalsContact O-N 3.14Å; Q57-A60 PolarHBondContact O-N 2.86Å; Q57-K61 PolarHBondContact O-N 3.06Å
58	E	75.9	Confident	67.2	Low	123 Å²	123	116 Å²	116	58%	0.575	57%	0.571	S	S	*	*	H	α-helix	trans	-61.6	-49.5	172.4	-75.5	177.2	174	0	0	110.5	K54 A60 K61 T62	K54-E58 WeakPolarHBondContact O-CG 3.47Å; K54-E58 PolarHBondContact O-N 3.23Å; E58-A60 VanDerWaalsContact C-N 3.25Å; E58-A60 PolarHBondContact O-N 2.75Å; E58-K61 PolarHBondContact O-N 2.9Å; E58-K61 VanDerWaalsContact O-N 3.14Å; E58-T62 PolarHBondContact O-N 2.91Å; E58-T62 PolarHBondContact O-OG1 3.14Å
59	K	74.3	Confident	66.1	Low	149 Å²	149	120.1 Å²	120.1	65%	0.648	58%	0.575	S	S	*	*	H	α-helix	trans	-59.4	-34.1	174.8	-79.3	-176.1	176.7	-178.6	0	113.3	I55 R63	I55-K59 HydrophobicContact CG2-CD 4.43Å; I55-K59 WeakPolarHBondContact O-CB 3.03Å; I55-K59 WeakPolarHBondContact O-CG 3.31Å; I55-K59 PolarHBondContact O-N 3.25Å; K59-R63 WeakPolarHBondContact O-CB 3.47Å; K59-R63 PolarHBondContact O-N 2.91Å
60	A	68.8	Low	64.4	Low	58 Å²	58	120.9 Å²	120.9	48%	0.479	58%	0.581	S	S	.	*	H	α-helix	trans	-70	-42.2	176.6	0	0	0	0	0	111.8	R56 Q57 E58 R63 S64	R56-A60 WeakPolarHBondContact O-CB 3.21Å; R56-A60 PolarHBondContact O-N 3.37Å; Q57-A60 PolarHBondContact O-N 2.86Å; E58-A60 VanDerWaalsContact C-N 3.25Å; E58-A60 PolarHBondContact O-N 2.75Å; A60-R63 PolarHBondContact O-N 2.77Å; A60-S64 PolarHBondContact O-N 3.25Å; A60-S64 PolarHBondContact O-OG 3.2Å
61	K	66.4	Low	62.8	Low	142 Å²	142	129.6 Å²	129.6	62%	0.617	61%	0.609	S	S	*	*	H	α-helix	trans	-65	-46.1	174.8	-79.6	-174.6	173.7	-173.7	0	112.3	Q57 E58 R63 S64 E65	Q57-K61 PolarHBondContact O-N 3.06Å; E58-K61 PolarHBondContact O-N 2.9Å; E58-K61 VanDerWaalsContact O-N 3.14Å; K61-R63 PolarHBondContact O-N 3.21Å; K61-S64 WeakPolarHBondContact CA-OG 3.42Å; K61-S64 PolarHBondContact O-N 3.33Å; K61-S64 PolarHBondContact O-OG 3.42Å; K61-E65 WeakPolarHBondContact O-CG 3.47Å; K61-E65 PolarHBondContact O-N 3.31Å
62	T	58.6	Low	61.9	Low	79 Å²	79	131.2 Å²	131.2	49%	0.485	62%	0.618	S	S	.	*	H	α-helix	trans	-59.8	-38.9	175.2	-39.9	0	0	0	0	110.5	E58 E65 T66	E58-T62 PolarHBondContact O-N 2.91Å; E58-T62 PolarHBondContact O-OG1 3.14Å; T62-E65 PolarHBondContact O-N 3.46Å; T62-T66 WeakPolarHBondContact O-CB 3.43Å; T62-T66 PolarHBondContact O-N 3.15Å; T62-T66 PolarHBondContact O-OG1 3.25Å
63	R	55.6	Low	61	Low	199 Å²	199	133.8 Å²	133.8	75%	0.751	63%	0.631	S	S	*	*	H	α-helix	trans	-73.8	-27	-179.4	-155.8	176.9	-164	-173.9	2.9	113.5	K59 A60 K61	K59-R63 WeakPolarHBondContact O-CB 3.47Å; K59-R63 PolarHBondContact O-N 2.91Å; A60-R63 PolarHBondContact O-N 2.77Å; K61-R63 PolarHBondContact O-N 3.21Å
64	S	50.7	Low	60	Low	71 Å²	71	132.9 Å²	132.9	50%	0.497	64%	0.644	S	S	.	*	H	α-helix	trans	-75.8	-37.4	169.9	53.8	0	0	0	0	112.2	A60 K61 R67 T68	A60-S64 PolarHBondContact O-N 3.25Å; A60-S64 PolarHBondContact O-OG 3.2Å; K61-S64 WeakPolarHBondContact CA-OG 3.42Å; K61-S64 PolarHBondContact O-N 3.33Å; K61-S64 PolarHBondContact O-OG 3.42Å; S64-R67 PolarHBondContact O-N 3.01Å; S64-T68 PolarHBondContact O-OG1 3.1Å
65	E	53.1	Low	59.2	Low	123 Å²	123	129.6 Å²	129.6	58%	0.575	64%	0.635	S	S	*	*	H	α-helix	trans	-71.7	-34.7	177.1	-72.2	167.3	-179.4	0	0	112.5	K61 T62 R67 T68	K61-E65 WeakPolarHBondContact O-CG 3.47Å; K61-E65 PolarHBondContact O-N 3.31Å; T62-E65 PolarHBondContact O-N 3.46Å; E65-R67 VanDerWaalsContact C-N 3.28Å; E65-R67 PolarHBondContact O-N 3.3Å; E65-T68 PolarHBondContact O-OG1 2.8Å
66	T	45.7	Very low	59.1	Low	75 Å²	75	128.7 Å²	128.7	46%	0.46	64%	0.635	S	S	.	*	H	α-helix	trans	-70.1	-26.5	175.9	-42.1	0	0	0	0	111.8	T62 T68	T62-T66 WeakPolarHBondContact O-CB 3.43Å; T62-T66 PolarHBondContact O-N 3.15Å; T62-T66 PolarHBondContact O-OG1 3.25Å; T66-T68 VanDerWaalsContact C-N 3.34Å; T66-T68 PolarHBondContact O-N 3.16Å
67	R	45.9	Very low	59.1	Low	223 Å²	223	121.8 Å²	121.8	84%	0.842	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-18.8	-176.7	-115.7	179.2	172.8	-176.4	-3.9	113.9	S64 E65	S64-R67 PolarHBondContact O-N 3.01Å; E65-R67 VanDerWaalsContact C-N 3.28Å; E65-R67 PolarHBondContact O-N 3.3Å
68	T	45.1	Very low	59.1	Low	125 Å²	125	116.3 Å²	116.3	77%	0.767	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-8.2	178.5	26.1	0	0	0	0	113.8	S64 E65 T66	S64-T68 PolarHBondContact O-OG1 3.1Å; E65-T68 PolarHBondContact O-OG1 2.8Å; T66-T68 VanDerWaalsContact C-N 3.34Å; T66-T68 PolarHBondContact O-N 3.16Å
69	Q	45.4	Very low	59.4	Low	174 Å²	174	114.9 Å²	114.9	81%	0.813	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	-14.2	179.7	-74.2	-172.5	-14	0	0	115.6	R71	Q69-R71 PolarHBondContact O-N 2.84Å
70	D	41.7	Very low	59.8	Low	119 Å²	119	113.2 Å²	113.2	64%	0.636	59%	0.589	S	S	*	*			trans	-96.8	75.5	-179.4	-104.7	-6.1	0	0	0	112.3
71	R	45.8	Very low	60.5	Low	243 Å²	243	111.2 Å²	111.2	92%	0.917	57%	0.569	S	S	*	*			trans	-123	79.6	151	-79.2	-165.6	179.9	-170	2	107.7	Q69	Q69-R71 PolarHBondContact O-N 2.84Å
72	D	54.6	Low	61.4	Low	132 Å²	132	104.9 Å²	104.9	71%	0.706	54%	0.542	S	S	*	.			trans	-51.1	135.1	168.9	-82.3	-35.4	0	0	0	109.8
73	P	56.6	Low	62.7	Low	100 Å²	100	105.5 Å²	105.5	65%	0.649	55%	0.546	S	S	*	.			trans	-59.2	153.6	174.7	24.1	-31.9	0	0	0	110.4	V75	P73-V75 PolarHBondContact O-N 2.85Å
74	P	58.7	Low	64	Low	131 Å²	131	98.6 Å²	98.6	85%	0.851	52%	0.522	S	S	*	.			trans	-57.6	111.1	179.6	22.5	-31.3	0	0	0	109.8	S76	P74-S76 PolarHBondContact O-N 3.28Å
75	V	65.1	Low	65.5	Low	58 Å²	58	95.2 Å²	95.2	35%	0.352	50%	0.498	S	S	.	.			trans	-60	126.6	-177.9	-176.5	0	0	0	0	108.5	P73 Q79 Q80	P73-V75 PolarHBondContact O-N 2.85Å; V75-Q79 HydrophobicContact CG1-CB 3.27Å; V75-Q79 HydrophobicContact CG1-CG 4.42Å; V75-Q80 HydrophobicContact CB-CG 3.76Å; V75-Q80 HydrophobicContact CG1-CB 4.46Å; V75-Q80 HydrophobicContact CG1-CG 3.66Å; V75-Q80 WeakPolarHBondContact O-CG 3.32Å; V75-Q80 PolarHBondContact O-NE2 2.86Å
76	S	79.5	Confident	67	Low	56 Å²	56	94.1 Å²	94.1	39%	0.392	49%	0.492	S	S	.	.			trans	-53.6	148.1	176.2	162.3	0	0	0	0	110.8	P74 S78 Q79 Q80	P74-S76 PolarHBondContact O-N 3.28Å; S76-S78 PolarHBondContact O-N 2.77Å; S76-S78 VanDerWaalsContact O-N 3.1Å; S76-S78 PolarHBondContact OG-N 3.02Å; S76-S78 PolarHBondContact OG-OG 2.76Å; S76-Q79 VanDerWaalsContact N-OE1 3.08Å; S76-Q79 WeakPolarHBondContact O-CA 3.34Å; S76-Q79 WeakPolarHBondContact O-CB 3.3Å; S76-Q79 PolarHBondContact O-N 2.94Å; S76-Q80 WeakPolarHBondContact O-CG 3.27Å; S76-Q80 PolarHBondContact O-N 2.81Å
77	G	77.9	Confident	68.8	Low	51 Å²	51	100.3 Å²	100.3	53%	0.526	51%	0.507	S	S	.	.	H	α-helix	trans	-52.5	-35.4	178.2	0	0	0	0	0	113.4	R81	G77-R81 WeakPolarHBondContact O-CB 3.33Å; G77-R81 PolarHBondContact O-N 2.84Å; G77-R81 VanDerWaalsContact O-N 3.09Å
78	S	75.6	Confident	70.3	Confident	12 Å²	12	92.7 Å²	92.7	8%	0.084	48%	0.48	C	S	.	.	H	α-helix	trans	-68.8	-40.2	175.9	64.9	0	0	0	0	112.3	S76 R81 V82 E326	S76-S78 PolarHBondContact O-N 2.77Å; S76-S78 VanDerWaalsContact O-N 3.1Å; S76-S78 PolarHBondContact OG-N 3.02Å; S76-S78 PolarHBondContact OG-OG 2.76Å; S78-R81 PolarHBondContact O-N 3.16Å; S78-V82 WeakPolarHBondContact O-CG2 3.24Å; S78-V82 PolarHBondContact O-N 2.83Å; S78-V82 VanDerWaalsContact O-N 3.08Å; S78-E326 WeakPolarHBondContact CB-OE1 3.32Å; S78-E326 PolarHBondContact OG-OE1 2.9Å
79	Q	82.4	Confident	71.7	Confident	93 Å²	93	87.8 Å²	87.8	44%	0.435	45%	0.45	S	S	.	.	H	α-helix	trans	-69.1	-41.3	176.5	-72	169.7	-20.1	0	0	111.6	V75 S76 R81 V82 T83	V75-Q79 HydrophobicContact CG1-CB 3.27Å; V75-Q79 HydrophobicContact CG1-CG 4.42Å; S76-Q79 VanDerWaalsContact N-OE1 3.08Å; S76-Q79 WeakPolarHBondContact O-CA 3.34Å; S76-Q79 WeakPolarHBondContact O-CB 3.3Å; S76-Q79 PolarHBondContact O-N 2.94Å; Q79-R81 VanDerWaalsContact C-N 3.25Å; Q79-R81 PolarHBondContact O-N 3.48Å; Q79-V82 PolarHBondContact O-N 3.44Å; Q79-T83 PolarHBondContact O-N 3.12Å; Q79-T83 PolarHBondContact O-OG1 2.85Å; Q79-T83 VanDerWaalsContact O-OG1 3.1Å
80	Q	83.6	Confident	73	Confident	114 Å²	114	82 Å²	82	53%	0.533	43%	0.432	S	S	.	.	H	α-helix	trans	-57.9	-42.7	174.1	-67.6	-179	9.4	0	0	110.6	V75 S76 V82 T83 E84	V75-Q80 HydrophobicContact CB-CG 3.76Å; V75-Q80 HydrophobicContact CG1-CB 4.46Å; V75-Q80 HydrophobicContact CG1-CG 3.66Å; V75-Q80 WeakPolarHBondContact O-CG 3.32Å; V75-Q80 PolarHBondContact O-NE2 2.86Å; S76-Q80 WeakPolarHBondContact O-CG 3.27Å; S76-Q80 PolarHBondContact O-N 2.81Å; Q80-V82 PolarHBondContact O-N 2.9Å; Q80-T83 PolarHBondContact O-N 3.34Å; Q80-E84 WeakPolarHBondContact O-CB 3.39Å; Q80-E84 PolarHBondContact O-N 3.3Å
81	R	83.6	Confident	74.3	Confident	15 Å²	15	82 Å²	82	6%	0.057	43%	0.428	C	S	.	.	H	α-helix	trans	-63.6	-41.8	177.6	-176	57	179.6	166.8	3.8	112.7	G77 S78 Q79 E84 L85 L325	G77-R81 WeakPolarHBondContact O-CB 3.33Å; G77-R81 PolarHBondContact O-N 2.84Å; G77-R81 VanDerWaalsContact O-N 3.09Å; S78-R81 PolarHBondContact O-N 3.16Å; Q79-R81 VanDerWaalsContact C-N 3.25Å; Q79-R81 PolarHBondContact O-N 3.48Å; R81-E84 WeakPolarHBondContact CD-OE2 3.42Å; R81-E84 IonicContact CZ-OE2 2.51Å; R81-E84 IonicContact NE-OE2 3.34Å; R81-E84 VanDerWaalsContact NH1-CD 3.32Å; R81-E84 IonicContact NH1-OE1 3.63Å; R81-E84 IonicContact NH1-OE2 3.75Å; R81-E84 PolarHBondContact NH1-OE2 3.37Å; R81-E84 WeakPolarHBondContact O-CB 3.49Å; R81-E84 PolarHBondContact O-N 3.35Å; R81-L85 WeakPolarHBondContact O-CG 3.29Å; R81-L85 PolarHBondContact O-N 2.93Å; R81-L325 HydrophobicContact CB-CD2 4.04Å; R81-L325 HydrophobicContact CG-CD2 3.62Å; R81-L325 HydrophobicContact CG-CG 4.07Å
82	V	83.9	Confident	75.8	Confident	9 Å²	9	72 Å²	72	6%	0.055	39%	0.393	C	S	.	.	H	α-helix	trans	-62.3	-44.4	175	170.9	0	0	0	0	111.1	S78 Q79 Q80 E84 L85 K86 L325 K329 Y332	S78-V82 WeakPolarHBondContact O-CG2 3.24Å; S78-V82 PolarHBondContact O-N 2.83Å; S78-V82 VanDerWaalsContact O-N 3.08Å; Q79-V82 PolarHBondContact O-N 3.44Å; Q80-V82 PolarHBondContact O-N 2.9Å; V82-E84 VanDerWaalsContact C-N 3.28Å; V82-E84 PolarHBondContact O-N 3.49Å; V82-L85 PolarHBondContact O-N 3.2Å; V82-K86 HydrophobicContact CG1-CD 4.04Å; V82-K86 HydrophobicContact CG1-CG 4.39Å; V82-K86 WeakPolarHBondContact O-CB 3.01Å; V82-K86 VanDerWaalsContact O-CG 3.31Å; V82-K86 WeakPolarHBondContact O-CG 3.39Å; V82-K86 PolarHBondContact O-N 3.33Å; V82-L325 HydrophobicContact CG2-CD2 4.11Å; V82-K329 HydrophobicContact CG2-CB 3.63Å; V82-K329 HydrophobicContact CG2-CD 4.19Å; V82-K329 HydrophobicContact CG2-CG 3.9Å; V82-Y332 HydrophobicContact CB-CD2 4.45Å; V82-Y332 HydrophobicContact CG1-CD1 4.45Å; V82-Y332 HydrophobicContact CG1-CD2 3.53Å; V82-Y332 HydrophobicContact CG1-CE2 3.97Å; V82-Y332 HydrophobicContact CG1-CG 3.8Å; V82-Y332 HydrophobicContact CG2-CD2 3.99Å
83	T	85.6	Confident	76.9	Confident	93 Å²	93	66.8 Å²	66.8	57%	0.571	36%	0.364	S	S	*	.	H	α-helix	trans	-60.7	-40.8	177.1	-59.6	0	0	0	0	111.3	Q79 Q80 R87	Q79-T83 PolarHBondContact O-N 3.12Å; Q79-T83 PolarHBondContact O-OG1 2.85Å; Q79-T83 VanDerWaalsContact O-OG1 3.1Å; Q80-T83 PolarHBondContact O-N 3.34Å; T83-R87 WeakPolarHBondContact O-CB 3.39Å; T83-R87 PolarHBondContact O-N 2.8Å
84	E	84.3	Confident	78.1	Confident	53 Å²	53	67.1 Å²	67.1	25%	0.248	36%	0.36	C	S	.	.	H	α-helix	trans	-64.1	-47.5	175.8	-176.6	-174	-163	0	0	112.5	Q80 R81 V82 R87 F88 K364	Q80-E84 WeakPolarHBondContact O-CB 3.39Å; Q80-E84 PolarHBondContact O-N 3.3Å; R81-E84 WeakPolarHBondContact CD-OE2 3.42Å; R81-E84 IonicContact CZ-OE2 2.51Å; R81-E84 IonicContact NE-OE2 3.34Å; R81-E84 VanDerWaalsContact NH1-CD 3.32Å; R81-E84 IonicContact NH1-OE1 3.63Å; R81-E84 IonicContact NH1-OE2 3.75Å; R81-E84 PolarHBondContact NH1-OE2 3.37Å; R81-E84 WeakPolarHBondContact O-CB 3.49Å; R81-E84 PolarHBondContact O-N 3.35Å; V82-E84 VanDerWaalsContact C-N 3.28Å; V82-E84 PolarHBondContact O-N 3.49Å; E84-R87 WeakPolarHBondContact O-CB 3.48Å; E84-R87 PolarHBondContact O-N 2.99Å; E84-F88 HydrophobicContact CG-CD2 3.93Å; E84-F88 HydrophobicContact CG-CE2 3.37Å; E84-F88 HydrophobicContact CG-CZ 4.12Å; E84-F88 VanDerWaalsContact O-CD2 3.3Å; E84-F88 WeakPolarHBondContact O-CD2 3.44Å; E84-F88 PolarHBondContact O-N 3.24Å; E84-F88 WeakPolarHBondContact OE1-CE2 3.29Å; E84-K364 WeakPolarHBondContact OE1-CD 3.34Å; E84-K364 WeakPolarHBondContact OE1-CE 3.42Å; E84-K364 IonicContact OE1-NZ 2.8Å; E84-K364 PolarHBondContact OE1-NZ 3.5Å
85	L	81.7	Confident	79.5	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-59	-49	176	-73.9	174	0	0	0	110.8	R81 V82 R87 F88 T89 L325 L333	R81-L85 WeakPolarHBondContact O-CG 3.29Å; R81-L85 PolarHBondContact O-N 2.93Å; V82-L85 PolarHBondContact O-N 3.2Å; L85-R87 PolarHBondContact O-N 2.95Å; L85-F88 PolarHBondContact O-N 3.41Å; L85-T89 WeakPolarHBondContact O-CG2 3.45Å; L85-T89 PolarHBondContact O-N 2.82Å; L85-T89 PolarHBondContact O-OG1 3.15Å; L85-L325 HydrophobicContact CD1-CD1 4.18Å; L85-L333 HydrophobicContact CD1-CD2 3.95Å
86	K	83.4	Confident	80.6	Confident	101 Å²	101	65.6 Å²	65.6	44%	0.439	34%	0.34	S	S	.	.	H	α-helix	trans	-56.8	-36	176.2	-74.8	178.3	177.8	-179	0	112.6	V82 T89 A90 Y332	V82-K86 HydrophobicContact CG1-CD 4.04Å; V82-K86 HydrophobicContact CG1-CG 4.39Å; V82-K86 WeakPolarHBondContact O-CB 3.01Å; V82-K86 VanDerWaalsContact O-CG 3.31Å; V82-K86 WeakPolarHBondContact O-CG 3.39Å; V82-K86 PolarHBondContact O-N 3.33Å; K86-T89 CarbonylContact O-C 3.18Å; K86-A90 WeakPolarHBondContact O-CA 3.39Å; K86-A90 PolarHBondContact O-N 3.11Å; K86-A90 VanDerWaalsContact O-N 3.09Å; K86-Y332 VanDerWaalsContact CE-CD1 3.44Å; K86-Y332 VanDerWaalsContact CE-CE1 3.41Å
87	R	83.9	Confident	81.1	Confident	205 Å²	205	65 Å²	65	77%	0.774	34%	0.335	S	S	*	.	H	α-helix	trans	-68.6	-39.8	175.9	-175	-179.9	178.5	-179.7	1.1	112	T83 E84 L85 A90	T83-R87 WeakPolarHBondContact O-CB 3.39Å; T83-R87 PolarHBondContact O-N 2.8Å; E84-R87 WeakPolarHBondContact O-CB 3.48Å; E84-R87 PolarHBondContact O-N 2.99Å; L85-R87 PolarHBondContact O-N 2.95Å; R87-A90 WeakPolarHBondContact O-CB 3.31Å; R87-A90 PolarHBondContact O-N 3.15Å
88	F	77.1	Confident	81.7	Confident	62 Å²	62	66.1 Å²	66.1	27%	0.272	33%	0.329	S	S	.	.	H	α-helix	trans	-74.4	-28.6	177	-68	-46.4	0	0	0	113.4	E84 L85 A90 K360 K364	E84-F88 HydrophobicContact CG-CD2 3.93Å; E84-F88 HydrophobicContact CG-CE2 3.37Å; E84-F88 HydrophobicContact CG-CZ 4.12Å; E84-F88 VanDerWaalsContact O-CD2 3.3Å; E84-F88 WeakPolarHBondContact O-CD2 3.44Å; E84-F88 PolarHBondContact O-N 3.24Å; E84-F88 WeakPolarHBondContact OE1-CE2 3.29Å; L85-F88 PolarHBondContact O-N 3.41Å; F88-A90 VanDerWaalsContact C-N 3.3Å; F88-K360 HydrophobicContact CD1-CB 3.96Å; F88-K360 HydrophobicContact CD1-CD 4.34Å; F88-K360 HydrophobicContact CE1-CB 3.96Å; F88-K360 HydrophobicContact CE1-CD 3.94Å; F88-K360 HydrophobicContact CG-CB 4.45Å; F88-K360 HydrophobicContact CZ-CB 4.42Å; F88-K364 HydrophobicContact CE2-CD 3.6Å; F88-K364 HydrophobicContact CZ-CD 4.09Å
89	T	74.6	Confident	82.5	Confident	23 Å²	23	69.2 Å²	69.2	14%	0.141	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	26.8	176.2	68.8	0	0	0	0	110.9	L85 K86 Q91 Y122 P334	L85-T89 WeakPolarHBondContact O-CG2 3.45Å; L85-T89 PolarHBondContact O-N 2.82Å; L85-T89 PolarHBondContact O-OG1 3.15Å; K86-T89 CarbonylContact O-C 3.18Å; T89-Q91 PolarHBondContact O-N 3.47Å; T89-Q91 VanDerWaalsContact O-N 3.16Å; T89-Y122 HydrophobicContact CG2-CD1 3.96Å; T89-Y122 HydrophobicContact CG2-CE1 4.09Å; T89-P334 HydrophobicContact CG2-CB 3.58Å; T89-P334 HydrophobicContact CG2-CG 3.7Å
90	A	72.6	Confident	83	Confident	52 Å²	52	64.8 Å²	64.8	43%	0.43	33%	0.327	S	S	.	.			trans	-52.3	127	-178.9	0	0	0	0	0	108.7	K86 R87 F88 L92	K86-A90 WeakPolarHBondContact O-CA 3.39Å; K86-A90 PolarHBondContact O-N 3.11Å; K86-A90 VanDerWaalsContact O-N 3.09Å; R87-A90 WeakPolarHBondContact O-CB 3.31Å; R87-A90 PolarHBondContact O-N 3.15Å; F88-A90 VanDerWaalsContact C-N 3.3Å; A90-L92 VanDerWaalsContact C-N 3.31Å; A90-L92 PolarHBondContact O-N 3.45Å
91	Q	69.9	Low	83.4	Confident	118 Å²	118	59.4 Å²	59.4	55%	0.551	30%	0.301	S	S	*	.			trans	-71.1	86.8	-170.5	-71.6	-175.1	-11.9	0	0	110	T89 Q93 N94	T89-Q91 PolarHBondContact O-N 3.47Å; T89-Q91 VanDerWaalsContact O-N 3.16Å; Q91-Q93 HydrophobicContact CB-CG 3.98Å; Q91-Q93 PolarHBondContact O-N 3.26Å; Q91-N94 PolarHBondContact O-N 3.31Å
92	L	78.3	Confident	83.9	Confident	35 Å²	35	64.4 Å²	64.4	18%	0.183	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	0.5	172	-67.3	179.4	0	0	0	112.8	A90 V95 L100 P121 V124	A90-L92 VanDerWaalsContact C-N 3.31Å; A90-L92 PolarHBondContact O-N 3.45Å; L92-V95 HydrophobicContact CD2-CG1 4.22Å; L92-V95 WeakPolarHBondContact O-CG2 3.4Å; L92-L100 HydrophobicContact CB-CD1 4.33Å; L92-P121 HydrophobicContact CD1-CB 3.83Å; L92-P121 HydrophobicContact CD1-CG 3.72Å; L92-V124 HydrophobicContact CB-CG2 3.67Å
93	Q	75.9	Confident	84.3	Confident	21 Å²	21	67.1 Å²	67.1	10%	0.098	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-20.6	178.9	82.8	-141	35.1	0	0	112.4	Q91 G123 V132 T133	Q91-Q93 HydrophobicContact CB-CG 3.98Å; Q91-Q93 PolarHBondContact O-N 3.26Å; Q93-G123 PolarHBondContact OE1-O 3.3Å; Q93-G123 VanDerWaalsContact OE1-O 3.12Å; Q93-V132 HydrophobicContact CB-CG1 3.34Å; Q93-V132 HydrophobicContact CG-CG1 3.75Å; Q93-V132 WeakPolarHBondContact O-CG1 3.45Å; Q93-T133 VanDerWaalsContact O-CB 3.3Å; Q93-T133 WeakPolarHBondContact O-CB 3.39Å; Q93-T133 PolarHBondContact O-N 3.38Å; Q93-T133 PolarHBondContact O-OG1 3.32Å
94	N	83.4	Confident	84.7	Confident	107 Å²	107	62.7 Å²	62.7	57%	0.572	31%	0.309	S	S	*	.	S	Bend	trans	-108.5	11.6	-179.8	-61.6	-23.9	0	0	0	112.8	Q91	Q91-N94 PolarHBondContact O-N 3.31Å
95	V	86.7	Confident	85.2	Confident	39 Å²	39	63.4 Å²	63.4	24%	0.236	31%	0.311	C	S	.	.	S	Bend	trans	-89.7	158.6	178.1	-54.2	0	0	0	0	110	L92 V99 L100 T133	L92-V95 HydrophobicContact CD2-CG1 4.22Å; L92-V95 WeakPolarHBondContact O-CG2 3.4Å; V95-V99 HydrophobicContact CB-CB 4.28Å; V95-V99 HydrophobicContact CB-CG1 4.34Å; V95-V99 HydrophobicContact CG2-CB 4.05Å; V95-V99 HydrophobicContact CG2-CG1 4.19Å; V95-L100 HydrophobicContact CG2-CB 4.12Å; V95-T133 PolarHBondContact O-OG1 2.87Å
96	H	89.1	Confident	85.8	Confident	118 Å²	118	73.2 Å²	73.2	55%	0.546	35%	0.349	S	S	.	.			trans	-57.1	137.8	174.2	-173.6	-74.8	0	0	0	111	N98 V99 L100	H96-N98 VanDerWaalsContact C-N 3.29Å; H96-N98 PolarHBondContact CE1-ND2 3.37Å; H96-N98 PolarHBondContact ND1-N 3.12Å; H96-N98 VanDerWaalsContact ND1-N 3.2Å; H96-N98 PolarHBondContact O-N 3.44Å; H96-N98 VanDerWaalsContact O-N 3.09Å; H96-V99 HydrophobicContact CB-CG2 4.22Å; H96-V99 WeakPolarHBondContact O-CA 3.46Å; H96-V99 WeakPolarHBondContact O-CB 3.48Å; H96-V99 PolarHBondContact O-N 2.89Å; H96-L100 PolarHBondContact O-N 2.99Å
97	P	89.4	Confident	86.3	Confident	45 Å²	45	70.1 Å²	70.1	29%	0.292	34%	0.338	S	S	.	.	H	α-helix	trans	-46.4	-44.9	-177.7	-33.8	36.6	0	0	0	114.9	V99 L100 A101 T133 V138	P97-V99 VanDerWaalsContact C-N 3.25Å; P97-V99 PolarHBondContact O-N 3.48Å; P97-L100 PolarHBondContact O-N 3.42Å; P97-L100 VanDerWaalsContact O-N 3.15Å; P97-A101 PolarHBondContact O-N 2.88Å; P97-T133 HydrophobicContact CB-CG2 4.45Å; P97-T133 HydrophobicContact CG-CG2 4.29Å; P97-V138 HydrophobicContact CB-CG1 3.93Å; P97-V138 WeakPolarHBondContact O-CG1 3.41Å
98	N	90.8	Very high	86.8	Confident	73 Å²	73	63 Å²	63	39%	0.39	32%	0.315	S	S	.	.	H	α-helix	trans	-59.4	-29	176.5	-67	-17.5	0	0	0	114.8	H96 K102	H96-N98 VanDerWaalsContact C-N 3.29Å; H96-N98 PolarHBondContact CE1-ND2 3.37Å; H96-N98 PolarHBondContact ND1-N 3.12Å; H96-N98 VanDerWaalsContact ND1-N 3.2Å; H96-N98 PolarHBondContact O-N 3.44Å; H96-N98 VanDerWaalsContact O-N 3.09Å; N98-K102 WeakPolarHBondContact O-CB 3.37Å; N98-K102 VanDerWaalsContact O-CG 3.24Å; N98-K102 WeakPolarHBondContact O-CG 3.42Å; N98-K102 PolarHBondContact O-N 2.89Å
99	V	92.6	Very high	87.7	Confident	78 Å²	78	62.4 Å²	62.4	47%	0.473	32%	0.315	S	S	.	.	H	α-helix	trans	-71.4	-44.6	176.9	178	0	0	0	0	109.7	V95 H96 P97 K102 H103	V95-V99 HydrophobicContact CB-CB 4.28Å; V95-V99 HydrophobicContact CB-CG1 4.34Å; V95-V99 HydrophobicContact CG2-CB 4.05Å; V95-V99 HydrophobicContact CG2-CG1 4.19Å; H96-V99 HydrophobicContact CB-CG2 4.22Å; H96-V99 WeakPolarHBondContact O-CA 3.46Å; H96-V99 WeakPolarHBondContact O-CB 3.48Å; H96-V99 PolarHBondContact O-N 2.89Å; P97-V99 VanDerWaalsContact C-N 3.25Å; P97-V99 PolarHBondContact O-N 3.48Å; V99-K102 PolarHBondContact O-N 3.39Å; V99-H103 PolarHBondContact O-N 2.87Å
100	L	91.9	Very high	88.7	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64.7	-44.2	175.4	178.4	63.9	0	0	0	111.2	L92 V95 H96 P97 K102 H103 L104 P121 V124 T133 V138	L92-L100 HydrophobicContact CB-CD1 4.33Å; V95-L100 HydrophobicContact CG2-CB 4.12Å; H96-L100 PolarHBondContact O-N 2.99Å; P97-L100 PolarHBondContact O-N 3.42Å; P97-L100 VanDerWaalsContact O-N 3.15Å; L100-K102 VanDerWaalsContact C-N 3.34Å; L100-K102 PolarHBondContact O-N 3.08Å; L100-H103 WeakPolarHBondContact O-CB 3.5Å; L100-H103 PolarHBondContact O-N 3.17Å; L100-H103 VanDerWaalsContact O-N 3.08Å; L100-L104 HydrophobicContact CD1-CD1 4.36Å; L100-L104 HydrophobicContact CD1-CG 4.22Å; L100-L104 HydrophobicContact CG-CD1 4.17Å; L100-L104 HydrophobicContact CG-CG 4.43Å; L100-L104 WeakPolarHBondContact O-CG 3.45Å; L100-L104 PolarHBondContact O-N 3.06Å; L100-P121 HydrophobicContact CD1-CG 4.48Å; L100-V124 HydrophobicContact CD1-CG1 4.32Å; L100-V124 HydrophobicContact CD1-CG2 4.2Å; L100-V124 HydrophobicContact CD2-CG1 3.9Å; L100-T133 HydrophobicContact CB-CG2 4.45Å; L100-T133 HydrophobicContact CD2-CG2 3.71Å; L100-V138 HydrophobicContact CB-CG1 4.18Å; L100-V138 HydrophobicContact CD2-CG1 3.94Å; L100-V138 HydrophobicContact CD2-CG2 4.05Å; L100-V138 HydrophobicContact CG-CG1 4.25Å; L100-V138 HydrophobicContact CG-CG2 4.18Å
101	A	93.1	Very high	89.6	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-57	-45.8	175.4	0	0	0	0	0	111.9	P97 H103 L104 H105 V138 V141 M145	P97-A101 PolarHBondContact O-N 2.88Å; A101-H103 VanDerWaalsContact C-N 3.32Å; A101-H103 PolarHBondContact O-N 2.51Å; A101-L104 PolarHBondContact O-N 3.22Å; A101-H105 WeakPolarHBondContact O-CB 3.41Å; A101-H105 PolarHBondContact O-N 3.33Å; A101-V138 HydrophobicContact CB-CB 4.17Å; A101-V141 HydrophobicContact CB-CB 4.08Å; A101-V141 HydrophobicContact CB-CG1 3.73Å; A101-M145 HydrophobicContact CB-SD 4.1Å
102	K	93.7	Very high	90.5	Very high	120 Å²	120	62.4 Å²	62.4	52%	0.522	30%	0.299	S	S	.	.	H	α-helix	trans	-62.3	-36.8	174.9	-76.7	173.1	-178.4	-179.3	0	112.8	N98 V99 L100 R106 M145	N98-K102 WeakPolarHBondContact O-CB 3.37Å; N98-K102 VanDerWaalsContact O-CG 3.24Å; N98-K102 WeakPolarHBondContact O-CG 3.42Å; N98-K102 PolarHBondContact O-N 2.89Å; V99-K102 PolarHBondContact O-N 3.39Å; L100-K102 VanDerWaalsContact C-N 3.34Å; L100-K102 PolarHBondContact O-N 3.08Å; K102-R106 VanDerWaalsContact O-CG 3.27Å; K102-R106 WeakPolarHBondContact O-CG 3.34Å; K102-R106 PolarHBondContact O-N 3.35Å; K102-R106 VanDerWaalsContact O-N 3.16Å; K102-M145 HydrophobicContact CG-CE 3.92Å; K102-M145 HydrophobicContact CG-SD 4.36Å
103	H	93.4	Very high	91	Very high	66 Å²	66	69 Å²	69	31%	0.306	33%	0.326	S	S	.	.	H	α-helix	trans	-66.4	-48.8	175.9	-179.8	81.2	0	0	0	111.6	V99 L100 A101 H105 R106 T107	V99-H103 PolarHBondContact O-N 2.87Å; L100-H103 WeakPolarHBondContact O-CB 3.5Å; L100-H103 PolarHBondContact O-N 3.17Å; L100-H103 VanDerWaalsContact O-N 3.08Å; A101-H103 VanDerWaalsContact C-N 3.32Å; A101-H103 PolarHBondContact O-N 2.51Å; H103-H105 PolarHBondContact O-N 3.41Å; H103-R106 PolarHBondContact O-N 3.24Å; H103-T107 PolarHBondContact O-N 3.26Å; H103-T107 VanDerWaalsContact O-N 3.15Å; H103-T107 PolarHBondContact O-OG1 3.3Å
