A0A3Q0KFP2_SCHMA Loading...

Mitoguardin 2

AlphaFold DB , UniProt , Accession A0A3Q0KFP2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 628 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26.8	Very low	25.7	Very low	233 Å²	233	147.8 Å²	147.8	100%	1.148	82%	0.821	S	S	*	*				0	134.6	0	-76.8	170.5	81.8	0	0	108.6
2	K	25.6	Very low	25.4	Very low	187 Å²	187	148.1 Å²	148.1	81%	0.813	82%	0.82	S	S	*	*			trans	44.3	109.9	154.5	-70.9	-178.4	178.2	179.4	0	118.1
3	K	21.8	Very low	25.6	Very low	212 Å²	212	149.7 Å²	149.7	92%	0.922	82%	0.823	S	S	*	*				88.9	130.4	74.4	-90.6	-168.7	175.3	-172.4	0	113
4	G	24.2	Very low	25.4	Very low	78 Å²	78	149.4 Å²	149.4	80%	0.804	82%	0.818	S	S	*	*			trans	111.1	107.3	159.8	0	0	0	0	0	111.7
5	G	21.5	Very low	25.2	Very low	78 Å²	78	150.2 Å²	150.2	80%	0.804	81%	0.813	S	S	*	*			cis	83.8	78.9	23.6	0	0	0	0	0	110.3
6	V	28.8	Very low	25.4	Very low	153 Å²	153	153.4 Å²	153.4	93%	0.927	82%	0.817	S	S	*	*			trans	-141.2	123.8	156.1	-175.5	0	0	0	0	108.2
7	S	24.3	Very low	25.6	Very low	102 Å²	102	151.1 Å²	151.1	71%	0.713	81%	0.813	S	S	*	*			trans	-100.2	-169.8	175.8	-170	0	0	0	0	108.7
8	P	39.2	Very low	25.6	Very low	90 Å²	90	148.2 Å²	148.2	58%	0.584	81%	0.813	S	S	*	*				-101.2	-177.6	-104.5	35.7	-16.3	0	0	0	111.7
9	Y	24.9	Very low	25.6	Very low	205 Å²	205	149.8 Å²	149.8	80%	0.804	82%	0.82	S	S	*	*			trans	171.6	116.4	130.7	-85.7	-65.3	0	0	0	109.3
10	L	23	Very low	25.6	Very low	141 Å²	141	151.7 Å²	151.7	74%	0.738	82%	0.82	S	S	*	*			trans	41.1	120.9	149.2	-78.8	98.3	0	0	0	120.6
11	L	22.1	Very low	25.6	Very low	147 Å²	147	150.1 Å²	150.1	77%	0.77	82%	0.819	S	S	*	*				61.5	103.5	78.5	-91.4	146.1	0	0	0	112.8
12	D	22.3	Very low	25.7	Very low	151 Å²	151	146.5 Å²	146.5	81%	0.807	80%	0.803	S	S	*	*			trans	155.1	112	148.1	-80	-17.3	0	0	0	105.1
13	I	28.9	Very low	25.7	Very low	169 Å²	169	143.1 Å²	143.1	87%	0.867	80%	0.798	S	S	*	*				-164	120.3	82.5	-78.8	150.7	0	0	0	108.1
14	I	21.7	Very low	26	Very low	145 Å²	145	136.4 Å²	136.4	74%	0.744	78%	0.777	S	S	*	*			trans	-83.8	139.7	163.7	-67.6	168.5	0	0	0	108
15	H	23.5	Very low	26.3	Very low	162 Å²	162	143.8 Å²	143.8	75%	0.75	78%	0.781	S	S	*	*			trans	160	122.7	132	-94.6	-79.8	0	0	0	111.1
16	F	27.3	Very low	26.7	Very low	201 Å²	201	147.5 Å²	147.5	88%	0.882	78%	0.775	S	S	*	*				176.7	149.7	115.8	-104.6	-92.8	0	0	0	110.2
17	P	28.6	Very low	26.8	Very low	114 Å²	114	143.9 Å²	143.9	74%	0.74	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-101.8	155.4	-140.3	37.5	-33.9	0	0	0	115.8
18	A	25.6	Very low	27.1	Very low	99 Å²	99	146.4 Å²	146.4	82%	0.818	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-80.1	137.6	172.9	0	0	0	0	0	112.5
19	L	26.2	Very low	26.7	Very low	180 Å²	180	150.6 Å²	150.6	94%	0.942	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-85.3	129.3	179.8	-152.5	77	0	0	0	110.7
20	K	26.5	Very low	27	Very low	187 Å²	187	144.4 Å²	144.4	81%	0.813	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-76.4	132.7	-179.2	-64.3	171.4	178.1	175.7	0	111
21	C	25.4	Very low	27.4	Very low	119 Å²	119	140 Å²	140	80%	0.804	74%	0.735	S	S	*	*			trans	-128.1	97.1	154.2	-166.3	0	0	0	0	108.9	V23	C21-V23 PolarHBondContact O-N 3.36Å
22	L	27.3	Very low	27.9	Very low	157 Å²	157	133.9 Å²	133.9	82%	0.822	70%	0.703	S	S	*	*			trans	-77.5	97.1	174.1	-97.8	143.7	0	0	0	108.8	S24	L22-S24 PolarHBondContact O-N 2.6Å
23	V	27.3	Very low	28.5	Very low	116 Å²	116	127.6 Å²	127.6	70%	0.703	67%	0.669	S	S	*	*			trans	-78.3	104.8	164.5	179.8	0	0	0	0	107.4	C21 R25	C21-V23 PolarHBondContact O-N 3.36Å; V23-R25 PolarHBondContact O-N 2.86Å
24	S	28	Very low	28.8	Very low	70 Å²	70	119.7 Å²	119.7	49%	0.49	63%	0.629	S	S	.	*			trans	-56.3	128.2	-178.3	172.5	0	0	0	0	112.2	L22 K26 S27	L22-S24 PolarHBondContact O-N 2.6Å; S24-K26 PolarHBondContact O-N 3.23Å; S24-K26 PolarHBondContact OG-N 3.18Å; S24-S27 PolarHBondContact O-N 3.3Å
25	R	30.3	Very low	29.5	Very low	233 Å²	233	112.8 Å²	112.8	88%	0.879	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-52.4	-8.3	173.5	-83.7	178.8	171.2	173.2	-2.9	114.9	V23	V23-R25 PolarHBondContact O-N 2.86Å
26	K	29.6	Very low	29.9	Very low	156 Å²	156	105.1 Å²	105.1	68%	0.678	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-75.2	-21.6	177.2	-66.6	-173.6	178.4	-176.7	0	113.5	S24	S24-K26 PolarHBondContact O-N 3.23Å; S24-K26 PolarHBondContact OG-N 3.18Å
27	S	30.1	Very low	30.4	Very low	77 Å²	77	95.8 Å²	95.8	54%	0.538	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-88.9	-4.9	-176.7	77.7	0	0	0	0	115.7	S24	S24-S27 PolarHBondContact O-N 3.3Å
28	L	32	Very low	30.6	Very low	156 Å²	156	91.1 Å²	91.1	82%	0.817	49%	0.49	S	S	*	.	S	Bend	trans	-96.8	-13.2	-178.6	-150.2	94.2	0	0	0	113.6
29	K	29.9	Very low	30.9	Very low	177 Å²	177	86.5 Å²	86.5	77%	0.77	45%	0.453	S	S	*	.	S	Bend	trans	-82.3	-15.4	176.2	-69.3	-173.5	177.4	-176.3	0	113.1	V31	K29-V31 PolarHBondContact O-N 3.3Å
30	C	30.5	Very low	31.3	Very low	75 Å²	75	78 Å²	78	51%	0.507	41%	0.408	S	S	.	.	S	Bend	trans	-96.4	34.4	-167.9	-71.2	0	0	0	0	115.9	L373	C30-L373 HydrophobicContact CB-CD2 4.4Å; C30-L373 WeakPolarHBondContact O-CD2 3.47Å
31	V	32.3	Very low	31.7	Very low	49 Å²	49	69.1 Å²	69.1	30%	0.297	37%	0.37	S	S	.	.	S	Bend	trans	-122.7	-15.7	-176.3	-169.6	0	0	0	0	116	K29 P378 I406	K29-V31 PolarHBondContact O-N 3.3Å; V31-P378 HydrophobicContact CG1-CG 3.84Å; V31-P378 HydrophobicContact CG2-CG 3.92Å; V31-I406 HydrophobicContact CB-CD1 4.5Å; V31-I406 HydrophobicContact CG1-CD1 3.19Å; V31-I406 HydrophobicContact CG1-CG1 3.71Å
32	L	33.3	Very low	32.7	Very low	19 Å²	19	63.8 Å²	63.8	10%	0.099	33%	0.333	C	S	.	.			trans	-157.8	109.2	-173.7	-67.4	168.6	0	0	0	116.4	I406 K410 L432	L32-I406 HydrophobicContact CD1-CB 3.53Å; L32-I406 HydrophobicContact CD1-CG1 3.66Å; L32-I406 HydrophobicContact CD1-CG2 3.27Å; L32-I406 VanDerWaalsContact CD1-O 3.27Å; L32-I406 WeakPolarHBondContact CD1-O 3.36Å; L32-I406 HydrophobicContact CD2-CB 4.1Å; L32-I406 HydrophobicContact CD2-CD1 4.32Å; L32-I406 HydrophobicContact CD2-CG1 4.19Å; L32-I406 HydrophobicContact CD2-CG2 3.08Å; L32-I406 HydrophobicContact CG-CB 4.06Å; L32-I406 HydrophobicContact CG-CD1 4.42Å; L32-I406 HydrophobicContact CG-CG1 3.89Å; L32-I406 HydrophobicContact CG-CG2 3.53Å; L32-K410 HydrophobicContact CB-CD 3.98Å; L32-K410 HydrophobicContact CD1-CD 3.54Å; L32-K410 HydrophobicContact CD1-CG 3.89Å; L32-K410 PolarHBondContact O-NZ 2.91Å; L32-L432 HydrophobicContact CD2-CD2 3.95Å
33	L	33.5	Very low	33.1	Very low	18 Å²	18	57 Å²	57	9%	0.094	30%	0.299	C	S	.	.			trans	-147.3	112.1	152.6	-99.8	103.1	0	0	0	104.4	A35 L365 E369 A370 L373	L33-A35 PolarHBondContact O-N 2.92Å; L33-L365 HydrophobicContact CD2-CD1 3.72Å; L33-L365 HydrophobicContact CD2-CG 4.01Å; L33-L365 WeakPolarHBondContact CD2-O 3.24Å; L33-E369 HydrophobicContact CB-CB 3.94Å; L33-E369 HydrophobicContact CB-CG 3.81Å; L33-E369 HydrophobicContact CD1-CG 4.02Å; L33-E369 WeakPolarHBondContact CD1-OE1 3.39Å; L33-E369 WeakPolarHBondContact CD1-OE2 3.22Å; L33-E369 HydrophobicContact CD2-CB 4.34Å; L33-E369 HydrophobicContact CD2-CG 4.44Å; L33-E369 WeakPolarHBondContact CD2-OE2 3.43Å; L33-E369 HydrophobicContact CG-CB 4.5Å; L33-E369 HydrophobicContact CG-CG 4.22Å; L33-A370 WeakPolarHBondContact O-CA 3.42Å; L33-A370 WeakPolarHBondContact O-CB 3.34Å; L33-L373 HydrophobicContact CB-CD1 3.77Å
34	S	35.2	Very low	33.7	Very low	3 Å²	3	52.1 Å²	52.1	2%	0.021	27%	0.271	C	S	.	.			trans	48.4	59.6	135	60.6	0	0	0	0	121.5	A36 M366 A370 Y424	S34-A36 PolarHBondContact O-N 3.18Å; S34-M366 WeakPolarHBondContact OG-CA 3.44Å; S34-M366 PolarHBondContact OG-O 3.5Å; S34-A370 WeakPolarHBondContact O-CB 3.49Å; S34-Y424 WeakPolarHBondContact CB-OH 2.66Å; S34-Y424 PolarHBondContact OG-OH 3.17Å
35	A	36.2	Very low	34.2	Very low	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.	S	Bend	trans	-55.8	109.5	160.1	0	0	0	0	0	109.8	L33 L374 L432 L435	L33-A35 PolarHBondContact O-N 2.92Å; A35-L374 HydrophobicContact CB-CD1 3.7Å; A35-L432 HydrophobicContact CB-CB 4.31Å; A35-L432 HydrophobicContact CB-CD1 3.29Å; A35-L432 HydrophobicContact CB-CG 4.38Å; A35-L435 HydrophobicContact CB-CB 3.58Å; A35-L435 HydrophobicContact CB-CD1 3.34Å; A35-L435 HydrophobicContact CB-CG 4.08Å; A35-L435 WeakPolarHBondContact O-CD1 3.26Å
36	A	33.7	Very low	34.5	Very low	1 Å²	1	39.3 Å²	39.3	1%	0.008	21%	0.212	C	C	.	.	S	Bend	trans	50.2	123.2	-174.2	0	0	0	0	0	113	S34 V308 L311 V431 L435 F453	S34-A36 PolarHBondContact O-N 3.18Å; A36-V308 HydrophobicContact CB-CG2 4.21Å; A36-L311 HydrophobicContact CB-CD2 4.34Å; A36-V431 HydrophobicContact CB-CG1 3.74Å; A36-L435 HydrophobicContact CB-CD1 3.42Å; A36-L435 VanDerWaalsContact CB-CD1 3.42Å; A36-F453 HydrophobicContact CB-CE1 4.27Å; A36-F453 HydrophobicContact CB-CZ 4.44Å
37	V	37.3	Very low	35	Very low	5 Å²	5	34 Å²	34	3%	0.03	19%	0.188	C	C	.	.				-166.7	100.9	85.5	172.7	0	0	0	0	104.3	G39 A40 V308 F322 Y326 M427 V431	V37-G39 PolarHBondContact O-N 3.43Å; V37-G39 VanDerWaalsContact O-N 3.16Å; V37-A40 HydrophobicContact CB-CB 4.17Å; V37-A40 HydrophobicContact CG1-CB 3.68Å; V37-A40 PolarHBondContact O-N 3.39Å; V37-V308 HydrophobicContact CB-CG2 3.88Å; V37-V308 HydrophobicContact CG1-CB 4.23Å; V37-V308 HydrophobicContact CG1-CG2 3.6Å; V37-V308 HydrophobicContact CG2-CB 3.92Å; V37-V308 HydrophobicContact CG2-CG1 3.59Å; V37-V308 HydrophobicContact CG2-CG2 3.55Å; V37-F322 HydrophobicContact CB-CE2 4.39Å; V37-F322 HydrophobicContact CG1-CE2 4.15Å; V37-F322 HydrophobicContact CG1-CZ 3.95Å; V37-F322 HydrophobicContact CG2-CD2 4.41Å; V37-F322 HydrophobicContact CG2-CE2 3.47Å; V37-F322 VanDerWaalsContact CG2-CE2 3.47Å; V37-F322 HydrophobicContact CG2-CZ 3.92Å; V37-Y326 HydrophobicContact CG1-CD2 4.15Å; V37-Y326 HydrophobicContact CG1-CE2 4.02Å; V37-M427 HydrophobicContact CB-CE 3.96Å; V37-M427 HydrophobicContact CB-SD 4.09Å; V37-M427 HydrophobicContact CG1-SD 4.37Å; V37-M427 HydrophobicContact CG2-CE 4.11Å; V37-M427 HydrophobicContact CG2-SD 4.13Å; V37-V431 HydrophobicContact CG2-CB 4.47Å; V37-V431 HydrophobicContact CG2-CG1 4.33Å; V37-V431 HydrophobicContact CG2-CG2 3.85Å
38	G	32.1	Very low	35.3	Very low	16 Å²	16	34.6 Å²	34.6	17%	0.165	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-52.9	-32	166.4	0	0	0	0	0	110.2	A40 F42	G38-A40 VanDerWaalsContact C-N 3.31Å; G38-A40 PolarHBondContact O-N 3.36Å; G38-A40 VanDerWaalsContact O-N 3.14Å; G38-F42 VanDerWaalsContact C-CE1 3.5Å; G38-F42 WeakPolarHBondContact O-CE1 3.39Å; G38-F42 WeakPolarHBondContact O-CZ 3.33Å
39	G	32.6	Very low	35.6	Very low	3 Å²	3	28.6 Å²	28.6	3%	0.031	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-33.1	-47.7	166.1	0	0	0	0	0	118	V37 V41 F42 G304 Y326	V37-G39 PolarHBondContact O-N 3.43Å; V37-G39 VanDerWaalsContact O-N 3.16Å; G39-V41 PolarHBondContact O-N 3.08Å; G39-F42 VanDerWaalsContact C-CD2 3.4Å; G39-F42 VanDerWaalsContact N-CZ 3.29Å; G39-F42 WeakPolarHBondContact O-CD2 3.45Å; G39-F42 WeakPolarHBondContact O-CE2 3.22Å; G39-G304 VanDerWaalsContact CA-C 3.47Å; G39-Y326 VanDerWaalsContact O-CE2 3.24Å; G39-Y326 WeakPolarHBondContact O-CE2 3.32Å; G39-Y326 PolarHBondContact O-OH 3.47Å
40	A	34.1	Very low	36.2	Very low	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-108.5	21.2	-146.3	0	0	0	0	0	114	V37 G38 Y326 L329 M330 M427	V37-A40 HydrophobicContact CB-CB 4.17Å; V37-A40 HydrophobicContact CG1-CB 3.68Å; V37-A40 PolarHBondContact O-N 3.39Å; G38-A40 VanDerWaalsContact C-N 3.31Å; G38-A40 PolarHBondContact O-N 3.36Å; G38-A40 VanDerWaalsContact O-N 3.14Å; A40-Y326 HydrophobicContact CB-CD2 3.26Å; A40-Y326 HydrophobicContact CB-CE2 3.27Å; A40-Y326 HydrophobicContact CB-CG 4.22Å; A40-L329 HydrophobicContact CB-CD2 3.82Å; A40-L329 WeakPolarHBondContact O-CD2 3.17Å; A40-L329 WeakPolarHBondContact O-CG 3.37Å; A40-M330 HydrophobicContact CB-CE 4.42Å; A40-M330 WeakPolarHBondContact O-CE 3.26Å; A40-M427 HydrophobicContact CB-CE 3.85Å; A40-M427 HydrophobicContact CB-SD 3.01Å; A40-M427 WeakPolarHBondContact CB-SD 3.1Å
41	V	35.9	Very low	36.5	Very low	2 Å²	2	24.6 Å²	24.6	1%	0.012	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-134.8	6	179.3	-173.8	0	0	0	0	112.4	G39 S43 A44 L329 I333 M344 V361 V362 M366 F420	G39-V41 PolarHBondContact O-N 3.08Å; V41-S43 PolarHBondContact O-N 2.83Å; V41-A44 HydrophobicContact CG1-CB 4.09Å; V41-A44 PolarHBondContact O-N 3.21Å; V41-A44 VanDerWaalsContact O-N 3.15Å; V41-L329 HydrophobicContact CG2-CD2 4.34Å; V41-I333 HydrophobicContact CB-CD1 4.18Å; V41-I333 HydrophobicContact CG1-CD1 3.99Å; V41-I333 HydrophobicContact CG2-CD1 4.31Å; V41-M344 HydrophobicContact CG1-CE 4.09Å; V41-V361 HydrophobicContact CG1-CG1 3.99Å; V41-V362 HydrophobicContact CB-CG2 3.7Å; V41-V362 HydrophobicContact CG1-CG2 4.01Å; V41-M366 HydrophobicContact CG2-CE 4.05Å; V41-M366 HydrophobicContact CG2-SD 3.77Å; V41-F420 HydrophobicContact CG1-CE2 4.11Å; V41-F420 HydrophobicContact CG1-CZ 4.06Å; V41-F420 HydrophobicContact CG2-CE2 4.3Å; V41-F420 HydrophobicContact CG2-CZ 4.08Å
42	F	45.1	Very low	36.5	Very low	6 Å²	6	30 Å²	30	3%	0.026	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-13.4	-166.1	-60.2	-57.9	0	0	0	117.5	G38 G39 F291 F300 I301 F358	G38-F42 VanDerWaalsContact C-CE1 3.5Å; G38-F42 WeakPolarHBondContact O-CE1 3.39Å; G38-F42 WeakPolarHBondContact O-CZ 3.33Å; G39-F42 VanDerWaalsContact C-CD2 3.4Å; G39-F42 VanDerWaalsContact N-CZ 3.29Å; G39-F42 WeakPolarHBondContact O-CD2 3.45Å; G39-F42 WeakPolarHBondContact O-CE2 3.22Å; F42-F291 HydrophobicContact CB-CE1 4.34Å; F42-F291 HydrophobicContact CD1-CZ 4.4Å; F42-F300 HydrophobicContact CB-CB 4.39Å; F42-F300 HydrophobicContact CB-CD1 4.38Å; F42-F300 AromaticContact CD1-CD1 3.13Å; F42-F300 HydrophobicContact CD1-CD1 3.13Å; F42-F300 AromaticContact CD1-CE1 3.39Å; F42-F300 HydrophobicContact CD1-CE1 3.39Å; F42-F300 HydrophobicContact CD1-CG 4.06Å; F42-F300 HydrophobicContact CD1-CZ 4.43Å; F42-F300 HydrophobicContact CD2-CB 4.41Å; F42-F300 AromaticContact CD2-CD1 3.72Å; F42-F300 HydrophobicContact CD2-CD1 3.72Å; F42-F300 VanDerWaalsContact CD2-O 3.31Å; F42-F300 WeakPolarHBondContact CD2-O 3.28Å; F42-F300 AromaticContact CE1-CD1 3.06Å; F42-F300 HydrophobicContact CE1-CD1 3.06Å; F42-F300 AromaticContact CE1-CE1 2.94Å; F42-F300 HydrophobicContact CE1-CE1 2.94Å; F42-F300 HydrophobicContact CE1-CG 4.31Å; F42-F300 HydrophobicContact CE1-CZ 4.12Å; F42-F300 AromaticContact CE2-CD1 3.51Å; F42-F300 HydrophobicContact CE2-CD1 3.51Å; F42-F300 HydrophobicContact CE2-CE1 4.11Å; F42-F300 WeakPolarHBondContact CE2-O 3.44Å; F42-F300 HydrophobicContact CG-CB 4.28Å; F42-F300 AromaticContact CG-CD1 3.52Å; F42-F300 HydrophobicContact CG-CD1 3.52Å; F42-F300 HydrophobicContact CG-CE1 4.23Å; F42-F300 HydrophobicContact CG-CG 4.22Å; F42-F300 AromaticContact CZ-CD1 3.23Å; F42-F300 HydrophobicContact CZ-CD1 3.23Å; F42-F300 AromaticContact CZ-CE1 3.33Å; F42-F300 HydrophobicContact CZ-CE1 3.33Å; F42-I301 HydrophobicContact CB-CG1 3.81Å; F42-I301 HydrophobicContact CD2-CG1 4.26Å; F42-F358 AromaticContact CD1-CD2 3.98Å; F42-F358 HydrophobicContact CD1-CD2 3.98Å; F42-F358 AromaticContact CD1-CE2 3.23Å; F42-F358 HydrophobicContact CD1-CE2 3.23Å; F42-F358 AromaticContact CD1-CZ 3.91Å; F42-F358 HydrophobicContact CD1-CZ 3.91Å; F42-F358 HydrophobicContact CE1-CD2 4.48Å; F42-F358 AromaticContact CE1-CE2 3.36Å; F42-F358 HydrophobicContact CE1-CE2 3.36Å; F42-F358 AromaticContact CE1-CZ 3.63Å; F42-F358 HydrophobicContact CE1-CZ 3.63Å; F42-F358 HydrophobicContact CG-CE2 4.49Å
43	S	35.9	Very low	36.6	Very low	16 Å²	16	33.9 Å²	33.9	11%	0.112	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-9.3	177.6	-83.7	0	0	0	0	115.4	V41 L45 Y46 T297 I301	V41-S43 PolarHBondContact O-N 2.83Å; S43-L45 PolarHBondContact O-N 3.5Å; S43-Y46 WeakPolarHBondContact O-CB 3.31Å; S43-Y46 PolarHBondContact O-N 2.99Å; S43-T297 WeakPolarHBondContact OG-CG2 3.29Å; S43-I301 WeakPolarHBondContact OG-CD1 3.31Å
44	A	39.8	Very low	36.5	Very low	13 Å²	13	38 Å²	38	11%	0.107	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-28.7	179.8	0	0	0	0	0	112.1	V41 I333 M344	V41-A44 HydrophobicContact CG1-CB 4.09Å; V41-A44 PolarHBondContact O-N 3.21Å; V41-A44 VanDerWaalsContact O-N 3.15Å; A44-I333 HydrophobicContact CB-CB 4.1Å; A44-I333 HydrophobicContact CB-CD1 4.01Å; A44-I333 HydrophobicContact CB-CG1 3.84Å; A44-I333 HydrophobicContact CB-CG2 3.39Å; A44-M344 HydrophobicContact CB-CE 3.28Å; A44-M344 HydrophobicContact CB-SD 3.59Å; A44-M344 VanDerWaalsContact CB-SD 3.59Å
45	L	39.7	Very low	36.3	Very low	3 Å²	3	42.3 Å²	42.3	2%	0.016	23%	0.233	C	C	.	.	H	α-helix	trans	-77.9	-39	-177.8	-139	88.6	0	0	0	113.8	S43 Y47 W48 L49 F291 I356 N357 F358	S43-L45 PolarHBondContact O-N 3.5Å; L45-Y47 PolarHBondContact O-N 3.31Å; L45-W48 PolarHBondContact O-N 3.41Å; L45-L49 HydrophobicContact CD2-CD1 4.23Å; L45-L49 VanDerWaalsContact O-CD1 3.31Å; L45-L49 WeakPolarHBondContact O-CD1 3.35Å; L45-F291 HydrophobicContact CD2-CD2 4.18Å; L45-I356 HydrophobicContact CD1-CG2 3.94Å; L45-N357 WeakPolarHBondContact CD1-O 3.46Å; L45-N357 HydrophobicContact CD2-CB 4.23Å; L45-F358 HydrophobicContact CD1-CB 4.4Å; L45-F358 HydrophobicContact CD2-CB 3.64Å; L45-F358 HydrophobicContact CG-CB 4.36Å
46	Y	35.1	Very low	35.8	Very low	30 Å²	30	50.8 Å²	50.8	12%	0.118	27%	0.27	C	S	.	.	H	α-helix	trans	-46	-34.7	-179.3	169.9	-141.2	0	0	0	111.6	S43 F291 K337	S43-Y46 WeakPolarHBondContact O-CB 3.31Å; S43-Y46 PolarHBondContact O-N 2.99Å; Y46-F291 WeakPolarHBondContact CD2-O 3.14Å; Y46-F291 VanDerWaalsContact CE2-O 3.23Å; Y46-F291 WeakPolarHBondContact CE2-O 3.4Å; Y46-K337 VanDerWaalsContact CE1-NZ 3.33Å
47	Y	40.6	Very low	35.3	Very low	44 Å²	44	55.7 Å²	55.7	17%	0.173	31%	0.311	C	S	.	.	H	α-helix	trans	-99.6	-29.3	-167.2	-160.2	-94.8	0	0	0	117.7	L45 L49 K50 S51 K337 N338	L45-Y47 PolarHBondContact O-N 3.31Å; Y47-L49 PolarHBondContact O-N 2.95Å; Y47-L49 VanDerWaalsContact O-N 3.12Å; Y47-K50 HydrophobicContact CD2-CB 3.85Å; Y47-K50 HydrophobicContact CD2-CD 4.5Å; Y47-K50 HydrophobicContact CD2-CG 4.48Å; Y47-K50 HydrophobicContact CE2-CB 3.96Å; Y47-K50 HydrophobicContact CE2-CD 4.26Å; Y47-K50 HydrophobicContact CE2-CG 4.17Å; Y47-K50 PolarHBondContact O-N 3.04Å; Y47-K50 VanDerWaalsContact O-N 3.09Å; Y47-S51 PolarHBondContact O-N 3.37Å; Y47-K337 HydrophobicContact CD1-CB 3.76Å; Y47-K337 HydrophobicContact CD1-CD 4.18Å; Y47-K337 HydrophobicContact CD1-CG 3.48Å; Y47-K337 VanDerWaalsContact CD1-CG 3.48Å; Y47-K337 WeakPolarHBondContact CD1-O 3.3Å; Y47-K337 HydrophobicContact CD2-CB 4.33Å; Y47-K337 HydrophobicContact CD2-CD 3.17Å; Y47-K337 HydrophobicContact CD2-CG 3.31Å; Y47-K337 HydrophobicContact CE1-CB 4.28Å; Y47-K337 HydrophobicContact CE1-CG 3.73Å; Y47-K337 WeakPolarHBondContact CE1-O 3.43Å; Y47-K337 HydrophobicContact CE2-CD 3.73Å; Y47-K337 HydrophobicContact CE2-CG 3.55Å; Y47-K337 HydrophobicContact CG-CB 3.73Å; Y47-K337 HydrophobicContact CG-CD 3.37Å; Y47-K337 HydrophobicContact CG-CG 3.2Å; Y47-N338 VanDerWaalsContact CE1-OD1 3.24Å; Y47-N338 WeakPolarHBondContact CE1-OD1 3.44Å; Y47-N338 PolarHBondContact OH-OD1 3.14Å
48	W	36.8	Very low	34.8	Very low	90 Å²	90	59.9 Å²	59.9	34%	0.341	34%	0.34	S	S	.	.	H	α-helix	trans	-60.5	-28.1	173.4	-167.8	73.7	0	0	0	110.9	L45 R52	L45-W48 PolarHBondContact O-N 3.41Å; W48-R52 PolarHBondContact O-N 3.16Å
49	L	38.9	Very low	34.5	Very low	30 Å²	30	64.3 Å²	64.3	16%	0.157	37%	0.368	C	S	.	.	H	α-helix	trans	-73.4	-41.2	174.9	-60.8	155.3	0	0	0	112.7	L45 Y47 S51 R52 S53 D288	L45-L49 HydrophobicContact CD2-CD1 4.23Å; L45-L49 VanDerWaalsContact O-CD1 3.31Å; L45-L49 WeakPolarHBondContact O-CD1 3.35Å; Y47-L49 PolarHBondContact O-N 2.95Å; Y47-L49 VanDerWaalsContact O-N 3.12Å; L49-S51 VanDerWaalsContact C-N 3.33Å; L49-S51 PolarHBondContact O-N 3.21Å; L49-R52 WeakPolarHBondContact O-CB 3.49Å; L49-R52 PolarHBondContact O-N 3.33Å; L49-R52 VanDerWaalsContact O-N 3.1Å; L49-S53 PolarHBondContact O-N 3.02Å; L49-D288 HydrophobicContact CD1-CB 3.61Å; L49-D288 WeakPolarHBondContact CD1-OD1 3.5Å; L49-D288 HydrophobicContact CD2-CB 4.15Å; L49-D288 WeakPolarHBondContact CD2-OD2 3.47Å; L49-D288 HydrophobicContact CG-CB 4.42Å
50	K	40.8	Very low	34.3	Very low	106 Å²	106	72.7 Å²	72.7	46%	0.461	41%	0.412	S	S	.	.	H	α-helix	trans	-68.8	-29.3	177.1	-167.4	161.6	-175.5	166.1	0	113.3	Y47 R52 S53	Y47-K50 HydrophobicContact CD2-CB 3.85Å; Y47-K50 HydrophobicContact CD2-CD 4.5Å; Y47-K50 HydrophobicContact CD2-CG 4.48Å; Y47-K50 HydrophobicContact CE2-CB 3.96Å; Y47-K50 HydrophobicContact CE2-CD 4.26Å; Y47-K50 HydrophobicContact CE2-CG 4.17Å; Y47-K50 PolarHBondContact O-N 3.04Å; Y47-K50 VanDerWaalsContact O-N 3.09Å; K50-R52 VanDerWaalsContact C-N 3.28Å; K50-R52 PolarHBondContact O-N 3.09Å; K50-S53 PolarHBondContact O-N 2.92Å
51	S	37	Very low	33.8	Very low	63 Å²	63	81 Å²	81	44%	0.441	45%	0.45	S	S	.	.	H	α-helix	trans	-70.1	-26.9	172	-159.2	0	0	0	0	112.3	Y47 L49 S54	Y47-S51 PolarHBondContact O-N 3.37Å; L49-S51 VanDerWaalsContact C-N 3.33Å; L49-S51 PolarHBondContact O-N 3.21Å; S51-S54 PolarHBondContact O-N 3.26Å
52	R	32.2	Very low	33.1	Very low	161 Å²	161	85.7 Å²	85.7	61%	0.608	48%	0.483	S	S	*	.	H	α-helix	trans	-76.3	-27	176.4	-144.2	175.6	-179.7	-169.9	-0.7	113.3	W48 L49 K50 S54	W48-R52 PolarHBondContact O-N 3.16Å; L49-R52 WeakPolarHBondContact O-CB 3.49Å; L49-R52 PolarHBondContact O-N 3.33Å; L49-R52 VanDerWaalsContact O-N 3.1Å; K50-R52 VanDerWaalsContact C-N 3.28Å; K50-R52 PolarHBondContact O-N 3.09Å; R52-S54 PolarHBondContact O-N 2.61Å
53	S	35.8	Very low	32.2	Very low	101 Å²	101	94.8 Å²	94.8	71%	0.706	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-18.3	173.4	-178	0	0	0	0	113.5	L49 K50	L49-S53 PolarHBondContact O-N 3.02Å; K50-S53 PolarHBondContact O-N 2.92Å
54	S	31.9	Very low	31.7	Very low	104 Å²	104	99.1 Å²	99.1	73%	0.727	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-3.2	-178.8	-163.9	0	0	0	0	114.1	S51 R52	S51-S54 PolarHBondContact O-N 3.26Å; R52-S54 PolarHBondContact O-N 2.61Å
55	S	30.5	Very low	31.2	Very low	95 Å²	95	105.1 Å²	105.1	66%	0.664	59%	0.586	S	S	*	*	S	Bend	trans	-124.6	10.6	-172.5	-51.1	0	0	0	0	115.3
56	K	25.9	Very low	30.7	Very low	178 Å²	178	107.9 Å²	107.9	77%	0.774	62%	0.616	S	S	*	*			trans	-132	59.7	165.8	-78.1	-170.6	177.2	-173.8	0	111.4
57	A	24.5	Very low	30.6	Very low	104 Å²	104	112.2 Å²	112.2	86%	0.86	64%	0.641	S	S	*	*			trans	-99.1	72.8	153.7	0	0	0	0	0	107.9
58	S	26.1	Very low	30.3	Very low	93 Å²	93	116.8 Å²	116.8	65%	0.65	67%	0.668	S	S	*	*	S	Bend	trans	-151	103.6	166.3	61.7	0	0	0	0	109.4
59	S	24.8	Very low	30.4	Very low	108 Å²	108	118.9 Å²	118.9	76%	0.755	69%	0.685	S	S	*	*			trans	45.1	94.9	158.1	67.5	0	0	0	0	117.5
60	L	28.1	Very low	30.7	Very low	180 Å²	180	122.4 Å²	122.4	94%	0.942	70%	0.704	S	S	*	*			trans	-124.2	108.4	135.7	-96.3	162.8	0	0	0	106.7	S62	L60-S62 PolarHBondContact O-N 3.47Å
61	H	24.1	Very low	30.6	Very low	175 Å²	175	121.3 Å²	121.3	81%	0.81	70%	0.703	S	S	*	*			trans	-58.3	133.8	172.1	-109.8	-83.2	0	0	0	108.6	E63	H61-E63 PolarHBondContact O-N 2.9Å
62	S	22.5	Very low	31	Very low	100 Å²	100	123.2 Å²	123.2	70%	0.699	71%	0.708	S	S	*	*			trans	-45.4	106.4	159.7	-177.8	0	0	0	0	109.3	L60 V64	L60-S62 PolarHBondContact O-N 3.47Å; S62-V64 WeakPolarHBondContact OG-CG2 3.46Å
63	E	25.1	Very low	31.9	Very low	196 Å²	196	119.5 Å²	119.5	92%	0.916	70%	0.703	S	S	*	*			trans	-103	115.2	158.7	-159.5	164.4	-158.5	0	0	106.7	H61	H61-E63 PolarHBondContact O-N 2.9Å
64	V	26.3	Very low	32.3	Very low	108 Å²	108	117.3 Å²	117.3	66%	0.655	68%	0.684	S	S	*	*			trans	-89	133	-167	163.4	0	0	0	0	108.5	S62	S62-V64 WeakPolarHBondContact OG-CG2 3.46Å
65	V	28.9	Very low	33.3	Very low	139 Å²	139	113.8 Å²	113.8	84%	0.842	66%	0.657	S	S	*	*			trans	49.1	91.8	148.6	-174	0	0	0	0	116.1
66	G	29.7	Very low	34	Very low	61 Å²	61	114.4 Å²	114.4	63%	0.629	65%	0.654	S	S	*	*			trans	-146	141.6	151.1	0	0	0	0	0	107.4
67	D	31.7	Very low	35.1	Very low	121 Å²	121	109.1 Å²	109.1	65%	0.647	64%	0.636	S	S	*	*			trans	93.1	30.3	170	-48.1	-15.6	0	0	0	118.3	D69 D70	D67-D69 VanDerWaalsContact C-N 3.34Å; D67-D70 HydrophobicContact CB-CB 4.29Å
68	L	34.4	Very low	36.1	Very low	140 Å²	140	105.1 Å²	105.1	73%	0.733	60%	0.603	S	S	*	*	H	α-helix	trans	-71.2	-30.2	159.8	-123.7	80.8	0	0	0	112.3	L71 D72	L68-L71 PolarHBondContact O-N 2.98Å; L68-D72 PolarHBondContact O-N 3.41Å
69	D	39	Very low	36.9	Very low	133 Å²	133	103.2 Å²	103.2	71%	0.711	59%	0.585	S	S	*	*	H	α-helix	trans	-72.5	-31.1	-179.8	-71.5	-29.7	0	0	0	112.9	D67 L71 T73	D67-D69 VanDerWaalsContact C-N 3.34Å; D69-L71 VanDerWaalsContact C-N 3.35Å; D69-T73 PolarHBondContact O-N 3.45Å; D69-T73 PolarHBondContact O-OG1 3.35Å
70	D	45.3	Very low	37.7	Very low	104 Å²	104	105.6 Å²	105.6	56%	0.556	58%	0.579	S	S	*	*	H	α-helix	trans	-71.7	-31.6	175.2	-89.1	-10	0	0	0	111.6	D67 T73 L74	D67-D70 HydrophobicContact CB-CB 4.29Å; D70-T73 PolarHBondContact O-N 3.15Å; D70-L74 WeakPolarHBondContact O-CB 3.3Å; D70-L74 PolarHBondContact O-N 2.9Å
71	L	39.5	Very low	38.1	Very low	84 Å²	84	102.8 Å²	102.8	44%	0.44	56%	0.557	S	S	.	*	H	α-helix	trans	-67.1	-44.6	177.4	-168.1	67.5	0	0	0	111.6	L68 D69 T73 L74 V75 V241	L68-L71 PolarHBondContact O-N 2.98Å; D69-L71 VanDerWaalsContact C-N 3.35Å; L71-T73 VanDerWaalsContact C-N 3.32Å; L71-T73 PolarHBondContact O-N 3.19Å; L71-L74 PolarHBondContact O-N 3.23Å; L71-V75 HydrophobicContact CG-CG2 4.49Å; L71-V75 VanDerWaalsContact O-CB 3.3Å; L71-V75 WeakPolarHBondContact O-CB 3.1Å; L71-V75 WeakPolarHBondContact O-CG2 3.38Å; L71-V75 PolarHBondContact O-N 2.8Å; L71-V241 HydrophobicContact CD1-CG1 3.4Å
72	D	44.7	Very low	38.9	Very low	103 Å²	103	97.2 Å²	97.2	55%	0.551	54%	0.537	S	S	*	.	H	α-helix	trans	-64.9	-37.8	176.1	-83.5	-18	0	0	0	111.7	L68 N76	L68-D72 PolarHBondContact O-N 3.41Å; D72-N76 WeakPolarHBondContact O-CB 2.96Å; D72-N76 VanDerWaalsContact O-CG 3.28Å; D72-N76 PolarHBondContact O-N 3.33Å; D72-N76 PolarHBondContact O-ND2 3.08Å
73	T	51.8	Low	39.6	Very low	82 Å²	82	99 Å²	99	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-65.8	-45.2	176.2	-53.2	0	0	0	0	111.2	D69 D70 L71 N76 V77	D69-T73 PolarHBondContact O-N 3.45Å; D69-T73 PolarHBondContact O-OG1 3.35Å; D70-T73 PolarHBondContact O-N 3.15Å; L71-T73 VanDerWaalsContact C-N 3.32Å; L71-T73 PolarHBondContact O-N 3.19Å; T73-N76 PolarHBondContact O-N 3.32Å; T73-V77 WeakPolarHBondContact O-CG2 3.28Å; T73-V77 PolarHBondContact O-N 3.49Å; T73-V77 VanDerWaalsContact O-N 3.08Å
74	L	43.6	Very low	40.1	Very low	56 Å²	56	92 Å²	92	29%	0.293	51%	0.505	S	S	.	.	H	α-helix	trans	-67.5	-36.9	178.5	-159.6	75.7	0	0	0	111.9	D70 L71 V77 A78 V241	D70-L74 WeakPolarHBondContact O-CB 3.3Å; D70-L74 PolarHBondContact O-N 2.9Å; L71-L74 PolarHBondContact O-N 3.23Å; L74-V77 PolarHBondContact O-N 3.2Å; L74-A78 WeakPolarHBondContact O-CB 3.47Å; L74-A78 PolarHBondContact O-N 2.95Å; L74-V241 HydrophobicContact CD2-CB 4.2Å; L74-V241 HydrophobicContact CD2-CG1 3.86Å; L74-V241 HydrophobicContact CD2-CG2 3.22Å; L74-V241 HydrophobicContact CG-CG1 4.45Å; L74-V241 HydrophobicContact CG-CG2 3.8Å
75	V	52.3	Low	40.4	Very low	29 Å²	29	93.6 Å²	93.6	18%	0.176	50%	0.503	C	S	.	.	H	α-helix	trans	-63.9	-43.8	174.4	168.2	0	0	0	0	111.1	L71 V77 A78 D79 V241	L71-V75 HydrophobicContact CG-CG2 4.49Å; L71-V75 VanDerWaalsContact O-CB 3.3Å; L71-V75 WeakPolarHBondContact O-CB 3.1Å; L71-V75 WeakPolarHBondContact O-CG2 3.38Å; L71-V75 PolarHBondContact O-N 2.8Å; V75-V77 VanDerWaalsContact C-N 3.34Å; V75-V77 PolarHBondContact O-N 3.23Å; V75-A78 PolarHBondContact O-N 3.35Å; V75-D79 WeakPolarHBondContact O-CB 3.22Å; V75-D79 PolarHBondContact O-N 2.91Å; V75-V241 HydrophobicContact CG2-CG1 4.04Å
76	N	46.5	Very low	40.6	Very low	109 Å²	109	94.6 Å²	94.6	58%	0.583	50%	0.503	S	S	*	.	H	α-helix	trans	-65.1	-36.5	177	-75.3	-43.4	0	0	0	112.5	D72 T73 Y80	D72-N76 WeakPolarHBondContact O-CB 2.96Å; D72-N76 VanDerWaalsContact O-CG 3.28Å; D72-N76 PolarHBondContact O-N 3.33Å; D72-N76 PolarHBondContact O-ND2 3.08Å; T73-N76 PolarHBondContact O-N 3.32Å; N76-Y80 PolarHBondContact O-N 2.85Å
77	V	49.2	Very low	40.7	Very low	67 Å²	67	96.3 Å²	96.3	41%	0.406	51%	0.506	S	S	.	.	H	α-helix	trans	-69.1	-43.2	175.1	174.1	0	0	0	0	111	T73 L74 V75 D79 Y80 Y81	T73-V77 WeakPolarHBondContact O-CG2 3.28Å; T73-V77 PolarHBondContact O-N 3.49Å; T73-V77 VanDerWaalsContact O-N 3.08Å; L74-V77 PolarHBondContact O-N 3.2Å; V75-V77 VanDerWaalsContact C-N 3.34Å; V75-V77 PolarHBondContact O-N 3.23Å; V77-D79 VanDerWaalsContact C-N 3.33Å; V77-D79 PolarHBondContact O-N 2.92Å; V77-Y80 WeakPolarHBondContact O-CB 3.19Å; V77-Y80 PolarHBondContact O-N 2.87Å; V77-Y81 HydrophobicContact CG1-CD2 3.73Å; V77-Y81 HydrophobicContact CG1-CE2 3.58Å; V77-Y81 WeakPolarHBondContact O-CD2 3.42Å; V77-Y81 PolarHBondContact O-N 3.42Å; V77-Y81 VanDerWaalsContact O-N 3.08Å
78	A	45.2	Very low	40.5	Very low	19 Å²	19	94.2 Å²	94.2	16%	0.157	50%	0.5	C	S	.	.	H	α-helix	trans	-63.5	-35.9	176.3	0	0	0	0	0	112.7	L74 V75 Y80 Y81 S82	L74-A78 WeakPolarHBondContact O-CB 3.47Å; L74-A78 PolarHBondContact O-N 2.95Å; V75-A78 PolarHBondContact O-N 3.35Å; A78-Y80 VanDerWaalsContact C-N 3.32Å; A78-Y80 PolarHBondContact O-N 3.37Å; A78-Y81 PolarHBondContact O-N 3.44Å; A78-S82 WeakPolarHBondContact O-CB 3.42Å; A78-S82 PolarHBondContact O-N 3.2Å; A78-S82 PolarHBondContact O-OG 3.4Å
79	D	42.2	Very low	40.1	Very low	53 Å²	53	95.2 Å²	95.2	28%	0.283	51%	0.506	S	S	.	.	H	α-helix	trans	-67.3	-31.6	175.1	-78.3	2.4	0	0	0	112.7	V75 V77 S82 Q83 R242	V75-D79 WeakPolarHBondContact O-CB 3.22Å; V75-D79 PolarHBondContact O-N 2.91Å; V77-D79 VanDerWaalsContact C-N 3.33Å; V77-D79 PolarHBondContact O-N 2.92Å; D79-S82 WeakPolarHBondContact CA-OG 3.32Å; D79-S82 PolarHBondContact O-OG 2.97Å; D79-Q83 VanDerWaalsContact O-CG 3.31Å; D79-Q83 WeakPolarHBondContact O-CG 3.44Å; D79-Q83 PolarHBondContact O-N 3.35Å; D79-Q83 PolarHBondContact O-NE2 3.46Å; D79-Q83 VanDerWaalsContact O-NE2 3.15Å; D79-R242 IonicContact OD1-CZ 3.45Å; D79-R242 IonicContact OD1-NE 2.82Å; D79-R242 IonicContact OD1-NH2 3.31Å; D79-R242 PolarHBondContact OD1-NH2 3.01Å; D79-R242 IonicContact OD2-NH2 3.49Å; D79-R242 PolarHBondContact OD2-NH2 2.82Å
80	Y	41.8	Very low	39.5	Very low	158 Å²	158	100 Å²	100	62%	0.62	51%	0.514	S	S	*	.	H	α-helix	trans	-71	-41.2	172.7	-174.9	-100.4	0	0	0	111.7	N76 V77 A78 T84	N76-Y80 PolarHBondContact O-N 2.85Å; V77-Y80 WeakPolarHBondContact O-CB 3.19Å; V77-Y80 PolarHBondContact O-N 2.87Å; A78-Y80 VanDerWaalsContact C-N 3.32Å; A78-Y80 PolarHBondContact O-N 3.37Å; Y80-T84 HydrophobicContact CE1-CG2 4.34Å; Y80-T84 WeakPolarHBondContact O-CG2 3.46Å; Y80-T84 PolarHBondContact O-N 3.48Å; Y80-T84 PolarHBondContact O-OG1 3.24Å
81	Y	36	Very low	38.7	Very low	122 Å²	122	100.5 Å²	100.5	48%	0.478	53%	0.526	S	S	.	.	H	α-helix	trans	-73.5	-34.4	178.9	-78.8	-70.5	0	0	0	114	V77 A78 Q83 T84 K85	V77-Y81 HydrophobicContact CG1-CD2 3.73Å; V77-Y81 HydrophobicContact CG1-CE2 3.58Å; V77-Y81 WeakPolarHBondContact O-CD2 3.42Å; V77-Y81 PolarHBondContact O-N 3.42Å; V77-Y81 VanDerWaalsContact O-N 3.08Å; A78-Y81 PolarHBondContact O-N 3.44Å; Y81-Q83 VanDerWaalsContact C-N 3.34Å; Y81-T84 WeakPolarHBondContact CA-OG1 3.34Å; Y81-T84 PolarHBondContact O-N 3.4Å; Y81-T84 PolarHBondContact O-OG1 2.91Å; Y81-K85 PolarHBondContact O-N 2.88Å
82	S	42.1	Very low	38.1	Very low	58 Å²	58	101.6 Å²	101.6	41%	0.406	55%	0.547	S	S	.	.	H	α-helix	trans	-68.5	-33	174.7	47.9	0	0	0	0	112.5	A78 D79	A78-S82 WeakPolarHBondContact O-CB 3.42Å; A78-S82 PolarHBondContact O-N 3.2Å; A78-S82 PolarHBondContact O-OG 3.4Å; D79-S82 WeakPolarHBondContact CA-OG 3.32Å; D79-S82 PolarHBondContact O-OG 2.97Å
83	Q	35.8	Very low	37.1	Very low	138 Å²	138	108.5 Å²	108.5	65%	0.645	57%	0.566	S	S	*	*	H	α-helix	trans	-70.7	-34.2	172	-74.1	177.8	62.5	0	0	113	D79 Y81 L86	D79-Q83 VanDerWaalsContact O-CG 3.31Å; D79-Q83 WeakPolarHBondContact O-CG 3.44Å; D79-Q83 PolarHBondContact O-N 3.35Å; D79-Q83 PolarHBondContact O-NE2 3.46Å; D79-Q83 VanDerWaalsContact O-NE2 3.15Å; Y81-Q83 VanDerWaalsContact C-N 3.34Å; Q83-L86 PolarHBondContact O-N 3.45Å
84	T	36.1	Very low	35.9	Very low	49 Å²	49	109.4 Å²	109.4	30%	0.301	58%	0.575	S	S	.	*	H	α-helix	trans	-73.4	-31.6	179.8	51.2	0	0	0	0	112.8	Y80 Y81 L86 S87 S88	Y80-T84 HydrophobicContact CE1-CG2 4.34Å; Y80-T84 WeakPolarHBondContact O-CG2 3.46Å; Y80-T84 PolarHBondContact O-N 3.48Å; Y80-T84 PolarHBondContact O-OG1 3.24Å; Y81-T84 WeakPolarHBondContact CA-OG1 3.34Å; Y81-T84 PolarHBondContact O-N 3.4Å; Y81-T84 PolarHBondContact O-OG1 2.91Å; T84-L86 VanDerWaalsContact C-N 3.25Å; T84-L86 PolarHBondContact O-N 2.81Å; T84-S87 PolarHBondContact O-N 2.88Å; T84-S87 PolarHBondContact O-OG 3.19Å; T84-S88 PolarHBondContact O-N 3.08Å
85	K	33.6	Very low	35.2	Very low	141 Å²	141	113.9 Å²	113.9	61%	0.613	60%	0.604	S	S	*	*	H	α-helix	trans	-64.3	-24.1	173.6	-119.6	-179	-177.7	-178.8	0	113.8	Y81 S87	Y81-K85 PolarHBondContact O-N 2.88Å; K85-S87 VanDerWaalsContact C-N 3.26Å; K85-S87 PolarHBondContact O-N 3.33Å
86	L	32.4	Very low	33.8	Very low	160 Å²	160	120.5 Å²	120.5	84%	0.838	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-15.1	171.6	-83	154.5	0	0	0	113.3	Q83 T84	Q83-L86 PolarHBondContact O-N 3.45Å; T84-L86 VanDerWaalsContact C-N 3.25Å; T84-L86 PolarHBondContact O-N 2.81Å
87	S	31.9	Very low	32.8	Very low	97 Å²	97	120.8 Å²	120.8	68%	0.678	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	-13.4	-179.5	71.6	0	0	0	0	114.5	T84 K85	T84-S87 PolarHBondContact O-N 2.88Å; T84-S87 PolarHBondContact O-OG 3.19Å; K85-S87 VanDerWaalsContact C-N 3.26Å; K85-S87 PolarHBondContact O-N 3.33Å
88	S	26.7	Very low	31.6	Very low	76 Å²	76	129.6 Å²	129.6	53%	0.531	68%	0.675	S	S	.	*			trans	-108.7	47.7	-173.8	74.5	0	0	0	0	113.7	T84 R90	T84-S88 PolarHBondContact O-N 3.08Å; S88-R90 VanDerWaalsContact C-N 3.33Å
89	N	25.7	Very low	30.5	Very low	161 Å²	161	134.6 Å²	134.6	86%	0.861	70%	0.704	S	S	*	*			trans	-98.5	57.7	160.6	-88.7	-15.6	0	0	0	110.2
90	R	27.3	Very low	30	Very low	234 Å²	234	137.6 Å²	137.6	88%	0.883	73%	0.728	S	S	*	*	S	Bend	trans	-120.2	112.1	162.3	-91.2	-175.1	178.1	175	1	108.6	S88	S88-R90 VanDerWaalsContact C-N 3.33Å
91	S	28.4	Very low	29.1	Very low	114 Å²	114	137.2 Å²	137.2	80%	0.797	74%	0.737	S	S	*	*			trans	72.9	86.7	157.4	-171.8	0	0	0	0	117.6
92	A	27.2	Very low	28.7	Very low	108 Å²	108	139.3 Å²	139.3	89%	0.893	76%	0.756	S	S	*	*			trans	-140.8	53.9	146.4	0	0	0	0	0	110.3
93	R	23.2	Very low	27.9	Very low	248 Å²	248	140.5 Å²	140.5	94%	0.936	76%	0.764	S	S	*	*			trans	-112.5	76.6	166.2	-167.1	-177.7	-169.5	-177.8	4.4	108.1
94	S	26.6	Very low	27.3	Very low	101 Å²	101	142.7 Å²	142.7	71%	0.706	78%	0.775	S	S	*	*			trans	-166.9	60.8	167.4	67.2	0	0	0	0	113.3
95	V	28	Very low	26.8	Very low	149 Å²	149	147.9 Å²	147.9	90%	0.903	80%	0.801	S	S	*	*			trans	-140.3	54.4	153.4	-161.9	0	0	0	0	109.8
96	L	23.4	Very low	26.3	Very low	168 Å²	168	149 Å²	149	88%	0.88	81%	0.808	S	S	*	*			trans	-109.6	110.5	143.3	-98.3	92.8	0	0	0	105.5
97	S	25.4	Very low	26	Very low	116 Å²	116	149 Å²	149	81%	0.811	81%	0.808	S	S	*	*			trans	164.9	83.1	151	-74.5	0	0	0	0	109.1
98	R	24.8	Very low	25.7	Very low	251 Å²	251	149.6 Å²	149.6	95%	0.947	81%	0.807	S	S	*	*			trans	-140.8	86.9	149.5	-120.7	174.4	174.6	157	-2	109.2
99	T	22.9	Very low	25.5	Very low	125 Å²	125	153.9 Å²	153.9	77%	0.767	82%	0.823	S	S	*	*			trans	-58.1	137.8	157.4	51.6	0	0	0	0	110.2
100	S	29.8	Very low	25.6	Very low	115 Å²	115	152.1 Å²	152.1	80%	0.804	82%	0.823	S	S	*	*			trans	-150.9	102.9	137.4	57.8	0	0	0	0	108.8
101	N	22.8	Very low	25.3	Very low	151 Å²	151	151.6 Å²	151.6	81%	0.807	82%	0.821	S	S	*	*			trans	-54.5	133.2	161.5	-60.1	-30.3	0	0	0	109.3
102	L	28.2	Very low	25.2	Very low	165 Å²	165	151 Å²	151	86%	0.864	82%	0.817	S	S	*	*			trans	-142.4	108.9	152.1	-139	95.3	0	0	0	110.9
103	S	26.5	Very low	25.1	Very low	84 Å²	84	156.7 Å²	156.7	59%	0.587	82%	0.815	S	S	*	*			trans	45.7	103.1	152.4	71.8	0	0	0	0	120	N105	S103-N105 PolarHBondContact O-N 3.41Å
104	E	22.2	Very low	25.2	Very low	184 Å²	184	155 Å²	155	86%	0.86	82%	0.815	S	S	*	*				-18.8	113.4	128.3	-61	174.5	160.2	0	0	114
105	N	26.8	Very low	25.2	Very low	158 Å²	158	154.8 Å²	154.8	85%	0.845	81%	0.814	S	S	*	*			trans	-113.3	102.8	156.9	-88.9	-25.9	0	0	0	108.5	S103	S103-N105 PolarHBondContact O-N 3.41Å
106	H	22.1	Very low	25.2	Very low	165 Å²	165	153.2 Å²	153.2	76%	0.764	81%	0.809	S	S	*	*			trans	-91.4	98.2	-177	-156.4	-74.2	0	0	0	108.3
107	L	26	Very low	25.5	Very low	160 Å²	160	152.2 Å²	152.2	84%	0.838	80%	0.804	S	S	*	*			trans	-143.1	85.4	167.2	-75.5	179.5	0	0	0	112.4
108	T	25.2	Very low	25.4	Very low	108 Å²	108	154 Å²	154	66%	0.663	80%	0.803	S	S	*	*				40.1	97.5	127.6	62.1	0	0	0	0	119.4	S110	T108-S110 PolarHBondContact O-N 3.02Å
109	L	23.3	Very low	25.6	Very low	167 Å²	167	147.3 Å²	147.3	87%	0.874	79%	0.794	S	S	*	*				14.2	88.7	123.2	-157.1	76.7	0	0	0	117.3	R111	L109-R111 PolarHBondContact O-N 3.05Å
110	S	26.6	Very low	25.7	Very low	123 Å²	123	146.6 Å²	146.6	86%	0.86	79%	0.789	S	S	*	*			trans	-93.5	84.7	159.6	43.7	0	0	0	0	110.4	T108 S112	T108-S110 PolarHBondContact O-N 3.02Å; S110-S112 PolarHBondContact O-N 3.37Å
111	R	21.7	Very low	25.4	Very low	223 Å²	223	147.5 Å²	147.5	84%	0.842	79%	0.79	S	S	*	*			trans	-75.5	109.5	159.7	172.1	179.1	165	168.7	-4.1	108.6	L109	L109-R111 PolarHBondContact O-N 3.05Å
112	S	26.8	Very low	25.6	Very low	101 Å²	101	147.5 Å²	147.5	71%	0.706	79%	0.79	S	S	*	*			trans	-176.3	139.8	155.6	-87.5	0	0	0	0	108.1	S110	S110-S112 PolarHBondContact O-N 3.37Å
113	R	25.2	Very low	25.4	Very low	228 Å²	228	147.5 Å²	147.5	86%	0.86	79%	0.791	S	S	*	*			cis	-166.4	138.3	-11.5	-122.4	172.5	177.7	162.5	-1	101.8	S115	R113-S115 PolarHBondContact O-N 3.29Å
114	K	23.9	Very low	25.6	Very low	214 Å²	214	148.1 Å²	148.1	93%	0.93	80%	0.796	S	S	*	*			trans	-50.5	110.7	167.4	-71.1	176.1	173.1	-178.6	0	109.1
115	S	28.5	Very low	26	Very low	96 Å²	96	147 Å²	147	67%	0.671	80%	0.795	S	S	*	*			trans	-99.4	96.8	162.2	56.5	0	0	0	0	107.6	R113 L117	R113-S115 PolarHBondContact O-N 3.29Å; S115-L117 PolarHBondContact O-N 2.94Å
116	S	27.9	Very low	26.1	Very low	116 Å²	116	146 Å²	146	81%	0.811	80%	0.795	S	S	*	*			trans	-57.1	98.8	160.6	47.8	0	0	0	0	109.3	L118	S116-L118 PolarHBondContact O-N 3.4Å
117	L	29.7	Very low	26.5	Very low	147 Å²	147	145.9 Å²	145.9	77%	0.77	80%	0.8	S	S	*	*			trans	-90.3	89.2	165.3	-95.1	135.3	0	0	0	108	S115 C119	S115-L117 PolarHBondContact O-N 2.94Å; L117-C119 PolarHBondContact O-N 3.2Å
118	L	22.9	Very low	26.5	Very low	153 Å²	153	141.5 Å²	141.5	80%	0.801	79%	0.793	S	S	*	*			trans	-74	105.7	160	-158	87	0	0	0	106.2	S116 T120	S116-L118 PolarHBondContact O-N 3.4Å; L118-T120 HydrophobicContact CD2-CG2 4.48Å
119	C	28.1	Very low	27	Very low	110 Å²	110	142.7 Å²	142.7	74%	0.743	81%	0.806	S	S	*	*			trans	-107.5	97.4	167.5	-83.9	0	0	0	0	108.5	L117	L117-C119 PolarHBondContact O-N 3.2Å
120	T	24.6	Very low	27.4	Very low	110 Å²	110	140 Å²	140	68%	0.675	80%	0.8	S	S	*	*			trans	-59.8	129	164.6	46.1	0	0	0	0	110	L118 N122	L118-T120 HydrophobicContact CD2-CG2 4.48Å; T120-N122 PolarHBondContact O-N 3.45Å
121	T	24.2	Very low	28.1	Very low	134 Å²	134	139.8 Å²	139.8	82%	0.822	80%	0.799	S	S	*	*			trans	-62.4	112.2	171.2	47.6	0	0	0	0	110.3
122	N	26.6	Very low	29.2	Very low	151 Å²	151	132.4 Å²	132.4	81%	0.807	79%	0.791	S	S	*	*			trans	-114.9	113.4	158.5	-84.4	-1	0	0	0	108.8	T120	T120-N122 PolarHBondContact O-N 3.45Å
123	D	24.7	Very low	30.1	Very low	166 Å²	166	133 Å²	133	89%	0.888	79%	0.786	S	S	*	*			trans	-46.4	126.4	159.4	-118.6	-25.7	0	0	0	111.3
124	S	30.9	Very low	32.3	Very low	97 Å²	97	124.3 Å²	124.3	68%	0.678	76%	0.757	S	S	*	*			trans	-176.6	121.1	144.9	51.6	0	0	0	0	110.8
125	D	30	Very low	34.7	Very low	160 Å²	160	122.3 Å²	122.3	86%	0.856	75%	0.745	S	S	*	*			trans	75.8	96	150.6	-55.3	-26	0	0	0	119.5	D127	D125-D127 PolarHBondContact O-N 3.25Å
126	V	29.9	Very low	36.5	Very low	138 Å²	138	124.4 Å²	124.4	84%	0.836	74%	0.738	S	S	*	*			trans	-54.7	114.3	154.6	176.4	0	0	0	0	109.9
127	D	29.7	Very low	38.6	Very low	162 Å²	162	124.9 Å²	124.9	87%	0.866	73%	0.725	S	S	*	*			trans	-156.3	116.4	146	-100.5	-24.6	0	0	0	111.9	D125	D125-D127 PolarHBondContact O-N 3.25Å
128	G	27.1	Very low	40.8	Very low	68 Å²	68	123 Å²	123	70%	0.701	72%	0.715	S	S	*	*	S	Bend	trans	51.4	103.3	139.1	0	0	0	0	0	120.5
129	S	34	Very low	43.4	Very low	133 Å²	133	117.6 Å²	117.6	93%	0.93	70%	0.697	S	S	*	*			trans	78.9	61.7	149.6	-55.3	0	0	0	0	117.8
130	C	33	Very low	45.7	Very low	110 Å²	110	114.4 Å²	114.4	74%	0.743	67%	0.672	S	S	*	*			trans	-98.3	114.8	154.6	-168.5	0	0	0	0	108.8	G132	C130-G132 PolarHBondContact O-N 3.25Å
131	S	40.7	Very low	48.1	Very low	119 Å²	119	116.2 Å²	116.2	83%	0.832	67%	0.672	S	S	*	*			trans	-61.7	104.3	176.7	51.3	0	0	0	0	110.4
132	G	45.2	Very low	50.8	Low	67 Å²	67	112.6 Å²	112.6	69%	0.691	66%	0.657	S	S	*	*			trans	68.8	69.2	155.8	0	0	0	0	0	116.2	C130 D134	C130-G132 PolarHBondContact O-N 3.25Å; G132-D134 PolarHBondContact O-N 3.11Å
133	L	45.8	Very low	53.3	Low	114 Å²	114	106.6 Å²	106.6	60%	0.597	62%	0.624	S	S	*	*			trans	-54	111.2	151	-91.3	154.1	0	0	0	107.9	Y135	L133-Y135 VanDerWaalsContact C-N 3.25Å; L133-Y135 HydrophobicContact CB-CE2 4.3Å; L133-Y135 WeakPolarHBondContact O-CD2 2.85Å; L133-Y135 PolarHBondContact O-N 2.81Å
134	D	70.2	Confident	55.8	Low	45 Å²	45	100.1 Å²	100.1	24%	0.241	59%	0.594	C	S	.	*			trans	-74.8	82.7	178	-173	-10.4	0	0	0	109.1	G132 R136 K137 L138	G132-D134 PolarHBondContact O-N 3.11Å; D134-R136 PolarHBondContact O-N 2.67Å; D134-R136 WeakPolarHBondContact OD1-CB 3.45Å; D134-R136 PolarHBondContact OD1-N 2.77Å; D134-R136 VanDerWaalsContact OD1-N 3.15Å; D134-K137 HydrophobicContact CB-CB 4.3Å; D134-K137 HydrophobicContact CB-CD 4.36Å; D134-K137 PolarHBondContact O-N 2.8Å; D134-K137 VanDerWaalsContact O-N 3.1Å; D134-K137 PolarHBondContact OD1-N 3.34Å; D134-K137 WeakPolarHBondContact OD2-CD 3.49Å; D134-K137 WeakPolarHBondContact OD2-CE 3.43Å; D134-K137 VanDerWaalsContact OD2-CG 3.28Å; D134-K137 WeakPolarHBondContact OD2-CG 3.48Å; D134-K137 IonicContact OD2-NZ 3.6Å; D134-L138 PolarHBondContact O-N 2.87Å
135	Y	74.7	Confident	58	Low	173 Å²	173	96.5 Å²	96.5	68%	0.678	57%	0.572	S	S	*	*	H	α-helix	trans	-52.5	-25.1	178.1	-66.9	-77.8	0	0	0	112.7	L133 G139	L133-Y135 VanDerWaalsContact C-N 3.25Å; L133-Y135 HydrophobicContact CB-CE2 4.3Å; L133-Y135 WeakPolarHBondContact O-CD2 2.85Å; L133-Y135 PolarHBondContact O-N 2.81Å; Y135-G139 PolarHBondContact O-N 3.19Å
136	R	67.5	Low	60.5	Low	140 Å²	140	92.1 Å²	92.1	53%	0.528	55%	0.551	S	S	.	*	H	α-helix	trans	-74.8	-44.8	179	-59.4	-177.8	-179	173.2	4.9	111.6	D134 G139 L140 D200	D134-R136 PolarHBondContact O-N 2.67Å; D134-R136 WeakPolarHBondContact OD1-CB 3.45Å; D134-R136 PolarHBondContact OD1-N 2.77Å; D134-R136 VanDerWaalsContact OD1-N 3.15Å; R136-G139 PolarHBondContact O-N 3.09Å; R136-L140 WeakPolarHBondContact O-CB 3.48Å; R136-L140 PolarHBondContact O-N 3.22Å; R136-D200 IonicContact CZ-OD2 3.04Å; R136-D200 IonicContact NH1-OD2 3.32Å; R136-D200 PolarHBondContact NH1-OD2 2.95Å; R136-D200 IonicContact NH2-OD2 3.75Å
137	K	70.6	Confident	62.8	Low	125 Å²	125	85.6 Å²	85.6	54%	0.543	51%	0.511	S	S	.	.	H	α-helix	trans	-64.9	-41.9	172.6	-76.7	177.2	-169.8	161.1	0	111.7	D134 G139 L140 H141	D134-K137 HydrophobicContact CB-CB 4.3Å; D134-K137 HydrophobicContact CB-CD 4.36Å; D134-K137 PolarHBondContact O-N 2.8Å; D134-K137 VanDerWaalsContact O-N 3.1Å; D134-K137 PolarHBondContact OD1-N 3.34Å; D134-K137 WeakPolarHBondContact OD2-CD 3.49Å; D134-K137 WeakPolarHBondContact OD2-CE 3.43Å; D134-K137 VanDerWaalsContact OD2-CG 3.28Å; D134-K137 WeakPolarHBondContact OD2-CG 3.48Å; D134-K137 IonicContact OD2-NZ 3.6Å; K137-G139 VanDerWaalsContact C-N 3.35Å; K137-L140 PolarHBondContact O-N 3.19Å; K137-H141 WeakPolarHBondContact O-CB 3.44Å; K137-H141 PolarHBondContact O-N 2.84Å
