A0A087XW61_POEFO Loading...

Methionine aminopeptidase

Cotranslationally removes the N-terminal methionine from nascent proteins. The N-terminal methionine is often cleaved when the second residue in the primary sequence is small and uncharged (Met-Ala-, Cys, Gly, Pro, Ser, Thr, or Val).

AlphaFold DB , UniProt , Accession A0A087XW61, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 354 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	26.2	Very low	31.1	Very low	237 Å²	237	148.1 Å²	148.1	100%	1.167	68%	0.682	S	S	*	*				0	89.5	0	-92	177.2	176.5	0	0	108.1
2	I	23	Very low	32	Very low	156 Å²	156	142.7 Å²	142.7	80%	0.8	65%	0.652	S	S	*	*			trans	-102.8	112.9	173.6	-63.8	173	0	0	0	104.7	R4	I2-R4 PolarHBondContact O-N 3.26Å
3	F	20.9	Very low	33	Very low	205 Å²	205	132.6 Å²	132.6	90%	0.899	61%	0.607	S	S	*	*			trans	-63.4	101.3	169.7	-89.7	-97.1	0	0	0	107.7	S5	F3-S5 PolarHBondContact O-N 2.96Å
4	R	25.7	Very low	33.5	Very low	231 Å²	231	124.6 Å²	124.6	87%	0.872	57%	0.571	S	S	*	*			trans	-73.3	108.7	165.1	-80.6	-175.7	173.3	177.3	-1.8	107	I2 R6	I2-R4 PolarHBondContact O-N 3.26Å; R4-R6 PolarHBondContact O-N 2.87Å
5	S	28.1	Very low	33.3	Very low	71 Å²	71	117.1 Å²	117.1	50%	0.497	54%	0.539	S	S	.	.			trans	-62.6	129.5	173.7	165.4	0	0	0	0	109.8	F3 D7	F3-S5 PolarHBondContact O-N 2.96Å; S5-D7 PolarHBondContact O-N 3.11Å; S5-D7 VanDerWaalsContact O-N 3.17Å; S5-D7 PolarHBondContact OG-N 2.84Å
6	R	34.4	Very low	33.3	Very low	227 Å²	227	110.8 Å²	110.8	86%	0.857	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-8.4	178.3	-76.4	175.7	167.1	175.4	-8.6	114	R4	R4-R6 PolarHBondContact O-N 2.87Å
7	D	33.9	Very low	33.1	Very low	116 Å²	116	108.5 Å²	108.5	62%	0.62	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-8.4	-171.5	-67.3	-33.1	0	0	0	114.8	S5	S5-D7 PolarHBondContact O-N 3.11Å; S5-D7 VanDerWaalsContact O-N 3.17Å; S5-D7 PolarHBondContact OG-N 2.84Å
8	H	35.5	Very low	32.9	Very low	129 Å²	129	107.8 Å²	107.8	60%	0.597	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-30	-175.4	-79.2	17.5	0	0	0	114.3	Y12	H8-Y12 WeakPolarHBondContact O-CD2 3.07Å; H8-Y12 WeakPolarHBondContact O-CE2 3.31Å
9	N	35.9	Very low	32.7	Very low	70 Å²	70	107.5 Å²	107.5	37%	0.374	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-30.2	-177.6	-81.9	21.9	0	0	0	114.3	L11 Y12 E280	N9-L11 PolarHBondContact O-N 3.44Å; N9-Y12 PolarHBondContact O-N 2.94Å; N9-Y12 VanDerWaalsContact O-N 3.09Å; N9-E280 PolarHBondContact ND2-OE2 3.28Å
10	R	40.5	Very low	32.5	Very low	109 Å²	109	105.5 Å²	105.5	41%	0.411	55%	0.547	S	S	.	.	H	α-helix	trans	-61.8	-25.3	173.8	-83.2	-171.9	175.4	-167.1	-1	112.5	Y12 M14 E98 W99	R10-Y12 VanDerWaalsContact C-N 3.28Å; R10-Y12 PolarHBondContact O-N 3.49Å; R10-M14 WeakPolarHBondContact O-CB 3.47Å; R10-M14 WeakPolarHBondContact O-CG 3.16Å; R10-M14 PolarHBondContact O-N 3.29Å; R10-E98 IonicContact CZ-OE1 3.5Å; R10-E98 IonicContact NH1-OE1 3.49Å; R10-E98 PolarHBondContact NH1-OE1 3.21Å; R10-E98 IonicContact NH2-OE1 3.8Å; R10-W99 HydrophobicContact CG-CZ2 4.36Å
11	L	37.6	Very low	32.2	Very low	78 Å²	78	106.4 Å²	106.4	41%	0.408	56%	0.561	S	S	.	*	H	α-helix	trans	-72.4	-19.5	178.1	-124.6	115.7	0	0	0	113.9	N9 M14 V18	N9-L11 PolarHBondContact O-N 3.44Å; L11-M14 CarbonylContact O-C 3.55Å; L11-V18 HydrophobicContact CD1-CG2 3.61Å; L11-V18 HydrophobicContact CD2-CG2 3.6Å; L11-V18 HydrophobicContact CG-CG2 3.75Å
12	Y	42.1	Very low	32.3	Very low	83 Å²	83	101.2 Å²	101.2	33%	0.325	55%	0.548	S	S	.	.	H	α-helix	trans	-97.5	-32.9	-173.6	-75.2	-66.3	0	0	0	112.9	H8 N9 R10 M14 Y265 F311	H8-Y12 WeakPolarHBondContact O-CD2 3.07Å; H8-Y12 WeakPolarHBondContact O-CE2 3.31Å; N9-Y12 PolarHBondContact O-N 2.94Å; N9-Y12 VanDerWaalsContact O-N 3.09Å; R10-Y12 VanDerWaalsContact C-N 3.28Å; R10-Y12 PolarHBondContact O-N 3.49Å; Y12-M14 VanDerWaalsContact C-N 3.26Å; Y12-Y265 VanDerWaalsContact CB-O 3.28Å; Y12-Y265 WeakPolarHBondContact CB-O 3.44Å; Y12-Y265 HydrophobicContact CD1-CD1 4.41Å; Y12-Y265 WeakPolarHBondContact CD1-O 3.44Å; Y12-Y265 AromaticContact CE1-CD1 3.6Å; Y12-Y265 HydrophobicContact CE1-CD1 3.6Å; Y12-Y265 HydrophobicContact CE1-CG 4.04Å; Y12-Y265 AromaticContact CZ-CD1 3.94Å; Y12-F311 HydrophobicContact CE1-CZ 4.48Å
13	L	44.7	Very low	32.5	Very low	12 Å²	12	100.1 Å²	100.1	6%	0.063	55%	0.548	C	S	.	.	H	α-helix	trans	-72.2	-22.4	163.3	-80.2	132.3	0	0	0	112.7	W99 I267 H269 H276 E280	L13-W99 HydrophobicContact CD1-CZ2 4.44Å; L13-I267 HydrophobicContact CD1-CD1 3.65Å; L13-I267 HydrophobicContact CD1-CG1 4.45Å; L13-I267 HydrophobicContact CD2-CD1 4.24Å; L13-I267 HydrophobicContact CD2-CG1 4.41Å; L13-I267 HydrophobicContact CG-CD1 3.69Å; L13-I267 HydrophobicContact CG-CG1 3.96Å; L13-H269 HydrophobicContact CD2-CB 3.42Å; L13-H269 VanDerWaalsContact CD2-CB 3.42Å; L13-H276 HydrophobicContact CD2-CB 4.24Å; L13-E280 HydrophobicContact CD1-CG 3.97Å
14	M	40.2	Very low	32.7	Very low	21 Å²	21	93.7 Å²	93.7	10%	0.103	54%	0.539	C	S	.	.			trans	-127.3	78.4	-175.7	-45.9	174.8	104.2	0	0	109	R10 L11 Y12 A16 A17 V96 W99	R10-M14 WeakPolarHBondContact O-CB 3.47Å; R10-M14 WeakPolarHBondContact O-CG 3.16Å; R10-M14 PolarHBondContact O-N 3.29Å; L11-M14 CarbonylContact O-C 3.55Å; Y12-M14 VanDerWaalsContact C-N 3.26Å; M14-A16 CarbonylContact O-C 3.3Å; M14-A16 VanDerWaalsContact O-C 3.3Å; M14-A16 PolarHBondContact O-N 3.11Å; M14-A17 PolarHBondContact O-N 3.21Å; M14-V96 HydrophobicContact CE-CB 3.25Å; M14-V96 HydrophobicContact CE-CG1 2.93Å; M14-V96 HydrophobicContact CE-CG2 3.89Å; M14-W99 HydrophobicContact CE-CH2 4.04Å; M14-W99 HydrophobicContact CE-CZ3 3.64Å; M14-W99 HydrophobicContact CG-CH2 3.95Å; M14-W99 HydrophobicContact CG-CZ3 4.38Å; M14-W99 HydrophobicContact SD-CH2 3.68Å; M14-W99 HydrophobicContact SD-CZ3 3.92Å
15	A	31.7	Very low	32.8	Very low	11 Å²	11	91 Å²	91	9%	0.091	54%	0.541	C	S	.	.	S	Bend	trans	-58.7	8.9	160.6	0	0	0	0	0	113.2	H178 F266 K317 W318	A15-H178 VanDerWaalsContact CB-ND1 3.35Å; A15-H178 WeakPolarHBondContact CB-ND1 2.94Å; A15-F266 HydrophobicContact CB-CE1 4.43Å; A15-K317 VanDerWaalsContact O-O 3.07Å; A15-W318 HydrophobicContact CB-CE3 4.49Å
16	A	32.6	Very low	32.9	Very low	16 Å²	16	93.2 Å²	93.2	13%	0.132	55%	0.554	C	S	.	*			trans	-119.7	93.4	150.5	0	0	0	0	0	114.2	M14 G162 W318	M14-A16 CarbonylContact O-C 3.3Å; M14-A16 VanDerWaalsContact O-C 3.3Å; M14-A16 PolarHBondContact O-N 3.11Å; A16-G162 WeakPolarHBondContact CB-O 3.19Å; A16-W318 HydrophobicContact CB-CE3 4.45Å; A16-W318 HydrophobicContact CB-CH2 3.09Å; A16-W318 HydrophobicContact CB-CZ2 3.2Å; A16-W318 HydrophobicContact CB-CZ3 3.76Å
17	A	30.4	Very low	32.6	Very low	72 Å²	72	87.6 Å²	87.6	60%	0.595	55%	0.55	S	S	*	*			trans	-172.1	62.4	139.7	0	0	0	0	0	112.2	M14	M14-A17 PolarHBondContact O-N 3.21Å
18	V	29.6	Very low	32.4	Very low	96 Å²	96	94 Å²	94	58%	0.582	57%	0.565	S	S	*	*			trans	-138.7	89	158.4	-168.9	0	0	0	0	112.3	L11	L11-V18 HydrophobicContact CD1-CG2 3.61Å; L11-V18 HydrophobicContact CD2-CG2 3.6Å; L11-V18 HydrophobicContact CG-CG2 3.75Å
19	A	28.7	Very low	32.1	Very low	102 Å²	102	97.7 Å²	97.7	84%	0.843	58%	0.58	S	S	*	*			trans	-133.2	105.8	150.2	0	0	0	0	0	108.5
20	G	29.2	Very low	31.7	Very low	68 Å²	68	97.6 Å²	97.6	70%	0.701	60%	0.595	S	S	*	*			trans	150.1	72.4	166.3	0	0	0	0	0	115.5
21	C	25.4	Very low	31.2	Very low	124 Å²	124	98.7 Å²	98.7	84%	0.838	61%	0.613	S	S	*	*			trans	-174	90.7	143.2	-97.3	0	0	0	0	109.8	V23	C21-V23 PolarHBondContact O-N 2.99Å
22	S	27.8	Very low	30.8	Very low	128 Å²	128	101.6 Å²	101.6	90%	0.895	63%	0.63	S	S	*	*			trans	-72.2	105.6	162.3	45.6	0	0	0	0	109
23	V	28.3	Very low	30.1	Very low	134 Å²	134	102.6 Å²	102.6	81%	0.812	65%	0.647	S	S	*	*			trans	-105.8	114.7	167.2	-164.9	0	0	0	0	108.2	C21	C21-V23 PolarHBondContact O-N 2.99Å
24	G	24.3	Very low	29.3	Very low	69 Å²	69	111.8 Å²	111.8	71%	0.711	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-65.3	141.7	-173	0	0	0	0	0	113.9
25	L	27	Very low	28.9	Very low	174 Å²	174	118 Å²	118	91%	0.911	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-71	130.2	163.5	-76.5	157.1	0	0	0	109.6	S27	L25-S27 PolarHBondContact O-N 3.09Å
26	P	30.2	Very low	28.8	Very low	118 Å²	118	129.2 Å²	129.2	77%	0.766	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-81.4	117	165.8	30.1	-27.8	0	0	0	109.8
27	S	28.1	Very low	28.7	Very low	110 Å²	110	139.7 Å²	139.7	77%	0.769	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-59.6	133.9	163	66.7	0	0	0	0	110.5	L25	L25-S27 PolarHBondContact O-N 3.09Å
28	R	31.5	Very low	28.8	Very low	250 Å²	250	143 Å²	143	94%	0.943	81%	0.808	S	S	*	*			trans	-118.8	126.3	156.8	-87	-171	175.3	-168.4	0.2	111
29	K	28.1	Very low	28.8	Very low	207 Å²	207	143.1 Å²	143.1	90%	0.9	81%	0.814	S	S	*	*			trans	-65.9	152.3	174.6	-60.6	171.7	176	177.8	0	110.7
30	G	28.6	Very low	28.9	Very low	67 Å²	67	144.1 Å²	144.1	69%	0.691	81%	0.814	S	S	*	*				153.2	104.4	127.5	0	0	0	0	0	119.8
31	V	29.6	Very low	29.1	Very low	132 Å²	132	149.5 Å²	149.5	80%	0.8	83%	0.826	S	S	*	*				78.9	107.1	121.4	-170	0	0	0	0	121.1
32	N	28.2	Very low	29.2	Very low	140 Å²	140	147.4 Å²	147.4	75%	0.749	83%	0.826	S	S	*	*			trans	68.9	128.3	130.4	-68.4	-9.9	0	0	0	125.6
33	C	27.6	Very low	29.3	Very low	103 Å²	103	153.1 Å²	153.1	70%	0.696	83%	0.828	S	S	*	*				60.3	123.9	128.9	-68.4	0	0	0	0	120.3
34	F	28.9	Very low	29.3	Very low	206 Å²	206	159 Å²	159	90%	0.904	84%	0.836	S	S	*	*				-166.8	146.5	99.6	-120.9	-97.1	0	0	0	112.6
35	L	30.4	Very low	29.7	Very low	151 Å²	151	161.2 Å²	161.2	79%	0.791	84%	0.84	S	S	*	*			trans	-69.1	151.9	178.4	-72.2	134.3	0	0	0	113.3
36	R	30.2	Very low	29.9	Very low	246 Å²	246	164.7 Å²	164.7	93%	0.928	84%	0.841	S	S	*	*				-179.5	126.9	114.2	-100.6	173.8	174.8	-151.5	-1.3	113.6
37	R	31.6	Very low	30	Very low	236 Å²	236	164.2 Å²	164.2	89%	0.891	84%	0.84	S	S	*	*			trans	-60.4	152.1	152.9	-81.7	174.8	165.6	-178.3	-4.8	109.8
38	V	31.5	Very low	30.2	Very low	141 Å²	141	167.8 Å²	167.8	86%	0.855	84%	0.842	S	S	*	*				-162.4	135.3	116.4	171	0	0	0	0	109.6
39	S	30.1	Very low	30.3	Very low	100 Å²	100	162.3 Å²	162.3	70%	0.699	83%	0.832	S	S	*	*			trans	-71.1	154.1	170.9	49.2	0	0	0	0	114.3
40	S	31.1	Very low	30.9	Very low	122 Å²	122	160.8 Å²	160.8	85%	0.853	83%	0.832	S	S	*	*				178.5	144.3	121.3	44.5	0	0	0	0	113
41	L	31.7	Very low	31.1	Very low	182 Å²	182	165.4 Å²	165.4	95%	0.953	84%	0.84	S	S	*	*			trans	-73	147.3	173.5	-72.2	126.4	0	0	0	111.4
42	G	29.2	Very low	31.3	Very low	80 Å²	80	164.2 Å²	164.2	83%	0.825	84%	0.837	S	S	*	*			trans	-171	76.1	168.2	0	0	0	0	0	111.2
43	R	28.3	Very low	31.5	Very low	248 Å²	248	166 Å²	166	94%	0.936	84%	0.841	S	S	*	*			trans	-93	109.2	177.4	-146.6	-179.4	-153.2	-145.3	5.1	108.3
44	W	29.8	Very low	31.8	Very low	258 Å²	258	169.1 Å²	169.1	98%	0.977	85%	0.845	S	S	*	*			trans	-114.7	123.4	165.2	-100.9	35.6	0	0	0	108.8
45	S	32	Very low	32.1	Very low	115 Å²	115	167.5 Å²	167.5	80%	0.804	84%	0.84	S	S	*	*			trans	-70.7	132.6	175	57	0	0	0	0	110.7
46	R	31.4	Very low	32.6	Very low	246 Å²	246	170.6 Å²	170.6	93%	0.928	84%	0.841	S	S	*	*			trans	-152.8	119.3	145.7	-111.8	170.9	-177.8	-164.3	-0	109.9
47	S	33.3	Very low	32.7	Very low	108 Å²	108	162.9 Å²	162.9	76%	0.755	83%	0.825	S	S	*	*			trans	-52.8	153.1	170.2	40.7	0	0	0	0	114.2
48	K	31	Very low	32.9	Very low	185 Å²	185	159.2 Å²	159.2	80%	0.804	82%	0.816	S	S	*	*			trans	125.2	119.7	171.9	-78.2	179.7	-177	-168.9	0	107.7
49	D	33.3	Very low	33.3	Very low	136 Å²	136	160.5 Å²	160.5	73%	0.727	81%	0.81	S	S	*	*			cis	-156.7	160.3	28.3	-78.1	-49.7	0	0	0	110.5	L51	D49-L51 PolarHBondContact O-N 2.95Å
50	L	41.7	Very low	33.8	Very low	174 Å²	174	167 Å²	167	91%	0.911	82%	0.819	S	S	*	*			trans	-54	114.5	168	-76.4	90	0	0	0	110.6
51	L	32.9	Very low	34.1	Very low	164 Å²	164	171.7 Å²	171.7	86%	0.859	82%	0.818	S	S	*	*			trans	-137.3	109.8	154.9	-87.6	165.6	0	0	0	108.5	D49 E53	D49-L51 PolarHBondContact O-N 2.95Å; L51-E53 PolarHBondContact O-N 2.79Å
52	C	32.7	Very low	34.4	Very low	108 Å²	108	172 Å²	172	73%	0.73	81%	0.812	S	S	*	*			trans	-20	113.8	167.4	-170.1	0	0	0	0	114.5	Q54	C52-Q54 PolarHBondContact O-N 2.77Å
53	E	32.5	Very low	35.2	Very low	178 Å²	178	179.5 Å²	179.5	83%	0.832	82%	0.815	S	S	*	*			trans	-63	85.1	160.8	-76.5	178.2	148.4	0	0	109.4	L51 H55	L51-E53 PolarHBondContact O-N 2.79Å; E53-H55 VanDerWaalsContact C-N 3.35Å
54	Q	34	Very low	36.3	Very low	168 Å²	168	177 Å²	177	79%	0.785	81%	0.812	S	S	*	*			trans	-94.3	79.9	150.4	-81.6	-174.8	-8.4	0	0	107.4	C52 R56	C52-Q54 PolarHBondContact O-N 2.77Å; Q54-R56 VanDerWaalsContact C-N 3.26Å; Q54-R56 PolarHBondContact O-N 2.79Å
55	H	36	Very low	37.8	Very low	171 Å²	171	167.9 Å²	167.9	79%	0.792	79%	0.787	S	S	*	*			trans	-55.9	97.3	157.5	-105.4	-133	0	0	0	107.5	E53 S57	E53-H55 VanDerWaalsContact C-N 3.35Å; H55-S57 PolarHBondContact O-N 3.19Å
56	R	39.7	Very low	39.9	Very low	216 Å²	216	166.1 Å²	166.1	82%	0.815	77%	0.774	S	S	*	*			trans	-63.8	87.9	160.3	-86.3	-178.4	161.3	-157.4	-3.4	106.9	Q54 F58	Q54-R56 VanDerWaalsContact C-N 3.26Å; Q54-R56 PolarHBondContact O-N 2.79Å; R56-F58 PolarHBondContact O-N 2.93Å
57	S	33.3	Very low	42.4	Very low	84 Å²	84	154.9 Å²	154.9	59%	0.587	73%	0.732	S	S	*	*			trans	-65.1	85.3	156.8	56.8	0	0	0	0	106.9	H55 F59	H55-S57 PolarHBondContact O-N 3.19Å; S57-F59 PolarHBondContact O-N 3.41Å
58	F	36.4	Very low	45.1	Very low	160 Å²	160	153.2 Å²	153.2	70%	0.702	72%	0.715	S	S	*	*			trans	-68	79.2	163.3	-132.5	-94.2	0	0	0	105.7	R56 W60	R56-F58 PolarHBondContact O-N 2.93Å; F58-W60 PolarHBondContact O-N 3.41Å
59	F	38.3	Very low	48.2	Very low	168 Å²	168	147 Å²	147	74%	0.737	69%	0.693	S	S	*	*			trans	-60.1	109.5	168.2	-88.2	-89.2	0	0	0	105.7	S57 R61	S57-F59 PolarHBondContact O-N 3.41Å; F59-R61 PolarHBondContact O-N 2.89Å
60	W	42	Very low	51.1	Low	235 Å²	235	141.4 Å²	141.4	89%	0.89	66%	0.663	S	S	*	*			trans	-57.7	89	156.8	-65.3	84.9	0	0	0	106.1	F58 K62	F58-W60 PolarHBondContact O-N 3.41Å; W60-K62 PolarHBondContact O-N 2.86Å
61	R	36.6	Very low	53.7	Low	221 Å²	221	142 Å²	142	83%	0.834	65%	0.653	S	S	*	*			trans	-65.2	87.8	163.5	-140.9	177.5	172.8	-158.1	-4	103	F59 W63	F59-R61 PolarHBondContact O-N 2.89Å; R61-W63 PolarHBondContact O-N 2.84Å
62	K	39.2	Very low	56.6	Low	188 Å²	188	137.8 Å²	137.8	82%	0.817	64%	0.636	S	S	*	*			trans	-50.2	104.4	161.1	-102.9	-174.8	173.3	-176.5	0	103.1	W60 K64	W60-K62 PolarHBondContact O-N 2.86Å; K62-K64 PolarHBondContact O-N 2.73Å
63	W	44.4	Very low	59.7	Low	238 Å²	238	134.7 Å²	134.7	90%	0.902	62%	0.618	S	S	*	*			trans	-53.3	105.4	161.1	-105.8	56.9	0	0	0	103.3	R61 S65	R61-W63 PolarHBondContact O-N 2.84Å; W63-S65 PolarHBondContact O-N 3.39Å
64	K	52.4	Low	62.8	Low	197 Å²	197	131 Å²	131	86%	0.857	61%	0.608	S	S	*	*			trans	-62.5	112.1	171	-85.9	-174.1	173	-174	0	103.4	K62 S66	K62-K64 PolarHBondContact O-N 2.73Å; K64-S66 PolarHBondContact O-N 3.33Å
65	S	61.8	Low	65.9	Low	65 Å²	65	126 Å²	126	46%	0.455	59%	0.589	S	S	.	*			trans	-47.2	131.4	165.5	-165.5	0	0	0	0	107.4	W63 H67	W63-S65 PolarHBondContact O-N 3.39Å; S65-H67 WeakPolarHBondContact CB-O 3.39Å; S65-H67 PolarHBondContact O-N 2.66Å; S65-H67 PolarHBondContact OG-CE1 2.66Å; S65-H67 PolarHBondContact OG-ND1 2.92Å; S65-H67 PolarHBondContact OG-NE2 3.43Å; S65-H67 PolarHBondContact OG-O 2.94Å
66	S	75.5	Confident	68.8	Low	78 Å²	78	125 Å²	125	55%	0.545	58%	0.578	S	S	.	*	S	Bend	trans	-71.6	-18.6	178.8	49.7	0	0	0	0	111.7	K64 D217	K64-S66 PolarHBondContact O-N 3.33Å; S66-D217 WeakPolarHBondContact CB-OD2 3.26Å; S66-D217 PolarHBondContact OG-OD2 3.48Å
67	H	84.2	Confident	71.5	Confident	10 Å²	10	120.1 Å²	120.1	5%	0.046	57%	0.574	C	S	.	*	S	Bend	trans	-109.8	158.3	173.3	64.7	-80.2	0	0	0	113.1	S65 E306 D325 R327	S65-H67 WeakPolarHBondContact CB-O 3.39Å; S65-H67 PolarHBondContact O-N 2.66Å; S65-H67 PolarHBondContact OG-CE1 2.66Å; S65-H67 PolarHBondContact OG-ND1 2.92Å; S65-H67 PolarHBondContact OG-NE2 3.43Å; S65-H67 PolarHBondContact OG-O 2.94Å; H67-E306 IonicContact CE1-OE2 3.59Å; H67-D325 PolarHBondContact NE2-O 3.47Å; H67-R327 HydrophobicContact CB-CG 4.18Å
68	N	89.8	Confident	74.5	Confident	73 Å²	73	118.6 Å²	118.6	39%	0.39	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-85	133.9	175.2	-70.4	-55.9	0	0	0	112	V70 N173 E187	N68-V70 PolarHBondContact O-N 3.4Å; N68-N173 PolarHBondContact O-ND2 2.97Å; N68-E187 PolarHBondContact ND2-OE2 2.83Å
69	V	95.1	Very high	77.4	Confident	56 Å²	56	113.7 Å²	113.7	34%	0.339	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-75.3	120.2	171.4	-176.1	0	0	0	0	109.6	D325	V69-D325 HydrophobicContact CB-CB 4.39Å; V69-D325 HydrophobicContact CG1-CB 3.78Å; V69-D325 HydrophobicContact CG2-CB 3.69Å
70	V	95	Very high	80.3	Confident	17 Å²	17	110 Å²	110	10%	0.103	55%	0.545	C	S	.	.	P	Polyproline II helix	trans	-80.8	138.3	-177.7	-179.9	0	0	0	0	110.5	N68 V172 N173 N174 V175	N68-V70 PolarHBondContact O-N 3.4Å; V70-V172 HydrophobicContact CG2-CB 3.89Å; V70-V172 HydrophobicContact CG2-CG1 3.84Å; V70-V172 WeakPolarHBondContact CG2-O 3.43Å; V70-N173 HydrophobicContact CG2-CB 4.01Å; V70-N174 WeakPolarHBondContact CA-OD1 3.08Å; V70-N174 VanDerWaalsContact CB-OD1 3.31Å; V70-N174 WeakPolarHBondContact CB-OD1 3.48Å; V70-N174 PolarHBondContact N-OD1 3.2Å; V70-V175 HydrophobicContact CB-CG2 4.15Å; V70-V175 HydrophobicContact CG1-CG2 3.89Å
71	R	95.1	Very high	83	Confident	186 Å²	186	100.1 Å²	100.1	70%	0.702	51%	0.51	S	S	*	.			trans	-134.8	147.8	175.5	-62.8	179.9	179.2	-103.5	-8.3	108.1	A73	R71-A73 PolarHBondContact O-N 2.91Å
72	P	94.6	Very high	85.9	Confident	77 Å²	77	91.8 Å²	91.8	50%	0.5	49%	0.485	S	S	.	.			trans	-56.3	138.2	176.8	-26	34.6	0	0	0	112.3	L314	P72-L314 HydrophobicContact CG-CD1 3.34Å
73	A	97.3	Very high	88.7	Confident	42 Å²	42	92.8 Å²	92.8	35%	0.347	49%	0.489	S	S	.	.			trans	-109	-159	171.5	0	0	0	0	0	110.6	R71 V75 D182 S183 R184	R71-A73 PolarHBondContact O-N 2.91Å; A73-V75 PolarHBondContact O-N 3.34Å; A73-D182 HydrophobicContact CB-CB 4.27Å; A73-D182 PolarHBondContact N-OD2 2.89Å; A73-S183 WeakPolarHBondContact CB-OG 3.39Å; A73-R184 HydrophobicContact CB-CB 4.16Å
74	T	98.2	Very high	91.2	Very high	101 Å²	101	87.4 Å²	87.4	62%	0.62	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-81	120.3	-176	-57.4	0	0	0	0	110.2	S183	T74-S183 WeakPolarHBondContact CB-OG 3.47Å; T74-S183 PolarHBondContact N-OG 3.21Å; T74-S183 VanDerWaalsContact N-OG 3.07Å; T74-S183 WeakPolarHBondContact O-CB 3.41Å; T74-S183 PolarHBondContact O-N 3.42Å; T74-S183 PolarHBondContact O-OG 3.23Å
75	V	98.3	Very high	93.4	Very high	63 Å²	63	78.3 Å²	78.3	38%	0.382	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-88.1	128.4	174.5	-176.8	0	0	0	0	109.5	A73 I180 D182	A73-V75 PolarHBondContact O-N 3.34Å; V75-I180 HydrophobicContact CG1-CG2 3.97Å; V75-I180 HydrophobicContact CG2-CG2 3.89Å; V75-D182 HydrophobicContact CG2-CB 3.96Å
76	R	97.1	Very high	95.1	Very high	149 Å²	149	79.9 Å²	79.9	56%	0.562	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-86	159.4	172.5	-67.7	-169.4	-178.9	147.5	-10.5	111.5	D139 K166	R76-D139 WeakPolarHBondContact CD-OD2 3.33Å; R76-D139 IonicContact CZ-OD2 3.96Å; R76-D139 IonicContact NE-OD2 3.94Å; R76-D139 IonicContact NH1-OD2 3.56Å; R76-D139 PolarHBondContact NH1-OD2 3.3Å; R76-K166 WeakPolarHBondContact O-CE 3.45Å; R76-K166 PolarHBondContact O-NZ 3.37Å
77	P	97.7	Very high	96.1	Very high	114 Å²	114	80.2 Å²	80.2	74%	0.74	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-53.6	152.8	169.9	-25.3	35.1	0	0	0	112.7
78	A	96.4	Very high	96.6	Very high	53 Å²	53	79.8 Å²	79.8	44%	0.438	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-63.1	152.3	176	0	0	0	0	0	112.4	L159 P165	A78-L159 HydrophobicContact CB-CD1 3.77Å; A78-P165 WeakPolarHBondContact CB-O 3.31Å
79	Y	97.6	Very high	96.8	Very high	57 Å²	57	80.3 Å²	80.3	22%	0.224	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-75.2	147.9	171	-58.4	-64.6	0	0	0	111.1	D139 D142 F143 H146	Y79-D139 PolarHBondContact OH-O 3.35Å; Y79-D142 WeakPolarHBondContact CE2-OD2 3.34Å; Y79-F143 HydrophobicContact CD1-CD2 4.24Å; Y79-F143 AromaticContact CE1-CD2 3.75Å; Y79-F143 HydrophobicContact CE1-CD2 3.75Å; Y79-F143 HydrophobicContact CE1-CE2 4.48Å; Y79-F143 HydrophobicContact CE2-CB 3.82Å; Y79-F143 HydrophobicContact CE2-CD2 4.08Å; Y79-F143 HydrophobicContact CE2-CG 4.47Å; Y79-F143 AromaticContact CZ-CD2 3.68Å; Y79-H146 WeakPolarHBondContact CB-NE2 3.37Å; Y79-H146 HydrophobicContact CD2-CB 4.07Å; Y79-H146 PolarHBondContact O-CE1 3.03Å
80	A	97.7	Very high	96.7	Very high	91 Å²	91	77.7 Å²	77.7	75%	0.752	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-80.5	133.4	-176.9	0	0	0	0	0	111.7	H146	A80-H146 PolarHBondContact O-NE2 3.39Å
81	V	98.4	Very high	96.6	Very high	27 Å²	27	79 Å²	79	16%	0.164	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-89.8	126.2	172.8	-179.6	0	0	0	0	109.9	I85 I150 Y155 L159	V81-I85 HydrophobicContact CG1-CB 4.01Å; V81-I85 HydrophobicContact CG1-CD1 4.24Å; V81-I85 HydrophobicContact CG1-CG2 4.06Å; V81-I150 HydrophobicContact CB-CD1 4.34Å; V81-I150 HydrophobicContact CG1-CD1 3.86Å; V81-I150 HydrophobicContact CG2-CD1 4.16Å; V81-Y155 HydrophobicContact CB-CE2 4.32Å; V81-Y155 HydrophobicContact CG1-CD2 3.89Å; V81-Y155 HydrophobicContact CG1-CE2 4.14Å; V81-Y155 HydrophobicContact CG2-CD2 4.2Å; V81-Y155 HydrophobicContact CG2-CE2 3.83Å; V81-L159 HydrophobicContact CG2-CD2 3.77Å
82	P	98.4	Very high	96.3	Very high	46 Å²	46	75 Å²	75	30%	0.299	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-54.2	140.3	172.4	-29.7	36.3	0	0	0	113.8	H84 I85 I150	P82-H84 VanDerWaalsContact CB-CE1 3.42Å; P82-H84 WeakPolarHBondContact CB-CE1 2.85Å; P82-H84 WeakPolarHBondContact CB-ND1 3.15Å; P82-H84 PolarHBondContact O-N 2.92Å; P82-H84 VanDerWaalsContact O-N 3.12Å; P82-I85 HydrophobicContact CB-CD1 4.36Å; P82-I85 HydrophobicContact CG-CD1 4.34Å; P82-I85 PolarHBondContact O-N 3.16Å; P82-I85 VanDerWaalsContact O-N 3.16Å; P82-I150 HydrophobicContact CG-CG2 3.71Å
83	K	97.3	Very high	96.2	Very high	208 Å²	208	75 Å²	75	90%	0.904	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-19.7	-173.2	-66.3	-175.1	178.4	-177.6	0	115.2	I85	K83-I85 VanDerWaalsContact C-N 3.33Å
84	H	97.8	Very high	95.7	Very high	125 Å²	125	75.8 Å²	75.8	58%	0.579	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-14.3	-179.4	70.1	-83.5	0	0	0	113	P82 N153	P82-H84 VanDerWaalsContact CB-CE1 3.42Å; P82-H84 WeakPolarHBondContact CB-CE1 2.85Å; P82-H84 WeakPolarHBondContact CB-ND1 3.15Å; P82-H84 PolarHBondContact O-N 2.92Å; P82-H84 VanDerWaalsContact O-N 3.12Å; H84-N153 PolarHBondContact NE2-OD1 3.45Å
85	I	98.4	Very high	95.2	Very high	6 Å²	6	77 Å²	77	3%	0.031	44%	0.44	C	S	.	.	S	Bend	trans	-75.7	130.3	177.5	-70.2	174.3	0	0	0	108.9	V81 P82 K83 Q87 I150 N153 Y155	V81-I85 HydrophobicContact CG1-CB 4.01Å; V81-I85 HydrophobicContact CG1-CD1 4.24Å; V81-I85 HydrophobicContact CG1-CG2 4.06Å; P82-I85 HydrophobicContact CB-CD1 4.36Å; P82-I85 HydrophobicContact CG-CD1 4.34Å; P82-I85 PolarHBondContact O-N 3.16Å; P82-I85 VanDerWaalsContact O-N 3.16Å; K83-I85 VanDerWaalsContact C-N 3.33Å; I85-Q87 PolarHBondContact O-N 2.68Å; I85-I150 HydrophobicContact CD1-CB 4.25Å; I85-I150 HydrophobicContact CD1-CD1 3.55Å; I85-I150 HydrophobicContact CD1-CG1 4.42Å; I85-I150 HydrophobicContact CD1-CG2 3.83Å; I85-N153 HydrophobicContact CG1-CB 4.49Å; I85-Y155 HydrophobicContact CG2-CD2 4.48Å
86	V	97.1	Very high	94.7	Very high	98 Å²	98	75.4 Å²	75.4	59%	0.594	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-67	126.3	176.8	-176.1	0	0	0	0	108.5	Y199	V86-Y199 HydrophobicContact CG1-CE1 4.19Å
87	Q	96.6	Very high	94	Very high	85 Å²	85	69.5 Å²	69.5	40%	0.397	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-101.7	143.4	-179.5	-59.3	-178.8	-9.1	0	0	109.5	I85 V91 Y155	I85-Q87 PolarHBondContact O-N 2.68Å; Q87-V91 HydrophobicContact CB-CB 4.22Å; Q87-V91 HydrophobicContact CB-CG1 4.46Å; Q87-V91 HydrophobicContact CB-CG2 4.29Å; Q87-V91 VanDerWaalsContact OE1-CG1 3.29Å; Q87-Y155 HydrophobicContact CB-CD2 4.29Å; Q87-Y155 HydrophobicContact CB-CE2 4.38Å; Q87-Y155 HydrophobicContact CG-CD2 3.84Å; Q87-Y155 HydrophobicContact CG-CE2 3.92Å
88	P	95.8	Very high	93.4	Very high	2 Å²	2	70.9 Å²	70.9	1%	0.013	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-66.8	157	168.6	26.3	-29	0	0	0	110.7	Y90 V91 Y155 Y199	P88-Y90 VanDerWaalsContact C-N 3.33Å; P88-Y90 HydrophobicContact CB-CD1 3.94Å; P88-Y90 HydrophobicContact CB-CE1 3.44Å; P88-Y90 VanDerWaalsContact CB-CE1 3.44Å; P88-Y90 HydrophobicContact CB-CE2 4.3Å; P88-Y90 HydrophobicContact CG-CD1 4.29Å; P88-Y90 HydrophobicContact CG-CD2 4.32Å; P88-Y90 HydrophobicContact CG-CE1 3.59Å; P88-Y90 HydrophobicContact CG-CE2 3.59Å; P88-Y90 WeakPolarHBondContact CG-OH 3.33Å; P88-Y90 PolarHBondContact O-N 2.7Å; P88-V91 HydrophobicContact CG-CG2 3.91Å; P88-V91 WeakPolarHBondContact O-CB 3.48Å; P88-V91 WeakPolarHBondContact O-CG2 3.49Å; P88-V91 PolarHBondContact O-N 3.36Å; P88-Y155 HydrophobicContact CG-CD1 3.86Å; P88-Y155 HydrophobicContact CG-CE1 4.1Å; P88-Y155 HydrophobicContact CG-CG 4.47Å; P88-Y199 HydrophobicContact CB-CD1 4.22Å; P88-Y199 HydrophobicContact CB-CD2 4.47Å; P88-Y199 HydrophobicContact CB-CE1 4.16Å; P88-Y199 HydrophobicContact CB-CE2 4.39Å; P88-Y199 HydrophobicContact CB-CG 4.34Å; P88-Y199 HydrophobicContact CG-CD1 4.28Å; P88-Y199 HydrophobicContact CG-CG 4.39Å
89	D	92.9	Very high	92.8	Very high	83 Å²	83	69.3 Å²	69.3	44%	0.444	39%	0.391	S	S	.	.	H	α-helix	trans	-58.2	-39	-171	62	-16.5	0	0	0	113.8	V91 S92 T93 P97	D89-V91 PolarHBondContact O-N 3.27Å; D89-V91 VanDerWaalsContact O-N 3.1Å; D89-S92 PolarHBondContact O-N 3.42Å; D89-S92 PolarHBondContact O-OG 3.49Å; D89-T93 PolarHBondContact O-N 2.68Å; D89-T93 PolarHBondContact O-OG1 3.08Å; D89-P97 WeakPolarHBondContact OD1-CG 3.29Å; D89-P97 VanDerWaalsContact OD2-CG 3.29Å; D89-P97 WeakPolarHBondContact OD2-CG 3.46Å
