A0A087YRB1_POEFO Loading...

Inward rectifier potassium channel 2

AlphaFold DB , UniProt , Accession A0A087YRB1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 423 aa.

Structure Viewer

Loading PAE data...

(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	35.9	Very low	29.8	Very low	256 Å²	256	153.6 Å²	153.6	100%	1.261	85%	0.852	S	S	*	*				0	96.7	0	-82.2	166.9	154.1	0	0	108.2
2	G	30.3	Very low	29.8	Very low	72 Å²	72	150.4 Å²	150.4	74%	0.742	84%	0.839	S	S	*	*			trans	-142.2	114	178.4	0	0	0	0	0	107.9
3	S	29.4	Very low	29.5	Very low	126 Å²	126	148.2 Å²	148.2	88%	0.881	84%	0.84	S	S	*	*			trans	-83.8	116.7	-172.9	-173	0	0	0	0	110.3
4	V	30.1	Very low	29.4	Very low	134 Å²	134	144.7 Å²	144.7	81%	0.812	83%	0.83	S	S	*	*			trans	-82	115.4	174.3	175.8	0	0	0	0	108.2	A6	V4-A6 PolarHBondContact O-N 3.05Å
5	R	30.9	Very low	29.8	Very low	247 Å²	247	147.3 Å²	147.3	93%	0.932	83%	0.832	S	S	*	*			trans	-90.7	102	176.3	-139.7	175.6	-172.3	176.5	1.6	109.3
6	A	30.9	Very low	30	Very low	89 Å²	89	149.1 Å²	149.1	74%	0.736	83%	0.831	S	S	*	*			trans	-70.5	129.5	170.2	0	0	0	0	0	110.4	V4	V4-A6 PolarHBondContact O-N 3.05Å
7	S	27.7	Very low	29.9	Very low	124 Å²	124	150.5 Å²	150.5	87%	0.867	84%	0.836	S	S	*	*			trans	-92.3	122.2	169.4	-173.7	0	0	0	0	109.7
8	R	30	Very low	29.9	Very low	200 Å²	200	147.4 Å²	147.4	76%	0.755	83%	0.827	S	S	*	*			trans	-105.2	155.2	169	-75.3	-173.2	-177.1	-177.5	2.1	109.7
9	Y	28.3	Very low	30	Very low	193 Å²	193	149.5 Å²	149.5	76%	0.757	83%	0.832	S	S	*	*			trans	90.6	101.7	160.5	-67.6	-76.2	0	0	0	118.3
10	S	25.3	Very low	29.9	Very low	121 Å²	121	152.3 Å²	152.3	85%	0.846	84%	0.835	S	S	*	*			trans	-85.5	105.8	154.6	57.6	0	0	0	0	109
11	T	29.2	Very low	29.8	Very low	128 Å²	128	152.7 Å²	152.7	79%	0.785	84%	0.835	S	S	*	*			trans	-93.7	142.4	169.2	36.8	0	0	0	0	110.9
12	V	29.5	Very low	29.6	Very low	115 Å²	115	145.3 Å²	145.3	70%	0.697	82%	0.815	S	S	*	*			trans	-64	134.6	-178.6	172.6	0	0	0	0	110.3	S14	V12-S14 PolarHBondContact O-N 3.2Å
13	S	26.1	Very low	29.5	Very low	121 Å²	121	148.4 Å²	148.4	85%	0.846	82%	0.82	S	S	*	*			trans	-78.9	102.2	164.8	-169	0	0	0	0	107.6
14	S	28.4	Very low	29.6	Very low	100 Å²	100	149.6 Å²	149.6	70%	0.699	82%	0.822	S	S	*	*			trans	-75.3	146.5	162	-79.1	0	0	0	0	109.5	V12 E16	V12-S14 PolarHBondContact O-N 3.2Å; S14-E16 PolarHBondContact O-N 3.42Å
15	E	35.5	Very low	29.6	Very low	184 Å²	184	146.3 Å²	146.3	86%	0.86	82%	0.815	S	S	*	*	S	Bend	trans	-55.4	114	166.9	-64.4	162	137.5	0	0	109.4
16	E	32.8	Very low	29.9	Very low	176 Å²	176	141.2 Å²	141.2	82%	0.822	81%	0.811	S	S	*	*			trans	179.4	92.6	156.5	-104.4	172.1	-173.3	0	0	107.4	S14	S14-E16 PolarHBondContact O-N 3.42Å
17	D	28.4	Very low	30.4	Very low	172 Å²	172	142.7 Å²	142.7	92%	0.92	81%	0.813	S	S	*	*			trans	-148.5	96	143.6	-115.3	-19.2	0	0	0	109.7
18	S	29.6	Very low	30.7	Very low	96 Å²	96	145 Å²	145	67%	0.671	82%	0.815	S	S	*	*			trans	-64	125.3	178.8	-51.8	0	0	0	0	111.1
19	M	31	Very low	30.9	Very low	186 Å²	186	138.3 Å²	138.3	92%	0.916	81%	0.809	S	S	*	*			trans	33.4	94.7	130.3	-137.6	160.9	-167.1	0	0	115.7
20	K	28.4	Very low	31.7	Very low	206 Å²	206	139.8 Å²	139.8	90%	0.896	82%	0.819	S	S	*	*			trans	-124.8	106.3	159	-74.1	-171.3	-179.9	174.7	0	110.9
21	L	29	Very low	32.1	Very low	160 Å²	160	138 Å²	138	84%	0.838	81%	0.812	S	S	*	*			trans	-50.6	128.8	166.8	-146.6	78.5	0	0	0	109.9	T23	L21-T23 PolarHBondContact O-N 2.94Å
22	A	30.2	Very low	32.3	Very low	101 Å²	101	141.2 Å²	141.2	84%	0.835	82%	0.815	S	S	*	*			trans	-76.4	110.1	175.7	0	0	0	0	0	110.2
23	T	29.8	Very low	32.6	Very low	138 Å²	138	141.7 Å²	141.7	85%	0.847	82%	0.818	S	S	*	*			trans	-92.7	123.1	164.1	7.8	0	0	0	0	109.5	L21 G25	L21-T23 PolarHBondContact O-N 2.94Å; T23-G25 PolarHBondContact O-N 3.26Å
24	T	31	Very low	33	Very low	151 Å²	151	143.9 Å²	143.9	93%	0.926	82%	0.815	S	S	*	*			trans	-67	110.5	179.3	-17.8	0	0	0	0	110.4
25	G	29.1	Very low	33.4	Very low	64 Å²	64	144.9 Å²	144.9	66%	0.66	82%	0.817	S	S	*	*			trans	-123.1	118.2	171.3	0	0	0	0	0	110.1	T23 P27	T23-G25 PolarHBondContact O-N 3.26Å; G25-P27 WeakPolarHBondContact O-CD 3.44Å
26	V	38.6	Very low	33.7	Very low	141 Å²	141	146.8 Å²	146.8	86%	0.855	82%	0.816	S	S	*	*			trans	-69.1	131.2	174.4	177.3	0	0	0	0	109.7
27	P	40	Very low	34.4	Very low	120 Å²	120	145.7 Å²	145.7	78%	0.779	81%	0.811	S	S	*	*			trans	-109.4	117.6	163.5	20	-0.8	0	0	0	111.1	G25	G25-P27 WeakPolarHBondContact O-CD 3.44Å
28	N	35.6	Very low	35.4	Very low	171 Å²	171	145.9 Å²	145.9	91%	0.914	81%	0.806	S	S	*	*			trans	-89.1	117.8	163.8	-153.5	7.5	0	0	0	107.3
29	G	34.1	Very low	36.6	Very low	60 Å²	60	147.3 Å²	147.3	62%	0.619	81%	0.813	S	S	*	*	S	Bend	trans	161.6	119.5	176.9	0	0	0	0	0	114.2	A31	G29-A31 PolarHBondContact O-N 3.4Å
30	K	44.5	Very low	38.2	Very low	224 Å²	224	141.3 Å²	141.3	97%	0.974	78%	0.783	S	S	*	*			trans	-54.6	103.7	178.1	-68.4	175.6	176.4	177.4	0	111.4
31	A	32.8	Very low	40.5	Very low	85 Å²	85	136.5 Å²	136.5	70%	0.702	78%	0.775	S	S	*	*			trans	-106.7	126.7	170.5	0	0	0	0	0	109.6	G29 V33	G29-A31 PolarHBondContact O-N 3.4Å; A31-V33 PolarHBondContact O-N 3.06Å; A31-V33 VanDerWaalsContact O-N 3.16Å
32	K	34.4	Very low	43.4	Very low	194 Å²	194	131 Å²	131	84%	0.843	74%	0.743	S	S	*	*			trans	-51	119.4	168	-77.5	175.1	173.4	177.1	0	108.4	H34	K32-H34 VanDerWaalsContact C-N 3.26Å; K32-H34 PolarHBondContact O-N 2.95Å
33	V	35.2	Very low	46.3	Very low	125 Å²	125	129.2 Å²	129.2	76%	0.758	72%	0.717	S	S	*	*			trans	-67.9	89.5	171.8	-179.2	0	0	0	0	107.3	A31 T35	A31-V33 PolarHBondContact O-N 3.06Å; A31-V33 VanDerWaalsContact O-N 3.16Å; V33-T35 HydrophobicContact CG1-CG2 3.99Å; V33-T35 PolarHBondContact O-N 2.98Å
34	H	34.3	Very low	49.4	Very low	168 Å²	168	122.8 Å²	122.8	78%	0.778	68%	0.677	S	S	*	*			trans	-73	101.7	150.3	-85.3	4	0	0	0	105.7	K32 R36	K32-H34 VanDerWaalsContact C-N 3.26Å; K32-H34 PolarHBondContact O-N 2.95Å; H34-R36 PolarHBondContact O-N 3Å
35	T	37.7	Very low	52.4	Low	120 Å²	120	120.3 Å²	120.3	74%	0.736	65%	0.654	S	S	*	*			trans	-62.7	70.8	159.1	29.8	0	0	0	0	108.1	V33 H37	V33-T35 HydrophobicContact CG1-CG2 3.99Å; V33-T35 PolarHBondContact O-N 2.98Å; T35-H37 VanDerWaalsContact C-N 3.26Å; T35-H37 PolarHBondContact O-N 3.38Å
36	R	40.6	Very low	55.3	Low	225 Å²	225	120.2 Å²	120.2	85%	0.849	64%	0.635	S	S	*	*			trans	-73.5	94.4	162.2	-161	177.5	-170.7	-179	2.2	103.7	H34 Q38	H34-R36 PolarHBondContact O-N 3Å; R36-Q38 PolarHBondContact O-N 3.3Å
37	H	48.3	Very low	57.7	Low	153 Å²	153	118.4 Å²	118.4	71%	0.708	62%	0.62	S	S	*	*			trans	-44.4	111.2	167.1	-99.9	-90.8	0	0	0	106.3	T35	T35-H37 VanDerWaalsContact C-N 3.26Å; T35-H37 PolarHBondContact O-N 3.38Å
38	Q	48.2	Very low	60	Low	175 Å²	175	112.9 Å²	112.9	82%	0.818	59%	0.585	S	S	*	*			trans	-57.9	131.4	173.7	-85.9	177.6	-21.1	0	0	106.1	R36 Q40	R36-Q38 PolarHBondContact O-N 3.3Å; Q38-Q40 PolarHBondContact O-N 3.3Å
39	P	56.3	Low	62.6	Low	126 Å²	126	110.3 Å²	110.3	82%	0.818	57%	0.568	S	S	*	*			trans	-58.6	110.7	175.9	22.7	-29.9	0	0	0	107.3	S41	P39-S41 PolarHBondContact O-N 3.19Å
40	Q	65	Low	65.3	Low	60 Å²	60	110.9 Å²	110.9	28%	0.28	56%	0.561	S	S	.	*			trans	-52	125.2	178.5	-166.3	-174.7	-8.1	0	0	108	Q38 R42 D285	Q38-Q40 PolarHBondContact O-N 3.3Å; Q40-R42 PolarHBondContact O-N 2.85Å; Q40-D285 PolarHBondContact NE2-OD1 2.9Å
41	S	75	Confident	67.5	Low	106 Å²	106	104.2 Å²	104.2	74%	0.741	54%	0.536	S	S	*	.			trans	-64.2	129.6	176.3	-175.5	0	0	0	0	108.3	P39	P39-S41 PolarHBondContact O-N 3.19Å
42	R	90	Very high	70.1	Confident	44 Å²	44	103 Å²	103	17%	0.166	52%	0.52	C	S	.	.			trans	-109.8	137.9	-175.1	-175.8	-167.2	-70.2	-126.9	6.4	110	Q40 V44 N51 E287 S308 V310 E313	Q40-R42 PolarHBondContact O-N 2.85Å; R42-V44 WeakPolarHBondContact CD-O 3.31Å; R42-V44 WeakPolarHBondContact CG-O 3.26Å; R42-N51 VanDerWaalsContact O-CB 3.25Å; R42-N51 WeakPolarHBondContact O-CB 3.3Å; R42-N51 PolarHBondContact O-ND2 3.19Å; R42-N51 VanDerWaalsContact O-ND2 3.15Å; R42-E287 VanDerWaalsContact CG-CD 3.45Å; R42-E287 WeakPolarHBondContact CG-OE1 3.35Å; R42-E287 WeakPolarHBondContact CG-OE2 3.49Å; R42-S308 WeakPolarHBondContact CD-OG 3.47Å; R42-S308 PolarHBondContact NH1-O 3.25Å; R42-S308 VanDerWaalsContact NH1-O 3.1Å; R42-S308 PolarHBondContact NH1-OG 2.99Å; R42-V310 HydrophobicContact CG-CG1 4.46Å; R42-E313 IonicContact CZ-OE1 3.41Å; R42-E313 IonicContact CZ-OE2 2.67Å; R42-E313 IonicContact NH1-OE1 3.4Å; R42-E313 IonicContact NH1-OE2 3.55Å; R42-E313 PolarHBondContact NH1-OE2 3.29Å; R42-E313 IonicContact NH2-OE1 3.44Å; R42-E313 PolarHBondContact NH2-OE1 2.88Å; R42-E313 IonicContact NH2-OE2 2.6Å; R42-E313 PolarHBondContact NH2-OE2 3.04Å; R42-E313 VanDerWaalsContact NH2-OE2 3.11Å
43	F	92.7	Very high	72.5	Confident	64 Å²	64	101.5 Å²	101.5	28%	0.281	52%	0.516	S	S	.	.	S	Bend	trans	-76.5	-45.1	178.5	-170.9	-104.6	0	0	0	112.5	C50 N51 V52 L226 L239 E287	F43-C50 CarbonylContact O-C 3.52Å; F43-C50 WeakPolarHBondContact O-CA 3.3Å; F43-N51 PolarHBondContact O-N 3.09Å; F43-V52 HydrophobicContact CD2-CG2 3.67Å; F43-V52 HydrophobicContact CE2-CG2 3.17Å; F43-V52 HydrophobicContact CZ-CG2 3.66Å; F43-L226 HydrophobicContact CB-CD1 3.87Å; F43-L226 HydrophobicContact CD1-CD1 3.51Å; F43-L226 HydrophobicContact CE1-CD1 4.35Å; F43-L226 HydrophobicContact CG-CD1 3.92Å; F43-L239 HydrophobicContact CD2-CD1 3.86Å; F43-L239 HydrophobicContact CD2-CD2 4.5Å; F43-L239 HydrophobicContact CE2-CD1 4.42Å; F43-L239 HydrophobicContact CG-CD1 4.39Å; F43-E287 WeakPolarHBondContact CB-OE2 3.37Å; F43-E287 PolarHBondContact N-OE2 2.87Å
44	V	94.6	Very high	74.8	Confident	3 Å²	3	103 Å²	103	2%	0.018	51%	0.513	C	S	.	.	B	Isolated β-bridge	trans	-121.1	117	175.6	-177.2	0	0	0	0	109.6	R42 E287 V289 R306 S308	R42-V44 WeakPolarHBondContact CD-O 3.31Å; R42-V44 WeakPolarHBondContact CG-O 3.26Å; V44-E287 PolarHBondContact N-OE1 2.93Å; V44-E287 VanDerWaalsContact O-OE1 3.14Å; V44-V289 HydrophobicContact CB-CG2 4.15Å; V44-V289 HydrophobicContact CG2-CG1 4.1Å; V44-V289 HydrophobicContact CG2-CG2 3.76Å; V44-R306 HydrophobicContact CG1-CB 4.3Å; V44-S308 WeakPolarHBondContact O-CB 3.22Å; V44-S308 PolarHBondContact O-OG 3.47Å
45	K	93.2	Very high	77.2	Confident	99 Å²	99	101.2 Å²	101.2	43%	0.43	51%	0.508	S	S	.	.			trans	-60.8	160.7	176.8	-70.3	179.9	-175.4	-179.5	0	112.4	D47 G48 H49	K45-D47 WeakPolarHBondContact CB-OD1 3.18Å; K45-D47 PolarHBondContact O-N 3.08Å; K45-D47 VanDerWaalsContact O-N 3.09Å; K45-G48 WeakPolarHBondContact O-CA 3.45Å; K45-G48 PolarHBondContact O-N 3.3Å; K45-H49 WeakPolarHBondContact CB-O 3.25Å; K45-H49 PolarHBondContact N-O 3.4Å
46	K	91.4	Very high	79.3	Confident	61 Å²	61	103.3 Å²	103.3	27%	0.265	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-28.3	176.9	-78.1	-64.1	-172.8	-171.7	0	114.1	G48 H191 S307 S308 E313	K46-G48 PolarHBondContact O-N 3.29Å; K46-H191 PolarHBondContact NZ-O 3.42Å; K46-S307 PolarHBondContact O-OG 3.07Å; K46-S308 VanDerWaalsContact CD-O 3.29Å; K46-S308 WeakPolarHBondContact CD-O 3.09Å; K46-S308 VanDerWaalsContact CE-O 3.24Å; K46-S308 WeakPolarHBondContact CE-O 3.35Å; K46-S308 PolarHBondContact NZ-O 3.29Å; K46-E313 WeakPolarHBondContact CE-OE1 3.29Å; K46-E313 WeakPolarHBondContact CE-OE2 3.46Å; K46-E313 VanDerWaalsContact NZ-CD 3.26Å; K46-E313 IonicContact NZ-OE1 2.99Å; K46-E313 IonicContact NZ-OE2 3.89Å; K46-E313 PolarHBondContact NZ-OE2 3.01Å
47	D	88.1	Confident	81	Confident	103 Å²	103	96 Å²	96	55%	0.551	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-1.8	176.1	61.2	6.5	0	0	0	113.7	K45 H49	K45-D47 WeakPolarHBondContact CB-OD1 3.18Å; K45-D47 PolarHBondContact O-N 3.08Å; K45-D47 VanDerWaalsContact O-N 3.09Å; D47-H49 WeakPolarHBondContact OD1-CB 3.47Å; D47-H49 IonicContact OD1-CD2 3.26Å; D47-H49 IonicContact OD1-CG 2.87Å; D47-H49 PolarHBondContact OD1-N 3.13Å; D47-H49 IonicContact OD2-CD2 4Å; D47-H49 PolarHBondContact OD2-CD2 3.44Å
48	G	88.4	Confident	82.1	Confident	4 Å²	4	92.9 Å²	92.9	4%	0.041	49%	0.49	C	S	.	.	S	Bend	trans	85.1	4.6	-179.9	0	0	0	0	0	114.8	K45 K46 R306	K45-G48 WeakPolarHBondContact O-CA 3.45Å; K45-G48 PolarHBondContact O-N 3.3Å; K46-G48 PolarHBondContact O-N 3.29Å; G48-R306 WeakPolarHBondContact CA-O 3.16Å; G48-R306 PolarHBondContact N-O 2.95Å; G48-R306 PolarHBondContact O-NE 3.4Å; G48-R306 PolarHBondContact O-NH2 3.3Å
49	H	89.4	Confident	83.3	Confident	118 Å²	118	89.7 Å²	89.7	55%	0.546	48%	0.475	S	S	.	.			trans	-78.9	125.9	174.1	-75.7	-57.3	0	0	0	111.5	K45 D47	K45-H49 WeakPolarHBondContact CB-O 3.25Å; K45-H49 PolarHBondContact N-O 3.4Å; D47-H49 WeakPolarHBondContact OD1-CB 3.47Å; D47-H49 IonicContact OD1-CD2 3.26Å; D47-H49 IonicContact OD1-CG 2.87Å; D47-H49 PolarHBondContact OD1-N 3.13Å; D47-H49 IonicContact OD2-CD2 4Å; D47-H49 PolarHBondContact OD2-CD2 3.44Å
50	C	90.9	Very high	84	Confident	71 Å²	71	88.6 Å²	88.6	48%	0.48	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-72.7	129.8	175.3	-52	0	0	0	0	110.5	F43 V52	F43-C50 CarbonylContact O-C 3.52Å; F43-C50 WeakPolarHBondContact O-CA 3.3Å; C50-V52 VanDerWaalsContact C-N 3.3Å; C50-V52 PolarHBondContact O-N 3.09Å
51	N	90.4	Very high	84.3	Confident	84 Å²	84	88.2 Å²	88.2	45%	0.449	47%	0.469	S	S	.	.			trans	-94.2	57.1	-179.8	-169.6	38.8	0	0	0	110.6	R42 F43	R42-N51 VanDerWaalsContact O-CB 3.25Å; R42-N51 WeakPolarHBondContact O-CB 3.3Å; R42-N51 PolarHBondContact O-ND2 3.19Å; R42-N51 VanDerWaalsContact O-ND2 3.15Å; F43-N51 PolarHBondContact O-N 3.09Å
52	V	88.4	Confident	84.3	Confident	60 Å²	60	89.7 Å²	89.7	36%	0.364	46%	0.464	S	S	.	.			trans	-127.6	132.7	-176.7	-176.4	0	0	0	0	109.1	F43 C50 F54	F43-V52 HydrophobicContact CD2-CG2 3.67Å; F43-V52 HydrophobicContact CE2-CG2 3.17Å; F43-V52 HydrophobicContact CZ-CG2 3.66Å; C50-V52 VanDerWaalsContact C-N 3.3Å; C50-V52 PolarHBondContact O-N 3.09Å; V52-F54 HydrophobicContact CG1-CE1 4.35Å; V52-F54 HydrophobicContact CG1-CZ 4.31Å
53	Q	84.9	Confident	83.7	Confident	163 Å²	163	94.9 Å²	94.9	76%	0.762	48%	0.484	S	S	*	.			trans	-115.3	121	173.6	-171.8	173.9	10.8	0	0	109.4	I55	Q53-I55 HydrophobicContact CG-CG2 4.45Å
54	F	83.5	Confident	83	Confident	157 Å²	157	98.2 Å²	98.2	69%	0.689	50%	0.495	S	S	*	.			trans	-82.9	120.2	173.9	-58	-78.4	0	0	0	109.5	V52 V57	V52-F54 HydrophobicContact CG1-CE1 4.35Å; V52-F54 HydrophobicContact CG1-CZ 4.31Å; F54-V57 HydrophobicContact CB-CG2 3.87Å
55	I	84.6	Confident	82	Confident	130 Å²	130	103.9 Å²	103.9	67%	0.667	53%	0.525	S	S	*	.			trans	-109.9	151.8	174.6	59.7	171.3	0	0	0	109.9	Q53 V57	Q53-I55 HydrophobicContact CG-CG2 4.45Å; I55-V57 VanDerWaalsContact C-N 3.33Å; I55-V57 PolarHBondContact O-N 3.22Å
56	N	80.4	Confident	81.4	Confident	163 Å²	163	103.4 Å²	103.4	87%	0.872	54%	0.54	S	S	*	.			trans	54.8	37.3	176.6	-64.9	-16.2	0	0	0	115.9	S58	N56-S58 PolarHBondContact O-N 3.49Å
57	V	78.3	Confident	81.2	Confident	72 Å²	72	104.1 Å²	104.1	44%	0.436	55%	0.546	S	S	.	.			trans	-78.8	103.6	169.1	-174.9	0	0	0	0	108.5	F54 I55	F54-V57 HydrophobicContact CB-CG2 3.87Å; I55-V57 VanDerWaalsContact C-N 3.33Å; I55-V57 PolarHBondContact O-N 3.22Å
58	S	70.3	Confident	81	Confident	87 Å²	87	104.1 Å²	104.1	61%	0.608	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	144.8	174.5	51.8	0	0	0	0	110.9	N56 K60	N56-S58 PolarHBondContact O-N 3.49Å; S58-K60 PolarHBondContact O-N 2.84Å; S58-K60 VanDerWaalsContact O-N 3.14Å
59	E	73.1	Confident	80.8	Confident	109 Å²	109	108.7 Å²	108.7	51%	0.509	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	62.3	17.4	175.6	-53.8	173.3	162.7	0	0	116.6	G61 Q62 R63	E59-G61 VanDerWaalsContact C-N 3.3Å; E59-G61 PolarHBondContact O-N 2.54Å; E59-Q62 PolarHBondContact O-N 2.89Å; E59-R63 PolarHBondContact O-N 3.14Å; E59-R63 VanDerWaalsContact O-N 3.08Å; E59-R63 IonicContact OE2-CZ 2.85Å; E59-R63 IonicContact OE2-NE 3.59Å; E59-R63 IonicContact OE2-NH2 2.88Å; E59-R63 PolarHBondContact OE2-NH2 3.01Å
60	K	71.4	Confident	80.6	Confident	103 Å²	103	105.6 Å²	105.6	45%	0.448	55%	0.554	S	S	.	*	H	α-helix	trans	-51.4	-47.4	179.2	-166	178.9	-178.3	179.8	0	112.2	S58 Q62 R63 Y64	S58-K60 PolarHBondContact O-N 2.84Å; S58-K60 VanDerWaalsContact O-N 3.14Å; K60-Q62 PolarHBondContact O-N 3.23Å; K60-R63 PolarHBondContact O-N 2.96Å; K60-Y64 HydrophobicContact CD-CE2 4.27Å; K60-Y64 HydrophobicContact CG-CD2 3.81Å; K60-Y64 HydrophobicContact CG-CE2 3.5Å; K60-Y64 VanDerWaalsContact CG-CE2 3.5Å; K60-Y64 WeakPolarHBondContact O-CD2 3.1Å; K60-Y64 PolarHBondContact O-N 3.3Å; K60-Y64 VanDerWaalsContact O-N 3.15Å
61	G	72.1	Confident	80.4	Confident	51 Å²	51	104 Å²	104	53%	0.526	54%	0.542	S	S	.	.	H	α-helix	trans	-59.8	-46.3	-179.9	0	0	0	0	0	113.7	E59 Y64 L65	E59-G61 VanDerWaalsContact C-N 3.3Å; E59-G61 PolarHBondContact O-N 2.54Å; G61-Y64 PolarHBondContact O-N 3.41Å; G61-L65 WeakPolarHBondContact O-CB 3.46Å; G61-L65 VanDerWaalsContact O-CG 3.29Å; G61-L65 WeakPolarHBondContact O-CG 3.4Å; G61-L65 PolarHBondContact O-N 2.94Å
62	Q	74.4	Confident	80.3	Confident	138 Å²	138	100.4 Å²	100.4	65%	0.645	52%	0.523	S	S	*	.	H	α-helix	trans	-67	-39.1	-178.8	-78.3	179.2	-18.2	0	0	112.4	E59 K60 L65 A66	E59-Q62 PolarHBondContact O-N 2.89Å; K60-Q62 PolarHBondContact O-N 3.23Å; Q62-L65 PolarHBondContact O-N 3.45Å; Q62-A66 PolarHBondContact O-N 3.02Å
63	R	78.2	Confident	80.3	Confident	152 Å²	152	97.7 Å²	97.7	57%	0.574	51%	0.507	S	S	*	.	H	α-helix	trans	-67.5	-39.2	178.7	-66.1	-178.6	-172.3	-177.1	3.9	112.5	E59 K60 L65 A66 D67	E59-R63 PolarHBondContact O-N 3.14Å; E59-R63 VanDerWaalsContact O-N 3.08Å; E59-R63 IonicContact OE2-CZ 2.85Å; E59-R63 IonicContact OE2-NE 3.59Å; E59-R63 IonicContact OE2-NH2 2.88Å; E59-R63 PolarHBondContact OE2-NH2 3.01Å; K60-R63 PolarHBondContact O-N 2.96Å; R63-L65 VanDerWaalsContact C-N 3.34Å; R63-A66 PolarHBondContact O-N 3.46Å; R63-D67 PolarHBondContact O-N 3.15Å
64	Y	76.9	Confident	80.4	Confident	134 Å²	134	94.8 Å²	94.8	53%	0.525	50%	0.496	S	S	.	.	H	α-helix	trans	-69.5	-32.1	174.6	-80.5	-104.6	0	0	0	112.1	K60 G61 D67 T71	K60-Y64 HydrophobicContact CD-CE2 4.27Å; K60-Y64 HydrophobicContact CG-CD2 3.81Å; K60-Y64 HydrophobicContact CG-CE2 3.5Å; K60-Y64 VanDerWaalsContact CG-CE2 3.5Å; K60-Y64 WeakPolarHBondContact O-CD2 3.1Å; K60-Y64 PolarHBondContact O-N 3.3Å; K60-Y64 VanDerWaalsContact O-N 3.15Å; G61-Y64 PolarHBondContact O-N 3.41Å; Y64-D67 CarbonylContact O-C 3.3Å; Y64-D67 VanDerWaalsContact O-C 3.3Å; Y64-D67 PolarHBondContact O-N 3.24Å; Y64-T71 HydrophobicContact CD1-CG2 4.49Å; Y64-T71 PolarHBondContact O-OG1 2.98Å; Y64-T71 VanDerWaalsContact O-OG1 3.13Å
65	L	74.5	Confident	80.7	Confident	123 Å²	123	89.8 Å²	89.8	64%	0.644	48%	0.477	S	S	*	.	H	α-helix	trans	-76.7	-21.7	173.7	-70.7	175.8	0	0	0	113.7	G61 Q62 R63 D67 I68	G61-L65 WeakPolarHBondContact O-CB 3.46Å; G61-L65 VanDerWaalsContact O-CG 3.29Å; G61-L65 WeakPolarHBondContact O-CG 3.4Å; G61-L65 PolarHBondContact O-N 2.94Å; Q62-L65 PolarHBondContact O-N 3.45Å; R63-L65 VanDerWaalsContact C-N 3.34Å; L65-D67 VanDerWaalsContact C-N 3.26Å; L65-I68 VanDerWaalsContact O-CD1 3.23Å; L65-I68 WeakPolarHBondContact O-CD1 3.24Å; L65-I68 WeakPolarHBondContact O-CG1 3.37Å
66	A	80.4	Confident	81	Confident	89 Å²	89	92 Å²	92	74%	0.736	48%	0.476	S	S	*	.	H	α-helix	trans	-70.7	-29	169.8	0	0	0	0	0	111.1	Q62 R63	Q62-A66 PolarHBondContact O-N 3.02Å; R63-A66 PolarHBondContact O-N 3.46Å
67	D	85.6	Confident	81.5	Confident	75 Å²	75	89.1 Å²	89.1	40%	0.401	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	61	178.8	-164.2	3.6	0	0	0	112.2	R63 Y64 L65 F69 T70 T71	R63-D67 PolarHBondContact O-N 3.15Å; Y64-D67 CarbonylContact O-C 3.3Å; Y64-D67 VanDerWaalsContact O-C 3.3Å; Y64-D67 PolarHBondContact O-N 3.24Å; L65-D67 VanDerWaalsContact C-N 3.26Å; D67-F69 VanDerWaalsContact C-N 3.28Å; D67-F69 PolarHBondContact O-N 3.16Å; D67-T70 PolarHBondContact O-OG1 3.45Å; D67-T70 VanDerWaalsContact OD1-CG2 3.25Å; D67-T70 WeakPolarHBondContact OD1-CG2 3.29Å; D67-T70 PolarHBondContact OD1-N 3.2Å; D67-T70 PolarHBondContact OD1-OG1 3.46Å; D67-T70 VanDerWaalsContact OD1-OG1 3.05Å; D67-T70 WeakPolarHBondContact OD2-CB 3.43Å; D67-T70 WeakPolarHBondContact OD2-CG2 3.43Å; D67-T70 PolarHBondContact OD2-OG1 2.82Å; D67-T71 VanDerWaalsContact O-CB 3.29Å; D67-T71 WeakPolarHBondContact O-CB 3.45Å; D67-T71 PolarHBondContact O-N 3.45Å; D67-T71 VanDerWaalsContact O-N 3.15Å; D67-T71 PolarHBondContact O-OG1 2.9Å
68	I	84	Confident	82.2	Confident	104 Å²	104	95.3 Å²	95.3	53%	0.533	47%	0.469	S	S	.	.	H	α-helix	trans	-61.1	-37	-177.9	-73.5	154.9	0	0	0	111.7	L65 C72	L65-I68 VanDerWaalsContact O-CD1 3.23Å; L65-I68 WeakPolarHBondContact O-CD1 3.24Å; L65-I68 WeakPolarHBondContact O-CG1 3.37Å; I68-C72 VanDerWaalsContact O-CB 3.22Å; I68-C72 WeakPolarHBondContact O-CB 3.41Å; I68-C72 PolarHBondContact O-N 2.89Å
69	F	84.5	Confident	83.3	Confident	99 Å²	99	98.2 Å²	98.2	43%	0.434	47%	0.467	S	S	.	.	H	α-helix	trans	-67.4	-50.8	-176.1	-178.6	-100.8	0	0	0	111.5	D67 T71 C72 V73 F168 A175	D67-F69 VanDerWaalsContact C-N 3.28Å; D67-F69 PolarHBondContact O-N 3.16Å; F69-T71 VanDerWaalsContact C-N 3.31Å; F69-T71 PolarHBondContact O-N 3.01Å; F69-C72 PolarHBondContact O-N 2.6Å; F69-V73 HydrophobicContact CE1-CG2 4.18Å; F69-V73 HydrophobicContact CE2-CG2 4.25Å; F69-V73 HydrophobicContact CZ-CG2 4.04Å; F69-V73 VanDerWaalsContact O-CG2 3.32Å; F69-V73 WeakPolarHBondContact O-CG2 3.4Å; F69-V73 PolarHBondContact O-N 3Å; F69-F168 HydrophobicContact CD2-CE2 4.19Å; F69-F168 HydrophobicContact CD2-CZ 4.39Å; F69-A175 HydrophobicContact CZ-CB 3.95Å
70	T	85.6	Confident	84.2	Confident	54 Å²	54	93 Å²	93	33%	0.331	44%	0.442	S	S	.	.	H	α-helix	trans	-64.4	-40.7	178.3	67.1	0	0	0	0	110.9	D67 C72 V73 D74	D67-T70 PolarHBondContact O-OG1 3.45Å; D67-T70 VanDerWaalsContact OD1-CG2 3.25Å; D67-T70 WeakPolarHBondContact OD1-CG2 3.29Å; D67-T70 PolarHBondContact OD1-N 3.2Å; D67-T70 PolarHBondContact OD1-OG1 3.46Å; D67-T70 VanDerWaalsContact OD1-OG1 3.05Å; D67-T70 WeakPolarHBondContact OD2-CB 3.43Å; D67-T70 WeakPolarHBondContact OD2-CG2 3.43Å; D67-T70 PolarHBondContact OD2-OG1 2.82Å; T70-C72 PolarHBondContact O-N 3.46Å; T70-V73 PolarHBondContact O-N 3.24Å; T70-D74 WeakPolarHBondContact O-CB 3.26Å; T70-D74 PolarHBondContact O-N 3.25Å
71	T	87.3	Confident	85.2	Confident	36 Å²	36	93.2 Å²	93.2	22%	0.221	44%	0.444	C	S	.	.	H	α-helix	trans	-57.9	-47.7	176.8	-61.8	0	0	0	0	111	Y64 D67 F69 V73 D74 I75	Y64-T71 HydrophobicContact CD1-CG2 4.49Å; Y64-T71 PolarHBondContact O-OG1 2.98Å; Y64-T71 VanDerWaalsContact O-OG1 3.13Å; D67-T71 VanDerWaalsContact O-CB 3.29Å; D67-T71 WeakPolarHBondContact O-CB 3.45Å; D67-T71 PolarHBondContact O-N 3.45Å; D67-T71 VanDerWaalsContact O-N 3.15Å; D67-T71 PolarHBondContact O-OG1 2.9Å; F69-T71 VanDerWaalsContact C-N 3.31Å; F69-T71 PolarHBondContact O-N 3.01Å; T71-V73 PolarHBondContact O-N 2.95Å; T71-D74 PolarHBondContact O-N 3.5Å; T71-I75 HydrophobicContact CG2-CD1 3.99Å; T71-I75 WeakPolarHBondContact O-CD1 3.33Å; T71-I75 WeakPolarHBondContact O-CG1 3.49Å; T71-I75 PolarHBondContact O-N 2.95Å; T71-I75 VanDerWaalsContact O-N 3.1Å
72	C	87.3	Confident	86.3	Confident	10 Å²	10	95.1 Å²	95.1	7%	0.068	44%	0.441	C	S	.	.	H	α-helix	trans	-59.2	-45.2	176.9	-171.9	0	0	0	0	111.8	I68 F69 T70 D74	I68-C72 VanDerWaalsContact O-CB 3.22Å; I68-C72 WeakPolarHBondContact O-CB 3.41Å; I68-C72 PolarHBondContact O-N 2.89Å; F69-C72 PolarHBondContact O-N 2.6Å; T70-C72 PolarHBondContact O-N 3.46Å; C72-D74 VanDerWaalsContact C-N 3.34Å; C72-D74 PolarHBondContact O-N 3.49Å
73	V	88.8	Confident	87.2	Confident	3 Å²	3	92.1 Å²	92.1	2%	0.018	43%	0.428	C	S	.	.	H	α-helix	trans	-70.4	-28.8	-178.8	178.8	0	0	0	0	112	F69 T70 T71 A175 K176 K179	F69-V73 HydrophobicContact CE1-CG2 4.18Å; F69-V73 HydrophobicContact CE2-CG2 4.25Å; F69-V73 HydrophobicContact CZ-CG2 4.04Å; F69-V73 VanDerWaalsContact O-CG2 3.32Å; F69-V73 WeakPolarHBondContact O-CG2 3.4Å; F69-V73 PolarHBondContact O-N 3Å; T70-V73 PolarHBondContact O-N 3.24Å; T71-V73 PolarHBondContact O-N 2.95Å; V73-A175 HydrophobicContact CG1-CB 4.49Å; V73-A175 HydrophobicContact CG2-CB 4.21Å; V73-K176 HydrophobicContact CG1-CB 4.03Å; V73-K176 HydrophobicContact CG1-CG 4.48Å; V73-K176 PolarHBondContact O-NZ 3.42Å; V73-K179 HydrophobicContact CG1-CD 3.73Å; V73-K179 VanDerWaalsContact CG1-CE 3.41Å; V73-K179 HydrophobicContact CG1-CG 4.44Å
74	D	87	Confident	87.9	Confident	101 Å²	101	85.6 Å²	85.6	54%	0.54	40%	0.404	S	S	.	.	H	α-helix	trans	-84.2	-24.8	179.8	-80.1	-32.2	0	0	0	114.9	T70 T71 C72 K179	T70-D74 WeakPolarHBondContact O-CB 3.26Å; T70-D74 PolarHBondContact O-N 3.25Å; T71-D74 PolarHBondContact O-N 3.5Å; C72-D74 VanDerWaalsContact C-N 3.34Å; C72-D74 PolarHBondContact O-N 3.49Å; D74-K179 VanDerWaalsContact CG-NZ 3.27Å; D74-K179 IonicContact OD1-NZ 3.72Å; D74-K179 PolarHBondContact OD1-NZ 2.71Å; D74-K179 IonicContact OD2-NZ 3.67Å
75	I	89.3	Confident	88.8	Confident	53 Å²	53	82.8 Å²	82.8	27%	0.272	40%	0.403	S	S	.	.	S	Bend	trans	-57.4	151.9	176	-76.5	164.5	0	0	0	111.5	T71 W79 I83 K176	T71-I75 HydrophobicContact CG2-CD1 3.99Å; T71-I75 WeakPolarHBondContact O-CD1 3.33Å; T71-I75 WeakPolarHBondContact O-CG1 3.49Å; T71-I75 PolarHBondContact O-N 2.95Å; T71-I75 VanDerWaalsContact O-N 3.1Å; I75-W79 HydrophobicContact CG2-CB 3.25Å; I75-W79 HydrophobicContact CG2-CG 4.18Å; I75-I83 HydrophobicContact CD1-CD1 4.3Å; I75-K176 VanDerWaalsContact O-CE 3.3Å; I75-K176 WeakPolarHBondContact O-CE 3.23Å; I75-K176 PolarHBondContact O-NZ 2.84Å
76	R	91.1	Very high	89.7	Confident	175 Å²	175	81.4 Å²	81.4	66%	0.66	40%	0.396	S	S	*	.			trans	-62.4	146.8	177.9	-59.5	-178.2	-173.6	147.7	1.8	111	R78 W79 M80	R76-R78 PolarHBondContact O-N 3.19Å; R76-W79 PolarHBondContact O-N 2.9Å; R76-M80 PolarHBondContact O-N 3.09Å; R76-M80 VanDerWaalsContact O-N 3.11Å
77	W	91.3	Very high	90.4	Very high	104 Å²	104	79 Å²	79	39%	0.394	38%	0.376	S	S	.	.	H	α-helix	trans	-45.2	-44.7	178.9	-81	104.2	0	0	0	114.3	W79 M80 F81 V173 K176 M177	W77-W79 VanDerWaalsContact C-N 3.34Å; W77-W79 PolarHBondContact O-N 3.03Å; W77-M80 HydrophobicContact CD2-CE 4.35Å; W77-M80 HydrophobicContact CE3-CE 3.37Å; W77-M80 HydrophobicContact CH2-CE 4.01Å; W77-M80 HydrophobicContact CZ3-CE 3.18Å; W77-M80 PolarHBondContact O-N 2.99Å; W77-F81 HydrophobicContact CB-CD2 4.47Å; W77-F81 HydrophobicContact CB-CE2 4.29Å; W77-F81 HydrophobicContact CD2-CE2 4.38Å; W77-F81 HydrophobicContact CE3-CD2 4.32Å; W77-F81 AromaticContact CE3-CE2 3.51Å; W77-F81 HydrophobicContact CE3-CE2 3.51Å; W77-F81 AromaticContact CE3-CZ 3.66Å; W77-F81 HydrophobicContact CE3-CZ 3.66Å; W77-F81 HydrophobicContact CZ3-CE2 4.21Å; W77-F81 AromaticContact CZ3-CZ 3.88Å; W77-F81 HydrophobicContact CZ3-CZ 3.88Å; W77-F81 WeakPolarHBondContact O-CD2 3.36Å; W77-F81 PolarHBondContact O-N 2.86Å; W77-V173 HydrophobicContact CH2-CG1 4.31Å; W77-V173 HydrophobicContact CZ3-CG1 4.47Å; W77-K176 HydrophobicContact CD2-CD 3.95Å; W77-K176 HydrophobicContact CE3-CD 4.19Å; W77-K176 HydrophobicContact CH2-CB 4.38Å; W77-K176 HydrophobicContact CH2-CD 4.08Å; W77-K176 HydrophobicContact CH2-CG 4.22Å; W77-K176 HydrophobicContact CZ2-CB 4.32Å; W77-K176 HydrophobicContact CZ2-CD 3.83Å; W77-K176 HydrophobicContact CZ2-CG 3.77Å; W77-K176 HydrophobicContact CZ3-CD 4.27Å; W77-M177 HydrophobicContact CH2-CG 3.73Å; W77-M177 HydrophobicContact CZ2-CG 3.97Å
78	R	93.4	Very high	90.8	Very high	201 Å²	201	77.7 Å²	77.7	76%	0.758	37%	0.367	S	S	*	.	H	α-helix	trans	-54.7	-47.2	179.2	-66.5	-177.7	174.6	105.7	1.3	112.8	R76 I82	R76-R78 PolarHBondContact O-N 3.19Å; R78-I82 VanDerWaalsContact O-CG1 3.28Å; R78-I82 WeakPolarHBondContact O-CG1 3.49Å; R78-I82 PolarHBondContact O-N 2.81Å; R78-I82 VanDerWaalsContact O-N 3.11Å
