A0A087YHG0_POEFO Loading...

Metal response element binding transcription factor 2

AlphaFold DB , UniProt , Accession A0A087YHG0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 620 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36	Very low	31.7	Very low	223 Å²	223	150.1 Å²	150.1	100%	1.099	83%	0.829	S	S	*	*				0	125.7	0	-84.9	-157.6	-163.1	0	0	107
2	R	39.2	Very low	31.3	Very low	204 Å²	204	149.5 Å²	149.5	77%	0.77	82%	0.823	S	S	*	*			cis	-146.1	163.8	-9.2	-67.3	176.5	-176.7	150.1	0.2	106.9
3	D	28.6	Very low	30.9	Very low	159 Å²	159	153.4 Å²	153.4	85%	0.85	82%	0.818	S	S	*	*				177.5	170.7	108	-89	-22.1	0	0	0	112.4
4	L	40.6	Very low	30.6	Very low	182 Å²	182	154.4 Å²	154.4	95%	0.953	81%	0.814	S	S	*	*			trans	-110.3	138.7	-177.4	-71.3	161.8	0	0	0	109.8
5	G	29.6	Very low	30.3	Very low	78 Å²	78	159.3 Å²	159.3	80%	0.804	82%	0.817	S	S	*	*			trans	-173.4	142.6	174.3	0	0	0	0	0	111.3
6	V	32	Very low	29.9	Very low	141 Å²	141	154.8 Å²	154.8	86%	0.855	81%	0.812	S	S	*	*			trans	-122.8	140.2	-176.9	173.9	0	0	0	0	108.9
7	V	29.5	Very low	29.9	Very low	124 Å²	124	156.4 Å²	156.4	75%	0.752	81%	0.814	S	S	*	*			trans	175.5	129.3	134.6	148.7	0	0	0	0	111.4
8	D	26.7	Very low	29.9	Very low	141 Å²	141	154.9 Å²	154.9	75%	0.754	82%	0.815	S	S	*	*			trans	26.6	134.4	157.6	-57.7	-38.6	0	0	0	125
9	H	28.2	Very low	29.6	Very low	190 Å²	190	156.5 Å²	156.5	88%	0.88	82%	0.818	S	S	*	*				-154.2	151.8	122.2	-114	-82.3	0	0	0	110.9
10	P	31.8	Very low	29.6	Very low	105 Å²	105	157.7 Å²	157.7	68%	0.682	82%	0.819	S	S	*	*			trans	-108.7	149.6	-163.6	38.9	-33	0	0	0	117.6
11	S	26.5	Very low	29.4	Very low	104 Å²	104	159.2 Å²	159.2	73%	0.727	82%	0.822	S	S	*	*			trans	27.6	131.2	142.9	-55.7	0	0	0	0	122.6
12	L	26.4	Very low	29	Very low	143 Å²	143	155.1 Å²	155.1	75%	0.749	81%	0.81	S	S	*	*				171	121.2	101.5	-89.3	170.7	0	0	0	114.7
13	R	26.9	Very low	28.2	Very low	200 Å²	200	151.9 Å²	151.9	76%	0.755	81%	0.813	S	S	*	*			trans	58.2	152.3	143.2	-62.4	-178.3	-176.6	-151.9	-0.7	119.2
14	H	26.7	Very low	28	Very low	167 Å²	167	149.4 Å²	149.4	77%	0.773	81%	0.807	S	S	*	*			cis	-167.4	165.5	-5.6	-108.3	-18	0	0	0	108.2
15	R	25.8	Very low	27.2	Very low	228 Å²	228	148.9 Å²	148.9	86%	0.86	81%	0.805	S	S	*	*			cis	-139.2	-105	-8.3	-169.9	177.7	173.5	173	-1.8	111.1
16	A	24.5	Very low	27	Very low	88 Å²	88	150.2 Å²	150.2	73%	0.727	80%	0.802	S	S	*	*			trans	-168.2	175	-176	0	0	0	0	0	113.6
17	H	29.2	Very low	27.2	Very low	182 Å²	182	149.5 Å²	149.5	84%	0.843	80%	0.8	S	S	*	*			trans	-58.9	176.6	175.5	-59	-97	0	0	0	115.3
18	P	30.7	Very low	27	Very low	129 Å²	129	150 Å²	150	84%	0.838	81%	0.808	S	S	*	*				-137.7	-165.8	103	41.5	-30.4	0	0	0	114.8
19	E	24.1	Very low	26.9	Very low	185 Å²	185	146.8 Å²	146.8	86%	0.864	81%	0.807	S	S	*	*			trans	-110.8	-176.3	-159.6	-61.7	166.5	104.6	0	0	115.4
20	Q	29.7	Very low	27.2	Very low	180 Å²	180	146.7 Å²	146.7	84%	0.841	81%	0.812	S	S	*	*			trans	-32	144.5	172.7	-56.2	168.7	-9.8	0	0	117.8
21	Q	25	Very low	26.9	Very low	191 Å²	191	147.3 Å²	147.3	89%	0.893	82%	0.819	S	S	*	*			trans	-160.5	152.3	133.9	-116.2	169.2	32.4	0	0	113.4
22	T	26.7	Very low	27.1	Very low	137 Å²	137	146.6 Å²	146.6	84%	0.84	82%	0.82	S	S	*	*			trans	-94.1	136.1	178.2	49.7	0	0	0	0	111.7
23	V	24.1	Very low	27.2	Very low	136 Å²	136	149.8 Å²	149.8	82%	0.824	82%	0.822	S	S	*	*			trans	-136.6	137.1	169.9	-176.8	0	0	0	0	110.3
24	S	22.7	Very low	27.1	Very low	106 Å²	106	143.2 Å²	143.2	74%	0.741	82%	0.816	S	S	*	*			trans	-74	151	177.7	-48.5	0	0	0	0	112.6
25	L	24.8	Very low	27.7	Very low	172 Å²	172	142.1 Å²	142.1	90%	0.901	81%	0.811	S	S	*	*			trans	-118.4	135.3	162.4	-69.9	174.8	0	0	0	110.4
26	S	24.2	Very low	28	Very low	106 Å²	106	141.7 Å²	141.7	74%	0.741	81%	0.811	S	S	*	*			trans	-147.9	154.6	176.2	-71.1	0	0	0	0	107.6
27	P	36.2	Very low	28.4	Very low	126 Å²	126	140.3 Å²	140.3	82%	0.818	81%	0.806	S	S	*	*			trans	-80.6	144.8	-147.2	28.8	-36.2	0	0	0	115.1
28	C	26.6	Very low	28.7	Very low	135 Å²	135	141.5 Å²	141.5	91%	0.912	81%	0.812	S	S	*	*			trans	-137.2	149	154.2	-72.5	0	0	0	0	106.3
29	G	24.8	Very low	29	Very low	72 Å²	72	142.1 Å²	142.1	74%	0.742	81%	0.808	S	S	*	*			cis	165.4	127.6	-1.7	0	0	0	0	0	108.5
30	L	33.3	Very low	30.1	Very low	188 Å²	188	138.1 Å²	138.1	98%	0.984	79%	0.793	S	S	*	*			trans	-65.2	135.7	-172.4	-71.3	165.7	0	0	0	112.7
31	S	26.6	Very low	30.9	Very low	119 Å²	119	135.5 Å²	135.5	83%	0.832	78%	0.782	S	S	*	*			trans	-149.4	138	154.4	-178.3	0	0	0	0	110
32	A	29.4	Very low	31.7	Very low	89 Å²	89	127 Å²	127	74%	0.736	74%	0.743	S	S	*	*			trans	-62.3	164.4	171.9	0	0	0	0	0	110.8
33	R	29.2	Very low	33.2	Very low	210 Å²	210	123.6 Å²	123.6	79%	0.792	73%	0.729	S	S	*	*			cis	-165.3	143	36.2	-180	-177.7	179.8	-173	0.9	112	E35	R33-E35 IonicContact CZ-OE2 3.52Å; R33-E35 IonicContact NE-OE2 2.75Å; R33-E35 PolarHBondContact NE-OE2 2.61Å; R33-E35 IonicContact NH2-OE1 2.81Å; R33-E35 IonicContact NH2-OE2 3.2Å; R33-E35 PolarHBondContact NH2-OE2 2.66Å
34	G	25.3	Very low	35.5	Very low	61 Å²	61	123.2 Å²	123.2	63%	0.629	71%	0.713	S	S	*	*			trans	-166.8	90.3	170	0	0	0	0	0	110.3	Y36	G34-Y36 PolarHBondContact O-N 3.23Å
35	E	38.9	Very low	38.4	Very low	144 Å²	144	118.6 Å²	118.6	67%	0.673	68%	0.679	S	S	*	*			trans	-82.6	95.7	-177.4	-71.4	154.6	108.8	0	0	110.3	R33	R33-E35 IonicContact CZ-OE2 3.52Å; R33-E35 IonicContact NE-OE2 2.75Å; R33-E35 PolarHBondContact NE-OE2 2.61Å; R33-E35 IonicContact NH2-OE1 2.81Å; R33-E35 IonicContact NH2-OE2 3.2Å; R33-E35 PolarHBondContact NH2-OE2 2.66Å
36	Y	32.8	Very low	41.4	Very low	219 Å²	219	114.3 Å²	114.3	86%	0.859	66%	0.661	S	S	*	*			trans	-140	134.8	171	-63.1	-78.3	0	0	0	109.3	G34	G34-Y36 PolarHBondContact O-N 3.23Å
37	G	32.4	Very low	44.5	Very low	60 Å²	60	115.6 Å²	115.6	62%	0.619	66%	0.655	S	S	*	*			trans	51.4	73	162.8	0	0	0	0	0	118	D39	G37-D39 PolarHBondContact O-N 3.29Å; G37-D39 VanDerWaalsContact O-N 3.09Å
38	E	34.7	Very low	47	Very low	206 Å²	206	112.3 Å²	112.3	96%	0.963	64%	0.644	S	S	*	*			trans	-75.2	72.1	140.3	-75.6	-170.9	156.9	0	0	107.1
39	D	38.6	Very low	50	Low	143 Å²	143	107.3 Å²	107.3	77%	0.765	61%	0.607	S	S	*	*			trans	-66.4	139.1	-177.3	-97.1	-52.6	0	0	0	111.2	G37 M41	G37-D39 PolarHBondContact O-N 3.29Å; G37-D39 VanDerWaalsContact O-N 3.09Å; D39-M41 VanDerWaalsContact C-N 3.3Å; D39-M41 PolarHBondContact O-N 2.76Å
40	D	46.4	Very low	53.2	Low	101 Å²	101	108.2 Å²	108.2	54%	0.54	60%	0.595	S	S	.	*			trans	-77.7	76.9	-162.6	-171.3	17.6	0	0	0	112.1	S42 A43	D40-S42 PolarHBondContact O-N 3.38Å; D40-S42 WeakPolarHBondContact OD1-CB 3.24Å; D40-S42 PolarHBondContact OD1-N 3.2Å; D40-S42 PolarHBondContact OD1-OG 3.22Å; D40-S42 PolarHBondContact OD2-OG 3.45Å; D40-A43 VanDerWaalsContact O-CB 3.29Å; D40-A43 WeakPolarHBondContact O-CB 3.12Å; D40-A43 PolarHBondContact O-N 3.48Å
41	M	45.3	Very low	56	Low	125 Å²	125	99.4 Å²	99.4	62%	0.616	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-49.9	-19.7	173.1	-73.3	-166.8	173.1	0	0	113.3	D39 A43 W89	D39-M41 VanDerWaalsContact C-N 3.3Å; D39-M41 PolarHBondContact O-N 2.76Å; M41-A43 PolarHBondContact O-N 3.48Å; M41-W89 HydrophobicContact CB-CZ3 4.33Å
42	S	43.5	Very low	59	Low	12 Å²	12	97.4 Å²	97.4	8%	0.084	53%	0.528	C	S	.	.	G	3₁₀ helix	trans	-73.8	-7.6	177.4	90.2	0	0	0	0	114.6	D40 R70	D40-S42 PolarHBondContact O-N 3.38Å; D40-S42 WeakPolarHBondContact OD1-CB 3.24Å; D40-S42 PolarHBondContact OD1-N 3.2Å; D40-S42 PolarHBondContact OD1-OG 3.22Å; D40-S42 PolarHBondContact OD2-OG 3.45Å; S42-R70 PolarHBondContact O-NH2 2.85Å; S42-R70 PolarHBondContact OG-NE 3.44Å; S42-R70 PolarHBondContact OG-NH1 2.81Å; S42-R70 PolarHBondContact OG-NH2 3.09Å
43	A	57.3	Low	61.9	Low	66 Å²	66	93.1 Å²	93.1	55%	0.545	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-85.6	-15	176.3	0	0	0	0	0	114.5	D40 M41 F45	D40-A43 VanDerWaalsContact O-CB 3.29Å; D40-A43 WeakPolarHBondContact O-CB 3.12Å; D40-A43 PolarHBondContact O-N 3.48Å; M41-A43 PolarHBondContact O-N 3.48Å; A43-F45 PolarHBondContact O-N 3.18Å
44	R	71.8	Confident	64.7	Low	128 Å²	128	84.2 Å²	84.2	48%	0.483	46%	0.459	S	S	.	.	S	Bend	trans	-65	-20.1	-174.6	-167.7	171.6	-170.2	170.5	8.4	114.6
45	F	83.8	Confident	67.6	Low	8 Å²	8	85.2 Å²	85.2	4%	0.035	44%	0.444	C	S	.	.			trans	-128.3	144.3	-178.1	-53.8	-72.5	0	0	0	111.4	A43 I68 W89 I92 T94	A43-F45 PolarHBondContact O-N 3.18Å; F45-I68 HydrophobicContact CB-CD1 3.97Å; F45-I68 WeakPolarHBondContact O-CD1 3.35Å; F45-W89 AromaticContact CD2-CD1 3.7Å; F45-W89 HydrophobicContact CD2-CD2 4.27Å; F45-W89 HydrophobicContact CD2-CG 4.04Å; F45-W89 AromaticContact CD2-NE1 3.77Å; F45-W89 HydrophobicContact CE2-CB 3.75Å; F45-W89 AromaticContact CE2-CD1 3.49Å; F45-W89 VanDerWaalsContact CE2-CD1 3.49Å; F45-W89 HydrophobicContact CE2-CD2 4.03Å; F45-W89 AromaticContact CE2-CG 3.5Å; F45-W89 HydrophobicContact CE2-CG 3.5Å; F45-W89 VanDerWaalsContact CE2-CG 3.5Å; F45-W89 HydrophobicContact CZ-CB 4.31Å; F45-W89 HydrophobicContact CZ-CG 4.43Å; F45-I92 HydrophobicContact CD1-CG2 4.1Å; F45-I92 HydrophobicContact CE1-CB 3.83Å; F45-I92 HydrophobicContact CE1-CG2 3.46Å; F45-I92 VanDerWaalsContact CE1-CG2 3.46Å; F45-I92 HydrophobicContact CZ-CB 4.01Å; F45-I92 HydrophobicContact CZ-CG2 4.16Å; F45-T94 HydrophobicContact CD1-CG2 3.9Å; F45-T94 HydrophobicContact CE1-CG2 3.8Å
46	T	87.9	Confident	69.6	Low	82 Å²	82	79.4 Å²	79.4	50%	0.503	42%	0.42	S	S	.	.			trans	-127.6	151	175.5	58	0	0	0	0	112.5	G48 Q49 V65	T46-G48 PolarHBondContact O-N 3.23Å; T46-Q49 WeakPolarHBondContact O-CB 3.11Å; T46-Q49 PolarHBondContact O-N 3.28Å; T46-Q49 PolarHBondContact OG1-OE1 3.17Å; T46-V65 WeakPolarHBondContact O-CB 3.39Å; T46-V65 WeakPolarHBondContact O-CG1 3.43Å
47	E	90.3	Very high	71.6	Confident	134 Å²	134	71 Å²	71	63%	0.626	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	121.3	174.6	-69.5	-172.3	-178.9	0	0	110.1	K67	E47-K67 WeakPolarHBondContact OE1-CA 3.48Å
48	G	87.2	Confident	73.6	Confident	56 Å²	56	68.6 Å²	68.6	58%	0.577	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.8	-6.4	-172.7	0	0	0	0	0	114.8	T46 T64 V65	T46-G48 PolarHBondContact O-N 3.23Å; G48-T64 WeakPolarHBondContact O-CG2 3.39Å; G48-V65 PolarHBondContact N-O 3.16Å
49	Q	89.9	Confident	75.8	Confident	30 Å²	30	61.1 Å²	61.1	14%	0.14	33%	0.331	C	S	.	.			trans	-76.3	134.5	176.6	-167.8	174.3	9.7	0	0	111.5	T46 V51 T64 V65 D96	T46-Q49 WeakPolarHBondContact O-CB 3.11Å; T46-Q49 PolarHBondContact O-N 3.28Å; T46-Q49 PolarHBondContact OG1-OE1 3.17Å; Q49-V51 HydrophobicContact CG-CG1 4.22Å; Q49-T64 CarbonylContact O-C 3.49Å; Q49-T64 WeakPolarHBondContact O-CA 3.39Å; Q49-V65 PolarHBondContact O-N 2.72Å; Q49-D96 PolarHBondContact NE2-OD2 2.95Å
50	D	92.3	Very high	78	Confident	92 Å²	92	57.7 Å²	57.7	49%	0.492	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	134.9	171.6	-75.6	-34.4	0	0	0	110.4	L62 T64	D50-L62 HydrophobicContact CB-CD1 4.38Å; D50-T64 WeakPolarHBondContact OD1-CA 3.41Å; D50-T64 VanDerWaalsContact OD1-CB 3.25Å; D50-T64 WeakPolarHBondContact OD1-CB 3.37Å; D50-T64 WeakPolarHBondContact OD1-CG2 3.37Å; D50-T64 PolarHBondContact OD1-OG1 2.91Å
51	V	91.6	Very high	80.1	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.012	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	154.9	-172.1	-63.4	0	0	0	0	111.7	Q49 G63 V65 V77 I92 Q93 T94	Q49-V51 HydrophobicContact CG-CG1 4.22Å; V51-G63 VanDerWaalsContact CG2-O 3.3Å; V51-G63 WeakPolarHBondContact CG2-O 3.43Å; V51-G63 PolarHBondContact N-O 2.85Å; V51-G63 PolarHBondContact O-N 3.01Å; V51-V65 HydrophobicContact CG1-CG2 3.98Å; V51-V65 HydrophobicContact CG2-CG2 3.77Å; V51-V77 HydrophobicContact CG2-CG1 4.46Å; V51-V77 HydrophobicContact CG2-CG2 4.36Å; V51-I92 HydrophobicContact CB-CG2 3.51Å; V51-I92 HydrophobicContact CG1-CG2 3.81Å; V51-I92 HydrophobicContact CG2-CG2 3.59Å; V51-Q93 WeakPolarHBondContact CA-O 3.3Å; V51-Q93 WeakPolarHBondContact CB-O 3.48Å; V51-T94 HydrophobicContact CG1-CG2 4.1Å
52	L	90.7	Very high	82.3	Confident	77 Å²	77	55.2 Å²	55.2	40%	0.403	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	111.7	167.6	-67.4	177.4	0	0	0	108.9	F60 L62 Q93	L52-F60 HydrophobicContact CB-CB 4.41Å; L52-F60 HydrophobicContact CB-CD1 4.18Å; L52-L62 HydrophobicContact CD2-CB 4.2Å; L52-L62 HydrophobicContact CD2-CD1 4.25Å; L52-Q93 HydrophobicContact CB-CB 4.27Å; L52-Q93 PolarHBondContact N-O 3.04Å; L52-Q93 PolarHBondContact O-N 3.04Å
53	A	90.6	Very high	84.6	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	126.4	-178.5	0	0	0	0	0	111.1	Y61 V77 F79 V87 D91 I92	A53-Y61 PolarHBondContact N-O 2.98Å; A53-Y61 PolarHBondContact O-N 2.84Å; A53-V77 HydrophobicContact CB-CG1 4.31Å; A53-V77 HydrophobicContact CB-CG2 4.36Å; A53-F79 HydrophobicContact CB-CE1 3.89Å; A53-F79 HydrophobicContact CB-CZ 4.23Å; A53-V87 HydrophobicContact CB-CG1 4.12Å; A53-V87 HydrophobicContact CB-CG2 4.26Å; A53-D91 CarbonylContact C-O 3.51Å; A53-D91 WeakPolarHBondContact CA-O 3.42Å; A53-I92 HydrophobicContact CB-CG1 4.48Å
54	R	86.2	Confident	86.4	Confident	22 Å²	22	53.8 Å²	53.8	8%	0.083	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	134.7	177.1	-169.6	163.1	57.7	-177.1	2.8	110.8	L59 F60 S90 D91 C219 G221	R54-L59 CarbonylContact C-O 3.55Å; R54-L59 WeakPolarHBondContact CA-O 3.33Å; R54-F60 HydrophobicContact CB-CD1 3.89Å; R54-F60 HydrophobicContact CB-CE1 3.69Å; R54-F60 HydrophobicContact CB-CG 4.43Å; R54-F60 HydrophobicContact CB-CZ 4.07Å; R54-F60 HydrophobicContact CG-CE1 4.45Å; R54-F60 HydrophobicContact CG-CE2 4.49Å; R54-F60 HydrophobicContact CG-CZ 4.36Å; R54-S90 PolarHBondContact NH2-O 2.9Å; R54-D91 HydrophobicContact CB-CB 4.06Å; R54-D91 IonicContact CZ-OD1 3.56Å; R54-D91 PolarHBondContact N-O 3.25Å; R54-D91 IonicContact NE-OD1 3.96Å; R54-D91 PolarHBondContact NE-OD1 2.98Å; R54-D91 IonicContact NH2-OD1 2.58Å; R54-D91 PolarHBondContact NH2-OD1 3.3Å; R54-C219 PolarHBondContact NH1-O 2.85Å; R54-G221 VanDerWaalsContact CZ-CA 3.46Å
55	W	87.3	Confident	87.4	Confident	82 Å²	82	47.7 Å²	47.7	31%	0.311	25%	0.253	S	S	.	.			trans	-111.7	177	-173.9	-164.8	-114.5	0	0	0	112.8	D57 G58 L59 Y61 F79 S85	W55-D57 PolarHBondContact O-N 3.25Å; W55-G58 PolarHBondContact O-N 3.18Å; W55-L59 PolarHBondContact N-O 2.73Å; W55-Y61 HydrophobicContact CB-CD2 3.6Å; W55-Y61 HydrophobicContact CB-CE2 3.69Å; W55-Y61 HydrophobicContact CG-CD2 4.35Å; W55-Y61 HydrophobicContact CG-CE2 4.29Å; W55-F79 HydrophobicContact CE3-CE2 4.36Å; W55-F79 AromaticContact CE3-CZ 3.98Å; W55-F79 HydrophobicContact CE3-CZ 3.98Å; W55-F79 HydrophobicContact CZ3-CE2 4.12Å; W55-F79 HydrophobicContact CZ3-CZ 4.13Å; W55-S85 VanDerWaalsContact CZ3-CB 3.45Å
56	S	80.9	Confident	87.9	Confident	22 Å²	22	49.6 Å²	49.6	15%	0.154	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-2.2	-172.2	61	0	0	0	0	115.5	P222 H240	S56-P222 CarbonylContact C-O 3.54Å; S56-P222 WeakPolarHBondContact CA-O 3.48Å; S56-H240 PolarHBondContact O-CD2 3.06Å; S56-H240 VanDerWaalsContact O-CD2 3.29Å
57	D	75.4	Confident	88.1	Confident	42 Å²	42	51.3 Å²	51.3	23%	0.225	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-2.9	172.7	42.5	35.1	0	0	0	112.3	W55 L59 Y61 H240	W55-D57 PolarHBondContact O-N 3.25Å; D57-L59 VanDerWaalsContact C-N 3.35Å; D57-L59 PolarHBondContact OD1-N 2.8Å; D57-L59 VanDerWaalsContact OD1-N 3.1Å; D57-Y61 PolarHBondContact OD2-OH 3.34Å; D57-H240 WeakPolarHBondContact O-CB 3.45Å
58	G	73.7	Confident	88.2	Confident	10 Å²	10	46.9 Å²	46.9	10%	0.103	25%	0.247	C	C	.	.	S	Bend	trans	87.7	-3.4	-177.6	0	0	0	0	0	114.3	W55	W55-G58 PolarHBondContact O-N 3.18Å
59	L	80.4	Confident	88.3	Confident	50 Å²	50	45.5 Å²	45.5	26%	0.262	23%	0.226	S	C	.	.			trans	-91.6	153.2	-178.1	-57.7	178.3	0	0	0	112	R54 W55 D57 Y61 D242	R54-L59 CarbonylContact C-O 3.55Å; R54-L59 WeakPolarHBondContact CA-O 3.33Å; W55-L59 PolarHBondContact N-O 2.73Å; D57-L59 VanDerWaalsContact C-N 3.35Å; D57-L59 PolarHBondContact OD1-N 2.8Å; D57-L59 VanDerWaalsContact OD1-N 3.1Å; L59-Y61 HydrophobicContact CB-CE2 3.81Å; L59-D242 HydrophobicContact CD2-CB 4.14Å; L59-D242 HydrophobicContact CG-CB 4.43Å
60	F	85.9	Confident	88.1	Confident	71 Å²	71	50.4 Å²	50.4	31%	0.311	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	137.1	175.1	-73.2	-89.6	0	0	0	111.8	L52 R54 Q93	L52-F60 HydrophobicContact CB-CB 4.41Å; L52-F60 HydrophobicContact CB-CD1 4.18Å; R54-F60 HydrophobicContact CB-CD1 3.89Å; R54-F60 HydrophobicContact CB-CE1 3.69Å; R54-F60 HydrophobicContact CB-CG 4.43Å; R54-F60 HydrophobicContact CB-CZ 4.07Å; R54-F60 HydrophobicContact CG-CE1 4.45Å; R54-F60 HydrophobicContact CG-CE2 4.49Å; R54-F60 HydrophobicContact CG-CZ 4.36Å; F60-Q93 HydrophobicContact CE1-CG 3.83Å; F60-Q93 HydrophobicContact CZ-CG 4.33Å
61	Y	89.1	Confident	87.6	Confident	97 Å²	97	54 Å²	54	38%	0.38	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	136.9	180	-68.1	-91.3	0	0	0	111	A53 W55 D57 L59	A53-Y61 PolarHBondContact N-O 2.98Å; A53-Y61 PolarHBondContact O-N 2.84Å; W55-Y61 HydrophobicContact CB-CD2 3.6Å; W55-Y61 HydrophobicContact CB-CE2 3.69Å; W55-Y61 HydrophobicContact CG-CD2 4.35Å; W55-Y61 HydrophobicContact CG-CE2 4.29Å; D57-Y61 PolarHBondContact OD2-OH 3.34Å; L59-Y61 HydrophobicContact CB-CE2 3.81Å
62	L	92.1	Very high	87.2	Confident	77 Å²	77	58.8 Å²	58.8	40%	0.403	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	134.8	175.3	-175.4	65.2	0	0	0	111.2	D50 L52	D50-L62 HydrophobicContact CB-CD1 4.38Å; L52-L62 HydrophobicContact CD2-CB 4.2Å; L52-L62 HydrophobicContact CD2-CD1 4.25Å
63	G	92.3	Very high	87	Confident	3 Å²	3	59.3 Å²	59.3	3%	0.031	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167	161.9	170.7	0	0	0	0	0	113.2	V51 V78	V51-G63 VanDerWaalsContact CG2-O 3.3Å; V51-G63 WeakPolarHBondContact CG2-O 3.43Å; V51-G63 PolarHBondContact N-O 2.85Å; V51-G63 PolarHBondContact O-N 3.01Å; G63-V78 CarbonylContact C-O 3.56Å; G63-V78 WeakPolarHBondContact CA-O 3.35Å
64	T	94.1	Very high	87	Confident	44 Å²	44	62.6 Å²	62.6	27%	0.27	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	133.4	-177.9	-38.1	0	0	0	0	110.9	G48 Q49 D50 T66 V77 V78	G48-T64 WeakPolarHBondContact O-CG2 3.39Å; Q49-T64 CarbonylContact O-C 3.49Å; Q49-T64 WeakPolarHBondContact O-CA 3.39Å; D50-T64 WeakPolarHBondContact OD1-CA 3.41Å; D50-T64 VanDerWaalsContact OD1-CB 3.25Å; D50-T64 WeakPolarHBondContact OD1-CB 3.37Å; D50-T64 WeakPolarHBondContact OD1-CG2 3.37Å; D50-T64 PolarHBondContact OD1-OG1 2.91Å; T64-T66 PolarHBondContact O-N 2.85Å; T64-V77 WeakPolarHBondContact O-CA 3.46Å; T64-V78 PolarHBondContact N-O 2.89Å; T64-V78 PolarHBondContact O-N 2.83Å
65	V	94.6	Very high	87.4	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	127.4	170	174.6	0	0	0	0	109.4	T46 G48 Q49 V51 I68 C75	T46-V65 WeakPolarHBondContact O-CB 3.39Å; T46-V65 WeakPolarHBondContact O-CG1 3.43Å; G48-V65 PolarHBondContact N-O 3.16Å; Q49-V65 PolarHBondContact O-N 2.72Å; V51-V65 HydrophobicContact CG1-CG2 3.98Å; V51-V65 HydrophobicContact CG2-CG2 3.77Å; V65-I68 HydrophobicContact CG1-CD1 4.41Å; V65-I68 HydrophobicContact CG1-CG1 3.93Å; V65-C75 HydrophobicContact CG1-CB 4.04Å; V65-C75 HydrophobicContact CG2-CB 4.2Å
66	T	93	Very high	87.7	Confident	48 Å²	48	59.9 Å²	59.9	29%	0.294	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	-7.3	-178.6	62.1	0	0	0	0	115.4	T64 F76 V78	T64-T66 PolarHBondContact O-N 2.85Å; T66-F76 PolarHBondContact N-O 2.87Å; T66-F76 WeakPolarHBondContact OG1-CD1 3.37Å; T66-F76 PolarHBondContact OG1-O 2.96Å; T66-V78 HydrophobicContact CG2-CB 4.28Å; T66-V78 HydrophobicContact CG2-CG2 3.56Å; T66-V78 WeakPolarHBondContact OG1-CG2 3.33Å
67	K	92.3	Very high	88.3	Confident	118 Å²	118	58.8 Å²	58.8	51%	0.513	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	156.9	164.7	-57	-167.8	173.9	-157	0	110.1	E47 C75 F76 W86	E47-K67 WeakPolarHBondContact OE1-CA 3.48Å; K67-C75 CarbonylContact O-C 3.54Å; K67-C75 WeakPolarHBondContact O-CA 3.38Å; K67-F76 HydrophobicContact CB-CB 3.73Å; K67-F76 HydrophobicContact CG-CB 4.28Å; K67-F76 HydrophobicContact CG-CD1 4.38Å; K67-F76 PolarHBondContact O-N 3.48Å; K67-W86 HydrophobicContact CB-CH2 4.01Å; K67-W86 HydrophobicContact CB-CZ3 4.45Å
68	I	92.4	Very high	89.2	Confident	42 Å²	42	58 Å²	58	22%	0.215	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	128.4	174.5	-53.5	175.8	0	0	0	109.3	F45 V65 R70 W89	F45-I68 HydrophobicContact CB-CD1 3.97Å; F45-I68 WeakPolarHBondContact O-CD1 3.35Å; V65-I68 HydrophobicContact CG1-CD1 4.41Å; V65-I68 HydrophobicContact CG1-CG1 3.93Å; I68-R70 HydrophobicContact CG2-CG 4.02Å; I68-W89 HydrophobicContact CG2-CZ2 3.77Å
69	D	88.6	Confident	90.2	Very high	26 Å²	26	58.4 Å²	58.4	14%	0.139	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	92.3	178.6	176.6	-6.3	0	0	0	108.2	K72 Q73 R74 W86	D69-K72 CarbonylContact O-C 3.44Å; D69-K72 PolarHBondContact O-N 3.03Å; D69-K72 PolarHBondContact OD1-N 2.68Å; D69-Q73 PolarHBondContact O-N 2.79Å; D69-Q73 VanDerWaalsContact O-N 3.08Å; D69-R74 HydrophobicContact CB-CG 3.81Å; D69-R74 PolarHBondContact N-O 2.9Å; D69-R74 PolarHBondContact O-N 2.78Å; D69-R74 IonicContact OD2-CZ 3.53Å; D69-R74 IonicContact OD2-NE 2.7Å; D69-R74 PolarHBondContact OD2-NE 3.12Å; D69-R74 IonicContact OD2-NH2 3.12Å; D69-R74 PolarHBondContact OD2-NH2 2.82Å; D69-W86 HydrophobicContact CB-CE3 4.17Å; D69-W86 HydrophobicContact CB-CH2 3.7Å; D69-W86 HydrophobicContact CB-CZ3 3.41Å; D69-W86 VanDerWaalsContact CB-CZ3 3.41Å
70	R	85.5	Confident	90.7	Very high	134 Å²	134	63.7 Å²	63.7	51%	0.506	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-70.1	-33.4	-171.9	-63.8	176.6	170.1	-153.8	-15.7	112.4	S42 I68 K72 Q73 W89	S42-R70 PolarHBondContact O-NH2 2.85Å; S42-R70 PolarHBondContact OG-NE 3.44Å; S42-R70 PolarHBondContact OG-NH1 2.81Å; S42-R70 PolarHBondContact OG-NH2 3.09Å; I68-R70 HydrophobicContact CG2-CG 4.02Å; R70-K72 PolarHBondContact O-N 3.44Å; R70-Q73 PolarHBondContact O-N 2.76Å; R70-Q73 PolarHBondContact O-NE2 2.75Å; R70-W89 HydrophobicContact CB-CH2 4.35Å; R70-W89 HydrophobicContact CG-CH2 4.2Å; R70-W89 HydrophobicContact CG-CZ2 4.15Å
71	E	82.7	Confident	90.8	Very high	167 Å²	167	66 Å²	66	78%	0.78	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-60.7	-29.5	174.7	-64.6	-179.2	177.1	0	0	112.8
72	K	83.6	Confident	90.6	Very high	102 Å²	102	71.3 Å²	71.3	44%	0.443	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-121.2	19.4	-172.6	-62.8	172.5	-168.2	74.1	0	112.3	D69 R70 R74	D69-K72 CarbonylContact O-C 3.44Å; D69-K72 PolarHBondContact O-N 3.03Å; D69-K72 PolarHBondContact OD1-N 2.68Å; R70-K72 PolarHBondContact O-N 3.44Å; K72-R74 VanDerWaalsContact C-N 3.31Å; K72-R74 HydrophobicContact CB-CG 4.04Å; K72-R74 WeakPolarHBondContact O-CB 3.48Å; K72-R74 WeakPolarHBondContact O-CD 3.44Å; K72-R74 VanDerWaalsContact O-CG 3.29Å; K72-R74 WeakPolarHBondContact O-CG 3.5Å; K72-R74 PolarHBondContact O-N 3.03Å
73	Q	87	Confident	90.5	Very high	89 Å²	89	70 Å²	70	42%	0.416	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	47	50.3	170.4	-56.4	-73.1	-73.5	0	0	112.5	D69 R70 L88 W89	D69-Q73 PolarHBondContact O-N 2.79Å; D69-Q73 VanDerWaalsContact O-N 3.08Å; R70-Q73 PolarHBondContact O-N 2.76Å; R70-Q73 PolarHBondContact O-NE2 2.75Å; Q73-L88 CarbonylContact O-C 3.55Å; Q73-L88 WeakPolarHBondContact O-CA 3.33Å; Q73-W89 VanDerWaalsContact C-CG 3.45Å; Q73-W89 HydrophobicContact CB-CD2 4.18Å; Q73-W89 HydrophobicContact CB-CE3 4.06Å; Q73-W89 VanDerWaalsContact CD-CZ3 3.41Å; Q73-W89 HydrophobicContact CG-CE3 4.45Å; Q73-W89 PolarHBondContact O-N 3.03Å
74	R	90.7	Very high	90.5	Very high	68 Å²	68	75.7 Å²	75.7	26%	0.257	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	152.1	-170.1	64.4	-171.2	-170.8	151.8	6.8	114.1	D69 K72 W86 V87 L88	D69-R74 HydrophobicContact CB-CG 3.81Å; D69-R74 PolarHBondContact N-O 2.9Å; D69-R74 PolarHBondContact O-N 2.78Å; D69-R74 IonicContact OD2-CZ 3.53Å; D69-R74 IonicContact OD2-NE 2.7Å; D69-R74 PolarHBondContact OD2-NE 3.12Å; D69-R74 IonicContact OD2-NH2 3.12Å; D69-R74 PolarHBondContact OD2-NH2 2.82Å; K72-R74 VanDerWaalsContact C-N 3.31Å; K72-R74 HydrophobicContact CB-CG 4.04Å; K72-R74 WeakPolarHBondContact O-CB 3.48Å; K72-R74 WeakPolarHBondContact O-CD 3.44Å; K72-R74 VanDerWaalsContact O-CG 3.29Å; K72-R74 WeakPolarHBondContact O-CG 3.5Å; K72-R74 PolarHBondContact O-N 3.03Å; R74-W86 HydrophobicContact CB-CE3 4.44Å; R74-W86 HydrophobicContact CG-CD2 4.48Å; R74-W86 HydrophobicContact CG-CE3 3.76Å; R74-W86 HydrophobicContact CG-CZ3 4.29Å; R74-V87 CarbonylContact C-O 3.52Å; R74-V87 WeakPolarHBondContact CA-O 3Å; R74-V87 WeakPolarHBondContact CB-O 3.37Å; R74-L88 HydrophobicContact CB-CD2 4.37Å
75	C	93.1	Very high	90.4	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	151.1	176.9	-66	0	0	0	0	111.3	V65 K67 V77 W86 V87 W89 I92	V65-C75 HydrophobicContact CG1-CB 4.04Å; V65-C75 HydrophobicContact CG2-CB 4.2Å; K67-C75 CarbonylContact O-C 3.54Å; K67-C75 WeakPolarHBondContact O-CA 3.38Å; C75-V77 HydrophobicContact CB-CG2 4.4Å; C75-W86 VanDerWaalsContact C-CE3 3.49Å; C75-W86 CarbonylContact O-C 3.49Å; C75-W86 WeakPolarHBondContact O-CA 3.21Å; C75-V87 PolarHBondContact N-O 2.86Å; C75-V87 PolarHBondContact O-N 3.05Å; C75-W89 PolarHBondContact SG-NE1 2.71Å; C75-I92 HydrophobicContact CB-CD1 3.63Å
76	F	93.9	Very high	90.4	Very high	47 Å²	47	79.5 Å²	79.5	21%	0.206	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	94.5	174.3	-167.1	-117.8	0	0	0	109.5	T66 K67 K84 S85 W86	T66-F76 PolarHBondContact N-O 2.87Å; T66-F76 WeakPolarHBondContact OG1-CD1 3.37Å; T66-F76 PolarHBondContact OG1-O 2.96Å; K67-F76 HydrophobicContact CB-CB 3.73Å; K67-F76 HydrophobicContact CG-CB 4.28Å; K67-F76 HydrophobicContact CG-CD1 4.38Å; K67-F76 PolarHBondContact O-N 3.48Å; F76-K84 HydrophobicContact CE1-CB 4.04Å; F76-K84 HydrophobicContact CE1-CD 3.99Å; F76-K84 HydrophobicContact CE2-CB 4.16Å; F76-K84 HydrophobicContact CZ-CB 3.58Å; F76-K84 HydrophobicContact CZ-CD 4.21Å; F76-S85 CarbonylContact C-O 3.51Å; F76-S85 WeakPolarHBondContact CA-O 3.34Å; F76-S85 WeakPolarHBondContact CD2-O 3.45Å; F76-W86 HydrophobicContact CB-CD2 4.11Å; F76-W86 HydrophobicContact CB-CE3 3.82Å; F76-W86 HydrophobicContact CB-CH2 3.91Å; F76-W86 HydrophobicContact CB-CZ2 4.16Å; F76-W86 HydrophobicContact CB-CZ3 3.72Å; F76-W86 AromaticContact CD2-CD1 3.93Å; F76-W86 AromaticContact CD2-CD2 3.81Å; F76-W86 HydrophobicContact CD2-CD2 3.81Å; F76-W86 AromaticContact CD2-CE2 3.7Å; F76-W86 HydrophobicContact CD2-CE3 4.38Å; F76-W86 AromaticContact CD2-CG 3.99Å; F76-W86 HydrophobicContact CD2-CG 3.99Å; F76-W86 HydrophobicContact CD2-CZ2 4.22Å; F76-W86 AromaticContact CD2-NE1 3.75Å; F76-W86 HydrophobicContact CG-CD2 4.4Å; F76-W86 HydrophobicContact CG-CZ2 4.36Å
77	V	94.4	Very high	90.3	Very high	0 Å²	0	77.6 Å²	77.6	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	141.7	-174.6	-175.9	0	0	0	0	110.3	V51 A53 T64 C75 F79 K84 S85 V87 I92	V51-V77 HydrophobicContact CG2-CG1 4.46Å; V51-V77 HydrophobicContact CG2-CG2 4.36Å; A53-V77 HydrophobicContact CB-CG1 4.31Å; A53-V77 HydrophobicContact CB-CG2 4.36Å; T64-V77 WeakPolarHBondContact O-CA 3.46Å; C75-V77 HydrophobicContact CB-CG2 4.4Å; V77-F79 HydrophobicContact CB-CE2 4.44Å; V77-F79 HydrophobicContact CB-CZ 4.28Å; V77-F79 HydrophobicContact CG1-CD1 4.3Å; V77-F79 HydrophobicContact CG1-CE1 4.03Å; V77-F79 HydrophobicContact CG1-CE2 4.38Å; V77-F79 HydrophobicContact CG1-CZ 4.07Å; V77-K84 WeakPolarHBondContact O-CA 3.49Å; V77-S85 PolarHBondContact N-O 2.84Å; V77-S85 PolarHBondContact O-N 2.84Å; V77-S85 VanDerWaalsContact O-N 3.11Å; V77-V87 HydrophobicContact CB-CG2 4.25Å; V77-V87 HydrophobicContact CG2-CB 4.22Å; V77-V87 HydrophobicContact CG2-CG2 4Å; V77-I92 HydrophobicContact CG2-CD1 4.38Å
78	V	94.7	Very high	90.1	Very high	24 Å²	24	74.4 Å²	74.4	15%	0.145	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	113.4	171.8	-177.7	0	0	0	0	108.7	G63 T64 T66 S83 K84	G63-V78 CarbonylContact C-O 3.56Å; G63-V78 WeakPolarHBondContact CA-O 3.35Å; T64-V78 PolarHBondContact N-O 2.89Å; T64-V78 PolarHBondContact O-N 2.83Å; T66-V78 HydrophobicContact CG2-CB 4.28Å; T66-V78 HydrophobicContact CG2-CG2 3.56Å; T66-V78 WeakPolarHBondContact OG1-CG2 3.33Å; V78-S83 WeakPolarHBondContact CA-O 3.33Å; V78-K84 HydrophobicContact CB-CG 4.48Å; V78-K84 HydrophobicContact CG1-CD 4.49Å; V78-K84 HydrophobicContact CG1-CG 4.22Å; V78-K84 HydrophobicContact CG2-CD 3.77Å; V78-K84 HydrophobicContact CG2-CG 3.92Å
79	F	93.5	Very high	89.8	Confident	19 Å²	19	73.9 Å²	73.9	8%	0.083	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	166.6	-176.9	-57.6	-85.6	0	0	0	111.9	A53 W55 V77 D81 R82 S83 V87	A53-F79 HydrophobicContact CB-CE1 3.89Å; A53-F79 HydrophobicContact CB-CZ 4.23Å; W55-F79 HydrophobicContact CE3-CE2 4.36Å; W55-F79 AromaticContact CE3-CZ 3.98Å; W55-F79 HydrophobicContact CE3-CZ 3.98Å; W55-F79 HydrophobicContact CZ3-CE2 4.12Å; W55-F79 HydrophobicContact CZ3-CZ 4.13Å; V77-F79 HydrophobicContact CB-CE2 4.44Å; V77-F79 HydrophobicContact CB-CZ 4.28Å; V77-F79 HydrophobicContact CG1-CD1 4.3Å; V77-F79 HydrophobicContact CG1-CE1 4.03Å; V77-F79 HydrophobicContact CG1-CE2 4.38Å; V77-F79 HydrophobicContact CG1-CZ 4.07Å; F79-D81 PolarHBondContact O-N 2.8Å; F79-D81 VanDerWaalsContact O-N 3.17Å; F79-R82 WeakPolarHBondContact O-CA 3.39Å; F79-R82 PolarHBondContact O-N 2.89Å; F79-S83 WeakPolarHBondContact CD2-OG 3.49Å; F79-S83 PolarHBondContact N-O 3.23Å; F79-S83 VanDerWaalsContact N-O 3.07Å; F79-V87 HydrophobicContact CZ-CG2 4.22Å
80	E	90.6	Very high	89.5	Confident	162 Å²	162	76.9 Å²	76.9	76%	0.757	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-34.4	-179.2	-63.2	-166.9	114.7	0	0	114.1	R82	E80-R82 PolarHBondContact O-N 3.41Å
81	D	88.5	Confident	89.5	Confident	118 Å²	118	70.8 Å²	70.8	63%	0.631	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-3.3	176.8	85.9	-40	0	0	0	113.6	F79 S83	F79-D81 PolarHBondContact O-N 2.8Å; F79-D81 VanDerWaalsContact O-N 3.17Å; D81-S83 VanDerWaalsContact C-N 3.27Å; D81-S83 WeakPolarHBondContact OD1-CA 3.36Å; D81-S83 WeakPolarHBondContact OD1-CB 3.33Å; D81-S83 PolarHBondContact OD1-N 3.19Å; D81-S83 PolarHBondContact OD1-OG 3Å; D81-S83 WeakPolarHBondContact OD2-CB 3.35Å
82	R	85.4	Confident	89.7	Confident	209 Å²	209	63.3 Å²	63.3	79%	0.789	30%	0.301	S	S	*	.	S	Bend	trans	71.3	10.4	-174.5	-46.1	171.6	-176.5	178.6	-1	114.7	F79 E80	F79-R82 WeakPolarHBondContact O-CA 3.39Å; F79-R82 PolarHBondContact O-N 2.89Å; E80-R82 PolarHBondContact O-N 3.41Å
83	S	90.5	Very high	89.7	Confident	49 Å²	49	60.9 Å²	60.9	34%	0.343	29%	0.291	S	S	.	.			trans	-64.1	159	163.1	72.7	0	0	0	0	110.3	V78 F79 D81	V78-S83 WeakPolarHBondContact CA-O 3.33Å; F79-S83 WeakPolarHBondContact CD2-OG 3.49Å; F79-S83 PolarHBondContact N-O 3.23Å; F79-S83 VanDerWaalsContact N-O 3.07Å; D81-S83 VanDerWaalsContact C-N 3.27Å; D81-S83 WeakPolarHBondContact OD1-CA 3.36Å; D81-S83 WeakPolarHBondContact OD1-CB 3.33Å; D81-S83 PolarHBondContact OD1-N 3.19Å; D81-S83 PolarHBondContact OD1-OG 3Å; D81-S83 WeakPolarHBondContact OD2-CB 3.35Å
84	K	91.9	Very high	89.5	Confident	124 Å²	124	57.9 Å²	57.9	54%	0.539	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	134.1	-173.4	-48.8	-164	171.1	-144.7	0	110.3	F76 V77 V78	F76-K84 HydrophobicContact CE1-CB 4.04Å; F76-K84 HydrophobicContact CE1-CD 3.99Å; F76-K84 HydrophobicContact CE2-CB 4.16Å; F76-K84 HydrophobicContact CZ-CB 3.58Å; F76-K84 HydrophobicContact CZ-CD 4.21Å; V77-K84 WeakPolarHBondContact O-CA 3.49Å; V78-K84 HydrophobicContact CB-CG 4.48Å; V78-K84 HydrophobicContact CG1-CD 4.49Å; V78-K84 HydrophobicContact CG1-CG 4.22Å; V78-K84 HydrophobicContact CG2-CD 3.77Å; V78-K84 HydrophobicContact CG2-CG 3.92Å
85	S	92.6	Very high	88	Confident	32 Å²	32	57.7 Å²	57.7	22%	0.224	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	160.6	176.6	-164.5	0	0	0	0	112	W55 F76 V77	W55-S85 VanDerWaalsContact CZ3-CB 3.45Å; F76-S85 CarbonylContact C-O 3.51Å; F76-S85 WeakPolarHBondContact CA-O 3.34Å; F76-S85 WeakPolarHBondContact CD2-O 3.45Å; V77-S85 PolarHBondContact N-O 2.84Å; V77-S85 PolarHBondContact O-N 2.84Å; V77-S85 VanDerWaalsContact O-N 3.11Å
86	W	93.1	Very high	85.9	Confident	91 Å²	91	62.9 Å²	62.9	35%	0.345	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	139	156.1	-66.5	100.2	0	0	0	109	K67 D69 R74 C75 F76	K67-W86 HydrophobicContact CB-CH2 4.01Å; K67-W86 HydrophobicContact CB-CZ3 4.45Å; D69-W86 HydrophobicContact CB-CE3 4.17Å; D69-W86 HydrophobicContact CB-CH2 3.7Å; D69-W86 HydrophobicContact CB-CZ3 3.41Å; D69-W86 VanDerWaalsContact CB-CZ3 3.41Å; R74-W86 HydrophobicContact CB-CE3 4.44Å; R74-W86 HydrophobicContact CG-CD2 4.48Å; R74-W86 HydrophobicContact CG-CE3 3.76Å; R74-W86 HydrophobicContact CG-CZ3 4.29Å; C75-W86 VanDerWaalsContact C-CE3 3.49Å; C75-W86 CarbonylContact O-C 3.49Å; C75-W86 WeakPolarHBondContact O-CA 3.21Å; F76-W86 HydrophobicContact CB-CD2 4.11Å; F76-W86 HydrophobicContact CB-CE3 3.82Å; F76-W86 HydrophobicContact CB-CH2 3.91Å; F76-W86 HydrophobicContact CB-CZ2 4.16Å; F76-W86 HydrophobicContact CB-CZ3 3.72Å; F76-W86 AromaticContact CD2-CD1 3.93Å; F76-W86 AromaticContact CD2-CD2 3.81Å; F76-W86 HydrophobicContact CD2-CD2 3.81Å; F76-W86 AromaticContact CD2-CE2 3.7Å; F76-W86 HydrophobicContact CD2-CE3 4.38Å; F76-W86 AromaticContact CD2-CG 3.99Å; F76-W86 HydrophobicContact CD2-CG 3.99Å; F76-W86 HydrophobicContact CD2-CZ2 4.22Å; F76-W86 AromaticContact CD2-NE1 3.75Å; F76-W86 HydrophobicContact CG-CD2 4.4Å; F76-W86 HydrophobicContact CG-CZ2 4.36Å