104	L	93.8	Very high	91.7	Very high	1 Å²	1	70.7 Å²	70.7	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-62.5	-41.6	177.9	-68	175.9	0	0	0	111.8	L100 A101 R106 T107 L108 L118 V135 V138 L142	L100-L104 HydrophobicContact CD1-CD1 4.36Å; L100-L104 HydrophobicContact CD1-CG 4.22Å; L100-L104 HydrophobicContact CG-CD1 4.17Å; L100-L104 HydrophobicContact CG-CG 4.43Å; L100-L104 WeakPolarHBondContact O-CG 3.45Å; L100-L104 PolarHBondContact O-N 3.06Å; A101-L104 PolarHBondContact O-N 3.22Å; L104-R106 VanDerWaalsContact C-N 3.34Å; L104-R106 PolarHBondContact O-N 2.82Å; L104-T107 WeakPolarHBondContact CA-OG1 3.38Å; L104-T107 CarbonylContact O-C 3.57Å; L104-T107 PolarHBondContact O-N 3.39Å; L104-T107 VanDerWaalsContact O-N 3.15Å; L104-T107 PolarHBondContact O-OG1 3.22Å; L104-L108 PolarHBondContact O-N 3.16Å; L104-L118 HydrophobicContact CB-CD1 4.4Å; L104-L118 HydrophobicContact CD1-CD1 4.29Å; L104-L118 HydrophobicContact CD2-CD1 4.44Å; L104-V135 HydrophobicContact CD1-CG1 4.31Å; L104-V138 HydrophobicContact CD1-CG2 3.69Å; L104-L142 HydrophobicContact CB-CD1 4.43Å; L104-L142 HydrophobicContact CB-CD2 4.39Å
105	H	94.7	Very high	92.1	Very high	67 Å²	67	65.9 Å²	65.9	31%	0.31	31%	0.31	S	S	.	.	H	α-helix	trans	-60.8	-40.5	175.6	-179.5	-82.9	0	0	0	112.6	A101 H103 T107 L108 L142 M145	A101-H105 WeakPolarHBondContact O-CB 3.41Å; A101-H105 PolarHBondContact O-N 3.33Å; H103-H105 PolarHBondContact O-N 3.41Å; H105-T107 PolarHBondContact O-N 2.99Å; H105-L108 WeakPolarHBondContact O-CB 3.45Å; H105-L142 HydrophobicContact CB-CD1 3.8Å; H105-M145 HydrophobicContact CB-CE 3.63Å; H105-M145 HydrophobicContact CB-SD 4.48Å
106	R	94.3	Very high	92.5	Very high	206 Å²	206	64 Å²	64	78%	0.777	30%	0.299	S	S	*	.	H	α-helix	trans	-70.4	-21.5	177.3	-75.4	172.8	178.5	173.1	-1.1	113.6	K102 H103 L104	K102-R106 VanDerWaalsContact O-CG 3.27Å; K102-R106 WeakPolarHBondContact O-CG 3.34Å; K102-R106 PolarHBondContact O-N 3.35Å; K102-R106 VanDerWaalsContact O-N 3.16Å; H103-R106 PolarHBondContact O-N 3.24Å; L104-R106 VanDerWaalsContact C-N 3.34Å; L104-R106 PolarHBondContact O-N 2.82Å
107	T	93.1	Very high	92.8	Very high	37 Å²	37	58.4 Å²	58.4	23%	0.227	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	21	-176.4	56.2	0	0	0	0	111.7	H103 L104 H105 L109 N119	H103-T107 PolarHBondContact O-N 3.26Å; H103-T107 VanDerWaalsContact O-N 3.15Å; H103-T107 PolarHBondContact O-OG1 3.3Å; L104-T107 WeakPolarHBondContact CA-OG1 3.38Å; L104-T107 CarbonylContact O-C 3.57Å; L104-T107 PolarHBondContact O-N 3.39Å; L104-T107 VanDerWaalsContact O-N 3.15Å; L104-T107 PolarHBondContact O-OG1 3.22Å; H105-T107 PolarHBondContact O-N 2.99Å; T107-L109 PolarHBondContact O-N 2.99Å; T107-N119 WeakPolarHBondContact O-CB 3.34Å; T107-N119 PolarHBondContact O-N 2.96Å
108	L	95.4	Very high	93.1	Very high	54 Å²	54	56.2 Å²	56.2	28%	0.283	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	125.4	170.7	178.6	69.4	0	0	0	109.1	L104 H105 Y110 R111 V116 L118 L146	L104-L108 PolarHBondContact O-N 3.16Å; H105-L108 WeakPolarHBondContact O-CB 3.45Å; L108-Y110 WeakPolarHBondContact CD1-O 3.42Å; L108-R111 HydrophobicContact CD1-CB 4.38Å; L108-R111 HydrophobicContact CD2-CB 4.05Å; L108-V116 HydrophobicContact CD1-CG1 3.55Å; L108-L118 HydrophobicContact CD1-CD2 3.68Å; L108-L146 HydrophobicContact CD2-CD2 3.74Å
109	L	95.5	Very high	93.3	Very high	51 Å²	51	54.1 Å²	54.1	27%	0.267	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	-40.5	-178.6	-60.5	175.8	0	0	0	111.4	T107 I117 N119 A170 V354 C356	T107-L109 PolarHBondContact O-N 2.99Å; L109-I117 HydrophobicContact CB-CG2 4.27Å; L109-I117 WeakPolarHBondContact CB-O 3.41Å; L109-I117 HydrophobicContact CD1-CG2 4.17Å; L109-I117 PolarHBondContact N-O 2.96Å; L109-N119 HydrophobicContact CD1-CB 4.03Å; L109-N119 HydrophobicContact CD2-CB 4.13Å; L109-N119 HydrophobicContact CG-CB 4.03Å; L109-A170 HydrophobicContact CD1-CB 4.4Å; L109-V354 HydrophobicContact CB-CG1 3.63Å; L109-V354 HydrophobicContact CD1-CG1 4.03Å; L109-V354 HydrophobicContact CG-CG1 4.41Å; L109-C356 HydrophobicContact CD1-CB 3.81Å
110	Y	94.6	Very high	93.5	Very high	60 Å²	60	50.4 Å²	50.4	24%	0.235	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	149	-178.4	177.8	-96	0	0	0	110.8	L108 D112 V115 I117 V352 V354	L108-Y110 WeakPolarHBondContact CD1-O 3.42Å; Y110-D112 HydrophobicContact CE1-CB 4.01Å; Y110-D112 WeakPolarHBondContact CE1-OD2 3.39Å; Y110-D112 WeakPolarHBondContact OH-CB 3.46Å; Y110-D112 PolarHBondContact OH-OD2 3.41Å; Y110-V115 HydrophobicContact CD1-CG2 4.18Å; Y110-V115 HydrophobicContact CE1-CG2 3.8Å; Y110-I117 HydrophobicContact CD1-CD1 4.01Å; Y110-I117 HydrophobicContact CD1-CG1 4.4Å; Y110-I117 HydrophobicContact CG-CD1 4.4Å; Y110-I117 PolarHBondContact N-O 3.14Å; Y110-I117 PolarHBondContact O-N 3.47Å; Y110-V352 HydrophobicContact CD1-CG1 3.77Å; Y110-V352 HydrophobicContact CD2-CG1 4.48Å; Y110-V352 HydrophobicContact CE1-CB 4.43Å; Y110-V352 HydrophobicContact CE1-CG1 3.63Å; Y110-V352 HydrophobicContact CE1-CG2 3.85Å; Y110-V352 HydrophobicContact CE2-CG1 4.37Å; Y110-V352 HydrophobicContact CG-CG1 4.19Å; Y110-V354 HydrophobicContact CD2-CG2 4.44Å; Y110-V354 HydrophobicContact CG-CG2 4.04Å
111	R	92	Very high	93.5	Very high	103 Å²	103	51.3 Å²	51.3	39%	0.389	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	131.1	177.1	168.9	-179	172.8	-169	-0.3	109.6	L108 V116 L146 D147 R175	L108-R111 HydrophobicContact CD1-CB 4.38Å; L108-R111 HydrophobicContact CD2-CB 4.05Å; R111-V116 HydrophobicContact CG-CG2 4.33Å; R111-L146 VanDerWaalsContact NH1-C 3.34Å; R111-L146 PolarHBondContact NH1-O 3.33Å; R111-L146 VanDerWaalsContact NH2-C 3.28Å; R111-L146 PolarHBondContact NH2-O 3.32Å; R111-D147 IonicContact CZ-OD1 3.45Å; R111-D147 IonicContact NE-OD1 3.52Å; R111-D147 IonicContact NH2-OD1 2.63Å; R111-D147 PolarHBondContact NH2-OD1 3.11Å; R111-R175 VanDerWaalsContact NE-NH2 3.17Å
112	D	90	Very high	93.6	Very high	30 Å²	30	53.3 Å²	53.3	16%	0.16	24%	0.238	C	C	.	.			trans	-134.6	-156.9	164.4	65.2	27.7	0	0	0	110.8	Y110 D114 V115 R175	Y110-D112 HydrophobicContact CE1-CB 4.01Å; Y110-D112 WeakPolarHBondContact CE1-OD2 3.39Å; Y110-D112 WeakPolarHBondContact OH-CB 3.46Å; Y110-D112 PolarHBondContact OH-OD2 3.41Å; D112-D114 PolarHBondContact OD1-N 3.13Å; D112-V115 PolarHBondContact N-O 3.1Å; D112-V115 WeakPolarHBondContact OD1-CG2 3.15Å; D112-V115 PolarHBondContact OD1-N 3.05Å; D112-R175 PolarHBondContact O-NE 3.43Å
113	K	88.2	Confident	93.5	Very high	173 Å²	173	47.8 Å²	47.8	75%	0.752	22%	0.216	S	C	*	.	S	Bend	trans	-75.9	-25.6	-179.2	-64.6	-177.8	-178.9	178.3	0	113.4	R175	K113-R175 VanDerWaalsContact C-CD 3.48Å; K113-R175 WeakPolarHBondContact O-CD 3.19Å
114	D	89.8	Confident	93.4	Very high	56 Å²	56	44.6 Å²	44.6	30%	0.299	20%	0.201	S	C	.	.	S	Bend	trans	-107.2	-39.7	-172.6	-69.9	-23.4	0	0	0	111.6	D112 R175 V179	D112-D114 PolarHBondContact OD1-N 3.13Å; D114-R175 WeakPolarHBondContact O-CB 3.5Å; D114-R175 PolarHBondContact O-N 3.07Å; D114-V179 HydrophobicContact CB-CG1 4.12Å; D114-V179 HydrophobicContact CB-CG2 3.99Å
115	V	92.4	Very high	93.3	Very high	6 Å²	6	44.9 Å²	44.9	4%	0.036	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	154.8	-170.9	-58.6	0	0	0	0	113.6	Y110 D112 L172 L173 V179 I183	Y110-V115 HydrophobicContact CD1-CG2 4.18Å; Y110-V115 HydrophobicContact CE1-CG2 3.8Å; D112-V115 PolarHBondContact N-O 3.1Å; D112-V115 WeakPolarHBondContact OD1-CG2 3.15Å; D112-V115 PolarHBondContact OD1-N 3.05Å; V115-L172 HydrophobicContact CB-CD1 3.99Å; V115-L172 HydrophobicContact CG1-CD1 4.21Å; V115-L173 CarbonylContact C-O 3.55Å; V115-L173 VanDerWaalsContact CA-O 3.31Å; V115-L173 WeakPolarHBondContact CA-O 3.27Å; V115-V179 HydrophobicContact CG1-CG1 3.98Å; V115-I183 HydrophobicContact CG1-CD1 3.63Å
116	V	93.9	Very high	93.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	127.3	174.1	175.5	0	0	0	0	107.9	L108 R111 L118 L146 L157 L173 R175	L108-V116 HydrophobicContact CD1-CG1 3.55Å; R111-V116 HydrophobicContact CG-CG2 4.33Å; V116-L118 HydrophobicContact CG1-CD2 3.81Å; V116-L118 HydrophobicContact CG1-CG 4.27Å; V116-L146 HydrophobicContact CG1-CD1 4.16Å; V116-L146 HydrophobicContact CG2-CD1 4.31Å; V116-L157 HydrophobicContact CB-CD2 4.22Å; V116-L157 HydrophobicContact CG2-CD2 3.78Å; V116-L173 HydrophobicContact CB-CB 4.25Å; V116-L173 HydrophobicContact CG1-CD1 4.47Å; V116-L173 PolarHBondContact N-O 2.91Å; V116-L173 WeakPolarHBondContact O-CB 3.38Å; V116-L173 PolarHBondContact O-N 3.13Å; V116-R175 HydrophobicContact CG2-CG 4.31Å
117	I	95.7	Very high	92.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	119.4	177.2	-57.8	166.9	0	0	0	108.7	L109 Y110 A170 L171 L172 L342 L344 V352 V354	L109-I117 HydrophobicContact CB-CG2 4.27Å; L109-I117 WeakPolarHBondContact CB-O 3.41Å; L109-I117 HydrophobicContact CD1-CG2 4.17Å; L109-I117 PolarHBondContact N-O 2.96Å; Y110-I117 HydrophobicContact CD1-CD1 4.01Å; Y110-I117 HydrophobicContact CD1-CG1 4.4Å; Y110-I117 HydrophobicContact CG-CD1 4.4Å; Y110-I117 PolarHBondContact N-O 3.14Å; Y110-I117 PolarHBondContact O-N 3.47Å; I117-A170 HydrophobicContact CG2-CB 4.08Å; I117-L171 WeakPolarHBondContact CA-O 3.47Å; I117-L172 HydrophobicContact CD1-CD1 4.26Å; I117-L172 HydrophobicContact CG1-CD1 3.7Å; I117-L342 HydrophobicContact CD1-CD2 3.83Å; I117-L342 HydrophobicContact CG1-CD2 4.06Å; I117-L342 HydrophobicContact CG2-CD2 4.29Å; I117-L344 HydrophobicContact CD1-CD2 4.43Å; I117-V352 HydrophobicContact CD1-CG1 3.8Å; I117-V354 HydrophobicContact CD1-CB 4.1Å; I117-V354 HydrophobicContact CD1-CG2 3.56Å; I117-V354 HydrophobicContact CG2-CG1 4.19Å
118	L	95.8	Very high	92	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	151.1	-179.8	-56.8	-179.4	0	0	0	111.1	L104 L108 V116 K120 L142 A170 L171 L173	L104-L118 HydrophobicContact CB-CD1 4.4Å; L104-L118 HydrophobicContact CD1-CD1 4.29Å; L104-L118 HydrophobicContact CD2-CD1 4.44Å; L108-L118 HydrophobicContact CD1-CD2 3.68Å; V116-L118 HydrophobicContact CG1-CD2 3.81Å; V116-L118 HydrophobicContact CG1-CG 4.27Å; L118-K120 PolarHBondContact O-N 3.48Å; L118-L142 HydrophobicContact CD1-CD2 3.63Å; L118-L142 HydrophobicContact CD2-CD2 4.05Å; L118-L142 HydrophobicContact CG-CD2 4.47Å; L118-A170 CarbonylContact O-C 3.38Å; L118-A170 WeakPolarHBondContact O-CA 3.42Å; L118-L171 PolarHBondContact N-O 3.26Å; L118-L171 PolarHBondContact O-N 2.88Å; L118-L173 HydrophobicContact CD1-CD1 3.48Å; L118-L173 VanDerWaalsContact CD1-CD1 3.48Å; L118-L173 HydrophobicContact CD1-CG 4.35Å; L118-L173 HydrophobicContact CG-CD1 3.95Å
119	N	96.4	Very high	91.2	Very high	28 Å²	28	48 Å²	48	15%	0.15	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	99.2	161.9	-174.9	-7.4	0	0	0	109.6	T107 L109 P121 C356	T107-N119 WeakPolarHBondContact O-CB 3.34Å; T107-N119 PolarHBondContact O-N 2.96Å; L109-N119 HydrophobicContact CD1-CB 4.03Å; L109-N119 HydrophobicContact CD2-CB 4.13Å; L109-N119 HydrophobicContact CG-CB 4.03Å; N119-P121 WeakPolarHBondContact O-CD 3.39Å; N119-C356 PolarHBondContact OD1-SG 2.79Å; N119-C356 VanDerWaalsContact OD1-SG 3.35Å
120	K	95	Very high	90.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	123.2	177.8	-165.6	-170.2	76.9	69.4	0	110	L118 V124 V126 V135 L163 E164 K165 S167 S168 G169 L171	L118-K120 PolarHBondContact O-N 3.48Å; K120-V124 PolarHBondContact NZ-O 2.96Å; K120-V126 HydrophobicContact CD-CG2 3.58Å; K120-V135 HydrophobicContact CD-CG2 4.31Å; K120-V135 HydrophobicContact CG-CG2 4.23Å; K120-L163 HydrophobicContact CB-CD2 3.99Å; K120-L163 HydrophobicContact CD-CB 4.42Å; K120-L163 HydrophobicContact CD-CD2 3.9Å; K120-L163 HydrophobicContact CD-CG 4.39Å; K120-E164 VanDerWaalsContact CE-O 3.23Å; K120-E164 WeakPolarHBondContact CE-O 3.48Å; K120-E164 PolarHBondContact NZ-O 3.36Å; K120-E164 VanDerWaalsContact NZ-O 3.12Å; K120-K165 PolarHBondContact NZ-O 2.88Å; K120-S167 WeakPolarHBondContact CE-O 3.24Å; K120-S167 PolarHBondContact NZ-O 2.68Å; K120-S168 WeakPolarHBondContact O-CA 3.47Å; K120-G169 PolarHBondContact N-O 3.11Å; K120-G169 PolarHBondContact O-N 2.86Å; K120-L171 HydrophobicContact CB-CB 4.14Å; K120-L171 HydrophobicContact CB-CD2 4.48Å; K120-L171 HydrophobicContact CD-CD2 4.38Å
121	P	93.9	Very high	89.3	Confident	19 Å²	19	52.4 Å²	52.4	12%	0.123	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-69.5	159.7	173.4	29.7	-35.2	0	0	0	111.9	L92 L100 N119 V124	L92-P121 HydrophobicContact CD1-CB 3.83Å; L92-P121 HydrophobicContact CD1-CG 3.72Å; L100-P121 HydrophobicContact CD1-CG 4.48Å; N119-P121 WeakPolarHBondContact O-CD 3.39Å; P121-V124 HydrophobicContact CG-CB 4.26Å; P121-V124 HydrophobicContact CG-CG2 3.72Å
122	Y	93.6	Very high	89.1	Confident	42 Å²	42	49.2 Å²	49.2	17%	0.165	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	142.1	173.2	178	-87.9	0	0	0	111.6	T89 V124 D166 P334 L335 Y361	T89-Y122 HydrophobicContact CG2-CD1 3.96Å; T89-Y122 HydrophobicContact CG2-CE1 4.09Å; Y122-V124 VanDerWaalsContact C-N 3.26Å; Y122-V124 PolarHBondContact O-N 3.25Å; Y122-D166 HydrophobicContact CD2-CB 4.5Å; Y122-D166 WeakPolarHBondContact CD2-O 3.39Å; Y122-D166 HydrophobicContact CE2-CB 3.72Å; Y122-D166 WeakPolarHBondContact CE2-O 3.33Å; Y122-P334 HydrophobicContact CD1-CB 4.44Å; Y122-P334 HydrophobicContact CD2-CB 4.07Å; Y122-P334 HydrophobicContact CE1-CB 4Å; Y122-P334 HydrophobicContact CE2-CB 3.55Å; Y122-P334 HydrophobicContact CG-CB 4.48Å; Y122-P334 WeakPolarHBondContact OH-CA 3.36Å; Y122-L335 HydrophobicContact CE2-CB 4.02Å; Y122-L335 PolarHBondContact OH-N 3.09Å; Y122-Y361 HydrophobicContact CD2-CE1 4.39Å; Y122-Y361 WeakPolarHBondContact CD2-OH 3.43Å; Y122-Y361 HydrophobicContact CG-CE1 4.31Å
123	G	91.3	Very high	88.9	Confident	4 Å²	4	48.8 Å²	48.8	4%	0.041	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	-7	172.4	0	0	0	0	0	115.1	Q93 K165	Q93-G123 PolarHBondContact OE1-O 3.3Å; Q93-G123 VanDerWaalsContact OE1-O 3.12Å; G123-K165 CarbonylContact C-O 3.55Å; G123-K165 WeakPolarHBondContact CA-O 3.31Å; G123-K165 PolarHBondContact N-O 2.98Å; G123-K165 WeakPolarHBondContact O-CE 3.37Å; G123-K165 VanDerWaalsContact O-CG 3.31Å; G123-K165 WeakPolarHBondContact O-CG 3.34Å
124	V	91.8	Very high	89.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.228	C	C	.	.			trans	-90	119.1	177.6	-179.8	0	0	0	0	110.1	L92 L100 K120 P121 Y122 V135 K165	L92-V124 HydrophobicContact CB-CG2 3.67Å; L100-V124 HydrophobicContact CD1-CG1 4.32Å; L100-V124 HydrophobicContact CD1-CG2 4.2Å; L100-V124 HydrophobicContact CD2-CG1 3.9Å; K120-V124 PolarHBondContact NZ-O 2.96Å; P121-V124 HydrophobicContact CG-CB 4.26Å; P121-V124 HydrophobicContact CG-CG2 3.72Å; Y122-V124 VanDerWaalsContact C-N 3.26Å; Y122-V124 PolarHBondContact O-N 3.25Å; V124-V135 HydrophobicContact CG1-CG2 3.89Å; V124-K165 PolarHBondContact N-O 2.79Å
125	P	92.4	Very high	89.2	Confident	7 Å²	7	38 Å²	38	5%	0.045	21%	0.214	C	C	.	.			trans	-70.8	144.1	176	30.2	-34.3	0	0	0	110.9	E129 V132 T134 V135 K165	P125-E129 HydrophobicContact CB-CB 4.4Å; P125-E129 HydrophobicContact CG-CB 4.3Å; P125-V132 HydrophobicContact CG-CG1 4.1Å; P125-T134 HydrophobicContact CB-CG2 4.47Å; P125-T134 HydrophobicContact CG-CG2 3.77Å; P125-T134 CarbonylContact O-C 3.49Å; P125-T134 WeakPolarHBondContact O-CA 3.4Å; P125-V135 PolarHBondContact O-N 2.92Å; P125-K165 HydrophobicContact CB-CB 4.37Å; P125-K165 HydrophobicContact CB-CD 4.46Å; P125-K165 HydrophobicContact CB-CG 4.26Å
126	V	91.3	Very high	89.1	Confident	9 Å²	9	39.3 Å²	39.3	6%	0.055	22%	0.222	C	C	.	.	S	Bend	trans	-76.9	-56.6	178.5	176.9	0	0	0	0	110.7	K120 V135 T136 P159 L163 L171	K120-V126 HydrophobicContact CD-CG2 3.58Å; V126-V135 PolarHBondContact O-N 3.48Å; V126-T136 VanDerWaalsContact O-CG2 3.32Å; V126-T136 WeakPolarHBondContact O-CG2 3.41Å; V126-T136 PolarHBondContact O-N 3.36Å; V126-T136 PolarHBondContact O-OG1 2.87Å; V126-P159 HydrophobicContact CG1-CB 3.86Å; V126-P159 HydrophobicContact CG1-CG 4.03Å; V126-L163 HydrophobicContact CG2-CB 4.08Å; V126-L163 VanDerWaalsContact CG2-O 3.26Å; V126-L163 WeakPolarHBondContact CG2-O 3.44Å; V126-L171 HydrophobicContact CG1-CD1 4.34Å; V126-L171 HydrophobicContact CG1-CD2 4.45Å; V126-L171 HydrophobicContact CG2-CD1 4.12Å; V126-L171 HydrophobicContact CG2-CD2 4.24Å
127	R	87.3	Confident	88.9	Confident	158 Å²	158	42 Å²	42	60%	0.596	24%	0.241	S	C	*	.	S	Bend	trans	-94.9	166.6	178.9	-62.6	-173.6	-170.9	-89.4	-2.8	111.1	E129 T134	R127-E129 PolarHBondContact O-N 2.74Å; R127-T134 WeakPolarHBondContact O-CG2 3.49Å
128	E	76.9	Confident	88.7	Confident	177 Å²	177	42 Å²	42	83%	0.827	24%	0.241	S	C	*	.			trans	-51.7	130.2	-175.2	-66.4	-177.3	168.5	0	0	113.1
129	E	77.1	Confident	88.5	Confident	85 Å²	85	42.5 Å²	42.5	40%	0.397	24%	0.243	S	C	.	.			trans	-134.7	130.7	173.3	-170.3	-179.8	-179.7	0	0	106.2	P125 R127 G131 V132 K165	P125-E129 HydrophobicContact CB-CB 4.4Å; P125-E129 HydrophobicContact CG-CB 4.3Å; R127-E129 PolarHBondContact O-N 2.74Å; E129-G131 PolarHBondContact O-N 3.23Å; E129-V132 PolarHBondContact O-N 2.96Å; E129-K165 VanDerWaalsContact CD-NZ 3.27Å; E129-K165 IonicContact OE1-NZ 3.73Å; E129-K165 PolarHBondContact OE1-NZ 3.31Å; E129-K165 IonicContact OE2-NZ 3.64Å; E129-K165 PolarHBondContact OE2-NZ 3Å
130	S	74.9	Confident	88.2	Confident	125 Å²	125	44.9 Å²	44.9	87%	0.874	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	130	-172.1	-176.4	0	0	0	0	112.1	V132	S130-V132 VanDerWaalsContact C-N 3.34Å; S130-V132 PolarHBondContact O-N 2.85Å
131	G	76.5	Confident	87.9	Confident	79 Å²	79	47 Å²	47	81%	0.814	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	14.5	174.2	0	0	0	0	0	115.7	E129	E129-G131 PolarHBondContact O-N 3.23Å
132	V	86.3	Confident	87.8	Confident	36 Å²	36	46 Å²	46	22%	0.218	27%	0.267	C	S	.	.	S	Bend	trans	-134	143.5	-173.8	-177.6	0	0	0	0	111.4	Q93 P125 E129 S130 T134	Q93-V132 HydrophobicContact CB-CG1 3.34Å; Q93-V132 HydrophobicContact CG-CG1 3.75Å; Q93-V132 WeakPolarHBondContact O-CG1 3.45Å; P125-V132 HydrophobicContact CG-CG1 4.1Å; E129-V132 PolarHBondContact O-N 2.96Å; S130-V132 VanDerWaalsContact C-N 3.34Å; S130-V132 PolarHBondContact O-N 2.85Å; V132-T134 WeakPolarHBondContact O-CG2 3.49Å
133	T	87.1	Confident	87.6	Confident	20 Å²	20	44.7 Å²	44.7	12%	0.123	26%	0.263	C	S	.	.			trans	-73.4	127.1	173.4	-54.2	0	0	0	0	110.2	Q93 V95 P97 L100 V138	Q93-T133 VanDerWaalsContact O-CB 3.3Å; Q93-T133 WeakPolarHBondContact O-CB 3.39Å; Q93-T133 PolarHBondContact O-N 3.38Å; Q93-T133 PolarHBondContact O-OG1 3.32Å; V95-T133 PolarHBondContact O-OG1 2.87Å; P97-T133 HydrophobicContact CB-CG2 4.45Å; P97-T133 HydrophobicContact CG-CG2 4.29Å; L100-T133 HydrophobicContact CB-CG2 4.45Å; L100-T133 HydrophobicContact CD2-CG2 3.71Å; T133-V138 HydrophobicContact CG2-CG1 3.98Å
134	T	91.3	Very high	87.5	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.018	29%	0.29	C	S	.	.			trans	-114.2	170.7	-175.7	73.9	0	0	0	0	111.3	P125 R127 V132 T136 S137	P125-T134 HydrophobicContact CB-CG2 4.47Å; P125-T134 HydrophobicContact CG-CG2 3.77Å; P125-T134 CarbonylContact O-C 3.49Å; P125-T134 WeakPolarHBondContact O-CA 3.4Å; R127-T134 WeakPolarHBondContact O-CG2 3.49Å; V132-T134 WeakPolarHBondContact O-CG2 3.49Å; T134-T136 PolarHBondContact OG1-N 3.25Å; T134-T136 PolarHBondContact OG1-OG1 3.38Å; T134-S137 PolarHBondContact N-OG 3.27Å; T134-S137 VanDerWaalsContact N-OG 3.11Å; T134-S137 PolarHBondContact O-OG 3.36Å; T134-S137 PolarHBondContact OG1-N 3.35Å
135	V	91.8	Very high	87.4	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.9	-47.8	170.8	-178.7	0	0	0	0	109.9	L104 K120 V124 P125 V126 S137 V138 L139 L171	L104-V135 HydrophobicContact CD1-CG1 4.31Å; K120-V135 HydrophobicContact CD-CG2 4.31Å; K120-V135 HydrophobicContact CG-CG2 4.23Å; V124-V135 HydrophobicContact CG1-CG2 3.89Å; P125-V135 PolarHBondContact O-N 2.92Å; V126-V135 PolarHBondContact O-N 3.48Å; V135-S137 VanDerWaalsContact C-N 3.28Å; V135-S137 PolarHBondContact O-N 3.16Å; V135-V138 WeakPolarHBondContact O-CG2 3.33Å; V135-V138 PolarHBondContact O-N 3.43Å; V135-L139 HydrophobicContact CG1-CD2 3.91Å; V135-L139 HydrophobicContact CG1-CG 4.49Å; V135-L139 WeakPolarHBondContact O-CG 3.47Å; V135-L139 PolarHBondContact O-N 3.35Å; V135-L171 HydrophobicContact CB-CD2 4.43Å; V135-L171 HydrophobicContact CG1-CD2 3.84Å; V135-L171 HydrophobicContact CG2-CD2 4.22Å
136	T	91.2	Very high	87.2	Confident	34 Å²	34	54.5 Å²	54.5	21%	0.209	31%	0.306	C	S	.	.	H	α-helix	trans	-54.9	-41.5	179.2	49.3	0	0	0	0	112.6	V126 T134 V138 L139 P159	V126-T136 VanDerWaalsContact O-CG2 3.32Å; V126-T136 WeakPolarHBondContact O-CG2 3.41Å; V126-T136 PolarHBondContact O-N 3.36Å; V126-T136 PolarHBondContact O-OG1 2.87Å; T134-T136 PolarHBondContact OG1-N 3.25Å; T134-T136 PolarHBondContact OG1-OG1 3.38Å; T136-V138 PolarHBondContact O-N 2.9Å; T136-V138 VanDerWaalsContact O-N 3.16Å; T136-L139 HydrophobicContact CG2-CD1 4.37Å; T136-L139 PolarHBondContact O-N 3.45Å; T136-P159 HydrophobicContact CG2-CG 3.89Å
137	S	89.9	Confident	86.9	Confident	57 Å²	57	55.9 Å²	55.9	40%	0.399	31%	0.313	S	S	.	.	H	α-helix	trans	-65.4	-21.2	-178.8	73	0	0	0	0	113.6	T134 V135	T134-S137 PolarHBondContact N-OG 3.27Å; T134-S137 VanDerWaalsContact N-OG 3.11Å; T134-S137 PolarHBondContact O-OG 3.36Å; T134-S137 PolarHBondContact OG1-N 3.35Å; V135-S137 VanDerWaalsContact C-N 3.28Å; V135-S137 PolarHBondContact O-N 3.16Å
138	V	91.2	Very high	86.4	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-102.6	-6.6	-179.8	-58.2	0	0	0	0	113.9	P97 L100 A101 L104 T133 V135 T136 V141 L142	P97-V138 HydrophobicContact CB-CG1 3.93Å; P97-V138 WeakPolarHBondContact O-CG1 3.41Å; L100-V138 HydrophobicContact CB-CG1 4.18Å; L100-V138 HydrophobicContact CD2-CG1 3.94Å; L100-V138 HydrophobicContact CD2-CG2 4.05Å; L100-V138 HydrophobicContact CG-CG1 4.25Å; L100-V138 HydrophobicContact CG-CG2 4.18Å; A101-V138 HydrophobicContact CB-CB 4.17Å; L104-V138 HydrophobicContact CD1-CG2 3.69Å; T133-V138 HydrophobicContact CG2-CG1 3.98Å; V135-V138 WeakPolarHBondContact O-CG2 3.33Å; V135-V138 PolarHBondContact O-N 3.43Å; T136-V138 PolarHBondContact O-N 2.9Å; T136-V138 VanDerWaalsContact O-N 3.16Å; V138-V141 PolarHBondContact O-N 2.79Å; V138-L142 WeakPolarHBondContact O-CB 3.32Å; V138-L142 PolarHBondContact O-N 2.88Å
139	L	91.4	Very high	85.8	Confident	9 Å²	9	49.6 Å²	49.6	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-57.4	-40.8	-179.8	-65.2	-178.2	0	0	0	113.5	V135 T136 V141 L142 C143 L157 P159 L173	V135-L139 HydrophobicContact CG1-CD2 3.91Å; V135-L139 HydrophobicContact CG1-CG 4.49Å; V135-L139 WeakPolarHBondContact O-CG 3.47Å; V135-L139 PolarHBondContact O-N 3.35Å; T136-L139 HydrophobicContact CG2-CD1 4.37Å; T136-L139 PolarHBondContact O-N 3.45Å; L139-V141 VanDerWaalsContact C-N 3.32Å; L139-V141 PolarHBondContact O-N 2.82Å; L139-L142 HydrophobicContact CD2-CD2 4.25Å; L139-L142 PolarHBondContact O-N 2.81Å; L139-C143 WeakPolarHBondContact O-CB 3.39Å; L139-C143 PolarHBondContact O-N 2.93Å; L139-L157 HydrophobicContact CB-CB 4.24Å; L139-L157 HydrophobicContact CD1-CB 4.3Å; L139-L157 WeakPolarHBondContact CD1-O 3.48Å; L139-L157 HydrophobicContact CD2-CB 4.18Å; L139-L157 HydrophobicContact CD2-CD1 4.47Å; L139-L157 HydrophobicContact CG-CB 4.44Å; L139-P159 HydrophobicContact CD1-CG 4.02Å; L139-L173 HydrophobicContact CD2-CD1 3.62Å; L139-L173 HydrophobicContact CD2-CD2 4.49Å
140	P	89.3	Confident	84.8	Confident	78 Å²	78	55.3 Å²	55.3	51%	0.506	33%	0.328	S	S	.	.	H	α-helix	trans	-62.8	-38.2	177.2	-24.5	35.1	0	0	0	112.9	K144	P140-K144 WeakPolarHBondContact O-CG 3.42Å; P140-K144 PolarHBondContact O-N 3.17Å
141	V	90.5	Very high	83.8	Confident	44 Å²	44	52.6 Å²	52.6	27%	0.267	31%	0.306	S	S	.	.	H	α-helix	trans	-70.5	-44.2	176.5	-179.4	0	0	0	0	110.1	A101 V138 L139 C143 K144 M145	A101-V141 HydrophobicContact CB-CB 4.08Å; A101-V141 HydrophobicContact CB-CG1 3.73Å; V138-V141 PolarHBondContact O-N 2.79Å; L139-V141 VanDerWaalsContact C-N 3.32Å; L139-V141 PolarHBondContact O-N 2.82Å; V141-C143 VanDerWaalsContact C-N 3.35Å; V141-C143 PolarHBondContact O-N 2.93Å; V141-K144 PolarHBondContact O-N 3.37Å; V141-M145 HydrophobicContact CG1-SD 4.24Å; V141-M145 WeakPolarHBondContact O-CG 3.46Å; V141-M145 PolarHBondContact O-N 3.17Å