79	W	92.9	Very high	91.4	Very high	148 Å²	148	76.5 Å²	76.5	56%	0.561	36%	0.361	S	S	*	.	H	α-helix	trans	-74.3	-35.4	-179.1	-68.7	119.7	0	0	0	111.9	I75 R76 W77 F81 I82 I83	I75-W79 HydrophobicContact CG2-CB 3.25Å; I75-W79 HydrophobicContact CG2-CG 4.18Å; R76-W79 PolarHBondContact O-N 2.9Å; W77-W79 VanDerWaalsContact C-N 3.34Å; W77-W79 PolarHBondContact O-N 3.03Å; W79-F81 PolarHBondContact O-N 2.98Å; W79-I82 HydrophobicContact CE3-CD1 3.82Å; W79-I82 HydrophobicContact CZ3-CD1 4.09Å; W79-I82 PolarHBondContact O-N 2.87Å; W79-I83 VanDerWaalsContact O-CG1 3.29Å; W79-I83 WeakPolarHBondContact O-CG1 3.37Å; W79-I83 PolarHBondContact O-N 3.12Å
80	M	92.2	Very high	92	Very high	0 Å²	0	76.7 Å²	76.7	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-60.4	-45.6	173.5	-169	-175.8	75.7	0	0	111.4	R76 W77 I82 I83 F84 V173 K176	R76-M80 PolarHBondContact O-N 3.09Å; R76-M80 VanDerWaalsContact O-N 3.11Å; W77-M80 HydrophobicContact CD2-CE 4.35Å; W77-M80 HydrophobicContact CE3-CE 3.37Å; W77-M80 HydrophobicContact CH2-CE 4.01Å; W77-M80 HydrophobicContact CZ3-CE 3.18Å; W77-M80 PolarHBondContact O-N 2.99Å; M80-I82 PolarHBondContact O-N 3.25Å; M80-I83 PolarHBondContact O-N 2.96Å; M80-F84 HydrophobicContact CE-CE2 3.72Å; M80-F84 HydrophobicContact CE-CZ 4.43Å; M80-F84 HydrophobicContact CG-CD2 4.15Å; M80-F84 HydrophobicContact CG-CE1 4.29Å; M80-F84 HydrophobicContact CG-CE2 3.5Å; M80-F84 VanDerWaalsContact CG-CE2 3.5Å; M80-F84 HydrophobicContact CG-CZ 3.57Å; M80-F84 WeakPolarHBondContact O-CG 3.29Å; M80-F84 PolarHBondContact O-N 3.11Å; M80-F84 HydrophobicContact SD-CE2 3.8Å; M80-F84 HydrophobicContact SD-CZ 3.92Å; M80-V173 HydrophobicContact CE-CG2 3.91Å; M80-K176 HydrophobicContact CE-CD 3.7Å; M80-K176 HydrophobicContact SD-CB 4.41Å; M80-K176 HydrophobicContact SD-CD 3.34Å; M80-K176 WeakPolarHBondContact SD-CD 3.44Å
81	F	92.8	Very high	92.5	Very high	108 Å²	108	74.7 Å²	74.7	47%	0.474	36%	0.355	S	S	.	.	H	α-helix	trans	-62.1	-41.2	174.6	-74.4	-60	0	0	0	112.4	W77 W79 I83 F84 C85	W77-F81 HydrophobicContact CB-CD2 4.47Å; W77-F81 HydrophobicContact CB-CE2 4.29Å; W77-F81 HydrophobicContact CD2-CE2 4.38Å; W77-F81 HydrophobicContact CE3-CD2 4.32Å; W77-F81 AromaticContact CE3-CE2 3.51Å; W77-F81 HydrophobicContact CE3-CE2 3.51Å; W77-F81 AromaticContact CE3-CZ 3.66Å; W77-F81 HydrophobicContact CE3-CZ 3.66Å; W77-F81 HydrophobicContact CZ3-CE2 4.21Å; W77-F81 AromaticContact CZ3-CZ 3.88Å; W77-F81 HydrophobicContact CZ3-CZ 3.88Å; W77-F81 WeakPolarHBondContact O-CD2 3.36Å; W77-F81 PolarHBondContact O-N 2.86Å; W79-F81 PolarHBondContact O-N 2.98Å; F81-I83 VanDerWaalsContact C-N 3.33Å; F81-I83 PolarHBondContact O-N 3.26Å; F81-F84 PolarHBondContact O-N 3.25Å; F81-C85 WeakPolarHBondContact O-CB 3.21Å; F81-C85 PolarHBondContact O-N 2.79Å; F81-C85 PolarHBondContact O-SG 3.05Å
82	I	94.9	Very high	92.9	Very high	91 Å²	91	75.3 Å²	75.3	47%	0.467	35%	0.353	S	S	.	.	H	α-helix	trans	-60.1	-44.5	175.7	-70.5	165.1	0	0	0	110.9	R78 W79 M80 F84 C85 L86	R78-I82 VanDerWaalsContact O-CG1 3.28Å; R78-I82 WeakPolarHBondContact O-CG1 3.49Å; R78-I82 PolarHBondContact O-N 2.81Å; R78-I82 VanDerWaalsContact O-N 3.11Å; W79-I82 HydrophobicContact CE3-CD1 3.82Å; W79-I82 HydrophobicContact CZ3-CD1 4.09Å; W79-I82 PolarHBondContact O-N 2.87Å; M80-I82 PolarHBondContact O-N 3.25Å; I82-F84 PolarHBondContact O-N 3.06Å; I82-C85 PolarHBondContact O-N 3.23Å; I82-L86 VanDerWaalsContact O-CB 3.29Å; I82-L86 WeakPolarHBondContact O-CB 3.48Å; I82-L86 PolarHBondContact O-N 3.3Å
83	I	92.7	Very high	93.4	Very high	75 Å²	75	78.2 Å²	78.2	39%	0.385	37%	0.367	S	S	.	.	H	α-helix	trans	-61.7	-44.2	178.5	-69.4	164.7	0	0	0	110.8	I75 W79 M80 F81 L86 A87	I75-I83 HydrophobicContact CD1-CD1 4.3Å; W79-I83 VanDerWaalsContact O-CG1 3.29Å; W79-I83 WeakPolarHBondContact O-CG1 3.37Å; W79-I83 PolarHBondContact O-N 3.12Å; M80-I83 PolarHBondContact O-N 2.96Å; F81-I83 VanDerWaalsContact C-N 3.33Å; F81-I83 PolarHBondContact O-N 3.26Å; I83-L86 PolarHBondContact O-N 3.1Å; I83-A87 WeakPolarHBondContact O-CB 3.23Å; I83-A87 PolarHBondContact O-N 2.88Å
84	F	93.6	Very high	93.8	Very high	14 Å²	14	83.8 Å²	83.8	6%	0.061	39%	0.392	C	S	.	.	H	α-helix	trans	-67.6	-43.4	178.1	-63.5	-22.1	0	0	0	112.9	M80 F81 I82 L86 A87 F88 I169 A172 V173	M80-F84 HydrophobicContact CE-CE2 3.72Å; M80-F84 HydrophobicContact CE-CZ 4.43Å; M80-F84 HydrophobicContact CG-CD2 4.15Å; M80-F84 HydrophobicContact CG-CE1 4.29Å; M80-F84 HydrophobicContact CG-CE2 3.5Å; M80-F84 VanDerWaalsContact CG-CE2 3.5Å; M80-F84 HydrophobicContact CG-CZ 3.57Å; M80-F84 WeakPolarHBondContact O-CG 3.29Å; M80-F84 PolarHBondContact O-N 3.11Å; M80-F84 HydrophobicContact SD-CE2 3.8Å; M80-F84 HydrophobicContact SD-CZ 3.92Å; F81-F84 PolarHBondContact O-N 3.25Å; I82-F84 PolarHBondContact O-N 3.06Å; F84-L86 VanDerWaalsContact C-N 3.28Å; F84-L86 PolarHBondContact O-N 3.27Å; F84-A87 PolarHBondContact O-N 2.9Å; F84-F88 WeakPolarHBondContact O-CD2 3.36Å; F84-F88 PolarHBondContact O-N 2.73Å; F84-I169 HydrophobicContact CB-CD1 4.09Å; F84-I169 HydrophobicContact CB-CG1 4.34Å; F84-I169 HydrophobicContact CD1-CD1 4.33Å; F84-I169 HydrophobicContact CD1-CG1 3.75Å; F84-I169 HydrophobicContact CD2-CG1 4.32Å; F84-I169 HydrophobicContact CD2-CG2 3.8Å; F84-I169 HydrophobicContact CE1-CG1 4.08Å; F84-I169 HydrophobicContact CE2-CG2 3.97Å; F84-I169 HydrophobicContact CG-CD1 4.2Å; F84-I169 HydrophobicContact CG-CG1 3.9Å; F84-I169 HydrophobicContact CG-CG2 4.2Å; F84-I169 HydrophobicContact CZ-CG1 4.49Å; F84-A172 HydrophobicContact CE1-CB 4.46Å; F84-A172 HydrophobicContact CZ-CB 3.74Å; F84-V173 HydrophobicContact CD2-CG2 4.45Å; F84-V173 HydrophobicContact CE2-CG2 3.73Å
85	C	94.7	Very high	94.2	Very high	75 Å²	75	79.1 Å²	79.1	51%	0.507	37%	0.367	S	S	.	.	H	α-helix	trans	-59	-42.2	173.5	-70.4	0	0	0	0	111.3	F81 I82 F88 L89	F81-C85 WeakPolarHBondContact O-CB 3.21Å; F81-C85 PolarHBondContact O-N 2.79Å; F81-C85 PolarHBondContact O-SG 3.05Å; I82-C85 PolarHBondContact O-N 3.23Å; C85-F88 PolarHBondContact O-N 3.26Å; C85-L89 WeakPolarHBondContact O-CB 3.36Å; C85-L89 VanDerWaalsContact O-CG 3.26Å; C85-L89 WeakPolarHBondContact O-CG 3.23Å; C85-L89 PolarHBondContact O-N 3.16Å
86	L	95.3	Very high	94.5	Very high	95 Å²	95	76.6 Å²	76.6	50%	0.497	35%	0.354	S	S	.	.	H	α-helix	trans	-65.4	-41.6	177.4	-174.8	65.4	0	0	0	111.6	I82 I83 F84 F88 L89 L90	I82-L86 VanDerWaalsContact O-CB 3.29Å; I82-L86 WeakPolarHBondContact O-CB 3.48Å; I82-L86 PolarHBondContact O-N 3.3Å; I83-L86 PolarHBondContact O-N 3.1Å; F84-L86 VanDerWaalsContact C-N 3.28Å; F84-L86 PolarHBondContact O-N 3.27Å; L86-F88 PolarHBondContact O-N 2.96Å; L86-L89 PolarHBondContact O-N 3Å; L86-L90 HydrophobicContact CD1-CD1 4.1Å; L86-L90 HydrophobicContact CD1-CG 4.03Å; L86-L90 HydrophobicContact CD2-CD1 4.4Å; L86-L90 HydrophobicContact CG-CD1 3.82Å; L86-L90 HydrophobicContact CG-CG 4.17Å; L86-L90 VanDerWaalsContact O-CB 3.32Å; L86-L90 WeakPolarHBondContact O-CB 3.36Å; L86-L90 VanDerWaalsContact O-CG 3.23Å; L86-L90 WeakPolarHBondContact O-CG 3.15Å; L86-L90 PolarHBondContact O-N 2.96Å
87	A	94.1	Very high	94.7	Very high	39 Å²	39	70.9 Å²	70.9	32%	0.322	34%	0.34	S	S	.	.	H	α-helix	trans	-59.5	-46.5	176.6	0	0	0	0	0	111.8	I83 F84 S91	I83-A87 WeakPolarHBondContact O-CB 3.23Å; I83-A87 PolarHBondContact O-N 2.88Å; F84-A87 PolarHBondContact O-N 2.9Å; A87-S91 WeakPolarHBondContact O-CB 3.33Å; A87-S91 PolarHBondContact O-N 3.47Å; A87-S91 PolarHBondContact O-OG 3.36Å
88	F	95	Very high	94.9	Very high	46 Å²	46	67.5 Å²	67.5	20%	0.202	33%	0.329	C	S	.	.	H	α-helix	trans	-62	-51.3	174.4	-79.4	-57.8	0	0	0	112.1	F84 C85 L86 L90 S91 W92 I165 D166 I169	F84-F88 WeakPolarHBondContact O-CD2 3.36Å; F84-F88 PolarHBondContact O-N 2.73Å; C85-F88 PolarHBondContact O-N 3.26Å; L86-F88 PolarHBondContact O-N 2.96Å; F88-L90 VanDerWaalsContact C-N 3.33Å; F88-L90 PolarHBondContact O-N 3.14Å; F88-S91 WeakPolarHBondContact CA-OG 3.49Å; F88-S91 PolarHBondContact O-N 3.24Å; F88-S91 VanDerWaalsContact O-N 3.16Å; F88-S91 PolarHBondContact O-OG 2.89Å; F88-W92 HydrophobicContact CB-CD2 4.42Å; F88-W92 HydrophobicContact CB-CH2 4.06Å; F88-W92 HydrophobicContact CB-CZ2 3.81Å; F88-W92 HydrophobicContact CB-CZ3 4.46Å; F88-W92 HydrophobicContact CD1-CZ2 4.11Å; F88-W92 HydrophobicContact CG-CZ2 4.11Å; F88-W92 PolarHBondContact O-N 2.78Å; F88-I165 HydrophobicContact CD1-CG2 4.2Å; F88-I165 HydrophobicContact CE1-CG2 3.84Å; F88-I165 HydrophobicContact CZ-CG2 4.25Å; F88-D166 VanDerWaalsContact CE1-OD1 3.26Å; F88-D166 WeakPolarHBondContact CE1-OD1 3.46Å; F88-D166 WeakPolarHBondContact CZ-OD1 3.34Å; F88-I169 HydrophobicContact CD2-CD1 3.98Å; F88-I169 HydrophobicContact CE1-CD1 4.29Å; F88-I169 HydrophobicContact CE2-CD1 3.22Å; F88-I169 HydrophobicContact CZ-CD1 3.41Å; F88-I169 VanDerWaalsContact CZ-CD1 3.41Å
89	L	95.9	Very high	94.9	Very high	80 Å²	80	58 Å²	58	42%	0.419	29%	0.293	S	S	.	.	H	α-helix	trans	-57.9	-44.4	-179.7	-74.7	169.5	0	0	0	112.3	C85 L86 W92 L93	C85-L89 WeakPolarHBondContact O-CB 3.36Å; C85-L89 VanDerWaalsContact O-CG 3.26Å; C85-L89 WeakPolarHBondContact O-CG 3.23Å; C85-L89 PolarHBondContact O-N 3.16Å; L86-L89 PolarHBondContact O-N 3Å; L89-W92 HydrophobicContact CD2-CE3 4.02Å; L89-W92 HydrophobicContact CD2-CZ3 4.08Å; L89-W92 PolarHBondContact O-N 3.02Å; L89-L93 WeakPolarHBondContact O-CB 3.49Å; L89-L93 VanDerWaalsContact O-CG 3.25Å; L89-L93 WeakPolarHBondContact O-CG 3.44Å; L89-L93 PolarHBondContact O-N 3.18Å
90	L	96.4	Very high	94.9	Very high	102 Å²	102	55.4 Å²	55.4	53%	0.534	28%	0.283	S	S	.	.	H	α-helix	trans	-64.9	-41.4	177.8	-71.6	175.8	0	0	0	111.7	L86 F88 L93 F94	L86-L90 HydrophobicContact CD1-CD1 4.1Å; L86-L90 HydrophobicContact CD1-CG 4.03Å; L86-L90 HydrophobicContact CD2-CD1 4.4Å; L86-L90 HydrophobicContact CG-CD1 3.82Å; L86-L90 HydrophobicContact CG-CG 4.17Å; L86-L90 VanDerWaalsContact O-CB 3.32Å; L86-L90 WeakPolarHBondContact O-CB 3.36Å; L86-L90 VanDerWaalsContact O-CG 3.23Å; L86-L90 WeakPolarHBondContact O-CG 3.15Å; L86-L90 PolarHBondContact O-N 2.96Å; F88-L90 VanDerWaalsContact C-N 3.33Å; F88-L90 PolarHBondContact O-N 3.14Å; L90-L93 PolarHBondContact O-N 2.87Å; L90-F94 VanDerWaalsContact O-CB 3.25Å; L90-F94 WeakPolarHBondContact O-CB 3.31Å; L90-F94 PolarHBondContact O-N 3.3Å
91	S	96.4	Very high	94.9	Very high	13 Å²	13	59 Å²	59	9%	0.091	30%	0.302	C	S	.	.	H	α-helix	trans	-64.1	-45.1	176	66.5	0	0	0	0	112.2	A87 F88 L93 F94 F95 Q134	A87-S91 WeakPolarHBondContact O-CB 3.33Å; A87-S91 PolarHBondContact O-N 3.47Å; A87-S91 PolarHBondContact O-OG 3.36Å; F88-S91 WeakPolarHBondContact CA-OG 3.49Å; F88-S91 PolarHBondContact O-N 3.24Å; F88-S91 VanDerWaalsContact O-N 3.16Å; F88-S91 PolarHBondContact O-OG 2.89Å; S91-L93 PolarHBondContact O-N 2.81Å; S91-F94 PolarHBondContact O-N 3.12Å; S91-F95 VanDerWaalsContact O-CD2 3.31Å; S91-F95 WeakPolarHBondContact O-CD2 3.42Å; S91-F95 PolarHBondContact O-N 3.46Å; S91-Q134 PolarHBondContact OG-NE2 3.15Å; S91-Q134 PolarHBondContact OG-OE1 3.22Å
92	W	96.9	Very high	94.8	Very high	48 Å²	48	55 Å²	55	18%	0.182	29%	0.287	C	S	.	.	H	α-helix	trans	-63.7	-41.6	178.2	-60.9	-23.2	0	0	0	112	F88 L89 G96 F127 S130 I131 T135	F88-W92 HydrophobicContact CB-CD2 4.42Å; F88-W92 HydrophobicContact CB-CH2 4.06Å; F88-W92 HydrophobicContact CB-CZ2 3.81Å; F88-W92 HydrophobicContact CB-CZ3 4.46Å; F88-W92 HydrophobicContact CD1-CZ2 4.11Å; F88-W92 HydrophobicContact CG-CZ2 4.11Å; F88-W92 PolarHBondContact O-N 2.78Å; L89-W92 HydrophobicContact CD2-CE3 4.02Å; L89-W92 HydrophobicContact CD2-CZ3 4.08Å; L89-W92 PolarHBondContact O-N 3.02Å; W92-G96 WeakPolarHBondContact O-CA 3.31Å; W92-G96 PolarHBondContact O-N 2.88Å; W92-F127 HydrophobicContact CB-CD2 4.35Å; W92-F127 HydrophobicContact CB-CE2 3.66Å; W92-F127 HydrophobicContact CB-CZ 4.38Å; W92-S130 WeakPolarHBondContact O-CB 3.47Å; W92-S130 PolarHBondContact O-OG 2.85Å; W92-I131 HydrophobicContact CB-CG1 4Å; W92-I131 HydrophobicContact CD2-CD1 4.5Å; W92-I131 HydrophobicContact CD2-CG1 3.77Å; W92-I131 HydrophobicContact CE3-CD1 4.15Å; W92-I131 HydrophobicContact CE3-CG1 3.91Å; W92-I131 HydrophobicContact CG-CG1 3.81Å; W92-T135 HydrophobicContact CZ2-CG2 3.75Å
93	L	96.7	Very high	94.5	Very high	71 Å²	71	50.8 Å²	50.8	37%	0.372	27%	0.266	S	S	.	.	H	α-helix	trans	-65.1	-44.5	175.3	-74.8	171.3	0	0	0	111.5	L89 L90 S91 G96 C97 F123 F127	L89-L93 WeakPolarHBondContact O-CB 3.49Å; L89-L93 VanDerWaalsContact O-CG 3.25Å; L89-L93 WeakPolarHBondContact O-CG 3.44Å; L89-L93 PolarHBondContact O-N 3.18Å; L90-L93 PolarHBondContact O-N 2.87Å; S91-L93 PolarHBondContact O-N 2.81Å; L93-G96 PolarHBondContact O-N 2.83Å; L93-C97 WeakPolarHBondContact O-CB 3.43Å; L93-C97 PolarHBondContact O-N 2.94Å; L93-C97 PolarHBondContact O-SG 2.89Å; L93-F123 HydrophobicContact CD2-CE1 4.48Å; L93-F123 HydrophobicContact CD2-CZ 4.28Å; L93-F127 HydrophobicContact CD2-CD2 3.82Å; L93-F127 HydrophobicContact CD2-CE2 3.66Å; L93-F127 HydrophobicContact CD2-CZ 4.42Å; L93-F127 HydrophobicContact CG-CD2 4.38Å; L93-F127 HydrophobicContact CG-CE2 3.87Å
94	F	96.7	Very high	94.3	Very high	120 Å²	120	50.5 Å²	50.5	53%	0.526	26%	0.264	S	S	.	.	H	α-helix	trans	-59.1	-52.5	178.7	175.4	-102.9	0	0	0	111.9	L90 S91 C97 I98	L90-F94 VanDerWaalsContact O-CB 3.25Å; L90-F94 WeakPolarHBondContact O-CB 3.31Å; L90-F94 PolarHBondContact O-N 3.3Å; S91-F94 PolarHBondContact O-N 3.12Å; F94-C97 WeakPolarHBondContact O-CB 3.49Å; F94-C97 PolarHBondContact O-N 3.07Å; F94-I98 HydrophobicContact CD1-CD1 3.91Å; F94-I98 HydrophobicContact CE1-CD1 3.38Å; F94-I98 HydrophobicContact CE2-CD1 4.13Å; F94-I98 HydrophobicContact CG-CD1 4.49Å; F94-I98 HydrophobicContact CZ-CD1 3.52Å; F94-I98 WeakPolarHBondContact O-CG1 3.25Å; F94-I98 PolarHBondContact O-N 3.19Å
95	F	96.1	Very high	94	Very high	3 Å²	3	58.1 Å²	58.1	1%	0.013	30%	0.297	C	S	.	.	H	α-helix	trans	-68.6	-35	177.6	-77.4	-71.2	0	0	0	112.6	S91 C97 I98 F99 S130 F157 Q158 V161	S91-F95 VanDerWaalsContact O-CD2 3.31Å; S91-F95 WeakPolarHBondContact O-CD2 3.42Å; S91-F95 PolarHBondContact O-N 3.46Å; F95-C97 VanDerWaalsContact C-N 3.34Å; F95-C97 PolarHBondContact O-N 2.94Å; F95-I98 HydrophobicContact CD1-CD1 4.4Å; F95-I98 PolarHBondContact O-N 3.3Å; F95-F99 HydrophobicContact CB-CE2 4.2Å; F95-F99 WeakPolarHBondContact O-CD2 3.49Å; F95-F99 PolarHBondContact O-N 3.36Å; F95-S130 VanDerWaalsContact CB-OG 3.3Å; F95-S130 WeakPolarHBondContact CB-OG 3.26Å; F95-F157 AromaticContact CE1-CD1 3.75Å; F95-F157 HydrophobicContact CE1-CD1 3.75Å; F95-F157 HydrophobicContact CE1-CE1 4.22Å; F95-F157 AromaticContact CZ-CD1 3.77Å; F95-F157 HydrophobicContact CZ-CD1 3.77Å; F95-F157 AromaticContact CZ-CE1 3.92Å; F95-F157 HydrophobicContact CZ-CE1 3.92Å; F95-Q158 HydrophobicContact CB-CG 4.37Å; F95-Q158 HydrophobicContact CD1-CB 3.77Å; F95-Q158 HydrophobicContact CD1-CG 3.96Å; F95-Q158 HydrophobicContact CD2-CB 4.3Å; F95-Q158 HydrophobicContact CD2-CG 3.72Å; F95-Q158 HydrophobicContact CE1-CB 3.64Å; F95-Q158 HydrophobicContact CE1-CG 4.14Å; F95-Q158 HydrophobicContact CE2-CB 4.2Å; F95-Q158 HydrophobicContact CE2-CG 3.93Å; F95-Q158 HydrophobicContact CG-CB 4.11Å; F95-Q158 HydrophobicContact CG-CG 3.76Å; F95-Q158 HydrophobicContact CZ-CB 3.87Å; F95-Q158 HydrophobicContact CZ-CG 4.14Å; F95-V161 HydrophobicContact CE2-CB 4.33Å; F95-V161 HydrophobicContact CE2-CG1 4.18Å; F95-V161 HydrophobicContact CZ-CB 4.32Å; F95-V161 HydrophobicContact CZ-CG2 4.38Å
96	G	95.7	Very high	93.5	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.3	-42	173.6	0	0	0	0	0	112.3	W92 L93 W100 S130	W92-G96 WeakPolarHBondContact O-CA 3.31Å; W92-G96 PolarHBondContact O-N 2.88Å; L93-G96 PolarHBondContact O-N 2.83Å; G96-W100 VanDerWaalsContact O-CB 3.3Å; G96-W100 WeakPolarHBondContact O-CB 3.47Å; G96-W100 PolarHBondContact O-N 3.44Å; G96-S130 PolarHBondContact N-OG 2.81Å
97	C	95.8	Very high	92.9	Very high	55 Å²	55	55.4 Å²	55.4	37%	0.372	28%	0.282	S	S	.	.	H	α-helix	trans	-61.8	-43.7	171.7	-72.3	0	0	0	0	111.7	L93 F94 F95 W100 L101 F123	L93-C97 WeakPolarHBondContact O-CB 3.43Å; L93-C97 PolarHBondContact O-N 2.94Å; L93-C97 PolarHBondContact O-SG 2.89Å; F94-C97 WeakPolarHBondContact O-CB 3.49Å; F94-C97 PolarHBondContact O-N 3.07Å; F95-C97 VanDerWaalsContact C-N 3.34Å; F95-C97 PolarHBondContact O-N 2.94Å; C97-W100 PolarHBondContact O-N 3.32Å; C97-L101 WeakPolarHBondContact O-CB 3.48Å; C97-L101 VanDerWaalsContact O-CG 3.29Å; C97-L101 WeakPolarHBondContact O-CG 3.46Å; C97-L101 PolarHBondContact O-N 2.83Å; C97-F123 HydrophobicContact CB-CE2 4.49Å; C97-F123 VanDerWaalsContact SG-CE2 3.58Å
98	I	94.7	Very high	92.1	Very high	34 Å²	34	53.9 Å²	53.9	17%	0.174	27%	0.268	C	S	.	.	H	α-helix	trans	-61.6	-49.3	177.6	-69.9	171.3	0	0	0	111	F94 F95 W100 L101 V102 M154	F94-I98 HydrophobicContact CD1-CD1 3.91Å; F94-I98 HydrophobicContact CE1-CD1 3.38Å; F94-I98 HydrophobicContact CE2-CD1 4.13Å; F94-I98 HydrophobicContact CG-CD1 4.49Å; F94-I98 HydrophobicContact CZ-CD1 3.52Å; F94-I98 WeakPolarHBondContact O-CG1 3.25Å; F94-I98 PolarHBondContact O-N 3.19Å; F95-I98 HydrophobicContact CD1-CD1 4.4Å; F95-I98 PolarHBondContact O-N 3.3Å; I98-W100 VanDerWaalsContact C-N 3.3Å; I98-W100 PolarHBondContact O-N 3.15Å; I98-L101 PolarHBondContact O-N 3.14Å; I98-V102 HydrophobicContact CG2-CG2 4.38Å; I98-V102 WeakPolarHBondContact O-CG2 3.23Å; I98-V102 PolarHBondContact O-N 2.77Å; I98-M154 HydrophobicContact CG2-CE 4.28Å; I98-M154 HydrophobicContact CG2-CG 3.94Å; I98-M154 HydrophobicContact CG2-SD 3.94Å
99	F	93.8	Very high	91	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.5	-36	178.9	-67.4	-54.2	0	0	0	112.7	F95 V102 A103 I117 A126 F129 M154 V155	F95-F99 HydrophobicContact CB-CE2 4.2Å; F95-F99 WeakPolarHBondContact O-CD2 3.49Å; F95-F99 PolarHBondContact O-N 3.36Å; F99-V102 PolarHBondContact O-N 2.91Å; F99-A103 WeakPolarHBondContact O-CB 3.39Å; F99-A103 PolarHBondContact O-N 3.02Å; F99-I117 HydrophobicContact CB-CD1 3.9Å; F99-I117 HydrophobicContact CD1-CD1 3.48Å; F99-I117 VanDerWaalsContact CD1-CD1 3.48Å; F99-I117 HydrophobicContact CE1-CD1 4.28Å; F99-I117 HydrophobicContact CG-CD1 3.94Å; F99-A126 HydrophobicContact CB-CB 4.44Å; F99-F129 HydrophobicContact CB-CD1 4.47Å; F99-F129 HydrophobicContact CD1-CD1 4.36Å; F99-F129 HydrophobicContact CD1-CE1 4.05Å; F99-F129 AromaticContact CD2-CD1 3.74Å; F99-F129 HydrophobicContact CD2-CD1 3.74Å; F99-F129 HydrophobicContact CD2-CE1 4.05Å; F99-F129 AromaticContact CE1-CE1 3.92Å; F99-F129 HydrophobicContact CE1-CE1 3.92Å; F99-F129 AromaticContact CE2-CD1 3.96Å; F99-F129 HydrophobicContact CE2-CD1 3.96Å; F99-F129 AromaticContact CE2-CE1 3.93Å; F99-F129 HydrophobicContact CE2-CE1 3.93Å; F99-F129 AromaticContact CG-CD1 3.96Å; F99-F129 HydrophobicContact CG-CD1 3.96Å; F99-F129 HydrophobicContact CG-CE1 4.12Å; F99-F129 HydrophobicContact CZ-CD1 4.36Å; F99-F129 AromaticContact CZ-CE1 3.86Å; F99-F129 HydrophobicContact CZ-CE1 3.86Å; F99-M154 HydrophobicContact CE1-CB 3.83Å; F99-M154 HydrophobicContact CZ-CB 4.33Å; F99-V155 HydrophobicContact CE1-CG2 4.04Å; F99-V155 HydrophobicContact CZ-CG2 3.97Å
100	W	93.3	Very high	89.7	Confident	94 Å²	94	62 Å²	62	36%	0.356	31%	0.307	S	S	.	.	H	α-helix	trans	-63.6	-42.6	173.2	-178.6	85.6	0	0	0	111.8	G96 C97 I98 A103 I104 F123 A126	G96-W100 VanDerWaalsContact O-CB 3.3Å; G96-W100 WeakPolarHBondContact O-CB 3.47Å; G96-W100 PolarHBondContact O-N 3.44Å; C97-W100 PolarHBondContact O-N 3.32Å; I98-W100 VanDerWaalsContact C-N 3.3Å; I98-W100 PolarHBondContact O-N 3.15Å; W100-A103 PolarHBondContact O-N 2.92Å; W100-I104 HydrophobicContact CD2-CD1 3.63Å; W100-I104 HydrophobicContact CD2-CG1 4.49Å; W100-I104 HydrophobicContact CE3-CD1 3.74Å; W100-I104 HydrophobicContact CH2-CD1 3.13Å; W100-I104 HydrophobicContact CZ2-CD1 3Å; W100-I104 HydrophobicContact CZ2-CG1 4.39Å; W100-I104 HydrophobicContact CZ3-CD1 3.5Å; W100-I104 VanDerWaalsContact CZ3-CD1 3.5Å; W100-I104 PolarHBondContact O-N 2.79Å; W100-F123 HydrophobicContact CB-CD2 4.08Å; W100-F123 VanDerWaalsContact CD1-CA 3.46Å; W100-F123 HydrophobicContact CD2-CD2 4.47Å; W100-F123 HydrophobicContact CG-CB 4.5Å; W100-F123 AromaticContact CG-CD2 3.94Å; W100-F123 HydrophobicContact CG-CD2 3.94Å; W100-A126 HydrophobicContact CB-CB 3.79Å
101	L	92.3	Very high	88.1	Confident	76 Å²	76	59.2 Å²	59.2	40%	0.398	30%	0.296	S	S	.	.	H	α-helix	trans	-64	-43.9	175.4	-73.1	172.1	0	0	0	111.4	C97 I98 A103 I104 F105	C97-L101 WeakPolarHBondContact O-CB 3.48Å; C97-L101 VanDerWaalsContact O-CG 3.29Å; C97-L101 WeakPolarHBondContact O-CG 3.46Å; C97-L101 PolarHBondContact O-N 2.83Å; I98-L101 PolarHBondContact O-N 3.14Å; L101-A103 VanDerWaalsContact C-N 3.33Å; L101-A103 PolarHBondContact O-N 3.24Å; L101-I104 PolarHBondContact O-N 3.1Å; L101-F105 HydrophobicContact CB-CD2 4.29Å; L101-F105 HydrophobicContact CB-CE2 4.3Å; L101-F105 HydrophobicContact CD2-CE2 4.19Å; L101-F105 WeakPolarHBondContact O-CB 3.46Å; L101-F105 WeakPolarHBondContact O-CD2 3.2Å; L101-F105 PolarHBondContact O-N 2.79Å
102	V	90.4	Very high	86.7	Confident	25 Å²	25	65.3 Å²	65.3	15%	0.152	33%	0.328	C	S	.	.	H	α-helix	trans	-59.1	-45.7	176.2	170.9	0	0	0	0	110.7	I98 F99 I104 F105 H106 C116 V150 A151	I98-V102 HydrophobicContact CG2-CG2 4.38Å; I98-V102 WeakPolarHBondContact O-CG2 3.23Å; I98-V102 PolarHBondContact O-N 2.77Å; F99-V102 PolarHBondContact O-N 2.91Å; V102-I104 VanDerWaalsContact C-N 3.32Å; V102-I104 PolarHBondContact O-N 3.42Å; V102-F105 PolarHBondContact O-N 3.48Å; V102-H106 VanDerWaalsContact O-CB 3.32Å; V102-H106 WeakPolarHBondContact O-CB 3.32Å; V102-H106 PolarHBondContact O-N 3.18Å; V102-C116 HydrophobicContact CG1-CB 4.42Å; V102-V150 HydrophobicContact CG2-CG1 4.45Å; V102-A151 HydrophobicContact CG1-CB 4.35Å
103	A	88.6	Confident	85.1	Confident	2 Å²	2	68.5 Å²	68.5	2%	0.017	35%	0.353	C	S	.	.	H	α-helix	trans	-61.6	-38.7	177.9	0	0	0	0	0	112.3	F99 W100 L101 G107 D108 V120	F99-A103 WeakPolarHBondContact O-CB 3.39Å; F99-A103 PolarHBondContact O-N 3.02Å; W100-A103 PolarHBondContact O-N 2.92Å; L101-A103 VanDerWaalsContact C-N 3.33Å; L101-A103 PolarHBondContact O-N 3.24Å; A103-G107 PolarHBondContact O-N 2.79Å; A103-D108 HydrophobicContact CB-CB 4.2Å; A103-D108 WeakPolarHBondContact O-CB 3.49Å; A103-D108 PolarHBondContact O-N 3.02Å; A103-V120 HydrophobicContact CB-CG1 4.43Å
104	I	88.6	Confident	83.9	Confident	68 Å²	68	71.3 Å²	71.3	35%	0.349	36%	0.362	S	S	.	.	H	α-helix	trans	-72.3	-46.8	177.9	-76	178.3	0	0	0	112.4	W100 L101 V102 H106 G107	W100-I104 HydrophobicContact CD2-CD1 3.63Å; W100-I104 HydrophobicContact CD2-CG1 4.49Å; W100-I104 HydrophobicContact CE3-CD1 3.74Å; W100-I104 HydrophobicContact CH2-CD1 3.13Å; W100-I104 HydrophobicContact CZ2-CD1 3Å; W100-I104 HydrophobicContact CZ2-CG1 4.39Å; W100-I104 HydrophobicContact CZ3-CD1 3.5Å; W100-I104 VanDerWaalsContact CZ3-CD1 3.5Å; W100-I104 PolarHBondContact O-N 2.79Å; L101-I104 PolarHBondContact O-N 3.1Å; V102-I104 VanDerWaalsContact C-N 3.32Å; V102-I104 PolarHBondContact O-N 3.42Å; I104-H106 PolarHBondContact O-N 3.06Å; I104-G107 PolarHBondContact O-N 2.99Å; I104-G107 VanDerWaalsContact O-N 3.1Å
105	F	87.3	Confident	83.2	Confident	174 Å²	174	68.1 Å²	68.1	76%	0.763	35%	0.348	S	S	*	.	H	α-helix	trans	-65	-29.8	-179.9	-78.8	-61.6	0	0	0	112.4	L101 V102	L101-F105 HydrophobicContact CB-CD2 4.29Å; L101-F105 HydrophobicContact CB-CE2 4.3Å; L101-F105 HydrophobicContact CD2-CE2 4.19Å; L101-F105 WeakPolarHBondContact O-CB 3.46Å; L101-F105 WeakPolarHBondContact O-CD2 3.2Å; L101-F105 PolarHBondContact O-N 2.79Å; V102-F105 PolarHBondContact O-N 3.48Å
106	H	84.4	Confident	82.7	Confident	88 Å²	88	68.1 Å²	68.1	41%	0.407	35%	0.348	S	S	.	.	H	α-helix	trans	-79.3	-21.5	174.6	-165.9	-102.5	0	0	0	113.4	V102 I104 D108 K114 C116 C148	V102-H106 VanDerWaalsContact O-CB 3.32Å; V102-H106 WeakPolarHBondContact O-CB 3.32Å; V102-H106 PolarHBondContact O-N 3.18Å; I104-H106 PolarHBondContact O-N 3.06Å; H106-D108 IonicContact CE1-OD1 3.58Å; H106-D108 IonicContact CG-OD1 2.67Å; H106-D108 IonicContact ND1-OD1 3.73Å; H106-D108 PolarHBondContact ND1-OD1 3.25Å; H106-K114 PolarHBondContact CE1-O 2.75Å; H106-K114 VanDerWaalsContact CE1-O 3.31Å; H106-C116 VanDerWaalsContact CB-SG 3.57Å; H106-C116 PolarHBondContact CD2-SG 2.84Å; H106-C116 PolarHBondContact ND1-SG 3.06Å; H106-C148 VanDerWaalsContact CD2-SG 3.59Å; H106-C148 PolarHBondContact NE2-SG 3.41Å
107	G	81.9	Confident	82.2	Confident	26 Å²	26	68.2 Å²	68.2	27%	0.268	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	24	-175.6	0	0	0	0	0	114	A103 I104 L109 E110 S111	A103-G107 PolarHBondContact O-N 2.79Å; I104-G107 PolarHBondContact O-N 2.99Å; I104-G107 VanDerWaalsContact O-N 3.1Å; G107-L109 PolarHBondContact O-N 2.97Å; G107-L109 VanDerWaalsContact O-N 3.09Å; G107-E110 PolarHBondContact O-N 2.9Å; G107-S111 PolarHBondContact O-N 2.84Å; G107-S111 PolarHBondContact O-OG 3.18Å
108	D	76.6	Confident	81.7	Confident	7 Å²	7	66.4 Å²	66.4	4%	0.037	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.7	-180	-75.7	-6.8	0	0	0	113.1	A103 H106 K115 C116 I117	A103-D108 HydrophobicContact CB-CB 4.2Å; A103-D108 WeakPolarHBondContact O-CB 3.49Å; A103-D108 PolarHBondContact O-N 3.02Å; H106-D108 IonicContact CE1-OD1 3.58Å; H106-D108 IonicContact CG-OD1 2.67Å; H106-D108 IonicContact ND1-OD1 3.73Å; H106-D108 PolarHBondContact ND1-OD1 3.25Å; D108-K115 HydrophobicContact CB-CB 4.45Å; D108-K115 HydrophobicContact CB-CG 4.36Å; D108-K115 VanDerWaalsContact OD1-CA 3.3Å; D108-K115 WeakPolarHBondContact OD1-CA 3.23Å; D108-C116 PolarHBondContact OD1-N 2.75Å; D108-C116 VanDerWaalsContact OD1-N 3.15Å; D108-C116 VanDerWaalsContact OD2-CB 3.32Å; D108-C116 WeakPolarHBondContact OD2-CB 3.41Å; D108-C116 PolarHBondContact OD2-N 2.92Å; D108-I117 PolarHBondContact OD2-N 3.13Å
109	L	71.8	Confident	81.3	Confident	103 Å²	103	67.8 Å²	67.8	54%	0.539	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-26.6	-177.7	-143.3	75.4	0	0	0	113.4	G107	G107-L109 PolarHBondContact O-N 2.97Å; G107-L109 VanDerWaalsContact O-N 3.09Å
110	E	69.6	Low	81.1	Confident	193 Å²	193	68.2 Å²	68.2	90%	0.902	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-24.3	-172.6	-63.6	-175	173.5	0	0	112.9	G107	G107-E110 PolarHBondContact O-N 2.9Å
111	S	63.6	Low	80.7	Confident	43 Å²	43	68.2 Å²	68.2	30%	0.301	36%	0.361	S	S	.	.			trans	-108.6	131.4	-175.7	63.4	0	0	0	0	112	G107 K115	G107-S111 PolarHBondContact O-N 2.84Å; G107-S111 PolarHBondContact O-OG 3.18Å; S111-K115 WeakPolarHBondContact O-CE 3.27Å
112	D	66.2	Low	80.6	Confident	141 Å²	141	67 Å²	67	75%	0.754	36%	0.359	S	S	*	.			trans	-90.5	-6.7	179.6	-141.7	21.4	0	0	0	112.8	K115	D112-K115 IonicContact OD1-NZ 2.73Å; D112-K115 PolarHBondContact OD1-NZ 2.8Å
113	T	64	Low	80.7	Confident	115 Å²	115	69.6 Å²	69.6	71%	0.706	37%	0.369	S	S	*	.	S	Bend	trans	-103.3	114.7	-179.1	49.3	0	0	0	0	110.8
114	K	70.2	Confident	80.9	Confident	130 Å²	130	73.8 Å²	73.8	57%	0.565	39%	0.394	S	S	*	.	S	Bend	trans	64.2	79.1	175.1	-64.3	167.1	159.4	-92.6	0	114.6	H106 E147	H106-K114 PolarHBondContact CE1-O 2.75Å; H106-K114 VanDerWaalsContact CE1-O 3.31Å; K114-E147 HydrophobicContact CB-CG 4.08Å; K114-E147 HydrophobicContact CG-CG 4.41Å; K114-E147 IonicContact NZ-OE1 3.59Å; K114-E147 PolarHBondContact NZ-OE1 2.99Å; K114-E147 IonicContact NZ-OE2 2.7Å; K114-E147 PolarHBondContact NZ-OE2 3.27Å
115	K	82.9	Confident	81.1	Confident	54 Å²	54	70.8 Å²	70.8	24%	0.235	38%	0.379	C	S	.	.			trans	-87	143.7	176.2	-63.6	174.6	-176	162.5	0	111.5	D108 S111 D112 T145	D108-K115 HydrophobicContact CB-CB 4.45Å; D108-K115 HydrophobicContact CB-CG 4.36Å; D108-K115 VanDerWaalsContact OD1-CA 3.3Å; D108-K115 WeakPolarHBondContact OD1-CA 3.23Å; S111-K115 WeakPolarHBondContact O-CE 3.27Å; D112-K115 IonicContact OD1-NZ 2.73Å; D112-K115 PolarHBondContact OD1-NZ 2.8Å; K115-T145 WeakPolarHBondContact O-CB 3.38Å; K115-T145 VanDerWaalsContact O-CG2 3.22Å; K115-T145 WeakPolarHBondContact O-CG2 3.08Å; K115-T145 PolarHBondContact O-OG1 3.2Å