138	L	76.4	Confident	65.3	Low	108 Å²	108	84.1 Å²	84.1	57%	0.565	50%	0.499	S	S	*	.	H	α-helix	trans	-61	-45.4	176	-174.1	65.5	0	0	0	111	D134 H141 A142	D134-L138 PolarHBondContact O-N 2.87Å; L138-H141 PolarHBondContact O-N 3.28Å; L138-A142 WeakPolarHBondContact O-CB 3.45Å; L138-A142 PolarHBondContact O-N 2.82Å
139	G	77.3	Confident	67.9	Low	40 Å²	40	87.7 Å²	87.7	41%	0.412	50%	0.497	S	S	.	.	H	α-helix	trans	-61.9	-42.6	175.3	0	0	0	0	0	113	Y135 R136 K137 A142 L143	Y135-G139 PolarHBondContact O-N 3.19Å; R136-G139 PolarHBondContact O-N 3.09Å; K137-G139 VanDerWaalsContact C-N 3.35Å; G139-A142 PolarHBondContact O-N 3.48Å; G139-L143 WeakPolarHBondContact O-CB 3.44Å; G139-L143 PolarHBondContact O-N 3.09Å
140	L	77.3	Confident	70.2	Confident	42 Å²	42	82.1 Å²	82.1	22%	0.22	46%	0.457	C	S	.	.	H	α-helix	trans	-65.2	-40.3	177	-173	66.1	0	0	0	112.1	R136 K137 L143 A144 R190	R136-L140 WeakPolarHBondContact O-CB 3.48Å; R136-L140 PolarHBondContact O-N 3.22Å; K137-L140 PolarHBondContact O-N 3.19Å; L140-L143 PolarHBondContact O-N 3.27Å; L140-A144 WeakPolarHBondContact O-CB 3.25Å; L140-A144 PolarHBondContact O-N 3.34Å; L140-R190 HydrophobicContact CD1-CG 4.13Å
141	H	74.6	Confident	72.5	Confident	148 Å²	148	80.4 Å²	80.4	69%	0.685	44%	0.438	S	S	*	.	H	α-helix	trans	-67.1	-42.8	176.1	-171.9	-80.1	0	0	0	111.7	K137 L138 L143 A144 G145	K137-H141 WeakPolarHBondContact O-CB 3.44Å; K137-H141 PolarHBondContact O-N 2.84Å; L138-H141 PolarHBondContact O-N 3.28Å; H141-L143 VanDerWaalsContact C-N 3.34Å; H141-L143 PolarHBondContact O-N 3.07Å; H141-A144 PolarHBondContact O-N 3.41Å; H141-G145 PolarHBondContact O-N 3.45Å
142	A	80	Confident	74.4	Confident	59 Å²	59	77.4 Å²	77.4	49%	0.488	42%	0.417	S	S	.	.	H	α-helix	trans	-60.3	-44.9	174.3	0	0	0	0	0	111.3	L138 G139 G145 V146	L138-A142 WeakPolarHBondContact O-CB 3.45Å; L138-A142 PolarHBondContact O-N 2.82Å; G139-A142 PolarHBondContact O-N 3.48Å; A142-G145 PolarHBondContact O-N 3.19Å; A142-V146 WeakPolarHBondContact O-CG2 3.12Å; A142-V146 PolarHBondContact O-N 3.43Å
143	L	80.3	Confident	76.1	Confident	24 Å²	24	77.9 Å²	77.9	13%	0.126	40%	0.403	C	S	.	.	H	α-helix	trans	-65	-39.5	177.7	-176	61.6	0	0	0	112.5	G139 L140 H141 G145 V146 V147 A186 L189 R190 Y193	G139-L143 WeakPolarHBondContact O-CB 3.44Å; G139-L143 PolarHBondContact O-N 3.09Å; L140-L143 PolarHBondContact O-N 3.27Å; H141-L143 VanDerWaalsContact C-N 3.34Å; H141-L143 PolarHBondContact O-N 3.07Å; L143-G145 VanDerWaalsContact C-N 3.32Å; L143-G145 PolarHBondContact O-N 2.92Å; L143-V146 PolarHBondContact O-N 3.03Å; L143-V147 WeakPolarHBondContact O-CG2 3.45Å; L143-V147 PolarHBondContact O-N 3.17Å; L143-A186 HydrophobicContact CD1-CB 4.27Å; L143-L189 HydrophobicContact CD1-CD2 4.22Å; L143-L189 HydrophobicContact CD2-CB 4.1Å; L143-L189 HydrophobicContact CD2-CD2 4Å; L143-L189 HydrophobicContact CD2-CG 3.98Å; L143-R190 HydrophobicContact CD2-CB 3.87Å; L143-R190 HydrophobicContact CG-CB 4.36Å; L143-Y193 HydrophobicContact CD2-CD2 4.36Å
144	A	75.9	Confident	77.8	Confident	30 Å²	30	73.9 Å²	73.9	25%	0.248	38%	0.382	C	S	.	.	H	α-helix	trans	-59.1	-44.6	172.7	0	0	0	0	0	111.2	L140 H141 V146 V147 E148	L140-A144 WeakPolarHBondContact O-CB 3.25Å; L140-A144 PolarHBondContact O-N 3.34Å; H141-A144 PolarHBondContact O-N 3.41Å; A144-V146 VanDerWaalsContact C-N 3.34Å; A144-V146 PolarHBondContact O-N 3.06Å; A144-V147 PolarHBondContact O-N 3.47Å; A144-E148 WeakPolarHBondContact O-CG 3.35Å; A144-E148 PolarHBondContact O-N 3.34Å
145	G	78.2	Confident	78.1	Confident	21 Å²	21	74.6 Å²	74.6	22%	0.216	39%	0.39	C	S	.	.	H	α-helix	trans	-60.8	-38.8	173.4	0	0	0	0	0	113.3	H141 A142 L143 E148 H149	H141-G145 PolarHBondContact O-N 3.45Å; A142-G145 PolarHBondContact O-N 3.19Å; L143-G145 VanDerWaalsContact C-N 3.32Å; L143-G145 PolarHBondContact O-N 2.92Å; G145-E148 PolarHBondContact O-N 3Å; G145-H149 PolarHBondContact O-N 2.53Å; G145-H149 VanDerWaalsContact O-N 3.08Å; G145-H149 PolarHBondContact O-ND1 3.5Å
146	V	81.8	Confident	78.4	Confident	69 Å²	69	72.4 Å²	72.4	42%	0.418	38%	0.384	S	S	.	.	H	α-helix	trans	-63	-45.4	174.8	171.8	0	0	0	0	111.2	A142 L143 A144 H149 L150	A142-V146 WeakPolarHBondContact O-CG2 3.12Å; A142-V146 PolarHBondContact O-N 3.43Å; L143-V146 PolarHBondContact O-N 3.03Å; A144-V146 VanDerWaalsContact C-N 3.34Å; A144-V146 PolarHBondContact O-N 3.06Å; V146-H149 PolarHBondContact O-N 2.87Å; V146-L150 HydrophobicContact CG1-CD1 3.91Å; V146-L150 HydrophobicContact CG1-CG 4.45Å; V146-L150 WeakPolarHBondContact O-CG 3.26Å; V146-L150 PolarHBondContact O-N 3.49Å
147	V	79.5	Confident	79	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.006	37%	0.365	C	S	.	.	H	α-helix	trans	-61	-46.6	177.5	172.4	0	0	0	0	110.9	L143 A144 H149 L150 E151 L183 A186 Y187	L143-V147 WeakPolarHBondContact O-CG2 3.45Å; L143-V147 PolarHBondContact O-N 3.17Å; A144-V147 PolarHBondContact O-N 3.47Å; V147-H149 VanDerWaalsContact C-N 3.34Å; V147-H149 PolarHBondContact O-N 3.02Å; V147-L150 PolarHBondContact O-N 3.43Å; V147-E151 HydrophobicContact CG1-CG 4.21Å; V147-E151 WeakPolarHBondContact CG1-OE1 3.37Å; V147-E151 WeakPolarHBondContact O-CB 3.38Å; V147-E151 VanDerWaalsContact O-CG 3.31Å; V147-E151 WeakPolarHBondContact O-CG 3.42Å; V147-E151 PolarHBondContact O-N 3.03Å; V147-L183 HydrophobicContact CG1-CD1 4.16Å; V147-A186 HydrophobicContact CG2-CB 3.67Å; V147-Y187 HydrophobicContact CG1-CD1 4.15Å; V147-Y187 HydrophobicContact CG1-CE1 3.62Å
148	E	80.3	Confident	79	Confident	130 Å²	130	64.4 Å²	64.4	61%	0.607	36%	0.355	S	S	*	.	H	α-helix	trans	-60	-41.6	177.9	-74.8	-179.7	-174.1	0	0	112.6	A144 G145 S152	A144-E148 WeakPolarHBondContact O-CG 3.35Å; A144-E148 PolarHBondContact O-N 3.34Å; G145-E148 PolarHBondContact O-N 3Å; E148-S152 WeakPolarHBondContact O-CB 3.48Å; E148-S152 PolarHBondContact O-N 3.44Å
149	H	81.7	Confident	79	Confident	144 Å²	144	63.6 Å²	63.6	67%	0.667	35%	0.35	S	S	*	.	H	α-helix	trans	-66.7	-41.3	176.8	-71.2	119.9	0	0	0	112.2	G145 V146 V147 S152 L153	G145-H149 PolarHBondContact O-N 2.53Å; G145-H149 VanDerWaalsContact O-N 3.08Å; G145-H149 PolarHBondContact O-ND1 3.5Å; V146-H149 PolarHBondContact O-N 2.87Å; V147-H149 VanDerWaalsContact C-N 3.34Å; V147-H149 PolarHBondContact O-N 3.02Å; H149-S152 PolarHBondContact O-N 2.71Å; H149-L153 WeakPolarHBondContact O-CB 3.21Å; H149-L153 PolarHBondContact O-N 3.46Å
150	L	83.2	Confident	79	Confident	16 Å²	16	65.8 Å²	65.8	8%	0.084	35%	0.352	C	S	.	.	H	α-helix	trans	-65.9	-44.2	176.7	-73	172	0	0	0	111.4	V146 V147 S152 L153 M154 L179 L182 L183	V146-L150 HydrophobicContact CG1-CD1 3.91Å; V146-L150 HydrophobicContact CG1-CG 4.45Å; V146-L150 WeakPolarHBondContact O-CG 3.26Å; V146-L150 PolarHBondContact O-N 3.49Å; V147-L150 PolarHBondContact O-N 3.43Å; L150-S152 VanDerWaalsContact C-N 3.34Å; L150-S152 PolarHBondContact O-N 3Å; L150-L153 PolarHBondContact O-N 3.06Å; L150-L153 VanDerWaalsContact O-N 3.17Å; L150-M154 WeakPolarHBondContact O-CB 3.4Å; L150-M154 VanDerWaalsContact O-CG 3.28Å; L150-M154 WeakPolarHBondContact O-CG 3.45Å; L150-M154 PolarHBondContact O-N 2.72Å; L150-L179 HydrophobicContact CD2-CD2 3.82Å; L150-L182 HydrophobicContact CD1-CD2 4.1Å; L150-L182 HydrophobicContact CD1-CG 3.97Å; L150-L182 HydrophobicContact CD2-CD2 4.18Å; L150-L183 HydrophobicContact CB-CB 4.43Å; L150-L183 HydrophobicContact CB-CD1 3.81Å; L150-L183 HydrophobicContact CD1-CB 4.37Å; L150-L183 HydrophobicContact CD1-CD1 4.4Å
151	E	80.9	Confident	78.9	Confident	74 Å²	74	66.4 Å²	66.4	35%	0.346	35%	0.354	S	S	.	.	H	α-helix	trans	-58.7	-44	173.3	-73.5	175	178.5	0	0	111.6	V147 L153 M154 S155 L183 Y187	V147-E151 HydrophobicContact CG1-CG 4.21Å; V147-E151 WeakPolarHBondContact CG1-OE1 3.37Å; V147-E151 WeakPolarHBondContact O-CB 3.38Å; V147-E151 VanDerWaalsContact O-CG 3.31Å; V147-E151 WeakPolarHBondContact O-CG 3.42Å; V147-E151 PolarHBondContact O-N 3.03Å; E151-L153 VanDerWaalsContact C-N 3.32Å; E151-L153 PolarHBondContact O-N 3.32Å; E151-M154 PolarHBondContact O-N 3.26Å; E151-S155 PolarHBondContact O-N 3.36Å; E151-S155 PolarHBondContact O-OG 2.8Å; E151-L183 HydrophobicContact CG-CD1 4.15Å; E151-Y187 VanDerWaalsContact CD-OH 3.32Å; E151-Y187 WeakPolarHBondContact CG-OH 3.32Å; E151-Y187 WeakPolarHBondContact OE1-CE1 3.47Å; E151-Y187 VanDerWaalsContact OE1-CZ 3.3Å; E151-Y187 PolarHBondContact OE1-OH 2.82Å
152	S	81.1	Confident	78.9	Confident	55 Å²	55	64.7 Å²	64.7	39%	0.385	35%	0.35	S	S	.	.	H	α-helix	trans	-65.4	-33.5	176.3	-178.6	0	0	0	0	112.7	E148 H149 L150 S155 K156	E148-S152 WeakPolarHBondContact O-CB 3.48Å; E148-S152 PolarHBondContact O-N 3.44Å; H149-S152 PolarHBondContact O-N 2.71Å; L150-S152 VanDerWaalsContact C-N 3.34Å; L150-S152 PolarHBondContact O-N 3Å; S152-S155 WeakPolarHBondContact CA-OG 3.26Å; S152-S155 PolarHBondContact O-OG 2.86Å; S152-K156 WeakPolarHBondContact O-CG 3.49Å; S152-K156 PolarHBondContact O-N 3.36Å
153	L	81.5	Confident	78.9	Confident	77 Å²	77	68.8 Å²	68.8	40%	0.403	36%	0.356	S	S	.	.	H	α-helix	trans	-72.6	-46.7	176.1	-178	63.4	0	0	0	110.7	H149 L150 E151 S155 K156 V157 L179	H149-L153 WeakPolarHBondContact O-CB 3.21Å; H149-L153 PolarHBondContact O-N 3.46Å; L150-L153 PolarHBondContact O-N 3.06Å; L150-L153 VanDerWaalsContact O-N 3.17Å; E151-L153 VanDerWaalsContact C-N 3.32Å; E151-L153 PolarHBondContact O-N 3.32Å; L153-S155 VanDerWaalsContact C-N 3.3Å; L153-S155 PolarHBondContact O-N 3.37Å; L153-K156 WeakPolarHBondContact O-CB 3.49Å; L153-K156 PolarHBondContact O-N 2.96Å; L153-V157 HydrophobicContact CG-CG2 4.48Å; L153-V157 WeakPolarHBondContact O-CG2 3.43Å; L153-V157 PolarHBondContact O-N 2.63Å; L153-L179 HydrophobicContact CD2-CD1 3.67Å; L153-L179 HydrophobicContact CD2-CD2 4.49Å
154	M	80.8	Confident	78.3	Confident	31 Å²	31	70.7 Å²	70.7	15%	0.153	38%	0.382	C	S	.	.	H	α-helix	trans	-61.2	-37.7	179.4	-71.2	-52.3	-53.1	0	0	112.4	L150 E151 V157 K158 I176 L179 R180 L183	L150-M154 WeakPolarHBondContact O-CB 3.4Å; L150-M154 VanDerWaalsContact O-CG 3.28Å; L150-M154 WeakPolarHBondContact O-CG 3.45Å; L150-M154 PolarHBondContact O-N 2.72Å; E151-M154 PolarHBondContact O-N 3.26Å; M154-V157 PolarHBondContact O-N 2.79Å; M154-K158 WeakPolarHBondContact O-CB 3.42Å; M154-K158 PolarHBondContact O-N 3.47Å; M154-I176 HydrophobicContact CE-CG2 4.41Å; M154-L179 HydrophobicContact SD-CB 4.4Å; M154-R180 HydrophobicContact CE-CG 3.41Å; M154-R180 VanDerWaalsContact CE-CG 3.41Å; M154-R180 HydrophobicContact SD-CG 4.04Å; M154-L183 HydrophobicContact CG-CD2 4.16Å
155	S	77.4	Confident	77.7	Confident	60 Å²	60	75.1 Å²	75.1	42%	0.42	40%	0.401	S	S	.	.	H	α-helix	trans	-65.3	-36.7	173.2	53.2	0	0	0	0	112.9	E151 S152 L153 I159	E151-S155 PolarHBondContact O-N 3.36Å; E151-S155 PolarHBondContact O-OG 2.8Å; S152-S155 WeakPolarHBondContact CA-OG 3.26Å; S152-S155 PolarHBondContact O-OG 2.86Å; L153-S155 VanDerWaalsContact C-N 3.3Å; L153-S155 PolarHBondContact O-N 3.37Å; S155-I159 VanDerWaalsContact O-CG1 3.32Å; S155-I159 WeakPolarHBondContact O-CG1 3.36Å; S155-I159 PolarHBondContact O-N 2.89Å; S155-I159 VanDerWaalsContact O-N 3.1Å
156	K	80.9	Confident	76.6	Confident	127 Å²	127	76.1 Å²	76.1	55%	0.552	41%	0.405	S	S	*	.	H	α-helix	trans	-69.1	-43.7	173.9	-72.5	173.7	-177.7	176.9	0	112.4	S152 L153 K158 I159 L160	S152-K156 WeakPolarHBondContact O-CG 3.49Å; S152-K156 PolarHBondContact O-N 3.36Å; L153-K156 WeakPolarHBondContact O-CB 3.49Å; L153-K156 PolarHBondContact O-N 2.96Å; K156-K158 VanDerWaalsContact C-N 3.27Å; K156-K158 PolarHBondContact O-N 3.19Å; K156-I159 PolarHBondContact O-N 2.9Å; K156-L160 WeakPolarHBondContact O-CG 3.37Å; K156-L160 PolarHBondContact O-N 3.37Å
157	V	80.2	Confident	75.4	Confident	19 Å²	19	76.6 Å²	76.6	12%	0.115	42%	0.416	C	S	.	.	H	α-helix	trans	-56.3	-46.3	175.9	170.9	0	0	0	0	109.6	L153 M154 I159 L160 E161 I176	L153-V157 HydrophobicContact CG-CG2 4.48Å; L153-V157 WeakPolarHBondContact O-CG2 3.43Å; L153-V157 PolarHBondContact O-N 2.63Å; M154-V157 PolarHBondContact O-N 2.79Å; V157-I159 PolarHBondContact O-N 3.01Å; V157-L160 WeakPolarHBondContact O-CA 3.22Å; V157-L160 WeakPolarHBondContact O-CB 3.29Å; V157-L160 PolarHBondContact O-N 3.32Å; V157-E161 HydrophobicContact CG1-CG 4.37Å; V157-E161 WeakPolarHBondContact CG1-OE1 3.49Å; V157-E161 PolarHBondContact O-N 2.95Å; V157-I176 HydrophobicContact CG1-CD1 3.73Å; V157-I176 HydrophobicContact CG1-CG1 4.04Å; V157-I176 HydrophobicContact CG1-CG2 4.02Å; V157-I176 HydrophobicContact CG2-CG1 4.48Å
158	K	69.1	Low	74.2	Confident	78 Å²	78	81.7 Å²	81.7	34%	0.339	45%	0.449	S	S	.	.	H	α-helix	trans	-59.8	-45.2	175.4	-177.1	-178.4	168.2	-178	0	113.1	M154 K156 L160 E161 D162 W389	M154-K158 WeakPolarHBondContact O-CB 3.42Å; M154-K158 PolarHBondContact O-N 3.47Å; K156-K158 VanDerWaalsContact C-N 3.27Å; K156-K158 PolarHBondContact O-N 3.19Å; K158-L160 PolarHBondContact O-N 3.11Å; K158-E161 PolarHBondContact O-N 3.22Å; K158-D162 VanDerWaalsContact CE-OD2 3.32Å; K158-D162 WeakPolarHBondContact CE-OD2 3.38Å; K158-D162 WeakPolarHBondContact O-CB 3.28Å; K158-D162 VanDerWaalsContact O-CG 3.3Å; K158-D162 PolarHBondContact O-N 3.16Å; K158-W389 HydrophobicContact CD-CH2 4.43Å; K158-W389 HydrophobicContact CD-CZ2 3.67Å; K158-W389 VanDerWaalsContact CE-CZ2 3.44Å; K158-W389 HydrophobicContact CG-CZ2 4.38Å
159	I	77.3	Confident	73.3	Confident	90 Å²	90	78.6 Å²	78.6	46%	0.462	44%	0.442	S	S	.	.	H	α-helix	trans	-59.9	-32.5	176.4	-68	163.8	0	0	0	111.2	S155 K156 V157 K163	S155-I159 VanDerWaalsContact O-CG1 3.32Å; S155-I159 WeakPolarHBondContact O-CG1 3.36Å; S155-I159 PolarHBondContact O-N 2.89Å; S155-I159 VanDerWaalsContact O-N 3.1Å; K156-I159 PolarHBondContact O-N 2.9Å; V157-I159 PolarHBondContact O-N 3.01Å; I159-K163 HydrophobicContact CG2-CD 4.1Å; I159-K163 VanDerWaalsContact O-CB 3.3Å; I159-K163 WeakPolarHBondContact O-CB 3.49Å; I159-K163 WeakPolarHBondContact O-CG 3.45Å; I159-K163 PolarHBondContact O-N 3.42Å; I159-K163 VanDerWaalsContact O-N 3.13Å
160	L	77	Confident	72.6	Confident	86 Å²	86	75.6 Å²	75.6	45%	0.45	44%	0.437	S	S	.	.	H	α-helix	trans	-76.3	-39.4	176.7	-67.4	170.2	0	0	0	112.5	K156 V157 K158 K163 G164 L165	K156-L160 WeakPolarHBondContact O-CG 3.37Å; K156-L160 PolarHBondContact O-N 3.37Å; V157-L160 WeakPolarHBondContact O-CA 3.22Å; V157-L160 WeakPolarHBondContact O-CB 3.29Å; V157-L160 PolarHBondContact O-N 3.32Å; K158-L160 PolarHBondContact O-N 3.11Å; L160-K163 PolarHBondContact O-N 2.83Å; L160-G164 PolarHBondContact O-N 3.05Å; L160-L165 HydrophobicContact CD2-CB 4.44Å; L160-L165 PolarHBondContact O-N 3.31Å
161	E	75.2	Confident	72.1	Confident	55 Å²	55	80.8 Å²	80.8	26%	0.257	47%	0.465	S	S	.	.	H	α-helix	trans	-60.9	-49.9	171.5	-73.4	174.3	-173.5	0	0	110.6	V157 K158 K163 G164 R180	V157-E161 HydrophobicContact CG1-CG 4.37Å; V157-E161 WeakPolarHBondContact CG1-OE1 3.49Å; V157-E161 PolarHBondContact O-N 2.95Å; K158-E161 PolarHBondContact O-N 3.22Å; E161-K163 VanDerWaalsContact C-N 3.28Å; E161-K163 PolarHBondContact O-N 3.22Å; E161-G164 PolarHBondContact O-N 3.48Å; E161-R180 IonicContact OE1-NH2 2.61Å; E161-R180 PolarHBondContact OE1-NH2 2.98Å; E161-R180 IonicContact OE2-NH2 3.68Å
162	D	75.1	Confident	71.7	Confident	113 Å²	113	78.8 Å²	78.8	60%	0.604	46%	0.459	S	S	*	.	H	α-helix	trans	-62.5	-33.5	178.7	-71.9	-16.5	0	0	0	112	K158 G164	K158-D162 VanDerWaalsContact CE-OD2 3.32Å; K158-D162 WeakPolarHBondContact CE-OD2 3.38Å; K158-D162 WeakPolarHBondContact O-CB 3.28Å; K158-D162 VanDerWaalsContact O-CG 3.3Å; K158-D162 PolarHBondContact O-N 3.16Å; D162-G164 PolarHBondContact O-N 3.39Å
163	K	78.9	Confident	71.5	Confident	144 Å²	144	80.3 Å²	80.3	63%	0.626	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-2.2	174.4	-75.2	178.6	179.7	-174.4	0	113.7	I159 L160 E161 L165	I159-K163 HydrophobicContact CG2-CD 4.1Å; I159-K163 VanDerWaalsContact O-CB 3.3Å; I159-K163 WeakPolarHBondContact O-CB 3.49Å; I159-K163 WeakPolarHBondContact O-CG 3.45Å; I159-K163 PolarHBondContact O-N 3.42Å; I159-K163 VanDerWaalsContact O-N 3.13Å; L160-K163 PolarHBondContact O-N 2.83Å; E161-K163 VanDerWaalsContact C-N 3.28Å; E161-K163 PolarHBondContact O-N 3.22Å; K163-L165 HydrophobicContact CB-CD1 3.94Å; K163-L165 HydrophobicContact CB-CG 4.2Å; K163-L165 HydrophobicContact CD-CD1 4.26Å; K163-L165 PolarHBondContact O-N 3.12Å
164	G	69	Low	71.4	Confident	65 Å²	65	82.6 Å²	82.6	67%	0.67	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	18.3	-175.9	0	0	0	0	0	114	L160 E161 D162	L160-G164 PolarHBondContact O-N 3.05Å; E161-G164 PolarHBondContact O-N 3.48Å; D162-G164 PolarHBondContact O-N 3.39Å
165	L	61.9	Low	71.4	Confident	123 Å²	123	86 Å²	86	64%	0.644	49%	0.487	S	S	*	.			trans	-92.5	3.6	-178.5	-73.2	166.4	0	0	0	112.6	L160 K163 A167	L160-L165 HydrophobicContact CD2-CB 4.44Å; L160-L165 PolarHBondContact O-N 3.31Å; K163-L165 HydrophobicContact CB-CD1 3.94Å; K163-L165 HydrophobicContact CB-CG 4.2Å; K163-L165 HydrophobicContact CD-CD1 4.26Å; K163-L165 PolarHBondContact O-N 3.12Å; L165-A167 PolarHBondContact O-N 3.24Å; L165-A167 VanDerWaalsContact O-N 3.12Å
166	S	56.3	Low	71.7	Confident	42 Å²	42	84 Å²	84	29%	0.294	47%	0.471	S	S	.	.			trans	-72.9	101.3	173.2	-164.2	0	0	0	0	109.3	P168	S166-P168 VanDerWaalsContact O-CD 3.31Å; S166-P168 WeakPolarHBondContact O-CD 3.48Å
167	A	56.2	Low	71.8	Confident	79 Å²	79	82 Å²	82	65%	0.653	47%	0.466	S	S	*	.			trans	-72.5	114.5	168.3	0	0	0	0	0	107.9	L165 S169	L165-A167 PolarHBondContact O-N 3.24Å; L165-A167 VanDerWaalsContact O-N 3.12Å; A167-S169 VanDerWaalsContact C-N 3.29Å; A167-S169 PolarHBondContact O-N 3.48Å
168	P	54.4	Low	72	Confident	108 Å²	108	85.5 Å²	85.5	70%	0.701	49%	0.485	S	S	*	.			trans	-79.1	80.8	-172.8	32.6	-33.6	0	0	0	109	S166	S166-P168 VanDerWaalsContact O-CD 3.31Å; S166-P168 WeakPolarHBondContact O-CD 3.48Å
169	S	60.3	Low	72.8	Confident	65 Å²	65	83.4 Å²	83.4	46%	0.455	48%	0.477	S	S	.	.			trans	-73	129.3	154.7	73.4	0	0	0	0	106.6	A167 N171 S172 E173	A167-S169 VanDerWaalsContact C-N 3.29Å; A167-S169 PolarHBondContact O-N 3.48Å; S169-N171 PolarHBondContact O-N 3.47Å; S169-S172 PolarHBondContact N-OG 3.31Å; S169-S172 PolarHBondContact O-N 3.04Å; S169-S172 PolarHBondContact O-OG 2.8Å; S169-S172 WeakPolarHBondContact OG-CB 3.4Å; S169-S172 PolarHBondContact OG-N 3Å; S169-S172 PolarHBondContact OG-OG 3.27Å; S169-E173 PolarHBondContact O-N 2.71Å
170	S	67.5	Low	73	Confident	81 Å²	81	83.9 Å²	83.9	57%	0.566	47%	0.473	S	S	*	.	H	α-helix	trans	-49	-34.1	178.6	53.4	0	0	0	0	112.2	H174	S170-H174 PolarHBondContact O-CD2 3.49Å; S170-H174 PolarHBondContact O-N 3.22Å
171	N	73.1	Confident	73.4	Confident	124 Å²	124	83 Å²	83	66%	0.663	47%	0.468	S	S	*	.	H	α-helix	trans	-70.2	-32.5	-180	-62.1	-8.8	0	0	0	113.4	S169 L175	S169-N171 PolarHBondContact O-N 3.47Å; N171-L175 PolarHBondContact O-N 2.85Å; N171-L175 VanDerWaalsContact O-N 3.16Å
172	S	73.2	Confident	73.9	Confident	33 Å²	33	84.6 Å²	84.6	23%	0.231	48%	0.478	C	S	.	.	H	α-helix	trans	-73	-36.8	179.1	52.7	0	0	0	0	112.3	S169 L175 I176	S169-S172 PolarHBondContact N-OG 3.31Å; S169-S172 PolarHBondContact O-N 3.04Å; S169-S172 PolarHBondContact O-OG 2.8Å; S169-S172 WeakPolarHBondContact OG-CB 3.4Å; S169-S172 PolarHBondContact OG-N 3Å; S169-S172 PolarHBondContact OG-OG 3.27Å; S172-L175 PolarHBondContact O-N 3.43Å; S172-I176 WeakPolarHBondContact O-CD1 3.36Å; S172-I176 VanDerWaalsContact O-CG1 3.27Å; S172-I176 WeakPolarHBondContact O-CG1 3.42Å; S172-I176 PolarHBondContact O-N 2.84Å
173	E	77.1	Confident	74.2	Confident	86 Å²	86	80.3 Å²	80.3	40%	0.402	46%	0.455	S	S	.	.	H	α-helix	trans	-63.9	-45.4	174.7	-73.7	-65.8	141.7	0	0	111.7	S169 L175 I176 N177	S169-E173 PolarHBondContact O-N 2.71Å; E173-L175 VanDerWaalsContact C-N 3.34Å; E173-L175 PolarHBondContact O-N 2.86Å; E173-I176 PolarHBondContact O-N 3.23Å; E173-N177 PolarHBondContact O-N 3.12Å
174	H	78.6	Confident	74.1	Confident	125 Å²	125	76.4 Å²	76.4	58%	0.579	44%	0.439	S	S	*	.	H	α-helix	trans	-58.4	-45.6	175	-75.2	-59.2	0	0	0	111.8	S170 I176 N177 D178	S170-H174 PolarHBondContact O-CD2 3.49Å; S170-H174 PolarHBondContact O-N 3.22Å; H174-I176 PolarHBondContact O-N 3.1Å; H174-N177 PolarHBondContact O-N 3.42Å; H174-D178 PolarHBondContact O-N 3.05Å
175	L	81.4	Confident	74.8	Confident	102 Å²	102	78.4 Å²	78.4	53%	0.534	43%	0.431	S	S	.	.	H	α-helix	trans	-63.5	-40.5	177.8	-177.8	64.8	0	0	0	112.6	N171 S172 E173 N177 D178 L179	N171-L175 PolarHBondContact O-N 2.85Å; N171-L175 VanDerWaalsContact O-N 3.16Å; S172-L175 PolarHBondContact O-N 3.43Å; E173-L175 VanDerWaalsContact C-N 3.34Å; E173-L175 PolarHBondContact O-N 2.86Å; L175-N177 VanDerWaalsContact C-N 3.32Å; L175-N177 PolarHBondContact O-N 2.81Å; L175-D178 PolarHBondContact O-N 3.03Å; L175-L179 HydrophobicContact CG-CD1 4.24Å; L175-L179 WeakPolarHBondContact O-CB 3.44Å; L175-L179 VanDerWaalsContact O-CG 3.26Å; L175-L179 WeakPolarHBondContact O-CG 3.34Å; L175-L179 PolarHBondContact O-N 3.36Å
176	I	83.7	Confident	75.7	Confident	19 Å²	19	72.9 Å²	72.9	10%	0.097	40%	0.402	C	S	.	.	H	α-helix	trans	-62.3	-42.7	176.3	-70.6	162.5	0	0	0	110.3	M154 V157 S172 E173 H174 L179 R180	M154-I176 HydrophobicContact CE-CG2 4.41Å; V157-I176 HydrophobicContact CG1-CD1 3.73Å; V157-I176 HydrophobicContact CG1-CG1 4.04Å; V157-I176 HydrophobicContact CG1-CG2 4.02Å; V157-I176 HydrophobicContact CG2-CG1 4.48Å; S172-I176 WeakPolarHBondContact O-CD1 3.36Å; S172-I176 VanDerWaalsContact O-CG1 3.27Å; S172-I176 WeakPolarHBondContact O-CG1 3.42Å; S172-I176 PolarHBondContact O-N 2.84Å; E173-I176 PolarHBondContact O-N 3.23Å; H174-I176 PolarHBondContact O-N 3.1Å; I176-L179 PolarHBondContact O-N 3.38Å; I176-R180 WeakPolarHBondContact O-CG 3.47Å; I176-R180 PolarHBondContact O-N 3.06Å
177	N	82.2	Confident	76.8	Confident	84 Å²	84	75 Å²	75	45%	0.449	40%	0.404	S	S	.	.	H	α-helix	trans	-64.3	-41.8	177.2	-167.2	63.5	0	0	0	111.9	E173 H174 L175 L179 R180 I181	E173-N177 PolarHBondContact O-N 3.12Å; H174-N177 PolarHBondContact O-N 3.42Å; L175-N177 VanDerWaalsContact C-N 3.32Å; L175-N177 PolarHBondContact O-N 2.81Å; N177-L179 VanDerWaalsContact C-N 3.32Å; N177-L179 PolarHBondContact O-N 3.02Å; N177-R180 WeakPolarHBondContact O-CB 3.5Å; N177-R180 PolarHBondContact O-N 3.47Å; N177-I181 WeakPolarHBondContact O-CG1 3.37Å; N177-I181 PolarHBondContact O-N 2.99Å
178	D	85.3	Confident	77.8	Confident	94 Å²	94	77.1 Å²	77.1	50%	0.503	40%	0.396	S	S	.	.	H	α-helix	trans	-62.7	-38.5	175	-69.1	-15.7	0	0	0	111.8	H174 L175 I181 L182	H174-D178 PolarHBondContact O-N 3.05Å; L175-D178 PolarHBondContact O-N 3.03Å; D178-I181 PolarHBondContact O-N 3.48Å; D178-L182 WeakPolarHBondContact O-CB 3.33Å; D178-L182 PolarHBondContact O-N 3.28Å
179	L	84.2	Confident	79.1	Confident	34 Å²	34	75.3 Å²	75.3	18%	0.178	38%	0.38	C	S	.	.	H	α-helix	trans	-66.6	-34.6	174.6	-71.8	169.1	0	0	0	112.6	L150 L153 M154 L175 I176 N177 L182 L183	L150-L179 HydrophobicContact CD2-CD2 3.82Å; L153-L179 HydrophobicContact CD2-CD1 3.67Å; L153-L179 HydrophobicContact CD2-CD2 4.49Å; M154-L179 HydrophobicContact SD-CB 4.4Å; L175-L179 HydrophobicContact CG-CD1 4.24Å; L175-L179 WeakPolarHBondContact O-CB 3.44Å; L175-L179 VanDerWaalsContact O-CG 3.26Å; L175-L179 WeakPolarHBondContact O-CG 3.34Å; L175-L179 PolarHBondContact O-N 3.36Å; I176-L179 PolarHBondContact O-N 3.38Å; N177-L179 VanDerWaalsContact C-N 3.32Å; N177-L179 PolarHBondContact O-N 3.02Å; L179-L182 HydrophobicContact CD2-CD2 4.42Å; L179-L182 PolarHBondContact O-N 3.17Å; L179-L183 WeakPolarHBondContact O-CB 3.44Å; L179-L183 PolarHBondContact O-N 3.16Å
180	R	82.8	Confident	79.9	Confident	99 Å²	99	76.2 Å²	76.2	37%	0.374	37%	0.373	S	S	.	.	H	α-helix	trans	-63.7	-46.1	172.8	-71.1	173	-172.1	-162.4	1.9	110.9	M154 E161 I176 N177 L182 L183 E184	M154-R180 HydrophobicContact CE-CG 3.41Å; M154-R180 VanDerWaalsContact CE-CG 3.41Å; M154-R180 HydrophobicContact SD-CG 4.04Å; E161-R180 IonicContact OE1-NH2 2.61Å; E161-R180 PolarHBondContact OE1-NH2 2.98Å; E161-R180 IonicContact OE2-NH2 3.68Å; I176-R180 WeakPolarHBondContact O-CG 3.47Å; I176-R180 PolarHBondContact O-N 3.06Å; N177-R180 WeakPolarHBondContact O-CB 3.5Å; N177-R180 PolarHBondContact O-N 3.47Å; R180-L182 VanDerWaalsContact C-N 3.34Å; R180-L183 PolarHBondContact O-N 3Å; R180-E184 PolarHBondContact O-N 3.26Å; R180-E184 VanDerWaalsContact O-N 3.08Å
181	I	84.6	Confident	80.1	Confident	69 Å²	69	76.3 Å²	76.3	35%	0.354	37%	0.365	S	S	.	.	H	α-helix	trans	-61.6	-43.8	175.6	-66.7	166.9	0	0	0	110.3	N177 D178 L183 E184 H185	N177-I181 WeakPolarHBondContact O-CG1 3.37Å; N177-I181 PolarHBondContact O-N 2.99Å; D178-I181 PolarHBondContact O-N 3.48Å; I181-L183 PolarHBondContact O-N 3.29Å; I181-E184 WeakPolarHBondContact O-CB 3.43Å; I181-E184 PolarHBondContact O-N 2.86Å; I181-H185 PolarHBondContact O-CD2 3.49Å; I181-H185 PolarHBondContact O-N 3.07Å
182	L	85.5	Confident	80.2	Confident	88 Å²	88	75.7 Å²	75.7	46%	0.461	36%	0.358	S	S	.	.	H	α-helix	trans	-61.1	-42	177.3	-178.7	62.9	0	0	0	112.4	L150 D178 L179 R180 E184 H185 A186	L150-L182 HydrophobicContact CD1-CD2 4.1Å; L150-L182 HydrophobicContact CD1-CG 3.97Å; L150-L182 HydrophobicContact CD2-CD2 4.18Å; D178-L182 WeakPolarHBondContact O-CB 3.33Å; D178-L182 PolarHBondContact O-N 3.28Å; L179-L182 HydrophobicContact CD2-CD2 4.42Å; L179-L182 PolarHBondContact O-N 3.17Å; R180-L182 VanDerWaalsContact C-N 3.34Å; L182-E184 VanDerWaalsContact C-N 3.33Å; L182-E184 PolarHBondContact O-N 2.86Å; L182-H185 PolarHBondContact O-N 3.22Å; L182-A186 WeakPolarHBondContact O-CB 3.49Å; L182-A186 PolarHBondContact O-N 3.22Å
183	L	81.3	Confident	80	Confident	23 Å²	23	79.2 Å²	79.2	12%	0.12	37%	0.367	C	S	.	.	H	α-helix	trans	-62.4	-40.8	175.7	179.5	62.6	0	0	0	111.4	V147 L150 E151 M154 L179 R180 I181 A186 Y187	V147-L183 HydrophobicContact CG1-CD1 4.16Å; L150-L183 HydrophobicContact CB-CB 4.43Å; L150-L183 HydrophobicContact CB-CD1 3.81Å; L150-L183 HydrophobicContact CD1-CB 4.37Å; L150-L183 HydrophobicContact CD1-CD1 4.4Å; E151-L183 HydrophobicContact CG-CD1 4.15Å; M154-L183 HydrophobicContact CG-CD2 4.16Å; L179-L183 WeakPolarHBondContact O-CB 3.44Å; L179-L183 PolarHBondContact O-N 3.16Å; R180-L183 PolarHBondContact O-N 3Å; I181-L183 PolarHBondContact O-N 3.29Å; L183-A186 PolarHBondContact O-N 2.78Å; L183-Y187 HydrophobicContact CD1-CD2 4.18Å; L183-Y187 HydrophobicContact CD1-CE2 3.72Å; L183-Y187 HydrophobicContact CD2-CE2 4.09Å; L183-Y187 HydrophobicContact CG-CD2 4.04Å; L183-Y187 HydrophobicContact CG-CE2 3.63Å; L183-Y187 VanDerWaalsContact O-CD2 3.25Å; L183-Y187 WeakPolarHBondContact O-CD2 3.47Å; L183-Y187 PolarHBondContact O-N 3.32Å
184	E	77.5	Confident	79.8	Confident	62 Å²	62	81 Å²	81	29%	0.29	37%	0.373	S	S	.	.	H	α-helix	trans	-59.3	-47.7	173.9	-175.5	-173.6	163.1	0	0	111.7	R180 I181 L182 A186 Y187 R188 F394	R180-E184 PolarHBondContact O-N 3.26Å; R180-E184 VanDerWaalsContact O-N 3.08Å; I181-E184 WeakPolarHBondContact O-CB 3.43Å; I181-E184 PolarHBondContact O-N 2.86Å; L182-E184 VanDerWaalsContact C-N 3.33Å; L182-E184 PolarHBondContact O-N 2.86Å; E184-A186 VanDerWaalsContact C-N 3.33Å; E184-A186 PolarHBondContact O-N 3.39Å; E184-Y187 PolarHBondContact O-N 2.86Å; E184-R188 PolarHBondContact O-N 3.25Å; E184-R188 VanDerWaalsContact O-N 3.1Å; E184-R188 IonicContact OE1-CZ 2.82Å; E184-R188 IonicContact OE1-NH1 3.61Å; E184-R188 PolarHBondContact OE1-NH1 3.05Å; E184-R188 IonicContact OE1-NH2 3.64Å; E184-R188 PolarHBondContact OE1-NH2 3.06Å; E184-F394 HydrophobicContact CG-CE2 4.18Å
185	H	83	Confident	79.1	Confident	107 Å²	107	79 Å²	79	50%	0.495	36%	0.364	S	S	.	.	H	α-helix	trans	-62.2	-40.5	176.1	-77	-70.9	0	0	0	112.1	I181 L182 R188 L189	I181-H185 PolarHBondContact O-CD2 3.49Å; I181-H185 PolarHBondContact O-N 3.07Å; L182-H185 PolarHBondContact O-N 3.22Å; H185-R188 PolarHBondContact O-N 2.73Å; H185-L189 VanDerWaalsContact O-CB 3.3Å; H185-L189 WeakPolarHBondContact O-CB 3.39Å; H185-L189 PolarHBondContact O-N 3.32Å
186	A	80.5	Confident	78.3	Confident	6 Å²	6	79.7 Å²	79.7	5%	0.05	37%	0.365	C	S	.	.	H	α-helix	trans	-64.5	-40	178.6	0	0	0	0	0	112.3	L143 V147 L182 L183 E184 L189 R190	L143-A186 HydrophobicContact CD1-CB 4.27Å; V147-A186 HydrophobicContact CG2-CB 3.67Å; L182-A186 WeakPolarHBondContact O-CB 3.49Å; L182-A186 PolarHBondContact O-N 3.22Å; L183-A186 PolarHBondContact O-N 2.78Å; E184-A186 VanDerWaalsContact C-N 3.33Å; E184-A186 PolarHBondContact O-N 3.39Å; A186-L189 PolarHBondContact O-N 2.93Å; A186-R190 WeakPolarHBondContact O-CB 3.44Å; A186-R190 PolarHBondContact O-N 3.03Å
187	Y	81.1	Confident	77.3	Confident	86 Å²	86	82.2 Å²	82.2	34%	0.337	38%	0.378	S	S	.	.	H	α-helix	trans	-63.3	-47.2	173.5	-78.4	-55.8	0	0	0	112.5	V147 E151 L183 E184 L189 R190 E191	V147-Y187 HydrophobicContact CG1-CD1 4.15Å; V147-Y187 HydrophobicContact CG1-CE1 3.62Å; E151-Y187 VanDerWaalsContact CD-OH 3.32Å; E151-Y187 WeakPolarHBondContact CG-OH 3.32Å; E151-Y187 WeakPolarHBondContact OE1-CE1 3.47Å; E151-Y187 VanDerWaalsContact OE1-CZ 3.3Å; E151-Y187 PolarHBondContact OE1-OH 2.82Å; L183-Y187 HydrophobicContact CD1-CD2 4.18Å; L183-Y187 HydrophobicContact CD1-CE2 3.72Å; L183-Y187 HydrophobicContact CD2-CE2 4.09Å; L183-Y187 HydrophobicContact CG-CD2 4.04Å; L183-Y187 HydrophobicContact CG-CE2 3.63Å; L183-Y187 VanDerWaalsContact O-CD2 3.25Å; L183-Y187 WeakPolarHBondContact O-CD2 3.47Å; L183-Y187 PolarHBondContact O-N 3.32Å; E184-Y187 PolarHBondContact O-N 2.86Å; Y187-L189 VanDerWaalsContact C-N 3.31Å; Y187-L189 PolarHBondContact O-N 3.24Å; Y187-R190 PolarHBondContact O-N 3.17Å; Y187-E191 WeakPolarHBondContact O-CB 3.33Å; Y187-E191 PolarHBondContact O-N 3.34Å
188	R	77.4	Confident	76.1	Confident	125 Å²	125	83.4 Å²	83.4	47%	0.472	39%	0.388	S	S	.	.	H	α-helix	trans	-57.9	-46.4	177.3	-76.5	-172	174.5	128.7	9.2	111	E184 H185 E191 Q192	E184-R188 PolarHBondContact O-N 3.25Å; E184-R188 VanDerWaalsContact O-N 3.1Å; E184-R188 IonicContact OE1-CZ 2.82Å; E184-R188 IonicContact OE1-NH1 3.61Å; E184-R188 PolarHBondContact OE1-NH1 3.05Å; E184-R188 IonicContact OE1-NH2 3.64Å; E184-R188 PolarHBondContact OE1-NH2 3.06Å; H185-R188 PolarHBondContact O-N 2.73Å; R188-E191 PolarHBondContact O-N 2.98Å; R188-Q192 WeakPolarHBondContact O-CG 3.21Å; R188-Q192 PolarHBondContact O-N 2.89Å
189	L	80.4	Confident	74.5	Confident	69 Å²	69	85.9 Å²	85.9	36%	0.361	40%	0.396	S	S	.	.	H	α-helix	trans	-64.8	-42.5	-179.7	-167.4	68.6	0	0	0	111.6	L143 H185 A186 Y187 E191 Q192 Y193	L143-L189 HydrophobicContact CD1-CD2 4.22Å; L143-L189 HydrophobicContact CD2-CB 4.1Å; L143-L189 HydrophobicContact CD2-CD2 4Å; L143-L189 HydrophobicContact CD2-CG 3.98Å; H185-L189 VanDerWaalsContact O-CB 3.3Å; H185-L189 WeakPolarHBondContact O-CB 3.39Å; H185-L189 PolarHBondContact O-N 3.32Å; A186-L189 PolarHBondContact O-N 2.93Å; Y187-L189 VanDerWaalsContact C-N 3.31Å; Y187-L189 PolarHBondContact O-N 3.24Å; L189-E191 VanDerWaalsContact C-N 3.33Å; L189-E191 PolarHBondContact O-N 2.83Å; L189-Q192 PolarHBondContact O-N 2.99Å; L189-Y193 HydrophobicContact CD1-CD2 4.12Å; L189-Y193 HydrophobicContact CD1-CE2 3.64Å; L189-Y193 HydrophobicContact CD2-CE2 4.16Å; L189-Y193 HydrophobicContact CG-CD2 3.84Å; L189-Y193 HydrophobicContact CG-CE2 3.66Å; L189-Y193 VanDerWaalsContact O-CD2 3.27Å; L189-Y193 WeakPolarHBondContact O-CD2 3.49Å; L189-Y193 PolarHBondContact O-N 3.36Å
190	R	77.6	Confident	72.5	Confident	85 Å²	85	87 Å²	87	32%	0.321	40%	0.403	S	S	.	.	H	α-helix	trans	-61	-43.8	177.4	-173.2	-175.8	74.2	-179.1	-0	111.5	L140 L143 A186 Y187 Y193 K194	L140-R190 HydrophobicContact CD1-CG 4.13Å; L143-R190 HydrophobicContact CD2-CB 3.87Å; L143-R190 HydrophobicContact CG-CB 4.36Å; A186-R190 WeakPolarHBondContact O-CB 3.44Å; A186-R190 PolarHBondContact O-N 3.03Å; Y187-R190 PolarHBondContact O-N 3.17Å; R190-Y193 PolarHBondContact O-N 3.29Å; R190-K194 WeakPolarHBondContact O-CB 3.45Å; R190-K194 PolarHBondContact O-N 2.78Å
191	E	72.6	Confident	70.8	Confident	83 Å²	83	89.8 Å²	89.8	39%	0.388	43%	0.425	S	S	.	.	H	α-helix	trans	-66.5	-41.9	179.1	-170.9	54.8	-144.8	0	0	111.3	Y187 R188 L189 Y193 K194 Q195	Y187-E191 WeakPolarHBondContact O-CB 3.33Å; Y187-E191 PolarHBondContact O-N 3.34Å; R188-E191 PolarHBondContact O-N 2.98Å; L189-E191 VanDerWaalsContact C-N 3.33Å; L189-E191 PolarHBondContact O-N 2.83Å; E191-Y193 PolarHBondContact O-N 3.01Å; E191-K194 PolarHBondContact O-N 3.02Å; E191-Q195 VanDerWaalsContact O-CG 3.25Å; E191-Q195 WeakPolarHBondContact O-CG 3.2Å; E191-Q195 PolarHBondContact O-N 3.36Å; E191-Q195 PolarHBondContact OE1-NE2 3.43Å
192	Q	73.7	Confident	68.5	Low	111 Å²	111	90.9 Å²	90.9	52%	0.519	44%	0.439	S	S	.	.	H	α-helix	trans	-59.3	-47.4	174.2	-75.9	178.8	-28.4	0	0	112.7	R188 L189 Q195 Q196	R188-Q192 WeakPolarHBondContact O-CG 3.21Å; R188-Q192 PolarHBondContact O-N 2.89Å; L189-Q192 PolarHBondContact O-N 2.99Å; Q192-Q195 PolarHBondContact O-N 2.98Å; Q192-Q196 WeakPolarHBondContact O-CG 3.18Å; Q192-Q196 PolarHBondContact O-N 2.91Å
193	Y	70.5	Confident	65.9	Low	107 Å²	107	95.3 Å²	95.3	42%	0.42	45%	0.45	S	S	.	.	H	α-helix	trans	-67.3	-38	178.7	-84.1	-67.5	0	0	0	112.9	L143 L189 R190 E191 Q195 Q196 L197	L143-Y193 HydrophobicContact CD2-CD2 4.36Å; L189-Y193 HydrophobicContact CD1-CD2 4.12Å; L189-Y193 HydrophobicContact CD1-CE2 3.64Å; L189-Y193 HydrophobicContact CD2-CE2 4.16Å; L189-Y193 HydrophobicContact CG-CD2 3.84Å; L189-Y193 HydrophobicContact CG-CE2 3.66Å; L189-Y193 VanDerWaalsContact O-CD2 3.27Å; L189-Y193 WeakPolarHBondContact O-CD2 3.49Å; L189-Y193 PolarHBondContact O-N 3.36Å; R190-Y193 PolarHBondContact O-N 3.29Å; E191-Y193 PolarHBondContact O-N 3.01Å; Y193-Q195 VanDerWaalsContact C-N 3.28Å; Y193-Q195 PolarHBondContact O-N 3.14Å; Y193-Q196 PolarHBondContact O-N 2.84Å; Y193-L197 PolarHBondContact O-N 3.28Å
194	K	71.1	Confident	63.6	Low	123 Å²	123	99.2 Å²	99.2	54%	0.535	48%	0.477	S	S	.	.	H	α-helix	trans	-61.1	-40.5	175.4	-173	-178.8	176.7	-172.5	0	111.2	R190 E191 L197 V198	R190-K194 WeakPolarHBondContact O-CB 3.45Å; R190-K194 PolarHBondContact O-N 2.78Å; E191-K194 PolarHBondContact O-N 3.02Å; K194-L197 PolarHBondContact O-N 3.5Å; K194-V198 WeakPolarHBondContact O-CG2 3.48Å; K194-V198 PolarHBondContact O-N 3.27Å
195	Q	64.8	Low	61.4	Low	82 Å²	82	105.9 Å²	105.9	38%	0.383	51%	0.508	S	S	.	.	H	α-helix	trans	-67.9	-40.8	176	-70	171.9	9.3	0	0	112.1	E191 Q192 Y193 L197 V198 H199	E191-Q195 VanDerWaalsContact O-CG 3.25Å; E191-Q195 WeakPolarHBondContact O-CG 3.2Å; E191-Q195 PolarHBondContact O-N 3.36Å; E191-Q195 PolarHBondContact OE1-NE2 3.43Å; Q192-Q195 PolarHBondContact O-N 2.98Å; Y193-Q195 VanDerWaalsContact C-N 3.28Å; Y193-Q195 PolarHBondContact O-N 3.14Å; Q195-L197 VanDerWaalsContact C-N 3.31Å; Q195-L197 PolarHBondContact O-N 2.89Å; Q195-V198 PolarHBondContact O-N 3.36Å; Q195-H199 PolarHBondContact O-CD2 3.39Å; Q195-H199 PolarHBondContact O-N 3.17Å
196	Q	65.2	Low	58.8	Low	118 Å²	118	108.7 Å²	108.7	55%	0.551	52%	0.522	S	S	*	.	H	α-helix	trans	-63.7	-35	175.8	-74.3	180	1	0	0	112.9	Q192 Y193 V198 H199 D200	Q192-Q196 WeakPolarHBondContact O-CG 3.18Å; Q192-Q196 PolarHBondContact O-N 2.91Å; Y193-Q196 PolarHBondContact O-N 2.84Å; Q196-V198 VanDerWaalsContact C-N 3.33Å; Q196-V198 PolarHBondContact O-N 2.98Å; Q196-H199 PolarHBondContact O-N 3.43Å; Q196-D200 PolarHBondContact O-N 3.31Å
197	L	62.2	Low	56.4	Low	72 Å²	72	114 Å²	114	38%	0.377	56%	0.558	S	S	.	*	H	α-helix	trans	-69.8	-29.7	177.8	-162.9	71.8	0	0	0	112.7	Y193 K194 Q195 H199	Y193-L197 PolarHBondContact O-N 3.28Å; K194-L197 PolarHBondContact O-N 3.5Å; Q195-L197 VanDerWaalsContact C-N 3.31Å; Q195-L197 PolarHBondContact O-N 2.89Å; L197-H199 VanDerWaalsContact C-N 3.32Å
198	V	57.4	Low	54.4	Low	109 Å²	109	118 Å²	118	66%	0.661	58%	0.584	S	S	*	*	H	α-helix	trans	-74	-25.8	174	174.9	0	0	0	0	111.7	K194 Q195 Q196	K194-V198 WeakPolarHBondContact O-CG2 3.48Å; K194-V198 PolarHBondContact O-N 3.27Å; Q195-V198 PolarHBondContact O-N 3.36Å; Q196-V198 VanDerWaalsContact C-N 3.33Å; Q196-V198 PolarHBondContact O-N 2.98Å
199	H	50.4	Low	52	Low	145 Å²	145	114.8 Å²	114.8	67%	0.671	59%	0.589	S	S	*	*	H	α-helix	trans	-89.4	-7.9	-177.1	-76	-49.8	0	0	0	114.8	Q195 Q196 L197 D201	Q195-H199 PolarHBondContact O-CD2 3.39Å; Q195-H199 PolarHBondContact O-N 3.17Å; Q196-H199 PolarHBondContact O-N 3.43Å; L197-H199 VanDerWaalsContact C-N 3.32Å; H199-D201 PolarHBondContact O-N 3.31Å
200	D	44	Very low	49.5	Very low	59 Å²	59	116.7 Å²	116.7	32%	0.316	61%	0.609	S	S	.	*			trans	-92.3	81.9	179.3	-151	1	0	0	0	111.1	R136 Q196 S202	R136-D200 IonicContact CZ-OD2 3.04Å; R136-D200 IonicContact NH1-OD2 3.32Å; R136-D200 PolarHBondContact NH1-OD2 2.95Å; R136-D200 IonicContact NH2-OD2 3.75Å; Q196-D200 PolarHBondContact O-N 3.31Å; D200-S202 PolarHBondContact O-N 2.95Å; D200-S202 VanDerWaalsContact O-N 3.16Å; D200-S202 WeakPolarHBondContact OD1-CB 3.32Å; D200-S202 PolarHBondContact OD1-OG 2.89Å
201	D	45.1	Very low	47.1	Very low	156 Å²	156	118.1 Å²	118.1	83%	0.834	63%	0.632	S	S	*	*			trans	-71.9	11.8	170.5	-79.4	-36	0	0	0	112.9	H199 Y203	H199-D201 PolarHBondContact O-N 3.31Å; D201-Y203 PolarHBondContact O-N 2.94Å; D201-Y203 VanDerWaalsContact O-N 3.13Å
202	S	36.4	Very low	44.9	Very low	93 Å²	93	120.3 Å²	120.3	65%	0.65	65%	0.651	S	S	*	*			trans	-81.7	24.3	-177.2	-42	0	0	0	0	114.7	D200	D200-S202 PolarHBondContact O-N 2.95Å; D200-S202 VanDerWaalsContact O-N 3.16Å; D200-S202 WeakPolarHBondContact OD1-CB 3.32Å; D200-S202 PolarHBondContact OD1-OG 2.89Å
203	Y	32.1	Very low	42.8	Very low	181 Å²	181	121.2 Å²	121.2	71%	0.71	66%	0.664	S	S	*	*	S	Bend	trans	-98.4	114.3	164.3	-93.1	-88.6	0	0	0	108.4	D201 Q205	D201-Y203 PolarHBondContact O-N 2.94Å; D201-Y203 VanDerWaalsContact O-N 3.13Å; Y203-Q205 PolarHBondContact O-N 3.37Å; Y203-Q205 VanDerWaalsContact O-N 3.12Å
204	P	32.9	Very low	40.8	Very low	105 Å²	105	120.9 Å²	120.9	68%	0.682	68%	0.677	S	S	*	*			trans	-54.2	125.5	174.7	-20.5	30.9	0	0	0	108.6	E206	P204-E206 HydrophobicContact CB-CG 4.46Å; P204-E206 PolarHBondContact O-N 3.48Å
205	Q	30.7	Very low	38.9	Very low	201 Å²	201	124.5 Å²	124.5	94%	0.939	70%	0.696	S	S	*	*			trans	-59.4	75.4	156.8	-77.4	179.9	-55.8	0	0	107.4	Y203 S207	Y203-Q205 PolarHBondContact O-N 3.37Å; Y203-Q205 VanDerWaalsContact O-N 3.12Å; Q205-S207 PolarHBondContact O-N 3.44Å; Q205-S207 VanDerWaalsContact O-N 3.11Å
206	E	28.9	Very low	37.5	Very low	166 Å²	166	128.5 Å²	128.5	78%	0.776	72%	0.715	S	S	*	*			trans	-63.1	116.8	162.8	-81.9	-169.6	168.3	0	0	106.3	P204 I208	P204-E206 HydrophobicContact CB-CG 4.46Å; P204-E206 PolarHBondContact O-N 3.48Å; E206-I208 VanDerWaalsContact C-N 3.33Å; E206-I208 PolarHBondContact O-N 2.73Å
207	S	29.7	Very low	36.4	Very low	118 Å²	118	129.8 Å²	129.8	83%	0.825	73%	0.726	S	S	*	*			trans	-43	91.3	171.3	48.4	0	0	0	0	111.2	Q205 G209	Q205-S207 PolarHBondContact O-N 3.44Å; Q205-S207 VanDerWaalsContact O-N 3.11Å; S207-G209 PolarHBondContact O-N 3.1Å
208	I	38.7	Very low	35.1	Very low	170 Å²	170	133.3 Å²	133.3	87%	0.872	75%	0.75	S	S	*	*			trans	-74.6	84.4	161.6	-61.9	176.9	0	0	0	105.8	E206 S210	E206-I208 VanDerWaalsContact C-N 3.33Å; E206-I208 PolarHBondContact O-N 2.73Å; I208-S210 PolarHBondContact O-N 2.61Å
209	G	28.1	Very low	34.2	Very low	57 Å²	57	133 Å²	133	59%	0.588	75%	0.753	S	S	*	*			trans	-61.1	128.1	171.2	0	0	0	0	0	110.5	S207	S207-G209 PolarHBondContact O-N 3.1Å
210	S	26.7	Very low	33.5	Very low	110 Å²	110	131.8 Å²	131.8	77%	0.769	76%	0.761	S	S	*	*			trans	35.6	94.4	138.1	-174.8	0	0	0	0	116.7	I208	I208-S210 PolarHBondContact O-N 2.61Å
211	S	27.4	Very low	33.5	Very low	115 Å²	115	137.1 Å²	137.1	80%	0.804	78%	0.782	S	S	*	*			trans	-143.5	103.8	143	-74.2	0	0	0	0	108.5
212	T	27.2	Very low	33.2	Very low	129 Å²	129	138.8 Å²	138.8	79%	0.791	78%	0.782	S	S	*	*			trans	-38.2	125.8	171.3	50.3	0	0	0	0	113.6
213	T	30.2	Very low	33.5	Very low	129 Å²	129	138.2 Å²	138.2	79%	0.791	78%	0.778	S	S	*	*			trans	-156.1	110	146.6	1.6	0	0	0	0	109.8
214	S	28.8	Very low	33.9	Very low	100 Å²	100	134 Å²	134	70%	0.699	78%	0.781	S	S	*	*			trans	47.4	103.8	153.2	53.7	0	0	0	0	118.5	E216	S214-E216 PolarHBondContact O-N 2.87Å
215	Q	30.9	Very low	34.5	Very low	199 Å²	199	133.7 Å²	133.7	93%	0.93	78%	0.781	S	S	*	*			trans	-43.4	109.4	142.6	-67.3	171.2	-39.4	0	0	110.2
216	E	34.4	Very low	35.7	Very low	166 Å²	166	130.6 Å²	130.6	78%	0.776	77%	0.766	S	S	*	*			trans	-145.6	102.1	152.1	-69.5	-167.3	167.4	0	0	108.6	S214	S214-E216 PolarHBondContact O-N 2.87Å
217	D	42.3	Very low	37.4	Very low	146 Å²	146	130.8 Å²	130.8	78%	0.781	77%	0.767	S	S	*	*	S	Bend	trans	66.5	60.1	135.3	-57.3	-13.7	0	0	0	121.7
218	T	35	Very low	39.6	Very low	145 Å²	145	126.5 Å²	126.5	89%	0.89	74%	0.735	S	S	*	*			trans	-131	21.4	153.5	68.9	0	0	0	0	115.4
219	S	37.9	Very low	41.7	Very low	104 Å²	104	123.2 Å²	123.2	73%	0.727	72%	0.719	S	S	*	*			trans	-93.3	4	170.8	52.2	0	0	0	0	114.2	F221	S219-F221 PolarHBondContact O-N 3.45Å
220	S	36.9	Very low	44.4	Very low	119 Å²	119	124.1 Å²	124.1	83%	0.832	71%	0.71	S	S	*	*			trans	-93.9	62.8	179.4	-163.8	0	0	0	0	113.1
221	F	43.2	Very low	47.2	Very low	171 Å²	171	124.4 Å²	124.4	75%	0.75	71%	0.708	S	S	*	*			trans	-155.6	47.2	150.3	-146.7	-90.4	0	0	0	108.6	S219 S223	S219-F221 PolarHBondContact O-N 3.45Å; F221-S223 PolarHBondContact O-N 3.24Å
222	F	38.2	Very low	50.1	Low	190 Å²	190	123.5 Å²	123.5	83%	0.833	69%	0.69	S	S	*	*			trans	-66.3	108.7	148.7	-110.1	-97.7	0	0	0	104.1	A224	F222-A224 PolarHBondContact O-N 3.43Å
223	S	42.9	Very low	53.1	Low	81 Å²	81	117.5 Å²	117.5	57%	0.566	65%	0.654	S	S	*	*			trans	-45.5	121.6	162.2	-58.7	0	0	0	0	105.6	F221 S225	F221-S223 PolarHBondContact O-N 3.24Å; S223-S225 PolarHBondContact O-N 3.37Å
224	A	41.1	Very low	56	Low	93 Å²	93	118 Å²	118	77%	0.769	65%	0.647	S	S	*	*			trans	-42.5	118	166	0	0	0	0	0	105.4	F222 E226	F222-A224 PolarHBondContact O-N 3.43Å; A224-E226 PolarHBondContact O-N 3.25Å; A224-E226 VanDerWaalsContact O-N 3.09Å
225	S	46.4	Very low	58.9	Low	99 Å²	99	117.5 Å²	117.5	69%	0.692	64%	0.636	S	S	*	*			trans	-39.3	124.8	179	-56.1	0	0	0	0	107	S223 Q227	S223-S225 PolarHBondContact O-N 3.37Å; S225-Q227 PolarHBondContact O-N 2.95Å
226	E	53.9	Low	61.8	Low	135 Å²	135	109.2 Å²	109.2	63%	0.631	60%	0.598	S	S	*	*			trans	-52.8	87.7	-178.1	-73.3	171.3	174.8	0	0	108.4	A224 L228	A224-E226 PolarHBondContact O-N 3.25Å; A224-E226 VanDerWaalsContact O-N 3.09Å; E226-L228 PolarHBondContact O-N 3.4Å
227	Q	65.8	Low	64.5	Low	170 Å²	170	102.5 Å²	102.5	79%	0.794	57%	0.567	S	S	*	*			trans	-77.3	111.9	-178.5	-175.9	66.9	29.9	0	0	103.8	S225 D229	S225-Q227 PolarHBondContact O-N 2.95Å; Q227-D229 PolarHBondContact O-N 3.4Å
228	L	75.6	Confident	66.8	Low	28 Å²	28	98.8 Å²	98.8	15%	0.147	55%	0.545	C	S	.	.			trans	-57	124.7	177.3	-68	172	0	0	0	108.8	E226 L230 Y260 L263 D273 L277	E226-L228 PolarHBondContact O-N 3.4Å; L228-L230 HydrophobicContact CB-CD2 4.24Å; L228-L230 PolarHBondContact O-N 3.42Å; L228-Y260 HydrophobicContact CD1-CE1 4.24Å; L228-L263 HydrophobicContact CD2-CD1 4.36Å; L228-L263 HydrophobicContact CD2-CD2 4.36Å; L228-D273 HydrophobicContact CD2-CB 4.06Å; L228-L277 HydrophobicContact CD1-CD1 3.59Å; L228-L277 HydrophobicContact CD2-CD1 3.75Å; L228-L277 HydrophobicContact CG-CD1 4.34Å
229	D	82.3	Confident	69.4	Low	101 Å²	101	96.4 Å²	96.4	54%	0.54	52%	0.522	S	S	.	.			trans	-78	109.7	173.8	-173.2	2.3	0	0	0	109.2	Q227 T231 I274	Q227-D229 PolarHBondContact O-N 3.4Å; D229-T231 WeakPolarHBondContact OD1-CB 3.49Å; D229-T231 PolarHBondContact OD1-N 2.88Å; D229-T231 PolarHBondContact OD1-OG1 3.05Å; D229-I274 WeakPolarHBondContact O-CG2 3.45Å
230	L	84.8	Confident	71.9	Confident	77 Å²	77	91.9 Å²	91.9	40%	0.403	49%	0.49	S	S	.	.			trans	-97.7	5.3	179.1	-55.1	-175.9	0	0	0	112.5	L228 E232 L233 I274	L228-L230 HydrophobicContact CB-CD2 4.24Å; L228-L230 PolarHBondContact O-N 3.42Å; L230-E232 PolarHBondContact O-N 3.47Å; L230-E232 VanDerWaalsContact O-N 3.16Å; L230-L233 HydrophobicContact CB-CB 4.44Å; L230-L233 HydrophobicContact CD2-CD2 4.44Å; L230-L233 VanDerWaalsContact O-CB 3.26Å; L230-L233 WeakPolarHBondContact O-CB 3.33Å; L230-L233 PolarHBondContact O-N 3.25Å; L230-I274 HydrophobicContact CD2-CG2 3.44Å; L230-I274 VanDerWaalsContact CD2-CG2 3.44Å
