A0A087YB83_POEFO Loading...

HEAT repeat containing 3

AlphaFold DB , UniProt , Accession A0A087YB83, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 678 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	28	Very low	40.8	Very low	169 Å²	169	90.4 Å²	90.4	83%	0.833	46%	0.459	S	S	*	.				0	71.9	0	-77.8	-143.4	-74.4	0	0	111.1	D603	M1-D603 PolarHBondContact N-OD2 3.44Å
2	G	29.6	Very low	39.7	Very low	34 Å²	34	90.3 Å²	90.3	35%	0.351	47%	0.469	S	S	.	.			trans	-110.2	77.2	165.4	0	0	0	0	0	109.8	S4	G2-S4 PolarHBondContact O-N 3.46Å
3	K	35.2	Very low	38.8	Very low	159 Å²	159	91.9 Å²	91.9	69%	0.691	47%	0.473	S	S	*	.			trans	-79	84.1	168	-68.5	-174.5	-178.2	-179.4	0	106.9	K5 L410	K3-K5 PolarHBondContact O-N 3.01Å; K3-L410 HydrophobicContact CD-CD1 4.45Å
4	S	35.1	Very low	38.4	Very low	72 Å²	72	93.7 Å²	93.7	50%	0.503	48%	0.476	S	S	.	.			trans	-56.3	110.5	165.5	-167.3	0	0	0	0	106.4	G2 T6	G2-S4 PolarHBondContact O-N 3.46Å; S4-T6 PolarHBondContact O-N 3.01Å
5	K	38.4	Very low	37.5	Very low	152 Å²	152	97.4 Å²	97.4	66%	0.661	50%	0.497	S	S	*	.			trans	-57.1	134.1	169.5	-74.1	-175.3	175.9	-174.5	0	106.4	K3 T7	K3-K5 PolarHBondContact O-N 3.01Å; K5-T7 PolarHBondContact O-N 2.64Å
6	T	42.6	Very low	36.8	Very low	28 Å²	28	98.6 Å²	98.6	17%	0.172	52%	0.517	C	S	.	.			trans	-57.3	110.2	165.7	37.8	0	0	0	0	106.3	S4 K8 C373 C374	S4-T6 PolarHBondContact O-N 3.01Å; T6-K8 PolarHBondContact O-N 3.17Å; T6-C373 PolarHBondContact OG1-O 2.89Å; T6-C373 VanDerWaalsContact OG1-O 3.12Å; T6-C374 PolarHBondContact O-SG 3.3Å; T6-C374 VanDerWaalsContact O-SG 3.42Å
7	T	46.3	Very low	36.3	Very low	115 Å²	115	101.5 Å²	101.5	71%	0.706	53%	0.531	S	S	*	.			trans	-75.3	123	175	49.1	0	0	0	0	106.4	K5 F9	K5-T7 PolarHBondContact O-N 2.64Å; T7-F9 PolarHBondContact O-N 3.5Å
8	K	47.9	Very low	36.2	Very low	66 Å²	66	99.5 Å²	99.5	29%	0.287	54%	0.539	S	S	.	.			trans	-47.3	132.5	167.1	-73	-179.6	177	178.3	0	107.9	T6 K10 N371 C374 D376	T6-K8 PolarHBondContact O-N 3.17Å; K8-K10 HydrophobicContact CB-CG 4.25Å; K8-K10 PolarHBondContact O-N 2.82Å; K8-N371 VanDerWaalsContact CA-OD1 3.27Å; K8-N371 WeakPolarHBondContact CA-OD1 3.39Å; K8-N371 WeakPolarHBondContact CB-OD1 3.4Å; K8-C374 HydrophobicContact CD-CB 4.29Å; K8-C374 HydrophobicContact CG-CB 3.46Å; K8-C374 VanDerWaalsContact CG-CB 3.46Å; K8-C374 VanDerWaalsContact CG-SG 3.51Å; K8-C374 PolarHBondContact N-SG 3.12Å; K8-D376 WeakPolarHBondContact CE-OD1 3.42Å; K8-D376 IonicContact NZ-OD1 2.69Å; K8-D376 PolarHBondContact NZ-OD1 3.03Å
9	F	57.7	Low	35.6	Very low	43 Å²	43	102.1 Å²	102.1	19%	0.189	55%	0.552	C	S	.	*			trans	-63.7	96	160.1	-84.2	-71.3	0	0	0	106.1	T7 E367 V370 N371 R463 T466	T7-F9 PolarHBondContact O-N 3.5Å; F9-E367 HydrophobicContact CB-CB 4.16Å; F9-E367 HydrophobicContact CB-CG 4.29Å; F9-E367 HydrophobicContact CD1-CG 4.33Å; F9-E367 HydrophobicContact CD2-CB 4.28Å; F9-E367 HydrophobicContact CD2-CG 4.07Å; F9-E367 HydrophobicContact CG-CB 4.26Å; F9-E367 HydrophobicContact CG-CG 3.97Å; F9-V370 HydrophobicContact CD2-CB 3.56Å; F9-V370 HydrophobicContact CD2-CG1 3.41Å; F9-V370 VanDerWaalsContact CD2-CG1 3.41Å; F9-V370 HydrophobicContact CD2-CG2 3.79Å; F9-V370 HydrophobicContact CE2-CB 3.89Å; F9-V370 HydrophobicContact CE2-CG1 3.71Å; F9-V370 HydrophobicContact CE2-CG2 3.59Å; F9-N371 PolarHBondContact N-OD1 3.32Å; F9-N371 PolarHBondContact O-ND2 2.7Å; F9-N371 PolarHBondContact O-OD1 3.36Å; F9-R463 VanDerWaalsContact CZ-CD 3.46Å; F9-T466 HydrophobicContact CE2-CG2 3.58Å; F9-T466 HydrophobicContact CZ-CG2 3.52Å
10	K	42.5	Very low	34.8	Very low	115 Å²	115	103.5 Å²	103.5	50%	0.5	57%	0.566	S	S	.	*			trans	-85.7	136	163	-61.5	-164.8	179.3	-143.2	0	106.7	K8 E210 D211	K8-K10 HydrophobicContact CB-CG 4.25Å; K8-K10 PolarHBondContact O-N 2.82Å; K10-E210 VanDerWaalsContact CA-OE1 3.24Å; K10-E210 WeakPolarHBondContact CA-OE1 3.41Å; K10-D211 WeakPolarHBondContact CE-OD2 3.2Å; K10-D211 IonicContact NZ-OD2 3.72Å; K10-D211 PolarHBondContact NZ-OD2 3.4Å
11	R	45.3	Very low	34.5	Very low	41 Å²	41	104.1 Å²	104.1	16%	0.155	57%	0.573	C	S	.	*			trans	-57.3	145.4	160.3	-67.2	177.5	-175.1	-147.5	18.8	108.3	Q13 E166 H206 T207 E210	R11-Q13 PolarHBondContact O-N 3.44Å; R11-E166 WeakPolarHBondContact CD-OE1 3.45Å; R11-E166 IonicContact CZ-OE1 3.58Å; R11-E166 IonicContact NH1-OE1 2.72Å; R11-E166 PolarHBondContact NH1-OE1 3.27Å; R11-H206 PolarHBondContact NH2-ND1 3.48Å; R11-H206 VanDerWaalsContact NH2-ND1 3.12Å; R11-T207 VanDerWaalsContact CZ-OG1 3.31Å; R11-T207 PolarHBondContact NH1-OG1 3.49Å; R11-E210 VanDerWaalsContact CD-OE2 3.26Å; R11-E210 WeakPolarHBondContact CD-OE2 3.3Å; R11-E210 WeakPolarHBondContact CG-OE2 3.44Å; R11-E210 PolarHBondContact N-OE1 2.74Å; R11-E210 IonicContact NE-OE2 3.21Å
12	P	28.2	Very low	34.2	Very low	90 Å²	90	103.7 Å²	103.7	58%	0.584	58%	0.575	S	S	*	*			trans	-55	97.6	-178.5	-23.4	32.6	0	0	0	111.1	F14	P12-F14 HydrophobicContact CB-CE2 3.81Å; P12-F14 HydrophobicContact CB-CZ 3.78Å; P12-F14 WeakPolarHBondContact O-CD2 2.96Å; P12-F14 WeakPolarHBondContact O-CE2 3.37Å
13	Q	27.2	Very low	33.9	Very low	111 Å²	111	106.2 Å²	106.2	52%	0.519	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-94.3	119	171	-73.4	-173.9	-3.4	0	0	107.3	R11	R11-Q13 PolarHBondContact O-N 3.44Å
14	F	33.3	Very low	33.5	Very low	117 Å²	117	105.2 Å²	105.2	51%	0.513	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-96.4	131.7	-176.3	-61.3	-84.6	0	0	0	110	P12 Q110	P12-F14 HydrophobicContact CB-CE2 3.81Å; P12-F14 HydrophobicContact CB-CZ 3.78Å; P12-F14 WeakPolarHBondContact O-CD2 2.96Å; P12-F14 WeakPolarHBondContact O-CE2 3.37Å; F14-Q110 HydrophobicContact CB-CG 4.4Å; F14-Q110 VanDerWaalsContact CD1-OE1 3.27Å; F14-Q110 HydrophobicContact CD2-CB 4.3Å; F14-Q110 VanDerWaalsContact CD2-CD 3.47Å; F14-Q110 HydrophobicContact CD2-CG 3.9Å; F14-Q110 HydrophobicContact CE2-CB 4.41Å; F14-Q110 HydrophobicContact CE2-CG 4.49Å; F14-Q110 HydrophobicContact CG-CG 4.32Å
15	N	25.6	Very low	32.9	Very low	149 Å²	149	111 Å²	111	80%	0.797	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-84.8	152.1	-176.3	-77.2	-14.5	0	0	0	112.5	I17	N15-I17 VanDerWaalsContact C-N 3.25Å; N15-I17 PolarHBondContact O-N 3.39Å
16	S	25.8	Very low	32.6	Very low	116 Å²	116	112.7 Å²	112.7	81%	0.811	63%	0.625	S	S	*	*	S	Bend	trans	-71.8	21.5	-163	50.5	0	0	0	0	117.9
17	I	28.9	Very low	31.8	Very low	148 Å²	148	115 Å²	115	76%	0.759	65%	0.647	S	S	*	*			trans	-141.7	86.1	175.6	-49.9	175.7	0	0	0	108.7	N15 L19	N15-I17 VanDerWaalsContact C-N 3.25Å; N15-I17 PolarHBondContact O-N 3.39Å; I17-L19 PolarHBondContact O-N 3.23Å
18	G	33.7	Very low	31	Very low	66 Å²	66	116.9 Å²	116.9	68%	0.68	65%	0.652	S	S	*	*			trans	-56.3	135.7	164.8	0	0	0	0	0	111.1
19	L	24.2	Very low	30.2	Very low	149 Å²	149	120.8 Å²	120.8	78%	0.78	67%	0.672	S	S	*	*			trans	101.6	143.3	166	-56.1	168.7	0	0	0	118.8	I17	I17-L19 PolarHBondContact O-N 3.23Å
20	P	19.5	Very low	29	Very low	129 Å²	129	128 Å²	128	84%	0.838	71%	0.706	S	S	*	*				-107	129.5	124.7	14.5	1.8	0	0	0	111.6
21	V	28.6	Very low	28.7	Very low	117 Å²	117	129.7 Å²	129.7	71%	0.709	72%	0.716	S	S	*	*			trans	-72.2	125.2	170.9	175.2	0	0	0	0	110.1
22	N	21.9	Very low	28.2	Very low	161 Å²	161	135.1 Å²	135.1	86%	0.861	75%	0.748	S	S	*	*			trans	-162.5	114.6	138	-95.8	-29.3	0	0	0	112.6
23	A	23.1	Very low	28.8	Very low	86 Å²	86	139.2 Å²	139.2	71%	0.711	76%	0.759	S	S	*	*			trans	69.9	79.8	147.5	0	0	0	0	0	120.2
24	V	28.6	Very low	29.5	Very low	138 Å²	138	142.7 Å²	142.7	84%	0.836	78%	0.775	S	S	*	*				44.9	113.3	121.4	-169.8	0	0	0	0	118.3
25	K	22.5	Very low	30.4	Very low	194 Å²	194	142.5 Å²	142.5	84%	0.843	79%	0.789	S	S	*	*				-159.1	109.8	105.6	-102.3	178.5	-178.5	-176.5	0	109	A27	K25-A27 VanDerWaalsContact C-N 3.3Å; K25-A27 PolarHBondContact O-N 3.28Å
26	E	30.4	Very low	32.2	Very low	188 Å²	188	137.8 Å²	137.8	88%	0.879	77%	0.767	S	S	*	*			trans	-55.3	103.3	151.3	-72.7	170.7	167.6	0	0	106
27	A	25.6	Very low	35	Very low	76 Å²	76	135 Å²	135	63%	0.628	75%	0.745	S	S	*	*			trans	-86.8	108.3	152.4	0	0	0	0	0	103.9	K25 E29	K25-A27 VanDerWaalsContact C-N 3.3Å; K25-A27 PolarHBondContact O-N 3.28Å; A27-E29 PolarHBondContact O-N 3.43Å
28	D	30.2	Very low	37.8	Very low	154 Å²	154	127.9 Å²	127.9	82%	0.824	71%	0.709	S	S	*	*			trans	-55.3	91.2	157.1	-76.3	-39	0	0	0	106.6	E30	D28-E30 VanDerWaalsContact C-N 3.32Å; D28-E30 PolarHBondContact O-N 3.45Å
29	E	32.1	Very low	40.5	Very low	149 Å²	149	126.8 Å²	126.8	70%	0.696	69%	0.694	S	S	*	*			trans	-78	96.5	156.1	-71.1	-172.7	173.5	0	0	104.6	A27 H31	A27-E29 PolarHBondContact O-N 3.43Å; E29-H31 PolarHBondContact O-N 3.19Å
30	E	31.8	Very low	43.8	Very low	193 Å²	193	125 Å²	125	90%	0.902	68%	0.682	S	S	*	*			trans	-53.8	89.8	157	-76.4	178	160.2	0	0	106.7	D28 D32	D28-E30 VanDerWaalsContact C-N 3.32Å; D28-E30 PolarHBondContact O-N 3.45Å; E30-D32 PolarHBondContact O-N 2.97Å
31	H	36.7	Very low	47.4	Very low	152 Å²	152	119.5 Å²	119.5	70%	0.704	65%	0.645	S	S	*	*			trans	-67.2	119.5	163.5	-89.2	-52.6	0	0	0	106.6	E29 E33	E29-H31 PolarHBondContact O-N 3.19Å; H31-E33 PolarHBondContact O-N 3.35Å
32	D	34	Very low	50.5	Low	155 Å²	155	114 Å²	114	83%	0.829	61%	0.612	S	S	*	*			trans	-40.1	111.6	167.1	-90.4	-33.7	0	0	0	109.5	E30 E34	E30-D32 PolarHBondContact O-N 2.97Å; D32-E34 PolarHBondContact O-N 3.25Å
33	E	41.8	Very low	54	Low	175 Å²	175	112.7 Å²	112.7	82%	0.818	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-66.7	0.6	178.7	-76.2	-170	136.7	0	0	113.1	H31 S35	H31-E33 PolarHBondContact O-N 3.35Å; E33-S35 PolarHBondContact O-N 3.27Å
34	E	40.6	Very low	57.4	Low	185 Å²	185	111.7 Å²	111.7	86%	0.864	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-90	11.3	-162.7	-103.9	-178.4	175.4	0	0	116.7	D32	D32-E34 PolarHBondContact O-N 3.25Å
35	S	53.5	Low	60.6	Low	113 Å²	113	105.4 Å²	105.4	79%	0.79	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-146.9	16.7	-179.8	-153.2	0	0	0	0	118	E33 P37	E33-S35 PolarHBondContact O-N 3.27Å; S35-P37 WeakPolarHBondContact O-CD 3.5Å
36	C	62.8	Low	64	Low	50 Å²	50	103.4 Å²	103.4	34%	0.338	54%	0.535	S	S	.	.			trans	-95.4	112.7	173.7	-167.9	0	0	0	0	110.9	A38	C36-A38 PolarHBondContact O-N 3.27Å; C36-A38 WeakPolarHBondContact SG-CB 3.49Å
37	P	83.9	Confident	67.1	Low	56 Å²	56	95.5 Å²	95.5	36%	0.364	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	1.9	179.5	30.3	-36.1	0	0	0	113.3	S35 A39 E40 L41 V63	S35-P37 WeakPolarHBondContact O-CD 3.5Å; P37-A39 VanDerWaalsContact C-N 3.33Å; P37-A39 PolarHBondContact O-N 2.87Å; P37-E40 PolarHBondContact O-N 3.19Å; P37-L41 HydrophobicContact CB-CD1 4.12Å; P37-L41 HydrophobicContact CB-CG 4.4Å; P37-L41 HydrophobicContact CG-CD1 4.34Å; P37-L41 WeakPolarHBondContact O-CB 3.39Å; P37-L41 WeakPolarHBondContact O-CG 3.37Å; P37-L41 PolarHBondContact O-N 3.4Å; P37-V63 HydrophobicContact CG-CG2 4.44Å