87	V	90.8	Very high	84	Confident	9 Å²	9	67.1 Å²	67.1	6%	0.055	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	136	177.2	-175.3	0	0	0	0	107.4	A53 R74 C75 V77 F79 D91 I92	A53-V87 HydrophobicContact CB-CG1 4.12Å; A53-V87 HydrophobicContact CB-CG2 4.26Å; R74-V87 CarbonylContact C-O 3.52Å; R74-V87 WeakPolarHBondContact CA-O 3Å; R74-V87 WeakPolarHBondContact CB-O 3.37Å; C75-V87 PolarHBondContact N-O 2.86Å; C75-V87 PolarHBondContact O-N 3.05Å; V77-V87 HydrophobicContact CB-CG2 4.25Å; V77-V87 HydrophobicContact CG2-CB 4.22Å; V77-V87 HydrophobicContact CG2-CG2 4Å; F79-V87 HydrophobicContact CZ-CG2 4.22Å; V87-D91 HydrophobicContact CG1-CB 3.66Å; V87-I92 HydrophobicContact CB-CD1 4.13Å; V87-I92 HydrophobicContact CB-CG1 4.17Å; V87-I92 HydrophobicContact CG1-CD1 4.18Å; V87-I92 HydrophobicContact CG1-CG1 3.69Å
88	L	87.9	Confident	81.9	Confident	51 Å²	51	76 Å²	76	27%	0.267	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	152.2	-179.8	-66	168.4	0	0	0	110.8	Q73 R74 S90 D91 I92 Q214	Q73-L88 CarbonylContact O-C 3.55Å; Q73-L88 WeakPolarHBondContact O-CA 3.33Å; R74-L88 HydrophobicContact CB-CD2 4.37Å; L88-S90 WeakPolarHBondContact CB-OG 3.33Å; L88-S90 PolarHBondContact O-N 3.35Å; L88-D91 PolarHBondContact O-N 2.71Å; L88-I92 WeakPolarHBondContact O-CG1 3.35Å; L88-Q214 HydrophobicContact CD1-CB 4.23Å
89	W	87.1	Confident	79.5	Confident	30 Å²	30	82.8 Å²	82.8	11%	0.114	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-60.9	-29.1	177	-68.1	-11.2	0	0	0	113	M41 F45 I68 R70 Q73 C75 D91 I92	M41-W89 HydrophobicContact CB-CZ3 4.33Å; F45-W89 AromaticContact CD2-CD1 3.7Å; F45-W89 HydrophobicContact CD2-CD2 4.27Å; F45-W89 HydrophobicContact CD2-CG 4.04Å; F45-W89 AromaticContact CD2-NE1 3.77Å; F45-W89 HydrophobicContact CE2-CB 3.75Å; F45-W89 AromaticContact CE2-CD1 3.49Å; F45-W89 VanDerWaalsContact CE2-CD1 3.49Å; F45-W89 HydrophobicContact CE2-CD2 4.03Å; F45-W89 AromaticContact CE2-CG 3.5Å; F45-W89 HydrophobicContact CE2-CG 3.5Å; F45-W89 VanDerWaalsContact CE2-CG 3.5Å; F45-W89 HydrophobicContact CZ-CB 4.31Å; F45-W89 HydrophobicContact CZ-CG 4.43Å; I68-W89 HydrophobicContact CG2-CZ2 3.77Å; R70-W89 HydrophobicContact CB-CH2 4.35Å; R70-W89 HydrophobicContact CG-CH2 4.2Å; R70-W89 HydrophobicContact CG-CZ2 4.15Å; Q73-W89 VanDerWaalsContact C-CG 3.45Å; Q73-W89 HydrophobicContact CB-CD2 4.18Å; Q73-W89 HydrophobicContact CB-CE3 4.06Å; Q73-W89 VanDerWaalsContact CD-CZ3 3.41Å; Q73-W89 HydrophobicContact CG-CE3 4.45Å; Q73-W89 PolarHBondContact O-N 3.03Å; C75-W89 PolarHBondContact SG-NE1 2.71Å; W89-D91 PolarHBondContact O-N 2.81Å; W89-I92 PolarHBondContact O-N 3.05Å
90	S	82.3	Confident	77	Confident	89 Å²	89	90 Å²	90	62%	0.622	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-67.6	-9.2	171.6	52.1	0	0	0	0	114.9	R54 L88	R54-S90 PolarHBondContact NH2-O 2.9Å; L88-S90 WeakPolarHBondContact CB-OG 3.33Å; L88-S90 PolarHBondContact O-N 3.35Å
91	D	85.4	Confident	74.9	Confident	6 Å²	6	86.9 Å²	86.9	3%	0.032	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-117.7	17.1	-177.3	-70.6	-54.7	0	0	0	112.1	A53 R54 V87 L88 W89 P222	A53-D91 CarbonylContact C-O 3.51Å; A53-D91 WeakPolarHBondContact CA-O 3.42Å; R54-D91 HydrophobicContact CB-CB 4.06Å; R54-D91 IonicContact CZ-OD1 3.56Å; R54-D91 PolarHBondContact N-O 3.25Å; R54-D91 IonicContact NE-OD1 3.96Å; R54-D91 PolarHBondContact NE-OD1 2.98Å; R54-D91 IonicContact NH2-OD1 2.58Å; R54-D91 PolarHBondContact NH2-OD1 3.3Å; V87-D91 HydrophobicContact CG1-CB 3.66Å; L88-D91 PolarHBondContact O-N 2.71Å; W89-D91 PolarHBondContact O-N 2.81Å; D91-P222 VanDerWaalsContact CG-CD 3.48Å; D91-P222 WeakPolarHBondContact OD1-CD 3.3Å
92	I	86.1	Confident	72.9	Confident	10 Å²	10	88.5 Å²	88.5	5%	0.051	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	124.1	-177.2	-57.6	168.8	0	0	0	110.3	F45 V51 A53 C75 V77 V87 L88 W89	F45-I92 HydrophobicContact CD1-CG2 4.1Å; F45-I92 HydrophobicContact CE1-CB 3.83Å; F45-I92 HydrophobicContact CE1-CG2 3.46Å; F45-I92 VanDerWaalsContact CE1-CG2 3.46Å; F45-I92 HydrophobicContact CZ-CB 4.01Å; F45-I92 HydrophobicContact CZ-CG2 4.16Å; V51-I92 HydrophobicContact CB-CG2 3.51Å; V51-I92 HydrophobicContact CG1-CG2 3.81Å; V51-I92 HydrophobicContact CG2-CG2 3.59Å; A53-I92 HydrophobicContact CB-CG1 4.48Å; C75-I92 HydrophobicContact CB-CD1 3.63Å; V77-I92 HydrophobicContact CG2-CD1 4.38Å; V87-I92 HydrophobicContact CB-CD1 4.13Å; V87-I92 HydrophobicContact CB-CG1 4.17Å; V87-I92 HydrophobicContact CG1-CD1 4.18Å; V87-I92 HydrophobicContact CG1-CG1 3.69Å; L88-I92 WeakPolarHBondContact O-CG1 3.35Å; W89-I92 PolarHBondContact O-N 3.05Å
93	Q	84.9	Confident	71	Confident	51 Å²	51	86 Å²	86	24%	0.238	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132	173.3	-63.7	178.7	-16.5	0	0	110.1	V51 L52 F60 E157	V51-Q93 WeakPolarHBondContact CA-O 3.3Å; V51-Q93 WeakPolarHBondContact CB-O 3.48Å; L52-Q93 HydrophobicContact CB-CB 4.27Å; L52-Q93 PolarHBondContact N-O 3.04Å; L52-Q93 PolarHBondContact O-N 3.04Å; F60-Q93 HydrophobicContact CE1-CG 3.83Å; F60-Q93 HydrophobicContact CZ-CG 4.33Å; Q93-E157 PolarHBondContact NE2-OE1 2.67Å; Q93-E157 PolarHBondContact NE2-OE2 3.12Å
94	T	82.4	Confident	69	Low	27 Å²	27	91 Å²	91	17%	0.166	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	138.8	176.9	44.1	0	0	0	0	110.3	F45 V51	F45-T94 HydrophobicContact CD1-CG2 3.9Å; F45-T94 HydrophobicContact CE1-CG2 3.8Å; V51-T94 HydrophobicContact CG1-CG2 4.1Å
95	G	58.5	Low	67	Low	64 Å²	64	90.9 Å²	90.9	66%	0.66	50%	0.496	S	S	*	.			trans	-88.2	3.6	-176.2	0	0	0	0	0	115.6	E97	G95-E97 PolarHBondContact O-N 3.33Å
96	D	50.3	Low	65.7	Low	108 Å²	108	94.6 Å²	94.6	58%	0.578	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	28.5	-157.7	-52.8	-65.7	0	0	0	114.9	Q49	Q49-D96 PolarHBondContact NE2-OD2 2.95Å
97	E	53.7	Low	64.9	Low	136 Å²	136	95.1 Å²	95.1	64%	0.636	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-0.2	-179	-72.6	178.4	-161.4	0	0	114.3	G95	G95-E97 PolarHBondContact O-N 3.33Å
98	E	48.7	Very low	64.6	Low	188 Å²	188	97.6 Å²	97.6	88%	0.879	54%	0.537	S	S	*	.	S	Bend	trans	-92.5	-10.8	-178.4	-67.8	-160	143.2	0	0	115.9
99	D	45	Very low	64.4	Low	165 Å²	165	95.2 Å²	95.2	88%	0.882	52%	0.524	S	S	*	.	S	Bend	trans	-119.6	27.5	-167	-107	-26.8	0	0	0	115.3
100	K	41.5	Very low	64.2	Low	171 Å²	171	95.7 Å²	95.7	74%	0.743	53%	0.532	S	S	*	.			trans	-118.6	84.2	167.1	-78.9	-169.5	179.6	178.4	0	112
101	A	47	Very low	64	Low	97 Å²	97	95.7 Å²	95.7	80%	0.802	52%	0.524	S	S	*	.			trans	-104.8	72	174.3	0	0	0	0	0	111.5
102	D	45.2	Very low	63.7	Low	151 Å²	151	98.3 Å²	98.3	81%	0.807	54%	0.543	S	S	*	.	S	Bend	trans	-145.6	93.7	168.8	-92.6	-38.2	0	0	0	110.1
103	D	46.8	Very low	63.2	Low	156 Å²	156	103.4 Å²	103.4	83%	0.834	57%	0.566	S	S	*	*	S	Bend	trans	39.8	122.4	165.8	-63.7	-16.2	0	0	0	121.4
104	D	47.4	Very low	62.9	Low	155 Å²	155	104.5 Å²	104.5	83%	0.829	57%	0.573	S	S	*	*			trans	59.9	49.1	167	-62.4	-16.2	0	0	0	117.3	D106	D104-D106 PolarHBondContact O-N 3.27Å
105	D	49.3	Very low	62.8	Low	122 Å²	122	108.9 Å²	108.9	65%	0.652	59%	0.592	S	S	*	*			trans	-73.6	108.5	149.9	-80.1	-44.2	0	0	0	108.7
106	D	66.4	Low	63.9	Low	110 Å²	110	110.1 Å²	110.1	59%	0.588	59%	0.587	S	S	*	*			trans	-65.7	141.1	177.6	-85.9	-63.4	0	0	0	112	D104 V108 E115	D104-D106 PolarHBondContact O-N 3.27Å; D106-V108 PolarHBondContact O-N 3.06Å; D106-E115 HydrophobicContact CB-CB 4.43Å; D106-E115 HydrophobicContact CB-CG 3.99Å
107	I	75.3	Confident	65.4	Low	101 Å²	101	107.6 Å²	107.6	52%	0.518	58%	0.578	S	S	.	*			trans	-77.8	86.7	-170.5	-54.1	171.5	0	0	0	109.8	I123 I125	I107-I123 HydrophobicContact CG2-CG2 4.02Å; I107-I123 WeakPolarHBondContact O-CD1 3.48Å; I107-I125 HydrophobicContact CD1-CD1 4.38Å; I107-I125 HydrophobicContact CG2-CD1 4.08Å; I107-I125 HydrophobicContact CG2-CG1 4.29Å
108	V	85.5	Confident	66.7	Low	62 Å²	62	108.6 Å²	108.6	38%	0.376	58%	0.582	S	S	.	*			trans	-72.8	151.8	178.5	-70	0	0	0	0	113.9	D106 E115	D106-V108 PolarHBondContact O-N 3.06Å; V108-E115 HydrophobicContact CG1-CG 3.66Å
109	C	84	Confident	67.9	Low	0 Å²	0	107.7 Å²	107.7	0%	0	58%	0.578	C	S	.	*	B	Isolated β-bridge	trans	-79.3	125.7	164.3	171.4	0	0	0	0	111.6	I111 C112 Q113 D114 I123 G132 H134	C109-I111 PolarHBondContact O-N 3.25Å; C109-I111 PolarHBondContact SG-N 2.87Å; C109-C112 VanDerWaalsContact CB-SG 3.57Å; C109-Q113 WeakPolarHBondContact O-CA 3.33Å; C109-Q113 PolarHBondContact O-N 3.17Å; C109-D114 PolarHBondContact N-O 3.05Å; C109-I123 HydrophobicContact CB-CD1 4.42Å; C109-G132 CarbonylContact C-O 3.55Å; C109-G132 WeakPolarHBondContact CA-O 3.47Å; C109-H134 HydrophobicContact CB-CB 4.33Å; C109-H134 WeakPolarHBondContact CB-ND1 3.16Å; C109-H134 PolarHBondContact SG-N 3.01Å
110	S	81.6	Confident	69.3	Low	41 Å²	41	105.2 Å²	105.2	29%	0.287	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.7	-5.7	-178.5	-50.9	0	0	0	0	115.7	Q131 G132	S110-Q131 WeakPolarHBondContact OG-CB 3.49Å; S110-G132 PolarHBondContact N-O 2.6Å; S110-G132 PolarHBondContact OG-O 2.87Å
111	I	78.9	Confident	71.4	Confident	89 Å²	89	99 Å²	99	46%	0.456	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-51.6	-177.7	-64.1	175.1	0	0	0	111.7	C109 Y133 C137	C109-I111 PolarHBondContact O-N 3.25Å; C109-I111 PolarHBondContact SG-N 2.87Å; I111-Y133 HydrophobicContact CD1-CD1 3.75Å; I111-Y133 HydrophobicContact CD1-CE1 4.26Å; I111-Y133 HydrophobicContact CG1-CD1 4.01Å; I111-Y133 HydrophobicContact CG1-CE1 4.31Å; I111-C137 HydrophobicContact CB-CB 4.1Å; I111-C137 HydrophobicContact CD1-CB 4.28Å; I111-C137 WeakPolarHBondContact CD1-O 3.42Å; I111-C137 HydrophobicContact CG2-CB 4.1Å
112	C	78.4	Confident	73.3	Confident	61 Å²	61	97.1 Å²	97.1	41%	0.412	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-13.6	179.8	61.9	0	0	0	0	114.1	C109 D114 H134	C109-C112 VanDerWaalsContact CB-SG 3.57Å; C112-D114 PolarHBondContact O-N 2.95Å; C112-H134 PolarHBondContact SG-ND1 3.3Å
113	Q	75.6	Confident	75.4	Confident	117 Å²	117	91 Å²	91	55%	0.547	49%	0.488	S	S	.	.			trans	61.2	27.5	-177.4	-63.2	161.7	43.7	0	0	113.9	C109	C109-Q113 WeakPolarHBondContact O-CA 3.33Å; C109-Q113 PolarHBondContact O-N 3.17Å
114	D	79.2	Confident	77.4	Confident	73 Å²	73	84.4 Å²	84.4	39%	0.39	45%	0.453	S	S	.	.			trans	-101.3	143.4	176.5	-167.1	-38.5	0	0	0	110.3	C109 C112 T116	C109-D114 PolarHBondContact N-O 3.05Å; C112-D114 PolarHBondContact O-N 2.95Å; D114-T116 VanDerWaalsContact CG-OG1 3.28Å; D114-T116 WeakPolarHBondContact OD1-CB 3.21Å; D114-T116 WeakPolarHBondContact OD1-CG2 3.15Å; D114-T116 PolarHBondContact OD1-N 3.48Å; D114-T116 PolarHBondContact OD1-OG1 3.19Å
115	E	80.8	Confident	79.4	Confident	120 Å²	120	80.9 Å²	80.9	56%	0.561	43%	0.433	S	S	*	.			trans	-88.9	-15.2	-176.5	-60.9	159.9	-177.1	0	0	112.5	D106 V108 S117	D106-E115 HydrophobicContact CB-CB 4.43Å; D106-E115 HydrophobicContact CB-CG 3.99Å; V108-E115 HydrophobicContact CG1-CG 3.66Å; E115-S117 PolarHBondContact O-N 3.19Å
116	T	80.6	Confident	81.2	Confident	90 Å²	90	75.2 Å²	75.2	55%	0.552	40%	0.403	S	S	*	.			trans	-72.2	95.7	-168.7	51.8	0	0	0	0	113.4	D114 H134	D114-T116 VanDerWaalsContact CG-OG1 3.28Å; D114-T116 WeakPolarHBondContact OD1-CB 3.21Å; D114-T116 WeakPolarHBondContact OD1-CG2 3.15Å; D114-T116 PolarHBondContact OD1-N 3.48Å; D114-T116 PolarHBondContact OD1-OG1 3.19Å; T116-H134 PolarHBondContact O-NE2 3.01Å
117	S	83.3	Confident	82	Confident	55 Å²	55	73.2 Å²	73.2	39%	0.385	39%	0.392	S	S	.	.			trans	-100.6	92.6	174.8	-177.6	0	0	0	0	112	E115 E122 I123	E115-S117 PolarHBondContact O-N 3.19Å; S117-E122 WeakPolarHBondContact OG-CA 3.33Å; S117-E122 WeakPolarHBondContact OG-CB 3.31Å; S117-I123 PolarHBondContact OG-N 3.27Å
118	E	80.3	Confident	82.2	Confident	156 Å²	156	73.2 Å²	73.2	73%	0.729	39%	0.389	S	S	*	.	B	Isolated β-bridge	trans	-130.7	146.8	174.2	-62.9	-164.8	157.1	0	0	112.1	N121	E118-N121 CarbonylContact O-C 3.6Å; E118-N121 PolarHBondContact O-N 2.73Å
119	E	72.9	Confident	81.9	Confident	170 Å²	170	72.5 Å²	72.5	79%	0.794	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	131.4	171.4	-65	175.6	-155.8	0	0	110.9
120	P	75.4	Confident	81.7	Confident	113 Å²	113	75 Å²	75	73%	0.734	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	cis	-105.4	31.2	10	42.6	-36.1	0	0	0	113.4	Q135	P120-Q135 PolarHBondContact O-OE1 2.99Å
121	N	85.4	Confident	81.8	Confident	39 Å²	39	75 Å²	75	21%	0.209	41%	0.407	C	S	.	.	B	Isolated β-bridge	trans	-137.5	64.9	-179.8	-176.7	59.2	0	0	0	109.4	E118 H134 Q135 M136	E118-N121 CarbonylContact O-C 3.6Å; E118-N121 PolarHBondContact O-N 2.73Å; N121-H134 PolarHBondContact ND2-CD2 3.21Å; N121-H134 PolarHBondContact O-CD2 3.17Å; N121-H134 VanDerWaalsContact O-CD2 3.25Å; N121-Q135 PolarHBondContact OD1-N 2.92Å; N121-M136 HydrophobicContact CB-CG 4.42Å; N121-M136 HydrophobicContact CB-SD 4.42Å; N121-M136 VanDerWaalsContact OD1-CB 3.28Å; N121-M136 WeakPolarHBondContact OD1-CB 3.37Å; N121-M136 WeakPolarHBondContact OD1-CG 3.23Å; N121-M136 PolarHBondContact OD1-N 2.85Å
122	E	87.4	Confident	82.3	Confident	59 Å²	59	71 Å²	71	28%	0.276	39%	0.388	S	S	.	.			trans	-79.3	164.8	178.2	-62.4	-167.9	127.8	0	0	111.8	S117 H134 Q135 I147	S117-E122 WeakPolarHBondContact OG-CA 3.33Å; S117-E122 WeakPolarHBondContact OG-CB 3.31Å; E122-H134 WeakPolarHBondContact O-CA 3.25Å; E122-Q135 PolarHBondContact O-N 2.97Å; E122-Q135 VanDerWaalsContact O-N 3.1Å; E122-I147 HydrophobicContact CB-CD1 4.04Å
123	I	89	Confident	82.8	Confident	22 Å²	22	68.6 Å²	68.6	11%	0.113	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	118.2	179.4	-60.5	173.6	0	0	0	109.9	I107 C109 S117 H134	I107-I123 HydrophobicContact CG2-CG2 4.02Å; I107-I123 WeakPolarHBondContact O-CD1 3.48Å; C109-I123 HydrophobicContact CB-CD1 4.42Å; S117-I123 PolarHBondContact OG-N 3.27Å; I123-H134 WeakPolarHBondContact CG1-CD2 3.35Å; I123-H134 VanDerWaalsContact CG1-NE2 3.34Å; I123-H134 WeakPolarHBondContact CG1-NE2 3.43Å
124	V	88.6	Confident	83.5	Confident	17 Å²	17	63.2 Å²	63.2	10%	0.103	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	132	-177.7	-171.6	0	0	0	0	110.2	G132 Y133 Q135 I142 V146 I147 W153	V124-G132 CarbonylContact O-C 3.57Å; V124-G132 WeakPolarHBondContact O-CA 3.47Å; V124-Y133 PolarHBondContact N-O 2.85Å; V124-Y133 PolarHBondContact O-N 3.28Å; V124-Q135 HydrophobicContact CG2-CG 4.23Å; V124-I142 HydrophobicContact CB-CD1 3.74Å; V124-I142 HydrophobicContact CG1-CD1 4.38Å; V124-I142 HydrophobicContact CG1-CG2 4.5Å; V124-I142 HydrophobicContact CG2-CD1 3.99Å; V124-I142 HydrophobicContact CG2-CG2 4.22Å; V124-V146 HydrophobicContact CG1-CG1 4.39Å; V124-I147 HydrophobicContact CG2-CD1 3.91Å; V124-I147 HydrophobicContact CG2-CG1 3.76Å; V124-W153 HydrophobicContact CG1-CD2 4.11Å; V124-W153 HydrophobicContact CG1-CE3 3.76Å; V124-W153 HydrophobicContact CG1-CZ3 4.22Å
125	I	88.5	Confident	83.8	Confident	81 Å²	81	60.4 Å²	60.4	42%	0.415	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	132.7	-173.9	-61.3	173.9	0	0	0	110.9	I107 G130 Q131	I107-I125 HydrophobicContact CD1-CD1 4.38Å; I107-I125 HydrophobicContact CG2-CD1 4.08Å; I107-I125 HydrophobicContact CG2-CG1 4.29Å; I125-G130 WeakPolarHBondContact CG2-O 3.33Å; I125-Q131 WeakPolarHBondContact CA-O 3.38Å
126	C	87.6	Confident	83.9	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.02	33%	0.333	C	S	.	.			trans	-75.3	122.8	177.5	175.6	0	0	0	0	112.8	K128 C129 G130 Q131 Y133 W153 C155 C158	C126-K128 PolarHBondContact O-N 3.28Å; C126-C129 PolarHBondContact SG-SG 3.23Å; C126-G130 PolarHBondContact O-N 3.38Å; C126-Q131 PolarHBondContact N-O 2.83Å; C126-Y133 HydrophobicContact CB-CE2 4.17Å; C126-W153 HydrophobicContact CB-CE3 4.3Å; C126-W153 HydrophobicContact CB-CZ3 3.95Å; C126-C155 HydrophobicContact CB-CB 4.15Å; C126-C155 PolarHBondContact SG-N 2.76Å; C126-C155 VanDerWaalsContact SG-SG 3.69Å; C126-C158 VanDerWaalsContact SG-SG 3.68Å
127	D	83.1	Confident	83.9	Confident	68 Å²	68	58.7 Å²	58.7	36%	0.364	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	5.9	178.8	-84.2	-75.6	0	0	0	115.1	K152 W153 L154 R520	D127-K152 HydrophobicContact CB-CB 4.46Å; D127-K152 HydrophobicContact CB-CG 4.43Å; D127-K152 IonicContact OD1-NZ 3.19Å; D127-K152 WeakPolarHBondContact OD2-CA 3.28Å; D127-W153 WeakPolarHBondContact CB-O 3.47Å; D127-W153 PolarHBondContact N-O 2.7Å; D127-W153 PolarHBondContact OD2-N 3.18Å; D127-L154 HydrophobicContact CB-CD2 4.48Å; D127-R520 IonicContact OD2-NH2 2.93Å; D127-R520 PolarHBondContact OD2-NH2 2.9Å
128	K	79	Confident	84	Confident	102 Å²	102	56.6 Å²	56.6	44%	0.443	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.2	-32.2	179.3	177.2	178.4	164.8	-169.5	0	115.2	C126 L154 C158 S162	C126-K128 PolarHBondContact O-N 3.28Å; K128-L154 HydrophobicContact CB-CD2 3.48Å; K128-L154 VanDerWaalsContact CB-CD2 3.48Å; K128-L154 HydrophobicContact CD-CD2 4.49Å; K128-C158 HydrophobicContact CB-CB 4.2Å; K128-C158 HydrophobicContact CD-CB 3.87Å; K128-C158 HydrophobicContact CG-CB 4.3Å; K128-C158 PolarHBondContact NZ-O 2.92Å; K128-S162 PolarHBondContact NZ-OG 3.09Å
129	C	79.9	Confident	83.5	Confident	47 Å²	47	50 Å²	50	32%	0.318	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.8	0.8	178.7	64.9	0	0	0	0	114.9	C126 Q131 C158	C126-C129 PolarHBondContact SG-SG 3.23Å; C129-Q131 PolarHBondContact O-N 3.25Å; C129-C158 VanDerWaalsContact CB-SG 3.53Å
130	G	80.3	Confident	83.8	Confident	52 Å²	52	43.3 Å²	43.3	54%	0.536	25%	0.248	S	C	.	.			trans	72.3	-15.1	177.1	0	0	0	0	0	115.9	I125 C126	I125-G130 WeakPolarHBondContact CG2-O 3.33Å; C126-G130 PolarHBondContact O-N 3.38Å
131	Q	84.4	Confident	84.2	Confident	41 Å²	41	43.4 Å²	43.4	19%	0.192	24%	0.241	C	C	.	.			trans	-60.5	137.7	177.9	-75.7	175	57.8	0	0	112.5	S110 I125 C126 C129 Y133	S110-Q131 WeakPolarHBondContact OG-CB 3.49Å; I125-Q131 WeakPolarHBondContact CA-O 3.38Å; C126-Q131 PolarHBondContact N-O 2.83Å; C129-Q131 PolarHBondContact O-N 3.25Å; Q131-Y133 HydrophobicContact CB-CD2 4.49Å; Q131-Y133 HydrophobicContact CB-CE2 3.57Å; Q131-Y133 WeakPolarHBondContact CB-OH 3.4Å; Q131-Y133 VanDerWaalsContact CD-OH 3.23Å; Q131-Y133 WeakPolarHBondContact O-CE2 3.41Å; Q131-Y133 PolarHBondContact OE1-OH 3.35Å
132	G	87.6	Confident	84.2	Confident	6 Å²	6	41.8 Å²	41.8	6%	0.062	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	142.1	172	0	0	0	0	0	112.2	C109 S110 V124	C109-G132 CarbonylContact C-O 3.55Å; C109-G132 WeakPolarHBondContact CA-O 3.47Å; S110-G132 PolarHBondContact N-O 2.6Å; S110-G132 PolarHBondContact OG-O 2.87Å; V124-G132 CarbonylContact O-C 3.57Å; V124-G132 WeakPolarHBondContact O-CA 3.47Å
133	Y	89.9	Confident	84	Confident	9 Å²	9	44 Å²	44	4%	0.035	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	127.8	176.9	-53.6	-91.4	0	0	0	111.1	I111 V124 C126 Q131 W153 C155	I111-Y133 HydrophobicContact CD1-CD1 3.75Å; I111-Y133 HydrophobicContact CD1-CE1 4.26Å; I111-Y133 HydrophobicContact CG1-CD1 4.01Å; I111-Y133 HydrophobicContact CG1-CE1 4.31Å; V124-Y133 PolarHBondContact N-O 2.85Å; V124-Y133 PolarHBondContact O-N 3.28Å; C126-Y133 HydrophobicContact CB-CE2 4.17Å; Q131-Y133 HydrophobicContact CB-CD2 4.49Å; Q131-Y133 HydrophobicContact CB-CE2 3.57Å; Q131-Y133 WeakPolarHBondContact CB-OH 3.4Å; Q131-Y133 VanDerWaalsContact CD-OH 3.23Å; Q131-Y133 WeakPolarHBondContact O-CE2 3.41Å; Q131-Y133 PolarHBondContact OE1-OH 3.35Å; Y133-W153 AromaticContact CD2-CH2 3.63Å; Y133-W153 HydrophobicContact CD2-CH2 3.63Å; Y133-W153 AromaticContact CD2-CZ3 3.78Å; Y133-W153 HydrophobicContact CD2-CZ3 3.78Å; Y133-W153 HydrophobicContact CE2-CH2 4.25Å; Y133-W153 HydrophobicContact CE2-CZ3 4.32Å; Y133-W153 HydrophobicContact CG-CH2 4.25Å; Y133-C155 HydrophobicContact CD2-CB 4.03Å; Y133-C155 HydrophobicContact CE2-CB 3.35Å; Y133-C155 PolarHBondContact OH-SG 3.21Å
134	H	90.4	Very high	83.7	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.019	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	138.9	164.3	-78.6	122.8	0	0	0	110.7	C109 C112 T116 N121 E122 I123 M136 C137 H138	C109-H134 HydrophobicContact CB-CB 4.33Å; C109-H134 WeakPolarHBondContact CB-ND1 3.16Å; C109-H134 PolarHBondContact SG-N 3.01Å; C112-H134 PolarHBondContact SG-ND1 3.3Å; T116-H134 PolarHBondContact O-NE2 3.01Å; N121-H134 PolarHBondContact ND2-CD2 3.21Å; N121-H134 PolarHBondContact O-CD2 3.17Å; N121-H134 VanDerWaalsContact O-CD2 3.25Å; E122-H134 WeakPolarHBondContact O-CA 3.25Å; I123-H134 WeakPolarHBondContact CG1-CD2 3.35Å; I123-H134 VanDerWaalsContact CG1-NE2 3.34Å; I123-H134 WeakPolarHBondContact CG1-NE2 3.43Å; H134-M136 PolarHBondContact O-N 3.49Å; H134-M136 VanDerWaalsContact O-N 3.15Å; H134-C137 HydrophobicContact CB-CB 3.88Å; H134-C137 PolarHBondContact O-N 2.87Å; H134-H138 PolarHBondContact O-N 3.07Å; H134-H138 VanDerWaalsContact O-N 3.08Å
135	Q	85.7	Confident	83.3	Confident	15 Å²	15	47.5 Å²	47.5	7%	0.07	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-45.1	178.2	-65.9	179.8	-101.7	0	0	113.3	P120 N121 E122 V124 I141 I142 I147	P120-Q135 PolarHBondContact O-OE1 2.99Å; N121-Q135 PolarHBondContact OD1-N 2.92Å; E122-Q135 PolarHBondContact O-N 2.97Å; E122-Q135 VanDerWaalsContact O-N 3.1Å; V124-Q135 HydrophobicContact CG2-CG 4.23Å; Q135-I141 WeakPolarHBondContact O-CA 3.43Å; Q135-I141 WeakPolarHBondContact O-CG2 3.39Å; Q135-I142 HydrophobicContact CB-CB 4.28Å; Q135-I142 HydrophobicContact CG-CB 4.22Å; Q135-I142 PolarHBondContact NE2-O 3.18Å; Q135-I142 PolarHBondContact O-N 2.89Å; Q135-I147 VanDerWaalsContact CD-CD1 3.42Å; Q135-I147 HydrophobicContact CG-CD1 3.93Å
136	M	81.8	Confident	83	Confident	128 Å²	128	45.3 Å²	45.3	63%	0.631	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-14.5	-178.3	-62.8	-175.6	64.3	0	0	114.6	N121 H134	N121-M136 HydrophobicContact CB-CG 4.42Å; N121-M136 HydrophobicContact CB-SD 4.42Å; N121-M136 VanDerWaalsContact OD1-CB 3.28Å; N121-M136 WeakPolarHBondContact OD1-CB 3.37Å; N121-M136 WeakPolarHBondContact OD1-CG 3.23Å; N121-M136 PolarHBondContact OD1-N 2.85Å; H134-M136 PolarHBondContact O-N 3.49Å; H134-M136 VanDerWaalsContact O-N 3.15Å
137	C	81.5	Confident	82.6	Confident	46 Å²	46	48 Å²	48	31%	0.311	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-30.3	176.6	-64.4	0	0	0	0	112.1	I111 H134	I111-C137 HydrophobicContact CB-CB 4.1Å; I111-C137 HydrophobicContact CD1-CB 4.28Å; I111-C137 WeakPolarHBondContact CD1-O 3.42Å; I111-C137 HydrophobicContact CG2-CB 4.1Å; H134-C137 HydrophobicContact CB-CB 3.88Å; H134-C137 PolarHBondContact O-N 2.87Å
138	H	85.1	Confident	82.2	Confident	11 Å²	11	52.1 Å²	52.1	5%	0.051	31%	0.306	C	S	.	.	S	Bend	trans	-67.6	149.3	172.7	-168.5	-95.9	0	0	0	111.4	H134 P140 I141 I142 W153 C155 S156	H134-H138 PolarHBondContact O-N 3.07Å; H134-H138 VanDerWaalsContact O-N 3.08Å; H138-P140 CarbonylContact C-O 3.57Å; H138-P140 PolarHBondContact ND1-O 2.6Å; H138-P140 CarbonylContact O-C 3.18Å; H138-I141 PolarHBondContact O-N 3.11Å; H138-I142 HydrophobicContact CB-CD1 3.83Å; H138-I142 HydrophobicContact CB-CG1 3.67Å; H138-W153 AromaticContact CD2-CH2 3.8Å; H138-W153 AromaticContact CD2-CZ2 3.86Å; H138-W153 AromaticContact CE1-CZ2 3.67Å; H138-W153 AromaticContact CG-CZ2 3.99Å; H138-W153 AromaticContact ND1-CZ2 3.86Å; H138-W153 AromaticContact NE2-CH2 3.92Å; H138-W153 AromaticContact NE2-CZ2 3.68Å; H138-C155 WeakPolarHBondContact NE2-CA 3.45Å; H138-S156 PolarHBondContact NE2-N 2.84Å
139	S	69.8	Low	82.2	Confident	16 Å²	16	48.6 Å²	48.6	11%	0.112	29%	0.294	C	S	.	.	S	Bend	trans	-127.8	112.6	177.4	173	0	0	0	0	109.1	S156 S194	S139-S156 PolarHBondContact O-OG 3.39Å; S139-S194 PolarHBondContact OG-OG 3.01Å
140	P	79.5	Confident	81.9	Confident	30 Å²	30	53.6 Å²	53.6	20%	0.195	32%	0.318	C	S	.	.	S	Bend	cis	-69.2	160.8	1.2	30	-35.2	0	0	0	113.7	H138 I142 E190	H138-P140 CarbonylContact C-O 3.57Å; H138-P140 PolarHBondContact ND1-O 2.6Å; H138-P140 CarbonylContact O-C 3.18Å; P140-I142 PolarHBondContact O-N 2.81Å; P140-E190 HydrophobicContact CG-CG 4.47Å; P140-E190 VanDerWaalsContact CG-OE1 3.28Å; P140-E190 WeakPolarHBondContact CG-OE1 3.46Å
141	I	82.9	Confident	81.9	Confident	115 Å²	115	56.9 Å²	56.9	59%	0.59	32%	0.323	S	S	*	.			trans	-59.2	134.1	178.8	-66	176	0	0	0	110	Q135 H138 D143	Q135-I141 WeakPolarHBondContact O-CA 3.43Å; Q135-I141 WeakPolarHBondContact O-CG2 3.39Å; H138-I141 PolarHBondContact O-N 3.11Å; I141-D143 PolarHBondContact O-N 2.83Å
142	I	86.6	Confident	81.8	Confident	5 Å²	5	62.8 Å²	62.8	3%	0.026	35%	0.348	C	S	.	.			trans	-78.5	115.6	-177.9	-41.3	177.3	0	0	0	109.8	V124 Q135 H138 P140 V146 W153	V124-I142 HydrophobicContact CB-CD1 3.74Å; V124-I142 HydrophobicContact CG1-CD1 4.38Å; V124-I142 HydrophobicContact CG1-CG2 4.5Å; V124-I142 HydrophobicContact CG2-CD1 3.99Å; V124-I142 HydrophobicContact CG2-CG2 4.22Å; Q135-I142 HydrophobicContact CB-CB 4.28Å; Q135-I142 HydrophobicContact CG-CB 4.22Å; Q135-I142 PolarHBondContact NE2-O 3.18Å; Q135-I142 PolarHBondContact O-N 2.89Å; H138-I142 HydrophobicContact CB-CD1 3.83Å; H138-I142 HydrophobicContact CB-CG1 3.67Å; P140-I142 PolarHBondContact O-N 2.81Å; I142-V146 HydrophobicContact CG2-CB 3.81Å; I142-V146 HydrophobicContact CG2-CG1 4.03Å; I142-V146 HydrophobicContact CG2-CG2 3.83Å; I142-W153 HydrophobicContact CD1-CH2 3.54Å; I142-W153 HydrophobicContact CD1-CZ2 3.45Å; I142-W153 VanDerWaalsContact CD1-CZ2 3.45Å; I142-W153 HydrophobicContact CD1-CZ3 4.24Å; I142-W153 HydrophobicContact CG1-CH2 4.42Å; I142-W153 HydrophobicContact CG1-CZ2 3.85Å
143	D	82.6	Confident	81.9	Confident	107 Å²	107	64.1 Å²	64.1	57%	0.572	35%	0.351	S	S	*	.			trans	-60.7	140.3	175.7	-162.8	-44.7	0	0	0	110.8	I141 A145 V146	I141-D143 PolarHBondContact O-N 2.83Å; D143-A145 HydrophobicContact CB-CB 4.43Å; D143-A145 PolarHBondContact O-N 2.5Å; D143-A145 VanDerWaalsContact O-N 3.17Å; D143-A145 WeakPolarHBondContact OD1-CB 3.11Å; D143-A145 PolarHBondContact OD1-N 3.3Å; D143-V146 HydrophobicContact CB-CG2 4.49Å; D143-V146 VanDerWaalsContact O-CB 3.29Å; D143-V146 WeakPolarHBondContact O-CB 3.07Å; D143-V146 WeakPolarHBondContact O-CG2 3.46Å; D143-V146 PolarHBondContact O-N 2.91Å
144	A	82.3	Confident	81.7	Confident	51 Å²	51	66 Å²	66	42%	0.421	36%	0.361	S	S	.	.	H	α-helix	trans	-58.4	-25.9	173.9	0	0	0	0	0	112.1	V146 I147 D148	A144-V146 PolarHBondContact O-N 3.49Å; A144-V146 VanDerWaalsContact O-N 3.17Å; A144-I147 WeakPolarHBondContact O-CB 3.46Å; A144-I147 PolarHBondContact O-N 3.35Å; A144-D148 PolarHBondContact O-N 2.8Å; A144-D148 VanDerWaalsContact O-N 3.07Å
145	A	80.6	Confident	81.5	Confident	60 Å²	60	65.8 Å²	65.8	50%	0.496	36%	0.361	S	S	.	.	H	α-helix	trans	-57.6	-25	171.5	0	0	0	0	0	113.7	D143 S149	D143-A145 HydrophobicContact CB-CB 4.43Å; D143-A145 PolarHBondContact O-N 2.5Å; D143-A145 VanDerWaalsContact O-N 3.17Å; D143-A145 WeakPolarHBondContact OD1-CB 3.11Å; D143-A145 PolarHBondContact OD1-N 3.3Å; A145-S149 WeakPolarHBondContact O-CB 3.44Å; A145-S149 PolarHBondContact O-N 3.21Å
146	V	81.6	Confident	81.1	Confident	35 Å²	35	66.2 Å²	66.2	21%	0.212	37%	0.366	C	S	.	.	H	α-helix	trans	-69.3	-39.1	173.1	-179.3	0	0	0	0	110.8	V124 I142 D143 A144 S149 W153	V124-V146 HydrophobicContact CG1-CG1 4.39Å; I142-V146 HydrophobicContact CG2-CB 3.81Å; I142-V146 HydrophobicContact CG2-CG1 4.03Å; I142-V146 HydrophobicContact CG2-CG2 3.83Å; D143-V146 HydrophobicContact CB-CG2 4.49Å; D143-V146 VanDerWaalsContact O-CB 3.29Å; D143-V146 WeakPolarHBondContact O-CB 3.07Å; D143-V146 WeakPolarHBondContact O-CG2 3.46Å; D143-V146 PolarHBondContact O-N 2.91Å; A144-V146 PolarHBondContact O-N 3.49Å; A144-V146 VanDerWaalsContact O-N 3.17Å; V146-S149 PolarHBondContact O-N 2.86Å; V146-S149 PolarHBondContact O-OG 2.86Å; V146-W153 HydrophobicContact CG1-CB 3.72Å; V146-W153 HydrophobicContact CG1-CG 3.71Å
147	I	80.2	Confident	80.8	Confident	61 Å²	61	63.3 Å²	63.3	31%	0.313	35%	0.35	S	S	.	.	H	α-helix	trans	-72.3	-39.6	-179.2	-56.9	173.7	0	0	0	110.8	E122 V124 Q135 A144 S149	E122-I147 HydrophobicContact CB-CD1 4.04Å; V124-I147 HydrophobicContact CG2-CD1 3.91Å; V124-I147 HydrophobicContact CG2-CG1 3.76Å; Q135-I147 VanDerWaalsContact CD-CD1 3.42Å; Q135-I147 HydrophobicContact CG-CD1 3.93Å; A144-I147 WeakPolarHBondContact O-CB 3.46Å; A144-I147 PolarHBondContact O-N 3.35Å; I147-S149 PolarHBondContact O-N 3.28Å
148	D	74.6	Confident	80.7	Confident	153 Å²	153	61.6 Å²	61.6	82%	0.818	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-8.6	172.1	-86.1	-35	0	0	0	113.4	A144	A144-D148 PolarHBondContact O-N 2.8Å; A144-D148 VanDerWaalsContact O-N 3.07Å
149	S	79.1	Confident	80.4	Confident	29 Å²	29	64 Å²	64	20%	0.203	35%	0.35	C	S	.	.			trans	-96.3	144.2	-179.4	83.7	0	0	0	0	113.6	A145 V146 I147 D151 R520	A145-S149 WeakPolarHBondContact O-CB 3.44Å; A145-S149 PolarHBondContact O-N 3.21Å; V146-S149 PolarHBondContact O-N 2.86Å; V146-S149 PolarHBondContact O-OG 2.86Å; I147-S149 PolarHBondContact O-N 3.28Å; S149-D151 PolarHBondContact OG-N 3.28Å; S149-R520 PolarHBondContact O-NH1 2.96Å
150	D	72.7	Confident	80.4	Confident	152 Å²	152	65.8 Å²	65.8	81%	0.813	36%	0.358	S	S	*	.			trans	-83.9	5.1	163.1	-99	-32.2	0	0	0	111.7
151	D	80.2	Confident	79.8	Confident	120 Å²	120	66.9 Å²	66.9	64%	0.642	37%	0.369	S	S	*	.	S	Bend	trans	-76.8	161	-178.7	-79.2	-51.6	0	0	0	112.2	S149 R520	S149-D151 PolarHBondContact OG-N 3.28Å; D151-R520 PolarHBondContact O-NH1 2.83Å; D151-R520 PolarHBondContact O-NH2 2.99Å
152	K	83.7	Confident	79	Confident	165 Å²	165	62.9 Å²	62.9	72%	0.717	35%	0.352	S	S	*	.			trans	-79.5	131.3	-177.8	-76.6	-174.1	161.7	-98.9	0	111.6	D127	D127-K152 HydrophobicContact CB-CB 4.46Å; D127-K152 HydrophobicContact CB-CG 4.43Å; D127-K152 IonicContact OD1-NZ 3.19Å; D127-K152 WeakPolarHBondContact OD2-CA 3.28Å
153	W	88.8	Confident	77.6	Confident	34 Å²	34	68 Å²	68	13%	0.129	37%	0.374	C	S	.	.			trans	-115.5	141.2	175.2	-178.2	75.3	0	0	0	111.9	V124 C126 D127 Y133 H138 I142 V146 C155	V124-W153 HydrophobicContact CG1-CD2 4.11Å; V124-W153 HydrophobicContact CG1-CE3 3.76Å; V124-W153 HydrophobicContact CG1-CZ3 4.22Å; C126-W153 HydrophobicContact CB-CE3 4.3Å; C126-W153 HydrophobicContact CB-CZ3 3.95Å; D127-W153 WeakPolarHBondContact CB-O 3.47Å; D127-W153 PolarHBondContact N-O 2.7Å; D127-W153 PolarHBondContact OD2-N 3.18Å; Y133-W153 AromaticContact CD2-CH2 3.63Å; Y133-W153 HydrophobicContact CD2-CH2 3.63Å; Y133-W153 AromaticContact CD2-CZ3 3.78Å; Y133-W153 HydrophobicContact CD2-CZ3 3.78Å; Y133-W153 HydrophobicContact CE2-CH2 4.25Å; Y133-W153 HydrophobicContact CE2-CZ3 4.32Å; Y133-W153 HydrophobicContact CG-CH2 4.25Å; H138-W153 AromaticContact CD2-CH2 3.8Å; H138-W153 AromaticContact CD2-CZ2 3.86Å; H138-W153 AromaticContact CE1-CZ2 3.67Å; H138-W153 AromaticContact CG-CZ2 3.99Å; H138-W153 AromaticContact ND1-CZ2 3.86Å; H138-W153 AromaticContact NE2-CH2 3.92Å; H138-W153 AromaticContact NE2-CZ2 3.68Å; I142-W153 HydrophobicContact CD1-CH2 3.54Å; I142-W153 HydrophobicContact CD1-CZ2 3.45Å; I142-W153 VanDerWaalsContact CD1-CZ2 3.45Å; I142-W153 HydrophobicContact CD1-CZ3 4.24Å; I142-W153 HydrophobicContact CG1-CH2 4.42Å; I142-W153 HydrophobicContact CG1-CZ2 3.85Å; V146-W153 HydrophobicContact CG1-CB 3.72Å; V146-W153 HydrophobicContact CG1-CG 3.71Å; W153-C155 HydrophobicContact CH2-CB 3.72Å; W153-C155 HydrophobicContact CZ2-CB 4.31Å; W153-C155 HydrophobicContact CZ3-CB 4.2Å
154	L	86.1	Confident	75.7	Confident	48 Å²	48	65.8 Å²	65.8	25%	0.251	37%	0.367	S	S	.	.			trans	-124.3	134.6	178.9	-61.6	-179.6	0	0	0	108.6	D127 K128 C158 E159	D127-L154 HydrophobicContact CB-CD2 4.48Å; K128-L154 HydrophobicContact CB-CD2 3.48Å; K128-L154 VanDerWaalsContact CB-CD2 3.48Å; K128-L154 HydrophobicContact CD-CD2 4.49Å; L154-C158 HydrophobicContact CB-CB 4.31Å; L154-E159 HydrophobicContact CB-CG 3.54Å; L154-E159 HydrophobicContact CD1-CG 4.21Å
155	C	85.5	Confident	73.9	Confident	1 Å²	1	69.2 Å²	69.2	1%	0.007	38%	0.375	C	S	.	.			trans	-68.6	156.5	168.9	68.5	0	0	0	0	110.9	C126 Y133 H138 W153 E157 C158 E159	C126-C155 HydrophobicContact CB-CB 4.15Å; C126-C155 PolarHBondContact SG-N 2.76Å; C126-C155 VanDerWaalsContact SG-SG 3.69Å; Y133-C155 HydrophobicContact CD2-CB 4.03Å; Y133-C155 HydrophobicContact CE2-CB 3.35Å; Y133-C155 PolarHBondContact OH-SG 3.21Å; H138-C155 WeakPolarHBondContact NE2-CA 3.45Å; W153-C155 HydrophobicContact CH2-CB 3.72Å; W153-C155 HydrophobicContact CZ2-CB 4.31Å; W153-C155 HydrophobicContact CZ3-CB 4.2Å; C155-E157 VanDerWaalsContact C-N 3.26Å; C155-E157 PolarHBondContact O-N 3.44Å; C155-E157 VanDerWaalsContact O-N 3.17Å; C155-C158 WeakPolarHBondContact O-CA 3.33Å; C155-C158 VanDerWaalsContact O-CB 3.3Å; C155-C158 WeakPolarHBondContact O-CB 3.49Å; C155-C158 PolarHBondContact O-N 2.87Å; C155-E159 PolarHBondContact O-N 2.66Å
156	S	78.4	Confident	71.9	Confident	24 Å²	24	73 Å²	73	17%	0.168	38%	0.38	C	S	.	.	H	α-helix	trans	-59.1	-33.3	-172.4	54.3	0	0	0	0	113.5	H138 S139 E159 L160	H138-S156 PolarHBondContact NE2-N 2.84Å; S139-S156 PolarHBondContact O-OG 3.39Å; S156-E159 PolarHBondContact O-N 3.08Å; S156-L160 WeakPolarHBondContact O-CB 3.09Å; S156-L160 VanDerWaalsContact O-CG 3.23Å; S156-L160 WeakPolarHBondContact O-CG 3.44Å; S156-L160 PolarHBondContact O-N 3.31Å
157	E	75.3	Confident	69.8	Low	66 Å²	66	72.9 Å²	72.9	31%	0.308	39%	0.386	S	S	.	.	H	α-helix	trans	-62.7	-43.1	170.9	-58.5	-168.6	152.1	0	0	112.6	Q93 C155 E159 L160 A161	Q93-E157 PolarHBondContact NE2-OE1 2.67Å; Q93-E157 PolarHBondContact NE2-OE2 3.12Å; C155-E157 VanDerWaalsContact C-N 3.26Å; C155-E157 PolarHBondContact O-N 3.44Å; C155-E157 VanDerWaalsContact O-N 3.17Å; E157-E159 VanDerWaalsContact C-N 3.33Å; E157-E159 PolarHBondContact O-N 2.96Å; E157-L160 PolarHBondContact O-N 2.93Å; E157-A161 WeakPolarHBondContact O-CB 3.24Å; E157-A161 PolarHBondContact O-N 2.91Å
