A0A087YGT2_POEFO Loading...

Repulsive guidance molecule BMP co-receptor b

AlphaFold DB , UniProt , Accession A0A087YGT2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 451 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	T	40.8	Very low	32.1	Very low	207 Å²	207	154 Å²	154	100%	1.27	89%	0.886	S	S	*	*				0	97.2	0	31.4	0	0	0	0	108.3
2	G	33.8	Very low	31.6	Very low	75 Å²	75	147 Å²	147	77%	0.773	87%	0.873	S	S	*	*			trans	-117.4	149.8	-179.5	0	0	0	0	0	110.7
3	M	35.9	Very low	31.3	Very low	199 Å²	199	143.3 Å²	143.3	98%	0.98	87%	0.868	S	S	*	*			trans	-154.5	131.6	165	-67.8	174.4	63.7	0	0	105.1
4	G	32.8	Very low	31.2	Very low	74 Å²	74	145.8 Å²	145.8	76%	0.763	87%	0.866	S	S	*	*			cis	171.1	111.6	-1.5	0	0	0	0	0	108.7
5	R	33.9	Very low	31	Very low	243 Å²	243	150.3 Å²	150.3	92%	0.917	86%	0.862	S	S	*	*			trans	29.9	121.1	131.5	-88.9	-177.5	169.8	-179.7	-2.7	118.6
6	A	31.8	Very low	30.9	Very low	103 Å²	103	151.2 Å²	151.2	85%	0.851	86%	0.862	S	S	*	*				89.3	143.6	94.4	0	0	0	0	0	112
7	G	30	Very low	30.7	Very low	66 Å²	66	147.8 Å²	147.8	68%	0.68	86%	0.856	S	S	*	*			cis	167.7	158.1	3.7	0	0	0	0	0	108.7
8	C	28	Very low	30.8	Very low	124 Å²	124	145.4 Å²	145.4	84%	0.838	85%	0.849	S	S	*	*			trans	63.3	117.5	144.6	-68.1	0	0	0	0	123.1
9	C	29.5	Very low	31.3	Very low	123 Å²	123	143.9 Å²	143.9	83%	0.831	85%	0.845	S	S	*	*				97.3	144.6	115.2	-71.9	0	0	0	0	122.3
10	Y	27.1	Very low	31.3	Very low	228 Å²	228	141.8 Å²	141.8	89%	0.894	84%	0.838	S	S	*	*			trans	-83.5	174.7	-163.1	-90.8	-98.1	0	0	0	117.3
11	R	29	Very low	31.3	Very low	252 Å²	252	139.7 Å²	139.7	95%	0.951	84%	0.837	S	S	*	*			trans	103	135.1	157.6	-72.4	-175.2	165.8	-167.5	-2.6	113.3
12	G	27.2	Very low	31	Very low	70 Å²	70	135.1 Å²	135.1	72%	0.722	81%	0.808	S	S	*	*			cis	162.2	158.5	2.4	0	0	0	0	0	109.5
13	A	27.3	Very low	31	Very low	99 Å²	99	141.2 Å²	141.2	82%	0.818	81%	0.808	S	S	*	*			trans	78.4	145.4	152.7	0	0	0	0	0	122.1
14	E	29.2	Very low	31.2	Very low	178 Å²	178	143.2 Å²	143.2	83%	0.832	80%	0.804	S	S	*	*			trans	89.5	141.6	157	-53.4	-154.9	150.2	0	0	118.1
15	R	28.8	Very low	31.2	Very low	214 Å²	214	148.2 Å²	148.2	81%	0.808	81%	0.805	S	S	*	*			cis	179.1	159.1	-27.8	-133.5	-174	-152.1	-153.7	7.8	104.3
16	L	28.7	Very low	31.3	Very low	164 Å²	164	145.9 Å²	145.9	86%	0.859	80%	0.797	S	S	*	*			trans	77.4	143.2	163.2	-55.7	157.4	0	0	0	115.5
17	A	28	Very low	31.6	Very low	93 Å²	93	146.7 Å²	146.7	77%	0.769	79%	0.793	S	S	*	*			cis	-158.2	156.3	9.6	0	0	0	0	0	109.9
18	S	32.2	Very low	32	Very low	105 Å²	105	150.2 Å²	150.2	73%	0.734	80%	0.796	S	S	*	*			trans	-91.4	160.5	158.4	-173.8	0	0	0	0	109.3
19	P	41.2	Very low	33	Very low	117 Å²	117	150.3 Å²	150.3	76%	0.76	79%	0.787	S	S	*	*				-148.3	136.3	111	32.8	-13.9	0	0	0	117.1
20	S	31.1	Very low	33.7	Very low	101 Å²	101	151.4 Å²	151.4	71%	0.706	78%	0.784	S	S	*	*			trans	7.5	140.9	130.5	-14.9	0	0	0	0	123.4
21	A	32	Very low	34.4	Very low	99 Å²	99	147.3 Å²	147.3	82%	0.818	78%	0.777	S	S	*	*				-172.7	113.4	127.8	0	0	0	0	0	108.5
22	V	33	Very low	35.2	Very low	110 Å²	110	141.7 Å²	141.7	67%	0.667	76%	0.764	S	S	*	*				85.8	107.2	50.1	-179.8	0	0	0	0	114.5
23	R	35.4	Very low	36.2	Very low	203 Å²	203	145.4 Å²	145.4	77%	0.766	77%	0.766	S	S	*	*			trans	71.6	129.2	143.9	-72.2	168.9	-168.7	-176.9	1.1	121	F25	R23-F25 HydrophobicContact CG-CD2 4.33Å; R23-F25 HydrophobicContact CG-CE2 4.46Å
24	R	39.3	Very low	37.1	Very low	241 Å²	241	144.1 Å²	144.1	91%	0.909	76%	0.763	S	S	*	*				-172.8	105.7	97.6	-92.9	169.1	-170	-179.8	3.5	108.6
25	F	33.4	Very low	37.9	Very low	179 Å²	179	143.1 Å²	143.1	79%	0.785	76%	0.762	S	S	*	*				72.7	115.6	90.8	-99.1	-84.6	0	0	0	115.9	R23	R23-F25 HydrophobicContact CG-CD2 4.33Å; R23-F25 HydrophobicContact CG-CE2 4.46Å
26	R	35	Very low	38.5	Very low	194 Å²	194	138 Å²	138	73%	0.732	76%	0.758	S	S	*	*			trans	-48.5	154.6	172.6	-68.1	169.7	161.7	177.2	-6.2	113.5
27	P	38.4	Very low	39.3	Very low	120 Å²	120	136.8 Å²	136.8	78%	0.779	76%	0.762	S	S	*	*				-147.5	111.1	99.6	34.5	-16.1	0	0	0	113.4
28	L	38.3	Very low	40.2	Very low	141 Å²	141	135.9 Å²	135.9	74%	0.738	76%	0.762	S	S	*	*			trans	-165.2	53.6	139.4	-139.3	75.4	0	0	0	109.9	L30	L28-L30 VanDerWaalsContact C-N 3.26Å; L28-L30 PolarHBondContact O-N 2.93Å; L28-L30 VanDerWaalsContact O-N 3.08Å
29	L	48.1	Very low	41.1	Very low	126 Å²	126	134.8 Å²	134.8	66%	0.66	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	89.7	156	179.5	82.8	0	0	0	106.2
30	L	45.3	Very low	40.8	Very low	145 Å²	145	137.8 Å²	137.8	76%	0.759	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-174.5	-0.6	160.1	-101.9	160.2	0	0	0	114.7	L28	L28-L30 VanDerWaalsContact C-N 3.26Å; L28-L30 PolarHBondContact O-N 2.93Å; L28-L30 VanDerWaalsContact O-N 3.08Å
31	L	41.6	Very low	41.3	Very low	143 Å²	143	140.9 Å²	140.9	75%	0.749	77%	0.769	S	S	*	*	S	Bend	trans	-110.1	6.1	179	-112.5	150.3	0	0	0	115.2
32	I	45.7	Very low	41.6	Very low	133 Å²	133	141.4 Å²	141.4	68%	0.682	76%	0.762	S	S	*	*	S	Bend	trans	-120.6	42.9	176.1	-42.4	-179.2	0	0	0	110.9
33	I	48.4	Very low	41.9	Very low	148 Å²	148	145.2 Å²	145.2	76%	0.759	77%	0.77	S	S	*	*	S	Bend	trans	-107.6	-1.5	166.9	-62.4	178	0	0	0	111
34	G	45.8	Very low	42.2	Very low	72 Å²	72	141.2 Å²	141.2	74%	0.742	77%	0.768	S	S	*	*	S	Bend	trans	-99.4	-6.1	178.8	0	0	0	0	0	116.8
35	L	47.1	Very low	41.8	Very low	157 Å²	157	135.5 Å²	135.5	82%	0.822	76%	0.763	S	S	*	*	S	Bend	trans	-130.7	10.4	-167.5	-91.1	151.1	0	0	0	115.5
36	C	40.3	Very low	42.3	Very low	106 Å²	106	131.9 Å²	131.9	72%	0.716	76%	0.76	S	S	*	*			trans	-128.1	42.2	178.5	-63.4	0	0	0	0	113.3
37	C	45.6	Very low	42.2	Very low	140 Å²	140	133.7 Å²	133.7	95%	0.946	77%	0.767	S	S	*	*	S	Bend	trans	-108.1	26.9	170.5	-141.9	0	0	0	0	113
38	G	47.4	Very low	42	Very low	74 Å²	74	134 Å²	134	76%	0.763	77%	0.769	S	S	*	*	S	Bend	trans	-147.4	35.9	-173.2	0	0	0	0	0	115.2
39	A	49.6	Very low	41.8	Very low	81 Å²	81	138.3 Å²	138.3	67%	0.669	78%	0.775	S	S	*	*	S	Bend	trans	-168	129.8	161.1	0	0	0	0	0	110.5
40	H	36.9	Very low	41.1	Very low	180 Å²	180	140.5 Å²	140.5	83%	0.833	78%	0.782	S	S	*	*			trans	83.9	82.6	171.3	-54.2	-72.1	0	0	0	118.2
41	I	41	Very low	40.3	Very low	166 Å²	166	139 Å²	139	85%	0.851	78%	0.783	S	S	*	*			trans	-101.2	101	133.5	-68.3	178.9	0	0	0	108
42	V	38.5	Very low	39.9	Very low	111 Å²	111	140.5 Å²	140.5	67%	0.673	79%	0.786	S	S	*	*			trans	59.8	103.2	134.4	-171.9	0	0	0	0	118.8	V44	V42-V44 HydrophobicContact CG1-CG2 4.01Å
43	F	39.4	Very low	39.5	Very low	189 Å²	189	139.7 Å²	139.7	83%	0.829	79%	0.787	S	S	*	*			trans	-68.9	107.2	148.5	-167.2	-88.8	0	0	0	110
44	V	40.7	Very low	39	Very low	120 Å²	120	136.5 Å²	136.5	73%	0.727	78%	0.782	S	S	*	*			trans	-150.6	97.3	147.3	-176.5	0	0	0	0	108.6	V42	V42-V44 HydrophobicContact CG1-CG2 4.01Å
45	C	31.7	Very low	39	Very low	120 Å²	120	138.8 Å²	138.8	81%	0.811	78%	0.782	S	S	*	*			trans	-175.8	98.9	137.5	-95	0	0	0	0	109	R47	C45-R47 PolarHBondContact O-N 3.16Å
46	S	42.5	Very low	39.6	Very low	103 Å²	103	136.4 Å²	136.4	72%	0.72	77%	0.774	S	S	*	*			trans	-66	115.7	169	-54.2	0	0	0	0	110.6
47	R	33.1	Very low	41.4	Very low	232 Å²	232	139.1 Å²	139.1	88%	0.875	78%	0.777	S	S	*	*			trans	165.3	126.2	143.5	-92.7	170.9	-168.3	-172.8	5	108.7	C45 R49	C45-R47 PolarHBondContact O-N 3.16Å; R47-R49 PolarHBondContact O-N 3.19Å
48	P	35.1	Very low	43.4	Very low	126 Å²	126	134.1 Å²	134.1	82%	0.818	74%	0.743	S	S	*	*			trans	-74.1	95.9	168.7	31.1	-28	0	0	0	107.5	Q50	P48-Q50 PolarHBondContact O-N 3.26Å
49	R	33.6	Very low	45.3	Very low	233 Å²	233	138.6 Å²	138.6	88%	0.879	74%	0.737	S	S	*	*			trans	-67	112.3	150.9	-95.4	-177.5	159.3	134.6	-4.3	105.3	R47 C51	R47-R49 PolarHBondContact O-N 3.19Å; R49-C51 VanDerWaalsContact C-N 3.26Å; R49-C51 PolarHBondContact O-N 3.26Å
50	Q	33.6	Very low	47.3	Very low	171 Å²	171	134.8 Å²	134.8	80%	0.799	71%	0.705	S	S	*	*			trans	-53.1	103.1	151.9	-102.5	104.9	13	0	0	106.5	P48 Q52	P48-Q50 PolarHBondContact O-N 3.26Å; Q50-Q52 PolarHBondContact O-N 3.5Å
51	C	28.8	Very low	49.7	Very low	114 Å²	114	131.6 Å²	131.6	77%	0.77	69%	0.691	S	S	*	*			trans	-66.7	86.6	148.5	-77.9	0	0	0	0	105.3	R49 V53	R49-C51 VanDerWaalsContact C-N 3.26Å; R49-C51 PolarHBondContact O-N 3.26Å; C51-V53 PolarHBondContact O-N 2.72Å
52	Q	32.5	Very low	51.8	Low	174 Å²	174	129.7 Å²	129.7	81%	0.813	68%	0.676	S	S	*	*			trans	-61.1	94.2	152.6	-76.9	-169.3	-25.1	0	0	105.3	Q50 A54	Q50-Q52 PolarHBondContact O-N 3.5Å; Q52-A54 PolarHBondContact O-N 3.26Å
53	V	37.5	Very low	54.2	Low	117 Å²	117	124.5 Å²	124.5	71%	0.709	65%	0.645	S	S	*	*			trans	-58.8	98.2	148.3	177.7	0	0	0	0	103.1	C51 T55	C51-V53 PolarHBondContact O-N 2.72Å; V53-T55 HydrophobicContact CG1-CG2 4.42Å; V53-T55 PolarHBondContact O-N 3.02Å
54	A	37.9	Very low	56.6	Low	80 Å²	80	117.3 Å²	117.3	66%	0.661	62%	0.616	S	S	*	*			trans	-61	92.1	164.9	0	0	0	0	0	105.1	Q52 T56	Q52-A54 PolarHBondContact O-N 3.26Å; A54-T56 PolarHBondContact O-N 3.49Å
55	T	46.7	Very low	58.8	Low	120 Å²	120	115.9 Å²	115.9	74%	0.736	61%	0.608	S	S	*	*			trans	-58.8	100.7	163	44.1	0	0	0	0	104.4	V53 Q57	V53-T55 HydrophobicContact CG1-CG2 4.42Å; V53-T55 PolarHBondContact O-N 3.02Å; T55-Q57 VanDerWaalsContact C-N 3.3Å; T55-Q57 PolarHBondContact O-N 3.18Å
56	T	59	Low	61.3	Low	108 Å²	108	113.6 Å²	113.6	66%	0.663	59%	0.588	S	S	*	*			trans	-60	103.1	171.5	30.7	0	0	0	0	105.1	A54 A102	A54-T56 PolarHBondContact O-N 3.49Å; T56-A102 WeakPolarHBondContact O-CB 3.31Å
57	Q	78.6	Confident	63.5	Low	163 Å²	163	109.8 Å²	109.8	76%	0.762	56%	0.558	S	S	*	*			trans	-67.4	139.2	-179.5	-168.4	176.4	7.2	0	0	108.1	T55 R59	T55-Q57 VanDerWaalsContact C-N 3.3Å; T55-Q57 PolarHBondContact O-N 3.18Å; Q57-R59 WeakPolarHBondContact O-CG 3.31Å; Q57-R59 PolarHBondContact O-N 3.37Å
58	C	87.3	Confident	66.1	Low	35 Å²	35	102.7 Å²	102.7	24%	0.236	54%	0.54	C	S	.	.			trans	-59	121.5	175.1	175.1	0	0	0	0	110.2	I60 C103	C58-I60 VanDerWaalsContact SG-CG2 3.53Å; C58-C103 WeakPolarHBondContact CA-SG 3.21Å; C58-C103 HydrophobicContact CB-CB 3.97Å; C58-C103 WeakPolarHBondContact CB-SG 3.5Å; C58-C103 VanDerWaalsContact SG-CA 3.51Å; C58-C103 WeakPolarHBondContact SG-CB 3.41Å; C58-C103 CovalentContact SG-SG 2.03Å; C58-C103 PolarHBondContact SG-SG 2.83Å
59	R	88.4	Confident	68.4	Low	168 Å²	168	100.2 Å²	100.2	63%	0.634	53%	0.526	S	S	*	.			trans	-103.3	25.7	-176.6	-65.1	-171.7	177.3	179.9	-2.6	113.4	Q57 Q61 K62 C63 T99	Q57-R59 WeakPolarHBondContact O-CG 3.31Å; Q57-R59 PolarHBondContact O-N 3.37Å; R59-Q61 VanDerWaalsContact C-N 3.31Å; R59-Q61 PolarHBondContact O-N 3.48Å; R59-K62 PolarHBondContact O-N 3.49Å; R59-C63 PolarHBondContact O-N 3.14Å; R59-T99 PolarHBondContact N-OG1 2.8Å
60	I	90.4	Very high	70.8	Confident	1 Å²	1	92.6 Å²	92.6	1%	0.005	50%	0.502	C	S	.	.	H	α-helix	trans	-57.9	-42.3	-177.3	-177.2	59.6	0	0	0	112.7	C58 K62 C63 T64 T96 V108 F109 A112	C58-I60 VanDerWaalsContact SG-CG2 3.53Å; I60-K62 VanDerWaalsContact C-N 3.28Å; I60-K62 PolarHBondContact O-N 3.25Å; I60-C63 WeakPolarHBondContact O-CB 3.24Å; I60-C63 PolarHBondContact O-N 2.9Å; I60-T64 PolarHBondContact O-N 2.99Å; I60-T64 PolarHBondContact O-OG1 2.82Å; I60-T96 HydrophobicContact CD1-CG2 3.71Å; I60-V108 HydrophobicContact CG1-CG1 4.1Å; I60-V108 HydrophobicContact CG2-CB 4.36Å; I60-V108 HydrophobicContact CG2-CG1 4.48Å; I60-F109 HydrophobicContact CB-CB 4.25Å; I60-F109 HydrophobicContact CD1-CB 4.38Å; I60-F109 HydrophobicContact CD1-CD2 4.18Å; I60-F109 HydrophobicContact CG1-CB 4.1Å; I60-A112 HydrophobicContact CD1-CB 3.73Å; I60-A112 HydrophobicContact CG1-CB 4.46Å
61	Q	87.6	Confident	73.2	Confident	113 Å²	113	85.6 Å²	85.6	53%	0.528	47%	0.471	S	S	.	.	H	α-helix	trans	-57.4	-42.9	179.8	-66	-62.5	-24	0	0	111.5	R59 T64 T65	R59-Q61 VanDerWaalsContact C-N 3.31Å; R59-Q61 PolarHBondContact O-N 3.48Å; Q61-T64 PolarHBondContact O-N 2.87Å; Q61-T65 PolarHBondContact O-N 3.1Å; Q61-T65 PolarHBondContact O-OG1 2.93Å
62	K	85.6	Confident	75.7	Confident	125 Å²	125	83.7 Å²	83.7	54%	0.543	46%	0.459	S	S	.	.	H	α-helix	trans	-61.3	-47	175.2	-178.7	169.7	-179.7	165.3	0	111.7	R59 I60 T64 T65 D66	R59-K62 PolarHBondContact O-N 3.49Å; I60-K62 VanDerWaalsContact C-N 3.28Å; I60-K62 PolarHBondContact O-N 3.25Å; K62-T64 VanDerWaalsContact C-N 3.26Å; K62-T64 PolarHBondContact O-N 2.87Å; K62-T65 PolarHBondContact O-N 2.92Å; K62-D66 WeakPolarHBondContact O-CB 3.31Å; K62-D66 PolarHBondContact O-N 3.36Å
63	C	89.4	Confident	77.7	Confident	3 Å²	3	83 Å²	83	2%	0.02	46%	0.456	C	S	.	.	H	α-helix	trans	-58.9	-38.9	177.2	-62.9	0	0	0	0	112.3	R59 I60 F67 Y92 C95 T96	R59-C63 PolarHBondContact O-N 3.14Å; I60-C63 WeakPolarHBondContact O-CB 3.24Å; I60-C63 PolarHBondContact O-N 2.9Å; C63-F67 PolarHBondContact O-N 2.85Å; C63-Y92 VanDerWaalsContact C-CE2 3.49Å; C63-Y92 HydrophobicContact CB-CD2 3.93Å; C63-Y92 HydrophobicContact CB-CE2 3.81Å; C63-Y92 VanDerWaalsContact O-CD2 3.23Å; C63-Y92 WeakPolarHBondContact O-CD2 3.41Å; C63-Y92 WeakPolarHBondContact O-CE2 3.16Å; C63-C95 WeakPolarHBondContact CA-SG 3.35Å; C63-C95 HydrophobicContact CB-CB 3.78Å; C63-C95 WeakPolarHBondContact CB-SG 3.47Å; C63-C95 WeakPolarHBondContact SG-CB 3.33Å; C63-C95 PolarHBondContact SG-O 3.41Å; C63-C95 CovalentContact SG-SG 2.05Å; C63-C95 PolarHBondContact SG-SG 2.85Å; C63-T96 HydrophobicContact CB-CG2 4.19Å
64	T	89.5	Confident	79.6	Confident	37 Å²	37	79.7 Å²	79.7	23%	0.227	43%	0.434	C	S	.	.	H	α-helix	trans	-69.7	-44.7	177.8	-55	0	0	0	0	111.7	I60 Q61 K62 D66 F67 V68 Y92	I60-T64 PolarHBondContact O-N 2.99Å; I60-T64 PolarHBondContact O-OG1 2.82Å; Q61-T64 PolarHBondContact O-N 2.87Å; K62-T64 VanDerWaalsContact C-N 3.26Å; K62-T64 PolarHBondContact O-N 2.87Å; T64-D66 PolarHBondContact O-N 2.86Å; T64-F67 PolarHBondContact O-N 2.63Å; T64-V68 WeakPolarHBondContact O-CG2 3.01Å; T64-V68 PolarHBondContact O-N 2.89Å; T64-Y92 PolarHBondContact OG1-OH 3.35Å
65	T	86.3	Confident	81.2	Confident	90 Å²	90	79.5 Å²	79.5	55%	0.552	42%	0.424	S	S	*	.	H	α-helix	trans	-60.6	-44.1	176.1	-56.9	0	0	0	0	111.7	Q61 K62 F67 V68 S69	Q61-T65 PolarHBondContact O-N 3.1Å; Q61-T65 PolarHBondContact O-OG1 2.93Å; K62-T65 PolarHBondContact O-N 2.92Å; T65-F67 VanDerWaalsContact C-N 3.32Å; T65-F67 PolarHBondContact O-N 3.35Å; T65-V68 PolarHBondContact O-N 3.13Å; T65-S69 WeakPolarHBondContact O-CB 3.19Å; T65-S69 PolarHBondContact O-N 3.36Å
66	D	84	Confident	82.1	Confident	72 Å²	72	79.4 Å²	79.4	39%	0.385	43%	0.426	S	S	.	.	H	α-helix	trans	-61.4	-41	178.1	-66.5	-13.5	0	0	0	111	K62 T64 S69 L70	K62-D66 WeakPolarHBondContact O-CB 3.31Å; K62-D66 PolarHBondContact O-N 3.36Å; T64-D66 PolarHBondContact O-N 2.86Å; D66-S69 PolarHBondContact O-N 3.11Å; D66-L70 VanDerWaalsContact O-CG 3.27Å; D66-L70 WeakPolarHBondContact O-CG 3.4Å; D66-L70 PolarHBondContact O-N 3.03Å
67	F	88.9	Confident	82.2	Confident	24 Å²	24	79 Å²	79	11%	0.105	43%	0.434	C	S	.	.	H	α-helix	trans	-64.7	-44.9	176.1	175.5	-108.6	0	0	0	112.9	C63 T64 T65 S69 L70 T71 F85 A88 L89 Y92 L119	C63-F67 PolarHBondContact O-N 2.85Å; T64-F67 PolarHBondContact O-N 2.63Å; T65-F67 VanDerWaalsContact C-N 3.32Å; T65-F67 PolarHBondContact O-N 3.35Å; F67-S69 VanDerWaalsContact C-N 3.31Å; F67-S69 PolarHBondContact O-N 2.93Å; F67-L70 PolarHBondContact O-N 3.49Å; F67-T71 HydrophobicContact CD2-CG2 4.2Å; F67-T71 HydrophobicContact CE2-CG2 3.77Å; F67-T71 HydrophobicContact CZ-CG2 4.01Å; F67-T71 WeakPolarHBondContact O-CG2 3.47Å; F67-T71 PolarHBondContact O-N 2.75Å; F67-T71 PolarHBondContact O-OG1 2.97Å; F67-F85 HydrophobicContact CZ-CE2 4.28Å; F67-F85 AromaticContact CZ-CZ 3.91Å; F67-F85 HydrophobicContact CZ-CZ 3.91Å; F67-A88 HydrophobicContact CD2-CB 4.39Å; F67-A88 HydrophobicContact CE2-CB 4.42Å; F67-L89 HydrophobicContact CE2-CB 4.18Å; F67-L89 HydrophobicContact CE2-CD1 3.72Å; F67-L89 HydrophobicContact CZ-CD1 3.92Å; F67-Y92 HydrophobicContact CB-CD1 3.87Å; F67-Y92 HydrophobicContact CB-CD2 3.98Å; F67-Y92 HydrophobicContact CB-CE1 4.36Å; F67-Y92 HydrophobicContact CB-CE2 4.46Å; F67-Y92 HydrophobicContact CB-CG 3.67Å; F67-Y92 AromaticContact CD1-CD1 3.86Å; F67-Y92 HydrophobicContact CD1-CD1 3.86Å; F67-Y92 HydrophobicContact CD1-CE1 4.03Å; F67-Y92 AromaticContact CD2-CD1 3.84Å; F67-Y92 HydrophobicContact CD2-CD1 3.84Å; F67-Y92 HydrophobicContact CD2-CG 4.02Å; F67-Y92 HydrophobicContact CE1-CD1 4.38Å; F67-Y92 HydrophobicContact CE2-CD1 4.37Å; F67-Y92 AromaticContact CG-CD1 3.56Å; F67-Y92 HydrophobicContact CG-CD1 3.56Å; F67-Y92 HydrophobicContact CG-CE1 4.13Å; F67-Y92 AromaticContact CG-CG 3.81Å; F67-Y92 HydrophobicContact CG-CG 3.81Å; F67-L119 HydrophobicContact CE1-CD1 4.41Å; F67-L119 HydrophobicContact CZ-CD1 4.22Å
68	V	86.9	Confident	81.3	Confident	82 Å²	82	75.4 Å²	75.4	50%	0.497	42%	0.423	S	S	.	.	H	α-helix	trans	-61.8	-42.8	176.7	172.4	0	0	0	0	110.2	T64 T65 L70 T71 S72	T64-V68 WeakPolarHBondContact O-CG2 3.01Å; T64-V68 PolarHBondContact O-N 2.89Å; T65-V68 PolarHBondContact O-N 3.13Å; V68-L70 VanDerWaalsContact C-N 3.34Å; V68-L70 PolarHBondContact O-N 2.78Å; V68-T71 PolarHBondContact O-N 2.9Å; V68-T71 PolarHBondContact O-OG1 3.09Å; V68-S72 WeakPolarHBondContact O-CB 3.35Å; V68-S72 PolarHBondContact O-N 2.91Å
69	S	84.5	Confident	79.7	Confident	74 Å²	74	81.9 Å²	81.9	52%	0.517	46%	0.455	S	S	.	.	H	α-helix	trans	-63.6	-36.3	177.3	-177.6	0	0	0	0	113.3	T65 D66 F67 T71 S72	T65-S69 WeakPolarHBondContact O-CB 3.19Å; T65-S69 PolarHBondContact O-N 3.36Å; D66-S69 PolarHBondContact O-N 3.11Å; F67-S69 VanDerWaalsContact C-N 3.31Å; F67-S69 PolarHBondContact O-N 2.93Å; S69-T71 VanDerWaalsContact C-N 3.25Å; S69-T71 PolarHBondContact O-N 2.97Å; S69-S72 PolarHBondContact O-OG 3.07Å
70	L	82.7	Confident	78.8	Confident	73 Å²	73	75.8 Å²	75.8	38%	0.382	45%	0.445	S	S	.	.	H	α-helix	trans	-73.2	-19.8	178.3	-74.4	166.7	0	0	0	112.7	D66 F67 V68 A88 P132	D66-L70 VanDerWaalsContact O-CG 3.27Å; D66-L70 WeakPolarHBondContact O-CG 3.4Å; D66-L70 PolarHBondContact O-N 3.03Å; F67-L70 PolarHBondContact O-N 3.49Å; V68-L70 VanDerWaalsContact C-N 3.34Å; V68-L70 PolarHBondContact O-N 2.78Å; L70-A88 HydrophobicContact CB-CB 3.7Å; L70-A88 HydrophobicContact CD1-CB 4.24Å; L70-P132 HydrophobicContact CD1-CG 4.08Å; L70-P132 HydrophobicContact CD2-CB 4.19Å; L70-P132 HydrophobicContact CD2-CG 4.11Å
71	T	83.8	Confident	78.3	Confident	25 Å²	25	77 Å²	77	15%	0.153	45%	0.45	C	S	.	.	H	α-helix	trans	-111.2	-17.1	-173.5	54.8	0	0	0	0	113.8	F67 V68 S69 H73 L74 F85 A88	F67-T71 HydrophobicContact CD2-CG2 4.2Å; F67-T71 HydrophobicContact CE2-CG2 3.77Å; F67-T71 HydrophobicContact CZ-CG2 4.01Å; F67-T71 WeakPolarHBondContact O-CG2 3.47Å; F67-T71 PolarHBondContact O-N 2.75Å; F67-T71 PolarHBondContact O-OG1 2.97Å; V68-T71 PolarHBondContact O-N 2.9Å; V68-T71 PolarHBondContact O-OG1 3.09Å; S69-T71 VanDerWaalsContact C-N 3.25Å; S69-T71 PolarHBondContact O-N 2.97Å; T71-H73 PolarHBondContact O-N 3.07Å; T71-H73 VanDerWaalsContact O-N 3.14Å; T71-L74 HydrophobicContact CG2-CD1 4.25Å; T71-L74 WeakPolarHBondContact O-CB 3.47Å; T71-L74 PolarHBondContact O-N 2.93Å; T71-F85 HydrophobicContact CG2-CD2 3.74Å; T71-F85 HydrophobicContact CG2-CE2 3.76Å; T71-A88 HydrophobicContact CG2-CB 3.83Å
72	S	81.4	Confident	78	Confident	74 Å²	74	75.4 Å²	75.4	52%	0.517	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.7	-176.6	56.3	0	0	0	0	114.8	V68 S69	V68-S72 WeakPolarHBondContact O-CB 3.35Å; V68-S72 PolarHBondContact O-N 2.91Å; S69-S72 PolarHBondContact O-OG 3.07Å
73	H	75	Confident	77.9	Confident	160 Å²	160	73.5 Å²	73.5	74%	0.741	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-5.4	179.5	-59.4	-68.9	0	0	0	113.5	T71 T75	T71-H73 PolarHBondContact O-N 3.07Å; T71-H73 VanDerWaalsContact O-N 3.14Å; H73-T75 PolarHBondContact O-N 2.84Å
74	L	77.8	Confident	77.6	Confident	46 Å²	46	77.2 Å²	77.2	24%	0.241	46%	0.461	C	S	.	.			trans	-81.8	119.2	-179.7	-59.2	179.6	0	0	0	109.1	T71 F81 E84 F85	T71-L74 HydrophobicContact CG2-CD1 4.25Å; T71-L74 WeakPolarHBondContact O-CB 3.47Å; T71-L74 PolarHBondContact O-N 2.93Å; L74-F81 HydrophobicContact CB-CD2 3.65Å; L74-F81 HydrophobicContact CB-CE2 3.42Å; L74-F81 VanDerWaalsContact CB-CE2 3.42Å; L74-F81 HydrophobicContact CB-CZ 4.44Å; L74-E84 HydrophobicContact CD1-CB 4.21Å; L74-E84 HydrophobicContact CD2-CB 3.84Å; L74-F85 HydrophobicContact CD1-CB 4.02Å; L74-F85 HydrophobicContact CD1-CD2 4.18Å
75	T	71.6	Confident	77.4	Confident	76 Å²	76	76.4 Å²	76.4	47%	0.466	45%	0.454	S	S	.	.			trans	-107	138.6	174.7	47.4	0	0	0	0	110.6	H73 A77 V78 F81	H73-T75 PolarHBondContact O-N 2.84Å; T75-A77 PolarHBondContact O-N 2.87Å; T75-V78 PolarHBondContact O-N 2.94Å; T75-V78 VanDerWaalsContact OG1-CG2 3.22Å; T75-V78 WeakPolarHBondContact OG1-CG2 3.32Å; T75-F81 VanDerWaalsContact C-CD2 3.48Å; T75-F81 VanDerWaalsContact O-CD2 3.24Å; T75-F81 WeakPolarHBondContact O-CD2 3.31Å
76	P	65.4	Low	77.6	Confident	119 Å²	119	72.6 Å²	72.6	77%	0.773	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-10.3	-177.1	-22.6	32.1	0	0	0	115.3
77	A	60.4	Low	77.8	Confident	100 Å²	100	71.4 Å²	71.4	83%	0.826	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	3.4	-176.9	0	0	0	0	0	114	T75	T75-A77 PolarHBondContact O-N 2.87Å
78	V	59.9	Low	77.9	Confident	87 Å²	87	70.3 Å²	70.3	53%	0.527	42%	0.418	S	S	.	.	S	Bend	trans	-107.2	130.3	-175.1	-177.5	0	0	0	0	110.7	T75 G80 F81	T75-V78 PolarHBondContact O-N 2.94Å; T75-V78 VanDerWaalsContact OG1-CG2 3.22Å; T75-V78 WeakPolarHBondContact OG1-CG2 3.32Å; V78-G80 PolarHBondContact O-N 3.46Å; V78-F81 WeakPolarHBondContact O-CB 3.4Å; V78-F81 PolarHBondContact O-N 2.82Å
79	D	54.3	Low	78.1	Confident	170 Å²	170	66.4 Å²	66.4	91%	0.909	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	126.4	172.7	-81.6	-29.2	0	0	0	110.8
80	G	69.6	Low	78.4	Confident	41 Å²	41	64.6 Å²	64.6	42%	0.423	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	6.8	-178	0	0	0	0	0	115.6	V78 D82 T83 E84	V78-G80 PolarHBondContact O-N 3.46Å; G80-D82 PolarHBondContact O-N 2.88Å; G80-T83 WeakPolarHBondContact O-CB 3.41Å; G80-T83 PolarHBondContact O-N 3.13Å; G80-T83 VanDerWaalsContact O-N 3.13Å; G80-E84 PolarHBondContact O-N 3.11Å; G80-E84 VanDerWaalsContact O-N 3.07Å
81	F	80	Confident	78.7	Confident	25 Å²	25	62.1 Å²	62.1	11%	0.11	37%	0.366	C	S	.	.	H	α-helix	trans	-48.9	-53.1	174.1	174.3	-87.5	0	0	0	112.9	L74 T75 V78 T83 E84 F85	L74-F81 HydrophobicContact CB-CD2 3.65Å; L74-F81 HydrophobicContact CB-CE2 3.42Å; L74-F81 VanDerWaalsContact CB-CE2 3.42Å; L74-F81 HydrophobicContact CB-CZ 4.44Å; T75-F81 VanDerWaalsContact C-CD2 3.48Å; T75-F81 VanDerWaalsContact O-CD2 3.24Å; T75-F81 WeakPolarHBondContact O-CD2 3.31Å; V78-F81 WeakPolarHBondContact O-CB 3.4Å; V78-F81 PolarHBondContact O-N 2.82Å; F81-T83 VanDerWaalsContact C-N 3.26Å; F81-T83 PolarHBondContact O-N 3.24Å; F81-E84 PolarHBondContact O-N 2.7Å; F81-F85 HydrophobicContact CE1-CB 4.27Å; F81-F85 HydrophobicContact CE1-CD2 4.36Å; F81-F85 HydrophobicContact CE1-CG 4.4Å; F81-F85 HydrophobicContact CZ-CD2 4.05Å; F81-F85 VanDerWaalsContact O-CB 3.25Å; F81-F85 WeakPolarHBondContact O-CB 3.47Å; F81-F85 PolarHBondContact O-N 2.91Å
82	D	80.4	Confident	79.2	Confident	81 Å²	81	61.9 Å²	61.9	43%	0.433	36%	0.363	S	S	.	.	H	α-helix	trans	-65.2	-32.7	-177.5	-70.3	-49.1	0	0	0	111.6	G80 C86 R123	G80-D82 PolarHBondContact O-N 2.88Å; D82-C86 WeakPolarHBondContact O-CB 3.04Å; D82-C86 PolarHBondContact O-N 2.62Å; D82-C86 PolarHBondContact O-SG 3.25Å; D82-R123 IonicContact OD1-NH1 4Å; D82-R123 PolarHBondContact OD1-NH1 2.64Å
83	T	83.4	Confident	79.7	Confident	84 Å²	84	59.5 Å²	59.5	52%	0.515	35%	0.346	S	S	.	.	H	α-helix	trans	-65.3	-47.3	176.4	-55.2	0	0	0	0	111.7	G80 F81 K87	G80-T83 WeakPolarHBondContact O-CB 3.41Å; G80-T83 PolarHBondContact O-N 3.13Å; G80-T83 VanDerWaalsContact O-N 3.13Å; F81-T83 VanDerWaalsContact C-N 3.26Å; F81-T83 PolarHBondContact O-N 3.24Å; T83-K87 VanDerWaalsContact O-CG 3.32Å; T83-K87 WeakPolarHBondContact O-CG 3.19Å; T83-K87 PolarHBondContact O-N 3.24Å
84	E	83	Confident	80.5	Confident	81 Å²	81	53.3 Å²	53.3	38%	0.379	32%	0.322	S	S	.	.	H	α-helix	trans	-71.9	-37.2	178.5	-65.5	-51.1	123.7	0	0	112.3	L74 G80 F81 K87 A88	L74-E84 HydrophobicContact CD1-CB 4.21Å; L74-E84 HydrophobicContact CD2-CB 3.84Å; G80-E84 PolarHBondContact O-N 3.11Å; G80-E84 VanDerWaalsContact O-N 3.07Å; F81-E84 PolarHBondContact O-N 2.7Å; E84-K87 WeakPolarHBondContact O-CB 3.29Å; E84-K87 PolarHBondContact O-N 3.4Å; E84-K87 WeakPolarHBondContact OE1-CE 2.89Å; E84-K87 IonicContact OE1-NZ 3.76Å; E84-K87 PolarHBondContact OE1-NZ 3.06Å; E84-K87 WeakPolarHBondContact OE2-CD 3.37Å; E84-K87 IonicContact OE2-NZ 2.73Å; E84-A88 PolarHBondContact O-N 3.49Å
85	F	86.9	Confident	81	Confident	20 Å²	20	52.3 Å²	52.3	9%	0.088	32%	0.319	C	S	.	.	H	α-helix	trans	-63.3	-44.6	174.1	-169	-87.4	0	0	0	111.3	F67 T71 L74 F81 K87 A88 L89 L119 R123	F67-F85 HydrophobicContact CZ-CE2 4.28Å; F67-F85 AromaticContact CZ-CZ 3.91Å; F67-F85 HydrophobicContact CZ-CZ 3.91Å; T71-F85 HydrophobicContact CG2-CD2 3.74Å; T71-F85 HydrophobicContact CG2-CE2 3.76Å; L74-F85 HydrophobicContact CD1-CB 4.02Å; L74-F85 HydrophobicContact CD1-CD2 4.18Å; F81-F85 HydrophobicContact CE1-CB 4.27Å; F81-F85 HydrophobicContact CE1-CD2 4.36Å; F81-F85 HydrophobicContact CE1-CG 4.4Å; F81-F85 HydrophobicContact CZ-CD2 4.05Å; F81-F85 VanDerWaalsContact O-CB 3.25Å; F81-F85 WeakPolarHBondContact O-CB 3.47Å; F81-F85 PolarHBondContact O-N 2.91Å; F85-K87 VanDerWaalsContact C-N 3.33Å; F85-K87 PolarHBondContact O-N 3.43Å; F85-A88 PolarHBondContact O-N 3.26Å; F85-L89 HydrophobicContact CE1-CD2 4.2Å; F85-L89 WeakPolarHBondContact O-CB 2.78Å; F85-L89 PolarHBondContact O-N 2.83Å; F85-L119 HydrophobicContact CZ-CD2 4.45Å; F85-R123 VanDerWaalsContact CE1-CD 3.48Å
86	C	90	Very high	82	Confident	10 Å²	10	48.7 Å²	48.7	7%	0.068	30%	0.297	C	S	.	.	H	α-helix	trans	-64.2	-35.5	175.2	-71	0	0	0	0	112.3	D82 L89 R90 C125	D82-C86 WeakPolarHBondContact O-CB 3.04Å; D82-C86 PolarHBondContact O-N 2.62Å; D82-C86 PolarHBondContact O-SG 3.25Å; C86-L89 PolarHBondContact O-N 2.93Å; C86-R90 WeakPolarHBondContact O-CG 2.99Å; C86-R90 PolarHBondContact O-N 3.3Å; C86-C125 WeakPolarHBondContact CA-SG 3.31Å; C86-C125 HydrophobicContact CB-CB 3.76Å; C86-C125 WeakPolarHBondContact CB-SG 3.42Å; C86-C125 WeakPolarHBondContact SG-CA 3.33Å; C86-C125 WeakPolarHBondContact SG-CB 3.35Å; C86-C125 CovalentContact SG-SG 2.04Å; C86-C125 PolarHBondContact SG-SG 3.38Å
87	K	88.8	Confident	83.2	Confident	48 Å²	48	49 Å²	49	21%	0.209	29%	0.288	C	S	.	.	H	α-helix	trans	-60.2	-51.4	171.6	-72.4	171	-178.6	173	0	110.5	T83 E84 F85 L89 R90 A91 P130 P132	T83-K87 VanDerWaalsContact O-CG 3.32Å; T83-K87 WeakPolarHBondContact O-CG 3.19Å; T83-K87 PolarHBondContact O-N 3.24Å; E84-K87 WeakPolarHBondContact O-CB 3.29Å; E84-K87 PolarHBondContact O-N 3.4Å; E84-K87 WeakPolarHBondContact OE1-CE 2.89Å; E84-K87 IonicContact OE1-NZ 3.76Å; E84-K87 PolarHBondContact OE1-NZ 3.06Å; E84-K87 WeakPolarHBondContact OE2-CD 3.37Å; E84-K87 IonicContact OE2-NZ 2.73Å; F85-K87 VanDerWaalsContact C-N 3.33Å; F85-K87 PolarHBondContact O-N 3.43Å; K87-L89 VanDerWaalsContact C-N 3.3Å; K87-L89 PolarHBondContact O-N 3.44Å; K87-R90 PolarHBondContact O-N 3.02Å; K87-A91 PolarHBondContact O-N 3.08Å; K87-A91 VanDerWaalsContact O-N 3.14Å; K87-P130 HydrophobicContact CG-CG 4.5Å; K87-P130 WeakPolarHBondContact CG-O 3.2Å; K87-P132 HydrophobicContact CB-CG 4.21Å; K87-P132 WeakPolarHBondContact O-CD 3.37Å
88	A	89	Confident	84.5	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-58.5	-41	178	0	0	0	0	0	112.5	F67 L70 T71 E84 F85 A91 Y92	F67-A88 HydrophobicContact CD2-CB 4.39Å; F67-A88 HydrophobicContact CE2-CB 4.42Å; L70-A88 HydrophobicContact CB-CB 3.7Å; L70-A88 HydrophobicContact CD1-CB 4.24Å; T71-A88 HydrophobicContact CG2-CB 3.83Å; E84-A88 PolarHBondContact O-N 3.49Å; F85-A88 PolarHBondContact O-N 3.26Å; A88-A91 WeakPolarHBondContact O-CB 3.27Å; A88-A91 PolarHBondContact O-N 3.3Å; A88-Y92 PolarHBondContact O-N 2.94Å
89	L	91.5	Very high	85.8	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-68.7	-36.5	179.9	-166.5	59.7	0	0	0	112.9	F67 F85 C86 K87 Y92 S93 I116 L119 M120	F67-L89 HydrophobicContact CE2-CB 4.18Å; F67-L89 HydrophobicContact CE2-CD1 3.72Å; F67-L89 HydrophobicContact CZ-CD1 3.92Å; F85-L89 HydrophobicContact CE1-CD2 4.2Å; F85-L89 WeakPolarHBondContact O-CB 2.78Å; F85-L89 PolarHBondContact O-N 2.83Å; C86-L89 PolarHBondContact O-N 2.93Å; K87-L89 VanDerWaalsContact C-N 3.3Å; K87-L89 PolarHBondContact O-N 3.44Å; L89-Y92 HydrophobicContact CD1-CD1 4.37Å; L89-Y92 PolarHBondContact O-N 2.95Å; L89-S93 WeakPolarHBondContact O-CB 3.48Å; L89-S93 PolarHBondContact O-N 3.5Å; L89-I116 HydrophobicContact CD1-CG1 4.47Å; L89-I116 HydrophobicContact CD1-CG2 4.47Å; L89-L119 HydrophobicContact CD1-CB 4.01Å; L89-L119 HydrophobicContact CD1-CD1 4.07Å; L89-L119 HydrophobicContact CD2-CB 3.61Å; L89-L119 HydrophobicContact CG-CB 4.49Å; L89-M120 HydrophobicContact CB-SD 4.14Å; L89-M120 HydrophobicContact CD2-CB 4.31Å; L89-M120 HydrophobicContact CD2-CG 3.6Å; L89-M120 HydrophobicContact CD2-SD 3.46Å; L89-M120 WeakPolarHBondContact CD2-SD 3.46Å; L89-M120 HydrophobicContact CG-CG 3.9Å; L89-M120 HydrophobicContact CG-SD 3.58Å; L89-M120 VanDerWaalsContact CG-SD 3.58Å
90	R	92	Very high	87.4	Confident	36 Å²	36	43.6 Å²	43.6	14%	0.136	23%	0.233	C	C	.	.	H	α-helix	trans	-61.9	-41.5	169.9	-72.7	-178.6	-153.5	119.1	6.7	112	C86 K87 Y92 S93 A94 M120 S126 P130 T131	C86-R90 WeakPolarHBondContact O-CG 2.99Å; C86-R90 PolarHBondContact O-N 3.3Å; K87-R90 PolarHBondContact O-N 3.02Å; R90-Y92 VanDerWaalsContact C-N 3.35Å; R90-S93 PolarHBondContact O-N 3Å; R90-A94 WeakPolarHBondContact O-CB 3.47Å; R90-A94 PolarHBondContact O-N 3.17Å; R90-M120 HydrophobicContact CG-CE 4.34Å; R90-S126 PolarHBondContact NE-O 2.01Å; R90-P130 PolarHBondContact NH1-O 3.37Å; R90-T131 HydrophobicContact CB-CG2 4.17Å
91	A	89.3	Confident	88.3	Confident	21 Å²	21	49.9 Å²	49.9	17%	0.174	25%	0.248	C	C	.	.	H	α-helix	trans	-64.3	-40.2	176.8	0	0	0	0	0	112	K87 A88 A94 C95 T131 P132	K87-A91 PolarHBondContact O-N 3.08Å; K87-A91 VanDerWaalsContact O-N 3.14Å; A88-A91 WeakPolarHBondContact O-CB 3.27Å; A88-A91 PolarHBondContact O-N 3.3Å; A91-A94 PolarHBondContact O-N 3.42Å; A91-C95 WeakPolarHBondContact O-CB 3.27Å; A91-C95 PolarHBondContact O-N 3.49Å; A91-T131 HydrophobicContact CB-CG2 4.38Å; A91-P132 HydrophobicContact CB-CG 4.31Å