116	C	84.3	Confident	81.4	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.014	34%	0.343	C	S	.	.	S	Bend	trans	-66.4	-43.1	171.9	-63.4	0	0	0	0	111.8	V102 H106 D108 T145 C148 A151	V102-C116 HydrophobicContact CG1-CB 4.42Å; H106-C116 VanDerWaalsContact CB-SG 3.57Å; H106-C116 PolarHBondContact CD2-SG 2.84Å; H106-C116 PolarHBondContact ND1-SG 3.06Å; D108-C116 PolarHBondContact OD1-N 2.75Å; D108-C116 VanDerWaalsContact OD1-N 3.15Å; D108-C116 VanDerWaalsContact OD2-CB 3.32Å; D108-C116 WeakPolarHBondContact OD2-CB 3.41Å; D108-C116 PolarHBondContact OD2-N 2.92Å; C116-T145 PolarHBondContact O-N 2.81Å; C116-T145 PolarHBondContact O-OG1 3.39Å; C116-C148 WeakPolarHBondContact CA-SG 3.48Å; C116-C148 HydrophobicContact CB-CB 3.57Å; C116-C148 WeakPolarHBondContact CB-SG 3.23Å; C116-C148 WeakPolarHBondContact SG-CB 3.31Å; C116-C148 CovalentContact SG-SG 2.01Å; C116-C148 PolarHBondContact SG-SG 3.27Å; C116-A151 HydrophobicContact CB-CB 4.4Å
117	I	85.6	Confident	81.9	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.01	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-132	117.3	179	-50.5	171.1	0	0	0	108.3	F99 D108 V120 F129 A151	F99-I117 HydrophobicContact CB-CD1 3.9Å; F99-I117 HydrophobicContact CD1-CD1 3.48Å; F99-I117 VanDerWaalsContact CD1-CD1 3.48Å; F99-I117 HydrophobicContact CE1-CD1 4.28Å; F99-I117 HydrophobicContact CG-CD1 3.94Å; D108-I117 PolarHBondContact OD2-N 3.13Å; I117-V120 HydrophobicContact CB-CG2 4.01Å; I117-V120 HydrophobicContact CG2-CG2 3.49Å; I117-V120 VanDerWaalsContact CG2-CG2 3.49Å; I117-F129 HydrophobicContact CD1-CD1 4.19Å; I117-F129 HydrophobicContact CD1-CE1 3.88Å; I117-F129 HydrophobicContact CG1-CE1 4.48Å; I117-F129 HydrophobicContact CG2-CD1 4.07Å; I117-F129 HydrophobicContact CG2-CD2 4.23Å; I117-F129 HydrophobicContact CG2-CE1 3.98Å; I117-F129 HydrophobicContact CG2-CE2 4.12Å; I117-F129 HydrophobicContact CG2-CG 4.19Å; I117-F129 HydrophobicContact CG2-CZ 4Å; I117-A151 HydrophobicContact CG1-CB 4.41Å
118	S	86.8	Confident	82.6	Confident	18 Å²	18	62.3 Å²	62.3	13%	0.126	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	142.6	-177.1	-165.4	0	0	0	0	111.1	V120 Y143	S118-V120 VanDerWaalsContact C-N 3.34Å; S118-V120 PolarHBondContact O-N 3.45Å; S118-Y143 PolarHBondContact N-O 2.78Å
119	N	86.3	Confident	83.5	Confident	63 Å²	63	62.4 Å²	62.4	34%	0.337	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	30.4	175.5	-61.5	-34.2	0	0	0	116	Y141 R142	N119-Y141 HydrophobicContact CB-CD1 4.25Å; N119-Y141 HydrophobicContact CB-CE1 3.8Å; N119-Y141 PolarHBondContact ND2-O 3.21Å; N119-R142 HydrophobicContact CB-CG 4.22Å
120	V	87.8	Confident	84.6	Confident	9 Å²	9	57.5 Å²	57.5	6%	0.055	31%	0.311	C	S	.	.			trans	-102.8	87.7	170.6	-180	0	0	0	0	110.4	A103 I117 S118 A125 A126	A103-V120 HydrophobicContact CB-CG1 4.43Å; I117-V120 HydrophobicContact CB-CG2 4.01Å; I117-V120 HydrophobicContact CG2-CG2 3.49Å; I117-V120 VanDerWaalsContact CG2-CG2 3.49Å; S118-V120 VanDerWaalsContact C-N 3.34Å; S118-V120 PolarHBondContact O-N 3.45Å; V120-A125 HydrophobicContact CG1-CB 4.48Å; V120-A126 HydrophobicContact CG1-CB 3.7Å
121	S	85.1	Confident	85.9	Confident	93 Å²	93	49.9 Å²	49.9	65%	0.65	28%	0.276	S	S	*	.			trans	-102.2	-5.8	-177.9	58.7	0	0	0	0	114.8
122	S	90.8	Very high	87.4	Confident	52 Å²	52	48.1 Å²	48.1	36%	0.364	26%	0.263	S	S	.	.	S	Bend	trans	-151.3	163.3	-178	60.1	0	0	0	0	110.8	T124 A125 A126	S122-T124 PolarHBondContact O-N 3.35Å; S122-A125 WeakPolarHBondContact O-CB 3.37Å; S122-A125 PolarHBondContact O-N 3.07Å; S122-A125 PolarHBondContact OG-N 3.42Å; S122-A126 PolarHBondContact O-N 3.26Å; S122-A126 VanDerWaalsContact O-N 3.08Å
123	F	91.9	Very high	88.8	Confident	79 Å²	79	42.5 Å²	42.5	35%	0.346	23%	0.234	S	C	.	.	H	α-helix	trans	-55.6	-41.7	172.8	178.3	-102.6	0	0	0	111.9	L93 C97 W100 A125 A126 F127	L93-F123 HydrophobicContact CD2-CE1 4.48Å; L93-F123 HydrophobicContact CD2-CZ 4.28Å; C97-F123 HydrophobicContact CB-CE2 4.49Å; C97-F123 VanDerWaalsContact SG-CE2 3.58Å; W100-F123 HydrophobicContact CB-CD2 4.08Å; W100-F123 VanDerWaalsContact CD1-CA 3.46Å; W100-F123 HydrophobicContact CD2-CD2 4.47Å; W100-F123 HydrophobicContact CG-CB 4.5Å; W100-F123 AromaticContact CG-CD2 3.94Å; W100-F123 HydrophobicContact CG-CD2 3.94Å; F123-A125 VanDerWaalsContact C-N 3.28Å; F123-A125 PolarHBondContact O-N 3.46Å; F123-A126 PolarHBondContact O-N 3.1Å; F123-A126 VanDerWaalsContact O-N 3.14Å; F123-F127 WeakPolarHBondContact O-CB 3.49Å; F123-F127 PolarHBondContact O-N 3.28Å
124	T	94	Very high	90.3	Very high	89 Å²	89	37.5 Å²	37.5	55%	0.546	20%	0.202	S	C	.	.	H	α-helix	trans	-60	-38.4	175.9	-48.5	0	0	0	0	111.8	S122 F127 L128	S122-T124 PolarHBondContact O-N 3.35Å; T124-F127 PolarHBondContact O-N 2.7Å; T124-L128 HydrophobicContact CG2-CD1 4.41Å; T124-L128 WeakPolarHBondContact O-CB 3.39Å; T124-L128 VanDerWaalsContact O-CG 3.26Å; T124-L128 WeakPolarHBondContact O-CG 3.31Å; T124-L128 PolarHBondContact O-N 3.08Å
125	A	92.3	Very high	91.5	Very high	5 Å²	5	33.5 Å²	33.5	4%	0.041	19%	0.189	C	C	.	.	H	α-helix	trans	-66.9	-39.2	175.8	0	0	0	0	0	112.4	V120 S122 F123 L128 F129	V120-A125 HydrophobicContact CG1-CB 4.48Å; S122-A125 WeakPolarHBondContact O-CB 3.37Å; S122-A125 PolarHBondContact O-N 3.07Å; S122-A125 PolarHBondContact OG-N 3.42Å; F123-A125 VanDerWaalsContact C-N 3.28Å; F123-A125 PolarHBondContact O-N 3.46Å; A125-L128 PolarHBondContact O-N 3.2Å; A125-F129 WeakPolarHBondContact O-CB 3.5Å; A125-F129 PolarHBondContact O-N 3.08Å
126	A	93.8	Very high	92	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.1	-39.3	174.9	0	0	0	0	0	112	F99 W100 V120 S122 F123 F129 S130	F99-A126 HydrophobicContact CB-CB 4.44Å; W100-A126 HydrophobicContact CB-CB 3.79Å; V120-A126 HydrophobicContact CG1-CB 3.7Å; S122-A126 PolarHBondContact O-N 3.26Å; S122-A126 VanDerWaalsContact O-N 3.08Å; F123-A126 PolarHBondContact O-N 3.1Å; F123-A126 VanDerWaalsContact O-N 3.14Å; A126-F129 PolarHBondContact O-N 3.37Å; A126-S130 WeakPolarHBondContact O-CB 3.44Å; A126-S130 PolarHBondContact O-N 3.06Å
127	F	95.5	Very high	92.6	Very high	43 Å²	43	40.9 Å²	40.9	19%	0.189	24%	0.235	C	C	.	.	H	α-helix	trans	-63.7	-44	174.1	177.3	-111.3	0	0	0	112	W92 L93 F123 T124 S130 I131	W92-F127 HydrophobicContact CB-CD2 4.35Å; W92-F127 HydrophobicContact CB-CE2 3.66Å; W92-F127 HydrophobicContact CB-CZ 4.38Å; L93-F127 HydrophobicContact CD2-CD2 3.82Å; L93-F127 HydrophobicContact CD2-CE2 3.66Å; L93-F127 HydrophobicContact CD2-CZ 4.42Å; L93-F127 HydrophobicContact CG-CD2 4.38Å; L93-F127 HydrophobicContact CG-CE2 3.87Å; F123-F127 WeakPolarHBondContact O-CB 3.49Å; F123-F127 PolarHBondContact O-N 3.28Å; T124-F127 PolarHBondContact O-N 2.7Å; F127-S130 WeakPolarHBondContact O-CB 3.47Å; F127-S130 PolarHBondContact O-N 3.04Å; F127-I131 HydrophobicContact CD1-CD1 3.9Å; F127-I131 HydrophobicContact CE1-CD1 3.38Å; F127-I131 HydrophobicContact CE1-CG1 4.42Å; F127-I131 HydrophobicContact CE2-CD1 4.18Å; F127-I131 HydrophobicContact CE2-CG1 4.43Å; F127-I131 HydrophobicContact CG-CD1 4.5Å; F127-I131 HydrophobicContact CZ-CD1 3.56Å; F127-I131 HydrophobicContact CZ-CG1 4.26Å; F127-I131 WeakPolarHBondContact O-CG1 3.29Å; F127-I131 PolarHBondContact O-N 3.07Å
128	L	95.3	Very high	92.8	Very high	68 Å²	68	43.2 Å²	43.2	36%	0.356	26%	0.26	S	S	.	.	H	α-helix	trans	-62.2	-43	174.2	-72	171.7	0	0	0	111.6	T124 A125 S130 I131 E132	T124-L128 HydrophobicContact CG2-CD1 4.41Å; T124-L128 WeakPolarHBondContact O-CB 3.39Å; T124-L128 VanDerWaalsContact O-CG 3.26Å; T124-L128 WeakPolarHBondContact O-CG 3.31Å; T124-L128 PolarHBondContact O-N 3.08Å; A125-L128 PolarHBondContact O-N 3.2Å; L128-S130 VanDerWaalsContact C-N 3.32Å; L128-S130 PolarHBondContact O-N 3.31Å; L128-I131 PolarHBondContact O-N 3.07Å; L128-E132 WeakPolarHBondContact O-CB 3.44Å; L128-E132 VanDerWaalsContact O-CG 3.23Å; L128-E132 WeakPolarHBondContact O-CG 3.16Å; L128-E132 PolarHBondContact O-N 3.41Å
129	F	95	Very high	93.1	Very high	9 Å²	9	50.5 Å²	50.5	4%	0.039	29%	0.286	C	S	.	.	H	α-helix	trans	-60.1	-41.4	174.7	178.2	-109.2	0	0	0	112.5	F99 I117 A125 A126 E132 T133 R142 V144 V155	F99-F129 HydrophobicContact CB-CD1 4.47Å; F99-F129 HydrophobicContact CD1-CD1 4.36Å; F99-F129 HydrophobicContact CD1-CE1 4.05Å; F99-F129 AromaticContact CD2-CD1 3.74Å; F99-F129 HydrophobicContact CD2-CD1 3.74Å; F99-F129 HydrophobicContact CD2-CE1 4.05Å; F99-F129 AromaticContact CE1-CE1 3.92Å; F99-F129 HydrophobicContact CE1-CE1 3.92Å; F99-F129 AromaticContact CE2-CD1 3.96Å; F99-F129 HydrophobicContact CE2-CD1 3.96Å; F99-F129 AromaticContact CE2-CE1 3.93Å; F99-F129 HydrophobicContact CE2-CE1 3.93Å; F99-F129 AromaticContact CG-CD1 3.96Å; F99-F129 HydrophobicContact CG-CD1 3.96Å; F99-F129 HydrophobicContact CG-CE1 4.12Å; F99-F129 HydrophobicContact CZ-CD1 4.36Å; F99-F129 AromaticContact CZ-CE1 3.86Å; F99-F129 HydrophobicContact CZ-CE1 3.86Å; I117-F129 HydrophobicContact CD1-CD1 4.19Å; I117-F129 HydrophobicContact CD1-CE1 3.88Å; I117-F129 HydrophobicContact CG1-CE1 4.48Å; I117-F129 HydrophobicContact CG2-CD1 4.07Å; I117-F129 HydrophobicContact CG2-CD2 4.23Å; I117-F129 HydrophobicContact CG2-CE1 3.98Å; I117-F129 HydrophobicContact CG2-CE2 4.12Å; I117-F129 HydrophobicContact CG2-CG 4.19Å; I117-F129 HydrophobicContact CG2-CZ 4Å; A125-F129 WeakPolarHBondContact O-CB 3.5Å; A125-F129 PolarHBondContact O-N 3.08Å; A126-F129 PolarHBondContact O-N 3.37Å; F129-E132 PolarHBondContact O-N 2.98Å; F129-T133 WeakPolarHBondContact O-CB 3.29Å; F129-T133 PolarHBondContact O-N 2.77Å; F129-T133 PolarHBondContact O-OG1 2.9Å; F129-R142 HydrophobicContact CB-CB 4.39Å; F129-R142 HydrophobicContact CD2-CB 3.7Å; F129-R142 HydrophobicContact CE2-CB 4.49Å; F129-R142 HydrophobicContact CG-CB 4.43Å; F129-V144 HydrophobicContact CZ-CB 4.41Å; F129-V155 HydrophobicContact CE1-CG2 4.39Å; F129-V155 HydrophobicContact CZ-CG2 4.24Å
130	S	96.4	Very high	93.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.9	-45	174.3	174.1	0	0	0	0	112	W92 F95 G96 A126 F127 L128 T133 Q134 Q158	W92-S130 WeakPolarHBondContact O-CB 3.47Å; W92-S130 PolarHBondContact O-OG 2.85Å; F95-S130 VanDerWaalsContact CB-OG 3.3Å; F95-S130 WeakPolarHBondContact CB-OG 3.26Å; G96-S130 PolarHBondContact N-OG 2.81Å; A126-S130 WeakPolarHBondContact O-CB 3.44Å; A126-S130 PolarHBondContact O-N 3.06Å; F127-S130 WeakPolarHBondContact O-CB 3.47Å; F127-S130 PolarHBondContact O-N 3.04Å; L128-S130 VanDerWaalsContact C-N 3.32Å; L128-S130 PolarHBondContact O-N 3.31Å; S130-T133 PolarHBondContact O-N 3.14Å; S130-Q134 WeakPolarHBondContact O-CB 3.28Å; S130-Q134 PolarHBondContact O-N 3.49Å; S130-Q158 PolarHBondContact O-NE2 2.98Å; S130-Q158 PolarHBondContact OG-NE2 2.91Å; S130-Q158 VanDerWaalsContact OG-NE2 3.08Å
131	I	96.3	Very high	93.3	Very high	32 Å²	32	56.1 Å²	56.1	16%	0.164	32%	0.316	C	S	.	.	H	α-helix	trans	-61.8	-51.7	174.8	-67.3	168.4	0	0	0	110.3	W92 F127 L128 T133 Q134 T135	W92-I131 HydrophobicContact CB-CG1 4Å; W92-I131 HydrophobicContact CD2-CD1 4.5Å; W92-I131 HydrophobicContact CD2-CG1 3.77Å; W92-I131 HydrophobicContact CE3-CD1 4.15Å; W92-I131 HydrophobicContact CE3-CG1 3.91Å; W92-I131 HydrophobicContact CG-CG1 3.81Å; F127-I131 HydrophobicContact CD1-CD1 3.9Å; F127-I131 HydrophobicContact CE1-CD1 3.38Å; F127-I131 HydrophobicContact CE1-CG1 4.42Å; F127-I131 HydrophobicContact CE2-CD1 4.18Å; F127-I131 HydrophobicContact CE2-CG1 4.43Å; F127-I131 HydrophobicContact CG-CD1 4.5Å; F127-I131 HydrophobicContact CZ-CD1 3.56Å; F127-I131 HydrophobicContact CZ-CG1 4.26Å; F127-I131 WeakPolarHBondContact O-CG1 3.29Å; F127-I131 PolarHBondContact O-N 3.07Å; L128-I131 PolarHBondContact O-N 3.07Å; I131-T133 PolarHBondContact O-N 2.91Å; I131-Q134 PolarHBondContact O-N 2.73Å; I131-T135 HydrophobicContact CG2-CG2 4.16Å; I131-T135 WeakPolarHBondContact O-CB 3.28Å; I131-T135 PolarHBondContact O-N 2.98Å; I131-T135 PolarHBondContact O-OG1 2.72Å
132	E	95.4	Very high	93.5	Very high	7 Å²	7	53.9 Å²	53.9	3%	0.033	29%	0.294	C	S	.	.	H	α-helix	trans	-55.7	-38.6	-178.3	-72.2	170.5	-144	0	0	111.8	L128 F129 T136 I137 G138 Y139 R142	L128-E132 WeakPolarHBondContact O-CB 3.44Å; L128-E132 VanDerWaalsContact O-CG 3.23Å; L128-E132 WeakPolarHBondContact O-CG 3.16Å; L128-E132 PolarHBondContact O-N 3.41Å; F129-E132 PolarHBondContact O-N 2.98Å; E132-T136 PolarHBondContact O-N 2.96Å; E132-I137 PolarHBondContact O-N 3.43Å; E132-I137 VanDerWaalsContact O-N 3.11Å; E132-G138 PolarHBondContact O-N 2.89Å; E132-Y139 HydrophobicContact CG-CD2 3.63Å; E132-Y139 HydrophobicContact CG-CE2 4.02Å; E132-R142 IonicContact OE1-CZ 3.66Å; E132-R142 IonicContact OE1-NH1 2.72Å; E132-R142 PolarHBondContact OE1-NH1 2.76Å
133	T	94.6	Very high	93.5	Very high	22 Å²	22	57.6 Å²	57.6	14%	0.135	30%	0.301	C	S	.	.	H	α-helix	trans	-74.2	-50.4	179.9	-57.1	0	0	0	0	111.8	F129 S130 I131 T136 V155	F129-T133 WeakPolarHBondContact O-CB 3.29Å; F129-T133 PolarHBondContact O-N 2.77Å; F129-T133 PolarHBondContact O-OG1 2.9Å; S130-T133 PolarHBondContact O-N 3.14Å; I131-T133 PolarHBondContact O-N 2.91Å; T133-T136 PolarHBondContact O-N 2.93Å; T133-V155 HydrophobicContact CG2-CG1 3.88Å; T133-V155 HydrophobicContact CG2-CG2 4.4Å
134	Q	95.8	Very high	93.5	Very high	10 Å²	10	56.2 Å²	56.2	5%	0.047	30%	0.299	C	S	.	.	H	α-helix	trans	-72.2	-37.6	-175.7	-162.5	173.9	-47.3	0	0	113.1	S91 S130 I131 Q158	S91-Q134 PolarHBondContact OG-NE2 3.15Å; S91-Q134 PolarHBondContact OG-OE1 3.22Å; S130-Q134 WeakPolarHBondContact O-CB 3.28Å; S130-Q134 PolarHBondContact O-N 3.49Å; I131-Q134 PolarHBondContact O-N 2.73Å; Q134-Q158 HydrophobicContact CB-CG 4.1Å; Q134-Q158 HydrophobicContact CG-CG 4.23Å
135	T	94.8	Very high	93.3	Very high	47 Å²	47	53.5 Å²	53.5	29%	0.288	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-2.6	177.9	61.5	0	0	0	0	112.9	W92 I131 I137	W92-T135 HydrophobicContact CZ2-CG2 3.75Å; I131-T135 HydrophobicContact CG2-CG2 4.16Å; I131-T135 WeakPolarHBondContact O-CB 3.28Å; I131-T135 PolarHBondContact O-N 2.98Å; I131-T135 PolarHBondContact O-OG1 2.72Å; T135-I137 PolarHBondContact O-N 3.37Å; T135-I137 VanDerWaalsContact OG1-CD1 3.29Å; T135-I137 WeakPolarHBondContact OG1-CD1 3.48Å; T135-I137 WeakPolarHBondContact OG1-CG1 3.11Å
136	T	94.9	Very high	93.1	Very high	125 Å²	125	61.9 Å²	61.9	77%	0.767	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	23	-179.7	70.3	0	0	0	0	114.5	E132 T133	E132-T136 PolarHBondContact O-N 2.96Å; T133-T136 PolarHBondContact O-N 2.93Å
137	I	96.1	Very high	92.7	Very high	85 Å²	85	65.8 Å²	65.8	44%	0.436	34%	0.339	S	S	.	.			trans	-67.9	-46.1	174.6	-65	168.9	0	0	0	110.3	E132 T135 Y139	E132-I137 PolarHBondContact O-N 3.43Å; E132-I137 VanDerWaalsContact O-N 3.11Å; T135-I137 PolarHBondContact O-N 3.37Å; T135-I137 VanDerWaalsContact OG1-CD1 3.29Å; T135-I137 WeakPolarHBondContact OG1-CD1 3.48Å; T135-I137 WeakPolarHBondContact OG1-CG1 3.11Å; I137-Y139 HydrophobicContact CG2-CD1 3.75Å; I137-Y139 HydrophobicContact CG2-CD2 4.13Å; I137-Y139 HydrophobicContact CG2-CE1 3.38Å; I137-Y139 HydrophobicContact CG2-CE2 3.78Å; I137-Y139 HydrophobicContact CG2-CG 4.1Å; I137-Y139 PolarHBondContact O-N 2.73Å
138	G	90.8	Very high	92.3	Very high	52 Å²	52	64.2 Å²	64.2	54%	0.536	33%	0.333	S	S	.	.			trans	49.4	60.6	172.7	0	0	0	0	0	115.2	E132 G140	E132-G138 PolarHBondContact O-N 2.89Å; G138-G140 PolarHBondContact O-N 3.2Å
139	Y	91.4	Very high	92.1	Very high	170 Å²	170	65.8 Å²	65.8	67%	0.667	35%	0.347	S	S	*	.			trans	-57.3	-21.6	-179.5	-64.3	-59.9	0	0	0	113.8	E132 I137 Y141	E132-Y139 HydrophobicContact CG-CD2 3.63Å; E132-Y139 HydrophobicContact CG-CE2 4.02Å; I137-Y139 HydrophobicContact CG2-CD1 3.75Å; I137-Y139 HydrophobicContact CG2-CD2 4.13Å; I137-Y139 HydrophobicContact CG2-CE1 3.38Å; I137-Y139 HydrophobicContact CG2-CE2 3.78Å; I137-Y139 HydrophobicContact CG2-CG 4.1Å; I137-Y139 PolarHBondContact O-N 2.73Å; Y139-Y141 PolarHBondContact O-N 3.2Å
140	G	88	Confident	91.9	Very high	46 Å²	46	69.5 Å²	69.5	47%	0.474	37%	0.37	S	S	.	.	S	Bend	trans	82.3	-6.8	175.9	0	0	0	0	0	114.6	G138 R142	G138-G140 PolarHBondContact O-N 3.2Å; G140-R142 VanDerWaalsContact C-N 3.29Å
141	Y	90.4	Very high	91.6	Very high	144 Å²	144	69.5 Å²	69.5	57%	0.565	37%	0.37	S	S	*	.	S	Bend	trans	-65.9	-34	170.9	-177.7	-103.1	0	0	0	112	N119 Y139	N119-Y141 HydrophobicContact CB-CD1 4.25Å; N119-Y141 HydrophobicContact CB-CE1 3.8Å; N119-Y141 PolarHBondContact ND2-O 3.21Å; Y139-Y141 PolarHBondContact O-N 3.2Å
142	R	90.9	Very high	91.5	Very high	47 Å²	47	71 Å²	71	18%	0.177	38%	0.381	C	S	.	.	S	Bend	trans	-112.9	128.1	172	-61.8	173.3	-171.2	86.5	7.6	107.8	N119 F129 E132 G140	N119-R142 HydrophobicContact CB-CG 4.22Å; F129-R142 HydrophobicContact CB-CB 4.39Å; F129-R142 HydrophobicContact CD2-CB 3.7Å; F129-R142 HydrophobicContact CE2-CB 4.49Å; F129-R142 HydrophobicContact CG-CB 4.43Å; E132-R142 IonicContact OE1-CZ 3.66Å; E132-R142 IonicContact OE1-NH1 2.72Å; E132-R142 PolarHBondContact OE1-NH1 2.76Å; G140-R142 VanDerWaalsContact C-N 3.29Å
143	Y	90.6	Very high	91.4	Very high	129 Å²	129	76.9 Å²	76.9	51%	0.506	41%	0.406	S	S	.	.			trans	-146.2	150.3	-178.5	61	-91.3	0	0	0	110.7	S118 T145	S118-Y143 PolarHBondContact N-O 2.78Å; Y143-T145 HydrophobicContact CD2-CG2 4.39Å; Y143-T145 HydrophobicContact CE2-CG2 4.09Å
144	V	92	Very high	91.4	Very high	50 Å²	50	77.9 Å²	77.9	30%	0.303	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-79.8	141	175.5	65.1	0	0	0	0	110	F129 A151 V152 V155	F129-V144 HydrophobicContact CZ-CB 4.41Å; V144-A151 HydrophobicContact CG2-CB 3.91Å; V144-V152 HydrophobicContact CG2-CG2 4.15Å; V144-V155 HydrophobicContact CB-CG2 4.44Å; V144-V155 HydrophobicContact CG1-CG2 4.47Å
145	T	89.1	Confident	91.4	Very high	32 Å²	32	78.7 Å²	78.7	20%	0.196	42%	0.416	C	S	.	.			trans	-103.5	167	175.3	71.4	0	0	0	0	111	K115 C116 Y143 E147	K115-T145 WeakPolarHBondContact O-CB 3.38Å; K115-T145 VanDerWaalsContact O-CG2 3.22Å; K115-T145 WeakPolarHBondContact O-CG2 3.08Å; K115-T145 PolarHBondContact O-OG1 3.2Å; C116-T145 PolarHBondContact O-N 2.81Å; C116-T145 PolarHBondContact O-OG1 3.39Å; Y143-T145 HydrophobicContact CD2-CG2 4.39Å; Y143-T145 HydrophobicContact CE2-CG2 4.09Å; T145-E147 VanDerWaalsContact C-N 3.26Å; T145-E147 PolarHBondContact O-N 3.27Å
146	E	87.5	Confident	91.5	Very high	182 Å²	182	80.2 Å²	80.2	85%	0.85	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-5	178.2	61.7	-171.5	-172.3	0	0	114.3	C148	E146-C148 VanDerWaalsContact C-N 3.31Å; E146-C148 PolarHBondContact O-N 3.39Å
147	E	85.6	Confident	91.5	Very high	82 Å²	82	78.5 Å²	78.5	38%	0.383	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-31.4	-175.7	-62.8	-72.7	164.7	0	0	112.3	K114 T145 P149	K114-E147 HydrophobicContact CB-CG 4.08Å; K114-E147 HydrophobicContact CG-CG 4.41Å; K114-E147 IonicContact NZ-OE1 3.59Å; K114-E147 PolarHBondContact NZ-OE1 2.99Å; K114-E147 IonicContact NZ-OE2 2.7Å; K114-E147 PolarHBondContact NZ-OE2 3.27Å; T145-E147 VanDerWaalsContact C-N 3.26Å; T145-E147 PolarHBondContact O-N 3.27Å; E147-P149 WeakPolarHBondContact O-CD 3.35Å
148	C	87.7	Confident	91.6	Very high	10 Å²	10	74.4 Å²	74.4	7%	0.068	39%	0.386	C	S	.	.			trans	-121.1	98.3	-172	-55.7	0	0	0	0	112.1	H106 C116 E146 V150 A151 V152	H106-C148 VanDerWaalsContact CD2-SG 3.59Å; H106-C148 PolarHBondContact NE2-SG 3.41Å; C116-C148 WeakPolarHBondContact CA-SG 3.48Å; C116-C148 HydrophobicContact CB-CB 3.57Å; C116-C148 WeakPolarHBondContact CB-SG 3.23Å; C116-C148 WeakPolarHBondContact SG-CB 3.31Å; C116-C148 CovalentContact SG-SG 2.01Å; C116-C148 PolarHBondContact SG-SG 3.27Å; E146-C148 VanDerWaalsContact C-N 3.31Å; E146-C148 PolarHBondContact O-N 3.39Å; C148-V150 PolarHBondContact O-N 2.81Å; C148-V150 VanDerWaalsContact O-N 3.15Å; C148-A151 HydrophobicContact CB-CB 4.07Å; C148-A151 WeakPolarHBondContact O-CB 3.23Å; C148-A151 PolarHBondContact O-N 3.41Å; C148-V152 PolarHBondContact O-N 3.06Å
149	P	90.3	Very high	91.8	Very high	100 Å²	100	74.3 Å²	74.3	65%	0.649	38%	0.377	S	S	*	.	H	α-helix	trans	-58.1	-30.9	178.8	-26.2	34.4	0	0	0	113.7	E147 V152 F153	E147-P149 WeakPolarHBondContact O-CD 3.35Å; P149-V152 PolarHBondContact O-N 3.05Å; P149-F153 WeakPolarHBondContact O-CB 3.43Å; P149-F153 PolarHBondContact O-N 3.25Å
150	V	91	Very high	92.1	Very high	88 Å²	88	70.7 Å²	70.7	53%	0.533	37%	0.368	S	S	.	.	H	α-helix	trans	-63.7	-41.2	176.7	179.5	0	0	0	0	111.2	V102 C148 F153 M154	V102-V150 HydrophobicContact CG2-CG1 4.45Å; C148-V150 PolarHBondContact O-N 2.81Å; C148-V150 VanDerWaalsContact O-N 3.15Å; V150-F153 PolarHBondContact O-N 3.49Å; V150-M154 VanDerWaalsContact O-CG 3.29Å; V150-M154 WeakPolarHBondContact O-CG 2.95Å; V150-M154 PolarHBondContact O-N 2.98Å
151	A	90.9	Very high	92.4	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-66.4	-42.6	178.2	0	0	0	0	0	110.9	V102 C116 I117 V144 C148 M154 V155	V102-A151 HydrophobicContact CG1-CB 4.35Å; C116-A151 HydrophobicContact CB-CB 4.4Å; I117-A151 HydrophobicContact CG1-CB 4.41Å; V144-A151 HydrophobicContact CG2-CB 3.91Å; C148-A151 HydrophobicContact CB-CB 4.07Å; C148-A151 WeakPolarHBondContact O-CB 3.23Å; C148-A151 PolarHBondContact O-N 3.41Å; A151-M154 PolarHBondContact O-N 2.69Å; A151-V155 WeakPolarHBondContact O-CG2 3.49Å; A151-V155 PolarHBondContact O-N 2.9Å
152	V	93.3	Very high	92.7	Very high	64 Å²	64	63.4 Å²	63.4	39%	0.388	33%	0.33	S	S	.	.	H	α-helix	trans	-60	-46.7	175	178.7	0	0	0	0	111.1	V144 C148 P149 M154 V155 V156	V144-V152 HydrophobicContact CG2-CG2 4.15Å; C148-V152 PolarHBondContact O-N 3.06Å; P149-V152 PolarHBondContact O-N 3.05Å; V152-M154 VanDerWaalsContact C-N 3.34Å; V152-M154 PolarHBondContact O-N 2.86Å; V152-V155 PolarHBondContact O-N 2.82Å; V152-V156 WeakPolarHBondContact O-CG2 3.4Å; V152-V156 PolarHBondContact O-N 3.16Å
153	F	94.9	Very high	93	Very high	129 Å²	129	65.2 Å²	65.2	57%	0.566	35%	0.349	S	S	*	.	H	α-helix	trans	-60.5	-42.7	176.2	176.4	-95.6	0	0	0	112.2	P149 V150 V155 V156 F157	P149-F153 WeakPolarHBondContact O-CB 3.43Å; P149-F153 PolarHBondContact O-N 3.25Å; V150-F153 PolarHBondContact O-N 3.49Å; F153-V155 VanDerWaalsContact C-N 3.34Å; F153-V155 PolarHBondContact O-N 2.76Å; F153-V156 PolarHBondContact O-N 2.81Å; F153-F157 HydrophobicContact CE1-CB 4.4Å; F153-F157 WeakPolarHBondContact O-CB 3.43Å; F153-F157 PolarHBondContact O-N 2.87Å
154	M	94.6	Very high	93.2	Very high	43 Å²	43	64.3 Å²	64.3	21%	0.212	35%	0.351	C	S	.	.	H	α-helix	trans	-64.5	-37.4	178.4	-72.7	-61.9	172.4	0	0	112.5	I98 F99 V150 A151 V152 F157 Q158	I98-M154 HydrophobicContact CG2-CE 4.28Å; I98-M154 HydrophobicContact CG2-CG 3.94Å; I98-M154 HydrophobicContact CG2-SD 3.94Å; F99-M154 HydrophobicContact CE1-CB 3.83Å; F99-M154 HydrophobicContact CZ-CB 4.33Å; V150-M154 VanDerWaalsContact O-CG 3.29Å; V150-M154 WeakPolarHBondContact O-CG 2.95Å; V150-M154 PolarHBondContact O-N 2.98Å; A151-M154 PolarHBondContact O-N 2.69Å; V152-M154 VanDerWaalsContact C-N 3.34Å; V152-M154 PolarHBondContact O-N 2.86Å; M154-F157 PolarHBondContact O-N 2.86Å; M154-Q158 WeakPolarHBondContact O-CB 3.42Å; M154-Q158 PolarHBondContact O-N 2.86Å
155	V	95.3	Very high	93.3	Very high	27 Å²	27	63.5 Å²	63.5	16%	0.164	35%	0.345	C	S	.	.	H	α-helix	trans	-61.7	-47.9	172.6	169.3	0	0	0	0	110.6	F99 F129 T133 V144 A151 V152 F153 F157 Q158 S159	F99-V155 HydrophobicContact CE1-CG2 4.04Å; F99-V155 HydrophobicContact CZ-CG2 3.97Å; F129-V155 HydrophobicContact CE1-CG2 4.39Å; F129-V155 HydrophobicContact CZ-CG2 4.24Å; T133-V155 HydrophobicContact CG2-CG1 3.88Å; T133-V155 HydrophobicContact CG2-CG2 4.4Å; V144-V155 HydrophobicContact CB-CG2 4.44Å; V144-V155 HydrophobicContact CG1-CG2 4.47Å; A151-V155 WeakPolarHBondContact O-CG2 3.49Å; A151-V155 PolarHBondContact O-N 2.9Å; V152-V155 PolarHBondContact O-N 2.82Å; F153-V155 VanDerWaalsContact C-N 3.34Å; F153-V155 PolarHBondContact O-N 2.76Å; V155-F157 PolarHBondContact O-N 3.45Å; V155-Q158 PolarHBondContact O-N 2.92Å; V155-S159 PolarHBondContact O-N 2.82Å; V155-S159 PolarHBondContact O-OG 2.89Å; V155-S159 VanDerWaalsContact O-OG 3.08Å
156	V	95.9	Very high	93.6	Very high	79 Å²	79	65 Å²	65	48%	0.479	35%	0.352	S	S	.	.	H	α-helix	trans	-59.8	-47.2	177.4	172.9	0	0	0	0	111.2	V152 F153 Q158 S159 I160	V152-V156 WeakPolarHBondContact O-CG2 3.4Å; V152-V156 PolarHBondContact O-N 3.16Å; F153-V156 PolarHBondContact O-N 2.81Å; V156-Q158 PolarHBondContact O-N 3.48Å; V156-S159 PolarHBondContact O-N 2.8Å; V156-I160 HydrophobicContact CG1-CD1 4.14Å; V156-I160 WeakPolarHBondContact O-CG1 3.43Å; V156-I160 PolarHBondContact O-N 3.43Å; V156-I160 VanDerWaalsContact O-N 3.1Å
157	F	96	Very high	93.9	Very high	89 Å²	89	59.3 Å²	59.3	39%	0.39	34%	0.336	S	S	.	.	H	α-helix	trans	-62.7	-42.5	178.7	-177.9	-112.5	0	0	0	111.6	F95 F153 M154 V155 S159 I160 V161	F95-F157 AromaticContact CE1-CD1 3.75Å; F95-F157 HydrophobicContact CE1-CD1 3.75Å; F95-F157 HydrophobicContact CE1-CE1 4.22Å; F95-F157 AromaticContact CZ-CD1 3.77Å; F95-F157 HydrophobicContact CZ-CD1 3.77Å; F95-F157 AromaticContact CZ-CE1 3.92Å; F95-F157 HydrophobicContact CZ-CE1 3.92Å; F153-F157 HydrophobicContact CE1-CB 4.4Å; F153-F157 WeakPolarHBondContact O-CB 3.43Å; F153-F157 PolarHBondContact O-N 2.87Å; M154-F157 PolarHBondContact O-N 2.86Å; V155-F157 PolarHBondContact O-N 3.45Å; F157-S159 PolarHBondContact O-N 2.8Å; F157-I160 PolarHBondContact O-N 3.1Å; F157-V161 HydrophobicContact CD1-CG2 4.4Å; F157-V161 HydrophobicContact CD2-CG2 4.4Å; F157-V161 HydrophobicContact CE1-CG2 3.98Å; F157-V161 HydrophobicContact CE2-CG2 3.98Å; F157-V161 HydrophobicContact CZ-CG2 3.74Å; F157-V161 WeakPolarHBondContact O-CG2 3.5Å; F157-V161 PolarHBondContact O-N 3.12Å
158	Q	96.9	Very high	94.2	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-61.4	-42.5	175.4	-176.1	176.2	24.9	0	0	112.1	F95 S130 Q134 M154 V155 V156 I160 V161 G162	F95-Q158 HydrophobicContact CB-CG 4.37Å; F95-Q158 HydrophobicContact CD1-CB 3.77Å; F95-Q158 HydrophobicContact CD1-CG 3.96Å; F95-Q158 HydrophobicContact CD2-CB 4.3Å; F95-Q158 HydrophobicContact CD2-CG 3.72Å; F95-Q158 HydrophobicContact CE1-CB 3.64Å; F95-Q158 HydrophobicContact CE1-CG 4.14Å; F95-Q158 HydrophobicContact CE2-CB 4.2Å; F95-Q158 HydrophobicContact CE2-CG 3.93Å; F95-Q158 HydrophobicContact CG-CB 4.11Å; F95-Q158 HydrophobicContact CG-CG 3.76Å; F95-Q158 HydrophobicContact CZ-CB 3.87Å; F95-Q158 HydrophobicContact CZ-CG 4.14Å; S130-Q158 PolarHBondContact O-NE2 2.98Å; S130-Q158 PolarHBondContact OG-NE2 2.91Å; S130-Q158 VanDerWaalsContact OG-NE2 3.08Å; Q134-Q158 HydrophobicContact CB-CG 4.1Å; Q134-Q158 HydrophobicContact CG-CG 4.23Å; M154-Q158 WeakPolarHBondContact O-CB 3.42Å; M154-Q158 PolarHBondContact O-N 2.86Å; V155-Q158 PolarHBondContact O-N 2.92Å; V156-Q158 PolarHBondContact O-N 3.48Å; Q158-I160 VanDerWaalsContact C-N 3.34Å; Q158-I160 PolarHBondContact O-N 2.67Å; Q158-V161 PolarHBondContact O-N 3.14Å; Q158-G162 PolarHBondContact O-N 3.37Å
159	S	96	Very high	94.5	Very high	50 Å²	50	60.8 Å²	60.8	35%	0.35	34%	0.341	S	S	.	.	H	α-helix	trans	-61.2	-42.5	176.8	-60.8	0	0	0	0	111.9	V155 V156 F157 G162 C163	V155-S159 PolarHBondContact O-N 2.82Å; V155-S159 PolarHBondContact O-OG 2.89Å; V155-S159 VanDerWaalsContact O-OG 3.08Å; V156-S159 PolarHBondContact O-N 2.8Å; F157-S159 PolarHBondContact O-N 2.8Å; S159-G162 PolarHBondContact O-N 2.6Å; S159-C163 PolarHBondContact O-N 3.37Å; S159-C163 VanDerWaalsContact O-N 3.08Å; S159-C163 PolarHBondContact O-SG 2.91Å