158	C	78.9	Confident	67.6	Low	10 Å²	10	73.8 Å²	73.8	7%	0.068	40%	0.398	C	S	.	.	H	α-helix	trans	-67.5	-33.9	178.7	-93.2	0	0	0	0	112.5	C126 K128 C129 L154 C155 S162	C126-C158 VanDerWaalsContact SG-SG 3.68Å; K128-C158 HydrophobicContact CB-CB 4.2Å; K128-C158 HydrophobicContact CD-CB 3.87Å; K128-C158 HydrophobicContact CG-CB 4.3Å; K128-C158 PolarHBondContact NZ-O 2.92Å; C129-C158 VanDerWaalsContact CB-SG 3.53Å; L154-C158 HydrophobicContact CB-CB 4.31Å; C155-C158 WeakPolarHBondContact O-CA 3.33Å; C155-C158 VanDerWaalsContact O-CB 3.3Å; C155-C158 WeakPolarHBondContact O-CB 3.49Å; C155-C158 PolarHBondContact O-N 2.87Å; C158-S162 PolarHBondContact O-N 2.81Å; C158-S162 PolarHBondContact O-OG 3.47Å
159	E	80	Confident	65.8	Low	63 Å²	63	73.4 Å²	73.4	29%	0.294	39%	0.394	S	S	.	.	H	α-helix	trans	-68.4	-52.9	172.3	-63.2	-161.1	130.7	0	0	111.6	L154 C155 S156 E157 A161 S162 F163	L154-E159 HydrophobicContact CB-CG 3.54Å; L154-E159 HydrophobicContact CD1-CG 4.21Å; C155-E159 PolarHBondContact O-N 2.66Å; S156-E159 PolarHBondContact O-N 3.08Å; E157-E159 VanDerWaalsContact C-N 3.33Å; E157-E159 PolarHBondContact O-N 2.96Å; E159-A161 VanDerWaalsContact C-N 3.3Å; E159-A161 PolarHBondContact O-N 3.37Å; E159-S162 CarbonylContact O-C 3.34Å; E159-S162 WeakPolarHBondContact O-CA 3.37Å; E159-S162 VanDerWaalsContact O-CB 3.3Å; E159-S162 WeakPolarHBondContact O-CB 3.44Å; E159-S162 PolarHBondContact O-N 3.27Å; E159-F163 HydrophobicContact CB-CE2 4.04Å; E159-F163 WeakPolarHBondContact O-CD2 3.42Å; E159-F163 PolarHBondContact O-N 3.37Å; E159-F163 VanDerWaalsContact O-N 3.14Å
160	L	68.4	Low	64	Low	52 Å²	52	78.9 Å²	78.9	27%	0.272	42%	0.42	S	S	.	.	H	α-helix	trans	-50.9	-48.4	176.4	-74.9	168.1	0	0	0	111.7	S156 E157 S162 F163 S164	S156-L160 WeakPolarHBondContact O-CB 3.09Å; S156-L160 VanDerWaalsContact O-CG 3.23Å; S156-L160 WeakPolarHBondContact O-CG 3.44Å; S156-L160 PolarHBondContact O-N 3.31Å; E157-L160 PolarHBondContact O-N 2.93Å; L160-S162 PolarHBondContact O-N 2.96Å; L160-F163 PolarHBondContact O-N 2.99Å; L160-S164 PolarHBondContact O-N 3.3Å
161	A	67.9	Low	62.6	Low	53 Å²	53	79.7 Å²	79.7	44%	0.438	42%	0.417	S	S	.	.	H	α-helix	trans	-61.1	-29.1	175.5	0	0	0	0	0	113.5	E157 E159	E157-A161 WeakPolarHBondContact O-CB 3.24Å; E157-A161 PolarHBondContact O-N 2.91Å; E159-A161 VanDerWaalsContact C-N 3.3Å; E159-A161 PolarHBondContact O-N 3.37Å
162	S	65.7	Low	60.3	Low	32 Å²	32	83.1 Å²	83.1	22%	0.224	43%	0.426	C	S	.	.	H	α-helix	trans	-80.9	-18.4	179.1	-54.5	0	0	0	0	114	K128 C158 E159 L160	K128-S162 PolarHBondContact NZ-OG 3.09Å; C158-S162 PolarHBondContact O-N 2.81Å; C158-S162 PolarHBondContact O-OG 3.47Å; E159-S162 CarbonylContact O-C 3.34Å; E159-S162 WeakPolarHBondContact O-CA 3.37Å; E159-S162 VanDerWaalsContact O-CB 3.3Å; E159-S162 WeakPolarHBondContact O-CB 3.44Å; E159-S162 PolarHBondContact O-N 3.27Å; L160-S162 PolarHBondContact O-N 2.96Å
163	F	56.5	Low	57.9	Low	111 Å²	111	84.4 Å²	84.4	49%	0.487	43%	0.434	S	S	.	.	H	α-helix	trans	-81.6	-37.5	173.7	-65.9	-65.1	0	0	0	112.1	E159 L160 E165 K166 G167	E159-F163 HydrophobicContact CB-CE2 4.04Å; E159-F163 WeakPolarHBondContact O-CD2 3.42Å; E159-F163 PolarHBondContact O-N 3.37Å; E159-F163 VanDerWaalsContact O-N 3.14Å; L160-F163 PolarHBondContact O-N 2.99Å; F163-E165 VanDerWaalsContact C-N 3.34Å; F163-E165 PolarHBondContact O-N 3.44Å; F163-K166 PolarHBondContact O-N 3Å; F163-K166 VanDerWaalsContact O-N 3.12Å; F163-G167 PolarHBondContact O-N 2.83Å
164	S	43.3	Very low	55.3	Low	61 Å²	61	87.4 Å²	87.4	43%	0.427	47%	0.467	S	S	.	.	H	α-helix	trans	-56.9	-39.9	-178.9	-175.1	0	0	0	0	113.8	L160 K166 G167 S168	L160-S164 PolarHBondContact O-N 3.3Å; S164-K166 VanDerWaalsContact C-N 3.31Å; S164-K166 PolarHBondContact O-N 3.16Å; S164-G167 PolarHBondContact O-N 2.93Å; S164-S168 PolarHBondContact O-OG 3.48Å
165	E	43.7	Very low	52.8	Low	124 Å²	124	91 Å²	91	58%	0.579	50%	0.496	S	S	*	.	H	α-helix	trans	-59.9	-38.8	177.6	-65.1	-162.4	128.1	0	0	112.9	F163 S168	F163-E165 VanDerWaalsContact C-N 3.34Å; F163-E165 PolarHBondContact O-N 3.44Å; E165-S168 PolarHBondContact O-N 3.11Å
166	K	40.2	Very low	50.3	Low	138 Å²	138	95.1 Å²	95.1	60%	0.6	53%	0.53	S	S	*	.	H	α-helix	trans	-73.1	-39.4	-177.1	-63.4	172.8	-173.6	166.3	0	111.6	F163 S164 S168 I169	F163-K166 PolarHBondContact O-N 3Å; F163-K166 VanDerWaalsContact O-N 3.12Å; S164-K166 VanDerWaalsContact C-N 3.31Å; S164-K166 PolarHBondContact O-N 3.16Å; K166-S168 PolarHBondContact O-N 2.91Å; K166-S168 VanDerWaalsContact O-N 3.08Å; K166-I169 PolarHBondContact O-N 3.49Å
167	G	35.9	Very low	48.2	Very low	34 Å²	34	103.4 Å²	103.4	35%	0.351	56%	0.563	S	S	.	*	H	α-helix	trans	-61.8	-15.2	177.2	0	0	0	0	0	114.5	F163 S164 K171	F163-G167 PolarHBondContact O-N 2.83Å; S164-G167 PolarHBondContact O-N 2.93Å; G167-K171 WeakPolarHBondContact O-CD 3.17Å; G167-K171 WeakPolarHBondContact O-CE 3.2Å; G167-K171 PolarHBondContact O-NZ 3.37Å
168	S	35.5	Very low	46.2	Very low	79 Å²	79	108.2 Å²	108.2	55%	0.552	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-17	180	-66	0	0	0	0	114.6	S164 E165 K166	S164-S168 PolarHBondContact O-OG 3.48Å; E165-S168 PolarHBondContact O-N 3.11Å; K166-S168 PolarHBondContact O-N 2.91Å; K166-S168 VanDerWaalsContact O-N 3.08Å
169	I	36.5	Very low	44.3	Very low	145 Å²	145	117.3 Å²	117.3	74%	0.744	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-30.8	-175.3	-64.1	177.5	0	0	0	112.4	K166 K171	K166-I169 PolarHBondContact O-N 3.49Å; I169-K171 PolarHBondContact O-N 2.96Å
170	L	41.2	Very low	42.2	Very low	145 Å²	145	120 Å²	120	76%	0.759	65%	0.651	S	S	*	*	S	Bend	trans	-70.3	-15.5	179.6	-68.7	170	0	0	0	114.1	K172	L170-K172 PolarHBondContact O-N 2.85Å
171	K	43.3	Very low	40.7	Very low	168 Å²	168	127.2 Å²	127.2	73%	0.73	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	29	-167.9	-67.2	175.4	177.1	164	0	115	G167 I169	G167-K171 WeakPolarHBondContact O-CD 3.17Å; G167-K171 WeakPolarHBondContact O-CE 3.2Å; G167-K171 PolarHBondContact O-NZ 3.37Å; I169-K171 PolarHBondContact O-N 2.96Å
172	K	30.6	Very low	39.3	Very low	193 Å²	193	132.5 Å²	132.5	84%	0.839	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.9	-11.8	-179.8	-144.5	171.2	-176.2	177.7	0	118.5	L170	L170-K172 PolarHBondContact O-N 2.85Å
173	E	34.6	Very low	37.7	Very low	191 Å²	191	138.6 Å²	138.6	89%	0.893	72%	0.721	S	S	*	*			trans	-130.7	73.1	175.6	-67.5	-164.1	155.7	0	0	111.9
174	A	34	Very low	36.9	Very low	98 Å²	98	141 Å²	141	81%	0.81	73%	0.733	S	S	*	*			trans	-134.5	55.1	-179	0	0	0	0	0	112.3
175	S	34.3	Very low	36.5	Very low	123 Å²	123	146.1 Å²	146.1	86%	0.86	75%	0.751	S	S	*	*			trans	-143.6	28.1	-179.1	55.9	0	0	0	0	115.4
176	A	33.1	Very low	36.2	Very low	87 Å²	87	147.9 Å²	147.9	72%	0.719	76%	0.759	S	S	*	*	S	Bend	trans	-152.5	116.8	165.7	0	0	0	0	0	114.8
177	K	33.1	Very low	36.3	Very low	199 Å²	199	148.3 Å²	148.3	87%	0.865	76%	0.763	S	S	*	*			trans	62.8	115.5	146.5	-60.5	175.3	-178.7	175.4	0	120.6
178	L	34	Very low	36.5	Very low	166 Å²	166	154.4 Å²	154.4	87%	0.869	78%	0.782	S	S	*	*			trans	62.8	131.5	131.7	-122.4	71.5	0	0	0	120.9
179	F	38.3	Very low	37.5	Very low	201 Å²	201	156 Å²	156	88%	0.882	78%	0.782	S	S	*	*			trans	-51.7	146.1	174.2	-59.8	-90.1	0	0	0	115
180	P	35.5	Very low	38.9	Very low	119 Å²	119	153.8 Å²	153.8	77%	0.773	77%	0.769	S	S	*	*				-109.4	158.5	123.9	-8.2	27.1	0	0	0	112.2
181	K	38.3	Very low	40.7	Very low	204 Å²	204	149.6 Å²	149.6	89%	0.887	74%	0.744	S	S	*	*			trans	-85.4	133.9	160.3	-71.8	177	171.9	-176.9	0	109.1
182	Q	38.3	Very low	42.4	Very low	165 Å²	165	142.7 Å²	142.7	77%	0.771	72%	0.715	S	S	*	*			trans	-148.9	124.4	146.1	-81.9	-160.9	-76.5	0	0	106
183	E	32	Very low	45.2	Very low	160 Å²	160	138.2 Å²	138.2	75%	0.748	70%	0.7	S	S	*	*				77.9	141.7	76.1	-70.1	175.9	157	0	0	112.5	Q185	E183-Q185 PolarHBondContact O-N 3.09Å
184	H	39	Very low	47.9	Very low	160 Å²	160	131.3 Å²	131.3	74%	0.741	67%	0.672	S	S	*	*			trans	-65.6	113.9	-158.4	-69.7	-120.3	0	0	0	113	E186	H184-E186 IonicContact CE1-OE1 3.48Å; H184-E186 PolarHBondContact CE1-OE1 3.3Å; H184-E186 IonicContact CG-OE1 3.85Å; H184-E186 IonicContact ND1-OE1 2.72Å; H184-E186 PolarHBondContact ND1-OE1 3.39Å
185	Q	35.1	Very low	50.6	Low	169 Å²	169	128.2 Å²	128.2	79%	0.79	64%	0.64	S	S	*	*			trans	-116.8	90.4	144.9	-75.1	-169	-10.3	0	0	107.9	E183 Q187	E183-Q185 PolarHBondContact O-N 3.09Å; Q185-Q187 PolarHBondContact O-N 2.81Å
186	E	38.5	Very low	53.2	Low	162 Å²	162	126 Å²	126	76%	0.757	62%	0.623	S	S	*	*			trans	-69.9	86.9	167.1	-78.7	159.7	-149	0	0	108.3	H184 H188	H184-E186 IonicContact CE1-OE1 3.48Å; H184-E186 PolarHBondContact CE1-OE1 3.3Å; H184-E186 IonicContact CG-OE1 3.85Å; H184-E186 IonicContact ND1-OE1 2.72Å; H184-E186 PolarHBondContact ND1-OE1 3.39Å; E186-H188 PolarHBondContact O-N 3.07Å
187	Q	41.3	Very low	56	Low	147 Å²	147	123.9 Å²	123.9	69%	0.687	60%	0.597	S	S	*	*			trans	-64.7	128.9	162.3	-62	-178.9	13.9	0	0	107	Q185 M189	Q185-Q187 PolarHBondContact O-N 2.81Å; Q187-M189 VanDerWaalsContact C-N 3.27Å; Q187-M189 PolarHBondContact O-N 2.62Å
188	H	40.8	Very low	58.8	Low	162 Å²	162	116.3 Å²	116.3	75%	0.75	57%	0.571	S	S	*	*			trans	-67.8	85.3	179.1	-168	-96.8	0	0	0	109.4	E186 E190	E186-H188 PolarHBondContact O-N 3.07Å; H188-E190 IonicContact CE1-OE2 3.3Å; H188-E190 PolarHBondContact CE1-OE2 2.8Å; H188-E190 VanDerWaalsContact CE1-OE2 3.3Å; H188-E190 IonicContact ND1-OE2 3.56Å; H188-E190 PolarHBondContact O-N 2.86Å; H188-E190 VanDerWaalsContact O-N 3.16Å
189	M	56.3	Low	61.6	Low	113 Å²	113	110.2 Å²	110.2	56%	0.557	54%	0.542	S	S	*	.			trans	-78.2	96.2	174.6	-66.1	-159.7	-53.8	0	0	108.4	Q187 F191	Q187-M189 VanDerWaalsContact C-N 3.27Å; Q187-M189 PolarHBondContact O-N 2.62Å; M189-F191 HydrophobicContact CB-CE1 4.16Å; M189-F191 HydrophobicContact CB-CZ 4.12Å; M189-F191 HydrophobicContact CE-CE1 4.14Å; M189-F191 HydrophobicContact CE-CZ 4.08Å; M189-F191 WeakPolarHBondContact O-CD2 3.49Å; M189-F191 WeakPolarHBondContact O-CE2 3.2Å; M189-F191 PolarHBondContact O-N 3.32Å
190	E	66.3	Low	64.2	Low	97 Å²	97	108.5 Å²	108.5	45%	0.453	54%	0.537	S	S	.	.			trans	-70.7	119	174.1	-162.8	139.5	155.6	0	0	109.4	P140 H188	P140-E190 HydrophobicContact CG-CG 4.47Å; P140-E190 VanDerWaalsContact CG-OE1 3.28Å; P140-E190 WeakPolarHBondContact CG-OE1 3.46Å; H188-E190 IonicContact CE1-OE2 3.3Å; H188-E190 PolarHBondContact CE1-OE2 2.8Å; H188-E190 VanDerWaalsContact CE1-OE2 3.3Å; H188-E190 IonicContact ND1-OE2 3.56Å; H188-E190 PolarHBondContact O-N 2.86Å; H188-E190 VanDerWaalsContact O-N 3.16Å
191	F	77.8	Confident	67	Low	57 Å²	57	109.7 Å²	109.7	25%	0.25	53%	0.532	C	S	.	.			trans	-91.4	140.3	-177.3	-60.3	-65.1	0	0	0	110.5	M189 L193 P269	M189-F191 HydrophobicContact CB-CE1 4.16Å; M189-F191 HydrophobicContact CB-CZ 4.12Å; M189-F191 HydrophobicContact CE-CE1 4.14Å; M189-F191 HydrophobicContact CE-CZ 4.08Å; M189-F191 WeakPolarHBondContact O-CD2 3.49Å; M189-F191 WeakPolarHBondContact O-CE2 3.2Å; M189-F191 PolarHBondContact O-N 3.32Å; F191-L193 HydrophobicContact CB-CD2 4.22Å; F191-L193 PolarHBondContact O-N 2.89Å; F191-P269 HydrophobicContact CE1-CB 3.91Å; F191-P269 HydrophobicContact CE2-CB 4.27Å; F191-P269 HydrophobicContact CZ-CB 3.72Å
192	H	80.4	Confident	69.7	Low	24 Å²	24	100.9 Å²	100.9	11%	0.111	50%	0.495	C	S	.	.			trans	-69.3	93.7	170.5	-64.2	-63.2	0	0	0	110.2	Y218 S263 V264	H192-Y218 HydrophobicContact CB-CD1 3.39Å; H192-Y218 HydrophobicContact CB-CD2 4.38Å; H192-Y218 HydrophobicContact CB-CE1 3.93Å; H192-Y218 HydrophobicContact CB-CG 3.65Å; H192-Y218 AromaticContact CD2-CD2 3.61Å; H192-Y218 AromaticContact CD2-CG 3.52Å; H192-Y218 AromaticContact CG-CG 3.77Å; H192-S263 CarbonylContact O-C 3.44Å; H192-S263 WeakPolarHBondContact O-CB 3.29Å; H192-V264 WeakPolarHBondContact O-CG2 3.33Å; H192-V264 PolarHBondContact O-N 3.2Å; H192-V264 VanDerWaalsContact O-N 3.13Å
193	L	88.8	Confident	72.4	Confident	99 Å²	99	96.9 Å²	96.9	52%	0.518	48%	0.481	S	S	.	.			trans	-85.1	-12.2	178.2	-61.6	-178.3	0	0	0	113.3	F191	F191-L193 HydrophobicContact CB-CD2 4.22Å; F191-L193 PolarHBondContact O-N 2.89Å
194	S	90.6	Very high	75.5	Confident	45 Å²	45	91.8 Å²	91.8	32%	0.315	46%	0.455	S	S	.	.	S	Bend	trans	-134.3	161.7	178.3	46.1	0	0	0	0	111.4	S139	S139-S194 PolarHBondContact OG-OG 3.01Å
195	F	92	Very high	78.2	Confident	33 Å²	33	87.2 Å²	87.2	15%	0.145	44%	0.436	C	S	.	.			trans	-102.2	146.3	169.3	-63.5	-72.2	0	0	0	110.1	Y197 P199 C217 Y218 Q237 F239 V264	F195-Y197 HydrophobicContact CB-CD1 4.1Å; F195-Y197 HydrophobicContact CB-CD2 4.46Å; F195-Y197 HydrophobicContact CB-CE1 3.91Å; F195-Y197 HydrophobicContact CB-CE2 4.28Å; F195-Y197 HydrophobicContact CB-CG 4.37Å; F195-Y197 WeakPolarHBondContact CB-O 3.35Å; F195-Y197 AromaticContact CD1-CE1 3.88Å; F195-Y197 HydrophobicContact CD1-CE1 3.88Å; F195-Y197 HydrophobicContact CD1-CE2 4.39Å; F195-Y197 AromaticContact CD1-CZ 3.62Å; F195-Y197 VanDerWaalsContact CD1-OH 3.29Å; F195-Y197 WeakPolarHBondContact CD1-OH 3.34Å; F195-Y197 WeakPolarHBondContact CE1-OH 3.31Å; F195-Y197 HydrophobicContact CG-CE1 4.22Å; F195-Y197 HydrophobicContact CG-CE2 4.31Å; F195-Y197 AromaticContact CG-CZ 3.93Å; F195-Y197 PolarHBondContact O-N 3.09Å; F195-Y197 VanDerWaalsContact O-N 3.15Å; F195-P199 HydrophobicContact CD2-CG 3.44Å; F195-P199 VanDerWaalsContact CD2-CG 3.44Å; F195-P199 HydrophobicContact CE2-CG 3.83Å; F195-P199 HydrophobicContact CG-CG 4.18Å; F195-C217 WeakPolarHBondContact CD1-O 3.47Å; F195-Y218 HydrophobicContact CE1-CD1 4.34Å; F195-Q237 HydrophobicContact CE1-CG 4.5Å; F195-F239 AromaticContact CE1-CE1 3.85Å; F195-F239 HydrophobicContact CE1-CE1 3.85Å; F195-F239 AromaticContact CE1-CZ 3.82Å; F195-F239 HydrophobicContact CE1-CZ 3.82Å; F195-F239 HydrophobicContact CZ-CE1 4.32Å; F195-F239 AromaticContact CZ-CZ 3.88Å; F195-F239 HydrophobicContact CZ-CZ 3.88Å; F195-V264 HydrophobicContact CD1-CG2 4.28Å; F195-V264 HydrophobicContact CD2-CG1 4Å; F195-V264 HydrophobicContact CD2-CG2 4.14Å; F195-V264 HydrophobicContact CE1-CG2 4.01Å; F195-V264 HydrophobicContact CE2-CB 3.92Å; F195-V264 HydrophobicContact CE2-CG1 3.63Å; F195-V264 HydrophobicContact CE2-CG2 3.87Å; F195-V264 HydrophobicContact CG-CG2 4.35Å; F195-V264 HydrophobicContact CZ-CB 4.03Å; F195-V264 HydrophobicContact CZ-CG1 4.27Å; F195-V264 HydrophobicContact CZ-CG2 3.8Å
196	P	88.3	Confident	80.8	Confident	78 Å²	78	88.5 Å²	88.5	51%	0.506	44%	0.442	S	S	.	.	S	Bend	trans	-80	21.3	173.2	34.1	-34.9	0	0	0	113.1	Y218	P196-Y218 WeakPolarHBondContact CD-O 3.45Å; P196-Y218 WeakPolarHBondContact CG-O 3.4Å
197	Y	90.6	Very high	83.2	Confident	41 Å²	41	82.7 Å²	82.7	16%	0.161	43%	0.425	C	S	.	.	S	Bend	trans	-155.8	157.6	-179.2	59.7	-90.8	0	0	0	109.2	F195 P199 L202 C215 C217 Q237	F195-Y197 HydrophobicContact CB-CD1 4.1Å; F195-Y197 HydrophobicContact CB-CD2 4.46Å; F195-Y197 HydrophobicContact CB-CE1 3.91Å; F195-Y197 HydrophobicContact CB-CE2 4.28Å; F195-Y197 HydrophobicContact CB-CG 4.37Å; F195-Y197 WeakPolarHBondContact CB-O 3.35Å; F195-Y197 AromaticContact CD1-CE1 3.88Å; F195-Y197 HydrophobicContact CD1-CE1 3.88Å; F195-Y197 HydrophobicContact CD1-CE2 4.39Å; F195-Y197 AromaticContact CD1-CZ 3.62Å; F195-Y197 VanDerWaalsContact CD1-OH 3.29Å; F195-Y197 WeakPolarHBondContact CD1-OH 3.34Å; F195-Y197 WeakPolarHBondContact CE1-OH 3.31Å; F195-Y197 HydrophobicContact CG-CE1 4.22Å; F195-Y197 HydrophobicContact CG-CE2 4.31Å; F195-Y197 AromaticContact CG-CZ 3.93Å; F195-Y197 PolarHBondContact O-N 3.09Å; F195-Y197 VanDerWaalsContact O-N 3.15Å; Y197-P199 HydrophobicContact CD2-CG 4.47Å; Y197-P199 HydrophobicContact CE2-CB 4.48Å; Y197-P199 HydrophobicContact CE2-CG 4.16Å; Y197-P199 VanDerWaalsContact O-CD 3.26Å; Y197-P199 WeakPolarHBondContact O-CD 3.33Å; Y197-L202 HydrophobicContact CD2-CD1 4.21Å; Y197-L202 HydrophobicContact CE2-CD1 3.82Å; Y197-C215 WeakPolarHBondContact CD1-SG 3.37Å; Y197-C217 VanDerWaalsContact CE1-O 3.28Å; Y197-C217 WeakPolarHBondContact CE1-O 3.32Å; Y197-C217 PolarHBondContact OH-O 3.29Å; Y197-Q237 PolarHBondContact OH-NE2 3.04Å
198	A	92.4	Very high	85.8	Confident	40 Å²	40	77.7 Å²	77.7	33%	0.331	40%	0.402	S	S	.	.			trans	-82.2	112.5	175.2	0	0	0	0	0	111.2	E200 E201	A198-E200 PolarHBondContact O-N 3.07Å; A198-E201 HydrophobicContact CB-CB 4.44Å; A198-E201 HydrophobicContact CB-CG 3.89Å; A198-E201 PolarHBondContact O-N 3.48Å
199	P	92.7	Very high	88.3	Confident	39 Å²	39	71.2 Å²	71.2	25%	0.253	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-64.8	-24.1	-179.6	-22.9	36	0	0	0	113.8	F195 Y197 E201 L202	F195-P199 HydrophobicContact CD2-CG 3.44Å; F195-P199 VanDerWaalsContact CD2-CG 3.44Å; F195-P199 HydrophobicContact CE2-CG 3.83Å; F195-P199 HydrophobicContact CG-CG 4.18Å; Y197-P199 HydrophobicContact CD2-CG 4.47Å; Y197-P199 HydrophobicContact CE2-CB 4.48Å; Y197-P199 HydrophobicContact CE2-CG 4.16Å; Y197-P199 VanDerWaalsContact O-CD 3.26Å; Y197-P199 WeakPolarHBondContact O-CD 3.33Å; P199-E201 VanDerWaalsContact C-N 3.29Å; P199-E201 PolarHBondContact O-N 3.32Å; P199-L202 PolarHBondContact O-N 3.07Å
200	E	93.4	Very high	90.2	Very high	165 Å²	165	68.2 Å²	68.2	77%	0.771	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-71.4	-22	-178.4	-64.2	67.1	-143.9	0	0	113.1	A198	A198-E200 PolarHBondContact O-N 3.07Å
201	E	94.2	Very high	91.5	Very high	144 Å²	144	63.8 Å²	63.8	67%	0.673	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-87.2	-10.8	-179.9	-60.4	-173.4	160.5	0	0	112.8	A198 P199 V203 Q213	A198-E201 HydrophobicContact CB-CB 4.44Å; A198-E201 HydrophobicContact CB-CG 3.89Å; A198-E201 PolarHBondContact O-N 3.48Å; P199-E201 VanDerWaalsContact C-N 3.29Å; P199-E201 PolarHBondContact O-N 3.32Å; E201-V203 PolarHBondContact O-N 3.45Å; E201-Q213 PolarHBondContact O-NE2 3.09Å
202	L	95.2	Very high	92.2	Very high	19 Å²	19	67.3 Å²	67.3	10%	0.099	36%	0.359	C	S	.	.			trans	-70.5	120.6	-178.1	-61.7	-177.2	0	0	0	111.5	Y197 P199 W204 N211 Q213 C215	Y197-L202 HydrophobicContact CD2-CD1 4.21Å; Y197-L202 HydrophobicContact CE2-CD1 3.82Å; P199-L202 PolarHBondContact O-N 3.07Å; L202-W204 HydrophobicContact CD1-CZ2 4.01Å; L202-W204 PolarHBondContact O-N 3.5Å; L202-N211 HydrophobicContact CB-CB 4.33Å; L202-Q213 HydrophobicContact CD2-CB 4.04Å; L202-Q213 HydrophobicContact CD2-CG 4.2Å; L202-C215 HydrophobicContact CD2-CB 3.82Å
203	V	95.8	Very high	92.8	Very high	81 Å²	81	69.6 Å²	69.6	49%	0.491	37%	0.37	S	S	.	.			trans	-92.2	99.4	-179.9	-177	0	0	0	0	109.1	E201 N211 I212	E201-V203 PolarHBondContact O-N 3.45Å; V203-N211 VanDerWaalsContact O-CA 3.23Å; V203-N211 WeakPolarHBondContact O-CA 3.41Å; V203-N211 WeakPolarHBondContact O-CB 3.27Å; V203-I212 HydrophobicContact CB-CD1 3.78Å; V203-I212 HydrophobicContact CB-CG1 3.96Å; V203-I212 HydrophobicContact CG1-CD1 4.27Å; V203-I212 HydrophobicContact CG2-CD1 4.08Å; V203-I212 PolarHBondContact O-N 2.86Å
204	W	97	Very high	93	Very high	53 Å²	53	68.5 Å²	68.5	20%	0.201	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-84.1	152.8	-175.3	-70.8	91.9	0	0	0	114.3	L202 H208 T210 N211 Y216 Q237 W238	L202-W204 HydrophobicContact CD1-CZ2 4.01Å; L202-W204 PolarHBondContact O-N 3.5Å; W204-H208 AromaticContact CD1-CE1 3.41Å; W204-H208 VanDerWaalsContact CD1-CE1 3.41Å; W204-H208 AromaticContact CD1-ND1 3.89Å; W204-H208 AromaticContact CD2-CD2 3.83Å; W204-H208 AromaticContact CD2-CE1 3.48Å; W204-H208 VanDerWaalsContact CD2-CE1 3.48Å; W204-H208 AromaticContact CD2-CG 3.97Å; W204-H208 AromaticContact CD2-ND1 3.74Å; W204-H208 AromaticContact CD2-NE2 3.56Å; W204-H208 AromaticContact CE2-CE1 3.56Å; W204-H208 AromaticContact CE2-NE2 3.46Å; W204-H208 AromaticContact CE3-CD2 3.79Å; W204-H208 AromaticContact CE3-NE2 3.98Å; W204-H208 AromaticContact CG-CE1 3.42Å; W204-H208 VanDerWaalsContact CG-CE1 3.42Å; W204-H208 AromaticContact CG-ND1 3.5Å; W204-H208 AromaticContact CZ2-NE2 3.84Å; W204-H208 AromaticContact NE1-CE1 3.47Å; W204-H208 PolarHBondContact NE1-CE1 3.4Å; W204-H208 AromaticContact NE1-NE2 3.79Å; W204-T210 CarbonylContact C-O 3.59Å; W204-T210 WeakPolarHBondContact CA-O 3.34Å; W204-T210 VanDerWaalsContact CE3-C 3.47Å; W204-T210 VanDerWaalsContact CE3-O 3.26Å; W204-N211 HydrophobicContact CD2-CB 3.89Å; W204-N211 HydrophobicContact CE3-CB 4.04Å; W204-N211 HydrophobicContact CG-CB 4.29Å; W204-N211 HydrophobicContact CH2-CB 4.47Å; W204-N211 VanDerWaalsContact CH2-ND2 3.3Å; W204-N211 WeakPolarHBondContact CH2-ND2 3.38Å; W204-N211 HydrophobicContact CZ2-CB 4.34Å; W204-N211 VanDerWaalsContact CZ2-ND2 3.31Å; W204-N211 WeakPolarHBondContact CZ2-ND2 3.25Å; W204-N211 HydrophobicContact CZ3-CB 4.34Å; W204-Y216 AromaticContact CH2-CD1 3.84Å; W204-Y216 HydrophobicContact CH2-CD1 3.84Å; W204-Y216 AromaticContact CH2-CE1 3.7Å; W204-Y216 HydrophobicContact CH2-CE1 3.7Å; W204-Y216 HydrophobicContact CZ3-CD1 4.41Å; W204-Y216 AromaticContact CZ3-CE1 3.85Å; W204-Y216 HydrophobicContact CZ3-CE1 3.85Å; W204-Q237 VanDerWaalsContact CH2-OE1 3.25Å; W204-W238 AromaticContact CH2-CD1 3.91Å; W204-W238 AromaticContact CZ3-CD1 3.85Å
205	D	94.4	Very high	93.2	Very high	63 Å²	63	67.2 Å²	67.2	34%	0.337	35%	0.353	S	S	.	.			trans	-67.2	165.5	165.7	78.5	18.1	0	0	0	112.7	G207 H208 K209 T210	D205-G207 PolarHBondContact O-N 2.91Å; D205-G207 VanDerWaalsContact O-N 3.07Å; D205-G207 VanDerWaalsContact OD1-C 3.28Å; D205-G207 WeakPolarHBondContact OD1-CA 3.49Å; D205-G207 PolarHBondContact OD1-N 3.22Å; D205-H208 PolarHBondContact O-N 2.8Å; D205-H208 WeakPolarHBondContact OD1-CA 3.41Å; D205-H208 PolarHBondContact OD1-N 3.14Å; D205-K209 PolarHBondContact OD1-N 2.66Å; D205-T210 PolarHBondContact N-O 2.98Å; D205-T210 PolarHBondContact OD2-N 2.88Å; D205-T210 PolarHBondContact OD2-OG1 3.18Å
206	Q	90.9	Very high	93.4	Very high	197 Å²	197	65.6 Å²	65.6	92%	0.921	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-18.5	-179	-177.5	58.4	94.2	0	0	113.8
207	G	89.2	Confident	93.8	Very high	39 Å²	39	61.9 Å²	61.9	40%	0.402	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-4	177.4	0	0	0	0	0	114.4	D205 K209	D205-G207 PolarHBondContact O-N 2.91Å; D205-G207 VanDerWaalsContact O-N 3.07Å; D205-G207 VanDerWaalsContact OD1-C 3.28Å; D205-G207 WeakPolarHBondContact OD1-CA 3.49Å; D205-G207 PolarHBondContact OD1-N 3.22Å; G207-K209 VanDerWaalsContact C-N 3.32Å; G207-K209 WeakPolarHBondContact O-CG 3.16Å
208	H	94.3	Very high	94	Very high	42 Å²	42	60.3 Å²	60.3	19%	0.194	32%	0.316	C	S	.	.	S	Bend	trans	50.9	47.8	-166.8	-151.4	97.6	0	0	0	112.4	W204 D205 Q231 R236 W238	W204-H208 AromaticContact CD1-CE1 3.41Å; W204-H208 VanDerWaalsContact CD1-CE1 3.41Å; W204-H208 AromaticContact CD1-ND1 3.89Å; W204-H208 AromaticContact CD2-CD2 3.83Å; W204-H208 AromaticContact CD2-CE1 3.48Å; W204-H208 VanDerWaalsContact CD2-CE1 3.48Å; W204-H208 AromaticContact CD2-CG 3.97Å; W204-H208 AromaticContact CD2-ND1 3.74Å; W204-H208 AromaticContact CD2-NE2 3.56Å; W204-H208 AromaticContact CE2-CE1 3.56Å; W204-H208 AromaticContact CE2-NE2 3.46Å; W204-H208 AromaticContact CE3-CD2 3.79Å; W204-H208 AromaticContact CE3-NE2 3.98Å; W204-H208 AromaticContact CG-CE1 3.42Å; W204-H208 VanDerWaalsContact CG-CE1 3.42Å; W204-H208 AromaticContact CG-ND1 3.5Å; W204-H208 AromaticContact CZ2-NE2 3.84Å; W204-H208 AromaticContact NE1-CE1 3.47Å; W204-H208 PolarHBondContact NE1-CE1 3.4Å; W204-H208 AromaticContact NE1-NE2 3.79Å; D205-H208 PolarHBondContact O-N 2.8Å; D205-H208 WeakPolarHBondContact OD1-CA 3.41Å; D205-H208 PolarHBondContact OD1-N 3.14Å; H208-Q231 PolarHBondContact O-NE2 2.85Å; H208-Q231 VanDerWaalsContact O-NE2 3.09Å; H208-R236 VanDerWaalsContact CD2-CB 3.41Å; H208-R236 WeakPolarHBondContact CD2-CB 3.3Å; H208-R236 PolarHBondContact CD2-O 3.33Å; H208-R236 WeakPolarHBondContact NE2-CB 3.04Å; H208-R236 PolarHBondContact NE2-O 2.81Å; H208-W238 PolarHBondContact O-NE1 3.07Å
209	K	93.7	Very high	93.9	Very high	27 Å²	27	59.6 Å²	59.6	12%	0.117	31%	0.308	C	S	.	.	S	Bend	trans	-112.9	-34.7	-175.7	-49.8	-174.5	-172.3	-65.3	0	113	D205 G207 W225 F363 E372	D205-K209 PolarHBondContact OD1-N 2.66Å; G207-K209 VanDerWaalsContact C-N 3.32Å; G207-K209 WeakPolarHBondContact O-CG 3.16Å; K209-W225 HydrophobicContact CB-CD2 4.22Å; K209-W225 HydrophobicContact CB-CG 4.12Å; K209-W225 HydrophobicContact CD-CH2 4.25Å; K209-W225 HydrophobicContact CD-CZ2 3.79Å; K209-W225 VanDerWaalsContact O-CD1 3.29Å; K209-F363 HydrophobicContact CD-CZ 4.15Å; K209-E372 IonicContact NZ-OE1 3.96Å; K209-E372 PolarHBondContact NZ-OE1 2.56Å
210	T	95.6	Very high	93.9	Very high	50 Å²	50	58.4 Å²	58.4	31%	0.307	30%	0.302	S	S	.	.			trans	-135.3	157.9	168.4	62.8	0	0	0	0	111.6	W204 D205 Y216	W204-T210 CarbonylContact C-O 3.59Å; W204-T210 WeakPolarHBondContact CA-O 3.34Å; W204-T210 VanDerWaalsContact CE3-C 3.47Å; W204-T210 VanDerWaalsContact CE3-O 3.26Å; D205-T210 PolarHBondContact N-O 2.98Å; D205-T210 PolarHBondContact OD2-N 2.88Å; D205-T210 PolarHBondContact OD2-OG1 3.18Å; T210-Y216 WeakPolarHBondContact CA-OH 3.33Å; T210-Y216 WeakPolarHBondContact CB-OH 3.32Å
211	N	95.6	Very high	93.6	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.021	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-121	157	168.1	63.2	64.1	0	0	0	111.3	L202 V203 W204 Q213 Q214 C215 Y216	L202-N211 HydrophobicContact CB-CB 4.33Å; V203-N211 VanDerWaalsContact O-CA 3.23Å; V203-N211 WeakPolarHBondContact O-CA 3.41Å; V203-N211 WeakPolarHBondContact O-CB 3.27Å; W204-N211 HydrophobicContact CD2-CB 3.89Å; W204-N211 HydrophobicContact CE3-CB 4.04Å; W204-N211 HydrophobicContact CG-CB 4.29Å; W204-N211 HydrophobicContact CH2-CB 4.47Å; W204-N211 VanDerWaalsContact CH2-ND2 3.3Å; W204-N211 WeakPolarHBondContact CH2-ND2 3.38Å; W204-N211 HydrophobicContact CZ2-CB 4.34Å; W204-N211 VanDerWaalsContact CZ2-ND2 3.31Å; W204-N211 WeakPolarHBondContact CZ2-ND2 3.25Å; W204-N211 HydrophobicContact CZ3-CB 4.34Å; N211-Q213 VanDerWaalsContact C-N 3.3Å; N211-Q213 PolarHBondContact O-N 3.33Å; N211-Q213 PolarHBondContact OD1-N 2.86Å; N211-Q214 PolarHBondContact O-N 3.43Å; N211-Q214 PolarHBondContact O-NE2 3.37Å; N211-Q214 WeakPolarHBondContact OD1-CA 3.37Å; N211-Q214 PolarHBondContact OD1-N 2.85Å; N211-C215 PolarHBondContact ND2-O 2.91Å; N211-C215 PolarHBondContact OD1-N 2.95Å; N211-Y216 PolarHBondContact N-OH 3.26Å; N211-Y216 VanDerWaalsContact N-OH 3.07Å; N211-Y216 WeakPolarHBondContact ND2-CE1 3.39Å
212	I	92.4	Very high	93.5	Very high	130 Å²	130	44.7 Å²	44.7	67%	0.667	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-29.1	-175.5	72.2	-178.5	0	0	0	112.9	V203 Q214	V203-I212 HydrophobicContact CB-CD1 3.78Å; V203-I212 HydrophobicContact CB-CG1 3.96Å; V203-I212 HydrophobicContact CG1-CD1 4.27Å; V203-I212 HydrophobicContact CG2-CD1 4.08Å; V203-I212 PolarHBondContact O-N 2.86Å; I212-Q214 PolarHBondContact O-N 2.89Å
213	Q	92.3	Very high	93.4	Very high	73 Å²	73	44 Å²	44	34%	0.341	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-16.6	177.8	-66.7	91.7	-16.8	0	0	113.3	E201 L202 N211 C215	E201-Q213 PolarHBondContact O-NE2 3.09Å; L202-Q213 HydrophobicContact CD2-CB 4.04Å; L202-Q213 HydrophobicContact CD2-CG 4.2Å; N211-Q213 VanDerWaalsContact C-N 3.3Å; N211-Q213 PolarHBondContact O-N 3.33Å; N211-Q213 PolarHBondContact OD1-N 2.86Å; Q213-C215 HydrophobicContact CB-CB 4.12Å; Q213-C215 PolarHBondContact O-N 2.81Å
214	Q	92.7	Very high	93.4	Very high	76 Å²	76	42 Å²	42	36%	0.355	22%	0.224	S	C	.	.			trans	56.1	35.3	-170.2	-58.2	-71.8	-94.7	0	0	113.4	L88 N211 I212 Y216 G221 P222	L88-Q214 HydrophobicContact CD1-CB 4.23Å; N211-Q214 PolarHBondContact O-N 3.43Å; N211-Q214 PolarHBondContact O-NE2 3.37Å; N211-Q214 WeakPolarHBondContact OD1-CA 3.37Å; N211-Q214 PolarHBondContact OD1-N 2.85Å; I212-Q214 PolarHBondContact O-N 2.89Å; Q214-Y216 HydrophobicContact CB-CE2 4.27Å; Q214-Y216 PolarHBondContact NE2-OH 3.25Å; Q214-Y216 WeakPolarHBondContact O-CD2 3.43Å; Q214-G221 CarbonylContact O-C 3.57Å; Q214-P222 HydrophobicContact CB-CB 4.49Å; Q214-P222 WeakPolarHBondContact O-CA 3.33Å
215	C	94.6	Very high	93.3	Very high	17 Å²	17	40.3 Å²	40.3	12%	0.115	22%	0.218	C	C	.	.			trans	-106.4	119.6	-176.3	179.7	0	0	0	0	111.3	Y197 L202 N211 Q213 G220 Q237	Y197-C215 WeakPolarHBondContact CD1-SG 3.37Å; L202-C215 HydrophobicContact CD2-CB 3.82Å; N211-C215 PolarHBondContact ND2-O 2.91Å; N211-C215 PolarHBondContact OD1-N 2.95Å; Q213-C215 HydrophobicContact CB-CB 4.12Å; Q213-C215 PolarHBondContact O-N 2.81Å; C215-G220 PolarHBondContact SG-O 3.2Å; C215-G220 VanDerWaalsContact SG-O 3.39Å; C215-Q237 PolarHBondContact O-NE2 3.09Å
216	Y	96.9	Very high	93.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-140.4	168.3	-173.5	-50.1	-88.3	0	0	0	113.1	W204 T210 N211 Q214 G220 G221 M229 W238	W204-Y216 AromaticContact CH2-CD1 3.84Å; W204-Y216 HydrophobicContact CH2-CD1 3.84Å; W204-Y216 AromaticContact CH2-CE1 3.7Å; W204-Y216 HydrophobicContact CH2-CE1 3.7Å; W204-Y216 HydrophobicContact CZ3-CD1 4.41Å; W204-Y216 AromaticContact CZ3-CE1 3.85Å; W204-Y216 HydrophobicContact CZ3-CE1 3.85Å; T210-Y216 WeakPolarHBondContact CA-OH 3.33Å; T210-Y216 WeakPolarHBondContact CB-OH 3.32Å; N211-Y216 PolarHBondContact N-OH 3.26Å; N211-Y216 VanDerWaalsContact N-OH 3.07Å; N211-Y216 WeakPolarHBondContact ND2-CE1 3.39Å; Q214-Y216 HydrophobicContact CB-CE2 4.27Å; Q214-Y216 PolarHBondContact NE2-OH 3.25Å; Q214-Y216 WeakPolarHBondContact O-CD2 3.43Å; Y216-G220 CarbonylContact O-C 3.6Å; Y216-G220 WeakPolarHBondContact O-CA 3.25Å; Y216-G220 PolarHBondContact O-N 3.28Å; Y216-G221 WeakPolarHBondContact CB-O 3.47Å; Y216-G221 WeakPolarHBondContact CD2-O 3.35Å; Y216-G221 PolarHBondContact N-O 2.79Å; Y216-G221 PolarHBondContact O-N 3.44Å; Y216-M229 HydrophobicContact CG-CE 4.37Å; Y216-W238 HydrophobicContact CD1-CB 4.19Å
217	C	97.3	Very high	93.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	-167.3	173.7	-159.9	0	0	0	0	115	F195 Y197 C219 W238 F239 H240 C243	F195-C217 WeakPolarHBondContact CD1-O 3.47Å; Y197-C217 VanDerWaalsContact CE1-O 3.28Å; Y197-C217 WeakPolarHBondContact CE1-O 3.32Å; Y197-C217 PolarHBondContact OH-O 3.29Å; C217-C219 VanDerWaalsContact C-N 3.32Å; C217-W238 VanDerWaalsContact CA-O 3.22Å; C217-W238 WeakPolarHBondContact CA-O 3.48Å; C217-W238 PolarHBondContact N-O 2.95Å; C217-F239 HydrophobicContact CB-CB 4.45Å; C217-F239 HydrophobicContact CB-CD1 4.24Å; C217-F239 VanDerWaalsContact SG-CA 3.55Å; C217-F239 VanDerWaalsContact SG-CD1 3.58Å; C217-H240 WeakPolarHBondContact CB-ND1 3.42Å; C217-H240 PolarHBondContact SG-N 3.35Å; C217-C243 WeakPolarHBondContact SG-CB 3.45Å
218	Y	94.3	Very high	93.7	Very high	8 Å²	8	33.4 Å²	33.4	3%	0.031	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-27.9	173.7	-50.3	-67.2	0	0	0	112.2	H192 F195 P196 F239 C243 C262 S263 V264 E270	H192-Y218 HydrophobicContact CB-CD1 3.39Å; H192-Y218 HydrophobicContact CB-CD2 4.38Å; H192-Y218 HydrophobicContact CB-CE1 3.93Å; H192-Y218 HydrophobicContact CB-CG 3.65Å; H192-Y218 AromaticContact CD2-CD2 3.61Å; H192-Y218 AromaticContact CD2-CG 3.52Å; H192-Y218 AromaticContact CG-CG 3.77Å; F195-Y218 HydrophobicContact CE1-CD1 4.34Å; P196-Y218 WeakPolarHBondContact CD-O 3.45Å; P196-Y218 WeakPolarHBondContact CG-O 3.4Å; Y218-F239 HydrophobicContact CD1-CD1 4.15Å; Y218-F239 AromaticContact CD1-CE1 3.65Å; Y218-F239 HydrophobicContact CD1-CE1 3.65Å; Y218-F239 AromaticContact CD2-CD1 3.96Å; Y218-F239 HydrophobicContact CD2-CD1 3.96Å; Y218-F239 HydrophobicContact CD2-CE1 4.31Å; Y218-F239 AromaticContact CE1-CD1 3.93Å; Y218-F239 HydrophobicContact CE1-CD1 3.93Å; Y218-F239 AromaticContact CE1-CE1 3.44Å; Y218-F239 HydrophobicContact CE1-CE1 3.44Å; Y218-F239 VanDerWaalsContact CE1-CE1 3.44Å; Y218-F239 HydrophobicContact CE1-CZ 4.46Å; Y218-F239 AromaticContact CE2-CD1 3.72Å; Y218-F239 HydrophobicContact CE2-CD1 3.72Å; Y218-F239 HydrophobicContact CE2-CE1 4.13Å; Y218-F239 HydrophobicContact CG-CD1 4.17Å; Y218-F239 HydrophobicContact CG-CE1 4.09Å; Y218-F239 AromaticContact CZ-CD1 3.71Å; Y218-F239 AromaticContact CZ-CE1 3.71Å; Y218-C243 HydrophobicContact CD2-CB 4.42Å; Y218-C243 WeakPolarHBondContact CE2-O 3.43Å; Y218-C262 HydrophobicContact CE1-CB 3.93Å; Y218-C262 WeakPolarHBondContact OH-CA 3.39Å; Y218-C262 VanDerWaalsContact OH-CB 3.28Å; Y218-C262 WeakPolarHBondContact OH-CB 3.47Å; Y218-S263 PolarHBondContact OH-N 2.83Å; Y218-V264 HydrophobicContact CD1-CG2 4.22Å; Y218-V264 HydrophobicContact CE1-CG2 4.2Å; Y218-E270 VanDerWaalsContact CE2-OE1 3.26Å; Y218-E270 WeakPolarHBondContact CE2-OE1 3.36Å; Y218-E270 WeakPolarHBondContact OH-CG 3.34Å; Y218-E270 PolarHBondContact OH-OE1 2.91Å
219	C	90.7	Very high	93.9	Very high	25 Å²	25	31.8 Å²	31.8	17%	0.169	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-16.8	-176.6	61.1	0	0	0	0	114.5	R54 C217 G221	R54-C219 PolarHBondContact NH1-O 2.85Å; C217-C219 VanDerWaalsContact C-N 3.32Å; C219-G221 PolarHBondContact O-N 2.83Å; C219-G221 PolarHBondContact SG-N 2.86Å
220	G	90.8	Very high	94	Very high	13 Å²	13	30.8 Å²	30.8	13%	0.134	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.3	7.8	-173.5	0	0	0	0	0	114.8	C215 Y216	C215-G220 PolarHBondContact SG-O 3.2Å; C215-G220 VanDerWaalsContact SG-O 3.39Å; Y216-G220 CarbonylContact O-C 3.6Å; Y216-G220 WeakPolarHBondContact O-CA 3.25Å; Y216-G220 PolarHBondContact O-N 3.28Å
221	G	88.1	Confident	94.1	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-84	170	-176.2	0	0	0	0	0	115.2	R54 Q214 Y216 C219	R54-G221 VanDerWaalsContact CZ-CA 3.46Å; Q214-G221 CarbonylContact O-C 3.57Å; Y216-G221 WeakPolarHBondContact CB-O 3.47Å; Y216-G221 WeakPolarHBondContact CD2-O 3.35Å; Y216-G221 PolarHBondContact N-O 2.79Å; Y216-G221 PolarHBondContact O-N 3.44Å; C219-G221 PolarHBondContact O-N 2.83Å; C219-G221 PolarHBondContact SG-N 2.86Å