231	T	87	Confident	74.4	Confident	116 Å²	116	86.7 Å²	86.7	71%	0.712	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-34.3	-174	-54.1	0	0	0	0	112.5	D229	D229-T231 WeakPolarHBondContact OD1-CB 3.49Å; D229-T231 PolarHBondContact OD1-N 2.88Å; D229-T231 PolarHBondContact OD1-OG1 3.05Å
232	E	88.1	Confident	76.6	Confident	95 Å²	95	85.7 Å²	85.7	44%	0.444	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	3.9	-178.6	-60.8	-169	177.2	0	0	113.8	L230 E234 L235 L236 L272 I274	L230-E232 PolarHBondContact O-N 3.47Å; L230-E232 VanDerWaalsContact O-N 3.16Å; E232-E234 PolarHBondContact O-N 2.61Å; E232-L235 PolarHBondContact O-N 3.03Å; E232-L236 WeakPolarHBondContact O-CB 3.45Å; E232-L236 PolarHBondContact O-N 2.87Å; E232-L272 HydrophobicContact CB-CD1 3.97Å; E232-L272 WeakPolarHBondContact OE2-CD1 3.36Å; E232-I274 HydrophobicContact CB-CD1 4.45Å
233	L	89.8	Confident	79.2	Confident	4 Å²	4	78.9 Å²	78.9	2%	0.021	41%	0.413	C	S	.	.	H	α-helix	trans	-61.2	-44.7	-175	-177.7	61.5	0	0	0	112.5	L230 L235 L236 M237 L250 L253 N254 I274	L230-L233 HydrophobicContact CB-CB 4.44Å; L230-L233 HydrophobicContact CD2-CD2 4.44Å; L230-L233 VanDerWaalsContact O-CB 3.26Å; L230-L233 WeakPolarHBondContact O-CB 3.33Å; L230-L233 PolarHBondContact O-N 3.25Å; L233-L235 PolarHBondContact O-N 3.28Å; L233-L236 PolarHBondContact O-N 3.13Å; L233-M237 HydrophobicContact CG-SD 4.3Å; L233-M237 VanDerWaalsContact O-CG 3.32Å; L233-M237 WeakPolarHBondContact O-CG 3.47Å; L233-M237 PolarHBondContact O-N 3.37Å; L233-L250 HydrophobicContact CD1-CB 4.11Å; L233-L250 HydrophobicContact CD1-CD2 4.06Å; L233-L253 HydrophobicContact CD1-CB 4.33Å; L233-L253 HydrophobicContact CD2-CB 4.28Å; L233-N254 HydrophobicContact CD2-CB 3.76Å; L233-I274 HydrophobicContact CB-CD1 3.96Å; L233-I274 HydrophobicContact CD1-CB 4.44Å; L233-I274 HydrophobicContact CD1-CD1 4.13Å
234	E	90.4	Very high	81.7	Confident	140 Å²	140	78 Å²	78	65%	0.654	41%	0.405	S	S	*	.	H	α-helix	trans	-66.8	-38.4	-179.5	-174.9	155.2	-174.5	0	0	112.2	E232 M237 Q238	E232-E234 PolarHBondContact O-N 2.61Å; E234-M237 PolarHBondContact O-N 2.79Å; E234-Q238 WeakPolarHBondContact O-CG 3.34Å; E234-Q238 PolarHBondContact O-N 3.46Å
235	L	91.1	Very high	84.3	Confident	89 Å²	89	74.1 Å²	74.1	47%	0.466	37%	0.372	S	S	.	.	H	α-helix	trans	-62.5	-45.7	172.4	-70.6	174.8	0	0	0	110.8	E232 L233 M237 Q238 F239	E232-L235 PolarHBondContact O-N 3.03Å; L233-L235 PolarHBondContact O-N 3.28Å; L235-M237 VanDerWaalsContact C-N 3.3Å; L235-M237 PolarHBondContact O-N 3.16Å; L235-Q238 PolarHBondContact O-N 3.33Å; L235-F239 HydrophobicContact CB-CD2 4.45Å; L235-F239 HydrophobicContact CB-CE2 4.12Å; L235-F239 WeakPolarHBondContact O-CD2 3.32Å; L235-F239 PolarHBondContact O-N 3.01Å
236	L	91.3	Very high	86.7	Confident	25 Å²	25	69.5 Å²	69.5	13%	0.131	34%	0.339	C	S	.	.	H	α-helix	trans	-62.6	-38.5	179.1	-167.8	64.3	0	0	0	111.7	E232 L233 F239 N240 L250 I274 E275	E232-L236 WeakPolarHBondContact O-CB 3.45Å; E232-L236 PolarHBondContact O-N 2.87Å; L233-L236 PolarHBondContact O-N 3.13Å; L236-F239 PolarHBondContact O-N 3.45Å; L236-N240 WeakPolarHBondContact O-CB 3.32Å; L236-N240 PolarHBondContact O-N 3.1Å; L236-N240 PolarHBondContact O-ND2 2.57Å; L236-L250 HydrophobicContact CB-CD1 4.31Å; L236-L250 HydrophobicContact CD2-CD1 4.07Å; L236-L250 HydrophobicContact CD2-CD2 3.67Å; L236-L250 HydrophobicContact CG-CD1 3.76Å; L236-L250 HydrophobicContact CG-CD2 4.32Å; L236-I274 HydrophobicContact CD2-CD1 3.97Å; L236-I274 HydrophobicContact CD2-CG1 4.08Å; L236-E275 HydrophobicContact CD2-CB 4.05Å; L236-E275 HydrophobicContact CD2-CG 4.48Å
237	M	91.2	Very high	88.6	Confident	24 Å²	24	66.2 Å²	66.2	12%	0.118	32%	0.321	C	S	.	.	H	α-helix	trans	-60.8	-49.3	172.4	-74	176.3	67	0	0	111.4	L233 E234 L235 F239 N240 V241 Y247 L250 K251	L233-M237 HydrophobicContact CG-SD 4.3Å; L233-M237 VanDerWaalsContact O-CG 3.32Å; L233-M237 WeakPolarHBondContact O-CG 3.47Å; L233-M237 PolarHBondContact O-N 3.37Å; E234-M237 PolarHBondContact O-N 2.79Å; L235-M237 VanDerWaalsContact C-N 3.3Å; L235-M237 PolarHBondContact O-N 3.16Å; M237-F239 VanDerWaalsContact C-N 3.31Å; M237-F239 PolarHBondContact O-N 3.45Å; M237-N240 PolarHBondContact O-N 3.48Å; M237-N240 VanDerWaalsContact O-N 3.09Å; M237-V241 WeakPolarHBondContact O-CG2 3.28Å; M237-V241 PolarHBondContact O-N 3.07Å; M237-Y247 HydrophobicContact CB-CD2 4.18Å; M237-Y247 HydrophobicContact CB-CE2 3.87Å; M237-Y247 HydrophobicContact CE-CE1 4.48Å; M237-Y247 HydrophobicContact CE-CE2 3.84Å; M237-Y247 HydrophobicContact CG-CE2 4.42Å; M237-Y247 WeakPolarHBondContact O-CD2 3.5Å; M237-L250 HydrophobicContact CG-CB 3.66Å; M237-L250 HydrophobicContact CG-CD1 4.19Å; M237-K251 HydrophobicContact CE-CB 4.11Å
238	Q	90.4	Very high	90	Very high	69 Å²	69	62.4 Å²	62.4	32%	0.322	31%	0.306	S	S	.	.	H	α-helix	trans	-60.2	-37	178.1	-72.8	176.2	2	0	0	113	E234 L235 N240 V241	E234-Q238 WeakPolarHBondContact O-CG 3.34Å; E234-Q238 PolarHBondContact O-N 3.46Å; L235-Q238 PolarHBondContact O-N 3.33Å; Q238-N240 VanDerWaalsContact C-N 3.31Å; Q238-N240 PolarHBondContact O-N 2.98Å; Q238-V241 VanDerWaalsContact O-CG2 3.28Å; Q238-V241 WeakPolarHBondContact O-CG2 3.4Å
239	F	89.3	Confident	91	Very high	94 Å²	94	61.1 Å²	61.1	41%	0.412	30%	0.3	S	S	.	.	H	α-helix	trans	-74.2	-19.1	177.2	-68.8	-56.8	0	0	0	113.9	L235 L236 M237	L235-F239 HydrophobicContact CB-CD2 4.45Å; L235-F239 HydrophobicContact CB-CE2 4.12Å; L235-F239 WeakPolarHBondContact O-CD2 3.32Å; L235-F239 PolarHBondContact O-N 3.01Å; L236-F239 PolarHBondContact O-N 3.45Å; M237-F239 VanDerWaalsContact C-N 3.31Å; M237-F239 PolarHBondContact O-N 3.45Å
240	N	90.4	Very high	91.6	Very high	10 Å²	10	56.3 Å²	56.3	5%	0.053	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	18.3	-172.5	-72	-80.9	0	0	0	114.2	L236 M237 Q238 R242 R243 Y246 L250	L236-N240 WeakPolarHBondContact O-CB 3.32Å; L236-N240 PolarHBondContact O-N 3.1Å; L236-N240 PolarHBondContact O-ND2 2.57Å; M237-N240 PolarHBondContact O-N 3.48Å; M237-N240 VanDerWaalsContact O-N 3.09Å; Q238-N240 VanDerWaalsContact C-N 3.31Å; Q238-N240 PolarHBondContact O-N 2.98Å; N240-R242 PolarHBondContact O-N 3.32Å; N240-R243 CarbonylContact O-C 3.36Å; N240-R243 WeakPolarHBondContact O-CA 3.39Å; N240-R243 WeakPolarHBondContact O-CB 3.5Å; N240-R243 PolarHBondContact O-N 3.2Å; N240-R243 WeakPolarHBondContact OD1-CD 3.49Å; N240-R243 PolarHBondContact OD1-NH1 2.89Å; N240-Y246 HydrophobicContact CB-CD1 3.76Å; N240-Y246 HydrophobicContact CB-CE1 4.12Å; N240-Y246 WeakPolarHBondContact OD1-CD1 3.48Å; N240-L250 HydrophobicContact CB-CD1 4.38Å
241	V	89.4	Confident	92	Very high	10 Å²	10	56.9 Å²	56.9	6%	0.061	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-35.6	177	178.5	0	0	0	0	112.4	L71 L74 V75 M237 Q238 R243 Y247	L71-V241 HydrophobicContact CD1-CG1 3.4Å; L74-V241 HydrophobicContact CD2-CB 4.2Å; L74-V241 HydrophobicContact CD2-CG1 3.86Å; L74-V241 HydrophobicContact CD2-CG2 3.22Å; L74-V241 HydrophobicContact CG-CG1 4.45Å; L74-V241 HydrophobicContact CG-CG2 3.8Å; V75-V241 HydrophobicContact CG2-CG1 4.04Å; M237-V241 WeakPolarHBondContact O-CG2 3.28Å; M237-V241 PolarHBondContact O-N 3.07Å; Q238-V241 VanDerWaalsContact O-CG2 3.28Å; Q238-V241 WeakPolarHBondContact O-CG2 3.4Å; V241-R243 PolarHBondContact O-N 2.84Å; V241-Y247 HydrophobicContact CG2-CD2 4.48Å; V241-Y247 HydrophobicContact CG2-CE2 4.42Å
242	R	89.6	Confident	92.2	Very high	150 Å²	150	55 Å²	55	57%	0.566	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	1.1	176.7	-61.5	-174.4	-179.6	-135.6	0.2	114	D79 N240 P244	D79-R242 IonicContact OD1-CZ 3.45Å; D79-R242 IonicContact OD1-NE 2.82Å; D79-R242 IonicContact OD1-NH2 3.31Å; D79-R242 PolarHBondContact OD1-NH2 3.01Å; D79-R242 IonicContact OD2-NH2 3.49Å; D79-R242 PolarHBondContact OD2-NH2 2.82Å; N240-R242 PolarHBondContact O-N 3.32Å; R242-P244 VanDerWaalsContact C-CD 3.48Å; R242-P244 WeakPolarHBondContact O-CD 3.23Å
243	R	93.2	Very high	92.3	Very high	47 Å²	47	50.8 Å²	50.8	18%	0.177	24%	0.239	C	C	.	.			trans	-124.6	70.9	179.5	-64.2	176.9	-177.2	146.6	-2	109.1	N240 V241 L245 Y246 Y247 Y468 Y574	N240-R243 CarbonylContact O-C 3.36Å; N240-R243 WeakPolarHBondContact O-CA 3.39Å; N240-R243 WeakPolarHBondContact O-CB 3.5Å; N240-R243 PolarHBondContact O-N 3.2Å; N240-R243 WeakPolarHBondContact OD1-CD 3.49Å; N240-R243 PolarHBondContact OD1-NH1 2.89Å; V241-R243 PolarHBondContact O-N 2.84Å; R243-L245 VanDerWaalsContact C-N 3.3Å; R243-L245 PolarHBondContact O-N 3.24Å; R243-Y246 PolarHBondContact O-N 2.97Å; R243-Y247 PolarHBondContact O-N 2.86Å; R243-Y468 PolarHBondContact NE-O 2.82Å; R243-Y468 PolarHBondContact NH2-O 3.38Å; R243-Y574 CarbonylContact C-O 3.55Å; R243-Y574 VanDerWaalsContact C-O 3.28Å; R243-Y574 WeakPolarHBondContact CA-O 3.47Å; R243-Y574 WeakPolarHBondContact CB-O 3.18Å
244	P	94	Very high	92.2	Very high	61 Å²	61	55.8 Å²	55.8	40%	0.396	27%	0.266	S	S	.	.	H	α-helix	trans	-57.8	-36.2	-167.9	13.3	-25.7	0	0	0	114.2	R242 Y246 Y247 N248 T575	R242-P244 VanDerWaalsContact C-CD 3.48Å; R242-P244 WeakPolarHBondContact O-CD 3.23Å; P244-Y246 PolarHBondContact O-N 3.28Å; P244-Y247 PolarHBondContact O-N 3.31Å; P244-N248 WeakPolarHBondContact O-CB 3.49Å; P244-N248 PolarHBondContact O-N 2.73Å; P244-N248 PolarHBondContact O-ND2 3.5Å; P244-T575 WeakPolarHBondContact CG-O 3.33Å
245	L	96.1	Very high	92	Very high	13 Å²	13	55.4 Å²	55.4	7%	0.068	26%	0.264	C	S	.	.	H	α-helix	trans	-59.2	-46.2	173.4	176.7	65.4	0	0	0	111.9	R243 A249 C282 Q285 Y574 T575 V577 L580	R243-L245 VanDerWaalsContact C-N 3.3Å; R243-L245 PolarHBondContact O-N 3.24Å; L245-A249 PolarHBondContact O-N 2.56Å; L245-C282 HydrophobicContact CD2-CB 4.1Å; L245-C282 HydrophobicContact CG-CB 4.26Å; L245-Q285 VanDerWaalsContact CD1-OE1 3.31Å; L245-Y574 WeakPolarHBondContact CB-O 3.27Å; L245-T575 WeakPolarHBondContact CB-O 3.35Å; L245-T575 PolarHBondContact N-O 2.8Å; L245-T575 VanDerWaalsContact N-O 3.11Å; L245-V577 HydrophobicContact CD1-CG2 3.66Å; L245-V577 HydrophobicContact CD2-CG2 4.34Å; L245-L580 HydrophobicContact CD2-CB 4.06Å; L245-L580 HydrophobicContact CD2-CD2 3.66Å
246	Y	96.2	Very high	91.6	Very high	2 Å²	2	53 Å²	53	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-72.9	-41.1	179.3	-178.5	-134.7	0	0	0	112.4	N240 R243 P244 N248 A249 L250 E275 K279	N240-Y246 HydrophobicContact CB-CD1 3.76Å; N240-Y246 HydrophobicContact CB-CE1 4.12Å; N240-Y246 WeakPolarHBondContact OD1-CD1 3.48Å; R243-Y246 PolarHBondContact O-N 2.97Å; P244-Y246 PolarHBondContact O-N 3.28Å; Y246-N248 VanDerWaalsContact C-N 3.28Å; Y246-N248 PolarHBondContact O-N 3.38Å; Y246-A249 WeakPolarHBondContact O-CA 3.41Å; Y246-A249 WeakPolarHBondContact O-CB 3.36Å; Y246-A249 PolarHBondContact O-N 3.49Å; Y246-L250 HydrophobicContact CD1-CD1 4.24Å; Y246-L250 HydrophobicContact CD2-CG 4.29Å; Y246-L250 HydrophobicContact CE1-CD1 3.92Å; Y246-L250 HydrophobicContact CE1-CG 4.44Å; Y246-L250 HydrophobicContact CE2-CD1 4.36Å; Y246-L250 HydrophobicContact CE2-CD2 3.88Å; Y246-L250 HydrophobicContact CE2-CG 4Å; Y246-L250 WeakPolarHBondContact O-CG 3.49Å; Y246-L250 PolarHBondContact O-N 2.84Å; Y246-E275 VanDerWaalsContact OH-CA 3.25Å; Y246-E275 WeakPolarHBondContact OH-CA 3.5Å; Y246-E275 WeakPolarHBondContact OH-CG 3.16Å; Y246-E275 PolarHBondContact OH-O 3.45Å; Y246-K279 HydrophobicContact CD2-CG 4.24Å; Y246-K279 HydrophobicContact CE2-CG 3.69Å
247	Y	95.1	Very high	91.2	Very high	65 Å²	65	60.4 Å²	60.4	26%	0.255	30%	0.295	S	S	.	.	H	α-helix	trans	-53.8	-45.4	172	178.7	-92.8	0	0	0	111.7	M237 V241 R243 P244 A249 L250 K251	M237-Y247 HydrophobicContact CB-CD2 4.18Å; M237-Y247 HydrophobicContact CB-CE2 3.87Å; M237-Y247 HydrophobicContact CE-CE1 4.48Å; M237-Y247 HydrophobicContact CE-CE2 3.84Å; M237-Y247 HydrophobicContact CG-CE2 4.42Å; M237-Y247 WeakPolarHBondContact O-CD2 3.5Å; V241-Y247 HydrophobicContact CG2-CD2 4.48Å; V241-Y247 HydrophobicContact CG2-CE2 4.42Å; R243-Y247 PolarHBondContact O-N 2.86Å; P244-Y247 PolarHBondContact O-N 3.31Å; Y247-A249 VanDerWaalsContact C-N 3.33Å; Y247-A249 PolarHBondContact O-N 3.34Å; Y247-L250 PolarHBondContact O-N 3.39Å; Y247-K251 PolarHBondContact O-N 2.9Å
248	N	95	Very high	91.2	Very high	90 Å²	90	59.5 Å²	59.5	48%	0.481	29%	0.291	S	S	.	.	H	α-helix	trans	-63.1	-38.2	176	-72.1	-21.6	0	0	0	112.2	P244 Y246 L250 K251 L252	P244-N248 WeakPolarHBondContact O-CB 3.49Å; P244-N248 PolarHBondContact O-N 2.73Å; P244-N248 PolarHBondContact O-ND2 3.5Å; Y246-N248 VanDerWaalsContact C-N 3.28Å; Y246-N248 PolarHBondContact O-N 3.38Å; N248-L250 VanDerWaalsContact C-N 3.34Å; N248-K251 PolarHBondContact O-N 3.47Å; N248-L252 WeakPolarHBondContact O-CG 3.32Å; N248-L252 PolarHBondContact O-N 3.01Å
249	A	95.8	Very high	91.3	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.008	29%	0.292	C	S	.	.	H	α-helix	trans	-64.7	-37.6	174.6	0	0	0	0	0	112.6	L245 Y246 Y247 L252 L253 G278 H281	L245-A249 PolarHBondContact O-N 2.56Å; Y246-A249 WeakPolarHBondContact O-CA 3.41Å; Y246-A249 WeakPolarHBondContact O-CB 3.36Å; Y246-A249 PolarHBondContact O-N 3.49Å; Y247-A249 VanDerWaalsContact C-N 3.33Å; Y247-A249 PolarHBondContact O-N 3.34Å; A249-L252 WeakPolarHBondContact O-CB 3.43Å; A249-L252 PolarHBondContact O-N 2.91Å; A249-L253 PolarHBondContact O-N 3.28Å; A249-G278 WeakPolarHBondContact CB-O 3.48Å; A249-H281 HydrophobicContact CB-CB 4.27Å
250	L	95	Very high	91.5	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-68.6	-38.8	173.8	-64.2	175.8	0	0	0	111.8	L233 L236 M237 N240 Y246 Y247 N248 L252 L253 N254	L233-L250 HydrophobicContact CD1-CB 4.11Å; L233-L250 HydrophobicContact CD1-CD2 4.06Å; L236-L250 HydrophobicContact CB-CD1 4.31Å; L236-L250 HydrophobicContact CD2-CD1 4.07Å; L236-L250 HydrophobicContact CD2-CD2 3.67Å; L236-L250 HydrophobicContact CG-CD1 3.76Å; L236-L250 HydrophobicContact CG-CD2 4.32Å; M237-L250 HydrophobicContact CG-CB 3.66Å; M237-L250 HydrophobicContact CG-CD1 4.19Å; N240-L250 HydrophobicContact CB-CD1 4.38Å; Y246-L250 HydrophobicContact CD1-CD1 4.24Å; Y246-L250 HydrophobicContact CD2-CG 4.29Å; Y246-L250 HydrophobicContact CE1-CD1 3.92Å; Y246-L250 HydrophobicContact CE1-CG 4.44Å; Y246-L250 HydrophobicContact CE2-CD1 4.36Å; Y246-L250 HydrophobicContact CE2-CD2 3.88Å; Y246-L250 HydrophobicContact CE2-CG 4Å; Y246-L250 WeakPolarHBondContact O-CG 3.49Å; Y246-L250 PolarHBondContact O-N 2.84Å; Y247-L250 PolarHBondContact O-N 3.39Å; N248-L250 VanDerWaalsContact C-N 3.34Å; L250-L252 VanDerWaalsContact C-N 3.29Å; L250-L252 PolarHBondContact O-N 2.97Å; L250-L253 HydrophobicContact CD2-CD1 4.16Å; L250-L253 WeakPolarHBondContact O-CB 3.38Å; L250-L253 PolarHBondContact O-N 3.33Å; L250-L253 VanDerWaalsContact O-N 3.08Å; L250-N254 PolarHBondContact O-N 2.84Å
251	K	92.8	Very high	91.5	Very high	89 Å²	89	59.2 Å²	59.2	39%	0.387	29%	0.291	S	S	.	.	H	α-helix	trans	-61.1	-38.7	173.1	-175.4	174.4	172.7	175.9	0	111.8	M237 Y247 N248 L253 N254 E255	M237-K251 HydrophobicContact CE-CB 4.11Å; Y247-K251 PolarHBondContact O-N 2.9Å; N248-K251 PolarHBondContact O-N 3.47Å; K251-L253 VanDerWaalsContact C-N 3.27Å; K251-L253 PolarHBondContact O-N 2.99Å; K251-N254 WeakPolarHBondContact O-CB 3.38Å; K251-N254 PolarHBondContact O-N 3.43Å; K251-E255 WeakPolarHBondContact CE-OE1 3.3Å; K251-E255 IonicContact NZ-OE1 3.89Å; K251-E255 PolarHBondContact O-N 3.42Å
252	L	92.6	Very high	91.6	Very high	78 Å²	78	59.9 Å²	59.9	41%	0.408	30%	0.297	S	S	.	.	H	α-helix	trans	-62.5	-31.6	173.7	-71.8	173.7	0	0	0	113	N248 A249 L250 N254 G256 H281	N248-L252 WeakPolarHBondContact O-CG 3.32Å; N248-L252 PolarHBondContact O-N 3.01Å; A249-L252 WeakPolarHBondContact O-CB 3.43Å; A249-L252 PolarHBondContact O-N 2.91Å; L250-L252 VanDerWaalsContact C-N 3.29Å; L250-L252 PolarHBondContact O-N 2.97Å; L252-N254 VanDerWaalsContact C-N 3.3Å; L252-G256 CarbonylContact O-C 3.36Å; L252-G256 WeakPolarHBondContact O-CA 3.19Å; L252-G256 PolarHBondContact O-N 3.48Å; L252-H281 WeakPolarHBondContact CD1-NE2 2.93Å
253	L	90.4	Very high	91.8	Very high	6 Å²	6	54.7 Å²	54.7	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-71.1	-25.4	172.1	-74	166.9	0	0	0	112.9	L233 A249 L250 K251 G256 V258 I274 L277	L233-L253 HydrophobicContact CD1-CB 4.33Å; L233-L253 HydrophobicContact CD2-CB 4.28Å; A249-L253 PolarHBondContact O-N 3.28Å; L250-L253 HydrophobicContact CD2-CD1 4.16Å; L250-L253 WeakPolarHBondContact O-CB 3.38Å; L250-L253 PolarHBondContact O-N 3.33Å; L250-L253 VanDerWaalsContact O-N 3.08Å; K251-L253 VanDerWaalsContact C-N 3.27Å; K251-L253 PolarHBondContact O-N 2.99Å; L253-G256 CarbonylContact C-O 3.51Å; L253-G256 WeakPolarHBondContact CA-O 3.38Å; L253-V258 HydrophobicContact CD2-CB 3.65Å; L253-V258 HydrophobicContact CD2-CG2 3.45Å; L253-V258 VanDerWaalsContact CD2-CG2 3.45Å; L253-V258 HydrophobicContact CG-CB 4.39Å; L253-V258 HydrophobicContact CG-CG2 3.66Å; L253-I274 HydrophobicContact CD1-CB 4.33Å; L253-I274 WeakPolarHBondContact CD1-O 3.37Å; L253-L277 HydrophobicContact CD1-CB 4.06Å; L253-L277 HydrophobicContact CD2-CB 4.04Å; L253-L277 HydrophobicContact CD2-CD1 4.03Å
254	N	86.7	Confident	91.8	Very high	108 Å²	108	54.6 Å²	54.6	58%	0.578	28%	0.28	S	S	*	.	H	α-helix	trans	-77.6	-38.4	175.8	-171.6	59.6	0	0	0	111.6	L233 L250 K251 L252	L233-N254 HydrophobicContact CD2-CB 3.76Å; L250-N254 PolarHBondContact O-N 2.84Å; K251-N254 WeakPolarHBondContact O-CB 3.38Å; K251-N254 PolarHBondContact O-N 3.43Å; L252-N254 VanDerWaalsContact C-N 3.3Å
255	E	87.4	Confident	91.9	Very high	132 Å²	132	52.1 Å²	52.1	62%	0.617	26%	0.264	S	S	*	.	H	α-helix	trans	-88.3	-19	-177.2	-66.1	174.2	-178.2	0	0	113.4	K251	K251-E255 WeakPolarHBondContact CE-OE1 3.3Å; K251-E255 IonicContact NZ-OE1 3.89Å; K251-E255 PolarHBondContact O-N 3.42Å
256	G	81.4	Confident	91.8	Very high	40 Å²	40	60.1 Å²	60.1	41%	0.412	30%	0.301	S	S	.	.	S	Bend	trans	-166.1	-159.8	-177	0	0	0	0	0	112.7	L252 L253	L252-G256 CarbonylContact O-C 3.36Å; L252-G256 WeakPolarHBondContact O-CA 3.19Å; L252-G256 PolarHBondContact O-N 3.48Å; L253-G256 CarbonylContact C-O 3.51Å; L253-G256 WeakPolarHBondContact CA-O 3.38Å
257	E	83.8	Confident	91.7	Very high	179 Å²	179	62.8 Å²	62.8	84%	0.836	31%	0.313	S	S	*	.			trans	-110.8	132.7	-179.4	-66.9	180	-179	0	0	110.6	P259	E257-P259 WeakPolarHBondContact O-CD 3.2Å
258	V	91.3	Very high	91.6	Very high	5 Å²	5	60 Å²	60	3%	0.03	30%	0.303	C	S	.	.			trans	-82.6	114.2	164.9	174	0	0	0	0	107.2	L253 Y260 L277 H281	L253-V258 HydrophobicContact CD2-CB 3.65Å; L253-V258 HydrophobicContact CD2-CG2 3.45Å; L253-V258 VanDerWaalsContact CD2-CG2 3.45Å; L253-V258 HydrophobicContact CG-CB 4.39Å; L253-V258 HydrophobicContact CG-CG2 3.66Å; V258-Y260 WeakPolarHBondContact O-CD1 3.06Å; V258-L277 HydrophobicContact CB-CB 4.37Å; V258-L277 HydrophobicContact CG1-CB 4.45Å; V258-H281 HydrophobicContact CG1-CB 4.08Å; V258-H281 HydrophobicContact CG2-CB 4.45Å
259	P	92.8	Very high	91.6	Very high	52 Å²	52	58.6 Å²	58.6	34%	0.338	31%	0.309	S	S	.	.			trans	-69.6	141.6	-178.2	30.3	-36.7	0	0	0	110.2	E257 R284 K354 I355	E257-P259 WeakPolarHBondContact O-CD 3.2Å; P259-R284 VanDerWaalsContact O-CZ 3.27Å; P259-R284 PolarHBondContact O-NH1 2.99Å; P259-R284 PolarHBondContact O-NH2 3.19Å; P259-K354 HydrophobicContact CB-CB 3.72Å; P259-K354 HydrophobicContact CB-CG 4.28Å; P259-I355 HydrophobicContact CG-CD1 3.41Å; P259-I355 VanDerWaalsContact CG-CD1 3.41Å; P259-I355 HydrophobicContact CG-CG1 3.69Å
260	Y	93.3	Very high	91.5	Very high	57 Å²	57	59 Å²	59	22%	0.224	31%	0.312	C	S	.	.			trans	-139.8	158.8	178.2	60.3	-85.9	0	0	0	109.8	L228 V258 L263 L277 K354	L228-Y260 HydrophobicContact CD1-CE1 4.24Å; V258-Y260 WeakPolarHBondContact O-CD1 3.06Å; Y260-L263 HydrophobicContact CD2-CD2 4.09Å; Y260-L263 HydrophobicContact CD2-CG 4.09Å; Y260-L263 HydrophobicContact CE2-CD1 4.32Å; Y260-L263 HydrophobicContact CE2-CD2 3.98Å; Y260-L263 HydrophobicContact CE2-CG 3.7Å; Y260-L263 HydrophobicContact CG-CD2 4.43Å; Y260-L277 HydrophobicContact CD1-CD1 4.23Å; Y260-L277 HydrophobicContact CD1-CD2 3.47Å; Y260-L277 VanDerWaalsContact CD1-CD2 3.47Å; Y260-L277 HydrophobicContact CE1-CD1 4.34Å; Y260-L277 HydrophobicContact CE1-CD2 4.29Å; Y260-L277 HydrophobicContact CG-CD2 3.69Å; Y260-K354 WeakPolarHBondContact O-CG 3.39Å
261	R	89.8	Confident	91.3	Very high	58 Å²	58	67.4 Å²	67.4	22%	0.219	35%	0.351	C	S	.	.	S	Bend	trans	-91.4	-47.6	173.1	174.2	179.6	169.4	-83.8	-1.8	111.1	D364 E369	R261-D364 WeakPolarHBondContact CB-OD2 3.25Å; R261-D364 WeakPolarHBondContact CD-OD2 2.81Å; R261-D364 WeakPolarHBondContact CG-OD2 2.83Å; R261-D364 IonicContact CZ-OD2 3.6Å; R261-D364 VanDerWaalsContact NH1-CG 3.3Å; R261-D364 PolarHBondContact NH1-O 2.98Å; R261-D364 IonicContact NH1-OD1 3.86Å; R261-D364 PolarHBondContact NH1-OD1 3.29Å; R261-D364 IonicContact NH1-OD2 3.76Å; R261-D364 PolarHBondContact NH1-OD2 3.49Å; R261-E369 IonicContact CZ-OE2 2.98Å; R261-E369 IonicContact NH2-OE2 3.1Å; R261-E369 PolarHBondContact NH2-OE2 3.24Å
262	A	90.8	Very high	91.4	Very high	24 Å²	24	65.3 Å²	65.3	20%	0.198	34%	0.344	C	S	.	.			trans	-144.7	145.6	176.7	0	0	0	0	0	110.8	R264 Y276	A262-R264 PolarHBondContact O-N 2.83Å; A262-Y276 PolarHBondContact O-OH 3.46Å; A262-Y276 VanDerWaalsContact O-OH 3.04Å
263	L	93.7	Very high	91.5	Very high	41 Å²	41	64.5 Å²	64.5	22%	0.215	34%	0.34	C	S	.	.			trans	-78.1	116.1	170	-68	172.8	0	0	0	108.9	L228 Y260 D273 Y276 L277	L228-L263 HydrophobicContact CD2-CD1 4.36Å; L228-L263 HydrophobicContact CD2-CD2 4.36Å; Y260-L263 HydrophobicContact CD2-CD2 4.09Å; Y260-L263 HydrophobicContact CD2-CG 4.09Å; Y260-L263 HydrophobicContact CE2-CD1 4.32Å; Y260-L263 HydrophobicContact CE2-CD2 3.98Å; Y260-L263 HydrophobicContact CE2-CG 3.7Å; Y260-L263 HydrophobicContact CG-CD2 4.43Å; L263-D273 HydrophobicContact CD2-CB 4.19Å; L263-Y276 HydrophobicContact CD2-CD1 3.98Å; L263-Y276 HydrophobicContact CD2-CE1 4.18Å; L263-L277 HydrophobicContact CD2-CD2 4.07Å; L263-L277 HydrophobicContact CD2-CG 4.27Å
264	R	94.5	Very high	91.6	Very high	45 Å²	45	64.3 Å²	64.3	17%	0.17	34%	0.339	C	S	.	.			trans	-113.6	22.7	179.3	-57.3	-62.9	-168.7	174.8	6.1	111.7	A262 Q266 F267 V268 Y276 D364 L368 E372	A262-R264 PolarHBondContact O-N 2.83Å; R264-Q266 PolarHBondContact O-N 3.27Å; R264-F267 HydrophobicContact CB-CB 4.37Å; R264-F267 WeakPolarHBondContact O-CA 3.41Å; R264-F267 WeakPolarHBondContact O-CB 3.48Å; R264-F267 PolarHBondContact O-N 2.87Å; R264-V268 HydrophobicContact CB-CG1 4.41Å; R264-V268 PolarHBondContact O-N 3.4Å; R264-Y276 HydrophobicContact CB-CE2 3.82Å; R264-D364 IonicContact CZ-OD1 3.27Å; R264-D364 IonicContact NE-OD1 2.63Å; R264-D364 PolarHBondContact NE-OD1 3.16Å; R264-D364 IonicContact NH2-OD1 2.71Å; R264-D364 PolarHBondContact NH2-OD1 2.63Å; R264-L368 HydrophobicContact CG-CD1 4.18Å; R264-E372 IonicContact CZ-OE2 3.38Å; R264-E372 IonicContact NH1-OE2 2.73Å; R264-E372 PolarHBondContact NH1-OE2 3.28Å; R264-E372 IonicContact NH2-OE2 2.73Å
265	T	94.9	Very high	92	Very high	9 Å²	9	60.4 Å²	60.4	6%	0.055	32%	0.317	C	S	.	.	H	α-helix	trans	-47.1	-59.9	-173.1	-50.4	0	0	0	0	112.8	F267 V268 G269 C270 L272 D273	T265-F267 VanDerWaalsContact C-N 3.31Å; T265-F267 PolarHBondContact O-N 3.19Å; T265-V268 WeakPolarHBondContact O-CG2 3.1Å; T265-V268 PolarHBondContact O-N 2.85Å; T265-G269 PolarHBondContact O-N 2.91Å; T265-G269 VanDerWaalsContact O-N 3.16Å; T265-C270 HydrophobicContact CG2-CB 3.81Å; T265-C270 WeakPolarHBondContact CG2-O 2.94Å; T265-C270 PolarHBondContact O-N 2.98Å; T265-L272 WeakPolarHBondContact CG2-O 3.37Å; T265-D273 WeakPolarHBondContact CB-OD1 3.28Å; T265-D273 WeakPolarHBondContact CG2-OD1 3.45Å; T265-D273 PolarHBondContact OG1-OD1 3.25Å
266	Q	94	Very high	92.4	Very high	182 Å²	182	54.2 Å²	54.2	85%	0.85	29%	0.288	S	S	*	.	H	α-helix	trans	-64.4	-35.4	179.1	-64.4	179.5	-3.6	0	0	112.6	R264 G269	R264-Q266 PolarHBondContact O-N 3.27Å; Q266-G269 PolarHBondContact O-N 3.42Å
267	F	94	Very high	93.2	Very high	58 Å²	58	52.3 Å²	52.3	25%	0.254	27%	0.269	S	S	.	.	H	α-helix	trans	-65.8	-42.1	-177.9	169.9	-91.5	0	0	0	111.9	R264 T265 G269 L368 I458 I461 R462	R264-F267 HydrophobicContact CB-CB 4.37Å; R264-F267 WeakPolarHBondContact O-CA 3.41Å; R264-F267 WeakPolarHBondContact O-CB 3.48Å; R264-F267 PolarHBondContact O-N 2.87Å; T265-F267 VanDerWaalsContact C-N 3.31Å; T265-F267 PolarHBondContact O-N 3.19Å; F267-G269 VanDerWaalsContact C-N 3.31Å; F267-L368 HydrophobicContact CD1-CD1 4.17Å; F267-L368 HydrophobicContact CD1-CD2 4.28Å; F267-L368 HydrophobicContact CE1-CD1 3.93Å; F267-L368 HydrophobicContact CE1-CD2 3.39Å; F267-L368 HydrophobicContact CE1-CG 4.33Å; F267-L368 HydrophobicContact CE2-CD2 4.14Å; F267-L368 HydrophobicContact CZ-CD2 3.3Å; F267-I458 HydrophobicContact CE2-CD1 4.32Å; F267-I458 HydrophobicContact CE2-CG1 4.35Å; F267-I458 HydrophobicContact CE2-CG2 4.11Å; F267-I458 HydrophobicContact CZ-CB 4.39Å; F267-I458 HydrophobicContact CZ-CD1 4.48Å; F267-I458 HydrophobicContact CZ-CG1 4.02Å; F267-I458 HydrophobicContact CZ-CG2 3.87Å; F267-I461 HydrophobicContact CE1-CG2 3.97Å; F267-R462 PolarHBondContact O-NE 3.17Å
268	V	94.8	Very high	93.8	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.042	23%	0.229	C	C	.	.	H	α-helix	trans	-84.2	-6.3	178.9	-55.3	0	0	0	0	113.4	R264 T265 C270 Y276 I461 F465	R264-V268 HydrophobicContact CB-CG1 4.41Å; R264-V268 PolarHBondContact O-N 3.4Å; T265-V268 WeakPolarHBondContact O-CG2 3.1Å; T265-V268 PolarHBondContact O-N 2.85Å; V268-C270 HydrophobicContact CG2-CB 4.17Å; V268-Y276 HydrophobicContact CG1-CE2 4.44Å; V268-Y276 HydrophobicContact CG2-CD2 3.73Å; V268-Y276 HydrophobicContact CG2-CE2 4.25Å; V268-I461 HydrophobicContact CG1-CG2 4.23Å; V268-F465 HydrophobicContact CB-CB 4.33Å; V268-F465 HydrophobicContact CB-CD1 4.23Å; V268-F465 HydrophobicContact CB-CD2 3.69Å; V268-F465 HydrophobicContact CB-CE2 4.01Å; V268-F465 HydrophobicContact CB-CG 3.82Å; V268-F465 HydrophobicContact CB-CZ 4.41Å; V268-F465 HydrophobicContact CG1-CD2 3.82Å; V268-F465 HydrophobicContact CG1-CE2 3.63Å; V268-F465 HydrophobicContact CG1-CG 4.37Å; V268-F465 HydrophobicContact CG1-CZ 4.05Å; V268-F465 HydrophobicContact CG2-CB 4.44Å; V268-F465 HydrophobicContact CG2-CD1 3.76Å; V268-F465 HydrophobicContact CG2-CD2 4.14Å; V268-F465 HydrophobicContact CG2-CE1 4Å; V268-F465 HydrophobicContact CG2-CE2 4.36Å; V268-F465 HydrophobicContact CG2-CG 3.84Å; V268-F465 HydrophobicContact CG2-CZ 4.29Å
269	G	93.1	Very high	94	Very high	60 Å²	60	44.3 Å²	44.3	62%	0.619	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.9	21.2	179.8	0	0	0	0	0	114.6	T265 Q266 F267	T265-G269 PolarHBondContact O-N 2.91Å; T265-G269 VanDerWaalsContact O-N 3.16Å; Q266-G269 PolarHBondContact O-N 3.42Å; F267-G269 VanDerWaalsContact C-N 3.31Å
270	C	94.7	Very high	94.3	Very high	9 Å²	9	41.9 Å²	41.9	6%	0.061	22%	0.215	C	C	.	.			trans	-76.8	147	167	-74.2	0	0	0	0	110.1	T265 V268 E275	T265-C270 HydrophobicContact CG2-CB 3.81Å; T265-C270 WeakPolarHBondContact CG2-O 2.94Å; T265-C270 PolarHBondContact O-N 2.98Å; V268-C270 HydrophobicContact CG2-CB 4.17Å; C270-E275 WeakPolarHBondContact CA-OE2 3.2Å; C270-E275 HydrophobicContact CB-CB 4.41Å; C270-E275 HydrophobicContact CB-CG 4.45Å
271	E	91.6	Very high	94.5	Very high	177 Å²	177	40.9 Å²	40.9	83%	0.827	21%	0.212	S	C	*	.	S	Bend	trans	-83.1	-33.5	178.6	-64	-176	172.1	0	0	111.2	E275	E271-E275 PolarHBondContact N-OE2 3.29Å
272	L	93.5	Very high	94.9	Very high	45 Å²	45	38.1 Å²	38.1	24%	0.236	20%	0.201	C	C	.	.	S	Bend	trans	-127.2	148.3	-174.9	-55.8	169.8	0	0	0	112.2	E232 T265 I274 E275 Y276	E232-L272 HydrophobicContact CB-CD1 3.97Å; E232-L272 WeakPolarHBondContact OE2-CD1 3.36Å; T265-L272 WeakPolarHBondContact CG2-O 3.37Å; L272-I274 VanDerWaalsContact C-N 3.31Å; L272-I274 HydrophobicContact CB-CG1 3.79Å; L272-I274 HydrophobicContact CD1-CD1 4.15Å; L272-I274 HydrophobicContact CD1-CG1 4.16Å; L272-I274 PolarHBondContact O-N 2.95Å; L272-E275 HydrophobicContact CB-CB 4.1Å; L272-E275 VanDerWaalsContact O-CB 3.26Å; L272-E275 WeakPolarHBondContact O-CB 3.44Å; L272-E275 PolarHBondContact O-N 3.5Å; L272-Y276 PolarHBondContact O-N 3.38Å; L272-Y276 VanDerWaalsContact O-N 3.09Å
273	D	94.4	Very high	95.2	Very high	61 Å²	61	37 Å²	37	33%	0.326	19%	0.192	S	C	.	.	H	α-helix	trans	-63.5	-38.6	176.9	-67.9	-26	0	0	0	111.9	L228 L263 T265 E275 Y276 L277	L228-D273 HydrophobicContact CD2-CB 4.06Å; L263-D273 HydrophobicContact CD2-CB 4.19Å; T265-D273 WeakPolarHBondContact CB-OD1 3.28Å; T265-D273 WeakPolarHBondContact CG2-OD1 3.45Å; T265-D273 PolarHBondContact OG1-OD1 3.25Å; D273-E275 PolarHBondContact O-N 2.87Å; D273-Y276 WeakPolarHBondContact O-CB 3.15Å; D273-Y276 PolarHBondContact O-N 2.73Å; D273-L277 WeakPolarHBondContact O-CB 3.46Å; D273-L277 VanDerWaalsContact O-CG 3.26Å; D273-L277 WeakPolarHBondContact O-CG 3.31Å; D273-L277 PolarHBondContact O-N 3.42Å
274	I	94.1	Very high	95.4	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-62	-32.9	174.1	53.6	166.8	0	0	0	112.3	D229 L230 E232 L233 L236 L253 L272 G278	D229-I274 WeakPolarHBondContact O-CG2 3.45Å; L230-I274 HydrophobicContact CD2-CG2 3.44Å; L230-I274 VanDerWaalsContact CD2-CG2 3.44Å; E232-I274 HydrophobicContact CB-CD1 4.45Å; L233-I274 HydrophobicContact CB-CD1 3.96Å; L233-I274 HydrophobicContact CD1-CB 4.44Å; L233-I274 HydrophobicContact CD1-CD1 4.13Å; L236-I274 HydrophobicContact CD2-CD1 3.97Å; L236-I274 HydrophobicContact CD2-CG1 4.08Å; L253-I274 HydrophobicContact CD1-CB 4.33Å; L253-I274 WeakPolarHBondContact CD1-O 3.37Å; L272-I274 VanDerWaalsContact C-N 3.31Å; L272-I274 HydrophobicContact CB-CG1 3.79Å; L272-I274 HydrophobicContact CD1-CD1 4.15Å; L272-I274 HydrophobicContact CD1-CG1 4.16Å; L272-I274 PolarHBondContact O-N 2.95Å; I274-G278 PolarHBondContact O-N 2.99Å
275	E	94.7	Very high	95.6	Very high	26 Å²	26	35.9 Å²	35.9	12%	0.121	19%	0.187	C	C	.	.	H	α-helix	trans	-67.3	-49.5	177	-171.6	-154.5	156.9	0	0	109.9	L236 Y246 C270 E271 L272 D273 G278 K279	L236-E275 HydrophobicContact CD2-CB 4.05Å; L236-E275 HydrophobicContact CD2-CG 4.48Å; Y246-E275 VanDerWaalsContact OH-CA 3.25Å; Y246-E275 WeakPolarHBondContact OH-CA 3.5Å; Y246-E275 WeakPolarHBondContact OH-CG 3.16Å; Y246-E275 PolarHBondContact OH-O 3.45Å; C270-E275 WeakPolarHBondContact CA-OE2 3.2Å; C270-E275 HydrophobicContact CB-CB 4.41Å; C270-E275 HydrophobicContact CB-CG 4.45Å; E271-E275 PolarHBondContact N-OE2 3.29Å; L272-E275 HydrophobicContact CB-CB 4.1Å; L272-E275 VanDerWaalsContact O-CB 3.26Å; L272-E275 WeakPolarHBondContact O-CB 3.44Å; L272-E275 PolarHBondContact O-N 3.5Å; D273-E275 PolarHBondContact O-N 2.87Å; E275-G278 PolarHBondContact O-N 3.35Å; E275-K279 HydrophobicContact CG-CD 4.32Å; E275-K279 WeakPolarHBondContact O-CG 3.3Å; E275-K279 PolarHBondContact O-N 3.42Å; E275-K279 VanDerWaalsContact OE1-CE 3.28Å; E275-K279 WeakPolarHBondContact OE1-CE 3.28Å; E275-K279 IonicContact OE1-NZ 3.71Å; E275-K279 PolarHBondContact OE1-NZ 2.88Å
276	Y	96.3	Very high	95.7	Very high	3 Å²	3	35.4 Å²	35.4	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-55.1	-51.5	174.6	167.2	-106.8	0	0	0	111.6	A262 L263 R264 V268 L272 D273 G278 K279 V280 Y359 F465	A262-Y276 PolarHBondContact O-OH 3.46Å; A262-Y276 VanDerWaalsContact O-OH 3.04Å; L263-Y276 HydrophobicContact CD2-CD1 3.98Å; L263-Y276 HydrophobicContact CD2-CE1 4.18Å; R264-Y276 HydrophobicContact CB-CE2 3.82Å; V268-Y276 HydrophobicContact CG1-CE2 4.44Å; V268-Y276 HydrophobicContact CG2-CD2 3.73Å; V268-Y276 HydrophobicContact CG2-CE2 4.25Å; L272-Y276 PolarHBondContact O-N 3.38Å; L272-Y276 VanDerWaalsContact O-N 3.09Å; D273-Y276 WeakPolarHBondContact O-CB 3.15Å; D273-Y276 PolarHBondContact O-N 2.73Å; Y276-G278 PolarHBondContact O-N 3.29Å; Y276-K279 PolarHBondContact O-N 3.14Å; Y276-V280 HydrophobicContact CD1-CG2 4.4Å; Y276-V280 HydrophobicContact CD2-CG2 3.8Å; Y276-V280 HydrophobicContact CE1-CG2 4.01Å; Y276-V280 HydrophobicContact CE2-CG2 3.35Å; Y276-V280 HydrophobicContact CG-CG2 4.31Å; Y276-V280 VanDerWaalsContact CZ-CG2 3.48Å; Y276-V280 WeakPolarHBondContact O-CB 3.21Å; Y276-V280 WeakPolarHBondContact O-CG2 3.38Å; Y276-V280 PolarHBondContact O-N 3.36Å; Y276-Y359 PolarHBondContact OH-OH 2.98Å; Y276-F465 HydrophobicContact CD2-CD1 4.45Å; Y276-F465 AromaticContact CD2-CE1 3.64Å; Y276-F465 HydrophobicContact CD2-CE1 3.64Å; Y276-F465 HydrophobicContact CD2-CZ 4.06Å; Y276-F465 AromaticContact CE2-CE1 3.95Å; Y276-F465 HydrophobicContact CE2-CE1 3.95Å; Y276-F465 AromaticContact CE2-CZ 3.88Å; Y276-F465 HydrophobicContact CE2-CZ 3.88Å
277	L	96.9	Very high	95.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.9	-43.5	-176.7	-70	177.3	0	0	0	112.5	L228 L253 V258 Y260 L263 D273 K279 V280 H281	L228-L277 HydrophobicContact CD1-CD1 3.59Å; L228-L277 HydrophobicContact CD2-CD1 3.75Å; L228-L277 HydrophobicContact CG-CD1 4.34Å; L253-L277 HydrophobicContact CD1-CB 4.06Å; L253-L277 HydrophobicContact CD2-CB 4.04Å; L253-L277 HydrophobicContact CD2-CD1 4.03Å; V258-L277 HydrophobicContact CB-CB 4.37Å; V258-L277 HydrophobicContact CG1-CB 4.45Å; Y260-L277 HydrophobicContact CD1-CD1 4.23Å; Y260-L277 HydrophobicContact CD1-CD2 3.47Å; Y260-L277 VanDerWaalsContact CD1-CD2 3.47Å; Y260-L277 HydrophobicContact CE1-CD1 4.34Å; Y260-L277 HydrophobicContact CE1-CD2 4.29Å; Y260-L277 HydrophobicContact CG-CD2 3.69Å; L263-L277 HydrophobicContact CD2-CD2 4.07Å; L263-L277 HydrophobicContact CD2-CG 4.27Å; D273-L277 WeakPolarHBondContact O-CB 3.46Å; D273-L277 VanDerWaalsContact O-CG 3.26Å; D273-L277 WeakPolarHBondContact O-CG 3.31Å; D273-L277 PolarHBondContact O-N 3.42Å; L277-K279 VanDerWaalsContact C-N 3.34Å; L277-K279 PolarHBondContact O-N 3.07Å; L277-V280 PolarHBondContact O-N 2.87Å; L277-H281 WeakPolarHBondContact O-CB 3.48Å; L277-H281 PolarHBondContact O-N 3Å
278	G	96.1	Very high	95.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.8	-43	175.9	0	0	0	0	0	111.6	A249 I274 E275 Y276 H281 C282	A249-G278 WeakPolarHBondContact CB-O 3.48Å; I274-G278 PolarHBondContact O-N 2.99Å; E275-G278 PolarHBondContact O-N 3.35Å; Y276-G278 PolarHBondContact O-N 3.29Å; G278-H281 WeakPolarHBondContact O-CB 3.27Å; G278-H281 PolarHBondContact O-N 3.1Å; G278-C282 PolarHBondContact O-N 3.46Å; G278-C282 VanDerWaalsContact O-N 3.12Å; G278-C282 PolarHBondContact O-SG 3.05Å
279	K	97.1	Very high	96	Very high	15 Å²	15	25.8 Å²	25.8	7%	0.065	14%	0.141	C	C	.	.	H	α-helix	trans	-68.7	-42.5	178.9	-72.7	177.6	178.4	-174.7	0	112.7	Y246 E275 Y276 L277 H281 C282 L283 F465 C467 Y574	Y246-K279 HydrophobicContact CD2-CG 4.24Å; Y246-K279 HydrophobicContact CE2-CG 3.69Å; E275-K279 HydrophobicContact CG-CD 4.32Å; E275-K279 WeakPolarHBondContact O-CG 3.3Å; E275-K279 PolarHBondContact O-N 3.42Å; E275-K279 VanDerWaalsContact OE1-CE 3.28Å; E275-K279 WeakPolarHBondContact OE1-CE 3.28Å; E275-K279 IonicContact OE1-NZ 3.71Å; E275-K279 PolarHBondContact OE1-NZ 2.88Å; Y276-K279 PolarHBondContact O-N 3.14Å; L277-K279 VanDerWaalsContact C-N 3.34Å; L277-K279 PolarHBondContact O-N 3.07Å; K279-H281 VanDerWaalsContact C-N 3.26Å; K279-H281 PolarHBondContact O-N 3.35Å; K279-C282 PolarHBondContact O-N 3.17Å; K279-C282 VanDerWaalsContact O-N 3.14Å; K279-L283 WeakPolarHBondContact O-CG 3.32Å; K279-L283 PolarHBondContact O-N 3.23Å; K279-F465 HydrophobicContact CB-CD1 3.64Å; K279-F465 HydrophobicContact CB-CE1 3.8Å; K279-F465 HydrophobicContact CD-CB 4.37Å; K279-F465 HydrophobicContact CD-CD1 3.86Å; K279-F465 WeakPolarHBondContact CD-O 3.46Å; K279-F465 WeakPolarHBondContact CE-O 3.12Å; K279-F465 HydrophobicContact CG-CD1 4.41Å; K279-F465 PolarHBondContact NZ-O 3.37Å; K279-C467 WeakPolarHBondContact CE-SG 3.46Å; K279-Y574 HydrophobicContact CB-CE1 4.22Å; K279-Y574 HydrophobicContact CG-CE1 4.04Å
280	V	97.5	Very high	96.1	Very high	1 Å²	1	23 Å²	23	1%	0.006	11%	0.111	C	C	.	.	H	α-helix	trans	-56	-44.8	172.7	168.7	0	0	0	0	110	Y276 L277 C282 L283 R284 Y359 F465	Y276-V280 HydrophobicContact CD1-CG2 4.4Å; Y276-V280 HydrophobicContact CD2-CG2 3.8Å; Y276-V280 HydrophobicContact CE1-CG2 4.01Å; Y276-V280 HydrophobicContact CE2-CG2 3.35Å; Y276-V280 HydrophobicContact CG-CG2 4.31Å; Y276-V280 VanDerWaalsContact CZ-CG2 3.48Å; Y276-V280 WeakPolarHBondContact O-CB 3.21Å; Y276-V280 WeakPolarHBondContact O-CG2 3.38Å; Y276-V280 PolarHBondContact O-N 3.36Å; L277-V280 PolarHBondContact O-N 2.87Å; V280-C282 VanDerWaalsContact C-N 3.34Å; V280-C282 PolarHBondContact O-N 3.27Å; V280-L283 PolarHBondContact O-N 3.36Å; V280-R284 HydrophobicContact CG1-CG 4.35Å; V280-R284 VanDerWaalsContact CG1-CZ 3.41Å; V280-R284 VanDerWaalsContact O-CG 3.23Å; V280-R284 WeakPolarHBondContact O-CG 3.34Å; V280-R284 PolarHBondContact O-N 2.78Å; V280-Y359 HydrophobicContact CG1-CD1 3.85Å; V280-Y359 HydrophobicContact CG1-CE1 3.91Å; V280-Y359 HydrophobicContact CG2-CD1 4.46Å; V280-Y359 HydrophobicContact CG2-CE1 3.77Å; V280-F465 HydrophobicContact CG2-CE1 3.8Å; V280-F465 HydrophobicContact CG2-CZ 3.69Å
281	H	97.6	Very high	96.1	Very high	36 Å²	36	22.5 Å²	22.5	17%	0.167	11%	0.108	C	C	.	.	H	α-helix	trans	-58.5	-45.1	177.1	-176.2	75.7	0	0	0	112.3	A249 L252 V258 L277 G278 K279 R284 Q285	A249-H281 HydrophobicContact CB-CB 4.27Å; L252-H281 WeakPolarHBondContact CD1-NE2 2.93Å; V258-H281 HydrophobicContact CG1-CB 4.08Å; V258-H281 HydrophobicContact CG2-CB 4.45Å; L277-H281 WeakPolarHBondContact O-CB 3.48Å; L277-H281 PolarHBondContact O-N 3Å; G278-H281 WeakPolarHBondContact O-CB 3.27Å; G278-H281 PolarHBondContact O-N 3.1Å; K279-H281 VanDerWaalsContact C-N 3.26Å; K279-H281 PolarHBondContact O-N 3.35Å; H281-R284 WeakPolarHBondContact O-CB 3.32Å; H281-R284 PolarHBondContact O-N 2.85Å; H281-Q285 PolarHBondContact CD2-NE2 2.83Å; H281-Q285 VanDerWaalsContact CD2-NE2 3.31Å; H281-Q285 PolarHBondContact NE2-NE2 3.11Å; H281-Q285 PolarHBondContact O-N 3.49Å
282	C	98.2	Very high	96.1	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-64.5	-43.9	175.7	-59.6	0	0	0	0	112.6	L245 G278 K279 V280 R284 Q285 A286 Y574 L580	L245-C282 HydrophobicContact CD2-CB 4.1Å; L245-C282 HydrophobicContact CG-CB 4.26Å; G278-C282 PolarHBondContact O-N 3.46Å; G278-C282 VanDerWaalsContact O-N 3.12Å; G278-C282 PolarHBondContact O-SG 3.05Å; K279-C282 PolarHBondContact O-N 3.17Å; K279-C282 VanDerWaalsContact O-N 3.14Å; V280-C282 VanDerWaalsContact C-N 3.34Å; V280-C282 PolarHBondContact O-N 3.27Å; C282-R284 VanDerWaalsContact C-N 3.29Å; C282-R284 PolarHBondContact O-N 2.81Å; C282-Q285 WeakPolarHBondContact O-CB 3.39Å; C282-Q285 PolarHBondContact O-N 3.49Å; C282-A286 PolarHBondContact O-N 2.87Å; C282-Y574 HydrophobicContact CB-CD1 3.65Å; C282-Y574 HydrophobicContact CB-CE1 3.63Å; C282-L580 HydrophobicContact CB-CD2 3.66Å; C282-L580 WeakPolarHBondContact O-CD2 3.46Å
283	L	98.1	Very high	96.1	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.5	-37.8	178	-72.7	175	0	0	0	111.7	K279 V280 Q285 A286 F287 Y359 F465 L584	K279-L283 WeakPolarHBondContact O-CG 3.32Å; K279-L283 PolarHBondContact O-N 3.23Å; V280-L283 PolarHBondContact O-N 3.36Å; L283-Q285 PolarHBondContact O-N 3.09Å; L283-A286 PolarHBondContact O-N 3.12Å; L283-F287 WeakPolarHBondContact O-CD2 3.47Å; L283-F287 PolarHBondContact O-N 3.48Å; L283-Y359 HydrophobicContact CD1-CD2 4.44Å; L283-Y359 HydrophobicContact CD1-CE2 4.34Å; L283-F465 HydrophobicContact CD1-CD1 4.46Å; L283-F465 HydrophobicContact CD1-CD2 3.98Å; L283-F465 HydrophobicContact CD1-CE1 4.08Å; L283-F465 HydrophobicContact CD1-CE2 3.57Å; L283-F465 HydrophobicContact CD1-CG 4.41Å; L283-F465 HydrophobicContact CD1-CZ 3.61Å; L283-L584 HydrophobicContact CD2-CD1 4.35Å; L283-L584 HydrophobicContact CD2-CD2 4.13Å
284	R	97.8	Very high	96	Very high	7 Å²	7	17.8 Å²	17.8	3%	0.026	9%	0.085	C	C	.	.	H	α-helix	trans	-56.7	-51.2	173.2	-70.7	168.5	174.9	151.4	-3.4	110.8	P259 V280 H281 C282 A286 F287 D288 N357 D360	P259-R284 VanDerWaalsContact O-CZ 3.27Å; P259-R284 PolarHBondContact O-NH1 2.99Å; P259-R284 PolarHBondContact O-NH2 3.19Å; V280-R284 HydrophobicContact CG1-CG 4.35Å; V280-R284 VanDerWaalsContact CG1-CZ 3.41Å; V280-R284 VanDerWaalsContact O-CG 3.23Å; V280-R284 WeakPolarHBondContact O-CG 3.34Å; V280-R284 PolarHBondContact O-N 2.78Å; H281-R284 WeakPolarHBondContact O-CB 3.32Å; H281-R284 PolarHBondContact O-N 2.85Å; C282-R284 VanDerWaalsContact C-N 3.29Å; C282-R284 PolarHBondContact O-N 2.81Å; R284-A286 VanDerWaalsContact C-N 3.29Å; R284-A286 PolarHBondContact O-N 2.65Å; R284-F287 PolarHBondContact O-N 2.87Å; R284-D288 WeakPolarHBondContact O-CB 3.31Å; R284-D288 PolarHBondContact O-N 3.42Å; R284-N357 VanDerWaalsContact CA-ND2 3.32Å; R284-N357 WeakPolarHBondContact CA-ND2 3.12Å; R284-N357 HydrophobicContact CB-CB 4.28Å; R284-N357 WeakPolarHBondContact CB-ND2 3.45Å; R284-N357 HydrophobicContact CG-CB 3.88Å; R284-N357 VanDerWaalsContact CG-CG 3.47Å; R284-N357 WeakPolarHBondContact CG-OD1 3.3Å; R284-N357 PolarHBondContact O-ND2 3.07Å; R284-D360 IonicContact CZ-OD1 2.77Å; R284-D360 IonicContact CZ-OD2 2.67Å; R284-D360 IonicContact NE-OD1 2.77Å; R284-D360 IonicContact NE-OD2 3.78Å; R284-D360 PolarHBondContact NE-OD2 3.35Å; R284-D360 IonicContact NH2-OD1 3.38Å; R284-D360 PolarHBondContact NH2-OD1 3.03Å; R284-D360 IonicContact NH2-OD2 2.63Å; R284-D360 PolarHBondContact NH2-OD2 2.9Å
285	Q	97.7	Very high	96	Very high	56 Å²	56	23.6 Å²	23.6	26%	0.262	11%	0.112	S	C	.	.	H	α-helix	trans	-60.9	-37.9	178.3	-62	-177.3	23.4	0	0	112.5	L245 H281 C282 L283 D288 Y289 V577	L245-Q285 VanDerWaalsContact CD1-OE1 3.31Å; H281-Q285 PolarHBondContact CD2-NE2 2.83Å; H281-Q285 VanDerWaalsContact CD2-NE2 3.31Å; H281-Q285 PolarHBondContact NE2-NE2 3.11Å; H281-Q285 PolarHBondContact O-N 3.49Å; C282-Q285 WeakPolarHBondContact O-CB 3.39Å; C282-Q285 PolarHBondContact O-N 3.49Å; L283-Q285 PolarHBondContact O-N 3.09Å; Q285-D288 WeakPolarHBondContact O-CB 3.17Å; Q285-D288 PolarHBondContact O-N 2.58Å; Q285-Y289 WeakPolarHBondContact O-CB 3.45Å; Q285-Y289 PolarHBondContact O-N 2.99Å; Q285-V577 HydrophobicContact CB-CG1 4.14Å; Q285-V577 HydrophobicContact CB-CG2 4.2Å; Q285-V577 WeakPolarHBondContact O-CG1 3.48Å
286	A	97.4	Very high	96	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.9	-44.3	177.3	0	0	0	0	0	112.2	C282 L283 R284 D288 Y289 I290 L580 A581 L584	C282-A286 PolarHBondContact O-N 2.87Å; L283-A286 PolarHBondContact O-N 3.12Å; R284-A286 VanDerWaalsContact C-N 3.29Å; R284-A286 PolarHBondContact O-N 2.65Å; A286-D288 VanDerWaalsContact C-N 3.34Å; A286-Y289 WeakPolarHBondContact O-CB 3.04Å; A286-Y289 PolarHBondContact O-N 3.43Å; A286-I290 WeakPolarHBondContact O-CG1 2.98Å; A286-I290 PolarHBondContact O-N 3.04Å; A286-L580 HydrophobicContact CB-CB 4.28Å; A286-L580 HydrophobicContact CB-CD2 3.9Å; A286-L580 HydrophobicContact CB-CG 3.71Å; A286-A581 HydrophobicContact CB-CB 4.28Å; A286-L584 HydrophobicContact CB-CD2 3.82Å