160	I	96.8	Very high	94.6	Very high	94 Å²	94	61.3 Å²	61.3	48%	0.482	34%	0.337	S	S	.	.	H	α-helix	trans	-63.8	-48.7	177	-66	167.8	0	0	0	110.6	V156 F157 Q158 G162 C163 I164	V156-I160 HydrophobicContact CG1-CD1 4.14Å; V156-I160 WeakPolarHBondContact O-CG1 3.43Å; V156-I160 PolarHBondContact O-N 3.43Å; V156-I160 VanDerWaalsContact O-N 3.1Å; F157-I160 PolarHBondContact O-N 3.1Å; Q158-I160 VanDerWaalsContact C-N 3.34Å; Q158-I160 PolarHBondContact O-N 2.67Å; I160-G162 VanDerWaalsContact C-N 3.34Å; I160-G162 PolarHBondContact O-N 2.83Å; I160-C163 PolarHBondContact O-N 3.26Å; I160-I164 HydrophobicContact CG2-CD1 3.98Å; I160-I164 WeakPolarHBondContact O-CG1 3.34Å; I160-I164 PolarHBondContact O-N 3.13Å; I160-I164 VanDerWaalsContact O-N 3.1Å
161	V	95.6	Very high	94.8	Very high	36 Å²	36	58.8 Å²	58.8	22%	0.218	33%	0.329	C	S	.	.	H	α-helix	trans	-63	-41	179.4	172.2	0	0	0	0	111.4	F95 F157 Q158 C163 I164 I165	F95-V161 HydrophobicContact CE2-CB 4.33Å; F95-V161 HydrophobicContact CE2-CG1 4.18Å; F95-V161 HydrophobicContact CZ-CB 4.32Å; F95-V161 HydrophobicContact CZ-CG2 4.38Å; F157-V161 HydrophobicContact CD1-CG2 4.4Å; F157-V161 HydrophobicContact CD2-CG2 4.4Å; F157-V161 HydrophobicContact CE1-CG2 3.98Å; F157-V161 HydrophobicContact CE2-CG2 3.98Å; F157-V161 HydrophobicContact CZ-CG2 3.74Å; F157-V161 WeakPolarHBondContact O-CG2 3.5Å; F157-V161 PolarHBondContact O-N 3.12Å; Q158-V161 PolarHBondContact O-N 3.14Å; V161-C163 PolarHBondContact O-N 3.28Å; V161-I164 PolarHBondContact O-N 3.39Å; V161-I165 HydrophobicContact CG1-CD1 3.87Å; V161-I165 HydrophobicContact CG1-CG1 4.43Å; V161-I165 WeakPolarHBondContact O-CG1 3.36Å; V161-I165 PolarHBondContact O-N 3.5Å
162	G	95.9	Very high	94.8	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-56.8	-49.6	175.2	0	0	0	0	0	112	Q158 S159 I160 I164 I165 D166	Q158-G162 PolarHBondContact O-N 3.37Å; S159-G162 PolarHBondContact O-N 2.6Å; I160-G162 VanDerWaalsContact C-N 3.34Å; I160-G162 PolarHBondContact O-N 2.83Å; G162-I164 VanDerWaalsContact C-N 3.3Å; G162-I164 PolarHBondContact O-N 2.91Å; G162-I165 PolarHBondContact O-N 2.88Å; G162-D166 PolarHBondContact O-N 2.74Å
163	C	96.3	Very high	94.8	Very high	85 Å²	85	57.4 Å²	57.4	57%	0.574	32%	0.321	S	S	*	.	H	α-helix	trans	-60.3	-37.9	177.4	-66	0	0	0	0	112.7	S159 I160 V161 A167	S159-C163 PolarHBondContact O-N 3.37Å; S159-C163 VanDerWaalsContact O-N 3.08Å; S159-C163 PolarHBondContact O-SG 2.91Å; I160-C163 PolarHBondContact O-N 3.26Å; V161-C163 PolarHBondContact O-N 3.28Å; C163-A167 VanDerWaalsContact O-CB 3.32Å; C163-A167 WeakPolarHBondContact O-CB 3.26Å; C163-A167 PolarHBondContact O-N 3.11Å
164	I	95.6	Very high	94.6	Very high	109 Å²	109	56.8 Å²	56.8	56%	0.559	32%	0.321	S	S	*	.	H	α-helix	trans	-66	-44.2	177.4	-68.4	167.1	0	0	0	110.9	I160 V161 G162 A167 F168	I160-I164 HydrophobicContact CG2-CD1 3.98Å; I160-I164 WeakPolarHBondContact O-CG1 3.34Å; I160-I164 PolarHBondContact O-N 3.13Å; I160-I164 VanDerWaalsContact O-N 3.1Å; V161-I164 PolarHBondContact O-N 3.39Å; G162-I164 VanDerWaalsContact C-N 3.3Å; G162-I164 PolarHBondContact O-N 2.91Å; I164-A167 PolarHBondContact O-N 3.44Å; I164-F168 PolarHBondContact O-N 3.38Å
165	I	94.3	Very high	94.4	Very high	33 Å²	33	56.2 Å²	56.2	17%	0.169	32%	0.324	C	S	.	.	H	α-helix	trans	-62	-47	177.6	-67.6	168.7	0	0	0	110	F88 V161 G162 A167 F168 I169	F88-I165 HydrophobicContact CD1-CG2 4.2Å; F88-I165 HydrophobicContact CE1-CG2 3.84Å; F88-I165 HydrophobicContact CZ-CG2 4.25Å; V161-I165 HydrophobicContact CG1-CD1 3.87Å; V161-I165 HydrophobicContact CG1-CG1 4.43Å; V161-I165 WeakPolarHBondContact O-CG1 3.36Å; V161-I165 PolarHBondContact O-N 3.5Å; G162-I165 PolarHBondContact O-N 2.88Å; I165-A167 PolarHBondContact O-N 3.14Å; I165-F168 PolarHBondContact O-N 3.25Å; I165-I169 HydrophobicContact CG2-CD1 3.78Å; I165-I169 HydrophobicContact CG2-CG1 4.49Å; I165-I169 WeakPolarHBondContact O-CG1 3.3Å; I165-I169 PolarHBondContact O-N 2.73Å
166	D	94.5	Very high	94.2	Very high	63 Å²	63	56.1 Å²	56.1	34%	0.337	32%	0.321	S	S	.	.	H	α-helix	trans	-60.6	-45.6	178.9	-71.5	-18.1	0	0	0	111.7	F88 G162 F168 I169 I170	F88-D166 VanDerWaalsContact CE1-OD1 3.26Å; F88-D166 WeakPolarHBondContact CE1-OD1 3.46Å; F88-D166 WeakPolarHBondContact CZ-OD1 3.34Å; G162-D166 PolarHBondContact O-N 2.74Å; D166-F168 VanDerWaalsContact C-N 3.33Å; D166-F168 PolarHBondContact O-N 2.86Å; D166-I169 PolarHBondContact O-N 2.67Å; D166-I170 VanDerWaalsContact O-CG1 3.32Å; D166-I170 WeakPolarHBondContact O-CG1 3.43Å; D166-I170 PolarHBondContact O-N 2.69Å
167	A	94.6	Very high	93.9	Very high	64 Å²	64	58.4 Å²	58.4	53%	0.529	33%	0.328	S	S	.	.	H	α-helix	trans	-59.8	-42.3	177.2	0	0	0	0	0	112.1	C163 I164 I165 G171	C163-A167 VanDerWaalsContact O-CB 3.32Å; C163-A167 WeakPolarHBondContact O-CB 3.26Å; C163-A167 PolarHBondContact O-N 3.11Å; I164-A167 PolarHBondContact O-N 3.44Å; I165-A167 PolarHBondContact O-N 3.14Å; A167-G171 PolarHBondContact O-N 2.92Å
168	F	92.2	Very high	93.5	Very high	99 Å²	99	56 Å²	56	43%	0.434	33%	0.325	S	S	.	.	H	α-helix	trans	-64.7	-43.7	177.4	-174	-96.4	0	0	0	112	F69 I164 I165 D166 G171 A172	F69-F168 HydrophobicContact CD2-CE2 4.19Å; F69-F168 HydrophobicContact CD2-CZ 4.39Å; I164-F168 PolarHBondContact O-N 3.38Å; I165-F168 PolarHBondContact O-N 3.25Å; D166-F168 VanDerWaalsContact C-N 3.33Å; D166-F168 PolarHBondContact O-N 2.86Å; F168-G171 PolarHBondContact O-N 2.89Å; F168-A172 VanDerWaalsContact O-CB 3.32Å; F168-A172 WeakPolarHBondContact O-CB 3.22Å; F168-A172 PolarHBondContact O-N 3.45Å
169	I	92.9	Very high	92.8	Very high	24 Å²	24	59.4 Å²	59.4	12%	0.123	34%	0.34	C	S	.	.	H	α-helix	trans	-63.8	-49.2	179.2	-69.5	171.7	0	0	0	110.5	F84 F88 I165 D166 G171 A172 V173	F84-I169 HydrophobicContact CB-CD1 4.09Å; F84-I169 HydrophobicContact CB-CG1 4.34Å; F84-I169 HydrophobicContact CD1-CD1 4.33Å; F84-I169 HydrophobicContact CD1-CG1 3.75Å; F84-I169 HydrophobicContact CD2-CG1 4.32Å; F84-I169 HydrophobicContact CD2-CG2 3.8Å; F84-I169 HydrophobicContact CE1-CG1 4.08Å; F84-I169 HydrophobicContact CE2-CG2 3.97Å; F84-I169 HydrophobicContact CG-CD1 4.2Å; F84-I169 HydrophobicContact CG-CG1 3.9Å; F84-I169 HydrophobicContact CG-CG2 4.2Å; F84-I169 HydrophobicContact CZ-CG1 4.49Å; F88-I169 HydrophobicContact CD2-CD1 3.98Å; F88-I169 HydrophobicContact CE1-CD1 4.29Å; F88-I169 HydrophobicContact CE2-CD1 3.22Å; F88-I169 HydrophobicContact CZ-CD1 3.41Å; F88-I169 VanDerWaalsContact CZ-CD1 3.41Å; I165-I169 HydrophobicContact CG2-CD1 3.78Å; I165-I169 HydrophobicContact CG2-CG1 4.49Å; I165-I169 WeakPolarHBondContact O-CG1 3.3Å; I165-I169 PolarHBondContact O-N 2.73Å; D166-I169 PolarHBondContact O-N 2.67Å; I169-G171 VanDerWaalsContact C-N 3.31Å; I169-G171 PolarHBondContact O-N 2.84Å; I169-A172 PolarHBondContact O-N 3.38Å; I169-V173 HydrophobicContact CG2-CG2 4.25Å; I169-V173 WeakPolarHBondContact O-CB 3.44Å; I169-V173 VanDerWaalsContact O-CG2 3.23Å; I169-V173 WeakPolarHBondContact O-CG2 3.35Å; I169-V173 PolarHBondContact O-N 3.25Å
170	I	94.1	Very high	91.9	Very high	110 Å²	110	58.2 Å²	58.2	56%	0.564	33%	0.33	S	S	*	.	H	α-helix	trans	-59.4	-45.7	177.8	-66.7	167.7	0	0	0	109.9	D166 A172 V173 M174	D166-I170 VanDerWaalsContact O-CG1 3.32Å; D166-I170 WeakPolarHBondContact O-CG1 3.43Å; D166-I170 PolarHBondContact O-N 2.69Å; I170-A172 PolarHBondContact O-N 2.93Å; I170-V173 PolarHBondContact O-N 2.94Å; I170-M174 HydrophobicContact CG2-CG 4.29Å; I170-M174 VanDerWaalsContact O-CB 3.31Å; I170-M174 WeakPolarHBondContact O-CB 3.26Å; I170-M174 VanDerWaalsContact O-CG 3.27Å; I170-M174 WeakPolarHBondContact O-CG 3.31Å; I170-M174 PolarHBondContact O-N 2.94Å
171	G	93.3	Very high	90.8	Very high	36 Å²	36	61.4 Å²	61.4	37%	0.371	34%	0.341	S	S	.	.	H	α-helix	trans	-59.2	-47.2	177.6	0	0	0	0	0	113	A167 F168 I169 M174 A175	A167-G171 PolarHBondContact O-N 2.92Å; F168-G171 PolarHBondContact O-N 2.89Å; I169-G171 VanDerWaalsContact C-N 3.31Å; I169-G171 PolarHBondContact O-N 2.84Å; G171-M174 PolarHBondContact O-N 3.44Å; G171-A175 VanDerWaalsContact O-CB 3.29Å; G171-A175 WeakPolarHBondContact O-CB 3.48Å; G171-A175 PolarHBondContact O-N 3.33Å
172	A	92.1	Very high	89.8	Confident	0 Å²	0	66 Å²	66	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-67.8	-40.8	179.2	0	0	0	0	0	112.6	F84 F168 I169 I170 K176	F84-A172 HydrophobicContact CE1-CB 4.46Å; F84-A172 HydrophobicContact CZ-CB 3.74Å; F168-A172 VanDerWaalsContact O-CB 3.32Å; F168-A172 WeakPolarHBondContact O-CB 3.22Å; F168-A172 PolarHBondContact O-N 3.45Å; I169-A172 PolarHBondContact O-N 3.38Å; I170-A172 PolarHBondContact O-N 2.93Å; A172-K176 VanDerWaalsContact O-CB 3.3Å; A172-K176 WeakPolarHBondContact O-CB 3.41Å; A172-K176 PolarHBondContact O-N 2.75Å
173	V	92.9	Very high	89	Confident	34 Å²	34	66.7 Å²	66.7	21%	0.206	36%	0.36	C	S	.	.	H	α-helix	trans	-62.9	-47.7	175.4	171.7	0	0	0	0	110.4	W77 M80 F84 I169 I170 K176 M177	W77-V173 HydrophobicContact CH2-CG1 4.31Å; W77-V173 HydrophobicContact CZ3-CG1 4.47Å; M80-V173 HydrophobicContact CE-CG2 3.91Å; F84-V173 HydrophobicContact CD2-CG2 4.45Å; F84-V173 HydrophobicContact CE2-CG2 3.73Å; I169-V173 HydrophobicContact CG2-CG2 4.25Å; I169-V173 WeakPolarHBondContact O-CB 3.44Å; I169-V173 VanDerWaalsContact O-CG2 3.23Å; I169-V173 WeakPolarHBondContact O-CG2 3.35Å; I169-V173 PolarHBondContact O-N 3.25Å; I170-V173 PolarHBondContact O-N 2.94Å; V173-K176 PolarHBondContact O-N 3.02Å; V173-M177 HydrophobicContact CG1-CG 4.35Å; V173-M177 HydrophobicContact CG1-SD 3.84Å; V173-M177 WeakPolarHBondContact O-CB 3.45Å; V173-M177 VanDerWaalsContact O-CG 3.3Å; V173-M177 WeakPolarHBondContact O-CG 3.28Å; V173-M177 PolarHBondContact O-N 3.49Å
174	M	91.7	Very high	88	Confident	116 Å²	116	64.8 Å²	64.8	57%	0.571	34%	0.344	S	S	*	.	H	α-helix	trans	-62	-46	178.4	-75.8	-62.8	-66.9	0	0	111.7	I170 G171 K176 M177 A178	I170-M174 HydrophobicContact CG2-CG 4.29Å; I170-M174 VanDerWaalsContact O-CB 3.31Å; I170-M174 WeakPolarHBondContact O-CB 3.26Å; I170-M174 VanDerWaalsContact O-CG 3.27Å; I170-M174 WeakPolarHBondContact O-CG 3.31Å; I170-M174 PolarHBondContact O-N 2.94Å; G171-M174 PolarHBondContact O-N 3.44Å; M174-K176 VanDerWaalsContact C-N 3.3Å; M174-K176 PolarHBondContact O-N 3Å; M174-M177 PolarHBondContact O-N 3.09Å; M174-A178 WeakPolarHBondContact O-CB 3.27Å; M174-A178 PolarHBondContact O-N 3.34Å
175	A	90.5	Very high	87.3	Confident	32 Å²	32	65.8 Å²	65.8	26%	0.264	35%	0.347	S	S	.	.	H	α-helix	trans	-59.6	-41.3	175.7	0	0	0	0	0	111.9	F69 V73 G171 A178 K179	F69-A175 HydrophobicContact CZ-CB 3.95Å; V73-A175 HydrophobicContact CG1-CB 4.49Å; V73-A175 HydrophobicContact CG2-CB 4.21Å; G171-A175 VanDerWaalsContact O-CB 3.29Å; G171-A175 WeakPolarHBondContact O-CB 3.48Å; G171-A175 PolarHBondContact O-N 3.33Å; A175-A178 PolarHBondContact O-N 2.67Å; A175-K179 PolarHBondContact O-N 2.68Å
176	K	91.2	Very high	87	Confident	25 Å²	25	65.1 Å²	65.1	11%	0.109	34%	0.344	C	S	.	.	H	α-helix	trans	-68.8	-37.8	177.5	-171.6	172.7	-172	62.1	0	113.1	V73 I75 W77 M80 A172 V173 M174 A178 K179	V73-K176 HydrophobicContact CG1-CB 4.03Å; V73-K176 HydrophobicContact CG1-CG 4.48Å; V73-K176 PolarHBondContact O-NZ 3.42Å; I75-K176 VanDerWaalsContact O-CE 3.3Å; I75-K176 WeakPolarHBondContact O-CE 3.23Å; I75-K176 PolarHBondContact O-NZ 2.84Å; W77-K176 HydrophobicContact CD2-CD 3.95Å; W77-K176 HydrophobicContact CE3-CD 4.19Å; W77-K176 HydrophobicContact CH2-CB 4.38Å; W77-K176 HydrophobicContact CH2-CD 4.08Å; W77-K176 HydrophobicContact CH2-CG 4.22Å; W77-K176 HydrophobicContact CZ2-CB 4.32Å; W77-K176 HydrophobicContact CZ2-CD 3.83Å; W77-K176 HydrophobicContact CZ2-CG 3.77Å; W77-K176 HydrophobicContact CZ3-CD 4.27Å; M80-K176 HydrophobicContact CE-CD 3.7Å; M80-K176 HydrophobicContact SD-CB 4.41Å; M80-K176 HydrophobicContact SD-CD 3.34Å; M80-K176 WeakPolarHBondContact SD-CD 3.44Å; A172-K176 VanDerWaalsContact O-CB 3.3Å; A172-K176 WeakPolarHBondContact O-CB 3.41Å; A172-K176 PolarHBondContact O-N 2.75Å; V173-K176 PolarHBondContact O-N 3.02Å; M174-K176 VanDerWaalsContact C-N 3.3Å; M174-K176 PolarHBondContact O-N 3Å; K176-A178 VanDerWaalsContact C-N 3.34Å; K176-K179 PolarHBondContact O-N 2.94Å
177	M	88.6	Confident	87	Confident	126 Å²	126	62.4 Å²	62.4	62%	0.621	33%	0.33	S	S	*	.	H	α-helix	trans	-67.9	-35.5	176.2	-74.3	179.5	61.9	0	0	112	W77 V173 M174 K179	W77-M177 HydrophobicContact CH2-CG 3.73Å; W77-M177 HydrophobicContact CZ2-CG 3.97Å; V173-M177 HydrophobicContact CG1-CG 4.35Å; V173-M177 HydrophobicContact CG1-SD 3.84Å; V173-M177 WeakPolarHBondContact O-CB 3.45Å; V173-M177 VanDerWaalsContact O-CG 3.3Å; V173-M177 WeakPolarHBondContact O-CG 3.28Å; V173-M177 PolarHBondContact O-N 3.49Å; M174-M177 PolarHBondContact O-N 3.09Å; M177-K179 VanDerWaalsContact C-N 3.29Å; M177-K179 PolarHBondContact O-N 2.84Å
178	A	86.9	Confident	87	Confident	40 Å²	40	61 Å²	61	33%	0.331	31%	0.314	S	S	.	.	H	α-helix	trans	-68.2	-27.2	177.6	0	0	0	0	0	112.8	M174 A175 K176 P180 M301	M174-A178 WeakPolarHBondContact O-CB 3.27Å; M174-A178 PolarHBondContact O-N 3.34Å; A175-A178 PolarHBondContact O-N 2.67Å; K176-A178 VanDerWaalsContact C-N 3.34Å; A178-P180 WeakPolarHBondContact O-CD 3.48Å; A178-M301 HydrophobicContact CB-SD 3.88Å
179	K	83.3	Confident	87.2	Confident	71 Å²	71	57.1 Å²	57.1	31%	0.309	30%	0.297	S	S	.	.			trans	-57.8	123	-178.3	-82.3	-170.6	173.2	178.1	0	111.8	V73 D74 A175 K176 M177 K181 M301	V73-K179 HydrophobicContact CG1-CD 3.73Å; V73-K179 VanDerWaalsContact CG1-CE 3.41Å; V73-K179 HydrophobicContact CG1-CG 4.44Å; D74-K179 VanDerWaalsContact CG-NZ 3.27Å; D74-K179 IonicContact OD1-NZ 3.72Å; D74-K179 PolarHBondContact OD1-NZ 2.71Å; D74-K179 IonicContact OD2-NZ 3.67Å; A175-K179 PolarHBondContact O-N 2.68Å; K176-K179 PolarHBondContact O-N 2.94Å; M177-K179 VanDerWaalsContact C-N 3.29Å; M177-K179 PolarHBondContact O-N 2.84Å; K179-K181 PolarHBondContact O-N 3.02Å; K179-M301 HydrophobicContact CG-CE 4.5Å
180	P	77.1	Confident	87.4	Confident	24 Å²	24	56 Å²	56	16%	0.156	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-77.9	32.7	-174.4	32.6	-37.1	0	0	0	114.1	A178 K182 R183 V296 M301	A178-P180 WeakPolarHBondContact O-CD 3.48Å; P180-K182 PolarHBondContact O-N 2.62Å; P180-K182 VanDerWaalsContact O-N 3.16Å; P180-R183 HydrophobicContact CB-CB 4.16Å; P180-R183 VanDerWaalsContact O-CB 3.23Å; P180-R183 WeakPolarHBondContact O-CB 3.49Å; P180-R183 PolarHBondContact O-N 3.36Å; P180-V296 HydrophobicContact CB-CG2 3.64Å; P180-V296 HydrophobicContact CG-CG2 4.41Å; P180-M301 HydrophobicContact CG-CB 4.14Å
181	K	73.4	Confident	87.5	Confident	161 Å²	161	56 Å²	56	70%	0.7	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-59.7	-33.7	-174.7	-172	170.6	-176.2	167.7	0	113.2	K179 R183	K179-K181 PolarHBondContact O-N 3.02Å; K181-R183 VanDerWaalsContact C-N 3.3Å
182	K	74.2	Confident	87.7	Confident	133 Å²	133	56.5 Å²	56.5	58%	0.578	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-78	-12.2	177.3	-72.1	-57.2	-164.7	175.1	0	114	P180 E185	P180-K182 PolarHBondContact O-N 2.62Å; P180-K182 VanDerWaalsContact O-N 3.16Å; K182-E185 WeakPolarHBondContact CD-OE2 3.31Å; K182-E185 IonicContact NZ-OE1 3.65Å; K182-E185 PolarHBondContact NZ-OE1 2.67Å; K182-E185 IonicContact NZ-OE2 3.86Å; K182-E185 PolarHBondContact NZ-OE2 2.93Å
183	R	79	Confident	88	Confident	15 Å²	15	56.5 Å²	56.5	6%	0.057	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-36.2	176.2	-171.7	70.6	-179.7	-171.8	0.8	111.6	P180 K181 E185 T186 L187 N210 S214 V296 T303	P180-R183 HydrophobicContact CB-CB 4.16Å; P180-R183 VanDerWaalsContact O-CB 3.23Å; P180-R183 WeakPolarHBondContact O-CB 3.49Å; P180-R183 PolarHBondContact O-N 3.36Å; K181-R183 VanDerWaalsContact C-N 3.3Å; R183-E185 PolarHBondContact O-N 3.05Å; R183-T186 PolarHBondContact O-N 2.92Å; R183-T186 PolarHBondContact O-OG1 3.19Å; R183-L187 PolarHBondContact O-N 2.87Å; R183-N210 PolarHBondContact NH2-ND2 3.45Å; R183-N210 PolarHBondContact NH2-OD1 2.99Å; R183-S214 PolarHBondContact NH1-OG 2.85Å; R183-S214 PolarHBondContact NH2-O 3.29Å; R183-V296 HydrophobicContact CB-CG2 4.17Å; R183-V296 HydrophobicContact CG-CG2 3.8Å; R183-T303 HydrophobicContact CG-CG2 4.26Å
184	N	76.3	Confident	88.2	Confident	46 Å²	46	54.9 Å²	54.9	25%	0.246	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-54.3	-37.2	176.6	-72.2	14.3	0	0	0	112.4	T186 L187 T303 Q304	N184-T186 PolarHBondContact O-N 3.49Å; N184-L187 PolarHBondContact O-N 3.13Å; N184-T303 PolarHBondContact OD1-OG1 3.44Å; N184-Q304 PolarHBondContact ND2-O 3.41Å; N184-Q304 PolarHBondContact OD1-O 3.4Å
185	E	80.9	Confident	88.5	Confident	129 Å²	129	49.7 Å²	49.7	60%	0.603	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-67.4	-15.6	178.2	-64.8	173	-170.3	0	0	113.1	K182 R183	K182-E185 WeakPolarHBondContact CD-OE2 3.31Å; K182-E185 IonicContact NZ-OE1 3.65Å; K182-E185 PolarHBondContact NZ-OE1 2.67Å; K182-E185 IonicContact NZ-OE2 3.86Å; K182-E185 PolarHBondContact NZ-OE2 2.93Å; R183-E185 PolarHBondContact O-N 3.05Å
186	T	88.3	Confident	88.7	Confident	20 Å²	20	48.2 Å²	48.2	12%	0.123	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-103	-7.3	-179	61	0	0	0	0	114.7	R183 N184 L211 R212	R183-T186 PolarHBondContact O-N 2.92Å; R183-T186 PolarHBondContact O-OG1 3.19Å; N184-T186 PolarHBondContact O-N 3.49Å; T186-L211 WeakPolarHBondContact O-CB 3.37Å; T186-L211 WeakPolarHBondContact O-CG 3.11Å; T186-L211 PolarHBondContact O-N 2.86Å; T186-R212 HydrophobicContact CG2-CG 4.12Å; T186-R212 VanDerWaalsContact CG2-NE 3.34Å
187	L	93	Very high	88.9	Confident	6 Å²	6	49.5 Å²	49.5	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	120.1	170.5	-65.5	174.8	0	0	0	107.7	R183 N184 N210 L216 L257 L292 T303 C305	R183-L187 PolarHBondContact O-N 2.87Å; N184-L187 PolarHBondContact O-N 3.13Å; L187-N210 HydrophobicContact CD2-CB 4.24Å; L187-L216 HydrophobicContact CD1-CD1 4.41Å; L187-L216 HydrophobicContact CD1-CD2 4.02Å; L187-L216 HydrophobicContact CD2-CD2 4.25Å; L187-L257 HydrophobicContact CD2-CD2 4.25Å; L187-L292 HydrophobicContact CB-CD2 4.35Å; L187-L292 HydrophobicContact CD1-CD2 4.05Å; L187-L292 HydrophobicContact CD2-CD2 4.18Å; L187-L292 HydrophobicContact CG-CD2 4.42Å; L187-T303 HydrophobicContact CD1-CG2 4.4Å; L187-C305 HydrophobicContact CB-CB 4.12Å; L187-C305 HydrophobicContact CD1-CB 4.07Å
188	V	94.3	Very high	89.2	Confident	33 Å²	33	47.5 Å²	47.5	20%	0.2	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	141.8	-172.3	-68.6	0	0	0	0	111.6	V208 G209 L211 Y335 F338	V188-V208 CarbonylContact O-C 3.56Å; V188-V208 WeakPolarHBondContact O-CA 3.47Å; V188-G209 PolarHBondContact N-O 2.74Å; V188-G209 PolarHBondContact O-N 2.87Å; V188-L211 HydrophobicContact CG1-CD1 3.58Å; V188-L211 HydrophobicContact CG1-CG 3.98Å; V188-L211 HydrophobicContact CG2-CD2 4.06Å; V188-L211 HydrophobicContact CG2-CG 4.06Å; V188-Y335 HydrophobicContact CG2-CE1 4.46Å; V188-F338 HydrophobicContact CG2-CE1 4.07Å; V188-F338 HydrophobicContact CG2-CE2 4.23Å; V188-F338 HydrophobicContact CG2-CZ 3.81Å
189	F	97.3	Very high	89.4	Confident	18 Å²	18	52.5 Å²	52.5	8%	0.079	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	153.2	172.1	-67.2	-91.2	0	0	0	110.1	R207 V208 V290 L292 C305 H339	F189-R207 CarbonylContact C-O 3.5Å; F189-R207 VanDerWaalsContact CA-O 3.31Å; F189-R207 WeakPolarHBondContact CA-O 3.31Å; F189-V208 HydrophobicContact CD1-CG1 3.59Å; F189-V208 HydrophobicContact CE1-CG1 3.53Å; F189-V208 HydrophobicContact CZ-CG1 4.47Å; F189-V290 HydrophobicContact CD1-CG2 3.6Å; F189-V290 HydrophobicContact CE1-CB 4.2Å; F189-V290 HydrophobicContact CE1-CG2 3.6Å; F189-V290 HydrophobicContact CG-CG2 4.35Å; F189-V290 HydrophobicContact CZ-CG2 4.33Å; F189-L292 HydrophobicContact CE1-CB 4.3Å; F189-L292 HydrophobicContact CZ-CB 3.72Å; F189-C305 HydrophobicContact CE2-CB 4.09Å; F189-H339 PolarHBondContact O-CE1 3.35Å
190	S	97.6	Very high	89.8	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.014	27%	0.271	C	S	.	.			trans	-60.2	150.2	170	52.6	0	0	0	0	110.5	N192 R207 Y309 F320	S190-N192 VanDerWaalsContact C-N 3.31Å; S190-N192 VanDerWaalsContact CB-O 3.29Å; S190-N192 WeakPolarHBondContact CB-O 3.41Å; S190-N192 PolarHBondContact OG-O 3.27Å; S190-R207 PolarHBondContact N-O 3.36Å; S190-R207 PolarHBondContact OG-N 3.15Å; S190-Y309 VanDerWaalsContact O-CE1 3.22Å; S190-Y309 WeakPolarHBondContact O-CE1 3.48Å; S190-Y309 PolarHBondContact O-OH 3.26Å; S190-Y309 PolarHBondContact OG-OH 2.92Å; S190-F320 WeakPolarHBondContact OG-CZ 3.47Å
191	H	95.8	Very high	90.5	Very high	109 Å²	109	60.1 Å²	60.1	51%	0.505	29%	0.287	S	S	.	.	S	Bend	trans	-68.9	-37	178.8	-76.6	-52.3	0	0	0	111.4	K46 Y309 H339	K46-H191 PolarHBondContact NZ-O 3.42Å; H191-Y309 WeakPolarHBondContact O-CE1 3.29Å; H191-H339 AromaticContact CD2-CD2 3.91Å; H191-H339 AromaticContact CD2-CE1 3.67Å; H191-H339 AromaticContact CD2-CG 3.38Å; H191-H339 AromaticContact CD2-ND1 3.21Å; H191-H339 PolarHBondContact CD2-ND1 2.88Å; H191-H339 AromaticContact CG-ND1 3.64Å; H191-H339 PolarHBondContact N-ND1 3.02Å; H191-H339 AromaticContact NE2-CE1 3.65Å; H191-H339 AromaticContact NE2-CG 3.95Å; H191-H339 AromaticContact NE2-ND1 3.7Å; H191-H339 AromaticContact NE2-NE2 3.88Å
192	N	97.4	Very high	91.5	Very high	46 Å²	46	52.7 Å²	52.7	25%	0.246	26%	0.255	C	S	.	.	S	Bend	trans	-115	152.4	179.1	-62.7	84.9	0	0	0	110	S190 Y309 E313 L315 F320	S190-N192 VanDerWaalsContact C-N 3.31Å; S190-N192 VanDerWaalsContact CB-O 3.29Å; S190-N192 WeakPolarHBondContact CB-O 3.41Å; S190-N192 PolarHBondContact OG-O 3.27Å; N192-Y309 VanDerWaalsContact C-CE1 3.46Å; N192-E313 VanDerWaalsContact CA-O 3.26Å; N192-E313 WeakPolarHBondContact CA-O 3.26Å; N192-E313 VanDerWaalsContact CB-O 3.28Å; N192-E313 WeakPolarHBondContact CB-O 3.39Å; N192-E313 PolarHBondContact ND2-O 2.85Å; N192-L315 HydrophobicContact CB-CD1 3.84Å; N192-L315 HydrophobicContact CB-CG 4.04Å; N192-F320 WeakPolarHBondContact O-CZ 3.22Å
193	A	97.9	Very high	92.6	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.008	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	161.3	160.1	0	0	0	0	0	108.3	L204 M205 W206 Y309 E313 I314 L315	A193-L204 HydrophobicContact CB-CD1 4.1Å; A193-M205 CarbonylContact C-O 3.6Å; A193-M205 VanDerWaalsContact CA-O 3.28Å; A193-M205 WeakPolarHBondContact CA-O 3.48Å; A193-M205 WeakPolarHBondContact CB-O 3.45Å; A193-W206 HydrophobicContact CB-CB 4.34Å; A193-Y309 HydrophobicContact CB-CD1 3.97Å; A193-Y309 HydrophobicContact CB-CD2 4.09Å; A193-Y309 HydrophobicContact CB-CE1 4.28Å; A193-Y309 HydrophobicContact CB-CE2 4.36Å; A193-Y309 HydrophobicContact CB-CG 3.89Å; A193-E313 PolarHBondContact N-O 3.39Å; A193-I314 HydrophobicContact CB-CG1 4.27Å; A193-I314 CarbonylContact O-C 3.55Å; A193-I314 WeakPolarHBondContact O-CA 2.98Å; A193-L315 PolarHBondContact O-N 3.42Å
194	T	97.4	Very high	93.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	139.8	-177	59.8	0	0	0	0	110.3	M205 L315 H318 F320 T341	T194-M205 PolarHBondContact N-O 2.78Å; T194-M205 PolarHBondContact O-N 2.64Å; T194-L315 CarbonylContact C-O 3.48Å; T194-L315 VanDerWaalsContact CA-O 3.29Å; T194-L315 WeakPolarHBondContact CA-O 3.08Å; T194-L315 HydrophobicContact CG2-CB 4.42Å; T194-H318 WeakPolarHBondContact CB-O 3.21Å; T194-H318 HydrophobicContact CG2-CB 3.81Å; T194-F320 HydrophobicContact CG2-CE1 4.39Å; T194-F320 HydrophobicContact CG2-CE2 4.06Å; T194-F320 HydrophobicContact CG2-CZ 3.99Å; T194-F320 WeakPolarHBondContact OG1-CE2 3.29Å; T194-T341 HydrophobicContact CG2-CG2 3.69Å
195	V	97.3	Very high	94.5	Very high	6 Å²	6	43.9 Å²	43.9	4%	0.036	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	123	170.2	177.4	0	0	0	0	108.3	L202 C203 L204 I267 I314 L315 W316 G317	V195-L202 HydrophobicContact CG1-CD1 3.79Å; V195-L202 HydrophobicContact CG1-CD2 4.21Å; V195-L202 HydrophobicContact CG1-CG 3.88Å; V195-C203 WeakPolarHBondContact CA-O 3.42Å; V195-L204 HydrophobicContact CG2-CD1 3.77Å; V195-I267 HydrophobicContact CG1-CD1 4.32Å; V195-I314 HydrophobicContact CG2-CG2 3.75Å; V195-L315 PolarHBondContact N-O 3.15Å; V195-W316 HydrophobicContact CB-CD2 4.26Å; V195-W316 HydrophobicContact CB-CE3 4.07Å; V195-W316 HydrophobicContact CG1-CD2 4.08Å; V195-W316 HydrophobicContact CG1-CE3 3.92Å; V195-W316 HydrophobicContact CG1-CH2 4.21Å; V195-W316 HydrophobicContact CG1-CZ2 4.34Å; V195-W316 HydrophobicContact CG1-CZ3 3.99Å; V195-W316 HydrophobicContact CG2-CE3 4.37Å; V195-G317 WeakPolarHBondContact O-CA 3.24Å; V195-G317 PolarHBondContact O-N 3.08Å
196	A	96.3	Very high	95.4	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	164.1	178.1	0	0	0	0	0	111.7	C203 M205 H318 R319	A196-C203 PolarHBondContact N-O 2.6Å; A196-C203 VanDerWaalsContact N-O 3.1Å; A196-C203 PolarHBondContact O-N 3.49Å; A196-M205 HydrophobicContact CB-CE 3.66Å; A196-H318 VanDerWaalsContact CB-O 3.23Å; A196-H318 WeakPolarHBondContact CB-O 3.38Å; A196-R319 HydrophobicContact CB-CG 3.83Å
197	M	95	Very high	95.8	Very high	52 Å²	52	37.6 Å²	37.6	26%	0.256	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	131.2	174.3	-65.8	-63.2	-68.6	0	0	110.9	N200 K201 L202 T347 P348 L355	M197-N200 VanDerWaalsContact CE-C 3.45Å; M197-K201 CarbonylContact C-O 3.57Å; M197-K201 VanDerWaalsContact CA-O 3.29Å; M197-K201 WeakPolarHBondContact CA-O 3.29Å; M197-L202 HydrophobicContact CG-CD1 4.5Å; M197-L202 HydrophobicContact SD-CB 4.02Å; M197-L202 HydrophobicContact SD-CD1 3.86Å; M197-T347 HydrophobicContact CG-CG2 4.42Å; M197-P348 VanDerWaalsContact CG-CD 3.44Å; M197-P348 HydrophobicContact CG-CG 4.27Å; M197-P348 HydrophobicContact SD-CG 4.29Å; M197-L355 HydrophobicContact CE-CD1 4.24Å; M197-L355 HydrophobicContact CE-CD2 4.49Å; M197-L355 HydrophobicContact SD-CD1 4.09Å
198	R	93.9	Very high	96	Very high	85 Å²	85	37.3 Å²	37.3	32%	0.321	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	127.9	169.8	-177.3	178.1	-67.3	-161.4	1.8	108.2	N200 K201 M205	R198-N200 PolarHBondContact O-N 3.32Å; R198-N200 VanDerWaalsContact O-N 3.15Å; R198-K201 PolarHBondContact N-O 2.66Å; R198-K201 PolarHBondContact O-N 2.87Å; R198-K201 VanDerWaalsContact O-O 3.11Å; R198-M205 VanDerWaalsContact CZ-SD 3.58Å; R198-M205 PolarHBondContact NH2-SD 3.28Å
199	D	92.4	Very high	96.1	Very high	145 Å²	145	35.7 Å²	35.7	78%	0.775	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.6	44.9	179.1	-52.5	-38	0	0	0	113.4	K201	D199-K201 PolarHBondContact O-N 2.87Å
200	N	90.4	Very high	95.9	Very high	141 Å²	141	35.2 Å²	35.2	75%	0.754	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.9	17.5	-177.5	-61.5	-27.6	0	0	0	116.1	M197 R198	M197-N200 VanDerWaalsContact CE-C 3.45Å; R198-N200 PolarHBondContact O-N 3.32Å; R198-N200 VanDerWaalsContact O-N 3.15Å
201	K	92.4	Very high	95.6	Very high	114 Å²	114	39.3 Å²	39.3	50%	0.496	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	148.5	171.6	-63.2	176.3	174.7	179.2	0	110.5	M197 R198 D199 D266	M197-K201 CarbonylContact C-O 3.57Å; M197-K201 VanDerWaalsContact CA-O 3.29Å; M197-K201 WeakPolarHBondContact CA-O 3.29Å; R198-K201 PolarHBondContact N-O 2.66Å; R198-K201 PolarHBondContact O-N 2.87Å; R198-K201 VanDerWaalsContact O-O 3.11Å; D199-K201 PolarHBondContact O-N 2.87Å; K201-D266 VanDerWaalsContact CD-OD2 3.26Å; K201-D266 WeakPolarHBondContact CD-OD2 3.46Å; K201-D266 IonicContact NZ-OD2 3.97Å; K201-D266 PolarHBondContact NZ-OD2 3.35Å
202	L	95.4	Very high	95.3	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.026	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	123.6	171.1	-168.7	70	0	0	0	108.1	V195 M197 I267 W316 T347 A352	V195-L202 HydrophobicContact CG1-CD1 3.79Å; V195-L202 HydrophobicContact CG1-CD2 4.21Å; V195-L202 HydrophobicContact CG1-CG 3.88Å; M197-L202 HydrophobicContact CG-CD1 4.5Å; M197-L202 HydrophobicContact SD-CB 4.02Å; M197-L202 HydrophobicContact SD-CD1 3.86Å; L202-I267 HydrophobicContact CD2-CD1 4.15Å; L202-I267 HydrophobicContact CG-CD1 4.16Å; L202-I267 WeakPolarHBondContact O-CB 3.34Å; L202-I267 PolarHBondContact O-N 2.99Å; L202-W316 HydrophobicContact CD1-CZ2 4.39Å; L202-W316 HydrophobicContact CD2-CH2 3.79Å; L202-W316 HydrophobicContact CD2-CZ2 3.92Å; L202-T347 HydrophobicContact CD1-CG2 4.31Å; L202-A352 HydrophobicContact CB-CB 4.49Å; L202-A352 HydrophobicContact CD2-CB 4.19Å