222	P	92.1	Very high	94.2	Very high	22 Å²	22	30.9 Å²	30.9	14%	0.143	16%	0.157	C	C	.	.			trans	-66.3	152.6	-179.5	27.7	-36.4	0	0	0	112.7	S56 D91 Q214 H240	S56-P222 CarbonylContact C-O 3.54Å; S56-P222 WeakPolarHBondContact CA-O 3.48Å; D91-P222 VanDerWaalsContact CG-CD 3.48Å; D91-P222 WeakPolarHBondContact OD1-CD 3.3Å; Q214-P222 HydrophobicContact CB-CB 4.49Å; Q214-P222 WeakPolarHBondContact O-CA 3.33Å; P222-H240 PolarHBondContact O-NE2 3Å
223	G	93.4	Very high	94.4	Very high	5 Å²	5	29.3 Å²	29.3	5%	0.052	15%	0.15	C	C	.	.			trans	-156.3	133	-175.9	0	0	0	0	0	113.1	M229	G223-M229 VanDerWaalsContact CA-SD 3.58Å
224	D	94.4	Very high	94.6	Very high	37 Å²	37	33.6 Å²	33.6	20%	0.198	16%	0.163	C	C	.	.			trans	-93.8	100.9	166.9	-98.1	-54.9	0	0	0	107	Y226 L227	D224-Y226 HydrophobicContact CB-CD1 4.41Å; D224-Y226 HydrophobicContact CB-CE1 3.8Å; D224-Y226 PolarHBondContact O-N 2.93Å; D224-Y226 WeakPolarHBondContact OD1-CE1 3.48Å; D224-Y226 PolarHBondContact OD1-OH 2.85Å; D224-Y226 PolarHBondContact OD2-OH 3.4Å; D224-L227 HydrophobicContact CB-CB 4.08Å; D224-L227 HydrophobicContact CB-CD1 3.77Å; D224-L227 HydrophobicContact CB-CG 3.87Å; D224-L227 PolarHBondContact O-N 3.02Å
225	W	95.1	Very high	94.7	Very high	18 Å²	18	32.2 Å²	32.2	7%	0.068	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-22.4	-171.2	70	-92.7	0	0	0	116.4	K209 W238 F363 P364 I385	K209-W225 HydrophobicContact CB-CD2 4.22Å; K209-W225 HydrophobicContact CB-CG 4.12Å; K209-W225 HydrophobicContact CD-CH2 4.25Å; K209-W225 HydrophobicContact CD-CZ2 3.79Å; K209-W225 VanDerWaalsContact O-CD1 3.29Å; W225-W238 HydrophobicContact CB-CD2 3.7Å; W225-W238 HydrophobicContact CB-CE3 3.79Å; W225-W238 HydrophobicContact CB-CG 4.27Å; W225-W238 HydrophobicContact CB-CH2 4.15Å; W225-W238 HydrophobicContact CB-CZ2 4.07Å; W225-W238 HydrophobicContact CB-CZ3 4.01Å; W225-W238 HydrophobicContact CD2-CH2 4.24Å; W225-W238 HydrophobicContact CD2-CZ2 4.37Å; W225-W238 AromaticContact CE3-CH2 3.52Å; W225-W238 HydrophobicContact CE3-CH2 3.52Å; W225-W238 HydrophobicContact CE3-CZ2 4.04Å; W225-W238 HydrophobicContact CE3-CZ3 4.03Å; W225-W238 HydrophobicContact CG-CZ2 4.42Å; W225-W238 HydrophobicContact CZ3-CH2 4.3Å; W225-W238 WeakPolarHBondContact O-CZ3 3.46Å; W225-F363 HydrophobicContact CH2-CD2 4.45Å; W225-F363 HydrophobicContact CH2-CE1 4.01Å; W225-F363 AromaticContact CH2-CE2 3.72Å; W225-F363 HydrophobicContact CH2-CE2 3.72Å; W225-F363 AromaticContact CH2-CZ 3.45Å; W225-F363 HydrophobicContact CH2-CZ 3.45Å; W225-F363 VanDerWaalsContact CH2-CZ 3.45Å; W225-F363 HydrophobicContact CZ2-CD2 4.47Å; W225-F363 AromaticContact CZ2-CE2 3.6Å; W225-F363 HydrophobicContact CZ2-CE2 3.6Å; W225-F363 AromaticContact CZ2-CZ 3.71Å; W225-F363 HydrophobicContact CZ2-CZ 3.71Å; W225-P364 HydrophobicContact CH2-CB 4.28Å; W225-P364 HydrophobicContact CH2-CG 3.62Å; W225-P364 HydrophobicContact CZ3-CB 4.21Å; W225-P364 HydrophobicContact CZ3-CG 3.76Å; W225-I385 HydrophobicContact CH2-CD1 4.36Å; W225-I385 HydrophobicContact CZ2-CD1 3.87Å
226	Y	93.9	Very high	94.8	Very high	32 Å²	32	38.8 Å²	38.8	13%	0.125	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-5.2	179.7	58.9	-83.6	0	0	0	113.4	D224 N253 G254 Y288 I385	D224-Y226 HydrophobicContact CB-CD1 4.41Å; D224-Y226 HydrophobicContact CB-CE1 3.8Å; D224-Y226 PolarHBondContact O-N 2.93Å; D224-Y226 WeakPolarHBondContact OD1-CE1 3.48Å; D224-Y226 PolarHBondContact OD1-OH 2.85Å; D224-Y226 PolarHBondContact OD2-OH 3.4Å; Y226-N253 CarbonylContact O-C 3.5Å; Y226-N253 WeakPolarHBondContact O-CA 3.42Å; Y226-G254 PolarHBondContact O-N 2.79Å; Y226-Y288 WeakPolarHBondContact CD2-OH 3.31Å; Y226-I385 HydrophobicContact CD1-CD1 4.03Å; Y226-I385 HydrophobicContact CD1-CG2 4.22Å; Y226-I385 HydrophobicContact CD2-CD1 4.34Å; Y226-I385 HydrophobicContact CD2-CG2 3.88Å; Y226-I385 HydrophobicContact CE1-CG2 3.92Å; Y226-I385 HydrophobicContact CE2-CG2 3.51Å; Y226-I385 HydrophobicContact CG-CD1 3.87Å; Y226-I385 HydrophobicContact CG-CG2 4.23Å
227	L	94.6	Very high	94.8	Very high	48 Å²	48	39 Å²	39	25%	0.251	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	86.1	175.2	-58.8	-176	0	0	0	108.9	D224 M229 N253 V292	D224-L227 HydrophobicContact CB-CB 4.08Å; D224-L227 HydrophobicContact CB-CD1 3.77Å; D224-L227 HydrophobicContact CB-CG 3.87Å; D224-L227 PolarHBondContact O-N 3.02Å; L227-M229 PolarHBondContact O-N 2.8Å; L227-N253 HydrophobicContact CD2-CB 4.44Å; L227-N253 WeakPolarHBondContact CD2-OD1 3.29Å; L227-V292 HydrophobicContact CD2-CG1 3.98Å
228	K	95.5	Very high	94.9	Very high	75 Å²	75	39 Å²	39	33%	0.326	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	45.7	174.1	-55.1	-177	166.2	-169.2	0	115.6	E241 L251	K228-E241 HydrophobicContact CB-CB 4.02Å; K228-E241 HydrophobicContact CD-CB 4.3Å; K228-E241 IonicContact NZ-OE1 3.57Å; K228-E241 IonicContact NZ-OE2 2.72Å; K228-E241 PolarHBondContact NZ-OE2 2.83Å; K228-E241 PolarHBondContact O-N 3.34Å; K228-L251 HydrophobicContact CB-CB 4.11Å; K228-L251 HydrophobicContact CG-CB 4.25Å
229	M	97.4	Very high	95.1	Very high	8 Å²	8	38.7 Å²	38.7	4%	0.039	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	144.5	169.3	-55.7	-172.3	82.5	0	0	111.3	Y216 G223 L227 W238 F239	Y216-M229 HydrophobicContact CG-CE 4.37Å; G223-M229 VanDerWaalsContact CA-SD 3.58Å; L227-M229 PolarHBondContact O-N 2.8Å; M229-W238 HydrophobicContact CB-CB 4.44Å; M229-W238 HydrophobicContact CB-CE3 3.88Å; M229-W238 HydrophobicContact CE-CB 3.84Å; M229-W238 HydrophobicContact SD-CB 4.32Å; M229-F239 CarbonylContact C-O 3.6Å; M229-F239 WeakPolarHBondContact CA-O 3.37Å; M229-F239 WeakPolarHBondContact CB-O 3.36Å
230	L	97.3	Very high	95.4	Very high	5 Å²	5	37.6 Å²	37.6	3%	0.026	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	142.5	169.1	-63	-172.8	0	0	0	111.1	W238 F239 L244 L247 L251 F258 F260 L272	L230-W238 CarbonylContact O-C 3.57Å; L230-W238 WeakPolarHBondContact O-CA 3.46Å; L230-F239 PolarHBondContact N-O 3.04Å; L230-F239 PolarHBondContact O-N 3.18Å; L230-L244 HydrophobicContact CB-CD1 4.21Å; L230-L244 HydrophobicContact CD1-CD1 3.91Å; L230-L244 HydrophobicContact CG-CD1 4Å; L230-L247 HydrophobicContact CD1-CD2 4.25Å; L230-L251 HydrophobicContact CD1-CD2 4.47Å; L230-L251 HydrophobicContact CD2-CD1 3.99Å; L230-L251 HydrophobicContact CD2-CD2 3.96Å; L230-L251 HydrophobicContact CG-CD1 3.83Å; L230-L251 HydrophobicContact CG-CD2 4.34Å; L230-F258 HydrophobicContact CD2-CB 4.4Å; L230-F258 HydrophobicContact CD2-CD2 3.61Å; L230-F258 HydrophobicContact CD2-CE2 4.11Å; L230-F258 HydrophobicContact CD2-CG 4.22Å; L230-F260 HydrophobicContact CB-CB 4.37Å; L230-F260 HydrophobicContact CB-CD1 3.89Å; L230-F260 HydrophobicContact CB-CG 4.14Å; L230-F260 HydrophobicContact CD1-CB 4.24Å; L230-F260 HydrophobicContact CD1-CD2 4.32Å; L230-F260 HydrophobicContact CD1-CG 4.14Å; L230-L272 HydrophobicContact CD1-CD1 3.53Å
231	Q	97.6	Very high	95.6	Very high	56 Å²	56	38.2 Å²	38.2	26%	0.262	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	128	174	-174.9	162.7	49.4	0	0	110.2	H208 N233 R236 W238	H208-Q231 PolarHBondContact O-NE2 2.85Å; H208-Q231 VanDerWaalsContact O-NE2 3.09Å; Q231-N233 PolarHBondContact O-N 3.29Å; Q231-R236 WeakPolarHBondContact CG-O 3.46Å; Q231-R236 PolarHBondContact NE2-O 3.39Å; Q231-W238 HydrophobicContact CB-CD2 3.91Å; Q231-W238 HydrophobicContact CB-CE3 3.86Å; Q231-W238 HydrophobicContact CB-CH2 3.87Å; Q231-W238 HydrophobicContact CB-CZ2 3.9Å; Q231-W238 HydrophobicContact CB-CZ3 3.86Å; Q231-W238 HydrophobicContact CG-CD2 4.36Å; Q231-W238 HydrophobicContact CG-CZ2 4.19Å
232	C	97.3	Very high	95.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-71.4	125.1	176.2	176.2	0	0	0	0	111.1	R234 C235 R236 Q237 F239 F260 C262	C232-R234 PolarHBondContact O-N 2.84Å; C232-R234 VanDerWaalsContact O-N 3.11Å; C232-R234 PolarHBondContact SG-N 3.07Å; C232-R234 VanDerWaalsContact SG-N 3.44Å; C232-C235 VanDerWaalsContact SG-SG 3.65Å; C232-R236 WeakPolarHBondContact O-CA 3.23Å; C232-R236 PolarHBondContact O-N 3.27Å; C232-Q237 PolarHBondContact N-O 3.42Å; C232-F239 HydrophobicContact CB-CD2 4.29Å; C232-F239 HydrophobicContact CB-CE2 3.69Å; C232-F260 HydrophobicContact CB-CD1 4.14Å; C232-F260 HydrophobicContact CB-CE1 4.18Å; C232-C262 HydrophobicContact CB-CB 4.39Å
233	N	95.8	Very high	95.9	Very high	97 Å²	97	41.8 Å²	41.8	52%	0.519	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-14.8	178.7	-73.9	92.1	0	0	0	114.3	Q231 I259 F260	Q231-N233 PolarHBondContact O-N 3.29Å; N233-I259 WeakPolarHBondContact OD1-CA 3.43Å; N233-F260 WeakPolarHBondContact CB-O 3.41Å; N233-F260 PolarHBondContact N-O 2.7Å; N233-F260 PolarHBondContact OD1-N 2.84Å; N233-F260 PolarHBondContact OD1-O 2.69Å
234	R	96.2	Very high	95.9	Very high	164 Å²	164	42.3 Å²	42.3	62%	0.619	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-68.9	177.1	-65	-172.5	-176.5	179.1	0.9	111.9	C232 V261 C265	C232-R234 PolarHBondContact O-N 2.84Å; C232-R234 VanDerWaalsContact O-N 3.11Å; C232-R234 PolarHBondContact SG-N 3.07Å; C232-R234 VanDerWaalsContact SG-N 3.44Å; R234-V261 HydrophobicContact CG-CG1 4.04Å; R234-V261 HydrophobicContact CG-CG2 4.32Å; R234-C265 HydrophobicContact CB-CB 3.84Å; R234-C265 WeakPolarHBondContact CD-O 3.45Å; R234-C265 HydrophobicContact CG-CB 4.41Å; R234-C265 PolarHBondContact NH1-O 3.41Å
235	C	96.1	Very high	95.6	Very high	47 Å²	47	45 Å²	45	32%	0.318	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-9.3	-176.7	61.4	0	0	0	0	115.6	C232 Q237 C265	C232-C235 VanDerWaalsContact SG-SG 3.65Å; C235-Q237 PolarHBondContact O-N 2.87Å; C235-C265 VanDerWaalsContact CB-SG 3.54Å
236	R	96.4	Very high	95.4	Very high	154 Å²	154	45.4 Å²	45.4	58%	0.581	21%	0.212	S	C	*	.			trans	63.1	-1.2	-176.7	-54.6	-178.5	179.7	-179.4	-0.5	117	H208 Q231 C232	H208-R236 VanDerWaalsContact CD2-CB 3.41Å; H208-R236 WeakPolarHBondContact CD2-CB 3.3Å; H208-R236 PolarHBondContact CD2-O 3.33Å; H208-R236 WeakPolarHBondContact NE2-CB 3.04Å; H208-R236 PolarHBondContact NE2-O 2.81Å; Q231-R236 WeakPolarHBondContact CG-O 3.46Å; Q231-R236 PolarHBondContact NE2-O 3.39Å; C232-R236 WeakPolarHBondContact O-CA 3.23Å; C232-R236 PolarHBondContact O-N 3.27Å
237	Q	97.6	Very high	95.3	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.019	22%	0.216	C	C	.	.			trans	-57.7	152.3	165.8	-178.3	56.9	-68.3	0	0	111.2	F195 Y197 W204 C215 C232 C235 F239	F195-Q237 HydrophobicContact CE1-CG 4.5Å; Y197-Q237 PolarHBondContact OH-NE2 3.04Å; W204-Q237 VanDerWaalsContact CH2-OE1 3.25Å; C215-Q237 PolarHBondContact O-NE2 3.09Å; C232-Q237 PolarHBondContact N-O 3.42Å; C235-Q237 PolarHBondContact O-N 2.87Å; Q237-F239 HydrophobicContact CB-CE2 3.78Å; Q237-F239 HydrophobicContact CB-CZ 4.08Å; Q237-F239 HydrophobicContact CG-CE2 3.86Å; Q237-F239 HydrophobicContact CG-CZ 3.9Å; Q237-F239 WeakPolarHBondContact O-CD2 3.35Å; Q237-F239 VanDerWaalsContact O-CE2 3.25Å; Q237-F239 WeakPolarHBondContact O-CE2 3.28Å
238	W	98.1	Very high	95	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	145.7	178.5	-67.3	84.8	0	0	0	111.5	W204 H208 Y216 C217 W225 M229 L230 Q231	W204-W238 AromaticContact CH2-CD1 3.91Å; W204-W238 AromaticContact CZ3-CD1 3.85Å; H208-W238 PolarHBondContact O-NE1 3.07Å; Y216-W238 HydrophobicContact CD1-CB 4.19Å; C217-W238 VanDerWaalsContact CA-O 3.22Å; C217-W238 WeakPolarHBondContact CA-O 3.48Å; C217-W238 PolarHBondContact N-O 2.95Å; W225-W238 HydrophobicContact CB-CD2 3.7Å; W225-W238 HydrophobicContact CB-CE3 3.79Å; W225-W238 HydrophobicContact CB-CG 4.27Å; W225-W238 HydrophobicContact CB-CH2 4.15Å; W225-W238 HydrophobicContact CB-CZ2 4.07Å; W225-W238 HydrophobicContact CB-CZ3 4.01Å; W225-W238 HydrophobicContact CD2-CH2 4.24Å; W225-W238 HydrophobicContact CD2-CZ2 4.37Å; W225-W238 AromaticContact CE3-CH2 3.52Å; W225-W238 HydrophobicContact CE3-CH2 3.52Å; W225-W238 HydrophobicContact CE3-CZ2 4.04Å; W225-W238 HydrophobicContact CE3-CZ3 4.03Å; W225-W238 HydrophobicContact CG-CZ2 4.42Å; W225-W238 HydrophobicContact CZ3-CH2 4.3Å; W225-W238 WeakPolarHBondContact O-CZ3 3.46Å; M229-W238 HydrophobicContact CB-CB 4.44Å; M229-W238 HydrophobicContact CB-CE3 3.88Å; M229-W238 HydrophobicContact CE-CB 3.84Å; M229-W238 HydrophobicContact SD-CB 4.32Å; L230-W238 CarbonylContact O-C 3.57Å; L230-W238 WeakPolarHBondContact O-CA 3.46Å; Q231-W238 HydrophobicContact CB-CD2 3.91Å; Q231-W238 HydrophobicContact CB-CE3 3.86Å; Q231-W238 HydrophobicContact CB-CH2 3.87Å; Q231-W238 HydrophobicContact CB-CZ2 3.9Å; Q231-W238 HydrophobicContact CB-CZ3 3.86Å; Q231-W238 HydrophobicContact CG-CD2 4.36Å; Q231-W238 HydrophobicContact CG-CZ2 4.19Å
239	F	97.9	Very high	94.7	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	132.6	-173.2	-62.9	-101.9	0	0	0	111.1	F195 C217 Y218 M229 L230 C232 Q237 L244 F260 C262	F195-F239 AromaticContact CE1-CE1 3.85Å; F195-F239 HydrophobicContact CE1-CE1 3.85Å; F195-F239 AromaticContact CE1-CZ 3.82Å; F195-F239 HydrophobicContact CE1-CZ 3.82Å; F195-F239 HydrophobicContact CZ-CE1 4.32Å; F195-F239 AromaticContact CZ-CZ 3.88Å; F195-F239 HydrophobicContact CZ-CZ 3.88Å; C217-F239 HydrophobicContact CB-CB 4.45Å; C217-F239 HydrophobicContact CB-CD1 4.24Å; C217-F239 VanDerWaalsContact SG-CA 3.55Å; C217-F239 VanDerWaalsContact SG-CD1 3.58Å; Y218-F239 HydrophobicContact CD1-CD1 4.15Å; Y218-F239 AromaticContact CD1-CE1 3.65Å; Y218-F239 HydrophobicContact CD1-CE1 3.65Å; Y218-F239 AromaticContact CD2-CD1 3.96Å; Y218-F239 HydrophobicContact CD2-CD1 3.96Å; Y218-F239 HydrophobicContact CD2-CE1 4.31Å; Y218-F239 AromaticContact CE1-CD1 3.93Å; Y218-F239 HydrophobicContact CE1-CD1 3.93Å; Y218-F239 AromaticContact CE1-CE1 3.44Å; Y218-F239 HydrophobicContact CE1-CE1 3.44Å; Y218-F239 VanDerWaalsContact CE1-CE1 3.44Å; Y218-F239 HydrophobicContact CE1-CZ 4.46Å; Y218-F239 AromaticContact CE2-CD1 3.72Å; Y218-F239 HydrophobicContact CE2-CD1 3.72Å; Y218-F239 HydrophobicContact CE2-CE1 4.13Å; Y218-F239 HydrophobicContact CG-CD1 4.17Å; Y218-F239 HydrophobicContact CG-CE1 4.09Å; Y218-F239 AromaticContact CZ-CD1 3.71Å; Y218-F239 AromaticContact CZ-CE1 3.71Å; M229-F239 CarbonylContact C-O 3.6Å; M229-F239 WeakPolarHBondContact CA-O 3.37Å; M229-F239 WeakPolarHBondContact CB-O 3.36Å; L230-F239 PolarHBondContact N-O 3.04Å; L230-F239 PolarHBondContact O-N 3.18Å; C232-F239 HydrophobicContact CB-CD2 4.29Å; C232-F239 HydrophobicContact CB-CE2 3.69Å; Q237-F239 HydrophobicContact CB-CE2 3.78Å; Q237-F239 HydrophobicContact CB-CZ 4.08Å; Q237-F239 HydrophobicContact CG-CE2 3.86Å; Q237-F239 HydrophobicContact CG-CZ 3.9Å; Q237-F239 WeakPolarHBondContact O-CD2 3.35Å; Q237-F239 VanDerWaalsContact O-CE2 3.25Å; Q237-F239 WeakPolarHBondContact O-CE2 3.28Å; F239-L244 HydrophobicContact CB-CD1 4.43Å; F239-L244 HydrophobicContact CB-CD2 3.84Å; F239-L244 HydrophobicContact CB-CG 4.27Å; F239-F260 HydrophobicContact CB-CE1 4.15Å; F239-F260 HydrophobicContact CD2-CD1 4.49Å; F239-F260 AromaticContact CD2-CE1 3.63Å; F239-F260 HydrophobicContact CD2-CE1 3.63Å; F239-F260 HydrophobicContact CD2-CZ 4.49Å; F239-F260 HydrophobicContact CE2-CE1 4.22Å; F239-F260 AromaticContact CG-CE1 3.87Å; F239-F260 HydrophobicContact CG-CE1 3.87Å; F239-F260 HydrophobicContact CG-CZ 4.36Å; F239-C262 HydrophobicContact CD1-CB 4.17Å; F239-C262 HydrophobicContact CD2-CB 4.4Å; F239-C262 HydrophobicContact CE1-CB 3.6Å; F239-C262 HydrophobicContact CE2-CB 3.84Å; F239-C262 HydrophobicContact CZ-CB 3.43Å; F239-C262 VanDerWaalsContact CZ-CB 3.43Å; F239-C262 WeakPolarHBondContact CZ-SG 3.46Å
240	H	96.9	Very high	94.5	Very high	2 Å²	2	53 Å²	53	1%	0.009	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	147.5	-177.9	-50.9	88.6	0	0	0	113.2	S56 D57 C217 P222 D242 C243 L244	S56-H240 PolarHBondContact O-CD2 3.06Å; S56-H240 VanDerWaalsContact O-CD2 3.29Å; D57-H240 WeakPolarHBondContact O-CB 3.45Å; C217-H240 WeakPolarHBondContact CB-ND1 3.42Å; C217-H240 PolarHBondContact SG-N 3.35Å; P222-H240 PolarHBondContact O-NE2 3Å; H240-D242 VanDerWaalsContact C-N 3.31Å; H240-D242 PolarHBondContact O-N 3.47Å; H240-C243 HydrophobicContact CB-CB 4.35Å; H240-C243 PolarHBondContact O-N 3.11Å; H240-C243 VanDerWaalsContact O-N 3.13Å; H240-L244 VanDerWaalsContact O-CG 3.28Å; H240-L244 WeakPolarHBondContact O-CG 3.46Å; H240-L244 PolarHBondContact O-N 2.95Å
241	E	95.9	Very high	94.4	Very high	27 Å²	27	53.1 Å²	53.1	13%	0.126	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-45.5	-53	171.1	170.8	173.1	-79.4	0	0	112.8	K228 C243 L244 L247 P250 L251	K228-E241 HydrophobicContact CB-CB 4.02Å; K228-E241 HydrophobicContact CD-CB 4.3Å; K228-E241 IonicContact NZ-OE1 3.57Å; K228-E241 IonicContact NZ-OE2 2.72Å; K228-E241 PolarHBondContact NZ-OE2 2.83Å; K228-E241 PolarHBondContact O-N 3.34Å; E241-C243 PolarHBondContact O-N 2.83Å; E241-C243 VanDerWaalsContact O-N 3.17Å; E241-L244 PolarHBondContact O-N 3.06Å; E241-L244 VanDerWaalsContact O-N 3.17Å; E241-L247 HydrophobicContact CB-CD1 4.25Å; E241-L247 HydrophobicContact CG-CD1 3.86Å; E241-P250 VanDerWaalsContact OE1-CA 3.32Å; E241-P250 WeakPolarHBondContact OE1-CA 3.21Å; E241-L251 HydrophobicContact CB-CD1 4.18Å; E241-L251 PolarHBondContact OE1-N 3.08Å
242	D	92.6	Very high	94.3	Very high	85 Å²	85	51 Å²	51	46%	0.455	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-74	-4.6	-172.6	-59.9	-89.4	0	0	0	114	L59 H240	L59-D242 HydrophobicContact CD2-CB 4.14Å; L59-D242 HydrophobicContact CG-CB 4.43Å; H240-D242 VanDerWaalsContact C-N 3.31Å; H240-D242 PolarHBondContact O-N 3.47Å
243	C	93.2	Very high	94.2	Very high	11 Å²	11	52.3 Å²	52.3	7%	0.074	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-106.6	1.5	174	-62	0	0	0	0	113.6	C217 Y218 H240 E241	C217-C243 WeakPolarHBondContact SG-CB 3.45Å; Y218-C243 HydrophobicContact CD2-CB 4.42Å; Y218-C243 WeakPolarHBondContact CE2-O 3.43Å; H240-C243 HydrophobicContact CB-CB 4.35Å; H240-C243 PolarHBondContact O-N 3.11Å; H240-C243 VanDerWaalsContact O-N 3.13Å; E241-C243 PolarHBondContact O-N 2.83Å; E241-C243 VanDerWaalsContact O-N 3.17Å
244	L	93.3	Very high	94.2	Very high	17 Å²	17	47.9 Å²	47.9	9%	0.089	24%	0.235	C	C	.	.			trans	-103.1	133.2	-177.6	-69.5	169	0	0	0	111.3	L230 F239 H240 E241 L247 F260 E270	L230-L244 HydrophobicContact CB-CD1 4.21Å; L230-L244 HydrophobicContact CD1-CD1 3.91Å; L230-L244 HydrophobicContact CG-CD1 4Å; F239-L244 HydrophobicContact CB-CD1 4.43Å; F239-L244 HydrophobicContact CB-CD2 3.84Å; F239-L244 HydrophobicContact CB-CG 4.27Å; H240-L244 VanDerWaalsContact O-CG 3.28Å; H240-L244 WeakPolarHBondContact O-CG 3.46Å; H240-L244 PolarHBondContact O-N 2.95Å; E241-L244 PolarHBondContact O-N 3.06Å; E241-L244 VanDerWaalsContact O-N 3.17Å; L244-L247 HydrophobicContact CB-CD1 3.82Å; L244-L247 HydrophobicContact CB-CG 3.91Å; L244-L247 HydrophobicContact CD1-CD1 4.04Å; L244-L247 HydrophobicContact CD1-CG 4.33Å; L244-F260 HydrophobicContact CD2-CE1 4.01Å; L244-F260 HydrophobicContact CD2-CE2 3.61Å; L244-F260 HydrophobicContact CD2-CZ 3.25Å; L244-E270 VanDerWaalsContact CD2-OE1 3.22Å; L244-E270 WeakPolarHBondContact CD2-OE1 3.1Å
245	H	89	Confident	94.2	Very high	94 Å²	94	40.5 Å²	40.5	44%	0.435	21%	0.208	S	C	.	.	S	Bend	trans	-97.7	-20	-177.4	-62.6	82.7	0	0	0	112.7	L247 E270	H245-L247 PolarHBondContact O-N 3.35Å; H245-E270 WeakPolarHBondContact CA-OE2 3.36Å; H245-E270 PolarHBondContact N-OE2 3.35Å
246	C	91.4	Very high	94.1	Very high	26 Å²	26	39.5 Å²	39.5	18%	0.176	20%	0.198	C	C	.	.	S	Bend	trans	-79.6	-3.8	179	56.5	0	0	0	0	115.9	Q248 E270 L272	C246-Q248 PolarHBondContact O-N 2.85Å; C246-E270 HydrophobicContact CB-CB 3.81Å; C246-E270 PolarHBondContact N-OE2 2.84Å; C246-E270 PolarHBondContact SG-OE2 2.87Å; C246-L272 HydrophobicContact CB-CB 3.87Å; C246-L272 HydrophobicContact CB-CD2 4.41Å
247	L	91.9	Very high	94.1	Very high	39 Å²	39	32.2 Å²	32.2	20%	0.204	17%	0.17	C	C	.	.			trans	-78.5	115.3	-173.3	-68.5	177.7	0	0	0	113.1	L230 E241 L244 H245 L251 L272	L230-L247 HydrophobicContact CD1-CD2 4.25Å; E241-L247 HydrophobicContact CB-CD1 4.25Å; E241-L247 HydrophobicContact CG-CD1 3.86Å; L244-L247 HydrophobicContact CB-CD1 3.82Å; L244-L247 HydrophobicContact CB-CG 3.91Å; L244-L247 HydrophobicContact CD1-CD1 4.04Å; L244-L247 HydrophobicContact CD1-CG 4.33Å; H245-L247 PolarHBondContact O-N 3.35Å; L247-L251 HydrophobicContact CD1-CD1 4.22Å; L247-L251 HydrophobicContact CD1-CG 4.14Å; L247-L251 HydrophobicContact CD2-CD1 4.43Å; L247-L251 HydrophobicContact CD2-CD2 3.77Å; L247-L251 HydrophobicContact CD2-CG 4.07Å; L247-L272 HydrophobicContact CD2-CD2 3.83Å
248	Q	86.7	Confident	94	Very high	189 Å²	189	32.8 Å²	32.8	88%	0.883	17%	0.173	S	C	*	.	S	Bend	trans	-81	-20.6	173.9	-61.1	178.3	27	0	0	113.4	C246	C246-Q248 PolarHBondContact O-N 2.85Å
249	A	89.8	Confident	93.9	Very high	23 Å²	23	35.6 Å²	35.6	19%	0.19	19%	0.187	C	C	.	.	S	Bend	trans	-154.1	152.3	179.2	0	0	0	0	0	110.3	L315	A249-L315 HydrophobicContact CB-CD2 4.06Å
250	P	92.6	Very high	93.8	Very high	70 Å²	70	35.7 Å²	35.7	46%	0.455	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-56.2	144.8	177.5	-27.4	35.4	0	0	0	114.2	E241	E241-P250 VanDerWaalsContact OE1-CA 3.32Å; E241-P250 WeakPolarHBondContact OE1-CA 3.21Å
251	L	95.1	Very high	93.9	Very high	9 Å²	9	36.1 Å²	36.1	5%	0.047	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-74.5	139.4	176.4	-62.5	177.9	0	0	0	111.2	K228 L230 E241 L247 F258	K228-L251 HydrophobicContact CB-CB 4.11Å; K228-L251 HydrophobicContact CG-CB 4.25Å; L230-L251 HydrophobicContact CD1-CD2 4.47Å; L230-L251 HydrophobicContact CD2-CD1 3.99Å; L230-L251 HydrophobicContact CD2-CD2 3.96Å; L230-L251 HydrophobicContact CG-CD1 3.83Å; L230-L251 HydrophobicContact CG-CD2 4.34Å; E241-L251 HydrophobicContact CB-CD1 4.18Å; E241-L251 PolarHBondContact OE1-N 3.08Å; L247-L251 HydrophobicContact CD1-CD1 4.22Å; L247-L251 HydrophobicContact CD1-CG 4.14Å; L247-L251 HydrophobicContact CD2-CD1 4.43Å; L247-L251 HydrophobicContact CD2-CD2 3.77Å; L247-L251 HydrophobicContact CD2-CG 4.07Å; L251-F258 HydrophobicContact CD2-CD2 4.42Å; L251-F258 HydrophobicContact CD2-CE2 3.53Å; L251-F258 HydrophobicContact CD2-CZ 3.73Å
252	L	95.9	Very high	93.9	Very high	12 Å²	12	34.8 Å²	34.8	6%	0.063	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-83.4	147.8	164.8	-66.6	174.1	0	0	0	109.4	G254 D255 L285 L316	L252-G254 PolarHBondContact O-N 3.09Å; L252-D255 HydrophobicContact CB-CB 4.09Å; L252-D255 WeakPolarHBondContact O-CB 3.34Å; L252-D255 PolarHBondContact O-N 2.73Å; L252-L285 HydrophobicContact CB-CD1 4.37Å; L252-L285 HydrophobicContact CB-CD2 4.38Å; L252-L285 HydrophobicContact CB-CG 4.44Å; L252-L285 HydrophobicContact CD1-CD2 3.97Å; L252-L285 HydrophobicContact CD1-CG 4.34Å; L252-L316 HydrophobicContact CD1-CD2 3.49Å; L252-L316 VanDerWaalsContact CD1-CD2 3.49Å; L252-L316 HydrophobicContact CD1-CG 4.01Å
253	N	96.2	Very high	94.1	Very high	26 Å²	26	30.8 Å²	30.8	14%	0.139	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	129.6	178.9	-56.6	-87.4	0	0	0	109.4	Y226 L227 D255 L285 Y288 N289	Y226-N253 CarbonylContact O-C 3.5Å; Y226-N253 WeakPolarHBondContact O-CA 3.42Å; L227-N253 HydrophobicContact CD2-CB 4.44Å; L227-N253 WeakPolarHBondContact CD2-OD1 3.29Å; N253-D255 PolarHBondContact O-N 2.78Å; N253-L285 WeakPolarHBondContact O-CD1 3.26Å; N253-Y288 HydrophobicContact CB-CD1 4.43Å; N253-Y288 HydrophobicContact CB-CE1 4.13Å; N253-Y288 WeakPolarHBondContact O-CD1 3.43Å; N253-N289 VanDerWaalsContact CB-OD1 3.28Å; N253-N289 WeakPolarHBondContact CB-OD1 3.07Å; N253-N289 PolarHBondContact N-OD1 2.9Å; N253-N289 PolarHBondContact ND2-OD1 2.83Å; N253-N289 PolarHBondContact O-ND2 3.02Å
254	G	94.4	Very high	94.2	Very high	5 Å²	5	32.2 Å²	32.2	5%	0.052	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	13.4	-177.7	0	0	0	0	0	115.4	Y226 L252 R256	Y226-G254 PolarHBondContact O-N 2.79Å; L252-G254 PolarHBondContact O-N 3.09Å; G254-R256 PolarHBondContact O-N 3.02Å
255	D	96.3	Very high	94.4	Very high	8 Å²	8	33 Å²	33	4%	0.043	18%	0.177	C	C	.	.			trans	-76.3	94.9	175.8	-163.8	-10.2	0	0	0	111.5	L252 N253 F257 R274 L285	L252-D255 HydrophobicContact CB-CB 4.09Å; L252-D255 WeakPolarHBondContact O-CB 3.34Å; L252-D255 PolarHBondContact O-N 2.73Å; N253-D255 PolarHBondContact O-N 2.78Å; D255-F257 WeakPolarHBondContact OD1-CB 3.45Å; D255-F257 PolarHBondContact OD1-N 3.29Å; D255-F257 VanDerWaalsContact OD1-N 3.07Å; D255-R274 IonicContact OD1-CZ 2.68Å; D255-R274 IonicContact OD1-NH1 3.6Å; D255-R274 IonicContact OD1-NH2 3.94Å; D255-R274 IonicContact OD2-CZ 2.79Å; D255-R274 VanDerWaalsContact OD2-CZ 3.25Å; D255-R274 IonicContact OD2-NH1 3.12Å; D255-R274 PolarHBondContact OD2-NH1 2.84Å; D255-R274 IonicContact OD2-NH2 3.72Å; D255-R274 PolarHBondContact OD2-NH2 3.1Å; D255-L285 HydrophobicContact CB-CD1 3.87Å; D255-L285 HydrophobicContact CB-CD2 3.9Å; D255-L285 VanDerWaalsContact CG-CD2 3.5Å; D255-L285 WeakPolarHBondContact OD2-CD2 3.45Å
256	R	94.9	Very high	94.6	Very high	27 Å²	27	30.7 Å²	30.7	10%	0.102	17%	0.172	C	C	.	.			trans	-93.4	10.1	177.1	-63.4	-167.3	-68.8	169.7	-10.9	113.5	G254 F258 P365 P367 E372	G254-R256 PolarHBondContact O-N 3.02Å; R256-F258 PolarHBondContact O-N 2.77Å; R256-P365 PolarHBondContact NE-O 2.95Å; R256-P365 PolarHBondContact NH2-O 3.24Å; R256-P367 HydrophobicContact CB-CG 4.29Å; R256-P367 WeakPolarHBondContact O-CG 3.44Å; R256-E372 IonicContact CZ-OE1 2.83Å; R256-E372 IonicContact NH1-OE1 3.25Å; R256-E372 PolarHBondContact NH1-OE1 2.98Å; R256-E372 IonicContact NH2-OE1 3.74Å; R256-E372 PolarHBondContact NH2-OE1 3.1Å
257	F	96.4	Very high	94.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.194	C	C	.	.			trans	-82	55.3	-176.6	-70.5	-91.1	0	0	0	112.7	D255 R274 L275 L277 D281 P365 P367	D255-F257 WeakPolarHBondContact OD1-CB 3.45Å; D255-F257 PolarHBondContact OD1-N 3.29Å; D255-F257 VanDerWaalsContact OD1-N 3.07Å; F257-R274 WeakPolarHBondContact O-CD 3.45Å; F257-L275 HydrophobicContact CB-CB 4.14Å; F257-L275 HydrophobicContact CD1-CB 4.33Å; F257-L275 PolarHBondContact O-N 3.35Å; F257-L277 HydrophobicContact CB-CD1 3.89Å; F257-L277 HydrophobicContact CB-CD2 4.45Å; F257-L277 HydrophobicContact CB-CG 4.06Å; F257-L277 HydrophobicContact CD1-CD1 4.47Å; F257-L277 HydrophobicContact CD1-CG 3.88Å; F257-L277 HydrophobicContact CD2-CD2 3.89Å; F257-L277 HydrophobicContact CD2-CG 4.07Å; F257-L277 HydrophobicContact CE1-CG 4.38Å; F257-L277 HydrophobicContact CE2-CD2 4.3Å; F257-L277 HydrophobicContact CG-CD1 4.14Å; F257-L277 HydrophobicContact CG-CD2 4.05Å; F257-L277 HydrophobicContact CG-CG 3.72Å; F257-D281 HydrophobicContact CE1-CB 4.14Å; F257-D281 HydrophobicContact CE2-CB 4.03Å; F257-D281 HydrophobicContact CZ-CB 3.56Å; F257-P365 HydrophobicContact CE2-CB 3.81Å; F257-P365 HydrophobicContact CE2-CG 3.82Å; F257-P365 HydrophobicContact CZ-CB 4.26Å; F257-P367 HydrophobicContact CD1-CG 4.45Å
258	F	95.3	Very high	94.5	Very high	17 Å²	17	31 Å²	31	8%	0.075	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	153	177.6	-64.8	-83.9	0	0	0	111.5	L230 L251 R256 L272 D273	L230-F258 HydrophobicContact CD2-CB 4.4Å; L230-F258 HydrophobicContact CD2-CD2 3.61Å; L230-F258 HydrophobicContact CD2-CE2 4.11Å; L230-F258 HydrophobicContact CD2-CG 4.22Å; L251-F258 HydrophobicContact CD2-CD2 4.42Å; L251-F258 HydrophobicContact CD2-CE2 3.53Å; L251-F258 HydrophobicContact CD2-CZ 3.73Å; R256-F258 PolarHBondContact O-N 2.77Å; F258-L272 HydrophobicContact CB-CD1 3.89Å; F258-L272 HydrophobicContact CD1-CD1 3.62Å; F258-L272 HydrophobicContact CD1-CD2 4.22Å; F258-L272 HydrophobicContact CD1-CG 3.95Å; F258-L272 HydrophobicContact CE1-CD1 4.35Å; F258-L272 HydrophobicContact CE1-CD2 4.18Å; F258-L272 HydrophobicContact CE1-CG 4.39Å; F258-L272 HydrophobicContact CG-CD1 3.97Å; F258-D273 CarbonylContact C-O 3.51Å; F258-D273 VanDerWaalsContact CA-O 3.24Å; F258-D273 WeakPolarHBondContact CA-O 3.29Å
259	I	95.4	Very high	94.7	Very high	60 Å²	60	26 Å²	26	31%	0.308	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	120.9	156.2	-56.9	175.5	0	0	0	105.8	N233 F271 L272 D273 L275	N233-I259 WeakPolarHBondContact OD1-CA 3.43Å; I259-F271 HydrophobicContact CB-CE1 4.43Å; I259-F271 HydrophobicContact CG2-CE1 4.08Å; I259-L272 CarbonylContact O-C 3.37Å; I259-L272 WeakPolarHBondContact O-CA 3.5Å; I259-D273 HydrophobicContact CB-CB 4.42Å; I259-D273 PolarHBondContact N-O 2.79Å; I259-D273 PolarHBondContact O-N 3.46Å; I259-L275 HydrophobicContact CD1-CD2 3.89Å; I259-L275 HydrophobicContact CG1-CD1 4.41Å; I259-L275 HydrophobicContact CG1-CD2 3.73Å; I259-L275 HydrophobicContact CG1-CG 4.1Å
260	F	97.2	Very high	95	Very high	2 Å²	2	26 Å²	26	1%	0.009	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	137.4	-176.6	173.5	-115.8	0	0	0	111.7	L230 C232 N233 F239 L244 C262 E270 F271 L272	L230-F260 HydrophobicContact CB-CB 4.37Å; L230-F260 HydrophobicContact CB-CD1 3.89Å; L230-F260 HydrophobicContact CB-CG 4.14Å; L230-F260 HydrophobicContact CD1-CB 4.24Å; L230-F260 HydrophobicContact CD1-CD2 4.32Å; L230-F260 HydrophobicContact CD1-CG 4.14Å; C232-F260 HydrophobicContact CB-CD1 4.14Å; C232-F260 HydrophobicContact CB-CE1 4.18Å; N233-F260 WeakPolarHBondContact CB-O 3.41Å; N233-F260 PolarHBondContact N-O 2.7Å; N233-F260 PolarHBondContact OD1-N 2.84Å; N233-F260 PolarHBondContact OD1-O 2.69Å; F239-F260 HydrophobicContact CB-CE1 4.15Å; F239-F260 HydrophobicContact CD2-CD1 4.49Å; F239-F260 AromaticContact CD2-CE1 3.63Å; F239-F260 HydrophobicContact CD2-CE1 3.63Å; F239-F260 HydrophobicContact CD2-CZ 4.49Å; F239-F260 HydrophobicContact CE2-CE1 4.22Å; F239-F260 AromaticContact CG-CE1 3.87Å; F239-F260 HydrophobicContact CG-CE1 3.87Å; F239-F260 HydrophobicContact CG-CZ 4.36Å; L244-F260 HydrophobicContact CD2-CE1 4.01Å; L244-F260 HydrophobicContact CD2-CE2 3.61Å; L244-F260 HydrophobicContact CD2-CZ 3.25Å; F260-C262 HydrophobicContact CE1-CB 3.88Å; F260-C262 HydrophobicContact CZ-CB 3.73Å; F260-E270 HydrophobicContact CE2-CB 4.16Å; F260-E270 HydrophobicContact CE2-CG 4.29Å; F260-F271 CarbonylContact C-O 3.53Å; F260-F271 WeakPolarHBondContact CA-O 3.28Å; F260-F271 WeakPolarHBondContact CD2-O 3.48Å; F260-L272 HydrophobicContact CB-CD1 4Å; F260-L272 HydrophobicContact CD2-CD1 4.06Å; F260-L272 HydrophobicContact CG-CD1 4.43Å
261	V	97.6	Very high	95.2	Very high	11 Å²	11	27.9 Å²	27.9	7%	0.067	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	119	169	-173.5	0	0	0	0	109.2	R234 C265 E270 F271	R234-V261 HydrophobicContact CG-CG1 4.04Å; R234-V261 HydrophobicContact CG-CG2 4.32Å; V261-C265 HydrophobicContact CG1-CB 3.84Å; V261-E270 WeakPolarHBondContact O-CA 3.23Å; V261-F271 HydrophobicContact CB-CB 4.19Å; V261-F271 HydrophobicContact CG2-CD1 4.46Å; V261-F271 PolarHBondContact N-O 3.42Å; V261-F271 PolarHBondContact O-N 3.43Å
262	C	97.3	Very high	95.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.179	C	C	.	.			trans	-70.5	159.3	177.7	65.7	0	0	0	0	113.1	Y218 C232 F239 F260 V264 C265 S266	Y218-C262 HydrophobicContact CE1-CB 3.93Å; Y218-C262 WeakPolarHBondContact OH-CA 3.39Å; Y218-C262 VanDerWaalsContact OH-CB 3.28Å; Y218-C262 WeakPolarHBondContact OH-CB 3.47Å; C232-C262 HydrophobicContact CB-CB 4.39Å; F239-C262 HydrophobicContact CD1-CB 4.17Å; F239-C262 HydrophobicContact CD2-CB 4.4Å; F239-C262 HydrophobicContact CE1-CB 3.6Å; F239-C262 HydrophobicContact CE2-CB 3.84Å; F239-C262 HydrophobicContact CZ-CB 3.43Å; F239-C262 VanDerWaalsContact CZ-CB 3.43Å; F239-C262 WeakPolarHBondContact CZ-SG 3.46Å; F260-C262 HydrophobicContact CE1-CB 3.88Å; F260-C262 HydrophobicContact CZ-CB 3.73Å; C262-V264 PolarHBondContact O-N 3.06Å; C262-C265 CarbonylContact O-C 3.58Å; C262-C265 PolarHBondContact O-N 2.97Å; C262-S266 PolarHBondContact O-N 2.92Å; C262-S266 PolarHBondContact O-OG 3.43Å
263	S	96	Very high	95.1	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.007	20%	0.197	C	C	.	.	H	α-helix	trans	-54.8	-45	-177.5	-77.8	0	0	0	0	114.4	H192 Y218 C265 S266 G267 G268	H192-S263 CarbonylContact O-C 3.44Å; H192-S263 WeakPolarHBondContact O-CB 3.29Å; Y218-S263 PolarHBondContact OH-N 2.83Å; S263-C265 PolarHBondContact O-N 3.35Å; S263-S266 WeakPolarHBondContact CA-OG 3.43Å; S263-S266 PolarHBondContact O-N 3.13Å; S263-S266 PolarHBondContact O-OG 2.85Å; S263-G267 PolarHBondContact O-N 3.06Å; S263-G268 VanDerWaalsContact CA-O 3.26Å; S263-G268 WeakPolarHBondContact CA-O 3.48Å; S263-G268 WeakPolarHBondContact CB-O 3.45Å; S263-G268 PolarHBondContact O-N 3.43Å; S263-G268 PolarHBondContact OG-O 2.98Å
264	V	95.6	Very high	95	Very high	41 Å²	41	33.6 Å²	33.6	25%	0.248	20%	0.198	C	C	.	.	H	α-helix	trans	-54.3	-38.9	174.5	-175.4	0	0	0	0	111.8	H192 F195 Y218 C262	H192-V264 WeakPolarHBondContact O-CG2 3.33Å; H192-V264 PolarHBondContact O-N 3.2Å; H192-V264 VanDerWaalsContact O-N 3.13Å; F195-V264 HydrophobicContact CD1-CG2 4.28Å; F195-V264 HydrophobicContact CD2-CG1 4Å; F195-V264 HydrophobicContact CD2-CG2 4.14Å; F195-V264 HydrophobicContact CE1-CG2 4.01Å; F195-V264 HydrophobicContact CE2-CB 3.92Å; F195-V264 HydrophobicContact CE2-CG1 3.63Å; F195-V264 HydrophobicContact CE2-CG2 3.87Å; F195-V264 HydrophobicContact CG-CG2 4.35Å; F195-V264 HydrophobicContact CZ-CB 4.03Å; F195-V264 HydrophobicContact CZ-CG1 4.27Å; F195-V264 HydrophobicContact CZ-CG2 3.8Å; Y218-V264 HydrophobicContact CD1-CG2 4.22Å; Y218-V264 HydrophobicContact CE1-CG2 4.2Å; C262-V264 PolarHBondContact O-N 3.06Å