142	L	91.2	Very high	82.6	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-61.4	-42.9	178.6	-177.3	62.5	0	0	0	111.5	L104 H105 L118 V138 L139 K144 M145 L146 L157	L104-L142 HydrophobicContact CB-CD1 4.43Å; L104-L142 HydrophobicContact CB-CD2 4.39Å; H105-L142 HydrophobicContact CB-CD1 3.8Å; L118-L142 HydrophobicContact CD1-CD2 3.63Å; L118-L142 HydrophobicContact CD2-CD2 4.05Å; L118-L142 HydrophobicContact CG-CD2 4.47Å; V138-L142 WeakPolarHBondContact O-CB 3.32Å; V138-L142 PolarHBondContact O-N 2.88Å; L139-L142 HydrophobicContact CD2-CD2 4.25Å; L139-L142 PolarHBondContact O-N 2.81Å; L142-K144 PolarHBondContact O-N 2.89Å; L142-M145 WeakPolarHBondContact O-CB 3.46Å; L142-M145 PolarHBondContact O-N 3.16Å; L142-M145 VanDerWaalsContact O-N 3.11Å; L142-L146 HydrophobicContact CD1-CD1 4.46Å; L142-L146 HydrophobicContact CD1-CG 4.35Å; L142-L146 HydrophobicContact CG-CD1 4.11Å; L142-L146 HydrophobicContact CG-CG 4.41Å; L142-L146 VanDerWaalsContact O-CG 3.3Å; L142-L146 WeakPolarHBondContact O-CG 3.49Å; L142-L146 PolarHBondContact O-N 3.38Å; L142-L157 HydrophobicContact CD2-CD1 4.31Å; L142-L157 HydrophobicContact CG-CD1 4.36Å
143	C	89.6	Confident	80.9	Confident	13 Å²	13	62.6 Å²	62.6	9%	0.088	34%	0.335	C	S	.	.	H	α-helix	trans	-57.6	-47.9	176.4	-173.1	0	0	0	0	111.3	L139 V141 M145 L146 D147 T155 L157	L139-C143 WeakPolarHBondContact O-CB 3.39Å; L139-C143 PolarHBondContact O-N 2.93Å; V141-C143 VanDerWaalsContact C-N 3.35Å; V141-C143 PolarHBondContact O-N 2.93Å; C143-M145 VanDerWaalsContact C-N 3.3Å; C143-M145 PolarHBondContact O-N 2.98Å; C143-L146 PolarHBondContact O-N 2.82Å; C143-L146 VanDerWaalsContact O-N 3.14Å; C143-D147 PolarHBondContact O-N 2.9Å; C143-T155 PolarHBondContact SG-O 3.29Å; C143-L157 HydrophobicContact CB-CD1 4.18Å; C143-L157 HydrophobicContact CB-CG 4.38Å
144	K	88.3	Confident	79.4	Confident	139 Å²	139	69.2 Å²	69.2	60%	0.604	37%	0.37	S	S	*	.	H	α-helix	trans	-60.1	-37.3	174.5	-69.4	175.8	-178.3	-179.3	0	113	P140 V141 L142 G148	P140-K144 WeakPolarHBondContact O-CG 3.42Å; P140-K144 PolarHBondContact O-N 3.17Å; V141-K144 PolarHBondContact O-N 3.37Å; L142-K144 PolarHBondContact O-N 2.89Å; K144-G148 VanDerWaalsContact O-CA 3.31Å; K144-G148 WeakPolarHBondContact O-CA 3.36Å; K144-G148 PolarHBondContact O-N 3.05Å
145	M	89.6	Confident	77.8	Confident	67 Å²	67	71.6 Å²	71.6	33%	0.33	38%	0.384	S	S	.	.	H	α-helix	trans	-69	-36.2	176.8	-69.6	179.8	63.6	0	0	112.3	A101 K102 H105 V141 L142 C143	A101-M145 HydrophobicContact CB-SD 4.1Å; K102-M145 HydrophobicContact CG-CE 3.92Å; K102-M145 HydrophobicContact CG-SD 4.36Å; H105-M145 HydrophobicContact CB-CE 3.63Å; H105-M145 HydrophobicContact CB-SD 4.48Å; V141-M145 HydrophobicContact CG1-SD 4.24Å; V141-M145 WeakPolarHBondContact O-CG 3.46Å; V141-M145 PolarHBondContact O-N 3.17Å; L142-M145 WeakPolarHBondContact O-CB 3.46Å; L142-M145 PolarHBondContact O-N 3.16Å; L142-M145 VanDerWaalsContact O-N 3.11Å; C143-M145 VanDerWaalsContact C-N 3.3Å; C143-M145 PolarHBondContact O-N 2.98Å
146	L	88.7	Confident	77.3	Confident	12 Å²	12	77.8 Å²	77.8	6%	0.063	41%	0.413	C	S	.	.	H	α-helix	trans	-74	-51.3	179.4	-68.5	174.6	0	0	0	111.4	L108 R111 V116 L142 C143 L157	L108-L146 HydrophobicContact CD2-CD2 3.74Å; R111-L146 VanDerWaalsContact NH1-C 3.34Å; R111-L146 PolarHBondContact NH1-O 3.33Å; R111-L146 VanDerWaalsContact NH2-C 3.28Å; R111-L146 PolarHBondContact NH2-O 3.32Å; V116-L146 HydrophobicContact CG1-CD1 4.16Å; V116-L146 HydrophobicContact CG2-CD1 4.31Å; L142-L146 HydrophobicContact CD1-CD1 4.46Å; L142-L146 HydrophobicContact CD1-CG 4.35Å; L142-L146 HydrophobicContact CG-CD1 4.11Å; L142-L146 HydrophobicContact CG-CG 4.41Å; L142-L146 VanDerWaalsContact O-CG 3.3Å; L142-L146 WeakPolarHBondContact O-CG 3.49Å; L142-L146 PolarHBondContact O-N 3.38Å; C143-L146 PolarHBondContact O-N 2.82Å; C143-L146 VanDerWaalsContact O-N 3.14Å; L146-L157 HydrophobicContact CD1-CD1 4.13Å
147	D	84.4	Confident	77.2	Confident	37 Å²	37	76.2 Å²	76.2	20%	0.198	40%	0.404	C	S	.	.	H	α-helix	trans	-95.8	-6.6	-168.9	-58.6	-27.6	0	0	0	113.8	R111 C143 T151 R175	R111-D147 IonicContact CZ-OD1 3.45Å; R111-D147 IonicContact NE-OD1 3.52Å; R111-D147 IonicContact NH2-OD1 2.63Å; R111-D147 PolarHBondContact NH2-OD1 3.11Å; C143-D147 PolarHBondContact O-N 2.9Å; D147-T151 HydrophobicContact CB-CG2 3.51Å; D147-R175 IonicContact OD1-CZ 2.9Å; D147-R175 IonicContact OD1-NH1 3.84Å; D147-R175 PolarHBondContact OD1-NH1 3.03Å; D147-R175 IonicContact OD1-NH2 3.45Å; D147-R175 PolarHBondContact OD1-NH2 3.5Å; D147-R175 IonicContact OD2-CZ 3.64Å; D147-R175 IonicContact OD2-NH1 2.75Å; D147-R175 PolarHBondContact OD2-NH1 3.35Å; D147-R175 IonicContact OD2-NH2 3.61Å
148	G	77.1	Confident	77.3	Confident	32 Å²	32	74.8 Å²	74.8	33%	0.33	39%	0.391	S	S	.	.			trans	76.3	178	-177.7	0	0	0	0	0	113.3	K144 K150 T151	K144-G148 VanDerWaalsContact O-CA 3.31Å; K144-G148 WeakPolarHBondContact O-CA 3.36Å; K144-G148 PolarHBondContact O-N 3.05Å; G148-K150 PolarHBondContact O-N 2.89Å; G148-K150 VanDerWaalsContact O-N 3.15Å; G148-T151 PolarHBondContact O-OG1 3Å
149	L	64.4	Low	77.4	Confident	172 Å²	172	75.2 Å²	75.2	90%	0.901	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-0.9	-174.9	-65.3	173.2	0	0	0	114.6
150	K	56.4	Low	77.3	Confident	205 Å²	205	75.1 Å²	75.1	89%	0.891	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-1.3	-171.7	-68.1	-170.6	178.5	-175.8	0	114.3	G148 K152	G148-K150 PolarHBondContact O-N 2.89Å; G148-K150 VanDerWaalsContact O-N 3.15Å; K150-K152 PolarHBondContact O-N 2.82Å
151	T	54.1	Low	77.1	Confident	67 Å²	67	72 Å²	72	41%	0.411	37%	0.373	S	S	.	.			trans	-75.7	125.1	178.9	29.6	0	0	0	0	111.3	D147 G148 T153	D147-T151 HydrophobicContact CB-CG2 3.51Å; G148-T151 PolarHBondContact O-OG1 3Å; T151-T153 PolarHBondContact O-N 2.81Å
152	K	51.9	Low	76.6	Confident	194 Å²	194	72.7 Å²	72.7	84%	0.843	39%	0.389	S	S	*	.			trans	-56.7	133.3	164.2	-74.7	179.8	175.3	-179	0	108.3	K150 D154	K150-K152 PolarHBondContact O-N 2.82Å; K152-D154 PolarHBondContact O-N 3.24Å
153	T	50.3	Low	76.6	Confident	132 Å²	132	73.5 Å²	73.5	81%	0.81	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-37.3	111.3	167.8	38.8	0	0	0	0	112	T151	T151-T153 PolarHBondContact O-N 2.81Å
154	D	54.6	Low	76.7	Confident	158 Å²	158	74.6 Å²	74.6	85%	0.845	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	158.2	-3.8	149.1	-89.5	-2.6	0	0	0	114.4	K152 E156	K152-D154 PolarHBondContact O-N 3.24Å; D154-E156 PolarHBondContact O-N 2.83Å
155	T	59	Low	76.8	Confident	53 Å²	53	70.5 Å²	70.5	33%	0.325	38%	0.379	S	S	.	.			trans	-75.1	91.3	174.7	-43.6	0	0	0	0	110.7	C143 R175	C143-T155 PolarHBondContact SG-O 3.29Å; T155-R175 HydrophobicContact CG2-CB 4.02Å; T155-R175 HydrophobicContact CG2-CG 4.33Å
156	E	79.9	Confident	77	Confident	130 Å²	130	69.9 Å²	69.9	61%	0.607	38%	0.377	S	S	*	.			trans	-87.3	130.8	171.2	-168.2	168.7	-165.1	0	0	110	D154 L158 R175	D154-E156 PolarHBondContact O-N 2.83Å; E156-L158 HydrophobicContact CB-CD2 4.5Å; E156-L158 HydrophobicContact CG-CD2 3.84Å; E156-L158 HydrophobicContact CG-CG 4.27Å; E156-R175 CarbonylContact O-C 3.5Å
157	L	89.8	Confident	77.3	Confident	2 Å²	2	69.3 Å²	69.3	1%	0.01	37%	0.374	C	S	.	.			trans	-83	128	168.9	-69.1	173	0	0	0	108.4	V116 L139 L142 C143 L146 L173 A174 R175	V116-L157 HydrophobicContact CB-CD2 4.22Å; V116-L157 HydrophobicContact CG2-CD2 3.78Å; L139-L157 HydrophobicContact CB-CB 4.24Å; L139-L157 HydrophobicContact CD1-CB 4.3Å; L139-L157 WeakPolarHBondContact CD1-O 3.48Å; L139-L157 HydrophobicContact CD2-CB 4.18Å; L139-L157 HydrophobicContact CD2-CD1 4.47Å; L139-L157 HydrophobicContact CG-CB 4.44Å; L142-L157 HydrophobicContact CD2-CD1 4.31Å; L142-L157 HydrophobicContact CG-CD1 4.36Å; C143-L157 HydrophobicContact CB-CD1 4.18Å; C143-L157 HydrophobicContact CB-CG 4.38Å; L146-L157 HydrophobicContact CD1-CD1 4.13Å; L157-L173 HydrophobicContact CB-CD1 4.28Å; L157-L173 HydrophobicContact CD1-CD1 4.3Å; L157-A174 CarbonylContact C-O 3.52Å; L157-A174 VanDerWaalsContact CA-O 3.3Å; L157-A174 WeakPolarHBondContact CA-O 3.3Å; L157-R175 HydrophobicContact CD2-CG 3.75Å
158	L	92.1	Very high	77.8	Confident	27 Å²	27	67.7 Å²	67.7	14%	0.141	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	123.6	-173.7	-63.3	168.4	0	0	0	110.6	E156 C160 L173 A174 E177 L180	E156-L158 HydrophobicContact CB-CD2 4.5Å; E156-L158 HydrophobicContact CG-CD2 3.84Å; E156-L158 HydrophobicContact CG-CG 4.27Å; L158-C160 PolarHBondContact O-N 2.83Å; L158-L173 CarbonylContact O-C 3.56Å; L158-L173 VanDerWaalsContact O-CA 3.27Å; L158-L173 WeakPolarHBondContact O-CA 3.15Å; L158-A174 PolarHBondContact N-O 3.01Å; L158-A174 PolarHBondContact O-N 2.86Å; L158-E177 WeakPolarHBondContact CD1-OE2 3.47Å; L158-L180 HydrophobicContact CB-CD2 4.18Å; L158-L180 HydrophobicContact CD1-CD2 4.18Å
159	P	92.3	Very high	78.7	Confident	9 Å²	9	66.1 Å²	66.1	6%	0.058	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	121.1	176.6	-19.9	31.7	0	0	0	112.5	V126 T136 L139 L173	V126-P159 HydrophobicContact CG1-CB 3.86Å; V126-P159 HydrophobicContact CG1-CG 4.03Å; T136-P159 HydrophobicContact CG2-CG 3.89Å; L139-P159 HydrophobicContact CD1-CG 4.02Å; P159-L173 HydrophobicContact CB-CD2 3.98Å; P159-L173 HydrophobicContact CG-CD2 3.96Å
160	C	89.4	Confident	80.2	Confident	7 Å²	7	58.4 Å²	58.4	5%	0.047	31%	0.311	C	S	.	.			trans	-85	-56.5	-175.9	-47.1	0	0	0	0	112.7	L158 L172 A174 L180 I183 L184	L158-C160 PolarHBondContact O-N 2.83Å; C160-L172 HydrophobicContact CB-CB 4.48Å; C160-L172 HydrophobicContact CB-CD2 4.2Å; C160-L172 HydrophobicContact CB-CG 4.15Å; C160-L172 PolarHBondContact N-O 3.26Å; C160-A174 VanDerWaalsContact SG-CB 3.51Å; C160-A174 PolarHBondContact SG-N 3.43Å; C160-L180 VanDerWaalsContact CA-CD1 3.45Å; C160-L180 HydrophobicContact CB-CD1 3.78Å; C160-I183 HydrophobicContact CB-CB 4.5Å; C160-I183 HydrophobicContact CB-CG2 3.8Å; C160-L184 WeakPolarHBondContact O-CD2 3.43Å
161	L	84.9	Confident	82.1	Confident	13 Å²	13	48.8 Å²	48.8	7%	0.068	27%	0.269	C	S	.	.	S	Bend	trans	-114	122.4	-174.9	-56.5	174.6	0	0	0	107.6	L172 L184 V192	L161-L172 HydrophobicContact CD1-CD2 4.21Å; L161-L184 HydrophobicContact CD2-CD2 4.28Å; L161-V192 HydrophobicContact CD1-CG1 3.82Å
162	G	81.2	Confident	84	Confident	57 Å²	57	45.8 Å²	45.8	59%	0.588	25%	0.25	S	S	*	.			trans	-62.4	138.8	-176.1	0	0	0	0	0	111.7
163	L	90.4	Very high	86.1	Confident	17 Å²	17	36.5 Å²	36.5	9%	0.089	21%	0.21	C	C	.	.			trans	-124	138.5	170.7	-166.9	61.1	0	0	0	108.7	K120 V126 S167 L171 Y196 A339	K120-L163 HydrophobicContact CB-CD2 3.99Å; K120-L163 HydrophobicContact CD-CB 4.42Å; K120-L163 HydrophobicContact CD-CD2 3.9Å; K120-L163 HydrophobicContact CD-CG 4.39Å; V126-L163 HydrophobicContact CG2-CB 4.08Å; V126-L163 VanDerWaalsContact CG2-O 3.26Å; V126-L163 WeakPolarHBondContact CG2-O 3.44Å; L163-S167 VanDerWaalsContact CD1-OG 3.24Å; L163-S167 WeakPolarHBondContact CD1-OG 3.2Å; L163-L171 HydrophobicContact CB-CD1 4.07Å; L163-Y196 HydrophobicContact CD1-CE1 3.86Å; L163-A339 HydrophobicContact CD1-CB 4.21Å
164	E	91.6	Very high	88.1	Confident	36 Å²	36	30.2 Å²	30.2	17%	0.168	17%	0.171	C	C	.	.			trans	-66.8	153.9	-179.4	-59.2	-178.1	-157.6	0	0	111.5	K120 D166 S167 H284 R287	K120-E164 VanDerWaalsContact CE-O 3.23Å; K120-E164 WeakPolarHBondContact CE-O 3.48Å; K120-E164 PolarHBondContact NZ-O 3.36Å; K120-E164 VanDerWaalsContact NZ-O 3.12Å; E164-D166 VanDerWaalsContact C-N 3.31Å; E164-D166 PolarHBondContact O-N 2.99Å; E164-S167 PolarHBondContact O-N 2.94Å; E164-S167 VanDerWaalsContact O-N 3.11Å; E164-H284 VanDerWaalsContact OE1-CA 3.32Å; E164-H284 WeakPolarHBondContact OE1-CA 3.3Å; E164-H284 IonicContact OE1-CD2 2.95Å; E164-H284 PolarHBondContact OE1-CD2 3Å; E164-H284 VanDerWaalsContact OE1-CD2 3.32Å; E164-H284 IonicContact OE1-CG 3.52Å; E164-H284 IonicContact OE2-CD2 3.74Å; E164-H284 PolarHBondContact OE2-CD2 2.8Å; E164-H284 IonicContact OE2-NE2 2.73Å; E164-R287 WeakPolarHBondContact OE1-CD 3.24Å; E164-R287 WeakPolarHBondContact OE2-CD 3.21Å; E164-R287 IonicContact OE2-CZ 3.32Å; E164-R287 IonicContact OE2-NE 2.79Å; E164-R287 IonicContact OE2-NH1 3.97Å; E164-R287 PolarHBondContact OE2-NH1 3.43Å
165	K	91.8	Very high	89.9	Confident	54 Å²	54	24 Å²	24	24%	0.235	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-51.6	174.4	177.9	178.9	-176.4	158.2	0	111.9	K120 G123 V124 P125 E129 S167	K120-K165 PolarHBondContact NZ-O 2.88Å; G123-K165 CarbonylContact C-O 3.55Å; G123-K165 WeakPolarHBondContact CA-O 3.31Å; G123-K165 PolarHBondContact N-O 2.98Å; G123-K165 WeakPolarHBondContact O-CE 3.37Å; G123-K165 VanDerWaalsContact O-CG 3.31Å; G123-K165 WeakPolarHBondContact O-CG 3.34Å; V124-K165 PolarHBondContact N-O 2.79Å; P125-K165 HydrophobicContact CB-CB 4.37Å; P125-K165 HydrophobicContact CB-CD 4.46Å; P125-K165 HydrophobicContact CB-CG 4.26Å; E129-K165 VanDerWaalsContact CD-NZ 3.27Å; E129-K165 IonicContact OE1-NZ 3.73Å; E129-K165 PolarHBondContact OE1-NZ 3.31Å; E129-K165 IonicContact OE2-NZ 3.64Å; E129-K165 PolarHBondContact OE2-NZ 3Å; K165-S167 VanDerWaalsContact C-N 3.33Å
166	D	92.8	Very high	91.4	Very high	53 Å²	53	23.7 Å²	23.7	28%	0.283	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	1.2	-177.5	-60.7	-34	0	0	0	113.2	Y122 E164 L335	Y122-D166 HydrophobicContact CD2-CB 4.5Å; Y122-D166 WeakPolarHBondContact CD2-O 3.39Å; Y122-D166 HydrophobicContact CE2-CB 3.72Å; Y122-D166 WeakPolarHBondContact CE2-O 3.33Å; E164-D166 VanDerWaalsContact C-N 3.31Å; E164-D166 PolarHBondContact O-N 2.99Å; D166-L335 HydrophobicContact CB-CB 4.03Å; D166-L335 HydrophobicContact CB-CD2 4.07Å
167	S	94.2	Very high	91.9	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.007	13%	0.131	C	C	.	.			trans	-84.3	144.6	167.7	-174	0	0	0	0	109.4	K120 L163 E164 K165 L337	K120-S167 WeakPolarHBondContact CE-O 3.24Å; K120-S167 PolarHBondContact NZ-O 2.68Å; L163-S167 VanDerWaalsContact CD1-OG 3.24Å; L163-S167 WeakPolarHBondContact CD1-OG 3.2Å; E164-S167 PolarHBondContact O-N 2.94Å; E164-S167 VanDerWaalsContact O-N 3.11Å; K165-S167 VanDerWaalsContact C-N 3.33Å; S167-L337 PolarHBondContact OG-O 3.07Å
168	S	95.6	Very high	92	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.014	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	169.4	171.8	58.8	0	0	0	0	110.8	K120 L337 H338 A339	K120-S168 WeakPolarHBondContact O-CA 3.47Å; S168-L337 PolarHBondContact N-O 2.77Å; S168-H338 CarbonylContact O-C 3.51Å; S168-H338 WeakPolarHBondContact O-CA 3.46Å; S168-H338 PolarHBondContact OG-ND1 3.45Å; S168-A339 PolarHBondContact O-N 3.28Å
169	G	96.1	Very high	92	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	112.5	-158	167.5	0	0	0	0	0	115.2	K120 L171 H338 A339 C356	K120-G169 PolarHBondContact N-O 3.11Å; K120-G169 PolarHBondContact O-N 2.86Å; G169-L171 PolarHBondContact O-N 2.94Å; G169-H338 WeakPolarHBondContact CA-CE1 3.32Å; G169-A339 WeakPolarHBondContact CA-O 3.4Å; G169-C356 VanDerWaalsContact CA-SG 3.54Å
170	A	96.4	Very high	92.1	Very high	10 Å²	10	25 Å²	25	8%	0.083	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	122.9	-173.8	0	0	0	0	0	112.6	L109 I117 L118 A339 L342 C356	L109-A170 HydrophobicContact CD1-CB 4.4Å; I117-A170 HydrophobicContact CG2-CB 4.08Å; L118-A170 CarbonylContact O-C 3.38Å; L118-A170 WeakPolarHBondContact O-CA 3.42Å; A170-A339 HydrophobicContact CB-CB 4.48Å; A170-A339 PolarHBondContact N-O 2.99Å; A170-L342 HydrophobicContact CB-CB 4.15Å; A170-C356 HydrophobicContact CB-CB 4.24Å
171	L	95.6	Very high	92.2	Very high	3 Å²	3	29 Å²	29	2%	0.016	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	120.2	173.2	176.6	68.2	0	0	0	109.3	I117 L118 K120 V126 V135 L163 G169 L173	I117-L171 WeakPolarHBondContact CA-O 3.47Å; L118-L171 PolarHBondContact N-O 3.26Å; L118-L171 PolarHBondContact O-N 2.88Å; K120-L171 HydrophobicContact CB-CB 4.14Å; K120-L171 HydrophobicContact CB-CD2 4.48Å; K120-L171 HydrophobicContact CD-CD2 4.38Å; V126-L171 HydrophobicContact CG1-CD1 4.34Å; V126-L171 HydrophobicContact CG1-CD2 4.45Å; V126-L171 HydrophobicContact CG2-CD1 4.12Å; V126-L171 HydrophobicContact CG2-CD2 4.24Å; V135-L171 HydrophobicContact CB-CD2 4.43Å; V135-L171 HydrophobicContact CG1-CD2 3.84Å; V135-L171 HydrophobicContact CG2-CD2 4.22Å; L163-L171 HydrophobicContact CB-CD1 4.07Å; G169-L171 PolarHBondContact O-N 2.94Å; L171-L173 HydrophobicContact CD2-CD2 4.18Å; L171-L173 HydrophobicContact CG-CD2 4.17Å
172	L	94.9	Very high	92.6	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.016	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	126.6	-180	-175.9	59.1	0	0	0	111.3	V115 I117 C160 L161 I183 L342 L344	V115-L172 HydrophobicContact CB-CD1 3.99Å; V115-L172 HydrophobicContact CG1-CD1 4.21Å; I117-L172 HydrophobicContact CD1-CD1 4.26Å; I117-L172 HydrophobicContact CG1-CD1 3.7Å; C160-L172 HydrophobicContact CB-CB 4.48Å; C160-L172 HydrophobicContact CB-CD2 4.2Å; C160-L172 HydrophobicContact CB-CG 4.15Å; C160-L172 PolarHBondContact N-O 3.26Å; L161-L172 HydrophobicContact CD1-CD2 4.21Å; L172-I183 HydrophobicContact CD2-CD1 4.15Å; L172-I183 HydrophobicContact CD2-CG2 3.63Å; L172-I183 HydrophobicContact CG-CD1 4.46Å; L172-L342 HydrophobicContact CB-CD2 3.76Å; L172-L342 HydrophobicContact CD1-CD2 4.08Å; L172-L342 HydrophobicContact CD2-CD2 4.19Å; L172-L342 HydrophobicContact CG-CD2 4.22Å; L172-L344 HydrophobicContact CD2-CD1 4.45Å
173	L	94.6	Very high	93.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.6	173.2	-51.2	179.2	0	0	0	109.9	V115 V116 L118 L139 L157 L158 P159 L171	V115-L173 CarbonylContact C-O 3.55Å; V115-L173 VanDerWaalsContact CA-O 3.31Å; V115-L173 WeakPolarHBondContact CA-O 3.27Å; V116-L173 HydrophobicContact CB-CB 4.25Å; V116-L173 HydrophobicContact CG1-CD1 4.47Å; V116-L173 PolarHBondContact N-O 2.91Å; V116-L173 WeakPolarHBondContact O-CB 3.38Å; V116-L173 PolarHBondContact O-N 3.13Å; L118-L173 HydrophobicContact CD1-CD1 3.48Å; L118-L173 VanDerWaalsContact CD1-CD1 3.48Å; L118-L173 HydrophobicContact CD1-CG 4.35Å; L118-L173 HydrophobicContact CG-CD1 3.95Å; L139-L173 HydrophobicContact CD2-CD1 3.62Å; L139-L173 HydrophobicContact CD2-CD2 4.49Å; L157-L173 HydrophobicContact CB-CD1 4.28Å; L157-L173 HydrophobicContact CD1-CD1 4.3Å; L158-L173 CarbonylContact O-C 3.56Å; L158-L173 VanDerWaalsContact O-CA 3.27Å; L158-L173 WeakPolarHBondContact O-CA 3.15Å; P159-L173 HydrophobicContact CB-CD2 3.98Å; P159-L173 HydrophobicContact CG-CD2 3.96Å; L171-L173 HydrophobicContact CD2-CD2 4.18Å; L171-L173 HydrophobicContact CG-CD2 4.17Å
174	A	93.4	Very high	93.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	150.9	170.2	0	0	0	0	0	110.1	L157 L158 C160 V179 L180 I183	L157-A174 CarbonylContact C-O 3.52Å; L157-A174 VanDerWaalsContact CA-O 3.3Å; L157-A174 WeakPolarHBondContact CA-O 3.3Å; L158-A174 PolarHBondContact N-O 3.01Å; L158-A174 PolarHBondContact O-N 2.86Å; C160-A174 VanDerWaalsContact SG-CB 3.51Å; C160-A174 PolarHBondContact SG-N 3.43Å; A174-V179 HydrophobicContact CB-CB 4.11Å; A174-V179 HydrophobicContact CB-CG1 3.85Å; A174-L180 HydrophobicContact CB-CB 3.95Å; A174-I183 HydrophobicContact CB-CD1 4.34Å
175	R	91.3	Very high	93.3	Very high	26 Å²	26	30.7 Å²	30.7	10%	0.098	17%	0.17	C	C	.	.	S	Bend	trans	-91.5	-6.2	175.3	-74	175.7	159.3	-85.5	-3.5	114.1	R111 D112 K113 D114 V116 D147 T155 E156 L157	R111-R175 VanDerWaalsContact NE-NH2 3.17Å; D112-R175 PolarHBondContact O-NE 3.43Å; K113-R175 VanDerWaalsContact C-CD 3.48Å; K113-R175 WeakPolarHBondContact O-CD 3.19Å; D114-R175 WeakPolarHBondContact O-CB 3.5Å; D114-R175 PolarHBondContact O-N 3.07Å; V116-R175 HydrophobicContact CG2-CG 4.31Å; D147-R175 IonicContact OD1-CZ 2.9Å; D147-R175 IonicContact OD1-NH1 3.84Å; D147-R175 PolarHBondContact OD1-NH1 3.03Å; D147-R175 IonicContact OD1-NH2 3.45Å; D147-R175 PolarHBondContact OD1-NH2 3.5Å; D147-R175 IonicContact OD2-CZ 3.64Å; D147-R175 IonicContact OD2-NH1 2.75Å; D147-R175 PolarHBondContact OD2-NH1 3.35Å; D147-R175 IonicContact OD2-NH2 3.61Å; T155-R175 HydrophobicContact CG2-CB 4.02Å; T155-R175 HydrophobicContact CG2-CG 4.33Å; E156-R175 CarbonylContact O-C 3.5Å; L157-R175 HydrophobicContact CD2-CG 3.75Å
176	S	90.4	Very high	93.3	Very high	48 Å²	48	28.8 Å²	28.8	34%	0.336	16%	0.163	S	C	.	.	S	Bend	trans	-154	157.4	176.7	66.6	0	0	0	0	111.3	A178 V179 L180	S176-A178 VanDerWaalsContact C-N 3.27Å; S176-A178 PolarHBondContact O-N 3.05Å; S176-V179 PolarHBondContact O-N 3.26Å; S176-V179 VanDerWaalsContact O-N 3.17Å; S176-V179 VanDerWaalsContact OG-CG2 3.29Å; S176-V179 WeakPolarHBondContact OG-CG2 3.5Å; S176-V179 PolarHBondContact OG-N 3.27Å; S176-L180 PolarHBondContact O-N 2.71Å
177	E	92.1	Very high	93.2	Very high	106 Å²	106	26.3 Å²	26.3	50%	0.495	15%	0.15	S	C	.	.	H	α-helix	trans	-59.7	-38.2	175.6	-165.5	63.5	-157.4	0	0	111.9	L158 V179 L180 E181	L158-E177 WeakPolarHBondContact CD1-OE2 3.47Å; E177-V179 VanDerWaalsContact C-N 3.3Å; E177-V179 PolarHBondContact O-N 3.24Å; E177-L180 WeakPolarHBondContact O-CB 3.39Å; E177-L180 PolarHBondContact O-N 3.17Å; E177-L180 VanDerWaalsContact O-N 3.17Å; E177-E181 PolarHBondContact O-N 3.02Å
178	A	91.9	Very high	93.1	Very high	66 Å²	66	32.8 Å²	32.8	55%	0.545	17%	0.174	S	C	.	.	H	α-helix	trans	-63	-36.8	177.5	0	0	0	0	0	112.5	S176 H182	S176-A178 VanDerWaalsContact C-N 3.27Å; S176-A178 PolarHBondContact O-N 3.05Å; A178-H182 WeakPolarHBondContact O-CB 3.35Å; A178-H182 PolarHBondContact O-N 3.5Å
179	V	92.1	Very high	92.8	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.024	19%	0.194	C	C	.	.	H	α-helix	trans	-73.3	-38.3	174.7	172.9	0	0	0	0	110.8	D114 V115 A174 S176 E177 H182 I183	D114-V179 HydrophobicContact CB-CG1 4.12Å; D114-V179 HydrophobicContact CB-CG2 3.99Å; V115-V179 HydrophobicContact CG1-CG1 3.98Å; A174-V179 HydrophobicContact CB-CB 4.11Å; A174-V179 HydrophobicContact CB-CG1 3.85Å; S176-V179 PolarHBondContact O-N 3.26Å; S176-V179 VanDerWaalsContact O-N 3.17Å; S176-V179 VanDerWaalsContact OG-CG2 3.29Å; S176-V179 WeakPolarHBondContact OG-CG2 3.5Å; S176-V179 PolarHBondContact OG-N 3.27Å; E177-V179 VanDerWaalsContact C-N 3.3Å; E177-V179 PolarHBondContact O-N 3.24Å; V179-H182 PolarHBondContact O-N 3.15Å; V179-I183 HydrophobicContact CG1-CD1 3.65Å; V179-I183 HydrophobicContact CG1-CG1 4.31Å; V179-I183 VanDerWaalsContact O-CG1 3.31Å; V179-I183 WeakPolarHBondContact O-CG1 3.37Å; V179-I183 PolarHBondContact O-N 3.42Å
180	L	92.9	Very high	92.5	Very high	19 Å²	19	39.6 Å²	39.6	10%	0.099	22%	0.215	C	C	.	.	H	α-helix	trans	-57.5	-54	175.4	173.3	61.5	0	0	0	111.2	L158 C160 A174 S176 E177 H182 I183 L184	L158-L180 HydrophobicContact CB-CD2 4.18Å; L158-L180 HydrophobicContact CD1-CD2 4.18Å; C160-L180 VanDerWaalsContact CA-CD1 3.45Å; C160-L180 HydrophobicContact CB-CD1 3.78Å; A174-L180 HydrophobicContact CB-CB 3.95Å; S176-L180 PolarHBondContact O-N 2.71Å; E177-L180 WeakPolarHBondContact O-CB 3.39Å; E177-L180 PolarHBondContact O-N 3.17Å; E177-L180 VanDerWaalsContact O-N 3.17Å; L180-H182 VanDerWaalsContact C-N 3.28Å; L180-H182 PolarHBondContact O-N 3.49Å; L180-I183 PolarHBondContact O-N 2.91Å; L180-I183 VanDerWaalsContact O-N 3.16Å; L180-L184 HydrophobicContact CD1-CD1 4.09Å; L180-L184 HydrophobicContact CD1-CG 4.12Å; L180-L184 HydrophobicContact CG-CD1 4.11Å; L180-L184 WeakPolarHBondContact O-CG 3.43Å; L180-L184 PolarHBondContact O-N 3.42Å
181	E	92.7	Very high	92.3	Very high	91 Å²	91	44.1 Å²	44.1	43%	0.425	23%	0.234	S	C	.	.	H	α-helix	trans	-60.5	-38.6	179.5	-78.6	-60.4	156	0	0	112.3	E177 L184 S185	E177-E181 PolarHBondContact O-N 3.02Å; E181-L184 PolarHBondContact O-N 2.87Å; E181-S185 WeakPolarHBondContact O-CB 3.06Å; E181-S185 PolarHBondContact O-N 3.03Å
182	H	92.7	Very high	92.1	Very high	62 Å²	62	44.3 Å²	44.3	29%	0.287	24%	0.235	S	C	.	.	H	α-helix	trans	-61.4	-48.3	174	-177.5	-100.5	0	0	0	112.1	A178 V179 L180 L184 S185 L186 R347	A178-H182 WeakPolarHBondContact O-CB 3.35Å; A178-H182 PolarHBondContact O-N 3.5Å; V179-H182 PolarHBondContact O-N 3.15Å; L180-H182 VanDerWaalsContact C-N 3.28Å; L180-H182 PolarHBondContact O-N 3.49Å; H182-L184 VanDerWaalsContact C-N 3.32Å; H182-L184 PolarHBondContact O-N 3.09Å; H182-S185 WeakPolarHBondContact O-CB 3.46Å; H182-S185 PolarHBondContact O-N 3.2Å; H182-S185 VanDerWaalsContact O-N 3.16Å; H182-L186 VanDerWaalsContact CE1-CD1 3.49Å; H182-L186 WeakPolarHBondContact CE1-CD1 3.43Å; H182-L186 WeakPolarHBondContact O-CG 3.37Å; H182-L186 PolarHBondContact O-N 3.41Å; H182-R347 WeakPolarHBondContact CE1-CG 3.39Å; H182-R347 WeakPolarHBondContact ND1-CD 3.42Å