90	Y	93.2	Very high	92.2	Very high	2 Å²	2	68 Å²	68	1%	0.008	39%	0.39	C	S	.	.	H	α-helix	trans	-59	-23	179.9	54.9	-103.1	0	0	0	114.5	P88 S92 T93 G94 L95 P97 S157 Y161 H204 F275	P88-Y90 VanDerWaalsContact C-N 3.33Å; P88-Y90 HydrophobicContact CB-CD1 3.94Å; P88-Y90 HydrophobicContact CB-CE1 3.44Å; P88-Y90 VanDerWaalsContact CB-CE1 3.44Å; P88-Y90 HydrophobicContact CB-CE2 4.3Å; P88-Y90 HydrophobicContact CG-CD1 4.29Å; P88-Y90 HydrophobicContact CG-CD2 4.32Å; P88-Y90 HydrophobicContact CG-CE1 3.59Å; P88-Y90 HydrophobicContact CG-CE2 3.59Å; P88-Y90 WeakPolarHBondContact CG-OH 3.33Å; P88-Y90 PolarHBondContact O-N 2.7Å; Y90-S92 VanDerWaalsContact C-N 3.31Å; Y90-T93 WeakPolarHBondContact CA-OG1 3.46Å; Y90-G94 VanDerWaalsContact O-CA 3.3Å; Y90-G94 WeakPolarHBondContact O-CA 3.4Å; Y90-G94 PolarHBondContact O-N 3.13Å; Y90-L95 WeakPolarHBondContact CA-O 3.49Å; Y90-L95 WeakPolarHBondContact CB-O 3.34Å; Y90-P97 HydrophobicContact CD1-CG 4.17Å; Y90-S157 VanDerWaalsContact OH-CA 3.28Å; Y90-S157 WeakPolarHBondContact OH-CA 3.39Å; Y90-S157 WeakPolarHBondContact OH-CB 3.48Å; Y90-S157 PolarHBondContact OH-O 2.97Å; Y90-Y161 AromaticContact CD1-CD2 3.7Å; Y90-Y161 HydrophobicContact CD1-CD2 3.7Å; Y90-Y161 HydrophobicContact CD1-CE2 4.09Å; Y90-Y161 HydrophobicContact CD2-CD2 4.02Å; Y90-Y161 AromaticContact CE1-CD2 3.58Å; Y90-Y161 HydrophobicContact CE1-CD2 3.58Å; Y90-Y161 HydrophobicContact CE1-CE2 4.06Å; Y90-Y161 AromaticContact CE2-CD2 3.94Å; Y90-Y161 HydrophobicContact CE2-CD2 3.94Å; Y90-Y161 HydrophobicContact CE2-CG 4.45Å; Y90-Y161 AromaticContact CG-CD2 3.9Å; Y90-Y161 HydrophobicContact CG-CD2 3.9Å; Y90-Y161 AromaticContact CZ-CD2 3.72Å; Y90-H204 AromaticContact CE1-CE1 3.99Å; Y90-H204 PolarHBondContact OH-CE1 3.35Å; Y90-F275 HydrophobicContact CE1-CD1 4.47Å
91	V	92.4	Very high	91.8	Very high	45 Å²	45	70.6 Å²	70.6	27%	0.273	39%	0.391	S	S	.	.	H	α-helix	trans	-68.1	-37.1	175.9	-176.5	0	0	0	0	110.6	Q87 P88 D89 Y155	Q87-V91 HydrophobicContact CB-CB 4.22Å; Q87-V91 HydrophobicContact CB-CG1 4.46Å; Q87-V91 HydrophobicContact CB-CG2 4.29Å; Q87-V91 VanDerWaalsContact OE1-CG1 3.29Å; P88-V91 HydrophobicContact CG-CG2 3.91Å; P88-V91 WeakPolarHBondContact O-CB 3.48Å; P88-V91 WeakPolarHBondContact O-CG2 3.49Å; P88-V91 PolarHBondContact O-N 3.36Å; D89-V91 PolarHBondContact O-N 3.27Å; D89-V91 VanDerWaalsContact O-N 3.1Å; V91-Y155 HydrophobicContact CG1-CE2 4.5Å; V91-Y155 HydrophobicContact CG2-CE1 3.81Å; V91-Y155 HydrophobicContact CG2-CE2 4.03Å; V91-Y155 VanDerWaalsContact CG2-CZ 3.44Å; V91-Y155 VanDerWaalsContact CG2-OH 3.24Å; V91-Y155 WeakPolarHBondContact CG2-OH 3.16Å
92	S	90.4	Very high	91.6	Very high	100 Å²	100	76.2 Å²	76.2	70%	0.699	41%	0.41	S	S	*	.	H	α-helix	trans	-86.6	-36.2	-179.2	70	0	0	0	0	112.9	D89 Y90	D89-S92 PolarHBondContact O-N 3.42Å; D89-S92 PolarHBondContact O-OG 3.49Å; Y90-S92 VanDerWaalsContact C-N 3.31Å
93	T	91	Very high	91.5	Very high	77 Å²	77	76 Å²	76	47%	0.472	41%	0.406	S	S	.	.	H	α-helix	trans	-84.9	-25.8	-177.4	63.6	0	0	0	0	112.2	D89 Y90 L95	D89-T93 PolarHBondContact O-N 2.68Å; D89-T93 PolarHBondContact O-OG1 3.08Å; Y90-T93 WeakPolarHBondContact CA-OG1 3.46Å; T93-L95 PolarHBondContact O-N 2.96Å; T93-L95 PolarHBondContact OG1-N 2.81Å; T93-L95 VanDerWaalsContact OG1-N 3.15Å; T93-L95 PolarHBondContact OG1-O 3.26Å
94	G	87.7	Confident	91.4	Very high	60 Å²	60	67.8 Å²	67.8	62%	0.619	37%	0.371	S	S	*	.	S	Bend	trans	67.4	10.1	-169.6	0	0	0	0	0	113.5	Y90	Y90-G94 VanDerWaalsContact O-CA 3.3Å; Y90-G94 WeakPolarHBondContact O-CA 3.4Å; Y90-G94 PolarHBondContact O-N 3.13Å
95	L	87.8	Confident	91.4	Very high	125 Å²	125	66 Å²	66	65%	0.654	37%	0.365	S	S	*	.	S	Bend	trans	-118.2	138.4	-178.2	-62.4	177.3	0	0	0	108.6	Y90 T93	Y90-L95 WeakPolarHBondContact CA-O 3.49Å; Y90-L95 WeakPolarHBondContact CB-O 3.34Å; T93-L95 PolarHBondContact O-N 2.96Å; T93-L95 PolarHBondContact OG1-N 2.81Å; T93-L95 VanDerWaalsContact OG1-N 3.15Å; T93-L95 PolarHBondContact OG1-O 3.26Å
96	V	86.4	Confident	91.4	Very high	31 Å²	31	66.2 Å²	66.2	19%	0.188	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-72.4	133.1	172.3	-169.9	0	0	0	0	109.1	M14 Y161	M14-V96 HydrophobicContact CE-CB 3.25Å; M14-V96 HydrophobicContact CE-CG1 2.93Å; M14-V96 HydrophobicContact CE-CG2 3.89Å; V96-Y161 HydrophobicContact CB-CE2 4.45Å; V96-Y161 HydrophobicContact CG1-CD2 4.21Å; V96-Y161 HydrophobicContact CG1-CE1 4.18Å; V96-Y161 HydrophobicContact CG1-CE2 3.33Å; V96-Y161 WeakPolarHBondContact CG1-OH 3.47Å; V96-Y161 HydrophobicContact CG2-CE2 4.42Å
97	P	83.3	Confident	91.4	Very high	24 Å²	24	65.5 Å²	65.5	16%	0.156	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-67.1	143.6	-172.3	-20.2	35.7	0	0	0	110.9	D89 Y90 Y274	D89-P97 WeakPolarHBondContact OD1-CG 3.29Å; D89-P97 VanDerWaalsContact OD2-CG 3.29Å; D89-P97 WeakPolarHBondContact OD2-CG 3.46Å; Y90-P97 HydrophobicContact CD1-CG 4.17Å; P97-Y274 HydrophobicContact CB-CD1 4.4Å; P97-Y274 HydrophobicContact CB-CE1 4.43Å
98	E	84.4	Confident	91.5	Very high	143 Å²	143	67.2 Å²	67.2	67%	0.668	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-73.1	130.2	164.4	-58.3	-157.1	123.5	0	0	108.9	R10 Y274	R10-E98 IonicContact CZ-OE1 3.5Å; R10-E98 IonicContact NH1-OE1 3.49Å; R10-E98 PolarHBondContact NH1-OE1 3.21Å; R10-E98 IonicContact NH2-OE1 3.8Å; E98-Y274 WeakPolarHBondContact O-CE1 3.47Å
99	W	84.5	Confident	91.6	Very high	20 Å²	20	74.2 Å²	74.2	8%	0.076	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-95.9	157.3	172.9	55.2	87.5	0	0	0	111.4	R10 L13 M14 Y274 C277 H278	R10-W99 HydrophobicContact CG-CZ2 4.36Å; L13-W99 HydrophobicContact CD1-CZ2 4.44Å; M14-W99 HydrophobicContact CE-CH2 4.04Å; M14-W99 HydrophobicContact CE-CZ3 3.64Å; M14-W99 HydrophobicContact CG-CH2 3.95Å; M14-W99 HydrophobicContact CG-CZ3 4.38Å; M14-W99 HydrophobicContact SD-CH2 3.68Å; M14-W99 HydrophobicContact SD-CZ3 3.92Å; W99-Y274 HydrophobicContact CB-CD1 4.05Å; W99-Y274 HydrophobicContact CB-CE1 4.38Å; W99-Y274 HydrophobicContact CB-CG 4.24Å; W99-C277 HydrophobicContact CB-CB 3.64Å; W99-C277 HydrophobicContact CG-CB 3.82Å; W99-H278 AromaticContact CD1-CD2 3.99Å; W99-H278 AromaticContact NE1-NE2 3.89Å
100	P	84.5	Confident	91.9	Very high	31 Å²	31	72 Å²	72	20%	0.201	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-64.1	151	179	-18	30.7	0	0	0	113	Y102 Y274	P100-Y102 HydrophobicContact CB-CD1 3.39Å; P100-Y102 HydrophobicContact CB-CE1 3.13Å; P100-Y102 HydrophobicContact CB-CE2 4.44Å; P100-Y102 HydrophobicContact CB-CG 4.16Å; P100-Y102 HydrophobicContact CG-CD1 4.47Å; P100-Y102 HydrophobicContact CG-CE1 3.8Å; P100-Y102 PolarHBondContact O-N 2.67Å; P100-Y274 HydrophobicContact CG-CE2 4.15Å
101	D	89.9	Confident	92.1	Very high	145 Å²	145	73.1 Å²	73.1	78%	0.775	39%	0.392	S	S	*	.	S	Bend	trans	-81.6	37.6	176.6	-162.5	20.6	0	0	0	112.2	H278	D101-H278 IonicContact OD1-NE2 2.86Å
102	Y	93.5	Very high	92.4	Very high	144 Å²	144	75.6 Å²	75.6	57%	0.565	40%	0.4	S	S	*	.	S	Bend	trans	-144.3	156.1	177.2	67.3	-99.3	0	0	0	110.8	P100 E104	P100-Y102 HydrophobicContact CB-CD1 3.39Å; P100-Y102 HydrophobicContact CB-CE1 3.13Å; P100-Y102 HydrophobicContact CB-CE2 4.44Å; P100-Y102 HydrophobicContact CB-CG 4.16Å; P100-Y102 HydrophobicContact CG-CD1 4.47Å; P100-Y102 HydrophobicContact CG-CE1 3.8Å; P100-Y102 PolarHBondContact O-N 2.67Å; Y102-E104 HydrophobicContact CE2-CB 4.22Å
103	I	96.7	Very high	92.8	Very high	42 Å²	42	70.9 Å²	70.9	22%	0.215	37%	0.368	C	S	.	.			trans	-84	121.6	172.2	-61.2	165.2	0	0	0	108.5	I105 H278 P279 I290 M296	I103-I105 PolarHBondContact O-N 3.28Å; I103-H278 HydrophobicContact CG1-CB 3.96Å; I103-P279 HydrophobicContact CD1-CB 3.88Å; I103-P279 HydrophobicContact CG1-CB 4.07Å; I103-I290 HydrophobicContact CD1-CG2 3.66Å; I103-M296 HydrophobicContact CB-CE 4.21Å; I103-M296 HydrophobicContact CD1-CE 3.99Å; I103-M296 HydrophobicContact CG2-CE 3.66Å; I103-M296 HydrophobicContact CG2-CG 3.77Å; I103-M296 HydrophobicContact CG2-SD 3.81Å
104	E	95.6	Very high	93.2	Very high	36 Å²	36	67.2 Å²	67.2	17%	0.168	35%	0.345	C	S	.	.			trans	-75.6	124.8	179.6	-174.9	-173.2	-141.5	0	0	111.1	Y102 K106 Q110	Y102-E104 HydrophobicContact CE2-CB 4.22Å; E104-K106 HydrophobicContact CG-CG 4.32Å; E104-K106 WeakPolarHBondContact OE2-CE 3.36Å; E104-K106 IonicContact OE2-NZ 3.28Å; E104-K106 PolarHBondContact OE2-NZ 3.44Å; E104-Q110 PolarHBondContact OE1-NE2 3.41Å
105	I	97.9	Very high	93.7	Very high	86 Å²	86	65.4 Å²	65.4	44%	0.441	32%	0.324	S	S	.	.			trans	-91.5	109.8	166.4	-57	-54.2	0	0	0	108.3	I103 D293 E294 M296	I103-I105 PolarHBondContact O-N 3.28Å; I105-D293 HydrophobicContact CD1-CB 3.91Å; I105-E294 WeakPolarHBondContact CG2-O 3.34Å; I105-M296 HydrophobicContact CD1-CE 4.14Å; I105-M296 HydrophobicContact CD1-CG 3.5Å
106	K	97.8	Very high	94.2	Very high	11 Å²	11	65 Å²	65	5%	0.048	31%	0.314	C	S	.	.			trans	-76	136.8	-173.6	-70.4	178.3	171	53.8	0	111.6	E104 Q110 I111 L114 I271 G295 S297	E104-K106 HydrophobicContact CG-CG 4.32Å; E104-K106 WeakPolarHBondContact OE2-CE 3.36Å; E104-K106 IonicContact OE2-NZ 3.28Å; E104-K106 PolarHBondContact OE2-NZ 3.44Å; K106-Q110 HydrophobicContact CB-CB 3.96Å; K106-Q110 HydrophobicContact CD-CB 4.45Å; K106-Q110 HydrophobicContact CG-CB 4.13Å; K106-I111 HydrophobicContact CB-CD1 4.41Å; K106-I111 HydrophobicContact CB-CG1 3.77Å; K106-L114 HydrophobicContact CD-CD2 4.01Å; K106-I271 WeakPolarHBondContact CE-O 3.44Å; K106-I271 PolarHBondContact NZ-O 3.42Å; K106-G295 PolarHBondContact N-O 3.3Å; K106-S297 VanDerWaalsContact CD-OG 3.31Å; K106-S297 WeakPolarHBondContact CD-OG 3.41Å; K106-S297 WeakPolarHBondContact CE-OG 3.46Å; K106-S297 PolarHBondContact NZ-OG 3.4Å
107	N	98	Very high	94.8	Very high	83 Å²	83	63.5 Å²	63.5	44%	0.444	31%	0.305	S	S	.	.			trans	-78.9	174	167.3	72.3	43.7	0	0	0	111.2	E109 Q110 I111	N107-E109 PolarHBondContact O-N 3.26Å; N107-E109 WeakPolarHBondContact OD1-CB 3.44Å; N107-E109 PolarHBondContact OD1-N 3.22Å; N107-Q110 PolarHBondContact ND2-OE1 3.16Å; N107-Q110 PolarHBondContact O-N 2.85Å; N107-Q110 WeakPolarHBondContact OD1-CG 3.39Å; N107-Q110 PolarHBondContact OD1-N 3.2Å; N107-I111 VanDerWaalsContact O-CG1 3.31Å; N107-I111 WeakPolarHBondContact O-CG1 3.28Å; N107-I111 PolarHBondContact O-N 3.12Å
108	Q	98	Very high	95.5	Very high	122 Å²	122	62.4 Å²	62.4	57%	0.57	30%	0.298	S	S	*	.	H	α-helix	trans	-58.7	-40.8	-176.6	-174.1	58.8	37.6	0	0	113.9	I111 E112	Q108-I111 PolarHBondContact O-N 3.48Å; Q108-E112 WeakPolarHBondContact CG-OE1 3.08Å; Q108-E112 PolarHBondContact NE2-OE1 2.85Å; Q108-E112 WeakPolarHBondContact O-CG 3.15Å; Q108-E112 PolarHBondContact O-N 2.92Å
109	E	98.1	Very high	96.2	Very high	149 Å²	149	58.3 Å²	58.3	70%	0.696	28%	0.279	S	S	*	.	H	α-helix	trans	-65.6	-42.2	179	-177.5	-178	178.4	0	0	111.2	N107 E112 G113	N107-E109 PolarHBondContact O-N 3.26Å; N107-E109 WeakPolarHBondContact OD1-CB 3.44Å; N107-E109 PolarHBondContact OD1-N 3.22Å; E109-E112 PolarHBondContact O-N 2.83Å; E109-G113 PolarHBondContact O-N 2.86Å
110	Q	98.3	Very high	96.9	Very high	36 Å²	36	58 Å²	58	17%	0.168	28%	0.278	C	S	.	.	H	α-helix	trans	-65.3	-41	176.4	-65.6	175.3	-58.7	0	0	111.9	E104 K106 N107 G113 L114 Y203	E104-Q110 PolarHBondContact OE1-NE2 3.41Å; K106-Q110 HydrophobicContact CB-CB 3.96Å; K106-Q110 HydrophobicContact CD-CB 4.45Å; K106-Q110 HydrophobicContact CG-CB 4.13Å; N107-Q110 PolarHBondContact ND2-OE1 3.16Å; N107-Q110 PolarHBondContact O-N 2.85Å; N107-Q110 WeakPolarHBondContact OD1-CG 3.39Å; N107-Q110 PolarHBondContact OD1-N 3.2Å; Q110-G113 PolarHBondContact O-N 2.8Å; Q110-L114 WeakPolarHBondContact O-CB 3.29Å; Q110-L114 PolarHBondContact O-N 3Å; Q110-Y203 WeakPolarHBondContact CA-OH 3.35Å; Q110-Y203 HydrophobicContact CB-CE1 4.07Å; Q110-Y203 HydrophobicContact CG-CE1 4.31Å; Q110-Y203 WeakPolarHBondContact CG-OH 3.41Å
111	I	98.6	Very high	97.6	Very high	26 Å²	26	56.5 Å²	56.5	13%	0.133	27%	0.269	C	S	.	.	H	α-helix	trans	-60.8	-45.4	175.2	-72.2	165	0	0	0	110.6	K106 N107 Q108 A115 L336	K106-I111 HydrophobicContact CB-CD1 4.41Å; K106-I111 HydrophobicContact CB-CG1 3.77Å; N107-I111 VanDerWaalsContact O-CG1 3.31Å; N107-I111 WeakPolarHBondContact O-CG1 3.28Å; N107-I111 PolarHBondContact O-N 3.12Å; Q108-I111 PolarHBondContact O-N 3.48Å; I111-A115 VanDerWaalsContact O-CB 3.22Å; I111-A115 WeakPolarHBondContact O-CB 3.44Å; I111-A115 PolarHBondContact O-N 3.42Å; I111-L336 HydrophobicContact CB-CD2 4.49Å; I111-L336 HydrophobicContact CD1-CD1 4.19Å; I111-L336 HydrophobicContact CD1-CD2 4.13Å; I111-L336 HydrophobicContact CG1-CD1 3.98Å; I111-L336 HydrophobicContact CG1-CD2 4.09Å; I111-L336 HydrophobicContact CG2-CD2 3.61Å
112	E	98.5	Very high	98	Very high	96 Å²	96	50 Å²	50	45%	0.449	23%	0.233	S	C	.	.	H	α-helix	trans	-66.2	-40.4	179.3	-74.2	171.6	-167.4	0	0	112.3	Q108 E109 A115 R116	Q108-E112 WeakPolarHBondContact CG-OE1 3.08Å; Q108-E112 PolarHBondContact NE2-OE1 2.85Å; Q108-E112 WeakPolarHBondContact O-CG 3.15Å; Q108-E112 PolarHBondContact O-N 2.92Å; E109-E112 PolarHBondContact O-N 2.83Å; E112-A115 PolarHBondContact O-N 2.92Å; E112-R116 WeakPolarHBondContact O-CG 3.36Å; E112-R116 PolarHBondContact O-N 2.88Å; E112-R116 VanDerWaalsContact O-N 3.11Å; E112-R116 PolarHBondContact O-NH1 3.14Å; E112-R116 VanDerWaalsContact O-NH1 3.16Å
113	G	98.5	Very high	98.3	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-52.1	174.1	0	0	0	0	0	112.3	E109 Q110 A115 R116 A117	E109-G113 PolarHBondContact O-N 2.86Å; Q110-G113 PolarHBondContact O-N 2.8Å; G113-A115 VanDerWaalsContact C-N 3.33Å; G113-A115 PolarHBondContact O-N 3.5Å; G113-R116 PolarHBondContact O-N 3.12Å; G113-A117 PolarHBondContact O-N 3.37Å
114	L	98.7	Very high	98.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.4	-44.1	176.1	176.6	60.1	0	0	0	111.7	K106 Q110 R116 A117 C118 Y203 H204 S297 T334 L345	K106-L114 HydrophobicContact CD-CD2 4.01Å; Q110-L114 WeakPolarHBondContact O-CB 3.29Å; Q110-L114 PolarHBondContact O-N 3Å; L114-R116 VanDerWaalsContact C-N 3.33Å; L114-R116 PolarHBondContact O-N 3.11Å; L114-A117 PolarHBondContact O-N 3.28Å; L114-C118 WeakPolarHBondContact O-CB 3.42Å; L114-C118 PolarHBondContact O-N 3.11Å; L114-C118 PolarHBondContact O-SG 3.41Å; L114-Y203 HydrophobicContact CB-CD1 4.25Å; L114-H204 WeakPolarHBondContact CD1-O 3.45Å; L114-S297 WeakPolarHBondContact CD2-OG 3.15Å; L114-T334 HydrophobicContact CD2-CG2 4.44Å; L114-L345 HydrophobicContact CD2-CD1 3.62Å; L114-L345 HydrophobicContact CG-CD1 3.71Å
115	A	98.7	Very high	98.5	Very high	22 Å²	22	42.5 Å²	42.5	18%	0.182	20%	0.202	C	C	.	.	H	α-helix	trans	-59.6	-42	178.7	0	0	0	0	0	111.7	I111 E112 G113 C118 Q119 L345	I111-A115 VanDerWaalsContact O-CB 3.22Å; I111-A115 WeakPolarHBondContact O-CB 3.44Å; I111-A115 PolarHBondContact O-N 3.42Å; E112-A115 PolarHBondContact O-N 2.92Å; G113-A115 VanDerWaalsContact C-N 3.33Å; G113-A115 PolarHBondContact O-N 3.5Å; A115-C118 PolarHBondContact O-N 3.36Å; A115-Q119 WeakPolarHBondContact O-CG 3.45Å; A115-Q119 PolarHBondContact O-N 2.86Å; A115-L345 HydrophobicContact CB-CD2 4.33Å
116	R	98.6	Very high	98.5	Very high	117 Å²	117	41.1 Å²	41.1	44%	0.442	20%	0.196	S	C	.	.	H	α-helix	trans	-62	-45.3	176.1	-70.6	-169.7	-55.9	-81.2	5.9	112.3	E112 G113 L114 C118 Q119 L120 L200 D201	E112-R116 WeakPolarHBondContact O-CG 3.36Å; E112-R116 PolarHBondContact O-N 2.88Å; E112-R116 VanDerWaalsContact O-N 3.11Å; E112-R116 PolarHBondContact O-NH1 3.14Å; E112-R116 VanDerWaalsContact O-NH1 3.16Å; G113-R116 PolarHBondContact O-N 3.12Å; L114-R116 VanDerWaalsContact C-N 3.33Å; L114-R116 PolarHBondContact O-N 3.11Å; R116-C118 VanDerWaalsContact C-N 3.35Å; R116-C118 PolarHBondContact O-N 3.4Å; R116-Q119 PolarHBondContact O-N 2.96Å; R116-L120 PolarHBondContact O-N 3.16Å; R116-L120 VanDerWaalsContact O-N 3.11Å; R116-L200 HydrophobicContact CB-CD2 4.36Å; R116-D201 IonicContact NE-OD2 2.66Å; R116-D201 IonicContact NH2-OD2 3.99Å
117	A	98.8	Very high	98.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.4	-43.9	176.8	0	0	0	0	0	111.5	G113 L114 L120 A121 V198 L200 Y203	G113-A117 PolarHBondContact O-N 3.37Å; L114-A117 PolarHBondContact O-N 3.28Å; A117-L120 PolarHBondContact O-N 3.36Å; A117-A121 PolarHBondContact O-N 3.38Å; A117-V198 VanDerWaalsContact O-CG2 3.24Å; A117-V198 WeakPolarHBondContact O-CG2 3.28Å; A117-L200 HydrophobicContact CB-CB 4.19Å; A117-Y203 WeakPolarHBondContact CB-O 3.08Å
118	C	98.9	Very high	98.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.1	-44.8	177.2	-71.3	0	0	0	0	112.9	L114 A115 R116 L120 A121 R122 L345 T346	L114-C118 WeakPolarHBondContact O-CB 3.42Å; L114-C118 PolarHBondContact O-N 3.11Å; L114-C118 PolarHBondContact O-SG 3.41Å; A115-C118 PolarHBondContact O-N 3.36Å; R116-C118 VanDerWaalsContact C-N 3.35Å; R116-C118 PolarHBondContact O-N 3.4Å; C118-L120 VanDerWaalsContact C-N 3.28Å; C118-L120 PolarHBondContact O-N 3.22Å; C118-A121 PolarHBondContact O-N 3.49Å; C118-R122 PolarHBondContact O-N 2.93Å; C118-L345 HydrophobicContact CB-CB 3.73Å; C118-L345 VanDerWaalsContact CB-O 3.31Å; C118-L345 WeakPolarHBondContact CB-O 3.47Å; C118-T346 HydrophobicContact CB-CG2 3.46Å; C118-T346 VanDerWaalsContact CB-CG2 3.46Å; C118-T346 WeakPolarHBondContact O-CG2 3.49Å
119	Q	98.7	Very high	98.6	Very high	57 Å²	57	34.6 Å²	34.6	27%	0.266	17%	0.168	S	C	.	.	H	α-helix	trans	-61.8	-39.2	177.2	-68	-67.4	-58.9	0	0	111.4	A115 R116 H123 L345 K347 L348	A115-Q119 WeakPolarHBondContact O-CG 3.45Å; A115-Q119 PolarHBondContact O-N 2.86Å; R116-Q119 PolarHBondContact O-N 2.96Å; Q119-H123 WeakPolarHBondContact O-CB 3.35Å; Q119-H123 PolarHBondContact O-N 3.01Å; Q119-L345 PolarHBondContact NE2-O 3.42Å; Q119-K347 PolarHBondContact NE2-O 2.85Å; Q119-L348 HydrophobicContact CB-CD2 4.43Å; Q119-L348 WeakPolarHBondContact O-CD2 3.41Å; Q119-L348 VanDerWaalsContact OE1-CD2 3.27Å
120	L	98.8	Very high	98.6	Very high	13 Å²	13	31.1 Å²	31.1	7%	0.068	17%	0.171	C	C	.	.	H	α-helix	trans	-66	-46	174.2	177.3	60	0	0	0	112	R116 A117 C118 R122 H123 V124 H152 A154 V198 L200	R116-L120 PolarHBondContact O-N 3.16Å; R116-L120 VanDerWaalsContact O-N 3.11Å; A117-L120 PolarHBondContact O-N 3.36Å; C118-L120 VanDerWaalsContact C-N 3.28Å; C118-L120 PolarHBondContact O-N 3.22Å; L120-R122 VanDerWaalsContact C-N 3.29Å; L120-R122 PolarHBondContact O-N 2.97Å; L120-H123 WeakPolarHBondContact O-CB 3.32Å; L120-H123 PolarHBondContact O-N 2.99Å; L120-V124 HydrophobicContact CD1-CG2 3.98Å; L120-V124 HydrophobicContact CG-CG2 4.37Å; L120-V124 WeakPolarHBondContact O-CG2 3.14Å; L120-V124 PolarHBondContact O-N 2.98Å; L120-H152 HydrophobicContact CD1-CB 3.64Å; L120-H152 VanDerWaalsContact CD1-CD2 3.48Å; L120-H152 WeakPolarHBondContact CD1-CD2 3.41Å; L120-H152 VanDerWaalsContact CD1-CG 3.46Å; L120-H152 HydrophobicContact CD2-CB 3.73Å; L120-H152 HydrophobicContact CG-CB 4.36Å; L120-A154 HydrophobicContact CD2-CB 3.43Å; L120-A154 VanDerWaalsContact CD2-CB 3.43Å; L120-V198 HydrophobicContact CB-CG2 4.14Å; L120-V198 HydrophobicContact CD2-CG2 4.06Å; L120-V198 HydrophobicContact CG-CG2 4.06Å; L120-L200 HydrophobicContact CD2-CD2 4.02Å
121	A	98.9	Very high	98.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-55.5	-46.4	176.8	0	0	0	0	0	111.3	A117 C118 V124 L125 V196 V198 G205 T207	A117-A121 PolarHBondContact O-N 3.38Å; C118-A121 PolarHBondContact O-N 3.49Å; A121-V124 PolarHBondContact O-N 3.34Å; A121-L125 WeakPolarHBondContact O-CB 3.37Å; A121-L125 PolarHBondContact O-N 2.77Å; A121-V196 HydrophobicContact CB-CG1 4.49Å; A121-V198 HydrophobicContact CB-CG1 4.38Å; A121-V198 HydrophobicContact CB-CG2 4.01Å; A121-G205 VanDerWaalsContact CB-O 3.29Å; A121-G205 WeakPolarHBondContact CB-O 3.48Å; A121-T207 HydrophobicContact CB-CG2 4.07Å
122	R	98.8	Very high	98.5	Very high	8 Å²	8	31.2 Å²	31.2	3%	0.03	18%	0.176	C	C	.	.	H	α-helix	trans	-62.5	-44.3	177	-175.2	59.4	170.3	178.3	7.9	112.6	C118 L120 V124 L125 L126 T207 E209 T346 L348 E351	C118-R122 PolarHBondContact O-N 2.93Å; L120-R122 VanDerWaalsContact C-N 3.29Å; L120-R122 PolarHBondContact O-N 2.97Å; R122-V124 PolarHBondContact O-N 3.31Å; R122-L125 PolarHBondContact O-N 2.96Å; R122-L126 HydrophobicContact CG-CD1 4.2Å; R122-L126 HydrophobicContact CG-CG 4.46Å; R122-L126 WeakPolarHBondContact O-CG 3.45Å; R122-L126 PolarHBondContact O-N 2.96Å; R122-T207 HydrophobicContact CB-CG2 4.43Å; R122-E209 IonicContact CZ-OE1 3.49Å; R122-E209 IonicContact NH1-OE1 3.78Å; R122-E209 PolarHBondContact NH1-OE1 3.16Å; R122-E209 IonicContact NH2-OE1 3.22Å; R122-E209 PolarHBondContact NH2-OE1 3.25Å; R122-T346 WeakPolarHBondContact CD-O 3.31Å; R122-T346 WeakPolarHBondContact CG-O 3.17Å; R122-T346 PolarHBondContact NE-O 2.92Å; R122-L348 HydrophobicContact CB-CD2 4.02Å; R122-L348 HydrophobicContact CB-CG 4.26Å; R122-L348 HydrophobicContact CG-CD1 4.36Å; R122-L348 HydrophobicContact CG-CD2 4.01Å; R122-L348 HydrophobicContact CG-CG 3.68Å; R122-E351 IonicContact CZ-OE1 3.89Å; R122-E351 IonicContact CZ-OE2 3.91Å; R122-E351 IonicContact NE-OE1 3.27Å; R122-E351 PolarHBondContact NE-OE1 3.29Å; R122-E351 IonicContact NE-OE2 3.82Å; R122-E351 PolarHBondContact NE-OE2 3.35Å; R122-E351 IonicContact NH2-OE1 2.74Å; R122-E351 PolarHBondContact NH2-OE1 3.19Å; R122-E351 IonicContact NH2-OE2 2.77Å
123	H	98.7	Very high	98.5	Very high	65 Å²	65	33.2 Å²	33.2	30%	0.301	18%	0.183	S	C	.	.	H	α-helix	trans	-57.7	-47.1	175.1	170.2	78.5	0	0	0	111.8	Q119 L120 L126 L127 E148 H152	Q119-H123 WeakPolarHBondContact O-CB 3.35Å; Q119-H123 PolarHBondContact O-N 3.01Å; L120-H123 WeakPolarHBondContact O-CB 3.32Å; L120-H123 PolarHBondContact O-N 2.99Å; H123-L126 PolarHBondContact O-N 3.18Å; H123-L127 VanDerWaalsContact O-CB 3.32Å; H123-L127 WeakPolarHBondContact O-CB 3.38Å; H123-L127 PolarHBondContact O-N 3.2Å; H123-E148 IonicContact CD2-OE1 2.92Å; H123-E148 IonicContact CE1-OE1 3.84Å; H123-E148 IonicContact NE2-OE1 3.78Å; H123-E148 PolarHBondContact NE2-OE1 3.22Å; H123-H152 AromaticContact CD2-NE2 3.86Å; H123-H152 AromaticContact NE2-NE2 3.75Å
124	V	98.9	Very high	98.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.1	-43.9	178.8	173.9	0	0	0	0	111.2	L120 A121 R122 L127 A128 V145 E148 V196	L120-V124 HydrophobicContact CD1-CG2 3.98Å; L120-V124 HydrophobicContact CG-CG2 4.37Å; L120-V124 WeakPolarHBondContact O-CG2 3.14Å; L120-V124 PolarHBondContact O-N 2.98Å; A121-V124 PolarHBondContact O-N 3.34Å; R122-V124 PolarHBondContact O-N 3.31Å; V124-L127 PolarHBondContact O-N 3.41Å; V124-A128 WeakPolarHBondContact O-CB 3.48Å; V124-A128 PolarHBondContact O-N 3.11Å; V124-V145 HydrophobicContact CG1-CB 4.14Å; V124-V145 HydrophobicContact CG1-CG1 3.75Å; V124-V145 HydrophobicContact CG1-CG2 4.14Å; V124-E148 HydrophobicContact CG2-CB 4.29Å; V124-E148 HydrophobicContact CG2-CG 3.97Å; V124-V196 HydrophobicContact CB-CG1 4.05Å; V124-V196 HydrophobicContact CG1-CG1 3.83Å
125	L	98.8	Very high	98.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60	-49.4	176.8	175.7	60.6	0	0	0	112	A121 R122 L127 A128 G129 V194 V196 T207 E209 F211	A121-L125 WeakPolarHBondContact O-CB 3.37Å; A121-L125 PolarHBondContact O-N 2.77Å; R122-L125 PolarHBondContact O-N 2.96Å; L125-L127 VanDerWaalsContact C-N 3.33Å; L125-L127 PolarHBondContact O-N 3.5Å; L125-A128 PolarHBondContact O-N 3.23Å; L125-G129 PolarHBondContact O-N 3.38Å; L125-V194 HydrophobicContact CD1-CB 3.96Å; L125-V194 HydrophobicContact CD1-CG1 4.07Å; L125-V194 VanDerWaalsContact CD1-O 3.23Å; L125-V194 WeakPolarHBondContact CD1-O 3.34Å; L125-V196 HydrophobicContact CB-CB 4.26Å; L125-V196 HydrophobicContact CB-CG2 4.07Å; L125-V196 HydrophobicContact CD1-CG2 4.03Å; L125-T207 HydrophobicContact CB-CG2 4.31Å; L125-T207 HydrophobicContact CD2-CG2 3.77Å; L125-E209 HydrophobicContact CD2-CB 4.33Å; L125-E209 HydrophobicContact CD2-CG 4.05Å; L125-F211 HydrophobicContact CD1-CE2 4Å; L125-F211 HydrophobicContact CD1-CZ 4.13Å; L125-F211 HydrophobicContact CG-CZ 4.5Å
126	L	98.4	Very high	98.5	Very high	57 Å²	57	38 Å²	38	30%	0.298	22%	0.215	S	C	.	.	H	α-helix	trans	-65.9	-36.7	-179.4	-67.8	179.6	0	0	0	112.1	R122 H123 G130 L348	R122-L126 HydrophobicContact CG-CD1 4.2Å; R122-L126 HydrophobicContact CG-CG 4.46Å; R122-L126 WeakPolarHBondContact O-CG 3.45Å; R122-L126 PolarHBondContact O-N 2.96Å; H123-L126 PolarHBondContact O-N 3.18Å; L126-G130 PolarHBondContact O-N 3.17Å; L126-L348 HydrophobicContact CD1-CD1 3.77Å; L126-L348 HydrophobicContact CD1-CG 4.41Å
127	L	98.4	Very high	98.5	Very high	69 Å²	69	33.1 Å²	33.1	36%	0.361	20%	0.199	S	C	.	.	H	α-helix	trans	-64.4	-45.1	174.7	-179.6	136.2	0	0	0	111.7	H123 V124 L125 I144 E148	H123-L127 VanDerWaalsContact O-CB 3.32Å; H123-L127 WeakPolarHBondContact O-CB 3.38Å; H123-L127 PolarHBondContact O-N 3.2Å; V124-L127 PolarHBondContact O-N 3.41Å; L125-L127 VanDerWaalsContact C-N 3.33Å; L125-L127 PolarHBondContact O-N 3.5Å; L127-I144 HydrophobicContact CD2-CG2 3.38Å; L127-E148 HydrophobicContact CD1-CG 4.34Å; L127-E148 HydrophobicContact CD2-CB 4.15Å; L127-E148 HydrophobicContact CD2-CG 4.21Å
128	A	98.3	Very high	98.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.8	-47.6	175.2	0	0	0	0	0	111.3	V124 L125 G130 S131 I141 I144 V145	V124-A128 WeakPolarHBondContact O-CB 3.48Å; V124-A128 PolarHBondContact O-N 3.11Å; L125-A128 PolarHBondContact O-N 3.23Å; A128-G130 VanDerWaalsContact C-N 3.35Å; A128-G130 PolarHBondContact O-N 2.95Å; A128-S131 WeakPolarHBondContact O-CB 3.22Å; A128-S131 PolarHBondContact O-N 3.02Å; A128-S131 PolarHBondContact O-OG 3.37Å; A128-I141 HydrophobicContact CB-CG2 4.35Å; A128-I144 HydrophobicContact CB-CG2 4.4Å; A128-V145 HydrophobicContact CB-CG2 3.66Å
129	G	97.9	Very high	98.5	Very high	11 Å²	11	33.4 Å²	33.4	11%	0.113	20%	0.201	C	C	.	.	H	α-helix	trans	-55.8	-44.1	177.9	0	0	0	0	0	113.2	L125 S131 L132	L125-G129 PolarHBondContact O-N 3.38Å; G129-S131 PolarHBondContact O-N 3.33Å; G129-L132 WeakPolarHBondContact O-CB 3.19Å; G129-L132 WeakPolarHBondContact O-CG 3.4Å; G129-L132 PolarHBondContact O-N 3.14Å
130	G	97.9	Very high	98.5	Very high	75 Å²	75	35.1 Å²	35.1	77%	0.773	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-13.7	177.1	0	0	0	0	0	114.9	L126 A128	L126-G130 PolarHBondContact O-N 3.17Å; A128-G130 VanDerWaalsContact C-N 3.35Å; A128-G130 PolarHBondContact O-N 2.95Å
131	S	97.8	Very high	98.5	Very high	36 Å²	36	34.5 Å²	34.5	25%	0.252	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-13.4	178.3	78.2	0	0	0	0	114.1	A128 G129 K133 I144	A128-S131 WeakPolarHBondContact O-CB 3.22Å; A128-S131 PolarHBondContact O-N 3.02Å; A128-S131 PolarHBondContact O-OG 3.37Å; G129-S131 PolarHBondContact O-N 3.33Å; S131-K133 PolarHBondContact O-N 3.43Å; S131-I144 WeakPolarHBondContact OG-CD1 3.45Å