265	C	96.6	Very high	95	Very high	33 Å²	33	35.2 Å²	35.2	22%	0.223	21%	0.205	C	C	.	.	H	α-helix	trans	-91.1	-15.2	-177.5	-75.4	0	0	0	0	114.5	R234 C235 V261 C262 S263	R234-C265 HydrophobicContact CB-CB 3.84Å; R234-C265 WeakPolarHBondContact CD-O 3.45Å; R234-C265 HydrophobicContact CG-CB 4.41Å; R234-C265 PolarHBondContact NH1-O 3.41Å; C235-C265 VanDerWaalsContact CB-SG 3.54Å; V261-C265 HydrophobicContact CG1-CB 3.84Å; C262-C265 CarbonylContact O-C 3.58Å; C262-C265 PolarHBondContact O-N 2.97Å; S263-C265 PolarHBondContact O-N 3.35Å
266	S	94.2	Very high	94.9	Very high	45 Å²	45	40.2 Å²	40.2	32%	0.315	24%	0.237	S	C	.	.	H	α-helix	trans	-91.7	-25.2	171.6	65.1	0	0	0	0	112.8	C262 S263 G268 P269	C262-S266 PolarHBondContact O-N 2.92Å; C262-S266 PolarHBondContact O-OG 3.43Å; S263-S266 WeakPolarHBondContact CA-OG 3.43Å; S263-S266 PolarHBondContact O-N 3.13Å; S263-S266 PolarHBondContact O-OG 2.85Å; S266-G268 PolarHBondContact OG-N 2.88Å; S266-G268 PolarHBondContact OG-O 2.77Å; S266-P269 WeakPolarHBondContact CB-O 3.36Å; S266-P269 PolarHBondContact OG-O 2.86Å
267	G	91.1	Very high	94.9	Very high	62 Å²	62	39.3 Å²	39.3	64%	0.639	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.6	27.1	-171.1	0	0	0	0	0	113	S263	S263-G267 PolarHBondContact O-N 3.06Å
268	G	90.4	Very high	94.8	Very high	10 Å²	10	43.4 Å²	43.4	10%	0.103	26%	0.257	C	S	.	.	S	Bend	trans	168.3	-130.6	-175.3	0	0	0	0	0	112.2	S263 S266	S263-G268 VanDerWaalsContact CA-O 3.26Å; S263-G268 WeakPolarHBondContact CA-O 3.48Å; S263-G268 WeakPolarHBondContact CB-O 3.45Å; S263-G268 PolarHBondContact O-N 3.43Å; S263-G268 PolarHBondContact OG-O 2.98Å; S266-G268 PolarHBondContact OG-N 2.88Å; S266-G268 PolarHBondContact OG-O 2.77Å
269	P	91	Very high	94.8	Very high	84 Å²	84	44.4 Å²	44.4	55%	0.545	26%	0.26	S	S	.	.	S	Bend	trans	-64.9	151.9	179.7	27.5	-34.8	0	0	0	112.6	F191 S266	F191-P269 HydrophobicContact CE1-CB 3.91Å; F191-P269 HydrophobicContact CE2-CB 4.27Å; F191-P269 HydrophobicContact CZ-CB 3.72Å; S266-P269 WeakPolarHBondContact CB-O 3.36Å; S266-P269 PolarHBondContact OG-O 2.86Å
270	E	96.1	Very high	94.8	Very high	23 Å²	23	43.7 Å²	43.7	11%	0.107	26%	0.255	C	S	.	.			trans	-66	145.9	172.7	-63.7	179.4	148.9	0	0	111.7	Y218 L244 H245 C246 F260 V261	Y218-E270 VanDerWaalsContact CE2-OE1 3.26Å; Y218-E270 WeakPolarHBondContact CE2-OE1 3.36Å; Y218-E270 WeakPolarHBondContact OH-CG 3.34Å; Y218-E270 PolarHBondContact OH-OE1 2.91Å; L244-E270 VanDerWaalsContact CD2-OE1 3.22Å; L244-E270 WeakPolarHBondContact CD2-OE1 3.1Å; H245-E270 WeakPolarHBondContact CA-OE2 3.36Å; H245-E270 PolarHBondContact N-OE2 3.35Å; C246-E270 HydrophobicContact CB-CB 3.81Å; C246-E270 PolarHBondContact N-OE2 2.84Å; C246-E270 PolarHBondContact SG-OE2 2.87Å; F260-E270 HydrophobicContact CE2-CB 4.16Å; F260-E270 HydrophobicContact CE2-CG 4.29Å; V261-E270 WeakPolarHBondContact O-CA 3.23Å
271	F	95.3	Very high	94.8	Very high	110 Å²	110	44 Å²	44	48%	0.482	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.9	168.8	175.7	-90	0	0	0	110	I259 F260 V261 D273	I259-F271 HydrophobicContact CB-CE1 4.43Å; I259-F271 HydrophobicContact CG2-CE1 4.08Å; F260-F271 CarbonylContact C-O 3.53Å; F260-F271 WeakPolarHBondContact CA-O 3.28Å; F260-F271 WeakPolarHBondContact CD2-O 3.48Å; V261-F271 HydrophobicContact CB-CB 4.19Å; V261-F271 HydrophobicContact CG2-CD1 4.46Å; V261-F271 PolarHBondContact N-O 3.42Å; V261-F271 PolarHBondContact O-N 3.43Å; F271-D273 HydrophobicContact CE1-CB 3.86Å; F271-D273 HydrophobicContact CZ-CB 3.79Å
272	L	96.1	Very high	94.8	Very high	44 Å²	44	43.5 Å²	43.5	23%	0.23	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	129.4	174.8	-172.7	70.9	0	0	0	110.2	L230 C246 L247 F258 I259 F260	L230-L272 HydrophobicContact CD1-CD1 3.53Å; C246-L272 HydrophobicContact CB-CB 3.87Å; C246-L272 HydrophobicContact CB-CD2 4.41Å; L247-L272 HydrophobicContact CD2-CD2 3.83Å; F258-L272 HydrophobicContact CB-CD1 3.89Å; F258-L272 HydrophobicContact CD1-CD1 3.62Å; F258-L272 HydrophobicContact CD1-CD2 4.22Å; F258-L272 HydrophobicContact CD1-CG 3.95Å; F258-L272 HydrophobicContact CE1-CD1 4.35Å; F258-L272 HydrophobicContact CE1-CD2 4.18Å; F258-L272 HydrophobicContact CE1-CG 4.39Å; F258-L272 HydrophobicContact CG-CD1 3.97Å; I259-L272 CarbonylContact O-C 3.37Å; I259-L272 WeakPolarHBondContact O-CA 3.5Å; F260-L272 HydrophobicContact CB-CD1 4Å; F260-L272 HydrophobicContact CD2-CD1 4.06Å; F260-L272 HydrophobicContact CG-CD1 4.43Å
273	D	94.3	Very high	94.8	Very high	82 Å²	82	43.5 Å²	43.5	44%	0.439	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	144.6	170.5	-176.2	26.7	0	0	0	110.5	F258 I259 F271	F258-D273 CarbonylContact C-O 3.51Å; F258-D273 VanDerWaalsContact CA-O 3.24Å; F258-D273 WeakPolarHBondContact CA-O 3.29Å; I259-D273 HydrophobicContact CB-CB 4.42Å; I259-D273 PolarHBondContact N-O 2.79Å; I259-D273 PolarHBondContact O-N 3.46Å; F271-D273 HydrophobicContact CE1-CB 3.86Å; F271-D273 HydrophobicContact CZ-CB 3.79Å
274	R	94.6	Very high	94.9	Very high	41 Å²	41	44.4 Å²	44.4	16%	0.155	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	114.5	-174.8	-179.3	71.6	-177.1	-174.7	1	109.9	D255 F257 L316 Q317	D255-R274 IonicContact OD1-CZ 2.68Å; D255-R274 IonicContact OD1-NH1 3.6Å; D255-R274 IonicContact OD1-NH2 3.94Å; D255-R274 IonicContact OD2-CZ 2.79Å; D255-R274 VanDerWaalsContact OD2-CZ 3.25Å; D255-R274 IonicContact OD2-NH1 3.12Å; D255-R274 PolarHBondContact OD2-NH1 2.84Å; D255-R274 IonicContact OD2-NH2 3.72Å; D255-R274 PolarHBondContact OD2-NH2 3.1Å; F257-R274 WeakPolarHBondContact O-CD 3.45Å; R274-L316 PolarHBondContact NH2-O 2.62Å; R274-Q317 HydrophobicContact CG-CB 3.93Å
275	L	93.8	Very high	95	Very high	39 Å²	39	42.5 Å²	42.5	20%	0.204	25%	0.246	C	C	.	.			trans	-68.8	144.2	174.2	-66.1	174.6	0	0	0	110.5	F257 I259 L277 P367	F257-L275 HydrophobicContact CB-CB 4.14Å; F257-L275 HydrophobicContact CD1-CB 4.33Å; F257-L275 PolarHBondContact O-N 3.35Å; I259-L275 HydrophobicContact CD1-CD2 3.89Å; I259-L275 HydrophobicContact CG1-CD1 4.41Å; I259-L275 HydrophobicContact CG1-CD2 3.73Å; I259-L275 HydrophobicContact CG1-CG 4.1Å; L275-L277 WeakPolarHBondContact O-CD1 3.39Å; L275-P367 HydrophobicContact CD1-CB 3.82Å; L275-P367 HydrophobicContact CD1-CG 3.98Å
276	P	93.7	Very high	95	Very high	112 Å²	112	40.9 Å²	40.9	73%	0.727	24%	0.235	S	C	*	.			trans	-67	144.7	175.3	28.8	-35	0	0	0	111.3
277	L	94.7	Very high	95.1	Very high	8 Å²	8	38.8 Å²	38.8	4%	0.042	22%	0.22	C	C	.	.			trans	-110.6	136.9	175.7	-67.7	88.8	0	0	0	109.9	F257 L275 D281 I282 L285 L318 L321	F257-L277 HydrophobicContact CB-CD1 3.89Å; F257-L277 HydrophobicContact CB-CD2 4.45Å; F257-L277 HydrophobicContact CB-CG 4.06Å; F257-L277 HydrophobicContact CD1-CD1 4.47Å; F257-L277 HydrophobicContact CD1-CG 3.88Å; F257-L277 HydrophobicContact CD2-CD2 3.89Å; F257-L277 HydrophobicContact CD2-CG 4.07Å; F257-L277 HydrophobicContact CE1-CG 4.38Å; F257-L277 HydrophobicContact CE2-CD2 4.3Å; F257-L277 HydrophobicContact CG-CD1 4.14Å; F257-L277 HydrophobicContact CG-CD2 4.05Å; F257-L277 HydrophobicContact CG-CG 3.72Å; L275-L277 WeakPolarHBondContact O-CD1 3.39Å; L277-D281 HydrophobicContact CB-CB 4.18Å; L277-D281 HydrophobicContact CD2-CB 4.31Å; L277-D281 HydrophobicContact CG-CB 4.45Å; L277-I282 HydrophobicContact CB-CG1 4.07Å; L277-I282 HydrophobicContact CD2-CG1 4.48Å; L277-L285 HydrophobicContact CD2-CD2 4.27Å; L277-L318 HydrophobicContact CB-CD2 4.37Å; L277-L321 VanDerWaalsContact O-CD1 3.31Å; L277-L321 WeakPolarHBondContact O-CD1 3.42Å
278	D	94.6	Very high	95.4	Very high	87 Å²	87	35.8 Å²	35.8	47%	0.465	19%	0.19	S	C	.	.			trans	-83.3	164.4	164.4	-63.7	-48.4	0	0	0	110.6	K280 D281 I282	D278-K280 HydrophobicContact CB-CD 4.44Å; D278-K280 HydrophobicContact CB-CG 3.64Å; D278-K280 PolarHBondContact O-N 3.47Å; D278-K280 VanDerWaalsContact O-N 3.11Å; D278-K280 WeakPolarHBondContact OD2-CE 3.33Å; D278-K280 IonicContact OD2-NZ 3.01Å; D278-K280 PolarHBondContact OD2-NZ 2.75Å; D278-D281 WeakPolarHBondContact CB-OD2 3.38Å; D278-D281 PolarHBondContact N-OD2 3.26Å; D278-D281 WeakPolarHBondContact O-CA 3.13Å; D278-D281 WeakPolarHBondContact O-CB 3.1Å; D278-D281 PolarHBondContact O-N 2.81Å; D278-I282 WeakPolarHBondContact O-CG1 3.32Å; D278-I282 PolarHBondContact O-N 2.93Å; D278-I282 VanDerWaalsContact O-N 3.08Å
279	W	96.3	Very high	95.6	Very high	38 Å²	38	35.4 Å²	35.4	14%	0.144	19%	0.185	C	C	.	.	H	α-helix	trans	-54.3	-32.3	174.6	-72.8	99.4	0	0	0	114.1	D281 I282 V283 W313 T324 R329 K332 V333 A336	W279-D281 VanDerWaalsContact C-N 3.31Å; W279-D281 PolarHBondContact O-N 2.77Å; W279-I282 HydrophobicContact CD2-CD1 4.33Å; W279-I282 HydrophobicContact CE3-CD1 4.13Å; W279-V283 WeakPolarHBondContact O-CB 3.43Å; W279-V283 VanDerWaalsContact O-CG2 3.25Å; W279-V283 WeakPolarHBondContact O-CG2 3.36Å; W279-V283 PolarHBondContact O-N 3.05Å; W279-V283 VanDerWaalsContact O-N 3.11Å; W279-W313 AromaticContact CH2-CH2 3.7Å; W279-W313 HydrophobicContact CH2-CH2 3.7Å; W279-W313 HydrophobicContact CH2-CZ3 4.26Å; W279-W313 HydrophobicContact CZ3-CH2 4.19Å; W279-W313 HydrophobicContact CZ3-CZ3 4.32Å; W279-T324 HydrophobicContact CH2-CG2 4.04Å; W279-T324 HydrophobicContact CZ2-CG2 3.92Å; W279-R329 HydrophobicContact CH2-CB 4.18Å; W279-R329 HydrophobicContact CH2-CG 4.12Å; W279-R329 HydrophobicContact CZ3-CB 4.38Å; W279-K332 HydrophobicContact CD2-CB 3.63Å; W279-K332 HydrophobicContact CE3-CB 3.82Å; W279-K332 HydrophobicContact CG-CB 4.19Å; W279-K332 HydrophobicContact CH2-CB 4.02Å; W279-K332 HydrophobicContact CZ2-CB 3.85Å; W279-K332 HydrophobicContact CZ2-CG 4.18Å; W279-K332 HydrophobicContact CZ3-CB 4.01Å; W279-V333 HydrophobicContact CE3-CG2 4.01Å; W279-V333 HydrophobicContact CZ3-CG2 3.96Å; W279-A336 HydrophobicContact CB-CB 3.96Å
280	K	95.5	Very high	95.8	Very high	45 Å²	45	31.6 Å²	31.6	20%	0.196	16%	0.16	C	C	.	.	H	α-helix	trans	-60.4	-38.9	171.2	50.4	159.4	175	69.5	0	112.6	D278 H284 M343	D278-K280 HydrophobicContact CB-CD 4.44Å; D278-K280 HydrophobicContact CB-CG 3.64Å; D278-K280 PolarHBondContact O-N 3.47Å; D278-K280 VanDerWaalsContact O-N 3.11Å; D278-K280 WeakPolarHBondContact OD2-CE 3.33Å; D278-K280 IonicContact OD2-NZ 3.01Å; D278-K280 PolarHBondContact OD2-NZ 2.75Å; K280-H284 WeakPolarHBondContact O-CB 3.33Å; K280-H284 PolarHBondContact O-N 2.98Å; K280-M343 HydrophobicContact CB-CE 4.34Å
281	D	96.4	Very high	95.7	Very high	9 Å²	9	30.7 Å²	30.7	5%	0.048	16%	0.156	C	C	.	.	H	α-helix	trans	-79.4	-40	-174	-50.3	-41.4	0	0	0	110.2	F257 L277 D278 W279 V283 H284 L285	F257-D281 HydrophobicContact CE1-CB 4.14Å; F257-D281 HydrophobicContact CE2-CB 4.03Å; F257-D281 HydrophobicContact CZ-CB 3.56Å; L277-D281 HydrophobicContact CB-CB 4.18Å; L277-D281 HydrophobicContact CD2-CB 4.31Å; L277-D281 HydrophobicContact CG-CB 4.45Å; D278-D281 WeakPolarHBondContact CB-OD2 3.38Å; D278-D281 PolarHBondContact N-OD2 3.26Å; D278-D281 WeakPolarHBondContact O-CA 3.13Å; D278-D281 WeakPolarHBondContact O-CB 3.1Å; D278-D281 PolarHBondContact O-N 2.81Å; W279-D281 VanDerWaalsContact C-N 3.31Å; W279-D281 PolarHBondContact O-N 2.77Å; D281-V283 VanDerWaalsContact C-N 3.33Å; D281-V283 PolarHBondContact O-N 2.71Å; D281-H284 PolarHBondContact O-N 3.35Å; D281-L285 VanDerWaalsContact O-CB 3.26Å; D281-L285 WeakPolarHBondContact O-CB 3.42Å; D281-L285 PolarHBondContact O-N 3.29Å
282	I	97.2	Very high	95.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-54.7	-49.9	170.3	-57.8	174.6	0	0	0	110.2	L277 D278 W279 C286 I309 L316 L318 L321	L277-I282 HydrophobicContact CB-CG1 4.07Å; L277-I282 HydrophobicContact CD2-CG1 4.48Å; D278-I282 WeakPolarHBondContact O-CG1 3.32Å; D278-I282 PolarHBondContact O-N 2.93Å; D278-I282 VanDerWaalsContact O-N 3.08Å; W279-I282 HydrophobicContact CD2-CD1 4.33Å; W279-I282 HydrophobicContact CE3-CD1 4.13Å; I282-C286 VanDerWaalsContact O-CB 3.3Å; I282-C286 WeakPolarHBondContact O-CB 3.44Å; I282-C286 PolarHBondContact O-N 3.07Å; I282-C286 PolarHBondContact O-SG 3.3Å; I282-I309 HydrophobicContact CG2-CG2 4.42Å; I282-L316 HydrophobicContact CG2-CD1 4.18Å; I282-L318 HydrophobicContact CD1-CD1 3.94Å; I282-L318 HydrophobicContact CD1-CD2 3.51Å; I282-L318 HydrophobicContact CD1-CG 4.35Å; I282-L318 HydrophobicContact CG1-CD2 3.63Å; I282-L321 HydrophobicContact CD1-CD1 4.02Å
283	V	97.6	Very high	95.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66.1	-41.2	-179.8	168.5	0	0	0	0	111.7	W279 D281 L287 L305 I309 V333 A336 L337 F344	W279-V283 WeakPolarHBondContact O-CB 3.43Å; W279-V283 VanDerWaalsContact O-CG2 3.25Å; W279-V283 WeakPolarHBondContact O-CG2 3.36Å; W279-V283 PolarHBondContact O-N 3.05Å; W279-V283 VanDerWaalsContact O-N 3.11Å; D281-V283 VanDerWaalsContact C-N 3.33Å; D281-V283 PolarHBondContact O-N 2.71Å; V283-L287 HydrophobicContact CG1-CD1 4.02Å; V283-L287 VanDerWaalsContact O-CB 3.31Å; V283-L287 WeakPolarHBondContact O-CB 3.13Å; V283-L287 WeakPolarHBondContact O-CG 3.46Å; V283-L287 PolarHBondContact O-N 3.14Å; V283-L305 HydrophobicContact CG1-CD2 4.33Å; V283-I309 HydrophobicContact CG2-CD1 4.49Å; V283-V333 HydrophobicContact CG2-CB 4.14Å; V283-V333 HydrophobicContact CG2-CG1 3.86Å; V283-V333 HydrophobicContact CG2-CG2 3.9Å; V283-A336 HydrophobicContact CG2-CB 4.33Å; V283-L337 HydrophobicContact CG1-CD2 3.42Å; V283-L337 VanDerWaalsContact CG1-CD2 3.42Å; V283-L337 HydrophobicContact CG1-CG 3.77Å; V283-F344 HydrophobicContact CB-CE2 4.44Å; V283-F344 HydrophobicContact CB-CZ 4.02Å; V283-F344 HydrophobicContact CG1-CD1 4.44Å; V283-F344 HydrophobicContact CG1-CD2 4.49Å; V283-F344 HydrophobicContact CG1-CE1 3.84Å; V283-F344 HydrophobicContact CG1-CE2 3.87Å; V283-F344 HydrophobicContact CG1-CZ 3.51Å
284	H	97.5	Very high	95.1	Very high	20 Å²	20	28.7 Å²	28.7	9%	0.093	15%	0.149	C	C	.	.	H	α-helix	trans	-62.6	-53.1	175.7	-168	152.8	0	0	0	110.9	K280 D281 C286 L287 Y288 M343 F344 L359 F363 P365	K280-H284 WeakPolarHBondContact O-CB 3.33Å; K280-H284 PolarHBondContact O-N 2.98Å; D281-H284 PolarHBondContact O-N 3.35Å; H284-C286 VanDerWaalsContact C-N 3.33Å; H284-C286 PolarHBondContact O-N 3.3Å; H284-L287 PolarHBondContact O-N 2.95Å; H284-Y288 WeakPolarHBondContact O-CB 3.48Å; H284-Y288 PolarHBondContact O-N 3.02Å; H284-M343 HydrophobicContact CB-CE 3.91Å; H284-M343 VanDerWaalsContact ND1-CE 3.33Å; H284-M343 WeakPolarHBondContact ND1-CE 3.41Å; H284-F344 HydrophobicContact CB-CE1 4.13Å; H284-F344 HydrophobicContact CB-CZ 4.15Å; H284-L359 HydrophobicContact CB-CD2 4.45Å; H284-F363 PolarHBondContact NE2-O 3.46Å; H284-P365 HydrophobicContact CB-CB 4.2Å
285	L	97.3	Very high	94.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59	-42.9	-178.7	-175.7	59.5	0	0	0	111.8	L252 N253 D255 L277 D281 Y288 N289 L316 P365	L252-L285 HydrophobicContact CB-CD1 4.37Å; L252-L285 HydrophobicContact CB-CD2 4.38Å; L252-L285 HydrophobicContact CB-CG 4.44Å; L252-L285 HydrophobicContact CD1-CD2 3.97Å; L252-L285 HydrophobicContact CD1-CG 4.34Å; N253-L285 WeakPolarHBondContact O-CD1 3.26Å; D255-L285 HydrophobicContact CB-CD1 3.87Å; D255-L285 HydrophobicContact CB-CD2 3.9Å; D255-L285 VanDerWaalsContact CG-CD2 3.5Å; D255-L285 WeakPolarHBondContact OD2-CD2 3.45Å; L277-L285 HydrophobicContact CD2-CD2 4.27Å; D281-L285 VanDerWaalsContact O-CB 3.26Å; D281-L285 WeakPolarHBondContact O-CB 3.42Å; D281-L285 PolarHBondContact O-N 3.29Å; L285-Y288 PolarHBondContact O-N 2.85Å; L285-N289 WeakPolarHBondContact O-CB 3.3Å; L285-N289 PolarHBondContact O-N 3.39Å; L285-N289 PolarHBondContact O-ND2 3.01Å; L285-L316 HydrophobicContact CD2-CD2 3.92Å; L285-P365 HydrophobicContact CB-CG 4.14Å; L285-P365 HydrophobicContact CD1-CG 4.15Å
286	C	97.6	Very high	94.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-70.3	-40.4	178.4	-68.3	0	0	0	0	112.8	I282 H284 Y288 L290 L305 Y308 I309	I282-C286 VanDerWaalsContact O-CB 3.3Å; I282-C286 WeakPolarHBondContact O-CB 3.44Å; I282-C286 PolarHBondContact O-N 3.07Å; I282-C286 PolarHBondContact O-SG 3.3Å; H284-C286 VanDerWaalsContact C-N 3.33Å; H284-C286 PolarHBondContact O-N 3.3Å; C286-Y288 VanDerWaalsContact C-N 3.32Å; C286-L290 WeakPolarHBondContact O-CB 3.37Å; C286-L290 WeakPolarHBondContact O-CG 3.36Å; C286-L290 PolarHBondContact O-N 2.86Å; C286-L305 HydrophobicContact CB-CD1 3.69Å; C286-Y308 HydrophobicContact CB-CD1 3.84Å; C286-Y308 HydrophobicContact CB-CE1 4.14Å; C286-I309 HydrophobicContact CB-CD1 4.39Å; C286-I309 HydrophobicContact CB-CG1 3.75Å; C286-I309 VanDerWaalsContact SG-CG1 3.59Å
287	L	96.4	Very high	93.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65.8	-34.5	172.1	-78.6	175.5	0	0	0	112.4	V283 H284 S291 F299 L305 L337 F344 L359	V283-L287 HydrophobicContact CG1-CD1 4.02Å; V283-L287 VanDerWaalsContact O-CB 3.31Å; V283-L287 WeakPolarHBondContact O-CB 3.13Å; V283-L287 WeakPolarHBondContact O-CG 3.46Å; V283-L287 PolarHBondContact O-N 3.14Å; H284-L287 PolarHBondContact O-N 2.95Å; L287-S291 WeakPolarHBondContact O-CB 3.33Å; L287-S291 PolarHBondContact O-N 2.72Å; L287-S291 PolarHBondContact O-OG 3.06Å; L287-F299 HydrophobicContact CD2-CB 4.09Å; L287-F299 HydrophobicContact CD2-CD2 4.07Å; L287-F299 HydrophobicContact CD2-CG 4.41Å; L287-L305 HydrophobicContact CD2-CD1 4.05Å; L287-L305 HydrophobicContact CD2-CD2 4.21Å; L287-L305 HydrophobicContact CG-CD1 3.98Å; L287-L305 HydrophobicContact CG-CD2 4.21Å; L287-L337 HydrophobicContact CD1-CD2 3.99Å; L287-F344 HydrophobicContact CD1-CD1 3.87Å; L287-F344 HydrophobicContact CD1-CE1 4.03Å; L287-L359 HydrophobicContact CB-CD2 3.84Å; L287-L359 HydrophobicContact CB-CG 4.14Å; L287-L359 HydrophobicContact CD1-CD2 4.18Å
288	Y	96.3	Very high	93.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.4	-52.8	175.1	-175.8	-96.6	0	0	0	110.6	Y226 N253 H284 L285 C286 L290 S291 V292 L359 F362 P364	Y226-Y288 WeakPolarHBondContact CD2-OH 3.31Å; N253-Y288 HydrophobicContact CB-CD1 4.43Å; N253-Y288 HydrophobicContact CB-CE1 4.13Å; N253-Y288 WeakPolarHBondContact O-CD1 3.43Å; H284-Y288 WeakPolarHBondContact O-CB 3.48Å; H284-Y288 PolarHBondContact O-N 3.02Å; L285-Y288 PolarHBondContact O-N 2.85Å; C286-Y288 VanDerWaalsContact C-N 3.32Å; Y288-L290 PolarHBondContact O-N 3.33Å; Y288-S291 WeakPolarHBondContact O-CA 3.41Å; Y288-S291 WeakPolarHBondContact O-CB 3.1Å; Y288-S291 PolarHBondContact O-N 3.07Å; Y288-V292 HydrophobicContact CD1-CG2 4.2Å; Y288-V292 HydrophobicContact CE1-CG2 3.71Å; Y288-V292 PolarHBondContact O-N 3.26Å; Y288-L359 HydrophobicContact CD2-CD1 4.03Å; Y288-F362 AromaticContact CD2-CD2 3.95Å; Y288-F362 HydrophobicContact CD2-CD2 3.95Å; Y288-F362 AromaticContact CD2-CE2 3.42Å; Y288-F362 HydrophobicContact CD2-CE2 3.42Å; Y288-F362 VanDerWaalsContact CD2-CE2 3.42Å; Y288-F362 AromaticContact CD2-CZ 3.98Å; Y288-F362 HydrophobicContact CD2-CZ 3.98Å; Y288-F362 AromaticContact CE2-CD2 3.96Å; Y288-F362 HydrophobicContact CE2-CD2 3.96Å; Y288-F362 HydrophobicContact CE2-CE1 4.04Å; Y288-F362 AromaticContact CE2-CE2 3.3Å; Y288-F362 HydrophobicContact CE2-CE2 3.3Å; Y288-F362 AromaticContact CE2-CZ 3.36Å; Y288-F362 HydrophobicContact CE2-CZ 3.36Å; Y288-F362 HydrophobicContact CG-CE2 4.3Å; Y288-F362 AromaticContact CZ-CZ 3.83Å; Y288-P364 HydrophobicContact CE1-CG 4.01Å; Y288-P364 HydrophobicContact CE2-CG 3.95Å
289	N	95.9	Very high	93.9	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-59	-46.6	177.6	-84.9	-89.8	0	0	0	112.4	N253 L285 S291 V292 I293 Y308	N253-N289 VanDerWaalsContact CB-OD1 3.28Å; N253-N289 WeakPolarHBondContact CB-OD1 3.07Å; N253-N289 PolarHBondContact N-OD1 2.9Å; N253-N289 PolarHBondContact ND2-OD1 2.83Å; N253-N289 PolarHBondContact O-ND2 3.02Å; L285-N289 WeakPolarHBondContact O-CB 3.3Å; L285-N289 PolarHBondContact O-N 3.39Å; L285-N289 PolarHBondContact O-ND2 3.01Å; N289-S291 PolarHBondContact O-N 3.19Å; N289-V292 PolarHBondContact O-N 3.01Å; N289-I293 HydrophobicContact CB-CD1 4.3Å; N289-I293 WeakPolarHBondContact O-CB 3.49Å; N289-I293 WeakPolarHBondContact O-CD1 3.4Å; N289-I293 VanDerWaalsContact O-CG1 3.24Å; N289-I293 WeakPolarHBondContact O-CG1 3.1Å; N289-I293 PolarHBondContact O-N 3.26Å; N289-Y308 HydrophobicContact CB-CE1 3.99Å; N289-Y308 VanDerWaalsContact CB-OH 3.31Å; N289-Y308 WeakPolarHBondContact CB-OH 3.33Å
290	L	95.6	Very high	93.9	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-58.3	-37	174.5	-78.7	171	0	0	0	112.5	C286 Y288 Q294 F299 L305 Y308	C286-L290 WeakPolarHBondContact O-CB 3.37Å; C286-L290 WeakPolarHBondContact O-CG 3.36Å; C286-L290 PolarHBondContact O-N 2.86Å; Y288-L290 PolarHBondContact O-N 3.33Å; L290-Q294 HydrophobicContact CD2-CG 4.48Å; L290-Q294 WeakPolarHBondContact O-CB 3.22Å; L290-Q294 PolarHBondContact O-N 2.87Å; L290-F299 HydrophobicContact CB-CD1 3.98Å; L290-F299 HydrophobicContact CB-CD2 4.29Å; L290-F299 HydrophobicContact CB-CE1 3.79Å; L290-F299 HydrophobicContact CB-CE2 4.12Å; L290-F299 HydrophobicContact CB-CG 4.24Å; L290-F299 HydrophobicContact CB-CZ 3.87Å; L290-F299 HydrophobicContact CD1-CD1 4.31Å; L290-F299 HydrophobicContact CD1-CG 4.38Å; L290-F299 WeakPolarHBondContact O-CZ 3.31Å; L290-L305 HydrophobicContact CD1-CB 4.43Å; L290-L305 HydrophobicContact CD1-CD1 3.95Å; L290-Y308 HydrophobicContact CD1-CD1 4.43Å; L290-Y308 HydrophobicContact CD1-CG 4.16Å; L290-Y308 HydrophobicContact CD2-CD2 3.73Å; L290-Y308 HydrophobicContact CD2-CE2 4.43Å; L290-Y308 HydrophobicContact CD2-CG 3.85Å; L290-Y308 HydrophobicContact CG-CD1 4.15Å; L290-Y308 HydrophobicContact CG-CD2 4.12Å; L290-Y308 HydrophobicContact CG-CG 3.85Å
291	S	92.9	Very high	94	Very high	4 Å²	4	27.4 Å²	27.4	3%	0.028	13%	0.126	C	C	.	.	H	α-helix	trans	-67.1	-44.3	177.2	-58.9	0	0	0	0	112.3	L287 Y288 N289 K295 K296 F299	L287-S291 WeakPolarHBondContact O-CB 3.33Å; L287-S291 PolarHBondContact O-N 2.72Å; L287-S291 PolarHBondContact O-OG 3.06Å; Y288-S291 WeakPolarHBondContact O-CA 3.41Å; Y288-S291 WeakPolarHBondContact O-CB 3.1Å; Y288-S291 PolarHBondContact O-N 3.07Å; N289-S291 PolarHBondContact O-N 3.19Å; S291-K295 WeakPolarHBondContact O-CA 3.4Å; S291-K295 PolarHBondContact O-N 2.87Å; S291-K296 WeakPolarHBondContact CA-O 3.28Å; S291-F299 WeakPolarHBondContact OG-CE2 3.48Å
292	V	90.8	Very high	93.9	Very high	30 Å²	30	32.4 Å²	32.4	18%	0.182	15%	0.15	C	C	.	.	H	α-helix	trans	-61.8	-59.5	174.5	174.4	0	0	0	0	110.3	L227 Y288 N289 K295 F362	L227-V292 HydrophobicContact CD2-CG1 3.98Å; Y288-V292 HydrophobicContact CD1-CG2 4.2Å; Y288-V292 HydrophobicContact CE1-CG2 3.71Å; Y288-V292 PolarHBondContact O-N 3.26Å; N289-V292 PolarHBondContact O-N 3.01Å; V292-K295 PolarHBondContact O-N 2.94Å; V292-F362 HydrophobicContact CG2-CE2 4.35Å; V292-F362 HydrophobicContact CG2-CZ 3.8Å
293	I	90.9	Very high	93.9	Very high	100 Å²	100	39.3 Å²	39.3	51%	0.513	18%	0.184	S	C	.	.	H	α-helix	trans	-63.3	-49.5	-171.4	-64.5	164.5	0	0	0	111.3	N289 Y308	N289-I293 HydrophobicContact CB-CD1 4.3Å; N289-I293 WeakPolarHBondContact O-CB 3.49Å; N289-I293 WeakPolarHBondContact O-CD1 3.4Å; N289-I293 VanDerWaalsContact O-CG1 3.24Å; N289-I293 WeakPolarHBondContact O-CG1 3.1Å; N289-I293 PolarHBondContact O-N 3.26Å; I293-Y308 HydrophobicContact CD1-CE2 4.13Å
294	Q	90.9	Very high	93.8	Very high	65 Å²	65	41.7 Å²	41.7	30%	0.304	20%	0.195	S	C	.	.	H	α-helix	trans	-87	-4.6	-175.1	-56.1	-159.6	15.2	0	0	114.1	L290 K296 F299	L290-Q294 HydrophobicContact CD2-CG 4.48Å; L290-Q294 WeakPolarHBondContact O-CB 3.22Å; L290-Q294 PolarHBondContact O-N 2.87Å; Q294-K296 HydrophobicContact CB-CB 4.32Å; Q294-K296 HydrophobicContact CB-CD 3.95Å; Q294-K296 HydrophobicContact CB-CG 4.3Å; Q294-K296 WeakPolarHBondContact O-CG 3.46Å; Q294-K296 PolarHBondContact O-N 3.22Å; Q294-F299 HydrophobicContact CB-CE1 4.07Å; Q294-F299 HydrophobicContact CB-CZ 4.39Å; Q294-F299 HydrophobicContact CG-CE1 4.23Å
295	K	86.6	Confident	93.8	Very high	118 Å²	118	40.8 Å²	40.8	51%	0.513	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.9	45.6	-172.3	-56.3	-171.1	178.7	-169.9	0	112.2	S291 V292 I387 K388 C390	S291-K295 WeakPolarHBondContact O-CA 3.4Å; S291-K295 PolarHBondContact O-N 2.87Å; V292-K295 PolarHBondContact O-N 2.94Å; K295-I387 HydrophobicContact CB-CG2 4.17Å; K295-I387 HydrophobicContact CD-CG2 4.42Å; K295-I387 HydrophobicContact CG-CG2 3.93Å; K295-K388 PolarHBondContact NZ-O 2.93Å; K295-C390 PolarHBondContact O-SG 2.91Å; K295-C390 VanDerWaalsContact O-SG 3.34Å
296	K	86.6	Confident	93.8	Very high	103 Å²	103	41.4 Å²	41.4	45%	0.448	19%	0.194	S	C	.	.			trans	-127.9	154.1	-178.5	-75.2	166.6	-153.2	164.7	0	109.7	S291 Q294 F299	S291-K296 WeakPolarHBondContact CA-O 3.28Å; Q294-K296 HydrophobicContact CB-CB 4.32Å; Q294-K296 HydrophobicContact CB-CD 3.95Å; Q294-K296 HydrophobicContact CB-CG 4.3Å; Q294-K296 WeakPolarHBondContact O-CG 3.46Å; Q294-K296 PolarHBondContact O-N 3.22Å; K296-F299 HydrophobicContact CB-CE1 3.92Å; K296-F299 HydrophobicContact CB-CE2 4.42Å; K296-F299 HydrophobicContact CB-CZ 3.59Å; K296-F299 HydrophobicContact CD-CE1 4.48Å; K296-F299 WeakPolarHBondContact O-CE2 3.17Å; K296-F299 WeakPolarHBondContact O-CZ 3.36Å
297	R	85	Confident	93.8	Very high	51 Å²	51	43.6 Å²	43.6	19%	0.192	21%	0.208	C	C	.	.	S	Bend	trans	-112	4.6	-176.8	-94.3	177.4	162.5	157.2	-9.4	114.7	R358 E384 K391	R297-R358 WeakPolarHBondContact O-CB 3.42Å; R297-R358 WeakPolarHBondContact O-CD 3.3Å; R297-E384 IonicContact CZ-OE1 3.22Å; R297-E384 IonicContact NE-OE1 2.8Å; R297-E384 IonicContact NH2-OE1 3.48Å; R297-E384 PolarHBondContact NH2-OE1 2.89Å; R297-E384 IonicContact NH2-OE2 2.66Å; R297-E384 PolarHBondContact NH2-OE2 3.34Å; R297-K391 PolarHBondContact NH1-O 3.32Å
298	Y	92.3	Very high	93.9	Very high	47 Å²	47	45.2 Å²	45.2	18%	0.184	21%	0.214	C	C	.	.			trans	-149.2	136.4	176.8	-73.3	-93.8	0	0	0	109.5	M345 V350 K352 L356 F357 R358	Y298-M345 WeakPolarHBondContact OH-CE 3.22Å; Y298-V350 HydrophobicContact CE1-CG2 3.86Å; Y298-K352 HydrophobicContact CD1-CD 4.28Å; Y298-K352 HydrophobicContact CE1-CD 4.15Å; Y298-L356 HydrophobicContact CD1-CB 4.43Å; Y298-F357 WeakPolarHBondContact CA-O 3.28Å; Y298-R358 HydrophobicContact CD1-CB 4.26Å; Y298-R358 HydrophobicContact CD1-CG 4.11Å; Y298-R358 HydrophobicContact CE1-CB 4.45Å; Y298-R358 HydrophobicContact CE1-CG 3.79Å; Y298-R358 VanDerWaalsContact CZ-CD 3.5Å
299	F	96.3	Very high	93.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	141.3	-176	-61.4	-82.5	0	0	0	111.3	L287 L290 S291 Q294 K296 Q304 L356 F357	L287-F299 HydrophobicContact CD2-CB 4.09Å; L287-F299 HydrophobicContact CD2-CD2 4.07Å; L287-F299 HydrophobicContact CD2-CG 4.41Å; L290-F299 HydrophobicContact CB-CD1 3.98Å; L290-F299 HydrophobicContact CB-CD2 4.29Å; L290-F299 HydrophobicContact CB-CE1 3.79Å; L290-F299 HydrophobicContact CB-CE2 4.12Å; L290-F299 HydrophobicContact CB-CG 4.24Å; L290-F299 HydrophobicContact CB-CZ 3.87Å; L290-F299 HydrophobicContact CD1-CD1 4.31Å; L290-F299 HydrophobicContact CD1-CG 4.38Å; L290-F299 WeakPolarHBondContact O-CZ 3.31Å; S291-F299 WeakPolarHBondContact OG-CE2 3.48Å; Q294-F299 HydrophobicContact CB-CE1 4.07Å; Q294-F299 HydrophobicContact CB-CZ 4.39Å; Q294-F299 HydrophobicContact CG-CE1 4.23Å; K296-F299 HydrophobicContact CB-CE1 3.92Å; K296-F299 HydrophobicContact CB-CE2 4.42Å; K296-F299 HydrophobicContact CB-CZ 3.59Å; K296-F299 HydrophobicContact CD-CE1 4.48Å; K296-F299 WeakPolarHBondContact O-CE2 3.17Å; K296-F299 WeakPolarHBondContact O-CZ 3.36Å; F299-Q304 HydrophobicContact CB-CB 4.33Å; F299-Q304 HydrophobicContact CD1-CB 4.4Å; F299-L356 CarbonylContact O-C 3.47Å; F299-L356 WeakPolarHBondContact O-CA 3.36Å; F299-F357 PolarHBondContact N-O 3.46Å; F299-F357 PolarHBondContact O-N 3.45Å
300	D	97.1	Very high	94	Very high	22 Å²	22	46 Å²	46	12%	0.118	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	127.2	172.3	-168.2	-69.8	0	0	0	110.9	Q302 M303 Q304 L305 H355 L356	D300-Q302 VanDerWaalsContact C-N 3.28Å; D300-Q302 PolarHBondContact O-N 3.49Å; D300-Q302 PolarHBondContact OD1-N 3.38Å; D300-M303 HydrophobicContact CB-CB 3.97Å; D300-M303 PolarHBondContact OD1-N 3.47Å; D300-Q304 HydrophobicContact CB-CG 4.25Å; D300-Q304 WeakPolarHBondContact O-CB 3.26Å; D300-Q304 PolarHBondContact O-N 2.88Å; D300-L305 PolarHBondContact O-N 3.02Å; D300-H355 WeakPolarHBondContact CA-O 3.21Å; D300-H355 IonicContact OD2-CD2 3.19Å; D300-H355 PolarHBondContact OD2-CD2 3.2Å; D300-H355 IonicContact OD2-CG 2.66Å; D300-H355 IonicContact OD2-NE2 2.61Å; D300-H355 PolarHBondContact OD2-NE2 3.17Å; D300-L356 HydrophobicContact CB-CD2 4.19Å
301	S	96.4	Very high	94	Very high	1 Å²	1	51 Å²	51	1%	0.007	25%	0.245	C	C	.	.	I	π-helix	trans	-58.6	-38.8	-178.3	57.3	0	0	0	0	112.5	M306 Y330 H355	S301-M306 WeakPolarHBondContact O-CG 3.31Å; S301-M306 PolarHBondContact O-N 2.84Å; S301-Y330 PolarHBondContact OG-OH 3.15Å; S301-H355 PolarHBondContact N-O 3Å; S301-H355 PolarHBondContact OG-O 3.48Å
302	Q	95.4	Very high	94.1	Very high	115 Å²	115	52.1 Å²	52.1	54%	0.537	25%	0.251	S	S	.	.	I	π-helix	trans	-96.3	-35.7	-174.5	-166.3	169.5	-7.6	0	0	112.8	D300 P307 Y330	D300-Q302 VanDerWaalsContact C-N 3.28Å; D300-Q302 PolarHBondContact O-N 3.49Å; D300-Q302 PolarHBondContact OD1-N 3.38Å; Q302-P307 WeakPolarHBondContact O-CD 3.41Å; Q302-Y330 HydrophobicContact CB-CE1 4.38Å; Q302-Y330 HydrophobicContact CB-CE2 4.33Å; Q302-Y330 HydrophobicContact CG-CE1 4.13Å
303	M	95.8	Very high	94.3	Very high	144 Å²	144	51 Å²	51	71%	0.709	24%	0.243	S	C	*	.	I	π-helix	trans	-96.2	-9.7	-173	-57.7	-62.8	-65.2	0	0	114.2	D300	D300-M303 HydrophobicContact CB-CB 3.97Å; D300-M303 PolarHBondContact OD1-N 3.47Å
304	Q	96.8	Very high	94.3	Very high	50 Å²	50	53.2 Å²	53.2	23%	0.234	25%	0.252	C	S	.	.	I	π-helix	trans	-134.6	-47.9	179.7	-62.3	-179.4	-85.5	0	0	113	F299 D300 Y308	F299-Q304 HydrophobicContact CB-CB 4.33Å; F299-Q304 HydrophobicContact CD1-CB 4.4Å; D300-Q304 HydrophobicContact CB-CG 4.25Å; D300-Q304 WeakPolarHBondContact O-CB 3.26Å; D300-Q304 PolarHBondContact O-N 2.88Å; Q304-Y308 WeakPolarHBondContact O-CB 3.49Å; Q304-Y308 PolarHBondContact O-N 3.47Å
305	L	97.3	Very high	94.4	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	25%	0.251	C	S	.	.	I	π-helix	trans	-72.6	-49.1	-178.2	-178.5	64	0	0	0	112.2	V283 C286 L287 L290 D300 Y308 I309 V333 L337	V283-L305 HydrophobicContact CG1-CD2 4.33Å; C286-L305 HydrophobicContact CB-CD1 3.69Å; L287-L305 HydrophobicContact CD2-CD1 4.05Å; L287-L305 HydrophobicContact CD2-CD2 4.21Å; L287-L305 HydrophobicContact CG-CD1 3.98Å; L287-L305 HydrophobicContact CG-CD2 4.21Å; L290-L305 HydrophobicContact CD1-CB 4.43Å; L290-L305 HydrophobicContact CD1-CD1 3.95Å; D300-L305 PolarHBondContact O-N 3.02Å; L305-Y308 PolarHBondContact O-N 3.47Å; L305-I309 HydrophobicContact CD1-CD1 3.84Å; L305-I309 HydrophobicContact CD1-CG1 4.1Å; L305-I309 HydrophobicContact CD2-CD1 4.32Å; L305-I309 HydrophobicContact CG-CD1 3.71Å; L305-I309 HydrophobicContact CG-CG1 4.34Å; L305-I309 WeakPolarHBondContact O-CG1 3.29Å; L305-I309 PolarHBondContact O-N 3.29Å; L305-V333 HydrophobicContact CD2-CG1 3.94Å; L305-L337 HydrophobicContact CD2-CD1 4Å; L305-L337 HydrophobicContact CD2-CD2 4.47Å
306	M	97.6	Very high	94.7	Very high	13 Å²	13	47.1 Å²	47.1	6%	0.064	23%	0.227	C	C	.	.	H	α-helix	trans	-64.1	-37.7	179.4	-78.3	-45.9	-56.1	0	0	115.5	S301 I309 N310 R329 Y330 V333	S301-M306 WeakPolarHBondContact O-CG 3.31Å; S301-M306 PolarHBondContact O-N 2.84Å; M306-I309 HydrophobicContact SD-CD1 4.32Å; M306-N310 WeakPolarHBondContact CE-ND2 3.24Å; M306-N310 WeakPolarHBondContact O-CB 3.5Å; M306-N310 PolarHBondContact O-N 3.21Å; M306-N310 PolarHBondContact O-ND2 2.92Å; M306-R329 HydrophobicContact CE-CB 3.75Å; M306-Y330 HydrophobicContact CG-CD2 3.27Å; M306-Y330 HydrophobicContact CG-CE2 3.97Å; M306-Y330 HydrophobicContact CG-CG 3.87Å; M306-Y330 HydrophobicContact SD-CD2 3.78Å; M306-Y330 HydrophobicContact SD-CG 4.36Å; M306-V333 HydrophobicContact SD-CB 3.73Å; M306-V333 HydrophobicContact SD-CG1 3.76Å; M306-V333 HydrophobicContact SD-CG2 3.72Å
307	P	97.7	Very high	95	Very high	47 Å²	47	44.8 Å²	44.8	31%	0.305	22%	0.217	S	C	.	.	H	α-helix	trans	-56.8	-56.5	168	-27.6	36	0	0	0	110.5	Q302 I309 N310 D311	Q302-P307 WeakPolarHBondContact O-CD 3.41Å; P307-I309 PolarHBondContact O-N 2.86Å; P307-N310 PolarHBondContact O-N 3.38Å; P307-D311 WeakPolarHBondContact O-CB 3.4Å; P307-D311 PolarHBondContact O-N 3.46Å; P307-D311 VanDerWaalsContact O-OD2 3.1Å
308	Y	97.4	Very high	95.3	Very high	33 Å²	33	42.9 Å²	42.9	13%	0.129	21%	0.211	C	C	.	.	H	α-helix	trans	-55	-46.3	-178.2	-171.3	-90	0	0	0	113.7	C286 N289 L290 I293 Q304 L305 N310 D311 N312	C286-Y308 HydrophobicContact CB-CD1 3.84Å; C286-Y308 HydrophobicContact CB-CE1 4.14Å; N289-Y308 HydrophobicContact CB-CE1 3.99Å; N289-Y308 VanDerWaalsContact CB-OH 3.31Å; N289-Y308 WeakPolarHBondContact CB-OH 3.33Å; L290-Y308 HydrophobicContact CD1-CD1 4.43Å; L290-Y308 HydrophobicContact CD1-CG 4.16Å; L290-Y308 HydrophobicContact CD2-CD2 3.73Å; L290-Y308 HydrophobicContact CD2-CE2 4.43Å; L290-Y308 HydrophobicContact CD2-CG 3.85Å; L290-Y308 HydrophobicContact CG-CD1 4.15Å; L290-Y308 HydrophobicContact CG-CD2 4.12Å; L290-Y308 HydrophobicContact CG-CG 3.85Å; I293-Y308 HydrophobicContact CD1-CE2 4.13Å; Q304-Y308 WeakPolarHBondContact O-CB 3.49Å; Q304-Y308 PolarHBondContact O-N 3.47Å; L305-Y308 PolarHBondContact O-N 3.47Å; Y308-N310 VanDerWaalsContact C-N 3.29Å; Y308-N310 PolarHBondContact O-N 2.73Å; Y308-D311 PolarHBondContact O-N 3.13Å; Y308-N312 WeakPolarHBondContact CE2-ND2 3.43Å; Y308-N312 WeakPolarHBondContact O-CB 3.5Å; Y308-N312 PolarHBondContact O-N 3.17Å; Y308-N312 VanDerWaalsContact O-N 3.09Å; Y308-N312 PolarHBondContact O-ND2 3.47Å