183	I	92.6	Very high	92.1	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.015	25%	0.254	C	S	.	.	H	α-helix	trans	-62.5	-40.1	177.6	-70.2	164.5	0	0	0	111.2	V115 C160 L172 A174 V179 L180 S185 L186 S187 L344	V115-I183 HydrophobicContact CG1-CD1 3.63Å; C160-I183 HydrophobicContact CB-CB 4.5Å; C160-I183 HydrophobicContact CB-CG2 3.8Å; L172-I183 HydrophobicContact CD2-CD1 4.15Å; L172-I183 HydrophobicContact CD2-CG2 3.63Å; L172-I183 HydrophobicContact CG-CD1 4.46Å; A174-I183 HydrophobicContact CB-CD1 4.34Å; V179-I183 HydrophobicContact CG1-CD1 3.65Å; V179-I183 HydrophobicContact CG1-CG1 4.31Å; V179-I183 VanDerWaalsContact O-CG1 3.31Å; V179-I183 WeakPolarHBondContact O-CG1 3.37Å; V179-I183 PolarHBondContact O-N 3.42Å; L180-I183 PolarHBondContact O-N 2.91Å; L180-I183 VanDerWaalsContact O-N 3.16Å; I183-S185 VanDerWaalsContact C-N 3.3Å; I183-S185 PolarHBondContact O-N 2.84Å; I183-L186 PolarHBondContact O-N 3.47Å; I183-S187 WeakPolarHBondContact O-CB 3.47Å; I183-S187 PolarHBondContact O-N 2.59Å; I183-L344 HydrophobicContact CG1-CD1 4.44Å
184	L	92.5	Very high	92	Very high	29 Å²	29	48.9 Å²	48.9	15%	0.152	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-38.9	175.7	-68.8	177.6	0	0	0	111.2	C160 L161 L180 E181 H182 S187 R188	C160-L184 WeakPolarHBondContact O-CD2 3.43Å; L161-L184 HydrophobicContact CD2-CD2 4.28Å; L180-L184 HydrophobicContact CD1-CD1 4.09Å; L180-L184 HydrophobicContact CD1-CG 4.12Å; L180-L184 HydrophobicContact CG-CD1 4.11Å; L180-L184 WeakPolarHBondContact O-CG 3.43Å; L180-L184 PolarHBondContact O-N 3.42Å; E181-L184 PolarHBondContact O-N 2.87Å; H182-L184 VanDerWaalsContact C-N 3.32Å; H182-L184 PolarHBondContact O-N 3.09Å; L184-S187 PolarHBondContact O-N 3.37Å; L184-R188 VanDerWaalsContact O-CG 3.29Å; L184-R188 WeakPolarHBondContact O-CG 3.36Å; L184-R188 PolarHBondContact O-N 2.88Å
185	S	92.7	Very high	92.2	Very high	64 Å²	64	51 Å²	51	45%	0.448	27%	0.266	S	S	.	.	H	α-helix	trans	-61.3	-50.4	172.5	-169.8	0	0	0	0	112	E181 H182 I183 S187 R188 S189	E181-S185 WeakPolarHBondContact O-CB 3.06Å; E181-S185 PolarHBondContact O-N 3.03Å; H182-S185 WeakPolarHBondContact O-CB 3.46Å; H182-S185 PolarHBondContact O-N 3.2Å; H182-S185 VanDerWaalsContact O-N 3.16Å; I183-S185 VanDerWaalsContact C-N 3.3Å; I183-S185 PolarHBondContact O-N 2.84Å; S185-S187 PolarHBondContact O-N 3.25Å; S185-R188 WeakPolarHBondContact O-CB 3.31Å; S185-R188 PolarHBondContact O-N 3.39Å; S185-S189 PolarHBondContact O-N 2.96Å; S185-S189 PolarHBondContact O-OG 3.28Å
186	L	92.3	Very high	92.5	Very high	14 Å²	14	50.8 Å²	50.8	7%	0.073	27%	0.265	C	S	.	.	H	α-helix	trans	-57.5	-37.2	175.4	-67.5	177.5	0	0	0	112.3	H182 I183 S189 N190 Q191 V192 P345	H182-L186 VanDerWaalsContact CE1-CD1 3.49Å; H182-L186 WeakPolarHBondContact CE1-CD1 3.43Å; H182-L186 WeakPolarHBondContact O-CG 3.37Å; H182-L186 PolarHBondContact O-N 3.41Å; I183-L186 PolarHBondContact O-N 3.47Å; L186-S189 WeakPolarHBondContact CA-OG 3.11Å; L186-S189 PolarHBondContact O-N 3.18Å; L186-S189 PolarHBondContact O-OG 3.07Å; L186-N190 PolarHBondContact O-N 2.83Å; L186-Q191 HydrophobicContact CB-CB 4.32Å; L186-Q191 HydrophobicContact CD2-CB 4.23Å; L186-Q191 PolarHBondContact O-N 2.94Å; L186-V192 HydrophobicContact CB-CG2 3.72Å; L186-P345 HydrophobicContact CD1-CG 3.81Å; L186-P345 HydrophobicContact CD2-CG 3.98Å; L186-P345 HydrophobicContact CG-CG 4.48Å
187	S	91.1	Very high	92.8	Very high	1 Å²	1	49 Å²	49	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-68.8	-41.6	177.4	-158.6	0	0	0	0	110.8	I183 L184 S185 S189 N190 G279	I183-S187 WeakPolarHBondContact O-CB 3.47Å; I183-S187 PolarHBondContact O-N 2.59Å; L184-S187 PolarHBondContact O-N 3.37Å; S185-S187 PolarHBondContact O-N 3.25Å; S187-S189 VanDerWaalsContact C-N 3.27Å; S187-S189 PolarHBondContact O-N 2.83Å; S187-N190 PolarHBondContact O-N 2.85Å; S187-G279 VanDerWaalsContact C-CA 3.43Å; S187-G279 WeakPolarHBondContact O-CA 3.5Å; S187-G279 PolarHBondContact OG-O 2.81Å
188	R	90.5	Very high	93.1	Very high	138 Å²	138	43.9 Å²	43.9	52%	0.521	23%	0.227	S	C	.	.	H	α-helix	trans	-61.9	-33.3	175.2	-69.7	171.8	-163.7	126.8	-0.8	112.4	L184 S185 N190 T280	L184-R188 VanDerWaalsContact O-CG 3.29Å; L184-R188 WeakPolarHBondContact O-CG 3.36Å; L184-R188 PolarHBondContact O-N 2.88Å; S185-R188 WeakPolarHBondContact O-CB 3.31Å; S185-R188 PolarHBondContact O-N 3.39Å; R188-N190 VanDerWaalsContact C-N 3.3Å; R188-T280 HydrophobicContact CG-CG2 4.36Å
189	S	90.4	Very high	93.5	Very high	61 Å²	61	40.8 Å²	40.8	43%	0.427	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	8	174.6	57.7	0	0	0	0	114.2	S185 L186 S187 Q191	S185-S189 PolarHBondContact O-N 2.96Å; S185-S189 PolarHBondContact O-OG 3.28Å; L186-S189 WeakPolarHBondContact CA-OG 3.11Å; L186-S189 PolarHBondContact O-N 3.18Å; L186-S189 PolarHBondContact O-OG 3.07Å; S187-S189 VanDerWaalsContact C-N 3.27Å; S187-S189 PolarHBondContact O-N 2.83Å; S189-Q191 PolarHBondContact O-N 2.87Å; S189-Q191 WeakPolarHBondContact OG-CG 3.33Å; S189-Q191 PolarHBondContact OG-OE1 3.02Å
190	N	89.3	Confident	93.7	Very high	84 Å²	84	40.6 Å²	40.6	45%	0.449	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	26.5	-178.5	-71.8	-34.1	0	0	0	115	L186 S187 R188 L277	L186-N190 PolarHBondContact O-N 2.83Å; S187-N190 PolarHBondContact O-N 2.85Å; R188-N190 VanDerWaalsContact C-N 3.3Å; N190-L277 PolarHBondContact ND2-O 3.14Å; N190-L277 VanDerWaalsContact OD1-C 3.3Å; N190-L277 PolarHBondContact OD1-O 2.97Å
191	Q	91.4	Very high	94	Very high	105 Å²	105	40.4 Å²	40.4	49%	0.491	20%	0.2	S	C	.	.			trans	-87	-12.4	175.4	-64.3	176.3	-68.2	0	0	112.8	L186 S189 P345	L186-Q191 HydrophobicContact CB-CB 4.32Å; L186-Q191 HydrophobicContact CD2-CB 4.23Å; L186-Q191 PolarHBondContact O-N 2.94Å; S189-Q191 PolarHBondContact O-N 2.87Å; S189-Q191 WeakPolarHBondContact OG-CG 3.33Å; S189-Q191 PolarHBondContact OG-OE1 3.02Å; Q191-P345 HydrophobicContact CB-CG 4.35Å; Q191-P345 WeakPolarHBondContact O-CD 3.44Å
192	V	92.8	Very high	94.2	Very high	6 Å²	6	37.2 Å²	37.2	4%	0.036	19%	0.191	C	C	.	.	S	Bend	trans	-94.3	110.1	172.9	-175.7	0	0	0	0	109.7	L161 L186 R194 L342 A343 L344	L161-V192 HydrophobicContact CD1-CG1 3.82Å; L186-V192 HydrophobicContact CB-CG2 3.72Å; V192-R194 HydrophobicContact CG1-CG 4.27Å; V192-L342 HydrophobicContact CG1-CD1 3.96Å; V192-A343 CarbonylContact C-O 3.6Å; V192-A343 WeakPolarHBondContact CA-O 3.17Å; V192-L344 HydrophobicContact CG1-CB 4.41Å; V192-L344 HydrophobicContact CG2-CB 4.27Å
193	E	93.7	Very high	94.4	Very high	87 Å²	87	37 Å²	37	41%	0.407	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	126.1	176	-65.2	-167.3	172.7	0	0	110.8	L342 A343	E193-L342 CarbonylContact O-C 3.55Å; E193-L342 WeakPolarHBondContact O-CA 3.21Å; E193-A343 HydrophobicContact CB-CB 4.08Å; E193-A343 PolarHBondContact N-O 3.21Å; E193-A343 PolarHBondContact O-N 3.17Å
194	R	94.1	Very high	94.6	Very high	13 Å²	13	37 Å²	37	5%	0.049	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	119.4	175.2	-63.1	160.5	-70.9	-175	8.7	108.1	V192 Y196 Q275 P276 T278 G279 Q341 L342	V192-R194 HydrophobicContact CG1-CG 4.27Å; R194-Y196 HydrophobicContact CB-CD2 4.41Å; R194-Y196 HydrophobicContact CB-CE2 3.67Å; R194-Q275 WeakPolarHBondContact O-CA 3.36Å; R194-P276 HydrophobicContact CB-CG 4.45Å; R194-P276 PolarHBondContact NH2-O 3.09Å; R194-P276 WeakPolarHBondContact O-CD 3.42Å; R194-T278 PolarHBondContact NH2-O 2.8Å; R194-G279 PolarHBondContact NH1-O 3.35Å; R194-Q341 WeakPolarHBondContact CA-O 3.44Å; R194-L342 HydrophobicContact CG-CD1 3.63Å
195	K	96.3	Very high	94.7	Very high	45 Å²	45	41.7 Å²	41.7	20%	0.196	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127.8	173.5	-55.5	-175.4	-171.6	164.4	0	109.7	E273 L274 R340 Q341	K195-E273 HydrophobicContact CB-CG 4.35Å; K195-L274 WeakPolarHBondContact CA-O 3.43Å; K195-R340 PolarHBondContact O-N 2.96Å; K195-Q341 HydrophobicContact CB-CB 4.02Å; K195-Q341 HydrophobicContact CG-CB 4.43Å; K195-Q341 PolarHBondContact N-O 3.31Å; K195-Q341 PolarHBondContact O-N 3.4Å
196	Y	97.6	Very high	94.9	Very high	20 Å²	20	42.5 Å²	42.5	8%	0.078	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	138.6	177.1	-63.9	-101.8	0	0	0	108.9	L163 R194 E273 L274 P276 M286 L337 H338 A339	L163-Y196 HydrophobicContact CD1-CE1 3.86Å; R194-Y196 HydrophobicContact CB-CD2 4.41Å; R194-Y196 HydrophobicContact CB-CE2 3.67Å; Y196-E273 CarbonylContact O-C 3.41Å; Y196-E273 WeakPolarHBondContact O-CA 3.45Å; Y196-L274 PolarHBondContact N-O 3.04Å; Y196-L274 PolarHBondContact O-N 2.92Å; Y196-P276 HydrophobicContact CD2-CG 4.07Å; Y196-P276 HydrophobicContact CE2-CG 3.6Å; Y196-M286 HydrophobicContact CD1-CE 3.59Å; Y196-M286 HydrophobicContact CD1-SD 4.09Å; Y196-M286 HydrophobicContact CD2-CE 3.83Å; Y196-M286 HydrophobicContact CD2-SD 3.53Å; Y196-M286 VanDerWaalsContact CD2-SD 3.53Å; Y196-M286 HydrophobicContact CE1-CE 3.7Å; Y196-M286 HydrophobicContact CE2-CE 3.94Å; Y196-M286 HydrophobicContact CE2-SD 4.12Å; Y196-M286 HydrophobicContact CG-CE 3.66Å; Y196-M286 HydrophobicContact CG-SD 3.51Å; Y196-M286 VanDerWaalsContact CG-SD 3.51Å; Y196-L337 HydrophobicContact CD1-CD1 4.07Å; Y196-L337 HydrophobicContact CG-CD1 4.45Å; Y196-H338 CarbonylContact C-O 3.58Å; Y196-H338 WeakPolarHBondContact CA-O 3.35Å; Y196-A339 HydrophobicContact CD1-CB 3.8Å; Y196-A339 HydrophobicContact CE1-CB 3.53Å
197	W	98.3	Very high	95.1	Very high	10 Å²	10	45.3 Å²	45.3	4%	0.038	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	133.1	170.3	-73.8	4.9	0	0	0	109.4	L263 L271 V272 E273 H338 R340 M358 F362 F373 P374	W197-L263 HydrophobicContact CD2-CD1 4.14Å; W197-L263 HydrophobicContact CG-CD1 4.44Å; W197-L263 HydrophobicContact CZ2-CD1 3.9Å; W197-L271 HydrophobicContact CB-CD1 4.22Å; W197-V272 WeakPolarHBondContact CA-O 3.49Å; W197-E273 PolarHBondContact NE1-OE2 2.92Å; W197-E273 VanDerWaalsContact NE1-OE2 3.1Å; W197-H338 PolarHBondContact N-O 3.28Å; W197-H338 PolarHBondContact O-N 3.06Å; W197-R340 HydrophobicContact CB-CB 4.4Å; W197-R340 HydrophobicContact CD2-CB 4.17Å; W197-R340 HydrophobicContact CD2-CG 3.84Å; W197-R340 HydrophobicContact CE3-CG 4.18Å; W197-R340 HydrophobicContact CG-CB 3.97Å; W197-R340 HydrophobicContact CG-CG 4.17Å; W197-R340 HydrophobicContact CZ2-CG 4.26Å; W197-R340 HydrophobicContact CZ3-CG 4.49Å; W197-M358 HydrophobicContact CB-CE 4.47Å; W197-M358 HydrophobicContact CE3-CE 4.29Å; W197-M358 HydrophobicContact CE3-SD 3.93Å; W197-F362 HydrophobicContact CB-CZ 4.47Å; W197-F373 HydrophobicContact CE3-CD1 4.07Å; W197-F373 HydrophobicContact CE3-CE1 4.04Å; W197-F373 HydrophobicContact CH2-CD1 4.01Å; W197-F373 AromaticContact CZ3-CD1 3.29Å; W197-F373 HydrophobicContact CZ3-CD1 3.29Å; W197-F373 AromaticContact CZ3-CE1 3.57Å; W197-F373 HydrophobicContact CZ3-CE1 3.57Å; W197-F373 HydrophobicContact CZ3-CG 4.36Å; W197-P374 HydrophobicContact CH2-CG 4.12Å; W197-P374 HydrophobicContact CZ2-CG 4.05Å
198	V	98.3	Very high	95.4	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	149.9	178.7	-56.8	0	0	0	0	111.1	T200 L271 V272 L274 I298 H336 L337	V198-T200 HydrophobicContact CG2-CG2 3.91Å; V198-L271 WeakPolarHBondContact O-CA 3.3Å; V198-L271 WeakPolarHBondContact O-CD1 3.47Å; V198-V272 HydrophobicContact CG2-CB 3.77Å; V198-V272 PolarHBondContact N-O 3.11Å; V198-V272 PolarHBondContact O-N 2.96Å; V198-L274 HydrophobicContact CB-CD1 4.44Å; V198-L274 HydrophobicContact CG1-CD1 3.7Å; V198-L274 HydrophobicContact CG1-CG 4.38Å; V198-L274 HydrophobicContact CG2-CD1 3.8Å; V198-L274 HydrophobicContact CG2-CG 4.05Å; V198-I298 HydrophobicContact CB-CD1 4.18Å; V198-I298 HydrophobicContact CB-CG1 4.12Å; V198-I298 HydrophobicContact CB-CG2 4.3Å; V198-I298 HydrophobicContact CG1-CD1 3.73Å; V198-I298 HydrophobicContact CG1-CG1 4.23Å; V198-I298 HydrophobicContact CG2-CG1 4.37Å; V198-H336 WeakPolarHBondContact CA-O 3.2Å; V198-H336 WeakPolarHBondContact CB-O 3.43Å; V198-L337 HydrophobicContact CG1-CB 4.4Å; V198-L337 HydrophobicContact CG1-CD1 3.35Å; V198-L337 HydrophobicContact CG1-CG 4.46Å
199	I	98.3	Very high	95.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.6	163.2	-57	-179.8	0	0	0	107	S270 I298 L299 H336 F362 T365 L366 L369 L371	I199-S270 CarbonylContact C-O 3.56Å; I199-S270 WeakPolarHBondContact CA-O 3.32Å; I199-I298 CarbonylContact O-C 3.52Å; I199-I298 WeakPolarHBondContact O-CA 3.48Å; I199-L299 HydrophobicContact CB-CB 4.18Å; I199-L299 HydrophobicContact CB-CD2 4.37Å; I199-L299 HydrophobicContact CG2-CB 4.08Å; I199-L299 HydrophobicContact CG2-CD2 3.84Å; I199-L299 WeakPolarHBondContact O-CB 3.41Å; I199-L299 PolarHBondContact O-N 3.26Å; I199-H336 HydrophobicContact CB-CB 3.92Å; I199-H336 HydrophobicContact CD1-CB 4.44Å; I199-H336 HydrophobicContact CG1-CB 4.17Å; I199-H336 PolarHBondContact N-O 3.19Å; I199-F362 HydrophobicContact CD1-CD1 3.93Å; I199-F362 HydrophobicContact CD1-CE1 3.66Å; I199-F362 HydrophobicContact CD1-CZ 4.19Å; I199-F362 HydrophobicContact CG1-CD1 4.29Å; I199-F362 HydrophobicContact CG1-CE1 3.53Å; I199-F362 HydrophobicContact CG1-CE2 4.46Å; I199-F362 HydrophobicContact CG1-CZ 3.64Å; I199-T365 HydrophobicContact CD1-CG2 3.63Å; I199-L366 HydrophobicContact CD1-CD2 3.7Å; I199-L366 HydrophobicContact CD1-CG 3.93Å; I199-L366 HydrophobicContact CG1-CD2 4.01Å; I199-L369 HydrophobicContact CG2-CD1 3.85Å; I199-L371 HydrophobicContact CG2-CD1 4.12Å
200	T	98.2	Very high	96.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	153.1	175.7	57.1	0	0	0	0	112.1	V198 G202 C269 S270 V272 M290 C296 P297 I298	V198-T200 HydrophobicContact CG2-CG2 3.91Å; T200-G202 PolarHBondContact OG1-O 3.38Å; T200-C269 WeakPolarHBondContact O-CA 3.33Å; T200-C269 VanDerWaalsContact O-CB 3.29Å; T200-C269 WeakPolarHBondContact O-CB 3.23Å; T200-C269 PolarHBondContact O-SG 2.9Å; T200-S270 PolarHBondContact N-O 3.41Å; T200-S270 PolarHBondContact O-N 3.32Å; T200-S270 PolarHBondContact OG1-O 3.33Å; T200-S270 PolarHBondContact OG1-OG 3.12Å; T200-V272 HydrophobicContact CG2-CG2 4.15Å; T200-M290 HydrophobicContact CG2-CE 3.57Å; T200-C296 WeakPolarHBondContact CG2-O 3.05Å; T200-P297 WeakPolarHBondContact CA-O 3.43Å; T200-I298 HydrophobicContact CG2-CG1 4.44Å
201	V	97.6	Very high	96.5	Very high	16 Å²	16	44.2 Å²	44.2	10%	0.097	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	121.3	163.8	-175.9	0	0	0	0	106.7	C296 P297 L299 L315 P316	V201-C296 CarbonylContact O-C 3.53Å; V201-C296 VanDerWaalsContact O-CA 3.26Å; V201-C296 WeakPolarHBondContact O-CA 3.3Å; V201-P297 PolarHBondContact N-O 2.91Å; V201-L299 HydrophobicContact CG2-CB 4.42Å; V201-L299 HydrophobicContact CG2-CD1 3.86Å; V201-L315 HydrophobicContact CG1-CD2 4.49Å; V201-L315 HydrophobicContact CG2-CD2 3.56Å; V201-P316 HydrophobicContact CG1-CG 4.27Å
202	G	96.6	Very high	96.7	Very high	24 Å²	24	44.6 Å²	44.6	25%	0.247	26%	0.256	C	S	.	.	S	Bend	trans	92.2	159.9	-163.2	0	0	0	0	0	112	T200 G268 S270	T200-G202 PolarHBondContact OG1-O 3.38Å; G202-G268 WeakPolarHBondContact CA-O 3.42Å; G202-G268 PolarHBondContact N-O 2.97Å; G202-S270 PolarHBondContact O-OG 3.05Å; G202-S270 VanDerWaalsContact O-OG 3.09Å
203	V	97.1	Very high	96.8	Very high	56 Å²	56	46.6 Å²	46.6	34%	0.339	27%	0.266	S	S	.	.			trans	-113.7	119.9	176.6	-176.3	0	0	0	0	107.4	V205 C296	V203-V205 PolarHBondContact O-N 3.45Å; V203-C296 VanDerWaalsContact C-SG 3.55Å
204	P	97.1	Very high	96.8	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.019	25%	0.253	C	S	.	.			trans	-53.3	136.2	174.9	-30.6	37.2	0	0	0	112.8	P206 Y260 V262 S270 V272 M290 L294 C296	P204-P206 CarbonylContact C-O 3.46Å; P204-P206 CarbonylContact O-C 3.58Å; P204-Y260 HydrophobicContact CB-CD2 4.24Å; P204-Y260 HydrophobicContact CB-CE2 3.74Å; P204-V262 HydrophobicContact CB-CG2 3.93Å; P204-V262 HydrophobicContact CG-CG2 3.9Å; P204-S270 WeakPolarHBondContact CD-OG 3.44Å; P204-V272 HydrophobicContact CG-CG2 4.13Å; P204-M290 HydrophobicContact CG-CE 3.88Å; P204-L294 HydrophobicContact CB-CD1 4.05Å; P204-L294 HydrophobicContact CG-CD1 4.21Å; P204-C296 HydrophobicContact CG-CB 4.25Å
205	V	95.2	Very high	96.9	Very high	129 Å²	129	42.9 Å²	42.9	78%	0.782	25%	0.251	S	S	*	.	S	Bend	trans	-128.2	119.6	171.5	-178.6	0	0	0	0	107.6	V203	V203-V205 PolarHBondContact O-N 3.45Å
206	P	96.9	Very high	96.8	Very high	81 Å²	81	41 Å²	41	53%	0.526	24%	0.243	S	C	.	.	S	Bend	cis	-64	168.3	-3.4	28.2	-34.7	0	0	0	113.5	P204 E208 Y260	P204-P206 CarbonylContact C-O 3.46Å; P204-P206 CarbonylContact O-C 3.58Å; P206-E208 WeakPolarHBondContact CG-O 3.42Å; P206-E208 PolarHBondContact O-N 3.37Å; P206-Y260 VanDerWaalsContact O-CE2 3.31Å; P206-Y260 WeakPolarHBondContact O-CE2 3.26Å; P206-Y260 PolarHBondContact O-OH 3.03Å; P206-Y260 VanDerWaalsContact O-OH 3.06Å
207	S	96.6	Very high	96.6	Very high	73 Å²	73	43.5 Å²	43.5	51%	0.51	26%	0.255	S	S	.	.	S	Bend	trans	-72.9	-14.7	-178.4	53.1	0	0	0	0	113.7	R261 V262	S207-R261 CarbonylContact O-C 3.33Å; S207-R261 WeakPolarHBondContact O-CA 3.19Å; S207-V262 WeakPolarHBondContact O-CB 3.32Å; S207-V262 WeakPolarHBondContact O-CG2 3.4Å; S207-V262 PolarHBondContact O-N 3.06Å
208	E	97.9	Very high	96.2	Very high	121 Å²	121	48.5 Å²	48.5	57%	0.565	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.1	153.5	173.4	59.8	177.2	-163.4	0	0	110.5	P206 Y260 R261	P206-E208 WeakPolarHBondContact CG-O 3.42Å; P206-E208 PolarHBondContact O-N 3.37Å; E208-Y260 VanDerWaalsContact CA-O 3.29Å; E208-Y260 WeakPolarHBondContact CA-O 3.5Å; E208-R261 HydrophobicContact CB-CB 4.31Å; E208-R261 HydrophobicContact CB-CG 4.33Å
209	G	97.6	Very high	95.5	Very high	29 Å²	29	54.5 Å²	54.5	30%	0.299	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	171.8	-173.7	178.4	0	0	0	0	0	114	K259 Y260	G209-K259 WeakPolarHBondContact O-CA 3.24Å; G209-Y260 PolarHBondContact N-O 2.76Å; G209-Y260 VanDerWaalsContact O-CD1 3.26Å; G209-Y260 WeakPolarHBondContact O-CD1 3.42Å; G209-Y260 PolarHBondContact O-N 3.35Å
210	L	97.6	Very high	94.6	Very high	101 Å²	101	55.6 Å²	55.6	53%	0.529	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	127.2	175.6	179.4	66.1	0	0	0	109	A257 K259 L277	L210-A257 HydrophobicContact CD1-CB 4.38Å; L210-K259 HydrophobicContact CD1-CB 4.38Å; L210-L277 HydrophobicContact CD1-CD1 3.81Å
211	I	96.7	Very high	93.2	Very high	10 Å²	10	62.2 Å²	62.2	5%	0.051	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	110.3	172.1	-52.8	163.9	0	0	0	107.2	I213 A257 T258 Y260 H289 A293 L294	I211-I213 HydrophobicContact CG2-CD1 4.45Å; I211-I213 HydrophobicContact CG2-CG1 4.3Å; I211-A257 CarbonylContact O-C 3.59Å; I211-A257 VanDerWaalsContact O-CA 3.24Å; I211-A257 WeakPolarHBondContact O-CA 3.29Å; I211-T258 PolarHBondContact N-O 2.96Å; I211-T258 PolarHBondContact O-N 3.11Å; I211-Y260 HydrophobicContact CD1-CD1 3.92Å; I211-Y260 HydrophobicContact CD1-CE1 4.2Å; I211-Y260 HydrophobicContact CG1-CD1 3.91Å; I211-Y260 HydrophobicContact CG1-CE1 3.9Å; I211-H289 HydrophobicContact CD1-CB 3.89Å; I211-H289 HydrophobicContact CG2-CB 4.09Å; I211-H289 PolarHBondContact O-CE1 2.91Å; I211-A293 HydrophobicContact CG2-CB 3.72Å; I211-L294 HydrophobicContact CD1-CD1 3.6Å; I211-L294 HydrophobicContact CD1-CD2 4.32Å; I211-L294 HydrophobicContact CD1-CG 3.7Å; I211-L294 HydrophobicContact CG1-CG 4.42Å
212	D	95.4	Very high	91.8	Very high	112 Å²	112	63.3 Å²	63.3	60%	0.599	36%	0.364	S	S	*	.			trans	-112.4	16.5	-176.8	66.6	-15.1	0	0	0	113.2	P214 A256	D212-P214 WeakPolarHBondContact O-CD 3.34Å; D212-A256 CarbonylContact C-O 3.41Å; D212-A256 VanDerWaalsContact CA-O 3.24Å; D212-A256 WeakPolarHBondContact CA-O 3.21Å
213	I	95.4	Very high	90.5	Very high	49 Å²	49	69 Å²	69	25%	0.251	40%	0.397	S	S	.	.			trans	-71.8	122.7	-179	-52.5	174.6	0	0	0	109.7	I211 L231 P233 H289 A293	I211-I213 HydrophobicContact CG2-CD1 4.45Å; I211-I213 HydrophobicContact CG2-CG1 4.3Å; I213-L231 HydrophobicContact CB-CD2 4.22Å; I213-L231 HydrophobicContact CD1-CD1 4.25Å; I213-L231 HydrophobicContact CG2-CB 3.98Å; I213-L231 HydrophobicContact CG2-CD1 4.37Å; I213-L231 HydrophobicContact CG2-CD2 3.99Å; I213-L231 HydrophobicContact CG2-CG 4.34Å; I213-P233 HydrophobicContact CG2-CB 4.38Å; I213-H289 PolarHBondContact O-NE2 2.91Å; I213-A293 HydrophobicContact CD1-CB 3.96Å
214	P	95.1	Very high	89.4	Confident	22 Å²	22	74.3 Å²	74.3	14%	0.143	42%	0.415	C	S	.	.			trans	-59.7	155.5	177.5	-23.7	34	0	0	0	113	D212 S232 A253 H254	D212-P214 WeakPolarHBondContact O-CD 3.34Å; P214-S232 PolarHBondContact O-N 2.86Å; P214-A253 HydrophobicContact CB-CB 4.24Å; P214-H254 CarbonylContact C-O 3.5Å; P214-H254 VanDerWaalsContact CA-O 3.32Å; P214-H254 WeakPolarHBondContact CA-O 3.41Å; P214-H254 WeakPolarHBondContact CB-O 3.44Å
215	I	95.2	Very high	88.1	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	139.3	-177.6	-61.1	176.5	0	0	0	109.9	M229 T230 L231 A253 H254 A256 V282 Q285 V288	I215-M229 HydrophobicContact CG2-CB 3.79Å; I215-M229 HydrophobicContact CG2-CE 3.57Å; I215-T230 CarbonylContact C-O 3.56Å; I215-T230 WeakPolarHBondContact CA-O 3.47Å; I215-T230 WeakPolarHBondContact CG2-O 3.42Å; I215-L231 HydrophobicContact CG1-CD2 4.38Å; I215-A253 CarbonylContact O-C 3.58Å; I215-A253 WeakPolarHBondContact O-CA 3.29Å; I215-H254 PolarHBondContact N-O 3.29Å; I215-H254 PolarHBondContact O-N 3.15Å; I215-A256 HydrophobicContact CB-CB 4.41Å; I215-A256 HydrophobicContact CD1-CB 3.74Å; I215-A256 HydrophobicContact CG1-CB 3.76Å; I215-V282 HydrophobicContact CB-CG1 4.01Å; I215-V282 HydrophobicContact CD1-CG1 4.27Å; I215-V282 HydrophobicContact CG2-CG1 4.15Å; I215-Q285 HydrophobicContact CD1-CB 3.99Å; I215-Q285 HydrophobicContact CD1-CG 3.88Å; I215-V288 HydrophobicContact CD1-CB 4.15Å; I215-V288 HydrophobicContact CD1-CG1 4.07Å; I215-V288 HydrophobicContact CG1-CG1 4.18Å; I215-V288 HydrophobicContact CG2-CG1 4.33Å
216	I	94.7	Very high	87.3	Confident	4 Å²	4	75.1 Å²	75.1	2%	0.021	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	140.8	178.6	-172.8	174	0	0	0	110.6	R218 M229 T230 H250 Q252 A253	I216-R218 HydrophobicContact CG2-CG 4.17Å; I216-M229 CarbonylContact O-C 3.56Å; I216-M229 WeakPolarHBondContact O-CA 3.49Å; I216-T230 PolarHBondContact N-O 3.31Å; I216-T230 PolarHBondContact O-N 2.62Å; I216-T230 PolarHBondContact O-OG1 3.4Å; I216-H250 HydrophobicContact CD1-CB 4.01Å; I216-H250 WeakPolarHBondContact CD1-ND1 3.48Å; I216-Q252 HydrophobicContact CD1-CB 4.46Å; I216-A253 HydrophobicContact CB-CB 4.36Å
217	E	93	Very high	86.7	Confident	73 Å²	73	76.6 Å²	76.6	34%	0.341	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	126.3	169.9	-166.7	156	-137.6	0	0	109.8	F227 M229 K283	E217-F227 HydrophobicContact CG-CB 3.81Å; E217-F227 HydrophobicContact CG-CD1 4.24Å; E217-F227 HydrophobicContact CG-CG 4.42Å; E217-F227 WeakPolarHBondContact OE1-CB 3.48Å; E217-M229 HydrophobicContact CB-CE 4.31Å; E217-M229 HydrophobicContact CB-SD 3.59Å; E217-M229 VanDerWaalsContact CB-SD 3.59Å; E217-M229 HydrophobicContact CG-SD 3.84Å; E217-K283 IonicContact OE1-NZ 2.71Å; E217-K283 PolarHBondContact OE1-NZ 3.1Å
218	R	88.9	Confident	86.4	Confident	116 Å²	116	73.2 Å²	73.2	44%	0.438	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	145.7	175.4	-69.8	-171.8	179	176.1	2.9	110.4	I216 F227 K228 T230	I216-R218 HydrophobicContact CG2-CG 4.17Å; R218-F227 WeakPolarHBondContact O-CA 3.49Å; R218-K228 PolarHBondContact N-O 2.91Å; R218-K228 PolarHBondContact O-N 2.83Å; R218-T230 WeakPolarHBondContact CD-OG1 3.26Å