38	A	88.4	Confident	70.3	Confident	0 Å²	0	98 Å²	98	0%	0	51%	0.511	C	S	.	.	H	α-helix	trans	-56.9	-41.3	-174.8	0	0	0	0	0	113.4	C36 L42 F73	C36-A38 PolarHBondContact O-N 3.27Å; C36-A38 WeakPolarHBondContact SG-CB 3.49Å; A38-L42 VanDerWaalsContact O-CB 3.24Å; A38-L42 WeakPolarHBondContact O-CB 3.44Å; A38-L42 WeakPolarHBondContact O-CD1 3.39Å; A38-L42 WeakPolarHBondContact O-CG 3.48Å; A38-L42 PolarHBondContact O-N 3.43Å; A38-F73 HydrophobicContact CB-CD1 3.68Å; A38-F73 HydrophobicContact CB-CD2 4.05Å; A38-F73 HydrophobicContact CB-CE1 3.59Å; A38-F73 HydrophobicContact CB-CE2 3.97Å; A38-F73 HydrophobicContact CB-CG 3.91Å; A38-F73 HydrophobicContact CB-CZ 3.76Å
39	A	90.6	Very high	73.5	Confident	43 Å²	43	92.6 Å²	92.6	36%	0.355	49%	0.485	S	S	.	.	H	α-helix	trans	-62.6	-52.7	-179.9	0	0	0	0	0	111.7	P37 L41 L42 E43	P37-A39 VanDerWaalsContact C-N 3.33Å; P37-A39 PolarHBondContact O-N 2.87Å; A39-L41 PolarHBondContact O-N 3.17Å; A39-L42 PolarHBondContact O-N 3.13Å; A39-E43 WeakPolarHBondContact O-CG 3.31Å; A39-E43 PolarHBondContact O-N 2.99Å
40	E	93.3	Very high	76.5	Confident	112 Å²	112	86.8 Å²	86.8	52%	0.523	46%	0.462	S	S	.	.	H	α-helix	trans	-61.4	-44.6	-179	-166.9	-165.6	153.7	0	0	111.5	P37 E43 K44	P37-E40 PolarHBondContact O-N 3.19Å; E40-E43 PolarHBondContact O-N 2.89Å; E40-K44 WeakPolarHBondContact O-CG 3.26Å; E40-K44 PolarHBondContact O-N 2.9Å; E40-K44 WeakPolarHBondContact OE1-CE 3.46Å; E40-K44 IonicContact OE1-NZ 3.65Å; E40-K44 PolarHBondContact OE1-NZ 3.42Å
41	L	94.3	Very high	79.5	Confident	12 Å²	12	83.2 Å²	83.2	6%	0.063	45%	0.449	C	S	.	.	H	α-helix	trans	-65.8	-42.1	-179.6	-68.1	176.6	0	0	0	112.1	P37 A39 E43 K44 I60 F73	P37-L41 HydrophobicContact CB-CD1 4.12Å; P37-L41 HydrophobicContact CB-CG 4.4Å; P37-L41 HydrophobicContact CG-CD1 4.34Å; P37-L41 WeakPolarHBondContact O-CB 3.39Å; P37-L41 WeakPolarHBondContact O-CG 3.37Å; P37-L41 PolarHBondContact O-N 3.4Å; A39-L41 PolarHBondContact O-N 3.17Å; L41-E43 VanDerWaalsContact C-N 3.31Å; L41-E43 PolarHBondContact O-N 3.39Å; L41-K44 PolarHBondContact O-N 3.36Å; L41-I60 HydrophobicContact CB-CD1 4.19Å; L41-I60 HydrophobicContact CB-CG1 3.81Å; L41-I60 HydrophobicContact CD1-CG1 4.09Å; L41-F73 HydrophobicContact CD1-CZ 4.2Å
42	L	95.3	Very high	82.3	Confident	3 Å²	3	79.5 Å²	79.5	2%	0.016	43%	0.434	C	S	.	.	H	α-helix	trans	-70.7	-25.4	178.9	-70.3	173.6	0	0	0	113.2	A38 A39 L45 I60 F73 R76 A78 R81	A38-L42 VanDerWaalsContact O-CB 3.24Å; A38-L42 WeakPolarHBondContact O-CB 3.44Å; A38-L42 WeakPolarHBondContact O-CD1 3.39Å; A38-L42 WeakPolarHBondContact O-CG 3.48Å; A38-L42 PolarHBondContact O-N 3.43Å; A39-L42 PolarHBondContact O-N 3.13Å; L42-L45 HydrophobicContact CD2-CD1 3.83Å; L42-I60 HydrophobicContact CD2-CD1 3.95Å; L42-F73 HydrophobicContact CD1-CD1 4.12Å; L42-F73 HydrophobicContact CD2-CD1 4.33Å; L42-F73 HydrophobicContact CG-CD1 4.17Å; L42-F73 HydrophobicContact CG-CE1 4.34Å; L42-R76 HydrophobicContact CD1-CB 3.56Å; L42-A78 HydrophobicContact CD1-CB 4.17Å; L42-A78 HydrophobicContact CD2-CB 3.91Å; L42-R81 HydrophobicContact CD2-CB 4.34Å
43	E	94.6	Very high	85.4	Confident	132 Å²	132	73.6 Å²	73.6	62%	0.617	40%	0.4	S	S	*	.	H	α-helix	trans	-71.3	-40.4	171.2	-76.4	-179.7	-179.4	0	0	111.8	A39 E40 L41 L45 Q46	A39-E43 WeakPolarHBondContact O-CG 3.31Å; A39-E43 PolarHBondContact O-N 2.99Å; E40-E43 PolarHBondContact O-N 2.89Å; L41-E43 VanDerWaalsContact C-N 3.31Å; L41-E43 PolarHBondContact O-N 3.39Å; E43-L45 PolarHBondContact O-N 3.15Å; E43-L45 VanDerWaalsContact O-N 3.15Å; E43-Q46 PolarHBondContact O-N 3.04Å
44	K	94.9	Very high	87.9	Confident	65 Å²	65	68.6 Å²	68.6	28%	0.283	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-23	178.9	-71.5	-176.5	-154.2	-141.6	0	113.7	E40 L41 Q46 S47 I52 A56	E40-K44 WeakPolarHBondContact O-CG 3.26Å; E40-K44 PolarHBondContact O-N 2.9Å; E40-K44 WeakPolarHBondContact OE1-CE 3.46Å; E40-K44 IonicContact OE1-NZ 3.65Å; E40-K44 PolarHBondContact OE1-NZ 3.42Å; L41-K44 PolarHBondContact O-N 3.36Å; K44-Q46 PolarHBondContact O-N 3.01Å; K44-S47 WeakPolarHBondContact O-CB 3.29Å; K44-S47 PolarHBondContact O-N 3.06Å; K44-I52 HydrophobicContact CB-CG2 3.93Å; K44-I52 HydrophobicContact CD-CG2 4.39Å; K44-I52 HydrophobicContact CG-CG2 4.21Å; K44-A56 HydrophobicContact CB-CB 3.68Å
45	L	95.2	Very high	90.5	Very high	7 Å²	7	65.3 Å²	65.3	4%	0.037	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.7	172.5	-61.4	-179.2	0	0	0	113.4	L42 E43 S47 R53 A56 C57 I60 R81 L82	L42-L45 HydrophobicContact CD2-CD1 3.83Å; E43-L45 PolarHBondContact O-N 3.15Å; E43-L45 VanDerWaalsContact O-N 3.15Å; L45-S47 VanDerWaalsContact C-N 3.31Å; L45-R53 WeakPolarHBondContact O-CD 3.48Å; L45-R53 WeakPolarHBondContact O-CG 3.49Å; L45-A56 HydrophobicContact CD2-CB 3.83Å; L45-A56 HydrophobicContact CG-CB 4.47Å; L45-C57 WeakPolarHBondContact CD2-SG 3.43Å; L45-I60 HydrophobicContact CD1-CD1 4.08Å; L45-I60 HydrophobicContact CD2-CD1 4.27Å; L45-I60 HydrophobicContact CG-CD1 4.36Å; L45-R81 HydrophobicContact CD1-CB 4.09Å; L45-L82 HydrophobicContact CD1-CD2 3.86Å; L45-L82 HydrophobicContact CD1-CG 4.25Å; L45-L82 HydrophobicContact CD2-CD2 4.35Å
46	Q	93.6	Very high	92.6	Very high	151 Å²	151	60 Å²	60	71%	0.706	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	1.1	178.2	-58	-175.9	5.6	0	0	113.2	E43 K44	E43-Q46 PolarHBondContact O-N 3.04Å; K44-Q46 PolarHBondContact O-N 3.01Å
47	S	95.1	Very high	94.2	Very high	23 Å²	23	57.6 Å²	57.6	16%	0.161	31%	0.306	C	S	.	.			trans	-62.6	140.9	-179.8	-179.6	0	0	0	0	111.7	K44 L45 S49 R53	K44-S47 WeakPolarHBondContact O-CB 3.29Å; K44-S47 PolarHBondContact O-N 3.06Å; L45-S47 VanDerWaalsContact C-N 3.31Å; S47-S49 PolarHBondContact O-N 3.37Å; S47-S49 PolarHBondContact OG-N 2.98Å; S47-R53 WeakPolarHBondContact O-CD 3.46Å; S47-R53 WeakPolarHBondContact O-CG 3.49Å; S47-R53 PolarHBondContact O-NH1 3.43Å
48	P	94.4	Very high	94.6	Very high	129 Å²	129	57 Å²	57	84%	0.838	31%	0.306	S	S	*	.	S	Bend	trans	-67.2	-23.2	171.6	28.4	-34.9	0	0	0	112.8	R53	P48-R53 VanDerWaalsContact C-NH1 3.33Å; P48-R53 PolarHBondContact O-NH1 3.29Å; P48-R53 VanDerWaalsContact O-NH1 3.08Å
49	S	96.3	Very high	94.9	Very high	40 Å²	40	58.2 Å²	58.2	28%	0.28	32%	0.315	S	S	.	.			trans	-79.2	125.1	178	165.3	0	0	0	0	111	S47 D51 I52 R53	S47-S49 PolarHBondContact O-N 3.37Å; S47-S49 PolarHBondContact OG-N 2.98Å; S49-D51 VanDerWaalsContact C-N 3.33Å; S49-D51 PolarHBondContact OG-N 3.14Å; S49-I52 PolarHBondContact O-N 2.93Å; S49-I52 PolarHBondContact OG-N 3.13Å; S49-R53 PolarHBondContact O-N 3.21Å; S49-R53 PolarHBondContact O-NH1 2.9Å
50	A	96.1	Very high	95.1	Very high	27 Å²	27	56.3 Å²	56.3	22%	0.223	30%	0.298	C	S	.	.	H	α-helix	trans	-60.9	-42.1	176	0	0	0	0	0	111.8	I52 R53 E54 V93	A50-I52 VanDerWaalsContact C-N 3.29Å; A50-I52 PolarHBondContact O-N 3.29Å; A50-R53 PolarHBondContact O-N 3.1Å; A50-R53 VanDerWaalsContact O-N 3.08Å; A50-E54 WeakPolarHBondContact O-CB 3.46Å; A50-E54 PolarHBondContact O-N 2.95Å; A50-V93 HydrophobicContact CB-CG2 4.26Å; A50-V93 WeakPolarHBondContact O-CG2 3.25Å
51	D	95.1	Very high	95.1	Very high	118 Å²	118	52 Å²	52	63%	0.631	28%	0.28	S	S	*	.	H	α-helix	trans	-60	-39.1	-179.8	-46.5	-22.8	0	0	0	112	S49 F55	S49-D51 VanDerWaalsContact C-N 3.33Å; S49-D51 PolarHBondContact OG-N 3.14Å; D51-F55 VanDerWaalsContact O-CB 3.3Å; D51-F55 WeakPolarHBondContact O-CB 3.4Å; D51-F55 PolarHBondContact O-N 3.42Å
52	I	95.6	Very high	94.9	Very high	73 Å²	73	59.2 Å²	59.2	37%	0.374	31%	0.307	S	S	.	.	H	α-helix	trans	-68.1	-40.1	176.5	-65.6	178.2	0	0	0	111	K44 S49 A50 A56	K44-I52 HydrophobicContact CB-CG2 3.93Å; K44-I52 HydrophobicContact CD-CG2 4.39Å; K44-I52 HydrophobicContact CG-CG2 4.21Å; S49-I52 PolarHBondContact O-N 2.93Å; S49-I52 PolarHBondContact OG-N 3.13Å; A50-I52 VanDerWaalsContact C-N 3.29Å; A50-I52 PolarHBondContact O-N 3.29Å; I52-A56 WeakPolarHBondContact O-CB 3.46Å; I52-A56 PolarHBondContact O-N 3.45Å
53	R	97.6	Very high	94.7	Very high	32 Å²	32	60.6 Å²	60.6	12%	0.121	32%	0.315	C	S	.	.	H	α-helix	trans	-66.6	-44	176.9	-65.2	-163.8	-58.3	-74.9	-1.4	111.2	L45 S47 P48 S49 A50 A56 C57 D88 V93	L45-R53 WeakPolarHBondContact O-CD 3.48Å; L45-R53 WeakPolarHBondContact O-CG 3.49Å; S47-R53 WeakPolarHBondContact O-CD 3.46Å; S47-R53 WeakPolarHBondContact O-CG 3.49Å; S47-R53 PolarHBondContact O-NH1 3.43Å; P48-R53 VanDerWaalsContact C-NH1 3.33Å; P48-R53 PolarHBondContact O-NH1 3.29Å; P48-R53 VanDerWaalsContact O-NH1 3.08Å; S49-R53 PolarHBondContact O-N 3.21Å; S49-R53 PolarHBondContact O-NH1 2.9Å; A50-R53 PolarHBondContact O-N 3.1Å; A50-R53 VanDerWaalsContact O-N 3.08Å; R53-A56 WeakPolarHBondContact O-CB 3.35Å; R53-A56 PolarHBondContact O-N 3.07Å; R53-C57 WeakPolarHBondContact O-CB 3.45Å; R53-C57 PolarHBondContact O-N 3.49Å; R53-C57 PolarHBondContact O-SG 3.36Å; R53-C57 VanDerWaalsContact O-SG 3.33Å; R53-D88 IonicContact CZ-OD1 3.19Å; R53-D88 IonicContact CZ-OD2 3.7Å; R53-D88 IonicContact NE-OD1 3.34Å; R53-D88 IonicContact NE-OD2 3.45Å; R53-D88 PolarHBondContact NE-OD2 3.44Å; R53-D88 VanDerWaalsContact NH2-CG 3.29Å; R53-D88 IonicContact NH2-OD1 2.68Å; R53-D88 PolarHBondContact NH2-OD1 3.3Å; R53-D88 IonicContact NH2-OD2 2.64Å; R53-D88 PolarHBondContact NH2-OD2 2.93Å; R53-V93 HydrophobicContact CB-CG1 4.14Å; R53-V93 HydrophobicContact CB-CG2 4.03Å
54	E	95.9	Very high	94.5	Very high	69 Å²	69	54.3 Å²	54.3	32%	0.322	29%	0.286	S	S	.	.	H	α-helix	trans	-59.3	-49.9	176.4	-178.4	-173.9	162.3	0	0	111	A50 A56 C57 A58 A92 V93 T96	A50-E54 WeakPolarHBondContact O-CB 3.46Å; A50-E54 PolarHBondContact O-N 2.95Å; E54-A56 VanDerWaalsContact C-N 3.28Å; E54-A56 PolarHBondContact O-N 2.91Å; E54-C57 PolarHBondContact O-N 3.33Å; E54-A58 WeakPolarHBondContact O-CB 3.4Å; E54-A58 PolarHBondContact O-N 3.42Å; E54-A92 VanDerWaalsContact CD-CB 3.45Å; E54-A92 HydrophobicContact CG-CB 4.16Å; E54-A92 VanDerWaalsContact OE2-CB 3.27Å; E54-A92 WeakPolarHBondContact OE2-CB 3.43Å; E54-V93 HydrophobicContact CB-CG2 3.96Å; E54-T96 HydrophobicContact CG-CG2 3.94Å
55	F	94.6	Very high	94.2	Very high	117 Å²	117	55.1 Å²	55.1	51%	0.513	29%	0.291	S	S	.	.	H	α-helix	trans	-56.6	-43.7	175.8	172.2	-94.3	0	0	0	111.9	D51 A58 S59	D51-F55 VanDerWaalsContact O-CB 3.3Å; D51-F55 WeakPolarHBondContact O-CB 3.4Å; D51-F55 PolarHBondContact O-N 3.42Å; F55-A58 PolarHBondContact O-N 3.03Å; F55-S59 VanDerWaalsContact O-CB 3.3Å; F55-S59 WeakPolarHBondContact O-CB 3.37Å; F55-S59 PolarHBondContact O-N 3.38Å; F55-S59 PolarHBondContact O-OG 3.33Å
56	A	96.9	Very high	93.8	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63	-49	177.9	0	0	0	0	0	111.2	K44 L45 I52 R53 E54 A58 S59 I60	K44-A56 HydrophobicContact CB-CB 3.68Å; L45-A56 HydrophobicContact CD2-CB 3.83Å; L45-A56 HydrophobicContact CG-CB 4.47Å; I52-A56 WeakPolarHBondContact O-CB 3.46Å; I52-A56 PolarHBondContact O-N 3.45Å; R53-A56 WeakPolarHBondContact O-CB 3.35Å; R53-A56 PolarHBondContact O-N 3.07Å; E54-A56 VanDerWaalsContact C-N 3.28Å; E54-A56 PolarHBondContact O-N 2.91Å; A56-A58 PolarHBondContact O-N 3.42Å; A56-S59 PolarHBondContact O-N 3.37Å; A56-I60 WeakPolarHBondContact O-CG1 3.34Å; A56-I60 PolarHBondContact O-N 3.08Å