132	L	98.6	Very high	98.5	Very high	28 Å²	28	34.5 Å²	34.5	15%	0.147	21%	0.205	C	C	.	.			trans	-63.2	133.4	-173.1	-60.9	179.8	0	0	0	111.6	G129 I141 L186 I192 V194 F211 I213	G129-L132 WeakPolarHBondContact O-CB 3.19Å; G129-L132 WeakPolarHBondContact O-CG 3.4Å; G129-L132 PolarHBondContact O-N 3.14Å; L132-I141 HydrophobicContact CD2-CD1 3.38Å; L132-I141 HydrophobicContact CD2-CG1 3.67Å; L132-I141 HydrophobicContact CD2-CG2 4.31Å; L132-L186 HydrophobicContact CD2-CD1 4.32Å; L132-I192 HydrophobicContact CD1-CG2 4.03Å; L132-V194 HydrophobicContact CD1-CG2 4.29Å; L132-F211 HydrophobicContact CD1-CB 3.56Å; L132-F211 HydrophobicContact CD1-CD1 4.19Å; L132-F211 HydrophobicContact CD1-CD2 3.49Å; L132-F211 VanDerWaalsContact CD1-CD2 3.49Å; L132-F211 HydrophobicContact CD1-CE2 4.24Å; L132-F211 HydrophobicContact CD1-CG 3.47Å; L132-F211 VanDerWaalsContact CD1-CG 3.47Å; L132-I213 HydrophobicContact CB-CD1 3.83Å; L132-I213 HydrophobicContact CD1-CD1 4.35Å
133	K	98.3	Very high	98.5	Very high	138 Å²	138	38.6 Å²	38.6	60%	0.6	22%	0.224	S	C	*	.			trans	-158.5	157.8	179.9	62.5	-169.9	175.7	-168.8	0	111.8	S131 G135 M136	S131-K133 PolarHBondContact O-N 3.43Å; K133-G135 PolarHBondContact O-N 2.84Å; K133-M136 HydrophobicContact CG-CB 4.1Å; K133-M136 VanDerWaalsContact O-CB 3.26Å; K133-M136 WeakPolarHBondContact O-CB 3.44Å; K133-M136 PolarHBondContact O-N 3.34Å
134	V	98.6	Very high	98.5	Very high	78 Å²	78	37.6 Å²	37.6	47%	0.473	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	133.5	172	178.5	0	0	0	0	110.2	M136 D188 I213	V134-M136 VanDerWaalsContact C-N 3.34Å; V134-D188 HydrophobicContact CG2-CB 4.11Å; V134-I213 HydrophobicContact CG2-CG2 3.71Å
135	G	98.4	Very high	98.5	Very high	33 Å²	33	37.6 Å²	37.6	34%	0.34	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	-10.9	178.1	0	0	0	0	0	115.4	K133 K185 L186	K133-G135 PolarHBondContact O-N 2.84Å; G135-K185 WeakPolarHBondContact O-CD 3.31Å; G135-K185 WeakPolarHBondContact O-CG 3.3Å; G135-L186 PolarHBondContact N-O 2.75Å
136	M	98.6	Very high	98.5	Very high	12 Å²	12	37.7 Å²	37.7	6%	0.059	22%	0.22	C	C	.	.			trans	-72.3	139.8	173	-171.6	174.9	178.3	0	0	110.2	K133 V134 E140 I141 I144 K185 L186	K133-M136 HydrophobicContact CG-CB 4.1Å; K133-M136 VanDerWaalsContact O-CB 3.26Å; K133-M136 WeakPolarHBondContact O-CB 3.44Å; K133-M136 PolarHBondContact O-N 3.34Å; V134-M136 VanDerWaalsContact C-N 3.34Å; M136-E140 WeakPolarHBondContact CA-OE2 3.44Å; M136-E140 HydrophobicContact CE-CB 3.85Å; M136-E140 HydrophobicContact CG-CB 4Å; M136-E140 WeakPolarHBondContact CG-OE2 3.49Å; M136-I141 HydrophobicContact CE-CB 4.43Å; M136-I141 HydrophobicContact CE-CG1 3.71Å; M136-I141 HydrophobicContact SD-CG1 4.22Å; M136-I144 HydrophobicContact CE-CD1 3.5Å; M136-I144 VanDerWaalsContact CE-CD1 3.5Å; M136-K185 CarbonylContact O-C 3.53Å; M136-K185 WeakPolarHBondContact O-CA 3.44Å; M136-L186 WeakPolarHBondContact O-CG 3.45Å; M136-L186 PolarHBondContact O-N 3.49Å
137	T	98.8	Very high	98.6	Very high	16 Å²	16	39 Å²	39	10%	0.098	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-86.5	153.7	175.3	63.9	0	0	0	0	112.4	D139 E140 I141 S183 R184 K185	T137-D139 PolarHBondContact O-N 2.99Å; T137-E140 PolarHBondContact N-OE2 3.1Å; T137-E140 WeakPolarHBondContact O-CB 3.44Å; T137-E140 PolarHBondContact O-N 3.48Å; T137-E140 VanDerWaalsContact O-N 3.09Å; T137-E140 VanDerWaalsContact OG1-CG 3.25Å; T137-E140 WeakPolarHBondContact OG1-CG 3.33Å; T137-E140 PolarHBondContact OG1-N 2.94Å; T137-E140 PolarHBondContact OG1-OE2 3.39Å; T137-I141 PolarHBondContact O-N 3.4Å; T137-S183 WeakPolarHBondContact CG2-O 3.31Å; T137-R184 WeakPolarHBondContact CA-O 3.24Å; T137-K185 HydrophobicContact CG2-CG 3.71Å
138	T	98.7	Very high	98.6	Very high	4 Å²	4	36.5 Å²	36.5	3%	0.025	21%	0.212	C	C	.	.	H	α-helix	trans	-62	-32	172.3	44.5	0	0	0	0	112.9	E140 I141 D142 T170 V172 D182 R184 I192	T138-E140 VanDerWaalsContact C-N 3.3Å; T138-E140 PolarHBondContact O-N 2.95Å; T138-I141 HydrophobicContact CG2-CD1 4.32Å; T138-I141 WeakPolarHBondContact O-CB 3.41Å; T138-I141 PolarHBondContact O-N 3.06Å; T138-I141 VanDerWaalsContact O-N 3.1Å; T138-D142 PolarHBondContact O-N 3.27Å; T138-T170 WeakPolarHBondContact CB-OG1 3.33Å; T138-T170 HydrophobicContact CG2-CG2 4.29Å; T138-T170 WeakPolarHBondContact CG2-OG1 3.29Å; T138-V172 HydrophobicContact CG2-CG2 4.22Å; T138-D182 PolarHBondContact N-O 3.24Å; T138-D182 PolarHBondContact OG1-N 2.9Å; T138-D182 PolarHBondContact OG1-O 2.82Å; T138-D182 PolarHBondContact OG1-OD1 3.03Å; T138-R184 PolarHBondContact N-O 3.2Å; T138-I192 HydrophobicContact CG2-CD1 4.05Å
139	D	98.8	Very high	98.6	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.011	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-28.9	172.6	-172.5	70.2	0	0	0	113.5	R76 Y79 T137 F143 K166 D182	R76-D139 WeakPolarHBondContact CD-OD2 3.33Å; R76-D139 IonicContact CZ-OD2 3.96Å; R76-D139 IonicContact NE-OD2 3.94Å; R76-D139 IonicContact NH1-OD2 3.56Å; R76-D139 PolarHBondContact NH1-OD2 3.3Å; Y79-D139 PolarHBondContact OH-O 3.35Å; T137-D139 PolarHBondContact O-N 2.99Å; D139-F143 PolarHBondContact O-N 3.49Å; D139-K166 IonicContact OD1-NZ 3.02Å; D139-K166 PolarHBondContact OD1-NZ 2.96Å; D139-D182 WeakPolarHBondContact CB-O 3.05Å; D139-D182 PolarHBondContact N-O 2.95Å
140	E	98.8	Very high	98.6	Very high	92 Å²	92	37 Å²	37	43%	0.43	21%	0.212	S	C	.	.	H	α-helix	trans	-72.9	-31.9	171.9	-73.4	165.4	148.9	0	0	111.7	M136 T137 T138 F143 I144	M136-E140 WeakPolarHBondContact CA-OE2 3.44Å; M136-E140 HydrophobicContact CE-CB 3.85Å; M136-E140 HydrophobicContact CG-CB 4Å; M136-E140 WeakPolarHBondContact CG-OE2 3.49Å; T137-E140 PolarHBondContact N-OE2 3.1Å; T137-E140 WeakPolarHBondContact O-CB 3.44Å; T137-E140 PolarHBondContact O-N 3.48Å; T137-E140 VanDerWaalsContact O-N 3.09Å; T137-E140 VanDerWaalsContact OG1-CG 3.25Å; T137-E140 WeakPolarHBondContact OG1-CG 3.33Å; T137-E140 PolarHBondContact OG1-N 2.94Å; T137-E140 PolarHBondContact OG1-OE2 3.39Å; T138-E140 VanDerWaalsContact C-N 3.3Å; T138-E140 PolarHBondContact O-N 2.95Å; E140-F143 WeakPolarHBondContact O-CB 3.41Å; E140-F143 PolarHBondContact O-N 3.45Å; E140-I144 WeakPolarHBondContact O-CG1 3.42Å; E140-I144 PolarHBondContact O-N 3.16Å; E140-I144 VanDerWaalsContact O-N 3.17Å
141	I	98.8	Very high	98.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-67.8	-46.8	174	-53.6	169.4	0	0	0	109.4	A128 L132 M136 T137 T138 F143 I144 V145 T170 L186 I192 V194	A128-I141 HydrophobicContact CB-CG2 4.35Å; L132-I141 HydrophobicContact CD2-CD1 3.38Å; L132-I141 HydrophobicContact CD2-CG1 3.67Å; L132-I141 HydrophobicContact CD2-CG2 4.31Å; M136-I141 HydrophobicContact CE-CB 4.43Å; M136-I141 HydrophobicContact CE-CG1 3.71Å; M136-I141 HydrophobicContact SD-CG1 4.22Å; T137-I141 PolarHBondContact O-N 3.4Å; T138-I141 HydrophobicContact CG2-CD1 4.32Å; T138-I141 WeakPolarHBondContact O-CB 3.41Å; T138-I141 PolarHBondContact O-N 3.06Å; T138-I141 VanDerWaalsContact O-N 3.1Å; I141-F143 VanDerWaalsContact C-N 3.27Å; I141-F143 PolarHBondContact O-N 3.43Å; I141-I144 PolarHBondContact O-N 3.45Å; I141-I144 VanDerWaalsContact O-N 3.09Å; I141-V145 HydrophobicContact CG2-CG2 4.5Å; I141-V145 PolarHBondContact O-N 3.19Å; I141-T170 HydrophobicContact CB-CG2 4.35Å; I141-T170 HydrophobicContact CD1-CG2 4.34Å; I141-T170 HydrophobicContact CG2-CG2 4.24Å; I141-L186 HydrophobicContact CD1-CD1 4.19Å; I141-I192 HydrophobicContact CD1-CD1 3.64Å; I141-V194 HydrophobicContact CG2-CG1 4.19Å; I141-V194 HydrophobicContact CG2-CG2 4.35Å
142	D	98.9	Very high	98.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-55.4	-41.4	173.1	172.2	62.4	0	0	0	112.2	Y79 T138 I144 V145 H146 K166 S167 V168 P181	Y79-D142 WeakPolarHBondContact CE2-OD2 3.34Å; T138-D142 PolarHBondContact O-N 3.27Å; D142-I144 PolarHBondContact O-N 3.42Å; D142-V145 PolarHBondContact O-N 3.43Å; D142-H146 WeakPolarHBondContact O-CB 3.15Å; D142-H146 PolarHBondContact O-N 3.37Å; D142-K166 WeakPolarHBondContact OD2-CD 3.49Å; D142-K166 IonicContact OD2-NZ 3.48Å; D142-K166 PolarHBondContact OD2-NZ 2.95Å; D142-S167 WeakPolarHBondContact OD1-CA 3.37Å; D142-S167 WeakPolarHBondContact OD1-CB 3.24Å; D142-S167 PolarHBondContact OD1-N 3.26Å; D142-S167 PolarHBondContact OD1-OG 3.4Å; D142-S167 VanDerWaalsContact OD1-OG 3.12Å; D142-V168 HydrophobicContact CB-CG1 3.79Å; D142-P181 HydrophobicContact CB-CB 3.59Å; D142-P181 HydrophobicContact CB-CG 3.81Å
143	F	98.8	Very high	98.7	Very high	95 Å²	95	46.7 Å²	46.7	42%	0.417	23%	0.227	S	C	.	.	H	α-helix	trans	-59.6	-47	174.5	179.2	-102.4	0	0	0	112.3	Y79 D139 E140 I141 H146 Q147	Y79-F143 HydrophobicContact CD1-CD2 4.24Å; Y79-F143 AromaticContact CE1-CD2 3.75Å; Y79-F143 HydrophobicContact CE1-CD2 3.75Å; Y79-F143 HydrophobicContact CE1-CE2 4.48Å; Y79-F143 HydrophobicContact CE2-CB 3.82Å; Y79-F143 HydrophobicContact CE2-CD2 4.08Å; Y79-F143 HydrophobicContact CE2-CG 4.47Å; Y79-F143 AromaticContact CZ-CD2 3.68Å; D139-F143 PolarHBondContact O-N 3.49Å; E140-F143 WeakPolarHBondContact O-CB 3.41Å; E140-F143 PolarHBondContact O-N 3.45Å; I141-F143 VanDerWaalsContact C-N 3.27Å; I141-F143 PolarHBondContact O-N 3.43Å; F143-H146 PolarHBondContact O-N 3.18Å; F143-Q147 HydrophobicContact CD1-CG 4.26Å; F143-Q147 HydrophobicContact CD2-CG 4.02Å; F143-Q147 HydrophobicContact CE1-CG 3.87Å; F143-Q147 HydrophobicContact CE2-CG 3.61Å; F143-Q147 HydrophobicContact CG-CG 4.34Å; F143-Q147 HydrophobicContact CZ-CG 3.53Å; F143-Q147 WeakPolarHBondContact O-CB 3.44Å; F143-Q147 VanDerWaalsContact O-CG 3.26Å; F143-Q147 WeakPolarHBondContact O-CG 3.36Å; F143-Q147 PolarHBondContact O-N 3.05Å
144	I	98.8	Very high	98.7	Very high	43 Å²	43	40.1 Å²	40.1	22%	0.221	20%	0.199	C	C	.	.	H	α-helix	trans	-62.8	-48.9	-180	-69	172.1	0	0	0	110.8	L127 A128 S131 M136 E140 I141 D142 H146 Q147 E148	L127-I144 HydrophobicContact CD2-CG2 3.38Å; A128-I144 HydrophobicContact CB-CG2 4.4Å; S131-I144 WeakPolarHBondContact OG-CD1 3.45Å; M136-I144 HydrophobicContact CE-CD1 3.5Å; M136-I144 VanDerWaalsContact CE-CD1 3.5Å; E140-I144 WeakPolarHBondContact O-CG1 3.42Å; E140-I144 PolarHBondContact O-N 3.16Å; E140-I144 VanDerWaalsContact O-N 3.17Å; I141-I144 PolarHBondContact O-N 3.45Å; I141-I144 VanDerWaalsContact O-N 3.09Å; D142-I144 PolarHBondContact O-N 3.42Å; I144-H146 VanDerWaalsContact C-N 3.35Å; I144-H146 PolarHBondContact O-N 3Å; I144-Q147 PolarHBondContact O-N 3.29Å; I144-E148 PolarHBondContact O-N 3.05Å
145	V	98.9	Very high	98.8	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-60.3	-46.5	179	170	0	0	0	0	110.7	V124 A128 I141 D142 T149 V168 V196	V124-V145 HydrophobicContact CG1-CB 4.14Å; V124-V145 HydrophobicContact CG1-CG1 3.75Å; V124-V145 HydrophobicContact CG1-CG2 4.14Å; A128-V145 HydrophobicContact CB-CG2 3.66Å; I141-V145 HydrophobicContact CG2-CG2 4.5Å; I141-V145 PolarHBondContact O-N 3.19Å; D142-V145 PolarHBondContact O-N 3.43Å; V145-T149 VanDerWaalsContact O-CB 3.31Å; V145-T149 WeakPolarHBondContact O-CB 3.35Å; V145-T149 PolarHBondContact O-N 2.8Å; V145-T149 PolarHBondContact O-OG1 3.02Å; V145-V168 HydrophobicContact CB-CB 4.21Å; V145-V168 HydrophobicContact CB-CG1 4.25Å; V145-V168 HydrophobicContact CG1-CB 3.87Å; V145-V168 HydrophobicContact CG1-CG1 4.42Å; V145-V168 HydrophobicContact CG1-CG2 4.26Å; V145-V168 HydrophobicContact CG2-CB 4.34Å; V145-V168 HydrophobicContact CG2-CG1 4.39Å; V145-V168 HydrophobicContact CG2-CG2 4.14Å; V145-V196 HydrophobicContact CG1-CG1 4.39Å; V145-V196 HydrophobicContact CG1-CG2 4.31Å; V145-V196 HydrophobicContact CG2-CG2 4.24Å
146	H	98.9	Very high	98.8	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-58.9	-54.9	177.1	-172.8	95.2	0	0	0	110.9	Y79 A80 D142 F143 I144 E148 T149 I150 S167	Y79-H146 WeakPolarHBondContact CB-NE2 3.37Å; Y79-H146 HydrophobicContact CD2-CB 4.07Å; Y79-H146 PolarHBondContact O-CE1 3.03Å; A80-H146 PolarHBondContact O-NE2 3.39Å; D142-H146 WeakPolarHBondContact O-CB 3.15Å; D142-H146 PolarHBondContact O-N 3.37Å; F143-H146 PolarHBondContact O-N 3.18Å; I144-H146 VanDerWaalsContact C-N 3.35Å; I144-H146 PolarHBondContact O-N 3Å; H146-E148 PolarHBondContact O-N 3.26Å; H146-T149 PolarHBondContact O-N 2.93Å; H146-I150 VanDerWaalsContact O-CG1 3.27Å; H146-I150 WeakPolarHBondContact O-CG1 3.28Å; H146-I150 PolarHBondContact O-N 3.3Å; H146-S167 PolarHBondContact ND1-OG 2.82Å
147	Q	98.8	Very high	98.8	Very high	86 Å²	86	34.6 Å²	34.6	40%	0.402	16%	0.159	S	C	.	.	H	α-helix	trans	-61.1	-43.4	-176	-70.5	-55.4	-55.9	0	0	112.4	F143 I144 I150 R151	F143-Q147 HydrophobicContact CD1-CG 4.26Å; F143-Q147 HydrophobicContact CD2-CG 4.02Å; F143-Q147 HydrophobicContact CE1-CG 3.87Å; F143-Q147 HydrophobicContact CE2-CG 3.61Å; F143-Q147 HydrophobicContact CG-CG 4.34Å; F143-Q147 HydrophobicContact CZ-CG 3.53Å; F143-Q147 WeakPolarHBondContact O-CB 3.44Å; F143-Q147 VanDerWaalsContact O-CG 3.26Å; F143-Q147 WeakPolarHBondContact O-CG 3.36Å; F143-Q147 PolarHBondContact O-N 3.05Å; I144-Q147 PolarHBondContact O-N 3.29Å; Q147-I150 PolarHBondContact O-N 3.19Å; Q147-R151 WeakPolarHBondContact O-CB 3.42Å; Q147-R151 PolarHBondContact O-N 2.92Å
148	E	98.8	Very high	98.8	Very high	16 Å²	16	34.2 Å²	34.2	8%	0.075	16%	0.156	C	C	.	.	H	α-helix	trans	-67.3	-41.1	179.1	-170	63.4	-174.7	0	0	110.9	H123 V124 L127 I144 H146 I150 R151 H152	H123-E148 IonicContact CD2-OE1 2.92Å; H123-E148 IonicContact CE1-OE1 3.84Å; H123-E148 IonicContact NE2-OE1 3.78Å; H123-E148 PolarHBondContact NE2-OE1 3.22Å; V124-E148 HydrophobicContact CG2-CB 4.29Å; V124-E148 HydrophobicContact CG2-CG 3.97Å; L127-E148 HydrophobicContact CD1-CG 4.34Å; L127-E148 HydrophobicContact CD2-CB 4.15Å; L127-E148 HydrophobicContact CD2-CG 4.21Å; I144-E148 PolarHBondContact O-N 3.05Å; H146-E148 PolarHBondContact O-N 3.26Å; E148-I150 PolarHBondContact O-N 3.2Å; E148-R151 WeakPolarHBondContact O-CB 3.32Å; E148-R151 PolarHBondContact O-N 3.25Å; E148-R151 VanDerWaalsContact O-N 3.12Å; E148-R151 IonicContact OE1-CZ 2.68Å; E148-R151 IonicContact OE1-NE 2.96Å; E148-R151 IonicContact OE1-NH2 3.82Å; E148-R151 PolarHBondContact OE1-NH2 3.17Å; E148-R151 IonicContact OE2-CZ 3.14Å; E148-R151 IonicContact OE2-NE 3.85Å; E148-R151 PolarHBondContact OE2-NE 3.35Å; E148-R151 IonicContact OE2-NH2 2.7Å; E148-R151 PolarHBondContact OE2-NH2 3.26Å; E148-H152 PolarHBondContact O-CD2 2.94Å; E148-H152 PolarHBondContact O-N 3.21Å; E148-H152 IonicContact OE1-CD2 2.67Å; E148-H152 IonicContact OE1-NE2 3.38Å; E148-H152 PolarHBondContact OE1-NE2 3.31Å
149	T	98.9	Very high	98.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-57.8	-47.6	175.1	-55.9	0	0	0	0	111.8	V145 H146 R151 H152 A154 P156 V198	V145-T149 VanDerWaalsContact O-CB 3.31Å; V145-T149 WeakPolarHBondContact O-CB 3.35Å; V145-T149 PolarHBondContact O-N 2.8Å; V145-T149 PolarHBondContact O-OG1 3.02Å; H146-T149 PolarHBondContact O-N 2.93Å; T149-R151 VanDerWaalsContact C-N 3.3Å; T149-R151 PolarHBondContact O-N 3.38Å; T149-H152 PolarHBondContact O-N 3.02Å; T149-A154 HydrophobicContact CG2-CB 3.79Å; T149-A154 PolarHBondContact O-N 3.39Å; T149-A154 VanDerWaalsContact O-N 3.16Å; T149-P156 HydrophobicContact CG2-CB 4.26Å; T149-V198 HydrophobicContact CG2-CB 4.22Å; T149-V198 HydrophobicContact CG2-CG1 3.86Å
150	I	98.8	Very high	98.6	Very high	22 Å²	22	36 Å²	36	11%	0.113	17%	0.173	C	C	.	.	H	α-helix	trans	-62.3	-37.2	176.7	-63.6	-48.1	0	0	0	111.8	V81 P82 I85 H146 Q147 E148 H152 N153	V81-I150 HydrophobicContact CB-CD1 4.34Å; V81-I150 HydrophobicContact CG1-CD1 3.86Å; V81-I150 HydrophobicContact CG2-CD1 4.16Å; P82-I150 HydrophobicContact CG-CG2 3.71Å; I85-I150 HydrophobicContact CD1-CB 4.25Å; I85-I150 HydrophobicContact CD1-CD1 3.55Å; I85-I150 HydrophobicContact CD1-CG1 4.42Å; I85-I150 HydrophobicContact CD1-CG2 3.83Å; H146-I150 VanDerWaalsContact O-CG1 3.27Å; H146-I150 WeakPolarHBondContact O-CG1 3.28Å; H146-I150 PolarHBondContact O-N 3.3Å; Q147-I150 PolarHBondContact O-N 3.19Å; E148-I150 PolarHBondContact O-N 3.2Å; I150-H152 PolarHBondContact O-N 3.12Å; I150-N153 PolarHBondContact O-N 2.8Å
151	R	98.6	Very high	98.5	Very high	174 Å²	174	32.3 Å²	32.3	66%	0.657	16%	0.155	S	C	*	.	H	α-helix	trans	-62	-26.2	-179.9	-161.5	170	78.3	118.1	5.8	112.7	Q147 E148 T149	Q147-R151 WeakPolarHBondContact O-CB 3.42Å; Q147-R151 PolarHBondContact O-N 2.92Å; E148-R151 WeakPolarHBondContact O-CB 3.32Å; E148-R151 PolarHBondContact O-N 3.25Å; E148-R151 VanDerWaalsContact O-N 3.12Å; E148-R151 IonicContact OE1-CZ 2.68Å; E148-R151 IonicContact OE1-NE 2.96Å; E148-R151 IonicContact OE1-NH2 3.82Å; E148-R151 PolarHBondContact OE1-NH2 3.17Å; E148-R151 IonicContact OE2-CZ 3.14Å; E148-R151 IonicContact OE2-NE 3.85Å; E148-R151 PolarHBondContact OE2-NE 3.35Å; E148-R151 IonicContact OE2-NH2 2.7Å; E148-R151 PolarHBondContact OE2-NH2 3.26Å; T149-R151 VanDerWaalsContact C-N 3.3Å; T149-R151 PolarHBondContact O-N 3.38Å
152	H	98.6	Very high	98.2	Very high	74 Å²	74	33.7 Å²	33.7	34%	0.343	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	13.4	175.3	-68.4	-83.7	0	0	0	113.6	L120 H123 E148 T149 I150 A154	L120-H152 HydrophobicContact CD1-CB 3.64Å; L120-H152 VanDerWaalsContact CD1-CD2 3.48Å; L120-H152 WeakPolarHBondContact CD1-CD2 3.41Å; L120-H152 VanDerWaalsContact CD1-CG 3.46Å; L120-H152 HydrophobicContact CD2-CB 3.73Å; L120-H152 HydrophobicContact CG-CB 4.36Å; H123-H152 AromaticContact CD2-NE2 3.86Å; H123-H152 AromaticContact NE2-NE2 3.75Å; E148-H152 PolarHBondContact O-CD2 2.94Å; E148-H152 PolarHBondContact O-N 3.21Å; E148-H152 IonicContact OE1-CD2 2.67Å; E148-H152 IonicContact OE1-NE2 3.38Å; E148-H152 PolarHBondContact OE1-NE2 3.31Å; T149-H152 PolarHBondContact O-N 3.02Å; I150-H152 PolarHBondContact O-N 3.12Å; H152-A154 PolarHBondContact O-N 3.45Å
153	N	98.6	Very high	98	Very high	94 Å²	94	36.3 Å²	36.3	50%	0.503	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	26.4	-177	-56	-66.9	0	0	0	114.2	H84 I85 I150	H84-N153 PolarHBondContact NE2-OD1 3.45Å; I85-N153 HydrophobicContact CG1-CB 4.49Å; I150-N153 PolarHBondContact O-N 2.8Å
154	A	98.8	Very high	98	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.177	C	C	.	.			trans	-99.2	163.5	174.3	0	0	0	0	0	111.1	L120 T149 H152 V198 Y199 L200	L120-A154 HydrophobicContact CD2-CB 3.43Å; L120-A154 VanDerWaalsContact CD2-CB 3.43Å; T149-A154 HydrophobicContact CG2-CB 3.79Å; T149-A154 PolarHBondContact O-N 3.39Å; T149-A154 VanDerWaalsContact O-N 3.16Å; H152-A154 PolarHBondContact O-N 3.45Å; A154-V198 HydrophobicContact CB-CB 4.41Å; A154-Y199 WeakPolarHBondContact CA-O 3.3Å; A154-Y199 WeakPolarHBondContact CB-O 3.38Å; A154-L200 HydrophobicContact CB-CB 4.17Å; A154-L200 HydrophobicContact CB-CD1 4.19Å
155	Y	98.9	Very high	97.9	Very high	7 Å²	7	32.1 Å²	32.1	3%	0.027	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	135.1	174.2	-174.7	-83.3	0	0	0	110.3	V81 I85 Q87 P88 V91 S157 L159 V198 Y199	V81-Y155 HydrophobicContact CB-CE2 4.32Å; V81-Y155 HydrophobicContact CG1-CD2 3.89Å; V81-Y155 HydrophobicContact CG1-CE2 4.14Å; V81-Y155 HydrophobicContact CG2-CD2 4.2Å; V81-Y155 HydrophobicContact CG2-CE2 3.83Å; I85-Y155 HydrophobicContact CG2-CD2 4.48Å; Q87-Y155 HydrophobicContact CB-CD2 4.29Å; Q87-Y155 HydrophobicContact CB-CE2 4.38Å; Q87-Y155 HydrophobicContact CG-CD2 3.84Å; Q87-Y155 HydrophobicContact CG-CE2 3.92Å; P88-Y155 HydrophobicContact CG-CD1 3.86Å; P88-Y155 HydrophobicContact CG-CE1 4.1Å; P88-Y155 HydrophobicContact CG-CG 4.47Å; V91-Y155 HydrophobicContact CG1-CE2 4.5Å; V91-Y155 HydrophobicContact CG2-CE1 3.81Å; V91-Y155 HydrophobicContact CG2-CE2 4.03Å; V91-Y155 VanDerWaalsContact CG2-CZ 3.44Å; V91-Y155 VanDerWaalsContact CG2-OH 3.24Å; V91-Y155 WeakPolarHBondContact CG2-OH 3.16Å; Y155-S157 PolarHBondContact O-N 3Å; Y155-S157 VanDerWaalsContact O-N 3.17Å; Y155-L159 HydrophobicContact CE1-CB 4.09Å; Y155-L159 WeakPolarHBondContact CE1-O 3.32Å; Y155-L159 PolarHBondContact OH-O 3.05Å; Y155-V198 CarbonylContact O-C 3.57Å; Y155-V198 WeakPolarHBondContact O-CA 3.46Å; Y155-Y199 PolarHBondContact N-O 3.41Å; Y155-Y199 PolarHBondContact O-N 3.5Å
156	P	98.8	Very high	97.9	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	104.9	174.5	28.3	-31.5	0	0	0	110.1	T149 P158 L159	T149-P156 HydrophobicContact CG2-CB 4.26Å; P156-P158 VanDerWaalsContact C-N 3.33Å; P156-L159 HydrophobicContact CG-CB 4.06Å; P156-L159 HydrophobicContact CG-CD2 4.13Å; P156-L159 VanDerWaalsContact O-CB 3.31Å; P156-L159 WeakPolarHBondContact O-CB 3.39Å; P156-L159 PolarHBondContact O-N 3.45Å
157	S	98.8	Very high	97.9	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-36.9	-168.8	-43.6	0	0	0	0	114.9	Y90 Y155 L159 T197 V198 Y199 H204	Y90-S157 VanDerWaalsContact OH-CA 3.28Å; Y90-S157 WeakPolarHBondContact OH-CA 3.39Å; Y90-S157 WeakPolarHBondContact OH-CB 3.48Å; Y90-S157 PolarHBondContact OH-O 2.97Å; Y155-S157 PolarHBondContact O-N 3Å; Y155-S157 VanDerWaalsContact O-N 3.17Å; S157-L159 PolarHBondContact O-N 3.31Å; S157-L159 VanDerWaalsContact O-N 3.13Å; S157-T197 PolarHBondContact N-O 2.97Å; S157-T197 WeakPolarHBondContact OG-CG2 3.47Å; S157-T197 PolarHBondContact OG-O 3.06Å; S157-V198 PolarHBondContact OG-O 3.19Å; S157-Y199 PolarHBondContact OG-N 2.98Å; S157-H204 WeakPolarHBondContact CB-ND1 3.34Å; S157-H204 PolarHBondContact OG-ND1 3.43Å
158	P	98.6	Very high	97.9	Very high	8 Å²	8	28 Å²	28	5%	0.052	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-27.7	178.2	-26.7	37.2	0	0	0	112.9	P156 G160 Y161 F164 K166 T197 F275	P156-P158 VanDerWaalsContact C-N 3.33Å; P158-G160 PolarHBondContact O-N 2.81Å; P158-G160 VanDerWaalsContact O-N 3.11Å; P158-Y161 WeakPolarHBondContact O-CB 3.35Å; P158-Y161 PolarHBondContact O-N 3.04Å; P158-Y161 VanDerWaalsContact O-N 3.1Å; P158-F164 HydrophobicContact CB-CD1 3.72Å; P158-F164 HydrophobicContact CB-CE1 3.93Å; P158-F164 WeakPolarHBondContact O-CB 3.45Å; P158-K166 CarbonylContact C-O 3.55Å; P158-T197 WeakPolarHBondContact CD-O 3.47Å; P158-F275 HydrophobicContact CG-CZ 4.44Å
159	L	98.4	Very high	97.9	Very high	15 Å²	15	27.6 Å²	27.6	8%	0.079	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	116.9	-173.4	-175.1	61.1	0	0	0	111.6	A78 V81 Y155 P156 S157 Y161 K166	A78-L159 HydrophobicContact CB-CD1 3.77Å; V81-L159 HydrophobicContact CG2-CD2 3.77Å; Y155-L159 HydrophobicContact CE1-CB 4.09Å; Y155-L159 WeakPolarHBondContact CE1-O 3.32Å; Y155-L159 PolarHBondContact OH-O 3.05Å; P156-L159 HydrophobicContact CG-CB 4.06Å; P156-L159 HydrophobicContact CG-CD2 4.13Å; P156-L159 VanDerWaalsContact O-CB 3.31Å; P156-L159 WeakPolarHBondContact O-CB 3.39Å; P156-L159 PolarHBondContact O-N 3.45Å; S157-L159 PolarHBondContact O-N 3.31Å; S157-L159 VanDerWaalsContact O-N 3.13Å; L159-Y161 PolarHBondContact O-N 2.8Å; L159-K166 WeakPolarHBondContact CA-O 3.21Å; L159-K166 PolarHBondContact N-O 3.3Å
160	G	96.3	Very high	97.9	Very high	29 Å²	29	27.9 Å²	27.9	30%	0.299	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.6	-8.5	-178.9	0	0	0	0	0	114.9	P158 G162 G163 F164	P158-G160 PolarHBondContact O-N 2.81Å; P158-G160 VanDerWaalsContact O-N 3.11Å; G160-G162 PolarHBondContact O-N 2.91Å; G160-G162 VanDerWaalsContact O-N 3.16Å; G160-G163 PolarHBondContact O-N 3.47Å; G160-F164 PolarHBondContact N-O 2.93Å
161	Y	96.1	Very high	97.9	Very high	13 Å²	13	27 Å²	27	5%	0.051	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-63.2	115.6	176.9	-171.8	-104.3	0	0	0	110.1	Y90 V96 P158 L159 G163 F164 F275 H276 W318	Y90-Y161 AromaticContact CD1-CD2 3.7Å; Y90-Y161 HydrophobicContact CD1-CD2 3.7Å; Y90-Y161 HydrophobicContact CD1-CE2 4.09Å; Y90-Y161 HydrophobicContact CD2-CD2 4.02Å; Y90-Y161 AromaticContact CE1-CD2 3.58Å; Y90-Y161 HydrophobicContact CE1-CD2 3.58Å; Y90-Y161 HydrophobicContact CE1-CE2 4.06Å; Y90-Y161 AromaticContact CE2-CD2 3.94Å; Y90-Y161 HydrophobicContact CE2-CD2 3.94Å; Y90-Y161 HydrophobicContact CE2-CG 4.45Å; Y90-Y161 AromaticContact CG-CD2 3.9Å; Y90-Y161 HydrophobicContact CG-CD2 3.9Å; Y90-Y161 AromaticContact CZ-CD2 3.72Å; V96-Y161 HydrophobicContact CB-CE2 4.45Å; V96-Y161 HydrophobicContact CG1-CD2 4.21Å; V96-Y161 HydrophobicContact CG1-CE1 4.18Å; V96-Y161 HydrophobicContact CG1-CE2 3.33Å; V96-Y161 WeakPolarHBondContact CG1-OH 3.47Å; V96-Y161 HydrophobicContact CG2-CE2 4.42Å; P158-Y161 WeakPolarHBondContact O-CB 3.35Å; P158-Y161 PolarHBondContact O-N 3.04Å; P158-Y161 VanDerWaalsContact O-N 3.1Å; L159-Y161 PolarHBondContact O-N 2.8Å; Y161-G163 PolarHBondContact O-N 3.15Å; Y161-F164 WeakPolarHBondContact O-CB 3.44Å; Y161-F164 PolarHBondContact O-N 3.35Å; Y161-F275 HydrophobicContact CD1-CD1 4.3Å; Y161-F275 HydrophobicContact CD1-CE1 4.29Å; Y161-F275 AromaticContact CD2-CD1 3.69Å; Y161-F275 HydrophobicContact CD2-CD1 3.69Å; Y161-F275 HydrophobicContact CD2-CE1 4.3Å; Y161-F275 HydrophobicContact CE1-CD1 4.39Å; Y161-F275 HydrophobicContact CE2-CB 3.99Å; Y161-F275 AromaticContact CE2-CD1 3.77Å; Y161-F275 HydrophobicContact CE2-CD1 3.77Å; Y161-F275 HydrophobicContact CE2-CG 4.21Å; Y161-F275 AromaticContact CG-CD1 3.95Å; Y161-F275 HydrophobicContact CG-CD1 3.95Å; Y161-F275 HydrophobicContact CG-CE1 4.1Å; Y161-H276 AromaticContact CE1-CE1 3.69Å; Y161-H276 AromaticContact CE1-ND1 3.6Å; Y161-H276 AromaticContact CZ-CE1 3.91Å; Y161-H276 AromaticContact CZ-ND1 3.36Å; Y161-H276 PolarHBondContact OH-ND1 2.97Å; Y161-W318 WeakPolarHBondContact O-CH2 3.38Å; Y161-W318 WeakPolarHBondContact O-CZ2 3.28Å
162	G	92.4	Very high	97.9	Very high	30 Å²	30	18.9 Å²	18.9	31%	0.309	13%	0.128	S	C	.	.	G	3₁₀ helix	trans	58.1	17.3	-174.3	0	0	0	0	0	114.4	A16 G160 W318	A16-G162 WeakPolarHBondContact CB-O 3.19Å; G160-G162 PolarHBondContact O-N 2.91Å; G160-G162 VanDerWaalsContact O-N 3.16Å; G162-W318 WeakPolarHBondContact O-CZ2 3.42Å
163	G	94.9	Very high	97.9	Very high	54 Å²	54	15.4 Å²	15.4	56%	0.557	11%	0.111	S	C	*	.	G	3₁₀ helix	trans	82.9	16.6	-172.4	0	0	0	0	0	115.5	G160 Y161	G160-G163 PolarHBondContact O-N 3.47Å; Y161-G163 PolarHBondContact O-N 3.15Å