287	F	97.3	Very high	95.9	Very high	1 Å²	1	22.3 Å²	22.3	0%	0.004	11%	0.107	C	C	.	.	H	α-helix	trans	-62.1	-42.2	172.8	-78.9	-59	0	0	0	111.9	L283 R284 Y289 I290 F291 F358 Y359 I363 L584 I588	L283-F287 WeakPolarHBondContact O-CD2 3.47Å; L283-F287 PolarHBondContact O-N 3.48Å; R284-F287 PolarHBondContact O-N 2.87Å; F287-Y289 VanDerWaalsContact C-N 3.29Å; F287-Y289 PolarHBondContact O-N 3.1Å; F287-I290 HydrophobicContact CD1-CD1 4.5Å; F287-I290 PolarHBondContact O-N 3.42Å; F287-F291 HydrophobicContact CB-CD2 4.16Å; F287-F291 HydrophobicContact CB-CE2 3.96Å; F287-F291 AromaticContact CD1-CE2 3.79Å; F287-F291 HydrophobicContact CD1-CE2 3.79Å; F287-F291 HydrophobicContact CD1-CZ 4.24Å; F287-F291 HydrophobicContact CG-CE2 4.23Å; F287-F291 WeakPolarHBondContact O-CD2 3.49Å; F287-F291 WeakPolarHBondContact O-CG 3.46Å; F287-F291 PolarHBondContact O-N 3.44Å; F287-F358 HydrophobicContact CB-CB 4.25Å; F287-F358 AromaticContact CD1-CD1 3.5Å; F287-F358 HydrophobicContact CD1-CD1 3.5Å; F287-F358 VanDerWaalsContact CD1-CD1 3.5Å; F287-F358 HydrophobicContact CD1-CE1 4.07Å; F287-F358 HydrophobicContact CD1-CG 4.25Å; F287-F358 AromaticContact CD2-CD1 3.91Å; F287-F358 HydrophobicContact CD2-CD1 3.91Å; F287-F358 AromaticContact CE1-CD1 3.4Å; F287-F358 HydrophobicContact CE1-CD1 3.4Å; F287-F358 AromaticContact CE1-CE1 3.52Å; F287-F358 HydrophobicContact CE1-CE1 3.52Å; F287-F358 AromaticContact CE2-CD1 3.82Å; F287-F358 HydrophobicContact CE2-CD1 3.82Å; F287-F358 HydrophobicContact CE2-CE1 4.31Å; F287-F358 HydrophobicContact CG-CB 4.23Å; F287-F358 AromaticContact CG-CD1 3.76Å; F287-F358 HydrophobicContact CG-CD1 3.76Å; F287-F358 HydrophobicContact CG-CG 4.39Å; F287-F358 AromaticContact CZ-CD1 3.57Å; F287-F358 HydrophobicContact CZ-CD1 3.57Å; F287-F358 AromaticContact CZ-CE1 3.66Å; F287-F358 HydrophobicContact CZ-CE1 3.66Å; F287-Y359 HydrophobicContact CE2-CD2 4.46Å; F287-I363 HydrophobicContact CE2-CD1 3.99Å; F287-I363 HydrophobicContact CZ-CD1 3.93Å; F287-L584 HydrophobicContact CD1-CD2 4.04Å; F287-L584 HydrophobicContact CD2-CD2 4.19Å; F287-L584 HydrophobicContact CE1-CD2 3.83Å; F287-L584 HydrophobicContact CE1-CG 4.35Å; F287-L584 HydrophobicContact CE2-CD2 3.98Å; F287-L584 HydrophobicContact CG-CD2 4.21Å; F287-L584 HydrophobicContact CZ-CD1 4.28Å; F287-L584 HydrophobicContact CZ-CD2 3.8Å; F287-L584 HydrophobicContact CZ-CG 4.38Å; F287-I588 HydrophobicContact CE1-CD1 3.9Å
288	D	95.7	Very high	95.7	Very high	29 Å²	29	25.4 Å²	25.4	16%	0.155	13%	0.125	C	C	.	.	H	α-helix	trans	-57.2	-45.3	175.6	-66.4	-11.8	0	0	0	110.6	L49 R284 Q285 A286 I290 F291 D292 N357	L49-D288 HydrophobicContact CD1-CB 3.61Å; L49-D288 WeakPolarHBondContact CD1-OD1 3.5Å; L49-D288 HydrophobicContact CD2-CB 4.15Å; L49-D288 WeakPolarHBondContact CD2-OD2 3.47Å; L49-D288 HydrophobicContact CG-CB 4.42Å; R284-D288 WeakPolarHBondContact O-CB 3.31Å; R284-D288 PolarHBondContact O-N 3.42Å; Q285-D288 WeakPolarHBondContact O-CB 3.17Å; Q285-D288 PolarHBondContact O-N 2.58Å; A286-D288 VanDerWaalsContact C-N 3.34Å; D288-I290 PolarHBondContact O-N 3.24Å; D288-F291 PolarHBondContact O-N 2.88Å; D288-D292 WeakPolarHBondContact O-CB 3.41Å; D288-D292 VanDerWaalsContact O-CG 3.25Å; D288-D292 PolarHBondContact O-N 3.3Å; D288-N357 PolarHBondContact OD1-ND2 3.17Å
289	Y	96.3	Very high	95.7	Very high	15 Å²	15	25.9 Å²	25.9	6%	0.059	13%	0.127	C	C	.	.	H	α-helix	trans	-61.9	-43	176.1	-171.7	-75.7	0	0	0	112.7	Q285 A286 F287 D292 V577 E578 A581 L623 C624 K626	Q285-Y289 WeakPolarHBondContact O-CB 3.45Å; Q285-Y289 PolarHBondContact O-N 2.99Å; A286-Y289 WeakPolarHBondContact O-CB 3.04Å; A286-Y289 PolarHBondContact O-N 3.43Å; F287-Y289 VanDerWaalsContact C-N 3.29Å; F287-Y289 PolarHBondContact O-N 3.1Å; Y289-D292 PolarHBondContact O-N 2.79Å; Y289-V577 HydrophobicContact CD2-CG1 3.95Å; Y289-V577 HydrophobicContact CG-CG1 4.16Å; Y289-E578 HydrophobicContact CE2-CB 4.26Å; Y289-A581 HydrophobicContact CD1-CB 3.57Å; Y289-A581 HydrophobicContact CE1-CB 4.39Å; Y289-A581 HydrophobicContact CG-CB 3.93Å; Y289-L623 HydrophobicContact CD1-CD1 4.39Å; Y289-L623 HydrophobicContact CD1-CD2 3.87Å; Y289-L623 HydrophobicContact CD1-CG 4.28Å; Y289-L623 HydrophobicContact CE1-CD1 4.41Å; Y289-L623 HydrophobicContact CE1-CD2 3.66Å; Y289-L623 HydrophobicContact CE1-CG 3.89Å; Y289-C624 PolarHBondContact OH-O 3.19Å; Y289-K626 HydrophobicContact CD2-CD 4.43Å; Y289-K626 HydrophobicContact CE2-CD 3.97Å; Y289-K626 HydrophobicContact CE2-CG 4.1Å; Y289-K626 PolarHBondContact OH-N 2.8Å
290	I	95.4	Very high	95.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62	-49	176.8	-66.7	164.9	0	0	0	110.4	A286 F287 D288 D292 C293 P296 A581 L584 Y585 L623	A286-I290 WeakPolarHBondContact O-CG1 2.98Å; A286-I290 PolarHBondContact O-N 3.04Å; F287-I290 HydrophobicContact CD1-CD1 4.5Å; F287-I290 PolarHBondContact O-N 3.42Å; D288-I290 PolarHBondContact O-N 3.24Å; I290-D292 VanDerWaalsContact C-N 3.29Å; I290-D292 PolarHBondContact O-N 3.05Å; I290-C293 WeakPolarHBondContact O-CB 3.48Å; I290-C293 PolarHBondContact O-N 3.13Å; I290-C293 VanDerWaalsContact O-N 3.15Å; I290-P296 HydrophobicContact CG2-CB 4.23Å; I290-A581 HydrophobicContact CG1-CB 4.09Å; I290-L584 HydrophobicContact CD1-CB 4.43Å; I290-L584 HydrophobicContact CD1-CD2 4.15Å; I290-L584 HydrophobicContact CD1-CG 4.24Å; I290-Y585 HydrophobicContact CD1-CD2 4.47Å; I290-Y585 HydrophobicContact CG2-CD2 4Å; I290-Y585 HydrophobicContact CG2-CE2 4.33Å; I290-L623 HydrophobicContact CB-CD1 4.38Å; I290-L623 HydrophobicContact CG1-CD1 4.13Å; I290-L623 HydrophobicContact CG2-CD1 4.49Å
291	F	93.5	Very high	95.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-75.1	-19.7	-175.6	-63.5	-51.1	0	0	0	113.2	F42 L45 Y46 F287 D288 C293 T297 F300 F358	F42-F291 HydrophobicContact CB-CE1 4.34Å; F42-F291 HydrophobicContact CD1-CZ 4.4Å; L45-F291 HydrophobicContact CD2-CD2 4.18Å; Y46-F291 WeakPolarHBondContact CD2-O 3.14Å; Y46-F291 VanDerWaalsContact CE2-O 3.23Å; Y46-F291 WeakPolarHBondContact CE2-O 3.4Å; F287-F291 HydrophobicContact CB-CD2 4.16Å; F287-F291 HydrophobicContact CB-CE2 3.96Å; F287-F291 AromaticContact CD1-CE2 3.79Å; F287-F291 HydrophobicContact CD1-CE2 3.79Å; F287-F291 HydrophobicContact CD1-CZ 4.24Å; F287-F291 HydrophobicContact CG-CE2 4.23Å; F287-F291 WeakPolarHBondContact O-CD2 3.49Å; F287-F291 WeakPolarHBondContact O-CG 3.46Å; F287-F291 PolarHBondContact O-N 3.44Å; D288-F291 PolarHBondContact O-N 2.88Å; F291-C293 PolarHBondContact O-N 3.08Å; F291-T297 VanDerWaalsContact CA-OG1 3.3Å; F291-T297 WeakPolarHBondContact CA-OG1 3.35Å; F291-T297 HydrophobicContact CD1-CG2 4.22Å; F291-T297 PolarHBondContact O-OG1 2.92Å; F291-F300 HydrophobicContact CE1-CB 4.14Å; F291-F300 HydrophobicContact CE1-CD1 4.5Å; F291-F300 AromaticContact CE1-CD2 3.81Å; F291-F300 HydrophobicContact CE1-CD2 3.81Å; F291-F300 HydrophobicContact CE1-CE2 4.27Å; F291-F300 AromaticContact CE1-CG 3.89Å; F291-F300 HydrophobicContact CE1-CG 3.89Å; F291-F300 HydrophobicContact CZ-CD2 4.15Å; F291-F300 HydrophobicContact CZ-CE2 4.15Å; F291-F300 HydrophobicContact CZ-CG 4.36Å; F291-F300 HydrophobicContact CZ-CZ 4.43Å; F291-F358 HydrophobicContact CD2-CB 4.23Å; F291-F358 HydrophobicContact CE2-CB 3.49Å; F291-F358 VanDerWaalsContact CE2-CB 3.49Å; F291-F358 HydrophobicContact CE2-CD1 4.1Å; F291-F358 AromaticContact CE2-CD2 3.92Å; F291-F358 HydrophobicContact CE2-CD2 3.92Å; F291-F358 AromaticContact CE2-CG 3.56Å; F291-F358 HydrophobicContact CE2-CG 3.56Å; F291-F358 HydrophobicContact CZ-CB 4.35Å; F291-F358 HydrophobicContact CZ-CD1 4.37Å; F291-F358 AromaticContact CZ-CD2 3.94Å; F291-F358 HydrophobicContact CZ-CD2 3.94Å; F291-F358 HydrophobicContact CZ-CE2 4.39Å; F291-F358 AromaticContact CZ-CG 3.95Å; F291-F358 HydrophobicContact CZ-CG 3.95Å
292	D	92.5	Very high	95.2	Very high	48 Å²	48	28.5 Å²	28.5	26%	0.257	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-22.7	168.9	-84.7	-14.2	0	0	0	112.9	D288 Y289 I290 K626	D288-D292 WeakPolarHBondContact O-CB 3.41Å; D288-D292 VanDerWaalsContact O-CG 3.25Å; D288-D292 PolarHBondContact O-N 3.3Å; Y289-D292 PolarHBondContact O-N 2.79Å; I290-D292 VanDerWaalsContact C-N 3.29Å; I290-D292 PolarHBondContact O-N 3.05Å; D292-K626 WeakPolarHBondContact OD2-CE 3.44Å; D292-K626 IonicContact OD2-NZ 3.73Å; D292-K626 PolarHBondContact OD2-NZ 2.98Å
293	C	93.5	Very high	95.1	Very high	9 Å²	9	28.7 Å²	28.7	6%	0.061	14%	0.141	C	C	.	.	S	Bend	trans	-91.4	122.4	178.4	-56.4	0	0	0	0	110.9	I290 F291 P296 T297 L623 C624	I290-C293 WeakPolarHBondContact O-CB 3.48Å; I290-C293 PolarHBondContact O-N 3.13Å; I290-C293 VanDerWaalsContact O-N 3.15Å; F291-C293 PolarHBondContact O-N 3.08Å; C293-P296 HydrophobicContact CB-CB 4.15Å; C293-P296 HydrophobicContact CB-CG 3.56Å; C293-T297 WeakPolarHBondContact O-CB 3.48Å; C293-T297 PolarHBondContact O-N 2.78Å; C293-T297 VanDerWaalsContact O-N 3.13Å; C293-T297 PolarHBondContact O-OG1 3.29Å; C293-L623 HydrophobicContact CB-CD1 4.48Å; C293-C624 HydrophobicContact CB-CB 4.49Å
294	H	91.7	Very high	94.8	Very high	127 Å²	127	29 Å²	29	59%	0.588	14%	0.144	S	C	*	.	H	α-helix	trans	-61.1	-52.1	-175.9	176.5	-90.7	0	0	0	113.4	T297 V298	H294-T297 WeakPolarHBondContact O-CB 3.42Å; H294-T297 PolarHBondContact O-N 3.48Å; H294-V298 WeakPolarHBondContact O-CG2 3.17Å; H294-V298 PolarHBondContact O-N 3.06Å
295	E	95.2	Very high	94.7	Very high	122 Å²	122	29.8 Å²	29.8	57%	0.57	15%	0.148	S	C	*	.	H	α-helix	trans	-62.9	-49.4	-177.5	-69.4	179.2	-178.5	0	0	112.8	T297 V298 W299 P621	E295-T297 VanDerWaalsContact C-N 3.25Å; E295-T297 PolarHBondContact O-N 3.22Å; E295-V298 PolarHBondContact O-N 3.35Å; E295-W299 WeakPolarHBondContact O-CB 3.42Å; E295-W299 PolarHBondContact O-N 3.02Å; E295-P621 HydrophobicContact CB-CB 3.93Å; E295-P621 HydrophobicContact CB-CG 4.05Å
296	P	94.4	Very high	94.6	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-53.8	-39.5	171.6	-31.4	38.4	0	0	0	113.9	I290 C293 W299 F300 Y585 P621 L623	I290-P296 HydrophobicContact CG2-CB 4.23Å; C293-P296 HydrophobicContact CB-CB 4.15Å; C293-P296 HydrophobicContact CB-CG 3.56Å; P296-W299 PolarHBondContact O-N 3.5Å; P296-F300 WeakPolarHBondContact O-CB 3.42Å; P296-F300 PolarHBondContact O-N 3.46Å; P296-Y585 HydrophobicContact CB-CE2 4Å; P296-P621 HydrophobicContact CG-CG 4.38Å; P296-L623 HydrophobicContact CB-CD1 4.37Å; P296-L623 HydrophobicContact CG-CD1 4.06Å
297	T	93.3	Very high	94.6	Very high	3 Å²	3	30.5 Å²	30.5	2%	0.018	15%	0.149	C	C	.	.	H	α-helix	trans	-64.6	-48	178.6	-59.6	0	0	0	0	112.1	S43 F291 C293 H294 E295 W299 F300 I301	S43-T297 WeakPolarHBondContact OG-CG2 3.29Å; F291-T297 VanDerWaalsContact CA-OG1 3.3Å; F291-T297 WeakPolarHBondContact CA-OG1 3.35Å; F291-T297 HydrophobicContact CD1-CG2 4.22Å; F291-T297 PolarHBondContact O-OG1 2.92Å; C293-T297 WeakPolarHBondContact O-CB 3.48Å; C293-T297 PolarHBondContact O-N 2.78Å; C293-T297 VanDerWaalsContact O-N 3.13Å; C293-T297 PolarHBondContact O-OG1 3.29Å; H294-T297 WeakPolarHBondContact O-CB 3.42Å; H294-T297 PolarHBondContact O-N 3.48Å; E295-T297 VanDerWaalsContact C-N 3.25Å; E295-T297 PolarHBondContact O-N 3.22Å; T297-W299 VanDerWaalsContact C-N 3.33Å; T297-W299 PolarHBondContact O-N 3.26Å; T297-F300 WeakPolarHBondContact O-CB 3.41Å; T297-F300 PolarHBondContact O-N 3.05Å; T297-I301 HydrophobicContact CG2-CD1 4.38Å; T297-I301 WeakPolarHBondContact O-CG1 2.94Å; T297-I301 PolarHBondContact O-N 3.42Å; T297-I301 VanDerWaalsContact O-N 3.07Å
298	V	94.1	Very high	94.5	Very high	64 Å²	64	30.6 Å²	30.6	39%	0.388	15%	0.15	S	C	.	.	H	α-helix	trans	-62.5	-42.6	177	173.1	0	0	0	0	110.6	H294 E295 F300 I301 E302	H294-V298 WeakPolarHBondContact O-CG2 3.17Å; H294-V298 PolarHBondContact O-N 3.06Å; E295-V298 PolarHBondContact O-N 3.35Å; V298-F300 VanDerWaalsContact C-N 3.29Å; V298-F300 PolarHBondContact O-N 3.34Å; V298-I301 WeakPolarHBondContact O-CB 3.46Å; V298-I301 PolarHBondContact O-N 3.49Å; V298-E302 PolarHBondContact O-N 3.45Å
299	W	95.4	Very high	94.6	Very high	11 Å²	11	29.3 Å²	29.3	4%	0.042	14%	0.143	C	C	.	.	H	α-helix	trans	-59	-42.2	175.1	175.8	87.4	0	0	0	111.9	E295 P296 T297 I301 E302 V303 Y585 I588 N589 P618 V619 Q620 P621	E295-W299 WeakPolarHBondContact O-CB 3.42Å; E295-W299 PolarHBondContact O-N 3.02Å; P296-W299 PolarHBondContact O-N 3.5Å; T297-W299 VanDerWaalsContact C-N 3.33Å; T297-W299 PolarHBondContact O-N 3.26Å; W299-I301 PolarHBondContact O-N 3.43Å; W299-E302 PolarHBondContact O-N 3.36Å; W299-V303 HydrophobicContact CD2-CG2 3.91Å; W299-V303 VanDerWaalsContact CE2-CG2 3.48Å; W299-V303 HydrophobicContact CE3-CG2 4.46Å; W299-V303 HydrophobicContact CG-CG2 4.35Å; W299-V303 HydrophobicContact CH2-CG2 4.27Å; W299-V303 HydrophobicContact CZ2-CG2 3.71Å; W299-V303 WeakPolarHBondContact O-CB 3.18Å; W299-V303 WeakPolarHBondContact O-CG2 3.09Å; W299-V303 PolarHBondContact O-N 2.92Å; W299-Y585 AromaticContact CE3-CE2 3.78Å; W299-Y585 HydrophobicContact CE3-CE2 3.78Å; W299-Y585 HydrophobicContact CZ3-CD2 4.46Å; W299-Y585 AromaticContact CZ3-CE2 3.77Å; W299-Y585 HydrophobicContact CZ3-CE2 3.77Å; W299-I588 HydrophobicContact CH2-CG2 4.22Å; W299-I588 HydrophobicContact CZ3-CG2 4.02Å; W299-N589 HydrophobicContact CH2-CB 4.15Å; W299-N589 HydrophobicContact CZ2-CB 4.44Å; W299-P618 PolarHBondContact NE1-O 2.9Å; W299-V619 VanDerWaalsContact CD1-O 3.31Å; W299-Q620 HydrophobicContact CD2-CG 4.24Å; W299-Q620 HydrophobicContact CE3-CG 4.44Å; W299-Q620 HydrophobicContact CH2-CG 4.11Å; W299-Q620 HydrophobicContact CZ2-CB 3.81Å; W299-Q620 HydrophobicContact CZ2-CG 3.86Å; W299-Q620 HydrophobicContact CZ3-CG 4.39Å; W299-P621 HydrophobicContact CB-CG 3.8Å; W299-P621 HydrophobicContact CG-CG 4.23Å
300	F	94.4	Very high	94.6	Very high	14 Å²	14	28.6 Å²	28.6	6%	0.061	14%	0.14	C	C	.	.	H	α-helix	trans	-60.4	-46.7	178	-139.7	-64.4	0	0	0	111.7	F42 F291 P296 T297 V298 V303 G304 F358 I588	F42-F300 HydrophobicContact CB-CB 4.39Å; F42-F300 HydrophobicContact CB-CD1 4.38Å; F42-F300 AromaticContact CD1-CD1 3.13Å; F42-F300 HydrophobicContact CD1-CD1 3.13Å; F42-F300 AromaticContact CD1-CE1 3.39Å; F42-F300 HydrophobicContact CD1-CE1 3.39Å; F42-F300 HydrophobicContact CD1-CG 4.06Å; F42-F300 HydrophobicContact CD1-CZ 4.43Å; F42-F300 HydrophobicContact CD2-CB 4.41Å; F42-F300 AromaticContact CD2-CD1 3.72Å; F42-F300 HydrophobicContact CD2-CD1 3.72Å; F42-F300 VanDerWaalsContact CD2-O 3.31Å; F42-F300 WeakPolarHBondContact CD2-O 3.28Å; F42-F300 AromaticContact CE1-CD1 3.06Å; F42-F300 HydrophobicContact CE1-CD1 3.06Å; F42-F300 AromaticContact CE1-CE1 2.94Å; F42-F300 HydrophobicContact CE1-CE1 2.94Å; F42-F300 HydrophobicContact CE1-CG 4.31Å; F42-F300 HydrophobicContact CE1-CZ 4.12Å; F42-F300 AromaticContact CE2-CD1 3.51Å; F42-F300 HydrophobicContact CE2-CD1 3.51Å; F42-F300 HydrophobicContact CE2-CE1 4.11Å; F42-F300 WeakPolarHBondContact CE2-O 3.44Å; F42-F300 HydrophobicContact CG-CB 4.28Å; F42-F300 AromaticContact CG-CD1 3.52Å; F42-F300 HydrophobicContact CG-CD1 3.52Å; F42-F300 HydrophobicContact CG-CE1 4.23Å; F42-F300 HydrophobicContact CG-CG 4.22Å; F42-F300 AromaticContact CZ-CD1 3.23Å; F42-F300 HydrophobicContact CZ-CD1 3.23Å; F42-F300 AromaticContact CZ-CE1 3.33Å; F42-F300 HydrophobicContact CZ-CE1 3.33Å; F291-F300 HydrophobicContact CE1-CB 4.14Å; F291-F300 HydrophobicContact CE1-CD1 4.5Å; F291-F300 AromaticContact CE1-CD2 3.81Å; F291-F300 HydrophobicContact CE1-CD2 3.81Å; F291-F300 HydrophobicContact CE1-CE2 4.27Å; F291-F300 AromaticContact CE1-CG 3.89Å; F291-F300 HydrophobicContact CE1-CG 3.89Å; F291-F300 HydrophobicContact CZ-CD2 4.15Å; F291-F300 HydrophobicContact CZ-CE2 4.15Å; F291-F300 HydrophobicContact CZ-CG 4.36Å; F291-F300 HydrophobicContact CZ-CZ 4.43Å; P296-F300 WeakPolarHBondContact O-CB 3.42Å; P296-F300 PolarHBondContact O-N 3.46Å; T297-F300 WeakPolarHBondContact O-CB 3.41Å; T297-F300 PolarHBondContact O-N 3.05Å; V298-F300 VanDerWaalsContact C-N 3.29Å; V298-F300 PolarHBondContact O-N 3.34Å; F300-V303 PolarHBondContact O-N 3.41Å; F300-G304 PolarHBondContact O-N 3.32Å; F300-F358 HydrophobicContact CE1-CZ 4.23Å; F300-F358 HydrophobicContact CZ-CZ 4.34Å; F300-I588 HydrophobicContact CD2-CG2 4.44Å; F300-I588 HydrophobicContact CE1-CG2 4.42Å; F300-I588 HydrophobicContact CE2-CB 4.43Å; F300-I588 HydrophobicContact CE2-CD1 3.48Å; F300-I588 VanDerWaalsContact CE2-CD1 3.48Å; F300-I588 HydrophobicContact CE2-CG1 4.29Å; F300-I588 HydrophobicContact CE2-CG2 3.67Å; F300-I588 HydrophobicContact CZ-CD1 3.72Å; F300-I588 HydrophobicContact CZ-CG1 4.26Å; F300-I588 HydrophobicContact CZ-CG2 3.67Å
301	I	93	Very high	94.6	Very high	19 Å²	19	28.6 Å²	28.6	10%	0.097	14%	0.14	C	C	.	.	H	α-helix	trans	-49	-59	171.9	-65.9	167	0	0	0	111	F42 S43 T297 V298 W299 V303 G304 K305 Y326 M330	F42-I301 HydrophobicContact CB-CG1 3.81Å; F42-I301 HydrophobicContact CD2-CG1 4.26Å; S43-I301 WeakPolarHBondContact OG-CD1 3.31Å; T297-I301 HydrophobicContact CG2-CD1 4.38Å; T297-I301 WeakPolarHBondContact O-CG1 2.94Å; T297-I301 PolarHBondContact O-N 3.42Å; T297-I301 VanDerWaalsContact O-N 3.07Å; V298-I301 WeakPolarHBondContact O-CB 3.46Å; V298-I301 PolarHBondContact O-N 3.49Å; W299-I301 PolarHBondContact O-N 3.43Å; I301-V303 PolarHBondContact O-N 3.41Å; I301-G304 PolarHBondContact O-N 2.92Å; I301-K305 WeakPolarHBondContact O-CB 2.97Å; I301-K305 PolarHBondContact O-N 2.9Å; I301-Y326 HydrophobicContact CG2-CE1 3.95Å; I301-Y326 WeakPolarHBondContact CG2-OH 3.44Å; I301-Y326 PolarHBondContact O-OH 3.29Å; I301-M330 HydrophobicContact CD1-SD 4.04Å; I301-M330 HydrophobicContact CG1-SD 3.95Å; I301-M330 HydrophobicContact CG2-CG 4.19Å; I301-M330 HydrophobicContact CG2-SD 3.93Å
302	E	95.2	Very high	94.7	Very high	73 Å²	73	28.6 Å²	28.6	34%	0.341	14%	0.14	S	C	.	.	H	α-helix	trans	-62.3	-45.2	-176.1	-68.7	-56.7	128.7	0	0	112.7	V298 W299 G304 K305 R306 P618	V298-E302 PolarHBondContact O-N 3.45Å; W299-E302 PolarHBondContact O-N 3.36Å; E302-G304 PolarHBondContact O-N 3.37Å; E302-K305 PolarHBondContact O-N 2.9Å; E302-R306 WeakPolarHBondContact O-CB 3.38Å; E302-R306 VanDerWaalsContact O-CG 3.28Å; E302-R306 WeakPolarHBondContact O-CG 3.42Å; E302-R306 PolarHBondContact O-N 3.28Å; E302-P618 HydrophobicContact CB-CG 4.36Å
303	V	94.9	Very high	94.9	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.024	14%	0.143	C	C	.	.	H	α-helix	trans	-62.7	-45.7	-179.1	169.1	0	0	0	0	111.5	W299 F300 I301 R306 N307 S592 P618	W299-V303 HydrophobicContact CD2-CG2 3.91Å; W299-V303 VanDerWaalsContact CE2-CG2 3.48Å; W299-V303 HydrophobicContact CE3-CG2 4.46Å; W299-V303 HydrophobicContact CG-CG2 4.35Å; W299-V303 HydrophobicContact CH2-CG2 4.27Å; W299-V303 HydrophobicContact CZ2-CG2 3.71Å; W299-V303 WeakPolarHBondContact O-CB 3.18Å; W299-V303 WeakPolarHBondContact O-CG2 3.09Å; W299-V303 PolarHBondContact O-N 2.92Å; F300-V303 PolarHBondContact O-N 3.41Å; I301-V303 PolarHBondContact O-N 3.41Å; V303-R306 PolarHBondContact O-N 3.43Å; V303-N307 PolarHBondContact O-N 3.49Å; V303-N307 PolarHBondContact O-ND2 3.46Å; V303-S592 WeakPolarHBondContact CG1-OG 3.49Å; V303-P618 HydrophobicContact CG2-CG 3.82Å
304	G	93.2	Very high	95	Very high	7 Å²	7	30.5 Å²	30.5	7%	0.072	15%	0.145	C	C	.	.	H	α-helix	trans	-75.2	-27	-178.5	0	0	0	0	0	113.6	G39 F300 I301 E302 V308	G39-G304 VanDerWaalsContact CA-C 3.47Å; F300-G304 PolarHBondContact O-N 3.32Å; I301-G304 PolarHBondContact O-N 2.92Å; E302-G304 PolarHBondContact O-N 3.37Å; G304-V308 PolarHBondContact O-N 3.1Å
305	K	95.7	Very high	95.1	Very high	24 Å²	24	24.5 Å²	24.5	10%	0.104	12%	0.117	C	C	.	.	H	α-helix	trans	-60.3	-52.9	165.6	-171.8	179	-177.6	172	0	110.4	I301 E302 N307 V308 C309 F322 Y326 D327	I301-K305 WeakPolarHBondContact O-CB 2.97Å; I301-K305 PolarHBondContact O-N 2.9Å; E302-K305 PolarHBondContact O-N 2.9Å; K305-N307 VanDerWaalsContact C-N 3.34Å; K305-N307 PolarHBondContact O-N 3.42Å; K305-V308 PolarHBondContact O-N 3.25Å; K305-V308 VanDerWaalsContact O-N 3.12Å; K305-C309 PolarHBondContact O-N 3.25Å; K305-C309 PolarHBondContact O-SG 3.32Å; K305-F322 HydrophobicContact CG-CE1 4.19Å; K305-Y326 HydrophobicContact CB-CD1 4.27Å; K305-Y326 HydrophobicContact CB-CD2 4.39Å; K305-Y326 HydrophobicContact CB-CE1 3.82Å; K305-Y326 HydrophobicContact CB-CE2 3.88Å; K305-Y326 HydrophobicContact CD-CD1 3.67Å; K305-Y326 HydrophobicContact CD-CE1 3.79Å; K305-Y326 HydrophobicContact CD-CG 4.31Å; K305-Y326 HydrophobicContact CG-CD1 3.88Å; K305-Y326 HydrophobicContact CG-CD2 4.25Å; K305-Y326 HydrophobicContact CG-CE1 3.93Å; K305-Y326 HydrophobicContact CG-CE2 4.25Å; K305-Y326 HydrophobicContact CG-CG 4.09Å; K305-D327 IonicContact NZ-OD1 3.24Å; K305-D327 PolarHBondContact NZ-OD1 2.98Å; K305-D327 IonicContact NZ-OD2 2.7Å; K305-D327 PolarHBondContact NZ-OD2 3.23Å
306	R	95.6	Very high	95	Very high	59 Å²	59	21.6 Å²	21.6	22%	0.223	12%	0.12	C	C	.	.	H	α-helix	trans	-57.8	-42.4	-179.8	-73.2	178.4	-174.5	-145.6	-3.8	112.7	E302 V303 V308 C309 R310 E613 L614 S616	E302-R306 WeakPolarHBondContact O-CB 3.38Å; E302-R306 VanDerWaalsContact O-CG 3.28Å; E302-R306 WeakPolarHBondContact O-CG 3.42Å; E302-R306 PolarHBondContact O-N 3.28Å; V303-R306 PolarHBondContact O-N 3.43Å; R306-V308 VanDerWaalsContact C-N 3.25Å; R306-V308 PolarHBondContact O-N 3.33Å; R306-C309 PolarHBondContact O-N 3.27Å; R306-R310 WeakPolarHBondContact O-CB 3.1Å; R306-R310 VanDerWaalsContact O-CG 3.26Å; R306-R310 WeakPolarHBondContact O-CG 3.4Å; R306-R310 PolarHBondContact O-N 3.43Å; R306-E613 PolarHBondContact NH1-O 3.36Å; R306-L614 HydrophobicContact CB-CD2 4.22Å; R306-L614 HydrophobicContact CG-CD2 4.04Å; R306-S616 PolarHBondContact NH1-O 3.45Å
307	N	96	Very high	95	Very high	12 Å²	12	22.6 Å²	22.6	6%	0.064	12%	0.124	C	C	.	.	H	α-helix	trans	-61.5	-34	179.5	-76.6	-28.3	0	0	0	112.7	V303 K305 R310 L311 L595 F599	V303-N307 PolarHBondContact O-N 3.49Å; V303-N307 PolarHBondContact O-ND2 3.46Å; K305-N307 VanDerWaalsContact C-N 3.34Å; K305-N307 PolarHBondContact O-N 3.42Å; N307-R310 PolarHBondContact OD1-NH1 2.99Å; N307-L311 PolarHBondContact O-N 3.29Å; N307-L595 HydrophobicContact CB-CD1 4.38Å; N307-F599 WeakPolarHBondContact O-CE2 3.29Å; N307-F599 WeakPolarHBondContact O-CZ 3.26Å
308	V	95.4	Very high	95	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.018	15%	0.149	C	C	.	.	H	α-helix	trans	-80.8	-36.8	174.9	178.6	0	0	0	0	112.1	A36 V37 G304 K305 R306 R310 L311 L312 F322 V431	A36-V308 HydrophobicContact CB-CG2 4.21Å; V37-V308 HydrophobicContact CB-CG2 3.88Å; V37-V308 HydrophobicContact CG1-CB 4.23Å; V37-V308 HydrophobicContact CG1-CG2 3.6Å; V37-V308 HydrophobicContact CG2-CB 3.92Å; V37-V308 HydrophobicContact CG2-CG1 3.59Å; V37-V308 HydrophobicContact CG2-CG2 3.55Å; G304-V308 PolarHBondContact O-N 3.1Å; K305-V308 PolarHBondContact O-N 3.25Å; K305-V308 VanDerWaalsContact O-N 3.12Å; R306-V308 VanDerWaalsContact C-N 3.25Å; R306-V308 PolarHBondContact O-N 3.33Å; V308-R310 VanDerWaalsContact C-N 3.27Å; V308-R310 PolarHBondContact O-N 2.87Å; V308-L311 WeakPolarHBondContact O-CB 3.11Å; V308-L311 PolarHBondContact O-N 3.02Å; V308-L312 HydrophobicContact CG1-CD1 4.21Å; V308-L312 HydrophobicContact CG1-CG 4.2Å; V308-L312 WeakPolarHBondContact O-CG 3.34Å; V308-L312 PolarHBondContact O-N 3.02Å; V308-F322 HydrophobicContact CB-CE1 3.86Å; V308-F322 HydrophobicContact CB-CE2 4.35Å; V308-F322 HydrophobicContact CB-CZ 3.65Å; V308-F322 HydrophobicContact CG1-CD1 4.31Å; V308-F322 HydrophobicContact CG1-CD2 4.3Å; V308-F322 HydrophobicContact CG1-CE1 3.89Å; V308-F322 HydrophobicContact CG1-CE2 3.9Å; V308-F322 HydrophobicContact CG1-CZ 3.66Å; V308-V431 HydrophobicContact CG1-CG1 3.88Å; V308-V431 HydrophobicContact CG1-CG2 3.96Å
309	C	97.3	Very high	95.1	Very high	1 Å²	1	25 Å²	25	1%	0.007	14%	0.139	C	C	.	.	H	α-helix	trans	-56.8	-43.6	171	-68	0	0	0	0	111.5	K305 R306 L312 Y313 L319 L614	K305-C309 PolarHBondContact O-N 3.25Å; K305-C309 PolarHBondContact O-SG 3.32Å; R306-C309 PolarHBondContact O-N 3.27Å; C309-L312 PolarHBondContact O-N 2.67Å; C309-Y313 VanDerWaalsContact O-CB 3.29Å; C309-Y313 WeakPolarHBondContact O-CB 3.49Å; C309-Y313 PolarHBondContact O-N 3.38Å; C309-L319 HydrophobicContact CB-CD1 4.32Å; C309-L319 HydrophobicContact CB-CD2 4.35Å; C309-L319 VanDerWaalsContact O-CD2 3.25Å; C309-L319 WeakPolarHBondContact O-CD2 3.39Å; C309-L614 HydrophobicContact CB-CD1 3.87Å; C309-L614 HydrophobicContact CB-CD2 3.84Å
310	R	96.7	Very high	95.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-44.8	175.4	-70.5	168.7	-173.2	146.5	-1.4	112.1	R306 N307 V308 Y313 C314 F599 L610 L614 S616 N617	R306-R310 WeakPolarHBondContact O-CB 3.1Å; R306-R310 VanDerWaalsContact O-CG 3.26Å; R306-R310 WeakPolarHBondContact O-CG 3.4Å; R306-R310 PolarHBondContact O-N 3.43Å; N307-R310 PolarHBondContact OD1-NH1 2.99Å; V308-R310 VanDerWaalsContact C-N 3.27Å; V308-R310 PolarHBondContact O-N 2.87Å; R310-Y313 PolarHBondContact O-N 3.1Å; R310-C314 WeakPolarHBondContact O-CB 3.27Å; R310-C314 PolarHBondContact O-N 3.32Å; R310-C314 PolarHBondContact O-SG 3.17Å; R310-F599 HydrophobicContact CB-CB 4.26Å; R310-F599 HydrophobicContact CB-CD1 4.17Å; R310-F599 HydrophobicContact CB-CD2 3.44Å; R310-F599 VanDerWaalsContact CB-CD2 3.44Å; R310-F599 HydrophobicContact CB-CE1 4.38Å; R310-F599 HydrophobicContact CB-CE2 3.69Å; R310-F599 HydrophobicContact CB-CG 3.7Å; R310-F599 HydrophobicContact CB-CZ 4.15Å; R310-F599 HydrophobicContact CG-CD2 4.14Å; R310-L610 HydrophobicContact CB-CD2 4.39Å; R310-L610 HydrophobicContact CG-CD1 4.17Å; R310-L610 HydrophobicContact CG-CD2 4.03Å; R310-L614 HydrophobicContact CG-CB 4.03Å; R310-L614 HydrophobicContact CG-CD1 4.29Å; R310-L614 VanDerWaalsContact CZ-O 3.25Å; R310-L614 PolarHBondContact NE-O 3.16Å; R310-L614 PolarHBondContact NH2-O 3.2Å; R310-S616 VanDerWaalsContact NH2-C 3.27Å; R310-S616 PolarHBondContact NH2-O 3.03Å; R310-N617 PolarHBondContact NH1-OD1 3.19Å; R310-N617 PolarHBondContact NH2-OD1 3.15Å
311	L	96.1	Very high	95.2	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58.8	-50.4	175.9	177.8	63.4	0	0	0	111.6	A36 N307 V308 Y313 C314 L315 L435 I449 F453 F599	A36-L311 HydrophobicContact CB-CD2 4.34Å; N307-L311 PolarHBondContact O-N 3.29Å; V308-L311 WeakPolarHBondContact O-CB 3.11Å; V308-L311 PolarHBondContact O-N 3.02Å; L311-Y313 VanDerWaalsContact C-N 3.31Å; L311-Y313 PolarHBondContact O-N 3.15Å; L311-C314 PolarHBondContact O-N 3.37Å; L311-L315 HydrophobicContact CD1-CD1 3.91Å; L311-L315 HydrophobicContact CD1-CG 4.37Å; L311-L315 HydrophobicContact CG-CD1 4.07Å; L311-L315 VanDerWaalsContact O-CG 3.29Å; L311-L315 WeakPolarHBondContact O-CG 3.41Å; L311-L315 PolarHBondContact O-N 2.63Å; L311-L315 VanDerWaalsContact O-N 3.09Å; L311-L435 HydrophobicContact CD2-CD1 4.39Å; L311-L435 HydrophobicContact CD2-CD2 3.83Å; L311-L435 HydrophobicContact CD2-CG 4.35Å; L311-I449 HydrophobicContact CD1-CG2 4.1Å; L311-F453 HydrophobicContact CD1-CB 4.43Å; L311-F453 HydrophobicContact CD1-CG 4.33Å; L311-F453 HydrophobicContact CD2-CD1 4.02Å; L311-F453 HydrophobicContact CD2-CD2 4.44Å; L311-F453 HydrophobicContact CD2-CE1 3.86Å; L311-F453 HydrophobicContact CD2-CE2 4.31Å; L311-F453 HydrophobicContact CD2-CG 4.29Å; L311-F453 HydrophobicContact CD2-CZ 4Å; L311-F599 HydrophobicContact CB-CE1 3.87Å; L311-F599 HydrophobicContact CB-CZ 3.81Å; L311-F599 HydrophobicContact CD1-CE1 4.06Å
312	L	96.1	Very high	95.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.3	-43	178.1	-70.3	176.7	0	0	0	111.7	V308 C309 L315 G316 Y317 L319 F322 V431 A434	V308-L312 HydrophobicContact CG1-CD1 4.21Å; V308-L312 HydrophobicContact CG1-CG 4.2Å; V308-L312 WeakPolarHBondContact O-CG 3.34Å; V308-L312 PolarHBondContact O-N 3.02Å; C309-L312 PolarHBondContact O-N 2.67Å; L312-L315 CarbonylContact O-C 3.43Å; L312-L315 PolarHBondContact O-N 3.48Å; L312-G316 PolarHBondContact O-N 2.8Å; L312-G316 VanDerWaalsContact O-N 3.1Å; L312-Y317 HydrophobicContact CD2-CG 4.46Å; L312-Y317 PolarHBondContact O-N 2.98Å; L312-L319 HydrophobicContact CB-CD2 3.62Å; L312-L319 HydrophobicContact CD1-CD2 4.45Å; L312-F322 HydrophobicContact CD1-CB 3.53Å; L312-F322 HydrophobicContact CD1-CD1 3.95Å; L312-F322 HydrophobicContact CD1-CD2 4.45Å; L312-F322 HydrophobicContact CD1-CG 3.69Å; L312-V431 HydrophobicContact CD1-CG2 4.38Å; L312-V431 HydrophobicContact CD2-CG1 4.25Å; L312-A434 HydrophobicContact CD2-CB 3.6Å
313	Y	95.9	Very high	95.4	Very high	83 Å²	83	31.9 Å²	31.9	33%	0.325	18%	0.181	S	C	.	.	H	α-helix	trans	-60.5	-48.2	177.5	-173.5	-93	0	0	0	111.6	C309 R310 L311 L315 G316 L319 L603 T609 L610 P611	C309-Y313 VanDerWaalsContact O-CB 3.29Å; C309-Y313 WeakPolarHBondContact O-CB 3.49Å; C309-Y313 PolarHBondContact O-N 3.38Å; R310-Y313 PolarHBondContact O-N 3.1Å; L311-Y313 VanDerWaalsContact C-N 3.31Å; L311-Y313 PolarHBondContact O-N 3.15Å; Y313-L315 PolarHBondContact O-N 2.77Å; Y313-G316 PolarHBondContact O-N 3.07Å; Y313-L319 HydrophobicContact CD2-CD1 4.45Å; Y313-L603 HydrophobicContact CD1-CD1 3.99Å; Y313-L603 HydrophobicContact CD1-CD2 4.28Å; Y313-L603 HydrophobicContact CE1-CD1 4.05Å; Y313-L603 HydrophobicContact CE1-CD2 4.07Å; Y313-T609 PolarHBondContact OH-O 2.7Å; Y313-L610 HydrophobicContact CD1-CD2 3.93Å; Y313-L610 HydrophobicContact CE1-CD2 4.48Å; Y313-P611 HydrophobicContact CD2-CG 3.91Å; Y313-P611 HydrophobicContact CE2-CG 3.62Å
314	C	95	Very high	95.5	Very high	14 Å²	14	33 Å²	33	10%	0.095	19%	0.194	C	C	.	.	H	α-helix	trans	-62.6	-26.7	177.8	-64.5	0	0	0	0	112.9	R310 L311 I449 F599	R310-C314 WeakPolarHBondContact O-CB 3.27Å; R310-C314 PolarHBondContact O-N 3.32Å; R310-C314 PolarHBondContact O-SG 3.17Å; L311-C314 PolarHBondContact O-N 3.37Å; C314-I449 HydrophobicContact CB-CD1 4.36Å; C314-I449 HydrophobicContact CB-CG2 4.27Å; C314-F599 HydrophobicContact CB-CD1 4.46Å
315	L	93.9	Very high	95.7	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-1.2	176.2	-63.4	173.9	0	0	0	113.4	L311 L312 Y313 Y317 A434 Y446 I449	L311-L315 HydrophobicContact CD1-CD1 3.91Å; L311-L315 HydrophobicContact CD1-CG 4.37Å; L311-L315 HydrophobicContact CG-CD1 4.07Å; L311-L315 VanDerWaalsContact O-CG 3.29Å; L311-L315 WeakPolarHBondContact O-CG 3.41Å; L311-L315 PolarHBondContact O-N 2.63Å; L311-L315 VanDerWaalsContact O-N 3.09Å; L312-L315 CarbonylContact O-C 3.43Å; L312-L315 PolarHBondContact O-N 3.48Å; Y313-L315 PolarHBondContact O-N 2.77Å; L315-Y317 HydrophobicContact CB-CD2 3.75Å; L315-Y317 HydrophobicContact CB-CE2 4.09Å; L315-Y317 VanDerWaalsContact O-CD2 3.27Å; L315-Y317 WeakPolarHBondContact O-CD2 3.46Å; L315-A434 HydrophobicContact CD1-CB 3.91Å; L315-Y446 HydrophobicContact CD2-CD1 4.03Å; L315-Y446 HydrophobicContact CD2-CD2 4.24Å; L315-Y446 HydrophobicContact CD2-CG 3.79Å; L315-Y446 PolarHBondContact O-OH 2.89Å; L315-I449 HydrophobicContact CD2-CG2 4.44Å
316	G	93.4	Very high	95.7	Very high	61 Å²	61	33.8 Å²	33.8	63%	0.629	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.4	31	-179.6	0	0	0	0	0	114.5	L312 Y313	L312-G316 PolarHBondContact O-N 2.8Å; L312-G316 VanDerWaalsContact O-N 3.1Å; Y313-G316 PolarHBondContact O-N 3.07Å
317	Y	94.4	Very high	95.8	Very high	22 Å²	22	34.3 Å²	34.3	9%	0.086	20%	0.204	C	C	.	.			trans	-103.1	148.9	178.3	-77.1	-107.5	0	0	0	112	L312 L315 R396 P433 A434 W437	L312-Y317 HydrophobicContact CD2-CG 4.46Å; L312-Y317 PolarHBondContact O-N 2.98Å; L315-Y317 HydrophobicContact CB-CD2 3.75Å; L315-Y317 HydrophobicContact CB-CE2 4.09Å; L315-Y317 VanDerWaalsContact O-CD2 3.27Å; L315-Y317 WeakPolarHBondContact O-CD2 3.46Å; Y317-R396 PolarHBondContact OH-NE 3.19Å; Y317-R396 PolarHBondContact OH-NH1 2.73Å; Y317-R396 VanDerWaalsContact OH-NH1 3.08Å; Y317-R396 PolarHBondContact OH-NH2 2.97Å; Y317-R396 VanDerWaalsContact OH-NH2 3.09Å; Y317-P433 HydrophobicContact CE1-CB 4.12Å; Y317-P433 PolarHBondContact OH-O 3.22Å; Y317-P433 VanDerWaalsContact OH-O 3.06Å; Y317-A434 HydrophobicContact CD1-CB 3.83Å; Y317-A434 HydrophobicContact CD2-CB 3.57Å; Y317-A434 HydrophobicContact CE1-CB 3.76Å; Y317-A434 HydrophobicContact CE2-CB 3.54Å; Y317-A434 HydrophobicContact CG-CB 3.71Å; Y317-A434 VanDerWaalsContact OH-CA 3.29Å; Y317-A434 WeakPolarHBondContact OH-CA 3.46Å; Y317-W437 VanDerWaalsContact OH-CB 3.27Å; Y317-W437 WeakPolarHBondContact OH-CB 3.35Å
318	P	93.5	Very high	95.8	Very high	85 Å²	85	38.9 Å²	38.9	55%	0.552	23%	0.225	S	C	*	.			trans	-67.1	144.6	176.9	29.4	-35.2	0	0	0	111.6
319	L	96.3	Very high	95.8	Very high	33 Å²	33	38.7 Å²	38.7	17%	0.173	22%	0.224	C	C	.	.	S	Bend	trans	-92.9	-32.5	-176.7	-51.4	-174.2	0	0	0	112.8	C309 L312 Y313 D321 F322 E323 L614	C309-L319 HydrophobicContact CB-CD1 4.32Å; C309-L319 HydrophobicContact CB-CD2 4.35Å; C309-L319 VanDerWaalsContact O-CD2 3.25Å; C309-L319 WeakPolarHBondContact O-CD2 3.39Å; L312-L319 HydrophobicContact CB-CD2 3.62Å; L312-L319 HydrophobicContact CD1-CD2 4.45Å; Y313-L319 HydrophobicContact CD2-CD1 4.45Å; L319-D321 VanDerWaalsContact C-N 3.32Å; L319-D321 PolarHBondContact O-N 3.39Å; L319-F322 WeakPolarHBondContact O-CB 3.38Å; L319-F322 PolarHBondContact O-N 3.25Å; L319-E323 WeakPolarHBondContact O-CG 3.28Å; L319-E323 PolarHBondContact O-N 3.1Å; L319-L614 HydrophobicContact CD1-CD1 3.97Å
320	T	95.9	Very high	95.5	Very high	99 Å²	99	39.2 Å²	39.2	61%	0.607	23%	0.227	S	C	*	.	H	α-helix	trans	-55.5	-43.8	-169.9	51.7	0	0	0	0	113.3	E323 G324	T320-E323 PolarHBondContact O-N 2.62Å; T320-G324 PolarHBondContact O-N 2.88Å
321	D	94.8	Very high	95.3	Very high	94 Å²	94	45.5 Å²	45.5	50%	0.503	26%	0.256	S	S	.	.	H	α-helix	trans	-67.7	-41.3	-178.8	-64.5	-17.5	0	0	0	110.5	L319 N325 T430	L319-D321 VanDerWaalsContact C-N 3.32Å; L319-D321 PolarHBondContact O-N 3.39Å; D321-N325 WeakPolarHBondContact O-CB 3.47Å; D321-N325 PolarHBondContact O-N 2.85Å; D321-N325 VanDerWaalsContact O-N 3.09Å; D321-N325 PolarHBondContact O-ND2 3.11Å; D321-T430 HydrophobicContact CB-CG2 3.83Å
322	F	96.7	Very high	95.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-50.1	176	167.2	-108.4	0	0	0	111.2	V37 K305 V308 L312 L319 G324 N325 Y326 M427 T430 V431	V37-F322 HydrophobicContact CB-CE2 4.39Å; V37-F322 HydrophobicContact CG1-CE2 4.15Å; V37-F322 HydrophobicContact CG1-CZ 3.95Å; V37-F322 HydrophobicContact CG2-CD2 4.41Å; V37-F322 HydrophobicContact CG2-CE2 3.47Å; V37-F322 VanDerWaalsContact CG2-CE2 3.47Å; V37-F322 HydrophobicContact CG2-CZ 3.92Å; K305-F322 HydrophobicContact CG-CE1 4.19Å; V308-F322 HydrophobicContact CB-CE1 3.86Å; V308-F322 HydrophobicContact CB-CE2 4.35Å; V308-F322 HydrophobicContact CB-CZ 3.65Å; V308-F322 HydrophobicContact CG1-CD1 4.31Å; V308-F322 HydrophobicContact CG1-CD2 4.3Å; V308-F322 HydrophobicContact CG1-CE1 3.89Å; V308-F322 HydrophobicContact CG1-CE2 3.9Å; V308-F322 HydrophobicContact CG1-CZ 3.66Å; L312-F322 HydrophobicContact CD1-CB 3.53Å; L312-F322 HydrophobicContact CD1-CD1 3.95Å; L312-F322 HydrophobicContact CD1-CD2 4.45Å; L312-F322 HydrophobicContact CD1-CG 3.69Å; L319-F322 WeakPolarHBondContact O-CB 3.38Å; L319-F322 PolarHBondContact O-N 3.25Å; F322-G324 PolarHBondContact O-N 3.44Å; F322-N325 PolarHBondContact O-N 3.3Å; F322-Y326 HydrophobicContact CE1-CD2 4.4Å; F322-Y326 AromaticContact CE2-CD2 3.95Å; F322-Y326 HydrophobicContact CE2-CD2 3.95Å; F322-Y326 HydrophobicContact CE2-CG 4.49Å; F322-Y326 AromaticContact CZ-CD2 3.54Å; F322-Y326 HydrophobicContact CZ-CD2 3.54Å; F322-Y326 HydrophobicContact CZ-CE2 4.36Å; F322-Y326 HydrophobicContact CZ-CG 4.16Å; F322-Y326 WeakPolarHBondContact O-CB 3.47Å; F322-Y326 PolarHBondContact O-N 3.05Å; F322-M427 HydrophobicContact CD2-CG 3.92Å; F322-M427 HydrophobicContact CE2-CG 3.77Å; F322-M427 HydrophobicContact CE2-SD 3.99Å; F322-T430 WeakPolarHBondContact CA-OG1 3.42Å; F322-T430 WeakPolarHBondContact CB-OG1 3.42Å; F322-V431 HydrophobicContact CD2-CG2 3.38Å; F322-V431 HydrophobicContact CE2-CG2 3.83Å; F322-V431 HydrophobicContact CG-CG2 4.17Å
323	E	96.8	Very high	94.8	Very high	67 Å²	67	46.5 Å²	46.5	31%	0.313	26%	0.26	S	S	.	.	H	α-helix	trans	-59	-47.4	-177.7	-68.4	179.7	122	0	0	111.6	L319 T320 Y326 D327	L319-E323 WeakPolarHBondContact O-CG 3.28Å; L319-E323 PolarHBondContact O-N 3.1Å; T320-E323 PolarHBondContact O-N 2.62Å; E323-Y326 WeakPolarHBondContact O-CB 3.42Å; E323-Y326 PolarHBondContact O-N 2.72Å; E323-D327 PolarHBondContact O-N 3.39Å
324	G	97.1	Very high	94.4	Very high	28 Å²	28	46.9 Å²	46.9	29%	0.289	27%	0.267	S	S	.	.	H	α-helix	trans	-58.8	-50.9	175.9	0	0	0	0	0	111.9	T320 F322 Y326 D327 H328	T320-G324 PolarHBondContact O-N 2.88Å; F322-G324 PolarHBondContact O-N 3.44Å; G324-Y326 VanDerWaalsContact C-N 3.31Å; G324-Y326 PolarHBondContact O-N 3.45Å; G324-D327 PolarHBondContact O-N 2.87Å; G324-H328 PolarHBondContact O-N 3.44Å; G324-H328 PolarHBondContact O-ND1 2.97Å
325	N	97	Very high	94.1	Very high	47 Å²	47	48.5 Å²	48.5	25%	0.251	28%	0.279	S	S	.	.	H	α-helix	trans	-66.2	-33.8	-179.1	-78.9	-78.6	0	0	0	113.2	D321 F322 L329 S426 M427	D321-N325 WeakPolarHBondContact O-CB 3.47Å; D321-N325 PolarHBondContact O-N 2.85Å; D321-N325 VanDerWaalsContact O-N 3.09Å; D321-N325 PolarHBondContact O-ND2 3.11Å; F322-N325 PolarHBondContact O-N 3.3Å; N325-L329 WeakPolarHBondContact O-CB 3.41Å; N325-L329 PolarHBondContact O-N 3.3Å; N325-S426 WeakPolarHBondContact OD1-CB 3.46Å; N325-M427 HydrophobicContact CB-CB 3.95Å; N325-M427 HydrophobicContact CB-CG 4.49Å
326	Y	96.5	Very high	93.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61.5	-47.8	173.2	178.4	-78.2	0	0	0	110.8	V37 G39 A40 I301 K305 F322 E323 G324 H328 L329 M330 M427	V37-Y326 HydrophobicContact CG1-CD2 4.15Å; V37-Y326 HydrophobicContact CG1-CE2 4.02Å; G39-Y326 VanDerWaalsContact O-CE2 3.24Å; G39-Y326 WeakPolarHBondContact O-CE2 3.32Å; G39-Y326 PolarHBondContact O-OH 3.47Å; A40-Y326 HydrophobicContact CB-CD2 3.26Å; A40-Y326 HydrophobicContact CB-CE2 3.27Å; A40-Y326 HydrophobicContact CB-CG 4.22Å; I301-Y326 HydrophobicContact CG2-CE1 3.95Å; I301-Y326 WeakPolarHBondContact CG2-OH 3.44Å; I301-Y326 PolarHBondContact O-OH 3.29Å; K305-Y326 HydrophobicContact CB-CD1 4.27Å; K305-Y326 HydrophobicContact CB-CD2 4.39Å; K305-Y326 HydrophobicContact CB-CE1 3.82Å; K305-Y326 HydrophobicContact CB-CE2 3.88Å; K305-Y326 HydrophobicContact CD-CD1 3.67Å; K305-Y326 HydrophobicContact CD-CE1 3.79Å; K305-Y326 HydrophobicContact CD-CG 4.31Å; K305-Y326 HydrophobicContact CG-CD1 3.88Å; K305-Y326 HydrophobicContact CG-CD2 4.25Å; K305-Y326 HydrophobicContact CG-CE1 3.93Å; K305-Y326 HydrophobicContact CG-CE2 4.25Å; K305-Y326 HydrophobicContact CG-CG 4.09Å; F322-Y326 HydrophobicContact CE1-CD2 4.4Å; F322-Y326 AromaticContact CE2-CD2 3.95Å; F322-Y326 HydrophobicContact CE2-CD2 3.95Å; F322-Y326 HydrophobicContact CE2-CG 4.49Å; F322-Y326 AromaticContact CZ-CD2 3.54Å; F322-Y326 HydrophobicContact CZ-CD2 3.54Å; F322-Y326 HydrophobicContact CZ-CE2 4.36Å; F322-Y326 HydrophobicContact CZ-CG 4.16Å; F322-Y326 WeakPolarHBondContact O-CB 3.47Å; F322-Y326 PolarHBondContact O-N 3.05Å; E323-Y326 WeakPolarHBondContact O-CB 3.42Å; E323-Y326 PolarHBondContact O-N 2.72Å; G324-Y326 VanDerWaalsContact C-N 3.31Å; G324-Y326 PolarHBondContact O-N 3.45Å; Y326-H328 PolarHBondContact O-N 2.97Å; Y326-L329 WeakPolarHBondContact O-CB 3.33Å; Y326-L329 PolarHBondContact O-N 3.37Å; Y326-M330 HydrophobicContact CD1-CG 3.96Å; Y326-M330 HydrophobicContact CE1-CG 3.51Å; Y326-M330 HydrophobicContact CE1-SD 4.29Å; Y326-M330 WeakPolarHBondContact O-CG 3.49Å; Y326-M330 PolarHBondContact O-N 3.49Å; Y326-M427 HydrophobicContact CD2-SD 4.22Å
327	D	96.1	Very high	92.6	Very high	70 Å²	70	49 Å²	49	37%	0.374	26%	0.264	S	S	.	.	H	α-helix	trans	-65.5	-39.2	-179.2	-66.5	-25.2	0	0	0	111.5	K305 E323 G324 L329 M330 E331	K305-D327 IonicContact NZ-OD1 3.24Å; K305-D327 PolarHBondContact NZ-OD1 2.98Å; K305-D327 IonicContact NZ-OD2 2.7Å; K305-D327 PolarHBondContact NZ-OD2 3.23Å; E323-D327 PolarHBondContact O-N 3.39Å; G324-D327 PolarHBondContact O-N 2.87Å; D327-L329 VanDerWaalsContact C-N 3.34Å; D327-L329 PolarHBondContact O-N 2.97Å; D327-M330 WeakPolarHBondContact O-CB 3.33Å; D327-M330 PolarHBondContact O-N 3.25Å; D327-E331 WeakPolarHBondContact O-CB 3.36Å; D327-E331 PolarHBondContact O-N 3.47Å
328	H	96.3	Very high	91.4	Very high	108 Å²	108	53.6 Å²	53.6	50%	0.5	29%	0.29	S	S	.	.	H	α-helix	trans	-64.9	-37.6	173.9	-73	74.8	0	0	0	112.2	G324 Y326 E331 F332	G324-H328 PolarHBondContact O-N 3.44Å; G324-H328 PolarHBondContact O-ND1 2.97Å; Y326-H328 PolarHBondContact O-N 2.97Å; H328-E331 PolarHBondContact O-N 2.84Å; H328-F332 WeakPolarHBondContact O-CB 3.41Å; H328-F332 PolarHBondContact O-N 3.43Å
329	L	95.5	Very high	90.8	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.4	-43.1	174.2	177.5	59.5	0	0	0	110.7	A40 V41 N325 Y326 D327 F332 I333 F420 H423 Y424 M427	A40-L329 HydrophobicContact CB-CD2 3.82Å; A40-L329 WeakPolarHBondContact O-CD2 3.17Å; A40-L329 WeakPolarHBondContact O-CG 3.37Å; V41-L329 HydrophobicContact CG2-CD2 4.34Å; N325-L329 WeakPolarHBondContact O-CB 3.41Å; N325-L329 PolarHBondContact O-N 3.3Å; Y326-L329 WeakPolarHBondContact O-CB 3.33Å; Y326-L329 PolarHBondContact O-N 3.37Å; D327-L329 VanDerWaalsContact C-N 3.34Å; D327-L329 PolarHBondContact O-N 2.97Å; L329-F332 PolarHBondContact O-N 3.27Å; L329-I333 HydrophobicContact CD1-CD1 3.89Å; L329-I333 HydrophobicContact CD1-CG1 4.16Å; L329-I333 HydrophobicContact CG-CD1 3.85Å; L329-I333 WeakPolarHBondContact O-CB 3.23Å; L329-I333 WeakPolarHBondContact O-CD1 3.37Å; L329-I333 WeakPolarHBondContact O-CG1 3.45Å; L329-I333 PolarHBondContact O-N 3.4Å; L329-F420 HydrophobicContact CD1-CD2 4.11Å; L329-F420 HydrophobicContact CD1-CE2 4Å; L329-H423 HydrophobicContact CB-CB 4.3Å; L329-H423 HydrophobicContact CD1-CB 3.72Å; L329-Y424 HydrophobicContact CD2-CD2 4.16Å; L329-M427 HydrophobicContact CD2-CE 4.15Å; L329-M427 HydrophobicContact CD2-SD 3.89Å
330	M	91.9	Very high	89.6	Confident	11 Å²	11	58.7 Å²	58.7	5%	0.054	32%	0.317	C	S	.	.	H	α-helix	trans	-58	-48.2	173.1	-74.3	-59.7	97.5	0	0	112.2	A40 I301 Y326 D327 I333 I334	A40-M330 HydrophobicContact CB-CE 4.42Å; A40-M330 WeakPolarHBondContact O-CE 3.26Å; I301-M330 HydrophobicContact CD1-SD 4.04Å; I301-M330 HydrophobicContact CG1-SD 3.95Å; I301-M330 HydrophobicContact CG2-CG 4.19Å; I301-M330 HydrophobicContact CG2-SD 3.93Å; Y326-M330 HydrophobicContact CD1-CG 3.96Å; Y326-M330 HydrophobicContact CE1-CG 3.51Å; Y326-M330 HydrophobicContact CE1-SD 4.29Å; Y326-M330 WeakPolarHBondContact O-CG 3.49Å; Y326-M330 PolarHBondContact O-N 3.49Å; D327-M330 WeakPolarHBondContact O-CB 3.33Å; D327-M330 PolarHBondContact O-N 3.25Å; M330-I333 HydrophobicContact CE-CD1 3.85Å; M330-I333 WeakPolarHBondContact O-CB 3.44Å; M330-I333 PolarHBondContact O-N 3Å; M330-I334 WeakPolarHBondContact O-CB 3.36Å; M330-I334 VanDerWaalsContact O-CG1 3.25Å; M330-I334 WeakPolarHBondContact O-CG1 3.44Å; M330-I334 PolarHBondContact O-N 2.95Å
331	E	92	Very high	88.7	Confident	133 Å²	133	59.7 Å²	59.7	62%	0.621	32%	0.318	S	S	*	.	H	α-helix	trans	-61.9	-46.9	179.1	-173.9	-179.8	-173.2	0	0	111.4	D327 H328 I333 I334 S335	D327-E331 WeakPolarHBondContact O-CB 3.36Å; D327-E331 PolarHBondContact O-N 3.47Å; H328-E331 PolarHBondContact O-N 2.84Å; E331-I333 VanDerWaalsContact C-N 3.33Å; E331-I333 PolarHBondContact O-N 2.99Å; E331-I334 PolarHBondContact O-N 3.43Å; E331-S335 WeakPolarHBondContact O-CB 3.3Å; E331-S335 PolarHBondContact O-N 3.4Å
332	F	93.5	Very high	88.1	Confident	16 Å²	16	56.6 Å²	56.6	7%	0.07	30%	0.302	C	S	.	.	H	α-helix	trans	-56.3	-50.8	175.8	171.1	-92	0	0	0	110.8	H328 L329 I334 S335 Q336 M344 D418 F420 H423	H328-F332 WeakPolarHBondContact O-CB 3.41Å; H328-F332 PolarHBondContact O-N 3.43Å; L329-F332 PolarHBondContact O-N 3.27Å; F332-I334 VanDerWaalsContact C-N 3.33Å; F332-I334 PolarHBondContact O-N 3.5Å; F332-S335 WeakPolarHBondContact O-CA 3.29Å; F332-S335 WeakPolarHBondContact O-CB 3.45Å; F332-S335 PolarHBondContact O-N 2.94Å; F332-S335 PolarHBondContact O-OG 3.22Å; F332-Q336 HydrophobicContact CD1-CG 4.16Å; F332-Q336 HydrophobicContact CE1-CG 3.6Å; F332-Q336 HydrophobicContact CE2-CG 4.2Å; F332-Q336 HydrophobicContact CZ-CG 3.64Å; F332-Q336 VanDerWaalsContact CZ-NE2 3.3Å; F332-Q336 WeakPolarHBondContact O-CG 3.38Å; F332-Q336 PolarHBondContact O-N 3.49Å; F332-Q336 VanDerWaalsContact O-N 3.09Å; F332-M344 HydrophobicContact CE1-CB 4.21Å; F332-D418 VanDerWaalsContact CE2-O 3.22Å; F332-D418 WeakPolarHBondContact CE2-O 3.3Å; F332-F420 HydrophobicContact CD1-CD2 4.46Å; F332-F420 HydrophobicContact CE1-CB 3.72Å; F332-F420 HydrophobicContact CE1-CD2 4.21Å; F332-F420 HydrophobicContact CE1-CG 4.5Å; F332-F420 HydrophobicContact CZ-CB 4.28Å; F332-F420 VanDerWaalsContact CZ-N 3.3Å; F332-H423 AromaticContact CD2-CD2 3.29Å; F332-H423 WeakPolarHBondContact CD2-CD2 3.38Å; F332-H423 AromaticContact CD2-NE2 3.35Å; F332-H423 VanDerWaalsContact CD2-NE2 3.35Å; F332-H423 WeakPolarHBondContact CD2-NE2 2.89Å; F332-H423 AromaticContact CE2-CD2 3.95Å; F332-H423 AromaticContact CG-CD2 3.37Å; F332-H423 WeakPolarHBondContact CG-CD2 3.46Å; F332-H423 AromaticContact CG-NE2 3.75Å