57	C	96.9	Very high	93.3	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58.5	-46.3	176	-71.8	0	0	0	0	112.5	L45 R53 E54 S59 I60 S61 T96 A97	L45-C57 WeakPolarHBondContact CD2-SG 3.43Å; R53-C57 WeakPolarHBondContact O-CB 3.45Å; R53-C57 PolarHBondContact O-N 3.49Å; R53-C57 PolarHBondContact O-SG 3.36Å; R53-C57 VanDerWaalsContact O-SG 3.33Å; E54-C57 PolarHBondContact O-N 3.33Å; C57-S59 VanDerWaalsContact C-N 3.34Å; C57-S59 PolarHBondContact O-N 2.76Å; C57-I60 PolarHBondContact O-N 3.15Å; C57-S61 WeakPolarHBondContact O-CB 3.23Å; C57-S61 PolarHBondContact O-N 3.01Å; C57-T96 VanDerWaalsContact CB-OG1 3.31Å; C57-T96 WeakPolarHBondContact CB-OG1 3.33Å; C57-A97 HydrophobicContact CB-CB 4.38Å
58	A	93.2	Very high	93	Very high	43 Å²	43	61.4 Å²	61.4	36%	0.355	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-41.9	177.6	0	0	0	0	0	111.8	E54 F55 A56 S61 R62 T96	E54-A58 WeakPolarHBondContact O-CB 3.4Å; E54-A58 PolarHBondContact O-N 3.42Å; F55-A58 PolarHBondContact O-N 3.03Å; A56-A58 PolarHBondContact O-N 3.42Å; A58-S61 WeakPolarHBondContact O-CB 3.49Å; A58-S61 PolarHBondContact O-N 2.9Å; A58-R62 PolarHBondContact O-N 3.16Å; A58-T96 HydrophobicContact CB-CG2 4.07Å
59	S	93.9	Very high	92.8	Very high	27 Å²	27	56 Å²	56	19%	0.189	29%	0.292	C	S	.	.	H	α-helix	trans	-64.3	-44.6	176.2	-61.3	0	0	0	0	111.5	F55 A56 C57 S61 R62 V63	F55-S59 VanDerWaalsContact O-CB 3.3Å; F55-S59 WeakPolarHBondContact O-CB 3.37Å; F55-S59 PolarHBondContact O-N 3.38Å; F55-S59 PolarHBondContact O-OG 3.33Å; A56-S59 PolarHBondContact O-N 3.37Å; C57-S59 VanDerWaalsContact C-N 3.34Å; C57-S59 PolarHBondContact O-N 2.76Å; S59-S61 VanDerWaalsContact C-N 3.34Å; S59-S61 PolarHBondContact O-N 3.3Å; S59-R62 PolarHBondContact O-N 3.1Å; S59-V63 VanDerWaalsContact O-CG2 3.28Å; S59-V63 WeakPolarHBondContact O-CG2 3.43Å; S59-V63 PolarHBondContact O-N 3.41Å
60	I	95.1	Very high	92.5	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-59.6	-48.3	174.5	-64.4	166.7	0	0	0	109.7	L41 L42 L45 A56 C57 R62 V63 V64 F73 L82 A100	L41-I60 HydrophobicContact CB-CD1 4.19Å; L41-I60 HydrophobicContact CB-CG1 3.81Å; L41-I60 HydrophobicContact CD1-CG1 4.09Å; L42-I60 HydrophobicContact CD2-CD1 3.95Å; L45-I60 HydrophobicContact CD1-CD1 4.08Å; L45-I60 HydrophobicContact CD2-CD1 4.27Å; L45-I60 HydrophobicContact CG-CD1 4.36Å; A56-I60 WeakPolarHBondContact O-CG1 3.34Å; A56-I60 PolarHBondContact O-N 3.08Å; C57-I60 PolarHBondContact O-N 3.15Å; I60-R62 PolarHBondContact O-N 3.31Å; I60-V63 PolarHBondContact O-N 3.35Å; I60-V63 VanDerWaalsContact O-N 3.09Å; I60-V64 HydrophobicContact CG2-CG1 3.87Å; I60-V64 WeakPolarHBondContact O-CG1 3.21Å; I60-V64 VanDerWaalsContact O-CG2 3.31Å; I60-V64 WeakPolarHBondContact O-CG2 3.42Å; I60-V64 PolarHBondContact O-N 3.49Å; I60-F73 HydrophobicContact CB-CE1 4.32Å; I60-F73 HydrophobicContact CD1-CE1 4.36Å; I60-F73 HydrophobicContact CG1-CE1 3.74Å; I60-F73 HydrophobicContact CG1-CZ 4.22Å; I60-F73 HydrophobicContact CG2-CD1 4.18Å; I60-F73 HydrophobicContact CG2-CE1 3.86Å; I60-F73 HydrophobicContact CG2-CZ 4.25Å; I60-L82 HydrophobicContact CD1-CD2 4.22Å; I60-L82 HydrophobicContact CG2-CD1 4.25Å; I60-A100 HydrophobicContact CB-CB 4.37Å; I60-A100 HydrophobicContact CG2-CB 4.13Å
61	S	92.1	Very high	92.3	Very high	21 Å²	21	56.3 Å²	56.3	15%	0.147	29%	0.29	C	S	.	.	H	α-helix	trans	-54.3	-38.4	178.6	-175.9	0	0	0	0	112.9	C57 A58 S59 Q65 N103	C57-S61 WeakPolarHBondContact O-CB 3.23Å; C57-S61 PolarHBondContact O-N 3.01Å; A58-S61 WeakPolarHBondContact O-CB 3.49Å; A58-S61 PolarHBondContact O-N 2.9Å; S59-S61 VanDerWaalsContact C-N 3.34Å; S59-S61 PolarHBondContact O-N 3.3Å; S61-Q65 WeakPolarHBondContact O-CG 3.3Å; S61-N103 PolarHBondContact O-ND2 3.14Å; S61-N103 PolarHBondContact OG-ND2 3.39Å
62	R	90.8	Very high	92.2	Very high	164 Å²	164	51.2 Å²	51.2	62%	0.619	27%	0.266	S	S	*	.	H	α-helix	trans	-71.4	-47.4	174.1	-178	175.7	176.8	160.2	-1.4	112.2	A58 S59 I60 V64 Q65	A58-R62 PolarHBondContact O-N 3.16Å; S59-R62 PolarHBondContact O-N 3.1Å; I60-R62 PolarHBondContact O-N 3.31Å; R62-V64 PolarHBondContact O-N 2.64Å; R62-Q65 WeakPolarHBondContact O-CB 3.38Å; R62-Q65 PolarHBondContact O-N 3.38Å
63	V	90.9	Very high	92.1	Very high	32 Å²	32	47.8 Å²	47.8	19%	0.194	25%	0.248	C	C	.	.	H	α-helix	trans	-67	-38.5	-174.7	177.9	0	0	0	0	111.6	P37 S59 I60 Q65 Q66 A69 F73	P37-V63 HydrophobicContact CG-CG2 4.44Å; S59-V63 VanDerWaalsContact O-CG2 3.28Å; S59-V63 WeakPolarHBondContact O-CG2 3.43Å; S59-V63 PolarHBondContact O-N 3.41Å; I60-V63 PolarHBondContact O-N 3.35Å; I60-V63 VanDerWaalsContact O-N 3.09Å; V63-Q65 PolarHBondContact O-N 2.87Å; V63-Q65 VanDerWaalsContact O-N 3.17Å; V63-Q66 WeakPolarHBondContact O-CB 3.49Å; V63-Q66 PolarHBondContact O-N 3.04Å; V63-A69 HydrophobicContact CG1-CB 3.62Å; V63-F73 HydrophobicContact CB-CE2 4.17Å; V63-F73 HydrophobicContact CB-CZ 4.38Å; V63-F73 HydrophobicContact CG1-CE2 3.65Å; V63-F73 HydrophobicContact CG1-CZ 4.21Å
64	V	90.6	Very high	91.9	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-6.2	-177.9	-58.9	0	0	0	0	114.1	I60 R62 Q66 I70 F73 N103 L104 C107	I60-V64 HydrophobicContact CG2-CG1 3.87Å; I60-V64 WeakPolarHBondContact O-CG1 3.21Å; I60-V64 VanDerWaalsContact O-CG2 3.31Å; I60-V64 WeakPolarHBondContact O-CG2 3.42Å; I60-V64 PolarHBondContact O-N 3.49Å; R62-V64 PolarHBondContact O-N 2.64Å; V64-Q66 PolarHBondContact O-N 3.26Å; V64-I70 HydrophobicContact CB-CG1 4.33Å; V64-F73 HydrophobicContact CG1-CD2 3.8Å; V64-F73 HydrophobicContact CG1-CE2 4.04Å; V64-F73 HydrophobicContact CG1-CG 4.19Å; V64-N103 HydrophobicContact CG2-CB 3.61Å; V64-L104 HydrophobicContact CB-CD1 4.2Å; V64-L104 HydrophobicContact CG1-CD1 4.03Å; V64-L104 HydrophobicContact CG2-CB 4.29Å; V64-C107 WeakPolarHBondContact O-CB 3.45Å
65	Q	88.3	Confident	91.7	Very high	82 Å²	82	52.5 Å²	52.5	38%	0.383	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-21.9	167.6	-61.1	179.7	25.8	0	0	111.8	S61 R62 V63 N103 L344	S61-Q65 WeakPolarHBondContact O-CG 3.3Å; R62-Q65 WeakPolarHBondContact O-CB 3.38Å; R62-Q65 PolarHBondContact O-N 3.38Å; V63-Q65 PolarHBondContact O-N 2.87Å; V63-Q65 VanDerWaalsContact O-N 3.17Å; Q65-N103 HydrophobicContact CG-CB 4.45Å; Q65-N103 PolarHBondContact NE2-ND2 2.82Å; Q65-L344 HydrophobicContact CG-CD1 4.07Å; Q65-L344 HydrophobicContact CG-CD2 4.3Å
66	Q	86.3	Confident	91.7	Very high	103 Å²	103	50.4 Å²	50.4	48%	0.481	26%	0.262	S	S	.	.	S	Bend	trans	-88.6	105.2	172.4	-68.8	-177	-0.2	0	0	109.2	V63 V64 Q68 A69	V63-Q66 WeakPolarHBondContact O-CB 3.49Å; V63-Q66 PolarHBondContact O-N 3.04Å; V64-Q66 PolarHBondContact O-N 3.26Å; Q66-Q68 PolarHBondContact O-N 3.15Å; Q66-Q68 VanDerWaalsContact O-N 3.07Å; Q66-A69 HydrophobicContact CB-CB 4.45Å; Q66-A69 WeakPolarHBondContact O-CB 3.37Å; Q66-A69 PolarHBondContact O-N 3.33Å
67	S	84.9	Confident	91.5	Very high	77 Å²	77	54.3 Å²	54.3	54%	0.538	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-57.2	-28.9	-173.7	59.2	0	0	0	0	113.6	A69 I70 P71	S67-A69 VanDerWaalsContact C-N 3.25Å; S67-A69 PolarHBondContact O-N 3.42Å; S67-I70 WeakPolarHBondContact O-CB 3.16Å; S67-I70 PolarHBondContact O-N 2.92Å; S67-P71 WeakPolarHBondContact O-CD 3.41Å
68	Q	88	Confident	91.4	Very high	134 Å²	134	54.4 Å²	54.4	63%	0.626	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-64.6	-24.4	174.7	69.2	-83.7	16.9	0	0	114.2	Q66	Q66-Q68 PolarHBondContact O-N 3.15Å; Q66-Q68 VanDerWaalsContact O-N 3.07Å
69	A	89.2	Confident	91.4	Very high	14 Å²	14	52.4 Å²	52.4	12%	0.116	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-84	-22.4	179.8	0	0	0	0	0	112.5	V63 Q66 S67 G72 F73	V63-A69 HydrophobicContact CG1-CB 3.62Å; Q66-A69 HydrophobicContact CB-CB 4.45Å; Q66-A69 WeakPolarHBondContact O-CB 3.37Å; Q66-A69 PolarHBondContact O-N 3.33Å; S67-A69 VanDerWaalsContact C-N 3.25Å; S67-A69 PolarHBondContact O-N 3.42Å; A69-G72 PolarHBondContact O-N 3.19Å; A69-F73 WeakPolarHBondContact O-CD2 3.35Å
70	I	91.2	Very high	91.4	Very high	7 Å²	7	57.8 Å²	57.8	4%	0.036	28%	0.283	C	S	.	.	H	α-helix	trans	-56.6	-47.3	-174.6	-66	176.8	0	0	0	112.9	V64 S67 G72 F73 L74 L104 C107 V112	V64-I70 HydrophobicContact CB-CG1 4.33Å; S67-I70 WeakPolarHBondContact O-CB 3.16Å; S67-I70 PolarHBondContact O-N 2.92Å; I70-G72 PolarHBondContact O-N 3.47Å; I70-F73 PolarHBondContact O-N 3.31Å; I70-L74 HydrophobicContact CG2-CD1 3.63Å; I70-L74 HydrophobicContact CG2-CG 3.96Å; I70-L74 WeakPolarHBondContact O-CG 3.3Å; I70-L74 PolarHBondContact O-N 3.27Å; I70-L104 HydrophobicContact CB-CD1 4.29Å; I70-L104 HydrophobicContact CD1-CD1 4.48Å; I70-L104 HydrophobicContact CG1-CD1 4.04Å; I70-L104 HydrophobicContact CG2-CD1 3.67Å; I70-C107 HydrophobicContact CD1-CB 3.66Å; I70-C107 WeakPolarHBondContact CD1-O 3.44Å; I70-V112 HydrophobicContact CG2-CG2 4.37Å
71	P	92.4	Very high	91.4	Very high	67 Å²	67	62 Å²	62	44%	0.435	30%	0.298	S	S	.	.	H	α-helix	trans	-55.7	-38.7	179.4	-27	35.7	0	0	0	113.3	S67 F73 L74 Q75	S67-P71 WeakPolarHBondContact O-CD 3.41Å; P71-F73 VanDerWaalsContact C-N 3.31Å; P71-F73 PolarHBondContact O-N 3.4Å; P71-L74 PolarHBondContact O-N 3.45Å; P71-Q75 WeakPolarHBondContact O-CB 3.48Å; P71-Q75 VanDerWaalsContact O-CG 3.26Å; P71-Q75 WeakPolarHBondContact O-CG 3.28Å; P71-Q75 PolarHBondContact O-N 3.13Å
72	G	91.9	Very high	91.6	Very high	12 Å²	12	61 Å²	61	12%	0.124	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-32.4	178.9	0	0	0	0	0	113.8	A69 I70 R76	A69-G72 PolarHBondContact O-N 3.19Å; I70-G72 PolarHBondContact O-N 3.47Å; G72-R76 WeakPolarHBondContact O-CD 3.19Å; G72-R76 PolarHBondContact O-NH1 2.93Å
73	F	94.1	Very high	91.8	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-74.9	-44.6	173	-80.5	-78.4	0	0	0	112.2	A38 L41 L42 I60 V63 V64 A69 I70 P71 Q75 R76 A78	A38-F73 HydrophobicContact CB-CD1 3.68Å; A38-F73 HydrophobicContact CB-CD2 4.05Å; A38-F73 HydrophobicContact CB-CE1 3.59Å; A38-F73 HydrophobicContact CB-CE2 3.97Å; A38-F73 HydrophobicContact CB-CG 3.91Å; A38-F73 HydrophobicContact CB-CZ 3.76Å; L41-F73 HydrophobicContact CD1-CZ 4.2Å; L42-F73 HydrophobicContact CD1-CD1 4.12Å; L42-F73 HydrophobicContact CD2-CD1 4.33Å; L42-F73 HydrophobicContact CG-CD1 4.17Å; L42-F73 HydrophobicContact CG-CE1 4.34Å; I60-F73 HydrophobicContact CB-CE1 4.32Å; I60-F73 HydrophobicContact CD1-CE1 4.36Å; I60-F73 HydrophobicContact CG1-CE1 3.74Å; I60-F73 HydrophobicContact CG1-CZ 4.22Å; I60-F73 HydrophobicContact CG2-CD1 4.18Å; I60-F73 HydrophobicContact CG2-CE1 3.86Å; I60-F73 HydrophobicContact CG2-CZ 4.25Å; V63-F73 HydrophobicContact CB-CE2 4.17Å; V63-F73 HydrophobicContact CB-CZ 4.38Å; V63-F73 HydrophobicContact CG1-CE2 3.65Å; V63-F73 HydrophobicContact CG1-CZ 4.21Å; V64-F73 HydrophobicContact CG1-CD2 3.8Å; V64-F73 HydrophobicContact CG1-CE2 4.04Å; V64-F73 HydrophobicContact CG1-CG 4.19Å; A69-F73 WeakPolarHBondContact O-CD2 3.35Å; I70-F73 PolarHBondContact O-N 3.31Å; P71-F73 VanDerWaalsContact C-N 3.31Å; P71-F73 PolarHBondContact O-N 3.4Å; F73-Q75 PolarHBondContact O-N 3.09Å; F73-R76 CarbonylContact O-C 3.49Å; F73-R76 PolarHBondContact O-N 2.8Å; F73-R76 VanDerWaalsContact O-N 3.09Å; F73-A78 HydrophobicContact CB-CB 3.76Å; F73-A78 HydrophobicContact CD1-CB 4.15Å; F73-A78 HydrophobicContact CG-CB 4.44Å; F73-A78 WeakPolarHBondContact O-CB 3.43Å; F73-A78 PolarHBondContact O-N 2.86Å; F73-A78 VanDerWaalsContact O-N 3.14Å