309	I	97.8	Very high	95.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.4	-41	176	-73.5	172.8	0	0	0	111.8	I282 V283 C286 L305 M306 P307 W313 V333	I282-I309 HydrophobicContact CG2-CG2 4.42Å; V283-I309 HydrophobicContact CG2-CD1 4.49Å; C286-I309 HydrophobicContact CB-CD1 4.39Å; C286-I309 HydrophobicContact CB-CG1 3.75Å; C286-I309 VanDerWaalsContact SG-CG1 3.59Å; L305-I309 HydrophobicContact CD1-CD1 3.84Å; L305-I309 HydrophobicContact CD1-CG1 4.1Å; L305-I309 HydrophobicContact CD2-CD1 4.32Å; L305-I309 HydrophobicContact CG-CD1 3.71Å; L305-I309 HydrophobicContact CG-CG1 4.34Å; L305-I309 WeakPolarHBondContact O-CG1 3.29Å; L305-I309 PolarHBondContact O-N 3.29Å; M306-I309 HydrophobicContact SD-CD1 4.32Å; P307-I309 PolarHBondContact O-N 2.86Å; I309-W313 HydrophobicContact CG2-CE3 3.88Å; I309-W313 HydrophobicContact CG2-CZ3 3.86Å; I309-W313 WeakPolarHBondContact O-CA 3.25Å; I309-W313 PolarHBondContact O-N 3.37Å; I309-V333 HydrophobicContact CD1-CG1 4.15Å; I309-V333 HydrophobicContact CD1-CG2 3.61Å
310	N	96.5	Very high	94.6	Very high	18 Å²	18	52.6 Å²	52.6	10%	0.096	27%	0.27	C	S	.	.	H	α-helix	trans	-78.3	-35.8	-177.5	-80.6	-58.2	0	0	0	113.3	M306 P307 Y308 N312 W313 R326 R329	M306-N310 WeakPolarHBondContact CE-ND2 3.24Å; M306-N310 WeakPolarHBondContact O-CB 3.5Å; M306-N310 PolarHBondContact O-N 3.21Å; M306-N310 PolarHBondContact O-ND2 2.92Å; P307-N310 PolarHBondContact O-N 3.38Å; Y308-N310 VanDerWaalsContact C-N 3.29Å; Y308-N310 PolarHBondContact O-N 2.73Å; N310-N312 VanDerWaalsContact C-N 3.27Å; N310-W313 WeakPolarHBondContact O-CB 3.4Å; N310-W313 PolarHBondContact O-N 2.83Å; N310-R326 VanDerWaalsContact CB-NH2 3.3Å; N310-R329 VanDerWaalsContact OD1-CD 3.23Å; N310-R329 WeakPolarHBondContact OD1-CD 3.17Å; N310-R329 PolarHBondContact OD1-NH1 3.41Å
311	D	95.9	Very high	94.4	Very high	109 Å²	109	53.7 Å²	53.7	58%	0.583	28%	0.275	S	S	*	.	H	α-helix	trans	-78.8	-18.5	-176.2	-52.6	-22.2	0	0	0	110.6	P307 Y308 R326	P307-D311 WeakPolarHBondContact O-CB 3.4Å; P307-D311 PolarHBondContact O-N 3.46Å; P307-D311 VanDerWaalsContact O-OD2 3.1Å; Y308-D311 PolarHBondContact O-N 3.13Å; D311-R326 IonicContact OD1-NH2 2.62Å
312	N	94.3	Very high	94.2	Very high	28 Å²	28	55.2 Å²	55.2	15%	0.15	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	16.3	171.1	-61.7	-98.1	0	0	0	112.8	Y308 N310 E314 L315 L316	Y308-N312 WeakPolarHBondContact CE2-ND2 3.43Å; Y308-N312 WeakPolarHBondContact O-CB 3.5Å; Y308-N312 PolarHBondContact O-N 3.17Å; Y308-N312 VanDerWaalsContact O-N 3.09Å; Y308-N312 PolarHBondContact O-ND2 3.47Å; N310-N312 VanDerWaalsContact C-N 3.27Å; N312-E314 PolarHBondContact O-N 3.03Å; N312-L315 HydrophobicContact CB-CB 4.49Å; N312-L315 HydrophobicContact CB-CD1 4.43Å; N312-L315 PolarHBondContact O-N 3.31Å; N312-L315 VanDerWaalsContact O-N 3.14Å; N312-L316 WeakPolarHBondContact O-CG 3.29Å; N312-L316 PolarHBondContact O-N 2.64Å; N312-L316 VanDerWaalsContact O-N 3.07Å
313	W	95.1	Very high	94.1	Very high	5 Å²	5	56.2 Å²	56.2	2%	0.019	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-42.1	-168.4	-172.4	-101.2	0	0	0	114.1	W279 I309 N310 L318 L321 A322 R329	W279-W313 AromaticContact CH2-CH2 3.7Å; W279-W313 HydrophobicContact CH2-CH2 3.7Å; W279-W313 HydrophobicContact CH2-CZ3 4.26Å; W279-W313 HydrophobicContact CZ3-CH2 4.19Å; W279-W313 HydrophobicContact CZ3-CZ3 4.32Å; I309-W313 HydrophobicContact CG2-CE3 3.88Å; I309-W313 HydrophobicContact CG2-CZ3 3.86Å; I309-W313 WeakPolarHBondContact O-CA 3.25Å; I309-W313 PolarHBondContact O-N 3.37Å; N310-W313 WeakPolarHBondContact O-CB 3.4Å; N310-W313 PolarHBondContact O-N 2.83Å; W313-L318 HydrophobicContact CD2-CD1 3.83Å; W313-L318 HydrophobicContact CE3-CD1 3.67Å; W313-L318 HydrophobicContact CH2-CD1 3.44Å; W313-L318 VanDerWaalsContact CH2-CD1 3.44Å; W313-L318 HydrophobicContact CZ2-CD1 3.62Å; W313-L318 HydrophobicContact CZ3-CD1 3.46Å; W313-L318 VanDerWaalsContact CZ3-CD1 3.46Å; W313-L321 WeakPolarHBondContact CZ2-O 3.24Å; W313-A322 PolarHBondContact NE1-O 3.17Å; W313-R329 VanDerWaalsContact CG-NH1 3.26Å; W313-R329 HydrophobicContact CH2-CG 3.95Å; W313-R329 HydrophobicContact CZ2-CG 4.47Å; W313-R329 HydrophobicContact CZ3-CG 4.16Å
314	E	91.8	Very high	94	Very high	147 Å²	147	50.5 Å²	50.5	69%	0.687	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-36.9	178.1	-48.5	-50.2	140.3	0	0	111.7	N312 L316 Q317	N312-E314 PolarHBondContact O-N 3.03Å; E314-L316 PolarHBondContact O-N 2.79Å; E314-Q317 PolarHBondContact O-N 3.29Å
315	L	92.3	Very high	93.9	Very high	56 Å²	56	50.9 Å²	50.9	29%	0.293	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-29.9	177.7	-61.5	178.1	0	0	0	112.5	A249 N312 Q317	A249-L315 HydrophobicContact CB-CD2 4.06Å; N312-L315 HydrophobicContact CB-CB 4.49Å; N312-L315 HydrophobicContact CB-CD1 4.43Å; N312-L315 PolarHBondContact O-N 3.31Å; N312-L315 VanDerWaalsContact O-N 3.14Å; L315-Q317 PolarHBondContact O-N 2.97Å; L315-Q317 PolarHBondContact O-NE2 3.47Å
316	L	93.6	Very high	93.8	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-11.1	174.9	-74	162.8	0	0	0	113.8	L252 R274 I282 L285 N312 E314 L318	L252-L316 HydrophobicContact CD1-CD2 3.49Å; L252-L316 VanDerWaalsContact CD1-CD2 3.49Å; L252-L316 HydrophobicContact CD1-CG 4.01Å; R274-L316 PolarHBondContact NH2-O 2.62Å; I282-L316 HydrophobicContact CG2-CD1 4.18Å; L285-L316 HydrophobicContact CD2-CD2 3.92Å; N312-L316 WeakPolarHBondContact O-CG 3.29Å; N312-L316 PolarHBondContact O-N 2.64Å; N312-L316 VanDerWaalsContact O-N 3.07Å; E314-L316 PolarHBondContact O-N 2.79Å; L316-L318 VanDerWaalsContact C-N 3.31Å; L316-L318 HydrophobicContact CB-CD1 4.11Å; L316-L318 HydrophobicContact CB-CD2 3.74Å; L316-L318 HydrophobicContact CB-CG 3.66Å; L316-L318 HydrophobicContact CD1-CD1 4.48Å; L316-L318 WeakPolarHBondContact O-CD2 3.45Å; L316-L318 PolarHBondContact O-N 2.84Å
317	Q	92.4	Very high	93.6	Very high	53 Å²	53	61.9 Å²	61.9	25%	0.248	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	49	46.9	171.1	-65.3	167	59.1	0	0	113.5	R274 E314 L315 G319	R274-Q317 HydrophobicContact CG-CB 3.93Å; E314-Q317 PolarHBondContact O-N 3.29Å; L315-Q317 PolarHBondContact O-N 2.97Å; L315-Q317 PolarHBondContact O-NE2 3.47Å; Q317-G319 PolarHBondContact O-N 3.29Å
318	L	91.3	Very high	93.5	Very high	11 Å²	11	64.3 Å²	64.3	6%	0.058	34%	0.34	C	S	.	.			trans	-73.5	6.1	-162.4	-64.6	178	0	0	0	116.4	L277 I282 W313 L316 K320 L321 A322	L277-L318 HydrophobicContact CB-CD2 4.37Å; I282-L318 HydrophobicContact CD1-CD1 3.94Å; I282-L318 HydrophobicContact CD1-CD2 3.51Å; I282-L318 HydrophobicContact CD1-CG 4.35Å; I282-L318 HydrophobicContact CG1-CD2 3.63Å; W313-L318 HydrophobicContact CD2-CD1 3.83Å; W313-L318 HydrophobicContact CE3-CD1 3.67Å; W313-L318 HydrophobicContact CH2-CD1 3.44Å; W313-L318 VanDerWaalsContact CH2-CD1 3.44Å; W313-L318 HydrophobicContact CZ2-CD1 3.62Å; W313-L318 HydrophobicContact CZ3-CD1 3.46Å; W313-L318 VanDerWaalsContact CZ3-CD1 3.46Å; L316-L318 VanDerWaalsContact C-N 3.31Å; L316-L318 HydrophobicContact CB-CD1 4.11Å; L316-L318 HydrophobicContact CB-CD2 3.74Å; L316-L318 HydrophobicContact CB-CG 3.66Å; L316-L318 HydrophobicContact CD1-CD1 4.48Å; L316-L318 WeakPolarHBondContact O-CD2 3.45Å; L316-L318 PolarHBondContact O-N 2.84Å; L318-K320 PolarHBondContact O-N 2.98Å; L318-K320 VanDerWaalsContact O-N 3.09Å; L318-L321 HydrophobicContact CB-CB 4.14Å; L318-L321 PolarHBondContact O-N 3.18Å; L318-A322 HydrophobicContact CB-CB 4.2Å
319	G	88.6	Confident	93.5	Very high	55 Å²	55	64 Å²	64	57%	0.567	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	48.8	-116.1	179.4	0	0	0	0	0	112.6	Q317 L321 A322	Q317-G319 PolarHBondContact O-N 3.29Å; G319-L321 VanDerWaalsContact C-N 3.28Å; G319-L321 PolarHBondContact O-N 2.96Å; G319-A322 VanDerWaalsContact O-CB 3.31Å; G319-A322 WeakPolarHBondContact O-CB 3.49Å; G319-A322 PolarHBondContact O-N 2.93Å
320	K	86.7	Confident	93.5	Very high	197 Å²	197	67 Å²	67	86%	0.857	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-58.6	-35.7	179.8	-65.7	178.7	-178	173.9	0	113.4	L318 A322 N323	L318-K320 PolarHBondContact O-N 2.98Å; L318-K320 VanDerWaalsContact O-N 3.09Å; K320-A322 VanDerWaalsContact C-N 3.34Å; K320-N323 PolarHBondContact O-ND2 3.43Å; K320-N323 VanDerWaalsContact O-ND2 3.17Å
321	L	92.1	Very high	93.5	Very high	45 Å²	45	72.9 Å²	72.9	24%	0.236	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-77.3	-16.2	-178.9	-69	-177.3	0	0	0	113.4	L277 I282 W313 L318 G319 N323 T324	L277-L321 VanDerWaalsContact O-CD1 3.31Å; L277-L321 WeakPolarHBondContact O-CD1 3.42Å; I282-L321 HydrophobicContact CD1-CD1 4.02Å; W313-L321 WeakPolarHBondContact CZ2-O 3.24Å; L318-L321 HydrophobicContact CB-CB 4.14Å; L318-L321 PolarHBondContact O-N 3.18Å; G319-L321 VanDerWaalsContact C-N 3.28Å; G319-L321 PolarHBondContact O-N 2.96Å; L321-N323 PolarHBondContact O-N 3.09Å; L321-T324 PolarHBondContact O-N 3.17Å; L321-T324 PolarHBondContact O-OG1 3.15Å
322	A	92.1	Very high	93.6	Very high	33 Å²	33	71.1 Å²	71.1	27%	0.273	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-55.9	-29.6	179.4	0	0	0	0	0	112.6	W313 L318 G319 K320 T324	W313-A322 PolarHBondContact NE1-O 3.17Å; L318-A322 HydrophobicContact CB-CB 4.2Å; G319-A322 VanDerWaalsContact O-CB 3.31Å; G319-A322 WeakPolarHBondContact O-CB 3.49Å; G319-A322 PolarHBondContact O-N 2.93Å; K320-A322 VanDerWaalsContact C-N 3.34Å; A322-T324 VanDerWaalsContact C-N 3.26Å; A322-T324 PolarHBondContact O-N 2.82Å
323	N	92.5	Very high	93.7	Very high	136 Å²	136	69.8 Å²	69.8	73%	0.727	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-68.7	-11	178.4	-59.6	-65.4	0	0	0	115	K320 L321 P325	K320-N323 PolarHBondContact O-ND2 3.43Å; K320-N323 VanDerWaalsContact O-ND2 3.17Å; L321-N323 PolarHBondContact O-N 3.09Å; N323-P325 WeakPolarHBondContact O-CD 3.44Å
324	T	95.1	Very high	93.8	Very high	24 Å²	24	72.3 Å²	72.3	15%	0.147	37%	0.371	C	S	.	.	S	Bend	trans	-65	122.4	-177.3	-62.2	0	0	0	0	111.5	W279 L321 A322 E328 R329	W279-T324 HydrophobicContact CH2-CG2 4.04Å; W279-T324 HydrophobicContact CZ2-CG2 3.92Å; L321-T324 PolarHBondContact O-N 3.17Å; L321-T324 PolarHBondContact O-OG1 3.15Å; A322-T324 VanDerWaalsContact C-N 3.26Å; A322-T324 PolarHBondContact O-N 2.82Å; T324-E328 HydrophobicContact CG2-CB 3.99Å; T324-R329 HydrophobicContact CG2-CG 3.95Å; T324-R329 PolarHBondContact O-NE 3.06Å; T324-R329 PolarHBondContact O-NH2 2.9Å
325	P	94.9	Very high	94.1	Very high	58 Å²	58	69.5 Å²	69.5	38%	0.377	36%	0.358	S	S	.	.			trans	-59.5	143	179.1	-26.9	36.9	0	0	0	113.5	N323 S327 E328 R329	N323-P325 WeakPolarHBondContact O-CD 3.44Å; P325-S327 PolarHBondContact O-N 2.86Å; P325-E328 WeakPolarHBondContact CG-OE1 3.46Å; P325-E328 PolarHBondContact O-N 2.87Å; P325-R329 WeakPolarHBondContact O-CG 3.26Å; P325-R329 PolarHBondContact O-N 3.25Å
326	R	94.5	Very high	94.3	Very high	145 Å²	145	67.2 Å²	67.2	55%	0.547	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-27.5	-175.6	-172.9	167.2	-174.8	139	1.8	114.1	N310 D311	N310-R326 VanDerWaalsContact CB-NH2 3.3Å; D311-R326 IonicContact OD1-NH2 2.62Å
327	S	94.3	Very high	94.5	Very high	100 Å²	100	67.4 Å²	67.4	70%	0.699	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-39	173.8	39.5	0	0	0	0	114	P325	P325-S327 PolarHBondContact O-N 2.86Å
328	E	95.6	Very high	94.6	Very high	98 Å²	98	69 Å²	69	46%	0.458	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-25.7	-172	-68.3	161.4	-139.3	0	0	112.6	T324 P325 Y330 E331 K332	T324-E328 HydrophobicContact CG2-CB 3.99Å; P325-E328 WeakPolarHBondContact CG-OE1 3.46Å; P325-E328 PolarHBondContact O-N 2.87Å; E328-Y330 PolarHBondContact O-N 3.11Å; E328-Y330 VanDerWaalsContact O-N 3.12Å; E328-E331 PolarHBondContact O-N 3.44Å; E328-E331 VanDerWaalsContact O-N 3.09Å; E328-K332 PolarHBondContact O-N 2.82Å
329	R	96.5	Very high	94.8	Very high	27 Å²	27	73.9 Å²	73.9	10%	0.102	39%	0.385	C	S	.	.	H	α-helix	trans	-54.3	-36.2	-174.7	-59.7	175.4	-170.3	-177	-8.5	113.3	W279 M306 N310 W313 T324 P325 V333	W279-R329 HydrophobicContact CH2-CB 4.18Å; W279-R329 HydrophobicContact CH2-CG 4.12Å; W279-R329 HydrophobicContact CZ3-CB 4.38Å; M306-R329 HydrophobicContact CE-CB 3.75Å; N310-R329 VanDerWaalsContact OD1-CD 3.23Å; N310-R329 WeakPolarHBondContact OD1-CD 3.17Å; N310-R329 PolarHBondContact OD1-NH1 3.41Å; W313-R329 VanDerWaalsContact CG-NH1 3.26Å; W313-R329 HydrophobicContact CH2-CG 3.95Å; W313-R329 HydrophobicContact CZ2-CG 4.47Å; W313-R329 HydrophobicContact CZ3-CG 4.16Å; T324-R329 HydrophobicContact CG2-CG 3.95Å; T324-R329 PolarHBondContact O-NE 3.06Å; T324-R329 PolarHBondContact O-NH2 2.9Å; P325-R329 WeakPolarHBondContact O-CG 3.26Å; P325-R329 PolarHBondContact O-N 3.25Å; R329-V333 WeakPolarHBondContact O-CB 3.37Å; R329-V333 VanDerWaalsContact O-CG2 3.27Å; R329-V333 WeakPolarHBondContact O-CG2 3.37Å; R329-V333 PolarHBondContact O-N 3.28Å
330	Y	97.6	Very high	95.1	Very high	63 Å²	63	72.7 Å²	72.7	25%	0.247	37%	0.365	C	S	.	.	H	α-helix	trans	-70.2	-35.6	-178.4	-177.9	-139.6	0	0	0	113.1	S301 Q302 M306 E328 V333 L334	S301-Y330 PolarHBondContact OG-OH 3.15Å; Q302-Y330 HydrophobicContact CB-CE1 4.38Å; Q302-Y330 HydrophobicContact CB-CE2 4.33Å; Q302-Y330 HydrophobicContact CG-CE1 4.13Å; M306-Y330 HydrophobicContact CG-CD2 3.27Å; M306-Y330 HydrophobicContact CG-CE2 3.97Å; M306-Y330 HydrophobicContact CG-CG 3.87Å; M306-Y330 HydrophobicContact SD-CD2 3.78Å; M306-Y330 HydrophobicContact SD-CG 4.36Å; E328-Y330 PolarHBondContact O-N 3.11Å; E328-Y330 VanDerWaalsContact O-N 3.12Å; Y330-V333 PolarHBondContact O-N 2.96Å; Y330-L334 VanDerWaalsContact O-CB 3.28Å; Y330-L334 WeakPolarHBondContact O-CB 3.36Å; Y330-L334 PolarHBondContact O-N 3.24Å
331	E	97	Very high	95.3	Very high	141 Å²	141	66.5 Å²	66.5	66%	0.659	35%	0.347	S	S	*	.	H	α-helix	trans	-65.2	-46.3	176.7	-175	168.9	-162.1	0	0	110.5	E328 V333 L334 E335	E328-E331 PolarHBondContact O-N 3.44Å; E328-E331 VanDerWaalsContact O-N 3.09Å; E331-V333 PolarHBondContact O-N 3.46Å; E331-L334 PolarHBondContact O-N 2.95Å; E331-L334 VanDerWaalsContact O-N 3.16Å; E331-E335 WeakPolarHBondContact O-CB 3.38Å; E331-E335 PolarHBondContact O-N 3.16Å
332	K	97.5	Very high	95.1	Very high	71 Å²	71	69.1 Å²	69.1	31%	0.309	35%	0.354	S	S	.	.	H	α-helix	trans	-65.3	-36.2	177.6	-67.5	-83.6	151.9	-98.3	0	113.1	W279 E328 E335 A336	W279-K332 HydrophobicContact CD2-CB 3.63Å; W279-K332 HydrophobicContact CE3-CB 3.82Å; W279-K332 HydrophobicContact CG-CB 4.19Å; W279-K332 HydrophobicContact CH2-CB 4.02Å; W279-K332 HydrophobicContact CZ2-CB 3.85Å; W279-K332 HydrophobicContact CZ2-CG 4.18Å; W279-K332 HydrophobicContact CZ3-CB 4.01Å; E328-K332 PolarHBondContact O-N 2.82Å; K332-E335 WeakPolarHBondContact CD-OE2 3.23Å; K332-E335 WeakPolarHBondContact CE-OE2 3.41Å; K332-E335 VanDerWaalsContact NZ-CD 3.35Å; K332-E335 IonicContact NZ-OE1 2.73Å; K332-E335 PolarHBondContact NZ-OE1 3.46Å; K332-E335 IonicContact NZ-OE2 3.9Å; K332-E335 PolarHBondContact NZ-OE2 3.09Å; K332-A336 WeakPolarHBondContact O-CB 3.16Å; K332-A336 PolarHBondContact O-N 2.9Å; K332-A336 VanDerWaalsContact O-N 3.07Å
333	V	97.6	Very high	95.2	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-66.4	-40.5	171.1	162.2	0	0	0	0	111.7	W279 V283 L305 M306 I309 R329 Y330 E331 L337	W279-V333 HydrophobicContact CE3-CG2 4.01Å; W279-V333 HydrophobicContact CZ3-CG2 3.96Å; V283-V333 HydrophobicContact CG2-CB 4.14Å; V283-V333 HydrophobicContact CG2-CG1 3.86Å; V283-V333 HydrophobicContact CG2-CG2 3.9Å; L305-V333 HydrophobicContact CD2-CG1 3.94Å; M306-V333 HydrophobicContact SD-CB 3.73Å; M306-V333 HydrophobicContact SD-CG1 3.76Å; M306-V333 HydrophobicContact SD-CG2 3.72Å; I309-V333 HydrophobicContact CD1-CG1 4.15Å; I309-V333 HydrophobicContact CD1-CG2 3.61Å; R329-V333 WeakPolarHBondContact O-CB 3.37Å; R329-V333 VanDerWaalsContact O-CG2 3.27Å; R329-V333 WeakPolarHBondContact O-CG2 3.37Å; R329-V333 PolarHBondContact O-N 3.28Å; Y330-V333 PolarHBondContact O-N 2.96Å; E331-V333 PolarHBondContact O-N 3.46Å; V333-L337 HydrophobicContact CG1-CD1 3.99Å; V333-L337 HydrophobicContact CG1-CG 4.5Å; V333-L337 WeakPolarHBondContact O-CB 3.49Å; V333-L337 VanDerWaalsContact O-CG 3.23Å; V333-L337 WeakPolarHBondContact O-CG 3.48Å; V333-L337 PolarHBondContact O-N 3.46Å
334	L	96.8	Very high	95.3	Very high	58 Å²	58	62.8 Å²	62.8	30%	0.304	32%	0.315	S	S	.	.	H	α-helix	trans	-72.3	-37.4	180	-173.6	60.3	0	0	0	112.2	Y330 E331 L337 N338 F357	Y330-L334 VanDerWaalsContact O-CB 3.28Å; Y330-L334 WeakPolarHBondContact O-CB 3.36Å; Y330-L334 PolarHBondContact O-N 3.24Å; E331-L334 PolarHBondContact O-N 2.95Å; E331-L334 VanDerWaalsContact O-N 3.16Å; L334-L337 PolarHBondContact O-N 2.83Å; L334-N338 WeakPolarHBondContact CD1-ND2 3.38Å; L334-N338 PolarHBondContact O-N 2.94Å; L334-N338 PolarHBondContact O-ND2 3.23Å; L334-F357 HydrophobicContact CD1-CE2 4.49Å; L334-F357 HydrophobicContact CD1-CZ 4.4Å
335	E	96.9	Very high	95.2	Very high	89 Å²	89	62.8 Å²	62.8	42%	0.416	31%	0.314	S	S	.	.	H	α-helix	trans	-55.7	-58.6	169	-176.6	-179.5	-140.4	0	0	110	E331 K332 L337 N338 D339	E331-E335 WeakPolarHBondContact O-CB 3.38Å; E331-E335 PolarHBondContact O-N 3.16Å; K332-E335 WeakPolarHBondContact CD-OE2 3.23Å; K332-E335 WeakPolarHBondContact CE-OE2 3.41Å; K332-E335 VanDerWaalsContact NZ-CD 3.35Å; K332-E335 IonicContact NZ-OE1 2.73Å; K332-E335 PolarHBondContact NZ-OE1 3.46Å; K332-E335 IonicContact NZ-OE2 3.9Å; K332-E335 PolarHBondContact NZ-OE2 3.09Å; E335-L337 VanDerWaalsContact C-N 3.29Å; E335-L337 PolarHBondContact O-N 2.57Å; E335-N338 PolarHBondContact O-N 3.46Å; E335-D339 PolarHBondContact O-N 2.89Å
336	A	97.3	Very high	95.2	Very high	8 Å²	8	60.8 Å²	60.8	7%	0.066	30%	0.301	C	S	.	.	H	α-helix	trans	-56.2	-38.6	179.1	0	0	0	0	0	113.8	W279 V283 K332 N340	W279-A336 HydrophobicContact CB-CB 3.96Å; V283-A336 HydrophobicContact CG2-CB 4.33Å; K332-A336 WeakPolarHBondContact O-CB 3.16Å; K332-A336 PolarHBondContact O-N 2.9Å; K332-A336 VanDerWaalsContact O-N 3.07Å; A336-N340 WeakPolarHBondContact O-CB 3.2Å; A336-N340 PolarHBondContact O-N 3.26Å; A336-N340 PolarHBondContact O-ND2 3.42Å
337	L	96.8	Very high	95	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.016	28%	0.275	C	S	.	.	H	α-helix	trans	-65.5	-34	176.9	-83.2	171.9	0	0	0	114.3	V283 L287 L305 V333 L334 E335 F344 F357	V283-L337 HydrophobicContact CG1-CD2 3.42Å; V283-L337 VanDerWaalsContact CG1-CD2 3.42Å; V283-L337 HydrophobicContact CG1-CG 3.77Å; L287-L337 HydrophobicContact CD1-CD2 3.99Å; L305-L337 HydrophobicContact CD2-CD1 4Å; L305-L337 HydrophobicContact CD2-CD2 4.47Å; V333-L337 HydrophobicContact CG1-CD1 3.99Å; V333-L337 HydrophobicContact CG1-CG 4.5Å; V333-L337 WeakPolarHBondContact O-CB 3.49Å; V333-L337 VanDerWaalsContact O-CG 3.23Å; V333-L337 WeakPolarHBondContact O-CG 3.48Å; V333-L337 PolarHBondContact O-N 3.46Å; L334-L337 PolarHBondContact O-N 2.83Å; E335-L337 VanDerWaalsContact C-N 3.29Å; E335-L337 PolarHBondContact O-N 2.57Å; L337-F344 HydrophobicContact CD2-CB 4.31Å; L337-F344 HydrophobicContact CD2-CD1 4.36Å; L337-F344 HydrophobicContact CD2-CD2 4.18Å; L337-F344 HydrophobicContact CD2-CG 4.01Å; L337-F357 HydrophobicContact CB-CD1 4.23Å; L337-F357 HydrophobicContact CB-CE1 3.96Å; L337-F357 HydrophobicContact CB-CZ 4.21Å; L337-F357 HydrophobicContact CD1-CD1 4.46Å; L337-F357 HydrophobicContact CD1-CD2 3.91Å; L337-F357 HydrophobicContact CD1-CE2 4.02Å; L337-F357 HydrophobicContact CD1-CG 4.13Å; L337-F357 HydrophobicContact CD1-CZ 4.35Å; L337-F357 HydrophobicContact CD2-CB 3.96Å; L337-F357 HydrophobicContact CD2-CD1 3.84Å; L337-F357 HydrophobicContact CD2-CD2 4.46Å; L337-F357 HydrophobicContact CD2-CE1 4.43Å; L337-F357 HydrophobicContact CD2-CG 3.85Å; L337-F357 HydrophobicContact CG-CD1 4.42Å; L337-F357 HydrophobicContact CG-CG 4.47Å
338	N	94.6	Very high	94.8	Very high	87 Å²	87	56.9 Å²	56.9	47%	0.465	28%	0.275	S	S	.	.	H	α-helix	trans	-88.5	-40.4	-177.6	-72.6	-68.8	0	0	0	111.7	L334 E335	L334-N338 WeakPolarHBondContact CD1-ND2 3.38Å; L334-N338 PolarHBondContact O-N 2.94Å; L334-N338 PolarHBondContact O-ND2 3.23Å; E335-N338 PolarHBondContact O-N 3.46Å
339	D	96	Very high	94.6	Very high	114 Å²	114	56.8 Å²	56.8	61%	0.61	28%	0.275	S	S	*	.	H	α-helix	trans	-73.2	-38.3	-175.1	-64.2	-16.7	0	0	0	111.6	E335 S341	E335-D339 PolarHBondContact O-N 2.89Å; D339-S341 PolarHBondContact O-N 2.97Å
340	N	94.5	Very high	94.1	Very high	29 Å²	29	58.1 Å²	58.1	16%	0.155	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	47.1	178	-62.7	-88.5	0	0	0	112.2	A336 Y342 M343 F344	A336-N340 WeakPolarHBondContact O-CB 3.2Å; A336-N340 PolarHBondContact O-N 3.26Å; A336-N340 PolarHBondContact O-ND2 3.42Å; N340-Y342 HydrophobicContact CB-CE1 3.87Å; N340-Y342 PolarHBondContact O-N 3.28Å; N340-Y342 WeakPolarHBondContact OD1-CE1 3.33Å; N340-Y342 PolarHBondContact OD1-OH 3.45Å; N340-Y342 VanDerWaalsContact OD1-OH 3.09Å; N340-M343 HydrophobicContact CB-CB 4.47Å; N340-M343 PolarHBondContact O-N 2.95Å; N340-F344 HydrophobicContact CB-CD2 3.78Å; N340-F344 HydrophobicContact CB-CE2 3.76Å; N340-F344 PolarHBondContact O-N 3.5Å
341	S	90.7	Very high	93.8	Very high	67 Å²	67	64.9 Å²	64.9	47%	0.469	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-14.4	-177.1	62.5	0	0	0	0	114.8	D339 F344 R360	D339-S341 PolarHBondContact O-N 2.97Å; S341-F344 CarbonylContact C-O 3.42Å; S341-R360 PolarHBondContact O-NE 3.38Å; S341-R360 PolarHBondContact O-NH2 2.83Å
342	Y	89.3	Confident	93.5	Very high	100 Å²	100	62.8 Å²	62.8	39%	0.392	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-33.3	170.6	66.3	-81.2	0	0	0	112.4	N340 R360 Y375	N340-Y342 HydrophobicContact CB-CE1 3.87Å; N340-Y342 PolarHBondContact O-N 3.28Å; N340-Y342 WeakPolarHBondContact OD1-CE1 3.33Å; N340-Y342 PolarHBondContact OD1-OH 3.45Å; N340-Y342 VanDerWaalsContact OD1-OH 3.09Å; Y342-R360 WeakPolarHBondContact O-CD 3.41Å; Y342-R360 WeakPolarHBondContact O-CG 3.38Å; Y342-Y375 AromaticContact CD2-CE2 3.76Å; Y342-Y375 HydrophobicContact CD2-CE2 3.76Å; Y342-Y375 AromaticContact CD2-CZ 3.92Å; Y342-Y375 HydrophobicContact CE2-CE2 4.21Å; Y342-Y375 AromaticContact CE2-CZ 3.88Å; Y342-Y375 WeakPolarHBondContact CE2-OH 3.37Å
343	M	92.4	Very high	93.2	Very high	35 Å²	35	66.1 Å²	66.1	17%	0.172	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-40.8	176	-98.7	165.4	47.4	0	0	112.1	K280 H284 N340 L359 R360	K280-M343 HydrophobicContact CB-CE 4.34Å; H284-M343 HydrophobicContact CB-CE 3.91Å; H284-M343 VanDerWaalsContact ND1-CE 3.33Å; H284-M343 WeakPolarHBondContact ND1-CE 3.41Å; N340-M343 HydrophobicContact CB-CB 4.47Å; N340-M343 PolarHBondContact O-N 2.95Å; M343-L359 CarbonylContact O-C 3.49Å; M343-L359 WeakPolarHBondContact O-CA 3.34Å; M343-R360 PolarHBondContact O-N 3.28Å
344	F	95	Very high	92.9	Very high	2 Å²	2	73.9 Å²	73.9	1%	0.009	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.3	-174.8	-50.8	-53.8	0	0	0	111.8	V283 H284 L287 L337 N340 S341 R358 L359 R360	V283-F344 HydrophobicContact CB-CE2 4.44Å; V283-F344 HydrophobicContact CB-CZ 4.02Å; V283-F344 HydrophobicContact CG1-CD1 4.44Å; V283-F344 HydrophobicContact CG1-CD2 4.49Å; V283-F344 HydrophobicContact CG1-CE1 3.84Å; V283-F344 HydrophobicContact CG1-CE2 3.87Å; V283-F344 HydrophobicContact CG1-CZ 3.51Å; H284-F344 HydrophobicContact CB-CE1 4.13Å; H284-F344 HydrophobicContact CB-CZ 4.15Å; L287-F344 HydrophobicContact CD1-CD1 3.87Å; L287-F344 HydrophobicContact CD1-CE1 4.03Å; L337-F344 HydrophobicContact CD2-CB 4.31Å; L337-F344 HydrophobicContact CD2-CD1 4.36Å; L337-F344 HydrophobicContact CD2-CD2 4.18Å; L337-F344 HydrophobicContact CD2-CG 4.01Å; N340-F344 HydrophobicContact CB-CD2 3.78Å; N340-F344 HydrophobicContact CB-CE2 3.76Å; N340-F344 PolarHBondContact O-N 3.5Å; S341-F344 CarbonylContact C-O 3.42Å; F344-R358 WeakPolarHBondContact CA-O 3.41Å; F344-L359 HydrophobicContact CD1-CD2 4Å; F344-L359 HydrophobicContact CE1-CD2 3.75Å; F344-R360 PolarHBondContact O-NH2 2.85Å; F344-R360 VanDerWaalsContact O-NH2 3.09Å
345	M	93.8	Very high	92.7	Very high	23 Å²	23	74.1 Å²	74.1	11%	0.113	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122	171.2	178.5	165.7	60.1	0	0	110.1	Y298 E349 V350 F357 R358 R360	Y298-M345 WeakPolarHBondContact OH-CE 3.22Å; M345-E349 WeakPolarHBondContact CA-OE1 3.26Å; M345-E349 HydrophobicContact CG-CB 4.33Å; M345-V350 HydrophobicContact CE-CG1 4.12Å; M345-V350 HydrophobicContact SD-CG1 3.63Å; M345-F357 WeakPolarHBondContact O-CA 3.43Å; M345-R358 HydrophobicContact CB-CG 4.11Å; M345-R358 VanDerWaalsContact CE-CD 3.41Å; M345-R358 HydrophobicContact CE-CG 3.78Å; M345-R358 PolarHBondContact N-O 2.96Å; M345-R358 PolarHBondContact O-N 3.42Å; M345-R358 VanDerWaalsContact O-N 3.12Å; M345-R360 HydrophobicContact CB-CG 4.03Å
346	S	94.4	Very high	92.7	Very high	17 Å²	17	71.6 Å²	71.6	12%	0.119	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	144	171.6	178.6	0	0	0	0	110.5	K348 E349 K354	S346-K348 PolarHBondContact O-N 2.82Å; S346-K348 PolarHBondContact OG-N 3.3Å; S346-E349 PolarHBondContact N-OE1 3.39Å; S346-E349 WeakPolarHBondContact O-CB 3Å; S346-E349 PolarHBondContact O-N 2.81Å; S346-K354 PolarHBondContact OG-O 3.25Å
347	G	90.3	Very high	92.6	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-27.9	170.5	0	0	0	0	0	112.8	E349 V350 K351 K352 L356	G347-E349 VanDerWaalsContact C-N 3.26Å; G347-E349 PolarHBondContact O-N 3.33Å; G347-V350 CarbonylContact O-C 3.42Å; G347-V350 WeakPolarHBondContact O-CG2 3.49Å; G347-V350 PolarHBondContact O-N 3.12Å; G347-V350 VanDerWaalsContact O-N 3.16Å; G347-K351 PolarHBondContact O-N 3.16Å; G347-K352 CarbonylContact C-O 3.55Å; G347-K352 CarbonylContact O-C 3.53Å; G347-K352 WeakPolarHBondContact O-CA 3.28Å; G347-K352 WeakPolarHBondContact O-CB 3.35Å; G347-K352 PolarHBondContact O-N 2.76Å; G347-L356 WeakPolarHBondContact CA-O 3.22Å; G347-L356 PolarHBondContact N-O 3.3Å
348	K	90.4	Very high	92.5	Very high	162 Å²	162	73 Å²	73	70%	0.704	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-40.1	175.2	-176.4	-174.2	174.3	-169.1	0	112.6	S346 V350 K351	S346-K348 PolarHBondContact O-N 2.82Å; S346-K348 PolarHBondContact OG-N 3.3Å; K348-V350 VanDerWaalsContact C-N 3.33Å; K348-V350 PolarHBondContact O-N 2.9Å; K348-K351 PolarHBondContact O-N 2.83Å
349	E	90.8	Very high	92.5	Very high	97 Å²	97	69.1 Å²	69.1	45%	0.453	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-36.9	-178.5	-60.6	168.8	-121.6	0	0	111.9	M345 S346 G347 R360	M345-E349 WeakPolarHBondContact CA-OE1 3.26Å; M345-E349 HydrophobicContact CG-CB 4.33Å; S346-E349 PolarHBondContact N-OE1 3.39Å; S346-E349 WeakPolarHBondContact O-CB 3Å; S346-E349 PolarHBondContact O-N 2.81Å; G347-E349 VanDerWaalsContact C-N 3.26Å; G347-E349 PolarHBondContact O-N 3.33Å; E349-R360 IonicContact OE1-CZ 3.32Å; E349-R360 IonicContact OE1-NH2 3.14Å; E349-R360 PolarHBondContact OE1-NH2 3.42Å; E349-R360 IonicContact OE2-CZ 2.7Å; E349-R360 VanDerWaalsContact OE2-CZ 3.22Å; E349-R360 IonicContact OE2-NH1 2.62Å; E349-R360 PolarHBondContact OE2-NH1 3.33Å; E349-R360 IonicContact OE2-NH2 3.38Å; E349-R360 PolarHBondContact OE2-NH2 3.08Å
350	V	87.5	Confident	92.3	Very high	54 Å²	54	67.5 Å²	67.5	33%	0.327	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	23.4	-177.3	-65	0	0	0	0	113	Y298 M345 G347 K348 K352	Y298-V350 HydrophobicContact CE1-CG2 3.86Å; M345-V350 HydrophobicContact CE-CG1 4.12Å; M345-V350 HydrophobicContact SD-CG1 3.63Å; G347-V350 CarbonylContact O-C 3.42Å; G347-V350 WeakPolarHBondContact O-CG2 3.49Å; G347-V350 PolarHBondContact O-N 3.12Å; G347-V350 VanDerWaalsContact O-N 3.16Å; K348-V350 VanDerWaalsContact C-N 3.33Å; K348-V350 PolarHBondContact O-N 2.9Å; V350-K352 HydrophobicContact CG2-CB 4.24Å; V350-K352 HydrophobicContact CG2-CD 3.99Å; V350-K352 HydrophobicContact CG2-CG 3.96Å; V350-K352 PolarHBondContact O-N 3.27Å
351	K	89.9	Confident	92	Very high	205 Å²	205	70 Å²	70	89%	0.891	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	27.2	179.1	-54.5	177.1	-177.3	174.3	0	114.6	G347 K348	G347-K351 PolarHBondContact O-N 3.16Å; K348-K351 PolarHBondContact O-N 2.83Å
352	K	90.6	Very high	92	Very high	97 Å²	97	67.2 Å²	67.2	42%	0.422	30%	0.302	S	S	.	.	S	Bend	trans	-100.7	177.8	171.7	-64.2	-175.2	-180	-171	0	111.3	Y298 G347 V350 L356	Y298-K352 HydrophobicContact CD1-CD 4.28Å; Y298-K352 HydrophobicContact CE1-CD 4.15Å; G347-K352 CarbonylContact C-O 3.55Å; G347-K352 CarbonylContact O-C 3.53Å; G347-K352 WeakPolarHBondContact O-CA 3.28Å; G347-K352 WeakPolarHBondContact O-CB 3.35Å; G347-K352 PolarHBondContact O-N 2.76Å; V350-K352 HydrophobicContact CG2-CB 4.24Å; V350-K352 HydrophobicContact CG2-CD 3.99Å; V350-K352 HydrophobicContact CG2-CG 3.96Å; V350-K352 PolarHBondContact O-N 3.27Å; K352-L356 HydrophobicContact CB-CD1 4.34Å
353	K	91.4	Very high	92.1	Very high	142 Å²	142	64.6 Å²	64.6	62%	0.617	29%	0.293	S	S	*	.			trans	-58.7	138.7	176	-53	-175.1	-175.3	178.9	0	111.2	H355 L356	K353-H355 VanDerWaalsContact C-N 3.3Å; K353-H355 VanDerWaalsContact CB-NE2 3.3Å; K353-H355 WeakPolarHBondContact CB-NE2 3.34Å; K353-H355 WeakPolarHBondContact CD-NE2 3.41Å; K353-H355 PolarHBondContact O-N 2.86Å; K353-L356 HydrophobicContact CB-CD1 4.18Å; K353-L356 HydrophobicContact CB-CG 4.24Å; K353-L356 PolarHBondContact O-N 3.5Å; K353-L356 VanDerWaalsContact O-N 3.17Å
354	K	91.2	Very high	92.1	Very high	163 Å²	163	63.1 Å²	63.1	71%	0.709	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-27.3	-172.7	66.3	169.7	-175.4	169.1	0	115.8	S346	S346-K354 PolarHBondContact OG-O 3.25Å
355	H	93.3	Very high	92	Very high	62 Å²	62	63.1 Å²	63.1	29%	0.287	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-3.6	-179.4	47.8	-126.1	0	0	0	113.8	D300 S301 K353 F357	D300-H355 WeakPolarHBondContact CA-O 3.21Å; D300-H355 IonicContact OD2-CD2 3.19Å; D300-H355 PolarHBondContact OD2-CD2 3.2Å; D300-H355 IonicContact OD2-CG 2.66Å; D300-H355 IonicContact OD2-NE2 2.61Å; D300-H355 PolarHBondContact OD2-NE2 3.17Å; S301-H355 PolarHBondContact N-O 3Å; S301-H355 PolarHBondContact OG-O 3.48Å; K353-H355 VanDerWaalsContact C-N 3.3Å; K353-H355 VanDerWaalsContact CB-NE2 3.3Å; K353-H355 WeakPolarHBondContact CB-NE2 3.34Å; K353-H355 WeakPolarHBondContact CD-NE2 3.41Å; K353-H355 PolarHBondContact O-N 2.86Å; H355-F357 WeakPolarHBondContact O-CD2 3.37Å
356	L	95.7	Very high	91.7	Very high	36 Å²	36	63.9 Å²	63.9	19%	0.188	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	127.4	172.7	-66.4	176.5	0	0	0	108.9	Y298 F299 D300 G347 K352 K353	Y298-L356 HydrophobicContact CD1-CB 4.43Å; F299-L356 CarbonylContact O-C 3.47Å; F299-L356 WeakPolarHBondContact O-CA 3.36Å; D300-L356 HydrophobicContact CB-CD2 4.19Å; G347-L356 WeakPolarHBondContact CA-O 3.22Å; G347-L356 PolarHBondContact N-O 3.3Å; K352-L356 HydrophobicContact CB-CD1 4.34Å; K353-L356 HydrophobicContact CB-CD1 4.18Å; K353-L356 HydrophobicContact CB-CG 4.24Å; K353-L356 PolarHBondContact O-N 3.5Å; K353-L356 VanDerWaalsContact O-N 3.17Å
357	F	96.6	Very high	91.3	Very high	5 Å²	5	64 Å²	64	2%	0.022	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	159.3	177.3	-69.8	-92.6	0	0	0	111.7	Y298 F299 L334 L337 M345 H355	Y298-F357 WeakPolarHBondContact CA-O 3.28Å; F299-F357 PolarHBondContact N-O 3.46Å; F299-F357 PolarHBondContact O-N 3.45Å; L334-F357 HydrophobicContact CD1-CE2 4.49Å; L334-F357 HydrophobicContact CD1-CZ 4.4Å; L337-F357 HydrophobicContact CB-CD1 4.23Å; L337-F357 HydrophobicContact CB-CE1 3.96Å; L337-F357 HydrophobicContact CB-CZ 4.21Å; L337-F357 HydrophobicContact CD1-CD1 4.46Å; L337-F357 HydrophobicContact CD1-CD2 3.91Å; L337-F357 HydrophobicContact CD1-CE2 4.02Å; L337-F357 HydrophobicContact CD1-CG 4.13Å; L337-F357 HydrophobicContact CD1-CZ 4.35Å; L337-F357 HydrophobicContact CD2-CB 3.96Å; L337-F357 HydrophobicContact CD2-CD1 3.84Å; L337-F357 HydrophobicContact CD2-CD2 4.46Å; L337-F357 HydrophobicContact CD2-CE1 4.43Å; L337-F357 HydrophobicContact CD2-CG 3.85Å; L337-F357 HydrophobicContact CG-CD1 4.42Å; L337-F357 HydrophobicContact CG-CG 4.47Å; M345-F357 WeakPolarHBondContact O-CA 3.43Å; H355-F357 WeakPolarHBondContact O-CD2 3.37Å
358	R	94.3	Very high	90.5	Very high	36 Å²	36	68.9 Å²	68.9	14%	0.136	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	161.3	169.1	67.3	163.8	-94.2	-166.8	-4.6	112	R297 Y298 F344 M345 R360	R297-R358 WeakPolarHBondContact O-CB 3.42Å; R297-R358 WeakPolarHBondContact O-CD 3.3Å; Y298-R358 HydrophobicContact CD1-CB 4.26Å; Y298-R358 HydrophobicContact CD1-CG 4.11Å; Y298-R358 HydrophobicContact CE1-CB 4.45Å; Y298-R358 HydrophobicContact CE1-CG 3.79Å; Y298-R358 VanDerWaalsContact CZ-CD 3.5Å; F344-R358 WeakPolarHBondContact CA-O 3.41Å; M345-R358 HydrophobicContact CB-CG 4.11Å; M345-R358 VanDerWaalsContact CE-CD 3.41Å; M345-R358 HydrophobicContact CE-CG 3.78Å; M345-R358 PolarHBondContact N-O 2.96Å; M345-R358 PolarHBondContact O-N 3.42Å; M345-R358 VanDerWaalsContact O-N 3.12Å; R358-R360 PolarHBondContact NH2-O 3.01Å
359	L	94	Very high	89.2	Confident	5 Å²	5	68.5 Å²	68.5	3%	0.026	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	139.8	163.6	-51.5	179.5	0	0	0	110	H284 L287 Y288 M343 F344 I361 F362	H284-L359 HydrophobicContact CB-CD2 4.45Å; L287-L359 HydrophobicContact CB-CD2 3.84Å; L287-L359 HydrophobicContact CB-CG 4.14Å; L287-L359 HydrophobicContact CD1-CD2 4.18Å; Y288-L359 HydrophobicContact CD2-CD1 4.03Å; M343-L359 CarbonylContact O-C 3.49Å; M343-L359 WeakPolarHBondContact O-CA 3.34Å; F344-L359 HydrophobicContact CD1-CD2 4Å; F344-L359 HydrophobicContact CE1-CD2 3.75Å; L359-I361 WeakPolarHBondContact CB-O 3.3Å; L359-F362 HydrophobicContact CD1-CD2 4.33Å