92	Y	92.7	Very high	88.7	Confident	20 Å²	20	50.2 Å²	50.2	8%	0.078	26%	0.256	C	S	.	.	H	α-helix	trans	-63.8	-44.3	175.7	-173.3	-152.9	0	0	0	112.1	C63 T64 F67 A88 L89 R90 A94 C95 T96 A112 I116	C63-Y92 VanDerWaalsContact C-CE2 3.49Å; C63-Y92 HydrophobicContact CB-CD2 3.93Å; C63-Y92 HydrophobicContact CB-CE2 3.81Å; C63-Y92 VanDerWaalsContact O-CD2 3.23Å; C63-Y92 WeakPolarHBondContact O-CD2 3.41Å; C63-Y92 WeakPolarHBondContact O-CE2 3.16Å; T64-Y92 PolarHBondContact OG1-OH 3.35Å; F67-Y92 HydrophobicContact CB-CD1 3.87Å; F67-Y92 HydrophobicContact CB-CD2 3.98Å; F67-Y92 HydrophobicContact CB-CE1 4.36Å; F67-Y92 HydrophobicContact CB-CE2 4.46Å; F67-Y92 HydrophobicContact CB-CG 3.67Å; F67-Y92 AromaticContact CD1-CD1 3.86Å; F67-Y92 HydrophobicContact CD1-CD1 3.86Å; F67-Y92 HydrophobicContact CD1-CE1 4.03Å; F67-Y92 AromaticContact CD2-CD1 3.84Å; F67-Y92 HydrophobicContact CD2-CD1 3.84Å; F67-Y92 HydrophobicContact CD2-CG 4.02Å; F67-Y92 HydrophobicContact CE1-CD1 4.38Å; F67-Y92 HydrophobicContact CE2-CD1 4.37Å; F67-Y92 AromaticContact CG-CD1 3.56Å; F67-Y92 HydrophobicContact CG-CD1 3.56Å; F67-Y92 HydrophobicContact CG-CE1 4.13Å; F67-Y92 AromaticContact CG-CG 3.81Å; F67-Y92 HydrophobicContact CG-CG 3.81Å; A88-Y92 PolarHBondContact O-N 2.94Å; L89-Y92 HydrophobicContact CD1-CD1 4.37Å; L89-Y92 PolarHBondContact O-N 2.95Å; R90-Y92 VanDerWaalsContact C-N 3.35Å; Y92-A94 PolarHBondContact O-N 2.87Å; Y92-C95 PolarHBondContact O-N 3.11Å; Y92-T96 HydrophobicContact CD2-CG2 3.89Å; Y92-T96 HydrophobicContact CE2-CG2 3.64Å; Y92-T96 WeakPolarHBondContact O-CG2 3.34Å; Y92-T96 PolarHBondContact O-N 3.02Å; Y92-T96 PolarHBondContact O-OG1 3.23Å; Y92-A112 VanDerWaalsContact OH-CB 3.26Å; Y92-A112 WeakPolarHBondContact OH-CB 3.32Å; Y92-I116 HydrophobicContact CD1-CD1 3.63Å; Y92-I116 HydrophobicContact CD1-CG1 3.38Å; Y92-I116 HydrophobicContact CD2-CD1 4.21Å; Y92-I116 HydrophobicContact CE1-CD1 3.72Å; Y92-I116 HydrophobicContact CE1-CG1 3.51Å; Y92-I116 HydrophobicContact CE2-CD1 4.28Å; Y92-I116 HydrophobicContact CG-CD1 3.88Å; Y92-I116 HydrophobicContact CG-CG1 4.1Å
93	S	92.5	Very high	89.1	Confident	23 Å²	23	46.4 Å²	46.4	16%	0.161	24%	0.235	C	C	.	.	H	α-helix	trans	-57.2	-47.5	172.3	-175	0	0	0	0	112.3	L89 R90 C95 T96 Q97	L89-S93 WeakPolarHBondContact O-CB 3.48Å; L89-S93 PolarHBondContact O-N 3.5Å; R90-S93 PolarHBondContact O-N 3Å; S93-C95 PolarHBondContact O-N 2.93Å; S93-T96 PolarHBondContact O-N 3.03Å; S93-T96 PolarHBondContact O-OG1 3.06Å; S93-Q97 VanDerWaalsContact O-CG 3.27Å; S93-Q97 WeakPolarHBondContact O-CG 3.44Å; S93-Q97 PolarHBondContact O-N 3.09Å
94	A	90.9	Very high	89.3	Confident	30 Å²	30	51.2 Å²	51.2	25%	0.248	24%	0.244	C	C	.	.	H	α-helix	trans	-66.3	-35.5	178.6	0	0	0	0	0	113	R90 A91 Y92 R98	R90-A94 WeakPolarHBondContact O-CB 3.47Å; R90-A94 PolarHBondContact O-N 3.17Å; A91-A94 PolarHBondContact O-N 3.42Å; Y92-A94 PolarHBondContact O-N 2.87Å; A94-R98 WeakPolarHBondContact O-CG 3.38Å; A94-R98 PolarHBondContact O-N 2.91Å; A94-R98 PolarHBondContact O-NE 3.42Å; A94-R98 VanDerWaalsContact O-NE 3.09Å
95	C	90.2	Very high	89.5	Confident	26 Å²	26	51.4 Å²	51.4	18%	0.176	27%	0.268	C	S	.	.	H	α-helix	trans	-66.8	-47.2	176.7	-172.3	0	0	0	0	111.5	C63 A91 Y92 S93 Q97 R98 T99	C63-C95 WeakPolarHBondContact CA-SG 3.35Å; C63-C95 HydrophobicContact CB-CB 3.78Å; C63-C95 WeakPolarHBondContact CB-SG 3.47Å; C63-C95 WeakPolarHBondContact SG-CB 3.33Å; C63-C95 PolarHBondContact SG-O 3.41Å; C63-C95 CovalentContact SG-SG 2.05Å; C63-C95 PolarHBondContact SG-SG 2.85Å; A91-C95 WeakPolarHBondContact O-CB 3.27Å; A91-C95 PolarHBondContact O-N 3.49Å; Y92-C95 PolarHBondContact O-N 3.11Å; S93-C95 PolarHBondContact O-N 2.93Å; C95-Q97 PolarHBondContact O-N 3.43Å; C95-R98 PolarHBondContact O-N 2.81Å; C95-T99 PolarHBondContact O-N 2.75Å
96	T	91.1	Very high	89.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.8	-43.6	179.1	51.3	0	0	0	0	111.5	I60 C63 Y92 S93 R98 T99 A100 F109 I116	I60-T96 HydrophobicContact CD1-CG2 3.71Å; C63-T96 HydrophobicContact CB-CG2 4.19Å; Y92-T96 HydrophobicContact CD2-CG2 3.89Å; Y92-T96 HydrophobicContact CE2-CG2 3.64Å; Y92-T96 WeakPolarHBondContact O-CG2 3.34Å; Y92-T96 PolarHBondContact O-N 3.02Å; Y92-T96 PolarHBondContact O-OG1 3.23Å; S93-T96 PolarHBondContact O-N 3.03Å; S93-T96 PolarHBondContact O-OG1 3.06Å; T96-R98 VanDerWaalsContact C-N 3.33Å; T96-R98 PolarHBondContact O-N 2.91Å; T96-T99 WeakPolarHBondContact O-CG2 3.3Å; T96-T99 PolarHBondContact O-N 3.5Å; T96-A100 PolarHBondContact O-N 3.01Å; T96-A100 VanDerWaalsContact O-N 3.15Å; T96-F109 WeakPolarHBondContact O-CE2 3.39Å; T96-I116 HydrophobicContact CG2-CD1 3.71Å; T96-I116 WeakPolarHBondContact OG1-CD1 3.47Å
97	Q	90.2	Very high	89.5	Confident	126 Å²	126	58.9 Å²	58.9	59%	0.589	31%	0.308	S	S	*	.	H	α-helix	trans	-58.9	-40.6	175.7	-72.1	176.4	9.6	0	0	113.1	S93 C95 T99 A100	S93-Q97 VanDerWaalsContact O-CG 3.27Å; S93-Q97 WeakPolarHBondContact O-CG 3.44Å; S93-Q97 PolarHBondContact O-N 3.09Å; C95-Q97 PolarHBondContact O-N 3.43Å; Q97-T99 VanDerWaalsContact C-N 3.3Å; Q97-T99 PolarHBondContact O-N 3.42Å; Q97-A100 WeakPolarHBondContact O-CB 3.3Å; Q97-A100 PolarHBondContact O-N 3.29Å
98	R	88.7	Confident	89.5	Confident	195 Å²	195	59.5 Å²	59.5	74%	0.736	32%	0.316	S	S	*	.	H	α-helix	trans	-63.6	-32.5	178.9	-82.4	178.7	-96.6	148.5	-10.3	113.4	A94 C95 T96	A94-R98 WeakPolarHBondContact O-CG 3.38Å; A94-R98 PolarHBondContact O-N 2.91Å; A94-R98 PolarHBondContact O-NE 3.42Å; A94-R98 VanDerWaalsContact O-NE 3.09Å; C95-R98 PolarHBondContact O-N 2.81Å; T96-R98 VanDerWaalsContact C-N 3.33Å; T96-R98 PolarHBondContact O-N 2.91Å
99	T	87.3	Confident	89.6	Confident	16 Å²	16	60 Å²	60	10%	0.098	32%	0.317	C	S	.	.	H	α-helix	trans	-96.6	-0.4	-179.1	-164.4	0	0	0	0	113.7	R59 C95 T96 Q97 K101 A102 C103	R59-T99 PolarHBondContact N-OG1 2.8Å; C95-T99 PolarHBondContact O-N 2.75Å; T96-T99 WeakPolarHBondContact O-CG2 3.3Å; T96-T99 PolarHBondContact O-N 3.5Å; Q97-T99 VanDerWaalsContact C-N 3.3Å; Q97-T99 PolarHBondContact O-N 3.42Å; T99-K101 VanDerWaalsContact C-N 3.31Å; T99-K101 PolarHBondContact O-N 2.95Å; T99-K101 VanDerWaalsContact O-N 3.16Å; T99-A102 WeakPolarHBondContact O-CB 3.19Å; T99-A102 PolarHBondContact O-N 3.27Å; T99-C103 PolarHBondContact O-N 3.22Å; T99-C103 VanDerWaalsContact O-N 3.11Å; T99-C103 PolarHBondContact O-SG 3.02Å; T99-C103 PolarHBondContact OG1-SG 3.32Å; T99-C103 VanDerWaalsContact OG1-SG 3.41Å
100	A	88.2	Confident	89.6	Confident	32 Å²	32	64.1 Å²	64.1	26%	0.264	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-39	-173.4	0	0	0	0	0	114.8	T96 Q97 A102 C103 R104 F109	T96-A100 PolarHBondContact O-N 3.01Å; T96-A100 VanDerWaalsContact O-N 3.15Å; Q97-A100 WeakPolarHBondContact O-CB 3.3Å; Q97-A100 PolarHBondContact O-N 3.29Å; A100-A102 VanDerWaalsContact C-N 3.31Å; A100-A102 PolarHBondContact O-N 2.89Å; A100-C103 PolarHBondContact O-N 3.44Å; A100-R104 PolarHBondContact O-N 2.85Å; A100-F109 HydrophobicContact CB-CE2 4.08Å; A100-F109 HydrophobicContact CB-CZ 3.6Å
101	K	87.6	Confident	89.5	Confident	172 Å²	172	65.6 Å²	65.6	75%	0.748	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-37.1	179	-68.1	-178	-178.9	177.9	0	112.5	T99	T99-K101 VanDerWaalsContact C-N 3.31Å; T99-K101 PolarHBondContact O-N 2.95Å; T99-K101 VanDerWaalsContact O-N 3.16Å
102	A	88.3	Confident	89.6	Confident	32 Å²	32	65.1 Å²	65.1	26%	0.264	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-22.6	178.7	0	0	0	0	0	113	T56 T99 A100	T56-A102 WeakPolarHBondContact O-CB 3.31Å; T99-A102 WeakPolarHBondContact O-CB 3.19Å; T99-A102 PolarHBondContact O-N 3.27Å; A100-A102 VanDerWaalsContact C-N 3.31Å; A100-A102 PolarHBondContact O-N 2.89Å
103	C	89.1	Confident	89.5	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.007	36%	0.361	C	S	.	.			trans	-102	12.7	-172.9	-67.6	0	0	0	0	115.1	C58 T99 A100 G105 N106 F109	C58-C103 WeakPolarHBondContact CA-SG 3.21Å; C58-C103 HydrophobicContact CB-CB 3.97Å; C58-C103 WeakPolarHBondContact CB-SG 3.5Å; C58-C103 VanDerWaalsContact SG-CA 3.51Å; C58-C103 WeakPolarHBondContact SG-CB 3.41Å; C58-C103 CovalentContact SG-SG 2.03Å; C58-C103 PolarHBondContact SG-SG 2.83Å; T99-C103 PolarHBondContact O-N 3.22Å; T99-C103 VanDerWaalsContact O-N 3.11Å; T99-C103 PolarHBondContact O-SG 3.02Å; T99-C103 PolarHBondContact OG1-SG 3.32Å; T99-C103 VanDerWaalsContact OG1-SG 3.41Å; A100-C103 PolarHBondContact O-N 3.44Å; C103-G105 VanDerWaalsContact C-N 3.25Å; C103-G105 PolarHBondContact O-N 2.89Å; C103-G105 VanDerWaalsContact O-N 3.11Å; C103-N106 HydrophobicContact CB-CB 4.4Å; C103-N106 WeakPolarHBondContact O-CB 3.49Å; C103-N106 PolarHBondContact O-N 3.28Å; C103-F109 HydrophobicContact CB-CB 3.75Å; C103-F109 HydrophobicContact CB-CD1 3.97Å; C103-F109 HydrophobicContact CB-CD2 3.57Å; C103-F109 HydrophobicContact CB-CE2 4.17Å; C103-F109 HydrophobicContact CB-CG 3.47Å; C103-F109 VanDerWaalsContact CB-CG 3.47Å
104	R	88.4	Confident	89.4	Confident	185 Å²	185	72.6 Å²	72.6	70%	0.698	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-37.2	-173.8	-73.1	-176.5	173.8	136.7	-7.3	114.9	A100 H110	A100-R104 PolarHBondContact O-N 2.85Å; R104-H110 PolarHBondContact O-NE2 2.89Å
105	G	86.6	Confident	89.4	Confident	86 Å²	86	72.5 Å²	72.5	89%	0.887	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	10.5	179.9	0	0	0	0	0	115	C103	C103-G105 VanDerWaalsContact C-N 3.25Å; C103-G105 PolarHBondContact O-N 2.89Å; C103-G105 VanDerWaalsContact O-N 3.11Å
106	N	88.1	Confident	89.5	Confident	49 Å²	49	71.7 Å²	71.7	26%	0.262	38%	0.383	S	S	.	.			trans	-97.2	118.8	-176.3	-173.5	-65.1	0	0	0	110.8	C103 V108 F109 H110	C103-N106 HydrophobicContact CB-CB 4.4Å; C103-N106 WeakPolarHBondContact O-CB 3.49Å; C103-N106 PolarHBondContact O-N 3.28Å; N106-V108 VanDerWaalsContact C-N 3.35Å; N106-V108 PolarHBondContact O-N 3.18Å; N106-V108 WeakPolarHBondContact OD1-CA 3.43Å; N106-V108 VanDerWaalsContact OD1-CB 3.24Å; N106-V108 WeakPolarHBondContact OD1-CB 3.44Å; N106-V108 PolarHBondContact OD1-N 2.81Å; N106-F109 HydrophobicContact CB-CB 4.07Å; N106-F109 WeakPolarHBondContact O-CB 3.08Å; N106-F109 PolarHBondContact O-N 2.89Å; N106-F109 PolarHBondContact OD1-N 2.84Å; N106-H110 PolarHBondContact O-CD2 2.92Å; N106-H110 VanDerWaalsContact O-CD2 3.26Å; N106-H110 PolarHBondContact O-N 2.82Å
107	L	88.9	Confident	89.4	Confident	138 Å²	138	75.2 Å²	75.2	72%	0.723	41%	0.407	S	S	*	.	H	α-helix	trans	-62.6	-39.9	-179.3	-176.3	62.9	0	0	0	112.5	F109 H110 S111	L107-F109 PolarHBondContact O-N 3.38Å; L107-H110 PolarHBondContact O-N 3.38Å; L107-H110 VanDerWaalsContact O-N 3.14Å; L107-S111 PolarHBondContact O-N 3.08Å; L107-S111 PolarHBondContact O-OG 2.99Å; L107-S111 VanDerWaalsContact O-OG 3.12Å
108	V	88.1	Confident	89.5	Confident	61 Å²	61	73.3 Å²	73.3	37%	0.37	40%	0.401	S	S	.	.	H	α-helix	trans	-61.3	-35.9	179.2	-175.1	0	0	0	0	111.1	I60 N106 A112	I60-V108 HydrophobicContact CG1-CG1 4.1Å; I60-V108 HydrophobicContact CG2-CB 4.36Å; I60-V108 HydrophobicContact CG2-CG1 4.48Å; N106-V108 VanDerWaalsContact C-N 3.35Å; N106-V108 PolarHBondContact O-N 3.18Å; N106-V108 WeakPolarHBondContact OD1-CA 3.43Å; N106-V108 VanDerWaalsContact OD1-CB 3.24Å; N106-V108 WeakPolarHBondContact OD1-CB 3.44Å; N106-V108 PolarHBondContact OD1-N 2.81Å; V108-A112 VanDerWaalsContact O-CB 3.25Å; V108-A112 WeakPolarHBondContact O-CB 3.11Å; V108-A112 PolarHBondContact O-N 3.23Å
109	F	92.3	Very high	89.6	Confident	10 Å²	10	66 Å²	66	4%	0.044	38%	0.377	C	S	.	.	H	α-helix	trans	-63.4	-45.3	175	169.4	-96.1	0	0	0	112.4	I60 T96 A100 C103 N106 L107 A112 L113	I60-F109 HydrophobicContact CB-CB 4.25Å; I60-F109 HydrophobicContact CD1-CB 4.38Å; I60-F109 HydrophobicContact CD1-CD2 4.18Å; I60-F109 HydrophobicContact CG1-CB 4.1Å; T96-F109 WeakPolarHBondContact O-CE2 3.39Å; A100-F109 HydrophobicContact CB-CE2 4.08Å; A100-F109 HydrophobicContact CB-CZ 3.6Å; C103-F109 HydrophobicContact CB-CB 3.75Å; C103-F109 HydrophobicContact CB-CD1 3.97Å; C103-F109 HydrophobicContact CB-CD2 3.57Å; C103-F109 HydrophobicContact CB-CE2 4.17Å; C103-F109 HydrophobicContact CB-CG 3.47Å; C103-F109 VanDerWaalsContact CB-CG 3.47Å; N106-F109 HydrophobicContact CB-CB 4.07Å; N106-F109 WeakPolarHBondContact O-CB 3.08Å; N106-F109 PolarHBondContact O-N 2.89Å; N106-F109 PolarHBondContact OD1-N 2.84Å; L107-F109 PolarHBondContact O-N 3.38Å; F109-A112 WeakPolarHBondContact O-CB 3.29Å; F109-A112 PolarHBondContact O-N 3.33Å; F109-L113 HydrophobicContact CD1-CD1 4.21Å; F109-L113 HydrophobicContact CE1-CD1 3.48Å; F109-L113 VanDerWaalsContact CE1-CD1 3.48Å; F109-L113 HydrophobicContact CE1-CG 4.19Å; F109-L113 HydrophobicContact CE2-CD1 4.36Å; F109-L113 HydrophobicContact CE2-CD2 4.42Å; F109-L113 HydrophobicContact CE2-CG 4.32Å; F109-L113 HydrophobicContact CZ-CD1 3.56Å; F109-L113 HydrophobicContact CZ-CD2 4.25Å; F109-L113 HydrophobicContact CZ-CG 3.99Å; F109-L113 WeakPolarHBondContact O-CG 3.12Å; F109-L113 PolarHBondContact O-N 2.77Å
110	H	91.2	Very high	89.6	Confident	87 Å²	87	66.3 Å²	66.3	40%	0.403	38%	0.377	S	S	.	.	H	α-helix	trans	-68.6	-39.1	178.4	-69.6	-67.8	0	0	0	112	R104 N106 L107 A112 L113 L114	R104-H110 PolarHBondContact O-NE2 2.89Å; N106-H110 PolarHBondContact O-CD2 2.92Å; N106-H110 VanDerWaalsContact O-CD2 3.26Å; N106-H110 PolarHBondContact O-N 2.82Å; L107-H110 PolarHBondContact O-N 3.38Å; L107-H110 VanDerWaalsContact O-N 3.14Å; H110-A112 VanDerWaalsContact C-N 3.32Å; H110-A112 PolarHBondContact O-N 3.31Å; H110-L113 PolarHBondContact O-N 3.49Å; H110-L114 PolarHBondContact O-N 2.68Å
111	S	90.7	Very high	89.7	Confident	68 Å²	68	69.2 Å²	69.2	48%	0.476	40%	0.396	S	S	.	.	H	α-helix	trans	-60.5	-41.3	171.6	-57.6	0	0	0	0	111.9	L107 L114 G115	L107-S111 PolarHBondContact O-N 3.08Å; L107-S111 PolarHBondContact O-OG 2.99Å; L107-S111 VanDerWaalsContact O-OG 3.12Å; S111-L114 PolarHBondContact O-N 3.15Å; S111-G115 PolarHBondContact O-N 2.89Å
112	A	90.6	Very high	89.7	Confident	10 Å²	10	66.8 Å²	66.8	8%	0.083	39%	0.387	C	S	.	.	H	α-helix	trans	-65.8	-39.5	177.5	0	0	0	0	0	112.8	I60 Y92 V108 F109 H110 L114 G115 I116	I60-A112 HydrophobicContact CD1-CB 3.73Å; I60-A112 HydrophobicContact CG1-CB 4.46Å; Y92-A112 VanDerWaalsContact OH-CB 3.26Å; Y92-A112 WeakPolarHBondContact OH-CB 3.32Å; V108-A112 VanDerWaalsContact O-CB 3.25Å; V108-A112 WeakPolarHBondContact O-CB 3.11Å; V108-A112 PolarHBondContact O-N 3.23Å; F109-A112 WeakPolarHBondContact O-CB 3.29Å; F109-A112 PolarHBondContact O-N 3.33Å; H110-A112 VanDerWaalsContact C-N 3.32Å; H110-A112 PolarHBondContact O-N 3.31Å; A112-L114 VanDerWaalsContact C-N 3.33Å; A112-L114 PolarHBondContact O-N 2.75Å; A112-G115 PolarHBondContact O-N 2.77Å; A112-I116 WeakPolarHBondContact O-CB 3.38Å; A112-I116 WeakPolarHBondContact O-CD1 3.06Å; A112-I116 WeakPolarHBondContact O-CG1 3.45Å; A112-I116 PolarHBondContact O-N 3.33Å
113	L	91.1	Very high	89.4	Confident	68 Å²	68	69.8 Å²	69.8	36%	0.356	39%	0.391	S	S	.	.	H	α-helix	trans	-60.9	-42.7	176.3	-74.5	179.3	0	0	0	112.1	F109 H110 S117	F109-L113 HydrophobicContact CD1-CD1 4.21Å; F109-L113 HydrophobicContact CE1-CD1 3.48Å; F109-L113 VanDerWaalsContact CE1-CD1 3.48Å; F109-L113 HydrophobicContact CE1-CG 4.19Å; F109-L113 HydrophobicContact CE2-CD1 4.36Å; F109-L113 HydrophobicContact CE2-CD2 4.42Å; F109-L113 HydrophobicContact CE2-CG 4.32Å; F109-L113 HydrophobicContact CZ-CD1 3.56Å; F109-L113 HydrophobicContact CZ-CD2 4.25Å; F109-L113 HydrophobicContact CZ-CG 3.99Å; F109-L113 WeakPolarHBondContact O-CG 3.12Å; F109-L113 PolarHBondContact O-N 2.77Å; H110-L113 PolarHBondContact O-N 3.49Å; L113-S117 PolarHBondContact O-N 3.48Å; L113-S117 VanDerWaalsContact O-N 3.15Å
114	L	89.8	Confident	89.4	Confident	132 Å²	132	75 Å²	75	69%	0.691	43%	0.428	S	S	*	.	H	α-helix	trans	-64.8	-47	175.6	-66.3	173	0	0	0	110.9	H110 S111 A112 I116 S117 D118	H110-L114 PolarHBondContact O-N 2.68Å; S111-L114 PolarHBondContact O-N 3.15Å; A112-L114 VanDerWaalsContact C-N 3.33Å; A112-L114 PolarHBondContact O-N 2.75Å; L114-I116 PolarHBondContact O-N 2.71Å; L114-S117 PolarHBondContact O-N 3.47Å; L114-D118 WeakPolarHBondContact O-CB 3.3Å; L114-D118 PolarHBondContact O-N 3.49Å
115	G	91.7	Very high	89.3	Confident	29 Å²	29	66.8 Å²	66.8	30%	0.299	40%	0.399	S	S	.	.	H	α-helix	trans	-61.3	-39.8	178.1	0	0	0	0	0	113.4	S111 A112 D118 L119	S111-G115 PolarHBondContact O-N 2.89Å; A112-G115 PolarHBondContact O-N 2.77Å; G115-D118 PolarHBondContact O-N 3.15Å; G115-L119 VanDerWaalsContact O-CB 3.31Å; G115-L119 WeakPolarHBondContact O-CB 2.96Å; G115-L119 WeakPolarHBondContact O-CD1 3.01Å; G115-L119 WeakPolarHBondContact O-CG 3.42Å; G115-L119 PolarHBondContact O-N 2.9Å
116	I	92.2	Very high	89.3	Confident	9 Å²	9	66 Å²	66	5%	0.046	38%	0.379	C	S	.	.	H	α-helix	trans	-63.1	-45.3	175.2	-70.1	161.6	0	0	0	110.5	L89 Y92 T96 A112 L114 D118 M120	L89-I116 HydrophobicContact CD1-CG1 4.47Å; L89-I116 HydrophobicContact CD1-CG2 4.47Å; Y92-I116 HydrophobicContact CD1-CD1 3.63Å; Y92-I116 HydrophobicContact CD1-CG1 3.38Å; Y92-I116 HydrophobicContact CD2-CD1 4.21Å; Y92-I116 HydrophobicContact CE1-CD1 3.72Å; Y92-I116 HydrophobicContact CE1-CG1 3.51Å; Y92-I116 HydrophobicContact CE2-CD1 4.28Å; Y92-I116 HydrophobicContact CG-CD1 3.88Å; Y92-I116 HydrophobicContact CG-CG1 4.1Å; T96-I116 HydrophobicContact CG2-CD1 3.71Å; T96-I116 WeakPolarHBondContact OG1-CD1 3.47Å; A112-I116 WeakPolarHBondContact O-CB 3.38Å; A112-I116 WeakPolarHBondContact O-CD1 3.06Å; A112-I116 WeakPolarHBondContact O-CG1 3.45Å; A112-I116 PolarHBondContact O-N 3.33Å; L114-I116 PolarHBondContact O-N 2.71Å; I116-D118 VanDerWaalsContact C-N 3.35Å; I116-D118 PolarHBondContact O-N 2.98Å; I116-M120 HydrophobicContact CG2-CG 4.24Å; I116-M120 WeakPolarHBondContact O-CB 3.2Å; I116-M120 WeakPolarHBondContact O-CG 3.48Å; I116-M120 PolarHBondContact O-N 3.26Å
117	S	89.1	Confident	89	Confident	73 Å²	73	73 Å²	73	51%	0.51	40%	0.402	S	S	.	.	H	α-helix	trans	-63.5	-42.2	-180	-168.2	0	0	0	0	112.1	L113 L114 S121	L113-S117 PolarHBondContact O-N 3.48Å; L113-S117 VanDerWaalsContact O-N 3.15Å; L114-S117 PolarHBondContact O-N 3.47Å; S117-S121 PolarHBondContact O-N 2.78Å; S117-S121 VanDerWaalsContact O-N 3.15Å
118	D	91.6	Very high	88.5	Confident	86 Å²	86	72.9 Å²	72.9	46%	0.46	40%	0.403	S	S	.	.	H	α-helix	trans	-64.5	-50.4	177.8	-177	40.1	0	0	0	111.3	L114 G115 I116 M120 S121 Q122	L114-D118 WeakPolarHBondContact O-CB 3.3Å; L114-D118 PolarHBondContact O-N 3.49Å; G115-D118 PolarHBondContact O-N 3.15Å; I116-D118 VanDerWaalsContact C-N 3.35Å; I116-D118 PolarHBondContact O-N 2.98Å; D118-M120 VanDerWaalsContact C-N 3.3Å; D118-M120 PolarHBondContact O-N 3.22Å; D118-S121 PolarHBondContact O-N 3.03Å; D118-S121 VanDerWaalsContact O-N 3.08Å; D118-Q122 WeakPolarHBondContact O-CG 3.39Å; D118-Q122 PolarHBondContact O-N 3.02Å; D118-Q122 PolarHBondContact OD1-NE2 2.96Å; D118-Q122 PolarHBondContact OD2-NE2 3.28Å
119	L	90.4	Very high	87.8	Confident	43 Å²	43	72.2 Å²	72.2	23%	0.225	41%	0.408	C	S	.	.	H	α-helix	trans	-61.3	-36.2	177.7	-71.5	169.9	0	0	0	112.9	F67 F85 L89 G115 S121 R123	F67-L119 HydrophobicContact CE1-CD1 4.41Å; F67-L119 HydrophobicContact CZ-CD1 4.22Å; F85-L119 HydrophobicContact CZ-CD2 4.45Å; L89-L119 HydrophobicContact CD1-CB 4.01Å; L89-L119 HydrophobicContact CD1-CD1 4.07Å; L89-L119 HydrophobicContact CD2-CB 3.61Å; L89-L119 HydrophobicContact CG-CB 4.49Å; G115-L119 VanDerWaalsContact O-CB 3.31Å; G115-L119 WeakPolarHBondContact O-CB 2.96Å; G115-L119 WeakPolarHBondContact O-CD1 3.01Å; G115-L119 WeakPolarHBondContact O-CG 3.42Å; G115-L119 PolarHBondContact O-N 2.9Å; L119-S121 VanDerWaalsContact C-N 3.33Å; L119-R123 PolarHBondContact O-N 3.34Å
120	M	88.9	Confident	87	Confident	21 Å²	21	75.7 Å²	75.7	10%	0.103	43%	0.431	C	S	.	.	H	α-helix	trans	-66.8	-37.4	176.6	-71.6	-74.8	-87.3	0	0	111	L89 R90 I116 D118 S124 C125 R127	L89-M120 HydrophobicContact CB-SD 4.14Å; L89-M120 HydrophobicContact CD2-CB 4.31Å; L89-M120 HydrophobicContact CD2-CG 3.6Å; L89-M120 HydrophobicContact CD2-SD 3.46Å; L89-M120 WeakPolarHBondContact CD2-SD 3.46Å; L89-M120 HydrophobicContact CG-CG 3.9Å; L89-M120 HydrophobicContact CG-SD 3.58Å; L89-M120 VanDerWaalsContact CG-SD 3.58Å; R90-M120 HydrophobicContact CG-CE 4.34Å; I116-M120 HydrophobicContact CG2-CG 4.24Å; I116-M120 WeakPolarHBondContact O-CB 3.2Å; I116-M120 WeakPolarHBondContact O-CG 3.48Å; I116-M120 PolarHBondContact O-N 3.26Å; D118-M120 VanDerWaalsContact C-N 3.3Å; D118-M120 PolarHBondContact O-N 3.22Å; M120-S124 PolarHBondContact O-N 3.4Å; M120-C125 HydrophobicContact CE-CB 4.16Å; M120-C125 PolarHBondContact O-N 2.84Å; M120-C125 HydrophobicContact SD-CB 3.49Å; M120-C125 WeakPolarHBondContact SD-CB 3.45Å; M120-R127 HydrophobicContact CE-CB 4.41Å; M120-R127 HydrophobicContact CE-CG 3.89Å
121	S	88.8	Confident	86.4	Confident	94 Å²	94	75 Å²	75	66%	0.657	43%	0.434	S	S	*	.	H	α-helix	trans	-73.8	-43.7	178.2	-169.5	0	0	0	0	112.3	S117 D118 L119 R123 S124	S117-S121 PolarHBondContact O-N 2.78Å; S117-S121 VanDerWaalsContact O-N 3.15Å; D118-S121 PolarHBondContact O-N 3.03Å; D118-S121 VanDerWaalsContact O-N 3.08Å; L119-S121 VanDerWaalsContact C-N 3.33Å; S121-R123 PolarHBondContact O-N 2.79Å; S121-S124 PolarHBondContact O-N 3.31Å
122	Q	87	Confident	85.3	Confident	121 Å²	121	73.2 Å²	73.2	57%	0.565	42%	0.42	S	S	*	.	H	α-helix	trans	-61.6	-31.3	-178.3	-74	176.7	15.2	0	0	112.8	D118	D118-Q122 WeakPolarHBondContact O-CG 3.39Å; D118-Q122 PolarHBondContact O-N 3.02Å; D118-Q122 PolarHBondContact OD1-NE2 2.96Å; D118-Q122 PolarHBondContact OD2-NE2 3.28Å
123	R	83.9	Confident	83.6	Confident	94 Å²	94	77.8 Å²	77.8	36%	0.355	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	10.5	-175.4	-63.2	-173.9	178.9	-80.6	-3.6	114.1	D82 F85 L119 S121 C125	D82-R123 IonicContact OD1-NH1 4Å; D82-R123 PolarHBondContact OD1-NH1 2.64Å; F85-R123 VanDerWaalsContact CE1-CD 3.48Å; L119-R123 PolarHBondContact O-N 3.34Å; S121-R123 PolarHBondContact O-N 2.79Å; R123-C125 PolarHBondContact O-N 3Å; R123-C125 VanDerWaalsContact O-N 3.16Å
124	S	88	Confident	81.4	Confident	110 Å²	110	78.6 Å²	78.6	77%	0.769	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	38.6	-179.9	-59.8	0	0	0	0	113.4	M120 S121 S126	M120-S124 PolarHBondContact O-N 3.4Å; S121-S124 PolarHBondContact O-N 3.31Å; S124-S126 PolarHBondContact O-N 3.35Å
125	C	87.5	Confident	79	Confident	14 Å²	14	79.3 Å²	79.3	10%	0.095	47%	0.467	C	S	.	.			trans	-74.7	124.9	-179.5	-65.2	0	0	0	0	110.8	C86 M120 R123 R127	C86-C125 WeakPolarHBondContact CA-SG 3.31Å; C86-C125 HydrophobicContact CB-CB 3.76Å; C86-C125 WeakPolarHBondContact CB-SG 3.42Å; C86-C125 WeakPolarHBondContact SG-CA 3.33Å; C86-C125 WeakPolarHBondContact SG-CB 3.35Å; C86-C125 CovalentContact SG-SG 2.04Å; C86-C125 PolarHBondContact SG-SG 3.38Å; M120-C125 HydrophobicContact CE-CB 4.16Å; M120-C125 PolarHBondContact O-N 2.84Å; M120-C125 HydrophobicContact SD-CB 3.49Å; M120-C125 WeakPolarHBondContact SD-CB 3.45Å; R123-C125 PolarHBondContact O-N 3Å; R123-C125 VanDerWaalsContact O-N 3.16Å; C125-R127 PolarHBondContact O-N 2.04Å
126	S	86.4	Confident	76.3	Confident	68 Å²	68	82.5 Å²	82.5	48%	0.476	48%	0.483	S	S	.	.			trans	-60.3	136.8	167.7	177.3	0	0	0	0	110.8	R90 S124 D128	R90-S126 PolarHBondContact NE-O 2.01Å; S124-S126 PolarHBondContact O-N 3.35Å; S126-D128 VanDerWaalsContact C-N 3.3Å; S126-D128 WeakPolarHBondContact CB-O 3.43Å; S126-D128 PolarHBondContact OG-N 3.45Å; S126-D128 PolarHBondContact OG-O 3.29Å
127	R	81.3	Confident	73.6	Confident	196 Å²	196	90.5 Å²	90.5	74%	0.74	52%	0.52	S	S	*	.	S	Bend	trans	-65.7	-34	173.9	-80.3	-176.6	153.5	-163.8	-4.5	112.5	M120 C125	M120-R127 HydrophobicContact CE-CB 4.41Å; M120-R127 HydrophobicContact CE-CG 3.89Å; C125-R127 PolarHBondContact O-N 2.04Å
128	D	77.7	Confident	71.2	Confident	137 Å²	137	91.5 Å²	91.5	73%	0.733	52%	0.519	S	S	*	.	S	Bend	trans	-100.9	136.7	178.1	-58.6	-49.1	0	0	0	110.1	S126	S126-D128 VanDerWaalsContact C-N 3.3Å; S126-D128 WeakPolarHBondContact CB-O 3.43Å; S126-D128 PolarHBondContact OG-N 3.45Å; S126-D128 PolarHBondContact OG-O 3.29Å
129	G	74.3	Confident	68.9	Low	46 Å²	46	91.9 Å²	91.9	47%	0.474	53%	0.526	S	S	.	.	S	Bend	trans	156	177	-179.5	0	0	0	0	0	112.5	T131	G129-T131 PolarHBondContact O-N 2.94Å
130	P	75.7	Confident	66.8	Low	84 Å²	84	97.5 Å²	97.5	55%	0.545	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-60.2	134.5	178.4	25.1	-32.7	0	0	0	109.7	K87 R90	K87-P130 HydrophobicContact CG-CG 4.5Å; K87-P130 WeakPolarHBondContact CG-O 3.2Å; R90-P130 PolarHBondContact NH1-O 3.37Å
131	T	77.4	Confident	65.4	Low	73 Å²	73	99.1 Å²	99.1	45%	0.448	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-79.9	164.6	158.1	53.6	0	0	0	0	107.9	R90 A91 G129 S133	R90-T131 HydrophobicContact CB-CG2 4.17Å; A91-T131 HydrophobicContact CB-CG2 4.38Å; G129-T131 PolarHBondContact O-N 2.94Å; T131-S133 PolarHBondContact O-N 3.42Å
132	P	69.1	Low	64.2	Low	30 Å²	30	98.5 Å²	98.5	20%	0.195	55%	0.552	C	S	.	*	P	Polyproline II helix	trans	-49.8	135.5	168.5	-17.7	32.7	0	0	0	106	L70 K87 A91 A134	L70-P132 HydrophobicContact CD1-CG 4.08Å; L70-P132 HydrophobicContact CD2-CB 4.19Å; L70-P132 HydrophobicContact CD2-CG 4.11Å; K87-P132 HydrophobicContact CB-CG 4.21Å; K87-P132 WeakPolarHBondContact O-CD 3.37Å; A91-P132 HydrophobicContact CB-CG 4.31Å; P132-A134 PolarHBondContact O-N 3.26Å
133	S	53.3	Low	63.9	Low	105 Å²	105	93.1 Å²	93.1	73%	0.734	53%	0.527	S	S	*	.			trans	-42.9	126.9	169.5	-179.6	0	0	0	0	104.8	T131 H135	T131-S133 PolarHBondContact O-N 3.42Å; S133-H135 VanDerWaalsContact C-N 3.3Å; S133-H135 PolarHBondContact O-N 3Å
134	A	46.5	Very low	63.8	Low	86 Å²	86	90.8 Å²	90.8	71%	0.711	52%	0.522	S	S	*	.			trans	-42.6	115.9	163.1	0	0	0	0	0	103	P132	P132-A134 PolarHBondContact O-N 3.26Å
135	H	38	Very low	63.6	Low	146 Å²	146	85.8 Å²	85.8	68%	0.676	49%	0.486	S	S	*	.			trans	-40.2	123.4	173	-149.5	77.5	0	0	0	102.4	S133 E137	S133-H135 VanDerWaalsContact C-N 3.3Å; S133-H135 PolarHBondContact O-N 3Å; H135-E137 PolarHBondContact O-N 2.92Å
136	P	36.1	Very low	63.2	Low	96 Å²	96	89 Å²	89	62%	0.623	50%	0.5	S	S	*	.			trans	-48.8	113.5	164.3	20.2	-27.1	0	0	0	101.5	I138	P136-I138 PolarHBondContact O-N 3.23Å
137	E	34.8	Very low	62.7	Low	178 Å²	178	87 Å²	87	83%	0.832	49%	0.486	S	S	*	.			trans	-57.6	94.5	173.5	-82.4	-178.9	158.6	0	0	100.4	H135 P139	H135-E137 PolarHBondContact O-N 2.92Å; E137-P139 WeakPolarHBondContact O-CD 3.49Å
138	I	39.1	Very low	62.3	Low	93 Å²	93	81 Å²	81	48%	0.477	46%	0.463	S	S	.	.			trans	-54.6	110.7	161.8	-62.3	176.2	0	0	0	98.7	P136 H140	P136-I138 PolarHBondContact O-N 3.23Å; I138-H140 PolarHBondContact O-N 2.91Å
139	P	43.1	Very low	61.8	Low	95 Å²	95	75 Å²	75	62%	0.617	43%	0.432	S	S	*	.			trans	-53.2	114.5	-171.7	-24.3	33.3	0	0	0	104.8	E137 E141	E137-P139 WeakPolarHBondContact O-CD 3.49Å; P139-E141 PolarHBondContact O-N 3.38Å
140	H	46.8	Very low	61.3	Low	161 Å²	161	78 Å²	78	75%	0.745	43%	0.433	S	S	*	.			trans	-59.2	102.3	165.4	-77.9	-74.5	0	0	0	102.3	I138 P142	I138-H140 PolarHBondContact O-N 2.91Å; H140-P142 WeakPolarHBondContact O-CD 3.17Å
141	E	59.4	Low	60.3	Low	54 Å²	54	76.8 Å²	76.8	25%	0.252	42%	0.42	S	S	.	.			trans	-99.4	79.2	178.7	-161.7	178.3	122.2	0	0	103.9	P139 C143 N144 S147 V267	P139-E141 PolarHBondContact O-N 3.38Å; E141-C143 PolarHBondContact O-N 3.07Å; E141-N144 HydrophobicContact CB-CB 4.25Å; E141-N144 HydrophobicContact CG-CB 4Å; E141-N144 PolarHBondContact O-N 3.11Å; E141-N144 VanDerWaalsContact OE1-CB 3.25Å; E141-N144 WeakPolarHBondContact OE1-CB 3.15Å; E141-N144 PolarHBondContact OE1-ND2 2.97Å; E141-S147 PolarHBondContact O-OG 3.4Å; E141-V267 HydrophobicContact CG-CB 4.27Å; E141-V267 HydrophobicContact CG-CG2 4Å; E141-V267 WeakPolarHBondContact OE1-CB 3.39Å; E141-V267 VanDerWaalsContact OE1-CG1 3.23Å; E141-V267 WeakPolarHBondContact OE1-CG1 3.31Å; E141-V267 WeakPolarHBondContact OE1-CG2 3.3Å; E141-V267 WeakPolarHBondContact OE2-CG2 3.46Å
142	P	63.9	Low	59.1	Low	82 Å²	82	77.2 Å²	77.2	53%	0.532	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-21.2	-171.1	24.7	-36.3	0	0	0	111.6	H140 R148	H140-P142 WeakPolarHBondContact O-CD 3.17Å; P142-R148 PolarHBondContact O-NE 3.04Å; P142-R148 PolarHBondContact O-NH2 3.4Å
143	C	78.9	Confident	58.1	Low	7 Å²	7	80 Å²	80	5%	0.047	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	17.1	-175.7	-54.1	0	0	0	0	114.4	E141 G237 C238 A269 Y287	E141-C143 PolarHBondContact O-N 3.07Å; C143-G237 PolarHBondContact SG-O 2.86Å; C143-C238 WeakPolarHBondContact CA-SG 3.42Å; C143-C238 HydrophobicContact CB-CB 3.71Å; C143-C238 WeakPolarHBondContact CB-SG 3.4Å; C143-C238 WeakPolarHBondContact SG-CA 3.39Å; C143-C238 WeakPolarHBondContact SG-CB 3.38Å; C143-C238 CovalentContact SG-SG 2.05Å; C143-C238 PolarHBondContact SG-SG 2.88Å; C143-A269 HydrophobicContact CB-CB 3.91Å; C143-Y287 WeakPolarHBondContact O-CA 3.29Å; C143-Y287 WeakPolarHBondContact O-CB 3.32Å; C143-Y287 PolarHBondContact O-N 3.28Å
144	N	82.9	Confident	57.7	Low	45 Å²	45	79.5 Å²	79.5	24%	0.241	43%	0.426	C	S	.	.			trans	-115	116.2	168.8	-174.1	-31.3	0	0	0	108.9	E141 H146 S147 R148	E141-N144 HydrophobicContact CB-CB 4.25Å; E141-N144 HydrophobicContact CG-CB 4Å; E141-N144 PolarHBondContact O-N 3.11Å; E141-N144 VanDerWaalsContact OE1-CB 3.25Å; E141-N144 WeakPolarHBondContact OE1-CB 3.15Å; E141-N144 PolarHBondContact OE1-ND2 2.97Å; N144-H146 VanDerWaalsContact C-N 3.28Å; N144-H146 PolarHBondContact O-N 3.24Å; N144-H146 PolarHBondContact OD1-N 3.06Å; N144-H146 VanDerWaalsContact OD1-N 3.11Å; N144-S147 WeakPolarHBondContact CB-OG 3.34Å; N144-S147 PolarHBondContact O-N 2.87Å; N144-S147 PolarHBondContact O-OG 3.5Å; N144-R148 PolarHBondContact O-N 2.71Å; N144-R148 VanDerWaalsContact O-N 3.15Å
145	Y	84.1	Confident	57.4	Low	6 Å²	6	83.3 Å²	83.3	2%	0.024	43%	0.428	C	S	.	.	H	α-helix	trans	-58.6	-42.5	-177.8	173.9	-104.8	0	0	0	111.6	S147 R148 T149 P170 Y172 G286 G289 P308 E310	Y145-S147 PolarHBondContact O-N 3.06Å; Y145-R148 PolarHBondContact O-N 2.94Å; Y145-T149 HydrophobicContact CD1-CG2 4.5Å; Y145-T149 HydrophobicContact CD2-CG2 4.17Å; Y145-T149 HydrophobicContact CE1-CG2 4.02Å; Y145-T149 HydrophobicContact CE2-CG2 3.63Å; Y145-T149 WeakPolarHBondContact O-CG2 3.42Å; Y145-T149 PolarHBondContact O-N 3.34Å; Y145-T149 PolarHBondContact O-OG1 3.28Å; Y145-P170 HydrophobicContact CE1-CB 3.96Å; Y145-P170 HydrophobicContact CE1-CG 3.86Å; Y145-P170 VanDerWaalsContact OH-CB 3.31Å; Y145-P170 WeakPolarHBondContact OH-CB 3.38Å; Y145-Y172 WeakPolarHBondContact CE1-OH 3.38Å; Y145-G286 WeakPolarHBondContact CB-O 3.44Å; Y145-G286 PolarHBondContact N-O 3.36Å; Y145-G289 VanDerWaalsContact CB-N 3.33Å; Y145-P308 HydrophobicContact CD1-CG 4.16Å; Y145-P308 HydrophobicContact CE1-CB 4.01Å; Y145-P308 HydrophobicContact CE1-CG 3.5Å; Y145-P308 VanDerWaalsContact CE1-CG 3.5Å; Y145-P308 HydrophobicContact CE2-CB 4.39Å; Y145-P308 HydrophobicContact CE2-CG 4.1Å; Y145-P308 VanDerWaalsContact CZ-CG 3.48Å; Y145-P308 VanDerWaalsContact OH-CB 3.24Å; Y145-P308 WeakPolarHBondContact OH-CB 3.43Å; Y145-E310 WeakPolarHBondContact CE2-OE1 3.44Å; Y145-E310 PolarHBondContact OH-OE1 2.9Å; Y145-E310 PolarHBondContact OH-OE2 2.82Å