74	L	92.7	Very high	92	Very high	51 Å²	51	55.5 Å²	55.5	27%	0.267	28%	0.278	S	S	.	.	H	α-helix	trans	-64.1	-41.8	-178.4	-64.5	177.7	0	0	0	112	I70 P71 R76 D77 V79 L104 V112	I70-L74 HydrophobicContact CG2-CD1 3.63Å; I70-L74 HydrophobicContact CG2-CG 3.96Å; I70-L74 WeakPolarHBondContact O-CG 3.3Å; I70-L74 PolarHBondContact O-N 3.27Å; P71-L74 PolarHBondContact O-N 3.45Å; L74-R76 PolarHBondContact O-N 3.47Å; L74-D77 PolarHBondContact O-N 2.98Å; L74-D77 VanDerWaalsContact O-N 3.1Å; L74-V79 HydrophobicContact CD2-CG2 4.03Å; L74-L104 HydrophobicContact CD2-CD1 4.34Å; L74-L104 HydrophobicContact CD2-CD2 4.13Å; L74-V112 HydrophobicContact CD1-CG2 3.63Å; L74-V112 HydrophobicContact CD2-CG1 4.31Å
75	Q	92.6	Very high	92.4	Very high	149 Å²	149	56.9 Å²	56.9	70%	0.696	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-19	174.3	-73.5	171.9	5.3	0	0	113.9	P71 F73	P71-Q75 WeakPolarHBondContact O-CB 3.48Å; P71-Q75 VanDerWaalsContact O-CG 3.26Å; P71-Q75 WeakPolarHBondContact O-CG 3.28Å; P71-Q75 PolarHBondContact O-N 3.13Å; F73-Q75 PolarHBondContact O-N 3.09Å
76	R	93.5	Very high	92.8	Very high	74 Å²	74	53 Å²	53	28%	0.279	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	20.9	-177.7	-67.4	173.8	175.9	70	4.1	112.8	L42 G72 F73 L74 A78 R81	L42-R76 HydrophobicContact CD1-CB 3.56Å; G72-R76 WeakPolarHBondContact O-CD 3.19Å; G72-R76 PolarHBondContact O-NH1 2.93Å; F73-R76 CarbonylContact O-C 3.49Å; F73-R76 PolarHBondContact O-N 2.8Å; F73-R76 VanDerWaalsContact O-N 3.09Å; L74-R76 PolarHBondContact O-N 3.47Å; R76-A78 VanDerWaalsContact C-N 3.29Å; R76-A78 PolarHBondContact O-N 2.78Å; R76-R81 PolarHBondContact O-NE 3.01Å
77	D	92.9	Very high	93.3	Very high	82 Å²	82	52 Å²	52	44%	0.439	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	35.8	179.1	-63.4	-59.8	0	0	0	113.4	L74 V79 R80 R81	L74-D77 PolarHBondContact O-N 2.98Å; L74-D77 VanDerWaalsContact O-N 3.1Å; D77-V79 PolarHBondContact O-N 3.03Å; D77-V79 VanDerWaalsContact O-N 3.16Å; D77-R80 HydrophobicContact CB-CB 4.26Å; D77-R80 PolarHBondContact O-N 2.74Å; D77-R81 WeakPolarHBondContact O-CG 3.47Å; D77-R81 PolarHBondContact O-N 2.94Å
78	A	94.3	Very high	93.9	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.008	24%	0.243	C	C	.	.	H	α-helix	trans	-52	-41	-178	0	0	0	0	0	112.9	L42 F73 R76 R80 R81 L82	L42-A78 HydrophobicContact CD1-CB 4.17Å; L42-A78 HydrophobicContact CD2-CB 3.91Å; F73-A78 HydrophobicContact CB-CB 3.76Å; F73-A78 HydrophobicContact CD1-CB 4.15Å; F73-A78 HydrophobicContact CG-CB 4.44Å; F73-A78 WeakPolarHBondContact O-CB 3.43Å; F73-A78 PolarHBondContact O-N 2.86Å; F73-A78 VanDerWaalsContact O-N 3.14Å; R76-A78 VanDerWaalsContact C-N 3.29Å; R76-A78 PolarHBondContact O-N 2.78Å; A78-R80 PolarHBondContact O-N 2.84Å; A78-R81 PolarHBondContact O-N 3.05Å; A78-L82 WeakPolarHBondContact O-CB 3.3Å; A78-L82 WeakPolarHBondContact O-CG 3.3Å; A78-L82 PolarHBondContact O-N 3.15Å
79	V	94.1	Very high	94.2	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-58.1	-48.1	176.8	174.7	0	0	0	0	111.7	L74 D77 R81 L82 G83 L104 M116 H119 V121	L74-V79 HydrophobicContact CD2-CG2 4.03Å; D77-V79 PolarHBondContact O-N 3.03Å; D77-V79 VanDerWaalsContact O-N 3.16Å; V79-R81 VanDerWaalsContact C-N 3.28Å; V79-R81 PolarHBondContact O-N 3.35Å; V79-L82 PolarHBondContact O-N 3.46Å; V79-G83 PolarHBondContact O-N 2.87Å; V79-L104 HydrophobicContact CG2-CD2 3.96Å; V79-M116 HydrophobicContact CG1-CB 4.35Å; V79-M116 HydrophobicContact CG1-CG 3.91Å; V79-M116 HydrophobicContact CG2-CE 4.28Å; V79-M116 HydrophobicContact CG2-CG 3.86Å; V79-H119 HydrophobicContact CG1-CB 3.82Å; V79-V121 HydrophobicContact CG1-CG2 3.5Å; V79-V121 VanDerWaalsContact CG1-CG2 3.5Å
80	R	93.7	Very high	94.5	Very high	139 Å²	139	47.1 Å²	47.1	53%	0.525	26%	0.256	S	S	.	.	H	α-helix	trans	-69.7	-26.1	-179.6	-65.4	-179	177.7	-92.4	9.5	112.8	D77 A78 P84 H119	D77-R80 HydrophobicContact CB-CB 4.26Å; D77-R80 PolarHBondContact O-N 2.74Å; A78-R80 PolarHBondContact O-N 2.84Å; R80-P84 WeakPolarHBondContact O-CD 3.38Å; R80-H119 HydrophobicContact CG-CB 4.32Å; R80-H119 VanDerWaalsContact CZ-ND1 3.34Å; R80-H119 PolarHBondContact NE-CE1 3.49Å; R80-H119 PolarHBondContact NH2-CE1 3.25Å; R80-H119 PolarHBondContact NH2-ND1 2.98Å
81	R	95.3	Very high	94.6	Very high	91 Å²	91	49.4 Å²	49.4	34%	0.343	27%	0.269	S	S	.	.	H	α-helix	trans	-82.3	-37.2	177.7	-66.6	179.6	-177.1	-119.1	0.2	112.5	L42 L45 R76 D77 A78 V79	L42-R81 HydrophobicContact CD2-CB 4.34Å; L45-R81 HydrophobicContact CD1-CB 4.09Å; R76-R81 PolarHBondContact O-NE 3.01Å; D77-R81 WeakPolarHBondContact O-CG 3.47Å; D77-R81 PolarHBondContact O-N 2.94Å; A78-R81 PolarHBondContact O-N 3.05Å; V79-R81 VanDerWaalsContact C-N 3.28Å; V79-R81 PolarHBondContact O-N 3.35Å
82	L	96.4	Very high	94.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-79.3	-35	178.1	-72.7	168.2	0	0	0	112.6	L45 I60 A78 V79 M85 L86 A100 L101	L45-L82 HydrophobicContact CD1-CD2 3.86Å; L45-L82 HydrophobicContact CD1-CG 4.25Å; L45-L82 HydrophobicContact CD2-CD2 4.35Å; I60-L82 HydrophobicContact CD1-CD2 4.22Å; I60-L82 HydrophobicContact CG2-CD1 4.25Å; A78-L82 WeakPolarHBondContact O-CB 3.3Å; A78-L82 WeakPolarHBondContact O-CG 3.3Å; A78-L82 PolarHBondContact O-N 3.15Å; V79-L82 PolarHBondContact O-N 3.46Å; L82-M85 VanDerWaalsContact O-CB 3.29Å; L82-M85 WeakPolarHBondContact O-CB 3.18Å; L82-M85 PolarHBondContact O-N 2.85Å; L82-L86 WeakPolarHBondContact O-CD1 3.41Å; L82-A100 HydrophobicContact CD1-CB 4.14Å; L82-A100 HydrophobicContact CD2-CB 4.28Å; L82-L101 HydrophobicContact CB-CD1 4.32Å; L82-L101 HydrophobicContact CB-CD2 3.71Å; L82-L101 HydrophobicContact CB-CG 3.89Å; L82-L101 HydrophobicContact CD1-CD2 3.88Å; L82-L101 HydrophobicContact CD1-CG 4.31Å; L82-L101 HydrophobicContact CG-CD2 4.48Å
83	G	95.4	Very high	94.9	Very high	5 Å²	5	47 Å²	47	5%	0.052	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-49.5	-48.7	-178.7	0	0	0	0	0	114.6	V79 M85 L86	V79-G83 PolarHBondContact O-N 2.87Å; G83-M85 VanDerWaalsContact C-N 3.27Å; G83-M85 PolarHBondContact O-N 3.29Å; G83-L86 WeakPolarHBondContact O-CB 3.44Å; G83-L86 PolarHBondContact O-N 3Å
84	P	95.3	Very high	95	Very high	75 Å²	75	48.6 Å²	48.6	49%	0.487	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-64.3	-26.2	176.1	-25.1	35.5	0	0	0	114.7	R80 L86 L87	R80-P84 WeakPolarHBondContact O-CD 3.38Å; P84-L86 PolarHBondContact O-N 3.44Å; P84-L87 PolarHBondContact O-N 3.42Å; P84-L87 VanDerWaalsContact O-N 3.1Å
85	M	97.4	Very high	95.1	Very high	30 Å²	30	48.2 Å²	48.2	15%	0.148	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-69.5	-16.2	-179.2	-59.2	-66.4	92.7	0	0	112.7	L82 G83 L87 D88 V93 A97	L82-M85 VanDerWaalsContact O-CB 3.29Å; L82-M85 WeakPolarHBondContact O-CB 3.18Å; L82-M85 PolarHBondContact O-N 2.85Å; G83-M85 VanDerWaalsContact C-N 3.27Å; G83-M85 PolarHBondContact O-N 3.29Å; M85-L87 PolarHBondContact O-N 2.92Å; M85-L87 VanDerWaalsContact O-N 3.17Å; M85-D88 VanDerWaalsContact O-CB 3.32Å; M85-D88 WeakPolarHBondContact O-CB 3.24Å; M85-D88 PolarHBondContact O-N 3.46Å; M85-D88 VanDerWaalsContact O-N 3.14Å; M85-V93 HydrophobicContact CB-CG1 4.34Å; M85-V93 HydrophobicContact SD-CG1 4.37Å; M85-A97 HydrophobicContact CB-CB 3.51Å
86	L	97.7	Very high	95.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-61.2	-21.6	170.6	-84.7	57.4	0	0	0	111.9	L82 G83 P84 R94 A97 L101 P124 L125 L128	L82-L86 WeakPolarHBondContact O-CD1 3.41Å; G83-L86 WeakPolarHBondContact O-CB 3.44Å; G83-L86 PolarHBondContact O-N 3Å; P84-L86 PolarHBondContact O-N 3.44Å; L86-R94 WeakPolarHBondContact O-CD 3.39Å; L86-R94 WeakPolarHBondContact O-CG 3.29Å; L86-A97 HydrophobicContact CD1-CB 4.32Å; L86-L101 HydrophobicContact CD1-CD1 3.55Å; L86-L101 HydrophobicContact CD2-CD1 4.25Å; L86-P124 HydrophobicContact CB-CB 4.27Å; L86-P124 HydrophobicContact CD2-CB 4.46Å; L86-L125 HydrophobicContact CD2-CB 4.15Å; L86-L125 HydrophobicContact CD2-CD1 4.31Å; L86-L128 HydrophobicContact CB-CD2 4.05Å; L86-L128 HydrophobicContact CD2-CD2 4.5Å; L86-L128 HydrophobicContact CG-CD2 4.03Å; L86-L128 WeakPolarHBondContact O-CD1 3.45Å
87	L	96.9	Very high	95.5	Very high	82 Å²	82	38.9 Å²	38.9	43%	0.429	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-111.9	20.4	179.7	-55	178.4	0	0	0	112.3	P84 M85 P124 A127 L128	P84-L87 PolarHBondContact O-N 3.42Å; P84-L87 VanDerWaalsContact O-N 3.1Å; M85-L87 PolarHBondContact O-N 2.92Å; M85-L87 VanDerWaalsContact O-N 3.17Å; L87-P124 HydrophobicContact CD1-CB 4.03Å; L87-P124 HydrophobicContact CG-CB 4.12Å; L87-A127 HydrophobicContact CD1-CB 4.49Å; L87-A127 HydrophobicContact CD2-CB 3.88Å; L87-L128 HydrophobicContact CD2-CB 4.42Å
88	D	97.6	Very high	95.7	Very high	16 Å²	16	35 Å²	35	9%	0.086	20%	0.197	C	C	.	.			trans	-59.7	158.8	179.3	-165.9	-82.6	0	0	0	112.2	R53 M85 S90 V93 R94	R53-D88 IonicContact CZ-OD1 3.19Å; R53-D88 IonicContact CZ-OD2 3.7Å; R53-D88 IonicContact NE-OD1 3.34Å; R53-D88 IonicContact NE-OD2 3.45Å; R53-D88 PolarHBondContact NE-OD2 3.44Å; R53-D88 VanDerWaalsContact NH2-CG 3.29Å; R53-D88 IonicContact NH2-OD1 2.68Å; R53-D88 PolarHBondContact NH2-OD1 3.3Å; R53-D88 IonicContact NH2-OD2 2.64Å; R53-D88 PolarHBondContact NH2-OD2 2.93Å; M85-D88 VanDerWaalsContact O-CB 3.32Å; M85-D88 WeakPolarHBondContact O-CB 3.24Å; M85-D88 PolarHBondContact O-N 3.46Å; M85-D88 VanDerWaalsContact O-N 3.14Å; D88-S90 VanDerWaalsContact C-N 3.27Å; D88-S90 PolarHBondContact O-N 3.49Å; D88-S90 PolarHBondContact OD1-N 3.25Å; D88-V93 HydrophobicContact CB-CB 3.94Å; D88-V93 HydrophobicContact CB-CG1 3.65Å; D88-R94 HydrophobicContact CB-CG 4.31Å; D88-R94 PolarHBondContact O-NE 2.82Å; D88-R94 PolarHBondContact O-NH2 3.35Å
89	G	94.4	Very high	95.7	Very high	76 Å²	76	35.1 Å²	35.1	78%	0.784	20%	0.199	S	C	*	.	S	Bend	trans	-68.5	-24.4	175	0	0	0	0	0	114
90	S	95.3	Very high	95.8	Very high	31 Å²	31	35 Å²	35	22%	0.217	20%	0.198	C	C	.	.	S	Bend	trans	-95.2	127.5	179.8	176.8	0	0	0	0	111.9	D88 A92 V93 R94	D88-S90 VanDerWaalsContact C-N 3.27Å; D88-S90 PolarHBondContact O-N 3.49Å; D88-S90 PolarHBondContact OD1-N 3.25Å; S90-A92 VanDerWaalsContact C-N 3.28Å; S90-A92 PolarHBondContact O-N 3.42Å; S90-A92 PolarHBondContact OG-N 2.92Å; S90-V93 PolarHBondContact O-N 3.4Å; S90-R94 WeakPolarHBondContact O-CG 3.44Å; S90-R94 PolarHBondContact O-N 3.42Å; S90-R94 VanDerWaalsContact O-N 3.12Å
91	V	93.4	Very high	96	Very high	54 Å²	54	28.4 Å²	28.4	33%	0.327	17%	0.173	S	C	.	.	H	α-helix	trans	-59.9	-38.4	176.4	-178.6	0	0	0	0	111.5	R94 E95 P149 V153	V91-R94 WeakPolarHBondContact O-CB 3.4Å; V91-R94 PolarHBondContact O-N 2.9Å; V91-E95 PolarHBondContact O-N 3.39Å; V91-P149 HydrophobicContact CG1-CB 4.1Å; V91-V153 HydrophobicContact CG1-CG2 3.66Å
92	A	93.3	Very high	96.1	Very high	28 Å²	28	25.1 Å²	25.1	23%	0.231	16%	0.161	C	C	.	.	H	α-helix	trans	-68.1	-36.4	179.9	0	0	0	0	0	112.5	E54 S90 R94 E95 T96	E54-A92 VanDerWaalsContact CD-CB 3.45Å; E54-A92 HydrophobicContact CG-CB 4.16Å; E54-A92 VanDerWaalsContact OE2-CB 3.27Å; E54-A92 WeakPolarHBondContact OE2-CB 3.43Å; S90-A92 VanDerWaalsContact C-N 3.28Å; S90-A92 PolarHBondContact O-N 3.42Å; S90-A92 PolarHBondContact OG-N 2.92Å; A92-R94 VanDerWaalsContact C-N 3.35Å; A92-E95 PolarHBondContact O-N 2.87Å; A92-T96 WeakPolarHBondContact O-CG2 3.41Å; A92-T96 PolarHBondContact O-N 3.02Å; A92-T96 PolarHBondContact O-OG1 3.31Å