219	E	85.1	Confident	86.1	Confident	125 Å²	125	67.7 Å²	67.7	58%	0.584	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	135.3	165.4	-171.2	172.9	-174	0	0	109.1	P225 F227	E219-P225 VanDerWaalsContact OE1-CB 3.26Å; E219-P225 WeakPolarHBondContact OE1-CB 3.31Å; E219-F227 HydrophobicContact CB-CD1 4.21Å; E219-F227 HydrophobicContact CB-CE1 3.96Å; E219-F227 HydrophobicContact CG-CE1 4.43Å
220	V	78	Confident	85.9	Confident	23 Å²	23	67.6 Å²	67.6	14%	0.139	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	136.6	179	178.1	0	0	0	0	108.8	G222 H226 K228	V220-G222 PolarHBondContact O-N 2.85Å; V220-H226 VanDerWaalsContact CB-NE2 3.29Å; V220-H226 WeakPolarHBondContact CB-NE2 3.45Å; V220-H226 WeakPolarHBondContact CG1-NE2 3.29Å; V220-H226 PolarHBondContact N-O 2.97Å; V220-H226 PolarHBondContact O-CE1 3.44Å; V220-H226 PolarHBondContact O-ND1 2.99Å; V220-K228 HydrophobicContact CB-CG 4.42Å; V220-K228 HydrophobicContact CG2-CB 3.74Å; V220-K228 HydrophobicContact CG2-CD 3.9Å; V220-K228 HydrophobicContact CG2-CG 3.68Å
221	T	69.3	Low	85.8	Confident	140 Å²	140	64.2 Å²	64.2	86%	0.859	34%	0.343	S	S	*	.			trans	-63	122.9	179.6	-44	0	0	0	0	110.4
222	G	68.9	Low	85.7	Confident	38 Å²	38	64.2 Å²	64.2	39%	0.392	34%	0.344	S	S	.	.	S	Bend	trans	-167.5	174.7	177.7	0	0	0	0	0	111.4	V220 K224	V220-G222 PolarHBondContact O-N 2.85Å; G222-K224 PolarHBondContact O-N 2.79Å; G222-K224 VanDerWaalsContact O-N 3.1Å
223	P	69.8	Low	85.5	Confident	145 Å²	145	62.1 Å²	62.1	94%	0.942	34%	0.337	S	S	*	.	S	Bend	trans	-63.4	-17.4	-179.1	24	-32.5	0	0	0	113.3
224	K	72.9	Confident	85.2	Confident	166 Å²	166	63.3 Å²	63.3	72%	0.722	34%	0.343	S	S	*	.	S	Bend	trans	-132.6	146.5	169.1	-66.9	-175.6	179.3	-177.2	0	109.2	G222 H226	G222-K224 PolarHBondContact O-N 2.79Å; G222-K224 VanDerWaalsContact O-N 3.1Å; K224-H226 PolarHBondContact O-N 3.06Å; K224-H226 PolarHBondContact O-ND1 2.77Å; K224-H226 VanDerWaalsContact O-ND1 3.16Å
225	P	70.6	Confident	84.9	Confident	99 Å²	99	67.8 Å²	67.8	64%	0.643	36%	0.361	S	S	*	.			trans	-58.8	124.7	174.6	25.3	-33.7	0	0	0	108.9	E219	E219-P225 VanDerWaalsContact OE1-CB 3.26Å; E219-P225 WeakPolarHBondContact OE1-CB 3.31Å
226	H	76.9	Confident	84.5	Confident	51 Å²	51	75.6 Å²	75.6	24%	0.236	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	136	179.7	66.4	-76.4	0	0	0	110.9	V220 K224	V220-H226 VanDerWaalsContact CB-NE2 3.29Å; V220-H226 WeakPolarHBondContact CB-NE2 3.45Å; V220-H226 WeakPolarHBondContact CG1-NE2 3.29Å; V220-H226 PolarHBondContact N-O 2.97Å; V220-H226 PolarHBondContact O-CE1 3.44Å; V220-H226 PolarHBondContact O-ND1 2.99Å; K224-H226 PolarHBondContact O-N 3.06Å; K224-H226 PolarHBondContact O-ND1 2.77Å; K224-H226 VanDerWaalsContact O-ND1 3.16Å
227	F	86	Confident	84.1	Confident	112 Å²	112	81.9 Å²	81.9	49%	0.491	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	132.4	-176.7	-63.2	-85.4	0	0	0	111.6	E217 R218 E219 K303	E217-F227 HydrophobicContact CG-CB 3.81Å; E217-F227 HydrophobicContact CG-CD1 4.24Å; E217-F227 HydrophobicContact CG-CG 4.42Å; E217-F227 WeakPolarHBondContact OE1-CB 3.48Å; R218-F227 WeakPolarHBondContact O-CA 3.49Å; E219-F227 HydrophobicContact CB-CD1 4.21Å; E219-F227 HydrophobicContact CB-CE1 3.96Å; E219-F227 HydrophobicContact CG-CE1 4.43Å; F227-K303 PolarHBondContact O-NZ 3.41Å
228	K	89.1	Confident	83.7	Confident	2 Å²	2	80.8 Å²	80.8	1%	0.009	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	138.7	173.9	-59	-164.7	-170.5	-179.5	0	110.2	R218 V220 K303 K309	R218-K228 PolarHBondContact N-O 2.91Å; R218-K228 PolarHBondContact O-N 2.83Å; V220-K228 HydrophobicContact CB-CG 4.42Å; V220-K228 HydrophobicContact CG2-CB 3.74Å; V220-K228 HydrophobicContact CG2-CD 3.9Å; V220-K228 HydrophobicContact CG2-CG 3.68Å; K228-K303 PolarHBondContact NZ-O 2.99Å; K228-K309 PolarHBondContact NZ-O 2.81Å
229	M	93.1	Very high	83.3	Confident	4 Å²	4	85.4 Å²	85.4	2%	0.02	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	135.3	168.8	-53	-57.6	-69.5	0	0	109.7	I215 I216 E217 V282 K283 H284 V288 Y304	I215-M229 HydrophobicContact CG2-CB 3.79Å; I215-M229 HydrophobicContact CG2-CE 3.57Å; I216-M229 CarbonylContact O-C 3.56Å; I216-M229 WeakPolarHBondContact O-CA 3.49Å; E217-M229 HydrophobicContact CB-CE 4.31Å; E217-M229 HydrophobicContact CB-SD 3.59Å; E217-M229 VanDerWaalsContact CB-SD 3.59Å; E217-M229 HydrophobicContact CG-SD 3.84Å; M229-V282 HydrophobicContact CE-CG1 4.1Å; M229-K283 HydrophobicContact CE-CB 4.13Å; M229-K283 HydrophobicContact CG-CB 4.23Å; M229-K283 HydrophobicContact CG-CD 4.23Å; M229-K283 HydrophobicContact CG-CG 4.08Å; M229-K283 WeakPolarHBondContact CG-O 3.43Å; M229-K283 HydrophobicContact SD-CB 4.12Å; M229-K283 HydrophobicContact SD-CD 3.92Å; M229-K283 HydrophobicContact SD-CG 4.24Å; M229-H284 HydrophobicContact CG-CB 4.37Å; M229-V288 HydrophobicContact CB-CG2 3.64Å; M229-Y304 PolarHBondContact N-OH 3.21Å; M229-Y304 VanDerWaalsContact O-CE1 3.29Å; M229-Y304 WeakPolarHBondContact O-CE1 3.32Å
230	T	93.3	Very high	83.2	Confident	27 Å²	27	83.2 Å²	83.2	17%	0.166	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	162.9	179.9	56.3	0	0	0	0	109.6	I215 I216 R218	I215-T230 CarbonylContact C-O 3.56Å; I215-T230 WeakPolarHBondContact CA-O 3.47Å; I215-T230 WeakPolarHBondContact CG2-O 3.42Å; I216-T230 PolarHBondContact N-O 3.31Å; I216-T230 PolarHBondContact O-N 2.62Å; I216-T230 PolarHBondContact O-OG1 3.4Å; R218-T230 WeakPolarHBondContact CD-OG1 3.26Å
231	L	94.3	Very high	83.4	Confident	31 Å²	31	84.8 Å²	84.8	16%	0.162	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	144	173.8	-61	179.8	0	0	0	110.7	I213 I215 P233 V288 A293	I213-L231 HydrophobicContact CB-CD2 4.22Å; I213-L231 HydrophobicContact CD1-CD1 4.25Å; I213-L231 HydrophobicContact CG2-CB 3.98Å; I213-L231 HydrophobicContact CG2-CD1 4.37Å; I213-L231 HydrophobicContact CG2-CD2 3.99Å; I213-L231 HydrophobicContact CG2-CG 4.34Å; I215-L231 HydrophobicContact CG1-CD2 4.38Å; L231-P233 VanDerWaalsContact C-CD 3.47Å; L231-P233 WeakPolarHBondContact O-CD 3.04Å; L231-V288 HydrophobicContact CD2-CG1 3.73Å; L231-V288 HydrophobicContact CG-CG1 4.24Å; L231-A293 HydrophobicContact CD1-CB 4.03Å
232	S	94.1	Very high	84	Confident	10 Å²	10	84.3 Å²	84.3	7%	0.07	46%	0.46	C	S	.	.			trans	-119.9	73.1	172.1	-175.6	0	0	0	0	109.4	P214	P214-S232 PolarHBondContact O-N 2.86Å
233	P	92.5	Very high	84.8	Confident	68 Å²	68	83.7 Å²	83.7	44%	0.442	45%	0.454	S	S	.	.			trans	-65.6	151.2	-179.8	30	-35.7	0	0	0	111.4	I213 L231 F235	I213-P233 HydrophobicContact CG2-CB 4.38Å; L231-P233 VanDerWaalsContact C-CD 3.47Å; L231-P233 WeakPolarHBondContact O-CD 3.04Å; P233-F235 PolarHBondContact O-N 2.71Å
234	L	89.3	Confident	85.6	Confident	74 Å²	74	83.4 Å²	83.4	39%	0.387	44%	0.442	S	S	.	.	S	Bend	trans	-81.6	-4.3	177.4	-63.9	179.4	0	0	0	113.4	K246 V247	L234-K246 WeakPolarHBondContact O-CA 3.34Å; L234-V247 PolarHBondContact O-N 3.09Å
235	F	88.2	Confident	86.4	Confident	116 Å²	116	78.8 Å²	78.8	51%	0.509	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	144.1	178.4	-60.6	-87.4	0	0	0	109.5	P233 T245 K246	P233-F235 PolarHBondContact O-N 2.71Å; F235-T245 WeakPolarHBondContact CA-O 3.29Å; F235-K246 HydrophobicContact CD1-CB 4.17Å; F235-K246 HydrophobicContact CD1-CG 4.46Å; F235-K246 HydrophobicContact CE1-CB 4Å; F235-K246 HydrophobicContact CE1-CG 4.05Å
236	R	86.8	Confident	87.2	Confident	163 Å²	163	82.2 Å²	82.2	62%	0.615	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.3	145.8	175.2	-172.5	-175.2	-117.2	166.1	-4.8	109.1	M244 T245 V247	R236-M244 CarbonylContact O-C 3.58Å; R236-M244 WeakPolarHBondContact O-CA 3.23Å; R236-T245 PolarHBondContact N-O 3.2Å; R236-T245 PolarHBondContact O-N 2.86Å; R236-T245 PolarHBondContact O-OG1 3.35Å; R236-V247 HydrophobicContact CB-CG2 3.74Å
237	M	85.4	Confident	87.8	Confident	136 Å²	136	82.6 Å²	82.6	67%	0.67	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.8	139.1	169.1	-73.9	179.7	161	0	0	110.5	G243	M237-G243 WeakPolarHBondContact CA-O 3.41Å
238	N	84.6	Confident	87.9	Confident	50 Å²	50	87.7 Å²	87.7	27%	0.267	45%	0.454	S	S	.	.			trans	-66.6	157.8	173.8	-64.9	-7.4	0	0	0	110.4	A240 G241 G243 T245	N238-A240 PolarHBondContact O-N 2.87Å; N238-G241 PolarHBondContact O-N 3.42Å; N238-G243 PolarHBondContact N-O 3.05Å; N238-T245 WeakPolarHBondContact OD1-CB 3.47Å; N238-T245 WeakPolarHBondContact OD1-CG2 3.42Å; N238-T245 PolarHBondContact OD1-N 3.49Å; N238-T245 PolarHBondContact OD1-OG1 3.04Å
239	E	81.9	Confident	87.8	Confident	213 Å²	213	90.9 Å²	90.9	100%	0.995	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-30.3	179.8	-64	-174.4	165.5	0	0	112.7	G241	E239-G241 VanDerWaalsContact C-N 3.28Å; E239-G241 PolarHBondContact O-N 2.86Å
240	A	82.3	Confident	87.8	Confident	79 Å²	79	94.8 Å²	94.8	65%	0.653	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-7.3	174.5	0	0	0	0	0	114.1	N238 D242	N238-A240 PolarHBondContact O-N 2.87Å; A240-D242 WeakPolarHBondContact CB-OD1 3.44Å; A240-D242 PolarHBondContact O-N 2.99Å
241	G	81.8	Confident	87.6	Confident	56 Å²	56	104.9 Å²	104.9	58%	0.577	53%	0.53	S	S	*	.	S	Bend	trans	71.7	4.4	177.9	0	0	0	0	0	115.6	N238 E239	N238-G241 PolarHBondContact O-N 3.42Å; E239-G241 VanDerWaalsContact C-N 3.28Å; E239-G241 PolarHBondContact O-N 2.86Å
242	D	82.2	Confident	87.5	Confident	130 Å²	130	109.8 Å²	109.8	70%	0.695	55%	0.552	S	S	*	*	S	Bend	trans	-97.7	-8.8	-170.8	59.6	-10	0	0	0	114.3	A240	A240-D242 WeakPolarHBondContact CB-OD1 3.44Å; A240-D242 PolarHBondContact O-N 2.99Å
243	G	84.9	Confident	87.4	Confident	26 Å²	26	110.2 Å²	110.2	27%	0.268	56%	0.556	S	S	.	*			trans	-158.1	171.8	-176.8	0	0	0	0	0	114.4	M237 N238	M237-G243 WeakPolarHBondContact CA-O 3.41Å; N238-G243 PolarHBondContact N-O 3.05Å
244	M	88.5	Confident	87.5	Confident	139 Å²	139	111.9 Å²	111.9	69%	0.685	56%	0.558	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.2	132	175.1	-71.9	174	177.7	0	0	110.4	R236	R236-M244 CarbonylContact O-C 3.58Å; R236-M244 WeakPolarHBondContact O-CA 3.23Å
245	T	88.3	Confident	87.7	Confident	68 Å²	68	112.3 Å²	112.3	42%	0.417	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105	134.2	171.7	35.3	0	0	0	0	110.4	F235 R236 N238 V247	F235-T245 WeakPolarHBondContact CA-O 3.29Å; R236-T245 PolarHBondContact N-O 3.2Å; R236-T245 PolarHBondContact O-N 2.86Å; R236-T245 PolarHBondContact O-OG1 3.35Å; N238-T245 WeakPolarHBondContact OD1-CB 3.47Å; N238-T245 WeakPolarHBondContact OD1-CG2 3.42Å; N238-T245 PolarHBondContact OD1-N 3.49Å; N238-T245 PolarHBondContact OD1-OG1 3.04Å; T245-V247 PolarHBondContact O-N 2.75Å
246	K	88.4	Confident	88	Confident	171 Å²	171	107 Å²	107	74%	0.743	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	122.8	174.3	-171.2	176.8	-177.4	176.7	0	109.3	L234 F235	L234-K246 WeakPolarHBondContact O-CA 3.34Å; F235-K246 HydrophobicContact CD1-CB 4.17Å; F235-K246 HydrophobicContact CD1-CG 4.46Å; F235-K246 HydrophobicContact CE1-CB 4Å; F235-K246 HydrophobicContact CE1-CG 4.05Å
247	V	88.8	Confident	88.4	Confident	59 Å²	59	100.3 Å²	100.3	36%	0.358	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-100.4	136.7	177.4	-175.6	0	0	0	0	108.7	L234 R236 T245 S249	L234-V247 PolarHBondContact O-N 3.09Å; R236-V247 HydrophobicContact CB-CG2 3.74Å; T245-V247 PolarHBondContact O-N 2.75Å; V247-S249 PolarHBondContact O-N 3.38Å
248	R	87.9	Confident	88.9	Confident	219 Å²	219	93.9 Å²	93.9	83%	0.826	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-63.5	137.4	174.5	-172	177	-179	167.5	3.5	109.7	H250	R248-H250 PolarHBondContact O-N 3.14Å
249	S	88.4	Confident	89.6	Confident	69 Å²	69	96.9 Å²	96.9	48%	0.483	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-56	131.9	174.6	-172.1	0	0	0	0	110.8	V247	V247-S249 PolarHBondContact O-N 3.38Å
250	H	91.2	Very high	90.4	Very high	86 Å²	86	87.2 Å²	87.2	40%	0.398	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-75.7	136.9	-179.8	-167.9	-86.5	0	0	0	110.1	I216 R248 Q252 A253	I216-H250 HydrophobicContact CD1-CB 4.01Å; I216-H250 WeakPolarHBondContact CD1-ND1 3.48Å; R248-H250 PolarHBondContact O-N 3.14Å; H250-Q252 PolarHBondContact ND1-N 3.25Å; H250-Q252 VanDerWaalsContact ND1-N 3.16Å; H250-Q252 PolarHBondContact O-N 3.11Å; H250-Q252 VanDerWaalsContact O-N 3.15Å; H250-A253 HydrophobicContact CB-CB 4.14Å; H250-A253 WeakPolarHBondContact O-CB 3.18Å; H250-A253 PolarHBondContact O-N 2.86Å
251	R	90.1	Very high	91.1	Very high	239 Å²	239	88.9 Å²	88.9	90%	0.902	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.6	-175.9	-67	-175.9	-179.7	-176.2	0	113.9
252	Q	91.7	Very high	91.9	Very high	134 Å²	134	87.5 Å²	87.5	63%	0.626	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	3.3	178.2	-58.9	172.7	-15.9	0	0	113.3	I216 H250	I216-Q252 HydrophobicContact CD1-CB 4.46Å; H250-Q252 PolarHBondContact ND1-N 3.25Å; H250-Q252 VanDerWaalsContact ND1-N 3.16Å; H250-Q252 PolarHBondContact O-N 3.11Å; H250-Q252 VanDerWaalsContact O-N 3.15Å
253	A	92.7	Very high	92.6	Very high	20 Å²	20	82.4 Å²	82.4	17%	0.165	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-77.8	134.4	174.7	0	0	0	0	0	110	P214 I215 I216 H250	P214-A253 HydrophobicContact CB-CB 4.24Å; I215-A253 CarbonylContact O-C 3.58Å; I215-A253 WeakPolarHBondContact O-CA 3.29Å; I216-A253 HydrophobicContact CB-CB 4.36Å; H250-A253 HydrophobicContact CB-CB 4.14Å; H250-A253 WeakPolarHBondContact O-CB 3.18Å; H250-A253 PolarHBondContact O-N 2.86Å
254	H	93.4	Very high	93.2	Very high	102 Å²	102	82.4 Å²	82.4	47%	0.472	40%	0.399	S	S	.	.	B	Isolated β-bridge	trans	-96.2	129.4	175.3	-58.2	-80.3	0	0	0	109.4	P214 I215 A256 V282	P214-H254 CarbonylContact C-O 3.5Å; P214-H254 VanDerWaalsContact CA-O 3.32Å; P214-H254 WeakPolarHBondContact CA-O 3.41Å; P214-H254 WeakPolarHBondContact CB-O 3.44Å; I215-H254 PolarHBondContact N-O 3.29Å; I215-H254 PolarHBondContact O-N 3.15Å; H254-A256 PolarHBondContact O-N 2.94Å; H254-V282 HydrophobicContact CB-CG1 3.97Å; H254-V282 HydrophobicContact CB-CG2 3.74Å
255	A	93.3	Very high	93.6	Very high	83 Å²	83	78.7 Å²	78.7	69%	0.686	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-59.1	128.8	170.5	0	0	0	0	0	109.4
256	A	94.8	Very high	93.9	Very high	4 Å²	4	76.8 Å²	76.8	3%	0.033	38%	0.376	C	S	.	.			trans	-138	120.5	-174.6	0	0	0	0	0	110.9	D212 I215 H254 V282 Q285 H289	D212-A256 CarbonylContact C-O 3.41Å; D212-A256 VanDerWaalsContact CA-O 3.24Å; D212-A256 WeakPolarHBondContact CA-O 3.21Å; I215-A256 HydrophobicContact CB-CB 4.41Å; I215-A256 HydrophobicContact CD1-CB 3.74Å; I215-A256 HydrophobicContact CG1-CB 3.76Å; H254-A256 PolarHBondContact O-N 2.94Å; A256-V282 HydrophobicContact CB-CG2 4.31Å; A256-Q285 HydrophobicContact CB-CG 4.11Å; A256-H289 PolarHBondContact O-CE1 3.15Å
257	A	95.6	Very high	94	Very high	23 Å²	23	73.1 Å²	73.1	19%	0.19	36%	0.358	C	S	.	.			trans	-127.9	121.4	179.9	0	0	0	0	0	110.7	L210 I211 L277 T278 Q285	L210-A257 HydrophobicContact CD1-CB 4.38Å; I211-A257 CarbonylContact O-C 3.59Å; I211-A257 VanDerWaalsContact O-CA 3.24Å; I211-A257 WeakPolarHBondContact O-CA 3.29Å; A257-L277 HydrophobicContact CB-CB 4.09Å; A257-L277 PolarHBondContact O-N 3.16Å; A257-T278 HydrophobicContact CB-CG2 4.47Å; A257-Q285 VanDerWaalsContact C-NE2 3.3Å; A257-Q285 PolarHBondContact O-NE2 2.67Å
258	T	97.2	Very high	94.2	Very high	1 Å²	1	72.4 Å²	72.4	1%	0.006	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	116.2	178.6	-50.7	0	0	0	0	109.3	I211 L274 Q285 M286 H289	I211-T258 PolarHBondContact N-O 2.96Å; I211-T258 PolarHBondContact O-N 3.11Å; T258-L274 HydrophobicContact CG2-CB 4.18Å; T258-L274 HydrophobicContact CG2-CD2 4.41Å; T258-Q285 PolarHBondContact OG1-NE2 3.43Å; T258-M286 HydrophobicContact CG2-CG 4.21Å; T258-H289 VanDerWaalsContact CB-ND1 3.34Å; T258-H289 WeakPolarHBondContact CB-ND1 3.35Å; T258-H289 PolarHBondContact OG1-CE1 2.93Å; T258-H289 PolarHBondContact OG1-ND1 3.32Å
259	K	97.9	Very high	94.7	Very high	114 Å²	114	62 Å²	62	50%	0.496	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	138.2	167.9	-174.1	177.1	-177.7	178.7	0	108.6	G209 L210 L274 Q275 L277	G209-K259 WeakPolarHBondContact O-CA 3.24Å; L210-K259 HydrophobicContact CD1-CB 4.38Å; K259-L274 CarbonylContact O-C 3.56Å; K259-L274 WeakPolarHBondContact O-CA 3.4Å; K259-Q275 HydrophobicContact CB-CB 4.31Å; K259-Q275 PolarHBondContact N-O 3.23Å; K259-Q275 PolarHBondContact O-N 3.12Å; K259-L277 HydrophobicContact CB-CD1 4.41Å
260	Y	98.4	Very high	95.1	Very high	10 Å²	10	58.7 Å²	58.7	4%	0.039	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	153	177.5	73.9	-84.5	0	0	0	111.6	P204 P206 E208 G209 I211 V272 E273 L274 L294	P204-Y260 HydrophobicContact CB-CD2 4.24Å; P204-Y260 HydrophobicContact CB-CE2 3.74Å; P206-Y260 VanDerWaalsContact O-CE2 3.31Å; P206-Y260 WeakPolarHBondContact O-CE2 3.26Å; P206-Y260 PolarHBondContact O-OH 3.03Å; P206-Y260 VanDerWaalsContact O-OH 3.06Å; E208-Y260 VanDerWaalsContact CA-O 3.29Å; E208-Y260 WeakPolarHBondContact CA-O 3.5Å; G209-Y260 PolarHBondContact N-O 2.76Å; G209-Y260 VanDerWaalsContact O-CD1 3.26Å; G209-Y260 WeakPolarHBondContact O-CD1 3.42Å; G209-Y260 PolarHBondContact O-N 3.35Å; I211-Y260 HydrophobicContact CD1-CD1 3.92Å; I211-Y260 HydrophobicContact CD1-CE1 4.2Å; I211-Y260 HydrophobicContact CG1-CD1 3.91Å; I211-Y260 HydrophobicContact CG1-CE1 3.9Å; Y260-V272 HydrophobicContact CD2-CG1 4.44Å; Y260-E273 CarbonylContact C-O 3.28Å; Y260-E273 VanDerWaalsContact CA-O 3.23Å; Y260-E273 WeakPolarHBondContact CA-O 3.39Å; Y260-L274 VanDerWaalsContact CB-CD2 3.47Å; Y260-L294 HydrophobicContact CD1-CD1 4.09Å; Y260-L294 HydrophobicContact CD2-CD1 4.1Å; Y260-L294 HydrophobicContact CE1-CD1 3.96Å; Y260-L294 HydrophobicContact CE1-CD2 4.19Å; Y260-L294 HydrophobicContact CE2-CD1 3.97Å; Y260-L294 HydrophobicContact CG-CD1 4.15Å
261	R	98.1	Very high	95.4	Very high	114 Å²	114	54.6 Å²	54.6	43%	0.43	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	126.6	173.3	-179.8	174.7	59.6	158.8	0.7	109.9	S207 E208 L263 V272 E273	S207-R261 CarbonylContact O-C 3.33Å; S207-R261 WeakPolarHBondContact O-CA 3.19Å; E208-R261 HydrophobicContact CB-CB 4.31Å; E208-R261 HydrophobicContact CB-CG 4.33Å; R261-L263 PolarHBondContact O-N 3.43Å; R261-V272 WeakPolarHBondContact O-CA 3.43Å; R261-V272 WeakPolarHBondContact O-CG1 3.48Å; R261-E273 IonicContact CZ-OE1 2.77Å; R261-E273 PolarHBondContact N-O 3.32Å; R261-E273 IonicContact NE-OE1 2.81Å; R261-E273 IonicContact NH2-OE1 3.25Å; R261-E273 PolarHBondContact NH2-OE1 3.01Å; R261-E273 PolarHBondContact O-N 2.85Å
262	V	98.1	Very high	95.8	Very high	27 Å²	27	43.2 Å²	43.2	16%	0.164	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	122.4	172.1	177.6	0	0	0	0	108.1	P204 S207 V272	P204-V262 HydrophobicContact CB-CG2 3.93Å; P204-V262 HydrophobicContact CG-CG2 3.9Å; S207-V262 WeakPolarHBondContact O-CB 3.32Å; S207-V262 WeakPolarHBondContact O-CG2 3.4Å; S207-V262 PolarHBondContact O-N 3.06Å; V262-V272 HydrophobicContact CG2-CG2 4.25Å
263	L	97	Very high	96.1	Very high	23 Å²	23	37.9 Å²	37.9	12%	0.12	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	-38.6	177.8	-56.5	-178.3	0	0	0	111.3	W197 R261 L271 E273 P374 K377	W197-L263 HydrophobicContact CD2-CD1 4.14Å; W197-L263 HydrophobicContact CG-CD1 4.44Å; W197-L263 HydrophobicContact CZ2-CD1 3.9Å; R261-L263 PolarHBondContact O-N 3.43Å; L263-L271 HydrophobicContact CB-CD2 4.29Å; L263-L271 HydrophobicContact CB-CG 4.18Å; L263-L271 HydrophobicContact CD1-CD2 4.15Å; L263-L271 HydrophobicContact CD1-CG 4.07Å; L263-L271 PolarHBondContact N-O 3.47Å; L263-E273 HydrophobicContact CD1-CB 4.06Å; L263-E273 HydrophobicContact CD2-CB 3.96Å; L263-E273 HydrophobicContact CG-CB 4.04Å; L263-P374 HydrophobicContact CD1-CG 4.11Å; L263-K377 PolarHBondContact O-NZ 2.92Å
264	D	97.3	Very high	96.4	Very high	26 Å²	26	37 Å²	37	14%	0.139	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	154.7	177.5	-158.8	30.3	0	0	0	111	S270 L271 L371 T372 K377	D264-S270 CarbonylContact O-C 3.6Å; D264-S270 WeakPolarHBondContact O-CA 3.39Å; D264-S270 VanDerWaalsContact O-CB 3.24Å; D264-S270 WeakPolarHBondContact O-CB 3.03Å; D264-L271 HydrophobicContact CB-CB 4.42Å; D264-L271 PolarHBondContact N-O 3.3Å; D264-L271 PolarHBondContact O-N 2.86Å; D264-L371 HydrophobicContact CB-CD2 4.29Å; D264-L371 WeakPolarHBondContact OD2-CA 3.05Å; D264-T372 PolarHBondContact OD2-N 3.16Å; D264-T372 PolarHBondContact OD2-OG1 3.3Å; D264-K377 IonicContact OD1-NZ 3.62Å; D264-K377 PolarHBondContact OD1-NZ 3.22Å
265	S	96.3	Very high	96.5	Very high	60 Å²	60	34 Å²	34	42%	0.42	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	135.3	178.1	65.7	0	0	0	0	112	C269	S265-C269 CarbonylContact C-O 3.22Å; S265-C269 WeakPolarHBondContact CA-O 3Å
266	S	95.6	Very high	96.6	Very high	29 Å²	29	30.5 Å²	30.5	20%	0.203	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	144.1	-177.6	-167.4	0	0	0	0	110.8	G268 C269 L369 Q370	S266-G268 PolarHBondContact O-N 3.37Å; S266-C269 PolarHBondContact N-O 3.47Å; S266-C269 PolarHBondContact O-N 3.23Å; S266-C269 VanDerWaalsContact O-O 3.05Å; S266-L369 WeakPolarHBondContact CB-O 3.47Å; S266-L369 PolarHBondContact OG-O 3.41Å; S266-Q370 WeakPolarHBondContact CB-O 3.26Å
267	Y	91.3	Very high	96.5	Very high	94 Å²	94	32.8 Å²	32.8	37%	0.369	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	31.7	178.8	-57.9	-79.3	0	0	0	116.3	C269 K322 L369 Q370	Y267-C269 VanDerWaalsContact C-N 3.3Å; Y267-K322 HydrophobicContact CD1-CG 4.48Å; Y267-K322 HydrophobicContact CG-CG 4.33Å; Y267-K322 PolarHBondContact OH-NZ 3.11Å; Y267-L369 WeakPolarHBondContact CD2-O 3.36Å; Y267-Q370 HydrophobicContact CE2-CB 3.99Å; Y267-Q370 HydrophobicContact CE2-CG 4.04Å; Y267-Q370 PolarHBondContact OH-OE1 3.25Å
268	G	92.1	Very high	96	Very high	43 Å²	43	32.4 Å²	32.4	44%	0.443	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	21.1	-177.5	0	0	0	0	0	113.7	G202 S266	G202-G268 WeakPolarHBondContact CA-O 3.42Å; G202-G268 PolarHBondContact N-O 2.97Å; S266-G268 PolarHBondContact O-N 3.37Å
269	C	97.4	Very high	94.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	159	166.6	-73.4	0	0	0	0	109.4	T200 S265 S266 Y267 L369 L371	T200-C269 WeakPolarHBondContact O-CA 3.33Å; T200-C269 VanDerWaalsContact O-CB 3.29Å; T200-C269 WeakPolarHBondContact O-CB 3.23Å; T200-C269 PolarHBondContact O-SG 2.9Å; S265-C269 CarbonylContact C-O 3.22Å; S265-C269 WeakPolarHBondContact CA-O 3Å; S266-C269 PolarHBondContact N-O 3.47Å; S266-C269 PolarHBondContact O-N 3.23Å; S266-C269 VanDerWaalsContact O-O 3.05Å; Y267-C269 VanDerWaalsContact C-N 3.3Å; C269-L369 HydrophobicContact CB-CD1 4.08Å; C269-L371 HydrophobicContact CB-CD1 4.42Å
270	S	97.6	Very high	93.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	147.3	172.1	47.6	0	0	0	0	112.7	I199 T200 G202 P204 D264 V272	I199-S270 CarbonylContact C-O 3.56Å; I199-S270 WeakPolarHBondContact CA-O 3.32Å; T200-S270 PolarHBondContact N-O 3.41Å; T200-S270 PolarHBondContact O-N 3.32Å; T200-S270 PolarHBondContact OG1-O 3.33Å; T200-S270 PolarHBondContact OG1-OG 3.12Å; G202-S270 PolarHBondContact O-OG 3.05Å; G202-S270 VanDerWaalsContact O-OG 3.09Å; P204-S270 WeakPolarHBondContact CD-OG 3.44Å; D264-S270 CarbonylContact O-C 3.6Å; D264-S270 WeakPolarHBondContact O-CA 3.39Å; D264-S270 VanDerWaalsContact O-CB 3.24Å; D264-S270 WeakPolarHBondContact O-CB 3.03Å; S270-V272 WeakPolarHBondContact OG-CG2 3.38Å
271	L	98.3	Very high	92.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	120.4	162.3	176.4	60.6	0	0	0	107.5	W197 V198 L263 D264 F362 L366 L371 F373	W197-L271 HydrophobicContact CB-CD1 4.22Å; V198-L271 WeakPolarHBondContact O-CA 3.3Å; V198-L271 WeakPolarHBondContact O-CD1 3.47Å; L263-L271 HydrophobicContact CB-CD2 4.29Å; L263-L271 HydrophobicContact CB-CG 4.18Å; L263-L271 HydrophobicContact CD1-CD2 4.15Å; L263-L271 HydrophobicContact CD1-CG 4.07Å; L263-L271 PolarHBondContact N-O 3.47Å; D264-L271 HydrophobicContact CB-CB 4.42Å; D264-L271 PolarHBondContact N-O 3.3Å; D264-L271 PolarHBondContact O-N 2.86Å; L271-F362 HydrophobicContact CD1-CE1 4.15Å; L271-F362 HydrophobicContact CD1-CZ 4.23Å; L271-L366 HydrophobicContact CB-CD2 4.33Å; L271-L366 HydrophobicContact CD1-CD2 4.19Å; L271-L366 HydrophobicContact CD2-CD2 4.22Å; L271-L366 HydrophobicContact CG-CD2 4.47Å; L271-L371 HydrophobicContact CB-CD1 4.46Å; L271-F373 HydrophobicContact CD2-CD1 4.29Å