146	H	78.6	Confident	57.5	Low	82 Å²	82	79.9 Å²	79.9	38%	0.38	42%	0.421	S	S	.	.	H	α-helix	trans	-69.2	-32	-177.5	-66.4	-70.4	0	0	0	113.9	N144 T149 Q150 Y172	N144-H146 VanDerWaalsContact C-N 3.28Å; N144-H146 PolarHBondContact O-N 3.24Å; N144-H146 PolarHBondContact OD1-N 3.06Å; N144-H146 VanDerWaalsContact OD1-N 3.11Å; H146-T149 PolarHBondContact O-OG1 3.35Å; H146-Q150 WeakPolarHBondContact O-CB 3.37Å; H146-Q150 VanDerWaalsContact O-CG 3.23Å; H146-Q150 WeakPolarHBondContact O-CG 3.46Å; H146-Q150 PolarHBondContact O-N 3.17Å; H146-Q150 PolarHBondContact O-NE2 3.4Å; H146-Y172 AromaticContact CE1-CZ 3.95Å; H146-Y172 PolarHBondContact CE1-OH 3.48Å
147	S	75.4	Confident	57.7	Low	25 Å²	25	83.1 Å²	83.1	18%	0.175	43%	0.427	C	S	.	.	H	α-helix	trans	-69.9	-45.4	173.9	64.9	0	0	0	0	109.3	E141 N144 Y145 T149 Q150 H151	E141-S147 PolarHBondContact O-OG 3.4Å; N144-S147 WeakPolarHBondContact CB-OG 3.34Å; N144-S147 PolarHBondContact O-N 2.87Å; N144-S147 PolarHBondContact O-OG 3.5Å; Y145-S147 PolarHBondContact O-N 3.06Å; S147-T149 PolarHBondContact O-N 3.34Å; S147-Q150 PolarHBondContact O-N 3.19Å; S147-Q150 VanDerWaalsContact O-N 3.15Å; S147-H151 PolarHBondContact O-CD2 3.36Å; S147-H151 PolarHBondContact O-N 3.04Å; S147-H151 VanDerWaalsContact O-N 3.15Å
148	R	73.6	Confident	58.2	Low	70 Å²	70	78.9 Å²	78.9	26%	0.264	42%	0.417	S	S	.	.	H	α-helix	trans	-59.1	-48	-180	-163.5	-170.7	-56	148	1.4	112.4	P142 N144 Y145 Q150 H151 T152 Y235 Y287	P142-R148 PolarHBondContact O-NE 3.04Å; P142-R148 PolarHBondContact O-NH2 3.4Å; N144-R148 PolarHBondContact O-N 2.71Å; N144-R148 VanDerWaalsContact O-N 3.15Å; Y145-R148 PolarHBondContact O-N 2.94Å; R148-Q150 VanDerWaalsContact C-N 3.28Å; R148-Q150 PolarHBondContact O-N 3.12Å; R148-H151 PolarHBondContact O-N 3.37Å; R148-T152 PolarHBondContact O-N 3.03Å; R148-T152 PolarHBondContact O-OG1 3.14Å; R148-Y235 PolarHBondContact NH1-OH 3.05Å; R148-Y235 VanDerWaalsContact NH2-CE1 3.31Å; R148-Y235 PolarHBondContact NH2-OH 2.98Å; R148-Y287 PolarHBondContact NH2-O 3.05Å
149	T	66.6	Low	58.2	Low	12 Å²	12	83.2 Å²	83.2	7%	0.074	44%	0.435	C	S	.	.	H	α-helix	trans	-66.5	-29.4	178.6	56.7	0	0	0	0	112.6	Y145 H146 S147 T152 H153 P170	Y145-T149 HydrophobicContact CD1-CG2 4.5Å; Y145-T149 HydrophobicContact CD2-CG2 4.17Å; Y145-T149 HydrophobicContact CE1-CG2 4.02Å; Y145-T149 HydrophobicContact CE2-CG2 3.63Å; Y145-T149 WeakPolarHBondContact O-CG2 3.42Å; Y145-T149 PolarHBondContact O-N 3.34Å; Y145-T149 PolarHBondContact O-OG1 3.28Å; H146-T149 PolarHBondContact O-OG1 3.35Å; S147-T149 PolarHBondContact O-N 3.34Å; T149-T152 WeakPolarHBondContact CA-OG1 3.34Å; T149-T152 PolarHBondContact O-OG1 3.45Å; T149-T152 VanDerWaalsContact O-OG1 3.08Å; T149-H153 PolarHBondContact O-CD2 2.97Å; T149-P170 HydrophobicContact CG2-CG 4Å
150	Q	63.4	Low	57.7	Low	109 Å²	109	84.4 Å²	84.4	51%	0.509	45%	0.445	S	S	.	.	H	α-helix	trans	-71.3	-34.6	176.5	-78.6	174.4	64.7	0	0	112.3	H146 S147 R148 T154	H146-Q150 WeakPolarHBondContact O-CB 3.37Å; H146-Q150 VanDerWaalsContact O-CG 3.23Å; H146-Q150 WeakPolarHBondContact O-CG 3.46Å; H146-Q150 PolarHBondContact O-N 3.17Å; H146-Q150 PolarHBondContact O-NE2 3.4Å; S147-Q150 PolarHBondContact O-N 3.19Å; S147-Q150 VanDerWaalsContact O-N 3.15Å; R148-Q150 VanDerWaalsContact C-N 3.28Å; R148-Q150 PolarHBondContact O-N 3.12Å; Q150-T154 PolarHBondContact O-N 2.93Å; Q150-T154 PolarHBondContact O-OG1 3.12Å
151	H	55.2	Low	57.5	Low	57 Å²	57	86.6 Å²	86.6	26%	0.264	46%	0.456	S	S	.	.	H	α-helix	trans	-77.6	-33.8	-179.8	-72.4	-65.6	0	0	0	113.8	S147 R148 H153 T154 H155	S147-H151 PolarHBondContact O-CD2 3.36Å; S147-H151 PolarHBondContact O-N 3.04Å; S147-H151 VanDerWaalsContact O-N 3.15Å; R148-H151 PolarHBondContact O-N 3.37Å; H151-H153 VanDerWaalsContact C-N 3.31Å; H151-H153 PolarHBondContact O-N 2.98Å; H151-T154 WeakPolarHBondContact CA-OG1 3.5Å; H151-T154 PolarHBondContact O-N 2.91Å; H151-T154 PolarHBondContact O-OG1 3.31Å; H151-H155 PolarHBondContact O-CD2 2.91Å
152	T	51.6	Low	56.3	Low	82 Å²	82	86.7 Å²	86.7	50%	0.503	47%	0.471	S	S	.	.	H	α-helix	trans	-64.6	-35.6	175.4	45.4	0	0	0	0	112	R148 T149 S156	R148-T152 PolarHBondContact O-N 3.03Å; R148-T152 PolarHBondContact O-OG1 3.14Å; T149-T152 WeakPolarHBondContact CA-OG1 3.34Å; T149-T152 PolarHBondContact O-OG1 3.45Å; T149-T152 VanDerWaalsContact O-OG1 3.08Å; T152-S156 PolarHBondContact O-OG 3.35Å
153	H	48	Very low	55	Low	89 Å²	89	91.3 Å²	91.3	41%	0.412	49%	0.485	S	S	.	.	H	α-helix	trans	-78.6	-18.8	177.6	-66.3	-54	0	0	0	114.6	T149 H151 S156 H157	T149-H153 PolarHBondContact O-CD2 2.97Å; H151-H153 VanDerWaalsContact C-N 3.31Å; H151-H153 PolarHBondContact O-N 2.98Å; H153-S156 PolarHBondContact O-OG 3.39Å; H153-H157 PolarHBondContact O-CD2 2.97Å; H153-H157 VanDerWaalsContact O-CD2 3.3Å
154	T	44.9	Very low	53.2	Low	95 Å²	95	95.1 Å²	95.1	58%	0.583	53%	0.525	S	S	*	.	H	α-helix	trans	-78.5	-20.9	173.6	42.3	0	0	0	0	113.7	Q150 H151	Q150-T154 PolarHBondContact O-N 2.93Å; Q150-T154 PolarHBondContact O-OG1 3.12Å; H151-T154 WeakPolarHBondContact CA-OG1 3.5Å; H151-T154 PolarHBondContact O-N 2.91Å; H151-T154 PolarHBondContact O-OG1 3.31Å
155	H	41.9	Very low	51	Low	166 Å²	166	101.3 Å²	101.3	77%	0.769	55%	0.552	S	S	*	*	H	α-helix	trans	-95.2	-8.4	178.3	-73.6	-64.4	0	0	0	114.2	H151	H151-H155 PolarHBondContact O-CD2 2.91Å
156	S	38.4	Very low	48.9	Very low	74 Å²	74	105.7 Å²	105.7	52%	0.517	58%	0.584	S	S	.	*	S	Bend	trans	-94.1	7.2	180	55	0	0	0	0	114.9	T152 H153	T152-S156 PolarHBondContact O-OG 3.35Å; H153-S156 PolarHBondContact O-OG 3.39Å
157	H	41.9	Very low	47.2	Very low	164 Å²	164	112.2 Å²	112.2	76%	0.759	61%	0.605	S	S	*	*			trans	-102.1	71.8	176	-69.6	-54.8	0	0	0	112.2	H153	H153-H157 PolarHBondContact O-CD2 2.97Å; H153-H157 VanDerWaalsContact O-CD2 3.3Å
158	S	43.8	Very low	46	Very low	88 Å²	88	114.8 Å²	114.8	62%	0.615	62%	0.623	S	S	*	*	S	Bend	trans	-126.9	111.4	150.4	62.2	0	0	0	0	109
159	H	40.4	Very low	45.2	Very low	185 Å²	185	122.2 Å²	122.2	86%	0.856	65%	0.651	S	S	*	*	S	Bend	trans	87.1	82	166.8	-47.9	-64.8	0	0	0	118.5
160	S	32.2	Very low	45	Very low	119 Å²	119	122.7 Å²	122.7	83%	0.832	66%	0.655	S	S	*	*			trans	-168.9	115	131.9	49.1	0	0	0	0	110.3	G162	S160-G162 PolarHBondContact O-N 3.47Å
161	H	42.5	Very low	46.1	Very low	208 Å²	208	119 Å²	119	96%	0.963	65%	0.645	S	S	*	*			trans	-67.6	119.8	167.7	-74.9	-77.3	0	0	0	109.5
162	G	33.4	Very low	48	Very low	55 Å²	55	117.5 Å²	117.5	57%	0.567	64%	0.638	S	S	*	*			trans	165.6	104.7	171	0	0	0	0	0	113.1	S160	S160-G162 PolarHBondContact O-N 3.47Å
163	H	37.4	Very low	50.1	Low	180 Å²	180	115.1 Å²	115.1	83%	0.833	62%	0.622	S	S	*	*	S	Bend	trans	48.9	105.4	159.3	-64.8	-72	0	0	0	120.1	H165	H163-H165 PolarHBondContact O-CD2 3.38Å; H163-H165 PolarHBondContact O-N 2.92Å
164	G	41.3	Very low	52.5	Low	86 Å²	86	111 Å²	111	89%	0.887	60%	0.603	S	S	*	*			trans	31.2	74.3	142.9	0	0	0	0	0	118.5
165	H	37.1	Very low	55	Low	175 Å²	175	106.5 Å²	106.5	81%	0.81	58%	0.575	S	S	*	*			trans	-95.5	114.1	163.4	-78.7	-74	0	0	0	109.8	H163	H163-H165 PolarHBondContact O-CD2 3.38Å; H163-H165 PolarHBondContact O-N 2.92Å
166	S	39.4	Very low	57.7	Low	99 Å²	99	98.9 Å²	98.9	69%	0.692	54%	0.541	S	S	*	.			trans	-51.5	148.1	162.5	63.9	0	0	0	0	109.1	S168	S166-S168 VanDerWaalsContact C-N 3.28Å; S166-S168 PolarHBondContact O-N 2.89Å
167	R	44	Very low	60.5	Low	218 Å²	218	95.6 Å²	95.6	82%	0.823	52%	0.518	S	S	*	.			trans	-52.2	95.1	167	-72.7	162.3	72.2	148.5	1.3	107.9	R169	R167-R169 PolarHBondContact O-N 2.95Å
168	S	48.7	Very low	63.1	Low	80 Å²	80	88 Å²	88	56%	0.559	48%	0.482	S	S	*	.			trans	-68.6	97.6	-176.9	54.7	0	0	0	0	107.7	S166	S166-S168 VanDerWaalsContact C-N 3.28Å; S166-S168 PolarHBondContact O-N 2.89Å
169	R	56.8	Low	65.5	Low	226 Å²	226	84 Å²	84	85%	0.853	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-55.9	145.2	166.8	-76.8	-178.9	156	-179.4	-6	108.1	R167 G171	R167-R169 PolarHBondContact O-N 2.95Å; R169-G171 PolarHBondContact O-N 3.4Å
170	P	63.5	Low	67.5	Low	22 Å²	22	75.3 Å²	75.3	14%	0.143	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-52	132.3	175.2	-22.9	31.6	0	0	0	110	Y145 T149 Y172	Y145-P170 HydrophobicContact CE1-CB 3.96Å; Y145-P170 HydrophobicContact CE1-CG 3.86Å; Y145-P170 VanDerWaalsContact OH-CB 3.31Å; Y145-P170 WeakPolarHBondContact OH-CB 3.38Å; T149-P170 HydrophobicContact CG2-CG 4Å; P170-Y172 HydrophobicContact CB-CE2 4.29Å; P170-Y172 WeakPolarHBondContact O-CD2 3.24Å; P170-Y172 WeakPolarHBondContact O-CE2 3.42Å
171	G	86.6	Confident	70	Confident	30 Å²	30	69.6 Å²	69.6	31%	0.309	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-61.8	134.1	170.8	0	0	0	0	0	108.8	R169 P308 E309	R169-G171 PolarHBondContact O-N 3.4Å; G171-P308 CarbonylContact O-C 3.57Å; G171-P308 WeakPolarHBondContact O-CA 3.3Å; G171-E309 PolarHBondContact O-N 2.54Å
172	Y	94.3	Very high	72.5	Confident	27 Å²	27	59.7 Å²	59.7	11%	0.106	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	152.1	173.6	-77.8	-87.9	0	0	0	109.2	Y145 H146 P170 G289 R306 I307 P308 P411	Y145-Y172 WeakPolarHBondContact CE1-OH 3.38Å; H146-Y172 AromaticContact CE1-CZ 3.95Å; H146-Y172 PolarHBondContact CE1-OH 3.48Å; P170-Y172 HydrophobicContact CB-CE2 4.29Å; P170-Y172 WeakPolarHBondContact O-CD2 3.24Å; P170-Y172 WeakPolarHBondContact O-CE2 3.42Å; Y172-G289 WeakPolarHBondContact CE1-O 3.47Å; Y172-R306 HydrophobicContact CD1-CG 3.73Å; Y172-R306 HydrophobicContact CG-CG 4.28Å; Y172-I307 CarbonylContact C-O 3.56Å; Y172-I307 WeakPolarHBondContact CA-O 3.12Å; Y172-P308 HydrophobicContact CD1-CG 4.33Å; Y172-P308 HydrophobicContact CE1-CB 4.48Å; Y172-P308 HydrophobicContact CE1-CG 3.8Å; Y172-P411 WeakPolarHBondContact O-CG 3.46Å
173	L	96.3	Very high	75.5	Confident	31 Å²	31	57.1 Å²	57.1	16%	0.162	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	154.9	172.9	-56.7	175.8	0	0	0	109.3	F186 R306 I307 E309 A312	L173-F186 HydrophobicContact CB-CB 4.01Å; L173-F186 HydrophobicContact CB-CD1 3.61Å; L173-F186 HydrophobicContact CB-CE1 4.36Å; L173-F186 HydrophobicContact CB-CG 4Å; L173-F186 HydrophobicContact CD1-CB 3.95Å; L173-F186 HydrophobicContact CD1-CG 4.22Å; L173-F186 HydrophobicContact CG-CB 4.48Å; L173-R306 WeakPolarHBondContact O-CA 3.42Å; L173-I307 HydrophobicContact CB-CG2 4.25Å; L173-I307 PolarHBondContact N-O 3.32Å; L173-I307 PolarHBondContact O-N 3.38Å; L173-I307 VanDerWaalsContact O-N 3.08Å; L173-E309 HydrophobicContact CD1-CB 4.08Å; L173-E309 HydrophobicContact CD1-CG 4.08Å; L173-E309 HydrophobicContact CG-CB 4.04Å; L173-E309 HydrophobicContact CG-CG 4.42Å; L173-A312 HydrophobicContact CD1-CB 3.8Å
174	F	97.6	Very high	78.3	Confident	3 Å²	3	48.6 Å²	48.6	1%	0.013	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	134.7	-180	173.2	-92.6	0	0	0	110.5	R184 T185 F186 A304 V305 M406 L409 H410	F174-R184 HydrophobicContact CD1-CG 4.22Å; F174-R184 HydrophobicContact CE1-CB 4.46Å; F174-R184 HydrophobicContact CE1-CG 4.27Å; F174-T185 CarbonylContact O-C 3.53Å; F174-F186 WeakPolarHBondContact O-CA 3.36Å; F174-A304 HydrophobicContact CE2-CB 3.92Å; F174-A304 HydrophobicContact CZ-CB 4.14Å; F174-V305 WeakPolarHBondContact CA-O 3.11Å; F174-M406 HydrophobicContact CE1-CB 3.99Å; F174-M406 HydrophobicContact CE1-CG 4.21Å; F174-M406 HydrophobicContact CE2-CB 4.36Å; F174-M406 HydrophobicContact CZ-CB 3.74Å; F174-M406 HydrophobicContact CZ-CG 4.4Å; F174-L409 HydrophobicContact CD2-CB 3.64Å; F174-L409 HydrophobicContact CE2-CB 3.8Å; F174-L409 HydrophobicContact CE2-CD1 4.25Å; F174-H410 HydrophobicContact CB-CB 4.21Å; F174-H410 VanDerWaalsContact CB-CD2 3.45Å; F174-H410 WeakPolarHBondContact CB-CD2 3.49Å; F174-H410 AromaticContact CD1-CD2 3.82Å; F174-H410 HydrophobicContact CD2-CB 4.41Å; F174-H410 HydrophobicContact CG-CB 4.17Å; F174-H410 AromaticContact CG-CD2 3.78Å
175	C	98.1	Very high	80.9	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.007	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	144.5	168.3	-179.6	0	0	0	0	109.7	R184 F186 A304 V305 C324	C175-R184 CarbonylContact C-O 3.5Å; C175-R184 WeakPolarHBondContact CA-O 3.4Å; C175-R184 PolarHBondContact SG-O 3.12Å; C175-F186 HydrophobicContact CB-CD1 3.7Å; C175-F186 HydrophobicContact CB-CE1 3.38Å; C175-F186 HydrophobicContact CB-CZ 4.01Å; C175-A304 CarbonylContact O-C 3.59Å; C175-A304 WeakPolarHBondContact O-CA 3.45Å; C175-V305 PolarHBondContact N-O 3.33Å; C175-V305 PolarHBondContact O-N 3.08Å; C175-C324 HydrophobicContact CB-CB 3.64Å; C175-C324 WeakPolarHBondContact CB-SG 3.32Å; C175-C324 VanDerWaalsContact SG-CA 3.54Å; C175-C324 WeakPolarHBondContact SG-CB 3.41Å; C175-C324 CovalentContact SG-SG 2.03Å; C175-C324 PolarHBondContact SG-SG 3.34Å
176	G	97.8	Very high	83.6	Confident	6 Å²	6	36.6 Å²	36.6	6%	0.062	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	144.8	177.8	0	0	0	0	0	112.5	L183 R184 L303	G176-L183 WeakPolarHBondContact O-CA 3.42Å; G176-R184 PolarHBondContact N-O 3.31Å; G176-R184 PolarHBondContact O-N 2.96Å; G176-L303 CarbonylContact C-O 3.54Å; G176-L303 WeakPolarHBondContact CA-O 3.5Å
177	L	98.1	Very high	86.2	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	123.7	176.7	-164.4	81.9	0	0	0	109.6	P181 H182 L183 L201 V211 T225 T302 L303	L177-P181 HydrophobicContact CD1-CB 3.78Å; L177-P181 HydrophobicContact CD2-CB 4.36Å; L177-P181 HydrophobicContact CG-CB 3.95Å; L177-H182 WeakPolarHBondContact CA-O 3.16Å; L177-L183 HydrophobicContact CD1-CB 3.97Å; L177-L183 HydrophobicContact CD1-CD1 3.93Å; L177-L201 HydrophobicContact CB-CD2 4.04Å; L177-L201 HydrophobicContact CD2-CD1 4.21Å; L177-L201 HydrophobicContact CD2-CD2 4.08Å; L177-V211 HydrophobicContact CD2-CB 4.31Å; L177-V211 HydrophobicContact CD2-CG1 4.04Å; L177-V211 HydrophobicContact CD2-CG2 3.97Å; L177-T225 WeakPolarHBondContact CD2-OG1 3.43Å; L177-T302 WeakPolarHBondContact O-CA 3.39Å; L177-L303 HydrophobicContact CB-CB 4.39Å; L177-L303 PolarHBondContact N-O 3.12Å; L177-L303 PolarHBondContact O-N 3.35Å
178	F	96.8	Very high	88.5	Confident	4 Å²	4	29.2 Å²	29.2	2%	0.018	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	169.5	-178.9	68.1	-84.9	0	0	0	110.5	P181 H182 F190 T302 Y379 A399 A402	F178-P181 CarbonylContact O-C 3.27Å; F178-P181 WeakPolarHBondContact O-CA 3.37Å; F178-H182 HydrophobicContact CD1-CB 4.35Å; F178-H182 HydrophobicContact CD2-CB 4.47Å; F178-H182 HydrophobicContact CE1-CB 3.99Å; F178-H182 HydrophobicContact CE2-CB 4.11Å; F178-H182 AromaticContact CE2-CD2 3.68Å; F178-H182 HydrophobicContact CZ-CB 3.87Å; F178-H182 PolarHBondContact N-O 3Å; F178-H182 VanDerWaalsContact N-O 3.15Å; F178-H182 PolarHBondContact O-N 3.46Å; F178-F190 HydrophobicContact CE1-CE2 4.03Å; F178-F190 AromaticContact CE1-CZ 3.61Å; F178-F190 HydrophobicContact CE1-CZ 3.61Å; F178-F190 HydrophobicContact CZ-CE2 4.37Å; F178-F190 AromaticContact CZ-CZ 3.6Å; F178-F190 HydrophobicContact CZ-CZ 3.6Å; F178-T302 HydrophobicContact CB-CG2 3.76Å; F178-Y379 AromaticContact CE1-CD1 3.84Å; F178-Y379 HydrophobicContact CE1-CD1 3.84Å; F178-Y379 AromaticContact CE1-CE1 3.64Å; F178-Y379 HydrophobicContact CE1-CE1 3.64Å; F178-Y379 HydrophobicContact CE2-CD1 4.23Å; F178-Y379 AromaticContact CZ-CD1 3.46Å; F178-Y379 HydrophobicContact CZ-CD1 3.46Å; F178-Y379 VanDerWaalsContact CZ-CD1 3.46Å; F178-Y379 AromaticContact CZ-CE1 3.79Å; F178-Y379 HydrophobicContact CZ-CE1 3.79Å; F178-A399 HydrophobicContact CD2-CB 4.44Å; F178-A399 HydrophobicContact CE2-CB 4.06Å; F178-A402 HydrophobicContact CB-CB 3.77Å; F178-A402 HydrophobicContact CD1-CB 3.39Å; F178-A402 HydrophobicContact CD2-CB 3.88Å; F178-A402 HydrophobicContact CE1-CB 3.84Å; F178-A402 HydrophobicContact CE2-CB 4.29Å; F178-A402 HydrophobicContact CG-CB 3.39Å; F178-A402 HydrophobicContact CZ-CB 4.26Å
179	G	92.6	Very high	90.5	Very high	6 Å²	6	27.4 Å²	27.4	6%	0.062	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	-140.9	174.5	0	0	0	0	0	112.5	D386	G179-D386 VanDerWaalsContact CA-OD2 3.31Å; G179-D386 WeakPolarHBondContact CA-OD2 3.32Å
180	D	82.5	Confident	92.1	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	66	-172.8	74.2	-4.4	0	0	0	118.9	H182 T192 A222 T223 F385 D386 T389	D180-H182 IonicContact OD1-CE1 3.98Å; D180-H182 PolarHBondContact OD1-CE1 3.48Å; D180-H182 IonicContact OD1-ND1 3.25Å; D180-H182 IonicContact OD1-NE2 2.8Å; D180-H182 PolarHBondContact OD1-NE2 3.34Å; D180-T192 WeakPolarHBondContact OD1-CG2 3.49Å; D180-A222 HydrophobicContact CB-CB 4.05Å; D180-T223 CarbonylContact C-O 3.34Å; D180-T223 WeakPolarHBondContact CA-O 3.43Å; D180-T223 WeakPolarHBondContact CB-O 3.33Å; D180-F385 VanDerWaalsContact OD1-CD1 3.31Å; D180-F385 WeakPolarHBondContact OD1-CD1 3.31Å; D180-F385 WeakPolarHBondContact OD1-CE1 3.02Å; D180-F385 VanDerWaalsContact OD2-CD1 3.29Å; D180-F385 WeakPolarHBondContact OD2-CD1 3.28Å; D180-F385 WeakPolarHBondContact OD2-CE1 3.45Å; D180-D386 WeakPolarHBondContact CB-OD1 3.37Å; D180-D386 PolarHBondContact N-OD1 2.79Å; D180-D386 VanDerWaalsContact OD1-OD1 3.08Å; D180-T389 PolarHBondContact OD2-OG1 3.43Å
181	P	86.1	Confident	93.5	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn		-53	123.7	-80.9	29.1	-36.9	0	0	0	113.1	L177 F178 C193 V195 T223	L177-P181 HydrophobicContact CD1-CB 3.78Å; L177-P181 HydrophobicContact CD2-CB 4.36Å; L177-P181 HydrophobicContact CG-CB 3.95Å; F178-P181 CarbonylContact O-C 3.27Å; F178-P181 WeakPolarHBondContact O-CA 3.37Å; P181-C193 WeakPolarHBondContact CD-O 3.22Å; P181-C193 VanDerWaalsContact CG-O 3.29Å; P181-C193 WeakPolarHBondContact CG-O 3.45Å; P181-C193 PolarHBondContact O-N 2.79Å; P181-C193 VanDerWaalsContact O-N 3.08Å; P181-V195 HydrophobicContact CG-CG2 3.57Å; P181-T223 VanDerWaalsContact CD-O 3.32Å; P181-T223 WeakPolarHBondContact CD-O 3.47Å; P181-T223 WeakPolarHBondContact CD-OG1 3.44Å
182	H	94.4	Very high	93.7	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	123.9	163.2	-53.3	-58.7	0	0	0	110.5	L177 F178 D180 F190 Q191 T192 S382 F385 D386	L177-H182 WeakPolarHBondContact CA-O 3.16Å; F178-H182 HydrophobicContact CD1-CB 4.35Å; F178-H182 HydrophobicContact CD2-CB 4.47Å; F178-H182 HydrophobicContact CE1-CB 3.99Å; F178-H182 HydrophobicContact CE2-CB 4.11Å; F178-H182 AromaticContact CE2-CD2 3.68Å; F178-H182 HydrophobicContact CZ-CB 3.87Å; F178-H182 PolarHBondContact N-O 3Å; F178-H182 VanDerWaalsContact N-O 3.15Å; F178-H182 PolarHBondContact O-N 3.46Å; D180-H182 IonicContact OD1-CE1 3.98Å; D180-H182 PolarHBondContact OD1-CE1 3.48Å; D180-H182 IonicContact OD1-ND1 3.25Å; D180-H182 IonicContact OD1-NE2 2.8Å; D180-H182 PolarHBondContact OD1-NE2 3.34Å; H182-F190 HydrophobicContact CB-CE1 3.71Å; H182-F190 HydrophobicContact CB-CZ 3.7Å; H182-Q191 CarbonylContact C-O 3.51Å; H182-Q191 WeakPolarHBondContact CA-O 3.42Å; H182-T192 WeakPolarHBondContact ND1-CG2 3.36Å; H182-T192 PolarHBondContact ND1-OG1 3.12Å; H182-S382 WeakPolarHBondContact CD2-CB 3.35Å; H182-S382 VanDerWaalsContact NE2-CB 3.35Å; H182-S382 WeakPolarHBondContact NE2-CB 3.44Å; H182-S382 PolarHBondContact NE2-O 2.85Å; H182-F385 AromaticContact CE1-CD1 3.77Å; H182-D386 IonicContact CD2-OD1 3.67Å; H182-D386 IonicContact CD2-OD2 3.03Å; H182-D386 IonicContact NE2-OD1 2.81Å; H182-D386 PolarHBondContact NE2-OD1 3.28Å; H182-D386 IonicContact NE2-OD2 3.51Å; H182-D386 PolarHBondContact NE2-OD2 3.42Å
183	L	96.1	Very high	93.5	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	121.4	-177.9	174.3	67.2	0	0	0	110.3	G176 L177 T185 F190 Q191 L323 C328	G176-L183 WeakPolarHBondContact O-CA 3.42Å; L177-L183 HydrophobicContact CD1-CB 3.97Å; L177-L183 HydrophobicContact CD1-CD1 3.93Å; L183-T185 HydrophobicContact CD2-CG2 4.1Å; L183-T185 HydrophobicContact CG-CG2 4.12Å; L183-F190 WeakPolarHBondContact O-CA 3.41Å; L183-Q191 PolarHBondContact N-O 3.1Å; L183-Q191 PolarHBondContact O-N 3.22Å; L183-L323 HydrophobicContact CD1-CB 4.49Å; L183-L323 HydrophobicContact CD2-CB 3.84Å; L183-L323 WeakPolarHBondContact CD2-O 3.16Å; L183-C328 VanDerWaalsContact CD2-SG 3.59Å
184	R	95.8	Very high	93.2	Very high	1 Å²	1	16.8 Å²	16.8	0%	0.004	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	114.9	160.6	-178.4	162.3	172.3	162.5	2.9	109	F174 C175 G176 D188 S189 F190 Y379 H410 R415 W416	F174-R184 HydrophobicContact CD1-CG 4.22Å; F174-R184 HydrophobicContact CE1-CB 4.46Å; F174-R184 HydrophobicContact CE1-CG 4.27Å; C175-R184 CarbonylContact C-O 3.5Å; C175-R184 WeakPolarHBondContact CA-O 3.4Å; C175-R184 PolarHBondContact SG-O 3.12Å; G176-R184 PolarHBondContact N-O 3.31Å; G176-R184 PolarHBondContact O-N 2.96Å; R184-D188 IonicContact CZ-OD1 3.82Å; R184-D188 VanDerWaalsContact CZ-OD1 3.32Å; R184-D188 IonicContact NE-OD1 2.94Å; R184-D188 PolarHBondContact NE-OD1 3.03Å; R184-D188 IonicContact NH2-OD1 3.89Å; R184-D188 PolarHBondContact NH2-OD1 2.98Å; R184-S189 WeakPolarHBondContact CA-O 3.5Å; R184-F190 HydrophobicContact CB-CD2 3.72Å; R184-F190 HydrophobicContact CB-CE2 3.77Å; R184-F190 HydrophobicContact CG-CD2 4.25Å; R184-Y379 PolarHBondContact NH1-OH 3.45Å; R184-H410 PolarHBondContact NH2-CD2 3.39Å; R184-H410 PolarHBondContact NH2-NE2 3.14Å; R184-R415 PolarHBondContact NH2-O 2.83Å; R184-W416 PolarHBondContact NH1-O 2.85Å
185	T	95.9	Very high	93	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.006	8%	0.084	C	C	.	.			trans	-78.5	166.6	177.2	63.9	0	0	0	0	112.2	F174 L183 K187 D188 S189 C324	F174-T185 CarbonylContact O-C 3.53Å; L183-T185 HydrophobicContact CD2-CG2 4.1Å; L183-T185 HydrophobicContact CG-CG2 4.12Å; T185-K187 PolarHBondContact O-N 2.82Å; T185-K187 VanDerWaalsContact O-N 3.16Å; T185-K187 PolarHBondContact OG1-N 3.04Å; T185-D188 PolarHBondContact O-N 2.93Å; T185-S189 WeakPolarHBondContact CG2-OG 3.39Å; T185-S189 PolarHBondContact N-O 2.94Å; T185-S189 WeakPolarHBondContact OG1-CA 3.07Å; T185-S189 WeakPolarHBondContact OG1-CB 3.42Å; T185-S189 PolarHBondContact OG1-N 3.44Å; T185-S189 PolarHBondContact OG1-O 3Å; T185-S189 VanDerWaalsContact OG1-O 3.06Å; T185-S189 PolarHBondContact OG1-OG 2.8Å; T185-C324 CarbonylContact C-O 3.5Å; T185-C324 WeakPolarHBondContact CA-O 3.32Å; T185-C324 VanDerWaalsContact CB-O 3.29Å; T185-C324 WeakPolarHBondContact CB-O 3.05Å
186	F	95.4	Very high	92.8	Very high	9 Å²	9	21 Å²	21	4%	0.039	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.5	171.9	-66.4	-41.9	0	0	0	114.2	L173 F174 C175 D188 I202 I307 A312 C324 L325	L173-F186 HydrophobicContact CB-CB 4.01Å; L173-F186 HydrophobicContact CB-CD1 3.61Å; L173-F186 HydrophobicContact CB-CE1 4.36Å; L173-F186 HydrophobicContact CB-CG 4Å; L173-F186 HydrophobicContact CD1-CB 3.95Å; L173-F186 HydrophobicContact CD1-CG 4.22Å; L173-F186 HydrophobicContact CG-CB 4.48Å; F174-F186 WeakPolarHBondContact O-CA 3.36Å; C175-F186 HydrophobicContact CB-CD1 3.7Å; C175-F186 HydrophobicContact CB-CE1 3.38Å; C175-F186 HydrophobicContact CB-CZ 4.01Å; F186-D188 PolarHBondContact O-N 3.08Å; F186-I202 HydrophobicContact CE2-CG1 4.36Å; F186-I202 HydrophobicContact CZ-CD1 3.79Å; F186-I202 HydrophobicContact CZ-CG1 4.05Å; F186-I307 HydrophobicContact CD1-CG2 4.09Å; F186-I307 HydrophobicContact CE1-CG2 3.33Å; F186-I307 HydrophobicContact CE2-CG2 4.27Å; F186-I307 HydrophobicContact CZ-CG2 3.45Å; F186-I307 VanDerWaalsContact CZ-CG2 3.45Å; F186-A312 HydrophobicContact CD2-CB 4.22Å; F186-A312 HydrophobicContact CE2-CB 4.09Å; F186-C324 HydrophobicContact CD2-CB 3.86Å; F186-C324 WeakPolarHBondContact CD2-O 3.38Å; F186-C324 HydrophobicContact CE1-CB 4.26Å; F186-C324 HydrophobicContact CE2-CB 3.48Å; F186-C324 VanDerWaalsContact CE2-CB 3.48Å; F186-C324 HydrophobicContact CG-CB 4.39Å; F186-C324 WeakPolarHBondContact CG-O 3.14Å; F186-C324 HydrophobicContact CZ-CB 3.69Å; F186-C324 PolarHBondContact N-O 3.15Å; F186-L325 HydrophobicContact CD2-CD1 4.5Å
187	K	92.9	Very high	92.7	Very high	133 Å²	133	22 Å²	22	58%	0.578	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.2	11.2	176.3	-64.8	170.8	-178.1	152.3	0	112.6	T185 S189 L325	T185-K187 PolarHBondContact O-N 2.82Å; T185-K187 VanDerWaalsContact O-N 3.16Å; T185-K187 PolarHBondContact OG1-N 3.04Å; K187-S189 PolarHBondContact O-N 2.93Å; K187-S189 VanDerWaalsContact O-N 3.07Å; K187-L325 WeakPolarHBondContact CE-O 3.43Å; K187-L325 PolarHBondContact NZ-O 2.86Å
188	D	91.9	Very high	92.7	Very high	28 Å²	28	24.5 Å²	24.5	15%	0.15	14%	0.136	C	C	.	.	S	Bend	trans	57.7	17.3	-172.8	-66.6	-47.6	0	0	0	114.3	R184 T185 F186 H410 R415 I418	R184-D188 IonicContact CZ-OD1 3.82Å; R184-D188 VanDerWaalsContact CZ-OD1 3.32Å; R184-D188 IonicContact NE-OD1 2.94Å; R184-D188 PolarHBondContact NE-OD1 3.03Å; R184-D188 IonicContact NH2-OD1 3.89Å; R184-D188 PolarHBondContact NH2-OD1 2.98Å; T185-D188 PolarHBondContact O-N 2.93Å; F186-D188 PolarHBondContact O-N 3.08Å; D188-H410 IonicContact OD1-CD2 2.69Å; D188-H410 IonicContact OD1-CE1 2.82Å; D188-H410 IonicContact OD1-NE2 3.95Å; D188-H410 PolarHBondContact OD1-NE2 3.02Å; D188-H410 IonicContact OD2-NE2 2.65Å; D188-R415 WeakPolarHBondContact OD2-CD 3.26Å; D188-R415 IonicContact OD2-NH1 3.62Å; D188-I418 VanDerWaalsContact O-CD1 3.3Å; D188-I418 WeakPolarHBondContact O-CD1 3.43Å
189	S	90.8	Very high	92.7	Very high	43 Å²	43	26.3 Å²	26.3	30%	0.301	14%	0.142	S	C	.	.			trans	-76.7	139.8	169.3	84.4	0	0	0	0	109.9	R184 T185 K187 Q191	R184-S189 WeakPolarHBondContact CA-O 3.5Å; T185-S189 WeakPolarHBondContact CG2-OG 3.39Å; T185-S189 PolarHBondContact N-O 2.94Å; T185-S189 WeakPolarHBondContact OG1-CA 3.07Å; T185-S189 WeakPolarHBondContact OG1-CB 3.42Å; T185-S189 PolarHBondContact OG1-N 3.44Å; T185-S189 PolarHBondContact OG1-O 3Å; T185-S189 VanDerWaalsContact OG1-O 3.06Å; T185-S189 PolarHBondContact OG1-OG 2.8Å; K187-S189 PolarHBondContact O-N 2.93Å; K187-S189 VanDerWaalsContact O-N 3.07Å; S189-Q191 PolarHBondContact OG-NE2 3.09Å
190	F	91.9	Very high	92.9	Very high	25 Å²	25	27.7 Å²	27.7	11%	0.11	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.4	-177.4	-150.8	-92.9	0	0	0	110	F178 H182 L183 R184 I378 S382	F178-F190 HydrophobicContact CE1-CE2 4.03Å; F178-F190 AromaticContact CE1-CZ 3.61Å; F178-F190 HydrophobicContact CE1-CZ 3.61Å; F178-F190 HydrophobicContact CZ-CE2 4.37Å; F178-F190 AromaticContact CZ-CZ 3.6Å; F178-F190 HydrophobicContact CZ-CZ 3.6Å; H182-F190 HydrophobicContact CB-CE1 3.71Å; H182-F190 HydrophobicContact CB-CZ 3.7Å; L183-F190 WeakPolarHBondContact O-CA 3.41Å; R184-F190 HydrophobicContact CB-CD2 3.72Å; R184-F190 HydrophobicContact CB-CE2 3.77Å; R184-F190 HydrophobicContact CG-CD2 4.25Å; F190-I378 HydrophobicContact CD1-CB 4.24Å; F190-I378 HydrophobicContact CD1-CD1 4.33Å; F190-I378 HydrophobicContact CD1-CG2 4.26Å; F190-I378 HydrophobicContact CD2-CD1 3.24Å; F190-I378 HydrophobicContact CD2-CG1 4.48Å; F190-I378 HydrophobicContact CE1-CB 4.28Å; F190-I378 HydrophobicContact CE1-CD1 4.38Å; F190-I378 HydrophobicContact CE2-CD1 3.31Å; F190-I378 HydrophobicContact CE2-CG1 4.47Å; F190-I378 HydrophobicContact CG-CB 4.39Å; F190-I378 HydrophobicContact CG-CD1 3.79Å; F190-I378 HydrophobicContact CG-CG2 4.28Å; F190-I378 HydrophobicContact CZ-CB 4.49Å; F190-I378 HydrophobicContact CZ-CD1 3.91Å; F190-S382 WeakPolarHBondContact CE1-OG 3.16Å
191	Q	91.3	Very high	93.6	Very high	14 Å²	14	27.7 Å²	27.7	7%	0.065	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	145.4	-172.1	-57.9	178.1	11.1	0	0	109.9	H182 L183 S189 G327	H182-Q191 CarbonylContact C-O 3.51Å; H182-Q191 WeakPolarHBondContact CA-O 3.42Å; L183-Q191 PolarHBondContact N-O 3.1Å; L183-Q191 PolarHBondContact O-N 3.22Å; S189-Q191 PolarHBondContact OG-NE2 3.09Å; Q191-G327 VanDerWaalsContact OE1-CA 3.32Å
192	T	90.8	Very high	94.2	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.012	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.4	169.6	-53	0	0	0	0	109.3	D180 H182 I334 L340 F385	D180-T192 WeakPolarHBondContact OD1-CG2 3.49Å; H182-T192 WeakPolarHBondContact ND1-CG2 3.36Å; H182-T192 PolarHBondContact ND1-OG1 3.12Å; T192-I334 HydrophobicContact CG2-CB 4.34Å; T192-I334 HydrophobicContact CG2-CD1 4.32Å; T192-I334 PolarHBondContact O-N 2.96Å; T192-L340 WeakPolarHBondContact OG1-CD2 3.29Å; T192-F385 HydrophobicContact CG2-CD1 4.42Å; T192-F385 HydrophobicContact CG2-CE1 3.87Å
193	C	91.2	Very high	94.2	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.007	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-127.9	140	-164.6	-53.5	0	0	0	0	111.8	P181 V195 C328 E332	P181-C193 WeakPolarHBondContact CD-O 3.22Å; P181-C193 VanDerWaalsContact CG-O 3.29Å; P181-C193 WeakPolarHBondContact CG-O 3.45Å; P181-C193 PolarHBondContact O-N 2.79Å; P181-C193 VanDerWaalsContact O-N 3.08Å; C193-V195 HydrophobicContact CB-CB 4.38Å; C193-V195 HydrophobicContact CB-CG1 3.91Å; C193-V195 HydrophobicContact CB-CG2 3.66Å; C193-C328 HydrophobicContact CB-CB 3.8Å; C193-C328 WeakPolarHBondContact CB-SG 3.25Å; C193-C328 WeakPolarHBondContact SG-CB 3.35Å; C193-C328 CovalentContact SG-SG 2.01Å; C193-C328 PolarHBondContact SG-SG 3.27Å; C193-E332 CarbonylContact C-O 3.5Å; C193-E332 VanDerWaalsContact CA-O 3.31Å; C193-E332 WeakPolarHBondContact CA-O 3.24Å
194	K	90.4	Very high	94.1	Very high	71 Å²	71	29.9 Å²	29.9	31%	0.309	16%	0.162	S	C	.	.			trans	-70	-60.8	169.6	-174.6	-170	179.9	-149.4	0	109.9	E196 T223 E332 I334	K194-E196 WeakPolarHBondContact CE-OE2 3.38Å; K194-E196 IonicContact NZ-OE2 3.54Å; K194-E196 PolarHBondContact NZ-OE2 3.48Å; K194-E196 PolarHBondContact O-N 2.93Å; K194-T223 HydrophobicContact CG-CG2 3.98Å; K194-T223 WeakPolarHBondContact O-CB 3.35Å; K194-T223 WeakPolarHBondContact O-CG2 3.36Å; K194-T223 PolarHBondContact O-OG1 3.23Å; K194-E332 PolarHBondContact N-O 2.85Å; K194-I334 HydrophobicContact CB-CD1 4.27Å; K194-I334 HydrophobicContact CB-CG1 4.27Å