164	F	97.4	Very high	97.9	Very high	5 Å²	5	11 Å²	11	2%	0.022	9%	0.088	C	C	.	.			trans	-63.4	133	174.5	-173.3	-103.1	0	0	0	110.1	P158 G160 Y161 K166 I180 W318	P158-F164 HydrophobicContact CB-CD1 3.72Å; P158-F164 HydrophobicContact CB-CE1 3.93Å; P158-F164 WeakPolarHBondContact O-CB 3.45Å; G160-F164 PolarHBondContact N-O 2.93Å; Y161-F164 WeakPolarHBondContact O-CB 3.44Å; Y161-F164 PolarHBondContact O-N 3.35Å; F164-K166 HydrophobicContact CD1-CB 4.36Å; F164-K166 WeakPolarHBondContact CD1-O 3.42Å; F164-K166 HydrophobicContact CE1-CB 3.73Å; F164-K166 WeakPolarHBondContact CE1-O 3.23Å; F164-K166 HydrophobicContact CZ-CB 4.29Å; F164-I180 HydrophobicContact CD2-CG1 4.34Å; F164-I180 HydrophobicContact CE2-CG1 3.67Å; F164-I180 HydrophobicContact CZ-CG1 4.27Å; F164-W318 HydrophobicContact CB-CD2 4.34Å; F164-W318 HydrophobicContact CB-CH2 3.73Å; F164-W318 HydrophobicContact CB-CZ2 3.4Å; F164-W318 HydrophobicContact CB-CZ3 4.36Å; F164-W318 HydrophobicContact CD2-CB 4.29Å; F164-W318 AromaticContact CD2-CD2 3.55Å; F164-W318 HydrophobicContact CD2-CD2 3.55Å; F164-W318 AromaticContact CD2-CE2 3.79Å; F164-W318 AromaticContact CD2-CE3 3.82Å; F164-W318 HydrophobicContact CD2-CE3 3.82Å; F164-W318 AromaticContact CD2-CG 3.77Å; F164-W318 HydrophobicContact CD2-CG 3.77Å; F164-W318 HydrophobicContact CD2-CH2 4.4Å; F164-W318 HydrophobicContact CD2-CZ2 4.21Å; F164-W318 HydrophobicContact CD2-CZ3 4.24Å; F164-W318 HydrophobicContact CE2-CB 4.37Å; F164-W318 HydrophobicContact CE2-CD2 4.39Å; F164-W318 HydrophobicContact CE2-CG 4.32Å; F164-W318 HydrophobicContact CG-CD2 4.43Å; F164-W318 HydrophobicContact CG-CH2 4.49Å; F164-W318 HydrophobicContact CG-CZ2 4.31Å; F164-W318 VanDerWaalsContact N-CZ2 3.27Å
165	P	97.8	Very high	97.9	Very high	45 Å²	45	11.3 Å²	11.3	29%	0.292	9%	0.09	S	C	.	.			trans	-89	-4.5	-164.3	32.5	-34.7	0	0	0	114.8	A78 I180	A78-P165 WeakPolarHBondContact CB-O 3.31Å; P165-I180 HydrophobicContact CG-CD1 3.96Å; P165-I180 HydrophobicContact CG-CG1 4.24Å; P165-I180 HydrophobicContact CG-CG2 3.72Å
166	K	98.8	Very high	97.9	Very high	0 Å²	0	11 Å²	11	0%	0	9%	0.089	C	C	.	.	S	Bend	trans	-133.1	173.8	-167.7	-67.6	-56.6	-152.9	156.3	0	112.3	R76 D139 D142 P158 L159 F164 I180 P181	R76-K166 WeakPolarHBondContact O-CE 3.45Å; R76-K166 PolarHBondContact O-NZ 3.37Å; D139-K166 IonicContact OD1-NZ 3.02Å; D139-K166 PolarHBondContact OD1-NZ 2.96Å; D142-K166 WeakPolarHBondContact OD2-CD 3.49Å; D142-K166 IonicContact OD2-NZ 3.48Å; D142-K166 PolarHBondContact OD2-NZ 2.95Å; P158-K166 CarbonylContact C-O 3.55Å; L159-K166 WeakPolarHBondContact CA-O 3.21Å; L159-K166 PolarHBondContact N-O 3.3Å; F164-K166 HydrophobicContact CD1-CB 4.36Å; F164-K166 WeakPolarHBondContact CD1-O 3.42Å; F164-K166 HydrophobicContact CE1-CB 3.73Å; F164-K166 WeakPolarHBondContact CE1-O 3.23Å; F164-K166 HydrophobicContact CZ-CB 4.29Å; K166-I180 HydrophobicContact CG-CG2 3.83Å; K166-P181 HydrophobicContact CB-CB 4.43Å; K166-P181 HydrophobicContact CB-CG 3.93Å; K166-P181 WeakPolarHBondContact CE-O 3.39Å; K166-P181 HydrophobicContact CG-CB 4.12Å; K166-P181 HydrophobicContact CG-CG 4.13Å
167	S	98.8	Very high	97.9	Very high	1 Å²	1	11.1 Å²	11.1	1%	0.007	9%	0.09	C	C	.	.	S	Bend	trans	-93.1	-10.3	-171.6	-42.2	0	0	0	0	113.6	D142 H146	D142-S167 WeakPolarHBondContact OD1-CA 3.37Å; D142-S167 WeakPolarHBondContact OD1-CB 3.24Å; D142-S167 PolarHBondContact OD1-N 3.26Å; D142-S167 PolarHBondContact OD1-OG 3.4Å; D142-S167 VanDerWaalsContact OD1-OG 3.12Å; H146-S167 PolarHBondContact ND1-OG 2.82Å
168	V	98.9	Very high	97.8	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	-156	151.8	-171.2	60.4	0	0	0	0	108.6	D142 V145 T170 P181 V194 D195 V196	D142-V168 HydrophobicContact CB-CG1 3.79Å; V145-V168 HydrophobicContact CB-CB 4.21Å; V145-V168 HydrophobicContact CB-CG1 4.25Å; V145-V168 HydrophobicContact CG1-CB 3.87Å; V145-V168 HydrophobicContact CG1-CG1 4.42Å; V145-V168 HydrophobicContact CG1-CG2 4.26Å; V145-V168 HydrophobicContact CG2-CB 4.34Å; V145-V168 HydrophobicContact CG2-CG1 4.39Å; V145-V168 HydrophobicContact CG2-CG2 4.14Å; V168-T170 HydrophobicContact CG1-CG2 4.38Å; V168-P181 HydrophobicContact CG1-CG 3.89Å; V168-P181 WeakPolarHBondContact O-CD 3.38Å; V168-P181 WeakPolarHBondContact O-CG 3.31Å; V168-V194 HydrophobicContact CG2-CG1 3.65Å; V168-D195 WeakPolarHBondContact CG2-O 3.32Å; V168-V196 HydrophobicContact CG2-CG2 3.96Å
169	C	98.9	Very high	97.8	Very high	9 Å²	9	12.4 Å²	12.4	6%	0.061	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	134.2	168.9	-64.2	0	0	0	0	109.8	D195	C169-D195 HydrophobicContact CB-CB 4.04Å; C169-D195 PolarHBondContact N-O 2.87Å; C169-D195 PolarHBondContact O-N 2.85Å
170	T	98.8	Very high	97.9	Very high	6 Å²	6	12.5 Å²	12.5	4%	0.037	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	105	176.4	54.6	0	0	0	0	110.4	T138 I141 V168 G179 P181 I192 N193	T138-T170 WeakPolarHBondContact CB-OG1 3.33Å; T138-T170 HydrophobicContact CG2-CG2 4.29Å; T138-T170 WeakPolarHBondContact CG2-OG1 3.29Å; I141-T170 HydrophobicContact CB-CG2 4.35Å; I141-T170 HydrophobicContact CD1-CG2 4.34Å; I141-T170 HydrophobicContact CG2-CG2 4.24Å; V168-T170 HydrophobicContact CG1-CG2 4.38Å; T170-G179 PolarHBondContact N-O 3.33Å; T170-G179 WeakPolarHBondContact O-CA 3.17Å; T170-P181 HydrophobicContact CG2-CG 4.11Å; T170-I192 HydrophobicContact CG2-CD1 4.3Å; T170-N193 CarbonylContact C-O 3.52Å; T170-N193 WeakPolarHBondContact CA-O 3.33Å
171	S	98.8	Very high	98	Very high	4 Å²	4	11.1 Å²	11.1	3%	0.028	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	99.6	-169.3	-56.1	0	0	0	0	110.3	C177 H178 G179 I192 N193	S171-C177 WeakPolarHBondContact OG-CA 3.47Å; S171-H178 PolarHBondContact OG-N 3.21Å; S171-G179 PolarHBondContact OG-N 3.32Å; S171-I192 WeakPolarHBondContact O-CA 3.38Å; S171-N193 PolarHBondContact N-O 3.02Å; S171-N193 PolarHBondContact O-N 2.77Å
172	V	98.8	Very high	98.1	Very high	3 Å²	3	11.1 Å²	11.1	2%	0.018	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	133.9	-176.4	-172.4	0	0	0	0	111.4	V70 T138 N174 V175 L186 D190 I191 I192	V70-V172 HydrophobicContact CG2-CB 3.89Å; V70-V172 HydrophobicContact CG2-CG1 3.84Å; V70-V172 WeakPolarHBondContact CG2-O 3.43Å; T138-V172 HydrophobicContact CG2-CG2 4.22Å; V172-N174 PolarHBondContact O-N 2.91Å; V172-V175 WeakPolarHBondContact O-CB 3.48Å; V172-V175 WeakPolarHBondContact O-CG2 3.24Å; V172-V175 PolarHBondContact O-N 2.82Å; V172-L186 HydrophobicContact CG2-CD2 3.98Å; V172-D190 HydrophobicContact CG1-CB 4.04Å; V172-I191 WeakPolarHBondContact CA-O 3.5Å; V172-I191 WeakPolarHBondContact CG1-O 3.24Å; V172-I192 HydrophobicContact CG2-CB 4.04Å; V172-I192 HydrophobicContact CG2-CD1 3.81Å; V172-I192 HydrophobicContact CG2-CG1 3.86Å
173	N	98.7	Very high	98.4	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	-102.7	174.1	-59.8	-24.8	0	0	0	114.1	N68 V70 V175 D190 I191 R327 S328	N68-N173 PolarHBondContact O-ND2 2.97Å; V70-N173 HydrophobicContact CG2-CB 4.01Å; N173-V175 VanDerWaalsContact C-N 3.25Å; N173-V175 PolarHBondContact O-N 3.29Å; N173-D190 PolarHBondContact ND2-OD1 3.49Å; N173-D190 WeakPolarHBondContact OD1-CA 3.27Å; N173-I191 PolarHBondContact N-O 2.93Å; N173-I191 PolarHBondContact OD1-N 2.86Å; N173-I191 PolarHBondContact OD1-O 2.84Å; N173-R327 HydrophobicContact CB-CG 4.03Å; N173-R327 CarbonylContact O-C 3.5Å; N173-R327 VanDerWaalsContact O-CA 3.27Å; N173-R327 WeakPolarHBondContact O-CA 3.36Å; N173-S328 PolarHBondContact O-N 2.75Å; N173-S328 PolarHBondContact O-OG 3.41Å
174	N	98.4	Very high	98.5	Very high	1 Å²	1	10.9 Å²	10.9	1%	0.005	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	1.3	-176.5	66.6	-72.1	0	0	0	114.3	V70 V172 V321 S322 K326	V70-N174 WeakPolarHBondContact CA-OD1 3.08Å; V70-N174 VanDerWaalsContact CB-OD1 3.31Å; V70-N174 WeakPolarHBondContact CB-OD1 3.48Å; V70-N174 PolarHBondContact N-OD1 3.2Å; V172-N174 PolarHBondContact O-N 2.91Å; N174-V321 CarbonylContact O-C 3.38Å; N174-V321 WeakPolarHBondContact O-CA 3.03Å; N174-V321 WeakPolarHBondContact O-CB 3.27Å; N174-S322 PolarHBondContact O-N 2.8Å; N174-K326 WeakPolarHBondContact CA-O 3.18Å; N174-K326 VanDerWaalsContact CB-O 3.25Å; N174-K326 WeakPolarHBondContact CB-O 3.21Å
175	V	98.7	Very high	98.6	Very high	7 Å²	7	16.8 Å²	16.8	4%	0.042	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	115.6	168.9	-175.8	0	0	0	0	108.1	V70 V172 N173 T319 A320 V321 S328	V70-V175 HydrophobicContact CB-CG2 4.15Å; V70-V175 HydrophobicContact CG1-CG2 3.89Å; V172-V175 WeakPolarHBondContact O-CB 3.48Å; V172-V175 WeakPolarHBondContact O-CG2 3.24Å; V172-V175 PolarHBondContact O-N 2.82Å; N173-V175 VanDerWaalsContact C-N 3.25Å; N173-V175 PolarHBondContact O-N 3.29Å; V175-T319 HydrophobicContact CG1-CG2 3.74Å; V175-T319 HydrophobicContact CG2-CG2 4.17Å; V175-A320 CarbonylContact C-O 3.4Å; V175-A320 WeakPolarHBondContact CA-O 3.34Å; V175-V321 HydrophobicContact CG2-CG1 4.18Å; V175-S328 PolarHBondContact O-OG 2.79Å
176	V	98.4	Very high	98.6	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.012	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	-52.5	-176.9	177.9	0	0	0	0	110.6	F266 I303 M305 F311 A320 S328	V176-F266 HydrophobicContact CG1-CD2 3.94Å; V176-F266 HydrophobicContact CG1-CE2 3.87Å; V176-I303 HydrophobicContact CG1-CD1 3.87Å; V176-I303 HydrophobicContact CG1-CG2 3.81Å; V176-M305 HydrophobicContact CG1-SD 4.23Å; V176-M305 HydrophobicContact CG2-CE 3.74Å; V176-M305 HydrophobicContact CG2-SD 4.05Å; V176-F311 HydrophobicContact CG2-CB 4.23Å; V176-A320 HydrophobicContact CB-CB 4.05Å; V176-A320 PolarHBondContact N-O 2.88Å; V176-S328 VanDerWaalsContact CA-OG 3.28Å; V176-S328 WeakPolarHBondContact CA-OG 3.2Å
177	C	98.3	Very high	98.6	Very high	2 Å²	2	19 Å²	19	1%	0.014	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	175.4	175.5	58.6	0	0	0	0	109.7	S171 G179 F266 I303 A320	S171-C177 WeakPolarHBondContact OG-CA 3.47Å; C177-G179 PolarHBondContact O-N 2.91Å; C177-G179 VanDerWaalsContact O-N 3.12Å; C177-F266 WeakPolarHBondContact SG-CE1 3.27Å; C177-F266 VanDerWaalsContact SG-CE2 3.53Å; C177-F266 WeakPolarHBondContact SG-CZ 3.39Å; C177-I303 HydrophobicContact CB-CD1 3.82Å; C177-A320 PolarHBondContact O-N 3.44Å
178	H	98.2	Very high	98.5	Very high	32 Å²	32	23.6 Å²	23.6	15%	0.148	12%	0.12	C	C	.	.			trans	55.4	29.4	174	-49.9	148.5	0	0	0	114.8	A15 S171 I180 F266 W318	A15-H178 VanDerWaalsContact CB-ND1 3.35Å; A15-H178 WeakPolarHBondContact CB-ND1 2.94Å; S171-H178 PolarHBondContact OG-N 3.21Å; H178-I180 PolarHBondContact O-N 3.19Å; H178-F266 AromaticContact CE1-CE1 3.97Å; H178-W318 HydrophobicContact CB-CE3 4.45Å; H178-W318 WeakPolarHBondContact CB-O 3.38Å
179	G	98.6	Very high	98.5	Very high	3 Å²	3	24.1 Å²	24.1	3%	0.031	13%	0.125	C	C	.	.	P	Polyproline II helix	trans	-62	124.5	172.5	0	0	0	0	0	110.7	T170 S171 C177 P181	T170-G179 PolarHBondContact N-O 3.33Å; T170-G179 WeakPolarHBondContact O-CA 3.17Å; S171-G179 PolarHBondContact OG-N 3.32Å; C177-G179 PolarHBondContact O-N 2.91Å; C177-G179 VanDerWaalsContact O-N 3.12Å; G179-P181 WeakPolarHBondContact O-CD 3.31Å
180	I	98.8	Very high	98.5	Very high	16 Å²	16	23.7 Å²	23.7	8%	0.082	12%	0.122	C	C	.	.	P	Polyproline II helix	trans	-77.1	123.7	177.8	-63	169.7	0	0	0	109.3	V75 F164 P165 K166 H178 D182 D316 W318	V75-I180 HydrophobicContact CG1-CG2 3.97Å; V75-I180 HydrophobicContact CG2-CG2 3.89Å; F164-I180 HydrophobicContact CD2-CG1 4.34Å; F164-I180 HydrophobicContact CE2-CG1 3.67Å; F164-I180 HydrophobicContact CZ-CG1 4.27Å; P165-I180 HydrophobicContact CG-CD1 3.96Å; P165-I180 HydrophobicContact CG-CG1 4.24Å; P165-I180 HydrophobicContact CG-CG2 3.72Å; K166-I180 HydrophobicContact CG-CG2 3.83Å; H178-I180 PolarHBondContact O-N 3.19Å; I180-D182 PolarHBondContact O-N 3.39Å; I180-D316 HydrophobicContact CD1-CB 3.84Å; I180-W318 HydrophobicContact CD1-CB 4.02Å; I180-W318 HydrophobicContact CD1-CG 4.36Å; I180-W318 HydrophobicContact CG1-CB 4.13Å
181	P	98.8	Very high	98.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.121	C	C	.	.	P	Polyproline II helix	trans	-52.3	123.9	171.7	-29.2	34	0	0	0	113.5	D142 K166 V168 T170 G179	D142-P181 HydrophobicContact CB-CB 3.59Å; D142-P181 HydrophobicContact CB-CG 3.81Å; K166-P181 HydrophobicContact CB-CB 4.43Å; K166-P181 HydrophobicContact CB-CG 3.93Å; K166-P181 WeakPolarHBondContact CE-O 3.39Å; K166-P181 HydrophobicContact CG-CB 4.12Å; K166-P181 HydrophobicContact CG-CG 4.13Å; V168-P181 HydrophobicContact CG1-CG 3.89Å; V168-P181 WeakPolarHBondContact O-CD 3.38Å; V168-P181 WeakPolarHBondContact O-CG 3.31Å; T170-P181 HydrophobicContact CG2-CG 4.11Å; G179-P181 WeakPolarHBondContact O-CD 3.31Å
182	D	98.8	Very high	98.5	Very high	13 Å²	13	23.3 Å²	23.3	7%	0.07	12%	0.12	C	C	.	.			trans	-140.9	-173	-177.2	71.1	27.3	0	0	0	112.9	A73 V75 T138 D139 I180 R184	A73-D182 HydrophobicContact CB-CB 4.27Å; A73-D182 PolarHBondContact N-OD2 2.89Å; V75-D182 HydrophobicContact CG2-CB 3.96Å; T138-D182 PolarHBondContact N-O 3.24Å; T138-D182 PolarHBondContact OG1-N 2.9Å; T138-D182 PolarHBondContact OG1-O 2.82Å; T138-D182 PolarHBondContact OG1-OD1 3.03Å; D139-D182 WeakPolarHBondContact CB-O 3.05Å; D139-D182 PolarHBondContact N-O 2.95Å; I180-D182 PolarHBondContact O-N 3.39Å; D182-R184 PolarHBondContact O-N 2.96Å; D182-R184 WeakPolarHBondContact OD1-CA 3.39Å; D182-R184 WeakPolarHBondContact OD1-CB 3.44Å; D182-R184 PolarHBondContact OD1-N 3.04Å
183	S	98.6	Very high	98.5	Very high	51 Å²	51	23.4 Å²	23.4	36%	0.357	12%	0.12	S	C	.	.	S	Bend	trans	-74.1	3.3	-178.6	68.1	0	0	0	0	115.7	A73 T74 T137 K185	A73-S183 WeakPolarHBondContact CB-OG 3.39Å; T74-S183 WeakPolarHBondContact CB-OG 3.47Å; T74-S183 PolarHBondContact N-OG 3.21Å; T74-S183 VanDerWaalsContact N-OG 3.07Å; T74-S183 WeakPolarHBondContact O-CB 3.41Å; T74-S183 PolarHBondContact O-N 3.42Å; T74-S183 PolarHBondContact O-OG 3.23Å; T137-S183 WeakPolarHBondContact CG2-O 3.31Å; S183-K185 PolarHBondContact O-N 2.86Å
184	R	97.8	Very high	98.5	Very high	29 Å²	29	23.4 Å²	23.4	11%	0.109	12%	0.12	C	C	.	.	P	Polyproline II helix	trans	-65.2	130.6	174.8	-179.7	-172.4	-179.7	-78.9	0.9	109.5	A73 T137 T138 D182 D190	A73-R184 HydrophobicContact CB-CB 4.16Å; T137-R184 WeakPolarHBondContact CA-O 3.24Å; T138-R184 PolarHBondContact N-O 3.2Å; D182-R184 PolarHBondContact O-N 2.96Å; D182-R184 WeakPolarHBondContact OD1-CA 3.39Å; D182-R184 WeakPolarHBondContact OD1-CB 3.44Å; D182-R184 PolarHBondContact OD1-N 3.04Å; R184-D190 IonicContact CZ-OD2 3.79Å; R184-D190 VanDerWaalsContact CZ-OD2 3.27Å; R184-D190 IonicContact NH1-OD2 2.69Å; R184-D190 PolarHBondContact NH1-OD2 3.39Å; R184-D190 VanDerWaalsContact NH2-CG 3.33Å; R184-D190 IonicContact NH2-OD1 3.04Å; R184-D190 PolarHBondContact NH2-OD1 3.11Å; R184-D190 IonicContact NH2-OD2 3.66Å; R184-D190 PolarHBondContact NH2-OD2 2.93Å
185	K	98.5	Very high	98.5	Very high	129 Å²	129	24 Å²	24	56%	0.561	12%	0.124	S	C	*	.	B	Isolated β-bridge	trans	-84.3	141.1	171.2	-66.5	-176.9	174.4	-171.9	0	110.7	G135 M136 T137 S183	G135-K185 WeakPolarHBondContact O-CD 3.31Å; G135-K185 WeakPolarHBondContact O-CG 3.3Å; M136-K185 CarbonylContact O-C 3.53Å; M136-K185 WeakPolarHBondContact O-CA 3.44Å; T137-K185 HydrophobicContact CG2-CG 3.71Å; S183-K185 PolarHBondContact O-N 2.86Å
186	L	98.6	Very high	98.5	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	12%	0.122	C	C	.	.	P	Polyproline II helix	trans	-64.3	135	166.8	-62.5	178.3	0	0	0	109.7	L132 G135 M136 I141 V172 I192 I213	L132-L186 HydrophobicContact CD2-CD1 4.32Å; G135-L186 PolarHBondContact N-O 2.75Å; M136-L186 WeakPolarHBondContact O-CG 3.45Å; M136-L186 PolarHBondContact O-N 3.49Å; I141-L186 HydrophobicContact CD1-CD1 4.19Å; V172-L186 HydrophobicContact CG2-CD2 3.98Å; L186-I192 HydrophobicContact CD2-CB 4.34Å; L186-I192 HydrophobicContact CD2-CD1 3.83Å; L186-I192 HydrophobicContact CD2-CG2 4.4Å; L186-I213 HydrophobicContact CB-CG1 4.5Å; L186-I213 HydrophobicContact CB-CG2 4.13Å; L186-I213 HydrophobicContact CD1-CD1 3.83Å; L186-I213 HydrophobicContact CD1-CG1 4.09Å
187	E	98.1	Very high	98.5	Very high	91 Å²	91	23.8 Å²	23.8	43%	0.425	12%	0.122	S	C	.	.			trans	-108.3	157.3	179.3	-62.4	-173.1	-162.7	0	0	110.6	N68 G189 D190 I213	N68-E187 PolarHBondContact ND2-OE2 2.83Å; E187-G189 PolarHBondContact O-N 3.34Å; E187-D190 PolarHBondContact N-OD2 2.79Å; E187-D190 WeakPolarHBondContact O-CB 3.47Å; E187-D190 PolarHBondContact O-N 3.45Å; E187-D190 VanDerWaalsContact O-N 3.16Å; E187-I213 WeakPolarHBondContact O-CG2 3.33Å
188	D	97.8	Very high	98.6	Very high	97 Å²	97	23.7 Å²	23.7	52%	0.519	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	126.5	172.6	-175.3	52	0	0	0	109.7	V134 G214 Q215	V134-D188 HydrophobicContact CG2-CB 4.11Å; D188-G214 VanDerWaalsContact OD1-CA 3.24Å; D188-G214 WeakPolarHBondContact OD1-CA 3.47Å; D188-Q215 PolarHBondContact OD1-N 3.48Å
189	G	97.4	Very high	98.6	Very high	10 Å²	10	23.8 Å²	23.8	10%	0.103	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.9	-1.5	-176	0	0	0	0	0	115.5	E187 I213 Q215	E187-G189 PolarHBondContact O-N 3.34Å; G189-I213 PolarHBondContact N-O 2.85Å; G189-Q215 WeakPolarHBondContact CA-O 3.31Å
190	D	98.6	Very high	98.6	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	13%	0.126	C	C	.	.			trans	-68	149.5	171.8	-79.4	-15.1	0	0	0	111.7	V172 N173 R184 E187 I213 V216	V172-D190 HydrophobicContact CG1-CB 4.04Å; N173-D190 PolarHBondContact ND2-OD1 3.49Å; N173-D190 WeakPolarHBondContact OD1-CA 3.27Å; R184-D190 IonicContact CZ-OD2 3.79Å; R184-D190 VanDerWaalsContact CZ-OD2 3.27Å; R184-D190 IonicContact NH1-OD2 2.69Å; R184-D190 PolarHBondContact NH1-OD2 3.39Å; R184-D190 VanDerWaalsContact NH2-CG 3.33Å; R184-D190 IonicContact NH2-OD1 3.04Å; R184-D190 PolarHBondContact NH2-OD1 3.11Å; R184-D190 IonicContact NH2-OD2 3.66Å; R184-D190 PolarHBondContact NH2-OD2 2.93Å; E187-D190 PolarHBondContact N-OD2 2.79Å; E187-D190 WeakPolarHBondContact O-CB 3.47Å; E187-D190 PolarHBondContact O-N 3.45Å; E187-D190 VanDerWaalsContact O-N 3.16Å; D190-I213 HydrophobicContact CB-CB 4.1Å; D190-I213 HydrophobicContact CB-CG1 4.22Å; D190-I213 WeakPolarHBondContact O-CB 3.31Å; D190-I213 PolarHBondContact O-N 2.76Å; D190-V216 WeakPolarHBondContact O-CG2 3.25Å
191	I	98.9	Very high	98.5	Very high	1 Å²	1	29 Å²	29	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	143.3	156.5	67.1	175	0	0	0	109	V172 N173 T210 F211 L212 V216 L223 V224 R327 S328 A329	V172-I191 WeakPolarHBondContact CA-O 3.5Å; V172-I191 WeakPolarHBondContact CG1-O 3.24Å; N173-I191 PolarHBondContact N-O 2.93Å; N173-I191 PolarHBondContact OD1-N 2.86Å; N173-I191 PolarHBondContact OD1-O 2.84Å; I191-T210 HydrophobicContact CB-CG2 3.96Å; I191-T210 HydrophobicContact CD1-CG2 4.27Å; I191-T210 HydrophobicContact CG1-CG2 4.36Å; I191-F211 WeakPolarHBondContact CA-O 3.41Å; I191-L212 HydrophobicContact CG2-CD2 3.7Å; I191-V216 HydrophobicContact CG2-CG1 3.71Å; I191-V216 HydrophobicContact CG2-CG2 4.08Å; I191-L223 HydrophobicContact CD1-CD2 3.97Å; I191-V224 HydrophobicContact CB-CG2 4.25Å; I191-V224 HydrophobicContact CD1-CG2 3.97Å; I191-V224 HydrophobicContact CG2-CG2 3.95Å; I191-R327 HydrophobicContact CD1-CB 4.04Å; I191-R327 HydrophobicContact CD1-CG 4.38Å; I191-S328 WeakPolarHBondContact CD1-O 3.36Å; I191-A329 HydrophobicContact CD1-CB 4.45Å
192	I	98.9	Very high	98.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	122.9	-179.1	176.8	170.6	0	0	0	110.6	L132 T138 I141 T170 S171 V172 L186 V194 T210 F211 I213	L132-I192 HydrophobicContact CD1-CG2 4.03Å; T138-I192 HydrophobicContact CG2-CD1 4.05Å; I141-I192 HydrophobicContact CD1-CD1 3.64Å; T170-I192 HydrophobicContact CG2-CD1 4.3Å; S171-I192 WeakPolarHBondContact O-CA 3.38Å; V172-I192 HydrophobicContact CG2-CB 4.04Å; V172-I192 HydrophobicContact CG2-CD1 3.81Å; V172-I192 HydrophobicContact CG2-CG1 3.86Å; L186-I192 HydrophobicContact CD2-CB 4.34Å; L186-I192 HydrophobicContact CD2-CD1 3.83Å; L186-I192 HydrophobicContact CD2-CG2 4.4Å; I192-V194 HydrophobicContact CD1-CG2 4.19Å; I192-V194 HydrophobicContact CG1-CG2 4.13Å; I192-T210 CarbonylContact O-C 3.6Å; I192-T210 WeakPolarHBondContact O-CA 3.48Å; I192-F211 HydrophobicContact CG2-CB 4.2Å; I192-F211 PolarHBondContact N-O 3.21Å; I192-F211 PolarHBondContact O-N 3.02Å; I192-I213 HydrophobicContact CG2-CD1 3.79Å; I192-I213 HydrophobicContact CG2-CG1 3.84Å
193	N	98.9	Very high	98.4	Very high	6 Å²	6	31.1 Å²	31.1	3%	0.032	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	133.5	162	172.9	-79.7	0	0	0	110	T170 S171 D195 S208 E209 Q330	T170-N193 CarbonylContact C-O 3.52Å; T170-N193 WeakPolarHBondContact CA-O 3.33Å; S171-N193 PolarHBondContact N-O 3.02Å; S171-N193 PolarHBondContact O-N 2.77Å; N193-D195 WeakPolarHBondContact OD1-CB 3.34Å; N193-S208 WeakPolarHBondContact ND2-CB 3.44Å; N193-S208 PolarHBondContact ND2-OG 2.89Å; N193-S208 VanDerWaalsContact ND2-OG 3.16Å; N193-E209 VanDerWaalsContact CA-O 3.28Å; N193-E209 WeakPolarHBondContact CA-O 3.41Å; N193-Q330 PolarHBondContact ND2-O 2.86Å
194	V	98.9	Very high	98.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	121.3	169.9	-176	0	0	0	0	107.1	L125 L132 I141 V168 I192 V196 S208 E209 F211	L125-V194 HydrophobicContact CD1-CB 3.96Å; L125-V194 HydrophobicContact CD1-CG1 4.07Å; L125-V194 VanDerWaalsContact CD1-O 3.23Å; L125-V194 WeakPolarHBondContact CD1-O 3.34Å; L132-V194 HydrophobicContact CD1-CG2 4.29Å; I141-V194 HydrophobicContact CG2-CG1 4.19Å; I141-V194 HydrophobicContact CG2-CG2 4.35Å; V168-V194 HydrophobicContact CG2-CG1 3.65Å; I192-V194 HydrophobicContact CD1-CG2 4.19Å; I192-V194 HydrophobicContact CG1-CG2 4.13Å; V194-V196 HydrophobicContact CG1-CG2 4.08Å; V194-S208 VanDerWaalsContact O-CA 3.23Å; V194-S208 WeakPolarHBondContact O-CA 3.42Å; V194-S208 WeakPolarHBondContact O-CB 3.26Å; V194-E209 PolarHBondContact N-O 2.92Å; V194-E209 PolarHBondContact O-N 3.01Å; V194-F211 HydrophobicContact CB-CE2 4.11Å; V194-F211 HydrophobicContact CG2-CD2 4.11Å; V194-F211 HydrophobicContact CG2-CE2 4.15Å
195	D	98.9	Very high	98.5	Very high	14 Å²	14	27.4 Å²	27.4	8%	0.075	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	113.1	-171.3	168.4	18	0	0	0	110.4	V168 C169 N193 S208	V168-D195 WeakPolarHBondContact CG2-O 3.32Å; C169-D195 HydrophobicContact CB-CB 4.04Å; C169-D195 PolarHBondContact N-O 2.87Å; C169-D195 PolarHBondContact O-N 2.85Å; N193-D195 WeakPolarHBondContact OD1-CB 3.34Å; D195-S208 VanDerWaalsContact CA-CB 3.47Å; D195-S208 VanDerWaalsContact CB-CB 3.49Å
196	V	98.9	Very high	98.5	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.006	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	112.8	-165.2	177.3	0	0	0	0	110	A121 V124 L125 V145 V168 V194 V198 T207	A121-V196 HydrophobicContact CB-CG1 4.49Å; V124-V196 HydrophobicContact CB-CG1 4.05Å; V124-V196 HydrophobicContact CG1-CG1 3.83Å; L125-V196 HydrophobicContact CB-CB 4.26Å; L125-V196 HydrophobicContact CB-CG2 4.07Å; L125-V196 HydrophobicContact CD1-CG2 4.03Å; V145-V196 HydrophobicContact CG1-CG1 4.39Å; V145-V196 HydrophobicContact CG1-CG2 4.31Å; V145-V196 HydrophobicContact CG2-CG2 4.24Å; V168-V196 HydrophobicContact CG2-CG2 3.96Å; V194-V196 HydrophobicContact CG1-CG2 4.08Å; V196-V198 HydrophobicContact CG1-CG1 4.22Å; V196-T207 PolarHBondContact N-O 2.67Å; V196-T207 PolarHBondContact O-N 2.79Å
197	T	98.9	Very high	98.5	Very high	3 Å²	3	21.4 Å²	21.4	2%	0.018	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	133.1	165.7	-28.2	0	0	0	0	111.2	S157 P158 H204 G205 D206 F275	S157-T197 PolarHBondContact N-O 2.97Å; S157-T197 WeakPolarHBondContact OG-CG2 3.47Å; S157-T197 PolarHBondContact OG-O 3.06Å; P158-T197 WeakPolarHBondContact CD-O 3.47Å; T197-H204 HydrophobicContact CG2-CB 4.25Å; T197-G205 VanDerWaalsContact CA-O 3.25Å; T197-G205 WeakPolarHBondContact CA-O 3.35Å; T197-G205 VanDerWaalsContact CG2-O 3.29Å; T197-G205 WeakPolarHBondContact CG2-O 3.23Å; T197-D206 WeakPolarHBondContact CB-OD1 3.29Å; T197-D206 HydrophobicContact CG2-CB 3.95Å; T197-D206 PolarHBondContact OG1-OD1 2.69Å; T197-D206 PolarHBondContact OG1-OD2 2.93Å; T197-F275 HydrophobicContact CG2-CD2 3.98Å; T197-F275 HydrophobicContact CG2-CE1 4.45Å; T197-F275 HydrophobicContact CG2-CE2 3.45Å; T197-F275 VanDerWaalsContact CG2-CE2 3.45Å; T197-F275 HydrophobicContact CG2-CZ 3.71Å; T197-F275 WeakPolarHBondContact OG1-CE2 3.37Å; T197-F275 VanDerWaalsContact OG1-CZ 3.23Å; T197-F275 WeakPolarHBondContact OG1-CZ 3.38Å
198	V	98.8	Very high	98.6	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	152.2	172.8	-52.4	0	0	0	0	111	A117 L120 A121 T149 A154 Y155 S157 V196 H204 G205	A117-V198 VanDerWaalsContact O-CG2 3.24Å; A117-V198 WeakPolarHBondContact O-CG2 3.28Å; L120-V198 HydrophobicContact CB-CG2 4.14Å; L120-V198 HydrophobicContact CD2-CG2 4.06Å; L120-V198 HydrophobicContact CG-CG2 4.06Å; A121-V198 HydrophobicContact CB-CG1 4.38Å; A121-V198 HydrophobicContact CB-CG2 4.01Å; T149-V198 HydrophobicContact CG2-CB 4.22Å; T149-V198 HydrophobicContact CG2-CG1 3.86Å; A154-V198 HydrophobicContact CB-CB 4.41Å; Y155-V198 CarbonylContact O-C 3.57Å; Y155-V198 WeakPolarHBondContact O-CA 3.46Å; S157-V198 PolarHBondContact OG-O 3.19Å; V196-V198 HydrophobicContact CG1-CG1 4.22Å; V198-H204 CarbonylContact O-C 3.6Å; V198-H204 VanDerWaalsContact O-CA 3.22Å; V198-H204 WeakPolarHBondContact O-CA 3.38Å; V198-G205 PolarHBondContact N-O 2.75Å; V198-G205 PolarHBondContact O-N 3.38Å
199	Y	98.9	Very high	98.6	Very high	33 Å²	33	13.9 Å²	13.9	13%	0.129	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	115.2	172.4	-178.4	-107.2	0	0	0	109.6	V86 P88 A154 Y155 S157 G202 Y203 H204	V86-Y199 HydrophobicContact CG1-CE1 4.19Å; P88-Y199 HydrophobicContact CB-CD1 4.22Å; P88-Y199 HydrophobicContact CB-CD2 4.47Å; P88-Y199 HydrophobicContact CB-CE1 4.16Å; P88-Y199 HydrophobicContact CB-CE2 4.39Å; P88-Y199 HydrophobicContact CB-CG 4.34Å; P88-Y199 HydrophobicContact CG-CD1 4.28Å; P88-Y199 HydrophobicContact CG-CG 4.39Å; A154-Y199 WeakPolarHBondContact CA-O 3.3Å; A154-Y199 WeakPolarHBondContact CB-O 3.38Å; Y155-Y199 PolarHBondContact N-O 3.41Å; Y155-Y199 PolarHBondContact O-N 3.5Å; S157-Y199 PolarHBondContact OG-N 2.98Å; Y199-G202 WeakPolarHBondContact CE2-O 3.39Å; Y199-G202 WeakPolarHBondContact OH-CA 3.39Å; Y199-Y203 CarbonylContact C-O 3.52Å; Y199-Y203 VanDerWaalsContact CA-O 3.29Å; Y199-Y203 WeakPolarHBondContact CA-O 3.28Å; Y199-H204 AromaticContact CD2-CD2 3.61Å; Y199-H204 AromaticContact CD2-CE1 3.27Å; Y199-H204 WeakPolarHBondContact CD2-CE1 3.49Å; Y199-H204 AromaticContact CD2-CG 3.81Å; Y199-H204 AromaticContact CD2-ND1 3.61Å; Y199-H204 AromaticContact CD2-NE2 3.29Å; Y199-H204 VanDerWaalsContact CD2-NE2 3.29Å; Y199-H204 WeakPolarHBondContact CD2-NE2 3.47Å; Y199-H204 AromaticContact CE2-CD2 3.94Å; Y199-H204 AromaticContact CE2-CE1 3.99Å; Y199-H204 AromaticContact CE2-NE2 3.56Å; Y199-H204 AromaticContact CG-CE1 3.81Å
200	L	98.8	Very high	98.7	Very high	27 Å²	27	13.5 Å²	13.5	14%	0.141	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	130.9	-176.1	178.7	66.2	0	0	0	109.5	R116 A117 L120 A154 G202 Y203	R116-L200 HydrophobicContact CB-CD2 4.36Å; A117-L200 HydrophobicContact CB-CB 4.19Å; L120-L200 HydrophobicContact CD2-CD2 4.02Å; A154-L200 HydrophobicContact CB-CB 4.17Å; A154-L200 HydrophobicContact CB-CD1 4.19Å; L200-G202 PolarHBondContact O-N 2.89Å; L200-Y203 PolarHBondContact N-O 2.78Å; L200-Y203 PolarHBondContact O-N 2.97Å