272	V	98.4	Very high	92.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	132.4	-174.5	-170.6	0	0	0	0	109.4	W197 V198 T200 P204 Y260 R261 V262 S270 L274 M290	W197-V272 WeakPolarHBondContact CA-O 3.49Å; V198-V272 HydrophobicContact CG2-CB 3.77Å; V198-V272 PolarHBondContact N-O 3.11Å; V198-V272 PolarHBondContact O-N 2.96Å; T200-V272 HydrophobicContact CG2-CG2 4.15Å; P204-V272 HydrophobicContact CG-CG2 4.13Å; Y260-V272 HydrophobicContact CD2-CG1 4.44Å; R261-V272 WeakPolarHBondContact O-CA 3.43Å; R261-V272 WeakPolarHBondContact O-CG1 3.48Å; V262-V272 HydrophobicContact CG2-CG2 4.25Å; S270-V272 WeakPolarHBondContact OG-CG2 3.38Å; V272-L274 HydrophobicContact CG1-CD2 3.77Å; V272-M290 HydrophobicContact CG1-CE 4.29Å; V272-M290 HydrophobicContact CG2-CE 4.44Å
273	E	98.3	Very high	91.8	Very high	23 Å²	23	32.7 Å²	32.7	11%	0.107	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	130.2	167.2	-177.9	166.8	82.1	0	0	109.6	K195 Y196 W197 Y260 R261 L263	K195-E273 HydrophobicContact CB-CG 4.35Å; Y196-E273 CarbonylContact O-C 3.41Å; Y196-E273 WeakPolarHBondContact O-CA 3.45Å; W197-E273 PolarHBondContact NE1-OE2 2.92Å; W197-E273 VanDerWaalsContact NE1-OE2 3.1Å; Y260-E273 CarbonylContact C-O 3.28Å; Y260-E273 VanDerWaalsContact CA-O 3.23Å; Y260-E273 WeakPolarHBondContact CA-O 3.39Å; R261-E273 IonicContact CZ-OE1 2.77Å; R261-E273 PolarHBondContact N-O 3.32Å; R261-E273 IonicContact NE-OE1 2.81Å; R261-E273 IonicContact NH2-OE1 3.25Å; R261-E273 PolarHBondContact NH2-OE1 3.01Å; R261-E273 PolarHBondContact O-N 2.85Å; L263-E273 HydrophobicContact CD1-CB 4.06Å; L263-E273 HydrophobicContact CD2-CB 3.96Å; L263-E273 HydrophobicContact CG-CB 4.04Å
274	L	97.9	Very high	91.7	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	135.6	177	-53.9	179.8	0	0	0	109.6	K195 Y196 V198 T258 K259 Y260 V272 M286 M290	K195-L274 WeakPolarHBondContact CA-O 3.43Å; Y196-L274 PolarHBondContact N-O 3.04Å; Y196-L274 PolarHBondContact O-N 2.92Å; V198-L274 HydrophobicContact CB-CD1 4.44Å; V198-L274 HydrophobicContact CG1-CD1 3.7Å; V198-L274 HydrophobicContact CG1-CG 4.38Å; V198-L274 HydrophobicContact CG2-CD1 3.8Å; V198-L274 HydrophobicContact CG2-CG 4.05Å; T258-L274 HydrophobicContact CG2-CB 4.18Å; T258-L274 HydrophobicContact CG2-CD2 4.41Å; K259-L274 CarbonylContact O-C 3.56Å; K259-L274 WeakPolarHBondContact O-CA 3.4Å; Y260-L274 VanDerWaalsContact CB-CD2 3.47Å; V272-L274 HydrophobicContact CG1-CD2 3.77Å; L274-M286 HydrophobicContact CB-CG 4.33Å; L274-M286 HydrophobicContact CB-SD 3.89Å; L274-M286 HydrophobicContact CD1-CB 3.76Å; L274-M286 HydrophobicContact CD1-CG 3.93Å; L274-M286 HydrophobicContact CD1-SD 3.99Å; L274-M290 HydrophobicContact CD1-CG 3.85Å; L274-M290 HydrophobicContact CD1-SD 4.16Å; L274-M290 HydrophobicContact CD2-CE 4.5Å; L274-M290 HydrophobicContact CD2-CG 4.36Å; L274-M290 HydrophobicContact CD2-SD 3.56Å; L274-M290 VanDerWaalsContact CD2-SD 3.56Å
275	Q	96.6	Very high	91.6	Very high	40 Å²	40	32.1 Å²	32.1	19%	0.187	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	104.2	173.9	-179.1	-179	5	0	0	109.1	R194 K259 L277	R194-Q275 WeakPolarHBondContact O-CA 3.36Å; K259-Q275 HydrophobicContact CB-CB 4.31Å; K259-Q275 PolarHBondContact N-O 3.23Å; K259-Q275 PolarHBondContact O-N 3.12Å; Q275-L277 HydrophobicContact CG-CD2 3.93Å; Q275-L277 PolarHBondContact O-N 3.33Å
276	P	94.7	Very high	91.6	Very high	10 Å²	10	30 Å²	30	7%	0.065	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	122	173.5	28.8	-32.4	0	0	0	110.4	R194 Y196 T278	R194-P276 HydrophobicContact CB-CG 4.45Å; R194-P276 PolarHBondContact NH2-O 3.09Å; R194-P276 WeakPolarHBondContact O-CD 3.42Å; Y196-P276 HydrophobicContact CD2-CG 4.07Å; Y196-P276 HydrophobicContact CE2-CG 3.6Å; P276-T278 VanDerWaalsContact C-N 3.32Å
277	L	92.6	Very high	91.7	Very high	51 Å²	51	29.4 Å²	29.4	27%	0.267	17%	0.168	S	C	.	.			trans	-95.8	16	178.4	-54.5	-179.7	0	0	0	112.3	N190 L210 A257 K259 Q275	N190-L277 PolarHBondContact ND2-O 3.14Å; N190-L277 VanDerWaalsContact OD1-C 3.3Å; N190-L277 PolarHBondContact OD1-O 2.97Å; L210-L277 HydrophobicContact CD1-CD1 3.81Å; A257-L277 HydrophobicContact CB-CB 4.09Å; A257-L277 PolarHBondContact O-N 3.16Å; K259-L277 HydrophobicContact CB-CD1 4.41Å; Q275-L277 HydrophobicContact CG-CD2 3.93Å; Q275-L277 PolarHBondContact O-N 3.33Å
278	T	85.6	Confident	91.9	Very high	16 Å²	16	25 Å²	25	10%	0.098	15%	0.151	C	C	.	.			trans	-99.4	121.9	177.9	48.6	0	0	0	0	108.6	R194 A257 P276 G281 Q285	R194-T278 PolarHBondContact NH2-O 2.8Å; A257-T278 HydrophobicContact CB-CG2 4.47Å; P276-T278 VanDerWaalsContact C-N 3.32Å; T278-G281 PolarHBondContact O-N 3.33Å; T278-Q285 PolarHBondContact OG1-NE2 2.96Å; T278-Q285 PolarHBondContact OG1-OE1 3.5Å
279	G	73	Confident	92.2	Very high	11 Å²	11	22.9 Å²	22.9	11%	0.113	13%	0.13	C	C	.	.	S	Bend	trans	-58.5	-63.9	-169.9	0	0	0	0	0	114.1	S187 R194 G281	S187-G279 VanDerWaalsContact C-CA 3.43Å; S187-G279 WeakPolarHBondContact O-CA 3.5Å; S187-G279 PolarHBondContact OG-O 2.81Å; R194-G279 PolarHBondContact NH1-O 3.35Å; G279-G281 PolarHBondContact O-N 2.99Å
280	T	67.4	Low	92.2	Very high	97 Å²	97	22.9 Å²	22.9	60%	0.595	13%	0.13	S	C	*	.	S	Bend	trans	-78.8	-6	-176.5	50.4	0	0	0	0	114.1	R188	R188-T280 HydrophobicContact CG-CG2 4.36Å
281	G	77.1	Confident	92.2	Very high	38 Å²	38	23.1 Å²	23.1	39%	0.392	13%	0.132	S	C	.	.			trans	76	133.8	-178.6	0	0	0	0	0	113.1	T278 G279	T278-G281 PolarHBondContact O-N 3.33Å; G279-G281 PolarHBondContact O-N 2.99Å
282	V	90.8	Very high	92	Very high	24 Å²	24	24.2 Å²	24.2	15%	0.145	14%	0.136	C	C	.	.			trans	-96.3	137.2	171.8	-179.3	0	0	0	0	109.4	I215 M229 H254 A256 H284 Q285	I215-V282 HydrophobicContact CB-CG1 4.01Å; I215-V282 HydrophobicContact CD1-CG1 4.27Å; I215-V282 HydrophobicContact CG2-CG1 4.15Å; M229-V282 HydrophobicContact CE-CG1 4.1Å; H254-V282 HydrophobicContact CB-CG1 3.97Å; H254-V282 HydrophobicContact CB-CG2 3.74Å; A256-V282 HydrophobicContact CB-CG2 4.31Å; V282-H284 PolarHBondContact O-N 3.02Å; V282-Q285 HydrophobicContact CB-CB 4.07Å; V282-Q285 VanDerWaalsContact O-CB 3.28Å; V282-Q285 WeakPolarHBondContact O-CB 3.44Å; V282-Q285 PolarHBondContact O-N 2.93Å; V282-Q285 VanDerWaalsContact O-N 3.08Å
283	K	92.1	Very high	91.9	Very high	101 Å²	101	25.9 Å²	25.9	44%	0.439	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	125	179.7	-178.9	179.5	176.9	-173.3	0	110.3	E217 M229 Q285	E217-K283 IonicContact OE1-NZ 2.71Å; E217-K283 PolarHBondContact OE1-NZ 3.1Å; M229-K283 HydrophobicContact CE-CB 4.13Å; M229-K283 HydrophobicContact CG-CB 4.23Å; M229-K283 HydrophobicContact CG-CD 4.23Å; M229-K283 HydrophobicContact CG-CG 4.08Å; M229-K283 WeakPolarHBondContact CG-O 3.43Å; M229-K283 HydrophobicContact SD-CB 4.12Å; M229-K283 HydrophobicContact SD-CD 3.92Å; M229-K283 HydrophobicContact SD-CG 4.24Å; K283-Q285 PolarHBondContact O-N 3.09Å; K283-Q285 VanDerWaalsContact O-N 3.09Å
284	H	94.8	Very high	91.8	Very high	30 Å²	30	26.3 Å²	26.3	14%	0.139	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	23.4	178	-54.9	168.6	0	0	0	115.2	E164 M229 V282 M286 R287 V288 Y304	E164-H284 VanDerWaalsContact OE1-CA 3.32Å; E164-H284 WeakPolarHBondContact OE1-CA 3.3Å; E164-H284 IonicContact OE1-CD2 2.95Å; E164-H284 PolarHBondContact OE1-CD2 3Å; E164-H284 VanDerWaalsContact OE1-CD2 3.32Å; E164-H284 IonicContact OE1-CG 3.52Å; E164-H284 IonicContact OE2-CD2 3.74Å; E164-H284 PolarHBondContact OE2-CD2 2.8Å; E164-H284 IonicContact OE2-NE2 2.73Å; M229-H284 HydrophobicContact CG-CB 4.37Å; V282-H284 PolarHBondContact O-N 3.02Å; H284-M286 PolarHBondContact O-N 3.2Å; H284-R287 HydrophobicContact CB-CB 4.4Å; H284-R287 WeakPolarHBondContact O-CB 3.47Å; H284-R287 PolarHBondContact O-N 3.39Å; H284-R287 VanDerWaalsContact O-N 3.14Å; H284-V288 HydrophobicContact CB-CG2 4.24Å; H284-V288 VanDerWaalsContact O-CG2 3.28Å; H284-V288 WeakPolarHBondContact O-CG2 3.34Å; H284-V288 PolarHBondContact O-N 3.1Å; H284-Y304 HydrophobicContact CB-CE2 3.72Å; H284-Y304 WeakPolarHBondContact CB-OH 3.48Å; H284-Y304 AromaticContact CG-CE2 3.82Å; H284-Y304 AromaticContact ND1-CE2 3.39Å; H284-Y304 WeakPolarHBondContact ND1-CE2 3.47Å; H284-Y304 AromaticContact ND1-CZ 3.48Å; H284-Y304 PolarHBondContact ND1-OH 3.41Å
285	Q	95.8	Very high	91.7	Very high	8 Å²	8	29.9 Å²	29.9	4%	0.037	18%	0.182	C	C	.	.	H	α-helix	trans	-50.1	-57.1	-173.6	176.6	175.4	-25.6	0	0	113.7	I215 A256 A257 T258 T278 V282 K283 R287 V288 H289	I215-Q285 HydrophobicContact CD1-CB 3.99Å; I215-Q285 HydrophobicContact CD1-CG 3.88Å; A256-Q285 HydrophobicContact CB-CG 4.11Å; A257-Q285 VanDerWaalsContact C-NE2 3.3Å; A257-Q285 PolarHBondContact O-NE2 2.67Å; T258-Q285 PolarHBondContact OG1-NE2 3.43Å; T278-Q285 PolarHBondContact OG1-NE2 2.96Å; T278-Q285 PolarHBondContact OG1-OE1 3.5Å; V282-Q285 HydrophobicContact CB-CB 4.07Å; V282-Q285 VanDerWaalsContact O-CB 3.28Å; V282-Q285 WeakPolarHBondContact O-CB 3.44Å; V282-Q285 PolarHBondContact O-N 2.93Å; V282-Q285 VanDerWaalsContact O-N 3.08Å; K283-Q285 PolarHBondContact O-N 3.09Å; K283-Q285 VanDerWaalsContact O-N 3.09Å; Q285-R287 VanDerWaalsContact C-N 3.29Å; Q285-R287 PolarHBondContact O-N 2.88Å; Q285-V288 PolarHBondContact O-N 3.28Å; Q285-H289 WeakPolarHBondContact O-CB 3.28Å; Q285-H289 PolarHBondContact O-N 3.32Å
286	M	96.4	Very high	91.7	Very high	16 Å²	16	28.3 Å²	28.3	8%	0.079	18%	0.176	C	C	.	.	H	α-helix	trans	-59.9	-41.9	-178.1	-70.7	179	-70.9	0	0	111.5	Y196 T258 L274 H284 V288 H289 M290 L337	Y196-M286 HydrophobicContact CD1-CE 3.59Å; Y196-M286 HydrophobicContact CD1-SD 4.09Å; Y196-M286 HydrophobicContact CD2-CE 3.83Å; Y196-M286 HydrophobicContact CD2-SD 3.53Å; Y196-M286 VanDerWaalsContact CD2-SD 3.53Å; Y196-M286 HydrophobicContact CE1-CE 3.7Å; Y196-M286 HydrophobicContact CE2-CE 3.94Å; Y196-M286 HydrophobicContact CE2-SD 4.12Å; Y196-M286 HydrophobicContact CG-CE 3.66Å; Y196-M286 HydrophobicContact CG-SD 3.51Å; Y196-M286 VanDerWaalsContact CG-SD 3.51Å; T258-M286 HydrophobicContact CG2-CG 4.21Å; L274-M286 HydrophobicContact CB-CG 4.33Å; L274-M286 HydrophobicContact CB-SD 3.89Å; L274-M286 HydrophobicContact CD1-CB 3.76Å; L274-M286 HydrophobicContact CD1-CG 3.93Å; L274-M286 HydrophobicContact CD1-SD 3.99Å; H284-M286 PolarHBondContact O-N 3.2Å; M286-V288 PolarHBondContact O-N 3.08Å; M286-H289 PolarHBondContact O-N 2.91Å; M286-M290 WeakPolarHBondContact O-CB 3.26Å; M286-M290 WeakPolarHBondContact O-CG 3.33Å; M286-M290 PolarHBondContact O-N 3.36Å; M286-L337 HydrophobicContact CE-CD1 3.85Å; M286-L337 HydrophobicContact CE-CD2 4.27Å; M286-L337 HydrophobicContact SD-CD1 4.18Å
287	R	97.3	Very high	91.9	Very high	16 Å²	16	28.9 Å²	28.9	6%	0.06	18%	0.179	C	C	.	.	H	α-helix	trans	-62.5	-45.9	179.8	-64.8	169	64.4	174.7	4.9	111.7	E164 H284 Q285 A291 I298 D301 Y304 L337	E164-R287 WeakPolarHBondContact OE1-CD 3.24Å; E164-R287 WeakPolarHBondContact OE2-CD 3.21Å; E164-R287 IonicContact OE2-CZ 3.32Å; E164-R287 IonicContact OE2-NE 2.79Å; E164-R287 IonicContact OE2-NH1 3.97Å; E164-R287 PolarHBondContact OE2-NH1 3.43Å; H284-R287 HydrophobicContact CB-CB 4.4Å; H284-R287 WeakPolarHBondContact O-CB 3.47Å; H284-R287 PolarHBondContact O-N 3.39Å; H284-R287 VanDerWaalsContact O-N 3.14Å; Q285-R287 VanDerWaalsContact C-N 3.29Å; Q285-R287 PolarHBondContact O-N 2.88Å; R287-A291 WeakPolarHBondContact O-CB 3.45Å; R287-A291 PolarHBondContact O-N 3.01Å; R287-I298 HydrophobicContact CG-CD1 3.98Å; R287-D301 WeakPolarHBondContact CB-OD2 3.31Å; R287-D301 WeakPolarHBondContact CG-OD2 3.42Å; R287-D301 IonicContact CZ-OD1 2.77Å; R287-D301 IonicContact CZ-OD2 3.43Å; R287-D301 IonicContact NE-OD1 2.72Å; R287-D301 IonicContact NE-OD2 3.64Å; R287-D301 PolarHBondContact NE-OD2 3.2Å; R287-D301 IonicContact NH2-OD1 3.65Å; R287-D301 PolarHBondContact NH2-OD1 3.34Å; R287-D301 IonicContact NH2-OD2 2.75Å; R287-D301 PolarHBondContact NH2-OD2 2.76Å; R287-Y304 HydrophobicContact CB-CD2 3.79Å; R287-Y304 HydrophobicContact CB-CE2 4.15Å; R287-L337 HydrophobicContact CG-CD2 4.25Å
288	V	96.7	Very high	92.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.9	-46.7	179.1	173.3	0	0	0	0	111	I215 M229 L231 H284 Q285 M286 A291 Y292 Y304	I215-V288 HydrophobicContact CD1-CB 4.15Å; I215-V288 HydrophobicContact CD1-CG1 4.07Å; I215-V288 HydrophobicContact CG1-CG1 4.18Å; I215-V288 HydrophobicContact CG2-CG1 4.33Å; M229-V288 HydrophobicContact CB-CG2 3.64Å; L231-V288 HydrophobicContact CD2-CG1 3.73Å; L231-V288 HydrophobicContact CG-CG1 4.24Å; H284-V288 HydrophobicContact CB-CG2 4.24Å; H284-V288 VanDerWaalsContact O-CG2 3.28Å; H284-V288 WeakPolarHBondContact O-CG2 3.34Å; H284-V288 PolarHBondContact O-N 3.1Å; Q285-V288 PolarHBondContact O-N 3.28Å; M286-V288 PolarHBondContact O-N 3.08Å; V288-A291 PolarHBondContact O-N 3.06Å; V288-Y292 HydrophobicContact CG1-CD2 3.85Å; V288-Y292 HydrophobicContact CG1-CE2 4.46Å; V288-Y292 WeakPolarHBondContact O-CB 3.2Å; V288-Y292 PolarHBondContact O-N 2.89Å; V288-Y304 HydrophobicContact CG2-CD1 4.12Å; V288-Y304 HydrophobicContact CG2-CE1 3.69Å; V288-Y304 HydrophobicContact CG2-CE2 4.41Å
289	H	97.4	Very high	92.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.162	C	C	.	.	I	π-helix	trans	-60.7	-48.9	177.5	-78.9	-173.6	0	0	0	111.4	I211 I213 A256 T258 Q285 M286 A291 A293 L294	I211-H289 HydrophobicContact CD1-CB 3.89Å; I211-H289 HydrophobicContact CG2-CB 4.09Å; I211-H289 PolarHBondContact O-CE1 2.91Å; I213-H289 PolarHBondContact O-NE2 2.91Å; A256-H289 PolarHBondContact O-CE1 3.15Å; T258-H289 VanDerWaalsContact CB-ND1 3.34Å; T258-H289 WeakPolarHBondContact CB-ND1 3.35Å; T258-H289 PolarHBondContact OG1-CE1 2.93Å; T258-H289 PolarHBondContact OG1-ND1 3.32Å; Q285-H289 WeakPolarHBondContact O-CB 3.28Å; Q285-H289 PolarHBondContact O-N 3.32Å; M286-H289 PolarHBondContact O-N 2.91Å; H289-A291 PolarHBondContact O-N 3.33Å; H289-A293 WeakPolarHBondContact O-CA 3.34Å; H289-A293 WeakPolarHBondContact O-CB 3.46Å; H289-A293 PolarHBondContact O-N 2.84Å; H289-L294 PolarHBondContact O-N 2.91Å
290	M	97.8	Very high	93.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	16%	0.16	C	C	.	.	I	π-helix	trans	-62.4	-44.7	177.7	-68.4	-44.7	-68	0	0	112.2	T200 P204 V272 L274 M286 L294 A295 C296 I298	T200-M290 HydrophobicContact CG2-CE 3.57Å; P204-M290 HydrophobicContact CG-CE 3.88Å; V272-M290 HydrophobicContact CG1-CE 4.29Å; V272-M290 HydrophobicContact CG2-CE 4.44Å; L274-M290 HydrophobicContact CD1-CG 3.85Å; L274-M290 HydrophobicContact CD1-SD 4.16Å; L274-M290 HydrophobicContact CD2-CE 4.5Å; L274-M290 HydrophobicContact CD2-CG 4.36Å; L274-M290 HydrophobicContact CD2-SD 3.56Å; L274-M290 VanDerWaalsContact CD2-SD 3.56Å; M286-M290 WeakPolarHBondContact O-CB 3.26Å; M286-M290 WeakPolarHBondContact O-CG 3.33Å; M286-M290 PolarHBondContact O-N 3.36Å; M290-L294 HydrophobicContact CE-CD1 3.78Å; M290-L294 HydrophobicContact SD-CD1 3.8Å; M290-A295 PolarHBondContact O-N 2.74Å; M290-C296 CarbonylContact C-O 3.54Å; M290-C296 WeakPolarHBondContact CB-O 3.43Å; M290-C296 HydrophobicContact CE-CB 4.32Å; M290-C296 CarbonylContact O-C 3.6Å; M290-C296 VanDerWaalsContact O-C 3.28Å; M290-C296 PolarHBondContact O-N 3.46Å; M290-I298 HydrophobicContact CB-CG1 4.16Å; M290-I298 HydrophobicContact CG-CD1 4.41Å; M290-I298 HydrophobicContact CG-CG1 4.22Å
291	A	96.6	Very high	95.2	Very high	5 Å²	5	20.9 Å²	20.9	4%	0.041	13%	0.131	C	C	.	.	I	π-helix	trans	-73	-45.7	-176.1	0	0	0	0	0	113.8	R287 V288 H289 A295 P297	R287-A291 WeakPolarHBondContact O-CB 3.45Å; R287-A291 PolarHBondContact O-N 3.01Å; V288-A291 PolarHBondContact O-N 3.06Å; H289-A291 PolarHBondContact O-N 3.33Å; A291-A295 WeakPolarHBondContact O-CA 3.17Å; A291-P297 HydrophobicContact CB-CB 3.99Å
292	Y	95.1	Very high	95.9	Very high	22 Å²	22	21.1 Å²	21.1	9%	0.086	12%	0.122	C	C	.	.	I	π-helix	trans	-104.2	-26.4	-169.4	-59.5	-40.5	0	0	0	114.2	V288 Y304 H306 W307	V288-Y292 HydrophobicContact CG1-CD2 3.85Å; V288-Y292 HydrophobicContact CG1-CE2 4.46Å; V288-Y292 WeakPolarHBondContact O-CB 3.2Å; V288-Y292 PolarHBondContact O-N 2.89Å; Y292-Y304 AromaticContact CE2-CD1 3.74Å; Y292-Y304 HydrophobicContact CE2-CD1 3.74Å; Y292-Y304 HydrophobicContact CE2-CE1 4.33Å; Y292-Y304 AromaticContact CZ-CD1 3.92Å; Y292-H306 PolarHBondContact OH-O 2.93Å; Y292-W307 AromaticContact CD1-CD2 3.9Å; Y292-W307 HydrophobicContact CD1-CD2 3.9Å; Y292-W307 AromaticContact CD1-CE3 3.45Å; Y292-W307 HydrophobicContact CD1-CE3 3.45Å; Y292-W307 VanDerWaalsContact CD1-CE3 3.45Å; Y292-W307 AromaticContact CD1-CH2 3.52Å; Y292-W307 HydrophobicContact CD1-CH2 3.52Å; Y292-W307 AromaticContact CD1-CZ2 3.94Å; Y292-W307 HydrophobicContact CD1-CZ2 3.94Å; Y292-W307 AromaticContact CD1-CZ3 3.25Å; Y292-W307 HydrophobicContact CD1-CZ3 3.25Å; Y292-W307 AromaticContact CE1-CD2 3.91Å; Y292-W307 HydrophobicContact CE1-CD2 3.91Å; Y292-W307 AromaticContact CE1-CE3 3.62Å; Y292-W307 HydrophobicContact CE1-CE3 3.62Å; Y292-W307 HydrophobicContact CE1-CG 4.5Å; Y292-W307 HydrophobicContact CE1-CH2 4.47Å; Y292-W307 AromaticContact CE1-CZ3 3.93Å; Y292-W307 HydrophobicContact CE1-CZ3 3.93Å; Y292-W307 HydrophobicContact CG-CE3 4.3Å; Y292-W307 HydrophobicContact CG-CH2 4.07Å; Y292-W307 AromaticContact CG-CZ3 3.77Å; Y292-W307 HydrophobicContact CG-CZ3 3.77Å
293	A	95.4	Very high	96	Very high	36 Å²	36	22.5 Å²	22.5	30%	0.298	13%	0.126	S	C	.	.	I	π-helix	trans	-88.6	-42.7	178	0	0	0	0	0	111.4	I211 I213 L231 H289	I211-A293 HydrophobicContact CG2-CB 3.72Å; I213-A293 HydrophobicContact CD1-CB 3.96Å; L231-A293 HydrophobicContact CD1-CB 4.03Å; H289-A293 WeakPolarHBondContact O-CA 3.34Å; H289-A293 WeakPolarHBondContact O-CB 3.46Å; H289-A293 PolarHBondContact O-N 2.84Å
294	L	96.2	Very high	96	Very high	32 Å²	32	17.8 Å²	17.8	17%	0.168	11%	0.106	C	C	.	.	S	Bend	trans	-101.9	-2.1	-178.1	-63.8	-179.6	0	0	0	114.3	P204 I211 Y260 H289 M290 C296	P204-L294 HydrophobicContact CB-CD1 4.05Å; P204-L294 HydrophobicContact CG-CD1 4.21Å; I211-L294 HydrophobicContact CD1-CD1 3.6Å; I211-L294 HydrophobicContact CD1-CD2 4.32Å; I211-L294 HydrophobicContact CD1-CG 3.7Å; I211-L294 HydrophobicContact CG1-CG 4.42Å; Y260-L294 HydrophobicContact CD1-CD1 4.09Å; Y260-L294 HydrophobicContact CD2-CD1 4.1Å; Y260-L294 HydrophobicContact CE1-CD1 3.96Å; Y260-L294 HydrophobicContact CE1-CD2 4.19Å; Y260-L294 HydrophobicContact CE2-CD1 3.97Å; Y260-L294 HydrophobicContact CG-CD1 4.15Å; H289-L294 PolarHBondContact O-N 2.91Å; M290-L294 HydrophobicContact CE-CD1 3.78Å; M290-L294 HydrophobicContact SD-CD1 3.8Å; L294-C296 HydrophobicContact CB-CB 4.34Å; L294-C296 PolarHBondContact O-N 3.32Å; L294-C296 PolarHBondContact O-SG 3.48Å
295	A	96.3	Very high	95.8	Very high	75 Å²	75	17.5 Å²	17.5	62%	0.62	11%	0.107	S	C	*	.	S	Bend	trans	52.6	25.9	-173.9	0	0	0	0	0	114	M290 A291 P297	M290-A295 PolarHBondContact O-N 2.74Å; A291-A295 WeakPolarHBondContact O-CA 3.17Å; A295-P297 WeakPolarHBondContact O-CD 3.49Å
296	C	97.3	Very high	95.3	Very high	7 Å²	7	18.7 Å²	18.7	5%	0.047	11%	0.113	C	C	.	.			trans	-121.6	69.1	-176.8	-69.3	0	0	0	0	110.1	T200 V201 V203 P204 M290 L294	T200-C296 WeakPolarHBondContact CG2-O 3.05Å; V201-C296 CarbonylContact O-C 3.53Å; V201-C296 VanDerWaalsContact O-CA 3.26Å; V201-C296 WeakPolarHBondContact O-CA 3.3Å; V203-C296 VanDerWaalsContact C-SG 3.55Å; P204-C296 HydrophobicContact CG-CB 4.25Å; M290-C296 CarbonylContact C-O 3.54Å; M290-C296 WeakPolarHBondContact CB-O 3.43Å; M290-C296 HydrophobicContact CE-CB 4.32Å; M290-C296 CarbonylContact O-C 3.6Å; M290-C296 VanDerWaalsContact O-C 3.28Å; M290-C296 PolarHBondContact O-N 3.46Å; L294-C296 HydrophobicContact CB-CB 4.34Å; L294-C296 PolarHBondContact O-N 3.32Å; L294-C296 PolarHBondContact O-SG 3.48Å
297	P	97.4	Very high	94.4	Very high	22 Å²	22	26.6 Å²	26.6	14%	0.143	14%	0.142	C	C	.	.	P	Polyproline II helix	trans	-61.5	145.7	-174.7	27	-35.6	0	0	0	112	T200 V201 A291 A295	T200-P297 WeakPolarHBondContact CA-O 3.43Å; V201-P297 PolarHBondContact N-O 2.91Å; A291-P297 HydrophobicContact CB-CB 3.99Å; A295-P297 WeakPolarHBondContact O-CD 3.49Å
298	I	98.3	Very high	93.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-62.6	137.7	177	-60.4	172.8	0	0	0	109.7	V198 I199 T200 R287 M290 G300 D301 Q313 L335 H336 L337	V198-I298 HydrophobicContact CB-CD1 4.18Å; V198-I298 HydrophobicContact CB-CG1 4.12Å; V198-I298 HydrophobicContact CB-CG2 4.3Å; V198-I298 HydrophobicContact CG1-CD1 3.73Å; V198-I298 HydrophobicContact CG1-CG1 4.23Å; V198-I298 HydrophobicContact CG2-CG1 4.37Å; I199-I298 CarbonylContact O-C 3.52Å; I199-I298 WeakPolarHBondContact O-CA 3.48Å; T200-I298 HydrophobicContact CG2-CG1 4.44Å; R287-I298 HydrophobicContact CG-CD1 3.98Å; M290-I298 HydrophobicContact CB-CG1 4.16Å; M290-I298 HydrophobicContact CG-CD1 4.41Å; M290-I298 HydrophobicContact CG-CG1 4.22Å; I298-G300 PolarHBondContact O-N 2.62Å; I298-D301 HydrophobicContact CB-CB 4.27Å; I298-D301 WeakPolarHBondContact O-CB 3.42Å; I298-D301 PolarHBondContact O-N 3.39Å; I298-Q313 PolarHBondContact O-NE2 3.14Å; I298-L335 HydrophobicContact CB-CD1 4.13Å; I298-L335 HydrophobicContact CG2-CD1 3.67Å; I298-L335 HydrophobicContact CG2-CG 4.43Å; I298-H336 HydrophobicContact CG2-CB 4.44Å; I298-H336 VanDerWaalsContact CG2-O 3.29Å; I298-H336 WeakPolarHBondContact CG2-O 3.28Å; I298-L337 HydrophobicContact CD1-CD1 4.4Å
299	L	97.9	Very high	92.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	128	178.1	-177.9	65.1	0	0	0	110.6	I199 V201 D301 L315 L323 L333 H336 T365 L369	I199-L299 HydrophobicContact CB-CB 4.18Å; I199-L299 HydrophobicContact CB-CD2 4.37Å; I199-L299 HydrophobicContact CG2-CB 4.08Å; I199-L299 HydrophobicContact CG2-CD2 3.84Å; I199-L299 WeakPolarHBondContact O-CB 3.41Å; I199-L299 PolarHBondContact O-N 3.26Å; V201-L299 HydrophobicContact CG2-CB 4.42Å; V201-L299 HydrophobicContact CG2-CD1 3.86Å; L299-D301 VanDerWaalsContact C-N 3.32Å; L299-L315 HydrophobicContact CD1-CD1 4.19Å; L299-L315 HydrophobicContact CD1-CD2 3.73Å; L299-L323 HydrophobicContact CD1-CD1 4.4Å; L299-L333 HydrophobicContact CD1-CD1 4.27Å; L299-H336 HydrophobicContact CB-CB 4.37Å; L299-H336 PolarHBondContact O-N 2.93Å; L299-H336 PolarHBondContact O-ND1 3.1Å; L299-H336 VanDerWaalsContact O-ND1 3.15Å; L299-T365 HydrophobicContact CD2-CG2 3.51Å; L299-L369 HydrophobicContact CD2-CD1 4.07Å
300	G	95.8	Very high	91.5	Very high	6 Å²	6	42 Å²	42	6%	0.062	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	-1.1	-172.5	0	0	0	0	0	114	I298 H302	I298-G300 PolarHBondContact O-N 2.62Å; G300-H302 PolarHBondContact O-N 3.5Å; G300-H302 PolarHBondContact O-ND1 2.91Å
301	D	96.1	Very high	90.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.235	C	C	.	.			trans	-80.1	82.2	177.3	-163	-22.8	0	0	0	112.3	R287 I298 L299 K303 Y304 S305 L335	R287-D301 WeakPolarHBondContact CB-OD2 3.31Å; R287-D301 WeakPolarHBondContact CG-OD2 3.42Å; R287-D301 IonicContact CZ-OD1 2.77Å; R287-D301 IonicContact CZ-OD2 3.43Å; R287-D301 IonicContact NE-OD1 2.72Å; R287-D301 IonicContact NE-OD2 3.64Å; R287-D301 PolarHBondContact NE-OD2 3.2Å; R287-D301 IonicContact NH2-OD1 3.65Å; R287-D301 PolarHBondContact NH2-OD1 3.34Å; R287-D301 IonicContact NH2-OD2 2.75Å; R287-D301 PolarHBondContact NH2-OD2 2.76Å; I298-D301 HydrophobicContact CB-CB 4.27Å; I298-D301 WeakPolarHBondContact O-CB 3.42Å; I298-D301 PolarHBondContact O-N 3.39Å; L299-D301 VanDerWaalsContact C-N 3.32Å; D301-K303 PolarHBondContact O-N 2.91Å; D301-K303 PolarHBondContact OD1-N 3.08Å; D301-K303 VanDerWaalsContact OD1-N 3.07Å; D301-Y304 PolarHBondContact OD1-N 3.07Å; D301-Y304 VanDerWaalsContact OD1-N 3.1Å; D301-Y304 WeakPolarHBondContact OD2-CD2 3.31Å; D301-S305 WeakPolarHBondContact O-CB 3.35Å; D301-S305 PolarHBondContact O-N 3.34Å; D301-S305 PolarHBondContact O-OG 2.73Å; D301-L335 HydrophobicContact CB-CD1 3.6Å