93	V	97	Very high	96	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.9	-41	172.3	177.9	0	0	0	0	110.4	A50 R53 E54 M85 D88 S90 T96 A97	A50-V93 HydrophobicContact CB-CG2 4.26Å; A50-V93 WeakPolarHBondContact O-CG2 3.25Å; R53-V93 HydrophobicContact CB-CG1 4.14Å; R53-V93 HydrophobicContact CB-CG2 4.03Å; E54-V93 HydrophobicContact CB-CG2 3.96Å; M85-V93 HydrophobicContact CB-CG1 4.34Å; M85-V93 HydrophobicContact SD-CG1 4.37Å; D88-V93 HydrophobicContact CB-CB 3.94Å; D88-V93 HydrophobicContact CB-CG1 3.65Å; S90-V93 PolarHBondContact O-N 3.4Å; V93-T96 PolarHBondContact O-OG1 3.27Å; V93-A97 WeakPolarHBondContact O-CB 3.26Å; V93-A97 PolarHBondContact O-N 2.97Å
94	R	97	Very high	95.9	Very high	35 Å²	35	25 Å²	25	13%	0.132	16%	0.159	C	C	.	.	H	α-helix	trans	-62.4	-46.8	176.1	-62.3	179.4	-165	-179.4	-1.5	111.7	L86 D88 S90 V91 A92 T98 E131 V153	L86-R94 WeakPolarHBondContact O-CD 3.39Å; L86-R94 WeakPolarHBondContact O-CG 3.29Å; D88-R94 HydrophobicContact CB-CG 4.31Å; D88-R94 PolarHBondContact O-NE 2.82Å; D88-R94 PolarHBondContact O-NH2 3.35Å; S90-R94 WeakPolarHBondContact O-CG 3.44Å; S90-R94 PolarHBondContact O-N 3.42Å; S90-R94 VanDerWaalsContact O-N 3.12Å; V91-R94 WeakPolarHBondContact O-CB 3.4Å; V91-R94 PolarHBondContact O-N 2.9Å; A92-R94 VanDerWaalsContact C-N 3.35Å; R94-T98 VanDerWaalsContact O-CB 3.24Å; R94-T98 WeakPolarHBondContact O-CB 3.35Å; R94-T98 PolarHBondContact O-N 2.85Å; R94-T98 PolarHBondContact O-OG1 3.27Å; R94-E131 IonicContact CZ-OE1 2.98Å; R94-E131 IonicContact CZ-OE2 3.43Å; R94-E131 IonicContact NH1-OE1 3.24Å; R94-E131 PolarHBondContact NH1-OE1 2.81Å; R94-E131 IonicContact NH1-OE2 3.86Å; R94-E131 PolarHBondContact NH1-OE2 2.96Å; R94-E131 VanDerWaalsContact NH1-OE2 3.14Å; R94-E131 IonicContact NH2-OE1 2.71Å; R94-E131 PolarHBondContact NH2-OE1 3.4Å; R94-E131 IonicContact NH2-OE2 3.37Å; R94-V153 HydrophobicContact CB-CG1 4.12Å; R94-V153 HydrophobicContact CB-CG2 4.33Å
95	E	94.8	Very high	95.9	Very high	42 Å²	42	21.6 Å²	21.6	20%	0.196	14%	0.137	C	C	.	.	H	α-helix	trans	-58.1	-53.8	179.1	-170.2	176.8	171.7	0	0	110.3	V91 A92 T98 G99 V153 E156 R347	V91-E95 PolarHBondContact O-N 3.39Å; A92-E95 PolarHBondContact O-N 2.87Å; E95-T98 PolarHBondContact O-N 3.41Å; E95-G99 PolarHBondContact O-N 2.97Å; E95-V153 HydrophobicContact CB-CG2 3.78Å; E95-V153 HydrophobicContact CG-CG2 4.45Å; E95-E156 HydrophobicContact CG-CG 4.34Å; E95-R347 IonicContact OE1-CZ 3.53Å; E95-R347 IonicContact OE1-NH2 3.59Å; E95-R347 PolarHBondContact OE1-NH2 3.1Å
96	T	95	Very high	95.5	Very high	27 Å²	27	21.3 Å²	21.3	17%	0.166	14%	0.139	C	C	.	.	H	α-helix	trans	-68.2	-38.2	-176.7	52.5	0	0	0	0	113	E54 C57 A58 A92 V93 G99 A100	E54-T96 HydrophobicContact CG-CG2 3.94Å; C57-T96 VanDerWaalsContact CB-OG1 3.31Å; C57-T96 WeakPolarHBondContact CB-OG1 3.33Å; A58-T96 HydrophobicContact CB-CG2 4.07Å; A92-T96 WeakPolarHBondContact O-CG2 3.41Å; A92-T96 PolarHBondContact O-N 3.02Å; A92-T96 PolarHBondContact O-OG1 3.31Å; V93-T96 PolarHBondContact O-OG1 3.27Å; T96-G99 PolarHBondContact O-N 3.5Å; T96-A100 WeakPolarHBondContact O-CB 3.45Å; T96-A100 PolarHBondContact O-N 3.33Å
97	A	97.9	Very high	95.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-66.6	-42.5	176.1	0	0	0	0	0	111.9	C57 M85 L86 V93 A100 L101	C57-A97 HydrophobicContact CB-CB 4.38Å; M85-A97 HydrophobicContact CB-CB 3.51Å; L86-A97 HydrophobicContact CD1-CB 4.32Å; V93-A97 WeakPolarHBondContact O-CB 3.26Å; V93-A97 PolarHBondContact O-N 2.97Å; A97-A100 WeakPolarHBondContact O-CB 3.43Å; A97-A100 PolarHBondContact O-N 2.95Å; A97-L101 PolarHBondContact O-N 3.47Å
98	T	97.7	Very high	94.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.8	-42.8	177.2	-51.4	0	0	0	0	110.3	R94 E95 A100 L101 R102 L128 E156 A157 L160	R94-T98 VanDerWaalsContact O-CB 3.24Å; R94-T98 WeakPolarHBondContact O-CB 3.35Å; R94-T98 PolarHBondContact O-N 2.85Å; R94-T98 PolarHBondContact O-OG1 3.27Å; E95-T98 PolarHBondContact O-N 3.41Å; T98-A100 VanDerWaalsContact C-N 3.31Å; T98-A100 PolarHBondContact O-N 3.34Å; T98-L101 PolarHBondContact O-N 3.23Å; T98-R102 WeakPolarHBondContact O-CB 3.37Å; T98-R102 PolarHBondContact O-N 2.75Å; T98-L128 HydrophobicContact CG2-CD2 4.49Å; T98-L128 WeakPolarHBondContact OG1-CD2 3.5Å; T98-E156 VanDerWaalsContact CG2-C 3.48Å; T98-E156 HydrophobicContact CG2-CB 3.77Å; T98-A157 HydrophobicContact CG2-CB 4.08Å; T98-L160 HydrophobicContact CG2-CD2 4.3Å
99	G	94.9	Very high	94.1	Very high	4 Å²	4	19.8 Å²	19.8	4%	0.041	14%	0.144	C	C	.	.	H	α-helix	trans	-60.3	-38	172.9	0	0	0	0	0	113.1	E95 T96 R102 N103 E156	E95-G99 PolarHBondContact O-N 2.97Å; T96-G99 PolarHBondContact O-N 3.5Å; G99-R102 PolarHBondContact O-N 2.84Å; G99-N103 PolarHBondContact O-N 3.43Å; G99-N103 PolarHBondContact O-OD1 3.47Å; G99-E156 WeakPolarHBondContact CA-OE2 3.36Å
100	A	96.5	Very high	93.8	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.5	-45.6	174.9	0	0	0	0	0	112.5	I60 L82 T96 A97 T98 N103 L104	I60-A100 HydrophobicContact CB-CB 4.37Å; I60-A100 HydrophobicContact CG2-CB 4.13Å; L82-A100 HydrophobicContact CD1-CB 4.14Å; L82-A100 HydrophobicContact CD2-CB 4.28Å; T96-A100 WeakPolarHBondContact O-CB 3.45Å; T96-A100 PolarHBondContact O-N 3.33Å; A97-A100 WeakPolarHBondContact O-CB 3.43Å; A97-A100 PolarHBondContact O-N 2.95Å; T98-A100 VanDerWaalsContact C-N 3.31Å; T98-A100 PolarHBondContact O-N 3.34Å; A100-N103 PolarHBondContact O-N 3.37Å; A100-L104 VanDerWaalsContact O-CB 3.28Å; A100-L104 WeakPolarHBondContact O-CB 3.31Å; A100-L104 PolarHBondContact O-N 2.99Å
101	L	97.6	Very high	93.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.4	-40.1	174	-73	-179	0	0	0	111.7	L82 L86 A97 T98 L104 S105 M116 V121 L160	L82-L101 HydrophobicContact CB-CD1 4.32Å; L82-L101 HydrophobicContact CB-CD2 3.71Å; L82-L101 HydrophobicContact CB-CG 3.89Å; L82-L101 HydrophobicContact CD1-CD2 3.88Å; L82-L101 HydrophobicContact CD1-CG 4.31Å; L82-L101 HydrophobicContact CG-CD2 4.48Å; L86-L101 HydrophobicContact CD1-CD1 3.55Å; L86-L101 HydrophobicContact CD2-CD1 4.25Å; A97-L101 PolarHBondContact O-N 3.47Å; T98-L101 PolarHBondContact O-N 3.23Å; L101-L104 PolarHBondContact O-N 3.02Å; L101-S105 WeakPolarHBondContact O-CB 3.15Å; L101-S105 PolarHBondContact O-N 3.41Å; L101-S105 PolarHBondContact O-OG 3.04Å; L101-M116 HydrophobicContact CD2-CE 4.07Å; L101-M116 WeakPolarHBondContact O-CE 3.16Å; L101-V121 HydrophobicContact CD1-CG1 4.04Å; L101-L160 HydrophobicContact CB-CD1 4.08Å; L101-L160 HydrophobicContact CB-CD2 3.71Å; L101-L160 HydrophobicContact CD1-CD2 4.06Å
102	R	96.1	Very high	93.5	Very high	22 Å²	22	22.1 Å²	22.1	8%	0.083	13%	0.128	C	C	.	.	H	α-helix	trans	-58.9	-48	176.6	-175.8	-92	-68.8	-160.8	-3.9	111	T98 G99 S105 A106 E156 N159 L160 N163 D343	T98-R102 WeakPolarHBondContact O-CB 3.37Å; T98-R102 PolarHBondContact O-N 2.75Å; G99-R102 PolarHBondContact O-N 2.84Å; R102-S105 PolarHBondContact O-N 3.17Å; R102-S105 PolarHBondContact O-OG 3.48Å; R102-A106 WeakPolarHBondContact O-CB 3.5Å; R102-A106 PolarHBondContact O-N 3.42Å; R102-E156 IonicContact CZ-OE2 3.49Å; R102-E156 VanDerWaalsContact CZ-OE2 3.28Å; R102-E156 IonicContact NE-OE2 2.73Å; R102-E156 PolarHBondContact NE-OE2 3.06Å; R102-E156 IonicContact NH2-OE1 3.27Å; R102-E156 PolarHBondContact NH2-OE1 3.16Å; R102-E156 IonicContact NH2-OE2 2.73Å; R102-E156 PolarHBondContact NH2-OE2 3.28Å; R102-N159 HydrophobicContact CG-CB 3.78Å; R102-L160 HydrophobicContact CB-CB 4.17Å; R102-N163 PolarHBondContact O-ND2 2.91Å; R102-D343 VanDerWaalsContact NH1-C 3.33Å; R102-D343 PolarHBondContact NH1-O 3.29Å; R102-D343 PolarHBondContact NH2-O 3.45Å
103	N	94.2	Very high	93.6	Very high	3 Å²	3	20.9 Å²	20.9	2%	0.016	12%	0.118	C	C	.	.	H	α-helix	trans	-67	-39.7	177.5	-67.8	-0	0	0	0	112.1	S61 V64 Q65 G99 A100 S105 A106 C107 L344	S61-N103 PolarHBondContact O-ND2 3.14Å; S61-N103 PolarHBondContact OG-ND2 3.39Å; V64-N103 HydrophobicContact CG2-CB 3.61Å; Q65-N103 HydrophobicContact CG-CB 4.45Å; Q65-N103 PolarHBondContact NE2-ND2 2.82Å; G99-N103 PolarHBondContact O-N 3.43Å; G99-N103 PolarHBondContact O-OD1 3.47Å; A100-N103 PolarHBondContact O-N 3.37Å; N103-S105 VanDerWaalsContact C-N 3.32Å; N103-S105 PolarHBondContact O-N 2.92Å; N103-A106 PolarHBondContact O-N 3.02Å; N103-C107 VanDerWaalsContact O-CB 3.29Å; N103-C107 WeakPolarHBondContact O-CB 3.48Å; N103-C107 PolarHBondContact O-N 3.42Å; N103-C107 PolarHBondContact O-SG 2.89Å; N103-L344 HydrophobicContact CB-CD2 4.46Å; N103-L344 VanDerWaalsContact CG-CD2 3.44Å; N103-L344 WeakPolarHBondContact OD1-CD2 3.48Å
104	L	94.6	Very high	93.4	Very high	1 Å²	1	23 Å²	23	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-60.9	-41.1	175.9	-174.3	64.6	0	0	0	111.4	V64 I70 L74 V79 A100 L101 G108 V112 M116	V64-L104 HydrophobicContact CB-CD1 4.2Å; V64-L104 HydrophobicContact CG1-CD1 4.03Å; V64-L104 HydrophobicContact CG2-CB 4.29Å; I70-L104 HydrophobicContact CB-CD1 4.29Å; I70-L104 HydrophobicContact CD1-CD1 4.48Å; I70-L104 HydrophobicContact CG1-CD1 4.04Å; I70-L104 HydrophobicContact CG2-CD1 3.67Å; L74-L104 HydrophobicContact CD2-CD1 4.34Å; L74-L104 HydrophobicContact CD2-CD2 4.13Å; V79-L104 HydrophobicContact CG2-CD2 3.96Å; A100-L104 VanDerWaalsContact O-CB 3.28Å; A100-L104 WeakPolarHBondContact O-CB 3.31Å; A100-L104 PolarHBondContact O-N 2.99Å; L101-L104 PolarHBondContact O-N 3.02Å; L104-G108 VanDerWaalsContact O-CA 3.31Å; L104-G108 WeakPolarHBondContact O-CA 3.44Å; L104-G108 PolarHBondContact O-N 3.47Å; L104-V112 HydrophobicContact CG-CG1 3.98Å; L104-M116 HydrophobicContact CB-CE 3.65Å; L104-M116 HydrophobicContact CD2-CE 3.54Å; L104-M116 HydrophobicContact CG-CE 3.54Å
105	S	94.4	Very high	93.2	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.014	13%	0.133	C	C	.	.	H	α-helix	trans	-68.4	-44.8	176	64.9	0	0	0	0	112.3	L101 R102 N103 G109 N163	L101-S105 WeakPolarHBondContact O-CB 3.15Å; L101-S105 PolarHBondContact O-N 3.41Å; L101-S105 PolarHBondContact O-OG 3.04Å; R102-S105 PolarHBondContact O-N 3.17Å; R102-S105 PolarHBondContact O-OG 3.48Å; N103-S105 VanDerWaalsContact C-N 3.32Å; N103-S105 PolarHBondContact O-N 2.92Å; S105-G109 PolarHBondContact O-N 3.41Å; S105-N163 WeakPolarHBondContact OG-CB 3.48Å; S105-N163 PolarHBondContact OG-ND2 3.25Å
106	A	89.5	Confident	93.2	Very high	24 Å²	24	21.5 Å²	21.5	20%	0.198	12%	0.124	C	C	.	.	H	α-helix	trans	-67.9	-41.6	-179.2	0	0	0	0	0	113	R102 N103 T339	R102-A106 WeakPolarHBondContact O-CB 3.5Å; R102-A106 PolarHBondContact O-N 3.42Å; N103-A106 PolarHBondContact O-N 3.02Å; A106-T339 WeakPolarHBondContact O-CG2 3.38Å
107	C	89.6	Confident	93.3	Very high	18 Å²	18	20.4 Å²	20.4	12%	0.122	12%	0.117	C	C	.	.	H	α-helix	trans	-90	-21.1	-175.7	-54.7	0	0	0	0	112.9	V64 I70 N103	V64-C107 WeakPolarHBondContact O-CB 3.45Å; I70-C107 HydrophobicContact CD1-CB 3.66Å; I70-C107 WeakPolarHBondContact CD1-O 3.44Å; N103-C107 VanDerWaalsContact O-CB 3.29Å; N103-C107 WeakPolarHBondContact O-CB 3.48Å; N103-C107 PolarHBondContact O-N 3.42Å; N103-C107 PolarHBondContact O-SG 2.89Å