201	D	96.9	Very high	98.7	Very high	103 Å²	103	15.1 Å²	15.1	55%	0.551	8%	0.079	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.1	32.3	176.2	-58.1	-25.8	0	0	0	114.8	R116 Y203	R116-D201 IonicContact NE-OD2 2.66Å; R116-D201 IonicContact NH2-OD2 3.99Å; D201-Y203 WeakPolarHBondContact O-CD2 3.33Å
202	G	97.6	Very high	98.7	Very high	22 Å²	22	19 Å²	19	23%	0.227	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.2	0.6	179.8	0	0	0	0	0	115.7	Y199 L200 S273	Y199-G202 WeakPolarHBondContact CE2-O 3.39Å; Y199-G202 WeakPolarHBondContact OH-CA 3.39Å; L200-G202 PolarHBondContact O-N 2.89Å; G202-S273 WeakPolarHBondContact O-CA 3.18Å
203	Y	98.6	Very high	98.7	Very high	34 Å²	34	19.2 Å²	19.2	13%	0.133	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	142.4	-176	-61.2	-89.5	0	0	0	112.5	Q110 L114 A117 Y199 L200 D201 G272	Q110-Y203 WeakPolarHBondContact CA-OH 3.35Å; Q110-Y203 HydrophobicContact CB-CE1 4.07Å; Q110-Y203 HydrophobicContact CG-CE1 4.31Å; Q110-Y203 WeakPolarHBondContact CG-OH 3.41Å; L114-Y203 HydrophobicContact CB-CD1 4.25Å; A117-Y203 WeakPolarHBondContact CB-O 3.08Å; Y199-Y203 CarbonylContact C-O 3.52Å; Y199-Y203 VanDerWaalsContact CA-O 3.29Å; Y199-Y203 WeakPolarHBondContact CA-O 3.28Å; L200-Y203 PolarHBondContact N-O 2.78Å; L200-Y203 PolarHBondContact O-N 2.97Å; D201-Y203 WeakPolarHBondContact O-CD2 3.33Å; Y203-G272 CarbonylContact C-O 3.5Å; Y203-G272 WeakPolarHBondContact CA-O 3.17Å
204	H	98.8	Very high	98.6	Very high	3 Å²	3	21.1 Å²	21.1	1%	0.014	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	136.8	170	-63.4	-82.9	0	0	0	110.4	Y90 L114 S157 T197 V198 Y199 I271 G272 Y274 F275	Y90-H204 AromaticContact CE1-CE1 3.99Å; Y90-H204 PolarHBondContact OH-CE1 3.35Å; L114-H204 WeakPolarHBondContact CD1-O 3.45Å; S157-H204 WeakPolarHBondContact CB-ND1 3.34Å; S157-H204 PolarHBondContact OG-ND1 3.43Å; T197-H204 HydrophobicContact CG2-CB 4.25Å; V198-H204 CarbonylContact O-C 3.6Å; V198-H204 VanDerWaalsContact O-CA 3.22Å; V198-H204 WeakPolarHBondContact O-CA 3.38Å; Y199-H204 AromaticContact CD2-CD2 3.61Å; Y199-H204 AromaticContact CD2-CE1 3.27Å; Y199-H204 WeakPolarHBondContact CD2-CE1 3.49Å; Y199-H204 AromaticContact CD2-CG 3.81Å; Y199-H204 AromaticContact CD2-ND1 3.61Å; Y199-H204 AromaticContact CD2-NE2 3.29Å; Y199-H204 VanDerWaalsContact CD2-NE2 3.29Å; Y199-H204 WeakPolarHBondContact CD2-NE2 3.47Å; Y199-H204 AromaticContact CE2-CD2 3.94Å; Y199-H204 AromaticContact CE2-CE1 3.99Å; Y199-H204 AromaticContact CE2-NE2 3.56Å; Y199-H204 AromaticContact CG-CE1 3.81Å; H204-I271 HydrophobicContact CB-CD1 4Å; H204-I271 HydrophobicContact CB-CG1 4Å; H204-G272 PolarHBondContact N-O 2.87Å; H204-Y274 VanDerWaalsContact CD2-C 3.49Å; H204-F275 PolarHBondContact CD2-N 2.74Å; H204-F275 VanDerWaalsContact CD2-N 3.29Å
205	G	98.8	Very high	98.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	135.7	169.1	0	0	0	0	0	110.4	A121 T197 V198	A121-G205 VanDerWaalsContact CB-O 3.29Å; A121-G205 WeakPolarHBondContact CB-O 3.48Å; T197-G205 VanDerWaalsContact CA-O 3.25Å; T197-G205 WeakPolarHBondContact CA-O 3.35Å; T197-G205 VanDerWaalsContact CG2-O 3.29Å; T197-G205 WeakPolarHBondContact CG2-O 3.23Å; V198-G205 PolarHBondContact N-O 2.75Å; V198-G205 PolarHBondContact O-N 3.38Å
206	D	98.9	Very high	98.4	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.021	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	136.2	-165.1	-146.1	-0.5	0	0	0	114.7	T197 H269 I271 F275 T299 E332 T334 T346	T197-D206 WeakPolarHBondContact CB-OD1 3.29Å; T197-D206 HydrophobicContact CG2-CB 3.95Å; T197-D206 PolarHBondContact OG1-OD1 2.69Å; T197-D206 PolarHBondContact OG1-OD2 2.93Å; D206-H269 IonicContact OD2-CE1 2.87Å; D206-H269 IonicContact OD2-NE2 3.88Å; D206-I271 HydrophobicContact CB-CD1 3.53Å; D206-F275 WeakPolarHBondContact OD2-CE2 3.49Å; D206-T299 HydrophobicContact CB-CG2 4.22Å; D206-E332 VanDerWaalsContact CG-OE1 3.31Å; D206-T334 PolarHBondContact N-OG1 3.32Å; D206-T334 PolarHBondContact O-N 2.9Å; D206-T334 PolarHBondContact O-OG1 3.01Å; D206-T346 VanDerWaalsContact O-CG2 3.24Å; D206-T346 WeakPolarHBondContact O-CG2 3.46Å
207	T	98.9	Very high	98.4	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.6	148.9	179.9	-175	0	0	0	0	112.2	A121 R122 L125 V196 E332 T346	A121-T207 HydrophobicContact CB-CG2 4.07Å; R122-T207 HydrophobicContact CB-CG2 4.43Å; L125-T207 HydrophobicContact CB-CG2 4.31Å; L125-T207 HydrophobicContact CD2-CG2 3.77Å; V196-T207 PolarHBondContact N-O 2.67Å; V196-T207 PolarHBondContact O-N 2.79Å; T207-E332 PolarHBondContact OG1-O 2.99Å; T207-T346 HydrophobicContact CG2-CG2 4.01Å
208	S	98.9	Very high	98.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	154.4	177.3	75	0	0	0	0	112.2	N193 V194 D195 E332	N193-S208 WeakPolarHBondContact ND2-CB 3.44Å; N193-S208 PolarHBondContact ND2-OG 2.89Å; N193-S208 VanDerWaalsContact ND2-OG 3.16Å; V194-S208 VanDerWaalsContact O-CA 3.23Å; V194-S208 WeakPolarHBondContact O-CA 3.42Å; V194-S208 WeakPolarHBondContact O-CB 3.26Å; D195-S208 VanDerWaalsContact CA-CB 3.47Å; D195-S208 VanDerWaalsContact CB-CB 3.49Å; S208-E332 PolarHBondContact N-O 2.73Å; S208-E332 PolarHBondContact O-N 3.07Å; S208-E332 VanDerWaalsContact OG-CB 3.24Å; S208-E332 WeakPolarHBondContact OG-CB 3.24Å; S208-E332 PolarHBondContact OG-OE2 2.74Å
209	E	98.8	Very high	98.2	Very high	29 Å²	29	40 Å²	40	14%	0.136	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	146.4	172.2	-74.2	-160.5	-177.4	0	0	111.7	R122 L125 N193 V194 F211 F331	R122-E209 IonicContact CZ-OE1 3.49Å; R122-E209 IonicContact NH1-OE1 3.78Å; R122-E209 PolarHBondContact NH1-OE1 3.16Å; R122-E209 IonicContact NH2-OE1 3.22Å; R122-E209 PolarHBondContact NH2-OE1 3.25Å; L125-E209 HydrophobicContact CD2-CB 4.33Å; L125-E209 HydrophobicContact CD2-CG 4.05Å; N193-E209 VanDerWaalsContact CA-O 3.28Å; N193-E209 WeakPolarHBondContact CA-O 3.41Å; V194-E209 PolarHBondContact N-O 2.92Å; V194-E209 PolarHBondContact O-N 3.01Å; E209-F211 HydrophobicContact CB-CD2 4.49Å; E209-F211 HydrophobicContact CB-CE1 4.4Å; E209-F211 HydrophobicContact CB-CE2 3.81Å; E209-F211 HydrophobicContact CB-CZ 3.75Å; E209-F211 WeakPolarHBondContact O-CD2 3.37Å; E209-F211 WeakPolarHBondContact O-CE2 3.24Å; E209-F331 HydrophobicContact CB-CD1 4.11Å; E209-F331 HydrophobicContact CB-CE1 3.85Å; E209-F331 HydrophobicContact CG-CD1 3.81Å; E209-F331 HydrophobicContact CG-CE1 3.84Å
210	T	98.9	Very high	98.2	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.018	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	119.9	168.5	-53.8	0	0	0	0	111.3	I191 I192 V224 A329 Q330 F331	I191-T210 HydrophobicContact CB-CG2 3.96Å; I191-T210 HydrophobicContact CD1-CG2 4.27Å; I191-T210 HydrophobicContact CG1-CG2 4.36Å; I192-T210 CarbonylContact O-C 3.6Å; I192-T210 WeakPolarHBondContact O-CA 3.48Å; T210-V224 HydrophobicContact CG2-CG1 4.44Å; T210-V224 HydrophobicContact CG2-CG2 3.62Å; T210-A329 HydrophobicContact CG2-CB 4.12Å; T210-Q330 PolarHBondContact N-O 3.33Å; T210-Q330 PolarHBondContact OG1-N 2.95Å; T210-Q330 PolarHBondContact OG1-O 3.01Å; T210-F331 WeakPolarHBondContact O-CZ 3.29Å
211	F	98.8	Very high	98.2	Very high	34 Å²	34	41.5 Å²	41.5	15%	0.149	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	149.2	178.9	-58	-87.3	0	0	0	111.8	L125 L132 I191 I192 V194 E209	L125-F211 HydrophobicContact CD1-CE2 4Å; L125-F211 HydrophobicContact CD1-CZ 4.13Å; L125-F211 HydrophobicContact CG-CZ 4.5Å; L132-F211 HydrophobicContact CD1-CB 3.56Å; L132-F211 HydrophobicContact CD1-CD1 4.19Å; L132-F211 HydrophobicContact CD1-CD2 3.49Å; L132-F211 VanDerWaalsContact CD1-CD2 3.49Å; L132-F211 HydrophobicContact CD1-CE2 4.24Å; L132-F211 HydrophobicContact CD1-CG 3.47Å; L132-F211 VanDerWaalsContact CD1-CG 3.47Å; I191-F211 WeakPolarHBondContact CA-O 3.41Å; I192-F211 HydrophobicContact CG2-CB 4.2Å; I192-F211 PolarHBondContact N-O 3.21Å; I192-F211 PolarHBondContact O-N 3.02Å; V194-F211 HydrophobicContact CB-CE2 4.11Å; V194-F211 HydrophobicContact CG2-CD2 4.11Å; V194-F211 HydrophobicContact CG2-CE2 4.15Å; E209-F211 HydrophobicContact CB-CD2 4.49Å; E209-F211 HydrophobicContact CB-CE1 4.4Å; E209-F211 HydrophobicContact CB-CE2 3.81Å; E209-F211 HydrophobicContact CB-CZ 3.75Å; E209-F211 WeakPolarHBondContact O-CD2 3.37Å; E209-F211 WeakPolarHBondContact O-CE2 3.24Å
212	L	98.7	Very high	98.3	Very high	82 Å²	82	42 Å²	42	43%	0.429	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	130.6	174.4	-54.3	-178.9	0	0	0	109.9	I191 V216 Q221 V224	I191-L212 HydrophobicContact CG2-CD2 3.7Å; L212-V216 HydrophobicContact CB-CG2 3.8Å; L212-V216 HydrophobicContact CD2-CB 4.24Å; L212-V216 HydrophobicContact CD2-CG1 4.23Å; L212-V216 HydrophobicContact CD2-CG2 4Å; L212-V216 HydrophobicContact CG-CG2 4.42Å; L212-Q221 HydrophobicContact CD1-CG 4.14Å; L212-V224 HydrophobicContact CD2-CB 4.11Å; L212-V224 HydrophobicContact CD2-CG1 4.18Å; L212-V224 HydrophobicContact CD2-CG2 3.79Å
213	I	98.6	Very high	98.3	Very high	5 Å²	5	41 Å²	41	3%	0.026	21%	0.205	C	C	.	.			trans	-106.7	112.3	178.3	-53.4	-56.3	0	0	0	110.1	L132 V134 L186 E187 G189 D190 I192 Q215	L132-I213 HydrophobicContact CB-CD1 3.83Å; L132-I213 HydrophobicContact CD1-CD1 4.35Å; V134-I213 HydrophobicContact CG2-CG2 3.71Å; L186-I213 HydrophobicContact CB-CG1 4.5Å; L186-I213 HydrophobicContact CB-CG2 4.13Å; L186-I213 HydrophobicContact CD1-CD1 3.83Å; L186-I213 HydrophobicContact CD1-CG1 4.09Å; E187-I213 WeakPolarHBondContact O-CG2 3.33Å; G189-I213 PolarHBondContact N-O 2.85Å; D190-I213 HydrophobicContact CB-CB 4.1Å; D190-I213 HydrophobicContact CB-CG1 4.22Å; D190-I213 WeakPolarHBondContact O-CB 3.31Å; D190-I213 PolarHBondContact O-N 2.76Å; I192-I213 HydrophobicContact CG2-CD1 3.79Å; I192-I213 HydrophobicContact CG2-CG1 3.84Å; I213-Q215 PolarHBondContact O-N 3.37Å
214	G	97.1	Very high	98.3	Very high	47 Å²	47	39.4 Å²	39.4	49%	0.485	20%	0.199	S	C	.	.	S	Bend	trans	64.5	-131	179.3	0	0	0	0	0	112.1	D188	D188-G214 VanDerWaalsContact OD1-CA 3.24Å; D188-G214 WeakPolarHBondContact OD1-CA 3.47Å
215	Q	96.9	Very high	98.3	Very high	154 Å²	154	43.5 Å²	43.5	72%	0.72	22%	0.218	S	C	*	.	S	Bend	trans	-99	85.9	-176.6	-61.5	-60.2	-22.7	0	0	112.1	D188 G189 I213	D188-Q215 PolarHBondContact OD1-N 3.48Å; G189-Q215 WeakPolarHBondContact CA-O 3.31Å; I213-Q215 PolarHBondContact O-N 3.37Å
216	V	97.8	Very high	98.3	Very high	7 Å²	7	43.5 Å²	43.5	4%	0.042	22%	0.219	C	C	.	.			trans	-75.5	140.8	175.3	-176.4	0	0	0	0	110.6	D190 I191 L212 Q221	D190-V216 WeakPolarHBondContact O-CG2 3.25Å; I191-V216 HydrophobicContact CG2-CG1 3.71Å; I191-V216 HydrophobicContact CG2-CG2 4.08Å; L212-V216 HydrophobicContact CB-CG2 3.8Å; L212-V216 HydrophobicContact CD2-CB 4.24Å; L212-V216 HydrophobicContact CD2-CG1 4.23Å; L212-V216 HydrophobicContact CD2-CG2 4Å; L212-V216 HydrophobicContact CG-CG2 4.42Å; V216-Q221 HydrophobicContact CB-CG 4.24Å; V216-Q221 HydrophobicContact CG1-CG 4.31Å; V216-Q221 PolarHBondContact O-NE2 3.07Å
217	D	97.3	Very high	98.3	Very high	41 Å²	41	43.3 Å²	43.3	22%	0.219	22%	0.218	C	C	.	.			trans	-66	162.8	175.8	67.6	55.4	0	0	0	113.5	S66 V219 G220 Q221 R327	S66-D217 WeakPolarHBondContact CB-OD2 3.26Å; S66-D217 PolarHBondContact OG-OD2 3.48Å; D217-V219 PolarHBondContact O-N 2.97Å; D217-V219 WeakPolarHBondContact OD1-CA 3.43Å; D217-V219 WeakPolarHBondContact OD1-CB 3.36Å; D217-V219 PolarHBondContact OD1-N 3.45Å; D217-G220 PolarHBondContact O-N 2.92Å; D217-G220 PolarHBondContact OD1-N 3.49Å; D217-Q221 WeakPolarHBondContact O-CG 3.38Å; D217-Q221 PolarHBondContact O-N 2.85Å; D217-R327 IonicContact OD1-CZ 3.93Å; D217-R327 IonicContact OD1-NH1 2.84Å; D217-R327 PolarHBondContact OD1-NH1 3.1Å; D217-R327 IonicContact OD1-NH2 3.48Å; D217-R327 PolarHBondContact OD1-NH2 2.8Å; D217-R327 VanDerWaalsContact OD1-NH2 3.11Å; D217-R327 IonicContact OD2-CZ 2.85Å; D217-R327 IonicContact OD2-NH1 2.97Å; D217-R327 PolarHBondContact OD2-NH1 3.29Å; D217-R327 IonicContact OD2-NH2 3.66Å; D217-R327 PolarHBondContact OD2-NH2 3.03Å
218	E	97.4	Very high	98.3	Very high	162 Å²	162	46.6 Å²	46.6	76%	0.757	23%	0.23	S	C	*	.	H	α-helix	trans	-58.3	-32.5	-177.4	-65.9	179.8	177.5	0	0	113.7	R222	E218-R222 WeakPolarHBondContact O-CB 3.23Å; E218-R222 PolarHBondContact O-N 3.04Å
219	V	97.6	Very high	98.3	Very high	50 Å²	50	51 Å²	51	30%	0.303	25%	0.246	S	C	.	.	H	α-helix	trans	-72.4	-41	-179.4	179.5	0	0	0	0	110.3	D217 R222 L223 E306	D217-V219 PolarHBondContact O-N 2.97Å; D217-V219 WeakPolarHBondContact OD1-CA 3.43Å; D217-V219 WeakPolarHBondContact OD1-CB 3.36Å; D217-V219 PolarHBondContact OD1-N 3.45Å; V219-R222 PolarHBondContact O-N 3.49Å; V219-L223 WeakPolarHBondContact O-CB 3.4Å; V219-L223 PolarHBondContact O-N 2.62Å; V219-E306 HydrophobicContact CG1-CG 4.2Å; V219-E306 VanDerWaalsContact CG1-OE1 3.27Å; V219-E306 WeakPolarHBondContact CG1-OE1 3.33Å
220	G	98.1	Very high	98.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.8	-41.7	175	0	0	0	0	0	112.2	D217 R222 L223 V224	D217-G220 PolarHBondContact O-N 2.92Å; D217-G220 PolarHBondContact OD1-N 3.49Å; G220-R222 PolarHBondContact O-N 3.47Å; G220-L223 PolarHBondContact O-N 3.22Å; G220-V224 WeakPolarHBondContact O-CG2 3.47Å; G220-V224 PolarHBondContact O-N 2.84Å
221	Q	98.6	Very high	98.3	Very high	91 Å²	91	49.7 Å²	49.7	43%	0.425	24%	0.24	S	C	.	.	H	α-helix	trans	-60.4	-45.5	173.5	-68.1	-178.8	29.3	0	0	111.4	L212 V216 D217 V224 E225	L212-Q221 HydrophobicContact CD1-CG 4.14Å; V216-Q221 HydrophobicContact CB-CG 4.24Å; V216-Q221 HydrophobicContact CG1-CG 4.31Å; V216-Q221 PolarHBondContact O-NE2 3.07Å; D217-Q221 WeakPolarHBondContact O-CG 3.38Å; D217-Q221 PolarHBondContact O-N 2.85Å; Q221-V224 PolarHBondContact O-N 2.7Å; Q221-E225 WeakPolarHBondContact O-CB 3.29Å; Q221-E225 PolarHBondContact O-N 2.64Å
222	R	98.6	Very high	98.3	Very high	114 Å²	114	49.4 Å²	49.4	43%	0.43	24%	0.24	S	C	.	.	H	α-helix	trans	-63.5	-42.1	176.8	-167.8	178.5	65.5	-113.5	-0.2	111.8	E218 V219 G220 V224 E225 T226 F260	E218-R222 WeakPolarHBondContact O-CB 3.23Å; E218-R222 PolarHBondContact O-N 3.04Å; V219-R222 PolarHBondContact O-N 3.49Å; G220-R222 PolarHBondContact O-N 3.47Å; R222-V224 PolarHBondContact O-N 3Å; R222-E225 PolarHBondContact O-N 3.29Å; R222-T226 WeakPolarHBondContact O-CB 3.4Å; R222-T226 PolarHBondContact O-N 3.35Å; R222-T226 PolarHBondContact O-OG1 3.38Å; R222-F260 HydrophobicContact CB-CE2 4.46Å; R222-F260 HydrophobicContact CB-CZ 4.28Å; R222-F260 HydrophobicContact CG-CE2 4.01Å; R222-F260 HydrophobicContact CG-CZ 4.22Å
223	L	98.8	Very high	98.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58	-48.2	176.7	177.4	67.9	0	0	0	111.7	I191 V219 G220 T226 A227 F260 V304 E306 R327 A329	I191-L223 HydrophobicContact CD1-CD2 3.97Å; V219-L223 WeakPolarHBondContact O-CB 3.4Å; V219-L223 PolarHBondContact O-N 2.62Å; G220-L223 PolarHBondContact O-N 3.22Å; L223-T226 PolarHBondContact O-N 2.83Å; L223-A227 WeakPolarHBondContact O-CB 3.22Å; L223-A227 PolarHBondContact O-N 2.97Å; L223-F260 HydrophobicContact CB-CE1 4.17Å; L223-F260 HydrophobicContact CB-CE2 4.35Å; L223-F260 HydrophobicContact CB-CZ 3.85Å; L223-F260 HydrophobicContact CD1-CD1 3.89Å; L223-F260 HydrophobicContact CD1-CD2 4.32Å; L223-F260 HydrophobicContact CD1-CE1 3.97Å; L223-F260 HydrophobicContact CD1-CE2 4.4Å; L223-F260 HydrophobicContact CD1-CG 4.05Å; L223-F260 HydrophobicContact CD1-CZ 4.22Å; L223-V304 HydrophobicContact CD1-CB 4.26Å; L223-V304 HydrophobicContact CD1-CG1 3.77Å; L223-E306 HydrophobicContact CD2-CB 4.14Å; L223-R327 HydrophobicContact CD2-CB 3.65Å; L223-A329 HydrophobicContact CD2-CB 4.24Å; L223-A329 HydrophobicContact CG-CB 3.91Å
224	V	98.9	Very high	98.3	Very high	2 Å²	2	50 Å²	50	1%	0.012	24%	0.24	C	C	.	.	H	α-helix	trans	-64	-42.5	179.3	171.5	0	0	0	0	111.2	I191 T210 L212 G220 Q221 R222 A227 R228 A329 F331	I191-V224 HydrophobicContact CB-CG2 4.25Å; I191-V224 HydrophobicContact CD1-CG2 3.97Å; I191-V224 HydrophobicContact CG2-CG2 3.95Å; T210-V224 HydrophobicContact CG2-CG1 4.44Å; T210-V224 HydrophobicContact CG2-CG2 3.62Å; L212-V224 HydrophobicContact CD2-CB 4.11Å; L212-V224 HydrophobicContact CD2-CG1 4.18Å; L212-V224 HydrophobicContact CD2-CG2 3.79Å; G220-V224 WeakPolarHBondContact O-CG2 3.47Å; G220-V224 PolarHBondContact O-N 2.84Å; Q221-V224 PolarHBondContact O-N 2.7Å; R222-V224 PolarHBondContact O-N 3Å; V224-A227 PolarHBondContact O-N 3.21Å; V224-R228 PolarHBondContact O-N 3.43Å; V224-A329 HydrophobicContact CG2-CB 4.13Å; V224-F331 HydrophobicContact CG1-CE2 3.88Å; V224-F331 HydrophobicContact CG1-CZ 3.78Å; V224-F331 VanDerWaalsContact O-CE2 3.28Å; V224-F331 WeakPolarHBondContact O-CE2 3.48Å
225	E	98.8	Very high	98.4	Very high	88 Å²	88	47.9 Å²	47.9	41%	0.411	22%	0.218	S	C	.	.	H	α-helix	trans	-65.4	-43.9	176.5	-178.2	56.2	-153.4	0	0	112.6	Q221 R222 A227 R228 R229	Q221-E225 WeakPolarHBondContact O-CB 3.29Å; Q221-E225 PolarHBondContact O-N 2.64Å; R222-E225 PolarHBondContact O-N 3.29Å; E225-A227 PolarHBondContact O-N 2.9Å; E225-R228 PolarHBondContact O-N 3.36Å; E225-R228 IonicContact OE2-CZ 3.39Å; E225-R228 IonicContact OE2-NH1 2.93Å; E225-R228 PolarHBondContact OE2-NH1 3.21Å; E225-R229 WeakPolarHBondContact O-CG 3.42Å; E225-R229 PolarHBondContact O-N 3.2Å; E225-R229 WeakPolarHBondContact OE1-CD 3.43Å; E225-R229 WeakPolarHBondContact OE1-CG 3.38Å
226	T	98.8	Very high	98.5	Very high	1 Å²	1	44 Å²	44	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-62.3	-43	175.7	-59.5	0	0	0	0	111.2	R222 L223 R228 R229 C230 I254 D258 F260	R222-T226 WeakPolarHBondContact O-CB 3.4Å; R222-T226 PolarHBondContact O-N 3.35Å; R222-T226 PolarHBondContact O-OG1 3.38Å; L223-T226 PolarHBondContact O-N 2.83Å; T226-R228 VanDerWaalsContact C-N 3.33Å; T226-R228 PolarHBondContact O-N 2.97Å; T226-R229 PolarHBondContact O-N 3.34Å; T226-C230 WeakPolarHBondContact O-CB 3.29Å; T226-C230 PolarHBondContact O-N 3.39Å; T226-C230 PolarHBondContact O-SG 2.96Å; T226-I254 HydrophobicContact CG2-CG2 4.15Å; T226-D258 HydrophobicContact CG2-CB 3.85Å; T226-D258 WeakPolarHBondContact CG2-OD2 3.17Å; T226-D258 WeakPolarHBondContact OG1-CB 3.15Å; T226-D258 PolarHBondContact OG1-OD2 3.34Å; T226-F260 HydrophobicContact CG2-CD2 3.92Å; T226-F260 HydrophobicContact CG2-CE2 4.49Å; T226-F260 WeakPolarHBondContact OG1-CE2 3.15Å
227	A	98.9	Very high	98.5	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-41.2	177.6	0	0	0	0	0	112.4	L223 V224 E225 C230 R231 V304 A329 F331	L223-A227 WeakPolarHBondContact O-CB 3.22Å; L223-A227 PolarHBondContact O-N 2.97Å; V224-A227 PolarHBondContact O-N 3.21Å; E225-A227 PolarHBondContact O-N 2.9Å; A227-C230 PolarHBondContact O-N 3.23Å; A227-R231 PolarHBondContact O-N 3.41Å; A227-V304 HydrophobicContact CB-CB 4.02Å; A227-V304 HydrophobicContact CB-CG2 3.87Å; A227-A329 HydrophobicContact CB-CB 3.73Å; A227-F331 HydrophobicContact CB-CD2 3.79Å; A227-F331 HydrophobicContact CB-CE2 4.15Å
228	R	98.8	Very high	98.6	Very high	68 Å²	68	44.2 Å²	44.2	26%	0.257	22%	0.215	S	C	.	.	H	α-helix	trans	-60.4	-51.5	173.9	-175	-175.6	-64.1	98.8	7.2	111.4	V224 E225 T226 C230 R231 D232 F331	V224-R228 PolarHBondContact O-N 3.43Å; E225-R228 PolarHBondContact O-N 3.36Å; E225-R228 IonicContact OE2-CZ 3.39Å; E225-R228 IonicContact OE2-NH1 2.93Å; E225-R228 PolarHBondContact OE2-NH1 3.21Å; T226-R228 VanDerWaalsContact C-N 3.33Å; T226-R228 PolarHBondContact O-N 2.97Å; R228-C230 PolarHBondContact O-N 2.74Å; R228-R231 PolarHBondContact O-N 3.25Å; R228-R231 VanDerWaalsContact O-N 3.16Å; R228-D232 WeakPolarHBondContact CG-OD2 3.42Å; R228-D232 VanDerWaalsContact O-CG 3.28Å; R228-D232 PolarHBondContact O-N 3.12Å; R228-F331 HydrophobicContact CB-CD1 4.32Å; R228-F331 HydrophobicContact CB-CD2 4.03Å; R228-F331 HydrophobicContact CB-CE1 4.27Å; R228-F331 HydrophobicContact CB-CE2 3.95Å; R228-F331 HydrophobicContact CB-CG 4.22Å; R228-F331 HydrophobicContact CB-CZ 4.09Å; R228-F331 HydrophobicContact CG-CD1 4.36Å; R228-F331 HydrophobicContact CG-CE1 4.36Å; R228-F331 VanDerWaalsContact NH2-CZ 3.29Å
229	R	98.7	Very high	98.6	Very high	93 Å²	93	42.3 Å²	42.3	35%	0.351	20%	0.204	S	C	.	.	H	α-helix	trans	-59.6	-42.1	177.7	-74	173	60.5	-140.1	-5.3	112.5	E225 T226 R231 D232 E233 D258	E225-R229 WeakPolarHBondContact O-CG 3.42Å; E225-R229 PolarHBondContact O-N 3.2Å; E225-R229 WeakPolarHBondContact OE1-CD 3.43Å; E225-R229 WeakPolarHBondContact OE1-CG 3.38Å; T226-R229 PolarHBondContact O-N 3.34Å; R229-R231 VanDerWaalsContact C-N 3.31Å; R229-R231 PolarHBondContact O-N 3.39Å; R229-D232 PolarHBondContact O-N 2.95Å; R229-E233 WeakPolarHBondContact O-CB 3.37Å; R229-E233 VanDerWaalsContact O-CG 3.31Å; R229-E233 WeakPolarHBondContact O-CG 3.41Å; R229-E233 PolarHBondContact O-N 3.16Å; R229-D258 IonicContact CZ-OD2 2.86Å; R229-D258 IonicContact NH1-OD1 3.11Å; R229-D258 IonicContact NH1-OD2 2.93Å; R229-D258 PolarHBondContact NH1-OD2 2.95Å
230	C	98.9	Very high	98.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-55	-47.6	174.6	-78	0	0	0	0	111.5	T226 A227 R228 A234 I251 I254 P302 V304	T226-C230 WeakPolarHBondContact O-CB 3.29Å; T226-C230 PolarHBondContact O-N 3.39Å; T226-C230 PolarHBondContact O-SG 2.96Å; A227-C230 PolarHBondContact O-N 3.23Å; R228-C230 PolarHBondContact O-N 2.74Å; C230-A234 WeakPolarHBondContact O-CB 3.29Å; C230-A234 PolarHBondContact O-N 3Å; C230-A234 VanDerWaalsContact O-N 3.13Å; C230-I251 HydrophobicContact CB-CB 4.49Å; C230-I251 HydrophobicContact CB-CG1 4.3Å; C230-I251 HydrophobicContact CB-CG2 4.02Å; C230-I254 VanDerWaalsContact SG-CG2 3.58Å; C230-P302 HydrophobicContact CB-CG 4.21Å; C230-V304 HydrophobicContact CB-CG2 4.45Å
231	R	98.7	Very high	98.7	Very high	5 Å²	5	44.8 Å²	44.8	2%	0.019	23%	0.231	C	C	.	.	H	α-helix	trans	-67	-45.4	179	-180	-85.6	-40.1	-109.9	12.6	111.6	A227 R228 R229 I235 P302 F331 H333	A227-R231 PolarHBondContact O-N 3.41Å; R228-R231 PolarHBondContact O-N 3.25Å; R228-R231 VanDerWaalsContact O-N 3.16Å; R229-R231 VanDerWaalsContact C-N 3.31Å; R229-R231 PolarHBondContact O-N 3.39Å; R231-I235 HydrophobicContact CG-CD1 4.38Å; R231-I235 VanDerWaalsContact O-CG1 3.28Å; R231-I235 WeakPolarHBondContact O-CG1 3.42Å; R231-I235 PolarHBondContact O-N 3.33Å; R231-I235 VanDerWaalsContact O-N 3.08Å; R231-P302 HydrophobicContact CB-CG 3.79Å; R231-F331 HydrophobicContact CB-CB 3.96Å; R231-F331 HydrophobicContact CG-CB 4.04Å; R231-H333 PolarHBondContact NH1-CD2 3.37Å; R231-H333 PolarHBondContact NH1-NE2 2.91Å
232	D	98.6	Very high	98.7	Very high	28 Å²	28	41 Å²	41	15%	0.15	22%	0.216	C	C	.	.	H	α-helix	trans	-65.8	-47.8	-177.7	-65	-19.5	0	0	0	112.5	R228 R229 A234 I235 A236 L354	R228-D232 WeakPolarHBondContact CG-OD2 3.42Å; R228-D232 VanDerWaalsContact O-CG 3.28Å; R228-D232 PolarHBondContact O-N 3.12Å; R229-D232 PolarHBondContact O-N 2.95Å; D232-A234 PolarHBondContact O-N 3.02Å; D232-I235 PolarHBondContact O-N 3.5Å; D232-A236 PolarHBondContact O-N 3.39Å; D232-L354 HydrophobicContact CB-CD1 4.29Å
233	E	98.8	Very high	98.7	Very high	98 Å²	98	39.9 Å²	39.9	46%	0.458	22%	0.216	S	C	.	.	H	α-helix	trans	-69	-34	179.6	-65.9	-67.7	167.2	0	0	112	R229 I235 A236 V237 T250 I254	R229-E233 WeakPolarHBondContact O-CB 3.37Å; R229-E233 VanDerWaalsContact O-CG 3.31Å; R229-E233 WeakPolarHBondContact O-CG 3.41Å; R229-E233 PolarHBondContact O-N 3.16Å; E233-I235 VanDerWaalsContact C-N 3.34Å; E233-A236 PolarHBondContact O-N 2.93Å; E233-V237 PolarHBondContact O-N 2.96Å; E233-T250 HydrophobicContact CB-CG2 4.05Å; E233-I254 HydrophobicContact CB-CD1 3.5Å; E233-I254 HydrophobicContact CG-CD1 3.75Å
234	A	98.8	Very high	98.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.3	-35.6	174	0	0	0	0	0	112.7	C230 D232 V237 C238 I247 I251 I300	C230-A234 WeakPolarHBondContact O-CB 3.29Å; C230-A234 PolarHBondContact O-N 3Å; C230-A234 VanDerWaalsContact O-N 3.13Å; D232-A234 PolarHBondContact O-N 3.02Å; A234-V237 WeakPolarHBondContact O-CG2 3.27Å; A234-C238 PolarHBondContact O-SG 3.17Å; A234-I247 HydrophobicContact CB-CG2 4.16Å; A234-I251 HydrophobicContact CB-CD1 3.78Å; A234-I251 HydrophobicContact CB-CG1 3.64Å; A234-I300 HydrophobicContact CB-CG2 4.03Å
235	I	98.8	Very high	98.6	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.015	22%	0.219	C	C	.	.	H	α-helix	trans	-66.2	-44	170.5	-67.5	167.4	0	0	0	109.7	R231 D232 E233 V237 C238 I300 H333 V335 V342 I344	R231-I235 HydrophobicContact CG-CD1 4.38Å; R231-I235 VanDerWaalsContact O-CG1 3.28Å; R231-I235 WeakPolarHBondContact O-CG1 3.42Å; R231-I235 PolarHBondContact O-N 3.33Å; R231-I235 VanDerWaalsContact O-N 3.08Å; D232-I235 PolarHBondContact O-N 3.5Å; E233-I235 VanDerWaalsContact C-N 3.34Å; I235-V237 PolarHBondContact O-N 2.89Å; I235-V237 VanDerWaalsContact O-N 3.11Å; I235-C238 VanDerWaalsContact O-CB 3.26Å; I235-C238 WeakPolarHBondContact O-CB 3.36Å; I235-C238 PolarHBondContact O-N 3.04Å; I235-I300 HydrophobicContact CG1-CB 4.36Å; I235-I300 HydrophobicContact CG1-CD1 3.79Å; I235-H333 HydrophobicContact CD1-CB 3.9Å; I235-V335 HydrophobicContact CD1-CG1 4.04Å; I235-V335 HydrophobicContact CG1-CG1 3.98Å; I235-V335 HydrophobicContact CG2-CG1 4.15Å; I235-V342 HydrophobicContact CG2-CG1 3.87Å; I235-V342 HydrophobicContact CG2-CG2 4.25Å; I235-V342 WeakPolarHBondContact O-CG1 3.5Å; I235-I344 HydrophobicContact CD1-CD1 4.3Å; I235-I344 HydrophobicContact CD1-CG1 4.43Å; I235-I344 HydrophobicContact CG2-CD1 4.09Å; I235-I344 HydrophobicContact CG2-CG1 3.95Å
236	A	98.4	Very high	98.6	Very high	72 Å²	72	38.3 Å²	38.3	60%	0.595	21%	0.212	S	C	*	.	H	α-helix	trans	-60	-25.7	-175.5	0	0	0	0	0	114.2	D232 E233	D232-A236 PolarHBondContact O-N 3.39Å; E233-A236 PolarHBondContact O-N 2.93Å
237	V	98.4	Very high	98.6	Very high	51 Å²	51	38.3 Å²	38.3	31%	0.309	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-9.7	176.3	-61.5	0	0	0	0	114	E233 A234 I235 V246	E233-V237 PolarHBondContact O-N 2.96Å; A234-V237 WeakPolarHBondContact O-CG2 3.27Å; I235-V237 PolarHBondContact O-N 2.89Å; I235-V237 VanDerWaalsContact O-N 3.11Å; V237-V246 HydrophobicContact CB-CG2 4.43Å; V237-V246 HydrophobicContact CG2-CB 4.47Å; V237-V246 HydrophobicContact CG2-CG2 3.89Å