195	V	92.1	Very high	94	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.184	C	C	.	.			trans	38.9	51.4	173.7	-70.4	0	0	0	0	112.9	P181 C193 W199 N213 L323 C328 E332	P181-V195 HydrophobicContact CG-CG2 3.57Å; C193-V195 HydrophobicContact CB-CB 4.38Å; C193-V195 HydrophobicContact CB-CG1 3.91Å; C193-V195 HydrophobicContact CB-CG2 3.66Å; V195-W199 VanDerWaalsContact C-CD1 3.47Å; V195-W199 HydrophobicContact CB-CD2 4.01Å; V195-W199 HydrophobicContact CB-CG 3.93Å; V195-W199 HydrophobicContact CG1-CD2 4Å; V195-W199 HydrophobicContact CG1-CE3 4.34Å; V195-W199 HydrophobicContact CG1-CG 4.33Å; V195-W199 HydrophobicContact CG1-CZ2 4.38Å; V195-W199 PolarHBondContact O-NE1 2.85Å; V195-W199 VanDerWaalsContact O-NE1 3.11Å; V195-N213 WeakPolarHBondContact CG2-ND2 3.31Å; V195-N213 WeakPolarHBondContact O-CB 3.48Å; V195-N213 PolarHBondContact O-ND2 2.84Å; V195-L323 HydrophobicContact CG1-CD1 4.28Å; V195-L323 HydrophobicContact CG1-CD2 4.42Å; V195-C328 HydrophobicContact CG1-CB 4.23Å; V195-E332 WeakPolarHBondContact CA-OE2 3.42Å; V195-E332 HydrophobicContact CG1-CB 3.93Å; V195-E332 HydrophobicContact CG1-CG 4.29Å; V195-E332 PolarHBondContact N-OE2 3.04Å
196	E	94.6	Very high	93.9	Very high	91 Å²	91	37.4 Å²	37.4	43%	0.425	20%	0.198	S	C	.	.			trans	-67.4	140.3	179.7	-175	-179.2	170.3	0	0	110.6	K194 W199 P215 T223	K194-E196 WeakPolarHBondContact CE-OE2 3.38Å; K194-E196 IonicContact NZ-OE2 3.54Å; K194-E196 PolarHBondContact NZ-OE2 3.48Å; K194-E196 PolarHBondContact O-N 2.93Å; E196-W199 PolarHBondContact O-NE1 3.4Å; E196-P215 HydrophobicContact CG-CG 4.31Å; E196-T223 HydrophobicContact CB-CG2 4.24Å
197	G	96	Very high	94	Very high	28 Å²	28	37 Å²	37	29%	0.289	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	85.1	-152.2	-177.2	0	0	0	0	0	112.8	T212 N213	G197-T212 CarbonylContact O-C 3.55Å; G197-T212 VanDerWaalsContact O-CA 3.24Å; G197-T212 WeakPolarHBondContact O-CA 3.4Å; G197-N213 PolarHBondContact N-O 3.44Å; G197-N213 PolarHBondContact O-N 3.46Å
198	A	97.1	Very high	94.2	Very high	57 Å²	57	31.7 Å²	31.7	47%	0.471	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.7	-172.8	0	0	0	0	0	112.3	V211	A198-V211 CarbonylContact C-O 3.56Å; A198-V211 VanDerWaalsContact CA-O 3.31Å; A198-V211 WeakPolarHBondContact CA-O 3.34Å
199	W	97.6	Very high	94.5	Very high	41 Å²	41	30.4 Å²	30.4	16%	0.155	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	138.5	-178.2	-68.7	84.4	0	0	0	113	V195 E196 Q210 V211 L321 L323 P329 E332	V195-W199 VanDerWaalsContact C-CD1 3.47Å; V195-W199 HydrophobicContact CB-CD2 4.01Å; V195-W199 HydrophobicContact CB-CG 3.93Å; V195-W199 HydrophobicContact CG1-CD2 4Å; V195-W199 HydrophobicContact CG1-CE3 4.34Å; V195-W199 HydrophobicContact CG1-CG 4.33Å; V195-W199 HydrophobicContact CG1-CZ2 4.38Å; V195-W199 PolarHBondContact O-NE1 2.85Å; V195-W199 VanDerWaalsContact O-NE1 3.11Å; E196-W199 PolarHBondContact O-NE1 3.4Å; W199-Q210 WeakPolarHBondContact O-CA 3.42Å; W199-V211 HydrophobicContact CB-CG2 4.41Å; W199-V211 PolarHBondContact N-O 3.34Å; W199-V211 PolarHBondContact O-N 3.24Å; W199-L321 HydrophobicContact CE3-CD1 4.49Å; W199-L321 HydrophobicContact CE3-CD2 4.08Å; W199-L321 HydrophobicContact CZ3-CD1 4.17Å; W199-L321 HydrophobicContact CZ3-CD2 3.95Å; W199-L323 HydrophobicContact CB-CD1 3.8Å; W199-L323 HydrophobicContact CG-CD1 4.44Å; W199-P329 HydrophobicContact CH2-CG 4.37Å; W199-P329 HydrophobicContact CZ3-CG 4.02Å; W199-E332 HydrophobicContact CH2-CG 3.85Å; W199-E332 HydrophobicContact CZ2-CG 4.01Å
200	P	97	Very high	94.9	Very high	36 Å²	36	32.9 Å²	32.9	23%	0.234	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	116.9	174.3	31.6	-34.6	0	0	0	111.3	L321 L323	P200-L321 HydrophobicContact CG-CB 4.38Å; P200-L321 HydrophobicContact CG-CD2 4.02Å; P200-L321 HydrophobicContact CG-CG 3.9Å; P200-L321 WeakPolarHBondContact CG-O 3.29Å; P200-L323 PolarHBondContact O-N 3.11Å
201	L	97.3	Very high	95.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-46.5	171	-101.6	69.4	0	0	0	111.6	L177 V209 V211 L303 L323 C324	L177-L201 HydrophobicContact CB-CD2 4.04Å; L177-L201 HydrophobicContact CD2-CD1 4.21Å; L177-L201 HydrophobicContact CD2-CD2 4.08Å; L201-V209 HydrophobicContact CB-CB 4.24Å; L201-V209 HydrophobicContact CB-CG1 4.05Å; L201-V209 PolarHBondContact N-O 3.16Å; L201-V211 HydrophobicContact CD1-CB 4.1Å; L201-V211 HydrophobicContact CD1-CG1 3.72Å; L201-V211 HydrophobicContact CD1-CG2 3.31Å; L201-V211 HydrophobicContact CD2-CG1 4.06Å; L201-V211 HydrophobicContact CG-CG1 4.46Å; L201-L303 HydrophobicContact CD2-CD2 3.37Å; L201-L323 HydrophobicContact CD1-CB 4.34Å; L201-L323 HydrophobicContact CD1-CD1 3.83Å; L201-L323 HydrophobicContact CG-CB 4.32Å; L201-L323 PolarHBondContact O-N 2.71Å; L201-C324 VanDerWaalsContact O-CB 3.22Å; L201-C324 WeakPolarHBondContact O-CB 3.37Å; L201-C324 PolarHBondContact O-N 3.39Å
202	I	97.5	Very high	95.5	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	132.4	177.9	-57.5	172.2	0	0	0	105.8	F186 L207 S208 V209 V305 C324	F186-I202 HydrophobicContact CE2-CG1 4.36Å; F186-I202 HydrophobicContact CZ-CD1 3.79Å; F186-I202 HydrophobicContact CZ-CG1 4.05Å; I202-L207 HydrophobicContact CD1-CD2 4.21Å; I202-L207 HydrophobicContact CG2-CD2 4.47Å; I202-S208 CarbonylContact O-C 3.55Å; I202-S208 WeakPolarHBondContact O-CA 3.5Å; I202-V209 HydrophobicContact CB-CB 4.07Å; I202-V209 HydrophobicContact CB-CG2 4.08Å; I202-V209 HydrophobicContact CD1-CG2 4.04Å; I202-V209 HydrophobicContact CG1-CB 4.4Å; I202-V209 HydrophobicContact CG1-CG2 4.37Å; I202-V209 PolarHBondContact N-O 3.05Å; I202-V209 PolarHBondContact O-N 2.89Å; I202-V305 HydrophobicContact CD1-CB 4.25Å; I202-V305 HydrophobicContact CD1-CG1 3.75Å; I202-V305 HydrophobicContact CD1-CG2 4.17Å; I202-C324 HydrophobicContact CG1-CB 4.02Å
203	D	95.5	Very high	95.8	Very high	45 Å²	45	32.5 Å²	32.5	24%	0.241	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	93	167.7	-174.1	37.7	0	0	0	108.5	S208 K233 Q319 Q322	D203-S208 PolarHBondContact OD1-OG 2.97Å; D203-K233 IonicContact OD1-NZ 3.3Å; D203-K233 PolarHBondContact OD1-NZ 2.79Å; D203-Q319 VanDerWaalsContact O-CD 3.29Å; D203-Q319 PolarHBondContact O-NE2 2.87Å; D203-Q319 VanDerWaalsContact O-NE2 3.15Å; D203-Q319 PolarHBondContact O-OE1 2.86Å; D203-Q319 PolarHBondContact OD1-NE2 2.87Å; D203-Q319 PolarHBondContact OD2-NE2 2.03Å; D203-Q322 HydrophobicContact CB-CG 4.22Å; D203-Q322 PolarHBondContact O-NE2 3.09Å; D203-Q322 PolarHBondContact O-OE1 2.96Å
204	N	93.8	Very high	95.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	-129.4	-178.1	-177	74.1	15.9	0	0	0	109.9	Y206 L207 K233 L311 A314	N204-Y206 PolarHBondContact O-N 2.95Å; N204-Y206 PolarHBondContact OD1-N 2.93Å; N204-L207 PolarHBondContact N-O 3.01Å; N204-L207 VanDerWaalsContact N-O 3.09Å; N204-L207 PolarHBondContact OD1-N 3.49Å; N204-L207 PolarHBondContact OD1-O 3.41Å; N204-K233 WeakPolarHBondContact O-CE 3.19Å; N204-K233 PolarHBondContact O-NZ 3.12Å; N204-L311 PolarHBondContact ND2-O 3.22Å; N204-A314 WeakPolarHBondContact CB-O 3.39Å
205	D	93.3	Very high	96	Very high	89 Å²	89	33.3 Å²	33.3	48%	0.476	19%	0.188	S	C	.	.	S	Bend	trans	-60	-17.8	-175.3	-68.5	-20.4	0	0	0	114.9	K233 A314	D205-K233 VanDerWaalsContact O-CD 3.23Å; D205-K233 WeakPolarHBondContact O-CD 3.49Å; D205-A314 PolarHBondContact N-O 3.38Å
206	Y	94.1	Very high	95.7	Very high	72 Å²	72	34.6 Å²	34.6	28%	0.282	20%	0.195	S	C	.	.	S	Bend	trans	-116.7	-27.7	-169.9	-55.2	-82.7	0	0	0	114.2	N204 K233 Y235 I288 L311 A314	N204-Y206 PolarHBondContact O-N 2.95Å; N204-Y206 PolarHBondContact OD1-N 2.93Å; Y206-K233 WeakPolarHBondContact O-CB 3.43Å; Y206-K233 PolarHBondContact O-N 2.77Å; Y206-Y235 HydrophobicContact CD1-CD2 4.24Å; Y206-Y235 HydrophobicContact CD1-CE2 4.34Å; Y206-Y235 HydrophobicContact CE1-CD2 4.38Å; Y206-Y235 HydrophobicContact CE1-CE2 4.07Å; Y206-I288 HydrophobicContact CD1-CG2 4.1Å; Y206-I288 HydrophobicContact CG-CG2 4.47Å; Y206-L311 HydrophobicContact CD2-CB 4.3Å; Y206-L311 HydrophobicContact CD2-CD2 3.85Å; Y206-L311 HydrophobicContact CD2-CG 4.5Å; Y206-L311 HydrophobicContact CE1-CD2 4.42Å; Y206-L311 HydrophobicContact CE2-CD2 3.52Å; Y206-L311 HydrophobicContact CG-CD2 4.43Å; Y206-A314 HydrophobicContact CD2-CB 4.41Å; Y206-A314 HydrophobicContact CE2-CB 3.74Å
207	L	96.8	Very high	95	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	131.8	-167.6	-169.6	74.1	0	0	0	110.4	I202 N204 V209 I230 F232 V290	I202-L207 HydrophobicContact CD1-CD2 4.21Å; I202-L207 HydrophobicContact CG2-CD2 4.47Å; N204-L207 PolarHBondContact N-O 3.01Å; N204-L207 VanDerWaalsContact N-O 3.09Å; N204-L207 PolarHBondContact OD1-N 3.49Å; N204-L207 PolarHBondContact OD1-O 3.41Å; L207-V209 HydrophobicContact CD2-CG2 3.76Å; L207-V209 HydrophobicContact CG-CG2 3.92Å; L207-I230 HydrophobicContact CD1-CG2 3.73Å; L207-F232 HydrophobicContact CD1-CD1 3.6Å; L207-F232 HydrophobicContact CD1-CE1 3.66Å; L207-F232 HydrophobicContact CD1-CG 4.24Å; L207-F232 HydrophobicContact CD1-CZ 4.34Å; L207-V290 HydrophobicContact CD2-CG1 4.07Å
208	S	97.5	Very high	94.2	Very high	21 Å²	21	38.2 Å²	38.2	15%	0.147	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	124.8	166.1	-54.1	0	0	0	0	109.2	I202 D203 I230 I231 K233	I202-S208 CarbonylContact O-C 3.55Å; I202-S208 WeakPolarHBondContact O-CA 3.5Å; D203-S208 PolarHBondContact OD1-OG 2.97Å; S208-I230 CarbonylContact O-C 3.5Å; S208-I230 WeakPolarHBondContact O-CA 3.18Å; S208-I231 PolarHBondContact N-O 2.61Å; S208-I231 PolarHBondContact O-N 3.42Å; S208-K233 WeakPolarHBondContact OG-CE 3.35Å
209	V	98.5	Very high	92.9	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	116.8	176.6	-178.8	0	0	0	0	108.1	L201 I202 L207 I230 L303	L201-V209 HydrophobicContact CB-CB 4.24Å; L201-V209 HydrophobicContact CB-CG1 4.05Å; L201-V209 PolarHBondContact N-O 3.16Å; I202-V209 HydrophobicContact CB-CB 4.07Å; I202-V209 HydrophobicContact CB-CG2 4.08Å; I202-V209 HydrophobicContact CD1-CG2 4.04Å; I202-V209 HydrophobicContact CG1-CB 4.4Å; I202-V209 HydrophobicContact CG1-CG2 4.37Å; I202-V209 PolarHBondContact N-O 3.05Å; I202-V209 PolarHBondContact O-N 2.89Å; L207-V209 HydrophobicContact CD2-CG2 3.76Å; L207-V209 HydrophobicContact CG-CG2 3.92Å; V209-I230 HydrophobicContact CG1-CG1 4.28Å; V209-I230 HydrophobicContact CG2-CG1 4.31Å; V209-I230 HydrophobicContact CG2-CG2 4.26Å; V209-L303 HydrophobicContact CG1-CD2 3.75Å
210	Q	98.3	Very high	91.7	Very high	94 Å²	94	39.4 Å²	39.4	44%	0.439	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	137.4	-179.5	-175.5	178.7	-21.8	0	0	109.8	W199 I228 T229	W199-Q210 WeakPolarHBondContact O-CA 3.42Å; Q210-I228 WeakPolarHBondContact O-CA 3.41Å; Q210-T229 PolarHBondContact N-O 3.26Å; Q210-T229 PolarHBondContact O-N 2.91Å
211	V	98.3	Very high	90.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	151.5	175.2	-59.4	0	0	0	0	110.1	L177 A198 W199 L201 T225 K227 I228	L177-V211 HydrophobicContact CD2-CB 4.31Å; L177-V211 HydrophobicContact CD2-CG1 4.04Å; L177-V211 HydrophobicContact CD2-CG2 3.97Å; A198-V211 CarbonylContact C-O 3.56Å; A198-V211 VanDerWaalsContact CA-O 3.31Å; A198-V211 WeakPolarHBondContact CA-O 3.34Å; W199-V211 HydrophobicContact CB-CG2 4.41Å; W199-V211 PolarHBondContact N-O 3.34Å; W199-V211 PolarHBondContact O-N 3.24Å; L201-V211 HydrophobicContact CD1-CB 4.1Å; L201-V211 HydrophobicContact CD1-CG1 3.72Å; L201-V211 HydrophobicContact CD1-CG2 3.31Å; L201-V211 HydrophobicContact CD2-CG1 4.06Å; L201-V211 HydrophobicContact CG-CG1 4.46Å; V211-T225 HydrophobicContact CB-CG2 3.91Å; V211-T225 HydrophobicContact CG1-CG2 4.25Å; V211-K227 CarbonylContact C-O 3.54Å; V211-K227 WeakPolarHBondContact CA-O 3.3Å; V211-I228 HydrophobicContact CG1-CG1 4.21Å
212	T	98	Very high	90.3	Very high	32 Å²	32	40.7 Å²	40.7	20%	0.196	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.7	167.2	-48.5	0	0	0	0	109.4	G197 T225 N226 K227	G197-T212 CarbonylContact O-C 3.55Å; G197-T212 VanDerWaalsContact O-CA 3.24Å; G197-T212 WeakPolarHBondContact O-CA 3.4Å; T212-T225 WeakPolarHBondContact O-CA 3.44Å; T212-N226 PolarHBondContact O-N 3.12Å; T212-N226 PolarHBondContact O-OD1 2.87Å; T212-N226 VanDerWaalsContact O-OD1 3.07Å; T212-K227 PolarHBondContact N-O 3.08Å
213	N	96.6	Very high	90	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.011	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	139	177.4	-48.4	-56.2	0	0	0	110.4	V195 G197 A224 T225	V195-N213 WeakPolarHBondContact CG2-ND2 3.31Å; V195-N213 WeakPolarHBondContact O-CB 3.48Å; V195-N213 PolarHBondContact O-ND2 2.84Å; G197-N213 PolarHBondContact N-O 3.44Å; G197-N213 PolarHBondContact O-N 3.46Å; N213-A224 WeakPolarHBondContact CA-O 3.42Å; N213-T225 WeakPolarHBondContact OD1-CA 3.41Å; N213-T225 WeakPolarHBondContact OD1-CB 3.41Å; N213-T225 PolarHBondContact OD1-OG1 3.07Å
214	V	94.7	Very high	89.9	Confident	46 Å²	46	38.5 Å²	38.5	28%	0.279	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	145	179.6	-66.2	0	0	0	0	110.3	V216 T223 A224 N226 Y300	V214-V216 PolarHBondContact O-N 3.44Å; V214-T223 CarbonylContact O-C 3.39Å; V214-T223 WeakPolarHBondContact O-CA 3.43Å; V214-T223 WeakPolarHBondContact O-CB 3.37Å; V214-A224 PolarHBondContact N-O 2.79Å; V214-A224 PolarHBondContact O-N 2.97Å; V214-N226 VanDerWaalsContact CG1-ND2 3.31Å; V214-N226 WeakPolarHBondContact CG1-ND2 3.41Å; V214-N226 HydrophobicContact CG2-CB 4.01Å; V214-Y300 HydrophobicContact CG2-CE1 4.42Å
215	P	91.1	Very high	90.1	Very high	43 Å²	43	38.7 Å²	38.7	28%	0.279	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	130.8	175.2	-23.9	34.2	0	0	0	111.3	E196 V217	E196-P215 HydrophobicContact CG-CG 4.31Å; P215-V217 VanDerWaalsContact C-N 3.29Å; P215-V217 PolarHBondContact O-N 3.06Å
216	V	87.1	Confident	90.2	Very high	26 Å²	26	36.6 Å²	36.6	16%	0.158	23%	0.233	C	C	.	.	S	Bend	trans	-67.8	-36	178.8	176.9	0	0	0	0	110.7	V214 A222 A224 Y300 T390 F395	V214-V216 PolarHBondContact O-N 3.44Å; V216-A222 PolarHBondContact N-O 3.16Å; V216-A224 HydrophobicContact CG2-CB 3.73Å; V216-Y300 HydrophobicContact CG1-CE2 4.42Å; V216-Y300 HydrophobicContact CG2-CE2 4.32Å; V216-T390 HydrophobicContact CB-CG2 4.12Å; V216-T390 HydrophobicContact CG1-CG2 3.91Å; V216-T390 HydrophobicContact CG2-CG2 4.11Å; V216-F395 HydrophobicContact CG1-CE2 4.42Å; V216-F395 HydrophobicContact CG2-CE2 4.48Å; V216-F395 HydrophobicContact CG2-CZ 4.05Å
217	V	80.1	Confident	90.4	Very high	71 Å²	71	36.8 Å²	36.8	43%	0.43	24%	0.236	S	C	.	.	S	Bend	trans	-130.7	136.2	172.9	-176.3	0	0	0	0	108	P215 G219 S220	P215-V217 VanDerWaalsContact C-N 3.29Å; P215-V217 PolarHBondContact O-N 3.06Å; V217-G219 PolarHBondContact O-N 2.94Å; V217-S220 VanDerWaalsContact O-CB 3.31Å; V217-S220 WeakPolarHBondContact O-CB 3.41Å; V217-S220 PolarHBondContact O-N 3.39Å
218	P	77.3	Confident	90.5	Very high	125 Å²	125	36.8 Å²	36.8	81%	0.812	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.3	127.8	176.8	-26.7	34.9	0	0	0	112	S220	P218-S220 VanDerWaalsContact C-N 3.32Å; P218-S220 PolarHBondContact O-N 3.11Å
219	G	70	Confident	90.6	Very high	88 Å²	88	36.8 Å²	36.8	91%	0.907	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.6	-1.7	-179.2	0	0	0	0	0	115.5	V217	V217-G219 PolarHBondContact O-N 2.94Å
220	S	72.7	Confident	90.6	Very high	35 Å²	35	36.8 Å²	36.8	25%	0.245	24%	0.235	C	C	.	.			trans	-82	149.8	172.2	-173	0	0	0	0	111.7	V217 P218 A222	V217-S220 VanDerWaalsContact O-CB 3.31Å; V217-S220 WeakPolarHBondContact O-CB 3.41Å; V217-S220 PolarHBondContact O-N 3.39Å; P218-S220 VanDerWaalsContact C-N 3.32Å; P218-S220 PolarHBondContact O-N 3.11Å; S220-A222 VanDerWaalsContact C-N 3.27Å; S220-A222 PolarHBondContact OG-N 3.13Å; S220-A222 VanDerWaalsContact OG-N 3.14Å
221	S	80	Confident	90.5	Very high	62 Å²	62	34.6 Å²	34.6	43%	0.434	23%	0.226	S	C	.	.	S	Bend	trans	-75.2	-17.6	167.7	56	0	0	0	0	112.8	T223 I334	S221-T223 PolarHBondContact O-N 2.94Å; S221-I334 WeakPolarHBondContact O-CD1 3.31Å
222	A	84.6	Confident	90.4	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.008	23%	0.226	C	C	.	.			trans	-74.1	115.2	176.5	0	0	0	0	0	109.9	D180 V216 S220 T390	D180-A222 HydrophobicContact CB-CB 4.05Å; V216-A222 PolarHBondContact N-O 3.16Å; S220-A222 VanDerWaalsContact C-N 3.27Å; S220-A222 PolarHBondContact OG-N 3.13Å; S220-A222 VanDerWaalsContact OG-N 3.14Å; A222-T390 HydrophobicContact CB-CG2 3.95Å
223	T	91.7	Very high	90.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	168.9	174.2	75	0	0	0	0	109.8	D180 P181 K194 E196 V214 S221	D180-T223 CarbonylContact C-O 3.34Å; D180-T223 WeakPolarHBondContact CA-O 3.43Å; D180-T223 WeakPolarHBondContact CB-O 3.33Å; P181-T223 VanDerWaalsContact CD-O 3.32Å; P181-T223 WeakPolarHBondContact CD-O 3.47Å; P181-T223 WeakPolarHBondContact CD-OG1 3.44Å; K194-T223 HydrophobicContact CG-CG2 3.98Å; K194-T223 WeakPolarHBondContact O-CB 3.35Å; K194-T223 WeakPolarHBondContact O-CG2 3.36Å; K194-T223 PolarHBondContact O-OG1 3.23Å; E196-T223 HydrophobicContact CB-CG2 4.24Å; V214-T223 CarbonylContact O-C 3.39Å; V214-T223 WeakPolarHBondContact O-CA 3.43Å; V214-T223 WeakPolarHBondContact O-CB 3.37Å; S221-T223 PolarHBondContact O-N 2.94Å
224	A	93.5	Very high	89.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	152.3	172.1	0	0	0	0	0	110.6	N213 V214 V216 N226 Y300 F395	N213-A224 WeakPolarHBondContact CA-O 3.42Å; V214-A224 PolarHBondContact N-O 2.79Å; V214-A224 PolarHBondContact O-N 2.97Å; V216-A224 HydrophobicContact CG2-CB 3.73Å; A224-N226 PolarHBondContact O-N 3.48Å; A224-Y300 HydrophobicContact CB-CD1 3.35Å; A224-Y300 HydrophobicContact CB-CD2 3.8Å; A224-Y300 HydrophobicContact CB-CE1 3.66Å; A224-Y300 HydrophobicContact CB-CE2 4.08Å; A224-Y300 HydrophobicContact CB-CG 3.42Å; A224-Y300 VanDerWaalsContact CB-CG 3.42Å; A224-F395 HydrophobicContact CB-CE1 4.35Å; A224-F395 HydrophobicContact CB-CZ 4.13Å
225	T	97.4	Very high	89.6	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.025	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	124.8	-174.3	-50.9	0	0	0	0	111.5	L177 V211 T212 N213 K227 I228 Y300 L301	L177-T225 WeakPolarHBondContact CD2-OG1 3.43Å; V211-T225 HydrophobicContact CB-CG2 3.91Å; V211-T225 HydrophobicContact CG1-CG2 4.25Å; T212-T225 WeakPolarHBondContact O-CA 3.44Å; N213-T225 WeakPolarHBondContact OD1-CA 3.41Å; N213-T225 WeakPolarHBondContact OD1-CB 3.41Å; N213-T225 PolarHBondContact OD1-OG1 3.07Å; T225-K227 WeakPolarHBondContact CG2-O 3.43Å; T225-I228 HydrophobicContact CG2-CD1 4.43Å; T225-I228 HydrophobicContact CG2-CG1 3.86Å; T225-Y300 CarbonylContact O-C 3.57Å; T225-Y300 WeakPolarHBondContact O-CA 3.48Å; T225-Y300 WeakPolarHBondContact O-CB 3.41Å; T225-L301 HydrophobicContact CG2-CB 4.32Å; T225-L301 PolarHBondContact O-N 2.86Å
226	N	97.1	Very high	89.2	Confident	45 Å²	45	47 Å²	47	24%	0.241	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	-8.1	176.9	75.5	-15.8	0	0	0	113.9	T212 V214 A224 V247 T248	T212-N226 PolarHBondContact O-N 3.12Å; T212-N226 PolarHBondContact O-OD1 2.87Å; T212-N226 VanDerWaalsContact O-OD1 3.07Å; V214-N226 VanDerWaalsContact CG1-ND2 3.31Å; V214-N226 WeakPolarHBondContact CG1-ND2 3.41Å; V214-N226 HydrophobicContact CG2-CB 4.01Å; A224-N226 PolarHBondContact O-N 3.48Å; N226-V247 CarbonylContact O-C 3.54Å; N226-V247 VanDerWaalsContact O-CA 3.27Å; N226-V247 WeakPolarHBondContact O-CA 3.44Å; N226-T248 WeakPolarHBondContact CB-OG1 3.2Å; N226-T248 PolarHBondContact O-N 2.91Å; N226-T248 PolarHBondContact O-OG1 3.06Å
227	K	98.4	Very high	88.8	Confident	76 Å²	76	49 Å²	49	33%	0.33	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	137.2	176.1	-179.9	-179	-60.2	-175.6	0	110.3	V211 T212 T225 Q245 A246 V247	V211-K227 CarbonylContact C-O 3.54Å; V211-K227 WeakPolarHBondContact CA-O 3.3Å; T212-K227 PolarHBondContact N-O 3.08Å; T225-K227 WeakPolarHBondContact CG2-O 3.43Å; K227-Q245 HydrophobicContact CG-CG 4.49Å; K227-A246 CarbonylContact C-O 3.6Å; K227-A246 VanDerWaalsContact CA-O 3.27Å; K227-A246 WeakPolarHBondContact CA-O 3.49Å; K227-V247 HydrophobicContact CB-CG1 4.06Å; K227-V247 HydrophobicContact CD-CG1 4.25Å; K227-V247 HydrophobicContact CG-CG1 3.8Å
228	I	98.6	Very high	89	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	132.6	172.4	-63.5	168.7	0	0	0	107.1	Q210 V211 T225 I230 Q245 A246 I294 L301 L303	Q210-I228 WeakPolarHBondContact O-CA 3.41Å; V211-I228 HydrophobicContact CG1-CG1 4.21Å; T225-I228 HydrophobicContact CG2-CD1 4.43Å; T225-I228 HydrophobicContact CG2-CG1 3.86Å; I228-I230 HydrophobicContact CG2-CD1 4.22Å; I228-I230 HydrophobicContact CG2-CG1 3.99Å; I228-Q245 WeakPolarHBondContact O-CA 3.34Å; I228-A246 PolarHBondContact N-O 2.69Å; I228-A246 PolarHBondContact O-N 2.82Å; I228-I294 HydrophobicContact CD1-CG1 4.35Å; I228-I294 HydrophobicContact CD1-CG2 3.64Å; I228-I294 HydrophobicContact CG2-CD1 4.06Å; I228-L301 HydrophobicContact CB-CD1 4.42Å; I228-L301 HydrophobicContact CD1-CB 3.62Å; I228-L301 HydrophobicContact CD1-CD1 3.96Å; I228-L301 HydrophobicContact CD1-CG 4.42Å; I228-L301 HydrophobicContact CG1-CB 4.25Å; I228-L301 HydrophobicContact CG1-CD1 3.93Å; I228-L303 HydrophobicContact CD1-CB 4.16Å; I228-L303 HydrophobicContact CD1-CD1 4.31Å; I228-L303 HydrophobicContact CG2-CD1 4.2Å
229	T	98.4	Very high	89.4	Confident	21 Å²	21	40.5 Å²	40.5	13%	0.129	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.4	173.9	-59.6	0	0	0	0	108.5	Q210 I231 V243 Y244 Q245	Q210-T229 PolarHBondContact N-O 3.26Å; Q210-T229 PolarHBondContact O-N 2.91Å; T229-I231 HydrophobicContact CG2-CG1 4.45Å; T229-V243 HydrophobicContact CG2-CG1 4.21Å; T229-Y244 CarbonylContact C-O 3.51Å; T229-Y244 WeakPolarHBondContact CA-O 3.49Å; T229-Q245 PolarHBondContact OG1-NE2 2.65Å
230	I	98.4	Very high	90.2	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	125.3	-179.9	-56.5	172.1	0	0	0	107.8	L207 S208 V209 I228 F232 V243 Y244 L283 V292 I294	L207-I230 HydrophobicContact CD1-CG2 3.73Å; S208-I230 CarbonylContact O-C 3.5Å; S208-I230 WeakPolarHBondContact O-CA 3.18Å; V209-I230 HydrophobicContact CG1-CG1 4.28Å; V209-I230 HydrophobicContact CG2-CG1 4.31Å; V209-I230 HydrophobicContact CG2-CG2 4.26Å; I228-I230 HydrophobicContact CG2-CD1 4.22Å; I228-I230 HydrophobicContact CG2-CG1 3.99Å; I230-F232 HydrophobicContact CB-CE2 4.4Å; I230-F232 HydrophobicContact CG2-CD2 4.11Å; I230-F232 HydrophobicContact CG2-CE1 4.36Å; I230-F232 HydrophobicContact CG2-CE2 3.6Å; I230-F232 HydrophobicContact CG2-CZ 3.75Å; I230-V243 WeakPolarHBondContact O-CA 3.34Å; I230-Y244 HydrophobicContact CD1-CD1 4.35Å; I230-Y244 PolarHBondContact N-O 3.15Å; I230-Y244 PolarHBondContact O-N 2.63Å; I230-L283 HydrophobicContact CD1-CD2 4.31Å; I230-V292 HydrophobicContact CD1-CB 4.29Å; I230-V292 HydrophobicContact CD1-CG1 3.67Å; I230-V292 HydrophobicContact CD1-CG2 4.45Å; I230-I294 HydrophobicContact CD1-CD1 3.82Å
231	I	97.5	Very high	91.1	Very high	49 Å²	49	45.8 Å²	45.8	25%	0.251	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	110.5	175.9	-53.7	175.6	0	0	0	107.3	S208 T229 K233 Q241 R242 V243	S208-I231 PolarHBondContact N-O 2.61Å; S208-I231 PolarHBondContact O-N 3.42Å; T229-I231 HydrophobicContact CG2-CG1 4.45Å; I231-K233 PolarHBondContact O-N 3.49Å; I231-Q241 HydrophobicContact CG2-CG 3.93Å; I231-R242 WeakPolarHBondContact CA-O 3.42Å; I231-V243 HydrophobicContact CG1-CG1 4.42Å; I231-V243 HydrophobicContact CG1-CG2 4.35Å; I231-V243 HydrophobicContact CG2-CG2 4.46Å
232	F	95.9	Very high	91.8	Very high	1 Å²	1	44.6 Å²	44.6	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	108.5	166.5	-63.5	-83.3	0	0	0	107.2	L207 I230 Q241 R242 F255 L270 L283 A285	L207-F232 HydrophobicContact CD1-CD1 3.6Å; L207-F232 HydrophobicContact CD1-CE1 3.66Å; L207-F232 HydrophobicContact CD1-CG 4.24Å; L207-F232 HydrophobicContact CD1-CZ 4.34Å; I230-F232 HydrophobicContact CB-CE2 4.4Å; I230-F232 HydrophobicContact CG2-CD2 4.11Å; I230-F232 HydrophobicContact CG2-CE1 4.36Å; I230-F232 HydrophobicContact CG2-CE2 3.6Å; I230-F232 HydrophobicContact CG2-CZ 3.75Å; F232-Q241 VanDerWaalsContact O-CA 3.3Å; F232-Q241 WeakPolarHBondContact O-CA 3.37Å; F232-Q241 WeakPolarHBondContact O-CG 3.23Å; F232-R242 HydrophobicContact CB-CB 4.32Å; F232-R242 HydrophobicContact CD2-CB 4.39Å; F232-R242 PolarHBondContact N-O 2.96Å; F232-R242 PolarHBondContact O-N 2.8Å; F232-F255 HydrophobicContact CD2-CE1 4.03Å; F232-F255 AromaticContact CE2-CE1 3.95Å; F232-F255 HydrophobicContact CE2-CE1 3.95Å; F232-L270 HydrophobicContact CB-CD2 3.98Å; F232-L270 HydrophobicContact CD1-CD1 3.94Å; F232-L270 HydrophobicContact CD1-CD2 4.33Å; F232-L270 HydrophobicContact CD2-CD1 4.17Å; F232-L270 HydrophobicContact CD2-CD2 3.95Å; F232-L270 HydrophobicContact CE1-CD1 3.83Å; F232-L270 HydrophobicContact CE2-CD1 4.06Å; F232-L270 HydrophobicContact CG-CD1 4.12Å; F232-L270 HydrophobicContact CG-CD2 3.81Å; F232-L270 HydrophobicContact CZ-CD1 3.88Å; F232-L283 HydrophobicContact CE2-CD2 3.67Å; F232-L283 HydrophobicContact CZ-CB 4.12Å; F232-L283 HydrophobicContact CZ-CD2 3.89Å; F232-A285 HydrophobicContact CD1-CB 3.97Å; F232-A285 HydrophobicContact CE1-CB 3.67Å
233	K	94	Very high	92.4	Very high	50 Å²	50	46.5 Å²	46.5	22%	0.217	25%	0.249	C	C	.	.			trans	-65.8	150.4	-179.9	-66.8	-179.9	178.3	179.4	0	109.7	D203 N204 D205 Y206 S208 I231 Y235	D203-K233 IonicContact OD1-NZ 3.3Å; D203-K233 PolarHBondContact OD1-NZ 2.79Å; N204-K233 WeakPolarHBondContact O-CE 3.19Å; N204-K233 PolarHBondContact O-NZ 3.12Å; D205-K233 VanDerWaalsContact O-CD 3.23Å; D205-K233 WeakPolarHBondContact O-CD 3.49Å; Y206-K233 WeakPolarHBondContact O-CB 3.43Å; Y206-K233 PolarHBondContact O-N 2.77Å; S208-K233 WeakPolarHBondContact OG-CE 3.35Å; I231-K233 PolarHBondContact O-N 3.49Å; K233-Y235 PolarHBondContact O-N 3.21Å
234	P	90.4	Very high	92.7	Very high	85 Å²	85	46.5 Å²	46.5	55%	0.552	25%	0.249	S	C	*	.			trans	-59.7	138.7	-177.1	25.6	-33.7	0	0	0	110.5
235	Y	86.8	Confident	92.9	Very high	60 Å²	60	50.1 Å²	50.1	24%	0.235	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-129.5	112.8	178.6	-166.5	-78.9	0	0	0	109.3	R148 Y206 K233 G237 C238 T239 Y287 I288	R148-Y235 PolarHBondContact NH1-OH 3.05Å; R148-Y235 VanDerWaalsContact NH2-CE1 3.31Å; R148-Y235 PolarHBondContact NH2-OH 2.98Å; Y206-Y235 HydrophobicContact CD1-CD2 4.24Å; Y206-Y235 HydrophobicContact CD1-CE2 4.34Å; Y206-Y235 HydrophobicContact CE1-CD2 4.38Å; Y206-Y235 HydrophobicContact CE1-CE2 4.07Å; K233-Y235 PolarHBondContact O-N 3.21Å; Y235-G237 PolarHBondContact O-N 2.96Å; Y235-C238 HydrophobicContact CD1-CB 3.8Å; Y235-C238 PolarHBondContact O-N 2.85Å; Y235-T239 PolarHBondContact N-O 3.45Å; Y235-T239 PolarHBondContact O-N 3.11Å; Y235-T239 VanDerWaalsContact O-N 3.1Å; Y235-Y287 VanDerWaalsContact CB-CE2 3.43Å; Y235-Y287 AromaticContact CD1-CD2 3.94Å; Y235-Y287 HydrophobicContact CD1-CD2 3.94Å; Y235-Y287 AromaticContact CD2-CD2 3.86Å; Y235-Y287 HydrophobicContact CD2-CD2 3.86Å; Y235-Y287 AromaticContact CD2-CE2 3.91Å; Y235-Y287 HydrophobicContact CD2-CE2 3.91Å; Y235-Y287 AromaticContact CG-CD2 3.51Å; Y235-Y287 HydrophobicContact CG-CD2 3.51Å; Y235-Y287 AromaticContact CG-CE2 3.7Å; Y235-Y287 HydrophobicContact CG-CE2 3.7Å; Y235-I288 HydrophobicContact CD2-CG2 4.29Å; Y235-I288 HydrophobicContact CE2-CG2 4.43Å
236	E	83.4	Confident	92.9	Very high	188 Å²	188	49.9 Å²	49.9	88%	0.879	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	128.2	-172.6	-69.5	-166.9	163.6	0	0	112.1	C238	E236-C238 VanDerWaalsContact C-N 3.26Å; E236-C238 PolarHBondContact O-N 3.01Å
237	G	78.3	Confident	92.9	Very high	68 Å²	68	50 Å²	50	70%	0.701	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-2	179.4	0	0	0	0	0	115.7	C143 Y235	C143-G237 PolarHBondContact SG-O 2.86Å; Y235-G237 PolarHBondContact O-N 2.96Å
238	C	83.6	Confident	92.8	Very high	4 Å²	4	47.9 Å²	47.9	3%	0.027	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	-46.7	-176	-61.1	0	0	0	0	115.8	C143 Y235 E236 A264 A269 Y287	C143-C238 WeakPolarHBondContact CA-SG 3.42Å; C143-C238 HydrophobicContact CB-CB 3.71Å; C143-C238 WeakPolarHBondContact CB-SG 3.4Å; C143-C238 WeakPolarHBondContact SG-CA 3.39Å; C143-C238 WeakPolarHBondContact SG-CB 3.38Å; C143-C238 CovalentContact SG-SG 2.05Å; C143-C238 PolarHBondContact SG-SG 2.88Å; Y235-C238 HydrophobicContact CD1-CB 3.8Å; Y235-C238 PolarHBondContact O-N 2.85Å; E236-C238 VanDerWaalsContact C-N 3.26Å; E236-C238 PolarHBondContact O-N 3.01Å; C238-A264 WeakPolarHBondContact O-CB 3.37Å; C238-A269 HydrophobicContact CB-CB 4.32Å; C238-Y287 HydrophobicContact CB-CD2 4.48Å; C238-Y287 HydrophobicContact CB-CG 4.25Å
239	T	85.9	Confident	92.6	Very high	12 Å²	12	54 Å²	54	7%	0.074	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-156.1	140.5	176.6	-174.6	0	0	0	0	110.5	Y235 Y287	Y235-T239 PolarHBondContact N-O 3.45Å; Y235-T239 PolarHBondContact O-N 3.11Å; Y235-T239 VanDerWaalsContact O-N 3.1Å; T239-Y287 HydrophobicContact CG2-CD1 4.16Å; T239-Y287 HydrophobicContact CG2-CE1 3.57Å; T239-Y287 HydrophobicContact CG2-CE2 4.02Å; T239-Y287 VanDerWaalsContact CG2-CZ 3.5Å
240	D	87.8	Confident	92.5	Very high	120 Å²	120	56 Å²	56	64%	0.642	31%	0.308	S	S	*	.			trans	-67.6	171.1	160	-58.8	-47.1	0	0	0	109.9	R242	D240-R242 PolarHBondContact O-N 2.77Å
241	Q	91.8	Very high	92.4	Very high	114 Å²	114	56.3 Å²	56.3	53%	0.533	31%	0.31	S	S	.	.			trans	-57.9	130.1	174.3	-171.4	178.5	-72	0	0	110.3	I231 F232	I231-Q241 HydrophobicContact CG2-CG 3.93Å; F232-Q241 VanDerWaalsContact O-CA 3.3Å; F232-Q241 WeakPolarHBondContact O-CA 3.37Å; F232-Q241 WeakPolarHBondContact O-CG 3.23Å
242	R	93.7	Very high	92.3	Very high	38 Å²	38	56 Å²	56	14%	0.143	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.5	173.7	-61	-62.7	175.4	168.3	-1.1	110.4	I231 F232 D240 F255 D257 T259 L270	I231-R242 WeakPolarHBondContact CA-O 3.42Å; F232-R242 HydrophobicContact CB-CB 4.32Å; F232-R242 HydrophobicContact CD2-CB 4.39Å; F232-R242 PolarHBondContact N-O 2.96Å; F232-R242 PolarHBondContact O-N 2.8Å; D240-R242 PolarHBondContact O-N 2.77Å; R242-F255 HydrophobicContact CB-CD1 3.9Å; R242-F255 HydrophobicContact CB-CE1 4.01Å; R242-F255 HydrophobicContact CB-CG 4.24Å; R242-F255 HydrophobicContact CB-CZ 4.44Å; R242-D257 IonicContact CZ-OD2 3.68Å; R242-D257 IonicContact NH1-OD2 3.49Å; R242-D257 PolarHBondContact NH1-OD2 3.22Å; R242-T259 PolarHBondContact NH1-OG1 3.32Å; R242-L270 HydrophobicContact CB-CD2 3.83Å; R242-L270 HydrophobicContact CG-CD2 3.69Å
243	V	96.6	Very high	92.2	Very high	40 Å²	40	57.6 Å²	57.6	24%	0.242	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.7	177.6	-174.5	0	0	0	0	108.4	T229 I230 I231 F255 D256	T229-V243 HydrophobicContact CG2-CG1 4.21Å; I230-V243 WeakPolarHBondContact O-CA 3.34Å; I231-V243 HydrophobicContact CG1-CG1 4.42Å; I231-V243 HydrophobicContact CG1-CG2 4.35Å; I231-V243 HydrophobicContact CG2-CG2 4.46Å; V243-F255 WeakPolarHBondContact O-CA 3.32Å; V243-F255 WeakPolarHBondContact O-CB 3.3Å; V243-D256 WeakPolarHBondContact CG1-OD2 3.36Å; V243-D256 PolarHBondContact O-N 3.43Å