108	G	86.6	Confident	93.1	Very high	25 Å²	25	27.1 Å²	27.1	26%	0.258	14%	0.142	S	C	.	.	H	α-helix	trans	-84.9	-15.3	179.5	0	0	0	0	0	114.3	L104 V112	L104-G108 VanDerWaalsContact O-CA 3.31Å; L104-G108 WeakPolarHBondContact O-CA 3.44Å; L104-G108 PolarHBondContact O-N 3.47Å; G108-V112 WeakPolarHBondContact O-CG2 3.38Å
109	G	85.6	Confident	92.9	Very high	23 Å²	23	29.4 Å²	29.4	24%	0.237	15%	0.153	C	C	.	.	H	α-helix	trans	71	-168.6	-179.2	0	0	0	0	0	113.6	S105 E111 V112 C113	S105-G109 PolarHBondContact O-N 3.41Å; G109-E111 PolarHBondContact O-N 3.1Å; G109-V112 PolarHBondContact O-N 3.06Å; G109-C113 PolarHBondContact O-N 3.23Å
110	Q	88.8	Confident	92.9	Very high	44 Å²	44	33.4 Å²	33.4	21%	0.206	17%	0.173	C	C	.	.	H	α-helix	trans	-57.7	-43.4	-169.1	-173	-156.8	-19.2	0	0	113.8	F14 V112 C113 E114 S167	F14-Q110 HydrophobicContact CB-CG 4.4Å; F14-Q110 VanDerWaalsContact CD1-OE1 3.27Å; F14-Q110 HydrophobicContact CD2-CB 4.3Å; F14-Q110 VanDerWaalsContact CD2-CD 3.47Å; F14-Q110 HydrophobicContact CD2-CG 3.9Å; F14-Q110 HydrophobicContact CE2-CB 4.41Å; F14-Q110 HydrophobicContact CE2-CG 4.49Å; F14-Q110 HydrophobicContact CG-CG 4.32Å; Q110-V112 PolarHBondContact O-N 3.34Å; Q110-C113 WeakPolarHBondContact O-CB 3.44Å; Q110-C113 PolarHBondContact O-N 2.97Å; Q110-C113 VanDerWaalsContact O-N 3.15Å; Q110-E114 HydrophobicContact CG-CG 4.45Å; Q110-E114 PolarHBondContact NE2-OE1 3.02Å; Q110-E114 PolarHBondContact O-N 3.44Å; Q110-S167 WeakPolarHBondContact CG-O 3.4Å
111	E	90.4	Very high	92.9	Very high	159 Å²	159	33.5 Å²	33.5	74%	0.743	17%	0.174	S	C	*	.	H	α-helix	trans	-59	-38.8	-176.8	-64.9	-175.6	175.7	0	0	111.7	G109 E114 D115	G109-E111 PolarHBondContact O-N 3.1Å; E111-E114 PolarHBondContact O-N 3.18Å; E111-D115 WeakPolarHBondContact O-CB 3.21Å; E111-D115 PolarHBondContact O-N 3.38Å
112	V	93.1	Very high	92.9	Very high	8 Å²	8	33.7 Å²	33.7	5%	0.048	18%	0.175	C	C	.	.	H	α-helix	trans	-70.6	-42.1	178.1	177	0	0	0	0	111.2	I70 L74 L104 G108 G109 Q110 E114 D115 M116	I70-V112 HydrophobicContact CG2-CG2 4.37Å; L74-V112 HydrophobicContact CD1-CG2 3.63Å; L74-V112 HydrophobicContact CD2-CG1 4.31Å; L104-V112 HydrophobicContact CG-CG1 3.98Å; G108-V112 WeakPolarHBondContact O-CG2 3.38Å; G109-V112 PolarHBondContact O-N 3.06Å; Q110-V112 PolarHBondContact O-N 3.34Å; V112-E114 VanDerWaalsContact C-N 3.34Å; V112-E114 PolarHBondContact O-N 2.87Å; V112-D115 PolarHBondContact O-N 3.19Å; V112-M116 HydrophobicContact CG1-CE 3.81Å; V112-M116 VanDerWaalsContact O-CG 3.3Å; V112-M116 WeakPolarHBondContact O-CG 3.34Å; V112-M116 PolarHBondContact O-N 2.99Å
113	C	94.6	Very high	92.9	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.007	19%	0.194	C	C	.	.	H	α-helix	trans	-59.6	-44	174	-68.4	0	0	0	0	111.9	G109 Q110 M116 V117 L164 S167	G109-C113 PolarHBondContact O-N 3.23Å; Q110-C113 WeakPolarHBondContact O-CB 3.44Å; Q110-C113 PolarHBondContact O-N 2.97Å; Q110-C113 VanDerWaalsContact O-N 3.15Å; C113-M116 WeakPolarHBondContact O-CB 3.18Å; C113-M116 PolarHBondContact O-N 3.14Å; C113-V117 WeakPolarHBondContact O-CG2 3.4Å; C113-V117 PolarHBondContact O-N 2.87Å; C113-V117 VanDerWaalsContact O-N 3.1Å; C113-L164 HydrophobicContact CB-CD2 3.97Å; C113-S167 VanDerWaalsContact CB-CB 3.43Å
114	E	92.6	Very high	93.1	Very high	45 Å²	45	37.1 Å²	37.1	21%	0.21	20%	0.199	C	C	.	.	H	α-helix	trans	-64.1	-41.7	176.2	-69.4	-176.9	174.1	0	0	112.1	Q110 E111 V112 V117 R118	Q110-E114 HydrophobicContact CG-CG 4.45Å; Q110-E114 PolarHBondContact NE2-OE1 3.02Å; Q110-E114 PolarHBondContact O-N 3.44Å; E111-E114 PolarHBondContact O-N 3.18Å; V112-E114 VanDerWaalsContact C-N 3.34Å; V112-E114 PolarHBondContact O-N 2.87Å; E114-V117 PolarHBondContact O-N 3.03Å; E114-R118 WeakPolarHBondContact O-CG 3.47Å; E114-R118 PolarHBondContact O-N 3.21Å; E114-R118 IonicContact OE2-CZ 3.21Å; E114-R118 IonicContact OE2-NH1 3.67Å; E114-R118 IonicContact OE2-NH2 3.9Å; E114-R118 PolarHBondContact OE2-NH2 3.2Å
115	D	92.3	Very high	93.3	Very high	45 Å²	45	37 Å²	37	24%	0.241	20%	0.198	C	C	.	.	H	α-helix	trans	-63.1	-41.3	176.5	-168.6	59.4	0	0	0	112.2	E111 V112 V117 R118 H119	E111-D115 WeakPolarHBondContact O-CB 3.21Å; E111-D115 PolarHBondContact O-N 3.38Å; V112-D115 PolarHBondContact O-N 3.19Å; D115-V117 VanDerWaalsContact C-N 3.31Å; D115-V117 PolarHBondContact O-N 2.94Å; D115-R118 WeakPolarHBondContact O-CB 3.39Å; D115-R118 PolarHBondContact O-N 3.45Å; D115-R118 VanDerWaalsContact O-N 3.16Å; D115-H119 WeakPolarHBondContact O-CB 3.43Å; D115-H119 PolarHBondContact O-N 3.31Å; D115-H119 IonicContact OD1-CD2 2.77Å; D115-H119 IonicContact OD1-NE2 2.63Å; D115-H119 IonicContact OD2-CD2 3.88Å; D115-H119 PolarHBondContact OD2-CD2 3.29Å; D115-H119 IonicContact OD2-NE2 3.5Å
116	M	96.3	Very high	93.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-56.6	-43.6	171.7	-73.6	179.4	179.2	0	0	112.7	V79 L101 L104 V112 C113 H119 D120 V121 L160 L164	V79-M116 HydrophobicContact CG1-CB 4.35Å; V79-M116 HydrophobicContact CG1-CG 3.91Å; V79-M116 HydrophobicContact CG2-CE 4.28Å; V79-M116 HydrophobicContact CG2-CG 3.86Å; L101-M116 HydrophobicContact CD2-CE 4.07Å; L101-M116 WeakPolarHBondContact O-CE 3.16Å; L104-M116 HydrophobicContact CB-CE 3.65Å; L104-M116 HydrophobicContact CD2-CE 3.54Å; L104-M116 HydrophobicContact CG-CE 3.54Å; V112-M116 HydrophobicContact CG1-CE 3.81Å; V112-M116 VanDerWaalsContact O-CG 3.3Å; V112-M116 WeakPolarHBondContact O-CG 3.34Å; V112-M116 PolarHBondContact O-N 2.99Å; C113-M116 WeakPolarHBondContact O-CB 3.18Å; C113-M116 PolarHBondContact O-N 3.14Å; M116-H119 CarbonylContact O-C 3.48Å; M116-H119 PolarHBondContact O-N 3.01Å; M116-D120 PolarHBondContact O-N 2.69Å; M116-V121 HydrophobicContact CB-CB 4.27Å; M116-V121 HydrophobicContact CB-CG2 3.96Å; M116-V121 HydrophobicContact CG-CG2 4.33Å; M116-V121 WeakPolarHBondContact O-CB 3.48Å; M116-V121 WeakPolarHBondContact O-CG2 3.5Å; M116-V121 PolarHBondContact O-N 2.95Å; M116-V121 VanDerWaalsContact O-N 3.1Å; M116-L160 HydrophobicContact SD-CD1 4.29Å; M116-L164 HydrophobicContact CB-CD2 3.86Å; M116-L164 HydrophobicContact SD-CD2 3.94Å
117	V	95.7	Very high	93.8	Very high	5 Å²	5	38.2 Å²	38.2	3%	0.03	21%	0.207	C	C	.	.	H	α-helix	trans	-66.7	-41.5	176.8	177.2	0	0	0	0	111	C113 E114 D115 H119 D120 M122 L164 Q170 A171 L174	C113-V117 WeakPolarHBondContact O-CG2 3.4Å; C113-V117 PolarHBondContact O-N 2.87Å; C113-V117 VanDerWaalsContact O-N 3.1Å; E114-V117 PolarHBondContact O-N 3.03Å; D115-V117 VanDerWaalsContact C-N 3.31Å; D115-V117 PolarHBondContact O-N 2.94Å; V117-H119 PolarHBondContact O-N 2.99Å; V117-D120 PolarHBondContact O-N 2.88Å; V117-D120 VanDerWaalsContact O-N 3.08Å; V117-M122 HydrophobicContact CG2-CG 4.44Å; V117-L164 HydrophobicContact CG2-CD2 4.29Å; V117-Q170 HydrophobicContact CG1-CB 4.07Å; V117-Q170 HydrophobicContact CG1-CG 3.7Å; V117-A171 HydrophobicContact CG2-CB 3.86Å; V117-L174 HydrophobicContact CG1-CD1 3.92Å
118	R	93.4	Very high	94.2	Very high	141 Å²	141	37.4 Å²	37.4	53%	0.532	20%	0.201	S	C	.	.	H	α-helix	trans	-62.7	-31.1	174.7	-69.3	175.9	-162	111.2	5	112.5	E114 D115 D120	E114-R118 WeakPolarHBondContact O-CG 3.47Å; E114-R118 PolarHBondContact O-N 3.21Å; E114-R118 IonicContact OE2-CZ 3.21Å; E114-R118 IonicContact OE2-NH1 3.67Å; E114-R118 IonicContact OE2-NH2 3.9Å; E114-R118 PolarHBondContact OE2-NH2 3.2Å; D115-R118 WeakPolarHBondContact O-CB 3.39Å; D115-R118 PolarHBondContact O-N 3.45Å; D115-R118 VanDerWaalsContact O-N 3.16Å; R118-D120 VanDerWaalsContact C-N 3.25Å; R118-D120 PolarHBondContact O-N 2.95Å
119	H	93.5	Very high	94.7	Very high	47 Å²	47	36.2 Å²	36.2	22%	0.218	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	14.3	175.6	-72	-19.6	0	0	0	114.1	V79 R80 D115 M116 V117 V121	V79-H119 HydrophobicContact CG1-CB 3.82Å; R80-H119 HydrophobicContact CG-CB 4.32Å; R80-H119 VanDerWaalsContact CZ-ND1 3.34Å; R80-H119 PolarHBondContact NE-CE1 3.49Å; R80-H119 PolarHBondContact NH2-CE1 3.25Å; R80-H119 PolarHBondContact NH2-ND1 2.98Å; D115-H119 WeakPolarHBondContact O-CB 3.43Å; D115-H119 PolarHBondContact O-N 3.31Å; D115-H119 IonicContact OD1-CD2 2.77Å; D115-H119 IonicContact OD1-NE2 2.63Å; D115-H119 IonicContact OD2-CD2 3.88Å; D115-H119 PolarHBondContact OD2-CD2 3.29Å; D115-H119 IonicContact OD2-NE2 3.5Å; M116-H119 CarbonylContact O-C 3.48Å; M116-H119 PolarHBondContact O-N 3.01Å; V117-H119 PolarHBondContact O-N 2.99Å; H119-V121 VanDerWaalsContact C-N 3.33Å; H119-V121 PolarHBondContact O-N 3.3Å
120	D	94.7	Very high	95.2	Very high	88 Å²	88	41.1 Å²	41.1	47%	0.471	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	34.2	171.7	-165.8	32.3	0	0	0	114.1	M116 V117 R118 M122 T123 P124	M116-D120 PolarHBondContact O-N 2.69Å; V117-D120 PolarHBondContact O-N 2.88Å; V117-D120 VanDerWaalsContact O-N 3.08Å; R118-D120 VanDerWaalsContact C-N 3.25Å; R118-D120 PolarHBondContact O-N 2.95Å; D120-M122 PolarHBondContact O-N 2.9Å; D120-T123 VanDerWaalsContact CG-OG1 3.26Å; D120-T123 PolarHBondContact O-N 2.84Å; D120-T123 WeakPolarHBondContact OD1-CB 3.34Å; D120-T123 PolarHBondContact OD1-OG1 2.93Å; D120-T123 PolarHBondContact OD2-OG1 3.22Å; D120-P124 WeakPolarHBondContact O-CD 3.49Å
121	V	97.3	Very high	95.4	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.012	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-28.4	173.3	171.4	0	0	0	0	112	V79 L101 M116 H119 T123 P124 L125 L160 L164	V79-V121 HydrophobicContact CG1-CG2 3.5Å; V79-V121 VanDerWaalsContact CG1-CG2 3.5Å; L101-V121 HydrophobicContact CD1-CG1 4.04Å; M116-V121 HydrophobicContact CB-CB 4.27Å; M116-V121 HydrophobicContact CB-CG2 3.96Å; M116-V121 HydrophobicContact CG-CG2 4.33Å; M116-V121 WeakPolarHBondContact O-CB 3.48Å; M116-V121 WeakPolarHBondContact O-CG2 3.5Å; M116-V121 PolarHBondContact O-N 2.95Å; M116-V121 VanDerWaalsContact O-N 3.1Å; H119-V121 VanDerWaalsContact C-N 3.33Å; H119-V121 PolarHBondContact O-N 3.3Å; V121-T123 VanDerWaalsContact C-N 3.25Å; V121-T123 PolarHBondContact O-N 2.91Å; V121-P124 VanDerWaalsContact O-CD 3.23Å; V121-P124 WeakPolarHBondContact O-CD 3.41Å; V121-P124 WeakPolarHBondContact O-CG 3.47Å; V121-L125 VanDerWaalsContact O-CB 3.22Å; V121-L125 WeakPolarHBondContact O-CB 3.43Å; V121-L125 PolarHBondContact O-N 3.05Å; V121-L125 VanDerWaalsContact O-N 3.11Å; V121-L160 HydrophobicContact CG1-CD2 4.19Å; V121-L164 HydrophobicContact CG1-CD1 4.37Å
122	M	97.3	Very high	95.5	Very high	4 Å²	4	35.9 Å²	35.9	2%	0.02	18%	0.177	C	C	.	.	H	α-helix	trans	-61.1	-30.8	179.8	-73.1	-65.2	-69.4	0	0	113.2	V117 D120 L125 T126 L161 L164 A171 L174 L180	V117-M122 HydrophobicContact CG2-CG 4.44Å; D120-M122 PolarHBondContact O-N 2.9Å; M122-L125 HydrophobicContact SD-CD2 4.35Å; M122-T126 VanDerWaalsContact O-CB 3.25Å; M122-T126 WeakPolarHBondContact O-CB 3.47Å; M122-T126 PolarHBondContact O-N 2.86Å; M122-T126 PolarHBondContact O-OG1 2.93Å; M122-L161 HydrophobicContact CE-CD1 3.64Å; M122-L161 HydrophobicContact SD-CD1 3.97Å; M122-L164 HydrophobicContact SD-CD1 3.78Å; M122-A171 HydrophobicContact SD-CB 4.43Å; M122-L174 HydrophobicContact CB-CD1 4Å; M122-L174 HydrophobicContact CE-CB 3.99Å; M122-L174 HydrophobicContact CG-CD1 3.86Å; M122-L180 HydrophobicContact CE-CD1 4.11Å