360	R	92.1	Very high	87.6	Confident	80 Å²	80	66.5 Å²	66.5	30%	0.302	33%	0.33	S	S	.	.	S	Bend	trans	-65.9	-60.8	171.3	-70.1	-155	-169	-87.6	-16.7	110.2	S341 Y342 M343 F344 M345 E349 R358	S341-R360 PolarHBondContact O-NE 3.38Å; S341-R360 PolarHBondContact O-NH2 2.83Å; Y342-R360 WeakPolarHBondContact O-CD 3.41Å; Y342-R360 WeakPolarHBondContact O-CG 3.38Å; M343-R360 PolarHBondContact O-N 3.28Å; F344-R360 PolarHBondContact O-NH2 2.85Å; F344-R360 VanDerWaalsContact O-NH2 3.09Å; M345-R360 HydrophobicContact CB-CG 4.03Å; E349-R360 IonicContact OE1-CZ 3.32Å; E349-R360 IonicContact OE1-NH2 3.14Å; E349-R360 PolarHBondContact OE1-NH2 3.42Å; E349-R360 IonicContact OE2-CZ 2.7Å; E349-R360 VanDerWaalsContact OE2-CZ 3.22Å; E349-R360 IonicContact OE2-NH1 2.62Å; E349-R360 PolarHBondContact OE2-NH1 3.33Å; E349-R360 IonicContact OE2-NH2 3.38Å; E349-R360 PolarHBondContact OE2-NH2 3.08Å; R358-R360 PolarHBondContact NH2-O 3.01Å
361	I	88.9	Confident	85.4	Confident	83 Å²	83	70.7 Å²	70.7	43%	0.426	36%	0.356	S	S	.	.	S	Bend	trans	-92	126.8	172.8	-53.3	175.9	0	0	0	107.2	L359 F363 F382	L359-I361 WeakPolarHBondContact CB-O 3.3Å; I361-F363 HydrophobicContact CG2-CB 4.07Å; I361-F363 PolarHBondContact O-N 3.29Å; I361-F363 VanDerWaalsContact O-N 3.17Å; I361-F382 HydrophobicContact CD1-CZ 4.43Å
362	F	90.7	Very high	83.5	Confident	7 Å²	7	64.1 Å²	64.1	3%	0.031	33%	0.328	C	S	.	.			trans	-84.6	90.5	175	177.6	-107.8	0	0	0	110	Y288 V292 L359 E384 I385 I387	Y288-F362 AromaticContact CD2-CD2 3.95Å; Y288-F362 HydrophobicContact CD2-CD2 3.95Å; Y288-F362 AromaticContact CD2-CE2 3.42Å; Y288-F362 HydrophobicContact CD2-CE2 3.42Å; Y288-F362 VanDerWaalsContact CD2-CE2 3.42Å; Y288-F362 AromaticContact CD2-CZ 3.98Å; Y288-F362 HydrophobicContact CD2-CZ 3.98Å; Y288-F362 AromaticContact CE2-CD2 3.96Å; Y288-F362 HydrophobicContact CE2-CD2 3.96Å; Y288-F362 HydrophobicContact CE2-CE1 4.04Å; Y288-F362 AromaticContact CE2-CE2 3.3Å; Y288-F362 HydrophobicContact CE2-CE2 3.3Å; Y288-F362 AromaticContact CE2-CZ 3.36Å; Y288-F362 HydrophobicContact CE2-CZ 3.36Å; Y288-F362 HydrophobicContact CG-CE2 4.3Å; Y288-F362 AromaticContact CZ-CZ 3.83Å; V292-F362 HydrophobicContact CG2-CE2 4.35Å; V292-F362 HydrophobicContact CG2-CZ 3.8Å; L359-F362 HydrophobicContact CD1-CD2 4.33Å; F362-E384 HydrophobicContact CB-CG 4.04Å; F362-E384 WeakPolarHBondContact CB-OE1 3.3Å; F362-E384 HydrophobicContact CD1-CG 4.49Å; F362-I385 HydrophobicContact CD1-CB 4.11Å; F362-I385 WeakPolarHBondContact CD1-O 3.05Å; F362-I385 HydrophobicContact CE1-CB 3.89Å; F362-I385 HydrophobicContact CE1-CG2 4.07Å; F362-I385 WeakPolarHBondContact CE1-O 3.39Å; F362-I387 HydrophobicContact CD1-CD1 4.07Å; F362-I387 HydrophobicContact CD1-CG1 3.94Å; F362-I387 HydrophobicContact CD2-CD1 4.4Å; F362-I387 HydrophobicContact CE1-CD1 3.69Å; F362-I387 HydrophobicContact CE1-CG1 3.33Å; F362-I387 HydrophobicContact CE2-CD1 4.07Å; F362-I387 HydrophobicContact CG-CD1 4.42Å; F362-I387 HydrophobicContact CZ-CD1 3.69Å; F362-I387 HydrophobicContact CZ-CG1 3.69Å
363	F	90.8	Very high	80.8	Confident	46 Å²	46	65.3 Å²	65.3	20%	0.202	35%	0.346	C	S	.	.	S	Bend	trans	-150.9	149.7	-177.9	-161.6	-106.6	0	0	0	109.3	K209 W225 H284 I361 I385	K209-F363 HydrophobicContact CD-CZ 4.15Å; W225-F363 HydrophobicContact CH2-CD2 4.45Å; W225-F363 HydrophobicContact CH2-CE1 4.01Å; W225-F363 AromaticContact CH2-CE2 3.72Å; W225-F363 HydrophobicContact CH2-CE2 3.72Å; W225-F363 AromaticContact CH2-CZ 3.45Å; W225-F363 HydrophobicContact CH2-CZ 3.45Å; W225-F363 VanDerWaalsContact CH2-CZ 3.45Å; W225-F363 HydrophobicContact CZ2-CD2 4.47Å; W225-F363 AromaticContact CZ2-CE2 3.6Å; W225-F363 HydrophobicContact CZ2-CE2 3.6Å; W225-F363 AromaticContact CZ2-CZ 3.71Å; W225-F363 HydrophobicContact CZ2-CZ 3.71Å; H284-F363 PolarHBondContact NE2-O 3.46Å; I361-F363 HydrophobicContact CG2-CB 4.07Å; I361-F363 PolarHBondContact O-N 3.29Å; I361-F363 VanDerWaalsContact O-N 3.17Å; F363-I385 HydrophobicContact CD2-CD1 3.96Å; F363-I385 HydrophobicContact CD2-CG1 4.25Å; F363-I385 HydrophobicContact CE2-CD1 4.29Å
364	P	92.9	Very high	77.9	Confident	3 Å²	3	64 Å²	64	2%	0.019	35%	0.35	C	S	.	.			trans	-54.7	150.7	171.9	-31.5	38.8	0	0	0	113.4	W225 Y288 I385	W225-P364 HydrophobicContact CH2-CB 4.28Å; W225-P364 HydrophobicContact CH2-CG 3.62Å; W225-P364 HydrophobicContact CZ3-CB 4.21Å; W225-P364 HydrophobicContact CZ3-CG 3.76Å; Y288-P364 HydrophobicContact CE1-CG 4.01Å; Y288-P364 HydrophobicContact CE2-CG 3.95Å; P364-I385 HydrophobicContact CG-CD1 4.27Å
365	P	92.9	Very high	75.6	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.013	35%	0.345	C	S	.	.			trans	-62	166.7	168.5	29	-35	0	0	0	111.6	R256 F257 H284 L285	R256-P365 PolarHBondContact NE-O 2.95Å; R256-P365 PolarHBondContact NH2-O 3.24Å; F257-P365 HydrophobicContact CE2-CB 3.81Å; F257-P365 HydrophobicContact CE2-CG 3.82Å; F257-P365 HydrophobicContact CZ-CB 4.26Å; H284-P365 HydrophobicContact CB-CB 4.2Å; L285-P365 HydrophobicContact CB-CG 4.14Å; L285-P365 HydrophobicContact CD1-CG 4.15Å
366	A	87.2	Confident	72.8	Confident	40 Å²	40	66.1 Å²	66.1	33%	0.331	37%	0.365	S	S	.	.			trans	-129.6	136.7	-178.9	0	0	0	0	0	110.2
367	P	86.3	Confident	69.6	Low	18 Å²	18	69.9 Å²	69.9	12%	0.117	39%	0.389	C	S	.	.			trans	-62.5	147.5	168.4	-22.9	34.5	0	0	0	111.6	R256 F257 L275 N369 C370	R256-P367 HydrophobicContact CB-CG 4.29Å; R256-P367 WeakPolarHBondContact O-CG 3.44Å; F257-P367 HydrophobicContact CD1-CG 4.45Å; L275-P367 HydrophobicContact CD1-CB 3.82Å; L275-P367 HydrophobicContact CD1-CG 3.98Å; P367-N369 PolarHBondContact O-N 3.48Å; P367-C370 VanDerWaalsContact O-CB 3.28Å; P367-C370 WeakPolarHBondContact O-CB 3.35Å; P367-C370 PolarHBondContact O-N 2.75Å
368	P	73.7	Confident	66.7	Low	103 Å²	103	79.1 Å²	79.1	67%	0.669	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.6	-175.1	-27.5	35.3	0	0	0	115.6	C370	P368-C370 VanDerWaalsContact C-N 3.32Å
369	N	62.5	Low	63.7	Low	155 Å²	155	80.8 Å²	80.8	83%	0.829	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-1.5	-179.5	-62.7	-12.8	0	0	0	113.3	P367 T371	P367-N369 PolarHBondContact O-N 3.48Å; N369-T371 PolarHBondContact O-N 3.39Å
370	C	56.3	Low	60.5	Low	54 Å²	54	88.3 Å²	88.3	37%	0.365	50%	0.498	S	S	.	.			trans	-80.7	113	176.2	-163.3	0	0	0	0	109.3	P367 P368 E372	P367-C370 VanDerWaalsContact O-CB 3.28Å; P367-C370 WeakPolarHBondContact O-CB 3.35Å; P367-C370 PolarHBondContact O-N 2.75Å; P368-C370 VanDerWaalsContact C-N 3.32Å; C370-E372 PolarHBondContact O-N 2.64Å
371	T	42.2	Very low	57.5	Low	142 Å²	142	90.1 Å²	90.1	87%	0.871	52%	0.52	S	S	*	.			trans	-76.4	58.3	178.9	57.9	0	0	0	0	111.9	N369	N369-T371 PolarHBondContact O-N 3.39Å
372	E	49.5	Very low	54.9	Low	67 Å²	67	92.9 Å²	92.9	31%	0.313	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-75.7	138.2	163.2	-60.2	-155.3	-172.4	0	0	108.8	K209 R256 C370 T374	K209-E372 IonicContact NZ-OE1 3.96Å; K209-E372 PolarHBondContact NZ-OE1 2.56Å; R256-E372 IonicContact CZ-OE1 2.83Å; R256-E372 IonicContact NH1-OE1 3.25Å; R256-E372 PolarHBondContact NH1-OE1 2.98Å; R256-E372 IonicContact NH2-OE1 3.74Å; R256-E372 PolarHBondContact NH2-OE1 3.1Å; C370-E372 PolarHBondContact O-N 2.64Å; E372-T374 PolarHBondContact O-N 3.17Å
373	P	33.5	Very low	52.5	Low	123 Å²	123	101.3 Å²	101.3	80%	0.799	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-63.2	137.4	-170.1	24.3	-34	0	0	0	112.1	Y375	P373-Y375 PolarHBondContact O-N 2.91Å
374	T	31.1	Very low	50.8	Low	113 Å²	113	102.3 Å²	102.3	69%	0.693	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-54.6	126.6	-175.9	-31.4	0	0	0	0	111	E372 T376	E372-T374 PolarHBondContact O-N 3.17Å; T374-T376 PolarHBondContact O-N 3.48Å; T374-T376 PolarHBondContact O-OG1 2.95Å
375	Y	42.7	Very low	49.3	Very low	157 Å²	157	103.1 Å²	103.1	62%	0.616	58%	0.578	S	S	*	*	S	Bend	trans	-74.1	55.7	-166.3	44.7	-93.2	0	0	0	114.2	Y342 P373	Y342-Y375 AromaticContact CD2-CE2 3.76Å; Y342-Y375 HydrophobicContact CD2-CE2 3.76Å; Y342-Y375 AromaticContact CD2-CZ 3.92Å; Y342-Y375 HydrophobicContact CE2-CE2 4.21Å; Y342-Y375 AromaticContact CE2-CZ 3.88Å; Y342-Y375 WeakPolarHBondContact CE2-OH 3.37Å; P373-Y375 PolarHBondContact O-N 2.91Å
376	T	34.9	Very low	47.5	Very low	113 Å²	113	108.3 Å²	108.3	69%	0.693	61%	0.61	S	S	*	*			trans	-128	44.7	-170	34.8	0	0	0	0	113.8	T374	T374-T376 PolarHBondContact O-N 3.48Å; T374-T376 PolarHBondContact O-OG1 2.95Å
377	V	29.4	Very low	45.9	Very low	116 Å²	116	107.4 Å²	107.4	70%	0.703	60%	0.599	S	S	*	*			trans	-131.9	123.6	159	179.5	0	0	0	0	110.3
378	M	35.2	Very low	43.9	Very low	198 Å²	198	113.8 Å²	113.8	98%	0.975	63%	0.625	S	S	*	*	S	Bend	trans	-85.7	106.4	163.3	-73.1	-93	-69.9	0	0	107.9
379	G	30.7	Very low	42.2	Very low	71 Å²	71	112.4 Å²	112.4	73%	0.732	63%	0.63	S	S	*	*			trans	178.3	-51.9	176.4	0	0	0	0	0	116.4
380	E	26.3	Very low	41.1	Very low	163 Å²	163	106.5 Å²	106.5	76%	0.762	60%	0.6	S	S	*	*	S	Bend	trans	-91.4	149.2	-166.1	-64.2	-153.2	136	0	0	114.9	F382	E380-F382 PolarHBondContact O-N 2.97Å
381	P	29.2	Very low	40.1	Very low	118 Å²	118	113 Å²	113	77%	0.766	62%	0.622	S	S	*	*			trans	-77	89.4	177.4	32.3	-34.5	0	0	0	110.9	H383	P381-H383 PolarHBondContact O-N 3.35Å
382	F	34.3	Very low	39.7	Very low	141 Å²	141	111.6 Å²	111.6	62%	0.618	62%	0.615	S	S	*	*			trans	-44	137.8	168.6	-74.3	-92	0	0	0	111.7	I361 E380 E384	I361-F382 HydrophobicContact CD1-CZ 4.43Å; E380-F382 PolarHBondContact O-N 2.97Å; F382-E384 PolarHBondContact O-N 2.97Å
383	H	42	Very low	39.2	Very low	184 Å²	184	112.1 Å²	112.1	85%	0.852	63%	0.631	S	S	*	*			trans	-70.6	73	163.5	-66.4	7.9	0	0	0	109.4	P381 I385	P381-H383 PolarHBondContact O-N 3.35Å; H383-I385 PolarHBondContact O-N 2.85Å
384	E	53.1	Low	39.2	Very low	67 Å²	67	114.9 Å²	114.9	31%	0.313	63%	0.631	S	S	.	*			trans	-60	124.4	172.4	-171.9	-175	-164.3	0	0	108.6	R297 F362 F382 T386	R297-E384 IonicContact CZ-OE1 3.22Å; R297-E384 IonicContact NE-OE1 2.8Å; R297-E384 IonicContact NH2-OE1 3.48Å; R297-E384 PolarHBondContact NH2-OE1 2.89Å; R297-E384 IonicContact NH2-OE2 2.66Å; R297-E384 PolarHBondContact NH2-OE2 3.34Å; F362-E384 HydrophobicContact CB-CG 4.04Å; F362-E384 WeakPolarHBondContact CB-OE1 3.3Å; F362-E384 HydrophobicContact CD1-CG 4.49Å; F382-E384 PolarHBondContact O-N 2.97Å; E384-T386 PolarHBondContact O-N 2.92Å; E384-T386 PolarHBondContact O-OG1 3.37Å
385	I	63.4	Low	39	Very low	20 Å²	20	114.4 Å²	114.4	10%	0.103	63%	0.632	C	S	.	*			trans	-58.8	106.1	-179.4	-61.1	174.4	0	0	0	108.2	W225 Y226 F362 F363 P364 H383 I387	W225-I385 HydrophobicContact CH2-CD1 4.36Å; W225-I385 HydrophobicContact CZ2-CD1 3.87Å; Y226-I385 HydrophobicContact CD1-CD1 4.03Å; Y226-I385 HydrophobicContact CD1-CG2 4.22Å; Y226-I385 HydrophobicContact CD2-CD1 4.34Å; Y226-I385 HydrophobicContact CD2-CG2 3.88Å; Y226-I385 HydrophobicContact CE1-CG2 3.92Å; Y226-I385 HydrophobicContact CE2-CG2 3.51Å; Y226-I385 HydrophobicContact CG-CD1 3.87Å; Y226-I385 HydrophobicContact CG-CG2 4.23Å; F362-I385 HydrophobicContact CD1-CB 4.11Å; F362-I385 WeakPolarHBondContact CD1-O 3.05Å; F362-I385 HydrophobicContact CE1-CB 3.89Å; F362-I385 HydrophobicContact CE1-CG2 4.07Å; F362-I385 WeakPolarHBondContact CE1-O 3.39Å; F363-I385 HydrophobicContact CD2-CD1 3.96Å; F363-I385 HydrophobicContact CD2-CG1 4.25Å; F363-I385 HydrophobicContact CE2-CD1 4.29Å; P364-I385 HydrophobicContact CG-CD1 4.27Å; H383-I385 PolarHBondContact O-N 2.85Å; I385-I387 PolarHBondContact O-N 2.92Å
386	T	54.4	Low	38.4	Very low	112 Å²	112	116.2 Å²	116.2	69%	0.687	64%	0.644	S	S	*	*			trans	-81.3	98.4	-165.7	-68.8	0	0	0	0	109.9	E384 K388	E384-T386 PolarHBondContact O-N 2.92Å; E384-T386 PolarHBondContact O-OG1 3.37Å; T386-K388 PolarHBondContact O-N 3.48Å
387	I	53.9	Low	38.2	Very low	20 Å²	20	116.1 Å²	116.1	10%	0.103	65%	0.647	C	S	.	*			trans	-55.6	105.5	177.2	-53.9	172.2	0	0	0	109.3	K295 F362 I385 G389 C390	K295-I387 HydrophobicContact CB-CG2 4.17Å; K295-I387 HydrophobicContact CD-CG2 4.42Å; K295-I387 HydrophobicContact CG-CG2 3.93Å; F362-I387 HydrophobicContact CD1-CD1 4.07Å; F362-I387 HydrophobicContact CD1-CG1 3.94Å; F362-I387 HydrophobicContact CD2-CD1 4.4Å; F362-I387 HydrophobicContact CE1-CD1 3.69Å; F362-I387 HydrophobicContact CE1-CG1 3.33Å; F362-I387 HydrophobicContact CE2-CD1 4.07Å; F362-I387 HydrophobicContact CG-CD1 4.42Å; F362-I387 HydrophobicContact CZ-CD1 3.69Å; F362-I387 HydrophobicContact CZ-CG1 3.69Å; I385-I387 PolarHBondContact O-N 2.92Å; I387-G389 PolarHBondContact O-N 3.33Å; I387-C390 HydrophobicContact CB-CB 4Å; I387-C390 HydrophobicContact CG2-CB 4.35Å; I387-C390 PolarHBondContact O-N 2.87Å
388	K	44	Very low	38.2	Very low	152 Å²	152	116.6 Å²	116.6	66%	0.661	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.2	95.2	178.1	-67.5	169.7	-178.6	162	0	110.2	K295 T386	K295-K388 PolarHBondContact NZ-O 2.93Å; T386-K388 PolarHBondContact O-N 3.48Å
389	G	37.4	Very low	37.9	Very low	75 Å²	75	115 Å²	115	77%	0.773	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	127.9	-15.8	-177.2	0	0	0	0	0	116.1	I387	I387-G389 PolarHBondContact O-N 3.33Å
390	C	40.1	Very low	37.7	Very low	30 Å²	30	120.2 Å²	120.2	20%	0.203	64%	0.641	C	S	.	*	P	Polyproline II helix	trans	-86.5	126.5	178.1	-79	0	0	0	0	112	K295 I387	K295-C390 PolarHBondContact O-SG 2.91Å; K295-C390 VanDerWaalsContact O-SG 3.34Å; I387-C390 HydrophobicContact CB-CB 4Å; I387-C390 HydrophobicContact CG2-CB 4.35Å; I387-C390 PolarHBondContact O-N 2.87Å
391	K	34.5	Very low	37.7	Very low	191 Å²	191	119.5 Å²	119.5	83%	0.83	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-64.6	131	169.3	-66.5	-173.1	179	-176.3	0	110.1	R297	R297-K391 PolarHBondContact NH1-O 3.32Å
392	P	35	Very low	37.7	Very low	112 Å²	112	119.8 Å²	119.8	73%	0.727	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-63.6	145.4	172.5	26.4	-33.2	0	0	0	110.4
393	A	38.1	Very low	37.5	Very low	78 Å²	78	119.5 Å²	119.5	65%	0.645	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-82.4	131.1	170.4	0	0	0	0	0	108.4	S395	A393-S395 PolarHBondContact O-N 3.06Å
394	K	32.8	Very low	36.8	Very low	181 Å²	181	115.3 Å²	115.3	79%	0.787	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-59.4	132.9	172.3	-69	-170	174.7	-169.8	0	109.5	F396	K394-F396 HydrophobicContact CB-CE2 4.37Å; K394-F396 WeakPolarHBondContact O-CD2 3.47Å; K394-F396 PolarHBondContact O-N 2.58Å
395	S	26.4	Very low	35.6	Very low	104 Å²	104	119.9 Å²	119.9	73%	0.727	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-63.3	127	168.1	38.7	0	0	0	0	109.4	A393	A393-S395 PolarHBondContact O-N 3.06Å
396	F	31.7	Very low	33.9	Very low	195 Å²	195	124.6 Å²	124.6	86%	0.855	71%	0.705	S	S	*	*			trans	-106.5	68.2	173.3	-76.6	-78.8	0	0	0	109.3	K394 D398	K394-F396 HydrophobicContact CB-CE2 4.37Å; K394-F396 WeakPolarHBondContact O-CD2 3.47Å; K394-F396 PolarHBondContact O-N 2.58Å; F396-D398 VanDerWaalsContact C-N 3.32Å; F396-D398 PolarHBondContact O-N 3.04Å
397	S	30.1	Very low	32.6	Very low	110 Å²	110	127.3 Å²	127.3	77%	0.769	72%	0.715	S	S	*	*			trans	-88.6	57.9	-179.8	57.4	0	0	0	0	112.3
398	D	30.1	Very low	31.3	Very low	126 Å²	126	130 Å²	130	67%	0.674	75%	0.748	S	S	*	*			trans	-157.9	110.5	158.2	-136.3	-24.8	0	0	0	113.3	F396	F396-D398 VanDerWaalsContact C-N 3.32Å; F396-D398 PolarHBondContact O-N 3.04Å
399	M	28.2	Very low	30.6	Very low	165 Å²	165	130.6 Å²	130.6	81%	0.813	76%	0.757	S	S	*	*			trans	-162.2	86.6	164.1	-102.4	-99	68.5	0	0	107.9	I401	M399-I401 PolarHBondContact O-N 2.93Å
400	K	27.5	Very low	30.1	Very low	180 Å²	180	133.5 Å²	133.5	78%	0.783	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-65.1	119.8	176.1	-69.2	173.5	-178.2	169.1	0	110.5
401	I	26.2	Very low	29.5	Very low	149 Å²	149	138.9 Å²	138.9	76%	0.764	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-96	131.8	166.6	-61	178.5	0	0	0	107.9	M399	M399-I401 PolarHBondContact O-N 2.93Å
402	P	29.3	Very low	29.2	Very low	123 Å²	123	137.8 Å²	137.8	80%	0.799	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-70.8	130.6	-179.3	-17	31.1	0	0	0	112.4
403	V	28.5	Very low	28.8	Very low	136 Å²	136	140.8 Å²	140.8	82%	0.824	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-79.2	132.7	168.5	177.1	0	0	0	0	109.3
404	A	27	Very low	28.3	Very low	96 Å²	96	145.6 Å²	145.6	79%	0.793	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-84.8	140.1	176	0	0	0	0	0	111.5
405	L	28.7	Very low	28	Very low	162 Å²	162	146.3 Å²	146.3	85%	0.848	78%	0.777	S	S	*	*			trans	-136.3	162.3	172.5	-101.7	161.7	0	0	0	110.4
406	T	27.9	Very low	28.2	Very low	120 Å²	120	151.3 Å²	151.3	74%	0.736	79%	0.785	S	S	*	*			trans	-93.8	143.9	-149.4	51.3	0	0	0	0	116.4
407	N	27	Very low	27.9	Very low	168 Å²	168	151.8 Å²	151.8	90%	0.898	79%	0.787	S	S	*	*			trans	36.6	110.1	148.9	-64.9	-13.1	0	0	0	119.7
408	G	26.9	Very low	27.9	Very low	78 Å²	78	156 Å²	156	80%	0.804	79%	0.791	S	S	*	*			trans	-144.8	149.8	161.1	0	0	0	0	0	110.9
409	I	28.5	Very low	27.9	Very low	163 Å²	163	159.3 Å²	159.3	84%	0.836	80%	0.8	S	S	*	*			trans	-114	128.3	-167.2	-48	175.6	0	0	0	110.4
410	E	27.5	Very low	27.9	Very low	137 Å²	137	160.1 Å²	160.1	64%	0.64	80%	0.799	S	S	*	*				170.1	133.3	121	-89.4	-152.8	169.4	0	0	117.8
411	K	27.7	Very low	27.9	Very low	142 Å²	142	163 Å²	163	62%	0.617	80%	0.804	S	S	*	*			trans	54.1	124.1	136.4	-63.7	-177.1	-164.2	139.9	0	123
412	K	27.2	Very low	28.1	Very low	168 Å²	168	163 Å²	163	73%	0.73	80%	0.799	S	S	*	*			trans	92.7	113.4	131	-75.4	166.7	-176.9	167.8	0	121.8
413	K	27.4	Very low	28.2	Very low	175 Å²	175	166.4 Å²	166.4	76%	0.761	80%	0.804	S	S	*	*				103.6	127	121	-79.6	174.5	178.7	177.4	0	122
414	K	28.2	Very low	28.2	Very low	180 Å²	180	166.6 Å²	166.6	78%	0.783	80%	0.796	S	S	*	*			trans	90	97.7	136.9	-78.1	-179.8	174.4	-177.3	0	122.5
415	K	26.8	Very low	28.2	Very low	196 Å²	196	166.4 Å²	166.4	85%	0.852	80%	0.795	S	S	*	*				49.3	113.7	115.4	-68.3	-175.8	174	-177.7	0	121.4
416	K	29.3	Very low	28.2	Very low	209 Å²	209	169 Å²	169	91%	0.909	79%	0.793	S	S	*	*				170.3	131.4	121	-93.2	164.5	180	179.8	0	108
417	K	26.8	Very low	28	Very low	204 Å²	204	168.2 Å²	168.2	89%	0.887	79%	0.791	S	S	*	*			cis	97	83.5	16.2	-160	-177.8	-176.4	177.2	0	117.4
418	K	29.4	Very low	28.1	Very low	200 Å²	200	166.1 Å²	166.1	87%	0.87	78%	0.779	S	S	*	*			trans	-148.8	130.4	145.6	-89.4	-179.7	174.7	178.3	0	106.3
419	K	29.5	Very low	28.1	Very low	194 Å²	194	169.9 Å²	169.9	84%	0.843	78%	0.776	S	S	*	*				64.8	133.5	63.1	-88.5	-166	173.5	-179	0	113.2
420	K	28	Very low	28.1	Very low	182 Å²	182	168.1 Å²	168.1	79%	0.791	77%	0.773	S	S	*	*			cis	-168.2	166	-4.1	-168.7	-172	172.2	-169.2	0	110.2
421	R	29.2	Very low	28.2	Very low	240 Å²	240	169.8 Å²	169.8	91%	0.906	79%	0.785	S	S	*	*			trans	93.9	121.4	175.8	-67.3	179.1	154.9	163.1	-7	112.7
422	K	29.5	Very low	28.2	Very low	150 Å²	150	167.9 Å²	167.9	65%	0.652	80%	0.796	S	S	*	*			cis	95.2	95.5	4	-149.3	-148.2	-168	-151	0	119	E424	K422-E424 VanDerWaalsContact CE-CD 3.41Å; K422-E424 WeakPolarHBondContact CE-OE1 3.5Å; K422-E424 VanDerWaalsContact CE-OE2 3.24Å; K422-E424 WeakPolarHBondContact CE-OE2 3.41Å; K422-E424 IonicContact NZ-OE1 2.81Å; K422-E424 PolarHBondContact NZ-OE1 2.91Å; K422-E424 IonicContact NZ-OE2 2.71Å; K422-E424 PolarHBondContact NZ-OE2 3.34Å
423	Q	31.5	Very low	28.2	Very low	195 Å²	195	169.5 Å²	169.5	91%	0.911	80%	0.803	S	S	*	*			trans	-160.2	131	140.7	-104.4	172	-43.7	0	0	105.3
424	E	27.5	Very low	28.7	Very low	139 Å²	139	166.4 Å²	166.4	65%	0.65	80%	0.801	S	S	*	*			cis	107.7	82.9	1.7	-161	172	-124.8	0	0	117.8	K422	K422-E424 VanDerWaalsContact CE-CD 3.41Å; K422-E424 WeakPolarHBondContact CE-OE1 3.5Å; K422-E424 VanDerWaalsContact CE-OE2 3.24Å; K422-E424 WeakPolarHBondContact CE-OE2 3.41Å; K422-E424 IonicContact NZ-OE1 2.81Å; K422-E424 PolarHBondContact NZ-OE1 2.91Å; K422-E424 IonicContact NZ-OE2 2.71Å; K422-E424 PolarHBondContact NZ-OE2 3.34Å
425	A	28.3	Very low	28.7	Very low	92 Å²	92	164 Å²	164	76%	0.76	79%	0.793	S	S	*	*			trans	-151.9	124.6	140	0	0	0	0	0	105.9
426	R	28.7	Very low	28.7	Very low	218 Å²	218	164.9 Å²	164.9	82%	0.823	79%	0.791	S	S	*	*				64.4	133.1	60.8	-87.4	-171.4	168.3	-172.2	-5.3	113.2
427	C	23.2	Very low	28.6	Very low	103 Å²	103	159 Å²	159	70%	0.696	78%	0.776	S	S	*	*			cis	-121	162.6	9.7	-81.4	0	0	0	0	111.5
428	L	29.4	Very low	28.6	Very low	123 Å²	123	156.8 Å²	156.8	64%	0.644	77%	0.774	S	S	*	*				57.1	131.6	59	-49.6	172.7	0	0	0	112.8
429	E	26.1	Very low	28.5	Very low	158 Å²	158	154.8 Å²	154.8	74%	0.738	77%	0.767	S	S	*	*			cis	-141.8	-148.3	-6.8	-131.2	171	98.9	0	0	109.6
430	T	28.3	Very low	28.9	Very low	125 Å²	125	151.3 Å²	151.3	77%	0.767	77%	0.765	S	S	*	*			cis	-155	-177.3	14.4	-29.8	0	0	0	0	109.3
431	L	30	Very low	28.8	Very low	172 Å²	172	146.5 Å²	146.5	90%	0.901	75%	0.754	S	S	*	*			trans	-110.4	143.6	177.2	-128.3	79	0	0	0	112.7
432	A	26.9	Very low	28.6	Very low	103 Å²	103	142.3 Å²	142.3	85%	0.851	75%	0.749	S	S	*	*			trans	-160.6	129.7	154.2	0	0	0	0	0	114.4
433	K	28.9	Very low	28.4	Very low	201 Å²	201	142.5 Å²	142.5	87%	0.874	75%	0.752	S	S	*	*			trans	-139.5	160.3	159.6	-110.3	-171.6	-178.4	-176.9	0	105.2
434	P	38.1	Very low	28.3	Very low	110 Å²	110	138.7 Å²	138.7	71%	0.714	74%	0.737	S	S	*	*			cis	-136.1	-134.3	48.3	30.4	-3.3	0	0	0	110.8
435	Q	26.4	Very low	28.2	Very low	130 Å²	130	143 Å²	143	61%	0.607	75%	0.747	S	S	*	*			cis	-161.8	140.7	2.1	-145.8	-162	122.1	0	0	112
436	R	27.8	Very low	28.2	Very low	215 Å²	215	146.9 Å²	146.9	81%	0.811	75%	0.747	S	S	*	*			trans	60.3	162.5	156.5	-78.9	-179.1	-177.3	157.9	0.5	119.9
437	S	27.4	Very low	28.3	Very low	86 Å²	86	142.5 Å²	142.5	60%	0.601	75%	0.747	S	S	*	*			cis	-171.7	152.3	-37.8	52.1	0	0	0	0	110.4
438	N	26.6	Very low	28.5	Very low	157 Å²	157	143.6 Å²	143.6	84%	0.84	75%	0.745	S	S	*	*				173	150.5	120.4	-83.6	0.9	0	0	0	112.5
439	E	27.6	Very low	29.8	Very low	157 Å²	157	143.5 Å²	143.5	73%	0.734	75%	0.752	S	S	*	*			trans	-138.6	162.6	178.5	-117.2	-90.2	134.7	0	0	104.7	S441	E439-S441 PolarHBondContact OE2-N 2.67Å
440	P	36.8	Very low	30.5	Very low	121 Å²	121	141.3 Å²	141.3	79%	0.786	75%	0.752	S	S	*	*				-154.4	138.3	75.9	37.3	-15.3	0	0	0	119.6
441	S	25.7	Very low	30.5	Very low	81 Å²	81	139.3 Å²	139.3	57%	0.566	75%	0.748	S	S	*	*				12.4	142.1	129.7	-170.4	0	0	0	0	123.3	E439	E439-S441 PolarHBondContact OE2-N 2.67Å
442	L	25.3	Very low	30.4	Very low	153 Å²	153	137.9 Å²	137.9	80%	0.801	74%	0.741	S	S	*	*			trans	-164.2	110.8	130.1	-96.3	166.8	0	0	0	108.1
443	E	26.8	Very low	30.5	Very low	154 Å²	154	139.2 Å²	139.2	72%	0.72	73%	0.733	S	S	*	*				60.5	145.3	101	-73	-151.5	149.2	0	0	116.7
444	I	28	Very low	30.6	Very low	115 Å²	115	136.7 Å²	136.7	59%	0.59	72%	0.724	S	S	*	*			cis	-165	152.7	30.9	-138	160	0	0	0	114.3
445	R	25.6	Very low	30.3	Very low	228 Å²	228	138.4 Å²	138.4	86%	0.86	73%	0.727	S	S	*	*			trans	59.2	156.5	154.5	-71.2	166.9	-168.4	-171.8	3.4	125.5
446	K	29	Very low	30.3	Very low	175 Å²	175	138.2 Å²	138.2	76%	0.761	73%	0.734	S	S	*	*			trans	-102.9	163.1	157.9	-78.6	-169.7	161.5	-152.1	0	111
447	P	31.4	Very low	30.3	Very low	126 Å²	126	132.8 Å²	132.8	82%	0.818	73%	0.73	S	S	*	*				-148	179.4	99.1	38.8	-21.3	0	0	0	116
448	D	25.8	Very low	30.3	Very low	125 Å²	125	134.5 Å²	134.5	67%	0.668	74%	0.736	S	S	*	*			trans	-100.5	-169.4	174.1	-33.4	-89.3	0	0	0	111.1
449	P	57	Low	30.2	Very low	122 Å²	122	134 Å²	134	79%	0.792	73%	0.733	S	S	*	*			cis	-116.4	-115.2	-27.8	23.2	3.2	0	0	0	109.1
450	P	41.3	Very low	30.2	Very low	111 Å²	111	133.1 Å²	133.1	72%	0.721	74%	0.739	S	S	*	*			cis	-133.9	-161.1	-34.5	42.9	-23.4	0	0	0	115.5
451	A	27.4	Very low	29.7	Very low	84 Å²	84	138.1 Å²	138.1	69%	0.694	74%	0.742	S	S	*	*			trans	73.1	111.8	159.2	0	0	0	0	0	119.8
452	L	29.1	Very low	29.8	Very low	142 Å²	142	139.3 Å²	139.3	74%	0.743	75%	0.751	S	S	*	*				84.4	143.8	90.1	-102.3	65.4	0	0	0	113.7
453	D	28.5	Very low	29.8	Very low	130 Å²	130	137.5 Å²	137.5	70%	0.695	75%	0.751	S	S	*	*			cis	-125.9	152.9	13.6	-84.3	-59.1	0	0	0	112
454	H	31.6	Very low	30.2	Very low	149 Å²	149	139.9 Å²	139.9	69%	0.69	76%	0.759	S	S	*	*				55.6	137	75.1	-71.7	-72.1	0	0	0	114.5
455	L	30.7	Very low	30.6	Very low	145 Å²	145	139.7 Å²	139.7	76%	0.759	77%	0.765	S	S	*	*			cis	-152.1	143.8	44.6	-76.9	165	0	0	0	115.8
456	T	27.8	Very low	30.6	Very low	126 Å²	126	135.9 Å²	135.9	77%	0.773	76%	0.761	S	S	*	*			trans	58.8	158.3	140.3	59.2	0	0	0	0	124
457	S	27.7	Very low	30.5	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	76%	0.762	S	S	*	*			cis	-177.5	174.5	-30	-166.6	0	0	0	0	110.9
458	V	27.5	Very low	30.2	Very low	122 Å²	122	136.6 Å²	136.6	74%	0.739	77%	0.765	S	S	*	*			trans	67.1	98.1	164	-167.3	0	0	0	0	116.5
459	N	24.5	Very low	30.3	Very low	145 Å²	145	135.7 Å²	135.7	78%	0.775	77%	0.768	S	S	*	*				62	106.2	80.6	-86.2	-25	0	0	0	117.3
460	T	26.3	Very low	29.6	Very low	139 Å²	139	135.3 Å²	135.3	85%	0.853	77%	0.765	S	S	*	*				167.4	171.7	110.7	38.6	0	0	0	0	111.2
461	R	27.4	Very low	28.9	Very low	226 Å²	226	135.4 Å²	135.4	85%	0.853	77%	0.769	S	S	*	*				-176	111.5	-55.4	173.4	-177	178.9	-161.7	-0.2	108.3
462	S	26.8	Very low	28.9	Very low	107 Å²	107	136.2 Å²	136.2	75%	0.748	77%	0.769	S	S	*	*			trans	61.8	133.2	160.2	-176.7	0	0	0	0	119.4
463	S	26.4	Very low	29	Very low	114 Å²	114	136.1 Å²	136.1	80%	0.797	77%	0.77	S	S	*	*				-173	136.3	116.5	-81	0	0	0	0	114.5
464	K	34.1	Very low	29.2	Very low	205 Å²	205	136.2 Å²	136.2	89%	0.891	78%	0.775	S	S	*	*			trans	-119.7	144.6	150.2	-98.3	-177.7	173.5	179.3	0	105.2
465	P	37	Very low	29.1	Very low	110 Å²	110	137.4 Å²	137.4	71%	0.714	78%	0.78	S	S	*	*				-154.1	152.6	98.3	36.5	-17.1	0	0	0	118.2
466	L	26.2	Very low	29.1	Very low	148 Å²	148	136 Å²	136	78%	0.775	78%	0.783	S	S	*	*			trans	54.5	122	135.8	-58.3	171	0	0	0	123.7
467	L	26.7	Very low	29.2	Very low	151 Å²	151	138 Å²	138	79%	0.791	79%	0.787	S	S	*	*				47.1	127.3	126.5	-56.5	176.2	0	0	0	121.7
468	L	24.5	Very low	29.1	Very low	166 Å²	166	141 Å²	141	87%	0.869	80%	0.795	S	S	*	*				-169.7	162.5	108.7	-101.3	167.2	0	0	0	112.7
469	S	26.9	Very low	29.2	Very low	105 Å²	105	139.7 Å²	139.7	73%	0.734	80%	0.797	S	S	*	*			trans	-148.6	163	171.7	-44.5	0	0	0	0	107.2
470	P	43.5	Very low	29.4	Very low	114 Å²	114	141.1 Å²	141.1	74%	0.74	80%	0.804	S	S	*	*				-157.8	-174.2	76.6	42.9	-22.5	0	0	0	117.6
471	S	25.9	Very low	29.4	Very low	113 Å²	113	139.6 Å²	139.6	79%	0.79	80%	0.799	S	S	*	*			trans	72.9	141.9	157.1	65.3	0	0	0	0	119.2
472	S	27.9	Very low	29.4	Very low	102 Å²	102	134.3 Å²	134.3	71%	0.713	80%	0.797	S	S	*	*			cis	-140.5	145	-5.2	60.6	0	0	0	0	109
473	D	30.9	Very low	29.5	Very low	140 Å²	140	133.8 Å²	133.8	75%	0.749	79%	0.793	S	S	*	*				43.2	129.5	81.6	-59.6	-44.5	0	0	0	113.2
474	V	33.6	Very low	29.7	Very low	132 Å²	132	137.4 Å²	137.4	80%	0.8	80%	0.797	S	S	*	*			cis	-143.8	179.2	6.5	-111.2	0	0	0	0	108.5
475	E	29.1	Very low	29.5	Very low	173 Å²	173	133 Å²	133	81%	0.808	79%	0.788	S	S	*	*			cis	-160.4	159.5	35.4	-160.2	166.4	-170.3	0	0	111.9
476	S	29.9	Very low	29.1	Very low	117 Å²	117	133.8 Å²	133.8	82%	0.818	79%	0.791	S	S	*	*			trans	-137.4	142.8	175.9	-62.4	0	0	0	0	110.5
477	I	29.6	Very low	29.1	Very low	168 Å²	168	133 Å²	133	86%	0.862	80%	0.797	S	S	*	*			trans	-133.8	144.6	163.8	52.7	172.4	0	0	0	112
478	D	26.5	Very low	29	Very low	164 Å²	164	131.9 Å²	131.9	88%	0.877	80%	0.797	S	S	*	*			trans	-87.2	169	-168.9	-115.5	-51.5	0	0	0	113.9
479	A	30.3	Very low	29.1	Very low	94 Å²	94	132.2 Å²	132.2	78%	0.777	80%	0.798	S	S	*	*			trans	-70.9	138.8	172.4	0	0	0	0	0	112
480	L	28.1	Very low	29	Very low	175 Å²	175	133.2 Å²	133.2	92%	0.916	80%	0.8	S	S	*	*			trans	-112.7	122.5	166.9	-87.6	170.6	0	0	0	111.6
481	S	25.6	Very low	28.2	Very low	107 Å²	107	132.9 Å²	132.9	75%	0.748	80%	0.8	S	S	*	*			trans	-83.5	130.4	167.2	-178.8	0	0	0	0	109.5
482	S	27.9	Very low	28.2	Very low	116 Å²	116	138.5 Å²	138.5	81%	0.811	80%	0.804	S	S	*	*			trans	-115.1	135.3	164.5	52.6	0	0	0	0	109.7
483	S	29.8	Very low	28.2	Very low	96 Å²	96	142 Å²	142	67%	0.671	81%	0.809	S	S	*	*			trans	-151	99.4	-174.2	-69.6	0	0	0	0	110.1
484	E	30.1	Very low	27.9	Very low	190 Å²	190	141.3 Å²	141.3	89%	0.888	82%	0.815	S	S	*	*			trans	-128.7	94.4	173.1	-63.8	-171.8	120.6	0	0	107.7
485	T	30.1	Very low	27.6	Very low	113 Å²	113	140.3 Å²	140.3	69%	0.693	81%	0.814	S	S	*	*				67.2	82.7	82.6	64.4	0	0	0	0	115.3
486	T	28.8	Very low	27.5	Very low	126 Å²	126	140.1 Å²	140.1	77%	0.773	82%	0.818	S	S	*	*			trans	48.1	124.4	131.9	51.4	0	0	0	0	120.7
487	S	25.2	Very low	27.3	Very low	130 Å²	130	145 Å²	145	91%	0.909	82%	0.82	S	S	*	*			trans	-141.9	128.7	138.2	-78.7	0	0	0	0	110.3
488	T	26.1	Very low	27.1	Very low	129 Å²	129	143.9 Å²	143.9	79%	0.791	82%	0.821	S	S	*	*			trans	-113.2	142.7	175.6	27.1	0	0	0	0	109.7
489	I	26.4	Very low	27.1	Very low	173 Å²	173	140 Å²	140	89%	0.887	81%	0.807	S	S	*	*			trans	-168.1	165	144.5	-103.8	153.5	0	0	0	111
490	T	25.1	Very low	27	Very low	125 Å²	125	142.3 Å²	142.3	77%	0.767	81%	0.806	S	S	*	*			trans	-80.3	144.7	-156	51.8	0	0	0	0	117.6
491	S	25.9	Very low	27	Very low	107 Å²	107	144 Å²	144	75%	0.748	81%	0.806	S	S	*	*			trans	-1.1	133.3	137.5	179	0	0	0	0	118.8
492	R	26	Very low	27.2	Very low	231 Å²	231	147.6 Å²	147.6	87%	0.872	81%	0.813	S	S	*	*				-159.6	171.5	124.5	-112.8	170.7	-171.4	-116.2	-0.4	113.4
493	Q	27.6	Very low	27.2	Very low	175 Å²	175	147 Å²	147	82%	0.818	82%	0.815	S	S	*	*			trans	-83.8	152.6	-170.8	-55.1	143.4	-63.2	0	0	113.1
494	S	24.2	Very low	27	Very low	127 Å²	127	149 Å²	149	89%	0.888	82%	0.824	S	S	*	*			trans	-156.7	139	143	56.1	0	0	0	0	110.8
495	S	27.6	Very low	26.8	Very low	111 Å²	111	144.9 Å²	144.9	78%	0.776	82%	0.822	S	S	*	*			trans	-127.3	123.5	-175.3	55.8	0	0	0	0	112.1
496	L	27.6	Very low	26.7	Very low	169 Å²	169	143.4 Å²	143.4	89%	0.885	82%	0.821	S	S	*	*			trans	-141.6	119.8	158.4	-66.1	176.1	0	0	0	105.1
497	Y	24.3	Very low	26.5	Very low	218 Å²	218	146.7 Å²	146.7	86%	0.855	83%	0.825	S	S	*	*			cis	72.3	79.4	46.7	-134.1	-68.7	0	0	0	113.4
498	T	25.9	Very low	26.6	Very low	145 Å²	145	147.3 Å²	147.3	89%	0.89	82%	0.818	S	S	*	*			trans	-138.4	149.1	157.4	-42.8	0	0	0	0	107.6
499	S	26.1	Very low	26.8	Very low	82 Å²	82	149.5 Å²	149.5	57%	0.573	82%	0.822	S	S	*	*			trans	-129.5	146.6	-160.6	-176	0	0	0	0	113.8
500	N	28.1	Very low	27	Very low	144 Å²	144	146.9 Å²	146.9	77%	0.77	82%	0.816	S	S	*	*			trans	47.3	128.1	152.4	-64.4	-1.1	0	0	0	120.4
501	K	28.8	Very low	27.3	Very low	210 Å²	210	151.2 Å²	151.2	91%	0.913	83%	0.825	S	S	*	*				-154	121	119.6	-108.9	160.6	-172	178.3	0	111.3
502	M	29.2	Very low	27.4	Very low	182 Å²	182	150.9 Å²	150.9	90%	0.897	83%	0.829	S	S	*	*			trans	-77.1	148.3	158.3	-77.3	173.7	148.3	0	0	108.9
503	A	28.5	Very low	27.9	Very low	104 Å²	104	145 Å²	145	86%	0.86	82%	0.823	S	S	*	*			trans	-127.7	102.9	162.8	0	0	0	0	0	107.9
504	T	24.9	Very low	28.2	Very low	138 Å²	138	142.2 Å²	142.2	85%	0.847	82%	0.82	S	S	*	*			trans	-85.7	123.4	178.7	-30.7	0	0	0	0	109.2
505	A	27.4	Very low	28.7	Very low	104 Å²	104	142.3 Å²	142.3	86%	0.86	82%	0.818	S	S	*	*			trans	-131.5	113.1	168.2	0	0	0	0	0	108.7
506	A	26.7	Very low	28.9	Very low	81 Å²	81	144.8 Å²	144.8	67%	0.669	82%	0.821	S	S	*	*			trans	-108.2	146.5	166.3	0	0	0	0	0	108.1
507	F	25.4	Very low	28.9	Very low	195 Å²	195	146.7 Å²	146.7	86%	0.855	82%	0.822	S	S	*	*				179.2	150	121	-98.7	-63.8	0	0	0	112.5
508	N	26.6	Very low	29.3	Very low	143 Å²	143	148.1 Å²	148.1	77%	0.765	83%	0.826	S	S	*	*			trans	62.7	95.9	154.5	-58.4	-17.3	0	0	0	119.3
509	M	30.4	Very low	29.6	Very low	175 Å²	175	150.7 Å²	150.7	86%	0.862	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-76.2	129.4	154.9	-63.7	-79.6	-80.2	0	0	110.1
510	P	30.7	Very low	30	Very low	119 Å²	119	153 Å²	153	77%	0.773	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-77.2	136.4	159.3	-9.2	26.7	0	0	0	110.1
511	F	31.5	Very low	30.1	Very low	216 Å²	216	149.9 Å²	149.9	95%	0.947	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-73.1	132.3	164.4	-89.3	-101.1	0	0	0	109.6
512	A	28.2	Very low	30.4	Very low	100 Å²	100	151 Å²	151	83%	0.826	82%	0.822	S	S	*	*			trans	-117.4	140.7	172.9	0	0	0	0	0	110.9
513	S	35.8	Very low	30.6	Very low	108 Å²	108	148.4 Å²	148.4	76%	0.755	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-76.2	157.2	-179.9	45.3	0	0	0	0	112.8
514	P	35.5	Very low	30.9	Very low	115 Å²	115	155 Å²	155	75%	0.747	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-63.8	144.2	-177	26.2	-35.9	0	0	0	113
515	P	34.2	Very low	31.3	Very low	130 Å²	130	160.1 Å²	160.1	84%	0.844	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-72.1	150.9	-179.3	29.7	-35.1	0	0	0	112.7
516	L	31.6	Very low	31.5	Very low	162 Å²	162	161.9 Å²	161.9	85%	0.848	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-83.8	148.4	-179.9	-66.2	168.2	0	0	0	111.6	R518	L516-R518 PolarHBondContact O-N 3.14Å; L516-R518 VanDerWaalsContact O-N 3.16Å
517	K	28.2	Very low	32	Very low	210 Å²	210	163.8 Å²	163.8	91%	0.913	83%	0.83	S	S	*	*			trans	-61.7	114	175.4	-61.8	-176.4	177.9	-172.4	0	110.7
518	R	32.6	Very low	32.1	Very low	248 Å²	248	164.3 Å²	164.3	94%	0.936	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-70.2	144.9	164.8	-63.4	174.6	93.3	156.7	0.4	108.5	L516	L516-R518 PolarHBondContact O-N 3.14Å; L516-R518 VanDerWaalsContact O-N 3.16Å
519	K	31.6	Very low	32.7	Very low	199 Å²	199	163 Å²	163	87%	0.865	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-97	153.5	172.9	-67.6	-173.2	173.2	-168.1	0	109.4	G521	K519-G521 PolarHBondContact O-N 3.2Å
520	R	34.8	Very low	33.2	Very low	130 Å²	130	160.6 Å²	160.6	49%	0.491	83%	0.829	S	S	.	*	P	Polyproline II helix	trans	-53.6	129.5	166.3	-71.9	-178.3	172	163	2.6	108.9	D127 S149 D151	D127-R520 IonicContact OD2-NH2 2.93Å; D127-R520 PolarHBondContact OD2-NH2 2.9Å; S149-R520 PolarHBondContact O-NH1 2.96Å; D151-R520 PolarHBondContact O-NH1 2.83Å; D151-R520 PolarHBondContact O-NH2 2.99Å