244	Y	98.1	Very high	92.2	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	125.1	171.8	179.5	-94.7	0	0	0	109.3	T229 I230 A246 L251 P252 A254 F255 I272 V281 L283 I294	T229-Y244 CarbonylContact C-O 3.51Å; T229-Y244 WeakPolarHBondContact CA-O 3.49Å; I230-Y244 HydrophobicContact CD1-CD1 4.35Å; I230-Y244 PolarHBondContact N-O 3.15Å; I230-Y244 PolarHBondContact O-N 2.63Å; Y244-A246 HydrophobicContact CE1-CB 3.78Å; Y244-L251 WeakPolarHBondContact OH-CD1 3.47Å; Y244-P252 HydrophobicContact CE2-CG 4.05Å; Y244-P252 VanDerWaalsContact CE2-O 3.23Å; Y244-P252 WeakPolarHBondContact CE2-O 3.29Å; Y244-P252 PolarHBondContact OH-O 2.9Å; Y244-A254 WeakPolarHBondContact CD2-O 3.46Å; Y244-A254 WeakPolarHBondContact CE2-O 3.43Å; Y244-F255 HydrophobicContact CD2-CD1 4.47Å; Y244-I272 HydrophobicContact CD2-CD1 3.71Å; Y244-I272 HydrophobicContact CE2-CD1 3.97Å; Y244-V281 WeakPolarHBondContact OH-CG2 3.44Å; Y244-L283 HydrophobicContact CD1-CD1 4.29Å; Y244-L283 HydrophobicContact CD1-CD2 3.87Å; Y244-L283 HydrophobicContact CD2-CD2 3.94Å; Y244-L283 HydrophobicContact CE1-CD1 4.22Å; Y244-L283 HydrophobicContact CG-CD2 3.55Å; Y244-I294 HydrophobicContact CD1-CD1 3.89Å; Y244-I294 HydrophobicContact CE1-CD1 3.39Å
245	Q	98.1	Very high	92.4	Very high	76 Å²	76	52.6 Å²	52.6	36%	0.355	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	132.2	172.8	-172.3	170	104.9	0	0	111.5	K227 I228 T229 P252 D256	K227-Q245 HydrophobicContact CG-CG 4.49Å; I228-Q245 WeakPolarHBondContact O-CA 3.34Å; T229-Q245 PolarHBondContact OG1-NE2 2.65Å; Q245-P252 WeakPolarHBondContact O-CG 3.37Å; Q245-D256 WeakPolarHBondContact CB-OD1 3.49Å; Q245-D256 PolarHBondContact N-OD1 3.29Å; Q245-D256 VanDerWaalsContact N-OD1 3.12Å
246	A	97.8	Very high	92.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	139	168.9	0	0	0	0	0	109.6	K227 I228 Y244 L251 L301	K227-A246 CarbonylContact C-O 3.6Å; K227-A246 VanDerWaalsContact CA-O 3.27Å; K227-A246 WeakPolarHBondContact CA-O 3.49Å; I228-A246 PolarHBondContact N-O 2.69Å; I228-A246 PolarHBondContact O-N 2.82Å; Y244-A246 HydrophobicContact CE1-CB 3.78Å; A246-L251 HydrophobicContact CB-CD1 3.45Å; A246-L251 VanDerWaalsContact CB-CD1 3.45Å; A246-L301 HydrophobicContact CB-CD1 4.19Å
247	V	97.7	Very high	92.7	Very high	46 Å²	46	49.6 Å²	49.6	28%	0.279	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	162.4	171.8	-65.6	0	0	0	0	109.5	N226 K227 D249 S250	N226-V247 CarbonylContact O-C 3.54Å; N226-V247 VanDerWaalsContact O-CA 3.27Å; N226-V247 WeakPolarHBondContact O-CA 3.44Å; K227-V247 HydrophobicContact CB-CG1 4.06Å; K227-V247 HydrophobicContact CD-CG1 4.25Å; K227-V247 HydrophobicContact CG-CG1 3.8Å; V247-D249 PolarHBondContact O-N 3.3Å; V247-S250 PolarHBondContact N-O 2.84Å; V247-S250 CarbonylContact O-C 3.56Å; V247-S250 VanDerWaalsContact O-C 3.27Å; V247-S250 PolarHBondContact O-N 2.96Å
248	T	95.4	Very high	93.1	Very high	32 Å²	32	49.2 Å²	49.2	20%	0.196	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	131.7	169.9	-59.4	0	0	0	0	110.5	N226 S250 R299	N226-T248 WeakPolarHBondContact CB-OG1 3.2Å; N226-T248 PolarHBondContact O-N 2.91Å; N226-T248 PolarHBondContact O-OG1 3.06Å; T248-S250 PolarHBondContact O-N 2.79Å; T248-R299 WeakPolarHBondContact CB-O 3.02Å; T248-R299 HydrophobicContact CG2-CB 4.37Å; T248-R299 WeakPolarHBondContact CG2-O 3.04Å; T248-R299 PolarHBondContact OG1-O 3.47Å
249	D	94.8	Very high	93.1	Very high	131 Å²	131	51.1 Å²	51.1	70%	0.701	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	4	-178	-50.9	-37.9	0	0	0	115	V247 Q296	V247-D249 PolarHBondContact O-N 3.3Å; D249-Q296 PolarHBondContact OD1-NE2 2.81Å
250	S	95.6	Very high	92.8	Very high	63 Å²	63	52.6 Å²	52.6	44%	0.441	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-142.3	95.2	174.2	-165.7	0	0	0	0	111.3	V247 T248 P252	V247-S250 PolarHBondContact N-O 2.84Å; V247-S250 CarbonylContact O-C 3.56Å; V247-S250 VanDerWaalsContact O-C 3.27Å; V247-S250 PolarHBondContact O-N 2.96Å; T248-S250 PolarHBondContact O-N 2.79Å; S250-P252 WeakPolarHBondContact O-CD 3.2Å
251	L	96.5	Very high	92.2	Very high	6 Å²	6	50 Å²	50	3%	0.031	30%	0.3	C	S	.	.			trans	-114.2	84.8	174.7	-168.8	68.8	0	0	0	109.5	Y244 A246 V281 I294	Y244-L251 WeakPolarHBondContact OH-CD1 3.47Å; A246-L251 HydrophobicContact CB-CD1 3.45Å; A246-L251 VanDerWaalsContact CB-CD1 3.45Å; L251-V281 HydrophobicContact CD1-CG2 3.89Å; L251-V281 HydrophobicContact CD2-CG1 4.19Å; L251-V281 HydrophobicContact CD2-CG2 4.14Å; L251-V281 HydrophobicContact CG-CG1 4Å; L251-V281 HydrophobicContact CG-CG2 3.93Å; L251-I294 HydrophobicContact CD1-CB 4.14Å; L251-I294 HydrophobicContact CD1-CG2 3.52Å
252	P	96	Very high	90.8	Very high	42 Å²	42	44.6 Å²	44.6	27%	0.273	28%	0.275	S	S	.	.			trans	-73.3	152.1	-173.2	29.4	-34.8	0	0	0	112.3	Y244 Q245 S250 A254	Y244-P252 HydrophobicContact CE2-CG 4.05Å; Y244-P252 VanDerWaalsContact CE2-O 3.23Å; Y244-P252 WeakPolarHBondContact CE2-O 3.29Å; Y244-P252 PolarHBondContact OH-O 2.9Å; Q245-P252 WeakPolarHBondContact O-CG 3.37Å; S250-P252 WeakPolarHBondContact O-CD 3.2Å; P252-A254 PolarHBondContact O-N 3.48Å
253	A	94.6	Very high	88.9	Confident	35 Å²	35	47.8 Å²	47.8	29%	0.289	30%	0.298	S	S	.	.	S	Bend	trans	-91.1	22.6	170.5	0	0	0	0	0	112.8	E274	A253-E274 HydrophobicContact CB-CB 3.8Å; A253-E274 HydrophobicContact CB-CG 4.26Å
254	A	93.9	Very high	86.5	Confident	25 Å²	25	47.4 Å²	47.4	21%	0.207	30%	0.299	C	S	.	.	S	Bend	trans	-142.7	157.3	-176.5	0	0	0	0	0	110.3	Y244 P252 T259	Y244-A254 WeakPolarHBondContact CD2-O 3.46Å; Y244-A254 WeakPolarHBondContact CE2-O 3.43Å; P252-A254 PolarHBondContact O-N 3.48Å; A254-T259 CarbonylContact C-O 3.52Å; A254-T259 VanDerWaalsContact CA-O 3.3Å; A254-T259 WeakPolarHBondContact CA-O 3.28Å
255	F	93.8	Very high	84.3	Confident	5 Å²	5	50.5 Å²	50.5	2%	0.022	33%	0.331	C	S	.	.			trans	-70.3	168.1	166.8	-63.3	-68.5	0	0	0	110.6	F232 R242 V243 Y244 D257 G258 T259 L270 I272 L283	F232-F255 HydrophobicContact CD2-CE1 4.03Å; F232-F255 AromaticContact CE2-CE1 3.95Å; F232-F255 HydrophobicContact CE2-CE1 3.95Å; R242-F255 HydrophobicContact CB-CD1 3.9Å; R242-F255 HydrophobicContact CB-CE1 4.01Å; R242-F255 HydrophobicContact CB-CG 4.24Å; R242-F255 HydrophobicContact CB-CZ 4.44Å; V243-F255 WeakPolarHBondContact O-CA 3.32Å; V243-F255 WeakPolarHBondContact O-CB 3.3Å; Y244-F255 HydrophobicContact CD2-CD1 4.47Å; F255-D257 WeakPolarHBondContact CB-OD1 3.41Å; F255-D257 PolarHBondContact O-N 3.16Å; F255-D257 VanDerWaalsContact O-N 3.1Å; F255-G258 WeakPolarHBondContact O-CA 3.47Å; F255-G258 PolarHBondContact O-N 3.5Å; F255-T259 WeakPolarHBondContact CD2-O 3.33Å; F255-T259 WeakPolarHBondContact CD2-OG1 3.38Å; F255-T259 PolarHBondContact N-O 3.48Å; F255-L270 HydrophobicContact CE1-CD2 4.23Å; F255-L270 HydrophobicContact CE1-CG 4.47Å; F255-L270 HydrophobicContact CE2-CD2 4.36Å; F255-L270 HydrophobicContact CE2-CG 4.23Å; F255-L270 HydrophobicContact CZ-CD1 4.01Å; F255-L270 HydrophobicContact CZ-CD2 3.73Å; F255-L270 HydrophobicContact CZ-CG 3.61Å; F255-I272 HydrophobicContact CD1-CD1 3.98Å; F255-I272 HydrophobicContact CD2-CD1 3.99Å; F255-I272 HydrophobicContact CE1-CD1 3.87Å; F255-I272 HydrophobicContact CE1-CG1 4.17Å; F255-I272 HydrophobicContact CE2-CD1 3.87Å; F255-I272 HydrophobicContact CE2-CG1 3.98Å; F255-I272 HydrophobicContact CG-CD1 4.02Å; F255-I272 HydrophobicContact CZ-CD1 3.79Å; F255-I272 HydrophobicContact CZ-CG1 3.72Å; F255-L283 HydrophobicContact CE1-CD2 4.36Å
256	D	90.8	Very high	82	Confident	93 Å²	93	57.5 Å²	57.5	50%	0.497	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-22.3	-176.7	-71.2	3	0	0	0	113.2	V243 Q245 G258	V243-D256 WeakPolarHBondContact CG1-OD2 3.36Å; V243-D256 PolarHBondContact O-N 3.43Å; Q245-D256 WeakPolarHBondContact CB-OD1 3.49Å; Q245-D256 PolarHBondContact N-OD1 3.29Å; Q245-D256 VanDerWaalsContact N-OD1 3.12Å; D256-G258 VanDerWaalsContact C-N 3.3Å
257	D	86.1	Confident	80.2	Confident	92 Å²	92	60 Å²	60	49%	0.492	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	1.4	174.2	63.4	11.2	0	0	0	114	R242 F255 T259	R242-D257 IonicContact CZ-OD2 3.68Å; R242-D257 IonicContact NH1-OD2 3.49Å; R242-D257 PolarHBondContact NH1-OD2 3.22Å; F255-D257 WeakPolarHBondContact CB-OD1 3.41Å; F255-D257 PolarHBondContact O-N 3.16Å; F255-D257 VanDerWaalsContact O-N 3.1Å; D257-T259 WeakPolarHBondContact OD1-CB 3.47Å; D257-T259 WeakPolarHBondContact OD1-CG2 3.3Å; D257-T259 PolarHBondContact OD1-N 3.06Å; D257-T259 PolarHBondContact OD1-OG1 3.42Å; D257-T259 PolarHBondContact OD2-OG1 3.28Å
258	G	85.7	Confident	78.9	Confident	59 Å²	59	65.2 Å²	65.2	61%	0.608	39%	0.39	S	S	*	.	S	Bend	trans	83.8	0.2	-179	0	0	0	0	0	115.2	F255 D256	F255-G258 WeakPolarHBondContact O-CA 3.47Å; F255-G258 PolarHBondContact O-N 3.5Å; D256-G258 VanDerWaalsContact C-N 3.3Å
259	T	84.3	Confident	78.4	Confident	44 Å²	44	63.7 Å²	63.7	27%	0.27	38%	0.381	S	S	.	.			trans	-78.8	147.4	176.4	63	0	0	0	0	111.4	R242 A254 F255 D257	R242-T259 PolarHBondContact NH1-OG1 3.32Å; A254-T259 CarbonylContact C-O 3.52Å; A254-T259 VanDerWaalsContact CA-O 3.3Å; A254-T259 WeakPolarHBondContact CA-O 3.28Å; F255-T259 WeakPolarHBondContact CD2-O 3.33Å; F255-T259 WeakPolarHBondContact CD2-OG1 3.38Å; F255-T259 PolarHBondContact N-O 3.48Å; D257-T259 WeakPolarHBondContact OD1-CB 3.47Å; D257-T259 WeakPolarHBondContact OD1-CG2 3.3Å; D257-T259 PolarHBondContact OD1-N 3.06Å; D257-T259 PolarHBondContact OD1-OG1 3.42Å; D257-T259 PolarHBondContact OD2-OG1 3.28Å
260	A	79.3	Confident	78.2	Confident	44 Å²	44	57.5 Å²	57.5	36%	0.364	35%	0.348	S	S	.	.	S	Bend	trans	-108.2	-12.3	175.9	0	0	0	0	0	112.7	W271 I272	A260-W271 WeakPolarHBondContact O-CA 3.42Å; A260-I272 PolarHBondContact O-N 3.36Å
261	D	76	Confident	78	Confident	65 Å²	65	57.7 Å²	57.7	35%	0.348	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	131.2	179.7	55.9	-22.3	0	0	0	111.9	V263 L270 W271	D261-V263 PolarHBondContact O-N 3.28Å; D261-L270 CarbonylContact C-O 3.57Å; D261-L270 WeakPolarHBondContact CA-O 3.18Å; D261-W271 HydrophobicContact CB-CB 4.45Å
262	G	61	Low	77.8	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.01	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	101.2	166.2	0	0	0	0	0	108.6	A264 L270	G262-A264 PolarHBondContact O-N 3.31Å; G262-L270 PolarHBondContact N-O 3.16Å
263	V	55.1	Low	77.7	Confident	104 Å²	104	57.9 Å²	57.9	63%	0.63	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	120.8	-175.3	-178.4	0	0	0	0	111.3	D261	D261-V263 PolarHBondContact O-N 3.28Å
264	A	46	Very low	77.7	Confident	32 Å²	32	60.4 Å²	60.4	26%	0.264	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	86.3	153.4	0	0	0	0	0	110.1	C238 G262	C238-A264 WeakPolarHBondContact O-CB 3.37Å; G262-A264 PolarHBondContact O-N 3.31Å
265	G	52.2	Low	77.7	Confident	66 Å²	66	66.4 Å²	66.4	68%	0.68	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	-156.9	172	0	0	0	0	0	115.6	V267	G265-V267 PolarHBondContact O-N 2.8Å
266	K	50.2	Low	77.6	Confident	223 Å²	223	67.8 Å²	67.8	97%	0.97	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-8.6	-170.2	-147.2	175.1	-175.7	-178.8	0	113.9
267	V	59.5	Low	77.7	Confident	53 Å²	53	68.3 Å²	68.3	32%	0.321	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.5	178.2	-179.8	0	0	0	0	110.3	E141 G265 A269	E141-V267 HydrophobicContact CG-CB 4.27Å; E141-V267 HydrophobicContact CG-CG2 4Å; E141-V267 WeakPolarHBondContact OE1-CB 3.39Å; E141-V267 VanDerWaalsContact OE1-CG1 3.23Å; E141-V267 WeakPolarHBondContact OE1-CG1 3.31Å; E141-V267 WeakPolarHBondContact OE1-CG2 3.3Å; E141-V267 WeakPolarHBondContact OE2-CG2 3.46Å; G265-V267 PolarHBondContact O-N 2.8Å; V267-A269 PolarHBondContact O-N 3.08Å; V267-A269 VanDerWaalsContact O-N 3.09Å
268	R	70.3	Confident	77.9	Confident	155 Å²	155	65.5 Å²	65.5	59%	0.585	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	104.5	175.3	-66.8	-178.7	177	171.1	-1.1	108.4	W271	R268-W271 HydrophobicContact CB-CB 4.3Å; R268-W271 HydrophobicContact CB-CD2 4.01Å; R268-W271 HydrophobicContact CB-CE3 3.61Å; R268-W271 HydrophobicContact CB-CG 4.33Å; R268-W271 HydrophobicContact CB-CZ3 4.3Å; R268-W271 WeakPolarHBondContact O-CZ3 3.47Å
269	A	84	Confident	78.3	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	-42.1	176.9	0	0	0	0	0	110.6	C143 C238 V267 A285 G286 Y287	C143-A269 HydrophobicContact CB-CB 3.91Å; C238-A269 HydrophobicContact CB-CB 4.32Å; V267-A269 PolarHBondContact O-N 3.08Å; V267-A269 VanDerWaalsContact O-N 3.09Å; A269-A285 CarbonylContact O-C 3.6Å; A269-G286 PolarHBondContact O-N 3.27Å; A269-Y287 HydrophobicContact CB-CD1 4.25Å; A269-Y287 WeakPolarHBondContact O-CD1 3.36Å; A269-Y287 PolarHBondContact O-N 3.36Å
270	L	90.9	Very high	78.9	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	130.2	179.5	174.7	59.8	0	0	0	108.9	F232 R242 F255 D261 G262 H284 A285 Y287	F232-L270 HydrophobicContact CB-CD2 3.98Å; F232-L270 HydrophobicContact CD1-CD1 3.94Å; F232-L270 HydrophobicContact CD1-CD2 4.33Å; F232-L270 HydrophobicContact CD2-CD1 4.17Å; F232-L270 HydrophobicContact CD2-CD2 3.95Å; F232-L270 HydrophobicContact CE1-CD1 3.83Å; F232-L270 HydrophobicContact CE2-CD1 4.06Å; F232-L270 HydrophobicContact CG-CD1 4.12Å; F232-L270 HydrophobicContact CG-CD2 3.81Å; F232-L270 HydrophobicContact CZ-CD1 3.88Å; R242-L270 HydrophobicContact CB-CD2 3.83Å; R242-L270 HydrophobicContact CG-CD2 3.69Å; F255-L270 HydrophobicContact CE1-CD2 4.23Å; F255-L270 HydrophobicContact CE1-CG 4.47Å; F255-L270 HydrophobicContact CE2-CD2 4.36Å; F255-L270 HydrophobicContact CE2-CG 4.23Å; F255-L270 HydrophobicContact CZ-CD1 4.01Å; F255-L270 HydrophobicContact CZ-CD2 3.73Å; F255-L270 HydrophobicContact CZ-CG 3.61Å; D261-L270 CarbonylContact C-O 3.57Å; D261-L270 WeakPolarHBondContact CA-O 3.18Å; G262-L270 PolarHBondContact N-O 3.16Å; L270-H284 CarbonylContact C-O 3.46Å; L270-H284 VanDerWaalsContact CA-O 3.3Å; L270-H284 WeakPolarHBondContact CA-O 3.46Å; L270-A285 HydrophobicContact CD1-CB 3.87Å; L270-Y287 HydrophobicContact CB-CD1 4.44Å; L270-Y287 HydrophobicContact CB-CE1 4.13Å
271	W	91	Very high	79.7	Confident	68 Å²	68	67.1 Å²	67.1	26%	0.258	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	159.3	176.8	70.5	95.6	0	0	0	112.7	A260 D261 R268 H284	A260-W271 WeakPolarHBondContact O-CA 3.42Å; D261-W271 HydrophobicContact CB-CB 4.45Å; R268-W271 HydrophobicContact CB-CB 4.3Å; R268-W271 HydrophobicContact CB-CD2 4.01Å; R268-W271 HydrophobicContact CB-CE3 3.61Å; R268-W271 HydrophobicContact CB-CG 4.33Å; R268-W271 HydrophobicContact CB-CZ3 4.3Å; R268-W271 WeakPolarHBondContact O-CZ3 3.47Å; W271-H284 HydrophobicContact CD2-CB 3.66Å; W271-H284 AromaticContact CE2-CG 3.73Å; W271-H284 HydrophobicContact CE3-CB 3.92Å; W271-H284 HydrophobicContact CG-CB 4.36Å; W271-H284 HydrophobicContact CH2-CB 3.58Å; W271-H284 HydrophobicContact CZ2-CB 3.28Å; W271-H284 AromaticContact CZ2-CG 3.65Å; W271-H284 HydrophobicContact CZ3-CB 3.88Å; W271-H284 PolarHBondContact N-O 2.91Å; W271-H284 AromaticContact NE1-CD2 3.61Å; W271-H284 AromaticContact NE1-CG 3.81Å; W271-H284 PolarHBondContact O-N 3.23Å
272	I	93.8	Very high	80.8	Confident	18 Å²	18	65.2 Å²	65.2	9%	0.092	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.9	176	-53.7	173	0	0	0	109	Y244 F255 A260 V281 L283	Y244-I272 HydrophobicContact CD2-CD1 3.71Å; Y244-I272 HydrophobicContact CE2-CD1 3.97Å; F255-I272 HydrophobicContact CD1-CD1 3.98Å; F255-I272 HydrophobicContact CD2-CD1 3.99Å; F255-I272 HydrophobicContact CE1-CD1 3.87Å; F255-I272 HydrophobicContact CE1-CG1 4.17Å; F255-I272 HydrophobicContact CE2-CD1 3.87Å; F255-I272 HydrophobicContact CE2-CG1 3.98Å; F255-I272 HydrophobicContact CG-CD1 4.02Å; F255-I272 HydrophobicContact CZ-CD1 3.79Å; F255-I272 HydrophobicContact CZ-CG1 3.72Å; A260-I272 PolarHBondContact O-N 3.36Å; I272-V281 HydrophobicContact CG2-CB 4.33Å; I272-L283 HydrophobicContact CG1-CD2 4.44Å; I272-L283 HydrophobicContact CG1-CG 4.22Å
273	S	93.5	Very high	82.5	Confident	34 Å²	34	65.2 Å²	65.2	24%	0.238	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	109	177.8	-177.5	0	0	0	0	109.2	R275 V281 E282	S273-R275 PolarHBondContact O-N 3.34Å; S273-V281 CarbonylContact O-C 3.56Å; S273-V281 WeakPolarHBondContact O-CA 3.23Å; S273-E282 PolarHBondContact N-O 2.73Å; S273-E282 PolarHBondContact O-N 3.07Å
274	E	93.4	Very high	84.4	Confident	88 Å²	88	61.9 Å²	61.9	41%	0.411	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	111.7	174.8	-170.8	173.9	-136.4	0	0	109.8	A253 P277 G278 V281	A253-E274 HydrophobicContact CB-CB 3.8Å; A253-E274 HydrophobicContact CB-CG 4.26Å; E274-P277 VanDerWaalsContact OE1-CA 3.23Å; E274-P277 WeakPolarHBondContact OE1-CA 3.47Å; E274-G278 PolarHBondContact OE1-N 3.27Å; E274-G278 VanDerWaalsContact OE1-N 3.12Å; E274-V281 HydrophobicContact CG-CG1 4.38Å
275	R	94.7	Very high	86.7	Confident	150 Å²	150	60.4 Å²	60.4	57%	0.566	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	-30.6	-178.6	-53.3	-65.6	-98.4	163	-1.9	111.6	S273 H280 E282	S273-R275 PolarHBondContact O-N 3.34Å; R275-H280 HydrophobicContact CB-CB 4.28Å; R275-H280 WeakPolarHBondContact CB-ND1 3.34Å; R275-H280 PolarHBondContact N-O 3.08Å; R275-E282 WeakPolarHBondContact CD-OE1 3.2Å; R275-E282 HydrophobicContact CG-CG 3.68Å; R275-E282 WeakPolarHBondContact CG-OE1 3.39Å; R275-E282 IonicContact CZ-OE1 2.81Å; R275-E282 IonicContact NE-OE1 3.73Å; R275-E282 PolarHBondContact NE-OE1 2.97Å; R275-E282 IonicContact NE-OE2 3.96Å; R275-E282 IonicContact NH2-OE1 3.94Å
276	S	92.9	Very high	88.5	Confident	35 Å²	35	58.2 Å²	58.2	25%	0.245	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	121.5	172.8	-59.7	0	0	0	0	108.7	G278 R279 H280	S276-G278 PolarHBondContact O-N 3.25Å; S276-R279 PolarHBondContact O-N 3.02Å; S276-H280 PolarHBondContact N-O 3.32Å; S276-H280 VanDerWaalsContact N-O 3.11Å; S276-H280 PolarHBondContact O-N 2.92Å
277	P	92	Very high	90.3	Very high	104 Å²	104	47.7 Å²	47.7	68%	0.675	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.5	123.1	-174.4	-31.7	36.5	0	0	0	113.5	E274 R279	E274-P277 VanDerWaalsContact OE1-CA 3.23Å; E274-P277 WeakPolarHBondContact OE1-CA 3.47Å; P277-R279 PolarHBondContact O-N 3.33Å
278	G	90.3	Very high	91.9	Very high	33 Å²	33	45.2 Å²	45.2	34%	0.34	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	11.9	179.2	0	0	0	0	0	116	E274 S276	E274-G278 PolarHBondContact OE1-N 3.27Å; E274-G278 VanDerWaalsContact OE1-N 3.12Å; S276-G278 PolarHBondContact O-N 3.25Å
279	R	94.6	Very high	92.9	Very high	158 Å²	158	38.2 Å²	38.2	60%	0.596	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-133.3	-26.8	-176.5	-71	-169.1	-66.7	131.3	-2.4	115.2	S276 P277 R295 Q296	S276-R279 PolarHBondContact O-N 3.02Å; P277-R279 PolarHBondContact O-N 3.33Å; R279-R295 CarbonylContact O-C 3.6Å; R279-R295 WeakPolarHBondContact O-CA 3.3Å; R279-Q296 PolarHBondContact O-N 3.33Å
280	H	96.2	Very high	93.5	Very high	23 Å²	23	38.3 Å²	38.3	11%	0.106	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	116.7	-178.3	-179.7	-164.3	0	0	0	110.5	R275 S276 E282 I293 I294 R295	R275-H280 HydrophobicContact CB-CB 4.28Å; R275-H280 WeakPolarHBondContact CB-ND1 3.34Å; R275-H280 PolarHBondContact N-O 3.08Å; S276-H280 PolarHBondContact N-O 3.32Å; S276-H280 VanDerWaalsContact N-O 3.11Å; S276-H280 PolarHBondContact O-N 2.92Å; H280-E282 IonicContact CE1-OE1 3.44Å; H280-E282 IonicContact NE2-OE1 3.79Å; H280-I293 WeakPolarHBondContact NE2-CG2 3.33Å; H280-I294 WeakPolarHBondContact CA-O 3.35Å; H280-R295 HydrophobicContact CB-CG 4.12Å; H280-R295 PolarHBondContact CD2-NE 2.93Å; H280-R295 PolarHBondContact CE1-NE 3.19Å; H280-R295 PolarHBondContact CE1-NH2 2.86Å; H280-R295 PolarHBondContact NE2-NE 2.93Å; H280-R295 PolarHBondContact NE2-NH2 3.37Å
281	V	97.2	Very high	93.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	149.3	174.5	-60.4	0	0	0	0	110.2	Y244 L251 I272 S273 E274 L283 I294	Y244-V281 WeakPolarHBondContact OH-CG2 3.44Å; L251-V281 HydrophobicContact CD1-CG2 3.89Å; L251-V281 HydrophobicContact CD2-CG1 4.19Å; L251-V281 HydrophobicContact CD2-CG2 4.14Å; L251-V281 HydrophobicContact CG-CG1 4Å; L251-V281 HydrophobicContact CG-CG2 3.93Å; I272-V281 HydrophobicContact CG2-CB 4.33Å; S273-V281 CarbonylContact O-C 3.56Å; S273-V281 WeakPolarHBondContact O-CA 3.23Å; E274-V281 HydrophobicContact CG-CG1 4.38Å; V281-L283 HydrophobicContact CG2-CD1 4.12Å; V281-I294 HydrophobicContact CG2-CB 3.9Å; V281-I294 HydrophobicContact CG2-CD1 4.48Å; V281-I294 PolarHBondContact N-O 3.37Å; V281-I294 PolarHBondContact O-N 3.29Å
282	E	97.3	Very high	94.2	Very high	24 Å²	24	35.5 Å²	35.5	11%	0.112	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125.1	173.2	-53.3	176.2	-175.8	0	0	108.6	S273 R275 H280 H284 V292 I293	S273-E282 PolarHBondContact N-O 2.73Å; S273-E282 PolarHBondContact O-N 3.07Å; R275-E282 WeakPolarHBondContact CD-OE1 3.2Å; R275-E282 HydrophobicContact CG-CG 3.68Å; R275-E282 WeakPolarHBondContact CG-OE1 3.39Å; R275-E282 IonicContact CZ-OE1 2.81Å; R275-E282 IonicContact NE-OE1 3.73Å; R275-E282 PolarHBondContact NE-OE1 2.97Å; R275-E282 IonicContact NE-OE2 3.96Å; R275-E282 IonicContact NH2-OE1 3.94Å; H280-E282 IonicContact CE1-OE1 3.44Å; H280-E282 IonicContact NE2-OE1 3.79Å; E282-H284 VanDerWaalsContact CB-NE2 3.32Å; E282-H284 WeakPolarHBondContact CB-NE2 3.46Å; E282-H284 PolarHBondContact O-CD2 2.78Å; E282-H284 IonicContact OE2-CE1 2.73Å; E282-H284 IonicContact OE2-NE2 3.32Å; E282-H284 PolarHBondContact OE2-NE2 2.73Å; E282-V292 CarbonylContact C-O 3.59Å; E282-V292 VanDerWaalsContact CA-O 3.32Å; E282-V292 WeakPolarHBondContact CA-O 3.44Å; E282-I293 HydrophobicContact CG-CG1 4.16Å
283	L	97	Very high	94.4	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	128.7	174.1	-62.6	84.5	0	0	0	108.7	I230 F232 Y244 F255 I272 V281 T291 V292 I294	I230-L283 HydrophobicContact CD1-CD2 4.31Å; F232-L283 HydrophobicContact CE2-CD2 3.67Å; F232-L283 HydrophobicContact CZ-CB 4.12Å; F232-L283 HydrophobicContact CZ-CD2 3.89Å; Y244-L283 HydrophobicContact CD1-CD1 4.29Å; Y244-L283 HydrophobicContact CD1-CD2 3.87Å; Y244-L283 HydrophobicContact CD2-CD2 3.94Å; Y244-L283 HydrophobicContact CE1-CD1 4.22Å; Y244-L283 HydrophobicContact CG-CD2 3.55Å; F255-L283 HydrophobicContact CE1-CD2 4.36Å; I272-L283 HydrophobicContact CG1-CD2 4.44Å; I272-L283 HydrophobicContact CG1-CG 4.22Å; V281-L283 HydrophobicContact CG2-CD1 4.12Å; L283-T291 CarbonylContact O-C 3.55Å; L283-T291 WeakPolarHBondContact O-CA 3.23Å; L283-V292 HydrophobicContact CB-CB 4.28Å; L283-V292 PolarHBondContact N-O 2.81Å; L283-V292 PolarHBondContact O-N 3.36Å; L283-I294 HydrophobicContact CD1-CD1 3.79Å; L283-I294 HydrophobicContact CD1-CG1 4.36Å
284	H	95.4	Very high	94.7	Very high	34 Å²	34	33.2 Å²	33.2	16%	0.157	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	111.4	-175.8	-65.9	-88.7	0	0	0	109.2	L270 W271 E282	L270-H284 CarbonylContact C-O 3.46Å; L270-H284 VanDerWaalsContact CA-O 3.3Å; L270-H284 WeakPolarHBondContact CA-O 3.46Å; W271-H284 HydrophobicContact CD2-CB 3.66Å; W271-H284 AromaticContact CE2-CG 3.73Å; W271-H284 HydrophobicContact CE3-CB 3.92Å; W271-H284 HydrophobicContact CG-CB 4.36Å; W271-H284 HydrophobicContact CH2-CB 3.58Å; W271-H284 HydrophobicContact CZ2-CB 3.28Å; W271-H284 AromaticContact CZ2-CG 3.65Å; W271-H284 HydrophobicContact CZ3-CB 3.88Å; W271-H284 PolarHBondContact N-O 2.91Å; W271-H284 AromaticContact NE1-CD2 3.61Å; W271-H284 AromaticContact NE1-CG 3.81Å; W271-H284 PolarHBondContact O-N 3.23Å; E282-H284 VanDerWaalsContact CB-NE2 3.32Å; E282-H284 WeakPolarHBondContact CB-NE2 3.46Å; E282-H284 PolarHBondContact O-CD2 2.78Å; E282-H284 IonicContact OE2-CE1 2.73Å; E282-H284 IonicContact OE2-NE2 3.32Å; E282-H284 PolarHBondContact OE2-NE2 2.73Å
285	A	94.3	Very high	94.9	Very high	2 Å²	2	30.5 Å²	30.5	2%	0.017	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	78.2	174.8	0	0	0	0	0	109.1	F232 A269 L270 Y287 I288 G289 V290	F232-A285 HydrophobicContact CD1-CB 3.97Å; F232-A285 HydrophobicContact CE1-CB 3.67Å; A269-A285 CarbonylContact O-C 3.6Å; L270-A285 HydrophobicContact CD1-CB 3.87Å; A285-Y287 HydrophobicContact CB-CD1 4.23Å; A285-Y287 HydrophobicContact CB-CE1 3.75Å; A285-Y287 PolarHBondContact O-N 2.78Å; A285-I288 HydrophobicContact CB-CD1 3.94Å; A285-I288 HydrophobicContact CB-CG1 3.61Å; A285-I288 CarbonylContact O-C 3.55Å; A285-I288 PolarHBondContact O-N 3.1Å; A285-I288 VanDerWaalsContact O-N 3.16Å; A285-G289 PolarHBondContact O-N 2.96Å; A285-V290 HydrophobicContact CB-CB 4.17Å; A285-V290 PolarHBondContact N-O 3.22Å; A285-V290 PolarHBondContact O-N 3.4Å; A285-V290 VanDerWaalsContact O-N 3.12Å
286	G	90.6	Very high	94.9	Very high	20 Å²	20	24.4 Å²	24.4	21%	0.206	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-28.3	-178.3	0	0	0	0	0	114.1	Y145 A269 I288 G289	Y145-G286 WeakPolarHBondContact CB-O 3.44Å; Y145-G286 PolarHBondContact N-O 3.36Å; A269-G286 PolarHBondContact O-N 3.27Å; G286-I288 VanDerWaalsContact C-N 3.29Å; G286-I288 PolarHBondContact O-N 3.48Å; G286-G289 PolarHBondContact O-N 2.78Å
287	Y	88	Confident	95	Very high	1 Å²	1	24.3 Å²	24.3	0%	0.004	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-20.3	179.4	71.8	-83.9	0	0	0	114.8	C143 R148 Y235 C238 T239 A269 L270 A285	C143-Y287 WeakPolarHBondContact O-CA 3.29Å; C143-Y287 WeakPolarHBondContact O-CB 3.32Å; C143-Y287 PolarHBondContact O-N 3.28Å; R148-Y287 PolarHBondContact NH2-O 3.05Å; Y235-Y287 VanDerWaalsContact CB-CE2 3.43Å; Y235-Y287 AromaticContact CD1-CD2 3.94Å; Y235-Y287 HydrophobicContact CD1-CD2 3.94Å; Y235-Y287 AromaticContact CD2-CD2 3.86Å; Y235-Y287 HydrophobicContact CD2-CD2 3.86Å; Y235-Y287 AromaticContact CD2-CE2 3.91Å; Y235-Y287 HydrophobicContact CD2-CE2 3.91Å; Y235-Y287 AromaticContact CG-CD2 3.51Å; Y235-Y287 HydrophobicContact CG-CD2 3.51Å; Y235-Y287 AromaticContact CG-CE2 3.7Å; Y235-Y287 HydrophobicContact CG-CE2 3.7Å; C238-Y287 HydrophobicContact CB-CD2 4.48Å; C238-Y287 HydrophobicContact CB-CG 4.25Å; T239-Y287 HydrophobicContact CG2-CD1 4.16Å; T239-Y287 HydrophobicContact CG2-CE1 3.57Å; T239-Y287 HydrophobicContact CG2-CE2 4.02Å; T239-Y287 VanDerWaalsContact CG2-CZ 3.5Å; A269-Y287 HydrophobicContact CB-CD1 4.25Å; A269-Y287 WeakPolarHBondContact O-CD1 3.36Å; A269-Y287 PolarHBondContact O-N 3.36Å; L270-Y287 HydrophobicContact CB-CD1 4.44Å; L270-Y287 HydrophobicContact CB-CE1 4.13Å; A285-Y287 HydrophobicContact CB-CD1 4.23Å; A285-Y287 HydrophobicContact CB-CE1 3.75Å; A285-Y287 PolarHBondContact O-N 2.78Å
288	I	92	Very high	94.9	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.01	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.7	7.1	175.9	49.4	169.6	0	0	0	112.4	Y206 Y235 A285 G286 V290 P308 L311	Y206-I288 HydrophobicContact CD1-CG2 4.1Å; Y206-I288 HydrophobicContact CG-CG2 4.47Å; Y235-I288 HydrophobicContact CD2-CG2 4.29Å; Y235-I288 HydrophobicContact CE2-CG2 4.43Å; A285-I288 HydrophobicContact CB-CD1 3.94Å; A285-I288 HydrophobicContact CB-CG1 3.61Å; A285-I288 CarbonylContact O-C 3.55Å; A285-I288 PolarHBondContact O-N 3.1Å; A285-I288 VanDerWaalsContact O-N 3.16Å; G286-I288 VanDerWaalsContact C-N 3.29Å; G286-I288 PolarHBondContact O-N 3.48Å; I288-V290 HydrophobicContact CB-CG2 4.45Å; I288-V290 HydrophobicContact CD1-CB 4.13Å; I288-V290 HydrophobicContact CD1-CG2 3.83Å; I288-V290 HydrophobicContact CG1-CB 4.17Å; I288-V290 HydrophobicContact CG1-CG2 3.99Å; I288-V290 PolarHBondContact O-N 2.89Å; I288-P308 WeakPolarHBondContact O-CD 3.36Å; I288-P308 WeakPolarHBondContact O-CG 3.43Å; I288-L311 HydrophobicContact CB-CD1 3.58Å; I288-L311 HydrophobicContact CG2-CD1 3.91Å; I288-L311 WeakPolarHBondContact O-CD1 3.46Å
289	G	92.6	Very high	95	Very high	7 Å²	7	27.2 Å²	27.2	7%	0.072	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	19.6	178.5	0	0	0	0	0	114.6	Y145 Y172 A285 G286	Y145-G289 VanDerWaalsContact CB-N 3.33Å; Y172-G289 WeakPolarHBondContact CE1-O 3.47Å; A285-G289 PolarHBondContact O-N 2.96Å; G286-G289 PolarHBondContact O-N 2.78Å
290	V	96.5	Very high	95	Very high	2 Å²	2	21 Å²	21	1%	0.012	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	138.7	-178	172.2	0	0	0	0	110.9	L207 A285 I288 V292 V305 R306 I307	L207-V290 HydrophobicContact CD2-CG1 4.07Å; A285-V290 HydrophobicContact CB-CB 4.17Å; A285-V290 PolarHBondContact N-O 3.22Å; A285-V290 PolarHBondContact O-N 3.4Å; A285-V290 VanDerWaalsContact O-N 3.12Å; I288-V290 HydrophobicContact CB-CG2 4.45Å; I288-V290 HydrophobicContact CD1-CB 4.13Å; I288-V290 HydrophobicContact CD1-CG2 3.83Å; I288-V290 HydrophobicContact CG1-CB 4.17Å; I288-V290 HydrophobicContact CG1-CG2 3.99Å; I288-V290 PolarHBondContact O-N 2.89Å; V290-V292 HydrophobicContact CG1-CG2 3.9Å; V290-V305 HydrophobicContact CG1-CG1 4.43Å; V290-R306 WeakPolarHBondContact CA-O 3.47Å; V290-I307 HydrophobicContact CG2-CB 4.16Å; V290-I307 HydrophobicContact CG2-CD1 4.13Å; V290-I307 HydrophobicContact CG2-CG1 3.78Å
291	T	97.6	Very high	95.1	Very high	10 Å²	10	20 Å²	20	6%	0.061	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	130.3	170.4	-52.9	0	0	0	0	109.2	L283 V305 R306 L409	L283-T291 CarbonylContact O-C 3.55Å; L283-T291 WeakPolarHBondContact O-CA 3.23Å; T291-V305 WeakPolarHBondContact O-CA 3.39Å; T291-R306 PolarHBondContact N-O 3.03Å; T291-R306 PolarHBondContact O-N 3.5Å; T291-R306 PolarHBondContact OG1-NH2 3.42Å; T291-R306 VanDerWaalsContact OG1-NH2 3.08Å; T291-L409 HydrophobicContact CG2-CD2 3.95Å
292	V	98.5	Very high	95.1	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	128.1	177.2	-174.1	0	0	0	0	109.6	I230 E282 L283 V290 I294 L303 A304 V305	I230-V292 HydrophobicContact CD1-CB 4.29Å; I230-V292 HydrophobicContact CD1-CG1 3.67Å; I230-V292 HydrophobicContact CD1-CG2 4.45Å; E282-V292 CarbonylContact C-O 3.59Å; E282-V292 VanDerWaalsContact CA-O 3.32Å; E282-V292 WeakPolarHBondContact CA-O 3.44Å; L283-V292 HydrophobicContact CB-CB 4.28Å; L283-V292 PolarHBondContact N-O 2.81Å; L283-V292 PolarHBondContact O-N 3.36Å; V290-V292 HydrophobicContact CG1-CG2 3.9Å; V292-I294 HydrophobicContact CG1-CG1 4.19Å; V292-L303 HydrophobicContact CG1-CD1 3.35Å; V292-L303 HydrophobicContact CG1-CG 4.41Å; V292-A304 CarbonylContact C-O 3.58Å; V292-A304 WeakPolarHBondContact CA-O 3.47Å; V292-V305 HydrophobicContact CG1-CG2 4.09Å; V292-V305 HydrophobicContact CG2-CG1 4.26Å; V292-V305 HydrophobicContact CG2-CG2 4.21Å