123	T	96.8	Very high	95.4	Very high	80 Å²	80	35.8 Å²	35.8	49%	0.491	18%	0.176	S	C	.	.	H	α-helix	trans	-68	-57.8	179.9	-67.4	0	0	0	0	113	D120 V121 L125 T126 A127	D120-T123 VanDerWaalsContact CG-OG1 3.26Å; D120-T123 PolarHBondContact O-N 2.84Å; D120-T123 WeakPolarHBondContact OD1-CB 3.34Å; D120-T123 PolarHBondContact OD1-OG1 2.93Å; D120-T123 PolarHBondContact OD2-OG1 3.22Å; V121-T123 VanDerWaalsContact C-N 3.25Å; V121-T123 PolarHBondContact O-N 2.91Å; T123-L125 VanDerWaalsContact C-N 3.28Å; T123-L125 PolarHBondContact O-N 3.41Å; T123-T126 PolarHBondContact O-N 3.28Å; T123-A127 PolarHBondContact O-N 3.15Å; T123-A127 VanDerWaalsContact O-N 3.11Å
124	P	97.8	Very high	95.2	Very high	17 Å²	17	40.1 Å²	40.1	11%	0.11	20%	0.203	C	C	.	.	H	α-helix	trans	-63.8	-32.7	174.8	25.4	-32.7	0	0	0	112.3	L86 L87 D120 V121 A127 L128	L86-P124 HydrophobicContact CB-CB 4.27Å; L86-P124 HydrophobicContact CD2-CB 4.46Å; L87-P124 HydrophobicContact CD1-CB 4.03Å; L87-P124 HydrophobicContact CG-CB 4.12Å; D120-P124 WeakPolarHBondContact O-CD 3.49Å; V121-P124 VanDerWaalsContact O-CD 3.23Å; V121-P124 WeakPolarHBondContact O-CD 3.41Å; V121-P124 WeakPolarHBondContact O-CG 3.47Å; P124-A127 PolarHBondContact O-N 3.03Å; P124-L128 WeakPolarHBondContact O-CB 3.48Å; P124-L128 PolarHBondContact O-N 3.4Å
125	L	98.2	Very high	94.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.3	-44	174.7	-177.6	57.9	0	0	0	112.6	L86 V121 M122 T123 A127 L128 L129 A157 L160 L161 L164	L86-L125 HydrophobicContact CD2-CB 4.15Å; L86-L125 HydrophobicContact CD2-CD1 4.31Å; V121-L125 VanDerWaalsContact O-CB 3.22Å; V121-L125 WeakPolarHBondContact O-CB 3.43Å; V121-L125 PolarHBondContact O-N 3.05Å; V121-L125 VanDerWaalsContact O-N 3.11Å; M122-L125 HydrophobicContact SD-CD2 4.35Å; T123-L125 VanDerWaalsContact C-N 3.28Å; T123-L125 PolarHBondContact O-N 3.41Å; L125-A127 VanDerWaalsContact C-N 3.33Å; L125-A127 PolarHBondContact O-N 2.99Å; L125-L128 PolarHBondContact O-N 2.91Å; L125-L129 HydrophobicContact CD1-CD1 4.45Å; L125-L129 HydrophobicContact CG-CD1 4.34Å; L125-L129 WeakPolarHBondContact O-CG 3.48Å; L125-L129 PolarHBondContact O-N 3.15Å; L125-A157 HydrophobicContact CD1-CB 3.74Å; L125-L160 HydrophobicContact CD1-CD2 4.2Å; L125-L160 HydrophobicContact CD2-CB 4.49Å; L125-L160 HydrophobicContact CD2-CD2 4.11Å; L125-L160 HydrophobicContact CD2-CG 4Å; L125-L161 HydrophobicContact CD2-CB 4.04Å; L125-L161 HydrophobicContact CD2-CD1 4.22Å; L125-L164 HydrophobicContact CD2-CD1 4.14Å
126	T	98.1	Very high	94.4	Very high	12 Å²	12	36.8 Å²	36.8	7%	0.074	19%	0.189	C	C	.	.	H	α-helix	trans	-62.6	-41	175.7	-64.1	0	0	0	0	111.4	M122 T123 R130 L180	M122-T126 VanDerWaalsContact O-CB 3.25Å; M122-T126 WeakPolarHBondContact O-CB 3.47Å; M122-T126 PolarHBondContact O-N 2.86Å; M122-T126 PolarHBondContact O-OG1 2.93Å; T123-T126 PolarHBondContact O-N 3.28Å; T126-R130 WeakPolarHBondContact O-CB 3.4Å; T126-R130 PolarHBondContact O-N 2.92Å; T126-R130 VanDerWaalsContact O-N 3.14Å; T126-L180 HydrophobicContact CG2-CD2 3.85Å
127	A	97.8	Very high	93.1	Very high	39 Å²	39	43.2 Å²	43.2	32%	0.322	22%	0.223	S	C	.	.	H	α-helix	trans	-65.3	-44.2	177.3	0	0	0	0	0	111.7	L87 T123 P124 L125 R130 E131	L87-A127 HydrophobicContact CD1-CB 4.49Å; L87-A127 HydrophobicContact CD2-CB 3.88Å; T123-A127 PolarHBondContact O-N 3.15Å; T123-A127 VanDerWaalsContact O-N 3.11Å; P124-A127 PolarHBondContact O-N 3.03Å; L125-A127 VanDerWaalsContact C-N 3.33Å; L125-A127 PolarHBondContact O-N 2.99Å; A127-R130 PolarHBondContact O-N 3.24Å; A127-E131 PolarHBondContact O-N 3.11Å; A127-E131 VanDerWaalsContact O-N 3.07Å
128	L	97.3	Very high	91.6	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.9	-49.6	176.8	-180	58.2	0	0	0	112	L86 L87 T98 P124 L125 R130 E131 C132 V153 A157	L86-L128 HydrophobicContact CB-CD2 4.05Å; L86-L128 HydrophobicContact CD2-CD2 4.5Å; L86-L128 HydrophobicContact CG-CD2 4.03Å; L86-L128 WeakPolarHBondContact O-CD1 3.45Å; L87-L128 HydrophobicContact CD2-CB 4.42Å; T98-L128 HydrophobicContact CG2-CD2 4.49Å; T98-L128 WeakPolarHBondContact OG1-CD2 3.5Å; P124-L128 WeakPolarHBondContact O-CB 3.48Å; P124-L128 PolarHBondContact O-N 3.4Å; L125-L128 PolarHBondContact O-N 2.91Å; L128-R130 VanDerWaalsContact C-N 3.3Å; L128-R130 PolarHBondContact O-N 3.13Å; L128-E131 PolarHBondContact O-N 2.63Å; L128-E131 VanDerWaalsContact O-N 3.16Å; L128-C132 PolarHBondContact O-N 2.99Å; L128-C132 PolarHBondContact O-SG 3.41Å; L128-V153 HydrophobicContact CD1-CG1 3.72Å; L128-V153 HydrophobicContact CD2-CG1 3.87Å; L128-V153 HydrophobicContact CG-CG1 4.03Å; L128-A157 HydrophobicContact CD2-CB 4.21Å
129	L	96.9	Very high	89.7	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-59.1	-41.7	178.3	-77.9	169	0	0	0	112	L125 E131 C132 C133 A157 V158 L161 L180 M183	L125-L129 HydrophobicContact CD1-CD1 4.45Å; L125-L129 HydrophobicContact CG-CD1 4.34Å; L125-L129 WeakPolarHBondContact O-CG 3.48Å; L125-L129 PolarHBondContact O-N 3.15Å; L129-E131 VanDerWaalsContact C-N 3.35Å; L129-E131 PolarHBondContact O-N 3.44Å; L129-C132 PolarHBondContact O-N 3.25Å; L129-C133 WeakPolarHBondContact O-CB 2.9Å; L129-C133 PolarHBondContact O-N 3.37Å; L129-C133 PolarHBondContact O-SG 3.34Å; L129-A157 HydrophobicContact CD2-CB 3.63Å; L129-A157 HydrophobicContact CG-CB 3.99Å; L129-V158 HydrophobicContact CD2-CG2 3.8Å; L129-L161 HydrophobicContact CD1-CD2 3.83Å; L129-L180 HydrophobicContact CD1-CD2 4.5Å; L129-M183 HydrophobicContact CB-SD 4.36Å
130	R	95.6	Very high	87.8	Confident	126 Å²	126	44.3 Å²	44.3	48%	0.475	26%	0.26	S	S	.	.	H	α-helix	trans	-61.8	-43.5	176.9	-171.1	176.8	-74.7	117.2	-2	111.4	T126 A127 L128 T134 M183	T126-R130 WeakPolarHBondContact O-CB 3.4Å; T126-R130 PolarHBondContact O-N 2.92Å; T126-R130 VanDerWaalsContact O-N 3.14Å; A127-R130 PolarHBondContact O-N 3.24Å; L128-R130 VanDerWaalsContact C-N 3.3Å; L128-R130 PolarHBondContact O-N 3.13Å; R130-T134 WeakPolarHBondContact O-CG2 3.46Å; R130-T134 PolarHBondContact O-N 3.32Å; R130-T134 VanDerWaalsContact O-N 3.09Å; R130-T134 PolarHBondContact O-OG1 2.93Å; R130-M183 HydrophobicContact CB-SD 4Å
131	E	93.9	Very high	85.6	Confident	88 Å²	88	46.7 Å²	46.7	41%	0.411	28%	0.278	S	S	.	.	H	α-helix	trans	-63.7	-45.8	176.5	-168	179.7	159.5	0	0	111.6	R94 A127 L128 L129 C133 T134 G135	R94-E131 IonicContact CZ-OE1 2.98Å; R94-E131 IonicContact CZ-OE2 3.43Å; R94-E131 IonicContact NH1-OE1 3.24Å; R94-E131 PolarHBondContact NH1-OE1 2.81Å; R94-E131 IonicContact NH1-OE2 3.86Å; R94-E131 PolarHBondContact NH1-OE2 2.96Å; R94-E131 VanDerWaalsContact NH1-OE2 3.14Å; R94-E131 IonicContact NH2-OE1 2.71Å; R94-E131 PolarHBondContact NH2-OE1 3.4Å; R94-E131 IonicContact NH2-OE2 3.37Å; A127-E131 PolarHBondContact O-N 3.11Å; A127-E131 VanDerWaalsContact O-N 3.07Å; L128-E131 PolarHBondContact O-N 2.63Å; L128-E131 VanDerWaalsContact O-N 3.16Å; L129-E131 VanDerWaalsContact C-N 3.35Å; L129-E131 PolarHBondContact O-N 3.44Å; E131-C133 PolarHBondContact O-N 3.13Å; E131-T134 WeakPolarHBondContact CA-OG1 3.25Å; E131-T134 PolarHBondContact O-N 3.42Å; E131-T134 PolarHBondContact O-OG1 3.37Å; E131-G135 PolarHBondContact O-N 2.57Å
132	C	93.3	Very high	83.2	Confident	5 Å²	5	50.4 Å²	50.4	3%	0.034	31%	0.308	C	S	.	.	H	α-helix	trans	-57	-50.1	175.9	-75.5	0	0	0	0	112.3	L128 L129 T134 G135 F136 V150 A154	L128-C132 PolarHBondContact O-N 2.99Å; L128-C132 PolarHBondContact O-SG 3.41Å; L129-C132 PolarHBondContact O-N 3.25Å; C132-T134 VanDerWaalsContact C-N 3.34Å; C132-T134 PolarHBondContact O-N 3.47Å; C132-G135 WeakPolarHBondContact O-CA 3.44Å; C132-G135 PolarHBondContact O-N 3.29Å; C132-F136 VanDerWaalsContact O-CD1 3.31Å; C132-F136 WeakPolarHBondContact O-CD1 3.47Å; C132-F136 PolarHBondContact O-N 2.8Å; C132-V150 HydrophobicContact CB-CG1 4.02Å; C132-A154 HydrophobicContact CB-CB 3.99Å
133	C	90.7	Very high	80.8	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.034	35%	0.347	C	S	.	.	H	α-helix	trans	-60.8	-41.6	179.1	-71.4	0	0	0	0	112	L129 E131 G135 F136 M183	L129-C133 WeakPolarHBondContact O-CB 2.9Å; L129-C133 PolarHBondContact O-N 3.37Å; L129-C133 PolarHBondContact O-SG 3.34Å; E131-C133 PolarHBondContact O-N 3.13Å; C133-G135 PolarHBondContact O-N 3.41Å; C133-F136 WeakPolarHBondContact O-CB 3.47Å; C133-F136 PolarHBondContact O-N 3.14Å; C133-M183 HydrophobicContact CB-CG 4.4Å
134	T	89.6	Confident	78.4	Confident	92 Å²	92	64.4 Å²	64.4	56%	0.564	37%	0.367	S	S	*	.	H	α-helix	trans	-64.4	-28	173.6	57.4	0	0	0	0	113.1	R130 E131 C132	R130-T134 WeakPolarHBondContact O-CG2 3.46Å; R130-T134 PolarHBondContact O-N 3.32Å; R130-T134 VanDerWaalsContact O-N 3.09Å; R130-T134 PolarHBondContact O-OG1 2.93Å; E131-T134 WeakPolarHBondContact CA-OG1 3.25Å; E131-T134 PolarHBondContact O-N 3.42Å; E131-T134 PolarHBondContact O-OG1 3.37Å; C132-T134 VanDerWaalsContact C-N 3.34Å; C132-T134 PolarHBondContact O-N 3.47Å
135	G	84.3	Confident	76.1	Confident	12 Å²	12	71.2 Å²	71.2	12%	0.124	40%	0.403	C	S	.	.	H	α-helix	trans	-74.4	-21.1	177.6	0	0	0	0	0	114.5	E131 C132 C133 D137 T138 A139	E131-G135 PolarHBondContact O-N 2.57Å; C132-G135 WeakPolarHBondContact O-CA 3.44Å; C132-G135 PolarHBondContact O-N 3.29Å; C133-G135 PolarHBondContact O-N 3.41Å; G135-D137 VanDerWaalsContact C-N 3.33Å; G135-D137 PolarHBondContact O-N 2.95Å; G135-T138 WeakPolarHBondContact CA-OG1 3.42Å; G135-T138 PolarHBondContact O-N 3.35Å; G135-T138 PolarHBondContact O-OG1 3.36Å; G135-A139 PolarHBondContact O-N 3.46Å; G135-A139 VanDerWaalsContact O-N 3.16Å
136	F	84.1	Confident	73.9	Confident	8 Å²	8	79.4 Å²	79.4	4%	0.035	44%	0.441	C	S	.	.	H	α-helix	trans	-60.8	-40.3	-179.4	-66	-18.5	0	0	0	112.5	C132 C133 A139 V150 E151 A154 R190 L197	C132-F136 VanDerWaalsContact O-CD1 3.31Å; C132-F136 WeakPolarHBondContact O-CD1 3.47Å; C132-F136 PolarHBondContact O-N 2.8Å; C133-F136 WeakPolarHBondContact O-CB 3.47Å; C133-F136 PolarHBondContact O-N 3.14Å; F136-A139 PolarHBondContact O-N 3.41Å; F136-V150 HydrophobicContact CE1-CG1 4.45Å; F136-E151 HydrophobicContact CD1-CG 4.15Å; F136-E151 HydrophobicContact CE1-CG 3.79Å; F136-A154 HydrophobicContact CE1-CB 4.12Å; F136-A154 HydrophobicContact CZ-CB 3.85Å; F136-R190 HydrophobicContact CE2-CG 4.45Å; F136-L197 HydrophobicContact CE1-CD2 4.49Å; F136-L197 HydrophobicContact CZ-CD2 3.98Å
137	D	69.9	Low	72.1	Confident	135 Å²	135	83.7 Å²	83.7	72%	0.722	47%	0.471	S	S	*	.	H	α-helix	trans	-69.8	-33.7	179.6	-71.4	-27	0	0	0	112.5	G135	G135-D137 VanDerWaalsContact C-N 3.33Å; G135-D137 PolarHBondContact O-N 2.95Å
138	T	63.8	Low	71.1	Confident	107 Å²	107	83.1 Å²	83.1	66%	0.656	46%	0.463	S	S	*	.	H	α-helix	trans	-75.8	-27.4	179.2	47.3	0	0	0	0	113.5	G135	G135-T138 WeakPolarHBondContact CA-OG1 3.42Å; G135-T138 PolarHBondContact O-N 3.35Å; G135-T138 PolarHBondContact O-OG1 3.36Å
139	A	53.8	Low	70.3	Confident	26 Å²	26	86.6 Å²	86.6	22%	0.215	49%	0.486	C	S	.	.	H	α-helix	trans	-82.6	-18.6	-177.2	0	0	0	0	0	114	G135 F136 V141 A142 N148	G135-A139 PolarHBondContact O-N 3.46Å; G135-A139 VanDerWaalsContact O-N 3.16Å; F136-A139 PolarHBondContact O-N 3.41Å; A139-V141 PolarHBondContact O-N 3.03Å; A139-A142 PolarHBondContact O-N 3.47Å; A139-N148 WeakPolarHBondContact CB-ND2 3.48Å