333	I	89.4	Confident	87.7	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.021	31%	0.311	C	S	.	.	H	α-helix	trans	-54.5	-49.3	178.7	-83.8	174.9	0	0	0	111.2	V41 A44 L329 M330 E331 S335 Q336 M344 F420	V41-I333 HydrophobicContact CB-CD1 4.18Å; V41-I333 HydrophobicContact CG1-CD1 3.99Å; V41-I333 HydrophobicContact CG2-CD1 4.31Å; A44-I333 HydrophobicContact CB-CB 4.1Å; A44-I333 HydrophobicContact CB-CD1 4.01Å; A44-I333 HydrophobicContact CB-CG1 3.84Å; A44-I333 HydrophobicContact CB-CG2 3.39Å; L329-I333 HydrophobicContact CD1-CD1 3.89Å; L329-I333 HydrophobicContact CD1-CG1 4.16Å; L329-I333 HydrophobicContact CG-CD1 3.85Å; L329-I333 WeakPolarHBondContact O-CB 3.23Å; L329-I333 WeakPolarHBondContact O-CD1 3.37Å; L329-I333 WeakPolarHBondContact O-CG1 3.45Å; L329-I333 PolarHBondContact O-N 3.4Å; M330-I333 HydrophobicContact CE-CD1 3.85Å; M330-I333 WeakPolarHBondContact O-CB 3.44Å; M330-I333 PolarHBondContact O-N 3Å; E331-I333 VanDerWaalsContact C-N 3.33Å; E331-I333 PolarHBondContact O-N 2.99Å; I333-S335 VanDerWaalsContact C-N 3.26Å; I333-S335 PolarHBondContact O-N 3.15Å; I333-Q336 PolarHBondContact O-N 3.18Å; I333-M344 HydrophobicContact CG1-SD 4.28Å; I333-F420 HydrophobicContact CD1-CE2 4.01Å; I333-F420 HydrophobicContact CG1-CD2 4.28Å; I333-F420 HydrophobicContact CG1-CE2 4.13Å
334	I	87.4	Confident	87.5	Confident	92 Å²	92	55.4 Å²	55.4	47%	0.472	30%	0.297	S	S	.	.	H	α-helix	trans	-65.4	-32.5	178.1	-67.7	164.9	0	0	0	110.4	M330 E331 F332 Q336 K337	M330-I334 WeakPolarHBondContact O-CB 3.36Å; M330-I334 VanDerWaalsContact O-CG1 3.25Å; M330-I334 WeakPolarHBondContact O-CG1 3.44Å; M330-I334 PolarHBondContact O-N 2.95Å; E331-I334 PolarHBondContact O-N 3.43Å; F332-I334 VanDerWaalsContact C-N 3.33Å; F332-I334 PolarHBondContact O-N 3.5Å; I334-Q336 VanDerWaalsContact C-N 3.31Å; I334-Q336 PolarHBondContact O-N 3.2Å; I334-K337 WeakPolarHBondContact O-CB 3.38Å; I334-K337 PolarHBondContact O-N 3.37Å
335	S	87.9	Confident	87.2	Confident	48 Å²	48	54.6 Å²	54.6	34%	0.336	29%	0.287	S	S	.	.	H	α-helix	trans	-69.3	-25.8	176.9	88.6	0	0	0	0	113.7	E331 F332 I333 K337 K339	E331-S335 WeakPolarHBondContact O-CB 3.3Å; E331-S335 PolarHBondContact O-N 3.4Å; F332-S335 WeakPolarHBondContact O-CA 3.29Å; F332-S335 WeakPolarHBondContact O-CB 3.45Å; F332-S335 PolarHBondContact O-N 2.94Å; F332-S335 PolarHBondContact O-OG 3.22Å; I333-S335 VanDerWaalsContact C-N 3.26Å; I333-S335 PolarHBondContact O-N 3.15Å; S335-K337 VanDerWaalsContact C-N 3.3Å; S335-K339 VanDerWaalsContact O-CE 3.24Å; S335-K339 WeakPolarHBondContact O-CE 3.39Å
336	Q	86.6	Confident	86.9	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.019	29%	0.292	C	S	.	.	H	α-helix	trans	-77.1	-18.5	-179.8	-65.4	-56.1	-45.8	0	0	113	F332 I333 I334 N338 K339 M344	F332-Q336 HydrophobicContact CD1-CG 4.16Å; F332-Q336 HydrophobicContact CE1-CG 3.6Å; F332-Q336 HydrophobicContact CE2-CG 4.2Å; F332-Q336 HydrophobicContact CZ-CG 3.64Å; F332-Q336 VanDerWaalsContact CZ-NE2 3.3Å; F332-Q336 WeakPolarHBondContact O-CG 3.38Å; F332-Q336 PolarHBondContact O-N 3.49Å; F332-Q336 VanDerWaalsContact O-N 3.09Å; I333-Q336 PolarHBondContact O-N 3.18Å; I334-Q336 VanDerWaalsContact C-N 3.31Å; I334-Q336 PolarHBondContact O-N 3.2Å; Q336-N338 PolarHBondContact O-N 2.91Å; Q336-K339 PolarHBondContact O-N 3.1Å; Q336-M344 HydrophobicContact CG-CB 4.29Å
337	K	68.2	Low	86.7	Confident	68 Å²	68	56.2 Å²	56.2	30%	0.296	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-31.4	-72.4	173.8	172.8	129.7	175.4	168.5	0	112.2	Y46 Y47 I334 S335 K339	Y46-K337 VanDerWaalsContact CE1-NZ 3.33Å; Y47-K337 HydrophobicContact CD1-CB 3.76Å; Y47-K337 HydrophobicContact CD1-CD 4.18Å; Y47-K337 HydrophobicContact CD1-CG 3.48Å; Y47-K337 VanDerWaalsContact CD1-CG 3.48Å; Y47-K337 WeakPolarHBondContact CD1-O 3.3Å; Y47-K337 HydrophobicContact CD2-CB 4.33Å; Y47-K337 HydrophobicContact CD2-CD 3.17Å; Y47-K337 HydrophobicContact CD2-CG 3.31Å; Y47-K337 HydrophobicContact CE1-CB 4.28Å; Y47-K337 HydrophobicContact CE1-CG 3.73Å; Y47-K337 WeakPolarHBondContact CE1-O 3.43Å; Y47-K337 HydrophobicContact CE2-CD 3.73Å; Y47-K337 HydrophobicContact CE2-CG 3.55Å; Y47-K337 HydrophobicContact CG-CB 3.73Å; Y47-K337 HydrophobicContact CG-CD 3.37Å; Y47-K337 HydrophobicContact CG-CG 3.2Å; I334-K337 WeakPolarHBondContact O-CB 3.38Å; I334-K337 PolarHBondContact O-N 3.37Å; S335-K337 VanDerWaalsContact C-N 3.3Å; K337-K339 PolarHBondContact O-N 3.41Å
338	N	70.8	Confident	86.6	Confident	119 Å²	119	52.9 Å²	52.9	64%	0.636	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	11.7	-169.1	-58.7	-16.7	0	0	0	114.9	Y47 Q336	Y47-N338 VanDerWaalsContact CE1-OD1 3.24Å; Y47-N338 WeakPolarHBondContact CE1-OD1 3.44Å; Y47-N338 PolarHBondContact OH-OD1 3.14Å; Q336-N338 PolarHBondContact O-N 2.91Å
339	K	80.1	Confident	86.5	Confident	104 Å²	104	52.2 Å²	52.2	45%	0.452	27%	0.272	S	S	.	.			trans	-89.1	127.8	-173.5	-68	-179.9	-177.6	168.3	0	110.5	S335 Q336 K337 N341	S335-K339 VanDerWaalsContact O-CE 3.24Å; S335-K339 WeakPolarHBondContact O-CE 3.39Å; Q336-K339 PolarHBondContact O-N 3.1Å; K337-K339 PolarHBondContact O-N 3.41Å; K339-N341 VanDerWaalsContact C-N 3.32Å; K339-N341 PolarHBondContact O-N 3.42Å
340	S	71.7	Confident	86.3	Confident	120 Å²	120	56.5 Å²	56.5	84%	0.839	31%	0.307	S	S	*	.	S	Bend	trans	-63	-38.8	174.2	55.9	0	0	0	0	112.2	N342	S340-N342 PolarHBondContact O-N 3.3Å
341	N	75.5	Confident	86.2	Confident	120 Å²	120	60.5 Å²	60.5	64%	0.642	32%	0.324	S	S	*	.	S	Bend	trans	-94.4	73.5	173.9	-65	-11.1	0	0	0	109.3	K339 M343	K339-N341 VanDerWaalsContact C-N 3.32Å; K339-N341 PolarHBondContact O-N 3.42Å; N341-M343 PolarHBondContact O-N 2.96Å
342	N	83.1	Confident	86.1	Confident	30 Å²	30	55.3 Å²	55.3	16%	0.16	31%	0.306	C	S	.	.			trans	-73.5	98.9	179.8	-174.1	-35.8	0	0	0	110	S340 M344 A345 E346	S340-N342 PolarHBondContact O-N 3.3Å; N342-M344 PolarHBondContact O-N 3.28Å; N342-M344 WeakPolarHBondContact OD1-CA 3.38Å; N342-M344 VanDerWaalsContact OD1-CB 3.25Å; N342-M344 WeakPolarHBondContact OD1-CB 3.22Å; N342-M344 PolarHBondContact OD1-N 2.89Å; N342-M344 VanDerWaalsContact OD1-N 3.08Å; N342-A345 HydrophobicContact CB-CB 3.94Å; N342-A345 WeakPolarHBondContact O-CB 3.07Å; N342-A345 PolarHBondContact O-N 2.95Å; N342-A345 VanDerWaalsContact O-N 3.13Å; N342-A345 PolarHBondContact OD1-N 3.15Å; N342-E346 PolarHBondContact O-N 3.25Å
343	M	88.2	Confident	86.2	Confident	36 Å²	36	54.6 Å²	54.6	18%	0.177	30%	0.303	C	S	.	.	H	α-helix	trans	-59.2	-36.5	-178.7	-63.9	161.6	71	0	0	111.7	N341 E346 E347 Y416 D418	N341-M343 PolarHBondContact O-N 2.96Å; M343-E346 PolarHBondContact O-N 3.4Å; M343-E347 WeakPolarHBondContact O-CB 3.33Å; M343-E347 WeakPolarHBondContact O-CG 3.27Å; M343-E347 PolarHBondContact O-N 2.92Å; M343-Y416 HydrophobicContact CB-CD2 3.97Å; M343-Y416 HydrophobicContact CB-CE2 4.1Å; M343-Y416 HydrophobicContact CB-CG 4.35Å; M343-Y416 VanDerWaalsContact CE-CB 3.44Å; M343-Y416 HydrophobicContact CE-CD1 3.59Å; M343-Y416 HydrophobicContact CE-CD2 4.26Å; M343-Y416 HydrophobicContact CE-CE1 4.4Å; M343-Y416 HydrophobicContact CE-CG 3.49Å; M343-Y416 VanDerWaalsContact CE-CG 3.49Å; M343-Y416 HydrophobicContact CG-CD1 4.37Å; M343-Y416 HydrophobicContact CG-CD2 4.36Å; M343-Y416 HydrophobicContact CG-CE1 4.34Å; M343-Y416 HydrophobicContact CG-CE2 4.36Å; M343-Y416 HydrophobicContact CG-CG 4.37Å; M343-D418 WeakPolarHBondContact CE-OD1 3.15Å
344	M	91.8	Very high	86.3	Confident	6 Å²	6	60.1 Å²	60.1	3%	0.03	33%	0.327	C	S	.	.	H	α-helix	trans	-62.8	-44.6	177.3	173.9	176.4	-177.2	0	0	111.4	V41 A44 F332 I333 Q336 N342 E347 L348 F420	V41-M344 HydrophobicContact CG1-CE 4.09Å; A44-M344 HydrophobicContact CB-CE 3.28Å; A44-M344 HydrophobicContact CB-SD 3.59Å; A44-M344 VanDerWaalsContact CB-SD 3.59Å; F332-M344 HydrophobicContact CE1-CB 4.21Å; I333-M344 HydrophobicContact CG1-SD 4.28Å; Q336-M344 HydrophobicContact CG-CB 4.29Å; N342-M344 PolarHBondContact O-N 3.28Å; N342-M344 WeakPolarHBondContact OD1-CA 3.38Å; N342-M344 VanDerWaalsContact OD1-CB 3.25Å; N342-M344 WeakPolarHBondContact OD1-CB 3.22Å; N342-M344 PolarHBondContact OD1-N 2.89Å; N342-M344 VanDerWaalsContact OD1-N 3.08Å; M344-E347 PolarHBondContact O-N 3.27Å; M344-L348 HydrophobicContact CE-CD1 3.59Å; M344-L348 HydrophobicContact CG-CD1 3.76Å; M344-L348 HydrophobicContact CG-CG 4.2Å; M344-L348 WeakPolarHBondContact O-CB 3.27Å; M344-L348 VanDerWaalsContact O-CG 3.27Å; M344-L348 WeakPolarHBondContact O-CG 3.16Å; M344-L348 PolarHBondContact O-N 3.36Å; M344-F420 HydrophobicContact CB-CB 3.78Å; M344-F420 HydrophobicContact CB-CD2 4.42Å; M344-F420 HydrophobicContact CB-CG 4.26Å; M344-F420 HydrophobicContact CE-CD2 3.56Å; M344-F420 HydrophobicContact CE-CE1 4.35Å; M344-F420 HydrophobicContact CE-CE2 3.25Å; M344-F420 HydrophobicContact CE-CG 4.21Å; M344-F420 HydrophobicContact CE-CZ 3.68Å; M344-F420 HydrophobicContact CG-CB 3.75Å; M344-F420 HydrophobicContact CG-CD1 4.36Å; M344-F420 HydrophobicContact CG-CD2 3.69Å; M344-F420 HydrophobicContact CG-CE2 4.36Å; M344-F420 HydrophobicContact CG-CG 3.67Å; M344-F420 HydrophobicContact SD-CD2 3.52Å; M344-F420 VanDerWaalsContact SD-CD2 3.52Å; M344-F420 HydrophobicContact SD-CE2 3.85Å; M344-F420 HydrophobicContact SD-CG 4.15Å
345	A	91.4	Very high	86.6	Confident	10 Å²	10	57.8 Å²	57.8	8%	0.083	32%	0.315	C	S	.	.	H	α-helix	trans	-60.3	-49	179.4	0	0	0	0	0	110.9	N342 E347 L348 F349 I356	N342-A345 HydrophobicContact CB-CB 3.94Å; N342-A345 WeakPolarHBondContact O-CB 3.07Å; N342-A345 PolarHBondContact O-N 2.95Å; N342-A345 VanDerWaalsContact O-N 3.13Å; N342-A345 PolarHBondContact OD1-N 3.15Å; A345-E347 VanDerWaalsContact C-N 3.31Å; A345-E347 PolarHBondContact O-N 3.4Å; A345-L348 PolarHBondContact O-N 3.44Å; A345-F349 HydrophobicContact CB-CD2 4.25Å; A345-F349 HydrophobicContact CB-CE2 3.94Å; A345-F349 WeakPolarHBondContact O-CB 3.2Å; A345-F349 WeakPolarHBondContact O-CD2 3.27Å; A345-F349 WeakPolarHBondContact O-CG 3.48Å; A345-F349 PolarHBondContact O-N 2.93Å; A345-I356 HydrophobicContact CB-CD1 3.45Å; A345-I356 VanDerWaalsContact CB-CD1 3.45Å
346	E	90.9	Very high	86.8	Confident	74 Å²	74	55.8 Å²	55.8	35%	0.346	30%	0.3	S	S	.	.	H	α-helix	trans	-57.8	-43.7	177.1	-67.6	-169.6	-144.2	0	0	112.5	N342 M343 A350 K415 Y416	N342-E346 PolarHBondContact O-N 3.25Å; M343-E346 PolarHBondContact O-N 3.4Å; E346-A350 WeakPolarHBondContact O-CB 2.93Å; E346-A350 PolarHBondContact O-N 2.49Å; E346-K415 IonicContact OE2-NZ 3.57Å; E346-K415 PolarHBondContact OE2-NZ 3.14Å; E346-Y416 HydrophobicContact CB-CE2 4.34Å; E346-Y416 PolarHBondContact OE2-OH 3.05Å
347	E	92.9	Very high	87.1	Confident	8 Å²	8	55.6 Å²	55.6	4%	0.037	30%	0.3	C	S	.	.	H	α-helix	trans	-65.2	-41.3	177.5	-77.5	-169.8	149.4	0	0	113.1	M343 M344 A345 K351 Y416 F420 Y421	M343-E347 WeakPolarHBondContact O-CB 3.33Å; M343-E347 WeakPolarHBondContact O-CG 3.27Å; M343-E347 PolarHBondContact O-N 2.92Å; M344-E347 PolarHBondContact O-N 3.27Å; A345-E347 VanDerWaalsContact C-N 3.31Å; A345-E347 PolarHBondContact O-N 3.4Å; E347-K351 WeakPolarHBondContact O-CG 3.23Å; E347-K351 PolarHBondContact O-N 2.7Å; E347-Y416 HydrophobicContact CG-CD2 3.74Å; E347-Y416 HydrophobicContact CG-CE2 4.2Å; E347-F420 WeakPolarHBondContact OE2-CA 3.44Å; E347-F420 VanDerWaalsContact OE2-CB 3.28Å; E347-F420 WeakPolarHBondContact OE2-CB 3.41Å; E347-F420 PolarHBondContact OE2-N 3Å; E347-Y421 HydrophobicContact CB-CD2 3.76Å; E347-Y421 HydrophobicContact CB-CE2 3.85Å; E347-Y421 HydrophobicContact CG-CD2 4.23Å; E347-Y421 PolarHBondContact OE2-N 2.98Å
348	L	93.8	Very high	88.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-69.4	-43.1	178.1	-71.6	175.6	0	0	0	111.9	M344 A345 A350 K351 G352 V353 I356 V361 L365 F420	M344-L348 HydrophobicContact CE-CD1 3.59Å; M344-L348 HydrophobicContact CG-CD1 3.76Å; M344-L348 HydrophobicContact CG-CG 4.2Å; M344-L348 WeakPolarHBondContact O-CB 3.27Å; M344-L348 VanDerWaalsContact O-CG 3.27Å; M344-L348 WeakPolarHBondContact O-CG 3.16Å; M344-L348 PolarHBondContact O-N 3.36Å; A345-L348 PolarHBondContact O-N 3.44Å; L348-A350 VanDerWaalsContact C-N 3.3Å; L348-A350 PolarHBondContact O-N 3.39Å; L348-K351 CarbonylContact O-C 3.26Å; L348-K351 WeakPolarHBondContact O-CA 2.96Å; L348-K351 WeakPolarHBondContact O-CB 3.3Å; L348-K351 PolarHBondContact O-N 2.72Å; L348-G352 PolarHBondContact O-N 3.44Å; L348-V353 HydrophobicContact CB-CB 4.13Å; L348-V353 HydrophobicContact CB-CG1 4.47Å; L348-V353 HydrophobicContact CB-CG2 4.24Å; L348-V353 HydrophobicContact CD2-CG2 4.31Å; L348-V353 WeakPolarHBondContact O-CB 3.32Å; L348-V353 PolarHBondContact O-N 3.21Å; L348-I356 HydrophobicContact CD1-CD1 4.46Å; L348-I356 HydrophobicContact CD1-CG1 4.26Å; L348-I356 HydrophobicContact CD1-CG2 4.14Å; L348-V361 HydrophobicContact CD1-CG1 4.36Å; L348-V361 HydrophobicContact CD1-CG2 3.78Å; L348-V361 HydrophobicContact CD2-CG1 4.06Å; L348-V361 HydrophobicContact CD2-CG2 4.3Å; L348-L365 HydrophobicContact CD2-CD2 3.8Å; L348-F420 HydrophobicContact CD2-CD1 4.16Å; L348-F420 HydrophobicContact CD2-CE1 3.84Å
349	F	93.9	Very high	89.6	Confident	94 Å²	94	47.2 Å²	47.2	41%	0.412	26%	0.257	S	S	.	.	H	α-helix	trans	-61	-40.2	175.2	-71.4	-54.8	0	0	0	111.5	A345 K351 G352 V353 I356	A345-F349 HydrophobicContact CB-CD2 4.25Å; A345-F349 HydrophobicContact CB-CE2 3.94Å; A345-F349 WeakPolarHBondContact O-CB 3.2Å; A345-F349 WeakPolarHBondContact O-CD2 3.27Å; A345-F349 WeakPolarHBondContact O-CG 3.48Å; A345-F349 PolarHBondContact O-N 2.93Å; F349-K351 PolarHBondContact O-N 3.43Å; F349-K351 VanDerWaalsContact O-N 3.1Å; F349-G352 PolarHBondContact O-N 3.44Å; F349-V353 WeakPolarHBondContact CD1-O 3.37Å; F349-I356 HydrophobicContact CE1-CG1 4.4Å; F349-I356 HydrophobicContact CE2-CD1 4.01Å; F349-I356 HydrophobicContact CZ-CD1 3.95Å; F349-I356 HydrophobicContact CZ-CG1 4.07Å
350	A	91.2	Very high	90.3	Very high	89 Å²	89	42.4 Å²	42.4	74%	0.736	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-16.9	173.9	0	0	0	0	0	113.5	E346 L348	E346-A350 WeakPolarHBondContact O-CB 2.93Å; E346-A350 PolarHBondContact O-N 2.49Å; L348-A350 VanDerWaalsContact C-N 3.3Å; L348-A350 PolarHBondContact O-N 3.39Å
351	K	89.7	Confident	91.4	Very high	96 Å²	96	36.7 Å²	36.7	42%	0.417	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	11	177.8	-68.3	-80.5	-170.3	-169.5	0	113.5	E347 L348 F349 V353 Y421	E347-K351 WeakPolarHBondContact O-CG 3.23Å; E347-K351 PolarHBondContact O-N 2.7Å; L348-K351 CarbonylContact O-C 3.26Å; L348-K351 WeakPolarHBondContact O-CA 2.96Å; L348-K351 WeakPolarHBondContact O-CB 3.3Å; L348-K351 PolarHBondContact O-N 2.72Å; F349-K351 PolarHBondContact O-N 3.43Å; F349-K351 VanDerWaalsContact O-N 3.1Å; K351-V353 VanDerWaalsContact C-N 3.34Å; K351-Y421 HydrophobicContact CG-CE2 3.74Å; K351-Y421 VanDerWaalsContact CG-OH 3.28Å; K351-Y421 WeakPolarHBondContact CG-OH 2.76Å
352	G	90.8	Very high	92.2	Very high	24 Å²	24	31 Å²	31	25%	0.247	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.3	0.5	173.7	0	0	0	0	0	114.6	L348 F349 K354	L348-G352 PolarHBondContact O-N 3.44Å; F349-G352 PolarHBondContact O-N 3.44Å; G352-K354 WeakPolarHBondContact O-CE 3.4Å; G352-K354 PolarHBondContact O-N 3.39Å
353	V	94.3	Very high	92.7	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.006	16%	0.159	C	C	.	.			trans	-61.8	121	169.4	176.8	0	0	0	0	107.7	L348 F349 K351 I355 I356 D360 V361 L365	L348-V353 HydrophobicContact CB-CB 4.13Å; L348-V353 HydrophobicContact CB-CG1 4.47Å; L348-V353 HydrophobicContact CB-CG2 4.24Å; L348-V353 HydrophobicContact CD2-CG2 4.31Å; L348-V353 WeakPolarHBondContact O-CB 3.32Å; L348-V353 PolarHBondContact O-N 3.21Å; F349-V353 WeakPolarHBondContact CD1-O 3.37Å; K351-V353 VanDerWaalsContact C-N 3.34Å; V353-I355 WeakPolarHBondContact CG1-O 2.66Å; V353-I356 HydrophobicContact CG1-CG1 4.47Å; V353-D360 HydrophobicContact CG1-CB 4.18Å; V353-V361 HydrophobicContact CG1-CG2 4.08Å; V353-L365 HydrophobicContact CG2-CB 4.39Å; V353-L365 HydrophobicContact CG2-CD2 3.7Å
354	K	92.9	Very high	93	Very high	120 Å²	120	28 Å²	28	52%	0.522	15%	0.151	S	C	.	.	S	Bend	trans	-95	-31.5	-177.5	-55.6	-57.1	-178.5	173.6	0	113	P259 Y260 G352	P259-K354 HydrophobicContact CB-CB 3.72Å; P259-K354 HydrophobicContact CB-CG 4.28Å; Y260-K354 WeakPolarHBondContact O-CG 3.39Å; G352-K354 WeakPolarHBondContact O-CE 3.4Å; G352-K354 PolarHBondContact O-N 3.39Å
355	I	92.7	Very high	93	Very high	43 Å²	43	27.8 Å²	27.8	22%	0.221	15%	0.15	C	C	.	.	S	Bend	trans	-126.5	128.3	172.3	-62.5	-179.4	0	0	0	105.9	P259 V353 N357 D360	P259-I355 HydrophobicContact CG-CD1 3.41Å; P259-I355 VanDerWaalsContact CG-CD1 3.41Å; P259-I355 HydrophobicContact CG-CG1 3.69Å; V353-I355 WeakPolarHBondContact CG1-O 2.66Å; I355-N357 HydrophobicContact CG2-CB 3.99Å; I355-N357 PolarHBondContact O-N 3.39Å; I355-D360 VanDerWaalsContact O-CB 3.3Å; I355-D360 WeakPolarHBondContact O-CB 3.41Å
356	I	92.3	Very high	92.9	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.026	15%	0.147	C	C	.	.			trans	-74.9	84	170.7	-57.9	174	0	0	0	106.4	L45 A345 L348 F349 V353 V361	L45-I356 HydrophobicContact CD1-CG2 3.94Å; A345-I356 HydrophobicContact CB-CD1 3.45Å; A345-I356 VanDerWaalsContact CB-CD1 3.45Å; L348-I356 HydrophobicContact CD1-CD1 4.46Å; L348-I356 HydrophobicContact CD1-CG1 4.26Å; L348-I356 HydrophobicContact CD1-CG2 4.14Å; F349-I356 HydrophobicContact CE1-CG1 4.4Å; F349-I356 HydrophobicContact CE2-CD1 4.01Å; F349-I356 HydrophobicContact CZ-CD1 3.95Å; F349-I356 HydrophobicContact CZ-CG1 4.07Å; V353-I356 HydrophobicContact CG1-CG1 4.47Å; I356-V361 HydrophobicContact CG2-CG2 4.31Å
357	N	93.8	Very high	92.8	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	13%	0.133	C	C	.	.			trans	-122.7	157.5	170	179.3	-84.2	0	0	0	111.3	L45 R284 D288 I355 Y359 D360 V361	L45-N357 WeakPolarHBondContact CD1-O 3.46Å; L45-N357 HydrophobicContact CD2-CB 4.23Å; R284-N357 VanDerWaalsContact CA-ND2 3.32Å; R284-N357 WeakPolarHBondContact CA-ND2 3.12Å; R284-N357 HydrophobicContact CB-CB 4.28Å; R284-N357 WeakPolarHBondContact CB-ND2 3.45Å; R284-N357 HydrophobicContact CG-CB 3.88Å; R284-N357 VanDerWaalsContact CG-CG 3.47Å; R284-N357 WeakPolarHBondContact CG-OD1 3.3Å; R284-N357 PolarHBondContact O-ND2 3.07Å; D288-N357 PolarHBondContact OD1-ND2 3.17Å; I355-N357 HydrophobicContact CG2-CB 3.99Å; I355-N357 PolarHBondContact O-N 3.39Å; N357-Y359 PolarHBondContact O-N 2.92Å; N357-Y359 VanDerWaalsContact OD1-CB 3.28Å; N357-Y359 WeakPolarHBondContact OD1-CB 3.43Å; N357-Y359 PolarHBondContact OD1-N 2.85Å; N357-D360 WeakPolarHBondContact CB-OD2 3.47Å; N357-D360 PolarHBondContact O-N 3.23Å; N357-D360 VanDerWaalsContact O-N 3.1Å; N357-V361 WeakPolarHBondContact O-CG2 3.49Å; N357-V361 PolarHBondContact O-N 2.73Å
358	F	94.2	Very high	92.6	Very high	9 Å²	9	24.6 Å²	24.6	4%	0.039	13%	0.134	C	C	.	.	H	α-helix	trans	-62	-38.8	-175.8	169.8	-97.3	0	0	0	110.2	F42 L45 F287 F291 F300 V362 I363	F42-F358 AromaticContact CD1-CD2 3.98Å; F42-F358 HydrophobicContact CD1-CD2 3.98Å; F42-F358 AromaticContact CD1-CE2 3.23Å; F42-F358 HydrophobicContact CD1-CE2 3.23Å; F42-F358 AromaticContact CD1-CZ 3.91Å; F42-F358 HydrophobicContact CD1-CZ 3.91Å; F42-F358 HydrophobicContact CE1-CD2 4.48Å; F42-F358 AromaticContact CE1-CE2 3.36Å; F42-F358 HydrophobicContact CE1-CE2 3.36Å; F42-F358 AromaticContact CE1-CZ 3.63Å; F42-F358 HydrophobicContact CE1-CZ 3.63Å; F42-F358 HydrophobicContact CG-CE2 4.49Å; L45-F358 HydrophobicContact CD1-CB 4.4Å; L45-F358 HydrophobicContact CD2-CB 3.64Å; L45-F358 HydrophobicContact CG-CB 4.36Å; F287-F358 HydrophobicContact CB-CB 4.25Å; F287-F358 AromaticContact CD1-CD1 3.5Å; F287-F358 HydrophobicContact CD1-CD1 3.5Å; F287-F358 VanDerWaalsContact CD1-CD1 3.5Å; F287-F358 HydrophobicContact CD1-CE1 4.07Å; F287-F358 HydrophobicContact CD1-CG 4.25Å; F287-F358 AromaticContact CD2-CD1 3.91Å; F287-F358 HydrophobicContact CD2-CD1 3.91Å; F287-F358 AromaticContact CE1-CD1 3.4Å; F287-F358 HydrophobicContact CE1-CD1 3.4Å; F287-F358 AromaticContact CE1-CE1 3.52Å; F287-F358 HydrophobicContact CE1-CE1 3.52Å; F287-F358 AromaticContact CE2-CD1 3.82Å; F287-F358 HydrophobicContact CE2-CD1 3.82Å; F287-F358 HydrophobicContact CE2-CE1 4.31Å; F287-F358 HydrophobicContact CG-CB 4.23Å; F287-F358 AromaticContact CG-CD1 3.76Å; F287-F358 HydrophobicContact CG-CD1 3.76Å; F287-F358 HydrophobicContact CG-CG 4.39Å; F287-F358 AromaticContact CZ-CD1 3.57Å; F287-F358 HydrophobicContact CZ-CD1 3.57Å; F287-F358 AromaticContact CZ-CE1 3.66Å; F287-F358 HydrophobicContact CZ-CE1 3.66Å; F291-F358 HydrophobicContact CD2-CB 4.23Å; F291-F358 HydrophobicContact CE2-CB 3.49Å; F291-F358 VanDerWaalsContact CE2-CB 3.49Å; F291-F358 HydrophobicContact CE2-CD1 4.1Å; F291-F358 AromaticContact CE2-CD2 3.92Å; F291-F358 HydrophobicContact CE2-CD2 3.92Å; F291-F358 AromaticContact CE2-CG 3.56Å; F291-F358 HydrophobicContact CE2-CG 3.56Å; F291-F358 HydrophobicContact CZ-CB 4.35Å; F291-F358 HydrophobicContact CZ-CD1 4.37Å; F291-F358 AromaticContact CZ-CD2 3.94Å; F291-F358 HydrophobicContact CZ-CD2 3.94Å; F291-F358 HydrophobicContact CZ-CE2 4.39Å; F291-F358 AromaticContact CZ-CG 3.95Å; F291-F358 HydrophobicContact CZ-CG 3.95Å; F300-F358 HydrophobicContact CE1-CZ 4.23Å; F300-F358 HydrophobicContact CZ-CZ 4.34Å; F358-V362 HydrophobicContact CD2-CB 3.71Å; F358-V362 HydrophobicContact CD2-CG1 4.35Å; F358-V362 HydrophobicContact CD2-CG2 3.44Å; F358-V362 VanDerWaalsContact CD2-CG2 3.44Å; F358-V362 HydrophobicContact CE2-CB 3.43Å; F358-V362 VanDerWaalsContact CE2-CB 3.43Å; F358-V362 HydrophobicContact CE2-CG1 3.58Å; F358-V362 HydrophobicContact CE2-CG2 3.49Å; F358-V362 VanDerWaalsContact CE2-CG2 3.49Å; F358-V362 HydrophobicContact CG-CB 4.38Å; F358-V362 HydrophobicContact CG-CG2 4.37Å; F358-V362 HydrophobicContact CZ-CB 3.97Å; F358-V362 HydrophobicContact CZ-CG1 3.9Å; F358-V362 HydrophobicContact CZ-CG2 4.48Å; F358-V362 WeakPolarHBondContact O-CA 3.39Å; F358-V362 VanDerWaalsContact O-CB 3.28Å; F358-V362 WeakPolarHBondContact O-CB 3.39Å; F358-V362 PolarHBondContact O-N 3.08Å; F358-I363 HydrophobicContact CD1-CD1 4.23Å; F358-I363 HydrophobicContact CD1-CG1 4.4Å; F358-I363 HydrophobicContact CE1-CD1 3.85Å; F358-I363 HydrophobicContact CE1-CG1 3.94Å; F358-I363 HydrophobicContact CZ-CG1 4.49Å; F358-I363 PolarHBondContact O-N 3.4Å
359	Y	95.9	Very high	92.1	Very high	1 Å²	1	26.2 Å²	26.2	0%	0.004	14%	0.142	C	C	.	.	I	π-helix	trans	-56.9	-54.2	171.6	-173.8	-85.5	0	0	0	111	Y276 V280 L283 F287 N357 V361 I363 D364 F465	Y276-Y359 PolarHBondContact OH-OH 2.98Å; V280-Y359 HydrophobicContact CG1-CD1 3.85Å; V280-Y359 HydrophobicContact CG1-CE1 3.91Å; V280-Y359 HydrophobicContact CG2-CD1 4.46Å; V280-Y359 HydrophobicContact CG2-CE1 3.77Å; L283-Y359 HydrophobicContact CD1-CD2 4.44Å; L283-Y359 HydrophobicContact CD1-CE2 4.34Å; F287-Y359 HydrophobicContact CE2-CD2 4.46Å; N357-Y359 PolarHBondContact O-N 2.92Å; N357-Y359 VanDerWaalsContact OD1-CB 3.28Å; N357-Y359 WeakPolarHBondContact OD1-CB 3.43Å; N357-Y359 PolarHBondContact OD1-N 2.85Å; Y359-V361 PolarHBondContact O-N 3Å; Y359-I363 HydrophobicContact CD2-CB 4.29Å; Y359-I363 HydrophobicContact CD2-CD1 3.83Å; Y359-I363 HydrophobicContact CD2-CG2 4.37Å; Y359-I363 HydrophobicContact CE2-CB 4.49Å; Y359-I363 HydrophobicContact CE2-CD1 4.37Å; Y359-I363 HydrophobicContact CE2-CG2 4.1Å; Y359-I363 CarbonylContact O-C 3.54Å; Y359-I363 WeakPolarHBondContact O-CA 3.27Å; Y359-I363 VanDerWaalsContact O-CB 3.3Å; Y359-I363 WeakPolarHBondContact O-CB 3.13Å; Y359-I363 PolarHBondContact O-N 2.96Å; Y359-I363 VanDerWaalsContact O-N 3.11Å; Y359-D364 HydrophobicContact CE1-CB 4.4Å; Y359-D364 PolarHBondContact O-N 3.49Å; Y359-F465 AromaticContact CE2-CE2 3.78Å; Y359-F465 HydrophobicContact CE2-CE2 3.78Å; Y359-F465 AromaticContact CE2-CZ 3.76Å; Y359-F465 HydrophobicContact CE2-CZ 3.76Å; Y359-F465 AromaticContact CZ-CZ 3.78Å; Y359-F465 WeakPolarHBondContact OH-CZ 3.43Å
360	D	95.6	Very high	91.5	Very high	3 Å²	3	21.8 Å²	21.8	2%	0.016	12%	0.122	C	C	.	.	I	π-helix	trans	-67.2	-40.7	-175.1	-65.4	-79	0	0	0	113.5	R284 V353 I355 N357 L365	R284-D360 IonicContact CZ-OD1 2.77Å; R284-D360 IonicContact CZ-OD2 2.67Å; R284-D360 IonicContact NE-OD1 2.77Å; R284-D360 IonicContact NE-OD2 3.78Å; R284-D360 PolarHBondContact NE-OD2 3.35Å; R284-D360 IonicContact NH2-OD1 3.38Å; R284-D360 PolarHBondContact NH2-OD1 3.03Å; R284-D360 IonicContact NH2-OD2 2.63Å; R284-D360 PolarHBondContact NH2-OD2 2.9Å; V353-D360 HydrophobicContact CG1-CB 4.18Å; I355-D360 VanDerWaalsContact O-CB 3.3Å; I355-D360 WeakPolarHBondContact O-CB 3.41Å; N357-D360 WeakPolarHBondContact CB-OD2 3.47Å; N357-D360 PolarHBondContact O-N 3.23Å; N357-D360 VanDerWaalsContact O-N 3.1Å; D360-L365 WeakPolarHBondContact O-CB 3.44Å; D360-L365 PolarHBondContact O-N 2.85Å
361	V	94.3	Very high	91.1	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.09	C	C	.	.	I	π-helix	trans	-81.7	-56.1	-177.1	179.1	0	0	0	0	110.1	V41 L348 V353 I356 N357 Y359 L365 M366	V41-V361 HydrophobicContact CG1-CG1 3.99Å; L348-V361 HydrophobicContact CD1-CG1 4.36Å; L348-V361 HydrophobicContact CD1-CG2 3.78Å; L348-V361 HydrophobicContact CD2-CG1 4.06Å; L348-V361 HydrophobicContact CD2-CG2 4.3Å; V353-V361 HydrophobicContact CG1-CG2 4.08Å; I356-V361 HydrophobicContact CG2-CG2 4.31Å; N357-V361 WeakPolarHBondContact O-CG2 3.49Å; N357-V361 PolarHBondContact O-N 2.73Å; Y359-V361 PolarHBondContact O-N 3Å; V361-L365 WeakPolarHBondContact O-CB 2.95Å; V361-M366 HydrophobicContact CG1-CE 3.89Å; V361-M366 HydrophobicContact CG1-SD 4.38Å; V361-M366 WeakPolarHBondContact O-CG 3.47Å; V361-M366 PolarHBondContact O-N 3.3Å
362	V	92.5	Very high	90.6	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.006	9%	0.092	C	C	.	.	I	π-helix	trans	-86.2	-47.9	-169.6	-174.7	0	0	0	0	111.7	V41 F358 M366 L367	V41-V362 HydrophobicContact CB-CG2 3.7Å; V41-V362 HydrophobicContact CG1-CG2 4.01Å; F358-V362 HydrophobicContact CD2-CB 3.71Å; F358-V362 HydrophobicContact CD2-CG1 4.35Å; F358-V362 HydrophobicContact CD2-CG2 3.44Å; F358-V362 VanDerWaalsContact CD2-CG2 3.44Å; F358-V362 HydrophobicContact CE2-CB 3.43Å; F358-V362 VanDerWaalsContact CE2-CB 3.43Å; F358-V362 HydrophobicContact CE2-CG1 3.58Å; F358-V362 HydrophobicContact CE2-CG2 3.49Å; F358-V362 VanDerWaalsContact CE2-CG2 3.49Å; F358-V362 HydrophobicContact CG-CB 4.38Å; F358-V362 HydrophobicContact CG-CG2 4.37Å; F358-V362 HydrophobicContact CZ-CB 3.97Å; F358-V362 HydrophobicContact CZ-CG1 3.9Å; F358-V362 HydrophobicContact CZ-CG2 4.48Å; F358-V362 WeakPolarHBondContact O-CA 3.39Å; F358-V362 VanDerWaalsContact O-CB 3.28Å; F358-V362 WeakPolarHBondContact O-CB 3.39Å; F358-V362 PolarHBondContact O-N 3.08Å; V362-M366 WeakPolarHBondContact O-CB 3.32Å; V362-L367 HydrophobicContact CG1-CD1 4.22Å; V362-L367 HydrophobicContact CG1-CG 4.46Å; V362-L367 WeakPolarHBondContact O-CB 3.23Å; V362-L367 VanDerWaalsContact O-CG 3.29Å; V362-L367 WeakPolarHBondContact O-CG 3.3Å; V362-L367 PolarHBondContact O-N 3.09Å
363	I	94.1	Very high	89.8	Confident	2 Å²	2	18.3 Å²	18.3	1%	0.01	9%	0.086	C	C	.	.	I	π-helix	trans	-74.5	-61.5	-176.6	-60.4	178.4	0	0	0	109.9	F287 F358 Y359 L367 L368 F460 I461	F287-I363 HydrophobicContact CE2-CD1 3.99Å; F287-I363 HydrophobicContact CZ-CD1 3.93Å; F358-I363 HydrophobicContact CD1-CD1 4.23Å; F358-I363 HydrophobicContact CD1-CG1 4.4Å; F358-I363 HydrophobicContact CE1-CD1 3.85Å; F358-I363 HydrophobicContact CE1-CG1 3.94Å; F358-I363 HydrophobicContact CZ-CG1 4.49Å; F358-I363 PolarHBondContact O-N 3.4Å; Y359-I363 HydrophobicContact CD2-CB 4.29Å; Y359-I363 HydrophobicContact CD2-CD1 3.83Å; Y359-I363 HydrophobicContact CD2-CG2 4.37Å; Y359-I363 HydrophobicContact CE2-CB 4.49Å; Y359-I363 HydrophobicContact CE2-CD1 4.37Å; Y359-I363 HydrophobicContact CE2-CG2 4.1Å; Y359-I363 CarbonylContact O-C 3.54Å; Y359-I363 WeakPolarHBondContact O-CA 3.27Å; Y359-I363 VanDerWaalsContact O-CB 3.3Å; Y359-I363 WeakPolarHBondContact O-CB 3.13Å; Y359-I363 PolarHBondContact O-N 2.96Å; Y359-I363 VanDerWaalsContact O-N 3.11Å; I363-L367 PolarHBondContact O-N 3.2Å; I363-L368 HydrophobicContact CG2-CD1 4.29Å; I363-L368 HydrophobicContact CG2-CG 4.35Å; I363-L368 WeakPolarHBondContact O-CB 3.22Å; I363-L368 VanDerWaalsContact O-CG 3.31Å; I363-L368 WeakPolarHBondContact O-CG 3.38Å; I363-L368 PolarHBondContact O-N 2.88Å; I363-F460 HydrophobicContact CD1-CE1 4.45Å; I363-I461 HydrophobicContact CG2-CD1 3.77Å; I363-I461 HydrophobicContact CG2-CG1 3.92Å; I363-I461 HydrophobicContact CG2-CG2 4.14Å
364	D	93.6	Very high	89.1	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.005	9%	0.092	C	C	.	.	I	π-helix	trans	-76.4	-54.7	-172.6	-179.2	44	0	0	0	113.3	R261 R264 Y359 E369	R261-D364 WeakPolarHBondContact CB-OD2 3.25Å; R261-D364 WeakPolarHBondContact CD-OD2 2.81Å; R261-D364 WeakPolarHBondContact CG-OD2 2.83Å; R261-D364 IonicContact CZ-OD2 3.6Å; R261-D364 VanDerWaalsContact NH1-CG 3.3Å; R261-D364 PolarHBondContact NH1-O 2.98Å; R261-D364 IonicContact NH1-OD1 3.86Å; R261-D364 PolarHBondContact NH1-OD1 3.29Å; R261-D364 IonicContact NH1-OD2 3.76Å; R261-D364 PolarHBondContact NH1-OD2 3.49Å; R264-D364 IonicContact CZ-OD1 3.27Å; R264-D364 IonicContact NE-OD1 2.63Å; R264-D364 PolarHBondContact NE-OD1 3.16Å; R264-D364 IonicContact NH2-OD1 2.71Å; R264-D364 PolarHBondContact NH2-OD1 2.63Å; Y359-D364 HydrophobicContact CE1-CB 4.4Å; Y359-D364 PolarHBondContact O-N 3.49Å; D364-E369 PolarHBondContact O-N 3.23Å
365	L	92.9	Very high	88.4	Confident	2 Å²	2	17 Å²	17	1%	0.01	9%	0.094	C	C	.	.	I	π-helix	trans	-68	-48	-178	170.1	72.5	0	0	0	111.3	L33 L348 V353 D360 V361 E369 Y421	L33-L365 HydrophobicContact CD2-CD1 3.72Å; L33-L365 HydrophobicContact CD2-CG 4.01Å; L33-L365 WeakPolarHBondContact CD2-O 3.24Å; L348-L365 HydrophobicContact CD2-CD2 3.8Å; V353-L365 HydrophobicContact CG2-CB 4.39Å; V353-L365 HydrophobicContact CG2-CD2 3.7Å; D360-L365 WeakPolarHBondContact O-CB 3.44Å; D360-L365 PolarHBondContact O-N 2.85Å; V361-L365 WeakPolarHBondContact O-CB 2.95Å; L365-E369 WeakPolarHBondContact O-CB 3.42Å; L365-Y421 WeakPolarHBondContact CD2-OH 3.38Å
366	M	89.1	Confident	87.8	Confident	4 Å²	4	20.3 Å²	20.3	2%	0.02	11%	0.112	C	C	.	.	I	π-helix	trans	-90.5	-57	-170.9	-62.6	-177.2	172	0	0	113.7	S34 V41 V361 V362 A370 F420 Y424	S34-M366 WeakPolarHBondContact OG-CA 3.44Å; S34-M366 PolarHBondContact OG-O 3.5Å; V41-M366 HydrophobicContact CG2-CE 4.05Å; V41-M366 HydrophobicContact CG2-SD 3.77Å; V361-M366 HydrophobicContact CG1-CE 3.89Å; V361-M366 HydrophobicContact CG1-SD 4.38Å; V361-M366 WeakPolarHBondContact O-CG 3.47Å; V361-M366 PolarHBondContact O-N 3.3Å; V362-M366 WeakPolarHBondContact O-CB 3.32Å; M366-A370 WeakPolarHBondContact O-CB 3.38Å; M366-A370 PolarHBondContact O-N 3.42Å; M366-F420 HydrophobicContact CE-CE1 3.36Å; M366-F420 HydrophobicContact CE-CZ 3.26Å; M366-Y424 WeakPolarHBondContact CB-OH 2.8Å; M366-Y424 HydrophobicContact CE-CD2 3.96Å; M366-Y424 HydrophobicContact CE-CE1 4.31Å; M366-Y424 HydrophobicContact CE-CE2 3.54Å; M366-Y424 HydrophobicContact CE-CG 4.45Å; M366-Y424 HydrophobicContact CG-CE2 4.28Å; M366-Y424 WeakPolarHBondContact CG-OH 3.31Å; M366-Y424 HydrophobicContact SD-CD2 4.32Å; M366-Y424 HydrophobicContact SD-CE2 3.46Å; M366-Y424 WeakPolarHBondContact SD-CE2 2.82Å; M366-Y424 PolarHBondContact SD-OH 3.42Å
367	L	88	Confident	87.1	Confident	12 Å²	12	21.1 Å²	21.1	6%	0.063	12%	0.118	C	C	.	.	I	π-helix	trans	-74.3	-52.2	-172.1	-71.4	173.5	0	0	0	112.1	V362 I363 A370 F371 I457	V362-L367 HydrophobicContact CG1-CD1 4.22Å; V362-L367 HydrophobicContact CG1-CG 4.46Å; V362-L367 WeakPolarHBondContact O-CB 3.23Å; V362-L367 VanDerWaalsContact O-CG 3.29Å; V362-L367 WeakPolarHBondContact O-CG 3.3Å; V362-L367 PolarHBondContact O-N 3.09Å; I363-L367 PolarHBondContact O-N 3.2Å; L367-A370 WeakPolarHBondContact O-CB 3.41Å; L367-A370 PolarHBondContact O-N 2.85Å; L367-F371 WeakPolarHBondContact O-CD2 3.45Å; L367-F371 PolarHBondContact O-N 3.08Å; L367-F371 VanDerWaalsContact O-N 3.07Å; L367-I457 HydrophobicContact CD1-CG2 4.33Å
368	L	88.8	Confident	86.4	Confident	9 Å²	9	23 Å²	23	5%	0.047	13%	0.13	C	C	.	.	I	π-helix	trans	-67.2	-41.5	-176.5	-67.9	-175.3	0	0	0	112	R264 F267 I363 A370 F371 E372 I461	R264-L368 HydrophobicContact CG-CD1 4.18Å; F267-L368 HydrophobicContact CD1-CD1 4.17Å; F267-L368 HydrophobicContact CD1-CD2 4.28Å; F267-L368 HydrophobicContact CE1-CD1 3.93Å; F267-L368 HydrophobicContact CE1-CD2 3.39Å; F267-L368 HydrophobicContact CE1-CG 4.33Å; F267-L368 HydrophobicContact CE2-CD2 4.14Å; F267-L368 HydrophobicContact CZ-CD2 3.3Å; I363-L368 HydrophobicContact CG2-CD1 4.29Å; I363-L368 HydrophobicContact CG2-CG 4.35Å; I363-L368 WeakPolarHBondContact O-CB 3.22Å; I363-L368 VanDerWaalsContact O-CG 3.31Å; I363-L368 WeakPolarHBondContact O-CG 3.38Å; I363-L368 PolarHBondContact O-N 2.88Å; L368-A370 PolarHBondContact O-N 3.32Å; L368-F371 PolarHBondContact O-N 3.36Å; L368-E372 WeakPolarHBondContact O-CB 3.46Å; L368-E372 PolarHBondContact O-N 3.42Å; L368-I461 HydrophobicContact CD2-CD1 3.78Å; L368-I461 HydrophobicContact CG-CD1 4.38Å
369	E	83.8	Confident	85.9	Confident	34 Å²	34	27.3 Å²	27.3	16%	0.159	16%	0.162	C	C	.	.	H	α-helix	trans	-62.8	-33.8	174.1	-161.6	169.7	172.9	0	0	111.7	L33 R261 D364 L365 E372 L373	L33-E369 HydrophobicContact CB-CB 3.94Å; L33-E369 HydrophobicContact CB-CG 3.81Å; L33-E369 HydrophobicContact CD1-CG 4.02Å; L33-E369 WeakPolarHBondContact CD1-OE1 3.39Å; L33-E369 WeakPolarHBondContact CD1-OE2 3.22Å; L33-E369 HydrophobicContact CD2-CB 4.34Å; L33-E369 HydrophobicContact CD2-CG 4.44Å; L33-E369 WeakPolarHBondContact CD2-OE2 3.43Å; L33-E369 HydrophobicContact CG-CB 4.5Å; L33-E369 HydrophobicContact CG-CG 4.22Å; R261-E369 IonicContact CZ-OE2 2.98Å; R261-E369 IonicContact NH2-OE2 3.1Å; R261-E369 PolarHBondContact NH2-OE2 3.24Å; D364-E369 PolarHBondContact O-N 3.23Å; L365-E369 WeakPolarHBondContact O-CB 3.42Å; E369-E372 PolarHBondContact O-N 3.29Å; E369-L373 HydrophobicContact CG-CD1 4.2Å; E369-L373 WeakPolarHBondContact O-CD1 3.26Å; E369-L373 WeakPolarHBondContact O-CG 3.13Å; E369-L373 PolarHBondContact O-N 3.27Å; E369-L373 VanDerWaalsContact O-N 3.1Å
370	A	81.7	Confident	85.3	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-67.8	-44.6	177.7	0	0	0	0	0	114.5	L33 S34 M366 L367 L368 E372 L373 L374	L33-A370 WeakPolarHBondContact O-CA 3.42Å; L33-A370 WeakPolarHBondContact O-CB 3.34Å; S34-A370 WeakPolarHBondContact O-CB 3.49Å; M366-A370 WeakPolarHBondContact O-CB 3.38Å; M366-A370 PolarHBondContact O-N 3.42Å; L367-A370 WeakPolarHBondContact O-CB 3.41Å; L367-A370 PolarHBondContact O-N 2.85Å; L368-A370 PolarHBondContact O-N 3.32Å; A370-E372 VanDerWaalsContact C-N 3.3Å; A370-L373 PolarHBondContact O-N 3.36Å; A370-L374 WeakPolarHBondContact O-CG 3.25Å; A370-L374 PolarHBondContact O-N 2.97Å
371	F	81.5	Confident	84.7	Confident	15 Å²	15	31.2 Å²	31.2	7%	0.066	19%	0.189	C	C	.	.	H	α-helix	trans	-64.7	-38.6	175.9	-64.1	-35.5	0	0	0	111.4	L367 L368 L373 L374 A375 R454 I457 I458	L367-F371 WeakPolarHBondContact O-CD2 3.45Å; L367-F371 PolarHBondContact O-N 3.08Å; L367-F371 VanDerWaalsContact O-N 3.07Å; L368-F371 PolarHBondContact O-N 3.36Å; F371-L373 VanDerWaalsContact C-N 3.26Å; F371-L373 PolarHBondContact O-N 3.09Å; F371-L374 PolarHBondContact O-N 3.19Å; F371-A375 VanDerWaalsContact O-CB 3.32Å; F371-A375 WeakPolarHBondContact O-CB 3.4Å; F371-A375 PolarHBondContact O-N 2.96Å; F371-R454 HydrophobicContact CD1-CB 4.35Å; F371-R454 HydrophobicContact CD1-CG 3.7Å; F371-R454 HydrophobicContact CD2-CG 3.99Å; F371-R454 HydrophobicContact CE1-CB 3.98Å; F371-R454 HydrophobicContact CE1-CG 3.74Å; F371-R454 HydrophobicContact CE2-CG 4.02Å; F371-R454 HydrophobicContact CG-CG 3.83Å; F371-R454 HydrophobicContact CZ-CB 4.16Å; F371-R454 HydrophobicContact CZ-CG 3.9Å; F371-I457 HydrophobicContact CE2-CB 4.21Å; F371-I457 HydrophobicContact CE2-CG2 3.82Å; F371-I457 HydrophobicContact CZ-CB 4.32Å; F371-I457 HydrophobicContact CZ-CD1 4.08Å; F371-I457 HydrophobicContact CZ-CG2 4.25Å; F371-I458 HydrophobicContact CD2-CG1 4.34Å; F371-I458 HydrophobicContact CE2-CG1 4.44Å
372	E	80.3	Confident	84.3	Confident	97 Å²	97	32.9 Å²	32.9	45%	0.453	20%	0.198	S	C	.	.	H	α-helix	trans	-60	-37.2	175.7	-170	175.3	162.5	0	0	112.2	R264 L368 E369 A370 N376	R264-E372 IonicContact CZ-OE2 3.38Å; R264-E372 IonicContact NH1-OE2 2.73Å; R264-E372 PolarHBondContact NH1-OE2 3.28Å; R264-E372 IonicContact NH2-OE2 2.73Å; L368-E372 WeakPolarHBondContact O-CB 3.46Å; L368-E372 PolarHBondContact O-N 3.42Å; E369-E372 PolarHBondContact O-N 3.29Å; A370-E372 VanDerWaalsContact C-N 3.3Å; E372-N376 PolarHBondContact O-N 3.31Å; E372-N376 PolarHBondContact O-ND2 2.99Å
373	L	74.1	Confident	84	Confident	24 Å²	24	36.4 Å²	36.4	13%	0.126	22%	0.222	C	C	.	.	H	α-helix	trans	-77.1	-40.8	179.5	-69.7	168.6	0	0	0	113.5	C30 L33 E369 A370 F371 A375 N376	C30-L373 HydrophobicContact CB-CD2 4.4Å; C30-L373 WeakPolarHBondContact O-CD2 3.47Å; L33-L373 HydrophobicContact CB-CD1 3.77Å; E369-L373 HydrophobicContact CG-CD1 4.2Å; E369-L373 WeakPolarHBondContact O-CD1 3.26Å; E369-L373 WeakPolarHBondContact O-CG 3.13Å; E369-L373 PolarHBondContact O-N 3.27Å; E369-L373 VanDerWaalsContact O-N 3.1Å; A370-L373 PolarHBondContact O-N 3.36Å; F371-L373 VanDerWaalsContact C-N 3.26Å; F371-L373 PolarHBondContact O-N 3.09Å; L373-A375 VanDerWaalsContact C-N 3.25Å; L373-A375 PolarHBondContact O-N 2.92Å; L373-N376 CarbonylContact O-C 3.57Å; L373-N376 VanDerWaalsContact O-C 3.26Å; L373-N376 PolarHBondContact O-N 3.48Å; L373-N376 VanDerWaalsContact O-N 3.14Å
374	L	79.4	Confident	83.7	Confident	24 Å²	24	38.2 Å²	38.2	13%	0.126	23%	0.233	C	C	.	.	H	α-helix	trans	-67.8	-28.9	175.7	-73.3	165	0	0	0	112	A35 A370 F371 N376 L435 F439	A35-L374 HydrophobicContact CB-CD1 3.7Å; A370-L374 WeakPolarHBondContact O-CG 3.25Å; A370-L374 PolarHBondContact O-N 2.97Å; F371-L374 PolarHBondContact O-N 3.19Å; L374-N376 VanDerWaalsContact C-N 3.31Å; L374-L435 HydrophobicContact CD1-CB 4.41Å; L374-F439 HydrophobicContact CB-CD2 4.21Å; L374-F439 HydrophobicContact CD1-CD2 3.61Å; L374-F439 HydrophobicContact CD1-CE2 3.71Å; L374-F439 HydrophobicContact CD2-CD2 4.18Å; L374-F439 HydrophobicContact CG-CD2 4.22Å
375	A	78.4	Confident	83.3	Confident	69 Å²	69	38.7 Å²	38.7	57%	0.57	24%	0.236	S	C	*	.	H	α-helix	trans	-69.9	-26.5	171.6	0	0	0	0	0	113	F371 L373 P377	F371-A375 VanDerWaalsContact O-CB 3.32Å; F371-A375 WeakPolarHBondContact O-CB 3.4Å; F371-A375 PolarHBondContact O-N 2.96Å; L373-A375 VanDerWaalsContact C-N 3.25Å; L373-A375 PolarHBondContact O-N 2.92Å; A375-P377 VanDerWaalsContact C-CD 3.45Å; A375-P377 WeakPolarHBondContact O-CD 3.27Å
376	N	79.2	Confident	83	Confident	112 Å²	112	47.3 Å²	47.3	60%	0.599	27%	0.269	S	S	*	.	S	Bend	trans	-126.8	61.9	-175.1	-61.3	-69.7	0	0	0	112.9	E372 L373 L374	E372-N376 PolarHBondContact O-N 3.31Å; E372-N376 PolarHBondContact O-ND2 2.99Å; L373-N376 CarbonylContact O-C 3.57Å; L373-N376 VanDerWaalsContact O-C 3.26Å; L373-N376 PolarHBondContact O-N 3.48Å; L373-N376 VanDerWaalsContact O-N 3.14Å; L374-N376 VanDerWaalsContact C-N 3.31Å
377	P	79.2	Confident	82.8	Confident	22 Å²	22	51.3 Å²	51.3	14%	0.143	29%	0.287	C	S	.	.			trans	-66.9	151.9	-178.1	30.3	-38.7	0	0	0	112.5	A375 L382 L440	A375-P377 VanDerWaalsContact C-CD 3.45Å; A375-P377 WeakPolarHBondContact O-CD 3.27Å; P377-L382 HydrophobicContact CB-CD2 4.31Å; P377-L382 HydrophobicContact CB-CG 4.35Å; P377-L382 HydrophobicContact CG-CD1 4.06Å; P377-L382 HydrophobicContact CG-CD2 3.4Å; P377-L382 VanDerWaalsContact CG-CD2 3.4Å; P377-L382 HydrophobicContact CG-CG 3.7Å; P377-L440 HydrophobicContact CB-CD1 3.84Å; P377-L440 HydrophobicContact CB-CD2 4.02Å; P377-L440 HydrophobicContact CG-CD1 4.43Å; P377-L440 HydrophobicContact CG-CD2 3.69Å
378	P	78.9	Confident	82.7	Confident	40 Å²	40	60.2 Å²	60.2	26%	0.26	33%	0.325	S	S	.	.			trans	-56.6	146.5	175.4	-25.2	34	0	0	0	113.2	V31 S380 V381 L382	V31-P378 HydrophobicContact CG1-CG 3.84Å; V31-P378 HydrophobicContact CG2-CG 3.92Å; P378-S380 PolarHBondContact O-N 3.32Å; P378-V381 HydrophobicContact CB-CG2 4.3Å; P378-V381 HydrophobicContact CG-CG2 4.36Å; P378-V381 WeakPolarHBondContact O-CB 3.44Å; P378-V381 PolarHBondContact O-N 3.01Å; P378-L382 PolarHBondContact O-N 3.38Å
379	S	83.2	Confident	82.4	Confident	101 Å²	101	67 Å²	67	71%	0.706	35%	0.35	S	S	*	.	H	α-helix	trans	-59.1	-32	179.7	59.1	0	0	0	0	113.5	L382 S383	S379-L382 PolarHBondContact O-N 3.45Å; S379-S383 WeakPolarHBondContact O-CB 3.48Å; S379-S383 PolarHBondContact O-N 3.48Å
380	S	82.4	Confident	82.5	Confident	74 Å²	74	67.6 Å²	67.6	52%	0.517	36%	0.355	S	S	.	.	H	α-helix	trans	-61.7	-42.8	173.7	52.2	0	0	0	0	112.1	P378 S383 V384	P378-S380 PolarHBondContact O-N 3.32Å; S380-S383 PolarHBondContact O-N 3.43Å; S380-S383 PolarHBondContact O-OG 3.5Å; S380-V384 PolarHBondContact O-N 3.37Å
381	V	84.1	Confident	82.9	Confident	12 Å²	12	71 Å²	71	7%	0.073	38%	0.378	C	S	.	.	H	α-helix	trans	-65.5	-48.7	176.6	175.9	0	0	0	0	110.1	P378 S383 V384 T385 L399 T402 L440	P378-V381 HydrophobicContact CB-CG2 4.3Å; P378-V381 HydrophobicContact CG-CG2 4.36Å; P378-V381 WeakPolarHBondContact O-CB 3.44Å; P378-V381 PolarHBondContact O-N 3.01Å; V381-S383 VanDerWaalsContact C-N 3.27Å; V381-S383 PolarHBondContact O-N 3.01Å; V381-V384 PolarHBondContact O-N 3.37Å; V381-V384 VanDerWaalsContact O-N 3.14Å; V381-T385 HydrophobicContact CG1-CG2 4.22Å; V381-T385 PolarHBondContact O-N 2.98Å; V381-T385 PolarHBondContact O-OG1 3.29Å; V381-L399 HydrophobicContact CG1-CD2 3.41Å; V381-L399 VanDerWaalsContact CG1-CD2 3.41Å; V381-T402 HydrophobicContact CG2-CG2 3.85Å; V381-L440 HydrophobicContact CG1-CD1 3.84Å
382	L	85.8	Confident	83.3	Confident	35 Å²	35	74 Å²	74	18%	0.183	40%	0.395	C	S	.	.	H	α-helix	trans	-58.7	-38.2	177.7	-70.3	-179.7	0	0	0	112.7	P377 P378 S379 V384 T385 R386	P377-L382 HydrophobicContact CB-CD2 4.31Å; P377-L382 HydrophobicContact CB-CG 4.35Å; P377-L382 HydrophobicContact CG-CD1 4.06Å; P377-L382 HydrophobicContact CG-CD2 3.4Å; P377-L382 VanDerWaalsContact CG-CD2 3.4Å; P377-L382 HydrophobicContact CG-CG 3.7Å; P378-L382 PolarHBondContact O-N 3.38Å; S379-L382 PolarHBondContact O-N 3.45Å; L382-V384 VanDerWaalsContact C-N 3.26Å; L382-V384 PolarHBondContact O-N 3.12Å; L382-T385 PolarHBondContact O-OG1 3.2Å; L382-R386 WeakPolarHBondContact O-CB 3.25Å; L382-R386 VanDerWaalsContact O-CG 3.27Å; L382-R386 WeakPolarHBondContact O-CG 3.46Å; L382-R386 PolarHBondContact O-N 3.27Å
383	S	86.8	Confident	83.7	Confident	74 Å²	74	75.7 Å²	75.7	52%	0.517	41%	0.407	S	S	.	.	H	α-helix	trans	-63.3	-34	-179.9	72.5	0	0	0	0	112.4	S379 S380 V381 H387	S379-S383 WeakPolarHBondContact O-CB 3.48Å; S379-S383 PolarHBondContact O-N 3.48Å; S380-S383 PolarHBondContact O-N 3.43Å; S380-S383 PolarHBondContact O-OG 3.5Å; V381-S383 VanDerWaalsContact C-N 3.27Å; V381-S383 PolarHBondContact O-N 3.01Å; S383-H387 WeakPolarHBondContact O-CB 3.47Å
384	V	85.8	Confident	84.4	Confident	40 Å²	40	77.3 Å²	77.3	24%	0.242	41%	0.413	C	S	.	.	H	α-helix	trans	-79.7	-50.1	177.2	174.4	0	0	0	0	110.6	S380 V381 L382 R386 H387 L390 F394 A398	S380-V384 PolarHBondContact O-N 3.37Å; V381-V384 PolarHBondContact O-N 3.37Å; V381-V384 VanDerWaalsContact O-N 3.14Å; L382-V384 VanDerWaalsContact C-N 3.26Å; L382-V384 PolarHBondContact O-N 3.12Å; V384-R386 VanDerWaalsContact C-N 3.33Å; V384-R386 PolarHBondContact O-N 2.98Å; V384-H387 WeakPolarHBondContact O-CB 3.26Å; V384-H387 PolarHBondContact O-N 3.41Å; V384-L390 HydrophobicContact CG1-CD1 3.93Å; V384-F394 HydrophobicContact CG1-CD1 4.41Å; V384-F394 HydrophobicContact CG1-CE1 4.07Å; V384-A398 HydrophobicContact CG1-CB 3.76Å