293	I	98.6	Very high	95.2	Very high	3 Å²	3	19.4 Å²	19.4	2%	0.015	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	129.9	174.5	-60	177.6	0	0	0	108.2	H280 E282 R295 L303 A304 L409	H280-I293 WeakPolarHBondContact NE2-CG2 3.33Å; E282-I293 HydrophobicContact CG-CG1 4.16Å; I293-R295 HydrophobicContact CG2-CG 4.28Å; I293-L303 WeakPolarHBondContact O-CA 3.39Å; I293-A304 HydrophobicContact CB-CB 4.36Å; I293-A304 PolarHBondContact N-O 3.35Å; I293-A304 PolarHBondContact O-N 2.98Å; I293-L409 HydrophobicContact CD1-CD1 3.66Å; I293-L409 HydrophobicContact CD1-CD2 4.17Å; I293-L409 HydrophobicContact CD1-CG 3.83Å; I293-L409 HydrophobicContact CG1-CD1 3.93Å
294	I	98.5	Very high	95.3	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	133.1	174	-54.9	167.4	0	0	0	108.8	I228 I230 Y244 L251 H280 V281 L283 V292 T302 L303	I228-I294 HydrophobicContact CD1-CG1 4.35Å; I228-I294 HydrophobicContact CD1-CG2 3.64Å; I228-I294 HydrophobicContact CG2-CD1 4.06Å; I230-I294 HydrophobicContact CD1-CD1 3.82Å; Y244-I294 HydrophobicContact CD1-CD1 3.89Å; Y244-I294 HydrophobicContact CE1-CD1 3.39Å; L251-I294 HydrophobicContact CD1-CB 4.14Å; L251-I294 HydrophobicContact CD1-CG2 3.52Å; H280-I294 WeakPolarHBondContact CA-O 3.35Å; V281-I294 HydrophobicContact CG2-CB 3.9Å; V281-I294 HydrophobicContact CG2-CD1 4.48Å; V281-I294 PolarHBondContact N-O 3.37Å; V281-I294 PolarHBondContact O-N 3.29Å; L283-I294 HydrophobicContact CD1-CD1 3.79Å; L283-I294 HydrophobicContact CD1-CG1 4.36Å; V292-I294 HydrophobicContact CG1-CG1 4.19Å; I294-T302 WeakPolarHBondContact CA-O 3.45Å; I294-L303 HydrophobicContact CD1-CD1 4.41Å; I294-L303 HydrophobicContact CG1-CD1 3.73Å
295	R	97.6	Very high	95.4	Very high	32 Å²	32	17.8 Å²	17.8	12%	0.121	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	146.1	173.8	-59.9	-176.5	175.1	134.8	7.9	111.5	R279 H280 I293 L297 L301 T302 S401 D405	R279-R295 CarbonylContact O-C 3.6Å; R279-R295 WeakPolarHBondContact O-CA 3.3Å; H280-R295 HydrophobicContact CB-CG 4.12Å; H280-R295 PolarHBondContact CD2-NE 2.93Å; H280-R295 PolarHBondContact CE1-NE 3.19Å; H280-R295 PolarHBondContact CE1-NH2 2.86Å; H280-R295 PolarHBondContact NE2-NE 2.93Å; H280-R295 PolarHBondContact NE2-NH2 3.37Å; I293-R295 HydrophobicContact CG2-CG 4.28Å; R295-L297 HydrophobicContact CB-CD1 4.48Å; R295-L297 HydrophobicContact CB-CG 4.37Å; R295-L301 CarbonylContact O-C 3.54Å; R295-L301 VanDerWaalsContact O-CA 3.24Å; R295-L301 WeakPolarHBondContact O-CA 3.49Å; R295-T302 PolarHBondContact N-O 3.39Å; R295-T302 VanDerWaalsContact N-O 3.08Å; R295-T302 PolarHBondContact O-N 3.16Å; R295-S401 PolarHBondContact NH1-O 3.29Å; R295-D405 IonicContact CZ-OD1 2.78Å; R295-D405 IonicContact CZ-OD2 3.47Å; R295-D405 IonicContact NE-OD1 2.88Å; R295-D405 IonicContact NE-OD2 3.4Å; R295-D405 IonicContact NH1-OD1 3.83Å; R295-D405 PolarHBondContact NH1-OD1 2.78Å; R295-D405 IonicContact NH1-OD2 2.63Å; R295-D405 PolarHBondContact NH1-OD2 2.87Å; R295-D405 IonicContact NH2-OD1 3.76Å; R295-D405 PolarHBondContact NH2-OD1 3.03Å; R295-D405 IonicContact NH2-OD2 3.06Å
296	Q	96.4	Very high	95.6	Very high	21 Å²	21	21.2 Å²	21.2	10%	0.098	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.7	164.8	-177	173.8	-26.7	0	0	109.5	D249 R279 G298 Y300 L301	D249-Q296 PolarHBondContact OD1-NE2 2.81Å; R279-Q296 PolarHBondContact O-N 3.33Å; Q296-G298 PolarHBondContact NE2-O 3.28Å; Q296-Y300 WeakPolarHBondContact CA-O 3.35Å; Q296-L301 HydrophobicContact CB-CD2 3.8Å; Q296-L301 HydrophobicContact CG-CD2 4.12Å
297	L	93.9	Very high	95.9	Very high	33 Å²	33	20.3 Å²	20.3	17%	0.173	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	111.3	179.8	-64.5	169.4	0	0	0	108.7	R295 R299 Y300 T302 L397 A398 S401	R295-L297 HydrophobicContact CB-CD1 4.48Å; R295-L297 HydrophobicContact CB-CG 4.37Å; L297-R299 PolarHBondContact O-N 2.91Å; L297-Y300 PolarHBondContact N-O 3.2Å; L297-Y300 PolarHBondContact O-N 3.48Å; L297-T302 HydrophobicContact CD1-CG2 3.95Å; L297-L397 HydrophobicContact CD2-CB 4.38Å; L297-A398 VanDerWaalsContact CD1-CA 3.48Å; L297-A398 HydrophobicContact CD1-CB 4.25Å; L297-S401 VanDerWaalsContact CD1-CB 3.48Å
298	G	90.9	Very high	96.2	Very high	33 Å²	33	20.2 Å²	20.2	34%	0.34	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	-117.5	-165.7	0	0	0	0	0	110.4	Q296	Q296-G298 PolarHBondContact NE2-O 3.28Å
299	R	91	Very high	96.3	Very high	165 Å²	165	24.1 Å²	24.1	62%	0.623	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.8	1.7	-176.4	-60.3	-173.5	65.6	-164.4	-3.6	114.1	T248 L297	T248-R299 WeakPolarHBondContact CB-O 3.02Å; T248-R299 HydrophobicContact CG2-CB 4.37Å; T248-R299 WeakPolarHBondContact CG2-O 3.04Å; T248-R299 PolarHBondContact OG1-O 3.47Å; L297-R299 PolarHBondContact O-N 2.91Å
300	Y	95.7	Very high	96.2	Very high	27 Å²	27	28.3 Å²	28.3	11%	0.106	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	160.8	-171	-53.4	-65.5	0	0	0	111.3	V214 V216 A224 T225 Q296 L297 F395	V214-Y300 HydrophobicContact CG2-CE1 4.42Å; V216-Y300 HydrophobicContact CG1-CE2 4.42Å; V216-Y300 HydrophobicContact CG2-CE2 4.32Å; A224-Y300 HydrophobicContact CB-CD1 3.35Å; A224-Y300 HydrophobicContact CB-CD2 3.8Å; A224-Y300 HydrophobicContact CB-CE1 3.66Å; A224-Y300 HydrophobicContact CB-CE2 4.08Å; A224-Y300 HydrophobicContact CB-CG 3.42Å; A224-Y300 VanDerWaalsContact CB-CG 3.42Å; T225-Y300 CarbonylContact O-C 3.57Å; T225-Y300 WeakPolarHBondContact O-CA 3.48Å; T225-Y300 WeakPolarHBondContact O-CB 3.41Å; Q296-Y300 WeakPolarHBondContact CA-O 3.35Å; L297-Y300 PolarHBondContact N-O 3.2Å; L297-Y300 PolarHBondContact O-N 3.48Å; Y300-F395 HydrophobicContact CD2-CE1 4.13Å; Y300-F395 HydrophobicContact CD2-CE2 4.49Å; Y300-F395 AromaticContact CD2-CZ 3.72Å; Y300-F395 HydrophobicContact CD2-CZ 3.72Å; Y300-F395 HydrophobicContact CE2-CE2 4.28Å; Y300-F395 AromaticContact CE2-CZ 3.79Å; Y300-F395 HydrophobicContact CE2-CZ 3.79Å
301	L	97.6	Very high	96	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.016	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	143.8	-178.2	-55.9	176.8	0	0	0	110.2	T225 I228 A246 R295 Q296	T225-L301 HydrophobicContact CG2-CB 4.32Å; T225-L301 PolarHBondContact O-N 2.86Å; I228-L301 HydrophobicContact CB-CD1 4.42Å; I228-L301 HydrophobicContact CD1-CB 3.62Å; I228-L301 HydrophobicContact CD1-CD1 3.96Å; I228-L301 HydrophobicContact CD1-CG 4.42Å; I228-L301 HydrophobicContact CG1-CB 4.25Å; I228-L301 HydrophobicContact CG1-CD1 3.93Å; A246-L301 HydrophobicContact CB-CD1 4.19Å; R295-L301 CarbonylContact O-C 3.54Å; R295-L301 VanDerWaalsContact O-CA 3.24Å; R295-L301 WeakPolarHBondContact O-CA 3.49Å; Q296-L301 HydrophobicContact CB-CD2 3.8Å; Q296-L301 HydrophobicContact CG-CD2 4.12Å
302	T	97.9	Very high	95.7	Very high	5 Å²	5	28.5 Å²	28.5	3%	0.031	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	148.7	167.7	67.5	0	0	0	0	109.4	L177 F178 I294 R295 L297 A398	L177-T302 WeakPolarHBondContact O-CA 3.39Å; F178-T302 HydrophobicContact CB-CG2 3.76Å; I294-T302 WeakPolarHBondContact CA-O 3.45Å; R295-T302 PolarHBondContact N-O 3.39Å; R295-T302 VanDerWaalsContact N-O 3.08Å; R295-T302 PolarHBondContact O-N 3.16Å; L297-T302 HydrophobicContact CD1-CG2 3.95Å; T302-A398 HydrophobicContact CG2-CB 4.19Å
303	L	98.5	Very high	95.2	Very high	6 Å²	6	33.7 Å²	33.7	3%	0.031	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	137.7	-179.1	-177.9	79.8	0	0	0	110.1	G176 L177 L201 V209 I228 V292 I293 I294 V305	G176-L303 CarbonylContact C-O 3.54Å; G176-L303 WeakPolarHBondContact CA-O 3.5Å; L177-L303 HydrophobicContact CB-CB 4.39Å; L177-L303 PolarHBondContact N-O 3.12Å; L177-L303 PolarHBondContact O-N 3.35Å; L201-L303 HydrophobicContact CD2-CD2 3.37Å; V209-L303 HydrophobicContact CG1-CD2 3.75Å; I228-L303 HydrophobicContact CD1-CB 4.16Å; I228-L303 HydrophobicContact CD1-CD1 4.31Å; I228-L303 HydrophobicContact CG2-CD1 4.2Å; V292-L303 HydrophobicContact CG1-CD1 3.35Å; V292-L303 HydrophobicContact CG1-CG 4.41Å; I293-L303 WeakPolarHBondContact O-CA 3.39Å; I294-L303 HydrophobicContact CD1-CD1 4.41Å; I294-L303 HydrophobicContact CG1-CD1 3.73Å; L303-V305 HydrophobicContact CD1-CG2 4.41Å; L303-V305 HydrophobicContact CD2-CG2 4.02Å; L303-V305 HydrophobicContact CG-CG2 4.08Å
304	A	98.5	Very high	94.8	Very high	2 Å²	2	34.7 Å²	34.7	2%	0.017	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	136.5	166	0	0	0	0	0	110.6	F174 C175 V292 I293 D405 L409	F174-A304 HydrophobicContact CE2-CB 3.92Å; F174-A304 HydrophobicContact CZ-CB 4.14Å; C175-A304 CarbonylContact O-C 3.59Å; C175-A304 WeakPolarHBondContact O-CA 3.45Å; V292-A304 CarbonylContact C-O 3.58Å; V292-A304 WeakPolarHBondContact CA-O 3.47Å; I293-A304 HydrophobicContact CB-CB 4.36Å; I293-A304 PolarHBondContact N-O 3.35Å; I293-A304 PolarHBondContact O-N 2.98Å; A304-D405 HydrophobicContact CB-CB 3.59Å; A304-L409 HydrophobicContact CB-CD1 3.96Å
305	V	98.6	Very high	94.2	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	132.5	-175.4	-176.8	0	0	0	0	109.8	F174 C175 I202 V290 T291 V292 L303 I307	F174-V305 WeakPolarHBondContact CA-O 3.11Å; C175-V305 PolarHBondContact N-O 3.33Å; C175-V305 PolarHBondContact O-N 3.08Å; I202-V305 HydrophobicContact CD1-CB 4.25Å; I202-V305 HydrophobicContact CD1-CG1 3.75Å; I202-V305 HydrophobicContact CD1-CG2 4.17Å; V290-V305 HydrophobicContact CG1-CG1 4.43Å; T291-V305 WeakPolarHBondContact O-CA 3.39Å; V292-V305 HydrophobicContact CG1-CG2 4.09Å; V292-V305 HydrophobicContact CG2-CG1 4.26Å; V292-V305 HydrophobicContact CG2-CG2 4.21Å; L303-V305 HydrophobicContact CD1-CG2 4.41Å; L303-V305 HydrophobicContact CD2-CG2 4.02Å; L303-V305 HydrophobicContact CG-CG2 4.08Å; V305-I307 HydrophobicContact CG1-CB 4.48Å
306	R	97.8	Very high	93.5	Very high	73 Å²	73	41.5 Å²	41.5	28%	0.275	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	126.9	164.4	-171.5	-176.4	65.4	179.9	-3.5	109.1	Y172 L173 V290 T291 L409	Y172-R306 HydrophobicContact CD1-CG 3.73Å; Y172-R306 HydrophobicContact CG-CG 4.28Å; L173-R306 WeakPolarHBondContact O-CA 3.42Å; V290-R306 WeakPolarHBondContact CA-O 3.47Å; T291-R306 PolarHBondContact N-O 3.03Å; T291-R306 PolarHBondContact O-N 3.5Å; T291-R306 PolarHBondContact OG1-NH2 3.42Å; T291-R306 VanDerWaalsContact OG1-NH2 3.08Å; R306-L409 HydrophobicContact CB-CB 4.12Å; R306-L409 HydrophobicContact CB-CD1 4.32Å; R306-L409 HydrophobicContact CB-CD2 4.07Å; R306-L409 HydrophobicContact CB-CG 4.4Å; R306-L409 VanDerWaalsContact CD-O 3.27Å; R306-L409 WeakPolarHBondContact CD-O 3.42Å
307	I	96.6	Very high	92.4	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	144.9	-177	-175.6	161.5	0	0	0	110.1	Y172 L173 F186 V290 V305 L311 A312	Y172-I307 CarbonylContact C-O 3.56Å; Y172-I307 WeakPolarHBondContact CA-O 3.12Å; L173-I307 HydrophobicContact CB-CG2 4.25Å; L173-I307 PolarHBondContact N-O 3.32Å; L173-I307 PolarHBondContact O-N 3.38Å; L173-I307 VanDerWaalsContact O-N 3.08Å; F186-I307 HydrophobicContact CD1-CG2 4.09Å; F186-I307 HydrophobicContact CE1-CG2 3.33Å; F186-I307 HydrophobicContact CE2-CG2 4.27Å; F186-I307 HydrophobicContact CZ-CG2 3.45Å; F186-I307 VanDerWaalsContact CZ-CG2 3.45Å; V290-I307 HydrophobicContact CG2-CB 4.16Å; V290-I307 HydrophobicContact CG2-CD1 4.13Å; V290-I307 HydrophobicContact CG2-CG1 3.78Å; V305-I307 HydrophobicContact CG1-CB 4.48Å; I307-L311 HydrophobicContact CD1-CB 4.26Å; I307-L311 HydrophobicContact CG1-CB 4.13Å; I307-A312 HydrophobicContact CD1-CB 4.32Å; I307-A312 HydrophobicContact CG1-CB 4.36Å; I307-A312 HydrophobicContact CG2-CB 3.89Å
308	P	95.4	Very high	91.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	141	169.1	-21.9	33.4	0	0	0	112.1	Y145 G171 Y172 I288 E310 L311 A312	Y145-P308 HydrophobicContact CD1-CG 4.16Å; Y145-P308 HydrophobicContact CE1-CB 4.01Å; Y145-P308 HydrophobicContact CE1-CG 3.5Å; Y145-P308 VanDerWaalsContact CE1-CG 3.5Å; Y145-P308 HydrophobicContact CE2-CB 4.39Å; Y145-P308 HydrophobicContact CE2-CG 4.1Å; Y145-P308 VanDerWaalsContact CZ-CG 3.48Å; Y145-P308 VanDerWaalsContact OH-CB 3.24Å; Y145-P308 WeakPolarHBondContact OH-CB 3.43Å; G171-P308 CarbonylContact O-C 3.57Å; G171-P308 WeakPolarHBondContact O-CA 3.3Å; Y172-P308 HydrophobicContact CD1-CG 4.33Å; Y172-P308 HydrophobicContact CE1-CB 4.48Å; Y172-P308 HydrophobicContact CE1-CG 3.8Å; I288-P308 WeakPolarHBondContact O-CD 3.36Å; I288-P308 WeakPolarHBondContact O-CG 3.43Å; P308-E310 VanDerWaalsContact C-N 3.3Å; P308-E310 HydrophobicContact CB-CG 4.19Å; P308-E310 PolarHBondContact O-N 2.88Å; P308-L311 HydrophobicContact CB-CG 4.27Å; P308-L311 HydrophobicContact CG-CD1 4.16Å; P308-L311 HydrophobicContact CG-CG 4.42Å; P308-L311 PolarHBondContact O-N 3.35Å; P308-L311 VanDerWaalsContact O-N 3.08Å; P308-A312 PolarHBondContact O-N 2.83Å
309	E	92.8	Very high	91	Very high	83 Å²	83	50.9 Å²	50.9	39%	0.388	24%	0.244	S	C	.	.	H	α-helix	trans	-56.5	-43.4	-176.7	175	167.1	-162.7	0	0	112.5	G171 L173 L311 A312 Q313	G171-E309 PolarHBondContact O-N 2.54Å; L173-E309 HydrophobicContact CD1-CB 4.08Å; L173-E309 HydrophobicContact CD1-CG 4.08Å; L173-E309 HydrophobicContact CG-CB 4.04Å; L173-E309 HydrophobicContact CG-CG 4.42Å; E309-L311 VanDerWaalsContact C-N 3.29Å; E309-L311 PolarHBondContact O-N 3.22Å; E309-A312 PolarHBondContact O-N 3.27Å; E309-Q313 WeakPolarHBondContact O-CG 3.33Å; E309-Q313 PolarHBondContact O-N 3.23Å; E309-Q313 VanDerWaalsContact O-N 3.12Å; E309-Q313 PolarHBondContact OE1-NE2 3.41Å
310	E	90.3	Very high	90.3	Very high	95 Å²	95	48.7 Å²	48.7	44%	0.444	25%	0.245	S	C	.	.	H	α-helix	trans	-60.4	-34.4	177.4	64.3	-148.6	-143.2	0	0	113.6	Y145 P308 A314	Y145-E310 WeakPolarHBondContact CE2-OE1 3.44Å; Y145-E310 PolarHBondContact OH-OE1 2.9Å; Y145-E310 PolarHBondContact OH-OE2 2.82Å; P308-E310 VanDerWaalsContact C-N 3.3Å; P308-E310 HydrophobicContact CB-CG 4.19Å; P308-E310 PolarHBondContact O-N 2.88Å; E310-A314 WeakPolarHBondContact O-CB 3.4Å; E310-A314 PolarHBondContact O-N 3.18Å
311	L	92.3	Very high	89.9	Confident	15 Å²	15	50.7 Å²	50.7	8%	0.079	26%	0.257	C	S	.	.	H	α-helix	trans	-81.8	-33.6	178	-58	-171.2	0	0	0	111.6	N204 Y206 I288 I307 P308 E309 Q313 A314	N204-L311 PolarHBondContact ND2-O 3.22Å; Y206-L311 HydrophobicContact CD2-CB 4.3Å; Y206-L311 HydrophobicContact CD2-CD2 3.85Å; Y206-L311 HydrophobicContact CD2-CG 4.5Å; Y206-L311 HydrophobicContact CE1-CD2 4.42Å; Y206-L311 HydrophobicContact CE2-CD2 3.52Å; Y206-L311 HydrophobicContact CG-CD2 4.43Å; I288-L311 HydrophobicContact CB-CD1 3.58Å; I288-L311 HydrophobicContact CG2-CD1 3.91Å; I288-L311 WeakPolarHBondContact O-CD1 3.46Å; I307-L311 HydrophobicContact CD1-CB 4.26Å; I307-L311 HydrophobicContact CG1-CB 4.13Å; P308-L311 HydrophobicContact CB-CG 4.27Å; P308-L311 HydrophobicContact CG-CD1 4.16Å; P308-L311 HydrophobicContact CG-CG 4.42Å; P308-L311 PolarHBondContact O-N 3.35Å; P308-L311 VanDerWaalsContact O-N 3.08Å; E309-L311 VanDerWaalsContact C-N 3.29Å; E309-L311 PolarHBondContact O-N 3.22Å; L311-Q313 PolarHBondContact O-N 2.81Å; L311-A314 PolarHBondContact O-N 3.44Å
312	A	92	Very high	89.8	Confident	2 Å²	2	50.7 Å²	50.7	2%	0.017	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-25.3	173.9	0	0	0	0	0	112.5	L173 F186 I307 P308 E309	L173-A312 HydrophobicContact CD1-CB 3.8Å; F186-A312 HydrophobicContact CD2-CB 4.22Å; F186-A312 HydrophobicContact CE2-CB 4.09Å; I307-A312 HydrophobicContact CD1-CB 4.32Å; I307-A312 HydrophobicContact CG1-CB 4.36Å; I307-A312 HydrophobicContact CG2-CB 3.89Å; P308-A312 PolarHBondContact O-N 2.83Å; E309-A312 PolarHBondContact O-N 3.27Å
313	Q	88.7	Confident	89.7	Confident	109 Å²	109	50.5 Å²	50.5	51%	0.509	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-3.2	179.1	-65.4	175.5	10.1	0	0	113.8	E309 L311 Y315	E309-Q313 WeakPolarHBondContact O-CG 3.33Å; E309-Q313 PolarHBondContact O-N 3.23Å; E309-Q313 VanDerWaalsContact O-N 3.12Å; E309-Q313 PolarHBondContact OE1-NE2 3.41Å; L311-Q313 PolarHBondContact O-N 2.81Å; Q313-Y315 WeakPolarHBondContact O-CD1 2.97Å; Q313-Y315 PolarHBondContact O-N 2.9Å
314	A	89.3	Confident	89.6	Confident	24 Å²	24	50.2 Å²	50.2	20%	0.198	25%	0.254	C	S	.	.			trans	-90.2	76.6	178.8	0	0	0	0	0	111.3	N204 D205 Y206 E310 L311	N204-A314 WeakPolarHBondContact CB-O 3.39Å; D205-A314 PolarHBondContact N-O 3.38Å; Y206-A314 HydrophobicContact CD2-CB 4.41Å; Y206-A314 HydrophobicContact CE2-CB 3.74Å; E310-A314 WeakPolarHBondContact O-CB 3.4Å; E310-A314 PolarHBondContact O-N 3.18Å; L311-A314 PolarHBondContact O-N 3.44Å
315	Y	86.9	Confident	89.4	Confident	90 Å²	90	50.8 Å²	50.8	35%	0.353	26%	0.257	S	S	.	.			trans	-136.1	157.9	178	64.5	-85.6	0	0	0	110.2	Q313 L325	Q313-Y315 WeakPolarHBondContact O-CD1 2.97Å; Q313-Y315 PolarHBondContact O-N 2.9Å; Y315-L325 HydrophobicContact CD1-CD2 4.02Å; Y315-L325 HydrophobicContact CE1-CD2 3.39Å; Y315-L325 HydrophobicContact CE2-CD2 4.21Å
316	D	82.1	Confident	89.1	Confident	84 Å²	84	54.4 Å²	54.4	45%	0.449	28%	0.276	S	S	.	.			trans	-91.2	160.1	177.9	-176.5	34.8	0	0	0	112.1	T318 Q319	D316-T318 PolarHBondContact O-N 3.2Å; D316-T318 PolarHBondContact OD2-OG1 3.32Å; D316-Q319 WeakPolarHBondContact O-CB 3.25Å; D316-Q319 PolarHBondContact O-N 3.41Å
317	D	73.9	Confident	88.9	Confident	151 Å²	151	51.1 Å²	51.1	81%	0.807	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-20.6	179.8	-72.1	-29.4	0	0	0	112.7	Q319	D317-Q319 PolarHBondContact O-N 2.96Å
318	T	77.3	Confident	88.7	Confident	111 Å²	111	51.2 Å²	51.2	68%	0.681	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-9.6	175.1	58.8	0	0	0	0	114	D316	D316-T318 PolarHBondContact O-N 3.2Å; D316-T318 PolarHBondContact OD2-OG1 3.32Å
319	Q	76.8	Confident	88.6	Confident	22 Å²	22	53.3 Å²	53.3	10%	0.103	28%	0.28	C	S	.	.			trans	-109.5	42.9	-174.7	-53.5	-179.9	-68.4	0	0	111.9	D203 D316 D317 L321 Q322	D203-Q319 VanDerWaalsContact O-CD 3.29Å; D203-Q319 PolarHBondContact O-NE2 2.87Å; D203-Q319 VanDerWaalsContact O-NE2 3.15Å; D203-Q319 PolarHBondContact O-OE1 2.86Å; D203-Q319 PolarHBondContact OD1-NE2 2.87Å; D203-Q319 PolarHBondContact OD2-NE2 2.03Å; D316-Q319 WeakPolarHBondContact O-CB 3.25Å; D316-Q319 PolarHBondContact O-N 3.41Å; D317-Q319 PolarHBondContact O-N 2.96Å; Q319-L321 VanDerWaalsContact C-N 3.34Å; Q319-L321 PolarHBondContact O-N 2.95Å; Q319-Q322 PolarHBondContact O-NE2 2.05Å
320	D	77.9	Confident	88.4	Confident	120 Å²	120	54.1 Å²	54.1	64%	0.642	30%	0.295	S	S	*	.			trans	-66.5	-32.4	-173.5	68	-19.1	0	0	0	113.6	Q322 N326	D320-Q322 PolarHBondContact O-N 3.2Å; D320-N326 PolarHBondContact O-ND2 2.99Å; D320-N326 VanDerWaalsContact O-ND2 3.09Å
321	L	87.5	Confident	88.4	Confident	69 Å²	69	54.5 Å²	54.5	36%	0.361	31%	0.308	S	S	.	.			trans	-87.1	93.6	179	-172.6	65.7	0	0	0	111.4	W199 P200 Q319 P329	W199-L321 HydrophobicContact CE3-CD1 4.49Å; W199-L321 HydrophobicContact CE3-CD2 4.08Å; W199-L321 HydrophobicContact CZ3-CD1 4.17Å; W199-L321 HydrophobicContact CZ3-CD2 3.95Å; P200-L321 HydrophobicContact CG-CB 4.38Å; P200-L321 HydrophobicContact CG-CD2 4.02Å; P200-L321 HydrophobicContact CG-CG 3.9Å; P200-L321 WeakPolarHBondContact CG-O 3.29Å; Q319-L321 VanDerWaalsContact C-N 3.34Å; Q319-L321 PolarHBondContact O-N 2.95Å; L321-P329 HydrophobicContact CD1-CG 4.08Å
322	Q	93.8	Very high	88.4	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.009	31%	0.314	C	S	.	.			trans	-136.7	111	171.7	-66.7	-177.8	67.2	0	0	110.7	D203 Q319 D320 C324 L325 N326	D203-Q322 HydrophobicContact CB-CG 4.22Å; D203-Q322 PolarHBondContact O-NE2 3.09Å; D203-Q322 PolarHBondContact O-OE1 2.96Å; Q319-Q322 PolarHBondContact O-NE2 2.05Å; D320-Q322 PolarHBondContact O-N 3.2Å; Q322-C324 VanDerWaalsContact C-N 3.34Å; Q322-C324 PolarHBondContact O-N 2.8Å; Q322-L325 HydrophobicContact CB-CB 4.02Å; Q322-L325 PolarHBondContact O-N 3.35Å; Q322-L325 VanDerWaalsContact O-N 3.11Å; Q322-N326 PolarHBondContact O-N 3.45Å
323	L	96.2	Very high	88.2	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-60.9	-41	-175	-64.7	-179	0	0	0	112.1	L183 V195 W199 P200 L201 L325 G327 C328	L183-L323 HydrophobicContact CD1-CB 4.49Å; L183-L323 HydrophobicContact CD2-CB 3.84Å; L183-L323 WeakPolarHBondContact CD2-O 3.16Å; V195-L323 HydrophobicContact CG1-CD1 4.28Å; V195-L323 HydrophobicContact CG1-CD2 4.42Å; W199-L323 HydrophobicContact CB-CD1 3.8Å; W199-L323 HydrophobicContact CG-CD1 4.44Å; P200-L323 PolarHBondContact O-N 3.11Å; L201-L323 HydrophobicContact CD1-CB 4.34Å; L201-L323 HydrophobicContact CD1-CD1 3.83Å; L201-L323 HydrophobicContact CG-CB 4.32Å; L201-L323 PolarHBondContact O-N 2.71Å; L323-L325 PolarHBondContact O-N 3.07Å; L323-G327 WeakPolarHBondContact CD2-O 3.36Å; L323-G327 WeakPolarHBondContact O-CA 3.47Å; L323-G327 PolarHBondContact O-N 3.23Å; L323-C328 HydrophobicContact CD2-CB 4.13Å
324	C	96.9	Very high	87.8	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-65.9	-24.3	179.3	-72.4	0	0	0	0	113.5	C175 T185 F186 L201 I202 Q322	C175-C324 HydrophobicContact CB-CB 3.64Å; C175-C324 WeakPolarHBondContact CB-SG 3.32Å; C175-C324 VanDerWaalsContact SG-CA 3.54Å; C175-C324 WeakPolarHBondContact SG-CB 3.41Å; C175-C324 CovalentContact SG-SG 2.03Å; C175-C324 PolarHBondContact SG-SG 3.34Å; T185-C324 CarbonylContact C-O 3.5Å; T185-C324 WeakPolarHBondContact CA-O 3.32Å; T185-C324 VanDerWaalsContact CB-O 3.29Å; T185-C324 WeakPolarHBondContact CB-O 3.05Å; F186-C324 HydrophobicContact CD2-CB 3.86Å; F186-C324 WeakPolarHBondContact CD2-O 3.38Å; F186-C324 HydrophobicContact CE1-CB 4.26Å; F186-C324 HydrophobicContact CE2-CB 3.48Å; F186-C324 VanDerWaalsContact CE2-CB 3.48Å; F186-C324 HydrophobicContact CG-CB 4.39Å; F186-C324 WeakPolarHBondContact CG-O 3.14Å; F186-C324 HydrophobicContact CZ-CB 3.69Å; F186-C324 PolarHBondContact N-O 3.15Å; L201-C324 VanDerWaalsContact O-CB 3.22Å; L201-C324 WeakPolarHBondContact O-CB 3.37Å; L201-C324 PolarHBondContact O-N 3.39Å; I202-C324 HydrophobicContact CG1-CB 4.02Å; Q322-C324 VanDerWaalsContact C-N 3.34Å; Q322-C324 PolarHBondContact O-N 2.8Å
325	L	93.8	Very high	86.6	Confident	14 Å²	14	56.5 Å²	56.5	7%	0.073	31%	0.31	C	S	.	.	H	α-helix	trans	-93.4	-47.4	-177.8	-173.6	67.9	0	0	0	112.8	F186 K187 Y315 Q322 L323	F186-L325 HydrophobicContact CD2-CD1 4.5Å; K187-L325 WeakPolarHBondContact CE-O 3.43Å; K187-L325 PolarHBondContact NZ-O 2.86Å; Y315-L325 HydrophobicContact CD1-CD2 4.02Å; Y315-L325 HydrophobicContact CE1-CD2 3.39Å; Y315-L325 HydrophobicContact CE2-CD2 4.21Å; Q322-L325 HydrophobicContact CB-CB 4.02Å; Q322-L325 PolarHBondContact O-N 3.35Å; Q322-L325 VanDerWaalsContact O-N 3.11Å; L323-L325 PolarHBondContact O-N 3.07Å
326	N	92.4	Very high	84.9	Confident	76 Å²	76	61.6 Å²	61.6	41%	0.406	34%	0.337	S	S	.	.	H	α-helix	trans	-111.3	-11.1	-170.1	-66.4	-32.3	0	0	0	113.3	D320 Q322	D320-N326 PolarHBondContact O-ND2 2.99Å; D320-N326 VanDerWaalsContact O-ND2 3.09Å; Q322-N326 PolarHBondContact O-N 3.45Å
327	G	93.4	Very high	82.9	Confident	5 Å²	5	61.5 Å²	61.5	5%	0.052	35%	0.348	C	S	.	.			trans	77	-172	-171.8	0	0	0	0	0	112.3	Q191 L323	Q191-G327 VanDerWaalsContact OE1-CA 3.32Å; L323-G327 WeakPolarHBondContact CD2-O 3.36Å; L323-G327 WeakPolarHBondContact O-CA 3.47Å; L323-G327 PolarHBondContact O-N 3.23Å
328	C	93.4	Very high	81.5	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.014	33%	0.332	C	S	.	.	S	Bend	trans	-76.6	146.5	-179.7	-52.4	0	0	0	0	110.9	L183 C193 V195 L323 E332 R333	L183-C328 VanDerWaalsContact CD2-SG 3.59Å; C193-C328 HydrophobicContact CB-CB 3.8Å; C193-C328 WeakPolarHBondContact CB-SG 3.25Å; C193-C328 WeakPolarHBondContact SG-CB 3.35Å; C193-C328 CovalentContact SG-SG 2.01Å; C193-C328 PolarHBondContact SG-SG 3.27Å; V195-C328 HydrophobicContact CG1-CB 4.23Å; L323-C328 HydrophobicContact CD2-CB 4.13Å; C328-E332 HydrophobicContact CB-CB 4.48Å; C328-R333 HydrophobicContact CB-CG 4.2Å; C328-R333 VanDerWaalsContact O-CZ 3.28Å; C328-R333 PolarHBondContact O-NE 3.27Å; C328-R333 PolarHBondContact O-NH2 3.44Å
329	P	93.1	Very high	80.1	Confident	44 Å²	44	55.1 Å²	55.1	29%	0.286	32%	0.318	S	S	.	.			trans	-54.4	146.5	169.3	-24.4	33.9	0	0	0	111.2	W199 L321 S331 E332 R333	W199-P329 HydrophobicContact CH2-CG 4.37Å; W199-P329 HydrophobicContact CZ3-CG 4.02Å; L321-P329 HydrophobicContact CD1-CG 4.08Å; P329-S331 PolarHBondContact O-N 2.88Å; P329-S331 VanDerWaalsContact O-N 3.1Å; P329-E332 HydrophobicContact CB-CG 4.44Å; P329-E332 HydrophobicContact CG-CG 4.49Å; P329-E332 PolarHBondContact O-N 2.76Å; P329-R333 PolarHBondContact O-N 2.95Å
330	S	89.4	Confident	78.9	Confident	100 Å²	100	55.4 Å²	55.4	70%	0.699	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-57.8	-29.6	-175.8	-57.2	0	0	0	0	113.8	E332 R333	S330-E332 VanDerWaalsContact C-N 3.28Å; S330-E332 PolarHBondContact O-N 3.18Å; S330-R333 PolarHBondContact O-N 3.08Å
331	S	89.6	Confident	77.6	Confident	104 Å²	104	53.7 Å²	53.7	73%	0.727	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-70.3	-22.6	175.3	56.1	0	0	0	0	113.8	P329	P329-S331 PolarHBondContact O-N 2.88Å; P329-S331 VanDerWaalsContact O-N 3.1Å
332	E	91.6	Very high	75.9	Confident	43 Å²	43	52.4 Å²	52.4	20%	0.201	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-97.9	-1.7	-179.4	-65.5	-58.5	135.4	0	0	112.4	C193 K194 V195 W199 C328 P329 S330	C193-E332 CarbonylContact C-O 3.5Å; C193-E332 VanDerWaalsContact CA-O 3.31Å; C193-E332 WeakPolarHBondContact CA-O 3.24Å; K194-E332 PolarHBondContact N-O 2.85Å; V195-E332 WeakPolarHBondContact CA-OE2 3.42Å; V195-E332 HydrophobicContact CG1-CB 3.93Å; V195-E332 HydrophobicContact CG1-CG 4.29Å; V195-E332 PolarHBondContact N-OE2 3.04Å; W199-E332 HydrophobicContact CH2-CG 3.85Å; W199-E332 HydrophobicContact CZ2-CG 4.01Å; C328-E332 HydrophobicContact CB-CB 4.48Å; P329-E332 HydrophobicContact CB-CG 4.44Å; P329-E332 HydrophobicContact CG-CG 4.49Å; P329-E332 PolarHBondContact O-N 2.76Å; S330-E332 VanDerWaalsContact C-N 3.28Å; S330-E332 PolarHBondContact O-N 3.18Å
333	R	88.4	Confident	73.7	Confident	86 Å²	86	54.1 Å²	54.1	33%	0.325	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-81.9	129.5	177.6	-65.4	-180	-170.4	-171.7	0.9	110	C328 P329 S330 D335	C328-R333 HydrophobicContact CB-CG 4.2Å; C328-R333 VanDerWaalsContact O-CZ 3.28Å; C328-R333 PolarHBondContact O-NE 3.27Å; C328-R333 PolarHBondContact O-NH2 3.44Å; P329-R333 PolarHBondContact O-N 2.95Å; S330-R333 PolarHBondContact O-N 3.08Å; R333-D335 VanDerWaalsContact C-N 3.29Å
334	I	79.9	Confident	71.2	Confident	52 Å²	52	62.7 Å²	62.7	27%	0.267	37%	0.365	S	S	.	.	S	Bend	trans	-81.8	-17.3	177.1	-62.2	178.5	0	0	0	110.7	T192 K194 S221 F385	T192-I334 HydrophobicContact CG2-CB 4.34Å; T192-I334 HydrophobicContact CG2-CD1 4.32Å; T192-I334 PolarHBondContact O-N 2.96Å; K194-I334 HydrophobicContact CB-CD1 4.27Å; K194-I334 HydrophobicContact CB-CG1 4.27Å; S221-I334 WeakPolarHBondContact O-CD1 3.31Å; I334-F385 HydrophobicContact CG2-CZ 3.96Å
335	D	64.3	Low	68.6	Low	10 Å²	10	65.8 Å²	65.8	5%	0.053	39%	0.391	C	S	.	.	S	Bend	trans	-104.7	130.3	172.4	62.4	52.7	0	0	0	112.3	R333 A337 G338 H339	R333-D335 VanDerWaalsContact C-N 3.29Å; D335-A337 PolarHBondContact O-N 3.11Å; D335-A337 VanDerWaalsContact O-N 3.07Å; D335-G338 VanDerWaalsContact OD1-CA 3.29Å; D335-G338 WeakPolarHBondContact OD1-CA 3.27Å; D335-G338 PolarHBondContact OD1-N 2.75Å; D335-H339 WeakPolarHBondContact CB-O 3.33Å
336	Q	51.1	Low	66.2	Low	198 Å²	198	69.5 Å²	69.5	93%	0.925	42%	0.416	S	S	*	.	S	Bend	trans	-75	98.3	158.9	-91.2	175.5	-34.1	0	0	107.6
337	A	40.9	Very low	63.8	Low	81 Å²	81	70.9 Å²	70.9	67%	0.669	43%	0.429	S	S	*	.	S	Bend	trans	88	36.6	165.8	0	0	0	0	0	118.8	D335 H339	D335-A337 PolarHBondContact O-N 3.11Å; D335-A337 VanDerWaalsContact O-N 3.07Å; A337-H339 PolarHBondContact O-CE1 3.15Å; A337-H339 PolarHBondContact O-N 3.03Å; A337-H339 PolarHBondContact O-ND1 3.26Å
338	G	43.4	Very low	61.3	Low	46 Å²	46	75.8 Å²	75.8	47%	0.474	47%	0.469	S	S	.	.	S	Bend	trans	76.4	23.3	168.5	0	0	0	0	0	114.7	D335	D335-G338 VanDerWaalsContact OD1-CA 3.29Å; D335-G338 WeakPolarHBondContact OD1-CA 3.27Å; D335-G338 PolarHBondContact OD1-N 2.75Å
339	H	47.6	Very low	59	Low	82 Å²	82	83.2 Å²	83.2	38%	0.38	51%	0.507	S	S	.	.			trans	-104.7	137.3	172.9	-62.6	77.2	0	0	0	107.5	D335 A337 P341	D335-H339 WeakPolarHBondContact CB-O 3.33Å; A337-H339 PolarHBondContact O-CE1 3.15Å; A337-H339 PolarHBondContact O-N 3.03Å; A337-H339 PolarHBondContact O-ND1 3.26Å; H339-P341 WeakPolarHBondContact O-CD 3.1Å
340	L	53.1	Low	56.3	Low	28 Å²	28	84.5 Å²	84.5	15%	0.147	53%	0.529	C	S	.	.			trans	-87.6	85.9	164.8	-72.4	163	0	0	0	107.1	T192 L342 H381 F385	T192-L340 WeakPolarHBondContact OG1-CD2 3.29Å; L340-L342 PolarHBondContact O-N 3.38Å; L340-H381 HydrophobicContact CD1-CB 3.65Å; L340-F385 HydrophobicContact CD2-CB 4.4Å; L340-F385 HydrophobicContact CD2-CG 4.29Å
341	P	50	Low	54.1	Low	84 Å²	84	87.6 Å²	87.6	55%	0.545	54%	0.536	S	S	.	.			trans	-64.4	105.2	170.4	28	-32.9	0	0	0	106.5	H339 P343	H339-P341 WeakPolarHBondContact O-CD 3.1Å; P341-P343 WeakPolarHBondContact O-CD 3.03Å; P341-P343 VanDerWaalsContact O-N 3.14Å
342	L	51.3	Low	51.6	Low	43 Å²	43	91.4 Å²	91.4	23%	0.225	54%	0.543	C	S	.	.			trans	-53.5	122.7	165.7	-68.8	176	0	0	0	106.5	L340 L344 V384 L388	L340-L342 PolarHBondContact O-N 3.38Å; L342-L344 PolarHBondContact O-N 3.15Å; L342-V384 HydrophobicContact CD2-CB 4Å; L342-V384 HydrophobicContact CD2-CG1 3.52Å; L342-L388 HydrophobicContact CD2-CD1 4.39Å
343	P	47.3	Very low	49.1	Very low	37 Å²	37	98 Å²	98	24%	0.24	57%	0.574	C	S	.	*			trans	-57.5	116	179.8	15.9	-25.3	0	0	0	108.7	P341 A345 L388	P341-P343 WeakPolarHBondContact O-CD 3.03Å; P341-P343 VanDerWaalsContact O-N 3.14Å; P343-A345 PolarHBondContact O-N 3.33Å; P343-L388 HydrophobicContact CG-CB 3.95Å; P343-L388 HydrophobicContact CG-CD1 4Å
344	L	43.5	Very low	46.6	Very low	181 Å²	181	102.8 Å²	102.8	95%	0.948	60%	0.6	S	S	*	*	S	Bend	trans	-67.2	-15.5	177.9	-70.7	169.1	0	0	0	111.7	L342	L342-L344 PolarHBondContact O-N 3.15Å
345	A	42.5	Very low	44.6	Very low	66 Å²	66	108 Å²	108	55%	0.545	62%	0.623	S	S	.	*	S	Bend	trans	-154.5	147.8	168.4	0	0	0	0	0	108.9	P343	P343-A345 PolarHBondContact O-N 3.33Å
346	P	44.5	Very low	43.6	Very low	92 Å²	92	116.4 Å²	116.4	60%	0.597	67%	0.667	S	S	*	*			trans	-56.3	139.7	167.7	22.9	-30.1	0	0	0	109	A348 V359	P346-A348 PolarHBondContact O-N 3.32Å; P346-V359 HydrophobicContact CB-CG1 4.34Å
347	P	41.3	Very low	43.3	Very low	105 Å²	105	116.9 Å²	116.9	68%	0.682	66%	0.66	S	S	*	*			trans	-53.9	133.6	176.6	20.9	-29.9	0	0	0	108.6	L349	P347-L349 PolarHBondContact O-N 3.19Å
348	A	40.1	Very low	43.9	Very low	108 Å²	108	123.4 Å²	123.4	89%	0.893	67%	0.667	S	S	*	*			trans	-66.4	80.5	176.1	0	0	0	0	0	109	P346 G350	P346-A348 PolarHBondContact O-N 3.32Å; A348-G350 PolarHBondContact O-N 3.45Å