203	C	96.8	Very high	94.8	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.007	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	139	-175.1	-52.8	0	0	0	0	111.5	V195 A196 M205 V264 H265 D266	V195-C203 WeakPolarHBondContact CA-O 3.42Å; A196-C203 PolarHBondContact N-O 2.6Å; A196-C203 VanDerWaalsContact N-O 3.1Å; A196-C203 PolarHBondContact O-N 3.49Å; C203-M205 HydrophobicContact CB-CG 4.32Å; C203-V264 HydrophobicContact CB-CG1 3.59Å; C203-H265 CarbonylContact C-O 3.55Å; C203-H265 WeakPolarHBondContact CA-O 3.39Å; C203-H265 WeakPolarHBondContact CB-O 3.3Å; C203-D266 PolarHBondContact SG-OD1 3.5Å
204	L	97.8	Very high	94.4	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.021	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	133.3	164.9	174.5	69.2	0	0	0	108.9	A193 V195 W206 H265 I267 F273 I288 I314	A193-L204 HydrophobicContact CB-CD1 4.1Å; V195-L204 HydrophobicContact CG2-CD1 3.77Å; L204-W206 HydrophobicContact CD2-CZ3 4.21Å; L204-W206 HydrophobicContact CG-CE3 4.4Å; L204-W206 HydrophobicContact CG-CZ3 4.29Å; L204-H265 HydrophobicContact CB-CB 4.26Å; L204-H265 PolarHBondContact N-O 3.25Å; L204-H265 PolarHBondContact O-N 3.11Å; L204-I267 HydrophobicContact CB-CD1 4.43Å; L204-F273 HydrophobicContact CD2-CE2 4.07Å; L204-I288 HydrophobicContact CD2-CD1 3.51Å; L204-I314 HydrophobicContact CD1-CG2 3.95Å
205	M	98	Very high	94.1	Very high	3 Å²	3	53.6 Å²	53.6	2%	0.015	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	140.7	-173.4	-64.2	174	-81.4	0	0	112.3	A193 T194 A196 R198 C203 T262 I263 V264 F320	A193-M205 CarbonylContact C-O 3.6Å; A193-M205 VanDerWaalsContact CA-O 3.28Å; A193-M205 WeakPolarHBondContact CA-O 3.48Å; A193-M205 WeakPolarHBondContact CB-O 3.45Å; T194-M205 PolarHBondContact N-O 2.78Å; T194-M205 PolarHBondContact O-N 2.64Å; A196-M205 HydrophobicContact CB-CE 3.66Å; R198-M205 VanDerWaalsContact CZ-SD 3.58Å; R198-M205 PolarHBondContact NH2-SD 3.28Å; C203-M205 HydrophobicContact CB-CG 4.32Å; M205-T262 HydrophobicContact CB-CG2 3.78Å; M205-T262 HydrophobicContact CG-CG2 4.13Å; M205-T262 HydrophobicContact SD-CG2 4.2Å; M205-I263 VanDerWaalsContact CA-O 3.23Å; M205-I263 WeakPolarHBondContact CA-O 3.23Å; M205-V264 HydrophobicContact CG-CG1 4.3Å; M205-V264 HydrophobicContact CG-CG2 4.25Å; M205-F320 HydrophobicContact CB-CE2 4.31Å
206	W	98.3	Very high	93.9	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.008	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	162.8	167	62.1	96.8	0	0	0	109.6	A193 L204 A223 V246 T262 I263 H265 V290 Y309	A193-W206 HydrophobicContact CB-CB 4.34Å; L204-W206 HydrophobicContact CD2-CZ3 4.21Å; L204-W206 HydrophobicContact CG-CE3 4.4Å; L204-W206 HydrophobicContact CG-CZ3 4.29Å; W206-A223 HydrophobicContact CH2-CB 3.56Å; W206-A223 HydrophobicContact CZ2-CB 3.82Å; W206-V246 HydrophobicContact CH2-CG1 3.52Å; W206-V246 HydrophobicContact CZ2-CG1 3.96Å; W206-T262 CarbonylContact O-C 3.49Å; W206-T262 WeakPolarHBondContact O-CA 3.32Å; W206-I263 HydrophobicContact CD2-CB 4.07Å; W206-I263 HydrophobicContact CD2-CG2 4.4Å; W206-I263 HydrophobicContact CG-CB 4.42Å; W206-I263 HydrophobicContact CH2-CG2 3.84Å; W206-I263 HydrophobicContact CZ2-CB 3.9Å; W206-I263 HydrophobicContact CZ2-CG2 3.37Å; W206-I263 PolarHBondContact N-O 2.88Å; W206-I263 PolarHBondContact O-N 3.25Å; W206-H265 HydrophobicContact CZ3-CB 4.4Å; W206-V290 HydrophobicContact CD2-CG1 3.89Å; W206-V290 HydrophobicContact CE3-CG1 4.42Å; W206-V290 HydrophobicContact CG-CG1 4.27Å; W206-V290 HydrophobicContact CH2-CG1 4.35Å; W206-V290 HydrophobicContact CZ2-CB 4.47Å; W206-V290 HydrophobicContact CZ2-CG1 3.8Å; W206-Y309 HydrophobicContact CB-CE2 3.83Å; W206-Y309 HydrophobicContact CG-CE2 4.09Å
207	R	97.6	Very high	93.7	Very high	15 Å²	15	56.5 Å²	56.5	6%	0.057	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	137.8	-177.3	-168.1	176.3	-97.1	167.5	-9.7	110.8	F189 S190 P260 I261 F320 E321 V323 F338	F189-R207 CarbonylContact C-O 3.5Å; F189-R207 VanDerWaalsContact CA-O 3.31Å; F189-R207 WeakPolarHBondContact CA-O 3.31Å; S190-R207 PolarHBondContact N-O 3.36Å; S190-R207 PolarHBondContact OG-N 3.15Å; R207-P260 HydrophobicContact CG-CB 4.12Å; R207-I261 WeakPolarHBondContact CA-O 3.41Å; R207-I261 WeakPolarHBondContact CG-O 3.42Å; R207-F320 HydrophobicContact CB-CE1 4.38Å; R207-F320 HydrophobicContact CB-CE2 4.46Å; R207-F320 HydrophobicContact CB-CZ 4.33Å; R207-E321 VanDerWaalsContact CZ-O 3.31Å; R207-E321 PolarHBondContact NH1-O 3.23Å; R207-E321 PolarHBondContact NH2-O 2.89Å; R207-V323 VanDerWaalsContact NH1-CG1 3.3Å; R207-F338 HydrophobicContact CB-CZ 4.24Å; R207-F338 HydrophobicContact CG-CD2 4.31Å; R207-F338 HydrophobicContact CG-CE2 3.71Å; R207-F338 HydrophobicContact CG-CZ 3.9Å; R207-F338 PolarHBondContact NH1-O 3.24Å
208	V	97.1	Very high	93.7	Very high	0 Å²	0	61 Å²	61	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	146.4	171.7	-64	0	0	0	0	109.5	V188 F189 I255 L257 P260 I261 I263	V188-V208 CarbonylContact O-C 3.56Å; V188-V208 WeakPolarHBondContact O-CA 3.47Å; F189-V208 HydrophobicContact CD1-CG1 3.59Å; F189-V208 HydrophobicContact CE1-CG1 3.53Å; F189-V208 HydrophobicContact CZ-CG1 4.47Å; V208-I255 HydrophobicContact CG2-CD1 4.01Å; V208-L257 HydrophobicContact CG2-CD1 3.91Å; V208-P260 CarbonylContact O-C 3.58Å; V208-P260 VanDerWaalsContact O-CA 3.23Å; V208-P260 WeakPolarHBondContact O-CA 3.29Å; V208-I261 HydrophobicContact CG2-CB 4.31Å; V208-I261 PolarHBondContact N-O 3.29Å; V208-I261 PolarHBondContact O-N 3.11Å; V208-I263 HydrophobicContact CG1-CG1 4.18Å; V208-I263 HydrophobicContact CG2-CD1 3.85Å; V208-I263 HydrophobicContact CG2-CG1 3.97Å
209	G	95.3	Very high	93.7	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	152.1	-179	0	0	0	0	0	112.6	V188	V188-G209 PolarHBondContact N-O 2.74Å; V188-G209 PolarHBondContact O-N 2.87Å
210	N	94.2	Very high	93.9	Very high	7 Å²	7	52.7 Å²	52.7	4%	0.037	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	113.7	174.7	-179.6	12	0	0	0	109.2	R183 L187 R212 S214 L257 Y335	R183-N210 PolarHBondContact NH2-ND2 3.45Å; R183-N210 PolarHBondContact NH2-OD1 2.99Å; L187-N210 HydrophobicContact CD2-CB 4.24Å; N210-R212 VanDerWaalsContact CG-O 3.26Å; N210-R212 PolarHBondContact ND2-O 3.31Å; N210-R212 PolarHBondContact O-N 3.16Å; N210-R212 PolarHBondContact OD1-N 2.83Å; N210-R212 PolarHBondContact OD1-O 3.38Å; N210-S214 PolarHBondContact ND2-O 3.46Å; N210-L257 HydrophobicContact CB-CD2 4.1Å; N210-L257 HydrophobicContact CB-CG 4.12Å; N210-Y335 PolarHBondContact O-OH 2.85Å
211	L	91	Very high	94.3	Very high	89 Å²	89	46.1 Å²	46.1	47%	0.466	22%	0.216	S	C	.	.			trans	-76.5	-10.9	179.5	-62.8	178.9	0	0	0	113.1	T186 V188 Y335	T186-L211 WeakPolarHBondContact O-CB 3.37Å; T186-L211 WeakPolarHBondContact O-CG 3.11Å; T186-L211 PolarHBondContact O-N 2.86Å; V188-L211 HydrophobicContact CG1-CD1 3.58Å; V188-L211 HydrophobicContact CG1-CG 3.98Å; V188-L211 HydrophobicContact CG2-CD2 4.06Å; V188-L211 HydrophobicContact CG2-CG 4.06Å; L211-Y335 HydrophobicContact CD2-CD1 3.8Å; L211-Y335 HydrophobicContact CD2-CE1 3.66Å; L211-Y335 HydrophobicContact CD2-CE2 4.45Å; L211-Y335 HydrophobicContact CD2-CG 4.29Å
212	R	89.5	Confident	94.5	Very high	137 Å²	137	45.7 Å²	45.7	52%	0.517	21%	0.211	S	C	.	.	S	Bend	trans	-104.5	153.6	179.3	-75.3	179.9	176.6	-93.1	-0.7	111.1	T186 N210	T186-R212 HydrophobicContact CG2-CG 4.12Å; T186-R212 VanDerWaalsContact CG2-NE 3.34Å; N210-R212 VanDerWaalsContact CG-O 3.26Å; N210-R212 PolarHBondContact ND2-O 3.31Å; N210-R212 PolarHBondContact O-N 3.16Å; N210-R212 PolarHBondContact OD1-N 2.83Å; N210-R212 PolarHBondContact OD1-O 3.38Å
213	K	86.1	Confident	94.6	Very high	206 Å²	206	45.4 Å²	45.4	90%	0.896	21%	0.21	S	C	*	.	S	Bend	trans	-71.6	-30.5	173.6	-66.9	-171.2	177.4	-174.2	0	113.4
214	S	91.1	Very high	94.6	Very high	43 Å²	43	47.1 Å²	47.1	30%	0.301	22%	0.218	S	C	.	.	S	Bend	trans	-67.9	143.2	176.3	50.7	0	0	0	0	111	R183 N210 E297	R183-S214 PolarHBondContact NH1-OG 2.85Å; R183-S214 PolarHBondContact NH2-O 3.29Å; N210-S214 PolarHBondContact ND2-O 3.46Å; S214-E297 VanDerWaalsContact CA-OE2 3.27Å; S214-E297 WeakPolarHBondContact CA-OE2 3.41Å; S214-E297 VanDerWaalsContact CB-OE2 3.23Å; S214-E297 WeakPolarHBondContact CB-OE2 3.28Å
215	H	90.6	Very high	94.5	Very high	69 Å²	69	47.2 Å²	47.2	32%	0.319	22%	0.218	S	C	.	.			trans	-78.5	155.2	-171.1	-64.2	-89.3	0	0	0	111.7	E297	H215-E297 IonicContact CD2-OE1 2.69Å; H215-E297 IonicContact CD2-OE2 2.82Å; H215-E297 PolarHBondContact N-OE2 3.32Å
216	L	92.6	Very high	94.4	Very high	7 Å²	7	47.4 Å²	47.4	4%	0.037	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	107.6	163.6	-172.3	70.5	0	0	0	106.2	L187 A219 L257 L292 T303	L187-L216 HydrophobicContact CD1-CD1 4.41Å; L187-L216 HydrophobicContact CD1-CD2 4.02Å; L187-L216 HydrophobicContact CD2-CD2 4.25Å; L216-A219 HydrophobicContact CB-CB 4.22Å; L216-A219 HydrophobicContact CD2-CB 3.69Å; L216-A219 HydrophobicContact CG-CB 3.88Å; L216-L257 HydrophobicContact CD2-CD2 4.5Å; L216-L292 HydrophobicContact CD2-CD1 4.18Å; L216-L292 HydrophobicContact CD2-CD2 4.11Å; L216-L292 HydrophobicContact CD2-CG 4.06Å; L216-T303 HydrophobicContact CD1-CG2 3.81Å
217	V	93.1	Very high	94.1	Very high	61 Å²	61	51.5 Å²	51.5	37%	0.37	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	143.6	-175.5	-178.4	0	0	0	0	109.1	A219 G294 M295 E297	V217-A219 PolarHBondContact O-N 3.1Å; V217-G294 CarbonylContact O-C 3.43Å; V217-M295 HydrophobicContact CB-CB 4.22Å; V217-M295 HydrophobicContact CG1-CE 4.11Å; V217-M295 PolarHBondContact N-O 3.06Å; V217-M295 PolarHBondContact O-N 2.9Å; V217-E297 HydrophobicContact CG2-CB 4.33Å
218	E	93.3	Very high	93.9	Very high	148 Å²	148	53.5 Å²	53.5	69%	0.692	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	49.6	40.6	-176.3	-65.6	-179.1	-179.6	0	0	113.1	H220 M295	E218-H220 PolarHBondContact O-N 3.2Å; E218-H220 PolarHBondContact O-ND1 3.22Å; E218-M295 HydrophobicContact CB-CE 3.94Å; E218-M295 HydrophobicContact CG-CE 3.79Å; E218-M295 WeakPolarHBondContact OE2-CE 3.38Å
219	A	95.6	Very high	93.6	Very high	2 Å²	2	58.4 Å²	58.4	2%	0.017	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	130	179.5	0	0	0	0	0	110.3	L216 V217 R254 I255 E293	L216-A219 HydrophobicContact CB-CB 4.22Å; L216-A219 HydrophobicContact CD2-CB 3.69Å; L216-A219 HydrophobicContact CG-CB 3.88Å; V217-A219 PolarHBondContact O-N 3.1Å; A219-R254 CarbonylContact O-C 3.6Å; A219-R254 WeakPolarHBondContact O-CA 3.35Å; A219-I255 HydrophobicContact CB-CG1 3.96Å; A219-I255 PolarHBondContact O-N 3.27Å; A219-E293 CarbonylContact C-O 3.58Å; A219-E293 VanDerWaalsContact CA-O 3.23Å; A219-E293 WeakPolarHBondContact CA-O 3.15Å
220	H	96.5	Very high	93.5	Very high	53 Å²	53	62.6 Å²	62.6	25%	0.245	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	156.1	175.7	62.6	-80.2	0	0	0	111	E218 D253 R254 E293	E218-H220 PolarHBondContact O-N 3.2Å; E218-H220 PolarHBondContact O-ND1 3.22Å; H220-D253 VanDerWaalsContact CA-O 3.25Å; H220-D253 WeakPolarHBondContact CA-O 2.96Å; H220-R254 HydrophobicContact CB-CG 4.32Å; H220-E293 WeakPolarHBondContact CE1-CB 3.4Å; H220-E293 IonicContact CE1-OE2 3.81Å; H220-E293 PolarHBondContact N-O 3.47Å; H220-E293 WeakPolarHBondContact NE2-CB 3Å; H220-E293 IonicContact NE2-OE2 3.92Å; H220-E293 PolarHBondContact NE2-OE2 3.33Å; H220-E293 PolarHBondContact O-N 3.37Å
221	V	97.3	Very high	93.5	Very high	3 Å²	3	63.3 Å²	63.3	2%	0.018	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	147.8	-174	-69.4	0	0	0	0	111.8	V246 D253 I255 I263 I291 L292	V221-V246 HydrophobicContact CG2-CB 4.42Å; V221-V246 HydrophobicContact CG2-CG2 3.97Å; V221-V246 WeakPolarHBondContact O-CG2 2.94Å; V221-D253 WeakPolarHBondContact CG2-O 3.46Å; V221-D253 PolarHBondContact N-O 3.2Å; V221-D253 VanDerWaalsContact N-O 3.12Å; V221-I255 HydrophobicContact CG1-CD1 3.88Å; V221-I263 HydrophobicContact CG1-CD1 3.95Å; V221-I263 HydrophobicContact CG1-CG1 4.22Å; V221-I263 HydrophobicContact CG2-CD1 4.01Å; V221-I263 HydrophobicContact CG2-CG1 4.42Å; V221-I263 HydrophobicContact CG2-CG2 3.98Å; V221-I291 WeakPolarHBondContact CA-O 3.29Å; V221-L292 HydrophobicContact CG1-CD1 3.7Å
222	R	96.9	Very high	93.7	Very high	104 Å²	104	64 Å²	64	39%	0.392	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	151.1	174.1	-59	176.6	62.7	-169.8	0.4	109.4	I291	R222-I291 HydrophobicContact CB-CB 4.29Å; R222-I291 PolarHBondContact N-O 2.95Å; R222-I291 PolarHBondContact O-N 3.18Å
223	A	97.5	Very high	93.9	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	142.1	176.1	0	0	0	0	0	110.3	W206 I244 V246 V289 V290	W206-A223 HydrophobicContact CH2-CB 3.56Å; W206-A223 HydrophobicContact CZ2-CB 3.82Å; A223-I244 HydrophobicContact CB-CB 3.85Å; A223-I244 HydrophobicContact CB-CD1 4.26Å; A223-I244 HydrophobicContact CB-CG2 4.24Å; A223-I244 PolarHBondContact O-N 3.49Å; A223-V246 HydrophobicContact CB-CG1 4.4Å; A223-V289 CarbonylContact C-O 3.56Å; A223-V289 VanDerWaalsContact CA-O 3.31Å; A223-V289 WeakPolarHBondContact CA-O 3.32Å; A223-V290 HydrophobicContact CB-CG1 4.3Å
224	Q	97.1	Very high	94.3	Very high	36 Å²	36	58 Å²	58	17%	0.168	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	134.9	-179.5	-64	-176.9	-51.3	0	0	110	M242 I288 V289	Q224-M242 CarbonylContact C-O 3.54Å; Q224-M242 VanDerWaalsContact CA-O 3.27Å; Q224-M242 WeakPolarHBondContact CA-O 3.27Å; Q224-I288 CarbonylContact O-C 3.59Å; Q224-I288 WeakPolarHBondContact O-CA 3.17Å; Q224-V289 PolarHBondContact N-O 3.32Å; Q224-V289 PolarHBondContact O-N 3.21Å
225	L	96.7	Very high	94.6	Very high	6 Å²	6	62.1 Å²	62.1	3%	0.031	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	123.1	168.5	177	62.3	0	0	0	109.2	M242 I244 P272 F273 F286 I288	L225-M242 HydrophobicContact CB-CB 4.32Å; L225-M242 HydrophobicContact CD2-CE 3.83Å; L225-M242 HydrophobicContact CG-CE 4.19Å; L225-M242 PolarHBondContact N-O 3.08Å; L225-M242 PolarHBondContact O-N 2.85Å; L225-I244 HydrophobicContact CB-CD1 4.02Å; L225-I244 HydrophobicContact CB-CG1 4.18Å; L225-P272 HydrophobicContact CD2-CB 3.61Å; L225-P272 HydrophobicContact CD2-CG 3.9Å; L225-F273 HydrophobicContact CB-CZ 4.42Å; L225-F273 HydrophobicContact CD1-CE1 4Å; L225-F273 HydrophobicContact CD1-CZ 3.87Å; L225-F273 HydrophobicContact CD2-CE1 4.18Å; L225-F273 HydrophobicContact CD2-CZ 4.14Å; L225-F273 HydrophobicContact CG-CZ 4.38Å; L225-F286 HydrophobicContact CD1-CB 3.71Å; L225-F286 HydrophobicContact CD1-CD2 3.38Å; L225-F286 HydrophobicContact CD1-CE2 4.14Å; L225-F286 HydrophobicContact CD1-CG 3.65Å; L225-I288 HydrophobicContact CD1-CG1 4.23Å
226	L	95.2	Very high	94.8	Very high	8 Å²	8	65.7 Å²	65.7	4%	0.042	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	116.4	174	-56.3	-174	0	0	0	109.3	F43 L239 D240 Q241 E287 V289	F43-L226 HydrophobicContact CB-CD1 3.87Å; F43-L226 HydrophobicContact CD1-CD1 3.51Å; F43-L226 HydrophobicContact CE1-CD1 4.35Å; F43-L226 HydrophobicContact CG-CD1 3.92Å; L226-L239 HydrophobicContact CB-CD2 3.84Å; L226-L239 HydrophobicContact CD1-CD2 4.03Å; L226-L239 HydrophobicContact CD2-CD2 3.8Å; L226-L239 HydrophobicContact CG-CD2 4.11Å; L226-D240 WeakPolarHBondContact CA-O 3.36Å; L226-Q241 HydrophobicContact CD2-CB 4.02Å; L226-Q241 HydrophobicContact CD2-CG 3.61Å; L226-E287 WeakPolarHBondContact CA-O 3.19Å; L226-E287 HydrophobicContact CB-CB 4.32Å; L226-E287 WeakPolarHBondContact CB-O 3.26Å; L226-E287 PolarHBondContact N-O 3.46Å; L226-E287 PolarHBondContact O-N 3.44Å; L226-V289 HydrophobicContact CD1-CB 4.42Å; L226-V289 HydrophobicContact CD1-CG2 3.35Å; L226-V289 HydrophobicContact CG-CG2 3.98Å
227	K	92.9	Very high	94.9	Very high	87 Å²	87	67 Å²	67	38%	0.378	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	145.8	178.8	-166.7	-178.2	175.2	-179.9	0	110.7	D240 M242 F286	K227-D240 PolarHBondContact N-O 3.37Å; K227-D240 WeakPolarHBondContact O-CB 3.48Å; K227-D240 PolarHBondContact O-N 3.43Å; K227-M242 HydrophobicContact CB-CE 4.28Å; K227-F286 HydrophobicContact CB-CB 4.22Å; K227-F286 HydrophobicContact CD-CB 4.39Å; K227-F286 HydrophobicContact CG-CB 4.2Å
228	S	92.1	Very high	94.8	Very high	58 Å²	58	68.4 Å²	68.4	41%	0.406	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	137.6	167.5	56.4	0	0	0	0	110.1	P238	S228-P238 WeakPolarHBondContact CA-O 3.31Å; S228-P238 VanDerWaalsContact CB-O 3.25Å; S228-P238 WeakPolarHBondContact CB-O 3.47Å
229	R	90.6	Very high	94.7	Very high	102 Å²	102	64.7 Å²	64.7	39%	0.385	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	154.1	173	69.1	168.8	173.5	109.8	7.9	111.8	I237 D240	R229-I237 HydrophobicContact CG-CB 4.4Å; R229-I237 PolarHBondContact N-O 2.97Å; R229-I237 VanDerWaalsContact N-O 3.13Å; R229-I237 PolarHBondContact O-N 3.06Å; R229-D240 WeakPolarHBondContact CD-OD2 3.46Å; R229-D240 HydrophobicContact CG-CB 3.83Å; R229-D240 IonicContact CZ-OD1 4Å; R229-D240 IonicContact CZ-OD2 2.95Å; R229-D240 IonicContact NE-OD1 3.68Å; R229-D240 PolarHBondContact NE-OD1 3.05Å; R229-D240 IonicContact NE-OD2 2.74Å; R229-D240 PolarHBondContact NE-OD2 3.32Å; R229-D240 IonicContact NH2-OD1 3.53Å; R229-D240 PolarHBondContact NH2-OD1 2.56Å; R229-D240 IonicContact NH2-OD2 2.91Å; R229-D240 PolarHBondContact NH2-OD2 3.22Å
230	T	94.1	Very high	94.6	Very high	89 Å²	89	65.7 Å²	65.7	55%	0.546	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130.1	167.4	-52	0	0	0	0	107.9	E235	T230-E235 CarbonylContact C-O 3.56Å; T230-E235 VanDerWaalsContact CA-O 3.27Å; T230-E235 WeakPolarHBondContact CA-O 3.3Å
231	T	94.4	Very high	94.5	Very high	21 Å²	21	68.1 Å²	68.1	13%	0.129	36%	0.361	C	S	.	.			trans	-71.5	167.2	178.2	77.5	0	0	0	0	111.2	E233 G234 E235 I237	T231-E233 WeakPolarHBondContact CB-OE2 3.43Å; T231-E233 PolarHBondContact O-N 3.19Å; T231-E233 PolarHBondContact OG1-N 3.04Å; T231-E233 PolarHBondContact OG1-OE2 3.25Å; T231-G234 PolarHBondContact O-N 3.41Å; T231-E235 HydrophobicContact CG2-CB 4.05Å; T231-E235 PolarHBondContact N-O 3.42Å; T231-E235 PolarHBondContact OG1-N 3.47Å; T231-I237 HydrophobicContact CG2-CD1 3.87Å; T231-I237 HydrophobicContact CG2-CG1 4.43Å
232	A	93.7	Very high	94.4	Very high	105 Å²	105	70.7 Å²	70.7	87%	0.868	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-27.7	177.2	0	0	0	0	0	112.1	G234	A232-G234 VanDerWaalsContact C-N 3.25Å; A232-G234 PolarHBondContact O-N 3Å
233	E	95.6	Very high	94.3	Very high	163 Å²	163	70.1 Å²	70.1	76%	0.762	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-5.9	177.2	-53.7	73.3	-158.7	0	0	112.8	T231	T231-E233 WeakPolarHBondContact CB-OE2 3.43Å; T231-E233 PolarHBondContact O-N 3.19Å; T231-E233 PolarHBondContact OG1-N 3.04Å; T231-E233 PolarHBondContact OG1-OE2 3.25Å
234	G	94.1	Very high	94.3	Very high	54 Å²	54	70.1 Å²	70.1	56%	0.557	38%	0.379	S	S	*	.	S	Bend	trans	92.3	9.2	177.8	0	0	0	0	0	115.3	T231 A232	T231-G234 PolarHBondContact O-N 3.41Å; A232-G234 VanDerWaalsContact C-N 3.25Å; A232-G234 PolarHBondContact O-N 3Å
235	E	96.1	Very high	94.3	Very high	129 Å²	129	71.6 Å²	71.6	60%	0.603	39%	0.388	S	S	*	.			trans	-75.4	125.7	174.4	-176.4	-179.2	-172.9	0	0	110.5	T230 T231 I237	T230-E235 CarbonylContact C-O 3.56Å; T230-E235 VanDerWaalsContact CA-O 3.27Å; T230-E235 WeakPolarHBondContact CA-O 3.3Å; T231-E235 HydrophobicContact CG2-CB 4.05Å; T231-E235 PolarHBondContact N-O 3.42Å; T231-E235 PolarHBondContact OG1-N 3.47Å; E235-I237 HydrophobicContact CG-CG1 4.47Å
236	Y	95	Very high	94.2	Very high	143 Å²	143	72 Å²	72	56%	0.561	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	116.2	174.8	178	-104.5	0	0	0	110.7	P238	Y236-P238 HydrophobicContact CD1-CG 4.14Å; Y236-P238 HydrophobicContact CE1-CB 4.06Å; Y236-P238 HydrophobicContact CE1-CG 3.86Å; Y236-P238 WeakPolarHBondContact O-CD 3.39Å
237	I	94.5	Very high	94.1	Very high	35 Å²	35	72.2 Å²	72.2	18%	0.179	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	109.8	174.8	-57.1	172.2	0	0	0	107.6	R229 T231 E235 L239 D240	R229-I237 HydrophobicContact CG-CB 4.4Å; R229-I237 PolarHBondContact N-O 2.97Å; R229-I237 VanDerWaalsContact N-O 3.13Å; R229-I237 PolarHBondContact O-N 3.06Å; T231-I237 HydrophobicContact CG2-CD1 3.87Å; T231-I237 HydrophobicContact CG2-CG1 4.43Å; E235-I237 HydrophobicContact CG-CG1 4.47Å; I237-L239 PolarHBondContact O-N 3.33Å; I237-D240 HydrophobicContact CB-CB 4.44Å; I237-D240 HydrophobicContact CG2-CB 3.81Å
238	P	91	Very high	94.1	Very high	90 Å²	90	74.9 Å²	74.9	58%	0.584	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.9	-34.4	-174.5	-25.7	33.7	0	0	0	113.9	S228 Y236	S228-P238 WeakPolarHBondContact CA-O 3.31Å; S228-P238 VanDerWaalsContact CB-O 3.25Å; S228-P238 WeakPolarHBondContact CB-O 3.47Å; Y236-P238 HydrophobicContact CD1-CG 4.14Å; Y236-P238 HydrophobicContact CE1-CB 4.06Å; Y236-P238 HydrophobicContact CE1-CG 3.86Å; Y236-P238 WeakPolarHBondContact O-CD 3.39Å
239	L	91.5	Very high	94	Very high	71 Å²	71	79.3 Å²	79.3	37%	0.372	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	88.2	-175.6	-151.2	149.1	0	0	0	108.7	F43 L226 I237	F43-L239 HydrophobicContact CD2-CD1 3.86Å; F43-L239 HydrophobicContact CD2-CD2 4.5Å; F43-L239 HydrophobicContact CE2-CD1 4.42Å; F43-L239 HydrophobicContact CG-CD1 4.39Å; L226-L239 HydrophobicContact CB-CD2 3.84Å; L226-L239 HydrophobicContact CD1-CD2 4.03Å; L226-L239 HydrophobicContact CD2-CD2 3.8Å; L226-L239 HydrophobicContact CG-CD2 4.11Å; I237-L239 PolarHBondContact O-N 3.33Å
240	D	94.4	Very high	94	Very high	23 Å²	23	78.4 Å²	78.4	12%	0.123	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	141.5	177.9	-170.9	62.1	0	0	0	110.2	L226 K227 R229 I237 M242	L226-D240 WeakPolarHBondContact CA-O 3.36Å; K227-D240 PolarHBondContact N-O 3.37Å; K227-D240 WeakPolarHBondContact O-CB 3.48Å; K227-D240 PolarHBondContact O-N 3.43Å; R229-D240 WeakPolarHBondContact CD-OD2 3.46Å; R229-D240 HydrophobicContact CG-CB 3.83Å; R229-D240 IonicContact CZ-OD1 4Å; R229-D240 IonicContact CZ-OD2 2.95Å; R229-D240 IonicContact NE-OD1 3.68Å; R229-D240 PolarHBondContact NE-OD1 3.05Å; R229-D240 IonicContact NE-OD2 2.74Å; R229-D240 PolarHBondContact NE-OD2 3.32Å; R229-D240 IonicContact NH2-OD1 3.53Å; R229-D240 PolarHBondContact NH2-OD1 2.56Å; R229-D240 IonicContact NH2-OD2 2.91Å; R229-D240 PolarHBondContact NH2-OD2 3.22Å; I237-D240 HydrophobicContact CB-CB 4.44Å; I237-D240 HydrophobicContact CG2-CB 3.81Å; D240-M242 VanDerWaalsContact OD2-CG 3.32Å; D240-M242 WeakPolarHBondContact OD2-CG 3.37Å
241	Q	94.7	Very high	93.9	Very high	103 Å²	103	74.8 Å²	74.8	48%	0.481	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	102.3	-178.2	-48	-171.6	10.8	0	0	108.5	L226	L226-Q241 HydrophobicContact CD2-CB 4.02Å; L226-Q241 HydrophobicContact CD2-CG 3.61Å
242	M	94.4	Very high	93.8	Very high	57 Å²	57	78.4 Å²	78.4	28%	0.281	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	133.4	176.6	-67.5	172.4	-84.2	0	0	109.2	Q224 L225 K227 D240	Q224-M242 CarbonylContact C-O 3.54Å; Q224-M242 VanDerWaalsContact CA-O 3.27Å; Q224-M242 WeakPolarHBondContact CA-O 3.27Å; L225-M242 HydrophobicContact CB-CB 4.32Å; L225-M242 HydrophobicContact CD2-CE 3.83Å; L225-M242 HydrophobicContact CG-CE 4.19Å; L225-M242 PolarHBondContact N-O 3.08Å; L225-M242 PolarHBondContact O-N 2.85Å; K227-M242 HydrophobicContact CB-CE 4.28Å; D240-M242 VanDerWaalsContact OD2-CG 3.32Å; D240-M242 WeakPolarHBondContact OD2-CG 3.37Å
243	D	95.7	Very high	93.8	Very high	92 Å²	92	73.8 Å²	73.8	49%	0.492	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	145.8	177.9	-163.5	66.4	0	0	0	111
244	I	96.7	Very high	93.8	Very high	1 Å²	1	74.3 Å²	74.3	1%	0.005	39%	0.393	C	S	.	.			trans	-115.2	110	174.4	-63.3	167.6	0	0	0	106.8	A223 L225 V246 H265 P272 F273 I288	A223-I244 HydrophobicContact CB-CB 3.85Å; A223-I244 HydrophobicContact CB-CD1 4.26Å; A223-I244 HydrophobicContact CB-CG2 4.24Å; A223-I244 PolarHBondContact O-N 3.49Å; L225-I244 HydrophobicContact CB-CD1 4.02Å; L225-I244 HydrophobicContact CB-CG1 4.18Å; I244-V246 PolarHBondContact O-N 3Å; I244-H265 HydrophobicContact CG2-CB 3.82Å; I244-H265 WeakPolarHBondContact CG2-ND1 3.32Å; I244-P272 HydrophobicContact CG1-CG 4.36Å; I244-F273 HydrophobicContact CD1-CE2 3.68Å; I244-F273 HydrophobicContact CD1-CZ 3.97Å; I244-F273 HydrophobicContact CG1-CE2 3.98Å; I244-I288 HydrophobicContact CD1-CD1 4.39Å; I244-I288 HydrophobicContact CD1-CG1 4.3Å; I244-I288 HydrophobicContact CD1-CG2 3.67Å
245	D	96.2	Very high	93.9	Very high	67 Å²	67	72.9 Å²	72.9	36%	0.358	37%	0.372	S	S	.	.			trans	-65.7	123	-176.2	-179.3	30.1	0	0	0	111.9	G247 F248 H265	D245-G247 WeakPolarHBondContact OD1-CA 2.97Å; D245-G247 PolarHBondContact OD1-N 3.45Å; D245-F248 PolarHBondContact OD1-N 3.29Å; D245-F248 VanDerWaalsContact OD1-N 3.1Å; D245-H265 PolarHBondContact O-ND1 2.95Å
246	V	95.9	Very high	93.8	Very high	15 Å²	15	74.2 Å²	74.2	9%	0.091	38%	0.376	C	S	.	.	S	Bend	trans	-113.3	18.2	175.7	-69.6	0	0	0	0	111.6	W206 V221 A223 I244 D253 I263	W206-V246 HydrophobicContact CH2-CG1 3.52Å; W206-V246 HydrophobicContact CZ2-CG1 3.96Å; V221-V246 HydrophobicContact CG2-CB 4.42Å; V221-V246 HydrophobicContact CG2-CG2 3.97Å; V221-V246 WeakPolarHBondContact O-CG2 2.94Å; A223-V246 HydrophobicContact CB-CG1 4.4Å; I244-V246 PolarHBondContact O-N 3Å; V246-D253 HydrophobicContact CG2-CB 4.15Å; V246-I263 HydrophobicContact CB-CG2 4.26Å; V246-I263 HydrophobicContact CG1-CG2 3.91Å
247	G	92.8	Very high	93.8	Very high	12 Å²	12	67.5 Å²	67.5	12%	0.124	35%	0.35	C	S	.	.	S	Bend	trans	95.3	36.6	-179.5	0	0	0	0	0	113.5	D245 S250 G251 V252 D253	D245-G247 WeakPolarHBondContact OD1-CA 2.97Å; D245-G247 PolarHBondContact OD1-N 3.45Å; G247-S250 PolarHBondContact O-N 2.88Å; G247-S250 PolarHBondContact O-OG 3.42Å; G247-S250 VanDerWaalsContact O-OG 3.14Å; G247-G251 PolarHBondContact O-N 3.1Å; G247-V252 PolarHBondContact O-N 3.2Å; G247-D253 PolarHBondContact O-N 3.46Å
248	F	91.9	Very high	93.7	Very high	143 Å²	143	69.1 Å²	69.1	63%	0.627	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-45.8	178.8	178.2	-98.9	0	0	0	111.6	D245 S250 G251	D245-F248 PolarHBondContact OD1-N 3.29Å; D245-F248 VanDerWaalsContact OD1-N 3.1Å; F248-S250 VanDerWaalsContact C-N 3.27Å; F248-S250 PolarHBondContact O-N 3.43Å; F248-G251 WeakPolarHBondContact O-CA 3.05Å; F248-G251 PolarHBondContact O-N 2.99Å
249	D	90.8	Very high	93.9	Very high	150 Å²	150	67 Å²	67	80%	0.802	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-30.3	-177.7	-65.9	-34.6	0	0	0	113.2
250	S	91.1	Very high	94.1	Very high	83 Å²	83	64.3 Å²	64.3	58%	0.58	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-8.6	174.4	57.7	0	0	0	0	112.9	G247 F248 V252	G247-S250 PolarHBondContact O-N 2.88Å; G247-S250 PolarHBondContact O-OG 3.42Å; G247-S250 VanDerWaalsContact O-OG 3.14Å; F248-S250 VanDerWaalsContact C-N 3.27Å; F248-S250 PolarHBondContact O-N 3.43Å; S250-V252 VanDerWaalsContact C-N 3.26Å; S250-V252 PolarHBondContact O-N 3.18Å; S250-V252 VanDerWaalsContact OG-CG2 3.26Å; S250-V252 WeakPolarHBondContact OG-CG2 3.35Å
251	G	91.4	Very high	94.2	Very high	13 Å²	13	65.4 Å²	65.4	13%	0.134	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	22.7	-176.4	0	0	0	0	0	114.4	G247 F248 D253 R254	G247-G251 PolarHBondContact O-N 3.1Å; F248-G251 WeakPolarHBondContact O-CA 3.05Å; F248-G251 PolarHBondContact O-N 2.99Å; G251-D253 VanDerWaalsContact C-N 3.33Å; G251-D253 VanDerWaalsContact C-OD1 3.27Å; G251-D253 VanDerWaalsContact CA-OD1 3.31Å; G251-D253 WeakPolarHBondContact CA-OD1 3.33Å; G251-R254 PolarHBondContact O-NE 2.6Å; G251-R254 PolarHBondContact O-NH2 2.91Å; G251-R254 VanDerWaalsContact O-NH2 3.16Å