238	C	98.7	Very high	98.6	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.02	21%	0.212	C	C	.	.			trans	-73.9	130.1	179.6	-68	0	0	0	0	112.1	A234 I235 M292 I337 V342	A234-C238 PolarHBondContact O-SG 3.17Å; I235-C238 VanDerWaalsContact O-CB 3.26Å; I235-C238 WeakPolarHBondContact O-CB 3.36Å; I235-C238 PolarHBondContact O-N 3.04Å; C238-M292 HydrophobicContact CB-CE 4.35Å; C238-M292 HydrophobicContact CB-SD 3.84Å; C238-I337 HydrophobicContact CB-CD1 3.92Å; C238-V342 HydrophobicContact CB-CB 3.95Å; C238-V342 HydrophobicContact CB-CG1 4.17Å; C238-V342 HydrophobicContact CB-CG2 4.07Å
239	K	98.5	Very high	98.6	Very high	122 Å²	122	38 Å²	38	53%	0.53	22%	0.216	S	C	.	.			trans	-167.2	162.4	176.2	60.8	-176.8	179.5	-174.9	0	110.4	G241 A242 M292	K239-G241 PolarHBondContact O-N 2.89Å; K239-A242 HydrophobicContact CG-CB 3.99Å; K239-A242 WeakPolarHBondContact O-CB 3.28Å; K239-A242 PolarHBondContact O-N 2.83Å; K239-M292 WeakPolarHBondContact O-CB 3.42Å
240	P	98.4	Very high	98.6	Very high	45 Å²	45	35 Å²	35	29%	0.292	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	137	171.8	-24.9	33.2	0	0	0	112.1	A242 M292 I337 T338	P240-A242 VanDerWaalsContact C-N 3.28Å; P240-A242 PolarHBondContact O-N 3.03Å; P240-M292 CarbonylContact C-O 3.51Å; P240-M292 VanDerWaalsContact CA-O 3.29Å; P240-M292 WeakPolarHBondContact CA-O 3.4Å; P240-I337 HydrophobicContact CB-CG2 4.46Å; P240-I337 HydrophobicContact CG-CG2 3.74Å; P240-T338 WeakPolarHBondContact CD-O 3.29Å; P240-T338 WeakPolarHBondContact CG-O 3.04Å
241	G	98.3	Very high	98.6	Very high	56 Å²	56	35 Å²	35	58%	0.577	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.7	-9.1	178.7	0	0	0	0	0	115.2	K239 M292	K239-G241 PolarHBondContact O-N 2.89Å; G241-M292 PolarHBondContact N-O 3.45Å
242	A	98.4	Very high	98.6	Very high	13 Å²	13	35.9 Å²	35.9	11%	0.107	21%	0.214	C	C	.	.			trans	-78.2	144.4	171.5	0	0	0	0	0	110.8	K239 P240 V246 T291 M292	K239-A242 HydrophobicContact CG-CB 3.99Å; K239-A242 WeakPolarHBondContact O-CB 3.28Å; K239-A242 PolarHBondContact O-N 2.83Å; P240-A242 VanDerWaalsContact C-N 3.28Å; P240-A242 PolarHBondContact O-N 3.03Å; A242-V246 HydrophobicContact CB-CG2 4.48Å; A242-T291 CarbonylContact O-C 3.57Å; A242-T291 WeakPolarHBondContact O-CA 3.43Å; A242-M292 HydrophobicContact CB-SD 4.35Å; A242-M292 WeakPolarHBondContact O-CG 3.02Å; A242-M292 PolarHBondContact O-N 3Å
243	E	98.7	Very high	98.7	Very high	90 Å²	90	41.4 Å²	41.4	42%	0.421	24%	0.239	S	C	.	.	B	Isolated β-bridge	trans	-76.8	148	173.7	-66.7	176.2	178.5	0	0	111.1	C245 V246 I290	E243-C245 PolarHBondContact O-N 2.87Å; E243-C245 PolarHBondContact OE2-SG 3.32Å; E243-V246 WeakPolarHBondContact O-CG1 3.27Å; E243-V246 WeakPolarHBondContact O-CG2 3.3Å; E243-V246 PolarHBondContact O-N 2.77Å; E243-I290 CarbonylContact C-O 3.53Å; E243-I290 VanDerWaalsContact CA-O 3.28Å; E243-I290 WeakPolarHBondContact CA-O 3.49Å
244	L	98.6	Very high	98.7	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.021	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-28.8	178.7	-68.7	-176.1	0	0	0	113	V246 I247 P279 I281 I290 M292 F298	L244-V246 PolarHBondContact O-N 2.98Å; L244-V246 VanDerWaalsContact O-N 3.12Å; L244-I247 WeakPolarHBondContact O-CB 3.39Å; L244-I247 PolarHBondContact O-N 3.06Å; L244-P279 HydrophobicContact CD1-CB 3.63Å; L244-P279 HydrophobicContact CD1-CG 4.31Å; L244-I281 HydrophobicContact CD1-CD1 3.97Å; L244-I281 HydrophobicContact CD2-CD1 3.7Å; L244-I281 HydrophobicContact CG-CD1 4.37Å; L244-I290 HydrophobicContact CD1-CB 3.8Å; L244-I290 HydrophobicContact CD1-CD1 4.42Å; L244-I290 HydrophobicContact CD1-CG2 3.74Å; L244-I290 HydrophobicContact CG-CB 4.1Å; L244-I290 HydrophobicContact CG-CG2 4.11Å; L244-I290 WeakPolarHBondContact CG-O 3.29Å; L244-I290 PolarHBondContact N-O 2.55Å; L244-M292 HydrophobicContact CD2-CE 3.8Å; L244-M292 HydrophobicContact CD2-CG 3.67Å; L244-F298 HydrophobicContact CD2-CZ 4.46Å
245	C	98.6	Very high	98.6	Very high	10 Å²	10	37.7 Å²	37.7	7%	0.068	22%	0.223	C	C	.	.	H	α-helix	trans	-59.2	-24.3	179.6	69	0	0	0	0	114.1	E243 I247 G248 N249 N286 N288	E243-C245 PolarHBondContact O-N 2.87Å; E243-C245 PolarHBondContact OE2-SG 3.32Å; C245-I247 PolarHBondContact O-N 3.13Å; C245-G248 PolarHBondContact O-N 3.39Å; C245-N249 WeakPolarHBondContact O-CB 3.37Å; C245-N249 PolarHBondContact O-N 2.8Å; C245-N249 PolarHBondContact O-ND2 2.85Å; C245-N249 VanDerWaalsContact O-ND2 3.17Å; C245-N286 WeakPolarHBondContact CA-OD1 3.38Å; C245-N286 WeakPolarHBondContact CB-O 3.25Å; C245-N286 VanDerWaalsContact CB-OD1 3.31Å; C245-N286 WeakPolarHBondContact CB-OD1 3.5Å; C245-N288 HydrophobicContact CB-CB 4.36Å; C245-N288 WeakPolarHBondContact CB-O 3.2Å; C245-N288 PolarHBondContact N-O 3.29Å
246	V	98.8	Very high	98.6	Very high	43 Å²	43	44.9 Å²	44.9	26%	0.261	26%	0.256	S	S	.	.	H	α-helix	trans	-60.7	-29.4	179.8	-54.3	0	0	0	0	112	V237 A242 E243 L244 T250 M292	V237-V246 HydrophobicContact CB-CG2 4.43Å; V237-V246 HydrophobicContact CG2-CB 4.47Å; V237-V246 HydrophobicContact CG2-CG2 3.89Å; A242-V246 HydrophobicContact CB-CG2 4.48Å; E243-V246 WeakPolarHBondContact O-CG1 3.27Å; E243-V246 WeakPolarHBondContact O-CG2 3.3Å; E243-V246 PolarHBondContact O-N 2.77Å; L244-V246 PolarHBondContact O-N 2.98Å; L244-V246 VanDerWaalsContact O-N 3.12Å; V246-T250 VanDerWaalsContact O-CB 3.29Å; V246-T250 WeakPolarHBondContact O-CB 3.28Å; V246-T250 PolarHBondContact O-N 2.92Å; V246-T250 PolarHBondContact O-OG1 2.89Å; V246-M292 HydrophobicContact CG2-CE 4.17Å
247	I	98.9	Very high	98.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.4	-60.6	176.6	-67.5	170.6	0	0	0	109.6	A234 L244 C245 N249 T250 I251 I281 M292 F298 I300	A234-I247 HydrophobicContact CB-CG2 4.16Å; L244-I247 WeakPolarHBondContact O-CB 3.39Å; L244-I247 PolarHBondContact O-N 3.06Å; C245-I247 PolarHBondContact O-N 3.13Å; I247-N249 VanDerWaalsContact C-N 3.32Å; I247-N249 PolarHBondContact O-N 2.74Å; I247-T250 PolarHBondContact O-N 3.37Å; I247-I251 HydrophobicContact CG2-CD1 3.65Å; I247-I251 WeakPolarHBondContact O-CD1 3.39Å; I247-I251 VanDerWaalsContact O-CG1 3.28Å; I247-I251 WeakPolarHBondContact O-CG1 3.44Å; I247-I251 PolarHBondContact O-N 3.42Å; I247-I281 HydrophobicContact CB-CG2 4.42Å; I247-I281 HydrophobicContact CD1-CD1 4.41Å; I247-I281 HydrophobicContact CD1-CG2 3.76Å; I247-I281 HydrophobicContact CG2-CG2 3.77Å; I247-M292 HydrophobicContact CD1-CE 3.58Å; I247-M292 HydrophobicContact CG1-CE 3.88Å; I247-F298 HydrophobicContact CD1-CE2 3.77Å; I247-F298 HydrophobicContact CD1-CZ 4.22Å; I247-I300 HydrophobicContact CD1-CD1 3.82Å; I247-I300 HydrophobicContact CD1-CG1 4.26Å; I247-I300 HydrophobicContact CG1-CD1 4.12Å; I247-I300 HydrophobicContact CG2-CD1 4.31Å; I247-I300 HydrophobicContact CG2-CG2 4.26Å
248	G	98.8	Very high	98.6	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.9	-33	-176.8	0	0	0	0	0	113.9	C245 S252 W282 H283 H284 A285	C245-G248 PolarHBondContact O-N 3.39Å; G248-S252 VanDerWaalsContact O-CB 3.3Å; G248-S252 WeakPolarHBondContact O-CB 3.43Å; G248-S252 PolarHBondContact O-N 3.33Å; G248-S252 PolarHBondContact O-OG 3.16Å; G248-W282 WeakPolarHBondContact CA-O 3.38Å; G248-W282 PolarHBondContact N-O 3Å; G248-H283 WeakPolarHBondContact CA-O 3.49Å; G248-H284 WeakPolarHBondContact CA-O 3.44Å; G248-H284 CarbonylContact O-C 3.46Å; G248-A285 PolarHBondContact O-N 2.88Å
249	N	98.8	Very high	98.5	Very high	62 Å²	62	47.9 Å²	47.9	33%	0.332	28%	0.281	S	S	.	.	H	α-helix	trans	-66	-45.6	175.5	-68.6	-23.5	0	0	0	111.3	C245 I247 S252 E253 A285 N286	C245-N249 WeakPolarHBondContact O-CB 3.37Å; C245-N249 PolarHBondContact O-N 2.8Å; C245-N249 PolarHBondContact O-ND2 2.85Å; C245-N249 VanDerWaalsContact O-ND2 3.17Å; I247-N249 VanDerWaalsContact C-N 3.32Å; I247-N249 PolarHBondContact O-N 2.74Å; N249-S252 PolarHBondContact O-N 2.78Å; N249-E253 PolarHBondContact O-N 2.95Å; N249-E253 VanDerWaalsContact O-N 3.1Å; N249-A285 WeakPolarHBondContact OD1-CA 3.38Å; N249-A285 WeakPolarHBondContact OD1-CB 3.38Å; N249-N286 PolarHBondContact ND2-O 3.44Å; N249-N286 PolarHBondContact OD1-N 2.77Å; N249-N286 PolarHBondContact OD1-O 3.18Å
250	T	98.9	Very high	98.5	Very high	31 Å²	31	42.6 Å²	42.6	19%	0.19	26%	0.259	C	S	.	.	H	α-helix	trans	-61.6	-48	176.6	-57.9	0	0	0	0	111.4	E233 V246 I247 S252 E253 I254	E233-T250 HydrophobicContact CB-CG2 4.05Å; V246-T250 VanDerWaalsContact O-CB 3.29Å; V246-T250 WeakPolarHBondContact O-CB 3.28Å; V246-T250 PolarHBondContact O-N 2.92Å; V246-T250 PolarHBondContact O-OG1 2.89Å; I247-T250 PolarHBondContact O-N 3.37Å; T250-S252 VanDerWaalsContact C-N 3.34Å; T250-S252 PolarHBondContact O-N 2.88Å; T250-E253 PolarHBondContact O-N 2.94Å; T250-I254 HydrophobicContact CG2-CD1 3.95Å; T250-I254 WeakPolarHBondContact O-CG1 3.4Å; T250-I254 PolarHBondContact O-N 3.39Å; T250-I254 VanDerWaalsContact O-N 3.16Å
251	I	98.9	Very high	98.5	Very high	0 Å²	0	45 Å²	45	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.4	-44.4	179.6	-67.9	160.2	0	0	0	111.2	C230 A234 I247 I254 A255 V262 H283 I300 P302	C230-I251 HydrophobicContact CB-CB 4.49Å; C230-I251 HydrophobicContact CB-CG1 4.3Å; C230-I251 HydrophobicContact CB-CG2 4.02Å; A234-I251 HydrophobicContact CB-CD1 3.78Å; A234-I251 HydrophobicContact CB-CG1 3.64Å; I247-I251 HydrophobicContact CG2-CD1 3.65Å; I247-I251 WeakPolarHBondContact O-CD1 3.39Å; I247-I251 VanDerWaalsContact O-CG1 3.28Å; I247-I251 WeakPolarHBondContact O-CG1 3.44Å; I247-I251 PolarHBondContact O-N 3.42Å; I251-I254 PolarHBondContact O-N 3.24Å; I251-A255 WeakPolarHBondContact O-CB 3.38Å; I251-A255 PolarHBondContact O-N 2.74Å; I251-V262 HydrophobicContact CG2-CG1 4.09Å; I251-V262 HydrophobicContact CG2-CG2 3.75Å; I251-H283 WeakPolarHBondContact CB-O 3.32Å; I251-H283 HydrophobicContact CD1-CB 4.03Å; I251-H283 WeakPolarHBondContact CG2-O 3.42Å; I251-I300 HydrophobicContact CD1-CG2 4.46Å; I251-P302 HydrophobicContact CD1-CB 4.04Å; I251-P302 HydrophobicContact CD1-CG 4.25Å; I251-P302 HydrophobicContact CG1-CB 4.44Å; I251-P302 HydrophobicContact CG2-CB 3.88Å
252	S	98.7	Very high	98.5	Very high	22 Å²	22	43.1 Å²	43.1	15%	0.154	24%	0.243	C	C	.	.	H	α-helix	trans	-66.8	-39.9	-177.7	-63.1	0	0	0	0	112.4	G248 N249 T250 Q256 H284 A285	G248-S252 VanDerWaalsContact O-CB 3.3Å; G248-S252 WeakPolarHBondContact O-CB 3.43Å; G248-S252 PolarHBondContact O-N 3.33Å; G248-S252 PolarHBondContact O-OG 3.16Å; N249-S252 PolarHBondContact O-N 2.78Å; T250-S252 VanDerWaalsContact C-N 3.34Å; T250-S252 PolarHBondContact O-N 2.88Å; S252-Q256 WeakPolarHBondContact O-CB 3.37Å; S252-Q256 PolarHBondContact O-N 3.36Å; S252-H284 WeakPolarHBondContact OG-CA 3.39Å; S252-A285 PolarHBondContact OG-N 2.67Å
253	E	98.7	Very high	98.3	Very high	144 Å²	144	42.6 Å²	42.6	67%	0.673	24%	0.239	S	C	*	.	H	α-helix	trans	-61.3	-48.5	176.1	-176.7	172.8	-173.5	0	0	111.2	N249 T250 Q256 S257	N249-E253 PolarHBondContact O-N 2.95Å; N249-E253 VanDerWaalsContact O-N 3.1Å; T250-E253 PolarHBondContact O-N 2.94Å; E253-Q256 PolarHBondContact O-N 3.34Å; E253-S257 WeakPolarHBondContact O-CB 3.49Å; E253-S257 PolarHBondContact O-N 2.87Å; E253-S257 PolarHBondContact O-OG 3.47Å
254	I	98.8	Very high	98	Very high	20 Å²	20	40.1 Å²	40.1	10%	0.103	23%	0.23	C	C	.	.	H	α-helix	trans	-62	-53.7	179.2	-65.3	166.2	0	0	0	110.6	T226 C230 E233 T250 I251 Q256 S257 D258	T226-I254 HydrophobicContact CG2-CG2 4.15Å; C230-I254 VanDerWaalsContact SG-CG2 3.58Å; E233-I254 HydrophobicContact CB-CD1 3.5Å; E233-I254 HydrophobicContact CG-CD1 3.75Å; T250-I254 HydrophobicContact CG2-CD1 3.95Å; T250-I254 WeakPolarHBondContact O-CG1 3.4Å; T250-I254 PolarHBondContact O-N 3.39Å; T250-I254 VanDerWaalsContact O-N 3.16Å; I251-I254 PolarHBondContact O-N 3.24Å; I254-Q256 VanDerWaalsContact C-N 3.32Å; I254-Q256 PolarHBondContact O-N 3.09Å; I254-S257 PolarHBondContact O-N 3.35Å; I254-S257 PolarHBondContact O-OG 3.47Å; I254-D258 PolarHBondContact O-N 3.4Å; I254-D258 VanDerWaalsContact O-N 3.14Å
255	A	98.6	Very high	97.8	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-43.9	-178.7	0	0	0	0	0	111.8	I251 D258 G259 F260 V262 V304	I251-A255 WeakPolarHBondContact O-CB 3.38Å; I251-A255 PolarHBondContact O-N 2.74Å; A255-D258 PolarHBondContact O-N 3.01Å; A255-G259 PolarHBondContact O-N 3.1Å; A255-F260 CarbonylContact C-O 3.57Å; A255-F260 CarbonylContact O-C 3.54Å; A255-F260 WeakPolarHBondContact O-CA 3.14Å; A255-F260 PolarHBondContact O-N 3.44Å; A255-V262 HydrophobicContact CB-CG2 3.63Å; A255-V304 HydrophobicContact CB-CG1 4.41Å
256	Q	97.9	Very high	97.5	Very high	153 Å²	153	42.6 Å²	42.6	72%	0.715	24%	0.239	S	C	*	.	H	α-helix	trans	-64.7	-41.3	178.2	-175.9	177.6	10.2	0	0	112	S252 E253 I254 D258 G259	S252-Q256 WeakPolarHBondContact O-CB 3.37Å; S252-Q256 PolarHBondContact O-N 3.36Å; E253-Q256 PolarHBondContact O-N 3.34Å; I254-Q256 VanDerWaalsContact C-N 3.32Å; I254-Q256 PolarHBondContact O-N 3.09Å; Q256-D258 VanDerWaalsContact C-N 3.26Å; Q256-D258 PolarHBondContact O-N 3.09Å; Q256-G259 PolarHBondContact O-N 3.17Å; Q256-G259 VanDerWaalsContact O-N 3.11Å
257	S	98.1	Very high	97.5	Very high	86 Å²	86	41.1 Å²	41.1	60%	0.601	23%	0.229	S	C	*	.	H	α-helix	trans	-62.9	-33.1	179.5	74.5	0	0	0	0	112.9	E253 I254 G259	E253-S257 WeakPolarHBondContact O-CB 3.49Å; E253-S257 PolarHBondContact O-N 2.87Å; E253-S257 PolarHBondContact O-OG 3.47Å; I254-S257 PolarHBondContact O-N 3.35Å; I254-S257 PolarHBondContact O-OG 3.47Å; S257-G259 VanDerWaalsContact C-N 3.32Å
258	D	98	Very high	97.4	Very high	41 Å²	41	41.1 Å²	41.1	22%	0.219	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	1.4	177.9	-73.6	-8.1	0	0	0	113.1	T226 R229 I254 A255 Q256 F260	T226-D258 HydrophobicContact CG2-CB 3.85Å; T226-D258 WeakPolarHBondContact CG2-OD2 3.17Å; T226-D258 WeakPolarHBondContact OG1-CB 3.15Å; T226-D258 PolarHBondContact OG1-OD2 3.34Å; R229-D258 IonicContact CZ-OD2 2.86Å; R229-D258 IonicContact NH1-OD1 3.11Å; R229-D258 IonicContact NH1-OD2 2.93Å; R229-D258 PolarHBondContact NH1-OD2 2.95Å; I254-D258 PolarHBondContact O-N 3.4Å; I254-D258 VanDerWaalsContact O-N 3.14Å; A255-D258 PolarHBondContact O-N 3.01Å; Q256-D258 VanDerWaalsContact C-N 3.26Å; Q256-D258 PolarHBondContact O-N 3.09Å; D258-F260 HydrophobicContact CB-CD2 3.98Å; D258-F260 HydrophobicContact CB-CE2 4.28Å
259	G	98	Very high	97.4	Very high	62 Å²	62	41.2 Å²	41.2	64%	0.639	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.7	24.4	175.5	0	0	0	0	0	115	A255 Q256 S257	A255-G259 PolarHBondContact O-N 3.1Å; Q256-G259 PolarHBondContact O-N 3.17Å; Q256-G259 VanDerWaalsContact O-N 3.11Å; S257-G259 VanDerWaalsContact C-N 3.32Å
260	F	98.6	Very high	97.4	Very high	12 Å²	12	38.3 Å²	38.3	5%	0.053	21%	0.214	C	C	.	.			trans	-113.6	173.5	177.9	-60.3	-57	0	0	0	112	R222 L223 T226 A255 D258 V304	R222-F260 HydrophobicContact CB-CE2 4.46Å; R222-F260 HydrophobicContact CB-CZ 4.28Å; R222-F260 HydrophobicContact CG-CE2 4.01Å; R222-F260 HydrophobicContact CG-CZ 4.22Å; L223-F260 HydrophobicContact CB-CE1 4.17Å; L223-F260 HydrophobicContact CB-CE2 4.35Å; L223-F260 HydrophobicContact CB-CZ 3.85Å; L223-F260 HydrophobicContact CD1-CD1 3.89Å; L223-F260 HydrophobicContact CD1-CD2 4.32Å; L223-F260 HydrophobicContact CD1-CE1 3.97Å; L223-F260 HydrophobicContact CD1-CE2 4.4Å; L223-F260 HydrophobicContact CD1-CG 4.05Å; L223-F260 HydrophobicContact CD1-CZ 4.22Å; T226-F260 HydrophobicContact CG2-CD2 3.92Å; T226-F260 HydrophobicContact CG2-CE2 4.49Å; T226-F260 WeakPolarHBondContact OG1-CE2 3.15Å; A255-F260 CarbonylContact C-O 3.57Å; A255-F260 CarbonylContact O-C 3.54Å; A255-F260 WeakPolarHBondContact O-CA 3.14Å; A255-F260 PolarHBondContact O-N 3.44Å; D258-F260 HydrophobicContact CB-CD2 3.98Å; D258-F260 HydrophobicContact CB-CE2 4.28Å; F260-V304 HydrophobicContact CB-CG1 3.54Å; F260-V304 HydrophobicContact CD2-CG1 4.36Å; F260-V304 HydrophobicContact CG-CG1 4.11Å
261	Q	98	Very high	97.3	Very high	95 Å²	95	36.8 Å²	36.8	44%	0.444	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	157.5	177	-52.3	-157.7	-97.3	0	0	110.8	V304 M305 G307 P309	Q261-V304 CarbonylContact O-C 3.53Å; Q261-V304 WeakPolarHBondContact O-CA 3.26Å; Q261-M305 HydrophobicContact CB-CB 4.42Å; Q261-M305 PolarHBondContact N-O 3.24Å; Q261-M305 PolarHBondContact O-N 3.21Å; Q261-G307 PolarHBondContact OE1-O 3.4Å; Q261-P309 HydrophobicContact CB-CB 4.49Å; Q261-P309 VanDerWaalsContact OE1-CD 3.31Å
262	V	97.5	Very high	97.2	Very high	17 Å²	17	36.9 Å²	36.9	10%	0.103	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	135.9	174.8	-173	0	0	0	0	108.6	I251 A255 P264 H283	I251-V262 HydrophobicContact CG2-CG1 4.09Å; I251-V262 HydrophobicContact CG2-CG2 3.75Å; A255-V262 HydrophobicContact CB-CG2 3.63Å; V262-P264 VanDerWaalsContact O-CD 3.32Å; V262-P264 WeakPolarHBondContact O-CD 3.16Å; V262-H283 HydrophobicContact CG1-CB 3.89Å
263	C	94.6	Very high	97.1	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.007	21%	0.214	C	C	.	.			trans	-70.2	118.4	172.6	-170.1	0	0	0	0	109.7	Y265 I303 M305	C263-Y265 VanDerWaalsContact C-N 3.26Å; C263-Y265 PolarHBondContact O-N 3.23Å; C263-I303 HydrophobicContact CB-CB 4.04Å; C263-I303 HydrophobicContact CB-CG2 4.43Å; C263-I303 PolarHBondContact N-O 3.37Å; C263-M305 HydrophobicContact CB-CG 4.21Å; C263-M305 HydrophobicContact CB-SD 4.32Å
264	P	93.2	Very high	96.9	Very high	38 Å²	38	35.1 Å²	35.1	25%	0.247	20%	0.197	C	C	.	.	S	Bend	trans	-82.5	-4.6	-175.4	34	-36.7	0	0	0	113.5	V262 H284	V262-P264 VanDerWaalsContact O-CD 3.32Å; V262-P264 WeakPolarHBondContact O-CD 3.16Å; P264-H284 WeakPolarHBondContact CA-ND1 3.41Å; P264-H284 HydrophobicContact CB-CB 4.14Å; P264-H284 PolarHBondContact O-CE1 3Å; P264-H284 PolarHBondContact O-ND1 3.43Å
265	Y	92.8	Very high	96.8	Very high	56 Å²	56	34.8 Å²	34.8	22%	0.22	20%	0.195	C	C	.	.	S	Bend	trans	-100.1	-23.9	-166.8	-55.7	-72.4	0	0	0	114	Y12 C263 E310 F311	Y12-Y265 VanDerWaalsContact CB-O 3.28Å; Y12-Y265 WeakPolarHBondContact CB-O 3.44Å; Y12-Y265 HydrophobicContact CD1-CD1 4.41Å; Y12-Y265 WeakPolarHBondContact CD1-O 3.44Å; Y12-Y265 AromaticContact CE1-CD1 3.6Å; Y12-Y265 HydrophobicContact CE1-CD1 3.6Å; Y12-Y265 HydrophobicContact CE1-CG 4.04Å; Y12-Y265 AromaticContact CZ-CD1 3.94Å; C263-Y265 VanDerWaalsContact C-N 3.26Å; C263-Y265 PolarHBondContact O-N 3.23Å; Y265-E310 PolarHBondContact OH-OE1 2.92Å; Y265-E310 PolarHBondContact OH-OE2 2.87Å; Y265-F311 VanDerWaalsContact CB-CE1 3.5Å; Y265-F311 HydrophobicContact CD1-CE1 4.22Å; Y265-F311 AromaticContact CD2-CD1 3.54Å; Y265-F311 HydrophobicContact CD2-CD1 3.54Å; Y265-F311 AromaticContact CD2-CE1 3.41Å; Y265-F311 HydrophobicContact CD2-CE1 3.41Å; Y265-F311 VanDerWaalsContact CD2-CE1 3.41Å; Y265-F311 HydrophobicContact CE2-CD1 4.13Å; Y265-F311 HydrophobicContact CE2-CE1 4.16Å; Y265-F311 HydrophobicContact CG-CD1 4.08Å; Y265-F311 AromaticContact CG-CE1 3.45Å; Y265-F311 HydrophobicContact CG-CE1 3.45Å; Y265-F311 VanDerWaalsContact CG-CE1 3.45Å; Y265-F311 HydrophobicContact CG-CZ 4.46Å
266	F	93.9	Very high	96.7	Very high	10 Å²	10	35.9 Å²	35.9	4%	0.044	20%	0.2	C	C	.	.			trans	-106	130.7	175.6	-62.5	-74.7	0	0	0	108.8	A15 V176 C177 H178 H283 I303 F311 A320	A15-F266 HydrophobicContact CB-CE1 4.43Å; V176-F266 HydrophobicContact CG1-CD2 3.94Å; V176-F266 HydrophobicContact CG1-CE2 3.87Å; C177-F266 WeakPolarHBondContact SG-CE1 3.27Å; C177-F266 VanDerWaalsContact SG-CE2 3.53Å; C177-F266 WeakPolarHBondContact SG-CZ 3.39Å; H178-F266 AromaticContact CE1-CE1 3.97Å; F266-H283 PolarHBondContact O-ND1 3.16Å; F266-I303 HydrophobicContact CB-CD1 3.67Å; F266-I303 HydrophobicContact CD2-CD1 3.86Å; F266-I303 HydrophobicContact CG-CD1 3.95Å; F266-F311 HydrophobicContact CE2-CD1 4.29Å; F266-F311 AromaticContact CE2-CD2 3.98Å; F266-F311 HydrophobicContact CE2-CD2 3.98Å; F266-F311 HydrophobicContact CE2-CE1 4.23Å; F266-F311 AromaticContact CE2-CE2 3.87Å; F266-F311 HydrophobicContact CE2-CE2 3.87Å; F266-F311 HydrophobicContact CE2-CG 4.18Å; F266-F311 HydrophobicContact CE2-CZ 4.01Å; F266-F311 HydrophobicContact CZ-CD2 4.06Å; F266-F311 AromaticContact CZ-CE2 3.6Å; F266-F311 HydrophobicContact CZ-CE2 3.6Å; F266-F311 AromaticContact CZ-CZ 3.9Å; F266-F311 HydrophobicContact CZ-CZ 3.9Å; F266-A320 HydrophobicContact CE2-CB 3.99Å; F266-A320 HydrophobicContact CZ-CB 3.71Å
267	I	97.3	Very high	96.5	Very high	13 Å²	13	29 Å²	29	7%	0.067	17%	0.169	C	C	.	.			trans	-129.4	152.3	-166.4	59.4	161.7	0	0	0	109	L13 E280 I281 W282	L13-I267 HydrophobicContact CD1-CD1 3.65Å; L13-I267 HydrophobicContact CD1-CG1 4.45Å; L13-I267 HydrophobicContact CD2-CD1 4.24Å; L13-I267 HydrophobicContact CD2-CG1 4.41Å; L13-I267 HydrophobicContact CG-CD1 3.69Å; L13-I267 HydrophobicContact CG-CG1 3.96Å; I267-E280 HydrophobicContact CD1-CB 3.65Å; I267-E280 HydrophobicContact CD1-CG 3.89Å; I267-I281 CarbonylContact C-O 3.59Å; I267-I281 WeakPolarHBondContact CA-O 3.39Å; I267-I281 VanDerWaalsContact CB-O 3.29Å; I267-I281 WeakPolarHBondContact CB-O 3.46Å; I267-W282 HydrophobicContact CG2-CG 4.31Å
268	G	98.4	Very high	96.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	170.2	168.7	0	0	0	0	0	110.4	I281 H283 T299 E301	G268-I281 PolarHBondContact N-O 3.29Å; G268-I281 PolarHBondContact O-N 3.47Å; G268-H283 PolarHBondContact N-CE1 3.38Å; G268-T299 VanDerWaalsContact CA-OG1 3.24Å; G268-T299 WeakPolarHBondContact CA-OG1 3.28Å; G268-E301 WeakPolarHBondContact CA-OE1 3.49Å
269	H	98.2	Very high	96.4	Very high	2 Å²	2	25 Å²	25	1%	0.009	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	154.7	-168.5	59	89.7	0	0	0	112.5	L13 D206 F275 H276 P279 F298 T299 E301	L13-H269 HydrophobicContact CD2-CB 3.42Å; L13-H269 VanDerWaalsContact CD2-CB 3.42Å; D206-H269 IonicContact OD2-CE1 2.87Å; D206-H269 IonicContact OD2-NE2 3.88Å; H269-F275 PolarHBondContact CE1-O 3.49Å; H269-F275 PolarHBondContact ND1-O 2.85Å; H269-H276 AromaticContact CD2-CD2 3.35Å; H269-H276 PolarHBondContact CD2-CD2 3.46Å; H269-H276 AromaticContact CD2-NE2 3.96Å; H269-H276 AromaticContact CE1-CD2 3.59Å; H269-H276 AromaticContact CG-CD2 3.54Å; H269-H276 AromaticContact ND1-CD2 3.7Å; H269-H276 AromaticContact NE2-CD2 3.36Å; H269-H276 PolarHBondContact NE2-CD2 2.89Å; H269-H276 AromaticContact NE2-NE2 3.61Å; H269-P279 CarbonylContact C-O 3.58Å; H269-P279 WeakPolarHBondContact CA-O 3.31Å; H269-F298 CarbonylContact O-C 3.53Å; H269-F298 WeakPolarHBondContact O-CA 3.46Å; H269-F298 VanDerWaalsContact O-CB 3.27Å; H269-F298 WeakPolarHBondContact O-CB 3.25Å; H269-T299 PolarHBondContact CD2-OG1 3.47Å; H269-T299 VanDerWaalsContact CD2-OG1 3.29Å; H269-T299 PolarHBondContact N-OG1 3.21Å; H269-T299 PolarHBondContact O-N 3.31Å; H269-E301 IonicContact CD2-OE1 3.18Å; H269-E301 PolarHBondContact CD2-OE1 3.2Å; H269-E301 IonicContact NE2-OE1 2.85Å; H269-E301 PolarHBondContact NE2-OE1 3.02Å
270	G	98.3	Very high	96.3	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	146.5	161.3	0	0	0	0	0	110.7	C277 H278 P279	G270-C277 WeakPolarHBondContact CA-O 3.41Å; G270-C277 PolarHBondContact N-O 3.12Å; G270-C277 PolarHBondContact O-N 2.88Å; G270-C277 PolarHBondContact O-SG 3.42Å; G270-C277 VanDerWaalsContact O-SG 3.39Å; G270-H278 WeakPolarHBondContact CA-O 3.41Å; G270-P279 PolarHBondContact N-O 2.89Å
271	I	98	Very high	96.3	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.113	C	C	.	.			trans	-144.8	148.9	-179.1	-171.7	168.9	0	0	0	110.8	K106 H204 D206 S297 T299 T334	K106-I271 WeakPolarHBondContact CE-O 3.44Å; K106-I271 PolarHBondContact NZ-O 3.42Å; H204-I271 HydrophobicContact CB-CD1 4Å; H204-I271 HydrophobicContact CB-CG1 4Å; D206-I271 HydrophobicContact CB-CD1 3.53Å; I271-S297 PolarHBondContact N-O 3.1Å; I271-S297 PolarHBondContact O-OG 3.46Å; I271-T299 HydrophobicContact CG2-CG2 4.32Å; I271-T334 HydrophobicContact CG2-CG2 3.49Å; I271-T334 VanDerWaalsContact CG2-CG2 3.49Å
272	G	96.8	Very high	96.3	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.01	10%	0.104	C	C	.	.	S	Bend	trans	173.1	-120.6	179.7	0	0	0	0	0	110.8	Y203 H204 Y274	Y203-G272 CarbonylContact C-O 3.5Å; Y203-G272 WeakPolarHBondContact CA-O 3.17Å; H204-G272 PolarHBondContact N-O 2.87Å; G272-Y274 CarbonylContact C-O 3.48Å; G272-Y274 PolarHBondContact N-O 3.13Å; G272-Y274 PolarHBondContact O-N 2.88Å
273	S	95.7	Very high	96.4	Very high	49 Å²	49	20.7 Å²	20.7	34%	0.343	10%	0.099	S	C	.	.	S	Bend	trans	-67.2	-24.6	169.7	53.8	0	0	0	0	113	G202	G202-S273 WeakPolarHBondContact O-CA 3.18Å
274	Y	95	Very high	96.5	Very high	80 Å²	80	23.2 Å²	23.2	31%	0.314	11%	0.111	S	C	.	.	S	Bend	trans	-94	141.9	167.8	-62.2	-87	0	0	0	109.8	P97 E98 W99 P100 H204 G272	P97-Y274 HydrophobicContact CB-CD1 4.4Å; P97-Y274 HydrophobicContact CB-CE1 4.43Å; E98-Y274 WeakPolarHBondContact O-CE1 3.47Å; W99-Y274 HydrophobicContact CB-CD1 4.05Å; W99-Y274 HydrophobicContact CB-CE1 4.38Å; W99-Y274 HydrophobicContact CB-CG 4.24Å; P100-Y274 HydrophobicContact CG-CE2 4.15Å; H204-Y274 VanDerWaalsContact CD2-C 3.49Å; G272-Y274 CarbonylContact C-O 3.48Å; G272-Y274 PolarHBondContact N-O 3.13Å; G272-Y274 PolarHBondContact O-N 2.88Å
275	F	96.3	Very high	96.7	Very high	14 Å²	14	24.2 Å²	24.2	6%	0.061	12%	0.122	C	C	.	.	S	Bend	trans	-63.8	-56.7	173.6	-165.8	163.2	0	0	0	109.6	Y90 P158 Y161 T197 H204 D206 H269	Y90-F275 HydrophobicContact CE1-CD1 4.47Å; P158-F275 HydrophobicContact CG-CZ 4.44Å; Y161-F275 HydrophobicContact CD1-CD1 4.3Å; Y161-F275 HydrophobicContact CD1-CE1 4.29Å; Y161-F275 AromaticContact CD2-CD1 3.69Å; Y161-F275 HydrophobicContact CD2-CD1 3.69Å; Y161-F275 HydrophobicContact CD2-CE1 4.3Å; Y161-F275 HydrophobicContact CE1-CD1 4.39Å; Y161-F275 HydrophobicContact CE2-CB 3.99Å; Y161-F275 AromaticContact CE2-CD1 3.77Å; Y161-F275 HydrophobicContact CE2-CD1 3.77Å; Y161-F275 HydrophobicContact CE2-CG 4.21Å; Y161-F275 AromaticContact CG-CD1 3.95Å; Y161-F275 HydrophobicContact CG-CD1 3.95Å; Y161-F275 HydrophobicContact CG-CE1 4.1Å; T197-F275 HydrophobicContact CG2-CD2 3.98Å; T197-F275 HydrophobicContact CG2-CE1 4.45Å; T197-F275 HydrophobicContact CG2-CE2 3.45Å; T197-F275 VanDerWaalsContact CG2-CE2 3.45Å; T197-F275 HydrophobicContact CG2-CZ 3.71Å; T197-F275 WeakPolarHBondContact OG1-CE2 3.37Å; T197-F275 VanDerWaalsContact OG1-CZ 3.23Å; T197-F275 WeakPolarHBondContact OG1-CZ 3.38Å; H204-F275 PolarHBondContact CD2-N 2.74Å; H204-F275 VanDerWaalsContact CD2-N 3.29Å; D206-F275 WeakPolarHBondContact OD2-CE2 3.49Å; H269-F275 PolarHBondContact CE1-O 3.49Å; H269-F275 PolarHBondContact ND1-O 2.85Å