349	L	45.6	Very low	44.9	Very low	158 Å²	158	125.7 Å²	125.7	83%	0.827	67%	0.672	S	S	*	*			trans	-67.5	111.8	166.8	-75.7	170.1	0	0	0	106.8	P347 L351	P347-L349 PolarHBondContact O-N 3.19Å; L349-L351 PolarHBondContact O-N 2.99Å
350	G	37.6	Very low	46.3	Very low	71 Å²	71	124.3 Å²	124.3	73%	0.732	67%	0.665	S	S	*	*			trans	-50.2	125.8	174.9	0	0	0	0	0	111	A348 Q352	A348-G350 PolarHBondContact O-N 3.45Å; G350-Q352 PolarHBondContact O-N 3.38Å; G350-Q352 VanDerWaalsContact O-N 3.16Å
351	L	43	Very low	47.9	Very low	164 Å²	164	126.4 Å²	126.4	86%	0.859	69%	0.686	S	S	*	*			trans	16.3	85	152.1	-75.2	155.6	0	0	0	116.3	L349	L349-L351 PolarHBondContact O-N 2.99Å
352	Q	36	Very low	49.6	Very low	185 Å²	185	124.7 Å²	124.7	86%	0.864	67%	0.674	S	S	*	*			trans	-143.3	97.7	142.9	-139	168.8	17.4	0	0	110.9	G350 Q354	G350-Q352 PolarHBondContact O-N 3.38Å; G350-Q352 VanDerWaalsContact O-N 3.16Å; Q352-Q354 PolarHBondContact O-N 2.86Å
353	Q	38.9	Very low	51.3	Low	182 Å²	182	128.5 Å²	128.5	85%	0.85	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	48.8	-167.2	-165.6	153.2	15	0	0	113.5
354	Q	36.2	Very low	53.4	Low	186 Å²	186	128.1 Å²	128.1	87%	0.869	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.1	5.4	179.6	-82.2	-171.6	-22.5	0	0	117.1	Q352	Q352-Q354 PolarHBondContact O-N 2.86Å
355	Q	38.8	Very low	55.6	Low	162 Å²	162	119.5 Å²	119.5	76%	0.757	65%	0.652	S	S	*	*			trans	-136.2	80.4	164.6	-76.1	-171.3	-8.8	0	0	111.9	R357	Q355-R357 PolarHBondContact O-N 3.46Å
356	L	41.8	Very low	58	Low	186 Å²	186	120.2 Å²	120.2	97%	0.974	64%	0.643	S	S	*	*			trans	-71.4	57.5	167.7	-145.1	111.8	0	0	0	110.4	R358	L356-R358 PolarHBondContact O-N 3.35Å
357	R	45.7	Very low	60.3	Low	207 Å²	207	121.1 Å²	121.1	78%	0.781	64%	0.64	S	S	*	*			trans	-89.8	94.3	175.1	-81.7	-167.2	169.5	-177.9	-0.9	109.7	Q355 V359	Q355-R357 PolarHBondContact O-N 3.46Å; R357-V359 PolarHBondContact O-N 3.46Å
358	R	53.7	Low	62.8	Low	218 Å²	218	120.6 Å²	120.6	82%	0.823	62%	0.624	S	S	*	*			trans	27.7	71	154	-61.3	-176.7	-179.6	176.1	-0.1	116.6	L356 G391	L356-R358 PolarHBondContact O-N 3.35Å; R358-G391 WeakPolarHBondContact O-CA 3.31Å
359	V	64.6	Low	65.4	Low	94 Å²	94	115.4 Å²	115.4	57%	0.57	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-75.5	122.3	157.8	-177.3	0	0	0	0	106.9	P346 R357	P346-V359 HydrophobicContact CB-CG1 4.34Å; R357-V359 PolarHBondContact O-N 3.46Å
360	F	75.9	Confident	67.8	Low	53 Å²	53	110.5 Å²	110.5	23%	0.232	56%	0.56	C	S	.	*	P	Polyproline II helix	trans	-63.3	140.3	176.3	-79.3	-97.1	0	0	0	109.9	A365 L387 L388 G391 A393	F360-A365 HydrophobicContact CB-CB 4.04Å; F360-L387 HydrophobicContact CB-CB 4.43Å; F360-L387 HydrophobicContact CD2-CB 4.01Å; F360-L387 HydrophobicContact CD2-CD2 4.36Å; F360-L387 WeakPolarHBondContact CD2-O 3.08Å; F360-L387 HydrophobicContact CE1-CD1 4.49Å; F360-L387 HydrophobicContact CE2-CB 4.48Å; F360-L387 HydrophobicContact CE2-CD2 3.98Å; F360-L387 HydrophobicContact CG-CB 4.18Å; F360-L387 HydrophobicContact CZ-CD2 4.28Å; F360-L388 HydrophobicContact CB-CD2 4.41Å; F360-L388 WeakPolarHBondContact O-CD2 3.48Å; F360-G391 WeakPolarHBondContact CE2-O 3.07Å; F360-A393 HydrophobicContact CZ-CB 4.18Å
361	A	86.7	Confident	70.5	Confident	72 Å²	72	113.2 Å²	113.2	60%	0.595	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-71.4	150.1	162.4	0	0	0	0	0	109.2	D363 G364 A365	A361-D363 VanDerWaalsContact C-N 3.28Å; A361-D363 PolarHBondContact O-N 2.95Å; A361-G364 CarbonylContact O-C 3.56Å; A361-G364 WeakPolarHBondContact O-CA 3.21Å; A361-G364 PolarHBondContact O-N 3.39Å; A361-A365 PolarHBondContact O-N 3.3Å
362	V	85.8	Confident	72.9	Confident	49 Å²	49	108.3 Å²	108.3	30%	0.297	52%	0.524	S	S	.	.	H	α-helix	trans	-52.4	-45.2	-178.4	178.2	0	0	0	0	112.3	A365 K366 L388	V362-A365 PolarHBondContact O-N 2.74Å; V362-K366 HydrophobicContact CG1-CD 4.31Å; V362-K366 WeakPolarHBondContact O-CG 3.15Å; V362-K366 PolarHBondContact O-N 3.31Å; V362-L388 HydrophobicContact CG2-CD1 4.17Å; V362-L388 HydrophobicContact CG2-CD2 4.12Å
363	D	88.3	Confident	75.6	Confident	122 Å²	122	99.5 Å²	99.5	65%	0.652	48%	0.483	S	S	*	.	H	α-helix	trans	-69.5	-38	179.8	-63.5	-33	0	0	0	112.1	A361 K366 E367	A361-D363 VanDerWaalsContact C-N 3.28Å; A361-D363 PolarHBondContact O-N 2.95Å; D363-K366 PolarHBondContact O-N 2.88Å; D363-E367 WeakPolarHBondContact O-CB 3.36Å; D363-E367 PolarHBondContact O-N 3.22Å
364	G	90.8	Very high	77.9	Confident	29 Å²	29	99.3 Å²	99.3	30%	0.299	48%	0.482	S	S	.	.	H	α-helix	trans	-65.4	-37.8	174.8	0	0	0	0	0	112.9	A361 R368	A361-G364 CarbonylContact O-C 3.56Å; A361-G364 WeakPolarHBondContact O-CA 3.21Å; A361-G364 PolarHBondContact O-N 3.39Å; G364-R368 VanDerWaalsContact O-CB 3.28Å; G364-R368 WeakPolarHBondContact O-CB 3.25Å; G364-R368 PolarHBondContact O-N 2.99Å
365	A	90.2	Very high	80.5	Confident	0 Å²	0	92.7 Å²	92.7	0%	0	45%	0.454	C	S	.	.	H	α-helix	trans	-65.4	-46.3	174.3	0	0	0	0	0	111.2	F360 A361 V362 R368 C369 V384 L387 L388	F360-A365 HydrophobicContact CB-CB 4.04Å; A361-A365 PolarHBondContact O-N 3.3Å; V362-A365 PolarHBondContact O-N 2.74Å; A365-R368 PolarHBondContact O-N 3.06Å; A365-C369 PolarHBondContact O-N 2.03Å; A365-C369 PolarHBondContact O-SG 2.77Å; A365-V384 HydrophobicContact CB-CG1 4.02Å; A365-L387 HydrophobicContact CB-CB 3.98Å; A365-L387 HydrophobicContact CB-CD1 4.12Å; A365-L388 HydrophobicContact CB-CD2 4.1Å; A365-L388 HydrophobicContact CB-CG 4.17Å
366	K	92.2	Very high	82.9	Confident	81 Å²	81	88.6 Å²	88.6	35%	0.352	44%	0.438	S	S	.	.	H	α-helix	trans	-60.1	-47.5	176.2	-73.5	174.3	-178.4	172.4	0	112.3	V362 D363 R368 C369 S370 F380 V384	V362-K366 HydrophobicContact CG1-CD 4.31Å; V362-K366 WeakPolarHBondContact O-CG 3.15Å; V362-K366 PolarHBondContact O-N 3.31Å; D363-K366 PolarHBondContact O-N 2.88Å; K366-R368 VanDerWaalsContact C-N 3.28Å; K366-R368 PolarHBondContact O-N 2.93Å; K366-C369 PolarHBondContact O-N 3.33Å; K366-S370 WeakPolarHBondContact O-CB 3.39Å; K366-S370 PolarHBondContact O-N 3.42Å; K366-S370 PolarHBondContact O-OG 2.82Å; K366-F380 HydrophobicContact CB-CZ 4.14Å; K366-F380 HydrophobicContact CG-CZ 4.12Å; K366-V384 HydrophobicContact CG-CG1 4.18Å; K366-V384 HydrophobicContact CG-CG2 4.06Å
367	E	93.8	Very high	85.1	Confident	112 Å²	112	79.8 Å²	79.8	52%	0.523	39%	0.391	S	S	.	.	H	α-helix	trans	-63.2	-36.2	178.1	-165.2	-151.2	134.3	0	0	111.7	D363 S370 K371	D363-E367 WeakPolarHBondContact O-CB 3.36Å; D363-E367 PolarHBondContact O-N 3.22Å; E367-S370 PolarHBondContact O-OG 3.02Å; E367-S370 VanDerWaalsContact O-OG 3.05Å; E367-K371 WeakPolarHBondContact O-CG 3.12Å; E367-K371 WeakPolarHBondContact OE1-CE 3Å; E367-K371 IonicContact OE1-NZ 3.7Å; E367-K371 PolarHBondContact OE1-NZ 3.06Å
368	R	93.8	Very high	87.3	Confident	93 Å²	93	70.3 Å²	70.3	35%	0.351	36%	0.356	S	S	.	.	H	α-helix	trans	-68.1	-46.6	177.1	-179	58.2	176.8	158.9	-0.9	111.5	G364 A365 K366 L387	G364-R368 VanDerWaalsContact O-CB 3.28Å; G364-R368 WeakPolarHBondContact O-CB 3.25Å; G364-R368 PolarHBondContact O-N 2.99Å; A365-R368 PolarHBondContact O-N 3.06Å; K366-R368 VanDerWaalsContact C-N 3.28Å; K366-R368 PolarHBondContact O-N 2.93Å; R368-L387 HydrophobicContact CB-CD1 3.95Å; R368-L387 HydrophobicContact CG-CD1 3.89Å
369	C	94.9	Very high	89.2	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-67.2	-38.2	179.7	-65.9	0	0	0	0	112.1	A365 K366 K371 Q372 L373 F380 C383 V384	A365-C369 PolarHBondContact O-N 2.03Å; A365-C369 PolarHBondContact O-SG 2.77Å; K366-C369 PolarHBondContact O-N 3.33Å; C369-K371 PolarHBondContact O-N 3.2Å; C369-K371 VanDerWaalsContact O-N 3.16Å; C369-Q372 PolarHBondContact O-N 2.9Å; C369-Q372 VanDerWaalsContact O-N 3.16Å; C369-L373 WeakPolarHBondContact O-CB 3.01Å; C369-L373 PolarHBondContact O-N 3.3Å; C369-F380 HydrophobicContact CB-CD2 3.86Å; C369-F380 HydrophobicContact CB-CE2 3.73Å; C369-C383 HydrophobicContact CB-CB 3.87Å; C369-C383 WeakPolarHBondContact CB-SG 3.38Å; C369-C383 WeakPolarHBondContact SG-CB 3.23Å; C369-C383 CovalentContact SG-SG 2.04Å; C369-C383 PolarHBondContact SG-SG 2.05Å; C369-V384 HydrophobicContact CB-CG2 3.97Å; C369-V384 PolarHBondContact SG-N 3.07Å; C369-V384 VanDerWaalsContact SG-N 3.38Å
370	S	94.8	Very high	90.6	Very high	54 Å²	54	56 Å²	56	38%	0.378	29%	0.292	S	S	.	.	H	α-helix	trans	-65.3	-19.8	-178.1	65.1	0	0	0	0	113.9	K366 E367 Q372	K366-S370 WeakPolarHBondContact O-CB 3.39Å; K366-S370 PolarHBondContact O-N 3.42Å; K366-S370 PolarHBondContact O-OG 2.82Å; E367-S370 PolarHBondContact O-OG 3.02Å; E367-S370 VanDerWaalsContact O-OG 3.05Å; S370-Q372 VanDerWaalsContact C-N 3.25Å; S370-Q372 PolarHBondContact O-N 3.24Å
371	K	94.6	Very high	91.3	Very high	128 Å²	128	55 Å²	55	56%	0.557	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-23.2	175.5	-73.2	170.8	-173.6	170.7	0	113.8	E367 C369	E367-K371 WeakPolarHBondContact O-CG 3.12Å; E367-K371 WeakPolarHBondContact OE1-CE 3Å; E367-K371 IonicContact OE1-NZ 3.7Å; E367-K371 PolarHBondContact OE1-NZ 3.06Å; C369-K371 PolarHBondContact O-N 3.2Å; C369-K371 VanDerWaalsContact O-N 3.16Å
372	Q	92.4	Very high	91.6	Very high	61 Å²	61	51.6 Å²	51.6	29%	0.285	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	-27.7	178.8	-66	-171.2	-1.9	0	0	112.9	C369 S370 T396 H400	C369-Q372 PolarHBondContact O-N 2.9Å; C369-Q372 VanDerWaalsContact O-N 3.16Å; S370-Q372 VanDerWaalsContact C-N 3.25Å; S370-Q372 PolarHBondContact O-N 3.24Å; Q372-T396 HydrophobicContact CB-CG2 4.47Å; Q372-T396 HydrophobicContact CG-CG2 4.45Å; Q372-H400 HydrophobicContact CB-CB 4.16Å; Q372-H400 PolarHBondContact O-CD2 3.44Å
373	L	93.4	Very high	92	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.246	C	C	.	.			trans	-114.5	85.5	-178	-66	163.3	0	0	0	108.4	C369 V375 F380 C383 A399 H400 Q403	C369-L373 WeakPolarHBondContact O-CB 3.01Å; C369-L373 PolarHBondContact O-N 3.3Å; L373-V375 VanDerWaalsContact C-N 3.26Å; L373-V375 PolarHBondContact O-N 3.24Å; L373-F380 HydrophobicContact CB-CB 4.19Å; L373-F380 HydrophobicContact CB-CD2 4.2Å; L373-C383 HydrophobicContact CD1-CB 3.74Å; L373-A399 HydrophobicContact CD1-CB 3.75Å; L373-H400 HydrophobicContact CD2-CB 4.36Å; L373-H400 HydrophobicContact CG-CB 4.48Å; L373-Q403 HydrophobicContact CD2-CB 4.25Å; L373-Q403 VanDerWaalsContact CD2-OE1 3.32Å
374	E	87.9	Confident	92.2	Very high	178 Å²	178	43.5 Å²	43.5	83%	0.832	22%	0.215	S	C	*	.			trans	-66.3	-30.7	-177.7	-62.8	179.8	174.8	0	0	112.4
375	V	89.8	Confident	92.1	Very high	47 Å²	47	42.9 Å²	42.9	29%	0.285	20%	0.204	S	C	.	.	S	Bend	trans	-90.2	127.1	-179.2	-175	0	0	0	0	109.7	L373 D377 F380 Y419	L373-V375 VanDerWaalsContact C-N 3.26Å; L373-V375 PolarHBondContact O-N 3.24Å; V375-D377 HydrophobicContact CG1-CB 4.05Å; V375-D377 PolarHBondContact O-N 3.41Å; V375-F380 VanDerWaalsContact O-CB 3.28Å; V375-F380 WeakPolarHBondContact O-CB 2.87Å; V375-Y419 HydrophobicContact CG1-CE1 4.15Å
376	L	89.2	Confident	92.1	Very high	77 Å²	77	42.9 Å²	42.9	40%	0.403	20%	0.204	S	C	.	.			trans	-76.8	48.9	177.4	-53.5	177.8	0	0	0	112.3	F380	L376-F380 HydrophobicContact CB-CD1 4.37Å; L376-F380 HydrophobicContact CD2-CD1 3.6Å; L376-F380 HydrophobicContact CD2-CD2 3.9Å; L376-F380 HydrophobicContact CD2-CE1 3.48Å; L376-F380 VanDerWaalsContact CD2-CE1 3.48Å; L376-F380 HydrophobicContact CD2-CE2 3.77Å; L376-F380 HydrophobicContact CD2-CG 3.82Å; L376-F380 HydrophobicContact CD2-CZ 3.57Å
377	D	89.7	Confident	92.1	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	-89	-176.3	175.2	65.6	22.1	0	0	0	111.5	V375 Y379 F380 H381 Q403 R417 I418 Y419	V375-D377 HydrophobicContact CG1-CB 4.05Å; V375-D377 PolarHBondContact O-N 3.41Å; D377-Y379 PolarHBondContact O-N 3.11Å; D377-Y379 VanDerWaalsContact O-N 3.13Å; D377-Y379 WeakPolarHBondContact OD1-CB 3.45Å; D377-Y379 PolarHBondContact OD1-N 2.93Å; D377-F380 WeakPolarHBondContact O-CB 3.47Å; D377-F380 PolarHBondContact O-N 3.26Å; D377-F380 VanDerWaalsContact O-N 3.11Å; D377-F380 PolarHBondContact OD1-N 3.11Å; D377-H381 PolarHBondContact O-CD2 3.4Å; D377-H381 VanDerWaalsContact O-CD2 3.23Å; D377-H381 PolarHBondContact O-N 3.47Å; D377-Q403 PolarHBondContact OD2-NE2 3.26Å; D377-R417 WeakPolarHBondContact OD2-CD 3.27Å; D377-R417 IonicContact OD2-CZ 3.97Å; D377-R417 IonicContact OD2-NE 2.93Å; D377-R417 IonicContact OD2-NH1 3.9Å; D377-R417 PolarHBondContact OD2-NH1 2.88Å; D377-I418 WeakPolarHBondContact CB-O 3.17Å; D377-Y419 HydrophobicContact CB-CD1 4.42Å; D377-Y419 HydrophobicContact CB-CE1 4.29Å
378	I	90	Very high	91.8	Very high	8 Å²	8	34.6 Å²	34.6	4%	0.041	17%	0.167	C	C	.	.	H	α-helix	trans	-48.6	-34.5	175.4	48	156	0	0	0	114.2	F190 H381 S382 I418	F190-I378 HydrophobicContact CD1-CB 4.24Å; F190-I378 HydrophobicContact CD1-CD1 4.33Å; F190-I378 HydrophobicContact CD1-CG2 4.26Å; F190-I378 HydrophobicContact CD2-CD1 3.24Å; F190-I378 HydrophobicContact CD2-CG1 4.48Å; F190-I378 HydrophobicContact CE1-CB 4.28Å; F190-I378 HydrophobicContact CE1-CD1 4.38Å; F190-I378 HydrophobicContact CE2-CD1 3.31Å; F190-I378 HydrophobicContact CE2-CG1 4.47Å; F190-I378 HydrophobicContact CG-CB 4.39Å; F190-I378 HydrophobicContact CG-CD1 3.79Å; F190-I378 HydrophobicContact CG-CG2 4.28Å; F190-I378 HydrophobicContact CZ-CB 4.49Å; F190-I378 HydrophobicContact CZ-CD1 3.91Å; I378-H381 PolarHBondContact O-N 3.41Å; I378-S382 WeakPolarHBondContact O-CB 3.46Å; I378-S382 PolarHBondContact O-N 3.26Å; I378-S382 PolarHBondContact O-OG 3.27Å; I378-I418 HydrophobicContact CB-CB 4.49Å; I378-I418 HydrophobicContact CD1-CB 3.95Å; I378-I418 HydrophobicContact CD1-CD1 3.94Å; I378-I418 HydrophobicContact CD1-CG1 4.31Å; I378-I418 HydrophobicContact CG1-CB 3.92Å; I378-I418 HydrophobicContact CG2-CB 3.81Å; I378-I418 HydrophobicContact CG2-CG2 3.7Å; I378-I418 WeakPolarHBondContact CG2-O 3.48Å; I378-I418 PolarHBondContact N-O 3.02Å
379	Y	93.9	Very high	91.3	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.008	16%	0.163	C	C	.	.	H	α-helix	trans	-72.2	-39.8	-178.3	-62.8	-83.1	0	0	0	110.5	F178 R184 D377 C383 A402 Q403 M406	F178-Y379 AromaticContact CE1-CD1 3.84Å; F178-Y379 HydrophobicContact CE1-CD1 3.84Å; F178-Y379 AromaticContact CE1-CE1 3.64Å; F178-Y379 HydrophobicContact CE1-CE1 3.64Å; F178-Y379 HydrophobicContact CE2-CD1 4.23Å; F178-Y379 AromaticContact CZ-CD1 3.46Å; F178-Y379 HydrophobicContact CZ-CD1 3.46Å; F178-Y379 VanDerWaalsContact CZ-CD1 3.46Å; F178-Y379 AromaticContact CZ-CE1 3.79Å; F178-Y379 HydrophobicContact CZ-CE1 3.79Å; R184-Y379 PolarHBondContact NH1-OH 3.45Å; D377-Y379 PolarHBondContact O-N 3.11Å; D377-Y379 VanDerWaalsContact O-N 3.13Å; D377-Y379 WeakPolarHBondContact OD1-CB 3.45Å; D377-Y379 PolarHBondContact OD1-N 2.93Å; Y379-C383 WeakPolarHBondContact O-CB 3.25Å; Y379-C383 PolarHBondContact O-N 3.44Å; Y379-A402 HydrophobicContact CD1-CB 4.19Å; Y379-A402 HydrophobicContact CE1-CB 4.03Å; Y379-Q403 HydrophobicContact CD1-CB 4.06Å; Y379-Q403 HydrophobicContact CD2-CB 4.09Å; Y379-Q403 HydrophobicContact CD2-CG 4.01Å; Y379-Q403 HydrophobicContact CE1-CB 4.46Å; Y379-Q403 HydrophobicContact CE2-CB 4.49Å; Y379-Q403 HydrophobicContact CE2-CG 4.39Å; Y379-Q403 HydrophobicContact CG-CB 3.88Å; Y379-Q403 HydrophobicContact CG-CG 4.27Å; Y379-M406 HydrophobicContact CE2-CE 3.73Å; Y379-M406 WeakPolarHBondContact OH-CB 3.47Å; Y379-M406 VanDerWaalsContact OH-CG 3.29Å; Y379-M406 WeakPolarHBondContact OH-CG 3.4Å
380	F	94.5	Very high	90.7	Very high	10 Å²	10	33.2 Å²	33.2	4%	0.044	17%	0.169	C	C	.	.	H	α-helix	trans	-60.7	-48.4	171	173.5	-89.6	0	0	0	111.3	K366 C369 L373 V375 L376 D377 S382 C383 V384	K366-F380 HydrophobicContact CB-CZ 4.14Å; K366-F380 HydrophobicContact CG-CZ 4.12Å; C369-F380 HydrophobicContact CB-CD2 3.86Å; C369-F380 HydrophobicContact CB-CE2 3.73Å; L373-F380 HydrophobicContact CB-CB 4.19Å; L373-F380 HydrophobicContact CB-CD2 4.2Å; V375-F380 VanDerWaalsContact O-CB 3.28Å; V375-F380 WeakPolarHBondContact O-CB 2.87Å; L376-F380 HydrophobicContact CB-CD1 4.37Å; L376-F380 HydrophobicContact CD2-CD1 3.6Å; L376-F380 HydrophobicContact CD2-CD2 3.9Å; L376-F380 HydrophobicContact CD2-CE1 3.48Å; L376-F380 VanDerWaalsContact CD2-CE1 3.48Å; L376-F380 HydrophobicContact CD2-CE2 3.77Å; L376-F380 HydrophobicContact CD2-CG 3.82Å; L376-F380 HydrophobicContact CD2-CZ 3.57Å; D377-F380 WeakPolarHBondContact O-CB 3.47Å; D377-F380 PolarHBondContact O-N 3.26Å; D377-F380 VanDerWaalsContact O-N 3.11Å; D377-F380 PolarHBondContact OD1-N 3.11Å; F380-S382 VanDerWaalsContact C-N 3.34Å; F380-S382 PolarHBondContact O-N 3.16Å; F380-C383 WeakPolarHBondContact O-CB 3.45Å; F380-C383 PolarHBondContact O-N 3.22Å; F380-V384 HydrophobicContact CD1-CG2 4.25Å; F380-V384 HydrophobicContact CE1-CG2 3.74Å; F380-V384 HydrophobicContact CE2-CG2 4.27Å; F380-V384 HydrophobicContact CZ-CG2 3.76Å; F380-V384 WeakPolarHBondContact O-CG2 3.48Å; F380-V384 PolarHBondContact O-N 2.6Å
381	H	91.3	Very high	90.3	Very high	33 Å²	33	31.7 Å²	31.7	15%	0.153	16%	0.162	C	C	.	.	H	α-helix	trans	-66	-36.9	-178.8	-75.9	-74.9	0	0	0	113	L340 D377 I378 V384 F385 P420	L340-H381 HydrophobicContact CD1-CB 3.65Å; D377-H381 PolarHBondContact O-CD2 3.4Å; D377-H381 VanDerWaalsContact O-CD2 3.23Å; D377-H381 PolarHBondContact O-N 3.47Å; I378-H381 PolarHBondContact O-N 3.41Å; H381-V384 PolarHBondContact O-N 2.69Å; H381-F385 WeakPolarHBondContact O-CB 3.23Å; H381-F385 PolarHBondContact O-N 3.14Å; H381-P420 HydrophobicContact CB-CG 4.44Å; H381-P420 VanDerWaalsContact CD2-CG 3.4Å; H381-P420 WeakPolarHBondContact CD2-CG 3.5Å
382	S	92.5	Very high	89.9	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60	-49.7	172.1	-64.7	0	0	0	0	110.9	H182 F190 I378 F380 V384 F385 D386	H182-S382 WeakPolarHBondContact CD2-CB 3.35Å; H182-S382 VanDerWaalsContact NE2-CB 3.35Å; H182-S382 WeakPolarHBondContact NE2-CB 3.44Å; H182-S382 PolarHBondContact NE2-O 2.85Å; F190-S382 WeakPolarHBondContact CE1-OG 3.16Å; I378-S382 WeakPolarHBondContact O-CB 3.46Å; I378-S382 PolarHBondContact O-N 3.26Å; I378-S382 PolarHBondContact O-OG 3.27Å; F380-S382 VanDerWaalsContact C-N 3.34Å; F380-S382 PolarHBondContact O-N 3.16Å; S382-V384 VanDerWaalsContact C-N 3.32Å; S382-V384 PolarHBondContact O-N 3.41Å; S382-F385 WeakPolarHBondContact O-CB 3.08Å; S382-F385 PolarHBondContact O-N 2.95Å; S382-F385 VanDerWaalsContact O-N 3.11Å; S382-D386 PolarHBondContact O-N 2.88Å
383	C	94.4	Very high	89.8	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-54.3	-47.1	174.2	175	0	0	0	0	112.3	C369 L373 Y379 F380 F385 D386 L387 T396 A399	C369-C383 HydrophobicContact CB-CB 3.87Å; C369-C383 WeakPolarHBondContact CB-SG 3.38Å; C369-C383 WeakPolarHBondContact SG-CB 3.23Å; C369-C383 CovalentContact SG-SG 2.04Å; C369-C383 PolarHBondContact SG-SG 2.05Å; L373-C383 HydrophobicContact CD1-CB 3.74Å; Y379-C383 WeakPolarHBondContact O-CB 3.25Å; Y379-C383 PolarHBondContact O-N 3.44Å; F380-C383 WeakPolarHBondContact O-CB 3.45Å; F380-C383 PolarHBondContact O-N 3.22Å; C383-F385 VanDerWaalsContact C-N 3.33Å; C383-F385 PolarHBondContact O-N 3.12Å; C383-D386 PolarHBondContact O-N 3.16Å; C383-L387 VanDerWaalsContact O-CG 3.3Å; C383-L387 WeakPolarHBondContact O-CG 3.4Å; C383-L387 PolarHBondContact O-N 2.92Å; C383-T396 VanDerWaalsContact SG-CA 3.59Å; C383-A399 HydrophobicContact CB-CB 3.69Å
384	V	92.1	Very high	89.7	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.9	-41.3	-179.9	177.7	0	0	0	0	110.5	L342 A365 K366 C369 F380 H381 S382 L387 L388	L342-V384 HydrophobicContact CD2-CB 4Å; L342-V384 HydrophobicContact CD2-CG1 3.52Å; A365-V384 HydrophobicContact CB-CG1 4.02Å; K366-V384 HydrophobicContact CG-CG1 4.18Å; K366-V384 HydrophobicContact CG-CG2 4.06Å; C369-V384 HydrophobicContact CB-CG2 3.97Å; C369-V384 PolarHBondContact SG-N 3.07Å; C369-V384 VanDerWaalsContact SG-N 3.38Å; F380-V384 HydrophobicContact CD1-CG2 4.25Å; F380-V384 HydrophobicContact CE1-CG2 3.74Å; F380-V384 HydrophobicContact CE2-CG2 4.27Å; F380-V384 HydrophobicContact CZ-CG2 3.76Å; F380-V384 WeakPolarHBondContact O-CG2 3.48Å; F380-V384 PolarHBondContact O-N 2.6Å; H381-V384 PolarHBondContact O-N 2.69Å; S382-V384 VanDerWaalsContact C-N 3.32Å; S382-V384 PolarHBondContact O-N 3.41Å; V384-L387 PolarHBondContact O-N 3.48Å; V384-L388 HydrophobicContact CG1-CD1 3.9Å; V384-L388 HydrophobicContact CG1-CG 4.46Å; V384-L388 WeakPolarHBondContact O-CG 3.24Å; V384-L388 PolarHBondContact O-N 3.32Å; V384-L388 VanDerWaalsContact O-N 3.17Å
385	F	89.8	Confident	89.9	Confident	16 Å²	16	20.9 Å²	20.9	7%	0.07	12%	0.122	C	C	.	.	H	α-helix	trans	-59.3	-54.9	176.2	-176.8	-96	0	0	0	111.2	D180 H182 T192 I334 L340 H381 S382 C383 L387 L388 T389	D180-F385 VanDerWaalsContact OD1-CD1 3.31Å; D180-F385 WeakPolarHBondContact OD1-CD1 3.31Å; D180-F385 WeakPolarHBondContact OD1-CE1 3.02Å; D180-F385 VanDerWaalsContact OD2-CD1 3.29Å; D180-F385 WeakPolarHBondContact OD2-CD1 3.28Å; D180-F385 WeakPolarHBondContact OD2-CE1 3.45Å; H182-F385 AromaticContact CE1-CD1 3.77Å; T192-F385 HydrophobicContact CG2-CD1 4.42Å; T192-F385 HydrophobicContact CG2-CE1 3.87Å; I334-F385 HydrophobicContact CG2-CZ 3.96Å; L340-F385 HydrophobicContact CD2-CB 4.4Å; L340-F385 HydrophobicContact CD2-CG 4.29Å; H381-F385 WeakPolarHBondContact O-CB 3.23Å; H381-F385 PolarHBondContact O-N 3.14Å; S382-F385 WeakPolarHBondContact O-CB 3.08Å; S382-F385 PolarHBondContact O-N 2.95Å; S382-F385 VanDerWaalsContact O-N 3.11Å; C383-F385 VanDerWaalsContact C-N 3.33Å; C383-F385 PolarHBondContact O-N 3.12Å; F385-L387 VanDerWaalsContact C-N 3.31Å; F385-L387 PolarHBondContact O-N 3.28Å; F385-L388 PolarHBondContact O-N 3.31Å; F385-T389 HydrophobicContact CD1-CG2 4.01Å; F385-T389 HydrophobicContact CD2-CG2 4.23Å; F385-T389 HydrophobicContact CE1-CG2 3.71Å; F385-T389 HydrophobicContact CE2-CG2 3.91Å; F385-T389 HydrophobicContact CG-CG2 4.29Å; F385-T389 HydrophobicContact CZ-CG2 3.64Å; F385-T389 WeakPolarHBondContact O-CG2 3.01Å; F385-T389 PolarHBondContact O-N 3.02Å; F385-T389 PolarHBondContact O-OG1 3.01Å; F385-T389 VanDerWaalsContact O-OG1 3.09Å
386	D	90.3	Very high	90.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-52	-46.3	177.9	-78	-32.6	0	0	0	112.1	G179 D180 H182 S382 C383 L388 T389 T390 F395	G179-D386 VanDerWaalsContact CA-OD2 3.31Å; G179-D386 WeakPolarHBondContact CA-OD2 3.32Å; D180-D386 WeakPolarHBondContact CB-OD1 3.37Å; D180-D386 PolarHBondContact N-OD1 2.79Å; D180-D386 VanDerWaalsContact OD1-OD1 3.08Å; H182-D386 IonicContact CD2-OD1 3.67Å; H182-D386 IonicContact CD2-OD2 3.03Å; H182-D386 IonicContact NE2-OD1 2.81Å; H182-D386 PolarHBondContact NE2-OD1 3.28Å; H182-D386 IonicContact NE2-OD2 3.51Å; H182-D386 PolarHBondContact NE2-OD2 3.42Å; S382-D386 PolarHBondContact O-N 2.88Å; C383-D386 PolarHBondContact O-N 3.16Å; D386-L388 VanDerWaalsContact C-N 3.3Å; D386-L388 PolarHBondContact O-N 2.95Å; D386-T389 WeakPolarHBondContact CA-OG1 3.34Å; D386-T389 PolarHBondContact O-N 2.96Å; D386-T389 PolarHBondContact O-OG1 3.18Å; D386-T390 WeakPolarHBondContact O-CB 3.48Å; D386-T390 WeakPolarHBondContact O-CG2 3.46Å; D386-T390 PolarHBondContact O-N 3.3Å; D386-T390 PolarHBondContact O-OG1 3.47Å; D386-F395 HydrophobicContact CB-CB 3.45Å; D386-F395 VanDerWaalsContact CB-CB 3.45Å; D386-F395 HydrophobicContact CB-CD1 4.23Å; D386-F395 HydrophobicContact CB-CD2 4.13Å; D386-F395 HydrophobicContact CB-CG 3.69Å
387	L	90.4	Very high	90.4	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64.4	-35.7	-179.9	-69.7	-172.6	0	0	0	112.4	F360 A365 R368 C383 V384 F385 G391 D392	F360-L387 HydrophobicContact CB-CB 4.43Å; F360-L387 HydrophobicContact CD2-CB 4.01Å; F360-L387 HydrophobicContact CD2-CD2 4.36Å; F360-L387 WeakPolarHBondContact CD2-O 3.08Å; F360-L387 HydrophobicContact CE1-CD1 4.49Å; F360-L387 HydrophobicContact CE2-CB 4.48Å; F360-L387 HydrophobicContact CE2-CD2 3.98Å; F360-L387 HydrophobicContact CG-CB 4.18Å; F360-L387 HydrophobicContact CZ-CD2 4.28Å; A365-L387 HydrophobicContact CB-CB 3.98Å; A365-L387 HydrophobicContact CB-CD1 4.12Å; R368-L387 HydrophobicContact CB-CD1 3.95Å; R368-L387 HydrophobicContact CG-CD1 3.89Å; C383-L387 VanDerWaalsContact O-CG 3.3Å; C383-L387 WeakPolarHBondContact O-CG 3.4Å; C383-L387 PolarHBondContact O-N 2.92Å; V384-L387 PolarHBondContact O-N 3.48Å; F385-L387 VanDerWaalsContact C-N 3.31Å; F385-L387 PolarHBondContact O-N 3.28Å; L387-G391 WeakPolarHBondContact O-CA 3.42Å; L387-G391 PolarHBondContact O-N 3.26Å; L387-G391 VanDerWaalsContact O-N 3.13Å; L387-D392 WeakPolarHBondContact CD2-O 3.48Å
388	L	87.6	Confident	90.7	Very high	20 Å²	20	18.2 Å²	18.2	11%	0.105	11%	0.107	C	C	.	.	H	α-helix	trans	-76.1	-36.8	179.2	-67.8	173.1	0	0	0	112.3	L342 P343 F360 V362 A365 V384 F385 D386	L342-L388 HydrophobicContact CD2-CD1 4.39Å; P343-L388 HydrophobicContact CG-CB 3.95Å; P343-L388 HydrophobicContact CG-CD1 4Å; F360-L388 HydrophobicContact CB-CD2 4.41Å; F360-L388 WeakPolarHBondContact O-CD2 3.48Å; V362-L388 HydrophobicContact CG2-CD1 4.17Å; V362-L388 HydrophobicContact CG2-CD2 4.12Å; A365-L388 HydrophobicContact CB-CD2 4.1Å; A365-L388 HydrophobicContact CB-CG 4.17Å; V384-L388 HydrophobicContact CG1-CD1 3.9Å; V384-L388 HydrophobicContact CG1-CG 4.46Å; V384-L388 WeakPolarHBondContact O-CG 3.24Å; V384-L388 PolarHBondContact O-N 3.32Å; V384-L388 VanDerWaalsContact O-N 3.17Å; F385-L388 PolarHBondContact O-N 3.31Å; D386-L388 VanDerWaalsContact C-N 3.3Å; D386-L388 PolarHBondContact O-N 2.95Å
389	T	83.1	Confident	91	Very high	42 Å²	42	17.9 Å²	17.9	26%	0.258	11%	0.105	S	C	.	.	H	α-helix	trans	-82.1	-36.3	-177.5	55.3	0	0	0	0	112.6	D180 F385 D386	D180-T389 PolarHBondContact OD2-OG1 3.43Å; F385-T389 HydrophobicContact CD1-CG2 4.01Å; F385-T389 HydrophobicContact CD2-CG2 4.23Å; F385-T389 HydrophobicContact CE1-CG2 3.71Å; F385-T389 HydrophobicContact CE2-CG2 3.91Å; F385-T389 HydrophobicContact CG-CG2 4.29Å; F385-T389 HydrophobicContact CZ-CG2 3.64Å; F385-T389 WeakPolarHBondContact O-CG2 3.01Å; F385-T389 PolarHBondContact O-N 3.02Å; F385-T389 PolarHBondContact O-OG1 3.01Å; F385-T389 VanDerWaalsContact O-OG1 3.09Å; D386-T389 WeakPolarHBondContact CA-OG1 3.34Å; D386-T389 PolarHBondContact O-N 2.96Å; D386-T389 PolarHBondContact O-OG1 3.18Å
390	T	83.9	Confident	91.1	Very high	21 Å²	21	20.2 Å²	20.2	13%	0.129	12%	0.117	C	C	.	.	H	α-helix	trans	-108.1	-28.5	-171.7	71.9	0	0	0	0	114.5	V216 A222 D386 D392 F395	V216-T390 HydrophobicContact CB-CG2 4.12Å; V216-T390 HydrophobicContact CG1-CG2 3.91Å; V216-T390 HydrophobicContact CG2-CG2 4.11Å; A222-T390 HydrophobicContact CB-CG2 3.95Å; D386-T390 WeakPolarHBondContact O-CB 3.48Å; D386-T390 WeakPolarHBondContact O-CG2 3.46Å; D386-T390 PolarHBondContact O-N 3.3Å; D386-T390 PolarHBondContact O-OG1 3.47Å; T390-D392 PolarHBondContact O-N 2.92Å; T390-D392 PolarHBondContact OG1-N 3.19Å; T390-D392 VanDerWaalsContact OG1-N 3.11Å; T390-F395 HydrophobicContact CG2-CD2 4.19Å; T390-F395 HydrophobicContact CG2-CE2 3.64Å; T390-F395 HydrophobicContact CG2-CZ 4.25Å; T390-F395 WeakPolarHBondContact OG1-CD2 3.39Å; T390-F395 VanDerWaalsContact OG1-CE2 3.3Å; T390-F395 WeakPolarHBondContact OG1-CE2 3.45Å
391	G	85.3	Confident	91.2	Very high	22 Å²	22	20.7 Å²	20.7	23%	0.227	12%	0.121	C	C	.	.			trans	71.7	6.2	-170.5	0	0	0	0	0	115.1	R358 F360 L387	R358-G391 WeakPolarHBondContact O-CA 3.31Å; F360-G391 WeakPolarHBondContact CE2-O 3.07Å; L387-G391 WeakPolarHBondContact O-CA 3.42Å; L387-G391 PolarHBondContact O-N 3.26Å; L387-G391 VanDerWaalsContact O-N 3.13Å
392	D	87.6	Confident	91.5	Very high	37 Å²	37	19.5 Å²	19.5	20%	0.198	12%	0.117	C	C	.	.			trans	-96.2	113.5	-177.8	-174	-8.6	0	0	0	112.1	L387 T390 N394 F395	L387-D392 WeakPolarHBondContact CD2-O 3.48Å; T390-D392 PolarHBondContact O-N 2.92Å; T390-D392 PolarHBondContact OG1-N 3.19Å; T390-D392 VanDerWaalsContact OG1-N 3.11Å; D392-N394 PolarHBondContact O-N 3.42Å; D392-N394 VanDerWaalsContact O-N 3.13Å; D392-N394 VanDerWaalsContact OD1-CB 3.3Å; D392-N394 WeakPolarHBondContact OD1-CB 3.44Å; D392-N394 PolarHBondContact OD1-N 3.47Å; D392-N394 PolarHBondContact OD1-ND2 3.35Å; D392-F395 HydrophobicContact CB-CD2 3.74Å; D392-F395 HydrophobicContact CB-CE2 3.83Å; D392-F395 WeakPolarHBondContact O-CD2 3.12Å; D392-F395 PolarHBondContact O-N 2.86Å
393	A	89.5	Confident	91.7	Very high	36 Å²	36	20 Å²	20	30%	0.298	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.3	180	0	0	0	0	0	114.6	F360 F395 T396	F360-A393 HydrophobicContact CZ-CB 4.18Å; A393-F395 PolarHBondContact O-N 3.35Å; A393-T396 WeakPolarHBondContact O-CB 3.25Å; A393-T396 PolarHBondContact O-N 3.24Å; A393-T396 PolarHBondContact O-OG1 3.33Å
394	N	91.3	Very high	91.8	Very high	62 Å²	62	24.1 Å²	24.1	33%	0.332	14%	0.137	S	C	.	.	H	α-helix	trans	-67.5	-23.2	177.3	-67.4	-53.3	0	0	0	112.5	D392 T396 L397 A398	D392-N394 PolarHBondContact O-N 3.42Å; D392-N394 VanDerWaalsContact O-N 3.13Å; D392-N394 VanDerWaalsContact OD1-CB 3.3Å; D392-N394 WeakPolarHBondContact OD1-CB 3.44Å; D392-N394 PolarHBondContact OD1-N 3.47Å; D392-N394 PolarHBondContact OD1-ND2 3.35Å; N394-T396 PolarHBondContact O-N 3.15Å; N394-L397 WeakPolarHBondContact O-CB 3.23Å; N394-L397 PolarHBondContact O-N 3.37Å; N394-A398 PolarHBondContact O-N 3.22Å; N394-A398 VanDerWaalsContact O-N 3.08Å
395	F	92.3	Very high	92	Very high	5 Å²	5	24.2 Å²	24.2	2%	0.022	14%	0.137	C	C	.	.	H	α-helix	trans	-65.1	-21.6	176.4	-73.5	-65.5	0	0	0	113.5	V216 A224 Y300 D386 T390 D392 A393 L397 A398 A399	V216-F395 HydrophobicContact CG1-CE2 4.42Å; V216-F395 HydrophobicContact CG2-CE2 4.48Å; V216-F395 HydrophobicContact CG2-CZ 4.05Å; A224-F395 HydrophobicContact CB-CE1 4.35Å; A224-F395 HydrophobicContact CB-CZ 4.13Å; Y300-F395 HydrophobicContact CD2-CE1 4.13Å; Y300-F395 HydrophobicContact CD2-CE2 4.49Å; Y300-F395 AromaticContact CD2-CZ 3.72Å; Y300-F395 HydrophobicContact CD2-CZ 3.72Å; Y300-F395 HydrophobicContact CE2-CE2 4.28Å; Y300-F395 AromaticContact CE2-CZ 3.79Å; Y300-F395 HydrophobicContact CE2-CZ 3.79Å; D386-F395 HydrophobicContact CB-CB 3.45Å; D386-F395 VanDerWaalsContact CB-CB 3.45Å; D386-F395 HydrophobicContact CB-CD1 4.23Å; D386-F395 HydrophobicContact CB-CD2 4.13Å; D386-F395 HydrophobicContact CB-CG 3.69Å; T390-F395 HydrophobicContact CG2-CD2 4.19Å; T390-F395 HydrophobicContact CG2-CE2 3.64Å; T390-F395 HydrophobicContact CG2-CZ 4.25Å; T390-F395 WeakPolarHBondContact OG1-CD2 3.39Å; T390-F395 VanDerWaalsContact OG1-CE2 3.3Å; T390-F395 WeakPolarHBondContact OG1-CE2 3.45Å; D392-F395 HydrophobicContact CB-CD2 3.74Å; D392-F395 HydrophobicContact CB-CE2 3.83Å; D392-F395 WeakPolarHBondContact O-CD2 3.12Å; D392-F395 PolarHBondContact O-N 2.86Å; A393-F395 PolarHBondContact O-N 3.35Å; F395-L397 VanDerWaalsContact C-N 3.33Å; F395-L397 PolarHBondContact O-N 3.27Å; F395-A398 HydrophobicContact CD1-CB 4.26Å; F395-A398 PolarHBondContact O-N 3.26Å; F395-A399 PolarHBondContact O-N 3.5Å