521	G	29.6	Very low	33	Very low	79 Å²	79	166.6 Å²	166.6	81%	0.814	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-89.2	142.2	-172.6	0	0	0	0	0	111.7	K519	K519-G521 PolarHBondContact O-N 3.2Å
522	R	36.3	Very low	33.5	Very low	234 Å²	234	162 Å²	162	88%	0.883	83%	0.829	S	S	*	*			trans	-128.1	131.4	174.6	-169.6	-178.5	-173	173.3	8.9	110.6
523	P	32.9	Very low	33.7	Very low	126 Å²	126	166.1 Å²	166.1	82%	0.818	83%	0.831	S	S	*	*			trans	-55.3	144.4	172.5	-27.4	36.1	0	0	0	113
524	R	33.3	Very low	33.5	Very low	242 Å²	242	169.2 Å²	169.2	91%	0.913	84%	0.838	S	S	*	*			trans	-104.5	114	-159.2	-166.6	-175.5	-164.9	-177.3	7.6	113.3
525	R	33.6	Very low	33.8	Very low	247 Å²	247	169.1 Å²	169.1	93%	0.932	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-81.7	158.5	165.3	-72.7	-173.9	175.4	172.8	1.6	112.1
526	T	32.3	Very low	34.1	Very low	140 Å²	140	168.7 Å²	168.7	86%	0.859	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-83.6	153.8	-163	45.9	0	0	0	0	115.2
527	P	36.5	Very low	34.4	Very low	122 Å²	122	166.7 Å²	166.7	79%	0.792	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-103.4	163.9	-166.6	39.4	-36.5	0	0	0	116
528	K	29	Very low	34.9	Very low	205 Å²	205	163 Å²	163	89%	0.891	83%	0.829	S	S	*	*			trans	-142.8	167.3	163.6	-101.6	-173.4	178.1	174.4	0	111.1
529	P	37.8	Very low	35	Very low	116 Å²	116	162.5 Å²	162.5	75%	0.753	83%	0.827	S	S	*	*			trans	-93.9	165.8	-135.8	35.7	-39.6	0	0	0	117.9
530	P	41	Very low	35.1	Very low	125 Å²	125	160.4 Å²	160.4	81%	0.812	82%	0.824	S	S	*	*			trans	-104.4	171.7	-168.4	41.1	-37.1	0	0	0	115.9
531	R	27.8	Very low	35.4	Very low	244 Å²	244	159.9 Å²	159.9	92%	0.921	84%	0.838	S	S	*	*			trans	-152.2	165.4	160.2	-105.4	-167.6	177.4	-164	-2.1	110.4
532	P	40.8	Very low	35.4	Very low	121 Å²	121	163.4 Å²	163.4	79%	0.786	84%	0.838	S	S	*	*				-114.3	-172.7	-116	42.9	-37.1	0	0	0	117
533	E	31.7	Very low	35.1	Very low	186 Å²	186	156.6 Å²	156.6	87%	0.869	83%	0.832	S	S	*	*			trans	-84.3	165.7	-157.3	-52.7	165.3	126.3	0	0	116.7
534	L	33.1	Very low	35	Very low	172 Å²	172	156.3 Å²	156.3	90%	0.901	83%	0.833	S	S	*	*			trans	-139.8	155.9	159.2	-80.8	178.1	0	0	0	111.1
535	P	41.8	Very low	34.9	Very low	113 Å²	113	151.6 Å²	151.6	73%	0.734	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-96.4	168.1	-158.8	37.5	-38	0	0	0	116.7
536	P	40.5	Very low	34.8	Very low	122 Å²	122	144.7 Å²	144.7	79%	0.792	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-89.8	165.6	-175.7	36.2	-37.6	0	0	0	116
537	P	37.5	Very low	34.6	Very low	119 Å²	119	144.8 Å²	144.8	77%	0.773	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-82.4	167	179.4	33.8	-36.6	0	0	0	115.3
538	P	38.3	Very low	34.3	Very low	134 Å²	134	144.8 Å²	144.8	87%	0.87	81%	0.813	S	S	*	*			trans	-89.3	177.2	-166.8	35.9	-38.1	0	0	0	116.7
539	R	33.9	Very low	34.4	Very low	237 Å²	237	143.9 Å²	143.9	89%	0.894	81%	0.812	S	S	*	*			trans	-118.6	177.3	-179.1	-65.3	-176	173.2	-156.5	0.3	113.1
540	L	35	Very low	34	Very low	155 Å²	155	145.7 Å²	145.7	81%	0.812	81%	0.812	S	S	*	*			trans	118.7	157.7	152.5	-67.5	176	0	0	0	114.8
541	P	41.4	Very low	33.5	Very low	119 Å²	119	149 Å²	149	77%	0.773	81%	0.814	S	S	*	*			cis	-127.9	-178.7	-7.1	24	0.1	0	0	0	115.4
542	D	29.6	Very low	33.4	Very low	153 Å²	153	141.3 Å²	141.3	82%	0.818	81%	0.81	S	S	*	*			trans	-86.8	174.1	-175.7	-48.9	-91.9	0	0	0	116.6
543	A	29.3	Very low	32.8	Very low	91 Å²	91	140 Å²	140	75%	0.752	81%	0.81	S	S	*	*			trans	-151.8	89.7	163.6	0	0	0	0	0	115.4
544	S	31.3	Very low	32.7	Very low	120 Å²	120	139.1 Å²	139.1	84%	0.839	81%	0.81	S	S	*	*			trans	55.2	153.7	144.7	56	0	0	0	0	123.8
545	V	31.6	Very low	33	Very low	143 Å²	143	136.6 Å²	136.6	87%	0.867	80%	0.804	S	S	*	*			trans	-130.9	147.5	-178	174.5	0	0	0	0	110.2
546	S	30.6	Very low	32.8	Very low	101 Å²	101	134.7 Å²	134.7	71%	0.706	81%	0.805	S	S	*	*			trans	168.3	156.5	154.7	-100	0	0	0	0	109.8
547	D	29	Very low	32.4	Very low	142 Å²	142	137.4 Å²	137.4	76%	0.759	81%	0.812	S	S	*	*			cis	-153.6	-174.1	-1.5	-130.5	-52.3	0	0	0	113
548	T	29	Very low	32.4	Very low	123 Å²	123	138.9 Å²	138.9	76%	0.755	81%	0.808	S	S	*	*			trans	-113.8	167.9	-172	-43.5	0	0	0	0	114.2
549	E	30.6	Very low	32.4	Very low	185 Å²	185	138.2 Å²	138.2	86%	0.864	80%	0.804	S	S	*	*			trans	128.9	-175.3	149.3	-63	-129.8	122.1	0	0	117.6
550	M	29.8	Very low	32.6	Very low	154 Å²	154	131.3 Å²	131.3	76%	0.759	79%	0.788	S	S	*	*			trans	-134.5	160.2	-135.5	-116.4	177.5	24.1	0	0	115.5
551	F	30.2	Very low	33	Very low	196 Å²	196	130.4 Å²	130.4	86%	0.86	78%	0.784	S	S	*	*			trans	23.5	124.2	160.6	-65.1	-78.6	0	0	0	121.8
552	G	25.7	Very low	33.4	Very low	81 Å²	81	131.3 Å²	131.3	84%	0.835	78%	0.781	S	S	*	*			trans	-165.5	156.6	160.5	0	0	0	0	0	111
553	A	29.4	Very low	34.2	Very low	94 Å²	94	127.6 Å²	127.6	78%	0.777	76%	0.764	S	S	*	*			trans	-145.3	164.1	-168.1	0	0	0	0	0	115.9
554	L	29.7	Very low	35.2	Very low	167 Å²	167	132.6 Å²	132.6	87%	0.874	77%	0.771	S	S	*	*			trans	77.1	158.4	170.4	-51.7	179.1	0	0	0	116.8
555	P	39.7	Very low	36.1	Very low	120 Å²	120	130.5 Å²	130.5	78%	0.779	77%	0.768	S	S	*	*			cis	-130.1	153.2	-13.9	30.5	-11.7	0	0	0	116
556	G	37.4	Very low	37	Very low	72 Å²	72	127.9 Å²	127.9	74%	0.742	75%	0.748	S	S	*	*			trans	76	93.5	134.7	0	0	0	0	0	121.1
557	L	30.9	Very low	38.2	Very low	180 Å²	180	126.9 Å²	126.9	94%	0.942	73%	0.734	S	S	*	*			trans	-136.5	156.6	146	-78.7	-178.9	0	0	0	110.1
558	H	38.7	Very low	39.6	Very low	149 Å²	149	124.7 Å²	124.7	69%	0.69	73%	0.728	S	S	*	*			trans	-83.7	148.1	-172.8	-122	-112.9	0	0	0	112.6	T560	H558-T560 VanDerWaalsContact C-N 3.27Å; H558-T560 PolarHBondContact O-N 3.03Å; H558-T560 VanDerWaalsContact O-N 3.1Å
559	P	37.3	Very low	40.9	Very low	121 Å²	121	124.4 Å²	124.4	79%	0.786	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	1.1	-168.9	-20.2	34.5	0	0	0	117.3
560	T	39.4	Very low	42.4	Very low	91 Å²	91	118 Å²	118	56%	0.558	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-20.5	-165.5	43.5	0	0	0	0	115.5	H558	H558-T560 VanDerWaalsContact C-N 3.27Å; H558-T560 PolarHBondContact O-N 3.03Å; H558-T560 VanDerWaalsContact O-N 3.1Å
561	D	43.4	Very low	43.9	Very low	137 Å²	137	114.8 Å²	114.8	73%	0.733	68%	0.678	S	S	*	*	S	Bend	trans	-100	6.8	-158.4	-54.8	-17.4	0	0	0	113.9
562	I	48.7	Very low	45.3	Very low	138 Å²	138	109.9 Å²	109.9	71%	0.708	66%	0.661	S	S	*	*	S	Bend	trans	-110.6	42.5	177.8	-37.8	-178.5	0	0	0	111.4	M566	I562-M566 HydrophobicContact CG2-SD 4.3Å
563	V	46.6	Very low	47.1	Very low	75 Å²	75	109 Å²	109	46%	0.455	64%	0.641	S	S	.	*	S	Bend	trans	-113.1	-16.4	-177.7	-174.4	0	0	0	0	113.1	Q571	V563-Q571 PolarHBondContact O-NE2 2.86Å
564	H	50.7	Low	48.4	Very low	196 Å²	196	110.1 Å²	110.1	91%	0.907	63%	0.63	S	S	*	*	S	Bend	trans	-114.4	42.1	-173.6	-67.8	-49.1	0	0	0	114.6
565	G	49	Very low	49.6	Very low	75 Å²	75	107.2 Å²	107.2	77%	0.773	62%	0.615	S	S	*	*	S	Bend	trans	-161	15	179.1	0	0	0	0	0	116.9
566	M	50.6	Low	50.7	Low	89 Å²	89	108.1 Å²	108.1	44%	0.438	61%	0.607	S	S	.	*	S	Bend	trans	-129.1	145.3	-177.8	-63.3	-177	76.2	0	0	111.5	I562 T570	I562-M566 HydrophobicContact CG2-SD 4.3Å; M566-T570 HydrophobicContact CE-CG2 3.72Å
567	D	56.5	Low	51.6	Low	80 Å²	80	107.8 Å²	107.8	43%	0.428	59%	0.593	S	S	.	*			trans	-62.7	141.3	179.2	162.7	82.4	0	0	0	111.9	N569 T570 Q571	D567-N569 VanDerWaalsContact C-N 3.26Å; D567-N569 PolarHBondContact O-N 2.79Å; D567-N569 VanDerWaalsContact O-N 3.15Å; D567-N569 PolarHBondContact OD1-ND2 2.99Å; D567-N569 WeakPolarHBondContact OD2-CA 3.39Å; D567-N569 WeakPolarHBondContact OD2-CB 3.08Å; D567-N569 PolarHBondContact OD2-N 3.25Å; D567-N569 PolarHBondContact OD2-ND2 2.82Å; D567-T570 WeakPolarHBondContact O-CA 3.34Å; D567-T570 WeakPolarHBondContact O-CB 3.3Å; D567-T570 PolarHBondContact O-N 3.08Å; D567-T570 PolarHBondContact O-OG1 2.85Å; D567-T570 PolarHBondContact OD2-N 2.99Å; D567-Q571 PolarHBondContact O-N 3.49Å
568	P	58.3	Low	52.8	Low	95 Å²	95	102.9 Å²	102.9	62%	0.617	57%	0.574	S	S	*	*	H	α-helix	trans	-52.4	-33.8	179.9	-31.8	37.2	0	0	0	115.9	T570 L572	P568-T570 VanDerWaalsContact C-N 3.28Å; P568-T570 PolarHBondContact O-N 2.74Å; P568-L572 VanDerWaalsContact O-CB 3.29Å; P568-L572 WeakPolarHBondContact O-CB 3.15Å; P568-L572 PolarHBondContact O-N 3.45Å
569	N	55.5	Low	53.6	Low	118 Å²	118	99.8 Å²	99.8	63%	0.631	56%	0.562	S	S	*	*	H	α-helix	trans	-70.3	-29	177.4	-49.5	-81.2	0	0	0	111.5	D567 L572 S573	D567-N569 VanDerWaalsContact C-N 3.26Å; D567-N569 PolarHBondContact O-N 2.79Å; D567-N569 VanDerWaalsContact O-N 3.15Å; D567-N569 PolarHBondContact OD1-ND2 2.99Å; D567-N569 WeakPolarHBondContact OD2-CA 3.39Å; D567-N569 WeakPolarHBondContact OD2-CB 3.08Å; D567-N569 PolarHBondContact OD2-N 3.25Å; D567-N569 PolarHBondContact OD2-ND2 2.82Å; N569-L572 PolarHBondContact O-N 3.25Å; N569-S573 WeakPolarHBondContact O-CB 3.26Å; N569-S573 PolarHBondContact O-N 2.75Å; N569-S573 PolarHBondContact O-OG 2.7Å
570	T	63.6	Low	54.7	Low	49 Å²	49	97.6 Å²	97.6	30%	0.301	55%	0.549	S	S	.	.	H	α-helix	trans	-73.6	-42.2	178.1	-34	0	0	0	0	111.2	M566 D567 P568 L572 S573 H574	M566-T570 HydrophobicContact CE-CG2 3.72Å; D567-T570 WeakPolarHBondContact O-CA 3.34Å; D567-T570 WeakPolarHBondContact O-CB 3.3Å; D567-T570 PolarHBondContact O-N 3.08Å; D567-T570 PolarHBondContact O-OG1 2.85Å; D567-T570 PolarHBondContact OD2-N 2.99Å; P568-T570 VanDerWaalsContact C-N 3.28Å; P568-T570 PolarHBondContact O-N 2.74Å; T570-L572 VanDerWaalsContact C-N 3.29Å; T570-L572 PolarHBondContact O-N 3.15Å; T570-S573 PolarHBondContact O-N 2.88Å; T570-S573 PolarHBondContact O-OG 3.13Å; T570-H574 PolarHBondContact O-CD2 2.68Å; T570-H574 VanDerWaalsContact O-CD2 3.25Å; T570-H574 PolarHBondContact O-N 3.31Å
571	Q	59.8	Low	55.4	Low	88 Å²	88	98.7 Å²	98.7	41%	0.411	55%	0.551	S	S	.	*	H	α-helix	trans	-61.3	-40.8	170.4	-71.8	-171.9	-7.6	0	0	111.3	V563 D567 H574 L575	V563-Q571 PolarHBondContact O-NE2 2.86Å; D567-Q571 PolarHBondContact O-N 3.49Å; Q571-H574 PolarHBondContact O-N 3.19Å; Q571-L575 WeakPolarHBondContact O-CB 3.45Å; Q571-L575 PolarHBondContact O-N 3.36Å
572	L	61.3	Low	55.7	Low	93 Å²	93	101 Å²	101	49%	0.487	55%	0.551	S	S	.	*	H	α-helix	trans	-71.8	-30.1	-178.3	-156.5	149.6	0	0	0	112.6	P568 N569 T570 K576	P568-L572 VanDerWaalsContact O-CB 3.29Å; P568-L572 WeakPolarHBondContact O-CB 3.15Å; P568-L572 PolarHBondContact O-N 3.45Å; N569-L572 PolarHBondContact O-N 3.25Å; T570-L572 VanDerWaalsContact C-N 3.29Å; T570-L572 PolarHBondContact O-N 3.15Å; L572-K576 HydrophobicContact CD2-CD 3.89Å; L572-K576 VanDerWaalsContact CD2-CE 3.43Å; L572-K576 HydrophobicContact CD2-CG 4.4Å; L572-K576 WeakPolarHBondContact O-CB 3.34Å; L572-K576 VanDerWaalsContact O-CG 3.3Å; L572-K576 WeakPolarHBondContact O-CG 3.11Å; L572-K576 PolarHBondContact O-N 3.22Å
573	S	63	Low	56	Low	62 Å²	62	101.5 Å²	101.5	43%	0.434	55%	0.548	S	S	.	.	H	α-helix	trans	-74.4	-42.2	172.2	69.5	0	0	0	0	112.5	N569 T570 L575 K576 S577	N569-S573 WeakPolarHBondContact O-CB 3.26Å; N569-S573 PolarHBondContact O-N 2.75Å; N569-S573 PolarHBondContact O-OG 2.7Å; T570-S573 PolarHBondContact O-N 2.88Å; T570-S573 PolarHBondContact O-OG 3.13Å; S573-L575 VanDerWaalsContact C-N 3.35Å; S573-L575 PolarHBondContact O-N 2.85Å; S573-K576 PolarHBondContact O-N 2.7Å; S573-S577 WeakPolarHBondContact O-CB 3.42Å; S573-S577 PolarHBondContact O-N 3.1Å
574	H	56.7	Low	57.1	Low	118 Å²	118	98.8 Å²	98.8	55%	0.546	54%	0.536	S	S	.	.	H	α-helix	trans	-61.5	-41.6	172.5	-84.1	-73.3	0	0	0	112	T570 Q571 S577 S578	T570-H574 PolarHBondContact O-CD2 2.68Å; T570-H574 VanDerWaalsContact O-CD2 3.25Å; T570-H574 PolarHBondContact O-N 3.31Å; Q571-H574 PolarHBondContact O-N 3.19Å; H574-S577 PolarHBondContact O-N 3.35Å; H574-S578 WeakPolarHBondContact O-CB 3.29Å; H574-S578 PolarHBondContact O-N 3.05Å
575	L	54.9	Low	58.1	Low	106 Å²	106	93.5 Å²	93.5	56%	0.555	52%	0.517	S	S	*	.	H	α-helix	trans	-63.2	-45.6	175.2	-177.1	60.5	0	0	0	111.7	Q571 S573 S577 S578 I579	Q571-L575 WeakPolarHBondContact O-CB 3.45Å; Q571-L575 PolarHBondContact O-N 3.36Å; S573-L575 VanDerWaalsContact C-N 3.35Å; S573-L575 PolarHBondContact O-N 2.85Å; L575-S577 VanDerWaalsContact C-N 3.35Å; L575-S577 PolarHBondContact O-N 3.2Å; L575-S578 PolarHBondContact O-N 3.48Å; L575-I579 HydrophobicContact CD1-CD1 3.91Å; L575-I579 HydrophobicContact CD1-CG1 4.28Å; L575-I579 HydrophobicContact CG-CD1 3.86Å; L575-I579 WeakPolarHBondContact O-CB 3.36Å; L575-I579 VanDerWaalsContact O-CG1 3.29Å; L575-I579 WeakPolarHBondContact O-CG1 3.38Å; L575-I579 PolarHBondContact O-N 3.37Å
576	K	61.4	Low	59.3	Low	139 Å²	139	93.4 Å²	93.4	60%	0.604	51%	0.509	S	S	*	.	H	α-helix	trans	-59.5	-42.3	173.9	-81	174.2	173.9	173.5	0	112.4	L572 S573 S580	L572-K576 HydrophobicContact CD2-CD 3.89Å; L572-K576 VanDerWaalsContact CD2-CE 3.43Å; L572-K576 HydrophobicContact CD2-CG 4.4Å; L572-K576 WeakPolarHBondContact O-CB 3.34Å; L572-K576 VanDerWaalsContact O-CG 3.3Å; L572-K576 WeakPolarHBondContact O-CG 3.11Å; L572-K576 PolarHBondContact O-N 3.22Å; S573-K576 PolarHBondContact O-N 2.7Å; K576-S580 VanDerWaalsContact O-CB 3.24Å; K576-S580 WeakPolarHBondContact O-CB 3.32Å; K576-S580 PolarHBondContact O-N 3.43Å
577	S	57.2	Low	60.4	Low	65 Å²	65	90 Å²	90	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-63.8	-46.2	177.5	-178.9	0	0	0	0	111.8	S573 H574 L575 S580 N581	S573-S577 WeakPolarHBondContact O-CB 3.42Å; S573-S577 PolarHBondContact O-N 3.1Å; H574-S577 PolarHBondContact O-N 3.35Å; L575-S577 VanDerWaalsContact C-N 3.35Å; L575-S577 PolarHBondContact O-N 3.2Å; S577-S580 PolarHBondContact O-N 3.25Å; S577-N581 PolarHBondContact O-N 2.87Å
578	S	55.3	Low	61.4	Low	77 Å²	77	89 Å²	89	54%	0.538	49%	0.487	S	S	.	.	H	α-helix	trans	-62.3	-45.8	177.5	-169.6	0	0	0	0	112.3	H574 L575 S580 N581 Y582	H574-S578 WeakPolarHBondContact O-CB 3.29Å; H574-S578 PolarHBondContact O-N 3.05Å; L575-S578 PolarHBondContact O-N 3.48Å; S578-S580 VanDerWaalsContact C-N 3.34Å; S578-S580 PolarHBondContact O-N 2.99Å; S578-N581 PolarHBondContact O-N 3.45Å; S578-Y582 PolarHBondContact O-N 3.06Å
579	I	57.3	Low	62.4	Low	84 Å²	84	88.1 Å²	88.1	43%	0.431	48%	0.477	S	S	.	.	H	α-helix	trans	-62.2	-41.4	174.6	-68.4	169.5	0	0	0	111	L575 N581 Y582 F583	L575-I579 HydrophobicContact CD1-CD1 3.91Å; L575-I579 HydrophobicContact CD1-CG1 4.28Å; L575-I579 HydrophobicContact CG-CD1 3.86Å; L575-I579 WeakPolarHBondContact O-CB 3.36Å; L575-I579 VanDerWaalsContact O-CG1 3.29Å; L575-I579 WeakPolarHBondContact O-CG1 3.38Å; L575-I579 PolarHBondContact O-N 3.37Å; I579-N581 VanDerWaalsContact C-N 3.34Å; I579-N581 PolarHBondContact O-N 3.44Å; I579-Y582 PolarHBondContact O-N 3.25Å; I579-F583 HydrophobicContact CG2-CD2 4.08Å; I579-F583 WeakPolarHBondContact O-CB 3.49Å; I579-F583 PolarHBondContact O-N 3.45Å
580	S	59.8	Low	63.3	Low	75 Å²	75	86.8 Å²	86.8	52%	0.524	48%	0.482	S	S	.	.	H	α-helix	trans	-64.8	-35.1	177.8	-166.1	0	0	0	0	112.6	K576 S577 S578 G584	K576-S580 VanDerWaalsContact O-CB 3.24Å; K576-S580 WeakPolarHBondContact O-CB 3.32Å; K576-S580 PolarHBondContact O-N 3.43Å; S577-S580 PolarHBondContact O-N 3.25Å; S578-S580 VanDerWaalsContact C-N 3.34Å; S578-S580 PolarHBondContact O-N 2.99Å; S580-G584 WeakPolarHBondContact O-CA 3.41Å; S580-G584 PolarHBondContact O-N 3.06Å
581	N	53.2	Low	63.8	Low	113 Å²	113	89.4 Å²	89.4	60%	0.604	50%	0.501	S	S	*	.	H	α-helix	trans	-72.4	-37.7	173.7	-80.4	-3.2	0	0	0	112.6	S577 S578 I579	S577-N581 PolarHBondContact O-N 2.87Å; S578-N581 PolarHBondContact O-N 3.45Å; I579-N581 VanDerWaalsContact C-N 3.34Å; I579-N581 PolarHBondContact O-N 3.44Å
582	Y	49.8	Very low	64.7	Low	187 Å²	187	88.1 Å²	88.1	73%	0.733	51%	0.511	S	S	*	.	H	α-helix	trans	-81.8	-32.5	-175.8	-155.7	-89.4	0	0	0	113.9	S578 I579	S578-Y582 PolarHBondContact O-N 3.06Å; I579-Y582 PolarHBondContact O-N 3.25Å
583	F	55.8	Low	65.7	Low	147 Å²	147	87.4 Å²	87.4	65%	0.645	51%	0.506	S	S	*	.	H	α-helix	trans	-111.9	-9.3	-178.8	-68.4	-85.7	0	0	0	114.3	I579	I579-F583 HydrophobicContact CG2-CD2 4.08Å; I579-F583 WeakPolarHBondContact O-CB 3.49Å; I579-F583 PolarHBondContact O-N 3.45Å
584	G	68.9	Low	66.5	Low	19 Å²	19	92.9 Å²	92.9	20%	0.196	52%	0.517	C	S	.	.	S	Bend	trans	-80.5	171.6	-179.6	0	0	0	0	0	114.3	S580 A586 G587 R588	S580-G584 WeakPolarHBondContact O-CA 3.41Å; S580-G584 PolarHBondContact O-N 3.06Å; G584-A586 VanDerWaalsContact C-N 3.29Å; G584-A586 PolarHBondContact O-N 2.93Å; G584-G587 PolarHBondContact O-N 3Å; G584-G587 VanDerWaalsContact O-N 3.15Å; G584-R588 PolarHBondContact O-N 3.3Å
585	V	72.4	Confident	68	Low	84 Å²	84	93 Å²	93	51%	0.509	51%	0.513	S	S	.	.	H	α-helix	trans	-52.6	-43.3	-173.8	176.7	0	0	0	0	112.5	G587 R588 L589 W614	V585-G587 PolarHBondContact O-N 3.1Å; V585-R588 PolarHBondContact O-N 3.16Å; V585-L589 HydrophobicContact CG1-CD1 4.05Å; V585-L589 HydrophobicContact CG1-CG 4.36Å; V585-L589 WeakPolarHBondContact O-CB 3.28Å; V585-L589 VanDerWaalsContact O-CG 3.29Å; V585-L589 WeakPolarHBondContact O-CG 3.47Å; V585-L589 PolarHBondContact O-N 3.36Å; V585-W614 HydrophobicContact CG1-CZ2 4.2Å
586	A	73.9	Confident	69.4	Low	73 Å²	73	93 Å²	93	60%	0.603	51%	0.509	S	S	*	.	H	α-helix	trans	-63.8	-41.6	-178.4	0	0	0	0	0	113.1	G584 A590	G584-A586 VanDerWaalsContact C-N 3.29Å; G584-A586 PolarHBondContact O-N 2.93Å; A586-A590 WeakPolarHBondContact O-CB 3.5Å; A586-A590 PolarHBondContact O-N 2.87Å
587	G	74.3	Confident	70.6	Confident	17 Å²	17	89.6 Å²	89.6	18%	0.175	50%	0.5	C	S	.	.	H	α-helix	trans	-65.4	-45.4	176.5	0	0	0	0	0	112	G584 V585 L589 A590 C591	G584-G587 PolarHBondContact O-N 3Å; G584-G587 VanDerWaalsContact O-N 3.15Å; V585-G587 PolarHBondContact O-N 3.1Å; G587-L589 VanDerWaalsContact C-N 3.35Å; G587-L589 PolarHBondContact O-N 2.8Å; G587-A590 PolarHBondContact O-N 3.36Å; G587-A590 VanDerWaalsContact O-N 3.13Å; G587-C591 PolarHBondContact O-N 3.15Å; G587-C591 PolarHBondContact O-SG 3.37Å; G587-C591 VanDerWaalsContact O-SG 3.35Å
588	R	77.8	Confident	71.6	Confident	60 Å²	60	90.5 Å²	90.5	23%	0.226	50%	0.499	C	S	.	.	H	α-helix	trans	-65.4	-35.7	179.4	-61.3	-176.3	70.8	-173.9	-2.9	112.8	G584 V585 E593 W614	G584-R588 PolarHBondContact O-N 3.3Å; V585-R588 PolarHBondContact O-N 3.16Å; R588-E593 WeakPolarHBondContact CG-OE1 3.28Å; R588-E593 IonicContact CZ-OE2 3.47Å; R588-E593 IonicContact NE-OE1 2.78Å; R588-E593 PolarHBondContact NE-OE1 2.82Å; R588-E593 VanDerWaalsContact NE-OE1 3.14Å; R588-E593 IonicContact NE-OE2 2.77Å; R588-E593 PolarHBondContact NE-OE2 3.15Å; R588-E593 IonicContact NH2-OE2 3.29Å; R588-E593 PolarHBondContact NH2-OE2 2.87Å; R588-E593 PolarHBondContact O-N 3.4Å; R588-W614 HydrophobicContact CB-CE3 4.32Å; R588-W614 HydrophobicContact CB-CH2 3.43Å; R588-W614 VanDerWaalsContact CB-CH2 3.43Å; R588-W614 HydrophobicContact CB-CZ2 3.72Å; R588-W614 HydrophobicContact CB-CZ3 3.77Å
589	L	78.6	Confident	72.6	Confident	76 Å²	76	89.2 Å²	89.2	40%	0.398	49%	0.493	S	S	.	.	H	α-helix	trans	-62.8	-46.3	169.7	-72.6	175.3	0	0	0	111.6	V585 G587 C591 G592 Y595 W614	V585-L589 HydrophobicContact CG1-CD1 4.05Å; V585-L589 HydrophobicContact CG1-CG 4.36Å; V585-L589 WeakPolarHBondContact O-CB 3.28Å; V585-L589 VanDerWaalsContact O-CG 3.29Å; V585-L589 WeakPolarHBondContact O-CG 3.47Å; V585-L589 PolarHBondContact O-N 3.36Å; G587-L589 VanDerWaalsContact C-N 3.35Å; G587-L589 PolarHBondContact O-N 2.8Å; L589-C591 VanDerWaalsContact C-N 3.32Å; L589-C591 PolarHBondContact O-N 2.98Å; L589-G592 PolarHBondContact O-N 3.36Å; L589-G592 VanDerWaalsContact O-N 3.07Å; L589-Y595 HydrophobicContact CD2-CD1 3.63Å; L589-Y595 HydrophobicContact CD2-CE1 3.26Å; L589-Y595 HydrophobicContact CD2-CE2 4.42Å; L589-Y595 HydrophobicContact CD2-CG 4.36Å; L589-W614 HydrophobicContact CD2-CH2 3.82Å; L589-W614 HydrophobicContact CD2-CZ3 4.49Å; L589-W614 HydrophobicContact CG-CH2 3.9Å
590	A	74.2	Confident	74.1	Confident	90 Å²	90	92.1 Å²	92.1	74%	0.744	50%	0.498	S	S	*	.	H	α-helix	trans	-65.9	-31.8	179.8	0	0	0	0	0	113.2	A586 G587 G592	A586-A590 WeakPolarHBondContact O-CB 3.5Å; A586-A590 PolarHBondContact O-N 2.87Å; G587-A590 PolarHBondContact O-N 3.36Å; G587-A590 VanDerWaalsContact O-N 3.13Å; A590-G592 PolarHBondContact O-N 3.35Å
591	C	75.1	Confident	75.2	Confident	104 Å²	104	96 Å²	96	70%	0.703	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-4.7	172.6	-69.4	0	0	0	0	114.1	G587 L589 E593	G587-C591 PolarHBondContact O-N 3.15Å; G587-C591 PolarHBondContact O-SG 3.37Å; G587-C591 VanDerWaalsContact O-SG 3.35Å; L589-C591 VanDerWaalsContact C-N 3.32Å; L589-C591 PolarHBondContact O-N 2.98Å; C591-E593 VanDerWaalsContact C-N 3.31Å; C591-E593 PolarHBondContact O-N 2.98Å
592	G	77.8	Confident	76.8	Confident	61 Å²	61	94.4 Å²	94.4	63%	0.629	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	24.3	-179.3	0	0	0	0	0	114.1	L589 A590	L589-G592 PolarHBondContact O-N 3.36Å; L589-G592 VanDerWaalsContact O-N 3.07Å; A590-G592 PolarHBondContact O-N 3.35Å
593	E	82.4	Confident	77.7	Confident	79 Å²	79	87.1 Å²	87.1	37%	0.369	47%	0.471	S	S	.	.			trans	-60.6	142.3	174.1	-75.7	-172.2	-134.3	0	0	111	R588 C591 Y595 W614	R588-E593 WeakPolarHBondContact CG-OE1 3.28Å; R588-E593 IonicContact CZ-OE2 3.47Å; R588-E593 IonicContact NE-OE1 2.78Å; R588-E593 PolarHBondContact NE-OE1 2.82Å; R588-E593 VanDerWaalsContact NE-OE1 3.14Å; R588-E593 IonicContact NE-OE2 2.77Å; R588-E593 PolarHBondContact NE-OE2 3.15Å; R588-E593 IonicContact NH2-OE2 3.29Å; R588-E593 PolarHBondContact NH2-OE2 2.87Å; R588-E593 PolarHBondContact O-N 3.4Å; C591-E593 VanDerWaalsContact C-N 3.31Å; C591-E593 PolarHBondContact O-N 2.98Å; E593-Y595 WeakPolarHBondContact O-CD1 3.39Å; E593-Y595 PolarHBondContact O-N 2.89Å; E593-W614 HydrophobicContact CB-CE3 3.75Å; E593-W614 HydrophobicContact CB-CZ3 3.64Å
594	R	80.4	Confident	77.8	Confident	177 Å²	177	88.7 Å²	88.7	67%	0.668	48%	0.482	S	S	*	.			trans	-73.6	130.3	-179.4	-70.6	176.4	54.9	94	10.1	110.6	E615	R594-E615 HydrophobicContact CB-CB 4.05Å; R594-E615 HydrophobicContact CB-CG 4.49Å; R594-E615 IonicContact CZ-OE2 2.73Å; R594-E615 IonicContact NE-OE2 2.98Å; R594-E615 PolarHBondContact NE-OE2 3.27Å; R594-E615 IonicContact NH2-OE1 2.91Å; R594-E615 IonicContact NH2-OE2 3.93Å; R594-E615 PolarHBondContact NH2-OE2 3.16Å; R594-E615 PolarHBondContact O-N 3.32Å
595	Y	86.6	Confident	78	Confident	120 Å²	120	92.1 Å²	92.1	47%	0.471	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	162.1	-177.8	71.1	-96.1	0	0	0	112.2	L589 E593 V597 V612 E613 W614	L589-Y595 HydrophobicContact CD2-CD1 3.63Å; L589-Y595 HydrophobicContact CD2-CE1 3.26Å; L589-Y595 HydrophobicContact CD2-CE2 4.42Å; L589-Y595 HydrophobicContact CD2-CG 4.36Å; E593-Y595 WeakPolarHBondContact O-CD1 3.39Å; E593-Y595 PolarHBondContact O-N 2.89Å; Y595-V597 HydrophobicContact CE2-CG2 4.2Å; Y595-V612 HydrophobicContact CD2-CG1 3.36Å; Y595-V612 HydrophobicContact CE2-CG1 4.21Å; Y595-V612 HydrophobicContact CG-CG1 3.81Å; Y595-E613 CarbonylContact C-O 3.56Å; Y595-E613 VanDerWaalsContact CA-O 3.25Å; Y595-E613 WeakPolarHBondContact CA-O 3.39Å; Y595-E613 WeakPolarHBondContact CB-O 3.32Å; Y595-W614 HydrophobicContact CD1-CH2 4.44Å; Y595-W614 HydrophobicContact CD1-CZ3 4.02Å; Y595-W614 HydrophobicContact CG-CZ3 4.28Å
596	K	85.6	Confident	77.9	Confident	105 Å²	105	90.7 Å²	90.7	46%	0.457	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	129.3	176.9	178.3	-176.9	161.7	-145.4	0	109.1	L598 E613	K596-L598 HydrophobicContact CD-CD2 4.14Å; K596-L598 HydrophobicContact CG-CD2 4.31Å; K596-E613 PolarHBondContact N-O 3.17Å; K596-E613 IonicContact NZ-OE2 2.69Å; K596-E613 PolarHBondContact NZ-OE2 3.42Å; K596-E613 PolarHBondContact O-N 2.94Å
597	V	86.3	Confident	77.8	Confident	68 Å²	68	93.2 Å²	93.2	41%	0.412	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	126	170.4	178	0	0	0	0	108.3	Y595 A599 Y610	Y595-V597 HydrophobicContact CE2-CG2 4.2Å; V597-A599 WeakPolarHBondContact CG1-O 3.34Å; V597-Y610 HydrophobicContact CG1-CD1 3.89Å; V597-Y610 HydrophobicContact CG2-CD1 4.41Å
598	L	78.6	Confident	78.3	Confident	85 Å²	85	95.4 Å²	95.4	45%	0.445	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-33.7	176.4	-66.5	-172.5	0	0	0	112.7	K596 L611 E613	K596-L598 HydrophobicContact CD-CD2 4.14Å; K596-L598 HydrophobicContact CG-CD2 4.31Å; L598-L611 HydrophobicContact CB-CD2 4.1Å; L598-L611 HydrophobicContact CB-CG 4.18Å; L598-L611 PolarHBondContact N-O 3.17Å; L598-E613 HydrophobicContact CD1-CB 3.8Å; L598-E613 HydrophobicContact CD2-CB 4.26Å; L598-E613 HydrophobicContact CG-CB 3.83Å
599	A	74.8	Confident	78.7	Confident	50 Å²	50	96.3 Å²	96.3	41%	0.413	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	156.2	176.3	0	0	0	0	0	110.7	V597 Y610 L611	V597-A599 WeakPolarHBondContact CG1-O 3.34Å; A599-Y610 WeakPolarHBondContact O-CA 3.39Å; A599-L611 HydrophobicContact CB-CB 4.02Å; A599-L611 HydrophobicContact CB-CD2 4.41Å; A599-L611 PolarHBondContact O-N 2.97Å
600	R	89.5	Confident	79	Confident	144 Å²	144	98.9 Å²	98.9	54%	0.543	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	131.4	171.5	173.9	-171.6	174.4	-88.6	-0.3	107.5	V608 Q609 Y610	R600-V608 HydrophobicContact CG-CG1 3.8Å; R600-Q609 WeakPolarHBondContact CA-O 3.46Å; R600-Y610 HydrophobicContact CB-CD1 3.9Å; R600-Y610 HydrophobicContact CB-CE1 3.95Å; R600-Y610 HydrophobicContact CG-CD1 3.96Å; R600-Y610 HydrophobicContact CG-CE1 3.62Å
601	R	84	Confident	79.5	Confident	158 Å²	158	99.7 Å²	99.7	60%	0.596	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.4	153.6	167.6	67.8	178.8	-178.3	-178.5	1.6	110.8	Q609	R601-Q609 HydrophobicContact CG-CB 3.96Å; R601-Q609 VanDerWaalsContact CZ-OE1 3.31Å; R601-Q609 PolarHBondContact N-O 3.34Å; R601-Q609 PolarHBondContact O-N 3.18Å
602	V	85.3	Confident	80	Confident	78 Å²	78	96.6 Å²	96.6	47%	0.473	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	129.9	163.7	-170.7	0	0	0	0	106.1	K607 V608	V602-K607 WeakPolarHBondContact CA-O 3.45Å; V602-V608 HydrophobicContact CG2-CG2 4.39Å
603	T	70.1	Confident	80.4	Confident	35 Å²	35	98 Å²	98	22%	0.215	48%	0.477	C	S	.	.			trans	-87.6	158.8	173.8	44.6	0	0	0	0	110.3	D605 G606 K607	T603-D605 VanDerWaalsContact CB-OD1 3.26Å; T603-D605 WeakPolarHBondContact CB-OD1 3.14Å; T603-D605 PolarHBondContact O-N 2.77Å; T603-D605 PolarHBondContact OG1-OD1 2.85Å; T603-G606 WeakPolarHBondContact O-CA 3.44Å; T603-G606 PolarHBondContact O-N 2.98Å; T603-K607 PolarHBondContact N-O 2.72Å; T603-K607 PolarHBondContact OG1-O 3.49Å; T603-K607 VanDerWaalsContact OG1-O 3.09Å
604	M	58	Low	80.5	Confident	180 Å²	180	96.2 Å²	96.2	89%	0.887	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-12.6	-174	-59.3	-58.7	-174.4	0	0	114.7	G606	M604-G606 VanDerWaalsContact C-N 3.33Å
605	D	71.9	Confident	80.2	Confident	90 Å²	90	93.2 Å²	93.2	48%	0.481	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	16.2	172	69.9	-24.5	0	0	0	113.5	T603 K607	T603-D605 VanDerWaalsContact CB-OD1 3.26Å; T603-D605 WeakPolarHBondContact CB-OD1 3.14Å; T603-D605 PolarHBondContact O-N 2.77Å; T603-D605 PolarHBondContact OG1-OD1 2.85Å; D605-K607 PolarHBondContact O-N 3.26Å; D605-K607 PolarHBondContact OD1-N 3.21Å; D605-K607 WeakPolarHBondContact OD2-CD 3.4Å; D605-K607 WeakPolarHBondContact OD2-CG 3.29Å; D605-K607 IonicContact OD2-NZ 2.71Å; D605-K607 PolarHBondContact OD2-NZ 2.92Å
606	G	70.9	Confident	79	Confident	55 Å²	55	90.1 Å²	90.1	57%	0.567	47%	0.465	S	S	*	.	S	Bend	trans	75.7	-2.3	178.8	0	0	0	0	0	115.5	T603 M604	T603-G606 WeakPolarHBondContact O-CA 3.44Å; T603-G606 PolarHBondContact O-N 2.98Å; M604-G606 VanDerWaalsContact C-N 3.33Å
607	K	71.8	Confident	77.2	Confident	126 Å²	126	92.1 Å²	92.1	55%	0.548	49%	0.486	S	S	.	.			trans	-75.5	133.6	-177.7	-63.4	-170.1	-176.8	83.5	0	111.4	V602 T603 D605	V602-K607 WeakPolarHBondContact CA-O 3.45Å; T603-K607 PolarHBondContact N-O 2.72Å; T603-K607 PolarHBondContact OG1-O 3.49Å; T603-K607 VanDerWaalsContact OG1-O 3.09Å; D605-K607 PolarHBondContact O-N 3.26Å; D605-K607 PolarHBondContact OD1-N 3.21Å; D605-K607 WeakPolarHBondContact OD2-CD 3.4Å; D605-K607 WeakPolarHBondContact OD2-CG 3.29Å; D605-K607 IonicContact OD2-NZ 2.71Å; D605-K607 PolarHBondContact OD2-NZ 2.92Å
608	V	83.8	Confident	75.2	Confident	62 Å²	62	93.8 Å²	93.8	38%	0.376	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	127.5	176.1	-170.3	0	0	0	0	109.8	R600 V602 Y610	R600-V608 HydrophobicContact CG-CG1 3.8Å; V602-V608 HydrophobicContact CG2-CG2 4.39Å; V608-Y610 HydrophobicContact CB-CE2 4.36Å; V608-Y610 HydrophobicContact CG1-CD2 4.39Å; V608-Y610 HydrophobicContact CG1-CE1 4.28Å; V608-Y610 HydrophobicContact CG1-CE2 3.64Å
609	Q	86.8	Confident	73.5	Confident	80 Å²	80	94.2 Å²	94.2	37%	0.374	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	141.4	178.1	-60.3	-177.9	2	0	0	110.4	R600 R601	R600-Q609 WeakPolarHBondContact CA-O 3.46Å; R601-Q609 HydrophobicContact CG-CB 3.96Å; R601-Q609 VanDerWaalsContact CZ-OE1 3.31Å; R601-Q609 PolarHBondContact N-O 3.34Å; R601-Q609 PolarHBondContact O-N 3.18Å
610	Y	85.4	Confident	71.6	Confident	129 Å²	129	100.8 Å²	100.8	51%	0.506	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.6	132.7	-177.1	-61.8	-87.1	0	0	0	110.5	V597 A599 R600 V608	V597-Y610 HydrophobicContact CG1-CD1 3.89Å; V597-Y610 HydrophobicContact CG2-CD1 4.41Å; A599-Y610 WeakPolarHBondContact O-CA 3.39Å; R600-Y610 HydrophobicContact CB-CD1 3.9Å; R600-Y610 HydrophobicContact CB-CE1 3.95Å; R600-Y610 HydrophobicContact CG-CD1 3.96Å; R600-Y610 HydrophobicContact CG-CE1 3.62Å; V608-Y610 HydrophobicContact CB-CE2 4.36Å; V608-Y610 HydrophobicContact CG1-CD2 4.39Å; V608-Y610 HydrophobicContact CG1-CE1 4.28Å; V608-Y610 HydrophobicContact CG1-CE2 3.64Å
611	L	85.4	Confident	70.7	Confident	107 Å²	107	98.7 Å²	98.7	56%	0.56	56%	0.556	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.9	124.7	164.6	-179.9	63.5	0	0	0	108.1	L598 A599	L598-L611 HydrophobicContact CB-CD2 4.1Å; L598-L611 HydrophobicContact CB-CG 4.18Å; L598-L611 PolarHBondContact N-O 3.17Å; A599-L611 HydrophobicContact CB-CB 4.02Å; A599-L611 HydrophobicContact CB-CD2 4.41Å; A599-L611 PolarHBondContact O-N 2.97Å
612	V	85.3	Confident	70	Confident	39 Å²	39	95.5 Å²	95.5	24%	0.236	55%	0.554	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.4	127.8	-170	-152.6	0	0	0	0	111.1	Y595	Y595-V612 HydrophobicContact CD2-CG1 3.36Å; Y595-V612 HydrophobicContact CE2-CG1 4.21Å; Y595-V612 HydrophobicContact CG-CG1 3.81Å
613	E	85.3	Confident	69.1	Low	91 Å²	91	96.5 Å²	96.5	43%	0.425	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.8	134.7	173.2	175	174.4	-117.1	0	0	109	Y595 K596 L598	Y595-E613 CarbonylContact C-O 3.56Å; Y595-E613 VanDerWaalsContact CA-O 3.25Å; Y595-E613 WeakPolarHBondContact CA-O 3.39Å; Y595-E613 WeakPolarHBondContact CB-O 3.32Å; K596-E613 PolarHBondContact N-O 3.17Å; K596-E613 IonicContact NZ-OE2 2.69Å; K596-E613 PolarHBondContact NZ-OE2 3.42Å; K596-E613 PolarHBondContact O-N 2.94Å; L598-E613 HydrophobicContact CD1-CB 3.8Å; L598-E613 HydrophobicContact CD2-CB 4.26Å; L598-E613 HydrophobicContact CG-CB 3.83Å
614	W	83.9	Confident	69	Low	41 Å²	41	100.1 Å²	100.1	16%	0.155	58%	0.578	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.2	132.9	-179.9	-62.6	93.7	0	0	0	110.2	V585 R588 L589 E593 Y595 G616	V585-W614 HydrophobicContact CG1-CZ2 4.2Å; R588-W614 HydrophobicContact CB-CE3 4.32Å; R588-W614 HydrophobicContact CB-CH2 3.43Å; R588-W614 VanDerWaalsContact CB-CH2 3.43Å; R588-W614 HydrophobicContact CB-CZ2 3.72Å; R588-W614 HydrophobicContact CB-CZ3 3.77Å; L589-W614 HydrophobicContact CD2-CH2 3.82Å; L589-W614 HydrophobicContact CD2-CZ3 4.49Å; L589-W614 HydrophobicContact CG-CH2 3.9Å; E593-W614 HydrophobicContact CB-CE3 3.75Å; E593-W614 HydrophobicContact CB-CZ3 3.64Å; Y595-W614 HydrophobicContact CD1-CH2 4.44Å; Y595-W614 HydrophobicContact CD1-CZ3 4.02Å; Y595-W614 HydrophobicContact CG-CZ3 4.28Å; W614-G616 VanDerWaalsContact C-N 3.28Å; W614-G616 PolarHBondContact O-N 3.07Å
615	E	74.3	Confident	69.7	Low	115 Å²	115	95.1 Å²	95.1	54%	0.537	56%	0.559	S	S	.	*	S	Bend	trans	-79.1	74.1	179.2	-69.1	-170.3	156.2	0	0	111.2	R594	R594-E615 HydrophobicContact CB-CB 4.05Å; R594-E615 HydrophobicContact CB-CG 4.49Å; R594-E615 IonicContact CZ-OE2 2.73Å; R594-E615 IonicContact NE-OE2 2.98Å; R594-E615 PolarHBondContact NE-OE2 3.27Å; R594-E615 IonicContact NH2-OE1 2.91Å; R594-E615 IonicContact NH2-OE2 3.93Å; R594-E615 PolarHBondContact NH2-OE2 3.16Å; R594-E615 PolarHBondContact O-N 3.32Å
616	G	63.1	Low	69.6	Low	54 Å²	54	95.5 Å²	95.5	56%	0.557	56%	0.564	S	S	*	*	S	Bend	trans	-172.1	154.9	176.5	0	0	0	0	0	113.2	W614 T618	W614-G616 VanDerWaalsContact C-N 3.28Å; W614-G616 PolarHBondContact O-N 3.07Å; G616-T618 PolarHBondContact O-N 2.88Å; G616-T618 VanDerWaalsContact O-N 3.09Å
617	V	46.7	Very low	69.5	Low	148 Å²	148	98.4 Å²	98.4	90%	0.897	56%	0.564	S	S	*	*			trans	-71.6	104.5	177.7	-178.7	0	0	0	0	109.5	A619	V617-A619 PolarHBondContact O-N 3.48Å
618	T	44	Very low	69.3	Low	103 Å²	103	96.2 Å²	96.2	63%	0.632	57%	0.565	S	S	*	*			trans	-65.2	112.4	159.4	48.9	0	0	0	0	108.3	G616 S620	G616-T618 PolarHBondContact O-N 2.88Å; G616-T618 VanDerWaalsContact O-N 3.09Å; T618-S620 PolarHBondContact O-N 2.72Å
619	A	42.9	Very low	68.1	Low	94 Å²	94	99.1 Å²	99.1	78%	0.777	58%	0.581	S	S	*	*			trans	-63.9	124.8	176.6	0	0	0	0	0	110.4	V617	V617-A619 PolarHBondContact O-N 3.48Å
620	S	34.3	Very low	66.4	Low	188 Å²	188	100.8 Å²	100.8	100%	1.315	60%	0.6	S	S	*	*			trans	-158.2	0	175.1	-67.7	0	0	0	0	108.8	T618	T618-S620 PolarHBondContact O-N 2.72Å

Retrieved 620 of 620 residues in 383.8 ms (Link to these results)

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