276	H	95.3	Very high	97	Very high	23 Å²	23	22.7 Å²	22.7	11%	0.106	12%	0.117	C	C	.	.	S	Bend	trans	-119.1	130.5	175	-56.2	84.5	0	0	0	109.5	L13 Y161 H269	L13-H276 HydrophobicContact CD2-CB 4.24Å; Y161-H276 AromaticContact CE1-CE1 3.69Å; Y161-H276 AromaticContact CE1-ND1 3.6Å; Y161-H276 AromaticContact CZ-CE1 3.91Å; Y161-H276 AromaticContact CZ-ND1 3.36Å; Y161-H276 PolarHBondContact OH-ND1 2.97Å; H269-H276 AromaticContact CD2-CD2 3.35Å; H269-H276 PolarHBondContact CD2-CD2 3.46Å; H269-H276 AromaticContact CD2-NE2 3.96Å; H269-H276 AromaticContact CE1-CD2 3.59Å; H269-H276 AromaticContact CG-CD2 3.54Å; H269-H276 AromaticContact ND1-CD2 3.7Å; H269-H276 AromaticContact NE2-CD2 3.36Å; H269-H276 PolarHBondContact NE2-CD2 2.89Å; H269-H276 AromaticContact NE2-NE2 3.61Å
277	C	94.8	Very high	97.2	Very high	8 Å²	8	28.9 Å²	28.9	5%	0.054	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	-171.7	171.7	65.8	0	0	0	0	111.7	W99 G270	W99-C277 HydrophobicContact CB-CB 3.64Å; W99-C277 HydrophobicContact CG-CB 3.82Å; G270-C277 WeakPolarHBondContact CA-O 3.41Å; G270-C277 PolarHBondContact N-O 3.12Å; G270-C277 PolarHBondContact O-N 2.88Å; G270-C277 PolarHBondContact O-SG 3.42Å; G270-C277 VanDerWaalsContact O-SG 3.39Å
278	H	96.3	Very high	97.2	Very high	43 Å²	43	29.3 Å²	29.3	20%	0.199	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	148.8	173.9	-74	-55.6	0	0	0	112.3	W99 D101 I103 G270	W99-H278 AromaticContact CD1-CD2 3.99Å; W99-H278 AromaticContact NE1-NE2 3.89Å; D101-H278 IonicContact OD1-NE2 2.86Å; I103-H278 HydrophobicContact CG1-CB 3.96Å; G270-H278 WeakPolarHBondContact CA-O 3.41Å
279	P	97.1	Very high	97.1	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-79.6	162.8	6.9	32.2	-36.7	0	0	0	114.5	I103 L244 H269 G270 I281 F298	I103-P279 HydrophobicContact CD1-CB 3.88Å; I103-P279 HydrophobicContact CG1-CB 4.07Å; L244-P279 HydrophobicContact CD1-CB 3.63Å; L244-P279 HydrophobicContact CD1-CG 4.31Å; H269-P279 CarbonylContact C-O 3.58Å; H269-P279 WeakPolarHBondContact CA-O 3.31Å; G270-P279 PolarHBondContact N-O 2.89Å; P279-I281 HydrophobicContact CB-CD1 4.13Å; P279-I281 HydrophobicContact CG-CD1 3.74Å; P279-I281 HydrophobicContact CG-CG1 4.43Å; P279-F298 HydrophobicContact CG-CB 4.06Å; P279-F298 HydrophobicContact CG-CD1 4.07Å; P279-F298 HydrophobicContact CG-CG 4.25Å
280	E	96.3	Very high	97.1	Very high	30 Å²	30	38 Å²	38	14%	0.14	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	123.7	164.9	-60.7	-169	173.6	0	0	109.1	N9 L13 I267 W282	N9-E280 PolarHBondContact ND2-OE2 3.28Å; L13-E280 HydrophobicContact CD1-CG 3.97Å; I267-E280 HydrophobicContact CD1-CB 3.65Å; I267-E280 HydrophobicContact CD1-CG 3.89Å; E280-W282 PolarHBondContact OE2-NE1 3.12Å
281	I	98.4	Very high	97.1	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	101.5	-177.2	-52.8	-61	0	0	0	110.1	L244 I247 I267 G268 P279 F298	L244-I281 HydrophobicContact CD1-CD1 3.97Å; L244-I281 HydrophobicContact CD2-CD1 3.7Å; L244-I281 HydrophobicContact CG-CD1 4.37Å; I247-I281 HydrophobicContact CB-CG2 4.42Å; I247-I281 HydrophobicContact CD1-CD1 4.41Å; I247-I281 HydrophobicContact CD1-CG2 3.76Å; I247-I281 HydrophobicContact CG2-CG2 3.77Å; I267-I281 CarbonylContact C-O 3.59Å; I267-I281 WeakPolarHBondContact CA-O 3.39Å; I267-I281 VanDerWaalsContact CB-O 3.29Å; I267-I281 WeakPolarHBondContact CB-O 3.46Å; G268-I281 PolarHBondContact N-O 3.29Å; G268-I281 PolarHBondContact O-N 3.47Å; P279-I281 HydrophobicContact CB-CD1 4.13Å; P279-I281 HydrophobicContact CG-CD1 3.74Å; P279-I281 HydrophobicContact CG-CG1 4.43Å; I281-F298 HydrophobicContact CD1-CB 4.31Å; I281-F298 HydrophobicContact CD1-CD1 4.41Å; I281-F298 HydrophobicContact CD1-CD2 3.67Å; I281-F298 HydrophobicContact CD1-CE2 4Å; I281-F298 HydrophobicContact CD1-CG 3.89Å; I281-F298 HydrophobicContact CG1-CB 4.05Å; I281-F298 HydrophobicContact CG1-CD2 3.67Å; I281-F298 HydrophobicContact CG1-CE2 4.36Å; I281-F298 HydrophobicContact CG1-CG 4.02Å
282	W	98.4	Very high	97.2	Very high	64 Å²	64	40.8 Å²	40.8	24%	0.242	22%	0.216	C	C	.	.			trans	-83.6	127.4	-178.8	-59.4	-2.8	0	0	0	111.1	G248 I267 E280 N286	G248-W282 WeakPolarHBondContact CA-O 3.38Å; G248-W282 PolarHBondContact N-O 3Å; I267-W282 HydrophobicContact CG2-CG 4.31Å; E280-W282 PolarHBondContact OE2-NE1 3.12Å; W282-N286 HydrophobicContact CE3-CB 3.58Å; W282-N286 HydrophobicContact CZ3-CB 4.08Å; W282-N286 PolarHBondContact O-ND2 2.94Å
283	H	98.5	Very high	97.2	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	24%	0.237	C	C	.	.			trans	-88	-13.6	-177.9	-56.4	119.7	0	0	0	114.4	G248 I251 V262 F266 G268 E301 P302	G248-H283 WeakPolarHBondContact CA-O 3.49Å; I251-H283 WeakPolarHBondContact CB-O 3.32Å; I251-H283 HydrophobicContact CD1-CB 4.03Å; I251-H283 WeakPolarHBondContact CG2-O 3.42Å; V262-H283 HydrophobicContact CG1-CB 3.89Å; F266-H283 PolarHBondContact O-ND1 3.16Å; G268-H283 PolarHBondContact N-CE1 3.38Å; H283-E301 VanDerWaalsContact CE1-C 3.46Å; H283-E301 WeakPolarHBondContact CE1-CG 3.31Å; H283-E301 PolarHBondContact NE2-N 2.83Å; H283-P302 HydrophobicContact CB-CB 4.18Å
284	H	97.6	Very high	97.4	Very high	54 Å²	54	47.8 Å²	47.8	25%	0.25	25%	0.246	C	C	.	.	S	Bend	trans	-91.2	158	173.1	65.7	-84.3	0	0	0	110.5	G248 S252 P264 N286	G248-H284 WeakPolarHBondContact CA-O 3.44Å; G248-H284 CarbonylContact O-C 3.46Å; S252-H284 WeakPolarHBondContact OG-CA 3.39Å; P264-H284 WeakPolarHBondContact CA-ND1 3.41Å; P264-H284 HydrophobicContact CB-CB 4.14Å; P264-H284 PolarHBondContact O-CE1 3Å; P264-H284 PolarHBondContact O-ND1 3.43Å; H284-N286 PolarHBondContact O-N 2.8Å; H284-N286 PolarHBondContact O-ND2 3.19Å
285	A	98.1	Very high	97.5	Very high	58 Å²	58	44.1 Å²	44.1	48%	0.479	23%	0.233	S	C	.	.	S	Bend	trans	-57.4	131.3	179.8	0	0	0	0	0	111.3	G248 N249 S252	G248-A285 PolarHBondContact O-N 2.88Å; N249-A285 WeakPolarHBondContact OD1-CA 3.38Å; N249-A285 WeakPolarHBondContact OD1-CB 3.38Å; S252-A285 PolarHBondContact OG-N 2.67Å
286	N	98.3	Very high	97.6	Very high	24 Å²	24	43.8 Å²	43.8	13%	0.128	23%	0.231	C	C	.	.			trans	-157.8	179.7	-170.8	69.3	83.4	0	0	0	112.5	C245 N249 W282 H284 N288	C245-N286 WeakPolarHBondContact CA-OD1 3.38Å; C245-N286 WeakPolarHBondContact CB-O 3.25Å; C245-N286 VanDerWaalsContact CB-OD1 3.31Å; C245-N286 WeakPolarHBondContact CB-OD1 3.5Å; N249-N286 PolarHBondContact ND2-O 3.44Å; N249-N286 PolarHBondContact OD1-N 2.77Å; N249-N286 PolarHBondContact OD1-O 3.18Å; W282-N286 HydrophobicContact CE3-CB 3.58Å; W282-N286 HydrophobicContact CZ3-CB 4.08Å; W282-N286 PolarHBondContact O-ND2 2.94Å; H284-N286 PolarHBondContact O-N 2.8Å; H284-N286 PolarHBondContact O-ND2 3.19Å; N286-N288 WeakPolarHBondContact OD1-CB 3.18Å; N286-N288 PolarHBondContact OD1-N 3.14Å
287	D	97.9	Very high	97.8	Very high	140 Å²	140	42.8 Å²	42.8	75%	0.749	23%	0.227	S	C	*	.			trans	-120.5	26.2	-177.3	62.2	-13.3	0	0	0	113.4	D289	D287-D289 PolarHBondContact O-N 2.82Å; D287-D289 VanDerWaalsContact O-N 3.15Å
288	N	96.8	Very high	98	Very high	22 Å²	22	42.4 Å²	42.4	12%	0.118	23%	0.225	C	C	.	.			trans	-63.7	110.5	175.1	-174.9	-17.1	0	0	0	111.6	C245 N286 I290	C245-N288 HydrophobicContact CB-CB 4.36Å; C245-N288 WeakPolarHBondContact CB-O 3.2Å; C245-N288 PolarHBondContact N-O 3.29Å; N286-N288 WeakPolarHBondContact OD1-CB 3.18Å; N286-N288 PolarHBondContact OD1-N 3.14Å; N288-I290 WeakPolarHBondContact OD1-CB 3.37Å; N288-I290 VanDerWaalsContact OD1-CG1 3.31Å; N288-I290 WeakPolarHBondContact OD1-CG1 3.49Å; N288-I290 PolarHBondContact OD1-N 3.25Å; N288-I290 VanDerWaalsContact OD1-N 3.07Å
289	D	97.8	Very high	98.1	Very high	118 Å²	118	40.4 Å²	40.4	63%	0.631	22%	0.215	S	C	*	.			trans	-93.1	5.8	-173.7	64.1	-11.1	0	0	0	114	D287 T291	D287-D289 PolarHBondContact O-N 2.82Å; D287-D289 VanDerWaalsContact O-N 3.15Å; D289-T291 PolarHBondContact O-N 2.72Å
290	I	98.1	Very high	98.2	Very high	67 Å²	67	40.3 Å²	40.3	34%	0.344	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-61.6	128.8	173.7	-66	171.6	0	0	0	108.9	I103 E243 L244 N288	I103-I290 HydrophobicContact CD1-CG2 3.66Å; E243-I290 CarbonylContact C-O 3.53Å; E243-I290 VanDerWaalsContact CA-O 3.28Å; E243-I290 WeakPolarHBondContact CA-O 3.49Å; L244-I290 HydrophobicContact CD1-CB 3.8Å; L244-I290 HydrophobicContact CD1-CD1 4.42Å; L244-I290 HydrophobicContact CD1-CG2 3.74Å; L244-I290 HydrophobicContact CG-CB 4.1Å; L244-I290 HydrophobicContact CG-CG2 4.11Å; L244-I290 WeakPolarHBondContact CG-O 3.29Å; L244-I290 PolarHBondContact N-O 2.55Å; N288-I290 WeakPolarHBondContact OD1-CB 3.37Å; N288-I290 VanDerWaalsContact OD1-CG1 3.31Å; N288-I290 WeakPolarHBondContact OD1-CG1 3.49Å; N288-I290 PolarHBondContact OD1-N 3.25Å; N288-I290 VanDerWaalsContact OD1-N 3.07Å
291	T	98.3	Very high	98.3	Very high	58 Å²	58	39.8 Å²	39.8	36%	0.356	21%	0.212	S	C	.	.	B	Isolated β-bridge	trans	-86.2	139.7	178.6	-57.6	0	0	0	0	111.2	A242 D289 M296	A242-T291 CarbonylContact O-C 3.57Å; A242-T291 WeakPolarHBondContact O-CA 3.43Å; D289-T291 PolarHBondContact O-N 2.72Å; T291-M296 WeakPolarHBondContact O-CE 3.16Å
292	M	98.7	Very high	98.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-73.3	124.7	171.3	-65.3	177.9	-160.9	0	0	110.2	C238 K239 P240 G241 A242 L244 V246 I247 F298 I337	C238-M292 HydrophobicContact CB-CE 4.35Å; C238-M292 HydrophobicContact CB-SD 3.84Å; K239-M292 WeakPolarHBondContact O-CB 3.42Å; P240-M292 CarbonylContact C-O 3.51Å; P240-M292 VanDerWaalsContact CA-O 3.29Å; P240-M292 WeakPolarHBondContact CA-O 3.4Å; G241-M292 PolarHBondContact N-O 3.45Å; A242-M292 HydrophobicContact CB-SD 4.35Å; A242-M292 WeakPolarHBondContact O-CG 3.02Å; A242-M292 PolarHBondContact O-N 3Å; L244-M292 HydrophobicContact CD2-CE 3.8Å; L244-M292 HydrophobicContact CD2-CG 3.67Å; V246-M292 HydrophobicContact CG2-CE 4.17Å; I247-M292 HydrophobicContact CD1-CE 3.58Å; I247-M292 HydrophobicContact CG1-CE 3.88Å; M292-F298 HydrophobicContact CE-CZ 4.35Å; M292-F298 HydrophobicContact SD-CZ 4.17Å; M292-I337 HydrophobicContact CB-CD1 4.36Å; M292-I337 HydrophobicContact CB-CG1 4.21Å; M292-I337 HydrophobicContact CB-CG2 4.47Å; M292-I337 HydrophobicContact CG-CD1 4.42Å; M292-I337 HydrophobicContact SD-CD1 3.8Å
293	D	98.4	Very high	98.3	Very high	82 Å²	82	36.8 Å²	36.8	44%	0.439	20%	0.201	S	C	.	.			trans	-109.7	151.9	174.4	-63.7	-47.5	0	0	0	111.3	I105 G295 M296 I337	I105-D293 HydrophobicContact CD1-CB 3.91Å; D293-G295 PolarHBondContact O-N 2.98Å; D293-M296 HydrophobicContact CB-CE 3.85Å; D293-M296 HydrophobicContact CB-CG 4.26Å; D293-M296 HydrophobicContact CB-SD 4.4Å; D293-M296 PolarHBondContact N-SD 3.41Å; D293-M296 VanDerWaalsContact N-SD 3.37Å; D293-M296 VanDerWaalsContact O-CB 3.31Å; D293-M296 WeakPolarHBondContact O-CB 3.44Å; D293-M296 VanDerWaalsContact O-CG 3.3Å; D293-M296 WeakPolarHBondContact O-CG 3.22Å; D293-M296 PolarHBondContact O-N 3.48Å; D293-M296 VanDerWaalsContact O-N 3.12Å; D293-M296 WeakPolarHBondContact OD2-CE 3.47Å; D293-I337 WeakPolarHBondContact O-CB 3.4Å; D293-I337 WeakPolarHBondContact O-CG2 3.23Å
294	E	98.6	Very high	98.4	Very high	115 Å²	115	36.7 Å²	36.7	54%	0.537	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	134.5	172	179.1	177.4	-169	0	0	110.8	I105 M296 A339	I105-E294 WeakPolarHBondContact CG2-O 3.34Å; E294-M296 VanDerWaalsContact C-N 3.34Å; E294-A339 PolarHBondContact OE1-N 3.05Å
295	G	98.4	Very high	98.4	Very high	4 Å²	4	34.2 Å²	34.2	4%	0.041	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.8	-7.8	-178	0	0	0	0	0	114.5	K106 D293 I337	K106-G295 PolarHBondContact N-O 3.3Å; D293-G295 PolarHBondContact O-N 2.98Å; G295-I337 PolarHBondContact N-O 3.38Å
296	M	98.6	Very high	98.4	Very high	6 Å²	6	33.1 Å²	33.1	3%	0.03	17%	0.174	C	C	.	.			trans	-65.9	136.8	167.2	-70.6	-169.2	178.9	0	0	110.5	I103 I105 T291 D293 E294 F298 L336 I337	I103-M296 HydrophobicContact CB-CE 4.21Å; I103-M296 HydrophobicContact CD1-CE 3.99Å; I103-M296 HydrophobicContact CG2-CE 3.66Å; I103-M296 HydrophobicContact CG2-CG 3.77Å; I103-M296 HydrophobicContact CG2-SD 3.81Å; I105-M296 HydrophobicContact CD1-CE 4.14Å; I105-M296 HydrophobicContact CD1-CG 3.5Å; T291-M296 WeakPolarHBondContact O-CE 3.16Å; D293-M296 HydrophobicContact CB-CE 3.85Å; D293-M296 HydrophobicContact CB-CG 4.26Å; D293-M296 HydrophobicContact CB-SD 4.4Å; D293-M296 PolarHBondContact N-SD 3.41Å; D293-M296 VanDerWaalsContact N-SD 3.37Å; D293-M296 VanDerWaalsContact O-CB 3.31Å; D293-M296 WeakPolarHBondContact O-CB 3.44Å; D293-M296 VanDerWaalsContact O-CG 3.3Å; D293-M296 WeakPolarHBondContact O-CG 3.22Å; D293-M296 PolarHBondContact O-N 3.48Å; D293-M296 VanDerWaalsContact O-N 3.12Å; D293-M296 WeakPolarHBondContact OD2-CE 3.47Å; E294-M296 VanDerWaalsContact C-N 3.34Å; M296-F298 HydrophobicContact CB-CD1 4.44Å; M296-F298 HydrophobicContact CB-CE1 4.45Å; M296-L336 WeakPolarHBondContact O-CA 3.45Å; M296-I337 HydrophobicContact CB-CB 4.44Å; M296-I337 HydrophobicContact CB-CG1 4.14Å; M296-I337 PolarHBondContact O-N 2.76Å
297	S	98.6	Very high	98.3	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.021	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	134.6	172	65.3	0	0	0	0	111.6	K106 L114 I271 V335	K106-S297 VanDerWaalsContact CD-OG 3.31Å; K106-S297 WeakPolarHBondContact CD-OG 3.41Å; K106-S297 WeakPolarHBondContact CE-OG 3.46Å; K106-S297 PolarHBondContact NZ-OG 3.4Å; L114-S297 WeakPolarHBondContact CD2-OG 3.15Å; I271-S297 PolarHBondContact N-O 3.1Å; I271-S297 PolarHBondContact O-OG 3.46Å; S297-V335 WeakPolarHBondContact CA-O 3.38Å; S297-V335 VanDerWaalsContact CB-O 3.32Å; S297-V335 WeakPolarHBondContact CB-O 3.03Å
298	F	98.8	Very high	98.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	167.3	-176.1	53.2	-95.5	0	0	0	111.3	L244 I247 H269 P279 I281 M292 M296 I300 V335 I337	L244-F298 HydrophobicContact CD2-CZ 4.46Å; I247-F298 HydrophobicContact CD1-CE2 3.77Å; I247-F298 HydrophobicContact CD1-CZ 4.22Å; H269-F298 CarbonylContact O-C 3.53Å; H269-F298 WeakPolarHBondContact O-CA 3.46Å; H269-F298 VanDerWaalsContact O-CB 3.27Å; H269-F298 WeakPolarHBondContact O-CB 3.25Å; P279-F298 HydrophobicContact CG-CB 4.06Å; P279-F298 HydrophobicContact CG-CD1 4.07Å; P279-F298 HydrophobicContact CG-CG 4.25Å; I281-F298 HydrophobicContact CD1-CB 4.31Å; I281-F298 HydrophobicContact CD1-CD1 4.41Å; I281-F298 HydrophobicContact CD1-CD2 3.67Å; I281-F298 HydrophobicContact CD1-CE2 4Å; I281-F298 HydrophobicContact CD1-CG 3.89Å; I281-F298 HydrophobicContact CG1-CB 4.05Å; I281-F298 HydrophobicContact CG1-CD2 3.67Å; I281-F298 HydrophobicContact CG1-CE2 4.36Å; I281-F298 HydrophobicContact CG1-CG 4.02Å; M292-F298 HydrophobicContact CE-CZ 4.35Å; M292-F298 HydrophobicContact SD-CZ 4.17Å; M296-F298 HydrophobicContact CB-CD1 4.44Å; M296-F298 HydrophobicContact CB-CE1 4.45Å; F298-I300 HydrophobicContact CD2-CG1 4.14Å; F298-I300 HydrophobicContact CE2-CD1 4.05Å; F298-I300 HydrophobicContact CE2-CG1 3.91Å; F298-V335 HydrophobicContact CD2-CG2 3.87Å; F298-V335 HydrophobicContact CE2-CG2 3.68Å; F298-V335 HydrophobicContact CG-CG2 4.43Å; F298-V335 HydrophobicContact CZ-CG2 4.07Å; F298-V335 PolarHBondContact N-O 3.38Å; F298-V335 VanDerWaalsContact N-O 3.14Å; F298-V335 WeakPolarHBondContact O-CG2 3.29Å; F298-V335 PolarHBondContact O-N 2.91Å; F298-I337 HydrophobicContact CE1-CD1 3.98Å; F298-I337 HydrophobicContact CE1-CG1 3.78Å; F298-I337 HydrophobicContact CZ-CD1 3.93Å; F298-I337 HydrophobicContact CZ-CG1 4.27Å
299	T	98.9	Very high	98.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	147	174.6	65.5	0	0	0	0	110.9	D206 G268 H269 I271 E301 E332 H333	D206-T299 HydrophobicContact CB-CG2 4.22Å; G268-T299 VanDerWaalsContact CA-OG1 3.24Å; G268-T299 WeakPolarHBondContact CA-OG1 3.28Å; H269-T299 PolarHBondContact CD2-OG1 3.47Å; H269-T299 VanDerWaalsContact CD2-OG1 3.29Å; H269-T299 PolarHBondContact N-OG1 3.21Å; H269-T299 PolarHBondContact O-N 3.31Å; I271-T299 HydrophobicContact CG2-CG2 4.32Å; T299-E301 WeakPolarHBondContact CB-OE1 3.39Å; T299-E301 PolarHBondContact OG1-OE1 2.96Å; T299-E332 WeakPolarHBondContact CB-OE1 3.49Å; T299-E332 VanDerWaalsContact CG2-OE1 3.29Å; T299-E332 WeakPolarHBondContact CG2-OE1 3.45Å; T299-H333 WeakPolarHBondContact CA-O 3.39Å
300	I	98.9	Very high	98	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	110.3	163.6	-62	-175.6	0	0	0	106.1	A234 I235 I247 I251 F298 E332 H333	A234-I300 HydrophobicContact CB-CG2 4.03Å; I235-I300 HydrophobicContact CG1-CB 4.36Å; I235-I300 HydrophobicContact CG1-CD1 3.79Å; I247-I300 HydrophobicContact CD1-CD1 3.82Å; I247-I300 HydrophobicContact CD1-CG1 4.26Å; I247-I300 HydrophobicContact CG1-CD1 4.12Å; I247-I300 HydrophobicContact CG2-CD1 4.31Å; I247-I300 HydrophobicContact CG2-CG2 4.26Å; I251-I300 HydrophobicContact CD1-CG2 4.46Å; F298-I300 HydrophobicContact CD2-CG1 4.14Å; F298-I300 HydrophobicContact CE2-CD1 4.05Å; F298-I300 HydrophobicContact CE2-CG1 3.91Å; I300-E332 VanDerWaalsContact O-CA 3.31Å; I300-E332 WeakPolarHBondContact O-CA 3.16Å; I300-H333 PolarHBondContact N-O 2.91Å; I300-H333 PolarHBondContact O-N 3.44Å
301	E	98.7	Very high	98	Very high	18 Å²	18	24.5 Å²	24.5	8%	0.084	13%	0.13	C	C	.	.			trans	-135.5	49.3	-165.5	61.8	-176.9	87	0	0	113.7	G268 H269 H283 T299 I303 Q330 F331 E332	G268-E301 WeakPolarHBondContact CA-OE1 3.49Å; H269-E301 IonicContact CD2-OE1 3.18Å; H269-E301 PolarHBondContact CD2-OE1 3.2Å; H269-E301 IonicContact NE2-OE1 2.85Å; H269-E301 PolarHBondContact NE2-OE1 3.02Å; H283-E301 VanDerWaalsContact CE1-C 3.46Å; H283-E301 WeakPolarHBondContact CE1-CG 3.31Å; H283-E301 PolarHBondContact NE2-N 2.83Å; T299-E301 WeakPolarHBondContact CB-OE1 3.39Å; T299-E301 PolarHBondContact OG1-OE1 2.96Å; E301-I303 PolarHBondContact O-N 2.77Å; E301-Q330 PolarHBondContact O-NE2 3.47Å; E301-F331 VanDerWaalsContact CA-O 3.32Å; E301-F331 WeakPolarHBondContact CA-O 3.19Å; E301-E332 HydrophobicContact CB-CB 3.7Å; E301-E332 HydrophobicContact CB-CG 3.65Å
302	P	98.6	Very high	97.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.135	C	C	.	.			trans	-59.7	133.1	-173.2	25	-34.9	0	0	0	112.9	C230 R231 I251 H283 Q330 F331	C230-P302 HydrophobicContact CB-CG 4.21Å; R231-P302 HydrophobicContact CB-CG 3.79Å; I251-P302 HydrophobicContact CD1-CB 4.04Å; I251-P302 HydrophobicContact CD1-CG 4.25Å; I251-P302 HydrophobicContact CG1-CB 4.44Å; I251-P302 HydrophobicContact CG2-CB 3.88Å; H283-P302 HydrophobicContact CB-CB 4.18Å; P302-Q330 WeakPolarHBondContact O-CA 3.18Å; P302-F331 WeakPolarHBondContact CD-O 3.2Å
303	I	98.7	Very high	97.8	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.01	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	111.7	169.7	-48.9	179.2	0	0	0	109.2	V176 C177 C263 F266 E301 M305 Q330	V176-I303 HydrophobicContact CG1-CD1 3.87Å; V176-I303 HydrophobicContact CG1-CG2 3.81Å; C177-I303 HydrophobicContact CB-CD1 3.82Å; C263-I303 HydrophobicContact CB-CB 4.04Å; C263-I303 HydrophobicContact CB-CG2 4.43Å; C263-I303 PolarHBondContact N-O 3.37Å; F266-I303 HydrophobicContact CB-CD1 3.67Å; F266-I303 HydrophobicContact CD2-CD1 3.86Å; F266-I303 HydrophobicContact CG-CD1 3.95Å; E301-I303 PolarHBondContact O-N 2.77Å; I303-M305 HydrophobicContact CG2-SD 4.06Å; I303-Q330 HydrophobicContact CG1-CB 4.11Å; I303-Q330 HydrophobicContact CG1-CG 3.86Å
304	V	98.8	Very high	97.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	134.8	177.9	-175.7	0	0	0	0	109.5	L223 A227 C230 A255 F260 Q261 S328 A329	L223-V304 HydrophobicContact CD1-CB 4.26Å; L223-V304 HydrophobicContact CD1-CG1 3.77Å; A227-V304 HydrophobicContact CB-CB 4.02Å; A227-V304 HydrophobicContact CB-CG2 3.87Å; C230-V304 HydrophobicContact CB-CG2 4.45Å; A255-V304 HydrophobicContact CB-CG1 4.41Å; F260-V304 HydrophobicContact CB-CG1 3.54Å; F260-V304 HydrophobicContact CD2-CG1 4.36Å; F260-V304 HydrophobicContact CG-CG1 4.11Å; Q261-V304 CarbonylContact O-C 3.53Å; Q261-V304 WeakPolarHBondContact O-CA 3.26Å; V304-S328 CarbonylContact O-C 3.55Å; V304-S328 WeakPolarHBondContact O-CA 3.45Å; V304-A329 PolarHBondContact N-O 3.48Å; V304-A329 PolarHBondContact O-N 3.39Å
305	M	98.5	Very high	97.5	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129.6	-171.3	-54.9	-69.1	-67.4	0	0	110.1	V176 Q261 C263 I303 G307 S308 S328	V176-M305 HydrophobicContact CG1-SD 4.23Å; V176-M305 HydrophobicContact CG2-CE 3.74Å; V176-M305 HydrophobicContact CG2-SD 4.05Å; Q261-M305 HydrophobicContact CB-CB 4.42Å; Q261-M305 PolarHBondContact N-O 3.24Å; Q261-M305 PolarHBondContact O-N 3.21Å; C263-M305 HydrophobicContact CB-CG 4.21Å; C263-M305 HydrophobicContact CB-SD 4.32Å; I303-M305 HydrophobicContact CG2-SD 4.06Å; M305-G307 PolarHBondContact O-N 3.49Å; M305-S308 VanDerWaalsContact CE-O 3.3Å; M305-S308 WeakPolarHBondContact CE-O 3.42Å; M305-S328 VanDerWaalsContact SD-CB 3.58Å
306	E	98.3	Very high	97.3	Very high	35 Å²	35	35 Å²	35	16%	0.164	17%	0.167	C	C	.	.	S	Bend	trans	-68.5	-22.3	172.3	-178.7	-178.1	-173.1	0	0	112.3	H67 V219 L223 K326 R327	H67-E306 IonicContact CE1-OE2 3.59Å; V219-E306 HydrophobicContact CG1-CG 4.2Å; V219-E306 VanDerWaalsContact CG1-OE1 3.27Å; V219-E306 WeakPolarHBondContact CG1-OE1 3.33Å; L223-E306 HydrophobicContact CD2-CB 4.14Å; E306-K326 HydrophobicContact CB-CB 4.2Å; E306-K326 HydrophobicContact CG-CB 4.46Å; E306-K326 HydrophobicContact CG-CD 4.35Å; E306-R327 HydrophobicContact CB-CB 4.43Å; E306-R327 VanDerWaalsContact CB-O 3.28Å; E306-R327 WeakPolarHBondContact CB-O 3.35Å; E306-R327 PolarHBondContact N-O 3.26Å; E306-R327 IonicContact OE1-CZ 3.65Å; E306-R327 IonicContact OE1-NE 2.91Å; E306-R327 IonicContact OE1-NH2 3.41Å; E306-R327 PolarHBondContact OE1-NH2 2.96Å; E306-R327 VanDerWaalsContact OE2-CB 3.29Å; E306-R327 WeakPolarHBondContact OE2-CB 3.44Å; E306-R327 IonicContact OE2-CZ 3.56Å; E306-R327 PolarHBondContact OE2-N 2.78Å; E306-R327 VanDerWaalsContact OE2-N 3.13Å; E306-R327 IonicContact OE2-NE 3.58Å; E306-R327 PolarHBondContact OE2-NE 3.19Å; E306-R327 IonicContact OE2-NH2 3.72Å; E306-R327 PolarHBondContact OE2-NH2 2.81Å
307	G	96.1	Very high	97.2	Very high	7 Å²	7	40.7 Å²	40.7	7%	0.072	19%	0.191	C	C	.	.	S	Bend	trans	-125.9	-143.1	-172.8	0	0	0	0	0	113.3	Q261 M305 D324	Q261-G307 PolarHBondContact OE1-O 3.4Å; M305-G307 PolarHBondContact O-N 3.49Å; G307-D324 VanDerWaalsContact CA-OD2 3.29Å; G307-D324 WeakPolarHBondContact CA-OD2 3.38Å
308	S	96.1	Very high	97.1	Very high	32 Å²	32	41.7 Å²	41.7	22%	0.224	20%	0.195	C	C	.	.			trans	-55.6	144.2	172.2	-175.7	0	0	0	0	111.4	M305 E310 D324	M305-S308 VanDerWaalsContact CE-O 3.3Å; M305-S308 WeakPolarHBondContact CE-O 3.42Å; S308-E310 PolarHBondContact O-N 2.98Å; S308-E310 WeakPolarHBondContact OG-CB 3.44Å; S308-E310 WeakPolarHBondContact OG-CG 3.1Å; S308-E310 PolarHBondContact OG-N 2.87Å; S308-D324 PolarHBondContact N-OD2 3.11Å
309	P	95	Very high	97	Very high	26 Å²	26	42.2 Å²	42.2	17%	0.169	20%	0.198	C	C	.	.	S	Bend	trans	-78.4	-6.5	173.6	35.9	-36.4	0	0	0	112.4	Q261	Q261-P309 HydrophobicContact CB-CB 4.49Å; Q261-P309 VanDerWaalsContact OE1-CD 3.31Å
310	E	95.9	Very high	97	Very high	88 Å²	88	42.2 Å²	42.2	41%	0.411	20%	0.198	S	C	.	.			trans	-77	142.6	-178.2	-61.3	-64.8	154.4	0	0	111.1	Y265 S308 V323	Y265-E310 PolarHBondContact OH-OE1 2.92Å; Y265-E310 PolarHBondContact OH-OE2 2.87Å; S308-E310 PolarHBondContact O-N 2.98Å; S308-E310 WeakPolarHBondContact OG-CB 3.44Å; S308-E310 WeakPolarHBondContact OG-CG 3.1Å; S308-E310 PolarHBondContact OG-N 2.87Å; E310-V323 HydrophobicContact CB-CB 4.48Å; E310-V323 HydrophobicContact CB-CG1 4.03Å; E310-V323 HydrophobicContact CB-CG2 3.63Å; E310-V323 PolarHBondContact O-N 3.25Å; E310-V323 VanDerWaalsContact O-N 3.1Å
311	F	96.8	Very high	97	Very high	38 Å²	38	42.3 Å²	42.3	17%	0.167	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	169.1	179.7	76.7	-75	0	0	0	111.4	Y12 V176 Y265 F266 I313 A320 V321	Y12-F311 HydrophobicContact CE1-CZ 4.48Å; V176-F311 HydrophobicContact CG2-CB 4.23Å; Y265-F311 VanDerWaalsContact CB-CE1 3.5Å; Y265-F311 HydrophobicContact CD1-CE1 4.22Å; Y265-F311 AromaticContact CD2-CD1 3.54Å; Y265-F311 HydrophobicContact CD2-CD1 3.54Å; Y265-F311 AromaticContact CD2-CE1 3.41Å; Y265-F311 HydrophobicContact CD2-CE1 3.41Å; Y265-F311 VanDerWaalsContact CD2-CE1 3.41Å; Y265-F311 HydrophobicContact CE2-CD1 4.13Å; Y265-F311 HydrophobicContact CE2-CE1 4.16Å; Y265-F311 HydrophobicContact CG-CD1 4.08Å; Y265-F311 AromaticContact CG-CE1 3.45Å; Y265-F311 HydrophobicContact CG-CE1 3.45Å; Y265-F311 VanDerWaalsContact CG-CE1 3.45Å; Y265-F311 HydrophobicContact CG-CZ 4.46Å; F266-F311 HydrophobicContact CE2-CD1 4.29Å; F266-F311 AromaticContact CE2-CD2 3.98Å; F266-F311 HydrophobicContact CE2-CD2 3.98Å; F266-F311 HydrophobicContact CE2-CE1 4.23Å; F266-F311 AromaticContact CE2-CE2 3.87Å; F266-F311 HydrophobicContact CE2-CE2 3.87Å; F266-F311 HydrophobicContact CE2-CG 4.18Å; F266-F311 HydrophobicContact CE2-CZ 4.01Å; F266-F311 HydrophobicContact CZ-CD2 4.06Å; F266-F311 AromaticContact CZ-CE2 3.6Å; F266-F311 HydrophobicContact CZ-CE2 3.6Å; F266-F311 AromaticContact CZ-CZ 3.9Å; F266-F311 HydrophobicContact CZ-CZ 3.9Å; F311-I313 HydrophobicContact CD2-CG1 4.28Å; F311-I313 HydrophobicContact CE2-CD1 4.17Å; F311-I313 HydrophobicContact CE2-CG1 3.74Å; F311-A320 HydrophobicContact CD2-CB 3.78Å; F311-A320 HydrophobicContact CE2-CB 4.3Å; F311-V321 CarbonylContact C-O 3.52Å; F311-V321 VanDerWaalsContact CA-O 3.23Å; F311-V321 WeakPolarHBondContact CA-O 3.15Å; F311-V321 WeakPolarHBondContact CB-O 3.28Å
312	R	95.7	Very high	96.9	Very high	122 Å²	122	41.4 Å²	41.4	46%	0.46	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	142.9	168.2	62	-175.9	-180	77.4	8.1	110.1	V321	R312-V321 HydrophobicContact CG-CG2 3.66Å; R312-V321 PolarHBondContact N-O 3.49Å; R312-V321 PolarHBondContact O-N 3.04Å
313	I	96.6	Very high	96.8	Very high	81 Å²	81	44.8 Å²	44.8	42%	0.415	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	134.2	174.3	-61.1	170.6	0	0	0	109.2	F311 K317	F311-I313 HydrophobicContact CD2-CG1 4.28Å; F311-I313 HydrophobicContact CE2-CD1 4.17Å; F311-I313 HydrophobicContact CE2-CG1 3.74Å; I313-K317 VanDerWaalsContact CG2-C 3.46Å; I313-K317 WeakPolarHBondContact CG2-O 3.33Å
314	L	96.2	Very high	96.7	Very high	24 Å²	24	47.6 Å²	47.6	13%	0.126	23%	0.23	C	C	.	.			trans	-73.8	174.6	178.7	-61.3	-168.5	0	0	0	112.4	P72 D316 K317 T319 V321	P72-L314 HydrophobicContact CG-CD1 3.34Å; L314-D316 PolarHBondContact O-N 3.29Å; L314-K317 PolarHBondContact O-N 3.36Å; L314-T319 HydrophobicContact CD1-CG2 3.7Å; L314-T319 HydrophobicContact CG-CG2 4.19Å; L314-T319 WeakPolarHBondContact CG-O 3.33Å; L314-T319 PolarHBondContact N-O 2.69Å; L314-V321 HydrophobicContact CD1-CG1 4.07Å; L314-V321 HydrophobicContact CD2-CG1 4.31Å; L314-V321 HydrophobicContact CD2-CG2 3.74Å; L314-V321 HydrophobicContact CG-CG1 4.16Å; L314-V321 HydrophobicContact CG-CG2 4.37Å