252	V	92.6	Very high	94.4	Very high	97 Å²	97	61.9 Å²	61.9	59%	0.588	33%	0.325	S	S	*	.			trans	-80.3	-17.9	176.1	175.5	0	0	0	0	111.4	G247 S250 R254	G247-V252 PolarHBondContact O-N 3.2Å; S250-V252 VanDerWaalsContact C-N 3.26Å; S250-V252 PolarHBondContact O-N 3.18Å; S250-V252 VanDerWaalsContact OG-CG2 3.26Å; S250-V252 WeakPolarHBondContact OG-CG2 3.35Å; V252-R254 PolarHBondContact O-N 3.29Å
253	D	93.8	Very high	94.5	Very high	9 Å²	9	59.6 Å²	59.6	5%	0.048	31%	0.313	C	S	.	.	S	Bend	trans	-57.8	-27.6	170.5	71	-52.8	0	0	0	112.7	H220 V221 V246 G247 G251 I255	H220-D253 VanDerWaalsContact CA-O 3.25Å; H220-D253 WeakPolarHBondContact CA-O 2.96Å; V221-D253 WeakPolarHBondContact CG2-O 3.46Å; V221-D253 PolarHBondContact N-O 3.2Å; V221-D253 VanDerWaalsContact N-O 3.12Å; V246-D253 HydrophobicContact CG2-CB 4.15Å; G247-D253 PolarHBondContact O-N 3.46Å; G251-D253 VanDerWaalsContact C-N 3.33Å; G251-D253 VanDerWaalsContact C-OD1 3.27Å; G251-D253 VanDerWaalsContact CA-OD1 3.31Å; G251-D253 WeakPolarHBondContact CA-OD1 3.33Å; D253-I255 PolarHBondContact O-N 3.11Å
254	R	95.6	Very high	94.6	Very high	173 Å²	173	57 Å²	57	65%	0.653	30%	0.301	S	S	*	.	B	Isolated β-bridge	trans	-77.4	114.9	174.8	-60	170.5	-60.3	-177.6	2.5	110	A219 H220 G251 V252	A219-R254 CarbonylContact O-C 3.6Å; A219-R254 WeakPolarHBondContact O-CA 3.35Å; H220-R254 HydrophobicContact CB-CG 4.32Å; G251-R254 PolarHBondContact O-NE 2.6Å; G251-R254 PolarHBondContact O-NH2 2.91Å; G251-R254 VanDerWaalsContact O-NH2 3.16Å; V252-R254 PolarHBondContact O-N 3.29Å
255	I	95.8	Very high	94.6	Very high	25 Å²	25	57.1 Å²	57.1	13%	0.128	30%	0.301	C	S	.	.			trans	-115.5	145.8	-172.2	60.1	170.4	0	0	0	112.5	V208 A219 V221 D253 L257 I261 I263 L292	V208-I255 HydrophobicContact CG2-CD1 4.01Å; A219-I255 HydrophobicContact CB-CG1 3.96Å; A219-I255 PolarHBondContact O-N 3.27Å; V221-I255 HydrophobicContact CG1-CD1 3.88Å; D253-I255 PolarHBondContact O-N 3.11Å; I255-L257 HydrophobicContact CD1-CB 4.27Å; I255-L257 HydrophobicContact CD1-CD1 4.34Å; I255-L257 PolarHBondContact O-N 3.03Å; I255-I261 HydrophobicContact CB-CD1 4.03Å; I255-I263 HydrophobicContact CD1-CD1 4.24Å; I255-I263 HydrophobicContact CG2-CD1 4.28Å; I255-L292 HydrophobicContact CD1-CD1 3.98Å
256	F	94.8	Very high	94.6	Very high	157 Å²	157	56.6 Å²	56.6	69%	0.689	30%	0.299	S	S	*	.			trans	-96	87.1	169.1	-178.7	-122.1	0	0	0	110.7	V258 I261	F256-V258 HydrophobicContact CD1-CG2 3.89Å; F256-V258 HydrophobicContact CD2-CG2 4.37Å; F256-V258 HydrophobicContact CE1-CB 4.35Å; F256-V258 HydrophobicContact CE1-CG2 3.31Å; F256-V258 HydrophobicContact CE2-CG2 3.84Å; F256-V258 HydrophobicContact CG-CG2 4.39Å; F256-V258 HydrophobicContact CZ-CG2 3.28Å; F256-V258 PolarHBondContact O-N 3.47Å; F256-I261 WeakPolarHBondContact O-CD1 2.99Å
257	L	94.6	Very high	94.6	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.01	30%	0.298	C	S	.	.			trans	-82.7	79.1	-169.9	-170.5	66	0	0	0	113.5	L187 V208 N210 L216 I255 I261 L292	L187-L257 HydrophobicContact CD2-CD2 4.25Å; V208-L257 HydrophobicContact CG2-CD1 3.91Å; N210-L257 HydrophobicContact CB-CD2 4.1Å; N210-L257 HydrophobicContact CB-CG 4.12Å; L216-L257 HydrophobicContact CD2-CD2 4.5Å; I255-L257 HydrophobicContact CD1-CB 4.27Å; I255-L257 HydrophobicContact CD1-CD1 4.34Å; I255-L257 PolarHBondContact O-N 3.03Å; L257-I261 HydrophobicContact CD1-CB 4.36Å; L257-I261 HydrophobicContact CD1-CD1 4.15Å; L257-I261 HydrophobicContact CD1-CG1 4.13Å; L257-L292 HydrophobicContact CD2-CD2 3.9Å
258	V	92.6	Very high	94.6	Very high	69 Å²	69	59.2 Å²	59.2	42%	0.418	31%	0.309	S	S	.	.	S	Bend	trans	-98.6	-53.4	170.3	178.6	0	0	0	0	111.4	F256	F256-V258 HydrophobicContact CD1-CG2 3.89Å; F256-V258 HydrophobicContact CD2-CG2 4.37Å; F256-V258 HydrophobicContact CE1-CB 4.35Å; F256-V258 HydrophobicContact CE1-CG2 3.31Å; F256-V258 HydrophobicContact CE2-CG2 3.84Å; F256-V258 HydrophobicContact CG-CG2 4.39Å; F256-V258 HydrophobicContact CZ-CG2 3.28Å; F256-V258 PolarHBondContact O-N 3.47Å
259	T	94.4	Very high	94.7	Very high	46 Å²	46	59.5 Å²	59.5	28%	0.282	31%	0.312	S	S	.	.	S	Bend	trans	-100.9	161.4	173.3	57.8	0	0	0	0	109.4	I261 L324 V333	T259-I261 WeakPolarHBondContact O-CG1 3.47Å; T259-I261 PolarHBondContact O-N 3.22Å; T259-L324 HydrophobicContact CG2-CD1 3.75Å; T259-L324 HydrophobicContact CG2-CD2 4.46Å; T259-V333 HydrophobicContact CG2-CG2 3.91Å
260	P	96.6	Very high	94.9	Very high	14 Å²	14	59.3 Å²	59.3	9%	0.091	31%	0.311	C	S	.	.			trans	-53.2	127.6	172.2	-31	38.8	0	0	0	112.6	R207 V208 V323 V333 Y335 F338	R207-P260 HydrophobicContact CG-CB 4.12Å; V208-P260 CarbonylContact O-C 3.58Å; V208-P260 VanDerWaalsContact O-CA 3.23Å; V208-P260 WeakPolarHBondContact O-CA 3.29Å; P260-V323 HydrophobicContact CB-CG2 3.88Å; P260-V323 HydrophobicContact CG-CG2 3.94Å; P260-V333 HydrophobicContact CG-CG1 3.84Å; P260-Y335 HydrophobicContact CG-CE1 3.88Å; P260-F338 HydrophobicContact CB-CD2 3.89Å; P260-F338 HydrophobicContact CB-CE2 3.73Å; P260-F338 HydrophobicContact CG-CD2 3.83Å; P260-F338 HydrophobicContact CG-CE2 3.96Å
261	I	96.8	Very high	95	Very high	46 Å²	46	55.7 Å²	55.7	24%	0.236	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	135.3	178.6	-62.4	175.5	0	0	0	108.3	R207 V208 I255 F256 L257 T259 I263	R207-I261 WeakPolarHBondContact CA-O 3.41Å; R207-I261 WeakPolarHBondContact CG-O 3.42Å; V208-I261 HydrophobicContact CG2-CB 4.31Å; V208-I261 PolarHBondContact N-O 3.29Å; V208-I261 PolarHBondContact O-N 3.11Å; I255-I261 HydrophobicContact CB-CD1 4.03Å; F256-I261 WeakPolarHBondContact O-CD1 2.99Å; L257-I261 HydrophobicContact CD1-CB 4.36Å; L257-I261 HydrophobicContact CD1-CD1 4.15Å; L257-I261 HydrophobicContact CD1-CG1 4.13Å; T259-I261 WeakPolarHBondContact O-CG1 3.47Å; T259-I261 PolarHBondContact O-N 3.22Å; I261-I263 HydrophobicContact CG2-CD1 4.02Å
262	T	97.4	Very high	95.2	Very high	29 Å²	29	57.4 Å²	57.4	18%	0.178	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	111.7	168.7	-63.7	0	0	0	0	108.2	M205 W206 F320	M205-T262 HydrophobicContact CB-CG2 3.78Å; M205-T262 HydrophobicContact CG-CG2 4.13Å; M205-T262 HydrophobicContact SD-CG2 4.2Å; W206-T262 CarbonylContact O-C 3.49Å; W206-T262 WeakPolarHBondContact O-CA 3.32Å; T262-F320 HydrophobicContact CG2-CD2 4.01Å; T262-F320 HydrophobicContact CG2-CE2 4.33Å
263	I	97.7	Very high	95.3	Very high	9 Å²	9	53.3 Å²	53.3	5%	0.046	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	141.2	172.7	-50.3	-53.6	0	0	0	108.2	M205 W206 V208 V221 V246 I255 I261	M205-I263 VanDerWaalsContact CA-O 3.23Å; M205-I263 WeakPolarHBondContact CA-O 3.23Å; W206-I263 HydrophobicContact CD2-CB 4.07Å; W206-I263 HydrophobicContact CD2-CG2 4.4Å; W206-I263 HydrophobicContact CG-CB 4.42Å; W206-I263 HydrophobicContact CH2-CG2 3.84Å; W206-I263 HydrophobicContact CZ2-CB 3.9Å; W206-I263 HydrophobicContact CZ2-CG2 3.37Å; W206-I263 PolarHBondContact N-O 2.88Å; W206-I263 PolarHBondContact O-N 3.25Å; V208-I263 HydrophobicContact CG1-CG1 4.18Å; V208-I263 HydrophobicContact CG2-CD1 3.85Å; V208-I263 HydrophobicContact CG2-CG1 3.97Å; V221-I263 HydrophobicContact CG1-CD1 3.95Å; V221-I263 HydrophobicContact CG1-CG1 4.22Å; V221-I263 HydrophobicContact CG2-CD1 4.01Å; V221-I263 HydrophobicContact CG2-CG1 4.42Å; V221-I263 HydrophobicContact CG2-CG2 3.98Å; V246-I263 HydrophobicContact CB-CG2 4.26Å; V246-I263 HydrophobicContact CG1-CG2 3.91Å; I255-I263 HydrophobicContact CD1-CD1 4.24Å; I255-I263 HydrophobicContact CG2-CD1 4.28Å; I261-I263 HydrophobicContact CG2-CD1 4.02Å
264	V	97.1	Very high	95.3	Very high	38 Å²	38	54.5 Å²	54.5	23%	0.23	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	128.7	-173.9	-171.3	0	0	0	0	108	C203 M205	C203-V264 HydrophobicContact CB-CG1 3.59Å; M205-V264 HydrophobicContact CG-CG1 4.3Å; M205-V264 HydrophobicContact CG-CG2 4.25Å
265	H	97.3	Very high	95.2	Very high	3 Å²	3	50.8 Å²	50.8	1%	0.014	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	120.3	164.7	165.7	64	0	0	0	107.7	C203 L204 W206 I244 D245 S271 F273	C203-H265 CarbonylContact C-O 3.55Å; C203-H265 WeakPolarHBondContact CA-O 3.39Å; C203-H265 WeakPolarHBondContact CB-O 3.3Å; L204-H265 HydrophobicContact CB-CB 4.26Å; L204-H265 PolarHBondContact N-O 3.25Å; L204-H265 PolarHBondContact O-N 3.11Å; W206-H265 HydrophobicContact CZ3-CB 4.4Å; I244-H265 HydrophobicContact CG2-CB 3.82Å; I244-H265 WeakPolarHBondContact CG2-ND1 3.32Å; D245-H265 PolarHBondContact O-ND1 2.95Å; H265-S271 PolarHBondContact CE1-OG 2.95Å; H265-S271 WeakPolarHBondContact NE2-CB 3.25Å; H265-S271 PolarHBondContact NE2-OG 2.92Å; H265-F273 AromaticContact NE2-CD2 3.93Å
266	D	95.8	Very high	95.1	Very high	56 Å²	56	51 Å²	51	30%	0.299	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	121.7	174.4	-79.3	1.8	0	0	0	109.1	K201 C203 N268	K201-D266 VanDerWaalsContact CD-OD2 3.26Å; K201-D266 WeakPolarHBondContact CD-OD2 3.46Å; K201-D266 IonicContact NZ-OD2 3.97Å; K201-D266 PolarHBondContact NZ-OD2 3.35Å; C203-D266 PolarHBondContact SG-OD1 3.5Å; D266-N268 VanDerWaalsContact C-N 3.33Å; D266-N268 PolarHBondContact O-N 3.07Å
267	I	96.3	Very high	95.1	Very high	17 Å²	17	44.4 Å²	44.4	9%	0.087	24%	0.24	C	C	.	.			trans	-82.5	85.6	176.9	-54.1	176.3	0	0	0	108	V195 L202 L204 F273 A352	V195-I267 HydrophobicContact CG1-CD1 4.32Å; L202-I267 HydrophobicContact CD2-CD1 4.15Å; L202-I267 HydrophobicContact CG-CD1 4.16Å; L202-I267 WeakPolarHBondContact O-CB 3.34Å; L202-I267 PolarHBondContact O-N 2.99Å; L204-I267 HydrophobicContact CB-CD1 4.43Å; I267-F273 HydrophobicContact CD1-CB 4.22Å; I267-F273 HydrophobicContact CG1-CB 4.39Å; I267-F273 HydrophobicContact CG2-CB 3.94Å; I267-A352 HydrophobicContact CB-CB 4.17Å; I267-A352 HydrophobicContact CG2-CB 3.57Å; I267-A352 WeakPolarHBondContact O-CB 3.46Å
268	N	93.4	Very high	95	Very high	65 Å²	65	47.5 Å²	47.5	35%	0.348	25%	0.254	S	S	.	.			trans	-101	-173.8	176.5	65.2	0	0	0	0	111.5	D266 D270 S271 Y274	D266-N268 VanDerWaalsContact C-N 3.33Å; D266-N268 PolarHBondContact O-N 3.07Å; N268-D270 VanDerWaalsContact C-N 3.25Å; N268-D270 PolarHBondContact O-N 3.3Å; N268-D270 PolarHBondContact OD1-N 3.1Å; N268-S271 VanDerWaalsContact O-CB 3.23Å; N268-S271 WeakPolarHBondContact O-CB 3.3Å; N268-S271 PolarHBondContact O-N 3.47Å; N268-S271 VanDerWaalsContact O-N 3.08Å; N268-S271 PolarHBondContact OD1-N 3.08Å; N268-S271 VanDerWaalsContact OD1-N 3.08Å; N268-Y274 VanDerWaalsContact O-CB 3.31Å; N268-Y274 WeakPolarHBondContact O-CB 3.4Å; N268-Y274 WeakPolarHBondContact O-CD2 3.1Å
269	E	94.1	Very high	95	Very high	148 Å²	148	51 Å²	51	69%	0.692	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-32.4	-178.7	-68.7	176.3	-169.7	0	0	113.6	S271 Y274	E269-S271 VanDerWaalsContact C-N 3.32Å; E269-Y274 HydrophobicContact CB-CE1 4.37Å; E269-Y274 HydrophobicContact CG-CE1 3.86Å; E269-Y274 HydrophobicContact CG-CE2 3.98Å
270	D	93	Very high	95	Very high	146 Å²	146	52.6 Å²	52.6	78%	0.781	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-12.5	178.9	-55.9	-52.9	0	0	0	112.8	N268	N268-D270 VanDerWaalsContact C-N 3.25Å; N268-D270 PolarHBondContact O-N 3.3Å; N268-D270 PolarHBondContact OD1-N 3.1Å
271	S	94.9	Very high	94.7	Very high	8 Å²	8	52.3 Å²	52.3	6%	0.056	27%	0.27	C	S	.	.	S	Bend	trans	-71.6	137.8	-178.8	177	0	0	0	0	111.7	H265 N268 E269 F273 Y274	H265-S271 PolarHBondContact CE1-OG 2.95Å; H265-S271 WeakPolarHBondContact NE2-CB 3.25Å; H265-S271 PolarHBondContact NE2-OG 2.92Å; N268-S271 VanDerWaalsContact O-CB 3.23Å; N268-S271 WeakPolarHBondContact O-CB 3.3Å; N268-S271 PolarHBondContact O-N 3.47Å; N268-S271 VanDerWaalsContact O-N 3.08Å; N268-S271 PolarHBondContact OD1-N 3.08Å; N268-S271 VanDerWaalsContact OD1-N 3.08Å; E269-S271 VanDerWaalsContact C-N 3.32Å; S271-F273 PolarHBondContact O-N 3.48Å; S271-F273 PolarHBondContact OG-N 3.48Å; S271-F273 VanDerWaalsContact OG-N 3.15Å; S271-Y274 WeakPolarHBondContact O-CB 3.49Å; S271-Y274 PolarHBondContact O-N 3.29Å
272	P	93.8	Very high	94.4	Very high	49 Å²	49	55.6 Å²	55.6	32%	0.318	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-13.4	172.8	28.7	-35.6	0	0	0	113	L225 I244	L225-P272 HydrophobicContact CD2-CB 3.61Å; L225-P272 HydrophobicContact CD2-CG 3.9Å; I244-P272 HydrophobicContact CG1-CG 4.36Å
273	F	94.9	Very high	94.1	Very high	11 Å²	11	60.9 Å²	60.9	5%	0.048	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	3.4	177.8	-54.1	-71	0	0	0	113.6	L204 L225 I244 H265 I267 S271 N275 M276 F286 I288	L204-F273 HydrophobicContact CD2-CE2 4.07Å; L225-F273 HydrophobicContact CB-CZ 4.42Å; L225-F273 HydrophobicContact CD1-CE1 4Å; L225-F273 HydrophobicContact CD1-CZ 3.87Å; L225-F273 HydrophobicContact CD2-CE1 4.18Å; L225-F273 HydrophobicContact CD2-CZ 4.14Å; L225-F273 HydrophobicContact CG-CZ 4.38Å; I244-F273 HydrophobicContact CD1-CE2 3.68Å; I244-F273 HydrophobicContact CD1-CZ 3.97Å; I244-F273 HydrophobicContact CG1-CE2 3.98Å; H265-F273 AromaticContact NE2-CD2 3.93Å; I267-F273 HydrophobicContact CD1-CB 4.22Å; I267-F273 HydrophobicContact CG1-CB 4.39Å; I267-F273 HydrophobicContact CG2-CB 3.94Å; S271-F273 PolarHBondContact O-N 3.48Å; S271-F273 PolarHBondContact OG-N 3.48Å; S271-F273 VanDerWaalsContact OG-N 3.15Å; F273-N275 VanDerWaalsContact C-N 3.3Å; F273-N275 PolarHBondContact O-N 3.29Å; F273-M276 HydrophobicContact CB-CB 4.48Å; F273-M276 HydrophobicContact CD1-CE 3.73Å; F273-M276 HydrophobicContact CD1-SD 3.82Å; F273-M276 HydrophobicContact CE1-CE 4.28Å; F273-M276 HydrophobicContact CE1-SD 4.48Å; F273-M276 VanDerWaalsContact O-CB 3.3Å; F273-M276 WeakPolarHBondContact O-CB 3.48Å; F273-M276 PolarHBondContact O-N 3.48Å; F273-F286 HydrophobicContact CD1-CZ 4.4Å; F273-F286 HydrophobicContact CE1-CD2 4.41Å; F273-F286 HydrophobicContact CE1-CE1 4.31Å; F273-F286 AromaticContact CE1-CE2 3.8Å; F273-F286 HydrophobicContact CE1-CE2 3.8Å; F273-F286 AromaticContact CE1-CZ 3.73Å; F273-F286 HydrophobicContact CE1-CZ 3.73Å; F273-F286 HydrophobicContact CZ-CE2 4.37Å; F273-I288 HydrophobicContact CE1-CD1 4.09Å; F273-I288 HydrophobicContact CE2-CD1 4.11Å; F273-I288 HydrophobicContact CZ-CD1 3.41Å; F273-I288 VanDerWaalsContact CZ-CD1 3.41Å; F273-I288 HydrophobicContact CZ-CG1 3.9Å
274	Y	94.9	Very high	93.7	Very high	33 Å²	33	61.5 Å²	61.5	13%	0.129	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-41.9	-172.3	-172.5	-126.4	0	0	0	114.2	N268 E269 S271 M276 A352 R353 A356	N268-Y274 VanDerWaalsContact O-CB 3.31Å; N268-Y274 WeakPolarHBondContact O-CB 3.4Å; N268-Y274 WeakPolarHBondContact O-CD2 3.1Å; E269-Y274 HydrophobicContact CB-CE1 4.37Å; E269-Y274 HydrophobicContact CG-CE1 3.86Å; E269-Y274 HydrophobicContact CG-CE2 3.98Å; S271-Y274 WeakPolarHBondContact O-CB 3.49Å; S271-Y274 PolarHBondContact O-N 3.29Å; Y274-M276 VanDerWaalsContact C-N 3.34Å; Y274-A352 HydrophobicContact CD2-CB 3.82Å; Y274-A352 HydrophobicContact CE2-CB 4.14Å; Y274-A352 PolarHBondContact O-N 3.15Å; Y274-R353 HydrophobicContact CD1-CB 3.9Å; Y274-R353 HydrophobicContact CD1-CG 4.42Å; Y274-R353 HydrophobicContact CD2-CB 4.46Å; Y274-R353 HydrophobicContact CE1-CB 3.59Å; Y274-R353 HydrophobicContact CE1-CG 3.79Å; Y274-R353 HydrophobicContact CE2-CB 4.17Å; Y274-R353 HydrophobicContact CG-CB 4.33Å; Y274-R353 PolarHBondContact O-N 3.02Å; Y274-A356 WeakPolarHBondContact OH-CB 3Å
275	N	93.4	Very high	93.4	Very high	96 Å²	96	65.1 Å²	65.1	51%	0.513	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	5.8	-179.9	-62.1	-58.6	0	0	0	113.6	F273 R353	F273-N275 VanDerWaalsContact C-N 3.3Å; F273-N275 PolarHBondContact O-N 3.29Å; N275-R353 WeakPolarHBondContact OD1-CD 3.49Å; N275-R353 PolarHBondContact OD1-NH1 2.6Å
276	M	93.3	Very high	93.2	Very high	30 Å²	30	65.2 Å²	65.2	15%	0.148	34%	0.335	C	S	.	.			trans	-92.9	121.2	-171	-166.4	171.3	-63.7	0	0	111.8	F273 Y274 D280 L281 F286 W316 S351	F273-M276 HydrophobicContact CB-CB 4.48Å; F273-M276 HydrophobicContact CD1-CE 3.73Å; F273-M276 HydrophobicContact CD1-SD 3.82Å; F273-M276 HydrophobicContact CE1-CE 4.28Å; F273-M276 HydrophobicContact CE1-SD 4.48Å; F273-M276 VanDerWaalsContact O-CB 3.3Å; F273-M276 WeakPolarHBondContact O-CB 3.48Å; F273-M276 PolarHBondContact O-N 3.48Å; Y274-M276 VanDerWaalsContact C-N 3.34Å; M276-D280 HydrophobicContact CG-CB 4.01Å; M276-L281 HydrophobicContact SD-CB 4.4Å; M276-L281 HydrophobicContact SD-CD1 4.07Å; M276-F286 HydrophobicContact CE-CD1 4.24Å; M276-F286 HydrophobicContact CE-CE1 3.61Å; M276-F286 HydrophobicContact CE-CZ 4.33Å; M276-F286 HydrophobicContact SD-CE1 3.61Å; M276-F286 HydrophobicContact SD-CZ 3.97Å; M276-W316 WeakPolarHBondContact O-CH2 3.39Å; M276-S351 WeakPolarHBondContact O-CA 3.15Å; M276-S351 WeakPolarHBondContact O-CB 3.27Å
277	S	94.7	Very high	93.2	Very high	17 Å²	17	63.1 Å²	63.1	12%	0.119	32%	0.323	C	S	.	.			trans	-91.9	174.3	171.6	75.9	0	0	0	0	112.4	Q279 D280 L281	S277-Q279 VanDerWaalsContact C-N 3.29Å; S277-Q279 PolarHBondContact O-N 2.98Å; S277-Q279 PolarHBondContact OG-N 3.38Å; S277-D280 VanDerWaalsContact CB-OD2 3.26Å; S277-D280 WeakPolarHBondContact CB-OD2 3.32Å; S277-D280 PolarHBondContact N-OD2 3.45Å; S277-D280 PolarHBondContact O-N 3.39Å; S277-D280 PolarHBondContact OG-N 2.86Å; S277-D280 PolarHBondContact OG-OD2 2.85Å; S277-L281 PolarHBondContact O-N 3.46Å
278	K	93.4	Very high	93.3	Very high	67 Å²	67	62.3 Å²	62.3	29%	0.291	32%	0.32	S	S	.	.	H	α-helix	trans	-57.8	-42.1	173.1	-179.7	178.7	175.5	-179.8	0	112.3	D280 L281 E282 W316 L349	K278-D280 VanDerWaalsContact C-N 3.33Å; K278-L281 PolarHBondContact O-N 3.15Å; K278-E282 VanDerWaalsContact CE-OE1 3.28Å; K278-E282 WeakPolarHBondContact CE-OE1 3.32Å; K278-E282 PolarHBondContact O-N 2.81Å; K278-W316 HydrophobicContact CB-CB 4.44Å; K278-W316 HydrophobicContact CB-CD2 3.73Å; K278-W316 HydrophobicContact CB-CE3 4.19Å; K278-W316 HydrophobicContact CB-CG 3.82Å; K278-W316 HydrophobicContact CB-CZ2 4.5Å; K278-W316 HydrophobicContact CD-CB 4.12Å; K278-W316 HydrophobicContact CD-CG 4.01Å; K278-W316 HydrophobicContact CG-CB 3.88Å; K278-W316 HydrophobicContact CG-CD2 4.17Å; K278-W316 HydrophobicContact CG-CG 3.77Å; K278-L349 HydrophobicContact CD-CD2 3.74Å; K278-L349 PolarHBondContact N-O 2.91Å; K278-L349 VanDerWaalsContact N-O 3.13Å
279	Q	92.8	Very high	93.5	Very high	143 Å²	143	59.5 Å²	59.5	67%	0.668	31%	0.305	S	S	*	.	H	α-helix	trans	-69.3	-35.3	-178.9	-67.3	-179	2.1	0	0	111.4	S277 E282 N283	S277-Q279 VanDerWaalsContact C-N 3.29Å; S277-Q279 PolarHBondContact O-N 2.98Å; S277-Q279 PolarHBondContact OG-N 3.38Å; Q279-E282 PolarHBondContact O-N 3.39Å; Q279-N283 PolarHBondContact O-N 3.13Å; Q279-N283 PolarHBondContact O-ND2 3.35Å
280	D	92.6	Very high	93.6	Very high	80 Å²	80	52.5 Å²	52.5	43%	0.428	27%	0.272	S	S	.	.	H	α-helix	trans	-67.6	-40.9	176.2	-57.5	-45.8	0	0	0	110.8	M276 S277 K278 E282 N283 S284	M276-D280 HydrophobicContact CG-CB 4.01Å; S277-D280 VanDerWaalsContact CB-OD2 3.26Å; S277-D280 WeakPolarHBondContact CB-OD2 3.32Å; S277-D280 PolarHBondContact N-OD2 3.45Å; S277-D280 PolarHBondContact O-N 3.39Å; S277-D280 PolarHBondContact OG-N 2.86Å; S277-D280 PolarHBondContact OG-OD2 2.85Å; K278-D280 VanDerWaalsContact C-N 3.33Å; D280-E282 VanDerWaalsContact C-N 3.33Å; D280-E282 PolarHBondContact O-N 3.37Å; D280-N283 CarbonylContact O-C 3.52Å; D280-N283 PolarHBondContact O-N 2.83Å; D280-N283 VanDerWaalsContact O-N 3.13Å; D280-S284 WeakPolarHBondContact O-CB 3.25Å; D280-S284 PolarHBondContact O-N 3.5Å; D280-S284 PolarHBondContact O-OG 2.99Å
281	L	92.3	Very high	93.8	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.042	24%	0.238	C	C	.	.	H	α-helix	trans	-56.5	-46.8	176.9	-179.6	65.1	0	0	0	111.4	M276 S277 K278 N283 S284 F286 A311 I314 W316	M276-L281 HydrophobicContact SD-CB 4.4Å; M276-L281 HydrophobicContact SD-CD1 4.07Å; S277-L281 PolarHBondContact O-N 3.46Å; K278-L281 PolarHBondContact O-N 3.15Å; L281-N283 PolarHBondContact O-N 2.8Å; L281-S284 WeakPolarHBondContact CA-OG 3.18Å; L281-S284 PolarHBondContact O-N 3.34Å; L281-S284 PolarHBondContact O-OG 3.24Å; L281-F286 HydrophobicContact CD1-CE1 3.95Å; L281-F286 HydrophobicContact CD1-CZ 3.5Å; L281-A311 HydrophobicContact CD1-CB 4.3Å; L281-I314 HydrophobicContact CD1-CB 4.33Å; L281-I314 HydrophobicContact CD1-CD1 4.2Å; L281-I314 HydrophobicContact CD2-CB 4.1Å; L281-I314 HydrophobicContact CD2-CG2 3.89Å; L281-W316 HydrophobicContact CD2-CB 4.47Å; L281-W316 HydrophobicContact CD2-CE3 3.86Å
282	E	90.3	Very high	93.9	Very high	114 Å²	114	46 Å²	46	53%	0.533	24%	0.236	S	C	.	.	H	α-helix	trans	-63.7	-27	179.8	-70.1	173.5	-172.8	0	0	113.3	K278 Q279 D280	K278-E282 VanDerWaalsContact CE-OE1 3.28Å; K278-E282 WeakPolarHBondContact CE-OE1 3.32Å; K278-E282 PolarHBondContact O-N 2.81Å; Q279-E282 PolarHBondContact O-N 3.39Å; D280-E282 VanDerWaalsContact C-N 3.33Å; D280-E282 PolarHBondContact O-N 3.37Å
283	N	90	Very high	94	Very high	140 Å²	140	45.7 Å²	45.7	75%	0.749	23%	0.231	S	C	*	.	H	α-helix	trans	-100.7	-3.4	-179.5	-66.4	-52.4	0	0	0	113.7	Q279 D280 L281	Q279-N283 PolarHBondContact O-N 3.13Å; Q279-N283 PolarHBondContact O-ND2 3.35Å; D280-N283 CarbonylContact O-C 3.52Å; D280-N283 PolarHBondContact O-N 2.83Å; D280-N283 VanDerWaalsContact O-N 3.13Å; L281-N283 PolarHBondContact O-N 2.8Å
284	S	89.2	Confident	93.9	Very high	23 Å²	23	45.4 Å²	45.4	16%	0.161	23%	0.231	C	C	.	.			trans	-86.7	143.6	-172.5	64.3	0	0	0	0	112.9	D280 L281 F286 A311	D280-S284 WeakPolarHBondContact O-CB 3.25Å; D280-S284 PolarHBondContact O-N 3.5Å; D280-S284 PolarHBondContact O-OG 2.99Å; L281-S284 WeakPolarHBondContact CA-OG 3.18Å; L281-S284 PolarHBondContact O-N 3.34Å; L281-S284 PolarHBondContact O-OG 3.24Å; S284-F286 WeakPolarHBondContact OG-CD1 3.39Å; S284-F286 WeakPolarHBondContact OG-CE1 3.47Å; S284-A311 VanDerWaalsContact O-CB 3.31Å; S284-A311 WeakPolarHBondContact O-CB 3.46Å
285	D	91.2	Very high	93.8	Very high	113 Å²	113	45.6 Å²	45.6	60%	0.604	23%	0.233	S	C	*	.			trans	-109.7	96.7	173.4	-170.4	-5.6	0	0	0	108.8	Q40	Q40-D285 PolarHBondContact NE2-OD1 2.9Å
286	F	93.6	Very high	93.7	Very high	5 Å²	5	41.8 Å²	41.8	2%	0.022	21%	0.213	C	C	.	.			trans	-153	166.5	171.4	67.1	-102.8	0	0	0	111.3	L225 K227 F273 M276 L281 S284 I288 A311 I314	L225-F286 HydrophobicContact CD1-CB 3.71Å; L225-F286 HydrophobicContact CD1-CD2 3.38Å; L225-F286 HydrophobicContact CD1-CE2 4.14Å; L225-F286 HydrophobicContact CD1-CG 3.65Å; K227-F286 HydrophobicContact CB-CB 4.22Å; K227-F286 HydrophobicContact CD-CB 4.39Å; K227-F286 HydrophobicContact CG-CB 4.2Å; F273-F286 HydrophobicContact CD1-CZ 4.4Å; F273-F286 HydrophobicContact CE1-CD2 4.41Å; F273-F286 HydrophobicContact CE1-CE1 4.31Å; F273-F286 AromaticContact CE1-CE2 3.8Å; F273-F286 HydrophobicContact CE1-CE2 3.8Å; F273-F286 AromaticContact CE1-CZ 3.73Å; F273-F286 HydrophobicContact CE1-CZ 3.73Å; F273-F286 HydrophobicContact CZ-CE2 4.37Å; M276-F286 HydrophobicContact CE-CD1 4.24Å; M276-F286 HydrophobicContact CE-CE1 3.61Å; M276-F286 HydrophobicContact CE-CZ 4.33Å; M276-F286 HydrophobicContact SD-CE1 3.61Å; M276-F286 HydrophobicContact SD-CZ 3.97Å; L281-F286 HydrophobicContact CD1-CE1 3.95Å; L281-F286 HydrophobicContact CD1-CZ 3.5Å; S284-F286 WeakPolarHBondContact OG-CD1 3.39Å; S284-F286 WeakPolarHBondContact OG-CE1 3.47Å; F286-I288 HydrophobicContact CD2-CG1 4Å; F286-I288 HydrophobicContact CE2-CD1 3.9Å; F286-I288 HydrophobicContact CE2-CG1 3.76Å; F286-A311 HydrophobicContact CE1-CB 4.25Å; F286-A311 HydrophobicContact CZ-CB 4.25Å; F286-A311 PolarHBondContact O-N 2.83Å; F286-I314 HydrophobicContact CE2-CD1 3.66Å; F286-I314 HydrophobicContact CZ-CD1 3.95Å
287	E	96	Very high	93.5	Very high	12 Å²	12	45.1 Å²	45.1	6%	0.056	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	133.5	174.2	178.8	178.1	179.9	0	0	110.4	R42 F43 V44 L226 V289 S308	R42-E287 VanDerWaalsContact CG-CD 3.45Å; R42-E287 WeakPolarHBondContact CG-OE1 3.35Å; R42-E287 WeakPolarHBondContact CG-OE2 3.49Å; F43-E287 WeakPolarHBondContact CB-OE2 3.37Å; F43-E287 PolarHBondContact N-OE2 2.87Å; V44-E287 PolarHBondContact N-OE1 2.93Å; V44-E287 VanDerWaalsContact O-OE1 3.14Å; L226-E287 WeakPolarHBondContact CA-O 3.19Å; L226-E287 HydrophobicContact CB-CB 4.32Å; L226-E287 WeakPolarHBondContact CB-O 3.26Å; L226-E287 PolarHBondContact N-O 3.46Å; L226-E287 PolarHBondContact O-N 3.44Å; E287-V289 HydrophobicContact CG-CG2 4.36Å; E287-S308 WeakPolarHBondContact OE1-CB 3.29Å; E287-S308 PolarHBondContact OE1-OG 3.44Å
288	I	97.1	Very high	93.2	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	117.6	171.7	-58	-178.9	0	0	0	108.1	L204 Q224 L225 I244 F273 F286 V290 S308 Y309 I314	L204-I288 HydrophobicContact CD2-CD1 3.51Å; Q224-I288 CarbonylContact O-C 3.59Å; Q224-I288 WeakPolarHBondContact O-CA 3.17Å; L225-I288 HydrophobicContact CD1-CG1 4.23Å; I244-I288 HydrophobicContact CD1-CD1 4.39Å; I244-I288 HydrophobicContact CD1-CG1 4.3Å; I244-I288 HydrophobicContact CD1-CG2 3.67Å; F273-I288 HydrophobicContact CE1-CD1 4.09Å; F273-I288 HydrophobicContact CE2-CD1 4.11Å; F273-I288 HydrophobicContact CZ-CD1 3.41Å; F273-I288 VanDerWaalsContact CZ-CD1 3.41Å; F273-I288 HydrophobicContact CZ-CG1 3.9Å; F286-I288 HydrophobicContact CD2-CG1 4Å; F286-I288 HydrophobicContact CE2-CD1 3.9Å; F286-I288 HydrophobicContact CE2-CG1 3.76Å; I288-V290 HydrophobicContact CG2-CG1 4.15Å; I288-S308 CarbonylContact O-C 3.54Å; I288-S308 WeakPolarHBondContact O-CA 3.46Å; I288-S308 WeakPolarHBondContact O-CB 3.25Å; I288-Y309 PolarHBondContact N-O 3.36Å; I288-Y309 PolarHBondContact O-N 3Å; I288-I314 HydrophobicContact CD1-CD1 3.59Å; I288-I314 HydrophobicContact CG1-CD1 4.32Å
289	V	97.7	Very high	93	Very high	6 Å²	6	48.7 Å²	48.7	4%	0.036	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	127.8	172.2	176.5	0	0	0	0	109	V44 A223 Q224 L226 E287 I291	V44-V289 HydrophobicContact CB-CG2 4.15Å; V44-V289 HydrophobicContact CG2-CG1 4.1Å; V44-V289 HydrophobicContact CG2-CG2 3.76Å; A223-V289 CarbonylContact C-O 3.56Å; A223-V289 VanDerWaalsContact CA-O 3.31Å; A223-V289 WeakPolarHBondContact CA-O 3.32Å; Q224-V289 PolarHBondContact N-O 3.32Å; Q224-V289 PolarHBondContact O-N 3.21Å; L226-V289 HydrophobicContact CD1-CB 4.42Å; L226-V289 HydrophobicContact CD1-CG2 3.35Å; L226-V289 HydrophobicContact CG-CG2 3.98Å; E287-V289 HydrophobicContact CG-CG2 4.36Å; V289-I291 HydrophobicContact CG1-CG1 4.15Å
290	V	97.7	Very high	92.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	138.7	176.5	-63.2	0	0	0	0	109.8	F189 W206 A223 I288 R306 S307 Y309	F189-V290 HydrophobicContact CD1-CG2 3.6Å; F189-V290 HydrophobicContact CE1-CB 4.2Å; F189-V290 HydrophobicContact CE1-CG2 3.6Å; F189-V290 HydrophobicContact CG-CG2 4.35Å; F189-V290 HydrophobicContact CZ-CG2 4.33Å; W206-V290 HydrophobicContact CD2-CG1 3.89Å; W206-V290 HydrophobicContact CE3-CG1 4.42Å; W206-V290 HydrophobicContact CG-CG1 4.27Å; W206-V290 HydrophobicContact CH2-CG1 4.35Å; W206-V290 HydrophobicContact CZ2-CB 4.47Å; W206-V290 HydrophobicContact CZ2-CG1 3.8Å; A223-V290 HydrophobicContact CB-CG1 4.3Å; I288-V290 HydrophobicContact CG2-CG1 4.15Å; V290-R306 VanDerWaalsContact O-CA 3.31Å; V290-R306 WeakPolarHBondContact O-CA 3.36Å; V290-S307 PolarHBondContact N-O 2.7Å; V290-S307 PolarHBondContact O-N 3.22Å; V290-Y309 HydrophobicContact CB-CE2 4.47Å; V290-Y309 HydrophobicContact CG1-CD2 4.1Å; V290-Y309 HydrophobicContact CG1-CE2 3.88Å; V290-Y309 HydrophobicContact CG2-CD2 4.38Å; V290-Y309 HydrophobicContact CG2-CE2 3.71Å
291	I	97	Very high	92.8	Very high	15 Å²	15	44.7 Å²	44.7	8%	0.077	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	132	-174.1	-49.4	-177	0	0	0	108	V221 R222 V289 E293 Q304 C305 R306	V221-I291 WeakPolarHBondContact CA-O 3.29Å; R222-I291 HydrophobicContact CB-CB 4.29Å; R222-I291 PolarHBondContact N-O 2.95Å; R222-I291 PolarHBondContact O-N 3.18Å; V289-I291 HydrophobicContact CG1-CG1 4.15Å; I291-E293 HydrophobicContact CG2-CG 4.01Å; I291-Q304 HydrophobicContact CG2-CG 3.5Å; I291-Q304 VanDerWaalsContact CG2-CG 3.5Å; I291-C305 WeakPolarHBondContact CA-O 3.37Å; I291-R306 HydrophobicContact CG1-CG 4.18Å; I291-R306 HydrophobicContact CG2-CG 4.19Å