385	T	86.7	Confident	84.9	Confident	12 Å²	12	76.9 Å²	76.9	7%	0.074	41%	0.41	C	S	.	.	H	α-helix	trans	-67.5	-34.2	-174.9	57.4	0	0	0	0	112.8	V381 L382 H387 L399 L440	V381-T385 HydrophobicContact CG1-CG2 4.22Å; V381-T385 PolarHBondContact O-N 2.98Å; V381-T385 PolarHBondContact O-OG1 3.29Å; L382-T385 PolarHBondContact O-OG1 3.2Å; T385-H387 VanDerWaalsContact C-N 3.33Å; T385-L399 HydrophobicContact CG2-CD1 3.99Å; T385-L399 HydrophobicContact CG2-CD2 3.66Å; T385-L399 HydrophobicContact CG2-CG 3.93Å; T385-L440 VanDerWaalsContact CB-O 3.24Å; T385-L440 WeakPolarHBondContact CB-O 3.36Å; T385-L440 HydrophobicContact CG2-CB 4.25Å
386	R	86.8	Confident	85.5	Confident	183 Å²	183	76.5 Å²	76.5	69%	0.691	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-4	177.1	-59.8	-179.3	175.4	171.9	2	113.6	L382 V384 K388	L382-R386 WeakPolarHBondContact O-CB 3.25Å; L382-R386 VanDerWaalsContact O-CG 3.27Å; L382-R386 WeakPolarHBondContact O-CG 3.46Å; L382-R386 PolarHBondContact O-N 3.27Å; V384-R386 VanDerWaalsContact C-N 3.33Å; V384-R386 PolarHBondContact O-N 2.98Å; R386-K388 PolarHBondContact O-N 3.2Å
387	H	85.1	Confident	86	Confident	88 Å²	88	74.9 Å²	74.9	41%	0.407	39%	0.391	S	S	.	.			trans	-74.9	110.6	-180	-152.8	-94.7	0	0	0	110.9	S383 V384 T385 W389 L390 K395	S383-H387 WeakPolarHBondContact O-CB 3.47Å; V384-H387 WeakPolarHBondContact O-CB 3.26Å; V384-H387 PolarHBondContact O-N 3.41Å; T385-H387 VanDerWaalsContact C-N 3.33Å; H387-W389 AromaticContact CE1-CD1 3.56Å; H387-W389 AromaticContact ND1-CD1 3.96Å; H387-W389 PolarHBondContact O-N 3.43Å; H387-L390 HydrophobicContact CB-CB 4.45Å; H387-L390 HydrophobicContact CB-CD1 3.64Å; H387-L390 HydrophobicContact CB-CG 3.88Å; H387-L390 PolarHBondContact O-N 2.98Å; H387-K395 VanDerWaalsContact O-CE 3.26Å; H387-K395 WeakPolarHBondContact O-CE 3.48Å
388	K	85.2	Confident	86.4	Confident	198 Å²	198	75 Å²	75	86%	0.861	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-24.2	-175.6	-64.8	-172.6	177.5	-173.8	0	114.4	R386	R386-K388 PolarHBondContact O-N 3.2Å
389	W	82.1	Confident	86.8	Confident	151 Å²	151	73.4 Å²	73.4	57%	0.572	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-10.3	-178.7	-57	100.2	0	0	0	114.4	K158 H387	K158-W389 HydrophobicContact CD-CH2 4.43Å; K158-W389 HydrophobicContact CD-CZ2 3.67Å; K158-W389 VanDerWaalsContact CE-CZ2 3.44Å; K158-W389 HydrophobicContact CG-CZ2 4.38Å; H387-W389 AromaticContact CE1-CD1 3.56Å; H387-W389 AromaticContact ND1-CD1 3.96Å; H387-W389 PolarHBondContact O-N 3.43Å
390	L	85.9	Confident	87	Confident	48 Å²	48	71 Å²	71	25%	0.251	36%	0.362	S	S	.	.	S	Bend	trans	-87.5	134.9	179.4	-63.3	176.6	0	0	0	109.3	V384 H387 F394 K395	V384-L390 HydrophobicContact CG1-CD1 3.93Å; H387-L390 HydrophobicContact CB-CB 4.45Å; H387-L390 HydrophobicContact CB-CD1 3.64Å; H387-L390 HydrophobicContact CB-CG 3.88Å; H387-L390 PolarHBondContact O-N 2.98Å; L390-F394 HydrophobicContact CB-CD1 3.99Å; L390-F394 HydrophobicContact CD1-CD1 3.78Å; L390-F394 HydrophobicContact CD1-CE1 3.67Å; L390-F394 HydrophobicContact CD2-CD1 3.88Å; L390-F394 HydrophobicContact CD2-CE1 3.94Å; L390-F394 HydrophobicContact CD2-CG 4.43Å; L390-F394 HydrophobicContact CD2-CZ 4.5Å; L390-F394 HydrophobicContact CG-CD1 4.09Å; L390-F394 HydrophobicContact CG-CE1 4.3Å; L390-K395 HydrophobicContact CB-CG 4.15Å; L390-K395 WeakPolarHBondContact O-CE 3.48Å; L390-K395 PolarHBondContact O-NZ 3.36Å
391	S	89.7	Confident	87.2	Confident	73 Å²	73	70.7 Å²	70.7	51%	0.51	36%	0.36	S	S	.	.			trans	-64.6	153.4	174.5	67.2	0	0	0	0	110.8	N393 F394 K395	S391-N393 VanDerWaalsContact C-N 3.27Å; S391-N393 PolarHBondContact O-N 2.9Å; S391-F394 WeakPolarHBondContact O-CB 3.48Å; S391-F394 PolarHBondContact O-N 3.12Å; S391-F394 WeakPolarHBondContact OG-CB 3.37Å; S391-F394 PolarHBondContact OG-N 3.38Å; S391-K395 PolarHBondContact O-N 3.15Å
392	D	89.9	Confident	87.2	Confident	78 Å²	78	72.4 Å²	72.4	42%	0.417	37%	0.37	S	S	.	.	H	α-helix	trans	-65.5	-35.1	-179	-65.5	-11.4	0	0	0	111.4	F394 K395 R396 W437 P442	D392-F394 VanDerWaalsContact C-N 3.31Å; D392-F394 PolarHBondContact O-N 2.91Å; D392-K395 PolarHBondContact O-N 2.99Å; D392-K395 IonicContact OD1-NZ 3.68Å; D392-K395 PolarHBondContact OD1-NZ 3.18Å; D392-R396 VanDerWaalsContact O-CB 3.28Å; D392-R396 WeakPolarHBondContact O-CB 3.4Å; D392-R396 PolarHBondContact O-N 3.28Å; D392-W437 HydrophobicContact CB-CH2 3.97Å; D392-W437 HydrophobicContact CB-CZ2 4.32Å; D392-W437 WeakPolarHBondContact O-CH2 3.13Å; D392-P442 HydrophobicContact CB-CG 4.17Å; D392-P442 WeakPolarHBondContact OD1-CG 3.39Å
393	N	89.3	Confident	87.1	Confident	132 Å²	132	71.3 Å²	71.3	71%	0.706	37%	0.365	S	S	*	.	H	α-helix	trans	-60.2	-40.4	170.8	-72.1	-7.6	0	0	0	112	S391 R396 C397	S391-N393 VanDerWaalsContact C-N 3.27Å; S391-N393 PolarHBondContact O-N 2.9Å; N393-R396 PolarHBondContact O-N 2.86Å; N393-C397 WeakPolarHBondContact O-CB 3.3Å; N393-C397 PolarHBondContact O-N 2.91Å; N393-C397 PolarHBondContact O-SG 3.4Å
394	F	88.7	Confident	87	Confident	58 Å²	58	74.8 Å²	74.8	25%	0.254	37%	0.367	S	S	.	.	H	α-helix	trans	-64.8	-47.4	175.5	-179.8	-84.7	0	0	0	111.3	E184 V384 L390 S391 D392 R396 C397 A398	E184-F394 HydrophobicContact CG-CE2 4.18Å; V384-F394 HydrophobicContact CG1-CD1 4.41Å; V384-F394 HydrophobicContact CG1-CE1 4.07Å; L390-F394 HydrophobicContact CB-CD1 3.99Å; L390-F394 HydrophobicContact CD1-CD1 3.78Å; L390-F394 HydrophobicContact CD1-CE1 3.67Å; L390-F394 HydrophobicContact CD2-CD1 3.88Å; L390-F394 HydrophobicContact CD2-CE1 3.94Å; L390-F394 HydrophobicContact CD2-CG 4.43Å; L390-F394 HydrophobicContact CD2-CZ 4.5Å; L390-F394 HydrophobicContact CG-CD1 4.09Å; L390-F394 HydrophobicContact CG-CE1 4.3Å; S391-F394 WeakPolarHBondContact O-CB 3.48Å; S391-F394 PolarHBondContact O-N 3.12Å; S391-F394 WeakPolarHBondContact OG-CB 3.37Å; S391-F394 PolarHBondContact OG-N 3.38Å; D392-F394 VanDerWaalsContact C-N 3.31Å; D392-F394 PolarHBondContact O-N 2.91Å; F394-R396 VanDerWaalsContact C-N 3.3Å; F394-R396 PolarHBondContact O-N 3.38Å; F394-C397 PolarHBondContact O-N 3.48Å; F394-A398 HydrophobicContact CE1-CB 4.42Å; F394-A398 WeakPolarHBondContact O-CB 3.46Å; F394-A398 PolarHBondContact O-N 2.99Å
395	K	90.5	Very high	86.8	Confident	14 Å²	14	76.4 Å²	76.4	6%	0.061	38%	0.377	C	S	.	.	H	α-helix	trans	-58.7	-43.6	178.1	-66.3	171.2	-169.7	152.5	0	111	H387 L390 S391 D392 A398 L399 W437 P442	H387-K395 VanDerWaalsContact O-CE 3.26Å; H387-K395 WeakPolarHBondContact O-CE 3.48Å; L390-K395 HydrophobicContact CB-CG 4.15Å; L390-K395 WeakPolarHBondContact O-CE 3.48Å; L390-K395 PolarHBondContact O-NZ 3.36Å; S391-K395 PolarHBondContact O-N 3.15Å; D392-K395 PolarHBondContact O-N 2.99Å; D392-K395 IonicContact OD1-NZ 3.68Å; D392-K395 PolarHBondContact OD1-NZ 3.18Å; K395-A398 PolarHBondContact O-N 3.11Å; K395-L399 WeakPolarHBondContact O-CG 3.45Å; K395-L399 PolarHBondContact O-N 3.25Å; K395-W437 HydrophobicContact CB-CH2 4.26Å; K395-W437 HydrophobicContact CB-CZ3 3.82Å; K395-P442 HydrophobicContact CD-CG 4.28Å
396	R	90	Very high	86.6	Confident	62 Å²	62	77.6 Å²	77.6	23%	0.234	38%	0.382	C	S	.	.	H	α-helix	trans	-59.5	-53.6	177.1	177.2	64.3	-178.7	-93.6	-14.9	111.2	Y317 D392 N393 F394 A398 L399 D400 W437	Y317-R396 PolarHBondContact OH-NE 3.19Å; Y317-R396 PolarHBondContact OH-NH1 2.73Å; Y317-R396 VanDerWaalsContact OH-NH1 3.08Å; Y317-R396 PolarHBondContact OH-NH2 2.97Å; Y317-R396 VanDerWaalsContact OH-NH2 3.09Å; D392-R396 VanDerWaalsContact O-CB 3.28Å; D392-R396 WeakPolarHBondContact O-CB 3.4Å; D392-R396 PolarHBondContact O-N 3.28Å; N393-R396 PolarHBondContact O-N 2.86Å; F394-R396 VanDerWaalsContact C-N 3.3Å; F394-R396 PolarHBondContact O-N 3.38Å; R396-A398 VanDerWaalsContact C-N 3.26Å; R396-A398 PolarHBondContact O-N 3.48Å; R396-L399 PolarHBondContact O-N 2.68Å; R396-D400 IonicContact NE-OD1 3.79Å; R396-D400 IonicContact NE-OD2 2.61Å; R396-D400 PolarHBondContact NE-OD2 2.79Å; R396-D400 VanDerWaalsContact O-CG 3.29Å; R396-D400 PolarHBondContact O-N 2.87Å; R396-W437 VanDerWaalsContact CA-CZ3 3.47Å; R396-W437 HydrophobicContact CB-CD2 4.3Å; R396-W437 HydrophobicContact CB-CE3 3.83Å; R396-W437 HydrophobicContact CB-CH2 3.87Å; R396-W437 HydrophobicContact CB-CZ2 4.31Å; R396-W437 HydrophobicContact CB-CZ3 3.63Å; R396-W437 HydrophobicContact CG-CD2 4.45Å; R396-W437 HydrophobicContact CG-CE3 4.36Å; R396-W437 VanDerWaalsContact N-CZ3 3.29Å
397	C	90.4	Very high	86.4	Confident	77 Å²	77	69.2 Å²	69.2	52%	0.52	35%	0.351	S	S	.	.	H	α-helix	trans	-58.9	-36.9	176.7	-70.9	0	0	0	0	112.7	N393 F394 S401	N393-C397 WeakPolarHBondContact O-CB 3.3Å; N393-C397 PolarHBondContact O-N 2.91Å; N393-C397 PolarHBondContact O-SG 3.4Å; F394-C397 PolarHBondContact O-N 3.48Å; C397-S401 VanDerWaalsContact O-CB 3.27Å; C397-S401 WeakPolarHBondContact O-CB 3.35Å; C397-S401 PolarHBondContact O-N 3Å; C397-S401 PolarHBondContact O-OG 3.28Å
398	A	87.1	Confident	86.4	Confident	24 Å²	24	68 Å²	68	20%	0.198	35%	0.348	C	S	.	.	H	α-helix	trans	-68.7	-41.3	177.5	0	0	0	0	0	112.2	V384 F394 K395 R396 T402	V384-A398 HydrophobicContact CG1-CB 3.76Å; F394-A398 HydrophobicContact CE1-CB 4.42Å; F394-A398 WeakPolarHBondContact O-CB 3.46Å; F394-A398 PolarHBondContact O-N 2.99Å; K395-A398 PolarHBondContact O-N 3.11Å; R396-A398 VanDerWaalsContact C-N 3.26Å; R396-A398 PolarHBondContact O-N 3.48Å; A398-T402 VanDerWaalsContact O-CB 3.32Å; A398-T402 WeakPolarHBondContact O-CB 3.27Å; A398-T402 PolarHBondContact O-N 3.49Å; A398-T402 PolarHBondContact O-OG1 3.01Å
399	L	88.4	Confident	86.3	Confident	7 Å²	7	60.9 Å²	60.9	4%	0.037	33%	0.326	C	S	.	.	H	α-helix	trans	-62.7	-48.1	172.4	-73.2	-174	0	0	0	111.2	V381 T385 K395 R396 S401 T402 V403 A436 W437 L440	V381-L399 HydrophobicContact CG1-CD2 3.41Å; V381-L399 VanDerWaalsContact CG1-CD2 3.41Å; T385-L399 HydrophobicContact CG2-CD1 3.99Å; T385-L399 HydrophobicContact CG2-CD2 3.66Å; T385-L399 HydrophobicContact CG2-CG 3.93Å; K395-L399 WeakPolarHBondContact O-CG 3.45Å; K395-L399 PolarHBondContact O-N 3.25Å; R396-L399 PolarHBondContact O-N 2.68Å; L399-S401 VanDerWaalsContact C-N 3.32Å; L399-S401 PolarHBondContact O-N 3.32Å; L399-T402 WeakPolarHBondContact O-CB 3.36Å; L399-T402 PolarHBondContact O-N 3.21Å; L399-T402 VanDerWaalsContact O-N 3.1Å; L399-V403 WeakPolarHBondContact O-CG2 3.39Å; L399-V403 PolarHBondContact O-N 2.92Å; L399-A436 HydrophobicContact CD1-CB 4.48Å; L399-W437 HydrophobicContact CD1-CE3 3.82Å; L399-W437 HydrophobicContact CD1-CZ3 4.47Å; L399-L440 HydrophobicContact CD1-CB 4.3Å; L399-L440 HydrophobicContact CD2-CD1 4.45Å
400	D	86.5	Confident	86.2	Confident	50 Å²	50	55.8 Å²	55.8	27%	0.267	31%	0.307	S	S	.	.	H	α-helix	trans	-59.8	-44.2	179.3	-67.9	-8.2	0	0	0	110.8	R396 T402 V403 W404 P433	R396-D400 IonicContact NE-OD1 3.79Å; R396-D400 IonicContact NE-OD2 2.61Å; R396-D400 PolarHBondContact NE-OD2 2.79Å; R396-D400 VanDerWaalsContact O-CG 3.29Å; R396-D400 PolarHBondContact O-N 2.87Å; D400-T402 VanDerWaalsContact C-N 3.32Å; D400-T402 PolarHBondContact O-N 3.05Å; D400-V403 PolarHBondContact O-N 3.39Å; D400-W404 WeakPolarHBondContact O-CB 3.24Å; D400-W404 PolarHBondContact O-N 2.83Å; D400-P433 WeakPolarHBondContact OD1-CB 3.25Å
401	S	86	Confident	86.3	Confident	68 Å²	68	57.3 Å²	57.3	48%	0.476	31%	0.31	S	S	.	.	H	α-helix	trans	-65.2	-36	176.2	-60.8	0	0	0	0	112.6	C397 L399 T405	C397-S401 VanDerWaalsContact O-CB 3.27Å; C397-S401 WeakPolarHBondContact O-CB 3.35Å; C397-S401 PolarHBondContact O-N 3Å; C397-S401 PolarHBondContact O-OG 3.28Å; L399-S401 VanDerWaalsContact C-N 3.32Å; L399-S401 PolarHBondContact O-N 3.32Å; S401-T405 WeakPolarHBondContact O-CB 2.94Å; S401-T405 PolarHBondContact O-N 3.44Å; S401-T405 PolarHBondContact O-OG1 3.24Å
402	T	84.9	Confident	86	Confident	48 Å²	48	61.4 Å²	61.4	29%	0.294	32%	0.318	S	S	.	.	H	α-helix	trans	-65	-53.4	175.4	-61.6	0	0	0	0	109.4	V381 A398 L399 D400 W404 T405 I406	V381-T402 HydrophobicContact CG2-CG2 3.85Å; A398-T402 VanDerWaalsContact O-CB 3.32Å; A398-T402 WeakPolarHBondContact O-CB 3.27Å; A398-T402 PolarHBondContact O-N 3.49Å; A398-T402 PolarHBondContact O-OG1 3.01Å; L399-T402 WeakPolarHBondContact O-CB 3.36Å; L399-T402 PolarHBondContact O-N 3.21Å; L399-T402 VanDerWaalsContact O-N 3.1Å; D400-T402 VanDerWaalsContact C-N 3.32Å; D400-T402 PolarHBondContact O-N 3.05Å; T402-W404 VanDerWaalsContact C-N 3.25Å; T402-W404 PolarHBondContact O-N 3.39Å; T402-T405 PolarHBondContact O-N 3.11Å; T402-I406 HydrophobicContact CG2-CD1 3.68Å; T402-I406 VanDerWaalsContact O-CB 3.22Å; T402-I406 WeakPolarHBondContact O-CB 3.2Å; T402-I406 VanDerWaalsContact O-CG2 3.3Å; T402-I406 WeakPolarHBondContact O-CG2 3.38Å; T402-I406 PolarHBondContact O-N 3.43Å; T402-I406 VanDerWaalsContact O-N 3.16Å
403	V	83.9	Confident	85.9	Confident	12 Å²	12	64.8 Å²	64.8	7%	0.073	34%	0.336	C	S	.	.	H	α-helix	trans	-58.3	-35.8	176.7	170.6	0	0	0	0	112.3	L399 D400 I406 L407 L432 P433 A436	L399-V403 WeakPolarHBondContact O-CG2 3.39Å; L399-V403 PolarHBondContact O-N 2.92Å; D400-V403 PolarHBondContact O-N 3.39Å; V403-I406 VanDerWaalsContact O-CG2 3.23Å; V403-I406 WeakPolarHBondContact O-CG2 3.41Å; V403-L407 HydrophobicContact CG1-CD1 4.01Å; V403-L407 WeakPolarHBondContact O-CB 3.41Å; V403-L407 VanDerWaalsContact O-CG 3.26Å; V403-L407 WeakPolarHBondContact O-CG 3.06Å; V403-L407 PolarHBondContact O-N 3.21Å; V403-L432 HydrophobicContact CB-CG 4.5Å; V403-L432 HydrophobicContact CG1-CB 4.04Å; V403-L432 HydrophobicContact CG1-CD2 3.67Å; V403-L432 HydrophobicContact CG1-CG 3.68Å; V403-L432 HydrophobicContact CG2-CD2 4.29Å; V403-L432 HydrophobicContact CG2-CG 3.95Å; V403-P433 HydrophobicContact CG1-CG 3.94Å; V403-A436 HydrophobicContact CG2-CB 4.19Å
404	W	83.9	Confident	85.7	Confident	148 Å²	148	60.1 Å²	60.1	56%	0.561	31%	0.31	S	S	*	.	H	α-helix	trans	-66	-53.7	174.8	173.1	-104	0	0	0	112.2	D400 T402 I406 L407 L408	D400-W404 WeakPolarHBondContact O-CB 3.24Å; D400-W404 PolarHBondContact O-N 2.83Å; T402-W404 VanDerWaalsContact C-N 3.25Å; T402-W404 PolarHBondContact O-N 3.39Å; W404-I406 PolarHBondContact O-N 3.13Å; W404-L407 PolarHBondContact O-N 3.45Å; W404-L408 VanDerWaalsContact O-CB 3.29Å; W404-L408 WeakPolarHBondContact O-CB 3.39Å; W404-L408 PolarHBondContact O-N 3.13Å
405	T	82.9	Confident	85.7	Confident	73 Å²	73	63.9 Å²	63.9	45%	0.448	33%	0.327	S	S	.	.	H	α-helix	trans	-57.2	-38.9	-175	-60.7	0	0	0	0	112.2	S401 T402 L408 A409	S401-T405 WeakPolarHBondContact O-CB 2.94Å; S401-T405 PolarHBondContact O-N 3.44Å; S401-T405 PolarHBondContact O-OG1 3.24Å; T402-T405 PolarHBondContact O-N 3.11Å; T405-L408 PolarHBondContact O-N 2.8Å; T405-A409 WeakPolarHBondContact O-CB 3.31Å; T405-A409 PolarHBondContact O-N 3.29Å
406	I	81.7	Confident	85.7	Confident	37 Å²	37	65.5 Å²	65.5	19%	0.19	33%	0.333	C	S	.	.	H	α-helix	trans	-78.7	-40.2	-170.4	-126.9	157.2	0	0	0	108.4	V31 L32 T402 V403 W404 A409 K410	V31-I406 HydrophobicContact CB-CD1 4.5Å; V31-I406 HydrophobicContact CG1-CD1 3.19Å; V31-I406 HydrophobicContact CG1-CG1 3.71Å; L32-I406 HydrophobicContact CD1-CB 3.53Å; L32-I406 HydrophobicContact CD1-CG1 3.66Å; L32-I406 HydrophobicContact CD1-CG2 3.27Å; L32-I406 VanDerWaalsContact CD1-O 3.27Å; L32-I406 WeakPolarHBondContact CD1-O 3.36Å; L32-I406 HydrophobicContact CD2-CB 4.1Å; L32-I406 HydrophobicContact CD2-CD1 4.32Å; L32-I406 HydrophobicContact CD2-CG1 4.19Å; L32-I406 HydrophobicContact CD2-CG2 3.08Å; L32-I406 HydrophobicContact CG-CB 4.06Å; L32-I406 HydrophobicContact CG-CD1 4.42Å; L32-I406 HydrophobicContact CG-CG1 3.89Å; L32-I406 HydrophobicContact CG-CG2 3.53Å; T402-I406 HydrophobicContact CG2-CD1 3.68Å; T402-I406 VanDerWaalsContact O-CB 3.22Å; T402-I406 WeakPolarHBondContact O-CB 3.2Å; T402-I406 VanDerWaalsContact O-CG2 3.3Å; T402-I406 WeakPolarHBondContact O-CG2 3.38Å; T402-I406 PolarHBondContact O-N 3.43Å; T402-I406 VanDerWaalsContact O-N 3.16Å; V403-I406 VanDerWaalsContact O-CG2 3.23Å; V403-I406 WeakPolarHBondContact O-CG2 3.41Å; W404-I406 PolarHBondContact O-N 3.13Å; I406-A409 PolarHBondContact O-N 3.45Å; I406-K410 PolarHBondContact O-N 2.74Å; I406-K410 VanDerWaalsContact O-N 3.09Å
407	L	82.7	Confident	85.7	Confident	7 Å²	7	67.9 Å²	67.9	4%	0.037	36%	0.356	C	S	.	.	H	α-helix	trans	-68.5	-39.5	171.2	-71.7	176.8	0	0	0	111.3	V403 W404 K410 R411 Y425 V428 G429	V403-L407 HydrophobicContact CG1-CD1 4.01Å; V403-L407 WeakPolarHBondContact O-CB 3.41Å; V403-L407 VanDerWaalsContact O-CG 3.26Å; V403-L407 WeakPolarHBondContact O-CG 3.06Å; V403-L407 PolarHBondContact O-N 3.21Å; W404-L407 PolarHBondContact O-N 3.45Å; L407-K410 PolarHBondContact O-N 3.25Å; L407-R411 WeakPolarHBondContact O-CG 3.18Å; L407-R411 PolarHBondContact O-N 3.33Å; L407-Y425 HydrophobicContact CD2-CD1 4.07Å; L407-Y425 HydrophobicContact CD2-CG 4.28Å; L407-V428 HydrophobicContact CD2-CG1 4.36Å; L407-G429 VanDerWaalsContact CD1-CA 3.45Å
408	L	84.1	Confident	85.7	Confident	64 Å²	64	68.7 Å²	68.7	34%	0.335	36%	0.356	S	S	.	.	H	α-helix	trans	-60.7	-46.1	174.9	180	62.7	0	0	0	111.4	W404 T405 K410 R411 K412	W404-L408 VanDerWaalsContact O-CB 3.29Å; W404-L408 WeakPolarHBondContact O-CB 3.39Å; W404-L408 PolarHBondContact O-N 3.13Å; T405-L408 PolarHBondContact O-N 2.8Å; L408-K410 VanDerWaalsContact C-N 3.3Å; L408-K410 PolarHBondContact O-N 2.87Å; L408-R411 PolarHBondContact O-N 2.87Å; L408-K412 WeakPolarHBondContact O-CG 3.39Å; L408-K412 PolarHBondContact O-N 2.84Å; L408-K412 VanDerWaalsContact O-N 3.12Å
409	A	83.3	Confident	86	Confident	48 Å²	48	67.6 Å²	67.6	40%	0.397	35%	0.346	S	S	.	.	H	α-helix	trans	-59	-42.5	175.4	0	0	0	0	0	111.5	T405 I406 K412 L413	T405-A409 WeakPolarHBondContact O-CB 3.31Å; T405-A409 PolarHBondContact O-N 3.29Å; I406-A409 PolarHBondContact O-N 3.45Å; A409-K412 PolarHBondContact O-N 3.22Å; A409-L413 WeakPolarHBondContact O-CG 3.3Å; A409-L413 PolarHBondContact O-N 3.41Å
410	K	81.5	Confident	86.3	Confident	43 Å²	43	67.2 Å²	67.2	19%	0.187	35%	0.345	C	S	.	.	H	α-helix	trans	-66.1	-41.7	176.2	-78.9	-165.8	157.8	-161.5	0	113.5	L32 I406 L407 L408 K412 L413 L414 Y425	L32-K410 HydrophobicContact CB-CD 3.98Å; L32-K410 HydrophobicContact CD1-CD 3.54Å; L32-K410 HydrophobicContact CD1-CG 3.89Å; L32-K410 PolarHBondContact O-NZ 2.91Å; I406-K410 PolarHBondContact O-N 2.74Å; I406-K410 VanDerWaalsContact O-N 3.09Å; L407-K410 PolarHBondContact O-N 3.25Å; L408-K410 VanDerWaalsContact C-N 3.3Å; L408-K410 PolarHBondContact O-N 2.87Å; K410-K412 VanDerWaalsContact C-N 3.26Å; K410-K412 PolarHBondContact O-N 3.31Å; K410-L413 PolarHBondContact O-N 2.97Å; K410-L414 PolarHBondContact O-N 2.82Å; K410-Y425 HydrophobicContact CB-CD2 4.19Å; K410-Y425 HydrophobicContact CB-CE2 3.64Å; K410-Y425 HydrophobicContact CD-CE1 4.18Å; K410-Y425 HydrophobicContact CD-CE2 4.25Å
411	R	86.2	Confident	86.6	Confident	80 Å²	80	65.1 Å²	65.1	30%	0.302	33%	0.333	S	S	.	.	H	α-helix	trans	-59.6	-37.2	176.6	-76	-174.5	-169.7	161.7	9.6	112	L407 L408 L413 L414 Y425 S426	L407-R411 WeakPolarHBondContact O-CG 3.18Å; L407-R411 PolarHBondContact O-N 3.33Å; L408-R411 PolarHBondContact O-N 2.87Å; R411-L413 PolarHBondContact O-N 3.49Å; R411-L414 HydrophobicContact CG-CD1 4.41Å; R411-L414 WeakPolarHBondContact O-CB 3.32Å; R411-L414 WeakPolarHBondContact O-CG 3.36Å; R411-L414 PolarHBondContact O-N 3.36Å; R411-Y425 HydrophobicContact CG-CD2 3.99Å; R411-Y425 PolarHBondContact NH2-O 3.21Å; R411-S426 VanDerWaalsContact NH2-CA 3.25Å
412	K	85.3	Confident	87	Confident	159 Å²	159	62.5 Å²	62.5	69%	0.691	32%	0.315	S	S	*	.	H	α-helix	trans	-65.7	-23.7	175.2	-70.6	178.7	178.6	-176.4	0	114	L408 A409 K410	L408-K412 WeakPolarHBondContact O-CG 3.39Å; L408-K412 PolarHBondContact O-N 2.84Å; L408-K412 VanDerWaalsContact O-N 3.12Å; A409-K412 PolarHBondContact O-N 3.22Å; K410-K412 VanDerWaalsContact C-N 3.26Å; K410-K412 PolarHBondContact O-N 3.31Å
413	L	86.3	Confident	87.5	Confident	150 Å²	150	62.5 Å²	62.5	79%	0.785	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	9.4	-179.2	-63	176.3	0	0	0	112.9	A409 K410 R411	A409-L413 WeakPolarHBondContact O-CG 3.3Å; A409-L413 PolarHBondContact O-N 3.41Å; K410-L413 PolarHBondContact O-N 2.97Å; R411-L413 PolarHBondContact O-N 3.49Å
414	L	86.4	Confident	88	Confident	33 Å²	33	62 Å²	62	17%	0.173	31%	0.309	C	S	.	.			trans	-73.3	137.5	177.9	-67.7	-178.7	0	0	0	111.2	K410 R411 Y416 Y421 A422 Y425	K410-L414 PolarHBondContact O-N 2.82Å; R411-L414 HydrophobicContact CG-CD1 4.41Å; R411-L414 WeakPolarHBondContact O-CB 3.32Å; R411-L414 WeakPolarHBondContact O-CG 3.36Å; R411-L414 PolarHBondContact O-N 3.36Å; L414-Y416 VanDerWaalsContact C-N 3.31Å; L414-Y421 VanDerWaalsContact CD2-CB 3.42Å; L414-Y421 HydrophobicContact CD2-CG 4.26Å; L414-A422 HydrophobicContact CD1-CB 3.89Å; L414-Y425 HydrophobicContact CD1-CD2 4.2Å; L414-Y425 HydrophobicContact CD1-CE2 4.38Å; L414-Y425 HydrophobicContact CD2-CD2 4.37Å; L414-Y425 HydrophobicContact CD2-CE2 3.73Å; L414-Y425 HydrophobicContact CG-CE2 4.35Å
415	K	87.5	Confident	88.4	Confident	138 Å²	138	55.4 Å²	55.4	60%	0.6	28%	0.283	S	S	*	.	S	Bend	trans	-64.9	-41.3	171.5	-175.1	-179.3	179.1	-169.7	0	110.4	E346	E346-K415 IonicContact OE2-NZ 3.57Å; E346-K415 PolarHBondContact OE2-NZ 3.14Å
416	Y	90.8	Very high	89	Confident	47 Å²	47	53.6 Å²	53.6	18%	0.184	27%	0.274	C	S	.	.			trans	-117.7	120.2	178	-57.1	-69.3	0	0	0	110.4	M343 E346 E347 L414 D418 G419	M343-Y416 HydrophobicContact CB-CD2 3.97Å; M343-Y416 HydrophobicContact CB-CE2 4.1Å; M343-Y416 HydrophobicContact CB-CG 4.35Å; M343-Y416 VanDerWaalsContact CE-CB 3.44Å; M343-Y416 HydrophobicContact CE-CD1 3.59Å; M343-Y416 HydrophobicContact CE-CD2 4.26Å; M343-Y416 HydrophobicContact CE-CE1 4.4Å; M343-Y416 HydrophobicContact CE-CG 3.49Å; M343-Y416 VanDerWaalsContact CE-CG 3.49Å; M343-Y416 HydrophobicContact CG-CD1 4.37Å; M343-Y416 HydrophobicContact CG-CD2 4.36Å; M343-Y416 HydrophobicContact CG-CE1 4.34Å; M343-Y416 HydrophobicContact CG-CE2 4.36Å; M343-Y416 HydrophobicContact CG-CG 4.37Å; E346-Y416 HydrophobicContact CB-CE2 4.34Å; E346-Y416 PolarHBondContact OE2-OH 3.05Å; E347-Y416 HydrophobicContact CG-CD2 3.74Å; E347-Y416 HydrophobicContact CG-CE2 4.2Å; L414-Y416 VanDerWaalsContact C-N 3.31Å; Y416-D418 PolarHBondContact O-N 3Å; Y416-G419 PolarHBondContact O-N 3.14Å
417	P	90.2	Very high	89.6	Confident	112 Å²	112	51.8 Å²	51.8	73%	0.727	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-20.5	-178.7	28.5	-34.9	0	0	0	113.2	A422	P417-A422 WeakPolarHBondContact O-CB 3.1Å
418	D	91.1	Very high	90	Very high	95 Å²	95	51.6 Å²	51.6	51%	0.508	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	24.9	176.6	63.7	-26	0	0	0	111.5	F332 M343 Y416	F332-D418 VanDerWaalsContact CE2-O 3.22Å; F332-D418 WeakPolarHBondContact CE2-O 3.3Å; M343-D418 WeakPolarHBondContact CE-OD1 3.15Å; Y416-D418 PolarHBondContact O-N 3Å
419	G	93	Very high	90.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	-77.4	-175.3	178.1	0	0	0	0	0	114.1	Y416 Y421 A422 H423	Y416-G419 PolarHBondContact O-N 3.14Å; G419-Y421 VanDerWaalsContact C-N 3.31Å; G419-Y421 PolarHBondContact O-N 3.16Å; G419-A422 WeakPolarHBondContact O-CB 3.26Å; G419-A422 PolarHBondContact O-N 3.28Å; G419-A422 VanDerWaalsContact O-N 3.08Å; G419-H423 PolarHBondContact O-CD2 3.46Å; G419-H423 VanDerWaalsContact O-CD2 3.29Å; G419-H423 PolarHBondContact O-N 3.19Å
420	F	94.3	Very high	90.8	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-55.8	-47.7	176	174.5	-105.3	0	0	0	111.4	V41 L329 F332 I333 M344 E347 L348 M366 A422 H423 Y424	V41-F420 HydrophobicContact CG1-CE2 4.11Å; V41-F420 HydrophobicContact CG1-CZ 4.06Å; V41-F420 HydrophobicContact CG2-CE2 4.3Å; V41-F420 HydrophobicContact CG2-CZ 4.08Å; L329-F420 HydrophobicContact CD1-CD2 4.11Å; L329-F420 HydrophobicContact CD1-CE2 4Å; F332-F420 HydrophobicContact CD1-CD2 4.46Å; F332-F420 HydrophobicContact CE1-CB 3.72Å; F332-F420 HydrophobicContact CE1-CD2 4.21Å; F332-F420 HydrophobicContact CE1-CG 4.5Å; F332-F420 HydrophobicContact CZ-CB 4.28Å; F332-F420 VanDerWaalsContact CZ-N 3.3Å; I333-F420 HydrophobicContact CD1-CE2 4.01Å; I333-F420 HydrophobicContact CG1-CD2 4.28Å; I333-F420 HydrophobicContact CG1-CE2 4.13Å; M344-F420 HydrophobicContact CB-CB 3.78Å; M344-F420 HydrophobicContact CB-CD2 4.42Å; M344-F420 HydrophobicContact CB-CG 4.26Å; M344-F420 HydrophobicContact CE-CD2 3.56Å; M344-F420 HydrophobicContact CE-CE1 4.35Å; M344-F420 HydrophobicContact CE-CE2 3.25Å; M344-F420 HydrophobicContact CE-CG 4.21Å; M344-F420 HydrophobicContact CE-CZ 3.68Å; M344-F420 HydrophobicContact CG-CB 3.75Å; M344-F420 HydrophobicContact CG-CD1 4.36Å; M344-F420 HydrophobicContact CG-CD2 3.69Å; M344-F420 HydrophobicContact CG-CE2 4.36Å; M344-F420 HydrophobicContact CG-CG 3.67Å; M344-F420 HydrophobicContact SD-CD2 3.52Å; M344-F420 VanDerWaalsContact SD-CD2 3.52Å; M344-F420 HydrophobicContact SD-CE2 3.85Å; M344-F420 HydrophobicContact SD-CG 4.15Å; E347-F420 WeakPolarHBondContact OE2-CA 3.44Å; E347-F420 VanDerWaalsContact OE2-CB 3.28Å; E347-F420 WeakPolarHBondContact OE2-CB 3.41Å; E347-F420 PolarHBondContact OE2-N 3Å; L348-F420 HydrophobicContact CD2-CD1 4.16Å; L348-F420 HydrophobicContact CD2-CE1 3.84Å; M366-F420 HydrophobicContact CE-CE1 3.36Å; M366-F420 HydrophobicContact CE-CZ 3.26Å; F420-A422 PolarHBondContact O-N 3.07Å; F420-H423 PolarHBondContact O-N 2.5Å; F420-Y424 WeakPolarHBondContact O-CB 3.24Å; F420-Y424 PolarHBondContact O-N 3.07Å
421	Y	93.6	Very high	91.3	Very high	6 Å²	6	46.7 Å²	46.7	2%	0.024	24%	0.24	C	C	.	.	H	α-helix	trans	-67.9	-24.3	-180	-78.5	-67.7	0	0	0	113.5	E347 K351 L365 L414 G419 Y424 Y425	E347-Y421 HydrophobicContact CB-CD2 3.76Å; E347-Y421 HydrophobicContact CB-CE2 3.85Å; E347-Y421 HydrophobicContact CG-CD2 4.23Å; E347-Y421 PolarHBondContact OE2-N 2.98Å; K351-Y421 HydrophobicContact CG-CE2 3.74Å; K351-Y421 VanDerWaalsContact CG-OH 3.28Å; K351-Y421 WeakPolarHBondContact CG-OH 2.76Å; L365-Y421 WeakPolarHBondContact CD2-OH 3.38Å; L414-Y421 VanDerWaalsContact CD2-CB 3.42Å; L414-Y421 HydrophobicContact CD2-CG 4.26Å; G419-Y421 VanDerWaalsContact C-N 3.31Å; G419-Y421 PolarHBondContact O-N 3.16Å; Y421-Y424 AromaticContact CD1-CD1 3.87Å; Y421-Y424 HydrophobicContact CD1-CD1 3.87Å; Y421-Y424 HydrophobicContact CD1-CE1 4.42Å; Y421-Y424 HydrophobicContact CE1-CD1 4.27Å; Y421-Y424 HydrophobicContact CE1-CE1 4.43Å; Y421-Y425 AromaticContact CD1-CE1 3.89Å; Y421-Y425 HydrophobicContact CD1-CE1 3.89Å; Y421-Y425 HydrophobicContact CD1-CE2 4.36Å; Y421-Y425 AromaticContact CD1-CZ 3.69Å; Y421-Y425 HydrophobicContact CG-CE2 4.45Å; Y421-Y425 VanDerWaalsContact O-CB 3.26Å; Y421-Y425 WeakPolarHBondContact O-CB 3.38Å; Y421-Y425 WeakPolarHBondContact O-CD2 3.08Å; Y421-Y425 PolarHBondContact O-N 3Å
422	A	94.4	Very high	91.6	Very high	12 Å²	12	43.5 Å²	43.5	10%	0.099	23%	0.229	C	C	.	.	H	α-helix	trans	-66.8	-53.7	175.5	0	0	0	0	0	110.6	L414 P417 G419 F420 Y424 Y425 S426	L414-A422 HydrophobicContact CD1-CB 3.89Å; P417-A422 WeakPolarHBondContact O-CB 3.1Å; G419-A422 WeakPolarHBondContact O-CB 3.26Å; G419-A422 PolarHBondContact O-N 3.28Å; G419-A422 VanDerWaalsContact O-N 3.08Å; F420-A422 PolarHBondContact O-N 3.07Å; A422-Y424 VanDerWaalsContact C-N 3.32Å; A422-Y424 PolarHBondContact O-N 3.04Å; A422-Y425 PolarHBondContact O-N 2.86Å; A422-S426 PolarHBondContact O-N 3.25Å; A422-S426 VanDerWaalsContact O-N 3.12Å; A422-S426 PolarHBondContact O-OG 3.18Å
423	H	95.2	Very high	91.8	Very high	49 Å²	49	36.8 Å²	36.8	23%	0.227	20%	0.201	C	C	.	.	H	α-helix	trans	-59.9	-44.1	175.1	-70.8	-77.8	0	0	0	111.7	L329 F332 G419 F420 S426 M427	L329-H423 HydrophobicContact CB-CB 4.3Å; L329-H423 HydrophobicContact CD1-CB 3.72Å; F332-H423 AromaticContact CD2-CD2 3.29Å; F332-H423 WeakPolarHBondContact CD2-CD2 3.38Å; F332-H423 AromaticContact CD2-NE2 3.35Å; F332-H423 VanDerWaalsContact CD2-NE2 3.35Å; F332-H423 WeakPolarHBondContact CD2-NE2 2.89Å; F332-H423 AromaticContact CE2-CD2 3.95Å; F332-H423 AromaticContact CG-CD2 3.37Å; F332-H423 WeakPolarHBondContact CG-CD2 3.46Å; F332-H423 AromaticContact CG-NE2 3.75Å; G419-H423 PolarHBondContact O-CD2 3.46Å; G419-H423 VanDerWaalsContact O-CD2 3.29Å; G419-H423 PolarHBondContact O-N 3.19Å; F420-H423 PolarHBondContact O-N 2.5Å; H423-S426 WeakPolarHBondContact O-CB 3.24Å; H423-S426 PolarHBondContact O-N 3.01Å; H423-M427 PolarHBondContact O-N 3.29Å; H423-M427 VanDerWaalsContact O-N 3.09Å
424	Y	94.3	Very high	92.1	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-61.8	-47.1	179	177.3	-112	0	0	0	113.4	S34 L329 M366 F420 Y421 A422 S426 M427 V428	S34-Y424 WeakPolarHBondContact CB-OH 2.66Å; S34-Y424 PolarHBondContact OG-OH 3.17Å; L329-Y424 HydrophobicContact CD2-CD2 4.16Å; M366-Y424 WeakPolarHBondContact CB-OH 2.8Å; M366-Y424 HydrophobicContact CE-CD2 3.96Å; M366-Y424 HydrophobicContact CE-CE1 4.31Å; M366-Y424 HydrophobicContact CE-CE2 3.54Å; M366-Y424 HydrophobicContact CE-CG 4.45Å; M366-Y424 HydrophobicContact CG-CE2 4.28Å; M366-Y424 WeakPolarHBondContact CG-OH 3.31Å; M366-Y424 HydrophobicContact SD-CD2 4.32Å; M366-Y424 HydrophobicContact SD-CE2 3.46Å; M366-Y424 WeakPolarHBondContact SD-CE2 2.82Å; M366-Y424 PolarHBondContact SD-OH 3.42Å; F420-Y424 WeakPolarHBondContact O-CB 3.24Å; F420-Y424 PolarHBondContact O-N 3.07Å; Y421-Y424 AromaticContact CD1-CD1 3.87Å; Y421-Y424 HydrophobicContact CD1-CD1 3.87Å; Y421-Y424 HydrophobicContact CD1-CE1 4.42Å; Y421-Y424 HydrophobicContact CE1-CD1 4.27Å; Y421-Y424 HydrophobicContact CE1-CE1 4.43Å; A422-Y424 VanDerWaalsContact C-N 3.32Å; A422-Y424 PolarHBondContact O-N 3.04Å; Y424-S426 PolarHBondContact O-N 3.45Å; Y424-M427 HydrophobicContact CD2-CE 3.96Å; Y424-M427 HydrophobicContact CE2-CE 4.02Å; Y424-M427 PolarHBondContact O-N 2.91Å; Y424-V428 HydrophobicContact CD1-CG2 4.16Å; Y424-V428 HydrophobicContact CD2-CG2 4.06Å; Y424-V428 HydrophobicContact CE1-CG2 3.86Å; Y424-V428 HydrophobicContact CE2-CG2 3.74Å; Y424-V428 HydrophobicContact CG-CG2 4.3Å; Y424-V428 WeakPolarHBondContact O-CB 3.44Å; Y424-V428 WeakPolarHBondContact O-CG2 3.45Å; Y424-V428 PolarHBondContact O-N 3.38Å
425	Y	92.1	Very high	92.4	Very high	8 Å²	8	28.1 Å²	28.1	3%	0.031	16%	0.156	C	C	.	.	H	α-helix	trans	-68.6	-22	176.9	-66.3	-28	0	0	0	112.7	L407 K410 R411 L414 Y421 A422 G429	L407-Y425 HydrophobicContact CD2-CD1 4.07Å; L407-Y425 HydrophobicContact CD2-CG 4.28Å; K410-Y425 HydrophobicContact CB-CD2 4.19Å; K410-Y425 HydrophobicContact CB-CE2 3.64Å; K410-Y425 HydrophobicContact CD-CE1 4.18Å; K410-Y425 HydrophobicContact CD-CE2 4.25Å; R411-Y425 HydrophobicContact CG-CD2 3.99Å; R411-Y425 PolarHBondContact NH2-O 3.21Å; L414-Y425 HydrophobicContact CD1-CD2 4.2Å; L414-Y425 HydrophobicContact CD1-CE2 4.38Å; L414-Y425 HydrophobicContact CD2-CD2 4.37Å; L414-Y425 HydrophobicContact CD2-CE2 3.73Å; L414-Y425 HydrophobicContact CG-CE2 4.35Å; Y421-Y425 AromaticContact CD1-CE1 3.89Å; Y421-Y425 HydrophobicContact CD1-CE1 3.89Å; Y421-Y425 HydrophobicContact CD1-CE2 4.36Å; Y421-Y425 AromaticContact CD1-CZ 3.69Å; Y421-Y425 HydrophobicContact CG-CE2 4.45Å; Y421-Y425 VanDerWaalsContact O-CB 3.26Å; Y421-Y425 WeakPolarHBondContact O-CB 3.38Å; Y421-Y425 WeakPolarHBondContact O-CD2 3.08Å; Y421-Y425 PolarHBondContact O-N 3Å; A422-Y425 PolarHBondContact O-N 2.86Å; Y425-G429 PolarHBondContact O-N 3.04Å; Y425-G429 VanDerWaalsContact O-N 3.09Å
426	S	94.3	Very high	92.5	Very high	35 Å²	35	21.9 Å²	21.9	25%	0.245	13%	0.13	C	C	.	.	H	α-helix	trans	-68.8	-46.4	170.7	-59.1	0	0	0	0	111.1	N325 R411 A422 H423 Y424 G429	N325-S426 WeakPolarHBondContact OD1-CB 3.46Å; R411-S426 VanDerWaalsContact NH2-CA 3.25Å; A422-S426 PolarHBondContact O-N 3.25Å; A422-S426 VanDerWaalsContact O-N 3.12Å; A422-S426 PolarHBondContact O-OG 3.18Å; H423-S426 WeakPolarHBondContact O-CB 3.24Å; H423-S426 PolarHBondContact O-N 3.01Å; Y424-S426 PolarHBondContact O-N 3.45Å; S426-G429 PolarHBondContact O-N 2.89Å
427	M	94.7	Very high	92.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-66.4	-48.1	173.3	-176.8	-151.8	65.1	0	0	112.9	V37 A40 F322 N325 Y326 L329 H423 Y424 G429 T430	V37-M427 HydrophobicContact CB-CE 3.96Å; V37-M427 HydrophobicContact CB-SD 4.09Å; V37-M427 HydrophobicContact CG1-SD 4.37Å; V37-M427 HydrophobicContact CG2-CE 4.11Å; V37-M427 HydrophobicContact CG2-SD 4.13Å; A40-M427 HydrophobicContact CB-CE 3.85Å; A40-M427 HydrophobicContact CB-SD 3.01Å; A40-M427 WeakPolarHBondContact CB-SD 3.1Å; F322-M427 HydrophobicContact CD2-CG 3.92Å; F322-M427 HydrophobicContact CE2-CG 3.77Å; F322-M427 HydrophobicContact CE2-SD 3.99Å; N325-M427 HydrophobicContact CB-CB 3.95Å; N325-M427 HydrophobicContact CB-CG 4.49Å; Y326-M427 HydrophobicContact CD2-SD 4.22Å; L329-M427 HydrophobicContact CD2-CE 4.15Å; L329-M427 HydrophobicContact CD2-SD 3.89Å; H423-M427 PolarHBondContact O-N 3.29Å; H423-M427 VanDerWaalsContact O-N 3.09Å; Y424-M427 HydrophobicContact CD2-CE 3.96Å; Y424-M427 HydrophobicContact CE2-CE 4.02Å; Y424-M427 PolarHBondContact O-N 2.91Å; M427-G429 PolarHBondContact O-N 3.45Å; M427-G429 VanDerWaalsContact O-N 3.17Å; M427-T430 PolarHBondContact O-N 2.85Å; M427-T430 PolarHBondContact O-OG1 3.18Å
428	V	91.6	Very high	92.7	Very high	2 Å²	2	15.1 Å²	15.1	1%	0.012	9%	0.09	C	C	.	.	H	α-helix	trans	-58.7	-32.6	177.9	169.9	0	0	0	0	111.1	L407 Y424 T430 V431 L432	L407-V428 HydrophobicContact CD2-CG1 4.36Å; Y424-V428 HydrophobicContact CD1-CG2 4.16Å; Y424-V428 HydrophobicContact CD2-CG2 4.06Å; Y424-V428 HydrophobicContact CE1-CG2 3.86Å; Y424-V428 HydrophobicContact CE2-CG2 3.74Å; Y424-V428 HydrophobicContact CG-CG2 4.3Å; Y424-V428 WeakPolarHBondContact O-CB 3.44Å; Y424-V428 WeakPolarHBondContact O-CG2 3.45Å; Y424-V428 PolarHBondContact O-N 3.38Å; V428-T430 PolarHBondContact O-N 2.84Å; V428-V431 PolarHBondContact O-N 2.92Å; V428-V431 VanDerWaalsContact O-N 3.17Å; V428-L432 HydrophobicContact CG1-CB 3.86Å; V428-L432 HydrophobicContact CG1-CD2 4Å; V428-L432 WeakPolarHBondContact O-CB 3.5Å; V428-L432 PolarHBondContact O-N 2.84Å
429	G	91	Very high	92.7	Very high	24 Å²	24	11.4 Å²	11.4	25%	0.247	7%	0.069	C	C	.	.	H	α-helix	trans	-61.1	-21.6	176.1	0	0	0	0	0	114.8	L407 Y425 S426 M427 P433	L407-G429 VanDerWaalsContact CD1-CA 3.45Å; Y425-G429 PolarHBondContact O-N 3.04Å; Y425-G429 VanDerWaalsContact O-N 3.09Å; S426-G429 PolarHBondContact O-N 2.89Å; M427-G429 PolarHBondContact O-N 3.45Å; M427-G429 VanDerWaalsContact O-N 3.17Å; G429-P433 VanDerWaalsContact O-CD 3.26Å; G429-P433 WeakPolarHBondContact O-CD 3.47Å; G429-P433 WeakPolarHBondContact O-CG 3.46Å
430	T	93.6	Very high	92.5	Very high	29 Å²	29	12.8 Å²	12.8	18%	0.178	8%	0.077	C	C	.	.	H	α-helix	trans	-90.2	-22.9	177.2	70.7	0	0	0	0	112.6	D321 F322 M427 V428	D321-T430 HydrophobicContact CB-CG2 3.83Å; F322-T430 WeakPolarHBondContact CA-OG1 3.42Å; F322-T430 WeakPolarHBondContact CB-OG1 3.42Å; M427-T430 PolarHBondContact O-N 2.85Å; M427-T430 PolarHBondContact O-OG1 3.18Å; V428-T430 PolarHBondContact O-N 2.84Å
431	V	92	Very high	92.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-104.5	-38.5	-173.5	-169.4	0	0	0	0	113	A36 V37 V308 L312 F322 V428 P433 A434 L435	A36-V431 HydrophobicContact CB-CG1 3.74Å; V37-V431 HydrophobicContact CG2-CB 4.47Å; V37-V431 HydrophobicContact CG2-CG1 4.33Å; V37-V431 HydrophobicContact CG2-CG2 3.85Å; V308-V431 HydrophobicContact CG1-CG1 3.88Å; V308-V431 HydrophobicContact CG1-CG2 3.96Å; L312-V431 HydrophobicContact CD1-CG2 4.38Å; L312-V431 HydrophobicContact CD2-CG1 4.25Å; F322-V431 HydrophobicContact CD2-CG2 3.38Å; F322-V431 HydrophobicContact CE2-CG2 3.83Å; F322-V431 HydrophobicContact CG-CG2 4.17Å; V428-V431 PolarHBondContact O-N 2.92Å; V428-V431 VanDerWaalsContact O-N 3.17Å; V431-P433 VanDerWaalsContact C-CD 3.49Å; V431-A434 WeakPolarHBondContact O-CB 3.23Å; V431-A434 PolarHBondContact O-N 3.38Å; V431-L435 HydrophobicContact CG1-CD1 4.03Å; V431-L435 PolarHBondContact O-N 3.1Å; V431-L435 VanDerWaalsContact O-N 3.14Å
432	L	90.9	Very high	92.1	Very high	12 Å²	12	15.8 Å²	15.8	6%	0.063	10%	0.099	C	C	.	.	H	α-helix	trans	-59.5	-38.1	-177.9	178.5	59.5	0	0	0	113.9	L32 A35 V403 V428 A434 L435 A436	L32-L432 HydrophobicContact CD2-CD2 3.95Å; A35-L432 HydrophobicContact CB-CB 4.31Å; A35-L432 HydrophobicContact CB-CD1 3.29Å; A35-L432 HydrophobicContact CB-CG 4.38Å; V403-L432 HydrophobicContact CB-CG 4.5Å; V403-L432 HydrophobicContact CG1-CB 4.04Å; V403-L432 HydrophobicContact CG1-CD2 3.67Å; V403-L432 HydrophobicContact CG1-CG 3.68Å; V403-L432 HydrophobicContact CG2-CD2 4.29Å; V403-L432 HydrophobicContact CG2-CG 3.95Å; V428-L432 HydrophobicContact CG1-CB 3.86Å; V428-L432 HydrophobicContact CG1-CD2 4Å; V428-L432 WeakPolarHBondContact O-CB 3.5Å; V428-L432 PolarHBondContact O-N 2.84Å; L432-A434 VanDerWaalsContact C-N 3.29Å; L432-A434 PolarHBondContact O-N 3.44Å; L432-L435 PolarHBondContact O-N 3.39Å; L432-A436 VanDerWaalsContact O-CB 3.23Å; L432-A436 WeakPolarHBondContact O-CB 3.14Å; L432-A436 PolarHBondContact O-N 2.9Å
433	P	91.2	Very high	91.9	Very high	18 Å²	18	17.8 Å²	17.8	12%	0.117	11%	0.109	C	C	.	.	H	α-helix	trans	-57.2	-40.7	172.1	-27.8	37.9	0	0	0	113.2	Y317 D400 V403 G429 V431 W437	Y317-P433 HydrophobicContact CE1-CB 4.12Å; Y317-P433 PolarHBondContact OH-O 3.22Å; Y317-P433 VanDerWaalsContact OH-O 3.06Å; D400-P433 WeakPolarHBondContact OD1-CB 3.25Å; V403-P433 HydrophobicContact CG1-CG 3.94Å; G429-P433 VanDerWaalsContact O-CD 3.26Å; G429-P433 WeakPolarHBondContact O-CD 3.47Å; G429-P433 WeakPolarHBondContact O-CG 3.46Å; V431-P433 VanDerWaalsContact C-CD 3.49Å; P433-W437 WeakPolarHBondContact O-CB 3.01Å; P433-W437 PolarHBondContact O-N 2.83Å
434	A	92	Very high	91.7	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.008	13%	0.133	C	C	.	.	H	α-helix	trans	-64.4	-46.5	177.9	0	0	0	0	0	112.4	L312 L315 Y317 V431 L432 W437 G438	L312-A434 HydrophobicContact CD2-CB 3.6Å; L315-A434 HydrophobicContact CD1-CB 3.91Å; Y317-A434 HydrophobicContact CD1-CB 3.83Å; Y317-A434 HydrophobicContact CD2-CB 3.57Å; Y317-A434 HydrophobicContact CE1-CB 3.76Å; Y317-A434 HydrophobicContact CE2-CB 3.54Å; Y317-A434 HydrophobicContact CG-CB 3.71Å; Y317-A434 VanDerWaalsContact OH-CA 3.29Å; Y317-A434 WeakPolarHBondContact OH-CA 3.46Å; V431-A434 WeakPolarHBondContact O-CB 3.23Å; V431-A434 PolarHBondContact O-N 3.38Å; L432-A434 VanDerWaalsContact C-N 3.29Å; L432-A434 PolarHBondContact O-N 3.44Å; A434-W437 PolarHBondContact O-N 2.89Å; A434-G438 PolarHBondContact O-N 3.09Å
435	L	91.8	Very high	91.6	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-71.9	-37.7	179.3	-75	172.9	0	0	0	112.9	A35 A36 L311 L374 V431 L432 W437 G438 F439 C450	A35-L435 HydrophobicContact CB-CB 3.58Å; A35-L435 HydrophobicContact CB-CD1 3.34Å; A35-L435 HydrophobicContact CB-CG 4.08Å; A35-L435 WeakPolarHBondContact O-CD1 3.26Å; A36-L435 HydrophobicContact CB-CD1 3.42Å; A36-L435 VanDerWaalsContact CB-CD1 3.42Å; L311-L435 HydrophobicContact CD2-CD1 4.39Å; L311-L435 HydrophobicContact CD2-CD2 3.83Å; L311-L435 HydrophobicContact CD2-CG 4.35Å; L374-L435 HydrophobicContact CD1-CB 4.41Å; V431-L435 HydrophobicContact CG1-CD1 4.03Å; V431-L435 PolarHBondContact O-N 3.1Å; V431-L435 VanDerWaalsContact O-N 3.14Å; L432-L435 PolarHBondContact O-N 3.39Å; L435-W437 VanDerWaalsContact C-N 3.32Å; L435-W437 PolarHBondContact O-N 3.25Å; L435-G438 PolarHBondContact O-N 3.17Å; L435-F439 HydrophobicContact CB-CD2 4.41Å; L435-F439 HydrophobicContact CD2-CD2 4.37Å; L435-F439 HydrophobicContact CD2-CE2 3.9Å; L435-F439 WeakPolarHBondContact O-CB 3.4Å; L435-F439 VanDerWaalsContact O-CD2 3.27Å; L435-F439 WeakPolarHBondContact O-CD2 2.71Å; L435-F439 PolarHBondContact O-N 3.39Å; L435-C450 HydrophobicContact CD2-CB 4.4Å; L435-C450 VanDerWaalsContact CD2-SG 3.57Å
436	A	90.1	Very high	91.7	Very high	6 Å²	6	30.8 Å²	30.8	5%	0.05	17%	0.171	C	C	.	.	H	α-helix	trans	-60.9	-44.3	173	0	0	0	0	0	110.7	L399 V403 L432 L440	L399-A436 HydrophobicContact CD1-CB 4.48Å; V403-A436 HydrophobicContact CG2-CB 4.19Å; L432-A436 VanDerWaalsContact O-CB 3.23Å; L432-A436 WeakPolarHBondContact O-CB 3.14Å; L432-A436 PolarHBondContact O-N 2.9Å; A436-L440 WeakPolarHBondContact O-CA 3.28Å; A436-L440 WeakPolarHBondContact O-CB 3.44Å; A436-L440 PolarHBondContact O-N 3.2Å
437	W	92	Very high	91.6	Very high	17 Å²	17	33.5 Å²	33.5	6%	0.064	18%	0.179	C	C	.	.	H	α-helix	trans	-66.6	-39.3	175.5	-174.6	-114.3	0	0	0	112.7	Y317 D392 K395 R396 L399 P433 A434 L435 G441 P442 Y446	Y317-W437 VanDerWaalsContact OH-CB 3.27Å; Y317-W437 WeakPolarHBondContact OH-CB 3.35Å; D392-W437 HydrophobicContact CB-CH2 3.97Å; D392-W437 HydrophobicContact CB-CZ2 4.32Å; D392-W437 WeakPolarHBondContact O-CH2 3.13Å; K395-W437 HydrophobicContact CB-CH2 4.26Å; K395-W437 HydrophobicContact CB-CZ3 3.82Å; R396-W437 VanDerWaalsContact CA-CZ3 3.47Å; R396-W437 HydrophobicContact CB-CD2 4.3Å; R396-W437 HydrophobicContact CB-CE3 3.83Å; R396-W437 HydrophobicContact CB-CH2 3.87Å; R396-W437 HydrophobicContact CB-CZ2 4.31Å; R396-W437 HydrophobicContact CB-CZ3 3.63Å; R396-W437 HydrophobicContact CG-CD2 4.45Å; R396-W437 HydrophobicContact CG-CE3 4.36Å; R396-W437 VanDerWaalsContact N-CZ3 3.29Å; L399-W437 HydrophobicContact CD1-CE3 3.82Å; L399-W437 HydrophobicContact CD1-CZ3 4.47Å; P433-W437 WeakPolarHBondContact O-CB 3.01Å; P433-W437 PolarHBondContact O-N 2.83Å; A434-W437 PolarHBondContact O-N 2.89Å; L435-W437 VanDerWaalsContact C-N 3.32Å; L435-W437 PolarHBondContact O-N 3.25Å; W437-G441 WeakPolarHBondContact O-CA 3.35Å; W437-G441 PolarHBondContact O-N 2.93Å; W437-P442 HydrophobicContact CH2-CG 3.97Å; W437-P442 HydrophobicContact CZ2-CG 4.34Å; W437-Y446 AromaticContact CD1-CD2 3.55Å; W437-Y446 AromaticContact CD1-CE2 3.86Å; W437-Y446 AromaticContact NE1-CD2 3.62Å; W437-Y446 AromaticContact NE1-CE2 3.77Å
438	G	92.5	Very high	91.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.1	-48	177.1	0	0	0	0	0	112.9	A434 L435 F447	A434-G438 PolarHBondContact O-N 3.09Å; L435-G438 PolarHBondContact O-N 3.17Å; G438-F447 WeakPolarHBondContact O-CA 3.43Å; G438-F447 WeakPolarHBondContact O-CB 3.46Å; G438-F447 PolarHBondContact O-N 3.45Å
439	F	91	Very high	91.7	Very high	18 Å²	18	38 Å²	38	8%	0.079	20%	0.2	C	C	.	.	H	α-helix	trans	-78.8	-32.4	-177.9	-75.1	-63.5	0	0	0	114.6	L374 L435 F447 C450 R454	L374-F439 HydrophobicContact CB-CD2 4.21Å; L374-F439 HydrophobicContact CD1-CD2 3.61Å; L374-F439 HydrophobicContact CD1-CE2 3.71Å; L374-F439 HydrophobicContact CD2-CD2 4.18Å; L374-F439 HydrophobicContact CG-CD2 4.22Å; L435-F439 HydrophobicContact CB-CD2 4.41Å; L435-F439 HydrophobicContact CD2-CD2 4.37Å; L435-F439 HydrophobicContact CD2-CE2 3.9Å; L435-F439 WeakPolarHBondContact O-CB 3.4Å; L435-F439 VanDerWaalsContact O-CD2 3.27Å; L435-F439 WeakPolarHBondContact O-CD2 2.71Å; L435-F439 PolarHBondContact O-N 3.39Å; F439-F447 HydrophobicContact CD1-CD2 4.39Å; F439-F447 HydrophobicContact CD1-CE2 4.25Å; F439-C450 HydrophobicContact CD1-CB 4.03Å; F439-C450 HydrophobicContact CD2-CB 4.13Å; F439-C450 HydrophobicContact CE1-CB 3.66Å; F439-C450 HydrophobicContact CE2-CB 3.82Å; F439-C450 HydrophobicContact CG-CB 4.25Å; F439-C450 HydrophobicContact CZ-CB 3.58Å; F439-C450 VanDerWaalsContact CZ-O 3.27Å; F439-C450 WeakPolarHBondContact CZ-O 3.41Å; F439-R454 HydrophobicContact CZ-CB 4.11Å
440	L	90.2	Very high	91.8	Very high	29 Å²	29	36.9 Å²	36.9	15%	0.152	19%	0.188	C	C	.	.	H	α-helix	trans	-113.8	-11.1	-171.5	-50.7	177.7	0	0	0	113.4	P377 V381 T385 L399 A436	P377-L440 HydrophobicContact CB-CD1 3.84Å; P377-L440 HydrophobicContact CB-CD2 4.02Å; P377-L440 HydrophobicContact CG-CD1 4.43Å; P377-L440 HydrophobicContact CG-CD2 3.69Å; V381-L440 HydrophobicContact CG1-CD1 3.84Å; T385-L440 VanDerWaalsContact CB-O 3.24Å; T385-L440 WeakPolarHBondContact CB-O 3.36Å; T385-L440 HydrophobicContact CG2-CB 4.25Å; L399-L440 HydrophobicContact CD1-CB 4.3Å; L399-L440 HydrophobicContact CD2-CD1 4.45Å; A436-L440 WeakPolarHBondContact O-CA 3.28Å; A436-L440 WeakPolarHBondContact O-CB 3.44Å; A436-L440 PolarHBondContact O-N 3.2Å
441	G	89.5	Confident	91.7	Very high	15 Å²	15	36.8 Å²	36.8	16%	0.155	19%	0.186	C	C	.	.	S	Bend	trans	-74.3	170.3	177.7	0	0	0	0	0	112.5	W437 N443	W437-G441 WeakPolarHBondContact O-CA 3.35Å; W437-G441 PolarHBondContact O-N 2.93Å; G441-N443 VanDerWaalsContact C-N 3.31Å