302	H	93.3	Very high	90.7	Very high	43 Å²	43	45.8 Å²	45.8	20%	0.199	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-17.8	178.9	-52.6	-30.6	0	0	0	113.7	G300 A311 Q313 S330 R331	G300-H302 PolarHBondContact O-N 3.5Å; G300-H302 PolarHBondContact O-ND1 2.91Å; H302-A311 VanDerWaalsContact O-O 3.09Å; H302-Q313 PolarHBondContact ND1-N 3.01Å; H302-S330 PolarHBondContact CE1-O 3.49Å; H302-S330 PolarHBondContact NE2-O 3.28Å; H302-R331 WeakPolarHBondContact NE2-CA 3.43Å; H302-R331 PolarHBondContact NE2-O 2.96Å
303	K	91.6	Very high	90.7	Very high	53 Å²	53	44.8 Å²	44.8	23%	0.23	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-42	-176.7	-174.6	171	-179.4	170.2	0	111.9	F227 K228 D301	F227-K303 PolarHBondContact O-NZ 3.41Å; K228-K303 PolarHBondContact NZ-O 2.99Å; D301-K303 PolarHBondContact O-N 2.91Å; D301-K303 PolarHBondContact OD1-N 3.08Å; D301-K303 VanDerWaalsContact OD1-N 3.07Å
304	Y	93.2	Very high	90.7	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.008	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-7.1	-171.9	-65.5	-69.3	0	0	0	114.7	M229 H284 R287 V288 Y292 D301 H306	M229-Y304 PolarHBondContact N-OH 3.21Å; M229-Y304 VanDerWaalsContact O-CE1 3.29Å; M229-Y304 WeakPolarHBondContact O-CE1 3.32Å; H284-Y304 HydrophobicContact CB-CE2 3.72Å; H284-Y304 WeakPolarHBondContact CB-OH 3.48Å; H284-Y304 AromaticContact CG-CE2 3.82Å; H284-Y304 AromaticContact ND1-CE2 3.39Å; H284-Y304 WeakPolarHBondContact ND1-CE2 3.47Å; H284-Y304 AromaticContact ND1-CZ 3.48Å; H284-Y304 PolarHBondContact ND1-OH 3.41Å; R287-Y304 HydrophobicContact CB-CD2 3.79Å; R287-Y304 HydrophobicContact CB-CE2 4.15Å; V288-Y304 HydrophobicContact CG2-CD1 4.12Å; V288-Y304 HydrophobicContact CG2-CE1 3.69Å; V288-Y304 HydrophobicContact CG2-CE2 4.41Å; Y292-Y304 AromaticContact CE2-CD1 3.74Å; Y292-Y304 HydrophobicContact CE2-CD1 3.74Å; Y292-Y304 HydrophobicContact CE2-CE1 4.33Å; Y292-Y304 AromaticContact CZ-CD1 3.92Å; D301-Y304 PolarHBondContact OD1-N 3.07Å; D301-Y304 VanDerWaalsContact OD1-N 3.1Å; D301-Y304 WeakPolarHBondContact OD2-CD2 3.31Å; Y304-H306 PolarHBondContact O-N 3.32Å; Y304-H306 VanDerWaalsContact O-N 3.16Å
305	S	90.5	Very high	90.6	Very high	25 Å²	25	49.6 Å²	49.6	18%	0.175	26%	0.262	C	S	.	.	S	Bend	trans	-69.1	-9	176.6	-67.1	0	0	0	0	115	D301 Q313	D301-S305 WeakPolarHBondContact O-CB 3.35Å; D301-S305 PolarHBondContact O-N 3.34Å; D301-S305 PolarHBondContact O-OG 2.73Å; S305-Q313 VanDerWaalsContact OG-CD 3.26Å; S305-Q313 WeakPolarHBondContact OG-CG 3.41Å; S305-Q313 PolarHBondContact OG-NE2 3.5Å
306	H	85.7	Confident	90.6	Very high	32 Å²	32	49.1 Å²	49.1	15%	0.148	25%	0.252	C	S	.	.	S	Bend	trans	-127.9	137.5	176.2	-70.7	96	0	0	0	109.4	Y292 Y304 K309 A311 P312	Y292-H306 PolarHBondContact OH-O 2.93Å; Y304-H306 PolarHBondContact O-N 3.32Å; Y304-H306 VanDerWaalsContact O-N 3.16Å; H306-K309 HydrophobicContact CB-CG 3.89Å; H306-K309 VanDerWaalsContact CB-O 3.3Å; H306-K309 WeakPolarHBondContact CB-O 3.31Å; H306-K309 VanDerWaalsContact CD2-CE 3.43Å; H306-K309 WeakPolarHBondContact CD2-CE 3.45Å; H306-A311 PolarHBondContact ND1-O 3.48Å; H306-P312 PolarHBondContact CE1-O 3.14Å
307	W	77.4	Confident	90.5	Very high	183 Å²	183	55.2 Å²	55.2	69%	0.693	29%	0.285	S	S	*	.	S	Bend	trans	-67.8	-45.5	-179.5	-65	93.7	0	0	0	112.6	Y292	Y292-W307 AromaticContact CD1-CD2 3.9Å; Y292-W307 HydrophobicContact CD1-CD2 3.9Å; Y292-W307 AromaticContact CD1-CE3 3.45Å; Y292-W307 HydrophobicContact CD1-CE3 3.45Å; Y292-W307 VanDerWaalsContact CD1-CE3 3.45Å; Y292-W307 AromaticContact CD1-CH2 3.52Å; Y292-W307 HydrophobicContact CD1-CH2 3.52Å; Y292-W307 AromaticContact CD1-CZ2 3.94Å; Y292-W307 HydrophobicContact CD1-CZ2 3.94Å; Y292-W307 AromaticContact CD1-CZ3 3.25Å; Y292-W307 HydrophobicContact CD1-CZ3 3.25Å; Y292-W307 AromaticContact CE1-CD2 3.91Å; Y292-W307 HydrophobicContact CE1-CD2 3.91Å; Y292-W307 AromaticContact CE1-CE3 3.62Å; Y292-W307 HydrophobicContact CE1-CE3 3.62Å; Y292-W307 HydrophobicContact CE1-CG 4.5Å; Y292-W307 HydrophobicContact CE1-CH2 4.47Å; Y292-W307 AromaticContact CE1-CZ3 3.93Å; Y292-W307 HydrophobicContact CE1-CZ3 3.93Å; Y292-W307 HydrophobicContact CG-CE3 4.3Å; Y292-W307 HydrophobicContact CG-CH2 4.07Å; Y292-W307 AromaticContact CG-CZ3 3.77Å; Y292-W307 HydrophobicContact CG-CZ3 3.77Å
308	S	70.8	Confident	90.4	Very high	93 Å²	93	63.7 Å²	63.7	65%	0.65	31%	0.314	S	S	*	.	S	Bend	trans	-113.5	-19.4	-168.2	55	0	0	0	0	115.3
309	K	77.6	Confident	90.2	Very high	118 Å²	118	63.7 Å²	63.7	51%	0.513	31%	0.314	S	S	.	.			trans	-124.7	153.6	-171.8	62.5	-177.1	177.6	-175.4	0	113.2	K228 H306 A311	K228-K309 PolarHBondContact NZ-O 2.81Å; H306-K309 HydrophobicContact CB-CG 3.89Å; H306-K309 VanDerWaalsContact CB-O 3.3Å; H306-K309 WeakPolarHBondContact CB-O 3.31Å; H306-K309 VanDerWaalsContact CD2-CE 3.43Å; H306-K309 WeakPolarHBondContact CD2-CE 3.45Å; K309-A311 HydrophobicContact CD-CB 4.22Å; K309-A311 HydrophobicContact CG-CB 4.14Å
310	L	80.7	Confident	90.1	Very high	127 Å²	127	64.3 Å²	64.3	67%	0.665	32%	0.317	S	S	*	.			trans	-92.2	97.7	168.2	-172.4	65.2	0	0	0	108.4
311	A	86.8	Confident	90	Very high	24 Å²	24	72.9 Å²	72.9	20%	0.198	35%	0.352	C	S	.	.			trans	-142.1	150.6	-178.9	0	0	0	0	0	110.3	H302 H306 K309 Q313	H302-A311 VanDerWaalsContact O-O 3.09Å; H306-A311 PolarHBondContact ND1-O 3.48Å; K309-A311 HydrophobicContact CD-CB 4.22Å; K309-A311 HydrophobicContact CG-CB 4.14Å; A311-Q313 PolarHBondContact O-N 3.37Å
312	P	92.1	Very high	89.9	Confident	61 Å²	61	75.6 Å²	75.6	40%	0.396	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-51.6	139.8	173.8	-24.9	34.3	0	0	0	111.1	H306 K314 R331	H306-P312 PolarHBondContact CE1-O 3.14Å; P312-K314 PolarHBondContact O-N 2.97Å; P312-R331 HydrophobicContact CB-CB 3.97Å; P312-R331 HydrophobicContact CG-CB 3.85Å
313	Q	95.1	Very high	90	Very high	2 Å²	2	73.6 Å²	73.6	1%	0.009	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-53.5	129.1	-179.8	179	175.7	46.8	0	0	110.4	I298 H302 S305 A311 L315 Q327 S330	I298-Q313 PolarHBondContact O-NE2 3.14Å; H302-Q313 PolarHBondContact ND1-N 3.01Å; S305-Q313 VanDerWaalsContact OG-CD 3.26Å; S305-Q313 WeakPolarHBondContact OG-CG 3.41Å; S305-Q313 PolarHBondContact OG-NE2 3.5Å; A311-Q313 PolarHBondContact O-N 3.37Å; Q313-L315 HydrophobicContact CG-CD2 3.81Å; Q313-L315 HydrophobicContact CG-CG 4.41Å; Q313-Q327 PolarHBondContact O-NE2 3.42Å; Q313-S330 PolarHBondContact O-OG 2.87Å
314	K	94.4	Very high	90	Very high	162 Å²	162	72.9 Å²	72.9	70%	0.704	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-82	126.2	172	-169.9	177.2	-179.3	-177.4	0	108.1	P312	P312-K314 PolarHBondContact O-N 2.97Å
315	L	95.4	Very high	90	Very high	6 Å²	6	73.3 Å²	73.3	3%	0.031	37%	0.365	C	S	.	.			trans	-112.7	144.2	-177.6	-64.6	177.6	0	0	0	109.6	V201 L299 Q313 L320 L323 L333	V201-L315 HydrophobicContact CG1-CD2 4.49Å; V201-L315 HydrophobicContact CG2-CD2 3.56Å; L299-L315 HydrophobicContact CD1-CD1 4.19Å; L299-L315 HydrophobicContact CD1-CD2 3.73Å; Q313-L315 HydrophobicContact CG-CD2 3.81Å; Q313-L315 HydrophobicContact CG-CG 4.41Å; L315-L320 HydrophobicContact CB-CD1 4.39Å; L315-L320 HydrophobicContact CB-CD2 3.84Å; L315-L320 HydrophobicContact CB-CG 3.78Å; L315-L320 HydrophobicContact CD1-CD2 3.86Å; L315-L320 HydrophobicContact CG-CD2 4.41Å; L315-L323 HydrophobicContact CD1-CD1 4.12Å; L315-L333 HydrophobicContact CD1-CD1 3.57Å
316	P	95.4	Very high	90.1	Very high	66 Å²	66	76.7 Å²	76.7	43%	0.429	38%	0.378	S	S	.	.			trans	-60.1	146.5	170.6	-21.4	32.1	0	0	0	111.5	V201 R318 V319 L320	V201-P316 HydrophobicContact CG1-CG 4.27Å; P316-R318 PolarHBondContact O-N 2.89Å; P316-R318 VanDerWaalsContact O-N 3.14Å; P316-V319 HydrophobicContact CB-CG2 4.18Å; P316-V319 HydrophobicContact CG-CG2 4.13Å; P316-V319 WeakPolarHBondContact O-CA 3.43Å; P316-V319 WeakPolarHBondContact O-CB 3.49Å; P316-V319 PolarHBondContact O-N 3.39Å; P316-L320 PolarHBondContact O-N 3.44Å
317	D	95	Very high	90.5	Very high	135 Å²	135	78.4 Å²	78.4	72%	0.722	39%	0.386	S	S	*	.	H	α-helix	trans	-57.1	-34.9	-177.4	-65	-26.9	0	0	0	113	V319 L320 K321	D317-V319 VanDerWaalsContact C-N 3.35Å; D317-V319 PolarHBondContact O-N 3.32Å; D317-L320 PolarHBondContact O-N 3.05Å; D317-K321 WeakPolarHBondContact O-CB 3.44Å; D317-K321 PolarHBondContact O-N 2.79Å
318	R	94.5	Very high	91.2	Very high	199 Å²	199	73 Å²	73	75%	0.751	38%	0.377	S	S	*	.	H	α-helix	trans	-61.2	-43.1	175.4	-64.4	-178.2	-179.9	179.4	-0.4	111.8	P316 K322	P316-R318 PolarHBondContact O-N 2.89Å; P316-R318 VanDerWaalsContact O-N 3.14Å; R318-K322 WeakPolarHBondContact O-CG 3.38Å; R318-K322 PolarHBondContact O-N 3.04Å; R318-K322 VanDerWaalsContact O-N 3.11Å
319	V	95.4	Very high	92.2	Very high	1 Å²	1	71.4 Å²	71.4	1%	0.006	36%	0.358	C	S	.	.	H	α-helix	trans	-68.1	-45.5	178	179.1	0	0	0	0	109.9	P316 D317 K321 K322 L323 L369	P316-V319 HydrophobicContact CB-CG2 4.18Å; P316-V319 HydrophobicContact CG-CG2 4.13Å; P316-V319 WeakPolarHBondContact O-CA 3.43Å; P316-V319 WeakPolarHBondContact O-CB 3.49Å; P316-V319 PolarHBondContact O-N 3.39Å; D317-V319 VanDerWaalsContact C-N 3.35Å; D317-V319 PolarHBondContact O-N 3.32Å; V319-K321 VanDerWaalsContact C-N 3.35Å; V319-K321 PolarHBondContact O-N 3.08Å; V319-K322 PolarHBondContact O-N 3.32Å; V319-L323 HydrophobicContact CG1-CD1 3.85Å; V319-L323 HydrophobicContact CG1-CG 4.26Å; V319-L323 WeakPolarHBondContact O-CB 3.24Å; V319-L323 VanDerWaalsContact O-CG 3.3Å; V319-L323 WeakPolarHBondContact O-CG 3.48Å; V319-L323 PolarHBondContact O-N 3.45Å; V319-L369 HydrophobicContact CG1-CD2 4.16Å
320	L	94.9	Very high	92.8	Very high	12 Å²	12	65.9 Å²	65.9	6%	0.063	33%	0.334	C	S	.	.	H	α-helix	trans	-56.6	-46.6	175.8	-73.7	173.1	0	0	0	112.2	L315 P316 D317 K322 L323 G324 L325 Q327	L315-L320 HydrophobicContact CB-CD1 4.39Å; L315-L320 HydrophobicContact CB-CD2 3.84Å; L315-L320 HydrophobicContact CB-CG 3.78Å; L315-L320 HydrophobicContact CD1-CD2 3.86Å; L315-L320 HydrophobicContact CG-CD2 4.41Å; P316-L320 PolarHBondContact O-N 3.44Å; D317-L320 PolarHBondContact O-N 3.05Å; L320-K322 PolarHBondContact O-N 3.35Å; L320-L323 PolarHBondContact O-N 2.74Å; L320-G324 PolarHBondContact O-N 3.16Å; L320-L325 WeakPolarHBondContact CB-O 3.4Å; L320-L325 HydrophobicContact CD2-CB 4.45Å; L320-L325 PolarHBondContact O-N 2.99Å; L320-Q327 HydrophobicContact CD1-CB 3.89Å
321	K	94.4	Very high	93.3	Very high	186 Å²	186	66.9 Å²	66.9	81%	0.809	33%	0.329	S	S	*	.	H	α-helix	trans	-60.7	-43.7	177.3	-171.6	175.7	-177.6	177.8	0	112	D317 V319 G324	D317-K321 WeakPolarHBondContact O-CB 3.44Å; D317-K321 PolarHBondContact O-N 2.79Å; V319-K321 VanDerWaalsContact C-N 3.35Å; V319-K321 PolarHBondContact O-N 3.08Å; K321-G324 PolarHBondContact O-N 2.95Å
322	K	94.8	Very high	93.5	Very high	57 Å²	57	69.2 Å²	69.2	25%	0.248	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-39.2	177.3	-74.3	-68.8	-172.6	169.9	0	112.8	Y267 R318 V319 L320 G324 L369	Y267-K322 HydrophobicContact CD1-CG 4.48Å; Y267-K322 HydrophobicContact CG-CG 4.33Å; Y267-K322 PolarHBondContact OH-NZ 3.11Å; R318-K322 WeakPolarHBondContact O-CG 3.38Å; R318-K322 PolarHBondContact O-N 3.04Å; R318-K322 VanDerWaalsContact O-N 3.11Å; V319-K322 PolarHBondContact O-N 3.32Å; L320-K322 PolarHBondContact O-N 3.35Å; K322-G324 PolarHBondContact O-N 3.4Å; K322-L369 HydrophobicContact CB-CD2 4.14Å
323	L	93.4	Very high	93.5	Very high	2 Å²	2	66.6 Å²	66.6	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-72.3	-14.9	175.3	-65.3	178.9	0	0	0	113.3	L299 L315 V319 L320 L325 L333 T365 R368 L369	L299-L323 HydrophobicContact CD1-CD1 4.4Å; L315-L323 HydrophobicContact CD1-CD1 4.12Å; V319-L323 HydrophobicContact CG1-CD1 3.85Å; V319-L323 HydrophobicContact CG1-CG 4.26Å; V319-L323 WeakPolarHBondContact O-CB 3.24Å; V319-L323 VanDerWaalsContact O-CG 3.3Å; V319-L323 WeakPolarHBondContact O-CG 3.48Å; V319-L323 PolarHBondContact O-N 3.45Å; L320-L323 PolarHBondContact O-N 2.74Å; L323-L325 VanDerWaalsContact C-N 3.34Å; L323-L325 HydrophobicContact CB-CB 4.35Å; L323-L325 HydrophobicContact CB-CD1 4.08Å; L323-L325 HydrophobicContact CB-CG 4.22Å; L323-L325 HydrophobicContact CD1-CD1 4.5Å; L323-L333 HydrophobicContact CD1-CD1 4.25Å; L323-L333 HydrophobicContact CD1-CD2 4.44Å; L323-T365 HydrophobicContact CD2-CG2 3.86Å; L323-R368 HydrophobicContact CD2-CB 4.47Å; L323-L369 HydrophobicContact CD2-CD1 4.34Å; L323-L369 HydrophobicContact CD2-CD2 3.92Å; L323-L369 HydrophobicContact CD2-CG 3.98Å; L323-L369 HydrophobicContact CG-CD2 4.18Å
324	G	93.1	Very high	93.5	Very high	38 Å²	38	66.6 Å²	66.6	39%	0.392	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	38	-174.4	0	0	0	0	0	112	L320 K321 K322	L320-G324 PolarHBondContact O-N 3.16Å; K321-G324 PolarHBondContact O-N 2.95Å; K322-G324 PolarHBondContact O-N 3.4Å
325	L	92.6	Very high	93.6	Very high	11 Å²	11	59 Å²	59	6%	0.058	28%	0.283	C	S	.	.			trans	-126.4	145	-175.5	-72.2	174.9	0	0	0	111.1	R81 V82 L85 L320 L323 K329 L333	R81-L325 HydrophobicContact CB-CD2 4.04Å; R81-L325 HydrophobicContact CG-CD2 3.62Å; R81-L325 HydrophobicContact CG-CG 4.07Å; V82-L325 HydrophobicContact CG2-CD2 4.11Å; L85-L325 HydrophobicContact CD1-CD1 4.18Å; L320-L325 WeakPolarHBondContact CB-O 3.4Å; L320-L325 HydrophobicContact CD2-CB 4.45Å; L320-L325 PolarHBondContact O-N 2.99Å; L323-L325 VanDerWaalsContact C-N 3.34Å; L323-L325 HydrophobicContact CB-CB 4.35Å; L323-L325 HydrophobicContact CB-CD1 4.08Å; L323-L325 HydrophobicContact CB-CG 4.22Å; L323-L325 HydrophobicContact CD1-CD1 4.5Å; L325-K329 HydrophobicContact CD2-CB 4.3Å; L325-L333 HydrophobicContact CD1-CD1 4.15Å; L325-L333 HydrophobicContact CD1-CD2 3.66Å; L325-L333 HydrophobicContact CD1-CG 3.9Å
326	E	92.5	Very high	93.7	Very high	95 Å²	95	58.7 Å²	58.7	44%	0.444	28%	0.282	S	S	.	.			trans	-83.8	152.9	164.8	-67.5	158.8	-142.7	0	0	110.2	S78 S328 K329 S330	S78-E326 WeakPolarHBondContact CB-OE1 3.32Å; S78-E326 PolarHBondContact OG-OE1 2.9Å; E326-S328 PolarHBondContact O-N 3.21Å; E326-S328 PolarHBondContact OE2-OG 3.25Å; E326-K329 HydrophobicContact CB-CG 4.3Å; E326-K329 PolarHBondContact O-N 2.92Å; E326-S330 PolarHBondContact O-N 3.33Å
327	Q	94	Very high	93.8	Very high	68 Å²	68	55.6 Å²	55.6	32%	0.318	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-57	-33.8	177.2	-177.8	57.5	74.4	0	0	112.6	Q313 L320 K329 S330	Q313-Q327 PolarHBondContact O-NE2 3.42Å; L320-Q327 HydrophobicContact CD1-CB 3.89Å; Q327-K329 PolarHBondContact O-N 2.98Å; Q327-S330 PolarHBondContact NE2-OG 3.03Å; Q327-S330 PolarHBondContact O-N 2.88Å; Q327-S330 PolarHBondContact O-OG 3.44Å
328	S	91.3	Very high	94	Very high	71 Å²	71	49.1 Å²	49.1	50%	0.497	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-60.9	-24.4	176.1	70.4	0	0	0	0	113.1	E326	E326-S328 PolarHBondContact O-N 3.21Å; E326-S328 PolarHBondContact OE2-OG 3.25Å
329	K	91.8	Very high	94.1	Very high	59 Å²	59	39.9 Å²	39.9	26%	0.257	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-100.2	-3.8	-177.1	-53.8	-51.5	178.7	-171.9	0	113.3	V82 L325 E326 Q327 R331 Y332	V82-K329 HydrophobicContact CG2-CB 3.63Å; V82-K329 HydrophobicContact CG2-CD 4.19Å; V82-K329 HydrophobicContact CG2-CG 3.9Å; L325-K329 HydrophobicContact CD2-CB 4.3Å; E326-K329 HydrophobicContact CB-CG 4.3Å; E326-K329 PolarHBondContact O-N 2.92Å; Q327-K329 PolarHBondContact O-N 2.98Å; K329-R331 PolarHBondContact O-N 2.98Å; K329-R331 VanDerWaalsContact O-N 3.1Å; K329-Y332 HydrophobicContact CB-CD2 4.37Å; K329-Y332 HydrophobicContact CD-CE2 4.24Å; K329-Y332 WeakPolarHBondContact O-CD2 3.16Å; K329-Y332 PolarHBondContact O-N 3.47Å; K329-Y332 VanDerWaalsContact O-N 3.11Å
330	S	91.3	Very high	94.2	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.007	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-58.9	-26.5	-179.9	76.3	0	0	0	0	112.9	H302 Q313 E326 Q327 Y332 L333	H302-S330 PolarHBondContact CE1-O 3.49Å; H302-S330 PolarHBondContact NE2-O 3.28Å; Q313-S330 PolarHBondContact O-OG 2.87Å; E326-S330 PolarHBondContact O-N 3.33Å; Q327-S330 PolarHBondContact NE2-OG 3.03Å; Q327-S330 PolarHBondContact O-N 2.88Å; Q327-S330 PolarHBondContact O-OG 3.44Å; S330-Y332 PolarHBondContact O-N 3.35Å; S330-L333 VanDerWaalsContact O-CB 3.31Å; S330-L333 WeakPolarHBondContact O-CB 3.38Å; S330-L333 PolarHBondContact O-N 2.87Å
331	R	90.9	Very high	94.2	Very high	149 Å²	149	43.9 Å²	43.9	56%	0.562	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-59.4	-13.6	176.3	72.9	179.6	-60.1	-158.2	3.2	115.6	H302 P312 K329	H302-R331 WeakPolarHBondContact NE2-CA 3.43Å; H302-R331 PolarHBondContact NE2-O 2.96Å; P312-R331 HydrophobicContact CB-CB 3.97Å; P312-R331 HydrophobicContact CG-CB 3.85Å; K329-R331 PolarHBondContact O-N 2.98Å; K329-R331 VanDerWaalsContact O-N 3.1Å
332	Y	90.4	Very high	94.2	Very high	72 Å²	72	35.5 Å²	35.5	28%	0.282	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-99.8	1	178.3	-58.1	-66.7	0	0	0	112.5	V82 K86 K329 S330 P334	V82-Y332 HydrophobicContact CB-CD2 4.45Å; V82-Y332 HydrophobicContact CG1-CD1 4.45Å; V82-Y332 HydrophobicContact CG1-CD2 3.53Å; V82-Y332 HydrophobicContact CG1-CE2 3.97Å; V82-Y332 HydrophobicContact CG1-CG 3.8Å; V82-Y332 HydrophobicContact CG2-CD2 3.99Å; K86-Y332 VanDerWaalsContact CE-CD1 3.44Å; K86-Y332 VanDerWaalsContact CE-CE1 3.41Å; K329-Y332 HydrophobicContact CB-CD2 4.37Å; K329-Y332 HydrophobicContact CD-CE2 4.24Å; K329-Y332 WeakPolarHBondContact O-CD2 3.16Å; K329-Y332 PolarHBondContact O-N 3.47Å; K329-Y332 VanDerWaalsContact O-N 3.11Å; S330-Y332 PolarHBondContact O-N 3.35Å; Y332-P334 WeakPolarHBondContact O-CD 3.36Å
333	L	93.3	Very high	94.2	Very high	6 Å²	6	33.6 Å²	33.6	3%	0.031	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-70.6	125.2	174.5	-77.6	165.8	0	0	0	109.5	L85 L299 L315 L323 L325 S330	L85-L333 HydrophobicContact CD1-CD2 3.95Å; L299-L333 HydrophobicContact CD1-CD1 4.27Å; L315-L333 HydrophobicContact CD1-CD1 3.57Å; L323-L333 HydrophobicContact CD1-CD1 4.25Å; L323-L333 HydrophobicContact CD1-CD2 4.44Å; L325-L333 HydrophobicContact CD1-CD1 4.15Å; L325-L333 HydrophobicContact CD1-CD2 3.66Å; L325-L333 HydrophobicContact CD1-CG 3.9Å; S330-L333 VanDerWaalsContact O-CB 3.31Å; S330-L333 WeakPolarHBondContact O-CB 3.38Å; S330-L333 PolarHBondContact O-N 2.87Å
334	P	94.8	Very high	94.2	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.013	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-66.7	154.5	170.6	25.8	-31.6	0	0	0	111	T89 Y122 Y332 H336 Y361	T89-P334 HydrophobicContact CG2-CB 3.58Å; T89-P334 HydrophobicContact CG2-CG 3.7Å; Y122-P334 HydrophobicContact CD1-CB 4.44Å; Y122-P334 HydrophobicContact CD2-CB 4.07Å; Y122-P334 HydrophobicContact CE1-CB 4Å; Y122-P334 HydrophobicContact CE2-CB 3.55Å; Y122-P334 HydrophobicContact CG-CB 4.48Å; Y122-P334 WeakPolarHBondContact OH-CA 3.36Å; Y332-P334 WeakPolarHBondContact O-CD 3.36Å; P334-H336 PolarHBondContact O-CE1 2.75Å; P334-H336 VanDerWaalsContact O-CE1 3.25Å; P334-H336 PolarHBondContact O-N 2.58Å; P334-H336 PolarHBondContact O-ND1 3.43Å; P334-Y361 HydrophobicContact CB-CD2 4.01Å; P334-Y361 HydrophobicContact CB-CE2 3.78Å; P334-Y361 HydrophobicContact CG-CD1 4.49Å; P334-Y361 HydrophobicContact CG-CD2 3.23Å; P334-Y361 HydrophobicContact CG-CE2 3.52Å; P334-Y361 HydrophobicContact CG-CG 3.78Å
335	L	96.8	Very high	94	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.016	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-61.1	123.9	167.1	-174.9	68	0	0	0	110	Y122 D166 I298 D301 L337 Y361	Y122-L335 HydrophobicContact CE2-CB 4.02Å; Y122-L335 PolarHBondContact OH-N 3.09Å; D166-L335 HydrophobicContact CB-CB 4.03Å; D166-L335 HydrophobicContact CB-CD2 4.07Å; I298-L335 HydrophobicContact CB-CD1 4.13Å; I298-L335 HydrophobicContact CG2-CD1 3.67Å; I298-L335 HydrophobicContact CG2-CG 4.43Å; D301-L335 HydrophobicContact CB-CD1 3.6Å; L335-L337 HydrophobicContact CD2-CB 3.86Å; L335-L337 HydrophobicContact CD2-CD2 4.06Å; L335-L337 HydrophobicContact CG-CB 3.82Å; L335-L337 PolarHBondContact O-N 2.77Å; L335-L337 VanDerWaalsContact O-N 3.14Å; L335-Y361 PolarHBondContact O-OH 3.16Å
336	H	97.8	Very high	93.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.174	C	C	.	.			trans	-88.8	65.3	175.1	-67.4	71.5	0	0	0	109.8	V198 I199 I298 L299 P334 Y361 F362 T365	V198-H336 WeakPolarHBondContact CA-O 3.2Å; V198-H336 WeakPolarHBondContact CB-O 3.43Å; I199-H336 HydrophobicContact CB-CB 3.92Å; I199-H336 HydrophobicContact CD1-CB 4.44Å; I199-H336 HydrophobicContact CG1-CB 4.17Å; I199-H336 PolarHBondContact N-O 3.19Å; I298-H336 HydrophobicContact CG2-CB 4.44Å; I298-H336 VanDerWaalsContact CG2-O 3.29Å; I298-H336 WeakPolarHBondContact CG2-O 3.28Å; L299-H336 HydrophobicContact CB-CB 4.37Å; L299-H336 PolarHBondContact O-N 2.93Å; L299-H336 PolarHBondContact O-ND1 3.1Å; L299-H336 VanDerWaalsContact O-ND1 3.15Å; P334-H336 PolarHBondContact O-CE1 2.75Å; P334-H336 VanDerWaalsContact O-CE1 3.25Å; P334-H336 PolarHBondContact O-N 2.58Å; P334-H336 PolarHBondContact O-ND1 3.43Å; H336-Y361 AromaticContact NE2-CD2 3.76Å; H336-F362 HydrophobicContact CB-CD2 4.14Å; H336-F362 HydrophobicContact CB-CE2 3.92Å; H336-F362 HydrophobicContact CB-CZ 4.49Å; H336-F362 AromaticContact CD2-CG 4Å; H336-T365 VanDerWaalsContact NE2-CB 3.31Å; H336-T365 WeakPolarHBondContact NE2-CB 3.15Å; H336-T365 WeakPolarHBondContact NE2-CG2 3.23Å; H336-T365 PolarHBondContact NE2-OG1 2.94Å
337	L	97.8	Very high	92.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	115.8	173.8	176.5	61.7	0	0	0	108.9	S167 S168 Y196 V198 M286 R287 I298 L335	S167-L337 PolarHBondContact OG-O 3.07Å; S168-L337 PolarHBondContact N-O 2.77Å; Y196-L337 HydrophobicContact CD1-CD1 4.07Å; Y196-L337 HydrophobicContact CG-CD1 4.45Å; V198-L337 HydrophobicContact CG1-CB 4.4Å; V198-L337 HydrophobicContact CG1-CD1 3.35Å; V198-L337 HydrophobicContact CG1-CG 4.46Å; M286-L337 HydrophobicContact CE-CD1 3.85Å; M286-L337 HydrophobicContact CE-CD2 4.27Å; M286-L337 HydrophobicContact SD-CD1 4.18Å; R287-L337 HydrophobicContact CG-CD2 4.25Å; I298-L337 HydrophobicContact CD1-CD1 4.4Å; L335-L337 HydrophobicContact CD2-CB 3.86Å; L335-L337 HydrophobicContact CD2-CD2 4.06Å; L335-L337 HydrophobicContact CG-CB 3.82Å; L335-L337 PolarHBondContact O-N 2.77Å; L335-L337 VanDerWaalsContact O-N 3.14Å
338	H	97.8	Very high	90.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	123.1	-175	-174.8	72.7	0	0	0	111.6	S168 G169 Y196 W197 R340 C356 P357 M358 P359 F362	S168-H338 CarbonylContact O-C 3.51Å; S168-H338 WeakPolarHBondContact O-CA 3.46Å; S168-H338 PolarHBondContact OG-ND1 3.45Å; G169-H338 WeakPolarHBondContact CA-CE1 3.32Å; Y196-H338 CarbonylContact C-O 3.58Å; Y196-H338 WeakPolarHBondContact CA-O 3.35Å; W197-H338 PolarHBondContact N-O 3.28Å; W197-H338 PolarHBondContact O-N 3.06Å; H338-R340 PolarHBondContact O-N 3.1Å; H338-C356 PolarHBondContact NE2-O 2.86Å; H338-P357 PolarHBondContact CE1-O 3.23Å; H338-M358 HydrophobicContact CB-CE 4.12Å; H338-M358 HydrophobicContact CB-SD 4.29Å; H338-M358 PolarHBondContact CD2-SD 3.48Å; H338-P359 WeakPolarHBondContact ND1-CD 3.48Å; H338-F362 HydrophobicContact CB-CD2 4.22Å; H338-F362 HydrophobicContact CB-CE2 4.01Å
339	A	97.2	Very high	89.6	Confident	4 Å²	4	40.6 Å²	40.6	3%	0.033	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	91.1	169.7	0	0	0	0	0	109.4	L163 S168 G169 A170 Y196 C356	L163-A339 HydrophobicContact CD1-CB 4.21Å; S168-A339 PolarHBondContact O-N 3.28Å; G169-A339 WeakPolarHBondContact CA-O 3.4Å; A170-A339 HydrophobicContact CB-CB 4.48Å; A170-A339 PolarHBondContact N-O 2.99Å; Y196-A339 HydrophobicContact CD1-CB 3.8Å; Y196-A339 HydrophobicContact CE1-CB 3.53Å; A339-C356 WeakPolarHBondContact O-CB 3.29Å