396	T	94.4	Very high	92.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.7	-43.7	168.2	-52.1	0	0	0	0	111.9	Q372 C383 A393 N394 H400	Q372-T396 HydrophobicContact CB-CG2 4.47Å; Q372-T396 HydrophobicContact CG-CG2 4.45Å; C383-T396 VanDerWaalsContact SG-CA 3.59Å; A393-T396 WeakPolarHBondContact O-CB 3.25Å; A393-T396 PolarHBondContact O-N 3.24Å; A393-T396 PolarHBondContact O-OG1 3.33Å; N394-T396 PolarHBondContact O-N 3.15Å; T396-H400 WeakPolarHBondContact O-CB 3.27Å; T396-H400 PolarHBondContact O-N 3.09Å; T396-H400 VanDerWaalsContact O-N 3.11Å
397	L	94.8	Very high	92.5	Very high	65 Å²	65	25.7 Å²	25.7	34%	0.34	15%	0.145	S	C	.	.	H	α-helix	trans	-69.4	-37.4	176.3	-67.1	169.2	0	0	0	110.9	L297 N394 F395 H400 S401	L297-L397 HydrophobicContact CD2-CB 4.38Å; N394-L397 WeakPolarHBondContact O-CB 3.23Å; N394-L397 PolarHBondContact O-N 3.37Å; F395-L397 VanDerWaalsContact C-N 3.33Å; F395-L397 PolarHBondContact O-N 3.27Å; L397-H400 PolarHBondContact O-N 2.88Å; L397-S401 VanDerWaalsContact O-CB 3.3Å; L397-S401 WeakPolarHBondContact O-CB 3.47Å; L397-S401 PolarHBondContact O-N 2.97Å; L397-S401 PolarHBondContact O-OG 2.92Å
398	A	95.6	Very high	92.8	Very high	4 Å²	4	29.6 Å²	29.6	3%	0.033	17%	0.172	C	C	.	.	H	α-helix	trans	-57.1	-51.1	175.8	0	0	0	0	0	112.3	L297 T302 N394 F395 S401 A402	L297-A398 VanDerWaalsContact CD1-CA 3.48Å; L297-A398 HydrophobicContact CD1-CB 4.25Å; T302-A398 HydrophobicContact CG2-CB 4.19Å; N394-A398 PolarHBondContact O-N 3.22Å; N394-A398 VanDerWaalsContact O-N 3.08Å; F395-A398 HydrophobicContact CD1-CB 4.26Å; F395-A398 PolarHBondContact O-N 3.26Å; A398-S401 PolarHBondContact O-N 3.05Å; A398-A402 WeakPolarHBondContact O-CB 3.34Å; A398-A402 PolarHBondContact O-N 3.43Å
399	A	96.3	Very high	93.1	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65	-42.1	178.3	0	0	0	0	0	112.8	F178 L373 C383 F395 A402 Q403	F178-A399 HydrophobicContact CD2-CB 4.44Å; F178-A399 HydrophobicContact CE2-CB 4.06Å; L373-A399 HydrophobicContact CD1-CB 3.75Å; C383-A399 HydrophobicContact CB-CB 3.69Å; F395-A399 PolarHBondContact O-N 3.5Å; A399-A402 PolarHBondContact O-N 3.48Å; A399-Q403 PolarHBondContact O-N 3.49Å
400	H	96.7	Very high	93.7	Very high	52 Å²	52	27.6 Å²	27.6	24%	0.241	16%	0.159	C	C	.	.	H	α-helix	trans	-63.1	-46.5	176	173.3	-100.3	0	0	0	112.2	Q372 L373 T396 L397 A402 Q403 K404	Q372-H400 HydrophobicContact CB-CB 4.16Å; Q372-H400 PolarHBondContact O-CD2 3.44Å; L373-H400 HydrophobicContact CD2-CB 4.36Å; L373-H400 HydrophobicContact CG-CB 4.48Å; T396-H400 WeakPolarHBondContact O-CB 3.27Å; T396-H400 PolarHBondContact O-N 3.09Å; T396-H400 VanDerWaalsContact O-N 3.11Å; L397-H400 PolarHBondContact O-N 2.88Å; H400-A402 PolarHBondContact O-N 3.34Å; H400-Q403 WeakPolarHBondContact O-CB 3.4Å; H400-Q403 PolarHBondContact O-N 3.02Å; H400-K404 WeakPolarHBondContact O-CG 3.41Å; H400-K404 PolarHBondContact O-N 3.35Å
401	S	96.6	Very high	94	Very high	19 Å²	19	29.2 Å²	29.2	13%	0.133	17%	0.17	C	C	.	.	H	α-helix	trans	-63.3	-40	176.7	-76.8	0	0	0	0	112.5	R295 L297 L397 A398 Q403 K404 D405	R295-S401 PolarHBondContact NH1-O 3.29Å; L297-S401 VanDerWaalsContact CD1-CB 3.48Å; L397-S401 VanDerWaalsContact O-CB 3.3Å; L397-S401 WeakPolarHBondContact O-CB 3.47Å; L397-S401 PolarHBondContact O-N 2.97Å; L397-S401 PolarHBondContact O-OG 2.92Å; A398-S401 PolarHBondContact O-N 3.05Å; S401-Q403 VanDerWaalsContact C-N 3.34Å; S401-Q403 PolarHBondContact O-N 3.29Å; S401-K404 PolarHBondContact O-N 3.46Å; S401-K404 VanDerWaalsContact O-N 3.16Å; S401-D405 PolarHBondContact O-N 3.32Å
402	A	96.9	Very high	94.1	Very high	8 Å²	8	32.3 Å²	32.3	7%	0.066	18%	0.178	C	C	.	.	H	α-helix	trans	-63.4	-38.8	175.7	0	0	0	0	0	112.3	F178 Y379 A398 A399 H400 K404 D405 M406	F178-A402 HydrophobicContact CB-CB 3.77Å; F178-A402 HydrophobicContact CD1-CB 3.39Å; F178-A402 HydrophobicContact CD2-CB 3.88Å; F178-A402 HydrophobicContact CE1-CB 3.84Å; F178-A402 HydrophobicContact CE2-CB 4.29Å; F178-A402 HydrophobicContact CG-CB 3.39Å; F178-A402 HydrophobicContact CZ-CB 4.26Å; Y379-A402 HydrophobicContact CD1-CB 4.19Å; Y379-A402 HydrophobicContact CE1-CB 4.03Å; A398-A402 WeakPolarHBondContact O-CB 3.34Å; A398-A402 PolarHBondContact O-N 3.43Å; A399-A402 PolarHBondContact O-N 3.48Å; H400-A402 PolarHBondContact O-N 3.34Å; A402-K404 VanDerWaalsContact C-N 3.34Å; A402-K404 PolarHBondContact O-N 3Å; A402-D405 PolarHBondContact O-N 3.29Å; A402-M406 PolarHBondContact O-N 2.82Å
403	Q	96.6	Very high	94.2	Very high	10 Å²	10	39.7 Å²	39.7	5%	0.047	20%	0.203	C	C	.	.	H	α-helix	trans	-61.2	-43.1	172.2	-172.5	-175.5	61	0	0	111.1	L373 D377 Y379 A399 H400 S401 D405 M406 E407	L373-Q403 HydrophobicContact CD2-CB 4.25Å; L373-Q403 VanDerWaalsContact CD2-OE1 3.32Å; D377-Q403 PolarHBondContact OD2-NE2 3.26Å; Y379-Q403 HydrophobicContact CD1-CB 4.06Å; Y379-Q403 HydrophobicContact CD2-CB 4.09Å; Y379-Q403 HydrophobicContact CD2-CG 4.01Å; Y379-Q403 HydrophobicContact CE1-CB 4.46Å; Y379-Q403 HydrophobicContact CE2-CB 4.49Å; Y379-Q403 HydrophobicContact CE2-CG 4.39Å; Y379-Q403 HydrophobicContact CG-CB 3.88Å; Y379-Q403 HydrophobicContact CG-CG 4.27Å; A399-Q403 PolarHBondContact O-N 3.49Å; H400-Q403 WeakPolarHBondContact O-CB 3.4Å; H400-Q403 PolarHBondContact O-N 3.02Å; S401-Q403 VanDerWaalsContact C-N 3.34Å; S401-Q403 PolarHBondContact O-N 3.29Å; Q403-D405 VanDerWaalsContact C-N 3.34Å; Q403-D405 PolarHBondContact O-N 3.35Å; Q403-M406 HydrophobicContact CG-CE 4.05Å; Q403-M406 PolarHBondContact O-N 3.2Å; Q403-E407 WeakPolarHBondContact O-CG 3.34Å; Q403-E407 PolarHBondContact O-N 2.76Å
404	K	96.6	Very high	94.1	Very high	87 Å²	87	43.9 Å²	43.9	38%	0.378	22%	0.221	S	C	.	.	H	α-helix	trans	-65.1	-34.9	175.9	-64.7	-54.9	174.8	-168.4	0	113.5	H400 S401 A402 E407 S408	H400-K404 WeakPolarHBondContact O-CG 3.41Å; H400-K404 PolarHBondContact O-N 3.35Å; S401-K404 PolarHBondContact O-N 3.46Å; S401-K404 VanDerWaalsContact O-N 3.16Å; A402-K404 VanDerWaalsContact C-N 3.34Å; A402-K404 PolarHBondContact O-N 3Å; K404-E407 VanDerWaalsContact CD-OE2 3.25Å; K404-E407 WeakPolarHBondContact CD-OE2 3.44Å; K404-E407 IonicContact NZ-OE1 3.71Å; K404-E407 IonicContact NZ-OE2 2.66Å; K404-E407 PolarHBondContact NZ-OE2 3.14Å; K404-E407 PolarHBondContact O-N 3.46Å; K404-S408 WeakPolarHBondContact O-CB 3.45Å; K404-S408 PolarHBondContact O-N 2.85Å
405	D	97	Very high	93.9	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.011	23%	0.228	C	C	.	.	H	α-helix	trans	-68.4	-40.5	175.2	-69.3	-27	0	0	0	112.1	R295 A304 S401 A402 Q403 S408 L409	R295-D405 IonicContact CZ-OD1 2.78Å; R295-D405 IonicContact CZ-OD2 3.47Å; R295-D405 IonicContact NE-OD1 2.88Å; R295-D405 IonicContact NE-OD2 3.4Å; R295-D405 IonicContact NH1-OD1 3.83Å; R295-D405 PolarHBondContact NH1-OD1 2.78Å; R295-D405 IonicContact NH1-OD2 2.63Å; R295-D405 PolarHBondContact NH1-OD2 2.87Å; R295-D405 IonicContact NH2-OD1 3.76Å; R295-D405 PolarHBondContact NH2-OD1 3.03Å; R295-D405 IonicContact NH2-OD2 3.06Å; A304-D405 HydrophobicContact CB-CB 3.59Å; S401-D405 PolarHBondContact O-N 3.32Å; A402-D405 PolarHBondContact O-N 3.29Å; Q403-D405 VanDerWaalsContact C-N 3.34Å; Q403-D405 PolarHBondContact O-N 3.35Å; D405-S408 PolarHBondContact O-N 2.98Å; D405-L409 WeakPolarHBondContact O-CB 3.49Å; D405-L409 PolarHBondContact O-N 2.97Å
406	M	95.8	Very high	93.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.7	-46.4	170.9	174.1	-80.4	-62.2	0	0	111.6	F174 Y379 A402 Q403 S408 L409 H410 W416	F174-M406 HydrophobicContact CE1-CB 3.99Å; F174-M406 HydrophobicContact CE1-CG 4.21Å; F174-M406 HydrophobicContact CE2-CB 4.36Å; F174-M406 HydrophobicContact CZ-CB 3.74Å; F174-M406 HydrophobicContact CZ-CG 4.4Å; Y379-M406 HydrophobicContact CE2-CE 3.73Å; Y379-M406 WeakPolarHBondContact OH-CB 3.47Å; Y379-M406 VanDerWaalsContact OH-CG 3.29Å; Y379-M406 WeakPolarHBondContact OH-CG 3.4Å; A402-M406 PolarHBondContact O-N 2.82Å; Q403-M406 HydrophobicContact CG-CE 4.05Å; Q403-M406 PolarHBondContact O-N 3.2Å; M406-S408 PolarHBondContact O-N 3.28Å; M406-L409 PolarHBondContact O-N 3.48Å; M406-H410 HydrophobicContact CG-CB 4.02Å; M406-H410 WeakPolarHBondContact O-CB 3.49Å; M406-H410 PolarHBondContact O-N 2.94Å; M406-H410 HydrophobicContact SD-CB 4.31Å; M406-W416 HydrophobicContact CE-CB 3.9Å; M406-W416 HydrophobicContact CE-CG 4.27Å; M406-W416 WeakPolarHBondContact CE-O 3.44Å; M406-W416 HydrophobicContact SD-CB 3.45Å; M406-W416 WeakPolarHBondContact SD-CB 3.39Å; M406-W416 HydrophobicContact SD-CD2 3.88Å; M406-W416 HydrophobicContact SD-CG 3.31Å
407	E	95.1	Very high	93.5	Very high	48 Å²	48	52.6 Å²	52.6	22%	0.224	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-29.1	177	-71.5	176.1	172.7	0	0	112.4	Q403 K404 W416 R417	Q403-E407 WeakPolarHBondContact O-CG 3.34Å; Q403-E407 PolarHBondContact O-N 2.76Å; K404-E407 VanDerWaalsContact CD-OE2 3.25Å; K404-E407 WeakPolarHBondContact CD-OE2 3.44Å; K404-E407 IonicContact NZ-OE1 3.71Å; K404-E407 IonicContact NZ-OE2 2.66Å; K404-E407 PolarHBondContact NZ-OE2 3.14Å; K404-E407 PolarHBondContact O-N 3.46Å; E407-W416 HydrophobicContact CB-CE3 4.49Å; E407-W416 HydrophobicContact CB-CH2 4.02Å; E407-W416 HydrophobicContact CB-CZ2 4.43Å; E407-W416 HydrophobicContact CB-CZ3 4.06Å; E407-W416 HydrophobicContact CG-CD2 4.47Å; E407-W416 HydrophobicContact CG-CE3 3.9Å; E407-W416 HydrophobicContact CG-CH2 4.29Å; E407-W416 HydrophobicContact CG-CZ3 3.8Å; E407-W416 VanDerWaalsContact O-CH2 3.31Å; E407-W416 WeakPolarHBondContact O-CH2 3.41Å; E407-W416 WeakPolarHBondContact O-CZ2 3.2Å; E407-R417 IonicContact OE1-NH2 2.98Å; E407-R417 PolarHBondContact OE1-NH2 3.03Å
408	S	95.1	Very high	93.1	Very high	81 Å²	81	51.5 Å²	51.5	57%	0.566	24%	0.243	S	C	*	.	H	α-helix	trans	-84.2	-36.5	179.3	-174.5	0	0	0	0	114	K404 D405 M406	K404-S408 WeakPolarHBondContact O-CB 3.45Å; K404-S408 PolarHBondContact O-N 2.85Å; D405-S408 PolarHBondContact O-N 2.98Å; M406-S408 PolarHBondContact O-N 3.28Å
409	L	95.6	Very high	92.5	Very high	9 Å²	9	57.5 Å²	57.5	5%	0.047	27%	0.266	C	S	.	.	H	α-helix	trans	-108.4	-25.9	-167.9	-70.1	-174.2	0	0	0	113.9	F174 T291 I293 A304 R306 D405 M406	F174-L409 HydrophobicContact CD2-CB 3.64Å; F174-L409 HydrophobicContact CE2-CB 3.8Å; F174-L409 HydrophobicContact CE2-CD1 4.25Å; T291-L409 HydrophobicContact CG2-CD2 3.95Å; I293-L409 HydrophobicContact CD1-CD1 3.66Å; I293-L409 HydrophobicContact CD1-CD2 4.17Å; I293-L409 HydrophobicContact CD1-CG 3.83Å; I293-L409 HydrophobicContact CG1-CD1 3.93Å; A304-L409 HydrophobicContact CB-CD1 3.96Å; R306-L409 HydrophobicContact CB-CB 4.12Å; R306-L409 HydrophobicContact CB-CD1 4.32Å; R306-L409 HydrophobicContact CB-CD2 4.07Å; R306-L409 HydrophobicContact CB-CG 4.4Å; R306-L409 VanDerWaalsContact CD-O 3.27Å; R306-L409 WeakPolarHBondContact CD-O 3.42Å; D405-L409 WeakPolarHBondContact O-CB 3.49Å; D405-L409 PolarHBondContact O-N 2.97Å; M406-L409 PolarHBondContact O-N 3.48Å
410	H	94	Very high	91.3	Very high	11 Å²	11	59.1 Å²	59.1	5%	0.051	28%	0.276	C	S	.	.			trans	-74.5	122.7	-173.8	-167.8	-70.4	0	0	0	111.5	F174 R184 D188 M406 H412 W416	F174-H410 HydrophobicContact CB-CB 4.21Å; F174-H410 VanDerWaalsContact CB-CD2 3.45Å; F174-H410 WeakPolarHBondContact CB-CD2 3.49Å; F174-H410 AromaticContact CD1-CD2 3.82Å; F174-H410 HydrophobicContact CD2-CB 4.41Å; F174-H410 HydrophobicContact CG-CB 4.17Å; F174-H410 AromaticContact CG-CD2 3.78Å; R184-H410 PolarHBondContact NH2-CD2 3.39Å; R184-H410 PolarHBondContact NH2-NE2 3.14Å; D188-H410 IonicContact OD1-CD2 2.69Å; D188-H410 IonicContact OD1-CE1 2.82Å; D188-H410 IonicContact OD1-NE2 3.95Å; D188-H410 PolarHBondContact OD1-NE2 3.02Å; D188-H410 IonicContact OD2-NE2 2.65Å; M406-H410 HydrophobicContact CG-CB 4.02Å; M406-H410 WeakPolarHBondContact O-CB 3.49Å; M406-H410 PolarHBondContact O-N 2.94Å; M406-H410 HydrophobicContact SD-CB 4.31Å; H410-H412 PolarHBondContact CE1-O 3.23Å; H410-H412 PolarHBondContact ND1-N 3.15Å; H410-H412 VanDerWaalsContact ND1-N 3.18Å; H410-H412 PolarHBondContact ND1-O 2.97Å; H410-H412 PolarHBondContact O-N 3.22Å; H410-W416 AromaticContact CG-CD1 3.77Å; H410-W416 AromaticContact CG-NE1 3.94Å; H410-W416 AromaticContact ND1-CD1 3.61Å; H410-W416 AromaticContact ND1-NE1 3.83Å; H410-W416 PolarHBondContact O-NE1 3.28Å
411	P	90.2	Very high	89.4	Confident	55 Å²	55	67.1 Å²	67.1	36%	0.357	30%	0.304	S	S	.	.	S	Bend	trans	-71.6	-28.8	-170	23.4	-29.4	0	0	0	114.1	Y172	Y172-P411 WeakPolarHBondContact O-CG 3.46Å
412	H	88.6	Confident	87.3	Confident	87 Å²	87	68.5 Å²	68.5	40%	0.403	32%	0.322	S	S	.	.			trans	-107.3	107.9	-176	-63	-67.6	0	0	0	111.2	H410 D414 R415 W416	H410-H412 PolarHBondContact CE1-O 3.23Å; H410-H412 PolarHBondContact ND1-N 3.15Å; H410-H412 VanDerWaalsContact ND1-N 3.18Å; H410-H412 PolarHBondContact ND1-O 2.97Å; H410-H412 PolarHBondContact O-N 3.22Å; H412-D414 VanDerWaalsContact C-N 3.27Å; H412-D414 WeakPolarHBondContact CB-OD1 3.5Å; H412-D414 PolarHBondContact O-N 3.21Å; H412-R415 HydrophobicContact CB-CB 4.37Å; H412-R415 HydrophobicContact CB-CG 4.15Å; H412-R415 PolarHBondContact O-N 3.42Å; H412-W416 PolarHBondContact O-NE1 3.45Å
413	R	89.1	Confident	84.8	Confident	192 Å²	192	70 Å²	70	73%	0.725	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-64.8	-31.3	-179.6	-66.3	-176.6	66.6	-163.5	-1.1	113	R415 W416	R413-R415 PolarHBondContact O-N 2.96Å; R413-W416 HydrophobicContact CB-CD2 4.28Å; R413-W416 HydrophobicContact CB-CZ2 4.47Å; R413-W416 HydrophobicContact CG-CD2 4.3Å; R413-W416 HydrophobicContact CG-CH2 4.01Å; R413-W416 HydrophobicContact CG-CZ2 3.62Å; R413-W416 HydrophobicContact CG-CZ3 4.48Å; R413-W416 WeakPolarHBondContact O-CB 3.44Å; R413-W416 PolarHBondContact O-N 3Å
414	D	88.3	Confident	82	Confident	124 Å²	124	73.1 Å²	73.1	66%	0.663	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-62.6	-25.6	176	54.7	-64.2	0	0	0	112.8	H412	H412-D414 VanDerWaalsContact C-N 3.27Å; H412-D414 WeakPolarHBondContact CB-OD1 3.5Å; H412-D414 PolarHBondContact O-N 3.21Å
415	R	86.8	Confident	79.2	Confident	130 Å²	130	72.1 Å²	72.1	49%	0.491	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-100.1	6.6	179.2	-55.2	-170.1	-174.1	-179.5	0.1	114.1	R184 D188 H412 R413 R417	R184-R415 PolarHBondContact NH2-O 2.83Å; D188-R415 WeakPolarHBondContact OD2-CD 3.26Å; D188-R415 IonicContact OD2-NH1 3.62Å; H412-R415 HydrophobicContact CB-CB 4.37Å; H412-R415 HydrophobicContact CB-CG 4.15Å; H412-R415 PolarHBondContact O-N 3.42Å; R413-R415 PolarHBondContact O-N 2.96Å; R415-R417 VanDerWaalsContact C-N 3.28Å; R415-R417 PolarHBondContact O-N 3.5Å
416	W	90.3	Very high	76.5	Confident	42 Å²	42	75.3 Å²	75.3	16%	0.159	39%	0.39	C	S	.	.	S	Bend	trans	-62.8	-38.3	180	-75	2.5	0	0	0	112.4	R184 M406 E407 H410 H412 R413	R184-W416 PolarHBondContact NH1-O 2.85Å; M406-W416 HydrophobicContact CE-CB 3.9Å; M406-W416 HydrophobicContact CE-CG 4.27Å; M406-W416 WeakPolarHBondContact CE-O 3.44Å; M406-W416 HydrophobicContact SD-CB 3.45Å; M406-W416 WeakPolarHBondContact SD-CB 3.39Å; M406-W416 HydrophobicContact SD-CD2 3.88Å; M406-W416 HydrophobicContact SD-CG 3.31Å; E407-W416 HydrophobicContact CB-CE3 4.49Å; E407-W416 HydrophobicContact CB-CH2 4.02Å; E407-W416 HydrophobicContact CB-CZ2 4.43Å; E407-W416 HydrophobicContact CB-CZ3 4.06Å; E407-W416 HydrophobicContact CG-CD2 4.47Å; E407-W416 HydrophobicContact CG-CE3 3.9Å; E407-W416 HydrophobicContact CG-CH2 4.29Å; E407-W416 HydrophobicContact CG-CZ3 3.8Å; E407-W416 VanDerWaalsContact O-CH2 3.31Å; E407-W416 WeakPolarHBondContact O-CH2 3.41Å; E407-W416 WeakPolarHBondContact O-CZ2 3.2Å; H410-W416 AromaticContact CG-CD1 3.77Å; H410-W416 AromaticContact CG-NE1 3.94Å; H410-W416 AromaticContact ND1-CD1 3.61Å; H410-W416 AromaticContact ND1-NE1 3.83Å; H410-W416 PolarHBondContact O-NE1 3.28Å; H412-W416 PolarHBondContact O-NE1 3.45Å; R413-W416 HydrophobicContact CB-CD2 4.28Å; R413-W416 HydrophobicContact CB-CZ2 4.47Å; R413-W416 HydrophobicContact CG-CD2 4.3Å; R413-W416 HydrophobicContact CG-CH2 4.01Å; R413-W416 HydrophobicContact CG-CZ2 3.62Å; R413-W416 HydrophobicContact CG-CZ3 4.48Å; R413-W416 WeakPolarHBondContact O-CB 3.44Å; R413-W416 PolarHBondContact O-N 3Å
417	R	88	Confident	73.9	Confident	78 Å²	78	83.3 Å²	83.3	29%	0.294	42%	0.421	S	S	.	.			trans	-96.8	122.1	-176	-54.9	-60.8	179	-170.1	-9.5	110.3	D377 E407 R415 Y419	D377-R417 WeakPolarHBondContact OD2-CD 3.27Å; D377-R417 IonicContact OD2-CZ 3.97Å; D377-R417 IonicContact OD2-NE 2.93Å; D377-R417 IonicContact OD2-NH1 3.9Å; D377-R417 PolarHBondContact OD2-NH1 2.88Å; E407-R417 IonicContact OE1-NH2 2.98Å; E407-R417 PolarHBondContact OE1-NH2 3.03Å; R415-R417 VanDerWaalsContact C-N 3.28Å; R415-R417 PolarHBondContact O-N 3.5Å; R417-Y419 HydrophobicContact CB-CE2 3.81Å
418	I	85.5	Confident	71.2	Confident	43 Å²	43	89.5 Å²	89.5	22%	0.221	45%	0.447	C	S	.	.			trans	-117.6	124.7	169.8	-57.1	169.5	0	0	0	105.9	D188 D377 I378	D188-I418 VanDerWaalsContact O-CD1 3.3Å; D188-I418 WeakPolarHBondContact O-CD1 3.43Å; D377-I418 WeakPolarHBondContact CB-O 3.17Å; I378-I418 HydrophobicContact CB-CB 4.49Å; I378-I418 HydrophobicContact CD1-CB 3.95Å; I378-I418 HydrophobicContact CD1-CD1 3.94Å; I378-I418 HydrophobicContact CD1-CG1 4.31Å; I378-I418 HydrophobicContact CG1-CB 3.92Å; I378-I418 HydrophobicContact CG2-CB 3.81Å; I378-I418 HydrophobicContact CG2-CG2 3.7Å; I378-I418 WeakPolarHBondContact CG2-O 3.48Å; I378-I418 PolarHBondContact N-O 3.02Å
419	Y	83.3	Confident	68.6	Low	130 Å²	130	91.2 Å²	91.2	51%	0.51	45%	0.446	S	S	.	.			trans	-106.1	136.4	178.7	-62	-76.8	0	0	0	109.3	V375 D377 R417	V375-Y419 HydrophobicContact CG1-CE1 4.15Å; D377-Y419 HydrophobicContact CB-CD1 4.42Å; D377-Y419 HydrophobicContact CB-CE1 4.29Å; R417-Y419 HydrophobicContact CB-CE2 3.81Å
420	P	70.4	Confident	66	Low	33 Å²	33	93.7 Å²	93.7	21%	0.214	46%	0.464	C	S	.	.			trans	-58.8	140.4	173.7	-21.5	31.6	0	0	0	111.2	H381 G422 S423	H381-P420 HydrophobicContact CB-CG 4.44Å; H381-P420 VanDerWaalsContact CD2-CG 3.4Å; H381-P420 WeakPolarHBondContact CD2-CG 3.5Å; P420-G422 PolarHBondContact O-N 3Å; P420-G422 VanDerWaalsContact O-N 3.14Å; P420-S423 PolarHBondContact O-N 3.37Å; P420-S423 PolarHBondContact O-OG 3.25Å; P420-S423 VanDerWaalsContact O-OG 3.04Å
421	R	58.5	Low	63.9	Low	220 Å²	220	97.9 Å²	97.9	83%	0.83	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	118.6	172.6	-79.8	-179.9	171.2	166.6	-2.1	109.2
422	G	51.8	Low	61.9	Low	48 Å²	48	97.6 Å²	97.6	50%	0.495	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	124.9	-20.4	-180	0	0	0	0	0	115.2	P420 A425 S426	P420-G422 PolarHBondContact O-N 3Å; P420-G422 VanDerWaalsContact O-N 3.14Å; G422-A425 PolarHBondContact O-N 2.96Å; G422-S426 PolarHBondContact O-N 3.47Å; G422-S426 PolarHBondContact O-OG 3.42Å
423	S	44.7	Very low	60.2	Low	39 Å²	39	98.3 Å²	98.3	27%	0.273	49%	0.49	S	S	.	.	H	α-helix	trans	-73.7	-27	176	55.1	0	0	0	0	113.3	P420 A425 S426	P420-S423 PolarHBondContact O-N 3.37Å; P420-S423 PolarHBondContact O-OG 3.25Å; P420-S423 VanDerWaalsContact O-OG 3.04Å; S423-A425 VanDerWaalsContact C-N 3.33Å; S423-S426 PolarHBondContact O-OG 2.86Å
424	A	37.5	Very low	58.7	Low	77 Å²	77	97.6 Å²	97.6	64%	0.636	49%	0.487	S	S	*	.	H	α-helix	trans	-71.1	-26.2	172.3	0	0	0	0	0	112.9	F428	A424-F428 WeakPolarHBondContact O-CD2 3.47Å
425	A	37.8	Very low	57.6	Low	66 Å²	66	97 Å²	97	55%	0.545	48%	0.482	S	S	.	.	H	α-helix	trans	-88.5	-30	-177.6	0	0	0	0	0	113	G422 S423 H429	G422-A425 PolarHBondContact O-N 2.96Å; S423-A425 VanDerWaalsContact C-N 3.33Å; A425-H429 WeakPolarHBondContact O-CB 3.09Å; A425-H429 PolarHBondContact O-N 2.87Å
426	S	40.6	Very low	56.6	Low	68 Å²	68	97.6 Å²	97.6	48%	0.476	49%	0.489	S	S	.	.	H	α-helix	trans	-75.7	-28.3	-176.8	49.6	0	0	0	0	113.8	G422 S423 S430	G422-S426 PolarHBondContact O-N 3.47Å; G422-S426 PolarHBondContact O-OG 3.42Å; S423-S426 PolarHBondContact O-OG 2.86Å; S426-S430 VanDerWaalsContact O-CB 3.29Å; S426-S430 WeakPolarHBondContact O-CB 3.49Å; S426-S430 PolarHBondContact O-N 2.93Å
427	Y	40	Very low	55.6	Low	169 Å²	169	102.3 Å²	102.3	66%	0.663	51%	0.511	S	S	*	.	H	α-helix	trans	-69.3	-43.8	174.7	-98.9	-91.4	0	0	0	112.4
428	F	39.3	Very low	54.8	Low	177 Å²	177	104 Å²	104	78%	0.776	52%	0.524	S	S	*	.	H	α-helix	trans	-78.6	-23.6	179.7	-69.8	-73.3	0	0	0	113.9	A424 S432	A424-F428 WeakPolarHBondContact O-CD2 3.47Å; F428-S432 WeakPolarHBondContact O-CB 3.2Å; F428-S432 PolarHBondContact O-N 2.78Å
429	H	40.1	Very low	54.3	Low	118 Å²	118	104.1 Å²	104.1	55%	0.546	53%	0.532	S	S	.	.	H	α-helix	trans	-85.3	-32.8	179.5	-144.2	67.5	0	0	0	113.3	A425 Q433	A425-H429 WeakPolarHBondContact O-CB 3.09Å; A425-H429 PolarHBondContact O-N 2.87Å; H429-Q433 PolarHBondContact O-N 2.87Å; H429-Q433 VanDerWaalsContact O-N 3.12Å
430	S	41.9	Very low	53.9	Low	60 Å²	60	103.4 Å²	103.4	42%	0.42	54%	0.536	S	S	.	.	H	α-helix	trans	-68.9	-40.5	178	-177.2	0	0	0	0	112.3	S426 R434	S426-S430 VanDerWaalsContact O-CB 3.29Å; S426-S430 WeakPolarHBondContact O-CB 3.49Å; S426-S430 PolarHBondContact O-N 2.93Å; S430-R434 WeakPolarHBondContact O-CB 3.37Å; S430-R434 WeakPolarHBondContact O-CG 3.33Å; S430-R434 PolarHBondContact O-N 2.95Å; S430-R434 VanDerWaalsContact O-N 3.12Å
431	D	48.6	Very low	54.2	Low	100 Å²	100	107.5 Å²	107.5	54%	0.535	56%	0.556	S	S	.	*	H	α-helix	trans	-71.4	-39.4	176.3	-102	-7.8	0	0	0	112.3	Q433 R434 I435	D431-Q433 VanDerWaalsContact C-N 3.34Å; D431-Q433 PolarHBondContact O-N 2.8Å; D431-R434 PolarHBondContact O-N 3.07Å; D431-I435 WeakPolarHBondContact O-CB 3.45Å; D431-I435 WeakPolarHBondContact O-CD1 3.5Å; D431-I435 WeakPolarHBondContact O-CG1 3.44Å; D431-I435 PolarHBondContact O-N 3.27Å
432	S	49.4	Very low	54.9	Low	48 Å²	48	101.8 Å²	101.8	34%	0.336	54%	0.542	S	S	.	.	H	α-helix	trans	-62.8	-39.2	177	-168.7	0	0	0	0	112.4	F428 K436	F428-S432 WeakPolarHBondContact O-CB 3.2Å; F428-S432 PolarHBondContact O-N 2.78Å; S432-K436 WeakPolarHBondContact O-CB 3.31Å; S432-K436 WeakPolarHBondContact O-CG 3.35Å; S432-K436 PolarHBondContact O-N 3.37Å
433	Q	53.2	Low	56.1	Low	103 Å²	103	105 Å²	105	48%	0.481	55%	0.546	S	S	.	.	H	α-helix	trans	-73.1	-35.7	176.6	-75.1	-160.3	4.3	0	0	113.3	H429 D431 K437	H429-Q433 PolarHBondContact O-N 2.87Å; H429-Q433 VanDerWaalsContact O-N 3.12Å; D431-Q433 VanDerWaalsContact C-N 3.34Å; D431-Q433 PolarHBondContact O-N 2.8Å; Q433-K437 WeakPolarHBondContact O-CB 3.25Å; Q433-K437 WeakPolarHBondContact O-CG 3.35Å; Q433-K437 PolarHBondContact O-N 2.66Å
434	R	56.3	Low	57.4	Low	177 Å²	177	106.4 Å²	106.4	67%	0.668	56%	0.556	S	S	*	*	H	α-helix	trans	-67.7	-42.1	175.4	-76.8	-178.5	177.9	-168.9	-1	111.9	S430 D431 K437 L438	S430-R434 WeakPolarHBondContact O-CB 3.37Å; S430-R434 WeakPolarHBondContact O-CG 3.33Å; S430-R434 PolarHBondContact O-N 2.95Å; S430-R434 VanDerWaalsContact O-N 3.12Å; D431-R434 PolarHBondContact O-N 3.07Å; R434-K437 PolarHBondContact O-N 2.86Å; R434-L438 WeakPolarHBondContact O-CB 3.24Å; R434-L438 PolarHBondContact O-N 3.44Å
435	I	64.8	Low	58.8	Low	110 Å²	110	105.4 Å²	105.4	56%	0.564	55%	0.548	S	S	*	.	H	α-helix	trans	-65.4	-42.4	176.3	-65.7	164.9	0	0	0	110.7	D431 L438 A439	D431-I435 WeakPolarHBondContact O-CB 3.45Å; D431-I435 WeakPolarHBondContact O-CD1 3.5Å; D431-I435 WeakPolarHBondContact O-CG1 3.44Å; D431-I435 PolarHBondContact O-N 3.27Å; I435-L438 PolarHBondContact O-N 3.15Å; I435-A439 VanDerWaalsContact O-CB 3.31Å; I435-A439 WeakPolarHBondContact O-CB 3.22Å; I435-A439 PolarHBondContact O-N 3.26Å
436	K	67.6	Low	60.2	Low	144 Å²	144	107 Å²	107	63%	0.626	55%	0.546	S	S	*	.	H	α-helix	trans	-63.7	-40.3	175.5	-75.2	174.4	-176.2	-177.6	0	112.7	S432 L440	S432-K436 WeakPolarHBondContact O-CB 3.31Å; S432-K436 WeakPolarHBondContact O-CG 3.35Å; S432-K436 PolarHBondContact O-N 3.37Å; K436-L440 WeakPolarHBondContact O-CB 3.34Å; K436-L440 PolarHBondContact O-N 3.1Å
437	K	69.2	Low	61.2	Low	141 Å²	141	107 Å²	107	61%	0.613	55%	0.547	S	S	*	.	H	α-helix	trans	-67.3	-40.1	175.3	-77.6	-177.1	178.4	-176.7	0	112.2	Q433 R434 L440 L441	Q433-K437 WeakPolarHBondContact O-CB 3.25Å; Q433-K437 WeakPolarHBondContact O-CG 3.35Å; Q433-K437 PolarHBondContact O-N 2.66Å; R434-K437 PolarHBondContact O-N 2.86Å; K437-L440 PolarHBondContact O-N 3.08Å; K437-L441 WeakPolarHBondContact O-CB 3.49Å; K437-L441 VanDerWaalsContact O-CG 3.31Å; K437-L441 WeakPolarHBondContact O-CG 3.46Å; K437-L441 PolarHBondContact O-N 3.31Å
438	L	71.2	Confident	62.2	Low	112 Å²	112	104.5 Å²	104.5	59%	0.586	55%	0.549	S	S	*	.	H	α-helix	trans	-66.9	-41.6	176.7	-157.2	80.2	0	0	0	111.5	R434 I435 L441 L442	R434-L438 WeakPolarHBondContact O-CB 3.24Å; R434-L438 PolarHBondContact O-N 3.44Å; I435-L438 PolarHBondContact O-N 3.15Å; L438-L441 PolarHBondContact O-N 3.27Å; L438-L442 HydrophobicContact CG-CD1 4.31Å; L438-L442 WeakPolarHBondContact O-CB 3.42Å; L438-L442 PolarHBondContact O-N 3.02Å
439	A	73.6	Confident	63	Low	46 Å²	46	101.5 Å²	101.5	38%	0.38	55%	0.545	S	S	.	.	H	α-helix	trans	-63.8	-41.2	175.5	0	0	0	0	0	112	I435 L442 L443	I435-A439 VanDerWaalsContact O-CB 3.31Å; I435-A439 WeakPolarHBondContact O-CB 3.22Å; I435-A439 PolarHBondContact O-N 3.26Å; A439-L442 PolarHBondContact O-N 3.37Å; A439-L443 WeakPolarHBondContact O-CB 3.32Å; A439-L443 WeakPolarHBondContact O-CD1 3.5Å; A439-L443 WeakPolarHBondContact O-CG 3.47Å; A439-L443 PolarHBondContact O-N 2.04Å
440	L	75.9	Confident	63.7	Low	115 Å²	115	104.3 Å²	104.3	60%	0.602	56%	0.556	S	S	*	*	H	α-helix	trans	-65.7	-41.4	175.9	-166.8	71.5	0	0	0	111.7	K436 K437 L443 C444	K436-L440 WeakPolarHBondContact O-CB 3.34Å; K436-L440 PolarHBondContact O-N 3.1Å; K437-L440 PolarHBondContact O-N 3.08Å; L440-L443 PolarHBondContact O-N 3.32Å; L440-C444 WeakPolarHBondContact O-CB 3.2Å; L440-C444 PolarHBondContact O-N 3.3Å; L440-C444 PolarHBondContact O-SG 2.75Å; L440-C444 VanDerWaalsContact O-SG 3.32Å
441	L	75.6	Confident	64	Low	119 Å²	119	110.5 Å²	110.5	62%	0.623	59%	0.59	S	S	*	*	H	α-helix	trans	-65	-38.5	175.4	-76.3	165.2	0	0	0	112.3	K437 L438 C444 A445	K437-L441 WeakPolarHBondContact O-CB 3.49Å; K437-L441 VanDerWaalsContact O-CG 3.31Å; K437-L441 WeakPolarHBondContact O-CG 3.46Å; K437-L441 PolarHBondContact O-N 3.31Å; L438-L441 PolarHBondContact O-N 3.27Å; L441-C444 PolarHBondContact O-N 2.98Å; L441-A445 WeakPolarHBondContact O-CB 3.1Å; L441-A445 PolarHBondContact O-N 2.86Å
442	L	74.8	Confident	64.7	Low	101 Å²	101	111.1 Å²	111.1	53%	0.529	59%	0.593	S	S	.	*	H	α-helix	trans	-67	-40.7	174.7	-85.7	155.7	0	0	0	112.2	L438 A439 A445 L446	L438-L442 HydrophobicContact CG-CD1 4.31Å; L438-L442 WeakPolarHBondContact O-CB 3.42Å; L438-L442 PolarHBondContact O-N 3.02Å; A439-L442 PolarHBondContact O-N 3.37Å; L442-A445 PolarHBondContact O-N 3.29Å; L442-L446 WeakPolarHBondContact O-CB 3.49Å; L442-L446 VanDerWaalsContact O-CG 3.3Å; L442-L446 WeakPolarHBondContact O-CG 3.06Å; L442-L446 PolarHBondContact O-N 3.41Å
443	L	75.7	Confident	65.5	Low	114 Å²	114	114.4 Å²	114.4	60%	0.597	61%	0.607	S	S	*	*	H	α-helix	trans	-65.9	-38.4	174.8	-77.9	158.9	0	0	0	112.1	A439 L440 S447	A439-L443 WeakPolarHBondContact O-CB 3.32Å; A439-L443 WeakPolarHBondContact O-CD1 3.5Å; A439-L443 WeakPolarHBondContact O-CG 3.47Å; A439-L443 PolarHBondContact O-N 2.04Å; L440-L443 PolarHBondContact O-N 3.32Å; L443-S447 PolarHBondContact O-N 3.13Å; L443-S447 VanDerWaalsContact O-N 3.12Å; L443-S447 PolarHBondContact O-OG 3.07Å
444	C	71.4	Confident	66.2	Low	70 Å²	70	115 Å²	115	47%	0.473	61%	0.614	S	S	.	*	H	α-helix	trans	-67.7	-38.6	172.7	-72.4	0	0	0	0	112.2	L440 L441 S447 V448	L440-C444 WeakPolarHBondContact O-CB 3.2Å; L440-C444 PolarHBondContact O-N 3.3Å; L440-C444 PolarHBondContact O-SG 2.75Å; L440-C444 VanDerWaalsContact O-SG 3.32Å; L441-C444 PolarHBondContact O-N 2.98Å; C444-S447 WeakPolarHBondContact CA-OG 3.49Å; C444-S447 PolarHBondContact O-N 3.4Å; C444-S447 PolarHBondContact O-OG 3.18Å; C444-V448 WeakPolarHBondContact O-CG2 3.39Å; C444-V448 PolarHBondContact O-N 3.32Å
445	A	67.7	Low	66.8	Low	56 Å²	56	111.4 Å²	111.4	46%	0.463	61%	0.611	S	S	.	*	H	α-helix	trans	-67.6	-38.6	176.8	0	0	0	0	0	112.2	L441 L442 V448 V449	L441-A445 WeakPolarHBondContact O-CB 3.1Å; L441-A445 PolarHBondContact O-N 2.86Å; L442-A445 PolarHBondContact O-N 3.29Å; A445-V448 PolarHBondContact O-N 3.48Å; A445-V449 WeakPolarHBondContact O-CG2 3.4Å; A445-V449 PolarHBondContact O-N 3.45Å
446	L	68.3	Low	66.9	Low	98 Å²	98	111.4 Å²	111.4	51%	0.513	61%	0.614	S	S	.	*	H	α-helix	trans	-69.6	-32.5	177.2	-73.1	165.5	0	0	0	112.6	L442 V448 V449 F450	L442-L446 WeakPolarHBondContact O-CB 3.49Å; L442-L446 VanDerWaalsContact O-CG 3.3Å; L442-L446 WeakPolarHBondContact O-CG 3.06Å; L442-L446 PolarHBondContact O-N 3.41Å; L446-V448 VanDerWaalsContact C-N 3.31Å; L446-V448 PolarHBondContact O-N 3.16Å; L446-V449 PolarHBondContact O-N 3.27Å; L446-F450 WeakPolarHBondContact O-CD2 3.42Å
447	S	60.3	Low	66.9	Low	70 Å²	70	109.3 Å²	109.3	49%	0.49	61%	0.613	S	S	.	*	H	α-helix	trans	-73.1	-21.5	176.5	38.5	0	0	0	0	113.7	L443 C444	L443-S447 PolarHBondContact O-N 3.13Å; L443-S447 VanDerWaalsContact O-N 3.12Å; L443-S447 PolarHBondContact O-OG 3.07Å; C444-S447 WeakPolarHBondContact CA-OG 3.49Å; C444-S447 PolarHBondContact O-N 3.4Å; C444-S447 PolarHBondContact O-OG 3.18Å
448	V	60.8	Low	66.7	Low	116 Å²	116	107 Å²	107	70%	0.703	61%	0.613	S	S	*	*	H	α-helix	trans	-81.4	-19.9	173.7	176.8	0	0	0	0	112.3	C444 A445 L446	C444-V448 WeakPolarHBondContact O-CG2 3.39Å; C444-V448 PolarHBondContact O-N 3.32Å; A445-V448 PolarHBondContact O-N 3.48Å; L446-V448 VanDerWaalsContact C-N 3.31Å; L446-V448 PolarHBondContact O-N 3.16Å
449	V	57.4	Low	66.4	Low	114 Å²	114	106.6 Å²	106.6	69%	0.691	62%	0.615	S	S	*	*	H	α-helix	trans	-86.7	-13.5	178.7	175.6	0	0	0	0	112.6	A445 L446	A445-V449 WeakPolarHBondContact O-CG2 3.4Å; A445-V449 PolarHBondContact O-N 3.45Å; L446-V449 PolarHBondContact O-N 3.27Å
450	F	53.3	Low	65.8	Low	177 Å²	177	111.7 Å²	111.7	78%	0.776	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	24.4	-178.5	-80.5	-76.8	0	0	0	114.3	L446	L446-F450 WeakPolarHBondContact O-CD2 3.42Å
451	V	48.1	Very low	64.9	Low	190 Å²	190	111.4 Å²	111.4	100%	1.152	64%	0.637	S	S	*	*			trans	-116.7	0	169.4	177.8	0	0	0	0	110.6

Retrieved 451 of 451 residues in 302.3 ms (Link to these results)

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