442	P	88.9	Confident	91.8	Very high	53 Å²	53	40.3 Å²	40.3	34%	0.344	20%	0.2	S	C	.	.	S	Bend	trans	-82	-6.4	-179	31.3	-30.3	0	0	0	113.7	D392 K395 W437 E444	D392-P442 HydrophobicContact CB-CG 4.17Å; D392-P442 WeakPolarHBondContact OD1-CG 3.39Å; K395-P442 HydrophobicContact CD-CG 4.28Å; W437-P442 HydrophobicContact CH2-CG 3.97Å; W437-P442 HydrophobicContact CZ2-CG 4.34Å; P442-E444 PolarHBondContact O-N 3.09Å
443	N	89.9	Confident	92	Very high	55 Å²	55	40 Å²	40	29%	0.294	20%	0.198	S	C	.	.			trans	-83.7	106.4	-177.7	-175.1	-23.8	0	0	0	110.7	G441 N445 Y446 F447	G441-N443 VanDerWaalsContact C-N 3.31Å; N443-N445 VanDerWaalsContact C-N 3.31Å; N443-N445 PolarHBondContact O-N 2.87Å; N443-N445 WeakPolarHBondContact OD1-CB 3.26Å; N443-N445 PolarHBondContact OD1-N 3.34Å; N443-Y446 HydrophobicContact CB-CD2 4.15Å; N443-Y446 HydrophobicContact CB-CG 4.13Å; N443-Y446 PolarHBondContact O-N 2.81Å; N443-Y446 PolarHBondContact OD1-N 3.24Å; N443-F447 PolarHBondContact O-N 3.33Å
444	E	91.2	Very high	92	Very high	160 Å²	160	42.1 Å²	42.1	75%	0.748	20%	0.204	S	C	*	.	H	α-helix	trans	-61.6	-33.9	-179.1	-64.2	-175.6	170.2	0	0	113.3	P442 F447 H448	P442-E444 PolarHBondContact O-N 3.09Å; E444-F447 WeakPolarHBondContact O-CB 3.41Å; E444-F447 PolarHBondContact O-N 3.44Å; E444-H448 WeakPolarHBondContact O-CB 3.41Å; E444-H448 PolarHBondContact O-N 2.92Å
445	N	93	Very high	92.1	Very high	115 Å²	115	46.1 Å²	46.1	62%	0.615	22%	0.222	S	C	*	.	H	α-helix	trans	-66.7	-41.7	177.7	-65.7	-8.5	0	0	0	110.8	N443 F447 H448 I449	N443-N445 VanDerWaalsContact C-N 3.31Å; N443-N445 PolarHBondContact O-N 2.87Å; N443-N445 WeakPolarHBondContact OD1-CB 3.26Å; N443-N445 PolarHBondContact OD1-N 3.34Å; N445-F447 VanDerWaalsContact C-N 3.33Å; N445-H448 WeakPolarHBondContact O-CB 3.19Å; N445-H448 PolarHBondContact O-N 2.89Å; N445-I449 VanDerWaalsContact O-CG1 3.28Å; N445-I449 WeakPolarHBondContact O-CG1 3.48Å; N445-I449 PolarHBondContact O-N 3.18Å
446	Y	93.6	Very high	92.2	Very high	57 Å²	57	47.2 Å²	47.2	22%	0.224	23%	0.228	C	C	.	.	H	α-helix	trans	-69	-35.9	177.6	-70.3	1.3	0	0	0	111.8	L315 W437 N443 I449 C450	L315-Y446 HydrophobicContact CD2-CD1 4.03Å; L315-Y446 HydrophobicContact CD2-CD2 4.24Å; L315-Y446 HydrophobicContact CD2-CG 3.79Å; L315-Y446 PolarHBondContact O-OH 2.89Å; W437-Y446 AromaticContact CD1-CD2 3.55Å; W437-Y446 AromaticContact CD1-CE2 3.86Å; W437-Y446 AromaticContact NE1-CD2 3.62Å; W437-Y446 AromaticContact NE1-CE2 3.77Å; N443-Y446 HydrophobicContact CB-CD2 4.15Å; N443-Y446 HydrophobicContact CB-CG 4.13Å; N443-Y446 PolarHBondContact O-N 2.81Å; N443-Y446 PolarHBondContact OD1-N 3.24Å; Y446-I449 HydrophobicContact CD1-CD1 4.36Å; Y446-C450 WeakPolarHBondContact O-CB 3.47Å; Y446-C450 PolarHBondContact O-N 3.27Å; Y446-C450 VanDerWaalsContact O-N 3.11Å; Y446-C450 PolarHBondContact O-SG 3.41Å; Y446-C450 VanDerWaalsContact O-SG 3.39Å
447	F	93.3	Very high	92.3	Very high	91 Å²	91	47.9 Å²	47.9	40%	0.399	23%	0.23	S	C	.	.	H	α-helix	trans	-58.2	-52.5	169.5	178.6	-92.6	0	0	0	110.4	G438 F439 N443 E444 N445 I449 C450 D451	G438-F447 WeakPolarHBondContact O-CA 3.43Å; G438-F447 WeakPolarHBondContact O-CB 3.46Å; G438-F447 PolarHBondContact O-N 3.45Å; F439-F447 HydrophobicContact CD1-CD2 4.39Å; F439-F447 HydrophobicContact CD1-CE2 4.25Å; N443-F447 PolarHBondContact O-N 3.33Å; E444-F447 WeakPolarHBondContact O-CB 3.41Å; E444-F447 PolarHBondContact O-N 3.44Å; N445-F447 VanDerWaalsContact C-N 3.33Å; F447-I449 PolarHBondContact O-N 2.94Å; F447-C450 PolarHBondContact O-N 3.41Å; F447-D451 HydrophobicContact CE1-CB 4.19Å; F447-D451 HydrophobicContact CZ-CB 4.49Å; F447-D451 WeakPolarHBondContact CZ-OD1 3.17Å; F447-D451 VanDerWaalsContact O-CB 3.3Å; F447-D451 WeakPolarHBondContact O-CB 3.47Å; F447-D451 PolarHBondContact O-N 3.43Å
448	H	94.5	Very high	92.3	Very high	86 Å²	86	48.4 Å²	48.4	40%	0.398	23%	0.234	S	C	.	.	H	α-helix	trans	-55.3	-47.3	179.6	179.1	-100.4	0	0	0	113.1	E444 N445 C450 D451 R452 E602	E444-H448 WeakPolarHBondContact O-CB 3.41Å; E444-H448 PolarHBondContact O-N 2.92Å; N445-H448 WeakPolarHBondContact O-CB 3.19Å; N445-H448 PolarHBondContact O-N 2.89Å; H448-C450 PolarHBondContact O-N 3.26Å; H448-D451 PolarHBondContact O-N 3.43Å; H448-R452 WeakPolarHBondContact CE1-CD 3.49Å; H448-R452 WeakPolarHBondContact O-CG 3.37Å; H448-R452 PolarHBondContact O-N 3.2Å; H448-E602 IonicContact CE1-OE1 2.81Å; H448-E602 PolarHBondContact CE1-OE1 2.86Å; H448-E602 IonicContact CE1-OE2 2.73Å; H448-E602 IonicContact ND1-OE1 3.37Å; H448-E602 PolarHBondContact ND1-OE1 2.84Å; H448-E602 IonicContact ND1-OE2 2.94Å; H448-E602 PolarHBondContact ND1-OE2 3.01Å
449	I	93.8	Very high	92.4	Very high	11 Å²	11	50.7 Å²	50.7	6%	0.056	25%	0.25	C	C	.	.	H	α-helix	trans	-58.7	-49.6	177.2	-66.3	162.5	0	0	0	110.8	L311 C314 L315 N445 Y446 F447 D451 F453 E602	L311-I449 HydrophobicContact CD1-CG2 4.1Å; C314-I449 HydrophobicContact CB-CD1 4.36Å; C314-I449 HydrophobicContact CB-CG2 4.27Å; L315-I449 HydrophobicContact CD2-CG2 4.44Å; N445-I449 VanDerWaalsContact O-CG1 3.28Å; N445-I449 WeakPolarHBondContact O-CG1 3.48Å; N445-I449 PolarHBondContact O-N 3.18Å; Y446-I449 HydrophobicContact CD1-CD1 4.36Å; F447-I449 PolarHBondContact O-N 2.94Å; I449-D451 VanDerWaalsContact C-N 3.33Å; I449-D451 PolarHBondContact O-N 3.33Å; I449-F453 WeakPolarHBondContact O-CB 3.25Å; I449-F453 PolarHBondContact O-N 3.44Å; I449-E602 HydrophobicContact CG1-CB 4.2Å; I449-E602 HydrophobicContact CG1-CG 3.88Å; I449-E602 WeakPolarHBondContact CG1-OE2 3.31Å
450	C	92.5	Very high	92.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.4	-38.3	179.1	-76	0	0	0	0	112.3	L435 F439 Y446 F447 H448 F453 R454	L435-C450 HydrophobicContact CD2-CB 4.4Å; L435-C450 VanDerWaalsContact CD2-SG 3.57Å; F439-C450 HydrophobicContact CD1-CB 4.03Å; F439-C450 HydrophobicContact CD2-CB 4.13Å; F439-C450 HydrophobicContact CE1-CB 3.66Å; F439-C450 HydrophobicContact CE2-CB 3.82Å; F439-C450 HydrophobicContact CG-CB 4.25Å; F439-C450 HydrophobicContact CZ-CB 3.58Å; F439-C450 VanDerWaalsContact CZ-O 3.27Å; F439-C450 WeakPolarHBondContact CZ-O 3.41Å; Y446-C450 WeakPolarHBondContact O-CB 3.47Å; Y446-C450 PolarHBondContact O-N 3.27Å; Y446-C450 VanDerWaalsContact O-N 3.11Å; Y446-C450 PolarHBondContact O-SG 3.41Å; Y446-C450 VanDerWaalsContact O-SG 3.39Å; F447-C450 PolarHBondContact O-N 3.41Å; H448-C450 PolarHBondContact O-N 3.26Å; C450-F453 PolarHBondContact O-N 3.08Å; C450-R454 WeakPolarHBondContact O-CB 3.35Å; C450-R454 PolarHBondContact O-N 3.5Å
451	D	92	Very high	92.8	Very high	27 Å²	27	49.8 Å²	49.8	14%	0.144	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-50.6	179.1	-142.1	68.1	0	0	0	111	F447 H448 I449 F453 R454 E455	F447-D451 HydrophobicContact CE1-CB 4.19Å; F447-D451 HydrophobicContact CZ-CB 4.49Å; F447-D451 WeakPolarHBondContact CZ-OD1 3.17Å; F447-D451 VanDerWaalsContact O-CB 3.3Å; F447-D451 WeakPolarHBondContact O-CB 3.47Å; F447-D451 PolarHBondContact O-N 3.43Å; H448-D451 PolarHBondContact O-N 3.43Å; I449-D451 VanDerWaalsContact C-N 3.33Å; I449-D451 PolarHBondContact O-N 3.33Å; D451-F453 VanDerWaalsContact C-N 3.33Å; D451-F453 PolarHBondContact O-N 2.96Å; D451-R454 WeakPolarHBondContact O-CB 3.42Å; D451-R454 PolarHBondContact O-N 3.37Å; D451-R454 VanDerWaalsContact O-N 3.11Å; D451-R454 IonicContact OD1-CZ 3.62Å; D451-R454 IonicContact OD1-NH1 3.36Å; D451-R454 PolarHBondContact OD1-NH1 3.1Å; D451-R454 IonicContact OD1-NH2 2.89Å; D451-R454 PolarHBondContact OD1-NH2 3Å; D451-R454 IonicContact OD2-NH2 3.85Å; D451-R454 PolarHBondContact OD2-NH2 3.02Å; D451-R454 VanDerWaalsContact OD2-NH2 3.1Å; D451-E455 WeakPolarHBondContact O-CG 3.29Å; D451-E455 PolarHBondContact O-N 3.46Å
452	R	94.6	Very high	93.1	Very high	74 Å²	74	54.1 Å²	54.1	28%	0.279	26%	0.257	S	S	.	.	H	α-helix	trans	-59.7	-42.8	174.9	-72.5	-172.2	69.4	-168.8	6.2	112.1	H448 R454 E455 I456 M598 E602	H448-R452 WeakPolarHBondContact CE1-CD 3.49Å; H448-R452 WeakPolarHBondContact O-CG 3.37Å; H448-R452 PolarHBondContact O-N 3.2Å; R452-R454 VanDerWaalsContact C-N 3.32Å; R452-R454 PolarHBondContact O-N 2.99Å; R452-E455 PolarHBondContact O-N 3.12Å; R452-I456 VanDerWaalsContact O-CG1 3.26Å; R452-I456 WeakPolarHBondContact O-CG1 3.37Å; R452-I456 PolarHBondContact O-N 3.31Å; R452-M598 HydrophobicContact CB-CG 4.09Å; R452-M598 HydrophobicContact CB-SD 4.48Å; R452-E602 WeakPolarHBondContact CD-OE1 3.25Å; R452-E602 IonicContact CZ-OE1 3.03Å; R452-E602 IonicContact NH1-OE1 2.73Å; R452-E602 PolarHBondContact NH1-OE1 3.48Å
453	F	94.3	Very high	93.3	Very high	7 Å²	7	52.8 Å²	52.8	3%	0.031	25%	0.246	C	C	.	.	H	α-helix	trans	-56.8	-46.7	174.4	174.6	-100.6	0	0	0	111.7	A36 L311 I449 C450 D451 I457 L595 M598 F599	A36-F453 HydrophobicContact CB-CE1 4.27Å; A36-F453 HydrophobicContact CB-CZ 4.44Å; L311-F453 HydrophobicContact CD1-CB 4.43Å; L311-F453 HydrophobicContact CD1-CG 4.33Å; L311-F453 HydrophobicContact CD2-CD1 4.02Å; L311-F453 HydrophobicContact CD2-CD2 4.44Å; L311-F453 HydrophobicContact CD2-CE1 3.86Å; L311-F453 HydrophobicContact CD2-CE2 4.31Å; L311-F453 HydrophobicContact CD2-CG 4.29Å; L311-F453 HydrophobicContact CD2-CZ 4Å; I449-F453 WeakPolarHBondContact O-CB 3.25Å; I449-F453 PolarHBondContact O-N 3.44Å; C450-F453 PolarHBondContact O-N 3.08Å; D451-F453 VanDerWaalsContact C-N 3.33Å; D451-F453 PolarHBondContact O-N 2.96Å; F453-I457 HydrophobicContact CD1-CD1 4.01Å; F453-I457 HydrophobicContact CD2-CD1 4.36Å; F453-I457 HydrophobicContact CE1-CD1 3.42Å; F453-I457 VanDerWaalsContact CE1-CD1 3.42Å; F453-I457 HydrophobicContact CE2-CD1 3.81Å; F453-I457 HydrophobicContact CG-CD1 4.45Å; F453-I457 HydrophobicContact CZ-CD1 3.32Å; F453-I457 WeakPolarHBondContact O-CG1 3.29Å; F453-I457 PolarHBondContact O-N 3.37Å; F453-L595 HydrophobicContact CD2-CD2 3.62Å; F453-L595 HydrophobicContact CE2-CD2 4.03Å; F453-M598 HydrophobicContact CB-CE 3.94Å; F453-M598 HydrophobicContact CD2-CE 4.28Å; F453-F599 AromaticContact CD2-CZ 3.8Å; F453-F599 HydrophobicContact CD2-CZ 3.8Å; F453-F599 HydrophobicContact CE2-CZ 4.22Å
454	R	91.9	Very high	93.6	Very high	62 Å²	62	50.1 Å²	50.1	23%	0.234	23%	0.232	C	C	.	.	H	α-helix	trans	-61.9	-47.5	176.2	-178.9	-174.3	76.4	-133.2	-5.3	111.4	F371 F439 C450 D451 R452 I456 I457 I458	F371-R454 HydrophobicContact CD1-CB 4.35Å; F371-R454 HydrophobicContact CD1-CG 3.7Å; F371-R454 HydrophobicContact CD2-CG 3.99Å; F371-R454 HydrophobicContact CE1-CB 3.98Å; F371-R454 HydrophobicContact CE1-CG 3.74Å; F371-R454 HydrophobicContact CE2-CG 4.02Å; F371-R454 HydrophobicContact CG-CG 3.83Å; F371-R454 HydrophobicContact CZ-CB 4.16Å; F371-R454 HydrophobicContact CZ-CG 3.9Å; F439-R454 HydrophobicContact CZ-CB 4.11Å; C450-R454 WeakPolarHBondContact O-CB 3.35Å; C450-R454 PolarHBondContact O-N 3.5Å; D451-R454 WeakPolarHBondContact O-CB 3.42Å; D451-R454 PolarHBondContact O-N 3.37Å; D451-R454 VanDerWaalsContact O-N 3.11Å; D451-R454 IonicContact OD1-CZ 3.62Å; D451-R454 IonicContact OD1-NH1 3.36Å; D451-R454 PolarHBondContact OD1-NH1 3.1Å; D451-R454 IonicContact OD1-NH2 2.89Å; D451-R454 PolarHBondContact OD1-NH2 3Å; D451-R454 IonicContact OD2-NH2 3.85Å; D451-R454 PolarHBondContact OD2-NH2 3.02Å; D451-R454 VanDerWaalsContact OD2-NH2 3.1Å; R452-R454 VanDerWaalsContact C-N 3.32Å; R452-R454 PolarHBondContact O-N 2.99Å; R454-I456 PolarHBondContact O-N 2.92Å; R454-I457 PolarHBondContact O-N 3.28Å; R454-I458 HydrophobicContact CG-CD1 3.7Å; R454-I458 HydrophobicContact CG-CG1 4.25Å; R454-I458 VanDerWaalsContact O-CG1 3.32Å; R454-I458 WeakPolarHBondContact O-CG1 3.35Å; R454-I458 PolarHBondContact O-N 2.77Å
455	E	92.8	Very high	93.8	Very high	84 Å²	84	42.7 Å²	42.7	39%	0.393	20%	0.197	S	C	.	.	H	α-helix	trans	-61.2	-41.5	-178.8	-73.5	-177.4	157.3	0	0	112.9	D451 R452 I457 I458 S459	D451-E455 WeakPolarHBondContact O-CG 3.29Å; D451-E455 PolarHBondContact O-N 3.46Å; R452-E455 PolarHBondContact O-N 3.12Å; E455-I457 VanDerWaalsContact C-N 3.34Å; E455-I457 PolarHBondContact O-N 2.66Å; E455-I458 PolarHBondContact O-N 2.88Å; E455-S459 VanDerWaalsContact O-CB 3.23Å; E455-S459 WeakPolarHBondContact O-CB 3.45Å; E455-S459 PolarHBondContact O-N 3.28Å; E455-S459 PolarHBondContact O-OG 2.98Å
456	I	94.3	Very high	93.8	Very high	24 Å²	24	41.3 Å²	41.3	12%	0.123	19%	0.189	C	C	.	.	H	α-helix	trans	-62.9	-42.9	176.9	-67.2	168.6	0	0	0	110.2	R452 R454 S459 F460 Y591 D594 L595 M598	R452-I456 VanDerWaalsContact O-CG1 3.26Å; R452-I456 WeakPolarHBondContact O-CG1 3.37Å; R452-I456 PolarHBondContact O-N 3.31Å; R454-I456 PolarHBondContact O-N 2.92Å; I456-S459 PolarHBondContact O-N 3.39Å; I456-F460 PolarHBondContact O-N 3.42Å; I456-Y591 HydrophobicContact CG2-CD1 3.72Å; I456-Y591 HydrophobicContact CG2-CE1 4.34Å; I456-Y591 VanDerWaalsContact O-CD1 3.3Å; I456-Y591 WeakPolarHBondContact O-CD1 3.14Å; I456-Y591 VanDerWaalsContact O-CE1 3.3Å; I456-Y591 WeakPolarHBondContact O-CE1 3.44Å; I456-D594 HydrophobicContact CG2-CB 4.24Å; I456-L595 HydrophobicContact CB-CD2 3.95Å; I456-L595 HydrophobicContact CD1-CD2 4.11Å; I456-L595 HydrophobicContact CG2-CD2 3.69Å; I456-L595 HydrophobicContact CG2-CG 3.73Å; I456-M598 HydrophobicContact CD1-CB 3.75Å; I456-M598 HydrophobicContact CD1-CE 4.35Å; I456-M598 HydrophobicContact CD1-CG 3.96Å
457	I	92.4	Very high	93.6	Very high	21 Å²	21	39.4 Å²	39.4	11%	0.108	18%	0.183	C	C	.	.	H	α-helix	trans	-66.2	-44.7	176.4	-68.2	172.4	0	0	0	111.6	L367 F371 F453 R454 E455 S459 F460 I461	L367-I457 HydrophobicContact CD1-CG2 4.33Å; F371-I457 HydrophobicContact CE2-CB 4.21Å; F371-I457 HydrophobicContact CE2-CG2 3.82Å; F371-I457 HydrophobicContact CZ-CB 4.32Å; F371-I457 HydrophobicContact CZ-CD1 4.08Å; F371-I457 HydrophobicContact CZ-CG2 4.25Å; F453-I457 HydrophobicContact CD1-CD1 4.01Å; F453-I457 HydrophobicContact CD2-CD1 4.36Å; F453-I457 HydrophobicContact CE1-CD1 3.42Å; F453-I457 VanDerWaalsContact CE1-CD1 3.42Å; F453-I457 HydrophobicContact CE2-CD1 3.81Å; F453-I457 HydrophobicContact CG-CD1 4.45Å; F453-I457 HydrophobicContact CZ-CD1 3.32Å; F453-I457 WeakPolarHBondContact O-CG1 3.29Å; F453-I457 PolarHBondContact O-N 3.37Å; R454-I457 PolarHBondContact O-N 3.28Å; E455-I457 VanDerWaalsContact C-N 3.34Å; E455-I457 PolarHBondContact O-N 2.66Å; I457-S459 VanDerWaalsContact C-N 3.28Å; I457-S459 PolarHBondContact O-N 3.18Å; I457-F460 WeakPolarHBondContact O-CB 3.08Å; I457-F460 PolarHBondContact O-N 3.32Å; I457-I461 HydrophobicContact CG2-CD1 3.86Å; I457-I461 HydrophobicContact CG2-CG1 4.5Å; I457-I461 VanDerWaalsContact O-CG1 3.3Å; I457-I461 WeakPolarHBondContact O-CG1 3.24Å; I457-I461 PolarHBondContact O-N 2.95Å
458	I	91.9	Very high	93	Very high	27 Å²	27	39 Å²	39	14%	0.138	18%	0.179	C	C	.	.	H	α-helix	trans	-62	-40.6	177.8	-69.9	178.3	0	0	0	110.4	F267 F371 R454 E455 I461 R462	F267-I458 HydrophobicContact CE2-CD1 4.32Å; F267-I458 HydrophobicContact CE2-CG1 4.35Å; F267-I458 HydrophobicContact CE2-CG2 4.11Å; F267-I458 HydrophobicContact CZ-CB 4.39Å; F267-I458 HydrophobicContact CZ-CD1 4.48Å; F267-I458 HydrophobicContact CZ-CG1 4.02Å; F267-I458 HydrophobicContact CZ-CG2 3.87Å; F371-I458 HydrophobicContact CD2-CG1 4.34Å; F371-I458 HydrophobicContact CE2-CG1 4.44Å; R454-I458 HydrophobicContact CG-CD1 3.7Å; R454-I458 HydrophobicContact CG-CG1 4.25Å; R454-I458 VanDerWaalsContact O-CG1 3.32Å; R454-I458 WeakPolarHBondContact O-CG1 3.35Å; R454-I458 PolarHBondContact O-N 2.77Å; E455-I458 PolarHBondContact O-N 2.88Å; I458-I461 PolarHBondContact O-N 2.88Å; I458-R462 HydrophobicContact CG2-CG 4.44Å; I458-R462 WeakPolarHBondContact O-CG 3.3Å; I458-R462 PolarHBondContact O-N 3.29Å
459	S	94.4	Very high	91.9	Very high	48 Å²	48	38 Å²	38	34%	0.336	18%	0.178	S	C	.	.	H	α-helix	trans	-63.8	-43.5	177.5	-61	0	0	0	0	111.3	E455 I456 I457 I461 R462 E463 Y591	E455-S459 VanDerWaalsContact O-CB 3.23Å; E455-S459 WeakPolarHBondContact O-CB 3.45Å; E455-S459 PolarHBondContact O-N 3.28Å; E455-S459 PolarHBondContact O-OG 2.98Å; I456-S459 PolarHBondContact O-N 3.39Å; I457-S459 VanDerWaalsContact C-N 3.28Å; I457-S459 PolarHBondContact O-N 3.18Å; S459-I461 PolarHBondContact O-N 2.74Å; S459-R462 PolarHBondContact O-N 3.06Å; S459-E463 VanDerWaalsContact O-CB 3.27Å; S459-E463 WeakPolarHBondContact O-CB 3.4Å; S459-E463 PolarHBondContact O-N 3.21Å; S459-Y591 VanDerWaalsContact C-OH 3.24Å; S459-Y591 WeakPolarHBondContact CB-OH 3.38Å; S459-Y591 PolarHBondContact O-OH 3.38Å
460	F	94.9	Very high	90.3	Very high	27 Å²	27	40.3 Å²	40.3	12%	0.118	20%	0.198	C	C	.	.	H	α-helix	trans	-55.7	-49.7	171.6	163.4	-108.9	0	0	0	111.9	I363 I456 I457 R462 E463 S464 L584 L587 I588 Y591	I363-F460 HydrophobicContact CD1-CE1 4.45Å; I456-F460 PolarHBondContact O-N 3.42Å; I457-F460 WeakPolarHBondContact O-CB 3.08Å; I457-F460 PolarHBondContact O-N 3.32Å; F460-R462 PolarHBondContact O-N 3.48Å; F460-E463 PolarHBondContact O-N 3.49Å; F460-S464 PolarHBondContact O-N 3Å; F460-L584 HydrophobicContact CE2-CD1 4.29Å; F460-L584 HydrophobicContact CZ-CD1 4.33Å; F460-L587 HydrophobicContact CD2-CD2 3.84Å; F460-L587 HydrophobicContact CD2-CG 3.97Å; F460-L587 HydrophobicContact CE2-CD2 3.82Å; F460-L587 HydrophobicContact CE2-CG 4.1Å; F460-I588 HydrophobicContact CD2-CG1 4.5Å; F460-I588 HydrophobicContact CE2-CB 4.48Å; F460-I588 HydrophobicContact CE2-CD1 4.4Å; F460-I588 HydrophobicContact CE2-CG1 3.43Å; F460-I588 VanDerWaalsContact CE2-CG1 3.43Å; F460-I588 HydrophobicContact CZ-CD1 4.18Å; F460-I588 HydrophobicContact CZ-CG1 3.57Å; F460-Y591 HydrophobicContact CB-CD1 3.64Å; F460-Y591 HydrophobicContact CB-CD2 3.91Å; F460-Y591 HydrophobicContact CB-CE1 3.96Å; F460-Y591 HydrophobicContact CB-CE2 4.2Å; F460-Y591 HydrophobicContact CB-CG 3.6Å; F460-Y591 AromaticContact CD2-CD2 3.93Å; F460-Y591 HydrophobicContact CD2-CD2 3.93Å; F460-Y591 HydrophobicContact CD2-CG 4.15Å; F460-Y591 HydrophobicContact CG-CD2 4.41Å; F460-Y591 HydrophobicContact CG-CG 4.28Å; F460-Y591 VanDerWaalsContact N-CE1 3.27Å
461	I	94.9	Very high	88.5	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-61.4	-48.3	-178.2	-64.9	163.7	0	0	0	109.7	F267 V268 I363 L368 I457 I458 S459 E463 S464 F465	F267-I461 HydrophobicContact CE1-CG2 3.97Å; V268-I461 HydrophobicContact CG1-CG2 4.23Å; I363-I461 HydrophobicContact CG2-CD1 3.77Å; I363-I461 HydrophobicContact CG2-CG1 3.92Å; I363-I461 HydrophobicContact CG2-CG2 4.14Å; L368-I461 HydrophobicContact CD2-CD1 3.78Å; L368-I461 HydrophobicContact CG-CD1 4.38Å; I457-I461 HydrophobicContact CG2-CD1 3.86Å; I457-I461 HydrophobicContact CG2-CG1 4.5Å; I457-I461 VanDerWaalsContact O-CG1 3.3Å; I457-I461 WeakPolarHBondContact O-CG1 3.24Å; I457-I461 PolarHBondContact O-N 2.95Å; I458-I461 PolarHBondContact O-N 2.88Å; S459-I461 PolarHBondContact O-N 2.74Å; I461-E463 PolarHBondContact O-N 3.27Å; I461-S464 PolarHBondContact O-N 3.37Å; I461-S464 PolarHBondContact O-OG 3.05Å; I461-F465 VanDerWaalsContact O-CD2 3.32Å; I461-F465 WeakPolarHBondContact O-CD2 3.33Å
462	R	95.4	Very high	86.4	Confident	107 Å²	107	45 Å²	45	40%	0.404	23%	0.23	S	C	.	.	H	α-helix	trans	-60.4	-46.1	177.3	-74.3	175.5	170.8	173.9	-1.7	112.4	F267 I458 S459 F460 S464 F465	F267-R462 PolarHBondContact O-NE 3.17Å; I458-R462 HydrophobicContact CG2-CG 4.44Å; I458-R462 WeakPolarHBondContact O-CG 3.3Å; I458-R462 PolarHBondContact O-N 3.29Å; S459-R462 PolarHBondContact O-N 3.06Å; F460-R462 PolarHBondContact O-N 3.48Å; R462-S464 PolarHBondContact O-N 2.86Å; R462-F465 PolarHBondContact O-N 3.19Å
463	E	94.7	Very high	84.1	Confident	24 Å²	24	43 Å²	43	11%	0.112	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-29.6	-178.5	-165.4	166.8	155.8	0	0	112	S459 F460 I461 F465 I466 R568 L572 L587 Y591	S459-E463 VanDerWaalsContact O-CB 3.27Å; S459-E463 WeakPolarHBondContact O-CB 3.4Å; S459-E463 PolarHBondContact O-N 3.21Å; F460-E463 PolarHBondContact O-N 3.49Å; I461-E463 PolarHBondContact O-N 3.27Å; E463-F465 PolarHBondContact O-N 2.92Å; E463-I466 HydrophobicContact CG-CD1 4.3Å; E463-I466 PolarHBondContact O-N 2.74Å; E463-R568 IonicContact OE2-CZ 2.95Å; E463-R568 IonicContact OE2-NH1 3.31Å; E463-R568 PolarHBondContact OE2-NH1 3.4Å; E463-L572 WeakPolarHBondContact O-CD1 3.34Å; E463-L587 HydrophobicContact CB-CD1 4.38Å; E463-L587 HydrophobicContact CB-CD2 4.31Å; E463-L587 HydrophobicContact CG-CD1 3.85Å; E463-L587 HydrophobicContact CG-CD2 4.41Å; E463-L587 WeakPolarHBondContact OE1-CD1 3.3Å; E463-Y591 HydrophobicContact CB-CE2 4.31Å; E463-Y591 VanDerWaalsContact OE2-CE2 3.3Å; E463-Y591 WeakPolarHBondContact OE2-CE2 3.48Å; E463-Y591 VanDerWaalsContact OE2-CZ 3.32Å; E463-Y591 PolarHBondContact OE2-OH 2.97Å
464	S	95.1	Very high	81.7	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62	-21.9	173.8	78.1	0	0	0	0	113.9	F460 I461 R462 Y574	F460-S464 PolarHBondContact O-N 3Å; I461-S464 PolarHBondContact O-N 3.37Å; I461-S464 PolarHBondContact O-OG 3.05Å; R462-S464 PolarHBondContact O-N 2.86Å; S464-Y574 PolarHBondContact O-OH 3.36Å
465	F	95.9	Very high	79	Confident	4 Å²	4	45 Å²	45	2%	0.018	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-6.1	176.6	-76.6	-99.1	0	0	0	113.7	V268 Y276 K279 V280 L283 Y359 I461 R462 E463 C467	V268-F465 HydrophobicContact CB-CB 4.33Å; V268-F465 HydrophobicContact CB-CD1 4.23Å; V268-F465 HydrophobicContact CB-CD2 3.69Å; V268-F465 HydrophobicContact CB-CE2 4.01Å; V268-F465 HydrophobicContact CB-CG 3.82Å; V268-F465 HydrophobicContact CB-CZ 4.41Å; V268-F465 HydrophobicContact CG1-CD2 3.82Å; V268-F465 HydrophobicContact CG1-CE2 3.63Å; V268-F465 HydrophobicContact CG1-CG 4.37Å; V268-F465 HydrophobicContact CG1-CZ 4.05Å; V268-F465 HydrophobicContact CG2-CB 4.44Å; V268-F465 HydrophobicContact CG2-CD1 3.76Å; V268-F465 HydrophobicContact CG2-CD2 4.14Å; V268-F465 HydrophobicContact CG2-CE1 4Å; V268-F465 HydrophobicContact CG2-CE2 4.36Å; V268-F465 HydrophobicContact CG2-CG 3.84Å; V268-F465 HydrophobicContact CG2-CZ 4.29Å; Y276-F465 HydrophobicContact CD2-CD1 4.45Å; Y276-F465 AromaticContact CD2-CE1 3.64Å; Y276-F465 HydrophobicContact CD2-CE1 3.64Å; Y276-F465 HydrophobicContact CD2-CZ 4.06Å; Y276-F465 AromaticContact CE2-CE1 3.95Å; Y276-F465 HydrophobicContact CE2-CE1 3.95Å; Y276-F465 AromaticContact CE2-CZ 3.88Å; Y276-F465 HydrophobicContact CE2-CZ 3.88Å; K279-F465 HydrophobicContact CB-CD1 3.64Å; K279-F465 HydrophobicContact CB-CE1 3.8Å; K279-F465 HydrophobicContact CD-CB 4.37Å; K279-F465 HydrophobicContact CD-CD1 3.86Å; K279-F465 WeakPolarHBondContact CD-O 3.46Å; K279-F465 WeakPolarHBondContact CE-O 3.12Å; K279-F465 HydrophobicContact CG-CD1 4.41Å; K279-F465 PolarHBondContact NZ-O 3.37Å; V280-F465 HydrophobicContact CG2-CE1 3.8Å; V280-F465 HydrophobicContact CG2-CZ 3.69Å; L283-F465 HydrophobicContact CD1-CD1 4.46Å; L283-F465 HydrophobicContact CD1-CD2 3.98Å; L283-F465 HydrophobicContact CD1-CE1 4.08Å; L283-F465 HydrophobicContact CD1-CE2 3.57Å; L283-F465 HydrophobicContact CD1-CG 4.41Å; L283-F465 HydrophobicContact CD1-CZ 3.61Å; Y359-F465 AromaticContact CE2-CE2 3.78Å; Y359-F465 HydrophobicContact CE2-CE2 3.78Å; Y359-F465 AromaticContact CE2-CZ 3.76Å; Y359-F465 HydrophobicContact CE2-CZ 3.76Å; Y359-F465 AromaticContact CZ-CZ 3.78Å; Y359-F465 WeakPolarHBondContact OH-CZ 3.43Å; I461-F465 VanDerWaalsContact O-CD2 3.32Å; I461-F465 WeakPolarHBondContact O-CD2 3.33Å; R462-F465 PolarHBondContact O-N 3.19Å; E463-F465 PolarHBondContact O-N 2.92Å; F465-C467 PolarHBondContact O-N 3.01Å
466	I	93.2	Very high	76.3	Confident	86 Å²	86	46.8 Å²	46.8	44%	0.441	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-78.6	119.5	179.4	-59.7	179.7	0	0	0	108.9	E463 G571 L572	E463-I466 HydrophobicContact CG-CD1 4.3Å; E463-I466 PolarHBondContact O-N 2.74Å; I466-G571 WeakPolarHBondContact O-CA 3.28Å; I466-L572 PolarHBondContact O-N 3.08Å
467	C	88	Confident	73.1	Confident	16 Å²	16	49.3 Å²	49.3	11%	0.108	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-83.4	137	175.1	-64.7	0	0	0	0	110.9	K279 F465 D469 Y574	K279-C467 WeakPolarHBondContact CE-SG 3.46Å; F465-C467 PolarHBondContact O-N 3.01Å; C467-D469 PolarHBondContact O-N 2.87Å; C467-Y574 HydrophobicContact CB-CD2 4.18Å; C467-Y574 HydrophobicContact CB-CE2 4.47Å; C467-Y574 WeakPolarHBondContact SG-CD2 3.28Å
468	Y	81.8	Confident	69.9	Low	82 Å²	82	57.5 Å²	57.5	32%	0.322	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-60.9	127.5	168.9	-177.3	-100.4	0	0	0	110.2	R243 A470 S473 I570 L572 R573	R243-Y468 PolarHBondContact NE-O 2.82Å; R243-Y468 PolarHBondContact NH2-O 3.38Å; Y468-A470 HydrophobicContact CE1-CB 4Å; Y468-S473 PolarHBondContact OH-OG 3.32Å; Y468-I570 HydrophobicContact CD2-CB 4.21Å; Y468-I570 HydrophobicContact CE2-CB 4.22Å; Y468-L572 WeakPolarHBondContact CB-O 3.46Å; Y468-L572 PolarHBondContact N-O 3.02Å; Y468-R573 HydrophobicContact CD1-CG 4.44Å; Y468-R573 HydrophobicContact CG-CG 4.35Å
469	D	71.7	Confident	67	Low	67 Å²	67	61.7 Å²	61.7	36%	0.358	33%	0.331	S	S	.	.			trans	-113.2	115	171.1	-164.5	-17.1	0	0	0	110.2	C467 S471 T472	C467-D469 PolarHBondContact O-N 2.87Å; D469-S471 PolarHBondContact O-N 3.31Å; D469-S471 VanDerWaalsContact OD1-CB 3.29Å; D469-S471 WeakPolarHBondContact OD1-CB 3.41Å; D469-S471 PolarHBondContact OD1-N 3.37Å; D469-S471 PolarHBondContact OD1-OG 3.23Å; D469-S471 PolarHBondContact OD2-OG 3.32Å; D469-S471 VanDerWaalsContact OD2-OG 3.06Å; D469-T472 PolarHBondContact O-OG1 3.09Å
470	A	60.3	Low	63.7	Low	58 Å²	58	64.4 Å²	64.4	48%	0.479	35%	0.35	S	S	.	.	H	α-helix	trans	-66.1	-26.6	177.1	0	0	0	0	0	111.9	Y468 T472 S473 S474	Y468-A470 HydrophobicContact CE1-CB 4Å; A470-T472 VanDerWaalsContact C-N 3.34Å; A470-T472 PolarHBondContact O-N 3.43Å; A470-S473 PolarHBondContact O-N 3.18Å; A470-S474 PolarHBondContact O-N 3.12Å; A470-S474 VanDerWaalsContact O-N 3.16Å
471	S	53.5	Low	60.4	Low	61 Å²	61	68.3 Å²	68.3	43%	0.427	38%	0.38	S	S	.	.	H	α-helix	trans	-65.2	-37.9	-178	71.4	0	0	0	0	111.8	D469 S474 T475	D469-S471 PolarHBondContact O-N 3.31Å; D469-S471 VanDerWaalsContact OD1-CB 3.29Å; D469-S471 WeakPolarHBondContact OD1-CB 3.41Å; D469-S471 PolarHBondContact OD1-N 3.37Å; D469-S471 PolarHBondContact OD1-OG 3.23Å; D469-S471 PolarHBondContact OD2-OG 3.32Å; D469-S471 VanDerWaalsContact OD2-OG 3.06Å; S471-S474 PolarHBondContact O-N 3.3Å; S471-S474 PolarHBondContact O-OG 3.31Å; S471-T475 PolarHBondContact O-N 2.95Å; S471-T475 VanDerWaalsContact O-N 3.17Å; S471-T475 PolarHBondContact O-OG1 2.96Å
472	T	49.2	Very low	57.1	Low	65 Å²	65	72.4 Å²	72.4	40%	0.399	41%	0.408	S	S	.	.	H	α-helix	trans	-66.6	-37	175	35.2	0	0	0	0	113.2	D469 A470 T475 L476	D469-T472 PolarHBondContact O-OG1 3.09Å; A470-T472 VanDerWaalsContact C-N 3.34Å; A470-T472 PolarHBondContact O-N 3.43Å; T472-T475 PolarHBondContact O-N 3.34Å; T472-L476 PolarHBondContact O-N 3.47Å
473	S	46.4	Very low	53.9	Low	32 Å²	32	75 Å²	75	22%	0.224	43%	0.43	C	S	.	.	H	α-helix	trans	-68	-36	176.1	-63.4	0	0	0	0	112.3	Y468 A470 T475 L476 S477	Y468-S473 PolarHBondContact OH-OG 3.32Å; A470-S473 PolarHBondContact O-N 3.18Å; S473-T475 VanDerWaalsContact C-N 3.3Å; S473-T475 PolarHBondContact O-N 3.35Å; S473-L476 PolarHBondContact O-N 3.39Å; S473-S477 PolarHBondContact O-N 3.39Å; S473-S477 PolarHBondContact O-OG 3.18Å
474	S	42.5	Very low	50.7	Low	38 Å²	38	77.4 Å²	77.4	27%	0.266	46%	0.462	S	S	.	.	H	α-helix	trans	-69.8	-28.3	175.6	77.8	0	0	0	0	112.9	A470 S471 S477 R478	A470-S474 PolarHBondContact O-N 3.12Å; A470-S474 VanDerWaalsContact O-N 3.16Å; S471-S474 PolarHBondContact O-N 3.3Å; S471-S474 PolarHBondContact O-OG 3.31Å; S474-S477 WeakPolarHBondContact CA-OG 3.47Å; S474-S477 PolarHBondContact O-OG 3.48Å; S474-R478 WeakPolarHBondContact O-CB 3.45Å; S474-R478 VanDerWaalsContact O-CG 3.22Å; S474-R478 WeakPolarHBondContact O-CG 3.5Å; S474-R478 PolarHBondContact O-N 2.93Å
475	T	36.8	Very low	47.4	Very low	73 Å²	73	85.1 Å²	85.1	45%	0.448	50%	0.502	S	S	.	.	H	α-helix	trans	-76.2	-39.5	176.8	-52.6	0	0	0	0	110.6	S471 T472 S473 R478 I479	S471-T475 PolarHBondContact O-N 2.95Å; S471-T475 VanDerWaalsContact O-N 3.17Å; S471-T475 PolarHBondContact O-OG1 2.96Å; T472-T475 PolarHBondContact O-N 3.34Å; S473-T475 VanDerWaalsContact C-N 3.3Å; S473-T475 PolarHBondContact O-N 3.35Å; T475-R478 PolarHBondContact O-N 3.41Å; T475-I479 HydrophobicContact CG2-CD1 3.8Å; T475-I479 WeakPolarHBondContact O-CB 2.96Å; T475-I479 WeakPolarHBondContact O-CD1 3.29Å; T475-I479 WeakPolarHBondContact O-CG1 3.34Å; T475-I479 PolarHBondContact O-N 3.33Å
476	L	34.3	Very low	44.2	Very low	122 Å²	122	90 Å²	90	64%	0.639	53%	0.534	S	S	*	.	H	α-helix	trans	-64.7	-41.1	171.4	-101.2	76.3	0	0	0	112.3	T472 S473 I479 S480	T472-L476 PolarHBondContact O-N 3.47Å; S473-L476 PolarHBondContact O-N 3.39Å; L476-I479 PolarHBondContact O-N 3.49Å; L476-S480 PolarHBondContact O-N 3.5Å; L476-S480 VanDerWaalsContact O-N 3.1Å; L476-S480 PolarHBondContact O-OG 3.27Å
477	S	27.9	Very low	40.9	Very low	77 Å²	77	93.3 Å²	93.3	54%	0.538	55%	0.552	S	S	.	*	H	α-helix	trans	-72.6	-28.6	178.8	66.6	0	0	0	0	113.5	S473 S474	S473-S477 PolarHBondContact O-N 3.39Å; S473-S477 PolarHBondContact O-OG 3.18Å; S474-S477 WeakPolarHBondContact CA-OG 3.47Å; S474-S477 PolarHBondContact O-OG 3.48Å
478	R	26.1	Very low	38	Very low	193 Å²	193	102.6 Å²	102.6	73%	0.728	59%	0.586	S	S	*	*	H	α-helix	trans	-75.7	-29.4	171.5	-73.5	-178.7	-154.3	168.6	7.9	113.1	S474 T475	S474-R478 WeakPolarHBondContact O-CB 3.45Å; S474-R478 VanDerWaalsContact O-CG 3.22Å; S474-R478 WeakPolarHBondContact O-CG 3.5Å; S474-R478 PolarHBondContact O-N 2.93Å; T475-R478 PolarHBondContact O-N 3.41Å
479	I	29.6	Very low	35.1	Very low	114 Å²	114	107.8 Å²	107.8	59%	0.585	61%	0.611	S	S	*	*	H	α-helix	trans	-81	-19	177.3	-64.8	169.3	0	0	0	111.9	T475 L476 C481	T475-I479 HydrophobicContact CG2-CD1 3.8Å; T475-I479 WeakPolarHBondContact O-CB 2.96Å; T475-I479 WeakPolarHBondContact O-CD1 3.29Å; T475-I479 WeakPolarHBondContact O-CG1 3.34Å; T475-I479 PolarHBondContact O-N 3.33Å; L476-I479 PolarHBondContact O-N 3.49Å; I479-C481 PolarHBondContact O-N 2.93Å
480	S	26.3	Very low	32.9	Very low	105 Å²	105	109.6 Å²	109.6	73%	0.734	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	0	171.1	-77.2	0	0	0	0	115.2	L476	L476-S480 PolarHBondContact O-N 3.5Å; L476-S480 VanDerWaalsContact O-N 3.1Å; L476-S480 PolarHBondContact O-OG 3.27Å
481	C	24.8	Very low	31.1	Very low	110 Å²	110	115.3 Å²	115.3	74%	0.743	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.4	39.8	176.4	-67.4	0	0	0	0	113.5	I479	I479-C481 PolarHBondContact O-N 2.93Å
482	S	26.2	Very low	29.7	Very low	86 Å²	86	120.9 Å²	120.9	60%	0.601	66%	0.664	S	S	*	*	S	Bend	trans	-178	110.7	153.2	47	0	0	0	0	111.1
483	N	28.8	Very low	28.7	Very low	162 Å²	162	122.8 Å²	122.8	87%	0.866	68%	0.681	S	S	*	*			trans	48.7	111.3	160.6	-60.9	-11.4	0	0	0	117.9
484	G	26.5	Very low	27.6	Very low	75 Å²	75	127.7 Å²	127.7	77%	0.773	70%	0.703	S	S	*	*			trans	-57.4	140.9	175.7	0	0	0	0	0	114.5
485	L	26.2	Very low	26.7	Very low	161 Å²	161	134.5 Å²	134.5	84%	0.843	73%	0.728	S	S	*	*			trans	-164.9	120.9	133.9	-106.5	148.4	0	0	0	107.8
486	P	28.5	Very low	26.1	Very low	108 Å²	108	138.8 Å²	138.8	70%	0.701	74%	0.742	S	S	*	*			trans	-65.5	137.1	173.1	-15.8	29.6	0	0	0	110.2	Y488	P486-Y488 VanDerWaalsContact C-N 3.31Å; P486-Y488 PolarHBondContact O-N 3.17Å
487	L	24.7	Very low	25.7	Very low	155 Å²	155	139.5 Å²	139.5	81%	0.812	75%	0.747	S	S	*	*			trans	-63.7	85.9	178.3	-71.2	166.3	0	0	0	111.1	F489	L487-F489 HydrophobicContact CB-CE2 4.37Å
488	Y	25.2	Very low	25.5	Very low	211 Å²	211	141.6 Å²	141.6	83%	0.827	76%	0.756	S	S	*	*			trans	-81.7	106.8	158.1	-111.2	-93.7	0	0	0	107.9	P486 S490	P486-Y488 VanDerWaalsContact C-N 3.31Å; P486-Y488 PolarHBondContact O-N 3.17Å; Y488-S490 PolarHBondContact O-N 3Å
489	F	22.2	Very low	25.6	Very low	191 Å²	191	142.7 Å²	142.7	84%	0.838	77%	0.767	S	S	*	*			trans	-78.6	109.3	164.2	-80.6	-88.1	0	0	0	107.9	L487	L487-F489 HydrophobicContact CB-CE2 4.37Å
490	S	24.2	Very low	25.4	Very low	104 Å²	104	144.1 Å²	144.1	73%	0.727	78%	0.775	S	S	*	*			trans	-127.5	131.3	162.9	-62.5	0	0	0	0	108.6	Y488	Y488-S490 PolarHBondContact O-N 3Å
491	E	23.5	Very low	25.3	Very low	178 Å²	178	148.8 Å²	148.8	83%	0.832	78%	0.782	S	S	*	*			trans	-65.9	143.3	-169.5	-71	176.3	137	0	0	113.4
492	H	23.6	Very low	25.3	Very low	178 Å²	178	148.5 Å²	148.5	82%	0.824	78%	0.782	S	S	*	*			trans	45.6	105.2	150.3	-70.6	-65.7	0	0	0	119.1
493	S	28.2	Very low	25.4	Very low	106 Å²	106	152.1 Å²	152.1	74%	0.741	79%	0.793	S	S	*	*				173.2	105.4	110.2	-166	0	0	0	0	112.3
494	I	23.2	Very low	25.2	Very low	135 Å²	135	154.4 Å²	154.4	69%	0.692	80%	0.795	S	S	*	*				49.3	121.4	124.1	-58.8	179.3	0	0	0	120.3
495	K	24.5	Very low	25	Very low	181 Å²	181	158 Å²	158	79%	0.787	80%	0.797	S	S	*	*			trans	87	118.5	147	-76.3	165.4	-167	-175.5	0	120.6
496	H	23.7	Very low	24.8	Very low	163 Å²	163	157.2 Å²	157.2	76%	0.755	79%	0.794	S	S	*	*			trans	46	123.7	131.8	-76	-92	0	0	0	117.8
497	D	25.1	Very low	24.6	Very low	137 Å²	137	163 Å²	163	73%	0.733	80%	0.803	S	S	*	*			cis	-167.5	159.2	49.2	-94.3	-35.9	0	0	0	111.3
498	T	24.6	Very low	24.5	Very low	120 Å²	120	160.6 Å²	160.6	74%	0.736	80%	0.799	S	S	*	*			trans	-18.3	126.2	163	-22.8	0	0	0	0	117.2
499	F	28	Very low	24.3	Very low	216 Å²	216	157.2 Å²	157.2	95%	0.947	80%	0.795	S	S	*	*			trans	-151.8	141.8	148.3	-121	-85.1	0	0	0	113.1
500	D	24.9	Very low	24.5	Very low	144 Å²	144	155.2 Å²	155.2	77%	0.77	79%	0.793	S	S	*	*			trans	-74.8	149.3	-153	-108	-45	0	0	0	117.4
501	K	25.1	Very low	24.4	Very low	203 Å²	203	158.8 Å²	158.8	88%	0.883	80%	0.795	S	S	*	*			trans	-85.2	100.4	171.4	-76	174	173.8	173.6	0	110.4
502	S	24.9	Very low	24.4	Very low	105 Å²	105	157.8 Å²	157.8	73%	0.734	80%	0.796	S	S	*	*			trans	-164.5	48.1	162.6	71.4	0	0	0	0	115.9
503	I	27.7	Very low	24.5	Very low	162 Å²	162	157.7 Å²	157.7	83%	0.831	80%	0.8	S	S	*	*			trans	-144.3	70.5	162.9	-47.6	176.8	0	0	0	109.5
504	F	24.4	Very low	24.3	Very low	209 Å²	209	160 Å²	160	92%	0.917	80%	0.801	S	S	*	*			trans	-154.8	81.5	161.2	-111.8	-80.1	0	0	0	108.3
505	N	22.9	Very low	24.3	Very low	152 Å²	152	160.4 Å²	160.4	81%	0.813	81%	0.805	S	S	*	*			trans	-157.8	136.6	154.5	-95.6	-19.6	0	0	0	107.8
506	N	22.5	Very low	24.4	Very low	143 Å²	143	157.4 Å²	157.4	77%	0.765	81%	0.807	S	S	*	*			trans	87.6	95.9	-178.3	-49.6	-25.5	0	0	0	113.2
507	Y	24.6	Very low	24.2	Very low	230 Å²	230	156 Å²	156	90%	0.902	81%	0.809	S	S	*	*				-162.4	115.6	97.8	-94.9	-77.2	0	0	0	108.9
508	S	20.9	Very low	24.2	Very low	105 Å²	105	156.8 Å²	156.8	73%	0.734	81%	0.812	S	S	*	*			trans	-121.4	139	168.8	-173.6	0	0	0	0	106.4
509	L	22.4	Very low	24.1	Very low	139 Å²	139	157.7 Å²	157.7	73%	0.728	81%	0.813	S	S	*	*			trans	66.6	135.1	-176.9	-84.4	74.2	0	0	0	113.9
510	D	24.9	Very low	24	Very low	149 Å²	149	151.7 Å²	151.7	80%	0.797	80%	0.797	S	S	*	*			cis	-151.5	153.8	45.1	-118.5	-35.4	0	0	0	114.2
511	K	23.3	Very low	23.9	Very low	179 Å²	179	151.7 Å²	151.7	78%	0.778	80%	0.797	S	S	*	*			trans	-82.9	151.3	172.1	-72	176	174.7	175.8	0	110.1
512	N	22.7	Very low	24	Very low	157 Å²	157	149.2 Å²	149.2	84%	0.84	79%	0.794	S	S	*	*			trans	84.8	96.5	164.7	-52.5	-31.5	0	0	0	116.5
513	L	26.6	Very low	24.1	Very low	177 Å²	177	148.8 Å²	148.8	93%	0.927	79%	0.791	S	S	*	*				-147.5	112.4	123.6	-163.1	57.8	0	0	0	110.7
514	M	22.9	Very low	23.9	Very low	153 Å²	153	148.3 Å²	148.3	75%	0.754	79%	0.79	S	S	*	*			trans	-71.4	141.3	166	-96	-82	175.8	0	0	110.3
515	N	23.8	Very low	24.2	Very low	145 Å²	145	146.4 Å²	146.4	78%	0.775	78%	0.784	S	S	*	*			trans	59.8	106.4	151.1	-63.3	-12.9	0	0	0	119.6
516	S	26.7	Very low	24.2	Very low	118 Å²	118	145.9 Å²	145.9	83%	0.825	78%	0.781	S	S	*	*			trans	-151.9	110.5	132.1	62.1	0	0	0	0	111.2
517	T	20.1	Very low	24.7	Very low	132 Å²	132	149.5 Å²	149.5	81%	0.81	79%	0.785	S	S	*	*			trans	-51.4	144.3	155.9	-26.7	0	0	0	0	111.2
518	I	25.4	Very low	24.7	Very low	155 Å²	155	145 Å²	145	80%	0.795	78%	0.777	S	S	*	*			trans	166.2	100.6	150.3	-86.4	153.3	0	0	0	104.5
519	D	22.4	Very low	25.1	Very low	139 Å²	139	147 Å²	147	74%	0.743	78%	0.779	S	S	*	*				92.9	127.3	80.1	-116	-25.9	0	0	0	113.1
520	S	25.1	Very low	25.3	Very low	89 Å²	89	147.7 Å²	147.7	62%	0.622	78%	0.778	S	S	*	*			trans	74.6	117.6	145.1	-60.8	0	0	0	0	121
521	N	22.6	Very low	25.8	Very low	144 Å²	144	148.1 Å²	148.1	77%	0.77	78%	0.781	S	S	*	*			trans	52.2	121	132.4	-63.4	-15.4	0	0	0	119.1
522	D	27.2	Very low	25.9	Very low	151 Å²	151	144.7 Å²	144.7	81%	0.807	78%	0.779	S	S	*	*				-168.7	140	100.6	-111	-25.8	0	0	0	115.2
523	S	27.7	Very low	26	Very low	96 Å²	96	140.1 Å²	140.1	67%	0.671	77%	0.769	S	S	*	*			trans	58.6	112.9	143.6	63	0	0	0	0	122.3
524	N	22.6	Very low	26.2	Very low	152 Å²	152	140.1 Å²	140.1	81%	0.813	77%	0.77	S	S	*	*			trans	-36.9	141	142.2	-70.4	-30.1	0	0	0	114.4
525	H	31.7	Very low	26.4	Very low	170 Å²	170	139.8 Å²	139.8	79%	0.787	77%	0.771	S	S	*	*			trans	-141.5	104.9	146.7	-103.8	-62.2	0	0	0	110.1
526	D	23.2	Very low	26.4	Very low	140 Å²	140	140 Å²	140	75%	0.749	77%	0.772	S	S	*	*			trans	-66.4	138.4	159	-81.5	-44.2	0	0	0	110.3
527	Y	33	Very low	26.8	Very low	220 Å²	220	140.2 Å²	140.2	86%	0.863	77%	0.774	S	S	*	*			trans	-138.7	113.9	151.3	-96.3	-78.6	0	0	0	110.4
528	N	23.5	Very low	27.1	Very low	136 Å²	136	139.3 Å²	139.3	73%	0.727	77%	0.773	S	S	*	*			trans	-75.2	146.4	161.5	-77.5	-50.9	0	0	0	111.3
529	N	29.2	Very low	27	Very low	145 Å²	145	136.4 Å²	136.4	78%	0.775	77%	0.772	S	S	*	*			trans	171.4	115.2	132.2	-97.1	-17.3	0	0	0	109.4
530	H	26.3	Very low	27.2	Very low	154 Å²	154	133.4 Å²	133.4	71%	0.713	77%	0.774	S	S	*	*				66.5	106.3	84.1	-81.4	-59.7	0	0	0	115.7
531	N	35	Very low	27	Very low	159 Å²	159	134.7 Å²	134.7	85%	0.85	78%	0.779	S	S	*	*			trans	-156.6	108.6	141.7	-85.4	-27.6	0	0	0	104
532	S	25.8	Very low	27.1	Very low	106 Å²	106	134 Å²	134	74%	0.741	78%	0.78	S	S	*	*				48.4	115.3	64.2	-43.5	0	0	0	0	109.9
533	G	24.4	Very low	27	Very low	61 Å²	61	133.5 Å²	133.5	63%	0.629	78%	0.775	S	S	*	*			cis	157.2	146.1	13.2	0	0	0	0	0	104
534	D	32.5	Very low	27	Very low	177 Å²	177	133.7 Å²	133.7	95%	0.947	78%	0.777	S	S	*	*			trans	-179.5	126.9	145	-90.4	-17.4	0	0	0	110.7
535	D	25.7	Very low	27.1	Very low	147 Å²	147	135.4 Å²	135.4	79%	0.786	78%	0.78	S	S	*	*			trans	-90	163	-175.9	-75.5	-45.4	0	0	0	112.8
536	N	25.2	Very low	26.9	Very low	149 Å²	149	132.6 Å²	132.6	80%	0.797	78%	0.779	S	S	*	*			trans	74.9	112.4	147.1	-72.3	-29.1	0	0	0	120.4
537	S	33.3	Very low	26.9	Very low	122 Å²	122	128.7 Å²	128.7	85%	0.853	77%	0.772	S	S	*	*				-173.6	117.9	97.6	39	0	0	0	0	114.1
538	S	26.9	Very low	26.7	Very low	114 Å²	114	123.9 Å²	123.9	80%	0.797	77%	0.768	S	S	*	*			trans	6.1	120.4	149.3	-166.9	0	0	0	0	122.4
539	A	24.7	Very low	26.7	Very low	93 Å²	93	123.4 Å²	123.4	77%	0.769	77%	0.77	S	S	*	*				50	116.2	122.7	0	0	0	0	0	121.7
540	G	25.4	Very low	26.5	Very low	77 Å²	77	123.6 Å²	123.6	79%	0.794	77%	0.77	S	S	*	*			trans	-158.7	84.1	157.4	0	0	0	0	0	110.1
541	T	21.9	Very low	26.4	Very low	116 Å²	116	121.3 Å²	121.3	71%	0.712	77%	0.766	S	S	*	*			trans	-80.9	116	-178.9	-56	0	0	0	0	111.1	I543	T541-I543 HydrophobicContact CG2-CD1 4.18Å; T541-I543 HydrophobicContact CG2-CG1 3.97Å
542	T	24.2	Very low	25.7	Very low	130 Å²	130	118.9 Å²	118.9	80%	0.798	76%	0.761	S	S	*	*			trans	-135	99.4	154	51.9	0	0	0	0	108.8	S544	T542-S544 PolarHBondContact O-N 3.26Å
543	I	24.2	Very low	25.6	Very low	139 Å²	139	120.8 Å²	120.8	71%	0.713	76%	0.758	S	S	*	*			trans	-72.8	105	176.6	-63.1	168.6	0	0	0	107.4	T541 E545	T541-I543 HydrophobicContact CG2-CD1 4.18Å; T541-I543 HydrophobicContact CG2-CG1 3.97Å; I543-E545 HydrophobicContact CG2-CG 3.91Å
544	S	27.3	Very low	25.7	Very low	101 Å²	101	122.9 Å²	122.9	71%	0.706	76%	0.763	S	S	*	*			trans	-105.4	99.9	163.1	-53.3	0	0	0	0	106.1	T542 S546	T542-S544 PolarHBondContact O-N 3.26Å; S544-S546 PolarHBondContact O-N 2.94Å
545	E	25	Very low	25.3	Very low	187 Å²	187	122.4 Å²	122.4	87%	0.874	76%	0.76	S	S	*	*			trans	-70.2	79.6	175.5	-77	179.1	152.6	0	0	110.2	I543 G547	I543-E545 HydrophobicContact CG2-CG 3.91Å; E545-G547 PolarHBondContact O-N 3.04Å
546	S	28.9	Very low	25.2	Very low	111 Å²	111	122.5 Å²	122.5	78%	0.776	76%	0.756	S	S	*	*			trans	-90	85.7	154.5	53.8	0	0	0	0	107.4	S544	S544-S546 PolarHBondContact O-N 2.94Å
547	G	23.2	Very low	25.3	Very low	58 Å²	58	122.5 Å²	122.5	60%	0.598	76%	0.755	S	S	*	*			trans	-59.4	144	171.7	0	0	0	0	0	110.9	E545 T549	E545-G547 PolarHBondContact O-N 3.04Å; G547-T549 PolarHBondContact O-N 3.39Å
548	P	27.5	Very low	25	Very low	119 Å²	119	121.3 Å²	121.3	77%	0.773	75%	0.745	S	S	*	*			trans	-65.2	127.8	-174.7	26.5	-32	0	0	0	109.9	I550	P548-I550 PolarHBondContact O-N 3.27Å
549	T	24	Very low	25.1	Very low	126 Å²	126	124.6 Å²	124.6	77%	0.773	75%	0.747	S	S	*	*			trans	-62.2	101.4	165.5	-56.9	0	0	0	0	107.7	G547 V551	G547-T549 PolarHBondContact O-N 3.39Å; T549-V551 VanDerWaalsContact C-N 3.26Å; T549-V551 HydrophobicContact CG2-CG2 4.22Å; T549-V551 PolarHBondContact O-N 2.98Å
550	I	24.5	Very low	25.2	Very low	150 Å²	150	125.6 Å²	125.6	77%	0.769	74%	0.744	S	S	*	*			trans	-68.2	94.2	165.9	-61.5	177.6	0	0	0	105.9	P548 C552	P548-I550 PolarHBondContact O-N 3.27Å; I550-C552 PolarHBondContact O-N 2.88Å
551	V	24.3	Very low	25.4	Very low	105 Å²	105	128.1 Å²	128.1	64%	0.636	74%	0.738	S	S	*	*			trans	-64.5	113.1	164.2	175.5	0	0	0	0	106	T549 Q553	T549-V551 VanDerWaalsContact C-N 3.26Å; T549-V551 HydrophobicContact CG2-CG2 4.22Å; T549-V551 PolarHBondContact O-N 2.98Å; V551-Q553 VanDerWaalsContact C-N 3.28Å; V551-Q553 PolarHBondContact O-N 2.97Å
552	C	21.9	Very low	25.9	Very low	109 Å²	109	126.4 Å²	126.4	74%	0.736	73%	0.731	S	S	*	*			trans	-59.4	92.1	169.6	-63.1	0	0	0	0	108.8	I550 S554	I550-C552 PolarHBondContact O-N 2.88Å; C552-S554 VanDerWaalsContact C-N 3.27Å; C552-S554 PolarHBondContact O-N 3.48Å
553	Q	22.8	Very low	26.1	Very low	146 Å²	146	125.5 Å²	125.5	68%	0.682	73%	0.727	S	S	*	*			trans	-74.2	85.7	165.2	-73.9	179.5	-16.7	0	0	107.5	V551	V551-Q553 VanDerWaalsContact C-N 3.28Å; V551-Q553 PolarHBondContact O-N 2.97Å
554	S	26.7	Very low	26.4	Very low	104 Å²	104	125.7 Å²	125.7	73%	0.727	73%	0.729	S	S	*	*			trans	-110.5	14.2	170.7	-48.6	0	0	0	0	112.7	C552	C552-S554 VanDerWaalsContact C-N 3.27Å; C552-S554 PolarHBondContact O-N 3.48Å
555	D	24.7	Very low	26.9	Very low	167 Å²	167	123.5 Å²	123.5	89%	0.893	71%	0.712	S	S	*	*			trans	-113.3	15.2	176.6	-76.4	-25.7	0	0	0	113.7
556	Q	23.5	Very low	27.4	Very low	149 Å²	149	121.8 Å²	121.8	70%	0.696	71%	0.707	S	S	*	*			trans	-103.5	96.6	167.6	-68.2	-169.1	3.1	0	0	109.7	P558	Q556-P558 VanDerWaalsContact O-CD 3.31Å; Q556-P558 WeakPolarHBondContact O-CD 3.45Å
557	L	27.2	Very low	27.9	Very low	150 Å²	150	125 Å²	125	79%	0.785	71%	0.71	S	S	*	*			trans	-55.5	117.4	171.5	-168.1	79.1	0	0	0	109.8	Q559	L557-Q559 PolarHBondContact O-N 2.89Å
558	P	27.2	Very low	29.3	Very low	97 Å²	97	126 Å²	126	63%	0.63	70%	0.696	S	S	*	*			trans	-72.1	116.6	177.4	-14.4	29.1	0	0	0	110.3	Q556 T560	Q556-P558 VanDerWaalsContact O-CD 3.31Å; Q556-P558 WeakPolarHBondContact O-CD 3.45Å; P558-T560 HydrophobicContact CB-CG2 4.34Å; P558-T560 PolarHBondContact O-N 3.12Å; P558-T560 VanDerWaalsContact O-N 3.07Å
559	Q	27.1	Very low	30.6	Very low	182 Å²	182	125 Å²	125	85%	0.85	68%	0.68	S	S	*	*			trans	-78.4	69.9	163.8	-68.2	-178.9	-3.8	0	0	109.2	L557 I561	L557-Q559 PolarHBondContact O-N 2.89Å; Q559-I561 PolarHBondContact O-N 3.07Å
560	T	28.2	Very low	32.7	Very low	114 Å²	114	123.1 Å²	123.1	70%	0.699	67%	0.665	S	S	*	*			trans	-96	84.2	168.9	49.5	0	0	0	0	108.9	P558 S562	P558-T560 HydrophobicContact CB-CG2 4.34Å; P558-T560 PolarHBondContact O-N 3.12Å; P558-T560 VanDerWaalsContact O-N 3.07Å; T560-S562 PolarHBondContact O-N 3.32Å
561	I	29	Very low	35.7	Very low	131 Å²	131	116.1 Å²	116.1	67%	0.672	63%	0.63	S	S	*	*			trans	-80.3	114.4	168.3	-59.6	174.2	0	0	0	107	Q559 T565	Q559-I561 PolarHBondContact O-N 3.07Å; I561-T565 HydrophobicContact CG2-CG2 3.84Å; I561-T565 WeakPolarHBondContact CG2-OG1 3.47Å