340	R	96.6	Very high	89	Confident	34 Å²	34	42.2 Å²	42.2	13%	0.128	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	-45.6	-172.1	173.1	58	173.9	165.1	0.4	112.1	K195 W197 H338 S355 C356 E375	K195-R340 PolarHBondContact O-N 2.96Å; W197-R340 HydrophobicContact CB-CB 4.4Å; W197-R340 HydrophobicContact CD2-CB 4.17Å; W197-R340 HydrophobicContact CD2-CG 3.84Å; W197-R340 HydrophobicContact CE3-CG 4.18Å; W197-R340 HydrophobicContact CG-CB 3.97Å; W197-R340 HydrophobicContact CG-CG 4.17Å; W197-R340 HydrophobicContact CZ2-CG 4.26Å; W197-R340 HydrophobicContact CZ3-CG 4.49Å; H338-R340 PolarHBondContact O-N 3.1Å; R340-S355 PolarHBondContact NE-OG 2.79Å; R340-S355 PolarHBondContact NH1-OG 2.78Å; R340-S355 CarbonylContact O-C 3.53Å; R340-S355 WeakPolarHBondContact O-CA 3.35Å; R340-C356 WeakPolarHBondContact CD-O 3.2Å; R340-C356 PolarHBondContact NH1-O 3.19Å; R340-C356 PolarHBondContact O-N 3.02Å; R340-E375 IonicContact NH2-OE1 3.67Å; R340-E375 PolarHBondContact NH2-OE1 3.47Å; R340-E375 IonicContact NH2-OE2 4Å
341	Q	95.6	Very high	88.9	Confident	64 Å²	64	47.9 Å²	47.9	30%	0.299	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	139	-175.9	-165.1	179.8	2.6	0	0	110.5	R194 K195 V354	R194-Q341 WeakPolarHBondContact CA-O 3.44Å; K195-Q341 HydrophobicContact CB-CB 4.02Å; K195-Q341 HydrophobicContact CG-CB 4.43Å; K195-Q341 PolarHBondContact N-O 3.31Å; K195-Q341 PolarHBondContact O-N 3.4Å; Q341-V354 WeakPolarHBondContact CA-O 3.46Å
342	L	94.9	Very high	88.9	Confident	9 Å²	9	41.2 Å²	41.2	5%	0.047	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	124.9	171	-179.2	74.5	0	0	0	108.2	I117 A170 L172 V192 E193 R194 L344 V354	I117-L342 HydrophobicContact CD1-CD2 3.83Å; I117-L342 HydrophobicContact CG1-CD2 4.06Å; I117-L342 HydrophobicContact CG2-CD2 4.29Å; A170-L342 HydrophobicContact CB-CB 4.15Å; L172-L342 HydrophobicContact CB-CD2 3.76Å; L172-L342 HydrophobicContact CD1-CD2 4.08Å; L172-L342 HydrophobicContact CD2-CD2 4.19Å; L172-L342 HydrophobicContact CG-CD2 4.22Å; V192-L342 HydrophobicContact CG1-CD1 3.96Å; E193-L342 CarbonylContact O-C 3.55Å; E193-L342 WeakPolarHBondContact O-CA 3.21Å; R194-L342 HydrophobicContact CG-CD1 3.63Å; L342-L344 HydrophobicContact CD2-CD2 4.4Å; L342-L344 HydrophobicContact CG-CD2 4.41Å; L342-V354 PolarHBondContact N-O 3.19Å; L342-V354 PolarHBondContact O-N 3.4Å
343	A	94.4	Very high	89.1	Confident	18 Å²	18	41.2 Å²	41.2	15%	0.149	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	135.7	173.6	0	0	0	0	0	110.5	V192 E193 V352 A353	V192-A343 CarbonylContact C-O 3.6Å; V192-A343 WeakPolarHBondContact CA-O 3.17Å; E193-A343 HydrophobicContact CB-CB 4.08Å; E193-A343 PolarHBondContact N-O 3.21Å; E193-A343 PolarHBondContact O-N 3.17Å; A343-V352 CarbonylContact C-O 3.55Å; A343-V352 WeakPolarHBondContact CA-O 3.45Å; A343-A353 HydrophobicContact CB-CB 4.28Å
344	L	92.9	Very high	89.1	Confident	12 Å²	12	41.6 Å²	41.6	6%	0.063	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	146.8	175.5	64	153.7	0	0	0	110.5	I117 L172 I183 V192 L342 V352	I117-L344 HydrophobicContact CD1-CD2 4.43Å; L172-L344 HydrophobicContact CD2-CD1 4.45Å; I183-L344 HydrophobicContact CG1-CD1 4.44Å; V192-L344 HydrophobicContact CG1-CB 4.41Å; V192-L344 HydrophobicContact CG2-CB 4.27Å; L342-L344 HydrophobicContact CD2-CD2 4.4Å; L342-L344 HydrophobicContact CG-CD2 4.41Å; L344-V352 HydrophobicContact CD2-CB 3.86Å; L344-V352 HydrophobicContact CD2-CG1 3.97Å; L344-V352 HydrophobicContact CG-CB 4.13Å; L344-V352 PolarHBondContact N-O 3.22Å; L344-V352 PolarHBondContact O-N 3.42Å
345	P	90.3	Very high	89.1	Confident	38 Å²	38	44.4 Å²	44.4	25%	0.247	26%	0.262	C	S	.	.			trans	-67.5	139.1	175.9	27.7	-34.2	0	0	0	110.7	L186 Q191 D351	L186-P345 HydrophobicContact CD1-CG 3.81Å; L186-P345 HydrophobicContact CD2-CG 3.98Å; L186-P345 HydrophobicContact CG-CG 4.48Å; Q191-P345 HydrophobicContact CB-CG 4.35Å; Q191-P345 WeakPolarHBondContact O-CD 3.44Å; P345-D351 WeakPolarHBondContact CA-OD1 3.48Å
346	G	80.4	Confident	89.1	Confident	26 Å²	26	44.3 Å²	44.3	27%	0.268	26%	0.262	S	S	.	.			trans	-72.2	139.2	174.7	0	0	0	0	0	111	Q349 D351	G346-Q349 WeakPolarHBondContact CA-O 3.32Å; G346-D351 PolarHBondContact N-OD1 2.91Å
347	R	71.3	Confident	89	Confident	134 Å²	134	47.6 Å²	47.6	51%	0.506	28%	0.283	S	S	.	.	S	Bend	trans	-69.6	-44.4	174.3	-77	-178.7	83.3	-174.2	4.8	112.2	H182	H182-R347 WeakPolarHBondContact CE1-CG 3.39Å; H182-R347 WeakPolarHBondContact ND1-CD 3.42Å
348	S	59.6	Low	88.8	Confident	114 Å²	114	48.6 Å²	48.6	80%	0.797	29%	0.288	S	S	*	.	S	Bend	trans	-138	-0	-174.1	-44.4	0	0	0	0	112.8
349	Q	65.5	Low	88.6	Confident	107 Å²	107	50 Å²	50	50%	0.5	30%	0.297	S	S	.	.	S	Bend	trans	-124.8	178.1	179.7	-69	-169.4	-3.9	0	0	109.2	G346	G346-Q349 WeakPolarHBondContact CA-O 3.32Å
350	S	79.6	Confident	88.4	Confident	93 Å²	93	56.8 Å²	56.8	65%	0.65	33%	0.326	S	S	*	.	S	Bend	trans	-55.6	155.4	169.5	52.2	0	0	0	0	112.2
351	D	89.3	Confident	88.3	Confident	121 Å²	121	55.4 Å²	55.4	65%	0.647	32%	0.321	S	S	*	.			trans	-53.7	139.8	173.2	-64.4	-20	0	0	0	111.7	P345 G346	P345-D351 WeakPolarHBondContact CA-OD1 3.48Å; G346-D351 PolarHBondContact N-OD1 2.91Å
352	V	91	Very high	88.3	Confident	9 Å²	9	52.3 Å²	52.3	6%	0.055	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	112.2	179.8	178.5	0	0	0	0	107.6	Y110 I117 A343 L344 V354	Y110-V352 HydrophobicContact CD1-CG1 3.77Å; Y110-V352 HydrophobicContact CD2-CG1 4.48Å; Y110-V352 HydrophobicContact CE1-CB 4.43Å; Y110-V352 HydrophobicContact CE1-CG1 3.63Å; Y110-V352 HydrophobicContact CE1-CG2 3.85Å; Y110-V352 HydrophobicContact CE2-CG1 4.37Å; Y110-V352 HydrophobicContact CG-CG1 4.19Å; I117-V352 HydrophobicContact CD1-CG1 3.8Å; A343-V352 CarbonylContact C-O 3.55Å; A343-V352 WeakPolarHBondContact CA-O 3.45Å; L344-V352 HydrophobicContact CD2-CB 3.86Å; L344-V352 HydrophobicContact CD2-CG1 3.97Å; L344-V352 HydrophobicContact CG-CB 4.13Å; L344-V352 PolarHBondContact N-O 3.22Å; L344-V352 PolarHBondContact O-N 3.42Å; V352-V354 HydrophobicContact CG1-CG2 3.97Å
353	A	93.8	Very high	88.3	Confident	71 Å²	71	54.7 Å²	54.7	59%	0.587	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	116.7	173.2	0	0	0	0	0	109.9	A343	A343-A353 HydrophobicContact CB-CB 4.28Å
354	V	94.3	Very high	88.3	Confident	14 Å²	14	57.5 Å²	57.5	9%	0.085	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	129.7	-176.1	178.2	0	0	0	0	110.2	L109 Y110 I117 Q341 L342 V352	L109-V354 HydrophobicContact CB-CG1 3.63Å; L109-V354 HydrophobicContact CD1-CG1 4.03Å; L109-V354 HydrophobicContact CG-CG1 4.41Å; Y110-V354 HydrophobicContact CD2-CG2 4.44Å; Y110-V354 HydrophobicContact CG-CG2 4.04Å; I117-V354 HydrophobicContact CD1-CB 4.1Å; I117-V354 HydrophobicContact CD1-CG2 3.56Å; I117-V354 HydrophobicContact CG2-CG1 4.19Å; Q341-V354 WeakPolarHBondContact CA-O 3.46Å; L342-V354 PolarHBondContact N-O 3.19Å; L342-V354 PolarHBondContact O-N 3.4Å; V352-V354 HydrophobicContact CG1-CG2 3.97Å
355	S	95.4	Very high	88.4	Confident	62 Å²	62	56.9 Å²	56.9	43%	0.434	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	130.8	170.3	-173.1	0	0	0	0	109.9	R340	R340-S355 PolarHBondContact NE-OG 2.79Å; R340-S355 PolarHBondContact NH1-OG 2.78Å; R340-S355 CarbonylContact O-C 3.53Å; R340-S355 WeakPolarHBondContact O-CA 3.35Å
356	C	95.9	Very high	88.6	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-95.9	132.2	-179.8	-175.4	0	0	0	0	110.4	L109 N119 G169 A170 H338 A339 R340	L109-C356 HydrophobicContact CD1-CB 3.81Å; N119-C356 PolarHBondContact OD1-SG 2.79Å; N119-C356 VanDerWaalsContact OD1-SG 3.35Å; G169-C356 VanDerWaalsContact CA-SG 3.54Å; A170-C356 HydrophobicContact CB-CB 4.24Å; H338-C356 PolarHBondContact NE2-O 2.86Å; A339-C356 WeakPolarHBondContact O-CB 3.29Å; R340-C356 WeakPolarHBondContact CD-O 3.2Å; R340-C356 PolarHBondContact NH1-O 3.19Å; R340-C356 PolarHBondContact O-N 3.02Å
357	P	94.9	Very high	89.3	Confident	69 Å²	69	59 Å²	59	45%	0.448	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-66.7	138.4	176.4	27.2	-33.8	0	0	0	111.2	H338	H338-P357 PolarHBondContact CE1-O 3.23Å
358	M	93.6	Very high	90.4	Very high	21 Å²	21	59.2 Å²	59.2	10%	0.103	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-65	140.7	179.7	-64.8	-61.7	-70.5	0	0	111.3	W197 H338 F362 I363 F373	W197-M358 HydrophobicContact CB-CE 4.47Å; W197-M358 HydrophobicContact CE3-CE 4.29Å; W197-M358 HydrophobicContact CE3-SD 3.93Å; H338-M358 HydrophobicContact CB-CE 4.12Å; H338-M358 HydrophobicContact CB-SD 4.29Å; H338-M358 PolarHBondContact CD2-SD 3.48Å; M358-F362 HydrophobicContact CE-CB 4.19Å; M358-F362 HydrophobicContact CE-CD1 3.17Å; M358-F362 HydrophobicContact CE-CD2 3.58Å; M358-F362 HydrophobicContact CE-CE1 3.21Å; M358-F362 HydrophobicContact CE-CE2 3.6Å; M358-F362 HydrophobicContact CE-CG 3.38Å; M358-F362 HydrophobicContact CE-CZ 3.42Å; M358-F362 VanDerWaalsContact CE-CZ 3.42Å; M358-I363 HydrophobicContact CB-CD1 4.03Å; M358-I363 HydrophobicContact CB-CG1 3.76Å; M358-F373 HydrophobicContact CG-CE1 4.13Å; M358-F373 HydrophobicContact CG-CZ 4.19Å
359	P	94.3	Very high	92.2	Very high	29 Å²	29	53.8 Å²	53.8	19%	0.188	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-72.6	149.2	178.4	29.5	-33.9	0	0	0	111.1	H338 Y361 F362 I363	H338-P359 WeakPolarHBondContact ND1-CD 3.48Å; P359-Y361 VanDerWaalsContact C-N 3.27Å; P359-Y361 HydrophobicContact CB-CD1 3.79Å; P359-Y361 HydrophobicContact CB-CE1 3.52Å; P359-Y361 HydrophobicContact CG-CD1 4.06Å; P359-Y361 HydrophobicContact CG-CE1 3.47Å; P359-Y361 VanDerWaalsContact CG-CE1 3.47Å; P359-Y361 HydrophobicContact CG-CE2 4.48Å; P359-Y361 PolarHBondContact O-N 3.25Å; P359-Y361 VanDerWaalsContact O-N 3.15Å; P359-F362 HydrophobicContact CG-CB 3.79Å; P359-F362 WeakPolarHBondContact O-CB 3.45Å; P359-F362 PolarHBondContact O-N 3.5Å; P359-I363 PolarHBondContact O-N 2.72Å
360	K	93.6	Very high	93.6	Very high	148 Å²	148	53.5 Å²	53.5	64%	0.643	29%	0.289	S	S	*	.	H	α-helix	trans	-55.8	-36.8	-174	-65.2	-175.4	179.1	-177.4	0	114	F88 F362 K364	F88-K360 HydrophobicContact CD1-CB 3.96Å; F88-K360 HydrophobicContact CD1-CD 4.34Å; F88-K360 HydrophobicContact CE1-CB 3.96Å; F88-K360 HydrophobicContact CE1-CD 3.94Å; F88-K360 HydrophobicContact CG-CB 4.45Å; F88-K360 HydrophobicContact CZ-CB 4.42Å; K360-F362 VanDerWaalsContact C-N 3.31Å; K360-F362 PolarHBondContact O-N 3.46Å; K360-K364 WeakPolarHBondContact O-CG 3.3Å; K360-K364 PolarHBondContact O-N 2.95Å; K360-K364 VanDerWaalsContact O-N 3.12Å
361	Y	94.1	Very high	94.3	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.016	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-38.9	178.3	71.3	-96.5	0	0	0	111.3	Y122 P334 L335 H336 P359 K364 T365	Y122-Y361 HydrophobicContact CD2-CE1 4.39Å; Y122-Y361 WeakPolarHBondContact CD2-OH 3.43Å; Y122-Y361 HydrophobicContact CG-CE1 4.31Å; P334-Y361 HydrophobicContact CB-CD2 4.01Å; P334-Y361 HydrophobicContact CB-CE2 3.78Å; P334-Y361 HydrophobicContact CG-CD1 4.49Å; P334-Y361 HydrophobicContact CG-CD2 3.23Å; P334-Y361 HydrophobicContact CG-CE2 3.52Å; P334-Y361 HydrophobicContact CG-CG 3.78Å; L335-Y361 PolarHBondContact O-OH 3.16Å; H336-Y361 AromaticContact NE2-CD2 3.76Å; P359-Y361 VanDerWaalsContact C-N 3.27Å; P359-Y361 HydrophobicContact CB-CD1 3.79Å; P359-Y361 HydrophobicContact CB-CE1 3.52Å; P359-Y361 HydrophobicContact CG-CD1 4.06Å; P359-Y361 HydrophobicContact CG-CE1 3.47Å; P359-Y361 VanDerWaalsContact CG-CE1 3.47Å; P359-Y361 HydrophobicContact CG-CE2 4.48Å; P359-Y361 PolarHBondContact O-N 3.25Å; P359-Y361 VanDerWaalsContact O-N 3.15Å; Y361-K364 PolarHBondContact O-N 3.48Å; Y361-T365 PolarHBondContact O-N 2.8Å; Y361-T365 PolarHBondContact O-OG1 3.16Å
362	F	95.6	Very high	94.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-68.6	-48.2	-177.9	-163.6	-55.8	0	0	0	110.2	W197 I199 L271 H336 H338 M358 P359 K360 K364 T365 L366	W197-F362 HydrophobicContact CB-CZ 4.47Å; I199-F362 HydrophobicContact CD1-CD1 3.93Å; I199-F362 HydrophobicContact CD1-CE1 3.66Å; I199-F362 HydrophobicContact CD1-CZ 4.19Å; I199-F362 HydrophobicContact CG1-CD1 4.29Å; I199-F362 HydrophobicContact CG1-CE1 3.53Å; I199-F362 HydrophobicContact CG1-CE2 4.46Å; I199-F362 HydrophobicContact CG1-CZ 3.64Å; L271-F362 HydrophobicContact CD1-CE1 4.15Å; L271-F362 HydrophobicContact CD1-CZ 4.23Å; H336-F362 HydrophobicContact CB-CD2 4.14Å; H336-F362 HydrophobicContact CB-CE2 3.92Å; H336-F362 HydrophobicContact CB-CZ 4.49Å; H336-F362 AromaticContact CD2-CG 4Å; H338-F362 HydrophobicContact CB-CD2 4.22Å; H338-F362 HydrophobicContact CB-CE2 4.01Å; M358-F362 HydrophobicContact CE-CB 4.19Å; M358-F362 HydrophobicContact CE-CD1 3.17Å; M358-F362 HydrophobicContact CE-CD2 3.58Å; M358-F362 HydrophobicContact CE-CE1 3.21Å; M358-F362 HydrophobicContact CE-CE2 3.6Å; M358-F362 HydrophobicContact CE-CG 3.38Å; M358-F362 HydrophobicContact CE-CZ 3.42Å; M358-F362 VanDerWaalsContact CE-CZ 3.42Å; P359-F362 HydrophobicContact CG-CB 3.79Å; P359-F362 WeakPolarHBondContact O-CB 3.45Å; P359-F362 PolarHBondContact O-N 3.5Å; K360-F362 VanDerWaalsContact C-N 3.31Å; K360-F362 PolarHBondContact O-N 3.46Å; F362-K364 VanDerWaalsContact C-N 3.3Å; F362-K364 PolarHBondContact O-N 3.29Å; F362-T365 WeakPolarHBondContact O-CB 3.41Å; F362-T365 PolarHBondContact O-N 3.33Å; F362-L366 HydrophobicContact CD1-CD1 3.7Å; F362-L366 HydrophobicContact CD1-CG 3.83Å; F362-L366 HydrophobicContact CE1-CD1 3.76Å; F362-L366 HydrophobicContact CE1-CD2 4.06Å; F362-L366 HydrophobicContact CE1-CG 3.87Å; F362-L366 PolarHBondContact O-N 3.15Å
363	I	94.9	Very high	94	Very high	59 Å²	59	47.7 Å²	47.7	30%	0.303	25%	0.25	S	S	.	.	H	α-helix	trans	-56.9	-44.7	175.9	-60.3	171.7	0	0	0	110.7	M358 P359 T365 L366 N367 F373	M358-I363 HydrophobicContact CB-CD1 4.03Å; M358-I363 HydrophobicContact CB-CG1 3.76Å; P359-I363 PolarHBondContact O-N 2.72Å; I363-T365 VanDerWaalsContact C-N 3.29Å; I363-T365 PolarHBondContact O-N 3.21Å; I363-L366 WeakPolarHBondContact O-CB 3.43Å; I363-L366 PolarHBondContact O-N 3.28Å; I363-N367 VanDerWaalsContact O-CG 3.32Å; I363-N367 PolarHBondContact O-N 2.86Å; I363-N367 PolarHBondContact O-OD1 2.87Å; I363-F373 HydrophobicContact CG1-CZ 4.41Å
364	K	93.9	Very high	93.1	Very high	76 Å²	76	46.2 Å²	46.2	33%	0.33	24%	0.235	S	C	.	.	H	α-helix	trans	-62.8	-37.3	177.4	-75.8	-174.5	178.1	-163.1	0	112.7	E84 F88 K360 Y361 F362 R368	E84-K364 WeakPolarHBondContact OE1-CD 3.34Å; E84-K364 WeakPolarHBondContact OE1-CE 3.42Å; E84-K364 IonicContact OE1-NZ 2.8Å; E84-K364 PolarHBondContact OE1-NZ 3.5Å; F88-K364 HydrophobicContact CE2-CD 3.6Å; F88-K364 HydrophobicContact CZ-CD 4.09Å; K360-K364 WeakPolarHBondContact O-CG 3.3Å; K360-K364 PolarHBondContact O-N 2.95Å; K360-K364 VanDerWaalsContact O-N 3.12Å; Y361-K364 PolarHBondContact O-N 3.48Å; F362-K364 VanDerWaalsContact C-N 3.3Å; F362-K364 PolarHBondContact O-N 3.29Å; K364-R368 WeakPolarHBondContact O-CB 3.29Å; K364-R368 WeakPolarHBondContact O-CG 3.49Å; K364-R368 PolarHBondContact O-N 3.16Å; K364-R368 VanDerWaalsContact O-N 3.13Å
365	T	95.4	Very high	91.7	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.7	-43.9	175.4	-60.7	0	0	0	0	111.2	I199 L299 L323 H336 Y361 F362 I363 N367 R368 L369	I199-T365 HydrophobicContact CD1-CG2 3.63Å; L299-T365 HydrophobicContact CD2-CG2 3.51Å; L323-T365 HydrophobicContact CD2-CG2 3.86Å; H336-T365 VanDerWaalsContact NE2-CB 3.31Å; H336-T365 WeakPolarHBondContact NE2-CB 3.15Å; H336-T365 WeakPolarHBondContact NE2-CG2 3.23Å; H336-T365 PolarHBondContact NE2-OG1 2.94Å; Y361-T365 PolarHBondContact O-N 2.8Å; Y361-T365 PolarHBondContact O-OG1 3.16Å; F362-T365 WeakPolarHBondContact O-CB 3.41Å; F362-T365 PolarHBondContact O-N 3.33Å; I363-T365 VanDerWaalsContact C-N 3.29Å; I363-T365 PolarHBondContact O-N 3.21Å; T365-N367 PolarHBondContact O-N 2.88Å; T365-R368 PolarHBondContact O-N 3.23Å; T365-L369 HydrophobicContact CG2-CD1 3.79Å; T365-L369 HydrophobicContact CG2-CG 4.34Å; T365-L369 WeakPolarHBondContact O-CB 3.36Å; T365-L369 WeakPolarHBondContact O-CG 3.45Å; T365-L369 PolarHBondContact O-N 3.3Å
366	L	95.4	Very high	90	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-55.5	-52.3	174.4	-72.7	172	0	0	0	111.5	I199 L271 F362 I363 R368 L369 Q370 L371 F373	I199-L366 HydrophobicContact CD1-CD2 3.7Å; I199-L366 HydrophobicContact CD1-CG 3.93Å; I199-L366 HydrophobicContact CG1-CD2 4.01Å; L271-L366 HydrophobicContact CB-CD2 4.33Å; L271-L366 HydrophobicContact CD1-CD2 4.19Å; L271-L366 HydrophobicContact CD2-CD2 4.22Å; L271-L366 HydrophobicContact CG-CD2 4.47Å; F362-L366 HydrophobicContact CD1-CD1 3.7Å; F362-L366 HydrophobicContact CD1-CG 3.83Å; F362-L366 HydrophobicContact CE1-CD1 3.76Å; F362-L366 HydrophobicContact CE1-CD2 4.06Å; F362-L366 HydrophobicContact CE1-CG 3.87Å; F362-L366 PolarHBondContact O-N 3.15Å; I363-L366 WeakPolarHBondContact O-CB 3.43Å; I363-L366 PolarHBondContact O-N 3.28Å; L366-R368 VanDerWaalsContact C-N 3.28Å; L366-R368 PolarHBondContact O-N 2.88Å; L366-L369 CarbonylContact O-C 3.53Å; L366-L369 PolarHBondContact O-N 2.88Å; L366-L369 VanDerWaalsContact O-N 3.11Å; L366-Q370 PolarHBondContact O-N 3.31Å; L366-L371 HydrophobicContact CB-CB 4.47Å; L366-L371 HydrophobicContact CD2-CB 3.53Å; L366-L371 HydrophobicContact CD2-CD1 3.95Å; L366-L371 HydrophobicContact CD2-CG 4.4Å; L366-L371 PolarHBondContact O-N 3.05Å; L366-F373 HydrophobicContact CD1-CD1 4.14Å; L366-F373 HydrophobicContact CD1-CE1 3.24Å; L366-F373 HydrophobicContact CD1-CE2 4.15Å; L366-F373 HydrophobicContact CD1-CZ 3.26Å
367	N	94.8	Very high	88.1	Confident	109 Å²	109	56.7 Å²	56.7	58%	0.583	28%	0.278	S	S	*	.	H	α-helix	trans	-59.7	-38.7	-179.9	-65.2	-1.2	0	0	0	112.4	I363 T365 Q370	I363-N367 VanDerWaalsContact O-CG 3.32Å; I363-N367 PolarHBondContact O-N 2.86Å; I363-N367 PolarHBondContact O-OD1 2.87Å; T365-N367 PolarHBondContact O-N 2.88Å; N367-Q370 PolarHBondContact O-N 3.43Å
368	R	94.4	Very high	85.9	Confident	138 Å²	138	60 Å²	60	52%	0.521	29%	0.291	S	S	.	.	H	α-helix	trans	-69.2	-37.3	178	-73.8	-71.3	-173.6	179.4	1.5	112.4	L323 K364 T365 L366	L323-R368 HydrophobicContact CD2-CB 4.47Å; K364-R368 WeakPolarHBondContact O-CB 3.29Å; K364-R368 WeakPolarHBondContact O-CG 3.49Å; K364-R368 PolarHBondContact O-N 3.16Å; K364-R368 VanDerWaalsContact O-N 3.13Å; T365-R368 PolarHBondContact O-N 3.23Å; L366-R368 VanDerWaalsContact C-N 3.28Å; L366-R368 PolarHBondContact O-N 2.88Å
369	L	95.9	Very high	83.5	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-83.3	-1.4	175.8	-63.5	177.5	0	0	0	112.8	I199 S266 Y267 C269 L299 V319 K322 L323 T365 L366 L371	I199-L369 HydrophobicContact CG2-CD1 3.85Å; S266-L369 WeakPolarHBondContact CB-O 3.47Å; S266-L369 PolarHBondContact OG-O 3.41Å; Y267-L369 WeakPolarHBondContact CD2-O 3.36Å; C269-L369 HydrophobicContact CB-CD1 4.08Å; L299-L369 HydrophobicContact CD2-CD1 4.07Å; V319-L369 HydrophobicContact CG1-CD2 4.16Å; K322-L369 HydrophobicContact CB-CD2 4.14Å; L323-L369 HydrophobicContact CD2-CD1 4.34Å; L323-L369 HydrophobicContact CD2-CD2 3.92Å; L323-L369 HydrophobicContact CD2-CG 3.98Å; L323-L369 HydrophobicContact CG-CD2 4.18Å; T365-L369 HydrophobicContact CG2-CD1 3.79Å; T365-L369 HydrophobicContact CG2-CG 4.34Å; T365-L369 WeakPolarHBondContact O-CB 3.36Å; T365-L369 WeakPolarHBondContact O-CG 3.45Å; T365-L369 PolarHBondContact O-N 3.3Å; L366-L369 CarbonylContact O-C 3.53Å; L366-L369 PolarHBondContact O-N 2.88Å; L366-L369 VanDerWaalsContact O-N 3.11Å; L369-L371 HydrophobicContact CB-CD1 3.98Å; L369-L371 HydrophobicContact CB-CG 4.03Å; L369-L371 HydrophobicContact CD1-CD1 4.2Å; L369-L371 PolarHBondContact O-N 2.84Å
370	Q	95	Very high	80.6	Confident	101 Å²	101	76 Å²	76	47%	0.472	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	45.2	-175.5	-53.9	178.4	-11.8	0	0	111.6	S266 Y267 L366 N367	S266-Q370 WeakPolarHBondContact CB-O 3.26Å; Y267-Q370 HydrophobicContact CE2-CB 3.99Å; Y267-Q370 HydrophobicContact CE2-CG 4.04Å; Y267-Q370 PolarHBondContact OH-OE1 3.25Å; L366-Q370 PolarHBondContact O-N 3.31Å; N367-Q370 PolarHBondContact O-N 3.43Å
371	L	94.2	Very high	80	Confident	5 Å²	5	72.5 Å²	72.5	3%	0.026	36%	0.355	C	S	.	.			trans	-98.8	133.1	170.2	-66.6	170.3	0	0	0	107.9	I199 D264 C269 L271 L366 L369	I199-L371 HydrophobicContact CG2-CD1 4.12Å; D264-L371 HydrophobicContact CB-CD2 4.29Å; D264-L371 WeakPolarHBondContact OD2-CA 3.05Å; C269-L371 HydrophobicContact CB-CD1 4.42Å; L271-L371 HydrophobicContact CB-CD1 4.46Å; L366-L371 HydrophobicContact CB-CB 4.47Å; L366-L371 HydrophobicContact CD2-CB 3.53Å; L366-L371 HydrophobicContact CD2-CD1 3.95Å; L366-L371 HydrophobicContact CD2-CG 4.4Å; L366-L371 PolarHBondContact O-N 3.05Å; L369-L371 HydrophobicContact CB-CD1 3.98Å; L369-L371 HydrophobicContact CB-CG 4.03Å; L369-L371 HydrophobicContact CD1-CD1 4.2Å; L369-L371 PolarHBondContact O-N 2.84Å
372	T	90.6	Very high	79.2	Confident	57 Å²	57	76.1 Å²	76.1	35%	0.35	37%	0.373	S	S	.	.			trans	-105.2	152.9	-176	52.4	0	0	0	0	111	D264 K377	D264-T372 PolarHBondContact OD2-N 3.16Å; D264-T372 PolarHBondContact OD2-OG1 3.3Å; T372-K377 WeakPolarHBondContact OG1-CE 3.46Å
373	F	83.6	Confident	78.3	Confident	38 Å²	38	80.3 Å²	80.3	17%	0.167	39%	0.393	C	S	.	.			trans	-77.4	147.2	170.4	-63.9	-64.6	0	0	0	109.6	W197 L271 M358 I363 L366 E375 D376	W197-F373 HydrophobicContact CE3-CD1 4.07Å; W197-F373 HydrophobicContact CE3-CE1 4.04Å; W197-F373 HydrophobicContact CH2-CD1 4.01Å; W197-F373 AromaticContact CZ3-CD1 3.29Å; W197-F373 HydrophobicContact CZ3-CD1 3.29Å; W197-F373 AromaticContact CZ3-CE1 3.57Å; W197-F373 HydrophobicContact CZ3-CE1 3.57Å; W197-F373 HydrophobicContact CZ3-CG 4.36Å; L271-F373 HydrophobicContact CD2-CD1 4.29Å; M358-F373 HydrophobicContact CG-CE1 4.13Å; M358-F373 HydrophobicContact CG-CZ 4.19Å; I363-F373 HydrophobicContact CG1-CZ 4.41Å; L366-F373 HydrophobicContact CD1-CD1 4.14Å; L366-F373 HydrophobicContact CD1-CE1 3.24Å; L366-F373 HydrophobicContact CD1-CE2 4.15Å; L366-F373 HydrophobicContact CD1-CZ 3.26Å; F373-E375 PolarHBondContact O-N 3.22Å; F373-D376 WeakPolarHBondContact CD2-OD2 2.97Å; F373-D376 PolarHBondContact O-N 2.89Å; F373-D376 VanDerWaalsContact O-N 3.16Å
374	P	74.9	Confident	77.4	Confident	41 Å²	41	81.5 Å²	81.5	27%	0.266	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-61.8	-26.4	173	25.5	-33.9	0	0	0	112.5	W197 L263 D376 K377	W197-P374 HydrophobicContact CH2-CG 4.12Å; W197-P374 HydrophobicContact CZ2-CG 4.05Å; L263-P374 HydrophobicContact CD1-CG 4.11Å; P374-D376 VanDerWaalsContact C-N 3.3Å; P374-D376 PolarHBondContact O-N 3.02Å; P374-K377 PolarHBondContact O-N 3.1Å
375	E	65.5	Low	76.3	Confident	113 Å²	113	81.9 Å²	81.9	53%	0.528	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-64.1	-33.5	176.3	-66.9	169.8	-155.8	0	0	111.8	R340 F373 K377	R340-E375 IonicContact NH2-OE1 3.67Å; R340-E375 PolarHBondContact NH2-OE1 3.47Å; R340-E375 IonicContact NH2-OE2 4Å; F373-E375 PolarHBondContact O-N 3.22Å; E375-K377 VanDerWaalsContact C-N 3.34Å
376	D	60	Low	75	Confident	94 Å²	94	87.3 Å²	87.3	50%	0.503	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-80.8	-12.7	-179	-58.3	-37	0	0	0	113.1	F373 P374	F373-D376 WeakPolarHBondContact CD2-OD2 2.97Å; F373-D376 PolarHBondContact O-N 2.89Å; F373-D376 VanDerWaalsContact O-N 3.16Å; P374-D376 VanDerWaalsContact C-N 3.3Å; P374-D376 PolarHBondContact O-N 3.02Å
377	K	55.9	Low	73.6	Confident	88 Å²	88	93.6 Å²	93.6	38%	0.383	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-84.5	-11.6	-178.6	-68.5	-174.2	179.7	-179.1	0	113.8	L263 D264 T372 P374 E375	L263-K377 PolarHBondContact O-NZ 2.92Å; D264-K377 IonicContact OD1-NZ 3.62Å; D264-K377 PolarHBondContact OD1-NZ 3.22Å; T372-K377 WeakPolarHBondContact OG1-CE 3.46Å; P374-K377 PolarHBondContact O-N 3.1Å; E375-K377 VanDerWaalsContact C-N 3.34Å
378	N	48	Very low	72	Confident	138 Å²	138	92.4 Å²	92.4	74%	0.738	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-90.9	-5.1	-178.8	-67.9	-27.9	0	0	0	113.2
379	D	43.8	Very low	70.1	Confident	150 Å²	150	88.6 Å²	88.6	80%	0.802	45%	0.446	S	S	*	.			trans	-103.3	4.5	-179.7	-72.6	-22.1	0	0	0	113.2
380	E	33.7	Very low	67.7	Low	238 Å²	238	96.6 Å²	96.6	100%	1.112	49%	0.486	S	S	*	.			trans	-112.1	0	168.3	-74.6	-173.4	163.1	0	0	110.1

Retrieved 380 of 380 residues in 421.3 ms (Link to these results)

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