292	L	96.3	Very high	92.8	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	119.9	170.5	173.6	65.4	0	0	0	107.8	L187 F189 L216 V221 I255 L257 Q304 C305	L187-L292 HydrophobicContact CB-CD2 4.35Å; L187-L292 HydrophobicContact CD1-CD2 4.05Å; L187-L292 HydrophobicContact CD2-CD2 4.18Å; L187-L292 HydrophobicContact CG-CD2 4.42Å; F189-L292 HydrophobicContact CE1-CB 4.3Å; F189-L292 HydrophobicContact CZ-CB 3.72Å; L216-L292 HydrophobicContact CD2-CD1 4.18Å; L216-L292 HydrophobicContact CD2-CD2 4.11Å; L216-L292 HydrophobicContact CD2-CG 4.06Å; V221-L292 HydrophobicContact CG1-CD1 3.7Å; I255-L292 HydrophobicContact CD1-CD1 3.98Å; L257-L292 HydrophobicContact CD2-CD2 3.9Å; L292-Q304 WeakPolarHBondContact O-CA 3.45Å; L292-C305 PolarHBondContact N-O 3.02Å; L292-C305 PolarHBondContact O-N 3.3Å
293	E	94.8	Very high	92.8	Very high	43 Å²	43	44.7 Å²	44.7	20%	0.201	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	151.9	177.8	-75	177	-159.1	0	0	110.1	A219 H220 I291 T303 Q304	A219-E293 CarbonylContact C-O 3.58Å; A219-E293 VanDerWaalsContact CA-O 3.23Å; A219-E293 WeakPolarHBondContact CA-O 3.15Å; H220-E293 WeakPolarHBondContact CE1-CB 3.4Å; H220-E293 IonicContact CE1-OE2 3.81Å; H220-E293 PolarHBondContact N-O 3.47Å; H220-E293 WeakPolarHBondContact NE2-CB 3Å; H220-E293 IonicContact NE2-OE2 3.92Å; H220-E293 PolarHBondContact NE2-OE2 3.33Å; H220-E293 PolarHBondContact O-N 3.37Å; I291-E293 HydrophobicContact CG2-CG 4.01Å; E293-T303 WeakPolarHBondContact CA-O 3.32Å; E293-Q304 HydrophobicContact CG-CB 4.01Å; E293-Q304 HydrophobicContact CG-CG 3.68Å; E293-Q304 PolarHBondContact OE1-NE2 3.49Å
294	G	94.3	Very high	93	Very high	5 Å²	5	41.3 Å²	41.3	5%	0.052	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.5	177.7	173.3	0	0	0	0	0	111.9	V217 T302 T303	V217-G294 CarbonylContact O-C 3.43Å; G294-T302 CarbonylContact O-C 3.58Å; G294-T302 WeakPolarHBondContact O-CA 3.38Å; G294-T303 PolarHBondContact N-O 3.05Å; G294-T303 VanDerWaalsContact N-O 3.14Å; G294-T303 PolarHBondContact O-N 3.24Å
295	M	92.8	Very high	93.2	Very high	38 Å²	38	40.7 Å²	40.7	19%	0.187	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	138.4	-178.7	-68.7	-174.4	-69.9	0	0	112.2	V217 E218 E297 M301 T302	V217-M295 HydrophobicContact CB-CB 4.22Å; V217-M295 HydrophobicContact CG1-CE 4.11Å; V217-M295 PolarHBondContact N-O 3.06Å; V217-M295 PolarHBondContact O-N 2.9Å; E218-M295 HydrophobicContact CB-CE 3.94Å; E218-M295 HydrophobicContact CG-CE 3.79Å; E218-M295 WeakPolarHBondContact OE2-CE 3.38Å; M295-E297 PolarHBondContact O-N 3.49Å; M295-M301 WeakPolarHBondContact CA-O 3.37Å; M295-T302 HydrophobicContact CG-CG2 3.77Å
296	V	91.3	Very high	93.4	Very high	15 Å²	15	38.1 Å²	38.1	9%	0.091	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	120.4	173.6	-177	0	0	0	0	109.6	P180 R183 A298 T299 A300 M301 T303	P180-V296 HydrophobicContact CB-CG2 3.64Å; P180-V296 HydrophobicContact CG-CG2 4.41Å; R183-V296 HydrophobicContact CB-CG2 4.17Å; R183-V296 HydrophobicContact CG-CG2 3.8Å; V296-A298 VanDerWaalsContact C-N 3.25Å; V296-A298 PolarHBondContact O-N 3.36Å; V296-A298 VanDerWaalsContact O-N 3.07Å; V296-T299 PolarHBondContact O-N 2.93Å; V296-T299 VanDerWaalsContact O-N 3.07Å; V296-A300 WeakPolarHBondContact O-CA 3.42Å; V296-A300 PolarHBondContact O-N 2.89Å; V296-M301 PolarHBondContact N-O 3.4Å; V296-T303 HydrophobicContact CG2-CG2 4.02Å
297	E	88.6	Confident	93.5	Very high	101 Å²	101	38 Å²	38	47%	0.472	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.9	-42.3	-175.7	-177.3	178.3	-162	0	0	114.5	S214 H215 V217 M295	S214-E297 VanDerWaalsContact CA-OE2 3.27Å; S214-E297 WeakPolarHBondContact CA-OE2 3.41Å; S214-E297 VanDerWaalsContact CB-OE2 3.23Å; S214-E297 WeakPolarHBondContact CB-OE2 3.28Å; H215-E297 IonicContact CD2-OE1 2.69Å; H215-E297 IonicContact CD2-OE2 2.82Å; H215-E297 PolarHBondContact N-OE2 3.32Å; V217-E297 HydrophobicContact CG2-CB 4.33Å; M295-E297 PolarHBondContact O-N 3.49Å
298	A	87.9	Confident	93.6	Very high	96 Å²	96	37.5 Å²	37.5	79%	0.793	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-26.9	-175.8	0	0	0	0	0	114.7	V296	V296-A298 VanDerWaalsContact C-N 3.25Å; V296-A298 PolarHBondContact O-N 3.36Å; V296-A298 VanDerWaalsContact O-N 3.07Å
299	T	88.8	Confident	93.6	Very high	62 Å²	62	37.5 Å²	37.5	38%	0.38	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-9.4	-174.2	60.7	0	0	0	0	113.6	V296 M301	V296-T299 PolarHBondContact O-N 2.93Å; V296-T299 VanDerWaalsContact O-N 3.07Å; T299-M301 PolarHBondContact O-N 3.46Å; T299-M301 PolarHBondContact OG1-N 2.87Å
300	A	90.8	Very high	93.4	Very high	71 Å²	71	37.8 Å²	37.8	59%	0.587	22%	0.222	S	C	*	.			trans	50.8	20.3	-170.6	0	0	0	0	0	113.8	V296	V296-A300 WeakPolarHBondContact O-CA 3.42Å; V296-A300 PolarHBondContact O-N 2.89Å
301	M	90.8	Very high	93.3	Very high	69 Å²	69	37.9 Å²	37.9	34%	0.34	22%	0.223	S	C	.	.			trans	-87.4	136.6	176.8	-66.3	-176.8	73.5	0	0	109.7	A178 K179 P180 M295 V296 T299	A178-M301 HydrophobicContact CB-SD 3.88Å; K179-M301 HydrophobicContact CG-CE 4.5Å; P180-M301 HydrophobicContact CG-CB 4.14Å; M295-M301 WeakPolarHBondContact CA-O 3.37Å; V296-M301 PolarHBondContact N-O 3.4Å; T299-M301 PolarHBondContact O-N 3.46Å; T299-M301 PolarHBondContact OG1-N 2.87Å
302	T	91.9	Very high	93	Very high	113 Å²	113	41.8 Å²	41.8	69%	0.693	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68	141	174.7	53.5	0	0	0	0	110.8	G294 M295	G294-T302 CarbonylContact O-C 3.58Å; G294-T302 WeakPolarHBondContact O-CA 3.38Å; M295-T302 HydrophobicContact CG-CG2 3.77Å
303	T	91.9	Very high	93	Very high	9 Å²	9	43.5 Å²	43.5	6%	0.055	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	140.7	178.6	-160.3	0	0	0	0	108.7	R183 N184 L187 L216 E293 G294 V296	R183-T303 HydrophobicContact CG-CG2 4.26Å; N184-T303 PolarHBondContact OD1-OG1 3.44Å; L187-T303 HydrophobicContact CD1-CG2 4.4Å; L216-T303 HydrophobicContact CD1-CG2 3.81Å; E293-T303 WeakPolarHBondContact CA-O 3.32Å; G294-T303 PolarHBondContact N-O 3.05Å; G294-T303 VanDerWaalsContact N-O 3.14Å; G294-T303 PolarHBondContact O-N 3.24Å; V296-T303 HydrophobicContact CG2-CG2 4.02Å
304	Q	92.6	Very high	93.1	Very high	69 Å²	69	42 Å²	42	32%	0.322	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	117.9	-179.4	-174.6	-170.7	72.2	0	0	108.4	N184 I291 L292 E293 R306	N184-Q304 PolarHBondContact ND2-O 3.41Å; N184-Q304 PolarHBondContact OD1-O 3.4Å; I291-Q304 HydrophobicContact CG2-CG 3.5Å; I291-Q304 VanDerWaalsContact CG2-CG 3.5Å; L292-Q304 WeakPolarHBondContact O-CA 3.45Å; E293-Q304 HydrophobicContact CG-CB 4.01Å; E293-Q304 HydrophobicContact CG-CG 3.68Å; E293-Q304 PolarHBondContact OE1-NE2 3.49Å; Q304-R306 HydrophobicContact CG-CG 4.23Å
305	C	93.9	Very high	93.2	Very high	10 Å²	10	43.9 Å²	43.9	7%	0.068	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	140.7	171.7	-161.8	0	0	0	0	109.3	L187 F189 I291 L292	L187-C305 HydrophobicContact CB-CB 4.12Å; L187-C305 HydrophobicContact CD1-CB 4.07Å; F189-C305 HydrophobicContact CE2-CB 4.09Å; I291-C305 WeakPolarHBondContact CA-O 3.37Å; L292-C305 PolarHBondContact N-O 3.02Å; L292-C305 PolarHBondContact O-N 3.3Å
306	R	95.4	Very high	93.4	Very high	58 Å²	58	43.1 Å²	43.1	22%	0.219	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	150.8	-175.9	-61.3	174.4	-62	-74.9	-14	109.6	V44 G48 V290 I291 Q304	V44-R306 HydrophobicContact CG1-CB 4.3Å; G48-R306 WeakPolarHBondContact CA-O 3.16Å; G48-R306 PolarHBondContact N-O 2.95Å; G48-R306 PolarHBondContact O-NE 3.4Å; G48-R306 PolarHBondContact O-NH2 3.3Å; V290-R306 VanDerWaalsContact O-CA 3.31Å; V290-R306 WeakPolarHBondContact O-CA 3.36Å; I291-R306 HydrophobicContact CG1-CG 4.18Å; I291-R306 HydrophobicContact CG2-CG 4.19Å; Q304-R306 HydrophobicContact CG-CG 4.23Å
307	S	96.4	Very high	93.6	Very high	4 Å²	4	42.8 Å²	42.8	3%	0.028	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	177.5	164.9	-157.5	0	0	0	0	109	K46 V290	K46-S307 PolarHBondContact O-OG 3.07Å; V290-S307 PolarHBondContact N-O 2.7Å; V290-S307 PolarHBondContact O-N 3.22Å
308	S	96.9	Very high	94	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	157	174.7	83.2	0	0	0	0	113.6	R42 V44 K46 E287 I288	R42-S308 WeakPolarHBondContact CD-OG 3.47Å; R42-S308 PolarHBondContact NH1-O 3.25Å; R42-S308 VanDerWaalsContact NH1-O 3.1Å; R42-S308 PolarHBondContact NH1-OG 2.99Å; V44-S308 WeakPolarHBondContact O-CB 3.22Å; V44-S308 PolarHBondContact O-OG 3.47Å; K46-S308 VanDerWaalsContact CD-O 3.29Å; K46-S308 WeakPolarHBondContact CD-O 3.09Å; K46-S308 VanDerWaalsContact CE-O 3.24Å; K46-S308 WeakPolarHBondContact CE-O 3.35Å; K46-S308 PolarHBondContact NZ-O 3.29Å; E287-S308 WeakPolarHBondContact OE1-CB 3.29Å; E287-S308 PolarHBondContact OE1-OG 3.44Å; I288-S308 CarbonylContact O-C 3.54Å; I288-S308 WeakPolarHBondContact O-CA 3.46Å; I288-S308 WeakPolarHBondContact O-CB 3.25Å
309	Y	97	Very high	94.5	Very high	1 Å²	1	40 Å²	40	0%	0.004	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	116.7	175.5	-56.6	-77.6	0	0	0	108.9	S190 H191 N192 A193 W206 I288 V290 E313	S190-Y309 VanDerWaalsContact O-CE1 3.22Å; S190-Y309 WeakPolarHBondContact O-CE1 3.48Å; S190-Y309 PolarHBondContact O-OH 3.26Å; S190-Y309 PolarHBondContact OG-OH 2.92Å; H191-Y309 WeakPolarHBondContact O-CE1 3.29Å; N192-Y309 VanDerWaalsContact C-CE1 3.46Å; A193-Y309 HydrophobicContact CB-CD1 3.97Å; A193-Y309 HydrophobicContact CB-CD2 4.09Å; A193-Y309 HydrophobicContact CB-CE1 4.28Å; A193-Y309 HydrophobicContact CB-CE2 4.36Å; A193-Y309 HydrophobicContact CB-CG 3.89Å; W206-Y309 HydrophobicContact CB-CE2 3.83Å; W206-Y309 HydrophobicContact CG-CE2 4.09Å; I288-Y309 PolarHBondContact N-O 3.36Å; I288-Y309 PolarHBondContact O-N 3Å; V290-Y309 HydrophobicContact CB-CE2 4.47Å; V290-Y309 HydrophobicContact CG1-CD2 4.1Å; V290-Y309 HydrophobicContact CG1-CE2 3.88Å; V290-Y309 HydrophobicContact CG2-CD2 4.38Å; V290-Y309 HydrophobicContact CG2-CE2 3.71Å; Y309-E313 WeakPolarHBondContact CA-OE2 3.48Å
310	V	95.3	Very high	94.9	Very high	13 Å²	13	37.8 Å²	37.8	8%	0.079	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	160.7	165.8	-62.3	0	0	0	0	109.5	R42 N312 E313	R42-V310 HydrophobicContact CG-CG1 4.46Å; V310-N312 HydrophobicContact CG2-CB 4.45Å; V310-N312 PolarHBondContact O-N 3.41Å; V310-N312 VanDerWaalsContact O-N 3.12Å; V310-E313 HydrophobicContact CG2-CB 4.23Å; V310-E313 HydrophobicContact CG2-CG 3.61Å; V310-E313 PolarHBondContact N-OE2 2.96Å; V310-E313 VanDerWaalsContact N-OE2 3.14Å; V310-E313 WeakPolarHBondContact O-CA 3.23Å; V310-E313 WeakPolarHBondContact O-CB 3.45Å; V310-E313 PolarHBondContact O-N 2.92Å
311	A	93.8	Very high	95.2	Very high	2 Å²	2	36.7 Å²	36.7	2%	0.017	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-47.4	-44.5	-179.2	0	0	0	0	0	113.4	L281 S284 F286 E313 I314	L281-A311 HydrophobicContact CD1-CB 4.3Å; S284-A311 VanDerWaalsContact O-CB 3.31Å; S284-A311 WeakPolarHBondContact O-CB 3.46Å; F286-A311 HydrophobicContact CE1-CB 4.25Å; F286-A311 HydrophobicContact CZ-CB 4.25Å; F286-A311 PolarHBondContact O-N 2.83Å; A311-E313 PolarHBondContact O-N 3.46Å; A311-E313 VanDerWaalsContact O-N 3.14Å; A311-I314 WeakPolarHBondContact O-CB 3.42Å; A311-I314 PolarHBondContact O-N 3.48Å
312	N	92.6	Very high	95.5	Very high	96 Å²	96	37.2 Å²	37.2	51%	0.513	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-65.8	-14.2	178.2	-67.2	-12.1	0	0	0	115.2	V310	V310-N312 HydrophobicContact CG2-CB 4.45Å; V310-N312 PolarHBondContact O-N 3.41Å; V310-N312 VanDerWaalsContact O-N 3.12Å
313	E	95.7	Very high	95.7	Very high	39 Å²	39	32.1 Å²	32.1	18%	0.182	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-95.7	-1.3	177.2	-65.7	174.7	151.1	0	0	112.5	R42 K46 N192 A193 Y309 V310 A311	R42-E313 IonicContact CZ-OE1 3.41Å; R42-E313 IonicContact CZ-OE2 2.67Å; R42-E313 IonicContact NH1-OE1 3.4Å; R42-E313 IonicContact NH1-OE2 3.55Å; R42-E313 PolarHBondContact NH1-OE2 3.29Å; R42-E313 IonicContact NH2-OE1 3.44Å; R42-E313 PolarHBondContact NH2-OE1 2.88Å; R42-E313 IonicContact NH2-OE2 2.6Å; R42-E313 PolarHBondContact NH2-OE2 3.04Å; R42-E313 VanDerWaalsContact NH2-OE2 3.11Å; K46-E313 WeakPolarHBondContact CE-OE1 3.29Å; K46-E313 WeakPolarHBondContact CE-OE2 3.46Å; K46-E313 VanDerWaalsContact NZ-CD 3.26Å; K46-E313 IonicContact NZ-OE1 2.99Å; K46-E313 IonicContact NZ-OE2 3.89Å; K46-E313 PolarHBondContact NZ-OE2 3.01Å; N192-E313 VanDerWaalsContact CA-O 3.26Å; N192-E313 WeakPolarHBondContact CA-O 3.26Å; N192-E313 VanDerWaalsContact CB-O 3.28Å; N192-E313 WeakPolarHBondContact CB-O 3.39Å; N192-E313 PolarHBondContact ND2-O 2.85Å; A193-E313 PolarHBondContact N-O 3.39Å; Y309-E313 WeakPolarHBondContact CA-OE2 3.48Å; V310-E313 HydrophobicContact CG2-CB 4.23Å; V310-E313 HydrophobicContact CG2-CG 3.61Å; V310-E313 PolarHBondContact N-OE2 2.96Å; V310-E313 VanDerWaalsContact N-OE2 3.14Å; V310-E313 WeakPolarHBondContact O-CA 3.23Å; V310-E313 WeakPolarHBondContact O-CB 3.45Å; V310-E313 PolarHBondContact O-N 2.92Å; A311-E313 PolarHBondContact O-N 3.46Å; A311-E313 VanDerWaalsContact O-N 3.14Å
314	I	96.9	Very high	95.8	Very high	12 Å²	12	35.2 Å²	35.2	6%	0.062	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	116.8	177.2	-53.6	177	0	0	0	108.4	A193 V195 L204 L281 F286 I288 A311	A193-I314 HydrophobicContact CB-CG1 4.27Å; A193-I314 CarbonylContact O-C 3.55Å; A193-I314 WeakPolarHBondContact O-CA 2.98Å; V195-I314 HydrophobicContact CG2-CG2 3.75Å; L204-I314 HydrophobicContact CD1-CG2 3.95Å; L281-I314 HydrophobicContact CD1-CB 4.33Å; L281-I314 HydrophobicContact CD1-CD1 4.2Å; L281-I314 HydrophobicContact CD2-CB 4.1Å; L281-I314 HydrophobicContact CD2-CG2 3.89Å; F286-I314 HydrophobicContact CE2-CD1 3.66Å; F286-I314 HydrophobicContact CZ-CD1 3.95Å; I288-I314 HydrophobicContact CD1-CD1 3.59Å; I288-I314 HydrophobicContact CG1-CD1 4.32Å; A311-I314 WeakPolarHBondContact O-CB 3.42Å; A311-I314 PolarHBondContact O-N 3.48Å
315	L	96.9	Very high	96	Very high	43 Å²	43	35.8 Å²	35.8	23%	0.225	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	110.6	-176.5	-56.6	177.8	0	0	0	110.3	N192 A193 T194 V195 H318	N192-L315 HydrophobicContact CB-CD1 3.84Å; N192-L315 HydrophobicContact CB-CG 4.04Å; A193-L315 PolarHBondContact O-N 3.42Å; T194-L315 CarbonylContact C-O 3.48Å; T194-L315 VanDerWaalsContact CA-O 3.29Å; T194-L315 WeakPolarHBondContact CA-O 3.08Å; T194-L315 HydrophobicContact CG2-CB 4.42Å; V195-L315 PolarHBondContact N-O 3.15Å; L315-H318 HydrophobicContact CB-CB 3.84Å
316	W	96.6	Very high	96	Very high	22 Å²	22	42.4 Å²	42.4	8%	0.083	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	132	176.3	-165.9	-73.1	0	0	0	111.8	V195 L202 M276 K278 L281 H318 P348	V195-W316 HydrophobicContact CB-CD2 4.26Å; V195-W316 HydrophobicContact CB-CE3 4.07Å; V195-W316 HydrophobicContact CG1-CD2 4.08Å; V195-W316 HydrophobicContact CG1-CE3 3.92Å; V195-W316 HydrophobicContact CG1-CH2 4.21Å; V195-W316 HydrophobicContact CG1-CZ2 4.34Å; V195-W316 HydrophobicContact CG1-CZ3 3.99Å; V195-W316 HydrophobicContact CG2-CE3 4.37Å; L202-W316 HydrophobicContact CD1-CZ2 4.39Å; L202-W316 HydrophobicContact CD2-CH2 3.79Å; L202-W316 HydrophobicContact CD2-CZ2 3.92Å; M276-W316 WeakPolarHBondContact O-CH2 3.39Å; K278-W316 HydrophobicContact CB-CB 4.44Å; K278-W316 HydrophobicContact CB-CD2 3.73Å; K278-W316 HydrophobicContact CB-CE3 4.19Å; K278-W316 HydrophobicContact CB-CG 3.82Å; K278-W316 HydrophobicContact CB-CZ2 4.5Å; K278-W316 HydrophobicContact CD-CB 4.12Å; K278-W316 HydrophobicContact CD-CG 4.01Å; K278-W316 HydrophobicContact CG-CB 3.88Å; K278-W316 HydrophobicContact CG-CD2 4.17Å; K278-W316 HydrophobicContact CG-CG 3.77Å; L281-W316 HydrophobicContact CD2-CB 4.47Å; L281-W316 HydrophobicContact CD2-CE3 3.86Å; W316-H318 PolarHBondContact O-CD2 3.43Å; W316-P348 PolarHBondContact NE1-O 3.42Å
317	G	95.8	Very high	95.9	Very high	9 Å²	9	43 Å²	43	9%	0.093	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	23.2	-179.6	0	0	0	0	0	113.7	V195 E343 V344 T347	V195-G317 WeakPolarHBondContact O-CA 3.24Å; V195-G317 PolarHBondContact O-N 3.08Å; G317-E343 CarbonylContact O-C 3.54Å; G317-V344 PolarHBondContact O-N 2.97Å; G317-T347 WeakPolarHBondContact CA-OG1 3.45Å
318	H	97.1	Very high	95.7	Very high	32 Å²	32	52.8 Å²	52.8	15%	0.148	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	153.6	176.5	-78.6	-122.4	0	0	0	111.4	T194 A196 L315 W316 T341 Y342 E343	T194-H318 WeakPolarHBondContact CB-O 3.21Å; T194-H318 HydrophobicContact CG2-CB 3.81Å; A196-H318 VanDerWaalsContact CB-O 3.23Å; A196-H318 WeakPolarHBondContact CB-O 3.38Å; L315-H318 HydrophobicContact CB-CB 3.84Å; W316-H318 PolarHBondContact O-CD2 3.43Å; H318-T341 PolarHBondContact ND1-OG1 2.85Å; H318-T341 VanDerWaalsContact ND1-OG1 3.07Å; H318-Y342 CarbonylContact C-O 3.55Å; H318-Y342 WeakPolarHBondContact CA-O 3.34Å; H318-E343 VanDerWaalsContact CE1-CG 3.43Å; H318-E343 WeakPolarHBondContact CE1-CG 3.47Å; H318-E343 IonicContact CE1-OE1 3.11Å; H318-E343 VanDerWaalsContact NE2-CG 3.31Å; H318-E343 WeakPolarHBondContact NE2-CG 3.46Å; H318-E343 IonicContact NE2-OE1 3.63Å
319	R	96.9	Very high	95.5	Very high	106 Å²	106	60.4 Å²	60.4	40%	0.4	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	150.8	168.5	-72.1	175.9	71.2	-176.8	-1.6	110.3	A196 T341 Y342 V344	A196-R319 HydrophobicContact CB-CG 3.83Å; R319-T341 CarbonylContact O-C 3.49Å; R319-T341 WeakPolarHBondContact O-CA 3.32Å; R319-T341 WeakPolarHBondContact O-CB 3.25Å; R319-Y342 HydrophobicContact CB-CE1 3.9Å; R319-Y342 HydrophobicContact CB-CE2 3.97Å; R319-Y342 PolarHBondContact N-O 3.18Å; R319-Y342 PolarHBondContact NE-OH 3.14Å; R319-Y342 WeakPolarHBondContact O-CD1 3.23Å; R319-Y342 PolarHBondContact O-N 3.38Å; R319-V344 HydrophobicContact CB-CG2 4.15Å; R319-V344 HydrophobicContact CG-CG2 3.75Å
320	F	97.8	Very high	95.3	Very high	16 Å²	16	66.5 Å²	66.5	7%	0.07	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	140.2	174.6	-70.2	-72.7	0	0	0	112	S190 N192 T194 M205 R207 T262 T341 Y342	S190-F320 WeakPolarHBondContact OG-CZ 3.47Å; N192-F320 WeakPolarHBondContact O-CZ 3.22Å; T194-F320 HydrophobicContact CG2-CE1 4.39Å; T194-F320 HydrophobicContact CG2-CE2 4.06Å; T194-F320 HydrophobicContact CG2-CZ 3.99Å; T194-F320 WeakPolarHBondContact OG1-CE2 3.29Å; M205-F320 HydrophobicContact CB-CE2 4.31Å; R207-F320 HydrophobicContact CB-CE1 4.38Å; R207-F320 HydrophobicContact CB-CE2 4.46Å; R207-F320 HydrophobicContact CB-CZ 4.33Å; T262-F320 HydrophobicContact CG2-CD2 4.01Å; T262-F320 HydrophobicContact CG2-CE2 4.33Å; F320-T341 HydrophobicContact CD1-CG2 3.73Å; F320-T341 HydrophobicContact CE1-CG2 3.83Å; F320-T341 HydrophobicContact CG-CG2 4.46Å; F320-Y342 WeakPolarHBondContact O-CE1 3.23Å
321	E	97.1	Very high	95.3	Very high	48 Å²	48	73.1 Å²	73.1	22%	0.224	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-62.3	142.3	169.5	-75.2	-172.1	-170.8	0	0	110.9	R207 V323 R337 K340 Y342	R207-E321 VanDerWaalsContact CZ-O 3.31Å; R207-E321 PolarHBondContact NH1-O 3.23Å; R207-E321 PolarHBondContact NH2-O 2.89Å; E321-V323 PolarHBondContact O-N 3.24Å; E321-R337 HydrophobicContact CB-CB 4.29Å; E321-R337 WeakPolarHBondContact OE2-CD 3.06Å; E321-R337 WeakPolarHBondContact OE2-CG 3.49Å; E321-K340 HydrophobicContact CB-CB 4.34Å; E321-K340 HydrophobicContact CG-CB 4Å; E321-K340 PolarHBondContact N-O 2.86Å; E321-Y342 HydrophobicContact CG-CD1 4.05Å
322	P	96.3	Very high	95.3	Very high	80 Å²	80	78.1 Å²	78.1	52%	0.519	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-59.8	134	168.7	-21.3	33.1	0	0	0	110.8	F325	P322-F325 VanDerWaalsContact O-CZ 3.3Å; P322-F325 WeakPolarHBondContact O-CZ 3.45Å
323	V	96	Very high	95.4	Very high	5 Å²	5	75.7 Å²	75.7	3%	0.03	35%	0.353	C	S	.	.			trans	-112	-19.1	179.1	-67.1	0	0	0	0	112.8	R207 P260 E321 V333 D334 R337	R207-V323 VanDerWaalsContact NH1-CG1 3.3Å; P260-V323 HydrophobicContact CB-CG2 3.88Å; P260-V323 HydrophobicContact CG-CG2 3.94Å; E321-V323 PolarHBondContact O-N 3.24Å; V323-V333 HydrophobicContact CB-CG1 4.31Å; V323-V333 HydrophobicContact CG2-CG1 4.33Å; V323-V333 CarbonylContact O-C 3.46Å; V323-V333 VanDerWaalsContact O-CA 3.29Å; V323-V333 WeakPolarHBondContact O-CA 3.5Å; V323-D334 PolarHBondContact O-N 3.27Å; V323-R337 HydrophobicContact CG1-CB 4.08Å
324	L	95.5	Very high	95.4	Very high	75 Å²	75	76.1 Å²	76.1	39%	0.393	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	125.3	-177.7	-175.1	67.1	0	0	0	109.1	T259 Y331 V333	T259-L324 HydrophobicContact CG2-CD1 3.75Å; T259-L324 HydrophobicContact CG2-CD2 4.46Å; L324-Y331 HydrophobicContact CD1-CD1 4.43Å; L324-Y331 HydrophobicContact CD1-CG 4.42Å; L324-Y331 HydrophobicContact CG-CD1 4.47Å; L324-V333 HydrophobicContact CD1-CG2 3.76Å
325	F	95.2	Very high	95.3	Very high	80 Å²	80	79 Å²	79	35%	0.351	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	140.1	177.2	-54.6	-77.6	0	0	0	109.5	P322 K332 D334	P322-F325 VanDerWaalsContact O-CZ 3.3Å; P322-F325 WeakPolarHBondContact O-CZ 3.45Å; F325-K332 PolarHBondContact N-O 2.96Å; F325-K332 PolarHBondContact O-N 3.33Å; F325-D334 HydrophobicContact CD2-CB 4.49Å; F325-D334 HydrophobicContact CE2-CB 4.04Å
326	E	95.3	Very high	95.2	Very high	150 Å²	150	80.7 Å²	80.7	70%	0.701	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	126.5	175	-173.6	172.9	-159.3	0	0	109.8	Y331	E326-Y331 HydrophobicContact CB-CD1 4.1Å; E326-Y331 HydrophobicContact CB-CE1 3.95Å; E326-Y331 HydrophobicContact CG-CD1 4.31Å; E326-Y331 HydrophobicContact CG-CE1 3.88Å
327	E	93.3	Very high	95.2	Very high	71 Å²	71	84.1 Å²	84.1	33%	0.332	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	165.1	163.6	-69.3	-168.2	-166.1	0	0	108.9	N329 Y330 K332	E327-N329 PolarHBondContact O-N 3.08Å; E327-Y330 CarbonylContact C-O 3.55Å; E327-Y330 WeakPolarHBondContact CA-O 3.3Å; E327-Y330 HydrophobicContact CB-CD1 4.42Å; E327-Y330 HydrophobicContact CB-CE1 4.13Å; E327-Y330 PolarHBondContact N-O 3.27Å; E327-Y330 PolarHBondContact O-N 2.97Å; E327-Y330 VanDerWaalsContact O-O 3.05Å; E327-Y330 WeakPolarHBondContact OE2-CE1 3.31Å; E327-Y330 PolarHBondContact OE2-OH 2.93Å; E327-K332 WeakPolarHBondContact OE1-CD 3.44Å; E327-K332 IonicContact OE1-NZ 3.23Å; E327-K332 PolarHBondContact OE1-NZ 2.82Å
328	K	91.5	Very high	95.2	Very high	208 Å²	208	83.8 Å²	83.8	90%	0.904	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.2	-36.5	-166.5	-67.1	-178	178.4	179.7	0	116.1
329	N	93.5	Very high	95.2	Very high	160 Å²	160	85.5 Å²	85.5	86%	0.856	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.2	2	-176.4	-66.6	-16.2	0	0	0	114	E327	E327-N329 PolarHBondContact O-N 3.08Å
330	Y	92.8	Very high	95.3	Very high	129 Å²	129	85.4 Å²	85.4	51%	0.506	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	160.8	-175.6	69	-82.4	0	0	0	111.8	E327 K332	E327-Y330 CarbonylContact C-O 3.55Å; E327-Y330 WeakPolarHBondContact CA-O 3.3Å; E327-Y330 HydrophobicContact CB-CD1 4.42Å; E327-Y330 HydrophobicContact CB-CE1 4.13Å; E327-Y330 PolarHBondContact N-O 3.27Å; E327-Y330 PolarHBondContact O-N 2.97Å; E327-Y330 VanDerWaalsContact O-O 3.05Å; E327-Y330 WeakPolarHBondContact OE2-CE1 3.31Å; E327-Y330 PolarHBondContact OE2-OH 2.93Å; Y330-K332 HydrophobicContact CE2-CB 4.32Å
331	Y	94.6	Very high	95.2	Very high	152 Å²	152	86.3 Å²	86.3	60%	0.596	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	140	174.9	-62.2	-81.3	0	0	0	111.8	L324 E326	L324-Y331 HydrophobicContact CD1-CD1 4.43Å; L324-Y331 HydrophobicContact CD1-CG 4.42Å; L324-Y331 HydrophobicContact CG-CD1 4.47Å; E326-Y331 HydrophobicContact CB-CD1 4.1Å; E326-Y331 HydrophobicContact CB-CE1 3.95Å; E326-Y331 HydrophobicContact CG-CD1 4.31Å; E326-Y331 HydrophobicContact CG-CE1 3.88Å
332	K	94	Very high	95.2	Very high	107 Å²	107	88.2 Å²	88.2	47%	0.465	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	135.3	178.8	-172.8	173.4	-179.7	178.5	0	110.8	F325 E327 Y330	F325-K332 PolarHBondContact N-O 2.96Å; F325-K332 PolarHBondContact O-N 3.33Å; E327-K332 WeakPolarHBondContact OE1-CD 3.44Å; E327-K332 IonicContact OE1-NZ 3.23Å; E327-K332 PolarHBondContact OE1-NZ 2.82Å; Y330-K332 HydrophobicContact CE2-CB 4.32Å
333	V	95.4	Very high	95.2	Very high	45 Å²	45	90.9 Å²	90.9	27%	0.273	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	120	177.8	-177.4	0	0	0	0	109.9	T259 P260 V323 L324 Y335	T259-V333 HydrophobicContact CG2-CG2 3.91Å; P260-V333 HydrophobicContact CG-CG1 3.84Å; V323-V333 HydrophobicContact CB-CG1 4.31Å; V323-V333 HydrophobicContact CG2-CG1 4.33Å; V323-V333 CarbonylContact O-C 3.46Å; V323-V333 VanDerWaalsContact O-CA 3.29Å; V323-V333 WeakPolarHBondContact O-CA 3.5Å; L324-V333 HydrophobicContact CD1-CG2 3.76Å; V333-Y335 HydrophobicContact CB-CE2 4.42Å; V333-Y335 HydrophobicContact CG1-CD2 3.95Å; V333-Y335 HydrophobicContact CG1-CE2 3.78Å
334	D	95.3	Very high	95.1	Very high	49 Å²	49	92.4 Å²	92.4	26%	0.262	43%	0.429	S	S	.	.			trans	-94.4	95.2	174.5	-175.7	1.8	0	0	0	111	V323 F325 S336 R337	V323-D334 PolarHBondContact O-N 3.27Å; F325-D334 HydrophobicContact CD2-CB 4.49Å; F325-D334 HydrophobicContact CE2-CB 4.04Å; D334-S336 PolarHBondContact O-N 2.93Å; D334-S336 VanDerWaalsContact OD1-CB 3.24Å; D334-S336 WeakPolarHBondContact OD1-CB 3.39Å; D334-S336 PolarHBondContact OD1-N 3.45Å; D334-S336 PolarHBondContact OD1-OG 3.5Å; D334-S336 PolarHBondContact OD2-OG 2.94Å; D334-R337 PolarHBondContact O-N 3.42Å; D334-R337 IonicContact OD2-CZ 3.9Å; D334-R337 IonicContact OD2-NE 3Å; D334-R337 PolarHBondContact OD2-NE 3.28Å; D334-R337 IonicContact OD2-NH2 3.98Å
335	Y	94.5	Very high	94.7	Very high	73 Å²	73	96.3 Å²	96.3	29%	0.286	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-67.1	-14.1	178.1	-86.8	-81.7	0	0	0	113.7	V188 N210 L211 P260 V333 R337 F338	V188-Y335 HydrophobicContact CG2-CE1 4.46Å; N210-Y335 PolarHBondContact O-OH 2.85Å; L211-Y335 HydrophobicContact CD2-CD1 3.8Å; L211-Y335 HydrophobicContact CD2-CE1 3.66Å; L211-Y335 HydrophobicContact CD2-CE2 4.45Å; L211-Y335 HydrophobicContact CD2-CG 4.29Å; P260-Y335 HydrophobicContact CG-CE1 3.88Å; V333-Y335 HydrophobicContact CB-CE2 4.42Å; V333-Y335 HydrophobicContact CG1-CD2 3.95Å; V333-Y335 HydrophobicContact CG1-CE2 3.78Å; Y335-R337 PolarHBondContact O-N 3.45Å; Y335-F338 HydrophobicContact CD1-CB 4.04Å; Y335-F338 AromaticContact CD1-CD2 3.8Å; Y335-F338 HydrophobicContact CD1-CD2 3.8Å; Y335-F338 HydrophobicContact CD1-CG 4.07Å; Y335-F338 AromaticContact CE1-CD2 3.72Å; Y335-F338 HydrophobicContact CE1-CD2 3.72Å; Y335-F338 HydrophobicContact CE1-CE2 4.11Å; Y335-F338 HydrophobicContact CE1-CG 4.41Å; Y335-F338 WeakPolarHBondContact O-CB 3.47Å; Y335-F338 PolarHBondContact O-N 3.16Å; Y335-F338 VanDerWaalsContact O-N 3.1Å
336	S	95.2	Very high	94.4	Very high	77 Å²	77	99.7 Å²	99.7	54%	0.538	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-66.2	-22.6	175.2	76.7	0	0	0	0	112.7	D334 K340	D334-S336 PolarHBondContact O-N 2.93Å; D334-S336 VanDerWaalsContact OD1-CB 3.24Å; D334-S336 WeakPolarHBondContact OD1-CB 3.39Å; D334-S336 PolarHBondContact OD1-N 3.45Å; D334-S336 PolarHBondContact OD1-OG 3.5Å; D334-S336 PolarHBondContact OD2-OG 2.94Å; S336-K340 WeakPolarHBondContact O-CE 3.47Å