315	K	95.8	Very high	96.7	Very high	203 Å²	203	50.1 Å²	50.1	88%	0.883	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.5	-179.3	-67.9	-173.7	178.3	179.3	0	113.1	K317	K315-K317 PolarHBondContact O-N 3.2Å
316	D	94.6	Very high	96.6	Very high	50 Å²	50	54.2 Å²	54.2	27%	0.267	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-7.6	174.3	59.2	31	0	0	0	113.5	I180 L314 W318 T319	I180-D316 HydrophobicContact CD1-CB 3.84Å; L314-D316 PolarHBondContact O-N 3.29Å; D316-W318 PolarHBondContact O-N 2.99Å; D316-W318 PolarHBondContact OD1-N 3.12Å; D316-T319 PolarHBondContact OD1-N 2.87Å; D316-T319 PolarHBondContact OD1-OG1 3.48Å; D316-T319 WeakPolarHBondContact OD2-CB 3.35Å; D316-T319 PolarHBondContact OD2-OG1 3.05Å
317	K	95.3	Very high	96.6	Very high	125 Å²	125	52.6 Å²	52.6	54%	0.543	25%	0.253	S	S	.	.	S	Bend	trans	74.1	-0.5	177.9	-50	-58.5	-177.4	172.1	0	115.9	A15 I313 L314 K315	A15-K317 VanDerWaalsContact O-O 3.07Å; I313-K317 VanDerWaalsContact CG2-C 3.46Å; I313-K317 WeakPolarHBondContact CG2-O 3.33Å; L314-K317 PolarHBondContact O-N 3.36Å; K315-K317 PolarHBondContact O-N 3.2Å
318	W	96.3	Very high	96.8	Very high	24 Å²	24	52.6 Å²	52.6	9%	0.091	25%	0.252	C	S	.	.	S	Bend	trans	-121.8	-53.7	-174.5	-72.6	103.1	0	0	0	112.3	A15 A16 Y161 G162 F164 H178 I180 D316 A320	A15-W318 HydrophobicContact CB-CE3 4.49Å; A16-W318 HydrophobicContact CB-CE3 4.45Å; A16-W318 HydrophobicContact CB-CH2 3.09Å; A16-W318 HydrophobicContact CB-CZ2 3.2Å; A16-W318 HydrophobicContact CB-CZ3 3.76Å; Y161-W318 WeakPolarHBondContact O-CH2 3.38Å; Y161-W318 WeakPolarHBondContact O-CZ2 3.28Å; G162-W318 WeakPolarHBondContact O-CZ2 3.42Å; F164-W318 HydrophobicContact CB-CD2 4.34Å; F164-W318 HydrophobicContact CB-CH2 3.73Å; F164-W318 HydrophobicContact CB-CZ2 3.4Å; F164-W318 HydrophobicContact CB-CZ3 4.36Å; F164-W318 HydrophobicContact CD2-CB 4.29Å; F164-W318 AromaticContact CD2-CD2 3.55Å; F164-W318 HydrophobicContact CD2-CD2 3.55Å; F164-W318 AromaticContact CD2-CE2 3.79Å; F164-W318 AromaticContact CD2-CE3 3.82Å; F164-W318 HydrophobicContact CD2-CE3 3.82Å; F164-W318 AromaticContact CD2-CG 3.77Å; F164-W318 HydrophobicContact CD2-CG 3.77Å; F164-W318 HydrophobicContact CD2-CH2 4.4Å; F164-W318 HydrophobicContact CD2-CZ2 4.21Å; F164-W318 HydrophobicContact CD2-CZ3 4.24Å; F164-W318 HydrophobicContact CE2-CB 4.37Å; F164-W318 HydrophobicContact CE2-CD2 4.39Å; F164-W318 HydrophobicContact CE2-CG 4.32Å; F164-W318 HydrophobicContact CG-CD2 4.43Å; F164-W318 HydrophobicContact CG-CH2 4.49Å; F164-W318 HydrophobicContact CG-CZ2 4.31Å; F164-W318 VanDerWaalsContact N-CZ2 3.27Å; H178-W318 HydrophobicContact CB-CE3 4.45Å; H178-W318 WeakPolarHBondContact CB-O 3.38Å; I180-W318 HydrophobicContact CD1-CB 4.02Å; I180-W318 HydrophobicContact CD1-CG 4.36Å; I180-W318 HydrophobicContact CG1-CB 4.13Å; D316-W318 PolarHBondContact O-N 2.99Å; D316-W318 PolarHBondContact OD1-N 3.12Å; W318-A320 PolarHBondContact O-N 3.09Å
319	T	98.1	Very high	96.9	Very high	10 Å²	10	51.1 Å²	51.1	6%	0.061	24%	0.242	C	C	.	.			trans	-63.3	111.3	-170.2	-50.7	0	0	0	0	109.5	V175 L314 D316 V321	V175-T319 HydrophobicContact CG1-CG2 3.74Å; V175-T319 HydrophobicContact CG2-CG2 4.17Å; L314-T319 HydrophobicContact CD1-CG2 3.7Å; L314-T319 HydrophobicContact CG-CG2 4.19Å; L314-T319 WeakPolarHBondContact CG-O 3.33Å; L314-T319 PolarHBondContact N-O 2.69Å; D316-T319 PolarHBondContact OD1-N 2.87Å; D316-T319 PolarHBondContact OD1-OG1 3.48Å; D316-T319 WeakPolarHBondContact OD2-CB 3.35Å; D316-T319 PolarHBondContact OD2-OG1 3.05Å; T319-V321 HydrophobicContact CG2-CG1 3.91Å
320	A	98.1	Very high	97.1	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	127.8	172.7	0	0	0	0	0	108.6	V175 V176 C177 F266 F311 W318	V175-A320 CarbonylContact C-O 3.4Å; V175-A320 WeakPolarHBondContact CA-O 3.34Å; V176-A320 HydrophobicContact CB-CB 4.05Å; V176-A320 PolarHBondContact N-O 2.88Å; C177-A320 PolarHBondContact O-N 3.44Å; F266-A320 HydrophobicContact CE2-CB 3.99Å; F266-A320 HydrophobicContact CZ-CB 3.71Å; F311-A320 HydrophobicContact CD2-CB 3.78Å; F311-A320 HydrophobicContact CE2-CB 4.3Å; W318-A320 PolarHBondContact O-N 3.09Å
321	V	98.3	Very high	97.2	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.012	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	144.6	177.7	-57.3	0	0	0	0	111.4	N174 V175 F311 R312 L314 T319	N174-V321 CarbonylContact O-C 3.38Å; N174-V321 WeakPolarHBondContact O-CA 3.03Å; N174-V321 WeakPolarHBondContact O-CB 3.27Å; V175-V321 HydrophobicContact CG2-CG1 4.18Å; F311-V321 CarbonylContact C-O 3.52Å; F311-V321 VanDerWaalsContact CA-O 3.23Å; F311-V321 WeakPolarHBondContact CA-O 3.15Å; F311-V321 WeakPolarHBondContact CB-O 3.28Å; R312-V321 HydrophobicContact CG-CG2 3.66Å; R312-V321 PolarHBondContact N-O 3.49Å; R312-V321 PolarHBondContact O-N 3.04Å; L314-V321 HydrophobicContact CD1-CG1 4.07Å; L314-V321 HydrophobicContact CD2-CG1 4.31Å; L314-V321 HydrophobicContact CD2-CG2 3.74Å; L314-V321 HydrophobicContact CG-CG1 4.16Å; L314-V321 HydrophobicContact CG-CG2 4.37Å; T319-V321 HydrophobicContact CG2-CG1 3.91Å
322	S	97.8	Very high	97.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	141.3	174.1	64	0	0	0	0	110.5	N174 D324 D325 K326	N174-S322 PolarHBondContact O-N 2.8Å; S322-D324 VanDerWaalsContact C-N 3.29Å; S322-D324 PolarHBondContact O-N 3.25Å; S322-D325 PolarHBondContact O-N 3.1Å; S322-D325 WeakPolarHBondContact OG-CA 3.36Å; S322-D325 PolarHBondContact OG-N 2.99Å; S322-K326 PolarHBondContact OG-N 2.89Å; S322-K326 PolarHBondContact OG-O 2.9Å
323	V	96.9	Very high	97.5	Very high	70 Å²	70	38.5 Å²	38.5	42%	0.424	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-20.7	-179.8	-61.9	0	0	0	0	114.2	E310	E310-V323 HydrophobicContact CB-CB 4.48Å; E310-V323 HydrophobicContact CB-CG1 4.03Å; E310-V323 HydrophobicContact CB-CG2 3.63Å; E310-V323 PolarHBondContact O-N 3.25Å; E310-V323 VanDerWaalsContact O-N 3.1Å
324	D	96.8	Very high	97.6	Very high	61 Å²	61	34.7 Å²	34.7	33%	0.326	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	9.9	-178.7	65.5	-2.7	0	0	0	113.5	G307 S308 S322 K326	G307-D324 VanDerWaalsContact CA-OD2 3.29Å; G307-D324 WeakPolarHBondContact CA-OD2 3.38Å; S308-D324 PolarHBondContact N-OD2 3.11Å; S322-D324 VanDerWaalsContact C-N 3.29Å; S322-D324 PolarHBondContact O-N 3.25Å; D324-K326 PolarHBondContact O-N 3.24Å; D324-K326 VanDerWaalsContact O-N 3.14Å; D324-K326 WeakPolarHBondContact OD1-CB 3.4Å; D324-K326 PolarHBondContact OD1-N 3.18Å; D324-K326 WeakPolarHBondContact OD2-CD 3.36Å
325	D	97	Very high	97.7	Very high	54 Å²	54	33.5 Å²	33.5	29%	0.289	16%	0.161	S	C	.	.			trans	57.2	18.3	-179.4	-61.4	-34.3	0	0	0	114.7	H67 V69 S322	H67-D325 PolarHBondContact NE2-O 3.47Å; V69-D325 HydrophobicContact CB-CB 4.39Å; V69-D325 HydrophobicContact CG1-CB 3.78Å; V69-D325 HydrophobicContact CG2-CB 3.69Å; S322-D325 PolarHBondContact O-N 3.1Å; S322-D325 WeakPolarHBondContact OG-CA 3.36Å; S322-D325 PolarHBondContact OG-N 2.99Å
326	K	97.8	Very high	97.9	Very high	87 Å²	87	24.3 Å²	24.3	38%	0.378	12%	0.121	S	C	.	.			trans	-83.1	165.8	173.8	-74.2	-178.2	167.4	-173.6	0	112.1	N174 E306 S322 D324	N174-K326 WeakPolarHBondContact CA-O 3.18Å; N174-K326 VanDerWaalsContact CB-O 3.25Å; N174-K326 WeakPolarHBondContact CB-O 3.21Å; E306-K326 HydrophobicContact CB-CB 4.2Å; E306-K326 HydrophobicContact CG-CB 4.46Å; E306-K326 HydrophobicContact CG-CD 4.35Å; S322-K326 PolarHBondContact OG-N 2.89Å; S322-K326 PolarHBondContact OG-O 2.9Å; D324-K326 PolarHBondContact O-N 3.24Å; D324-K326 VanDerWaalsContact O-N 3.14Å; D324-K326 WeakPolarHBondContact OD1-CB 3.4Å; D324-K326 PolarHBondContact OD1-N 3.18Å; D324-K326 WeakPolarHBondContact OD2-CD 3.36Å
327	R	98.5	Very high	98.1	Very high	1 Å²	1	22 Å²	22	0%	0.004	11%	0.109	C	C	.	.			trans	-74.7	158.3	-175.3	-64.8	168.7	-72.2	-165.2	-2.8	113	H67 N173 I191 D217 L223 E306	H67-R327 HydrophobicContact CB-CG 4.18Å; N173-R327 HydrophobicContact CB-CG 4.03Å; N173-R327 CarbonylContact O-C 3.5Å; N173-R327 VanDerWaalsContact O-CA 3.27Å; N173-R327 WeakPolarHBondContact O-CA 3.36Å; I191-R327 HydrophobicContact CD1-CB 4.04Å; I191-R327 HydrophobicContact CD1-CG 4.38Å; D217-R327 IonicContact OD1-CZ 3.93Å; D217-R327 IonicContact OD1-NH1 2.84Å; D217-R327 PolarHBondContact OD1-NH1 3.1Å; D217-R327 IonicContact OD1-NH2 3.48Å; D217-R327 PolarHBondContact OD1-NH2 2.8Å; D217-R327 VanDerWaalsContact OD1-NH2 3.11Å; D217-R327 IonicContact OD2-CZ 2.85Å; D217-R327 IonicContact OD2-NH1 2.97Å; D217-R327 PolarHBondContact OD2-NH1 3.29Å; D217-R327 IonicContact OD2-NH2 3.66Å; D217-R327 PolarHBondContact OD2-NH2 3.03Å; L223-R327 HydrophobicContact CD2-CB 3.65Å; E306-R327 HydrophobicContact CB-CB 4.43Å; E306-R327 VanDerWaalsContact CB-O 3.28Å; E306-R327 WeakPolarHBondContact CB-O 3.35Å; E306-R327 PolarHBondContact N-O 3.26Å; E306-R327 IonicContact OE1-CZ 3.65Å; E306-R327 IonicContact OE1-NE 2.91Å; E306-R327 IonicContact OE1-NH2 3.41Å; E306-R327 PolarHBondContact OE1-NH2 2.96Å; E306-R327 VanDerWaalsContact OE2-CB 3.29Å; E306-R327 WeakPolarHBondContact OE2-CB 3.44Å; E306-R327 IonicContact OE2-CZ 3.56Å; E306-R327 PolarHBondContact OE2-N 2.78Å; E306-R327 VanDerWaalsContact OE2-N 3.13Å; E306-R327 IonicContact OE2-NE 3.58Å; E306-R327 PolarHBondContact OE2-NE 3.19Å; E306-R327 IonicContact OE2-NH2 3.72Å; E306-R327 PolarHBondContact OE2-NH2 2.81Å
328	S	98.7	Very high	98.2	Very high	6 Å²	6	17.5 Å²	17.5	4%	0.042	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	154.2	165.9	45.6	0	0	0	0	110.3	N173 V175 V176 I191 V304 M305	N173-S328 PolarHBondContact O-N 2.75Å; N173-S328 PolarHBondContact O-OG 3.41Å; V175-S328 PolarHBondContact O-OG 2.79Å; V176-S328 VanDerWaalsContact CA-OG 3.28Å; V176-S328 WeakPolarHBondContact CA-OG 3.2Å; I191-S328 WeakPolarHBondContact CD1-O 3.36Å; V304-S328 CarbonylContact O-C 3.55Å; V304-S328 WeakPolarHBondContact O-CA 3.45Å; M305-S328 VanDerWaalsContact SD-CB 3.58Å
329	A	98.9	Very high	98.3	Very high	2 Å²	2	19.6 Å²	19.6	2%	0.017	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	143.8	172.6	0	0	0	0	0	109.9	I191 T210 L223 V224 A227 V304	I191-A329 HydrophobicContact CD1-CB 4.45Å; T210-A329 HydrophobicContact CG2-CB 4.12Å; L223-A329 HydrophobicContact CD2-CB 4.24Å; L223-A329 HydrophobicContact CG-CB 3.91Å; V224-A329 HydrophobicContact CG2-CB 4.13Å; A227-A329 HydrophobicContact CB-CB 3.73Å; V304-A329 PolarHBondContact N-O 3.48Å; V304-A329 PolarHBondContact O-N 3.39Å
330	Q	98.9	Very high	98.2	Very high	3 Å²	3	26.1 Å²	26.1	1%	0.014	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	142.9	-179.2	-176.2	-179.6	19.8	0	0	109.9	N193 T210 E301 P302 I303	N193-Q330 PolarHBondContact ND2-O 2.86Å; T210-Q330 PolarHBondContact N-O 3.33Å; T210-Q330 PolarHBondContact OG1-N 2.95Å; T210-Q330 PolarHBondContact OG1-O 3.01Å; E301-Q330 PolarHBondContact O-NE2 3.47Å; P302-Q330 WeakPolarHBondContact O-CA 3.18Å; I303-Q330 HydrophobicContact CG1-CB 4.11Å; I303-Q330 HydrophobicContact CG1-CG 3.86Å
331	F	98.9	Very high	98.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.155	C	C	.	.			trans	-136.6	145.2	172	-79.2	-92.5	0	0	0	108	E209 T210 V224 A227 R228 R231 E301 P302	E209-F331 HydrophobicContact CB-CD1 4.11Å; E209-F331 HydrophobicContact CB-CE1 3.85Å; E209-F331 HydrophobicContact CG-CD1 3.81Å; E209-F331 HydrophobicContact CG-CE1 3.84Å; T210-F331 WeakPolarHBondContact O-CZ 3.29Å; V224-F331 HydrophobicContact CG1-CE2 3.88Å; V224-F331 HydrophobicContact CG1-CZ 3.78Å; V224-F331 VanDerWaalsContact O-CE2 3.28Å; V224-F331 WeakPolarHBondContact O-CE2 3.48Å; A227-F331 HydrophobicContact CB-CD2 3.79Å; A227-F331 HydrophobicContact CB-CE2 4.15Å; R228-F331 HydrophobicContact CB-CD1 4.32Å; R228-F331 HydrophobicContact CB-CD2 4.03Å; R228-F331 HydrophobicContact CB-CE1 4.27Å; R228-F331 HydrophobicContact CB-CE2 3.95Å; R228-F331 HydrophobicContact CB-CG 4.22Å; R228-F331 HydrophobicContact CB-CZ 4.09Å; R228-F331 HydrophobicContact CG-CD1 4.36Å; R228-F331 HydrophobicContact CG-CE1 4.36Å; R228-F331 VanDerWaalsContact NH2-CZ 3.29Å; R231-F331 HydrophobicContact CB-CB 3.96Å; R231-F331 HydrophobicContact CG-CB 4.04Å; E301-F331 VanDerWaalsContact CA-O 3.32Å; E301-F331 WeakPolarHBondContact CA-O 3.19Å; P302-F331 WeakPolarHBondContact CD-O 3.2Å
332	E	98.9	Very high	98.1	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	140.1	-175.9	173.7	-178.2	-179	0	0	113.3	D206 T207 S208 T299 I300 E301	D206-E332 VanDerWaalsContact CG-OE1 3.31Å; T207-E332 PolarHBondContact OG1-O 2.99Å; S208-E332 PolarHBondContact N-O 2.73Å; S208-E332 PolarHBondContact O-N 3.07Å; S208-E332 VanDerWaalsContact OG-CB 3.24Å; S208-E332 WeakPolarHBondContact OG-CB 3.24Å; S208-E332 PolarHBondContact OG-OE2 2.74Å; T299-E332 WeakPolarHBondContact CB-OE1 3.49Å; T299-E332 VanDerWaalsContact CG2-OE1 3.29Å; T299-E332 WeakPolarHBondContact CG2-OE1 3.45Å; I300-E332 VanDerWaalsContact O-CA 3.31Å; I300-E332 WeakPolarHBondContact O-CA 3.16Å; E301-E332 HydrophobicContact CB-CB 3.7Å; E301-E332 HydrophobicContact CB-CG 3.65Å
333	H	98.9	Very high	98.2	Very high	5 Å²	5	34 Å²	34	2%	0.023	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	144.4	162.3	-80.8	-55.4	0	0	0	111.6	R231 I235 T299 I300 V335 I344 T346	R231-H333 PolarHBondContact NH1-CD2 3.37Å; R231-H333 PolarHBondContact NH1-NE2 2.91Å; I235-H333 HydrophobicContact CD1-CB 3.9Å; T299-H333 WeakPolarHBondContact CA-O 3.39Å; I300-H333 PolarHBondContact N-O 2.91Å; I300-H333 PolarHBondContact O-N 3.44Å; H333-V335 HydrophobicContact CB-CG1 4.38Å; H333-I344 HydrophobicContact CB-CG2 3.85Å; H333-T346 WeakPolarHBondContact CA-OG1 3.15Å; H333-T346 PolarHBondContact CE1-O 3.37Å; H333-T346 PolarHBondContact ND1-O 2.94Å; H333-T346 PolarHBondContact ND1-OG1 2.95Å
334	T	98.9	Very high	98.2	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	127.1	158.3	-61.2	0	0	0	0	109.2	L114 D206 I271 L345 T346	L114-T334 HydrophobicContact CD2-CG2 4.44Å; D206-T334 PolarHBondContact N-OG1 3.32Å; D206-T334 PolarHBondContact O-N 2.9Å; D206-T334 PolarHBondContact O-OG1 3.01Å; I271-T334 HydrophobicContact CG2-CG2 3.49Å; I271-T334 VanDerWaalsContact CG2-CG2 3.49Å; T334-L345 HydrophobicContact CG2-CB 4.47Å; T334-L345 HydrophobicContact CG2-CD1 4.36Å; T334-L345 PolarHBondContact O-N 3.16Å; T334-T346 PolarHBondContact N-OG1 2.86Å; T334-T346 VanDerWaalsContact N-OG1 3.12Å
335	V	98.9	Very high	98.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	159.4	179.6	-58.9	0	0	0	0	112.3	I235 S297 F298 H333 V342 K343 I344	I235-V335 HydrophobicContact CD1-CG1 4.04Å; I235-V335 HydrophobicContact CG1-CG1 3.98Å; I235-V335 HydrophobicContact CG2-CG1 4.15Å; S297-V335 WeakPolarHBondContact CA-O 3.38Å; S297-V335 VanDerWaalsContact CB-O 3.32Å; S297-V335 WeakPolarHBondContact CB-O 3.03Å; F298-V335 HydrophobicContact CD2-CG2 3.87Å; F298-V335 HydrophobicContact CE2-CG2 3.68Å; F298-V335 HydrophobicContact CG-CG2 4.43Å; F298-V335 HydrophobicContact CZ-CG2 4.07Å; F298-V335 PolarHBondContact N-O 3.38Å; F298-V335 VanDerWaalsContact N-O 3.14Å; F298-V335 WeakPolarHBondContact O-CG2 3.29Å; F298-V335 PolarHBondContact O-N 2.91Å; H333-V335 HydrophobicContact CB-CG1 4.38Å; V335-V342 HydrophobicContact CB-CG2 3.67Å; V335-V342 HydrophobicContact CG1-CG2 4.17Å; V335-V342 HydrophobicContact CG2-CG2 4.09Å; V335-K343 CarbonylContact C-O 3.58Å; V335-K343 WeakPolarHBondContact CA-O 3.37Å; V335-I344 HydrophobicContact CG1-CG1 4.27Å
336	L	98.8	Very high	98.4	Very high	9 Å²	9	26.7 Å²	26.7	5%	0.047	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.5	173.7	174.8	73.2	0	0	0	109	I111 M296 V342 K343 L345	I111-L336 HydrophobicContact CB-CD2 4.49Å; I111-L336 HydrophobicContact CD1-CD1 4.19Å; I111-L336 HydrophobicContact CD1-CD2 4.13Å; I111-L336 HydrophobicContact CG1-CD1 3.98Å; I111-L336 HydrophobicContact CG1-CD2 4.09Å; I111-L336 HydrophobicContact CG2-CD2 3.61Å; M296-L336 WeakPolarHBondContact O-CA 3.45Å; L336-V342 CarbonylContact O-C 3.45Å; L336-V342 WeakPolarHBondContact O-CA 3.48Å; L336-K343 PolarHBondContact N-O 3.32Å; L336-K343 PolarHBondContact O-N 2.91Å; L336-L345 HydrophobicContact CB-CD1 4.03Å; L336-L345 HydrophobicContact CB-CD2 4.1Å; L336-L345 HydrophobicContact CB-CG 4.02Å; L336-L345 HydrophobicContact CD2-CD2 4.41Å
337	I	98.8	Very high	98.3	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	124.8	171.5	-55	-58.5	0	0	0	109	C238 P240 M292 D293 G295 M296 F298 V342	C238-I337 HydrophobicContact CB-CD1 3.92Å; P240-I337 HydrophobicContact CB-CG2 4.46Å; P240-I337 HydrophobicContact CG-CG2 3.74Å; M292-I337 HydrophobicContact CB-CD1 4.36Å; M292-I337 HydrophobicContact CB-CG1 4.21Å; M292-I337 HydrophobicContact CB-CG2 4.47Å; M292-I337 HydrophobicContact CG-CD1 4.42Å; M292-I337 HydrophobicContact SD-CD1 3.8Å; D293-I337 WeakPolarHBondContact O-CB 3.4Å; D293-I337 WeakPolarHBondContact O-CG2 3.23Å; G295-I337 PolarHBondContact N-O 3.38Å; M296-I337 HydrophobicContact CB-CB 4.44Å; M296-I337 HydrophobicContact CB-CG1 4.14Å; M296-I337 PolarHBondContact O-N 2.76Å; F298-I337 HydrophobicContact CE1-CD1 3.98Å; F298-I337 HydrophobicContact CE1-CG1 3.78Å; F298-I337 HydrophobicContact CZ-CD1 3.93Å; F298-I337 HydrophobicContact CZ-CG1 4.27Å; I337-V342 HydrophobicContact CD1-CB 4.4Å; I337-V342 HydrophobicContact CD1-CG2 4.21Å
338	T	98.4	Very high	98.1	Very high	32 Å²	32	26 Å²	26	20%	0.196	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	165.4	178	62.5	0	0	0	0	110.2	P240 D340 G341 K343	P240-T338 WeakPolarHBondContact CD-O 3.29Å; P240-T338 WeakPolarHBondContact CG-O 3.04Å; T338-D340 PolarHBondContact O-N 3.16Å; T338-D340 PolarHBondContact OG1-OD1 3.02Å; T338-G341 PolarHBondContact N-O 3.29Å; T338-G341 PolarHBondContact O-N 3.15Å; T338-G341 PolarHBondContact OG1-N 3.17Å; T338-G341 PolarHBondContact OG1-O 3.49Å; T338-K343 HydrophobicContact CG2-CB 3.93Å
339	A	97.3	Very high	97.6	Very high	68 Å²	68	31.4 Å²	31.4	56%	0.562	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.1	-26.4	178.8	0	0	0	0	0	115.3	E294	E294-A339 PolarHBondContact OE1-N 3.05Å
340	D	95.7	Very high	97	Very high	147 Å²	147	40 Å²	40	79%	0.786	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.3	3.1	-173	61.3	-18.2	0	0	0	114.4	T338	T338-D340 PolarHBondContact O-N 3.16Å; T338-D340 PolarHBondContact OG1-OD1 3.02Å
341	G	97.8	Very high	96.4	Very high	13 Å²	13	42.2 Å²	42.2	13%	0.134	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.5	-130.3	-178.9	0	0	0	0	0	113.9	T338	T338-G341 PolarHBondContact N-O 3.29Å; T338-G341 PolarHBondContact O-N 3.15Å; T338-G341 PolarHBondContact OG1-N 3.17Å; T338-G341 PolarHBondContact OG1-O 3.49Å
342	V	98.5	Very high	95.2	Very high	41 Å²	41	49.3 Å²	49.3	25%	0.248	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	142.5	-177.6	64	0	0	0	0	110.3	I235 C238 V335 L336 I337	I235-V342 HydrophobicContact CG2-CG1 3.87Å; I235-V342 HydrophobicContact CG2-CG2 4.25Å; I235-V342 WeakPolarHBondContact O-CG1 3.5Å; C238-V342 HydrophobicContact CB-CB 3.95Å; C238-V342 HydrophobicContact CB-CG1 4.17Å; C238-V342 HydrophobicContact CB-CG2 4.07Å; V335-V342 HydrophobicContact CB-CG2 3.67Å; V335-V342 HydrophobicContact CG1-CG2 4.17Å; V335-V342 HydrophobicContact CG2-CG2 4.09Å; L336-V342 CarbonylContact O-C 3.45Å; L336-V342 WeakPolarHBondContact O-CA 3.48Å; I337-V342 HydrophobicContact CD1-CB 4.4Å; I337-V342 HydrophobicContact CD1-CG2 4.21Å
343	K	98.1	Very high	93.2	Very high	114 Å²	114	56.2 Å²	56.2	50%	0.496	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130	173	-176.9	179.6	179.4	-178.7	0	109.7	V335 L336 T338 L345	V335-K343 CarbonylContact C-O 3.58Å; V335-K343 WeakPolarHBondContact CA-O 3.37Å; L336-K343 PolarHBondContact N-O 3.32Å; L336-K343 PolarHBondContact O-N 2.91Å; T338-K343 HydrophobicContact CG2-CB 3.93Å; K343-L345 HydrophobicContact CD-CD2 4.04Å; K343-L345 HydrophobicContact CG-CD2 4.19Å; K343-L345 PolarHBondContact O-N 2.86Å
344	I	98.7	Very high	91.1	Very high	28 Å²	28	62.4 Å²	62.4	14%	0.144	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	114.7	173.3	-56.6	171.1	0	0	0	108.4	I235 H333 V335 K347 L354	I235-I344 HydrophobicContact CD1-CD1 4.3Å; I235-I344 HydrophobicContact CD1-CG1 4.43Å; I235-I344 HydrophobicContact CG2-CD1 4.09Å; I235-I344 HydrophobicContact CG2-CG1 3.95Å; H333-I344 HydrophobicContact CB-CG2 3.85Å; V335-I344 HydrophobicContact CG1-CG1 4.27Å; I344-K347 HydrophobicContact CB-CB 4.01Å; I344-K347 HydrophobicContact CG2-CB 3.65Å; I344-L354 HydrophobicContact CD1-CD1 3.22Å; I344-L354 HydrophobicContact CD1-CG 3.98Å
345	L	98.6	Very high	90.7	Very high	3 Å²	3	65.6 Å²	65.6	2%	0.016	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-28.5	-177.7	-62.1	-172.9	0	0	0	112.3	L114 A115 C118 Q119 T334 L336 K343 K347	L114-L345 HydrophobicContact CD2-CD1 3.62Å; L114-L345 HydrophobicContact CG-CD1 3.71Å; A115-L345 HydrophobicContact CB-CD2 4.33Å; C118-L345 HydrophobicContact CB-CB 3.73Å; C118-L345 VanDerWaalsContact CB-O 3.31Å; C118-L345 WeakPolarHBondContact CB-O 3.47Å; Q119-L345 PolarHBondContact NE2-O 3.42Å; T334-L345 HydrophobicContact CG2-CB 4.47Å; T334-L345 HydrophobicContact CG2-CD1 4.36Å; T334-L345 PolarHBondContact O-N 3.16Å; L336-L345 HydrophobicContact CB-CD1 4.03Å; L336-L345 HydrophobicContact CB-CD2 4.1Å; L336-L345 HydrophobicContact CB-CG 4.02Å; L336-L345 HydrophobicContact CD2-CD2 4.41Å; K343-L345 HydrophobicContact CD-CD2 4.04Å; K343-L345 HydrophobicContact CG-CD2 4.19Å; K343-L345 PolarHBondContact O-N 2.86Å; L345-K347 VanDerWaalsContact C-N 3.27Å; L345-K347 PolarHBondContact O-N 2.85Å
346	T	98.6	Very high	90.2	Very high	0 Å²	0	69 Å²	69	0%	0	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	35.1	174.8	48.1	0	0	0	0	113.1	C118 R122 D206 T207 H333 T334	C118-T346 HydrophobicContact CB-CG2 3.46Å; C118-T346 VanDerWaalsContact CB-CG2 3.46Å; C118-T346 WeakPolarHBondContact O-CG2 3.49Å; R122-T346 WeakPolarHBondContact CD-O 3.31Å; R122-T346 WeakPolarHBondContact CG-O 3.17Å; R122-T346 PolarHBondContact NE-O 2.92Å; D206-T346 VanDerWaalsContact O-CG2 3.24Å; D206-T346 WeakPolarHBondContact O-CG2 3.46Å; T207-T346 HydrophobicContact CG2-CG2 4.01Å; H333-T346 WeakPolarHBondContact CA-OG1 3.15Å; H333-T346 PolarHBondContact CE1-O 3.37Å; H333-T346 PolarHBondContact ND1-O 2.94Å; H333-T346 PolarHBondContact ND1-OG1 2.95Å; T334-T346 PolarHBondContact N-OG1 2.86Å; T334-T346 VanDerWaalsContact N-OG1 3.12Å
347	K	95.9	Very high	89.8	Confident	40 Å²	40	72.3 Å²	72.3	17%	0.174	39%	0.393	C	S	.	.			trans	-114.7	125.1	168.2	177.9	-175.7	172.1	-173.9	0	109.2	Q119 I344 L345 E351 N352 N353	Q119-K347 PolarHBondContact NE2-O 2.85Å; I344-K347 HydrophobicContact CB-CB 4.01Å; I344-K347 HydrophobicContact CG2-CB 3.65Å; L345-K347 VanDerWaalsContact C-N 3.27Å; L345-K347 PolarHBondContact O-N 2.85Å; K347-E351 WeakPolarHBondContact CE-O 3.44Å; K347-E351 HydrophobicContact CG-CB 4.1Å; K347-E351 PolarHBondContact NZ-O 3.05Å; K347-N352 WeakPolarHBondContact CE-O 3.3Å; K347-N352 VanDerWaalsContact NZ-C 3.35Å; K347-N352 PolarHBondContact NZ-O 3Å; K347-N353 VanDerWaalsContact NZ-CA 3.28Å; K347-N353 PolarHBondContact NZ-OD1 3.43Å
348	L	94.4	Very high	89.2	Confident	32 Å²	32	76.5 Å²	76.5	17%	0.168	42%	0.416	C	S	.	.			trans	-73.3	151	175.2	-56.5	-178.6	0	0	0	111	Q119 R122 L126 E350 E351	Q119-L348 HydrophobicContact CB-CD2 4.43Å; Q119-L348 WeakPolarHBondContact O-CD2 3.41Å; Q119-L348 VanDerWaalsContact OE1-CD2 3.27Å; R122-L348 HydrophobicContact CB-CD2 4.02Å; R122-L348 HydrophobicContact CB-CG 4.26Å; R122-L348 HydrophobicContact CG-CD1 4.36Å; R122-L348 HydrophobicContact CG-CD2 4.01Å; R122-L348 HydrophobicContact CG-CG 3.68Å; L126-L348 HydrophobicContact CD1-CD1 3.77Å; L126-L348 HydrophobicContact CD1-CG 4.41Å; L348-E350 PolarHBondContact O-N 3.46Å; L348-E350 VanDerWaalsContact O-N 3.11Å; L348-E351 HydrophobicContact CB-CG 4.1Å; L348-E351 PolarHBondContact N-OE2 3.3Å; L348-E351 WeakPolarHBondContact O-CB 3.46Å; L348-E351 PolarHBondContact O-N 3.22Å; L348-E351 VanDerWaalsContact O-N 3.09Å
349	P	88.5	Confident	88.6	Confident	120 Å²	120	79.3 Å²	79.3	78%	0.779	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-25.2	178.8	-25.9	34.8	0	0	0	114.7	E351	P349-E351 VanDerWaalsContact C-N 3.31Å
350	E	85.9	Confident	88.1	Confident	183 Å²	183	80.1 Å²	80.1	86%	0.855	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-15.9	-176.6	-42.1	-103.9	-158.6	0	0	111.7	L348	L348-E350 PolarHBondContact O-N 3.46Å; L348-E350 VanDerWaalsContact O-N 3.11Å
351	E	85.9	Confident	87.5	Confident	49 Å²	49	75.3 Å²	75.3	23%	0.229	40%	0.395	C	S	.	.	S	Bend	trans	-80.6	136.6	-177.7	-62.4	-175.6	81.3	0	0	110.9	R122 K347 L348 P349	R122-E351 IonicContact CZ-OE1 3.89Å; R122-E351 IonicContact CZ-OE2 3.91Å; R122-E351 IonicContact NE-OE1 3.27Å; R122-E351 PolarHBondContact NE-OE1 3.29Å; R122-E351 IonicContact NE-OE2 3.82Å; R122-E351 PolarHBondContact NE-OE2 3.35Å; R122-E351 IonicContact NH2-OE1 2.74Å; R122-E351 PolarHBondContact NH2-OE1 3.19Å; R122-E351 IonicContact NH2-OE2 2.77Å; K347-E351 WeakPolarHBondContact CE-O 3.44Å; K347-E351 HydrophobicContact CG-CB 4.1Å; K347-E351 PolarHBondContact NZ-O 3.05Å; L348-E351 HydrophobicContact CB-CG 4.1Å; L348-E351 PolarHBondContact N-OE2 3.3Å; L348-E351 WeakPolarHBondContact O-CB 3.46Å; L348-E351 PolarHBondContact O-N 3.22Å; L348-E351 VanDerWaalsContact O-N 3.09Å; P349-E351 VanDerWaalsContact C-N 3.31Å
352	N	73.9	Confident	86.7	Confident	150 Å²	150	80.1 Å²	80.1	80%	0.802	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-55.8	153.7	176.9	-71.3	-34.1	0	0	0	111.5	K347	K347-N352 WeakPolarHBondContact CE-O 3.3Å; K347-N352 VanDerWaalsContact NZ-C 3.35Å; K347-N352 PolarHBondContact NZ-O 3Å
353	N	55.7	Low	85.8	Confident	145 Å²	145	83.3 Å²	83.3	78%	0.775	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-59.7	139.3	170.3	-68.2	-23.4	0	0	0	110.4	K347	K347-N353 VanDerWaalsContact NZ-CA 3.28Å; K347-N353 PolarHBondContact NZ-OD1 3.43Å
354	L	54.8	Low	84.6	Confident	136 Å²	136	80.5 Å²	80.5	71%	0.712	42%	0.423	S	S	*	.			trans	-54.8	0	171	-69.5	-175.2	0	0	0	109.9	D232 I344	D232-L354 HydrophobicContact CB-CD1 4.29Å; I344-L354 HydrophobicContact CD1-CD1 3.22Å; I344-L354 HydrophobicContact CD1-CG 3.98Å

Retrieved 354 of 354 residues in 743.5 ms (Link to these results)

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