562	S	31.6	Very low	39	Very low	79 Å²	79	111.5 Å²	111.5	55%	0.552	60%	0.601	S	S	*	*			trans	-59.3	134.5	175.8	174.4	0	0	0	0	111.2	T560 N564 T565	T560-S562 PolarHBondContact O-N 3.32Å; S562-N564 PolarHBondContact O-N 2.97Å; S562-T565 PolarHBondContact O-OG1 3.26Å
563	P	30.4	Very low	42.4	Very low	112 Å²	112	110 Å²	110	73%	0.727	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-1.2	-171.3	23.9	-32.7	0	0	0	116.4	T565	P563-T565 PolarHBondContact O-N 3.03Å
564	N	28.9	Very low	45.8	Very low	142 Å²	142	103.1 Å²	103.1	76%	0.759	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	19.7	173.5	-77.8	-11.1	0	0	0	113.9	S562 I566	S562-N564 PolarHBondContact O-N 2.97Å; N564-I566 PolarHBondContact O-N 3.23Å
565	T	38.5	Very low	49	Very low	55 Å²	55	100.2 Å²	100.2	34%	0.337	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-78.4	-4.4	-169.3	-6.3	0	0	0	0	115.9	I561 S562 P563 H567 R568	I561-T565 HydrophobicContact CG2-CG2 3.84Å; I561-T565 WeakPolarHBondContact CG2-OG1 3.47Å; S562-T565 PolarHBondContact O-OG1 3.26Å; P563-T565 PolarHBondContact O-N 3.03Å; T565-H567 PolarHBondContact O-N 3.41Å; T565-H567 VanDerWaalsContact O-N 3.07Å; T565-R568 PolarHBondContact O-N 2.84Å
566	I	35.6	Very low	52.4	Low	152 Å²	152	95.2 Å²	95.2	78%	0.779	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-67.1	-16.1	-167.3	-60.6	175.7	0	0	0	113.6	N564	N564-I566 PolarHBondContact O-N 3.23Å
567	H	38.5	Very low	55.9	Low	179 Å²	179	90 Å²	90	83%	0.829	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-117.1	9.5	-179.3	-73.7	-52.1	0	0	0	116.1	T565 Q569	T565-H567 PolarHBondContact O-N 3.41Å; T565-H567 VanDerWaalsContact O-N 3.07Å; H567-Q569 PolarHBondContact O-N 3.38Å; H567-Q569 VanDerWaalsContact O-N 3.17Å
568	R	52.8	Low	59.2	Low	79 Å²	79	86.2 Å²	86.2	30%	0.298	46%	0.458	S	S	.	.	S	Bend	trans	-67.6	119.1	172	-68.6	-170.7	178.6	-170.9	-0.7	108.5	E463 T565 I570 Y591 D594	E463-R568 IonicContact OE2-CZ 2.95Å; E463-R568 IonicContact OE2-NH1 3.31Å; E463-R568 PolarHBondContact OE2-NH1 3.4Å; T565-R568 PolarHBondContact O-N 2.84Å; R568-I570 PolarHBondContact O-N 3.36Å; R568-Y591 PolarHBondContact NH1-OH 3.5Å; R568-D594 IonicContact CZ-OD2 3.56Å; R568-D594 IonicContact NH2-OD2 3.58Å; R568-D594 PolarHBondContact NH2-OD2 3.04Å
569	Q	55.8	Low	62.4	Low	96 Å²	96	83.6 Å²	83.6	45%	0.449	44%	0.438	S	S	.	.			trans	-50.8	132.9	174.1	-77.3	176.7	-54	0	0	108.2	H567 G571	H567-Q569 PolarHBondContact O-N 3.38Å; H567-Q569 VanDerWaalsContact O-N 3.17Å; Q569-G571 PolarHBondContact O-N 3.09Å
570	I	68.5	Low	65.7	Low	88 Å²	88	74.9 Å²	74.9	45%	0.451	40%	0.398	S	S	.	.	S	Bend	trans	-58.2	-10.3	-172	-64.6	162	0	0	0	113.2	Y468 R568	Y468-I570 HydrophobicContact CD2-CB 4.21Å; Y468-I570 HydrophobicContact CE2-CB 4.22Å; R568-I570 PolarHBondContact O-N 3.36Å
571	G	86.5	Confident	68.9	Low	3 Å²	3	69.5 Å²	69.5	3%	0.031	37%	0.365	C	S	.	.	S	Bend	trans	166.6	179.7	171.2	0	0	0	0	0	110	I466 Q569	I466-G571 WeakPolarHBondContact O-CA 3.28Å; Q569-G571 PolarHBondContact O-N 3.09Å
572	L	94.3	Very high	72.1	Confident	7 Å²	7	65.1 Å²	65.1	4%	0.037	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-90.5	142.8	179.4	-74.4	64.5	0	0	0	110.2	E463 I466 Y468 Y574 L580 D583 L584 L587	E463-L572 WeakPolarHBondContact O-CD1 3.34Å; I466-L572 PolarHBondContact O-N 3.08Å; Y468-L572 WeakPolarHBondContact CB-O 3.46Å; Y468-L572 PolarHBondContact N-O 3.02Å; L572-Y574 HydrophobicContact CB-CD2 4.3Å; L572-Y574 HydrophobicContact CB-CE2 3.9Å; L572-Y574 VanDerWaalsContact O-CD2 3.32Å; L572-Y574 WeakPolarHBondContact O-CD2 3.35Å; L572-Y574 PolarHBondContact O-N 3.06Å; L572-L580 HydrophobicContact CB-CD1 3.67Å; L572-L580 HydrophobicContact CD2-CD1 3.79Å; L572-L580 HydrophobicContact CG-CD1 4.29Å; L572-D583 HydrophobicContact CB-CB 4.31Å; L572-D583 HydrophobicContact CG-CB 4.08Å; L572-L584 HydrophobicContact CD2-CB 4.06Å; L572-L584 HydrophobicContact CD2-CD1 4.13Å; L572-L587 HydrophobicContact CD1-CD2 4.25Å
573	R	93.7	Very high	75.1	Confident	79 Å²	79	61.4 Å²	61.4	30%	0.298	32%	0.317	S	S	.	.			trans	-83	100.4	178.1	-65.1	173.2	-65.8	141.1	9.6	110.5	Y468 T575 D579 L580 D583	Y468-R573 HydrophobicContact CD1-CG 4.44Å; Y468-R573 HydrophobicContact CG-CG 4.35Å; R573-T575 PolarHBondContact O-N 2.84Å; R573-D579 HydrophobicContact CB-CB 4.12Å; R573-D579 IonicContact CZ-OD1 2.74Å; R573-D579 VanDerWaalsContact CZ-OD1 3.31Å; R573-D579 IonicContact NH1-OD1 3.93Å; R573-D579 PolarHBondContact NH1-OD1 2.99Å; R573-D579 IonicContact NH2-OD1 3.06Å; R573-D579 PolarHBondContact NH2-OD1 3.25Å; R573-L580 WeakPolarHBondContact O-CA 3.46Å; R573-L580 WeakPolarHBondContact O-CB 3.47Å; R573-L580 PolarHBondContact O-N 3.42Å; R573-D583 WeakPolarHBondContact CB-OD2 3.48Å; R573-D583 WeakPolarHBondContact CG-OD2 3.19Å; R573-D583 IonicContact CZ-OD1 3.18Å; R573-D583 IonicContact CZ-OD2 2.98Å; R573-D583 PolarHBondContact N-OD2 3.17Å; R573-D583 IonicContact NE-OD1 3.39Å; R573-D583 PolarHBondContact NE-OD1 3.24Å; R573-D583 IonicContact NE-OD2 2.62Å; R573-D583 PolarHBondContact NE-OD2 3.09Å; R573-D583 IonicContact NH2-OD1 3.74Å; R573-D583 PolarHBondContact NH2-OD1 3.39Å; R573-D583 IonicContact NH2-OD2 2.72Å
574	Y	94.2	Very high	78.2	Confident	1 Å²	1	56.1 Å²	56.1	0%	0.004	28%	0.282	C	S	.	.			trans	-79.4	42.4	171.9	-72.8	-105.9	0	0	0	112.2	R243 L245 K279 C282 S464 C467 L572 L580	R243-Y574 CarbonylContact C-O 3.55Å; R243-Y574 VanDerWaalsContact C-O 3.28Å; R243-Y574 WeakPolarHBondContact CA-O 3.47Å; R243-Y574 WeakPolarHBondContact CB-O 3.18Å; L245-Y574 WeakPolarHBondContact CB-O 3.27Å; K279-Y574 HydrophobicContact CB-CE1 4.22Å; K279-Y574 HydrophobicContact CG-CE1 4.04Å; C282-Y574 HydrophobicContact CB-CD1 3.65Å; C282-Y574 HydrophobicContact CB-CE1 3.63Å; S464-Y574 PolarHBondContact O-OH 3.36Å; C467-Y574 HydrophobicContact CB-CD2 4.18Å; C467-Y574 HydrophobicContact CB-CE2 4.47Å; C467-Y574 WeakPolarHBondContact SG-CD2 3.28Å; L572-Y574 HydrophobicContact CB-CD2 4.3Å; L572-Y574 HydrophobicContact CB-CE2 3.9Å; L572-Y574 VanDerWaalsContact O-CD2 3.32Å; L572-Y574 WeakPolarHBondContact O-CD2 3.35Å; L572-Y574 PolarHBondContact O-N 3.06Å; Y574-L580 HydrophobicContact CD1-CD1 4.4Å; Y574-L580 HydrophobicContact CD1-CD2 3.94Å; Y574-L580 HydrophobicContact CD2-CD1 4.1Å; Y574-L580 HydrophobicContact CE1-CD1 4.28Å; Y574-L580 HydrophobicContact CE1-CD2 3.95Å; Y574-L580 HydrophobicContact CE2-CD1 3.96Å; Y574-L580 HydrophobicContact CG-CD1 4.31Å; Y574-L580 HydrophobicContact CG-CD2 4.49Å
575	T	94	Very high	81.4	Confident	42 Å²	42	49.7 Å²	49.7	26%	0.258	25%	0.247	S	C	.	.	S	Bend	trans	-91.2	-57.8	-178.5	44.2	0	0	0	0	111.2	P244 L245 R573 D579	P244-T575 WeakPolarHBondContact CG-O 3.33Å; L245-T575 WeakPolarHBondContact CB-O 3.35Å; L245-T575 PolarHBondContact N-O 2.8Å; L245-T575 VanDerWaalsContact N-O 3.11Å; R573-T575 PolarHBondContact O-N 2.84Å; T575-D579 WeakPolarHBondContact OG1-CB 3.29Å; T575-D579 PolarHBondContact OG1-OD2 3.25Å
576	T	95.8	Very high	84.1	Confident	63 Å²	63	51.7 Å²	51.7	39%	0.387	25%	0.252	S	S	.	.			trans	-130.1	161.7	177.3	67.3	0	0	0	0	109.7	E578 D579 L580	T576-E578 VanDerWaalsContact C-N 3.26Å; T576-E578 PolarHBondContact O-N 3.19Å; T576-D579 PolarHBondContact O-N 3.47Å; T576-D579 VanDerWaalsContact OG1-CB 3.32Å; T576-D579 WeakPolarHBondContact OG1-CB 3.39Å; T576-D579 PolarHBondContact OG1-N 3.3Å; T576-D579 PolarHBondContact OG1-OD2 2.99Å; T576-L580 WeakPolarHBondContact O-CB 3.38Å; T576-L580 PolarHBondContact O-N 2.9Å
577	V	96.7	Very high	86.9	Confident	40 Å²	40	45 Å²	45	24%	0.242	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-40.2	175.7	-179.5	0	0	0	0	110.6	L245 Q285 Y289 A581	L245-V577 HydrophobicContact CD1-CG2 3.66Å; L245-V577 HydrophobicContact CD2-CG2 4.34Å; Q285-V577 HydrophobicContact CB-CG1 4.14Å; Q285-V577 HydrophobicContact CB-CG2 4.2Å; Q285-V577 WeakPolarHBondContact O-CG1 3.48Å; Y289-V577 HydrophobicContact CD2-CG1 3.95Å; Y289-V577 HydrophobicContact CG-CG1 4.16Å; V577-A581 WeakPolarHBondContact O-CB 3.33Å; V577-A581 PolarHBondContact O-N 3.02Å
578	E	95.4	Very high	89.6	Confident	70 Å²	70	36.9 Å²	36.9	33%	0.327	18%	0.18	S	C	.	.	H	α-helix	trans	-65.1	-43.5	178.1	-178.9	178	-175.3	0	0	111.9	Y289 T576 A581 N582	Y289-E578 HydrophobicContact CE2-CB 4.26Å; T576-E578 VanDerWaalsContact C-N 3.26Å; T576-E578 PolarHBondContact O-N 3.19Å; E578-A581 PolarHBondContact O-N 2.99Å; E578-N582 WeakPolarHBondContact CG-ND2 3.42Å; E578-N582 WeakPolarHBondContact O-CB 3.33Å; E578-N582 PolarHBondContact O-N 3.29Å; E578-N582 PolarHBondContact O-ND2 2.9Å
579	D	94.4	Very high	91.6	Very high	41 Å²	41	35.1 Å²	35.1	22%	0.219	18%	0.176	C	C	.	.	H	α-helix	trans	-62.4	-48.4	177	-74.7	-44.9	0	0	0	111.6	R573 T575 T576 N582 D583	R573-D579 HydrophobicContact CB-CB 4.12Å; R573-D579 IonicContact CZ-OD1 2.74Å; R573-D579 VanDerWaalsContact CZ-OD1 3.31Å; R573-D579 IonicContact NH1-OD1 3.93Å; R573-D579 PolarHBondContact NH1-OD1 2.99Å; R573-D579 IonicContact NH2-OD1 3.06Å; R573-D579 PolarHBondContact NH2-OD1 3.25Å; T575-D579 WeakPolarHBondContact OG1-CB 3.29Å; T575-D579 PolarHBondContact OG1-OD2 3.25Å; T576-D579 PolarHBondContact O-N 3.47Å; T576-D579 VanDerWaalsContact OG1-CB 3.32Å; T576-D579 WeakPolarHBondContact OG1-CB 3.39Å; T576-D579 PolarHBondContact OG1-N 3.3Å; T576-D579 PolarHBondContact OG1-OD2 2.99Å; D579-N582 PolarHBondContact O-N 2.77Å; D579-D583 VanDerWaalsContact O-CG 3.28Å; D579-D583 PolarHBondContact O-N 3.34Å
580	L	96.1	Very high	93.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.5	-42.8	179.2	-178.6	59.1	0	0	0	111	L245 C282 A286 L572 R573 Y574 T576 D583 L584	L245-L580 HydrophobicContact CD2-CB 4.06Å; L245-L580 HydrophobicContact CD2-CD2 3.66Å; C282-L580 HydrophobicContact CB-CD2 3.66Å; C282-L580 WeakPolarHBondContact O-CD2 3.46Å; A286-L580 HydrophobicContact CB-CB 4.28Å; A286-L580 HydrophobicContact CB-CD2 3.9Å; A286-L580 HydrophobicContact CB-CG 3.71Å; L572-L580 HydrophobicContact CB-CD1 3.67Å; L572-L580 HydrophobicContact CD2-CD1 3.79Å; L572-L580 HydrophobicContact CG-CD1 4.29Å; R573-L580 WeakPolarHBondContact O-CA 3.46Å; R573-L580 WeakPolarHBondContact O-CB 3.47Å; R573-L580 PolarHBondContact O-N 3.42Å; Y574-L580 HydrophobicContact CD1-CD1 4.4Å; Y574-L580 HydrophobicContact CD1-CD2 3.94Å; Y574-L580 HydrophobicContact CD2-CD1 4.1Å; Y574-L580 HydrophobicContact CE1-CD1 4.28Å; Y574-L580 HydrophobicContact CE1-CD2 3.95Å; Y574-L580 HydrophobicContact CE2-CD1 3.96Å; Y574-L580 HydrophobicContact CG-CD1 4.31Å; Y574-L580 HydrophobicContact CG-CD2 4.49Å; T576-L580 WeakPolarHBondContact O-CB 3.38Å; T576-L580 PolarHBondContact O-N 2.9Å; L580-D583 PolarHBondContact O-N 2.75Å; L580-L584 WeakPolarHBondContact O-CB 3.28Å; L580-L584 PolarHBondContact O-N 3.49Å
581	A	96.6	Very high	94.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-62.5	-43.4	176.6	0	0	0	0	0	111.9	A286 Y289 I290 V577 E578 Y585 L623	A286-A581 HydrophobicContact CB-CB 4.28Å; Y289-A581 HydrophobicContact CD1-CB 3.57Å; Y289-A581 HydrophobicContact CE1-CB 4.39Å; Y289-A581 HydrophobicContact CG-CB 3.93Å; I290-A581 HydrophobicContact CG1-CB 4.09Å; V577-A581 WeakPolarHBondContact O-CB 3.33Å; V577-A581 PolarHBondContact O-N 3.02Å; E578-A581 PolarHBondContact O-N 2.99Å; A581-Y585 WeakPolarHBondContact O-CB 3.18Å; A581-Y585 PolarHBondContact O-N 2.84Å; A581-L623 HydrophobicContact CB-CD2 3.98Å
582	N	95.2	Very high	95.1	Very high	39 Å²	39	30 Å²	30	21%	0.209	15%	0.154	C	C	.	.	H	α-helix	trans	-62.8	-43.7	176.2	-84.1	-61.7	0	0	0	112.3	E578 D579 K586 L623	E578-N582 WeakPolarHBondContact CG-ND2 3.42Å; E578-N582 WeakPolarHBondContact O-CB 3.33Å; E578-N582 PolarHBondContact O-N 3.29Å; E578-N582 PolarHBondContact O-ND2 2.9Å; D579-N582 PolarHBondContact O-N 2.77Å; N582-K586 VanDerWaalsContact O-CG 3.29Å; N582-K586 WeakPolarHBondContact O-CG 3.46Å; N582-K586 PolarHBondContact O-N 3.34Å; N582-L623 WeakPolarHBondContact OD1-CD2 3.4Å
583	D	95.4	Very high	95.1	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.011	17%	0.167	C	C	.	.	H	α-helix	trans	-69.3	-44.5	179.7	-66.4	-11.3	0	0	0	111.1	L572 R573 D579 L580 Y585 K586 L587	L572-D583 HydrophobicContact CB-CB 4.31Å; L572-D583 HydrophobicContact CG-CB 4.08Å; R573-D583 WeakPolarHBondContact CB-OD2 3.48Å; R573-D583 WeakPolarHBondContact CG-OD2 3.19Å; R573-D583 IonicContact CZ-OD1 3.18Å; R573-D583 IonicContact CZ-OD2 2.98Å; R573-D583 PolarHBondContact N-OD2 3.17Å; R573-D583 IonicContact NE-OD1 3.39Å; R573-D583 PolarHBondContact NE-OD1 3.24Å; R573-D583 IonicContact NE-OD2 2.62Å; R573-D583 PolarHBondContact NE-OD2 3.09Å; R573-D583 IonicContact NH2-OD1 3.74Å; R573-D583 PolarHBondContact NH2-OD1 3.39Å; R573-D583 IonicContact NH2-OD2 2.72Å; D579-D583 VanDerWaalsContact O-CG 3.28Å; D579-D583 PolarHBondContact O-N 3.34Å; L580-D583 PolarHBondContact O-N 2.75Å; D583-Y585 VanDerWaalsContact C-N 3.33Å; D583-Y585 PolarHBondContact O-N 3.47Å; D583-K586 PolarHBondContact O-N 3.03Å; D583-L587 WeakPolarHBondContact O-CB 3.42Å; D583-L587 PolarHBondContact O-N 2.85Å
584	L	95.8	Very high	95.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.1	-41.9	175.5	-179.4	60.5	0	0	0	111.6	L283 A286 F287 I290 F460 L572 L580 L587 I588	L283-L584 HydrophobicContact CD2-CD1 4.35Å; L283-L584 HydrophobicContact CD2-CD2 4.13Å; A286-L584 HydrophobicContact CB-CD2 3.82Å; F287-L584 HydrophobicContact CD1-CD2 4.04Å; F287-L584 HydrophobicContact CD2-CD2 4.19Å; F287-L584 HydrophobicContact CE1-CD2 3.83Å; F287-L584 HydrophobicContact CE1-CG 4.35Å; F287-L584 HydrophobicContact CE2-CD2 3.98Å; F287-L584 HydrophobicContact CG-CD2 4.21Å; F287-L584 HydrophobicContact CZ-CD1 4.28Å; F287-L584 HydrophobicContact CZ-CD2 3.8Å; F287-L584 HydrophobicContact CZ-CG 4.38Å; I290-L584 HydrophobicContact CD1-CB 4.43Å; I290-L584 HydrophobicContact CD1-CD2 4.15Å; I290-L584 HydrophobicContact CD1-CG 4.24Å; F460-L584 HydrophobicContact CE2-CD1 4.29Å; F460-L584 HydrophobicContact CZ-CD1 4.33Å; L572-L584 HydrophobicContact CD2-CB 4.06Å; L572-L584 HydrophobicContact CD2-CD1 4.13Å; L580-L584 WeakPolarHBondContact O-CB 3.28Å; L580-L584 PolarHBondContact O-N 3.49Å; L584-L587 HydrophobicContact CD1-CD2 4.47Å; L584-L587 WeakPolarHBondContact O-CB 3.48Å; L584-L587 PolarHBondContact O-N 3.13Å; L584-I588 HydrophobicContact CD1-CD1 4.33Å; L584-I588 HydrophobicContact CG-CD1 4.05Å; L584-I588 WeakPolarHBondContact O-CD1 3.38Å; L584-I588 WeakPolarHBondContact O-CG1 3.27Å; L584-I588 PolarHBondContact O-N 3.17Å
585	Y	95.8	Very high	95.2	Very high	7 Å²	7	31.5 Å²	31.5	3%	0.027	17%	0.166	C	C	.	.	H	α-helix	trans	-67.4	-37.2	178.7	-173.6	-126	0	0	0	112.3	I290 P296 W299 A581 D583 I588 N589 Q620 P621 L623	I290-Y585 HydrophobicContact CD1-CD2 4.47Å; I290-Y585 HydrophobicContact CG2-CD2 4Å; I290-Y585 HydrophobicContact CG2-CE2 4.33Å; P296-Y585 HydrophobicContact CB-CE2 4Å; W299-Y585 AromaticContact CE3-CE2 3.78Å; W299-Y585 HydrophobicContact CE3-CE2 3.78Å; W299-Y585 HydrophobicContact CZ3-CD2 4.46Å; W299-Y585 AromaticContact CZ3-CE2 3.77Å; W299-Y585 HydrophobicContact CZ3-CE2 3.77Å; A581-Y585 WeakPolarHBondContact O-CB 3.18Å; A581-Y585 PolarHBondContact O-N 2.84Å; D583-Y585 VanDerWaalsContact C-N 3.33Å; D583-Y585 PolarHBondContact O-N 3.47Å; Y585-I588 PolarHBondContact O-N 2.73Å; Y585-N589 PolarHBondContact O-N 2.81Å; Y585-Q620 HydrophobicContact CD1-CG 4.46Å; Y585-Q620 HydrophobicContact CE1-CG 3.6Å; Y585-Q620 VanDerWaalsContact CE1-NE2 3.26Å; Y585-Q620 HydrophobicContact CE2-CG 4.18Å; Y585-Q620 VanDerWaalsContact CE2-NE2 3.25Å; Y585-Q620 VanDerWaalsContact CZ-CG 3.43Å; Y585-Q620 PolarHBondContact O-NE2 2.93Å; Y585-Q620 VanDerWaalsContact OH-CG 3.25Å; Y585-Q620 WeakPolarHBondContact OH-CG 3.43Å; Y585-P621 WeakPolarHBondContact CE1-O 3.44Å; Y585-P621 VanDerWaalsContact OH-CD 3.27Å; Y585-P621 WeakPolarHBondContact OH-CD 3.5Å; Y585-P621 WeakPolarHBondContact OH-CG 3.48Å; Y585-P621 PolarHBondContact OH-O 3.43Å; Y585-L623 HydrophobicContact CD1-CB 4.13Å; Y585-L623 HydrophobicContact CD1-CD1 4.45Å; Y585-L623 HydrophobicContact CE1-CB 4.32Å
586	K	95	Very high	95.3	Very high	98 Å²	98	30 Å²	30	43%	0.426	16%	0.156	S	C	.	.	H	α-helix	trans	-64.3	-44.1	169.9	-73	169.4	-174.8	171.7	0	111.7	N582 D583 I588 N589 V590	N582-K586 VanDerWaalsContact O-CG 3.29Å; N582-K586 WeakPolarHBondContact O-CG 3.46Å; N582-K586 PolarHBondContact O-N 3.34Å; D583-K586 PolarHBondContact O-N 3.03Å; K586-I588 VanDerWaalsContact C-N 3.27Å; K586-I588 PolarHBondContact O-N 3.42Å; K586-N589 WeakPolarHBondContact O-CB 3.41Å; K586-N589 PolarHBondContact O-N 3.21Å; K586-N589 VanDerWaalsContact O-N 3.11Å; K586-V590 WeakPolarHBondContact O-CG2 3.35Å; K586-V590 PolarHBondContact O-N 2.96Å
587	L	95.1	Very high	95.4	Very high	12 Å²	12	30.4 Å²	30.4	6%	0.063	16%	0.157	C	C	.	.	H	α-helix	trans	-56.4	-44.2	177.2	-173.7	71.2	0	0	0	111.2	F460 E463 L572 D583 L584 N589 V590 Y591	F460-L587 HydrophobicContact CD2-CD2 3.84Å; F460-L587 HydrophobicContact CD2-CG 3.97Å; F460-L587 HydrophobicContact CE2-CD2 3.82Å; F460-L587 HydrophobicContact CE2-CG 4.1Å; E463-L587 HydrophobicContact CB-CD1 4.38Å; E463-L587 HydrophobicContact CB-CD2 4.31Å; E463-L587 HydrophobicContact CG-CD1 3.85Å; E463-L587 HydrophobicContact CG-CD2 4.41Å; E463-L587 WeakPolarHBondContact OE1-CD1 3.3Å; L572-L587 HydrophobicContact CD1-CD2 4.25Å; D583-L587 WeakPolarHBondContact O-CB 3.42Å; D583-L587 PolarHBondContact O-N 2.85Å; L584-L587 HydrophobicContact CD1-CD2 4.47Å; L584-L587 WeakPolarHBondContact O-CB 3.48Å; L584-L587 PolarHBondContact O-N 3.13Å; L587-N589 VanDerWaalsContact C-N 3.31Å; L587-N589 PolarHBondContact O-N 2.98Å; L587-V590 PolarHBondContact O-N 3.36Å; L587-Y591 HydrophobicContact CD1-CD2 3.82Å; L587-Y591 HydrophobicContact CD1-CE2 3.64Å; L587-Y591 HydrophobicContact CG-CD2 3.94Å; L587-Y591 HydrophobicContact CG-CE2 4.13Å; L587-Y591 WeakPolarHBondContact O-CD2 3.4Å; L587-Y591 PolarHBondContact O-N 3.04Å
588	I	94.8	Very high	95.3	Very high	8 Å²	8	28.6 Å²	28.6	4%	0.041	15%	0.145	C	C	.	.	H	α-helix	trans	-60.5	-41.3	177.8	-69.9	161.2	0	0	0	111.2	F287 W299 F300 F460 L584 Y585 K586 S592	F287-I588 HydrophobicContact CE1-CD1 3.9Å; W299-I588 HydrophobicContact CH2-CG2 4.22Å; W299-I588 HydrophobicContact CZ3-CG2 4.02Å; F300-I588 HydrophobicContact CD2-CG2 4.44Å; F300-I588 HydrophobicContact CE1-CG2 4.42Å; F300-I588 HydrophobicContact CE2-CB 4.43Å; F300-I588 HydrophobicContact CE2-CD1 3.48Å; F300-I588 VanDerWaalsContact CE2-CD1 3.48Å; F300-I588 HydrophobicContact CE2-CG1 4.29Å; F300-I588 HydrophobicContact CE2-CG2 3.67Å; F300-I588 HydrophobicContact CZ-CD1 3.72Å; F300-I588 HydrophobicContact CZ-CG1 4.26Å; F300-I588 HydrophobicContact CZ-CG2 3.67Å; F460-I588 HydrophobicContact CD2-CG1 4.5Å; F460-I588 HydrophobicContact CE2-CB 4.48Å; F460-I588 HydrophobicContact CE2-CD1 4.4Å; F460-I588 HydrophobicContact CE2-CG1 3.43Å; F460-I588 VanDerWaalsContact CE2-CG1 3.43Å; F460-I588 HydrophobicContact CZ-CD1 4.18Å; F460-I588 HydrophobicContact CZ-CG1 3.57Å; L584-I588 HydrophobicContact CD1-CD1 4.33Å; L584-I588 HydrophobicContact CG-CD1 4.05Å; L584-I588 WeakPolarHBondContact O-CD1 3.38Å; L584-I588 WeakPolarHBondContact O-CG1 3.27Å; L584-I588 PolarHBondContact O-N 3.17Å; Y585-I588 PolarHBondContact O-N 2.73Å; K586-I588 VanDerWaalsContact C-N 3.27Å; K586-I588 PolarHBondContact O-N 3.42Å; I588-S592 VanDerWaalsContact O-CB 3.24Å; I588-S592 WeakPolarHBondContact O-CB 3.26Å; I588-S592 PolarHBondContact O-N 3.09Å; I588-S592 PolarHBondContact O-OG 2.79Å
589	N	94.5	Very high	95.3	Very high	41 Å²	41	25.3 Å²	25.3	22%	0.219	13%	0.13	C	C	.	.	H	α-helix	trans	-65.4	-45.2	175.8	-176.6	34.2	0	0	0	111.9	W299 Y585 K586 L587 Y591 S592 Q593 Q620	W299-N589 HydrophobicContact CH2-CB 4.15Å; W299-N589 HydrophobicContact CZ2-CB 4.44Å; Y585-N589 PolarHBondContact O-N 2.81Å; K586-N589 WeakPolarHBondContact O-CB 3.41Å; K586-N589 PolarHBondContact O-N 3.21Å; K586-N589 VanDerWaalsContact O-N 3.11Å; L587-N589 VanDerWaalsContact C-N 3.31Å; L587-N589 PolarHBondContact O-N 2.98Å; N589-Y591 VanDerWaalsContact C-N 3.34Å; N589-Y591 PolarHBondContact O-N 3.19Å; N589-S592 PolarHBondContact O-N 3.39Å; N589-S592 VanDerWaalsContact O-N 3.15Å; N589-Q593 WeakPolarHBondContact O-CG 3.27Å; N589-Q593 PolarHBondContact O-N 3.44Å; N589-Q593 PolarHBondContact OD1-NE2 2.88Å; N589-Q620 PolarHBondContact ND2-OE1 3.3Å
590	V	94.3	Very high	95.4	Very high	60 Å²	60	25.5 Å²	25.5	36%	0.364	13%	0.131	S	C	.	.	H	α-helix	trans	-53.9	-52.5	175.6	172.5	0	0	0	0	110.5	K586 L587 S592 Q593 D594	K586-V590 WeakPolarHBondContact O-CG2 3.35Å; K586-V590 PolarHBondContact O-N 2.96Å; L587-V590 PolarHBondContact O-N 3.36Å; V590-S592 VanDerWaalsContact C-N 3.31Å; V590-S592 PolarHBondContact O-N 3.4Å; V590-Q593 WeakPolarHBondContact O-CB 3.44Å; V590-Q593 PolarHBondContact O-N 2.96Å; V590-Q593 VanDerWaalsContact O-N 3.12Å; V590-D594 PolarHBondContact O-N 2.8Å
591	Y	95.6	Very high	95.3	Very high	9 Å²	9	28.9 Å²	28.9	4%	0.035	15%	0.149	C	C	.	.	H	α-helix	trans	-69.1	-27.8	-179.6	-85.7	-84.4	0	0	0	113.7	I456 S459 F460 E463 R568 L587 N589 Q593 D594 L595	I456-Y591 HydrophobicContact CG2-CD1 3.72Å; I456-Y591 HydrophobicContact CG2-CE1 4.34Å; I456-Y591 VanDerWaalsContact O-CD1 3.3Å; I456-Y591 WeakPolarHBondContact O-CD1 3.14Å; I456-Y591 VanDerWaalsContact O-CE1 3.3Å; I456-Y591 WeakPolarHBondContact O-CE1 3.44Å; S459-Y591 VanDerWaalsContact C-OH 3.24Å; S459-Y591 WeakPolarHBondContact CB-OH 3.38Å; S459-Y591 PolarHBondContact O-OH 3.38Å; F460-Y591 HydrophobicContact CB-CD1 3.64Å; F460-Y591 HydrophobicContact CB-CD2 3.91Å; F460-Y591 HydrophobicContact CB-CE1 3.96Å; F460-Y591 HydrophobicContact CB-CE2 4.2Å; F460-Y591 HydrophobicContact CB-CG 3.6Å; F460-Y591 AromaticContact CD2-CD2 3.93Å; F460-Y591 HydrophobicContact CD2-CD2 3.93Å; F460-Y591 HydrophobicContact CD2-CG 4.15Å; F460-Y591 HydrophobicContact CG-CD2 4.41Å; F460-Y591 HydrophobicContact CG-CG 4.28Å; F460-Y591 VanDerWaalsContact N-CE1 3.27Å; E463-Y591 HydrophobicContact CB-CE2 4.31Å; E463-Y591 VanDerWaalsContact OE2-CE2 3.3Å; E463-Y591 WeakPolarHBondContact OE2-CE2 3.48Å; E463-Y591 VanDerWaalsContact OE2-CZ 3.32Å; E463-Y591 PolarHBondContact OE2-OH 2.97Å; R568-Y591 PolarHBondContact NH1-OH 3.5Å; L587-Y591 HydrophobicContact CD1-CD2 3.82Å; L587-Y591 HydrophobicContact CD1-CE2 3.64Å; L587-Y591 HydrophobicContact CG-CD2 3.94Å; L587-Y591 HydrophobicContact CG-CE2 4.13Å; L587-Y591 WeakPolarHBondContact O-CD2 3.4Å; L587-Y591 PolarHBondContact O-N 3.04Å; N589-Y591 VanDerWaalsContact C-N 3.34Å; N589-Y591 PolarHBondContact O-N 3.19Å; Y591-Q593 VanDerWaalsContact C-N 3.35Å; Y591-D594 PolarHBondContact O-N 3.28Å; Y591-L595 WeakPolarHBondContact O-CG 3.36Å; Y591-L595 PolarHBondContact O-N 3.23Å
592	S	94	Very high	95.1	Very high	10 Å²	10	29.8 Å²	29.8	7%	0.07	15%	0.153	C	C	.	.	H	α-helix	trans	-70.1	-31.9	171.9	-61.2	0	0	0	0	112.4	V303 I588 N589 V590 L596 N617	V303-S592 WeakPolarHBondContact CG1-OG 3.49Å; I588-S592 VanDerWaalsContact O-CB 3.24Å; I588-S592 WeakPolarHBondContact O-CB 3.26Å; I588-S592 PolarHBondContact O-N 3.09Å; I588-S592 PolarHBondContact O-OG 2.79Å; N589-S592 PolarHBondContact O-N 3.39Å; N589-S592 VanDerWaalsContact O-N 3.15Å; V590-S592 VanDerWaalsContact C-N 3.31Å; V590-S592 PolarHBondContact O-N 3.4Å; S592-L596 PolarHBondContact O-N 2.98Å; S592-N617 PolarHBondContact O-ND2 2.76Å
593	Q	95.3	Very high	94.8	Very high	64 Å²	64	28.4 Å²	28.4	30%	0.299	15%	0.146	S	C	.	.	H	α-helix	trans	-73.8	-39.6	170.8	-62.8	-55.5	-27.5	0	0	111.5	N589 V590 Y591 L595 L596 N597 N617	N589-Q593 WeakPolarHBondContact O-CG 3.27Å; N589-Q593 PolarHBondContact O-N 3.44Å; N589-Q593 PolarHBondContact OD1-NE2 2.88Å; V590-Q593 WeakPolarHBondContact O-CB 3.44Å; V590-Q593 PolarHBondContact O-N 2.96Å; V590-Q593 VanDerWaalsContact O-N 3.12Å; Y591-Q593 VanDerWaalsContact C-N 3.35Å; Q593-L595 VanDerWaalsContact C-N 3.29Å; Q593-L595 PolarHBondContact O-N 3.19Å; Q593-L596 PolarHBondContact O-N 3.17Å; Q593-L596 VanDerWaalsContact O-N 3.17Å; Q593-N597 WeakPolarHBondContact O-CB 3.4Å; Q593-N597 VanDerWaalsContact O-CG 3.3Å; Q593-N597 PolarHBondContact O-N 2.92Å; Q593-N597 PolarHBondContact O-ND2 3.23Å; Q593-N617 PolarHBondContact NE2-ND2 2.95Å
594	D	95.2	Very high	94.6	Very high	42 Å²	42	34.8 Å²	34.8	23%	0.225	17%	0.173	C	C	.	.	H	α-helix	trans	-59.8	-41.3	175	-73.6	-10.3	0	0	0	111.2	I456 R568 V590 Y591 M598	I456-D594 HydrophobicContact CG2-CB 4.24Å; R568-D594 IonicContact CZ-OD2 3.56Å; R568-D594 IonicContact NH2-OD2 3.58Å; R568-D594 PolarHBondContact NH2-OD2 3.04Å; V590-D594 PolarHBondContact O-N 2.8Å; Y591-D594 PolarHBondContact O-N 3.28Å; D594-M598 WeakPolarHBondContact O-CB 3.29Å; D594-M598 PolarHBondContact O-N 3.28Å
595	L	95.2	Very high	94.2	Very high	14 Å²	14	41.6 Å²	41.6	7%	0.073	21%	0.209	C	C	.	.	H	α-helix	trans	-61	-47.9	171.9	-76.8	174.8	0	0	0	112.4	N307 F453 I456 Y591 Q593 M598 F599	N307-L595 HydrophobicContact CB-CD1 4.38Å; F453-L595 HydrophobicContact CD2-CD2 3.62Å; F453-L595 HydrophobicContact CE2-CD2 4.03Å; I456-L595 HydrophobicContact CB-CD2 3.95Å; I456-L595 HydrophobicContact CD1-CD2 4.11Å; I456-L595 HydrophobicContact CG2-CD2 3.69Å; I456-L595 HydrophobicContact CG2-CG 3.73Å; Y591-L595 WeakPolarHBondContact O-CG 3.36Å; Y591-L595 PolarHBondContact O-N 3.23Å; Q593-L595 VanDerWaalsContact C-N 3.29Å; Q593-L595 PolarHBondContact O-N 3.19Å; L595-M598 HydrophobicContact CD2-CE 4.08Å; L595-M598 WeakPolarHBondContact O-CB 3.48Å; L595-M598 PolarHBondContact O-N 2.86Å; L595-F599 HydrophobicContact CB-CE2 4.28Å; L595-F599 WeakPolarHBondContact O-CD2 3.49Å; L595-F599 PolarHBondContact O-N 3.47Å
596	L	95.9	Very high	93.7	Very high	9 Å²	9	43.9 Å²	43.9	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-58.8	-49.2	178	170.4	59.3	0	0	0	111.6	S592 Q593 M598 F599 I600 L610	S592-L596 PolarHBondContact O-N 2.98Å; Q593-L596 PolarHBondContact O-N 3.17Å; Q593-L596 VanDerWaalsContact O-N 3.17Å; L596-M598 VanDerWaalsContact C-N 3.3Å; L596-M598 PolarHBondContact O-N 3.1Å; L596-F599 PolarHBondContact O-N 3.14Å; L596-I600 HydrophobicContact CD1-CD1 3.71Å; L596-I600 HydrophobicContact CD1-CG1 4.02Å; L596-I600 HydrophobicContact CG-CD1 3.87Å; L596-I600 WeakPolarHBondContact O-CG1 3.25Å; L596-I600 PolarHBondContact O-N 3.04Å; L596-L610 HydrophobicContact CD1-CD1 4.15Å
597	N	96.4	Very high	93.2	Very high	73 Å²	73	48.2 Å²	48.2	39%	0.39	25%	0.248	S	C	.	.	H	α-helix	trans	-60.9	-41.5	179.1	-69.8	-28.3	0	0	0	111.2	Q593 F599 I600 D601	Q593-N597 WeakPolarHBondContact O-CB 3.4Å; Q593-N597 VanDerWaalsContact O-CG 3.3Å; Q593-N597 PolarHBondContact O-N 2.92Å; Q593-N597 PolarHBondContact O-ND2 3.23Å; N597-F599 PolarHBondContact O-N 3.34Å; N597-I600 PolarHBondContact O-N 2.85Å; N597-D601 WeakPolarHBondContact O-CB 3.41Å; N597-D601 PolarHBondContact O-N 3.37Å
598	M	95.8	Very high	92.9	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-55.8	-51.5	173.4	178.4	-85.4	-67.6	0	0	111.2	R452 F453 I456 D594 L595 L596 I600 D601 E602	R452-M598 HydrophobicContact CB-CG 4.09Å; R452-M598 HydrophobicContact CB-SD 4.48Å; F453-M598 HydrophobicContact CB-CE 3.94Å; F453-M598 HydrophobicContact CD2-CE 4.28Å; I456-M598 HydrophobicContact CD1-CB 3.75Å; I456-M598 HydrophobicContact CD1-CE 4.35Å; I456-M598 HydrophobicContact CD1-CG 3.96Å; D594-M598 WeakPolarHBondContact O-CB 3.29Å; D594-M598 PolarHBondContact O-N 3.28Å; L595-M598 HydrophobicContact CD2-CE 4.08Å; L595-M598 WeakPolarHBondContact O-CB 3.48Å; L595-M598 PolarHBondContact O-N 2.86Å; L596-M598 VanDerWaalsContact C-N 3.3Å; L596-M598 PolarHBondContact O-N 3.1Å; M598-I600 VanDerWaalsContact C-N 3.34Å; M598-I600 PolarHBondContact O-N 2.88Å; M598-D601 PolarHBondContact O-N 2.85Å; M598-E602 VanDerWaalsContact O-CG 3.3Å; M598-E602 WeakPolarHBondContact O-CG 3.4Å; M598-E602 PolarHBondContact O-N 2.9Å; M598-E602 HydrophobicContact SD-CG 3.99Å
599	F	95.4	Very high	92.7	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63	-38.1	179.2	-65.1	-57.8	0	0	0	113.4	N307 R310 L311 C314 F453 L595 L596 N597 L603 L610	N307-F599 WeakPolarHBondContact O-CE2 3.29Å; N307-F599 WeakPolarHBondContact O-CZ 3.26Å; R310-F599 HydrophobicContact CB-CB 4.26Å; R310-F599 HydrophobicContact CB-CD1 4.17Å; R310-F599 HydrophobicContact CB-CD2 3.44Å; R310-F599 VanDerWaalsContact CB-CD2 3.44Å; R310-F599 HydrophobicContact CB-CE1 4.38Å; R310-F599 HydrophobicContact CB-CE2 3.69Å; R310-F599 HydrophobicContact CB-CG 3.7Å; R310-F599 HydrophobicContact CB-CZ 4.15Å; R310-F599 HydrophobicContact CG-CD2 4.14Å; L311-F599 HydrophobicContact CB-CE1 3.87Å; L311-F599 HydrophobicContact CB-CZ 3.81Å; L311-F599 HydrophobicContact CD1-CE1 4.06Å; C314-F599 HydrophobicContact CB-CD1 4.46Å; F453-F599 AromaticContact CD2-CZ 3.8Å; F453-F599 HydrophobicContact CD2-CZ 3.8Å; F453-F599 HydrophobicContact CE2-CZ 4.22Å; L595-F599 HydrophobicContact CB-CE2 4.28Å; L595-F599 WeakPolarHBondContact O-CD2 3.49Å; L595-F599 PolarHBondContact O-N 3.47Å; L596-F599 PolarHBondContact O-N 3.14Å; N597-F599 PolarHBondContact O-N 3.34Å; F599-L603 PolarHBondContact O-N 2.79Å; F599-L603 VanDerWaalsContact O-N 3.09Å; F599-L610 HydrophobicContact CB-CD1 4.48Å
600	I	95.3	Very high	92.6	Very high	46 Å²	46	54.7 Å²	54.7	24%	0.236	29%	0.286	C	S	.	.	H	α-helix	trans	-62.7	-44.7	175.5	-72.1	171.9	0	0	0	110.6	L596 N597 M598 L603 K604 L610	L596-I600 HydrophobicContact CD1-CD1 3.71Å; L596-I600 HydrophobicContact CD1-CG1 4.02Å; L596-I600 HydrophobicContact CG-CD1 3.87Å; L596-I600 WeakPolarHBondContact O-CG1 3.25Å; L596-I600 PolarHBondContact O-N 3.04Å; N597-I600 PolarHBondContact O-N 2.85Å; M598-I600 VanDerWaalsContact C-N 3.34Å; M598-I600 PolarHBondContact O-N 2.88Å; I600-L603 PolarHBondContact O-N 3.22Å; I600-K604 HydrophobicContact CG2-CD 4.01Å; I600-K604 HydrophobicContact CG2-CG 4.41Å; I600-K604 WeakPolarHBondContact O-CB 3.5Å; I600-K604 VanDerWaalsContact O-CG 3.29Å; I600-K604 WeakPolarHBondContact O-CG 3.27Å; I600-K604 PolarHBondContact O-N 2.83Å; I600-L610 HydrophobicContact CG1-CD1 4.07Å
601	D	94.2	Very high	92.5	Very high	71 Å²	71	53.5 Å²	53.5	38%	0.38	28%	0.28	S	S	.	.	H	α-helix	trans	-66.3	-42.4	-179	-68.8	-18.7	0	0	0	111.4	N597 M598 L603 K604 L605	N597-D601 WeakPolarHBondContact O-CB 3.41Å; N597-D601 PolarHBondContact O-N 3.37Å; M598-D601 PolarHBondContact O-N 2.85Å; D601-L603 VanDerWaalsContact C-N 3.34Å; D601-L603 PolarHBondContact O-N 2.96Å; D601-K604 PolarHBondContact O-N 3.35Å; D601-K604 IonicContact OD1-NZ 2.83Å; D601-L605 WeakPolarHBondContact O-CG 3.41Å; D601-L605 PolarHBondContact O-N 2.7Å
602	E	92	Very high	92.2	Very high	19 Å²	19	58.2 Å²	58.2	9%	0.089	31%	0.309	C	S	.	.	H	α-helix	trans	-61.6	-40.4	175.9	-64.3	-62.9	147.8	0	0	112	H448 I449 R452 M598 L605	H448-E602 IonicContact CE1-OE1 2.81Å; H448-E602 PolarHBondContact CE1-OE1 2.86Å; H448-E602 IonicContact CE1-OE2 2.73Å; H448-E602 IonicContact ND1-OE1 3.37Å; H448-E602 PolarHBondContact ND1-OE1 2.84Å; H448-E602 IonicContact ND1-OE2 2.94Å; H448-E602 PolarHBondContact ND1-OE2 3.01Å; I449-E602 HydrophobicContact CG1-CB 4.2Å; I449-E602 HydrophobicContact CG1-CG 3.88Å; I449-E602 WeakPolarHBondContact CG1-OE2 3.31Å; R452-E602 WeakPolarHBondContact CD-OE1 3.25Å; R452-E602 IonicContact CZ-OE1 3.03Å; R452-E602 IonicContact NH1-OE1 2.73Å; R452-E602 PolarHBondContact NH1-OE1 3.48Å; M598-E602 VanDerWaalsContact O-CG 3.3Å; M598-E602 WeakPolarHBondContact O-CG 3.4Å; M598-E602 PolarHBondContact O-N 2.9Å; M598-E602 HydrophobicContact SD-CG 3.99Å; E602-L605 PolarHBondContact O-N 3.47Å
603	L	90.8	Very high	92	Very high	10 Å²	10	64.1 Å²	64.1	5%	0.052	34%	0.336	C	S	.	.	H	α-helix	trans	-73.9	-35.6	179.1	-75.6	167.2	0	0	0	113	Y313 F599 I600 D601 L605 S606 E607 N608 L610	Y313-L603 HydrophobicContact CD1-CD1 3.99Å; Y313-L603 HydrophobicContact CD1-CD2 4.28Å; Y313-L603 HydrophobicContact CE1-CD1 4.05Å; Y313-L603 HydrophobicContact CE1-CD2 4.07Å; F599-L603 PolarHBondContact O-N 2.79Å; F599-L603 VanDerWaalsContact O-N 3.09Å; I600-L603 PolarHBondContact O-N 3.22Å; D601-L603 VanDerWaalsContact C-N 3.34Å; D601-L603 PolarHBondContact O-N 2.96Å; L603-L605 VanDerWaalsContact C-N 3.25Å; L603-L605 PolarHBondContact O-N 2.98Å; L603-S606 CarbonylContact O-C 3.28Å; L603-S606 WeakPolarHBondContact O-CA 3.36Å; L603-S606 PolarHBondContact O-N 3.4Å; L603-S606 PolarHBondContact O-OG 3.3Å; L603-E607 PolarHBondContact O-N 3.27Å; L603-N608 CarbonylContact C-O 3.33Å; L603-N608 HydrophobicContact CD2-CB 3.93Å; L603-N608 PolarHBondContact O-N 3.33Å; L603-L610 HydrophobicContact CD1-CB 4.42Å; L603-L610 HydrophobicContact CD1-CD2 3.33Å; L603-L610 HydrophobicContact CD1-CG 3.46Å; L603-L610 VanDerWaalsContact CD1-CG 3.46Å
604	K	90.7	Very high	91.9	Very high	135 Å²	135	61.5 Å²	61.5	59%	0.587	32%	0.324	S	S	*	.	H	α-helix	trans	-57.9	-38.2	172.7	-78.8	171.7	-177.4	164.9	0	112.1	I600 D601 S606 E607	I600-K604 HydrophobicContact CG2-CD 4.01Å; I600-K604 HydrophobicContact CG2-CG 4.41Å; I600-K604 WeakPolarHBondContact O-CB 3.5Å; I600-K604 VanDerWaalsContact O-CG 3.29Å; I600-K604 WeakPolarHBondContact O-CG 3.27Å; I600-K604 PolarHBondContact O-N 2.83Å; D601-K604 PolarHBondContact O-N 3.35Å; D601-K604 IonicContact OD1-NZ 2.83Å; K604-S606 PolarHBondContact O-N 2.99Å; K604-E607 PolarHBondContact O-N 3.43Å; K604-E607 VanDerWaalsContact O-N 3.16Å
605	L	87.1	Confident	91.8	Very high	143 Å²	143	63.9 Å²	63.9	75%	0.749	33%	0.333	S	S	*	.	H	α-helix	trans	-63	-25.4	175	-67.3	171.9	0	0	0	112.7	D601 E602 L603	D601-L605 WeakPolarHBondContact O-CG 3.41Å; D601-L605 PolarHBondContact O-N 2.7Å; E602-L605 PolarHBondContact O-N 3.47Å; L603-L605 VanDerWaalsContact C-N 3.25Å; L603-L605 PolarHBondContact O-N 2.98Å
606	S	85.7	Confident	91.8	Very high	56 Å²	56	66.4 Å²	66.4	39%	0.392	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	8.7	177.3	72.9	0	0	0	0	114.3	L603 K604 N608	L603-S606 CarbonylContact O-C 3.28Å; L603-S606 WeakPolarHBondContact O-CA 3.36Å; L603-S606 PolarHBondContact O-N 3.4Å; L603-S606 PolarHBondContact O-OG 3.3Å; K604-S606 PolarHBondContact O-N 2.99Å; S606-N608 PolarHBondContact O-N 3.25Å; S606-N608 VanDerWaalsContact O-N 3.15Å; S606-N608 PolarHBondContact O-ND2 3.49Å; S606-N608 PolarHBondContact OG-ND2 3.02Å
607	E	84.5	Confident	91.6	Very high	188 Å²	188	66.7 Å²	66.7	88%	0.879	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	24.1	-173.4	-58	-176.1	169.7	0	0	114.2	L603 K604	L603-E607 PolarHBondContact O-N 3.27Å; K604-E607 PolarHBondContact O-N 3.43Å; K604-E607 VanDerWaalsContact O-N 3.16Å
608	N	87.7	Confident	91.5	Very high	87 Å²	87	65 Å²	65	47%	0.465	35%	0.347	S	S	.	.			trans	-108.4	164.4	177.1	-67.5	-54.8	0	0	0	111.1	L603 S606	L603-N608 CarbonylContact C-O 3.33Å; L603-N608 HydrophobicContact CD2-CB 3.93Å; L603-N608 PolarHBondContact O-N 3.33Å; S606-N608 PolarHBondContact O-N 3.25Å; S606-N608 VanDerWaalsContact O-N 3.15Å; S606-N608 PolarHBondContact O-ND2 3.49Å; S606-N608 PolarHBondContact OG-ND2 3.02Å
609	T	91.3	Very high	91.4	Very high	101 Å²	101	71.3 Å²	71.3	62%	0.62	39%	0.385	S	S	*	.			trans	-126.3	157	174.1	60.1	0	0	0	0	110.7	Y313	Y313-T609 PolarHBondContact OH-O 2.7Å
610	L	92.5	Very high	91.4	Very high	10 Å²	10	73.2 Å²	73.2	5%	0.052	39%	0.394	C	S	.	.			trans	-67.2	152.4	171.4	-74.9	169.6	0	0	0	110.1	R310 Y313 L596 F599 I600 L603 L614 E615	R310-L610 HydrophobicContact CB-CD2 4.39Å; R310-L610 HydrophobicContact CG-CD1 4.17Å; R310-L610 HydrophobicContact CG-CD2 4.03Å; Y313-L610 HydrophobicContact CD1-CD2 3.93Å; Y313-L610 HydrophobicContact CE1-CD2 4.48Å; L596-L610 HydrophobicContact CD1-CD1 4.15Å; F599-L610 HydrophobicContact CB-CD1 4.48Å; I600-L610 HydrophobicContact CG1-CD1 4.07Å; L603-L610 HydrophobicContact CD1-CB 4.42Å; L603-L610 HydrophobicContact CD1-CD2 3.33Å; L603-L610 HydrophobicContact CD1-CG 3.46Å; L603-L610 VanDerWaalsContact CD1-CG 3.46Å; L610-L614 HydrophobicContact CB-CB 4.3Å; L610-L614 HydrophobicContact CD2-CB 4.38Å; L610-E615 HydrophobicContact CB-CG 3.98Å
611	P	91.5	Very high	91.4	Very high	35 Å²	35	72.3 Å²	72.3	23%	0.227	39%	0.391	C	S	.	.			trans	-56.4	146.1	163.3	-22.1	33.1	0	0	0	110.7	Y313 E613 L614 E615	Y313-P611 HydrophobicContact CD2-CG 3.91Å; Y313-P611 HydrophobicContact CE2-CG 3.62Å; P611-E613 PolarHBondContact O-N 3.47Å; P611-L614 HydrophobicContact CG-CD1 4.31Å; P611-L614 WeakPolarHBondContact O-CA 3.33Å; P611-L614 PolarHBondContact O-N 3.16Å; P611-E615 PolarHBondContact O-N 2.94Å
612	V	89.9	Confident	91.3	Very high	107 Å²	107	76.1 Å²	76.1	65%	0.648	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-36.7	-174.2	177.9	0	0	0	0	112.1	L614 E615	V612-L614 PolarHBondContact O-N 2.94Å; V612-E615 PolarHBondContact O-N 3.35Å
613	E	90.2	Very high	91.2	Very high	135 Å²	135	75.8 Å²	75.8	63%	0.631	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-23.2	179.4	-56.8	80.6	-171.9	0	0	113.2	R306 P611	R306-E613 PolarHBondContact NH1-O 3.36Å; P611-E613 PolarHBondContact O-N 3.47Å
614	L	93.5	Very high	90.7	Very high	9 Å²	9	78.3 Å²	78.3	5%	0.047	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-11	-176.2	-60	-176.8	0	0	0	113.6	R306 C309 R310 L319 L610 P611 V612 S616	R306-L614 HydrophobicContact CB-CD2 4.22Å; R306-L614 HydrophobicContact CG-CD2 4.04Å; C309-L614 HydrophobicContact CB-CD1 3.87Å; C309-L614 HydrophobicContact CB-CD2 3.84Å; R310-L614 HydrophobicContact CG-CB 4.03Å; R310-L614 HydrophobicContact CG-CD1 4.29Å; R310-L614 VanDerWaalsContact CZ-O 3.25Å; R310-L614 PolarHBondContact NE-O 3.16Å; R310-L614 PolarHBondContact NH2-O 3.2Å; L319-L614 HydrophobicContact CD1-CD1 3.97Å; L610-L614 HydrophobicContact CB-CB 4.3Å; L610-L614 HydrophobicContact CD2-CB 4.38Å; P611-L614 HydrophobicContact CG-CD1 4.31Å; P611-L614 WeakPolarHBondContact O-CA 3.33Å; P611-L614 PolarHBondContact O-N 3.16Å; V612-L614 PolarHBondContact O-N 2.94Å; L614-S616 PolarHBondContact O-N 3.29Å; L614-S616 VanDerWaalsContact O-N 3.17Å
615	E	92.8	Very high	89.4	Confident	91 Å²	91	81.5 Å²	81.5	43%	0.425	44%	0.435	S	S	.	.	S	Bend	trans	-63.4	-21.1	-176.6	-74.5	-178.9	164	0	0	114.4	L610 P611 V612	L610-E615 HydrophobicContact CB-CG 3.98Å; P611-E615 PolarHBondContact O-N 2.94Å; V612-E615 PolarHBondContact O-N 3.35Å
616	S	94.1	Very high	88	Confident	67 Å²	67	80.2 Å²	80.2	47%	0.469	42%	0.423	S	S	.	.	S	Bend	trans	-139.8	155.6	-178.7	61.2	0	0	0	0	112.6	R306 R310 L614	R306-S616 PolarHBondContact NH1-O 3.45Å; R310-S616 VanDerWaalsContact NH2-C 3.27Å; R310-S616 PolarHBondContact NH2-O 3.03Å; L614-S616 PolarHBondContact O-N 3.29Å; L614-S616 VanDerWaalsContact O-N 3.17Å
617	N	93	Very high	86.2	Confident	16 Å²	16	84.3 Å²	84.3	9%	0.086	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-82.9	143.6	167	-72.2	-29.9	0	0	0	109.8	R310 S592 Q593	R310-N617 PolarHBondContact NH1-OD1 3.19Å; R310-N617 PolarHBondContact NH2-OD1 3.15Å; S592-N617 PolarHBondContact O-ND2 2.76Å; Q593-N617 PolarHBondContact NE2-ND2 2.95Å
618	P	93.7	Very high	83.9	Confident	37 Å²	37	87.6 Å²	87.6	24%	0.24	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-58.5	148.6	168.1	27.1	-33.4	0	0	0	110	W299 E302 V303 Q620	W299-P618 PolarHBondContact NE1-O 2.9Å; E302-P618 HydrophobicContact CB-CG 4.36Å; V303-P618 HydrophobicContact CG2-CG 3.82Å; P618-Q620 PolarHBondContact O-N 3.07Å
619	V	94.2	Very high	83.7	Confident	134 Å²	134	87.7 Å²	87.7	81%	0.812	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-59.7	128.8	178.7	179.1	0	0	0	0	109.3	W299 P621	W299-V619 VanDerWaalsContact CD1-O 3.31Å; V619-P621 WeakPolarHBondContact O-CD 3.41Å
620	Q	95	Very high	83.3	Confident	41 Å²	41	86.9 Å²	86.9	19%	0.192	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-65.9	118.9	178.2	-172.8	179.2	38.2	0	0	110.1	W299 Y585 N589 P618	W299-Q620 HydrophobicContact CD2-CG 4.24Å; W299-Q620 HydrophobicContact CE3-CG 4.44Å; W299-Q620 HydrophobicContact CH2-CG 4.11Å; W299-Q620 HydrophobicContact CZ2-CB 3.81Å; W299-Q620 HydrophobicContact CZ2-CG 3.86Å; W299-Q620 HydrophobicContact CZ3-CG 4.39Å; Y585-Q620 HydrophobicContact CD1-CG 4.46Å; Y585-Q620 HydrophobicContact CE1-CG 3.6Å; Y585-Q620 VanDerWaalsContact CE1-NE2 3.26Å; Y585-Q620 HydrophobicContact CE2-CG 4.18Å; Y585-Q620 VanDerWaalsContact CE2-NE2 3.25Å; Y585-Q620 VanDerWaalsContact CZ-CG 3.43Å; Y585-Q620 PolarHBondContact O-NE2 2.93Å; Y585-Q620 VanDerWaalsContact OH-CG 3.25Å; Y585-Q620 WeakPolarHBondContact OH-CG 3.43Å; N589-Q620 PolarHBondContact ND2-OE1 3.3Å; P618-Q620 PolarHBondContact O-N 3.07Å
621	P	94.8	Very high	82.8	Confident	27 Å²	27	91.2 Å²	91.2	18%	0.175	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-70.5	158	176.8	28.6	-33.6	0	0	0	110.7	E295 P296 W299 Y585 V619	E295-P621 HydrophobicContact CB-CB 3.93Å; E295-P621 HydrophobicContact CB-CG 4.05Å; P296-P621 HydrophobicContact CG-CG 4.38Å; W299-P621 HydrophobicContact CB-CG 3.8Å; W299-P621 HydrophobicContact CG-CG 4.23Å; Y585-P621 WeakPolarHBondContact CE1-O 3.44Å; Y585-P621 VanDerWaalsContact OH-CD 3.27Å; Y585-P621 WeakPolarHBondContact OH-CD 3.5Å; Y585-P621 WeakPolarHBondContact OH-CG 3.48Å; Y585-P621 PolarHBondContact OH-O 3.43Å; V619-P621 WeakPolarHBondContact O-CD 3.41Å
622	I	92.6	Very high	82.3	Confident	150 Å²	150	94.5 Å²	94.5	77%	0.769	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-71.2	134.9	178.5	-59	172.2	0	0	0	109	C624	I622-C624 PolarHBondContact O-N 3.49Å
623	L	90	Very high	81.8	Confident	12 Å²	12	93.8 Å²	93.8	6%	0.063	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-65.8	122.7	173	-168	69.9	0	0	0	109.1	Y289 I290 C293 P296 A581 N582 Y585 R625	Y289-L623 HydrophobicContact CD1-CD1 4.39Å; Y289-L623 HydrophobicContact CD1-CD2 3.87Å; Y289-L623 HydrophobicContact CD1-CG 4.28Å; Y289-L623 HydrophobicContact CE1-CD1 4.41Å; Y289-L623 HydrophobicContact CE1-CD2 3.66Å; Y289-L623 HydrophobicContact CE1-CG 3.89Å; I290-L623 HydrophobicContact CB-CD1 4.38Å; I290-L623 HydrophobicContact CG1-CD1 4.13Å; I290-L623 HydrophobicContact CG2-CD1 4.49Å; C293-L623 HydrophobicContact CB-CD1 4.48Å; P296-L623 HydrophobicContact CB-CD1 4.37Å; P296-L623 HydrophobicContact CG-CD1 4.06Å; A581-L623 HydrophobicContact CB-CD2 3.98Å; N582-L623 WeakPolarHBondContact OD1-CD2 3.4Å; Y585-L623 HydrophobicContact CD1-CB 4.13Å; Y585-L623 HydrophobicContact CD1-CD1 4.45Å; Y585-L623 HydrophobicContact CE1-CB 4.32Å; L623-R625 PolarHBondContact O-N 3.27Å
624	C	79.7	Confident	81.2	Confident	64 Å²	64	91 Å²	91	43%	0.432	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-59.6	136.7	-179.3	-58.1	0	0	0	0	110.1	Y289 C293 I622 K626	Y289-C624 PolarHBondContact OH-O 3.19Å; C293-C624 HydrophobicContact CB-CB 4.49Å; I622-C624 PolarHBondContact O-N 3.49Å; C624-K626 PolarHBondContact O-N 3.06Å
625	R	64.6	Low	80.3	Confident	202 Å²	202	96.9 Å²	96.9	76%	0.762	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-72.9	121.4	159.7	-67.8	-169.4	-179	164.1	1.9	106.6	L623 V627	L623-R625 PolarHBondContact O-N 3.27Å; R625-V627 PolarHBondContact O-N 2.91Å
626	K	56.3	Low	79.4	Confident	116 Å²	116	97.3 Å²	97.3	50%	0.504	51%	0.505	S	S	.	.			trans	-59.1	112.5	164.8	-78.9	-174.3	177.7	178.1	0	106.2	Y289 D292 C624 E628	Y289-K626 HydrophobicContact CD2-CD 4.43Å; Y289-K626 HydrophobicContact CE2-CD 3.97Å; Y289-K626 HydrophobicContact CE2-CG 4.1Å; Y289-K626 PolarHBondContact OH-N 2.8Å; D292-K626 WeakPolarHBondContact OD2-CE 3.44Å; D292-K626 IonicContact OD2-NZ 3.73Å; D292-K626 PolarHBondContact OD2-NZ 2.98Å; C624-K626 PolarHBondContact O-N 3.06Å; K626-E628 PolarHBondContact O-N 3.01Å
627	V	47.7	Very low	78.2	Confident	141 Å²	141	99.8 Å²	99.8	86%	0.855	51%	0.508	S	S	*	.			trans	-69.9	113	162.1	-177.1	0	0	0	0	104	R625	R625-V627 PolarHBondContact O-N 2.91Å
628	E	36.5	Very low	76.8	Confident	258 Å²	258	107.5 Å²	107.5	100%	1.206	55%	0.546	S	S	*	.			trans	-52.5	0	-179.6	-71.3	-177.1	154.4	0	0	113.1	K626	K626-E628 PolarHBondContact O-N 3.01Å

Retrieved 628 of 628 residues in 361.9 ms (Link to these results)

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