337	R	95.6	Very high	94.2	Very high	95 Å²	95	92.9 Å²	92.9	36%	0.358	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-96.8	0.2	176.1	-54.7	-178.8	-161.9	-152.7	-0.4	113.1	E321 V323 D334 Y335 H339 K340	E321-R337 HydrophobicContact CB-CB 4.29Å; E321-R337 WeakPolarHBondContact OE2-CD 3.06Å; E321-R337 WeakPolarHBondContact OE2-CG 3.49Å; V323-R337 HydrophobicContact CG1-CB 4.08Å; D334-R337 PolarHBondContact O-N 3.42Å; D334-R337 IonicContact OD2-CZ 3.9Å; D334-R337 IonicContact OD2-NE 3Å; D334-R337 PolarHBondContact OD2-NE 3.28Å; D334-R337 IonicContact OD2-NH2 3.98Å; Y335-R337 PolarHBondContact O-N 3.45Å; R337-H339 VanDerWaalsContact C-N 3.3Å; R337-H339 PolarHBondContact O-N 2.89Å; R337-K340 HydrophobicContact CB-CD 4.49Å; R337-K340 HydrophobicContact CG-CD 4.42Å; R337-K340 PolarHBondContact O-N 3Å
338	F	96.8	Very high	94.1	Very high	1 Å²	1	91.4 Å²	91.4	0%	0.004	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-44.4	-173.1	-180	-88.8	0	0	0	112.7	V188 R207 P260 Y335	V188-F338 HydrophobicContact CG2-CE1 4.07Å; V188-F338 HydrophobicContact CG2-CE2 4.23Å; V188-F338 HydrophobicContact CG2-CZ 3.81Å; R207-F338 HydrophobicContact CB-CZ 4.24Å; R207-F338 HydrophobicContact CG-CD2 4.31Å; R207-F338 HydrophobicContact CG-CE2 3.71Å; R207-F338 HydrophobicContact CG-CZ 3.9Å; R207-F338 PolarHBondContact NH1-O 3.24Å; P260-F338 HydrophobicContact CB-CD2 3.89Å; P260-F338 HydrophobicContact CB-CE2 3.73Å; P260-F338 HydrophobicContact CG-CD2 3.83Å; P260-F338 HydrophobicContact CG-CE2 3.96Å; Y335-F338 HydrophobicContact CD1-CB 4.04Å; Y335-F338 AromaticContact CD1-CD2 3.8Å; Y335-F338 HydrophobicContact CD1-CD2 3.8Å; Y335-F338 HydrophobicContact CD1-CG 4.07Å; Y335-F338 AromaticContact CE1-CD2 3.72Å; Y335-F338 HydrophobicContact CE1-CD2 3.72Å; Y335-F338 HydrophobicContact CE1-CE2 4.11Å; Y335-F338 HydrophobicContact CE1-CG 4.41Å; Y335-F338 WeakPolarHBondContact O-CB 3.47Å; Y335-F338 PolarHBondContact O-N 3.16Å; Y335-F338 VanDerWaalsContact O-N 3.1Å
339	H	97.3	Very high	94.2	Very high	69 Å²	69	86.7 Å²	86.7	32%	0.319	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-7.6	-179.9	-52.9	-80.6	0	0	0	113.6	F189 H191 R337	F189-H339 PolarHBondContact O-CE1 3.35Å; H191-H339 AromaticContact CD2-CD2 3.91Å; H191-H339 AromaticContact CD2-CE1 3.67Å; H191-H339 AromaticContact CD2-CG 3.38Å; H191-H339 AromaticContact CD2-ND1 3.21Å; H191-H339 PolarHBondContact CD2-ND1 2.88Å; H191-H339 AromaticContact CG-ND1 3.64Å; H191-H339 PolarHBondContact N-ND1 3.02Å; H191-H339 AromaticContact NE2-CE1 3.65Å; H191-H339 AromaticContact NE2-CG 3.95Å; H191-H339 AromaticContact NE2-ND1 3.7Å; H191-H339 AromaticContact NE2-NE2 3.88Å; R337-H339 VanDerWaalsContact C-N 3.3Å; R337-H339 PolarHBondContact O-N 2.89Å
340	K	97.4	Very high	94.1	Very high	103 Å²	103	80.3 Å²	80.3	45%	0.448	39%	0.388	S	S	.	.			trans	-76	139.9	-174.4	-67.3	-172.7	-177.1	178.4	0	111	E321 S336 R337	E321-K340 HydrophobicContact CB-CB 4.34Å; E321-K340 HydrophobicContact CG-CB 4Å; E321-K340 PolarHBondContact N-O 2.86Å; S336-K340 WeakPolarHBondContact O-CE 3.47Å; R337-K340 HydrophobicContact CB-CD 4.49Å; R337-K340 HydrophobicContact CG-CD 4.42Å; R337-K340 PolarHBondContact O-N 3Å
341	T	97.6	Very high	94.1	Very high	35 Å²	35	74.3 Å²	74.3	22%	0.215	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	154.4	175.9	66.4	0	0	0	0	109.7	T194 H318 R319 F320	T194-T341 HydrophobicContact CG2-CG2 3.69Å; H318-T341 PolarHBondContact ND1-OG1 2.85Å; H318-T341 VanDerWaalsContact ND1-OG1 3.07Å; R319-T341 CarbonylContact O-C 3.49Å; R319-T341 WeakPolarHBondContact O-CA 3.32Å; R319-T341 WeakPolarHBondContact O-CB 3.25Å; F320-T341 HydrophobicContact CD1-CG2 3.73Å; F320-T341 HydrophobicContact CE1-CG2 3.83Å; F320-T341 HydrophobicContact CG-CG2 4.46Å
342	Y	96.6	Very high	94	Very high	88 Å²	88	67.4 Å²	67.4	35%	0.345	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	149.5	173.7	63.3	-89.3	0	0	0	110.1	H318 R319 F320 E321 V344	H318-Y342 CarbonylContact C-O 3.55Å; H318-Y342 WeakPolarHBondContact CA-O 3.34Å; R319-Y342 HydrophobicContact CB-CE1 3.9Å; R319-Y342 HydrophobicContact CB-CE2 3.97Å; R319-Y342 PolarHBondContact N-O 3.18Å; R319-Y342 PolarHBondContact NE-OH 3.14Å; R319-Y342 WeakPolarHBondContact O-CD1 3.23Å; R319-Y342 PolarHBondContact O-N 3.38Å; F320-Y342 WeakPolarHBondContact O-CE1 3.23Å; E321-Y342 HydrophobicContact CG-CD1 4.05Å; Y342-V344 HydrophobicContact CD2-CG2 4.05Å; Y342-V344 HydrophobicContact CE2-CG2 3.71Å
343	E	95.8	Very high	94	Very high	137 Å²	137	67.6 Å²	67.6	64%	0.64	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	143.1	179.8	-74.2	176.9	-159.7	0	0	111.9	G317 H318	G317-E343 CarbonylContact O-C 3.54Å; H318-E343 VanDerWaalsContact CE1-CG 3.43Å; H318-E343 WeakPolarHBondContact CE1-CG 3.47Å; H318-E343 IonicContact CE1-OE1 3.11Å; H318-E343 VanDerWaalsContact NE2-CG 3.31Å; H318-E343 WeakPolarHBondContact NE2-CG 3.46Å; H318-E343 IonicContact NE2-OE1 3.63Å
344	V	94.3	Very high	93.8	Very high	37 Å²	37	68.3 Å²	68.3	22%	0.224	34%	0.34	C	S	.	.			trans	-126	97.1	177	-176.3	0	0	0	0	108.3	G317 R319 Y342 N346 T347	G317-V344 PolarHBondContact O-N 2.97Å; R319-V344 HydrophobicContact CB-CG2 4.15Å; R319-V344 HydrophobicContact CG-CG2 3.75Å; Y342-V344 HydrophobicContact CD2-CG2 4.05Å; Y342-V344 HydrophobicContact CE2-CG2 3.71Å; V344-N346 PolarHBondContact O-N 3.37Å; V344-N346 VanDerWaalsContact O-N 3.16Å; V344-T347 WeakPolarHBondContact O-CB 3.26Å; V344-T347 PolarHBondContact O-N 3.46Å; V344-T347 VanDerWaalsContact O-N 3.12Å; V344-T347 PolarHBondContact O-OG1 3.3Å
345	L	87.7	Confident	93.5	Very high	156 Å²	156	68.1 Å²	68.1	82%	0.817	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.8	-175.6	-61.7	173.5	0	0	0	113.6	T347	L345-T347 PolarHBondContact O-N 2.91Å
346	N	88	Confident	93.2	Very high	152 Å²	152	66.3 Å²	66.3	81%	0.813	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	1.6	-179.2	-64.4	-9.5	0	0	0	113.4	V344 P348	V344-N346 PolarHBondContact O-N 3.37Å; V344-N346 VanDerWaalsContact O-N 3.16Å; N346-P348 WeakPolarHBondContact O-CD 3.48Å
347	T	91.1	Very high	92.9	Very high	7 Å²	7	66.9 Å²	66.9	4%	0.043	33%	0.333	C	S	.	.	S	Bend	trans	-74.8	123	179.4	-50.4	0	0	0	0	109.7	M197 L202 G317 V344 L345	M197-T347 HydrophobicContact CG-CG2 4.42Å; L202-T347 HydrophobicContact CD1-CG2 4.31Å; G317-T347 WeakPolarHBondContact CA-OG1 3.45Å; V344-T347 WeakPolarHBondContact O-CB 3.26Å; V344-T347 PolarHBondContact O-N 3.46Å; V344-T347 VanDerWaalsContact O-N 3.12Å; V344-T347 PolarHBondContact O-OG1 3.3Å; L345-T347 PolarHBondContact O-N 2.91Å
348	P	92.2	Very high	92.5	Very high	39 Å²	39	68.5 Å²	68.5	25%	0.253	34%	0.343	S	S	.	.			trans	-57.2	141.7	175.6	-26	38	0	0	0	111.4	M197 W316 N346 L355	M197-P348 VanDerWaalsContact CG-CD 3.44Å; M197-P348 HydrophobicContact CG-CG 4.27Å; M197-P348 HydrophobicContact SD-CG 4.29Å; W316-P348 PolarHBondContact NE1-O 3.42Å; N346-P348 WeakPolarHBondContact O-CD 3.48Å; P348-L355 HydrophobicContact CB-CD1 3.77Å; P348-L355 HydrophobicContact CG-CD1 3.54Å
349	L	91.8	Very high	91.9	Very high	109 Å²	109	75.5 Å²	75.5	57%	0.571	37%	0.373	S	S	*	.			trans	-92.3	-12	-179.8	-53.8	-178.4	0	0	0	112.9	K278	K278-L349 HydrophobicContact CD-CD2 3.74Å; K278-L349 PolarHBondContact N-O 2.91Å; K278-L349 VanDerWaalsContact N-O 3.13Å
350	C	92	Very high	91.1	Very high	26 Å²	26	79.9 Å²	79.9	18%	0.176	39%	0.388	C	S	.	.	S	Bend	trans	-81	169.5	178.4	62.7	0	0	0	0	111.7	D354	C350-D354 HydrophobicContact CB-CB 3.82Å
351	S	93.8	Very high	90.3	Very high	3 Å²	3	80 Å²	80	2%	0.021	39%	0.392	C	S	.	.			trans	-68	165	177.6	69.5	0	0	0	0	112.2	M276 R353 D354 L355	M276-S351 WeakPolarHBondContact O-CA 3.15Å; M276-S351 WeakPolarHBondContact O-CB 3.27Å; S351-R353 PolarHBondContact O-N 2.74Å; S351-D354 PolarHBondContact N-OD2 3.38Å; S351-D354 PolarHBondContact O-N 3.17Å; S351-D354 PolarHBondContact OG-N 2.93Å; S351-D354 VanDerWaalsContact OG-N 3.14Å; S351-D354 PolarHBondContact OG-OD2 3.43Å; S351-L355 PolarHBondContact O-N 3.15Å; S351-L355 VanDerWaalsContact O-N 3.15Å
352	A	92.3	Very high	89.3	Confident	8 Å²	8	83.9 Å²	83.9	7%	0.066	41%	0.411	C	S	.	.	H	α-helix	trans	-62.2	-36.2	173.9	0	0	0	0	0	111.4	L202 I267 Y274 L355 A356	L202-A352 HydrophobicContact CB-CB 4.49Å; L202-A352 HydrophobicContact CD2-CB 4.19Å; I267-A352 HydrophobicContact CB-CB 4.17Å; I267-A352 HydrophobicContact CG2-CB 3.57Å; I267-A352 WeakPolarHBondContact O-CB 3.46Å; Y274-A352 HydrophobicContact CD2-CB 3.82Å; Y274-A352 HydrophobicContact CE2-CB 4.14Å; Y274-A352 PolarHBondContact O-N 3.15Å; A352-L355 WeakPolarHBondContact O-CB 3.29Å; A352-L355 PolarHBondContact O-N 3.4Å; A352-A356 PolarHBondContact O-N 3.38Å
353	R	92.6	Very high	88.3	Confident	110 Å²	110	83.6 Å²	83.6	42%	0.415	42%	0.422	S	S	.	.	H	α-helix	trans	-59.3	-51.9	172.7	179.3	176.2	173.4	171.4	3.1	112.9	Y274 N275 S351 L355 A356 E357	Y274-R353 HydrophobicContact CD1-CB 3.9Å; Y274-R353 HydrophobicContact CD1-CG 4.42Å; Y274-R353 HydrophobicContact CD2-CB 4.46Å; Y274-R353 HydrophobicContact CE1-CB 3.59Å; Y274-R353 HydrophobicContact CE1-CG 3.79Å; Y274-R353 HydrophobicContact CE2-CB 4.17Å; Y274-R353 HydrophobicContact CG-CB 4.33Å; Y274-R353 PolarHBondContact O-N 3.02Å; N275-R353 WeakPolarHBondContact OD1-CD 3.49Å; N275-R353 PolarHBondContact OD1-NH1 2.6Å; S351-R353 PolarHBondContact O-N 2.74Å; R353-L355 PolarHBondContact O-N 2.95Å; R353-A356 WeakPolarHBondContact O-CB 3.06Å; R353-A356 PolarHBondContact O-N 2.89Å; R353-A356 VanDerWaalsContact O-N 3.07Å; R353-E357 HydrophobicContact CG-CG 4.38Å; R353-E357 WeakPolarHBondContact CG-OE1 3.43Å; R353-E357 IonicContact CZ-OE1 3.44Å; R353-E357 IonicContact NE-OE1 3.71Å; R353-E357 PolarHBondContact NE-OE1 2.84Å; R353-E357 IonicContact NH2-OE1 3.36Å; R353-E357 WeakPolarHBondContact O-CG 3.48Å; R353-E357 PolarHBondContact O-N 3.47Å
354	D	91.9	Very high	86.9	Confident	61 Å²	61	81.5 Å²	81.5	33%	0.326	42%	0.415	S	S	.	.	H	α-helix	trans	-59.8	-33.4	179.6	-57.4	-42.1	0	0	0	111.2	C350 S351 K358	C350-D354 HydrophobicContact CB-CB 3.82Å; S351-D354 PolarHBondContact N-OD2 3.38Å; S351-D354 PolarHBondContact O-N 3.17Å; S351-D354 PolarHBondContact OG-N 2.93Å; S351-D354 VanDerWaalsContact OG-N 3.14Å; S351-D354 PolarHBondContact OG-OD2 3.43Å; D354-K358 WeakPolarHBondContact O-CB 3.25Å; D354-K358 WeakPolarHBondContact O-CG 3.3Å; D354-K358 PolarHBondContact O-N 3.35Å
355	L	89.9	Confident	85.3	Confident	44 Å²	44	83.3 Å²	83.3	23%	0.23	43%	0.427	C	S	.	.	H	α-helix	trans	-70.5	-40.9	177.8	-166.7	143.4	0	0	0	111.7	M197 P348 S351 A352 R353 K359	M197-L355 HydrophobicContact CE-CD1 4.24Å; M197-L355 HydrophobicContact CE-CD2 4.49Å; M197-L355 HydrophobicContact SD-CD1 4.09Å; P348-L355 HydrophobicContact CB-CD1 3.77Å; P348-L355 HydrophobicContact CG-CD1 3.54Å; S351-L355 PolarHBondContact O-N 3.15Å; S351-L355 VanDerWaalsContact O-N 3.15Å; A352-L355 WeakPolarHBondContact O-CB 3.29Å; A352-L355 PolarHBondContact O-N 3.4Å; R353-L355 PolarHBondContact O-N 2.95Å; L355-K359 WeakPolarHBondContact O-CB 3.4Å; L355-K359 PolarHBondContact O-N 2.96Å; L355-K359 VanDerWaalsContact O-N 3.09Å
356	A	88.3	Confident	84	Confident	36 Å²	36	80.7 Å²	80.7	30%	0.298	41%	0.414	S	S	.	.	H	α-helix	trans	-64.4	-45.7	173.6	0	0	0	0	0	111.6	Y274 A352 R353 K358 K359 Y360	Y274-A356 WeakPolarHBondContact OH-CB 3Å; A352-A356 PolarHBondContact O-N 3.38Å; R353-A356 WeakPolarHBondContact O-CB 3.06Å; R353-A356 PolarHBondContact O-N 2.89Å; R353-A356 VanDerWaalsContact O-N 3.07Å; A356-K358 PolarHBondContact O-N 3.17Å; A356-K359 PolarHBondContact O-N 3.04Å; A356-Y360 PolarHBondContact O-N 3.21Å
357	E	89	Confident	82.5	Confident	88 Å²	88	76.5 Å²	76.5	41%	0.411	40%	0.396	S	S	.	.	H	α-helix	trans	-61.7	-44.9	177.7	-71.4	179.8	-172	0	0	111.7	R353 K359 Y360 I361	R353-E357 HydrophobicContact CG-CG 4.38Å; R353-E357 WeakPolarHBondContact CG-OE1 3.43Å; R353-E357 IonicContact CZ-OE1 3.44Å; R353-E357 IonicContact NE-OE1 3.71Å; R353-E357 PolarHBondContact NE-OE1 2.84Å; R353-E357 IonicContact NH2-OE1 3.36Å; R353-E357 WeakPolarHBondContact O-CG 3.48Å; R353-E357 PolarHBondContact O-N 3.47Å; E357-K359 VanDerWaalsContact C-N 3.33Å; E357-K359 PolarHBondContact O-N 3.35Å; E357-Y360 WeakPolarHBondContact O-CB 3.3Å; E357-Y360 PolarHBondContact O-N 2.72Å; E357-I361 WeakPolarHBondContact O-CG1 3.32Å; E357-I361 PolarHBondContact O-N 3.08Å
358	K	86.3	Confident	80.7	Confident	129 Å²	129	82.3 Å²	82.3	56%	0.561	42%	0.421	S	S	*	.	H	α-helix	trans	-61.2	-40.6	175.3	-77.1	171.3	-174	171.9	0	112.7	D354 A356 Y360 I361 L362	D354-K358 WeakPolarHBondContact O-CB 3.25Å; D354-K358 WeakPolarHBondContact O-CG 3.3Å; D354-K358 PolarHBondContact O-N 3.35Å; A356-K358 PolarHBondContact O-N 3.17Å; K358-Y360 VanDerWaalsContact C-N 3.34Å; K358-I361 PolarHBondContact O-N 3.14Å; K358-L362 WeakPolarHBondContact O-CB 3.46Å; K358-L362 PolarHBondContact O-N 3.03Å
359	K	83.9	Confident	78.9	Confident	148 Å²	148	83.8 Å²	83.8	64%	0.643	43%	0.431	S	S	*	.	H	α-helix	trans	-64.7	-41.2	177.3	-173.7	-179.1	178.1	-174.7	0	111.1	L355 A356 E357 S363	L355-K359 WeakPolarHBondContact O-CB 3.4Å; L355-K359 PolarHBondContact O-N 2.96Å; L355-K359 VanDerWaalsContact O-N 3.09Å; A356-K359 PolarHBondContact O-N 3.04Å; E357-K359 VanDerWaalsContact C-N 3.33Å; E357-K359 PolarHBondContact O-N 3.35Å; K359-S363 WeakPolarHBondContact O-CB 3.39Å; K359-S363 PolarHBondContact O-N 2.85Å
360	Y	80.2	Confident	77.1	Confident	162 Å²	162	86.9 Å²	86.9	64%	0.635	44%	0.437	S	S	*	.	H	α-helix	trans	-62.2	-47.8	175.8	-176.3	-97.8	0	0	0	111.7	A356 E357 K358 L362 S363 N364	A356-Y360 PolarHBondContact O-N 3.21Å; E357-Y360 WeakPolarHBondContact O-CB 3.3Å; E357-Y360 PolarHBondContact O-N 2.72Å; K358-Y360 VanDerWaalsContact C-N 3.34Å; Y360-L362 PolarHBondContact O-N 3.33Å; Y360-S363 PolarHBondContact O-N 3.43Å; Y360-N364 WeakPolarHBondContact O-CB 3.41Å; Y360-N364 PolarHBondContact O-N 3.32Å
361	I	81.2	Confident	75.3	Confident	105 Å²	105	91.8 Å²	91.8	54%	0.538	46%	0.457	S	S	.	.	H	α-helix	trans	-59.2	-48.6	178	-66.8	165.6	0	0	0	110.9	E357 K358 S363 N364 T365	E357-I361 WeakPolarHBondContact O-CG1 3.32Å; E357-I361 PolarHBondContact O-N 3.08Å; K358-I361 PolarHBondContact O-N 3.14Å; I361-S363 VanDerWaalsContact C-N 3.33Å; I361-S363 PolarHBondContact O-N 3.34Å; I361-N364 PolarHBondContact O-N 3.27Å; I361-N364 VanDerWaalsContact O-N 3.14Å; I361-T365 PolarHBondContact O-N 3.31Å; I361-T365 PolarHBondContact O-OG1 2.7Å
362	L	77.2	Confident	73.5	Confident	116 Å²	116	95.2 Å²	95.2	61%	0.607	48%	0.475	S	S	*	.	H	α-helix	trans	-62.7	-39.4	-179.5	-170	70.9	0	0	0	112.2	K358 Y360 N364 N366	K358-L362 WeakPolarHBondContact O-CB 3.46Å; K358-L362 PolarHBondContact O-N 3.03Å; Y360-L362 PolarHBondContact O-N 3.33Å; L362-N364 VanDerWaalsContact C-N 3.34Å; L362-N366 PolarHBondContact O-N 3.48Å
363	S	74.1	Confident	71.8	Confident	82 Å²	82	101.6 Å²	101.6	57%	0.573	50%	0.503	S	S	*	.	H	α-helix	trans	-63.1	-41.1	174.5	-170	0	0	0	0	111.7	K359 Y360 I361 N366 S367	K359-S363 WeakPolarHBondContact O-CB 3.39Å; K359-S363 PolarHBondContact O-N 2.85Å; Y360-S363 PolarHBondContact O-N 3.43Å; I361-S363 VanDerWaalsContact C-N 3.33Å; I361-S363 PolarHBondContact O-N 3.34Å; S363-N366 PolarHBondContact O-N 3.25Å; S363-S367 PolarHBondContact O-N 2.01Å; S363-S367 VanDerWaalsContact O-N 3.13Å
364	N	66.9	Low	70	Confident	93 Å²	93	102.4 Å²	102.4	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-73.6	-34.8	-177.3	-144.3	33	0	0	0	112.2	Y360 I361 L362 S367 F368	Y360-N364 WeakPolarHBondContact O-CB 3.41Å; Y360-N364 PolarHBondContact O-N 3.32Å; I361-N364 PolarHBondContact O-N 3.27Å; I361-N364 VanDerWaalsContact O-N 3.14Å; L362-N364 VanDerWaalsContact C-N 3.34Å; N364-S367 PolarHBondContact O-N 3.44Å; N364-F368 PolarHBondContact O-N 3.4Å
365	T	62	Low	68.3	Low	76 Å²	76	102 Å²	102	47%	0.466	52%	0.519	S	S	.	.	H	α-helix	trans	-64.1	-41.1	173.1	-47.7	0	0	0	0	111.6	I361 S367 F368 C369	I361-T365 PolarHBondContact O-N 3.31Å; I361-T365 PolarHBondContact O-OG1 2.7Å; T365-S367 VanDerWaalsContact C-N 3.31Å; T365-S367 PolarHBondContact O-N 3.46Å; T365-F368 PolarHBondContact O-N 3.02Å; T365-C369 PolarHBondContact O-N 2.87Å; T365-C369 VanDerWaalsContact O-N 3.09Å; T365-C369 PolarHBondContact O-SG 3.49Å
366	N	59	Low	66.5	Low	101 Å²	101	105.6 Å²	105.6	54%	0.54	54%	0.538	S	S	.	.	H	α-helix	trans	-65.4	-33.7	175.4	-72.6	-14.8	0	0	0	112.5	L362 S363 Y370	L362-N366 PolarHBondContact O-N 3.48Å; S363-N366 PolarHBondContact O-N 3.25Å; N366-Y370 PolarHBondContact O-N 3.18Å
367	S	56.9	Low	64.6	Low	63 Å²	63	110 Å²	110	44%	0.441	56%	0.556	S	S	.	*	H	α-helix	trans	-67.7	-40.6	174.2	-167	0	0	0	0	112.3	S363 N364 T365 Y370 E371	S363-S367 PolarHBondContact O-N 2.01Å; S363-S367 VanDerWaalsContact O-N 3.13Å; N364-S367 PolarHBondContact O-N 3.44Å; T365-S367 VanDerWaalsContact C-N 3.31Å; T365-S367 PolarHBondContact O-N 3.46Å; S367-Y370 PolarHBondContact O-N 3.41Å; S367-E371 PolarHBondContact O-N 2.96Å; S367-E371 VanDerWaalsContact O-N 3.08Å
368	F	53.4	Low	62.6	Low	130 Å²	130	114.6 Å²	114.6	57%	0.57	58%	0.575	S	S	*	*	H	α-helix	trans	-70.5	-32.1	-179.7	-156.9	-101.8	0	0	0	112.7	N364 T365 N372	N364-F368 PolarHBondContact O-N 3.4Å; T365-F368 PolarHBondContact O-N 3.02Å; F368-N372 VanDerWaalsContact CD1-ND2 3.3Å; F368-N372 WeakPolarHBondContact CD1-ND2 3.29Å; F368-N372 VanDerWaalsContact CE1-ND2 3.25Å; F368-N372 WeakPolarHBondContact CE1-ND2 3.48Å; F368-N372 PolarHBondContact O-N 3.23Å; F368-N372 PolarHBondContact O-ND2 3.42Å; F368-N372 VanDerWaalsContact O-ND2 3.09Å
369	C	53.5	Low	60.8	Low	70 Å²	70	116.9 Å²	116.9	47%	0.473	59%	0.585	S	S	.	*	H	α-helix	trans	-67.6	-38.9	172	-71	0	0	0	0	111.9	T365 N372 E373	T365-C369 PolarHBondContact O-N 2.87Å; T365-C369 VanDerWaalsContact O-N 3.09Å; T365-C369 PolarHBondContact O-SG 3.49Å; C369-N372 PolarHBondContact O-N 3.04Å; C369-E373 WeakPolarHBondContact O-CG 3.14Å; C369-E373 PolarHBondContact O-N 3.46Å
370	Y	54.2	Low	58.9	Low	174 Å²	174	117.9 Å²	117.9	68%	0.682	59%	0.592	S	S	*	*	H	α-helix	trans	-67.5	-39	176.6	-108.6	-88.9	0	0	0	113.3	N366 S367 N372 M374	N366-Y370 PolarHBondContact O-N 3.18Å; S367-Y370 PolarHBondContact O-N 3.41Å; Y370-N372 VanDerWaalsContact C-N 3.35Å; Y370-M374 WeakPolarHBondContact O-CB 3.13Å; Y370-M374 WeakPolarHBondContact O-CG 3.5Å; Y370-M374 PolarHBondContact O-N 3.34Å
371	E	54.2	Low	57.1	Low	128 Å²	128	117.1 Å²	117.1	60%	0.598	60%	0.599	S	S	*	*	H	α-helix	trans	-65.3	-37.9	174.7	-83.9	-174.4	150.7	0	0	112.3	S367 A375	S367-E371 PolarHBondContact O-N 2.96Å; S367-E371 VanDerWaalsContact O-N 3.08Å; E371-A375 VanDerWaalsContact O-CB 3.26Å; E371-A375 WeakPolarHBondContact O-CB 3.32Å; E371-A375 PolarHBondContact O-N 3.19Å
372	N	56.6	Low	55.4	Low	76 Å²	76	118.4 Å²	118.4	41%	0.406	61%	0.612	S	S	.	*	H	α-helix	trans	-73.2	-35.2	178.2	-72.1	-32.5	0	0	0	112.9	F368 C369 Y370 A375 L376	F368-N372 VanDerWaalsContact CD1-ND2 3.3Å; F368-N372 WeakPolarHBondContact CD1-ND2 3.29Å; F368-N372 VanDerWaalsContact CE1-ND2 3.25Å; F368-N372 WeakPolarHBondContact CE1-ND2 3.48Å; F368-N372 PolarHBondContact O-N 3.23Å; F368-N372 PolarHBondContact O-ND2 3.42Å; F368-N372 VanDerWaalsContact O-ND2 3.09Å; C369-N372 PolarHBondContact O-N 3.04Å; Y370-N372 VanDerWaalsContact C-N 3.35Å; N372-A375 PolarHBondContact O-N 2.91Å; N372-L376 WeakPolarHBondContact O-CB 3.34Å; N372-L376 VanDerWaalsContact O-CG 3.31Å; N372-L376 WeakPolarHBondContact O-CG 3.47Å; N372-L376 PolarHBondContact O-N 3.27Å
373	E	56.9	Low	53.5	Low	141 Å²	141	120.6 Å²	120.6	66%	0.659	62%	0.624	S	S	*	*	H	α-helix	trans	-67.3	-41.8	174	-64.9	-113.2	153	0	0	111	C369 A375 L376 D377	C369-E373 WeakPolarHBondContact O-CG 3.14Å; C369-E373 PolarHBondContact O-N 3.46Å; E373-A375 VanDerWaalsContact C-N 3.32Å; E373-A375 PolarHBondContact O-N 3.39Å; E373-L376 PolarHBondContact O-N 2.88Å; E373-D377 PolarHBondContact O-N 2.9Å
374	M	54.6	Low	51.6	Low	127 Å²	127	126 Å²	126	63%	0.626	64%	0.64	S	S	*	*	H	α-helix	trans	-69.2	-26	173.9	-72.4	-122.5	168	0	0	113.9	Y370 K378	Y370-M374 WeakPolarHBondContact O-CB 3.13Å; Y370-M374 WeakPolarHBondContact O-CG 3.5Å; Y370-M374 PolarHBondContact O-N 3.34Å; M374-K378 PolarHBondContact O-N 3.26Å
375	A	55.7	Low	49.8	Very low	54 Å²	54	125.3 Å²	125.3	45%	0.446	66%	0.655	S	S	.	*	H	α-helix	trans	-78.4	-24.9	172.7	0	0	0	0	0	112.8	E371 N372 E373	E371-A375 VanDerWaalsContact O-CB 3.26Å; E371-A375 WeakPolarHBondContact O-CB 3.32Å; E371-A375 PolarHBondContact O-N 3.19Å; N372-A375 PolarHBondContact O-N 2.91Å; E373-A375 VanDerWaalsContact C-N 3.32Å; E373-A375 PolarHBondContact O-N 3.39Å
376	L	52.3	Low	48.3	Very low	118 Å²	118	129.8 Å²	129.8	62%	0.618	68%	0.676	S	S	*	*	H	α-helix	trans	-80	-41.2	173.5	-76.2	165.8	0	0	0	111.5	N372 E373 K378 K379	N372-L376 WeakPolarHBondContact O-CB 3.34Å; N372-L376 VanDerWaalsContact O-CG 3.31Å; N372-L376 WeakPolarHBondContact O-CG 3.47Å; N372-L376 PolarHBondContact O-N 3.27Å; E373-L376 PolarHBondContact O-N 2.88Å; L376-K378 PolarHBondContact O-N 3.09Å; L376-K379 PolarHBondContact O-N 3.1Å
377	D	48	Very low	46.9	Very low	128 Å²	128	128.3 Å²	128.3	68%	0.684	68%	0.684	S	S	*	*	H	α-helix	trans	-63.3	-26	174.1	-94.6	-7.9	0	0	0	113	E373 K379	E373-D377 PolarHBondContact O-N 2.9Å; D377-K379 VanDerWaalsContact C-N 3.32Å
378	K	48	Very low	45.6	Very low	186 Å²	186	128.8 Å²	128.8	81%	0.809	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-5.7	175	-94.7	-178.1	176.8	174.5	0	114.8	M374 L376	M374-K378 PolarHBondContact O-N 3.26Å; L376-K378 PolarHBondContact O-N 3.09Å
379	K	47.8	Very low	44.5	Very low	176 Å²	176	128 Å²	128	77%	0.765	71%	0.71	S	S	*	*	S	Bend	trans	-107.8	-3.8	-175.4	-111.5	-179.5	179.4	174.3	0	114.6	L376 D377	L376-K379 PolarHBondContact O-N 3.1Å; D377-K379 VanDerWaalsContact C-N 3.32Å
380	E	43.2	Very low	43.5	Very low	170 Å²	170	131.5 Å²	131.5	79%	0.794	73%	0.729	S	S	*	*	S	Bend	trans	-93.9	-9.5	177.1	-72.9	-164.5	156.7	0	0	114.8
381	D	44	Very low	42.2	Very low	145 Å²	145	126.3 Å²	126.3	78%	0.775	73%	0.729	S	S	*	*	S	Bend	trans	-103.7	71.3	174.6	-76.7	-27.1	0	0	0	112
382	T	44.7	Very low	42.2	Very low	132 Å²	132	126 Å²	126	81%	0.81	74%	0.738	S	S	*	*			trans	-164.6	77.4	155.1	5.7	0	0	0	0	111.7
383	D	36.9	Very low	40.9	Very low	162 Å²	162	130.6 Å²	130.6	87%	0.866	76%	0.762	S	S	*	*			trans	-166.1	116.8	136.4	-136.9	-7.4	0	0	0	110.7
384	E	33.7	Very low	39.5	Very low	197 Å²	197	126.8 Å²	126.8	92%	0.921	76%	0.761	S	S	*	*			trans	175.6	125.4	132.2	-96.4	-169.7	-174.3	0	0	109.7
385	G	30.8	Very low	38.4	Very low	78 Å²	78	126.8 Å²	126.8	80%	0.804	77%	0.768	S	S	*	*			trans	-91.4	-176.4	-163.1	0	0	0	0	0	116.9
386	N	30.6	Very low	37.1	Very low	170 Å²	170	131.9 Å²	131.9	91%	0.909	78%	0.782	S	S	*	*			trans	-158.2	140.4	146.7	-156.5	10.1	0	0	0	110.9
387	G	29.3	Very low	36	Very low	69 Å²	69	133.6 Å²	133.6	71%	0.711	79%	0.789	S	S	*	*			trans	-90.1	169.9	179	0	0	0	0	0	114
388	G	29.6	Very low	35.1	Very low	73 Å²	73	133.6 Å²	133.6	75%	0.753	79%	0.789	S	S	*	*			trans	144.2	80	162.5	0	0	0	0	0	117.5
389	S	29.6	Very low	34.1	Very low	114 Å²	114	129 Å²	129	80%	0.797	78%	0.781	S	S	*	*			trans	16.5	130.7	143.4	52.7	0	0	0	0	123.3
390	V	31.9	Very low	33.2	Very low	143 Å²	143	127.7 Å²	127.7	87%	0.867	78%	0.78	S	S	*	*				159.3	126.9	110.9	169.4	0	0	0	0	109.5
391	G	27.9	Very low	32.4	Very low	66 Å²	66	124 Å²	124	68%	0.68	77%	0.773	S	S	*	*			trans	-103.3	-154	174.3	0	0	0	0	0	113.2
392	P	53.3	Low	31.7	Very low	122 Å²	122	125.3 Å²	125.3	79%	0.792	78%	0.775	S	S	*	*			cis	-130.7	167.3	-28.6	38.9	-23.5	0	0	0	112.8
393	D	29.8	Very low	30.9	Very low	171 Å²	171	124.2 Å²	124.2	91%	0.914	77%	0.768	S	S	*	*			trans	-170.8	136.5	143.1	-112.5	-14.4	0	0	0	113.5
394	G	28.6	Very low	30.5	Very low	61 Å²	61	124.2 Å²	124.2	63%	0.629	76%	0.763	S	S	*	*			trans	93.5	84.4	133	0	0	0	0	0	122.1
395	T	29.9	Very low	30.2	Very low	127 Å²	127	122.7 Å²	122.7	78%	0.779	76%	0.755	S	S	*	*				68.4	119.3	123.9	-23.7	0	0	0	0	123.4
396	Q	29.9	Very low	29.9	Very low	161 Å²	161	124 Å²	124	75%	0.752	75%	0.752	S	S	*	*			trans	66	118.4	142.3	-81.9	176	-31.8	0	0	121.8
397	M	29.1	Very low	29.9	Very low	155 Å²	155	124.6 Å²	124.6	76%	0.764	75%	0.75	S	S	*	*				70.3	119.7	100.4	-108.7	167.4	159.3	0	0	111.9
398	D	28.5	Very low	29.8	Very low	128 Å²	128	127.9 Å²	127.9	68%	0.684	76%	0.756	S	S	*	*				-160.3	128.4	52	-100.6	-44.8	0	0	0	113.5
399	S	27.8	Very low	29.8	Very low	89 Å²	89	133.1 Å²	133.1	62%	0.622	76%	0.763	S	S	*	*				34.1	139.8	119.6	70.3	0	0	0	0	124.5
400	I	29	Very low	30	Very low	148 Å²	148	134 Å²	134	76%	0.759	76%	0.763	S	S	*	*			trans	85.3	104.5	151.5	-59.2	152.1	0	0	0	116
401	S	26.3	Very low	30	Very low	93 Å²	93	132.8 Å²	132.8	65%	0.65	76%	0.758	S	S	*	*			cis	79.8	125.2	48	86.7	0	0	0	0	115.5
402	E	28.5	Very low	30.2	Very low	172 Å²	172	138.2 Å²	138.2	80%	0.804	77%	0.771	S	S	*	*			trans	103.9	101	148.1	-63.7	-168	162.7	0	0	121
403	T	28.5	Very low	29.3	Very low	109 Å²	109	141.3 Å²	141.3	67%	0.669	77%	0.774	S	S	*	*				48.1	120.4	114.9	10	0	0	0	0	120.4
404	E	29	Very low	29.4	Very low	162 Å²	162	138.9 Å²	138.9	76%	0.757	77%	0.768	S	S	*	*				143.2	132.2	92.8	-123.2	170.8	-159	0	0	114.5
405	H	26.8	Very low	29.6	Very low	165 Å²	165	147.7 Å²	147.7	76%	0.764	78%	0.782	S	S	*	*			trans	40.9	116.6	146.2	-76.2	-4.4	0	0	0	122.5
406	S	24.8	Very low	29.8	Very low	106 Å²	106	147.7 Å²	147.7	74%	0.741	78%	0.784	S	S	*	*				170.1	138.4	94.1	-80.4	0	0	0	0	112.9
407	Q	29.4	Very low	29.9	Very low	182 Å²	182	148.5 Å²	148.5	85%	0.85	79%	0.793	S	S	*	*			trans	13.8	135.9	148.2	-60.7	175.1	-11.2	0	0	119.2
408	V	28.2	Very low	30.1	Very low	139 Å²	139	152.6 Å²	152.6	84%	0.842	80%	0.8	S	S	*	*				-175.4	133.3	114.6	152.7	0	0	0	0	110.9
409	M	29.1	Very low	30.4	Very low	182 Å²	182	157.7 Å²	157.7	90%	0.897	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-60.3	135.5	173	-132.6	170.7	-170.6	0	0	111.6
410	V	33.8	Very low	30.6	Very low	134 Å²	134	162.1 Å²	162.1	81%	0.812	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-91.6	132.8	172.9	178.3	0	0	0	0	109.9
411	P	32.5	Very low	30.7	Very low	117 Å²	117	160.4 Å²	160.4	76%	0.76	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-85.6	145.2	179.8	32.6	-31.8	0	0	0	113
412	L	32	Very low	31.1	Very low	180 Å²	180	164.8 Å²	164.8	94%	0.942	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-86.4	125.1	171.7	-84.5	154.6	0	0	0	110.4
413	E	33.3	Very low	31.6	Very low	186 Å²	186	168.2 Å²	168.2	87%	0.869	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-93.7	141.2	179.8	-153.5	172.4	-171.1	0	0	111.6
414	P	33.3	Very low	31.8	Very low	120 Å²	120	171.2 Å²	171.2	78%	0.779	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-87.4	143.3	-174.3	32.3	-33.6	0	0	0	114.3
415	R	32.7	Very low	31.9	Very low	246 Å²	246	171.6 Å²	171.6	93%	0.928	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-71.3	142.9	174.2	-78.3	179.3	171.6	173.1	-2.3	112.5
416	P	33.8	Very low	32.2	Very low	127 Å²	127	172 Å²	172	83%	0.825	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-86.3	142.2	179	33.1	-32.7	0	0	0	113.7
417	L	32.6	Very low	32.6	Very low	179 Å²	179	175.9 Å²	175.9	94%	0.937	88%	0.881	S	S	*	*	P	Polyproline II helix	trans	-76.7	130.7	171.8	-83.8	148.2	0	0	0	111.1
418	R	32.8	Very low	32.8	Very low	241 Å²	241	175.5 Å²	175.5	91%	0.909	88%	0.883	S	S	*	*	P	Polyproline II helix	trans	-92.1	132.4	173	-165.4	175.3	-177.1	168.5	0.6	109.4
419	R	34.3	Very low	33.1	Very low	235 Å²	235	177.9 Å²	177.9	89%	0.887	89%	0.886	S	S	*	*			trans	-112.6	130.3	-178.3	-166.6	-171.9	-156.7	179.8	6.1	109.2
420	E	31.6	Very low	33.4	Very low	182 Å²	182	177.6 Å²	177.6	85%	0.85	89%	0.885	S	S	*	*			trans	174.3	143	158.9	-101.6	167.9	-177.4	0	0	105.4
421	S	31.7	Very low	33.4	Very low	112 Å²	112	181 Å²	181	78%	0.783	89%	0.891	S	S	*	*			cis	-167.9	163	12.3	44.6	0	0	0	0	109
422	E	34.8	Very low	33.5	Very low	184 Å²	184	186.3 Å²	186.3	86%	0.86	90%	0.902	S	S	*	*			trans	-49.4	145	169.8	-63.1	164.4	145.2	0	0	114
423	I	39.1	Very low	33.6	Very low	244 Å²	244	186.9 Å²	186.9	100%	1.251	90%	0.898	S	S	*	*				-157.7	0	124.3	-85.5	155.6	0	0	0	107

Retrieved 423 of 423 residues in 150.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).