140	A	52.3	Low	70	Confident	83 Å²	83	88.3 Å²	88.3	69%	0.686	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-11.7	177.3	0	0	0	0	0	114.2
141	V	50	Low	69.7	Low	139 Å²	139	82.9 Å²	82.9	84%	0.842	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-12.5	179.7	-174.8	0	0	0	0	112.4	A139	A139-V141 PolarHBondContact O-N 3.03Å
142	A	46.4	Very low	69.6	Low	79 Å²	79	79.3 Å²	79.3	65%	0.653	46%	0.463	S	S	*	.	S	Bend	trans	-101.7	138.1	-177.3	0	0	0	0	0	112.5	A139	A139-A142 PolarHBondContact O-N 3.47Å
143	M	45.7	Very low	69.6	Low	168 Å²	168	79.2 Å²	79.2	83%	0.828	46%	0.462	S	S	*	.			trans	-22.5	139.9	-171.1	-63.5	-161.3	171.1	0	0	120.3	D145	M143-D145 VanDerWaalsContact C-N 3.26Å; M143-D145 PolarHBondContact O-N 3.35Å
144	K	47.7	Very low	69.9	Low	210 Å²	210	79 Å²	79	91%	0.913	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-5.6	-173.8	-101.6	178.8	173.4	-178.4	0	118.2
145	D	47.8	Very low	70.1	Confident	161 Å²	161	75.7 Å²	75.7	86%	0.861	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.4	9.7	-167	-69.3	-35.9	0	0	0	115	M143	M143-D145 VanDerWaalsContact C-N 3.26Å; M143-D145 PolarHBondContact O-N 3.35Å
146	Q	52.4	Low	70.7	Confident	171 Å²	171	76.1 Å²	76.1	80%	0.799	44%	0.438	S	S	*	.	S	Bend	trans	-121.3	130.5	175	-70.1	-179.5	10.4	0	0	111.2	N148	Q146-N148 PolarHBondContact O-N 3.45Å
147	S	61.5	Low	71.4	Confident	103 Å²	103	75.8 Å²	75.8	72%	0.72	44%	0.437	S	S	*	.			trans	-54.1	126.5	172.7	-178.7	0	0	0	0	109.5	P149	S147-P149 VanDerWaalsContact O-CD 3.24Å; S147-P149 WeakPolarHBondContact O-CD 3.36Å
148	N	76.1	Confident	72.7	Confident	27 Å²	27	69.3 Å²	69.3	14%	0.144	40%	0.402	C	S	.	.			trans	-67.5	113	179.2	178.9	1.4	0	0	0	108.7	A139 Q146 V150 E151 G152	A139-N148 WeakPolarHBondContact CB-ND2 3.48Å; Q146-N148 PolarHBondContact O-N 3.45Å; N148-V150 PolarHBondContact O-N 3.01Å; N148-V150 VanDerWaalsContact O-N 3.09Å; N148-V150 WeakPolarHBondContact OD1-CB 3.21Å; N148-V150 PolarHBondContact OD1-N 3.21Å; N148-V150 VanDerWaalsContact OD1-N 3.11Å; N148-E151 HydrophobicContact CB-CB 4.19Å; N148-E151 HydrophobicContact CB-CG 3.92Å; N148-E151 WeakPolarHBondContact O-CB 3.21Å; N148-E151 PolarHBondContact O-N 3.14Å; N148-G152 PolarHBondContact O-N 2.85Å
149	P	81.5	Confident	74.3	Confident	73 Å²	73	64.4 Å²	64.4	47%	0.474	37%	0.372	S	S	.	.	H	α-helix	trans	-61.6	-25.5	-176.4	26.1	-35.2	0	0	0	112.2	V91 S147 E151 G152 V153	V91-P149 HydrophobicContact CG1-CB 4.1Å; S147-P149 VanDerWaalsContact O-CD 3.24Å; S147-P149 WeakPolarHBondContact O-CD 3.36Å; P149-E151 VanDerWaalsContact C-N 3.33Å; P149-E151 PolarHBondContact O-N 3.14Å; P149-G152 PolarHBondContact O-N 3.42Å; P149-V153 PolarHBondContact O-N 3.37Å
150	V	88.9	Confident	76.3	Confident	37 Å²	37	63.1 Å²	63.1	22%	0.224	36%	0.361	C	S	.	.	H	α-helix	trans	-67.2	-33.8	174.3	-177.5	0	0	0	0	111.9	C132 F136 N148 A154	C132-V150 HydrophobicContact CB-CG1 4.02Å; F136-V150 HydrophobicContact CE1-CG1 4.45Å; N148-V150 PolarHBondContact O-N 3.01Å; N148-V150 VanDerWaalsContact O-N 3.09Å; N148-V150 WeakPolarHBondContact OD1-CB 3.21Å; N148-V150 PolarHBondContact OD1-N 3.21Å; N148-V150 VanDerWaalsContact OD1-N 3.11Å; V150-A154 WeakPolarHBondContact O-CB 3.18Å; V150-A154 PolarHBondContact O-N 3.29Å
151	E	90.5	Very high	78.5	Confident	12 Å²	12	59.2 Å²	59.2	6%	0.056	33%	0.329	C	S	.	.	H	α-helix	trans	-72.6	-31.9	175.5	-70.3	-179.5	-176.4	0	0	112	F136 N148 P149 A154 N155 R190 N194 L197	F136-E151 HydrophobicContact CD1-CG 4.15Å; F136-E151 HydrophobicContact CE1-CG 3.79Å; N148-E151 HydrophobicContact CB-CB 4.19Å; N148-E151 HydrophobicContact CB-CG 3.92Å; N148-E151 WeakPolarHBondContact O-CB 3.21Å; N148-E151 PolarHBondContact O-N 3.14Å; P149-E151 VanDerWaalsContact C-N 3.33Å; P149-E151 PolarHBondContact O-N 3.14Å; E151-A154 PolarHBondContact O-N 2.87Å; E151-N155 WeakPolarHBondContact O-CB 3.48Å; E151-N155 PolarHBondContact O-N 3.43Å; E151-R190 IonicContact OE1-CZ 2.7Å; E151-R190 VanDerWaalsContact OE1-CZ 3.24Å; E151-R190 IonicContact OE1-NE 2.87Å; E151-R190 PolarHBondContact OE1-NE 3.46Å; E151-R190 IonicContact OE1-NH2 2.72Å; E151-R190 PolarHBondContact OE1-NH2 3.28Å; E151-N194 WeakPolarHBondContact OE2-CB 3.48Å; E151-N194 PolarHBondContact OE2-ND2 2.98Å; E151-L197 HydrophobicContact CB-CD2 4.19Å; E151-L197 HydrophobicContact CG-CD2 4.17Å
152	G	90.4	Very high	80.8	Confident	13 Å²	13	53.7 Å²	53.7	13%	0.134	29%	0.293	C	S	.	.	H	α-helix	trans	-60.3	-48.9	171	0	0	0	0	0	111.7	N148 P149 A154 N155 E156	N148-G152 PolarHBondContact O-N 2.85Å; P149-G152 PolarHBondContact O-N 3.42Å; G152-A154 PolarHBondContact O-N 3.37Å; G152-N155 WeakPolarHBondContact O-CB 3.44Å; G152-N155 PolarHBondContact O-N 2.94Å; G152-E156 PolarHBondContact O-N 3.44Å
153	V	94.8	Very high	83.1	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-44.4	173.9	179.5	0	0	0	0	111.7	V91 R94 E95 L128 P149 N155 E156 A157	V91-V153 HydrophobicContact CG1-CG2 3.66Å; R94-V153 HydrophobicContact CB-CG1 4.12Å; R94-V153 HydrophobicContact CB-CG2 4.33Å; E95-V153 HydrophobicContact CB-CG2 3.78Å; E95-V153 HydrophobicContact CG-CG2 4.45Å; L128-V153 HydrophobicContact CD1-CG1 3.72Å; L128-V153 HydrophobicContact CD2-CG1 3.87Å; L128-V153 HydrophobicContact CG-CG1 4.03Å; P149-V153 PolarHBondContact O-N 3.37Å; V153-N155 VanDerWaalsContact C-N 3.27Å; V153-N155 PolarHBondContact O-N 3.32Å; V153-E156 PolarHBondContact O-N 3.35Å; V153-A157 WeakPolarHBondContact O-CB 3.49Å; V153-A157 PolarHBondContact O-N 3.35Å
154	A	96.3	Very high	85.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-38.2	178	0	0	0	0	0	111.8	C132 F136 V150 E151 G152 A157 V158 L197	C132-A154 HydrophobicContact CB-CB 3.99Å; F136-A154 HydrophobicContact CE1-CB 4.12Å; F136-A154 HydrophobicContact CZ-CB 3.85Å; V150-A154 WeakPolarHBondContact O-CB 3.18Å; V150-A154 PolarHBondContact O-N 3.29Å; E151-A154 PolarHBondContact O-N 2.87Å; G152-A154 PolarHBondContact O-N 3.37Å; A154-A157 PolarHBondContact O-N 3.47Å; A154-V158 WeakPolarHBondContact O-CB 3.4Å; A154-V158 VanDerWaalsContact O-CG2 3.28Å; A154-V158 WeakPolarHBondContact O-CG2 3.34Å; A154-V158 PolarHBondContact O-N 2.97Å; A154-L197 HydrophobicContact CB-CD1 4.01Å; A154-L197 HydrophobicContact CB-CD2 4.31Å
155	N	94.9	Very high	87.9	Confident	23 Å²	23	33.1 Å²	33.1	12%	0.123	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-46.8	178.7	-175.3	65.1	0	0	0	111.7	E151 G152 V153 A157 V158 N159 L197 S200	E151-N155 WeakPolarHBondContact O-CB 3.48Å; E151-N155 PolarHBondContact O-N 3.43Å; G152-N155 WeakPolarHBondContact O-CB 3.44Å; G152-N155 PolarHBondContact O-N 2.94Å; V153-N155 VanDerWaalsContact C-N 3.27Å; V153-N155 PolarHBondContact O-N 3.32Å; N155-A157 VanDerWaalsContact C-N 3.32Å; N155-A157 PolarHBondContact O-N 2.77Å; N155-V158 PolarHBondContact O-N 3.29Å; N155-N159 PolarHBondContact O-N 3.12Å; N155-N159 PolarHBondContact O-ND2 3.45Å; N155-L197 HydrophobicContact CB-CD1 4.12Å; N155-L197 WeakPolarHBondContact OD1-CA 3.42Å; N155-S200 PolarHBondContact OD1-OG 2.94Å
156	E	95.8	Very high	90	Very high	21 Å²	21	28.2 Å²	28.2	10%	0.098	16%	0.158	C	C	.	.	H	α-helix	trans	-63.1	-39.5	175.1	-65	-58.4	151.1	0	0	111.7	E95 T98 G99 R102 G152 V153 N159 L160	E95-E156 HydrophobicContact CG-CG 4.34Å; T98-E156 VanDerWaalsContact CG2-C 3.48Å; T98-E156 HydrophobicContact CG2-CB 3.77Å; G99-E156 WeakPolarHBondContact CA-OE2 3.36Å; R102-E156 IonicContact CZ-OE2 3.49Å; R102-E156 VanDerWaalsContact CZ-OE2 3.28Å; R102-E156 IonicContact NE-OE2 2.73Å; R102-E156 PolarHBondContact NE-OE2 3.06Å; R102-E156 IonicContact NH2-OE1 3.27Å; R102-E156 PolarHBondContact NH2-OE1 3.16Å; R102-E156 IonicContact NH2-OE2 2.73Å; R102-E156 PolarHBondContact NH2-OE2 3.28Å; G152-E156 PolarHBondContact O-N 3.44Å; V153-E156 PolarHBondContact O-N 3.35Å; E156-N159 PolarHBondContact O-N 2.98Å; E156-L160 PolarHBondContact O-N 2.97Å
157	A	98	Very high	91.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.4	-42.9	179.7	0	0	0	0	0	112.6	T98 L125 L128 L129 V153 A154 N155 L160 L161	T98-A157 HydrophobicContact CG2-CB 4.08Å; L125-A157 HydrophobicContact CD1-CB 3.74Å; L128-A157 HydrophobicContact CD2-CB 4.21Å; L129-A157 HydrophobicContact CD2-CB 3.63Å; L129-A157 HydrophobicContact CG-CB 3.99Å; V153-A157 WeakPolarHBondContact O-CB 3.49Å; V153-A157 PolarHBondContact O-N 3.35Å; A154-A157 PolarHBondContact O-N 3.47Å; N155-A157 VanDerWaalsContact C-N 3.32Å; N155-A157 PolarHBondContact O-N 2.77Å; A157-L160 PolarHBondContact O-N 3.14Å; A157-L161 WeakPolarHBondContact O-CB 3.3Å; A157-L161 PolarHBondContact O-N 3.41Å
158	V	98.1	Very high	93.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-67	-38.3	176.8	172.4	0	0	0	0	111	L129 A154 N155 L161 W162 C187 L197 S200 A201 C204	L129-V158 HydrophobicContact CD2-CG2 3.8Å; A154-V158 WeakPolarHBondContact O-CB 3.4Å; A154-V158 VanDerWaalsContact O-CG2 3.28Å; A154-V158 WeakPolarHBondContact O-CG2 3.34Å; A154-V158 PolarHBondContact O-N 2.97Å; N155-V158 PolarHBondContact O-N 3.29Å; V158-L161 WeakPolarHBondContact O-CB 3.35Å; V158-L161 PolarHBondContact O-N 2.89Å; V158-W162 WeakPolarHBondContact O-CB 3.37Å; V158-W162 PolarHBondContact O-N 2.97Å; V158-C187 HydrophobicContact CG2-CB 4.36Å; V158-L197 HydrophobicContact CG2-CD1 4.33Å; V158-S200 VanDerWaalsContact CG1-C 3.45Å; V158-S200 WeakPolarHBondContact CG1-O 3.41Å; V158-A201 HydrophobicContact CG1-CB 4.32Å; V158-C204 HydrophobicContact CG1-CB 4.17Å
159	N	96.7	Very high	94	Very high	3 Å²	3	20.4 Å²	20.4	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-67.6	-41	175.6	-77.9	-43.9	0	0	0	112.6	R102 N155 E156 L161 W162 N163 S200	R102-N159 HydrophobicContact CG-CB 3.78Å; N155-N159 PolarHBondContact O-N 3.12Å; N155-N159 PolarHBondContact O-ND2 3.45Å; E156-N159 PolarHBondContact O-N 2.98Å; N159-L161 VanDerWaalsContact C-N 3.33Å; N159-L161 PolarHBondContact O-N 3.41Å; N159-W162 PolarHBondContact O-N 3.47Å; N159-N163 VanDerWaalsContact O-CG 3.27Å; N159-N163 PolarHBondContact O-N 3.47Å; N159-N163 PolarHBondContact O-OD1 3.41Å; N159-S200 PolarHBondContact ND2-OG 3.49Å; N159-S200 WeakPolarHBondContact OD1-CB 3.42Å; N159-S200 PolarHBondContact OD1-OG 2.78Å
160	L	97.7	Very high	94.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-59.8	-45.8	170.9	176.5	58.3	0	0	0	111	T98 L101 R102 M116 V121 L125 E156 A157 W162 N163 L164	T98-L160 HydrophobicContact CG2-CD2 4.3Å; L101-L160 HydrophobicContact CB-CD1 4.08Å; L101-L160 HydrophobicContact CB-CD2 3.71Å; L101-L160 HydrophobicContact CD1-CD2 4.06Å; R102-L160 HydrophobicContact CB-CB 4.17Å; M116-L160 HydrophobicContact SD-CD1 4.29Å; V121-L160 HydrophobicContact CG1-CD2 4.19Å; L125-L160 HydrophobicContact CD1-CD2 4.2Å; L125-L160 HydrophobicContact CD2-CB 4.49Å; L125-L160 HydrophobicContact CD2-CD2 4.11Å; L125-L160 HydrophobicContact CD2-CG 4Å; E156-L160 PolarHBondContact O-N 2.97Å; A157-L160 PolarHBondContact O-N 3.14Å; L160-W162 VanDerWaalsContact C-N 3.32Å; L160-W162 PolarHBondContact O-N 2.97Å; L160-N163 PolarHBondContact O-N 3.2Å; L160-L164 HydrophobicContact CD1-CD1 4.16Å; L160-L164 HydrophobicContact CD1-CG 4.11Å; L160-L164 HydrophobicContact CG-CD1 4.18Å; L160-L164 VanDerWaalsContact O-CG 3.28Å; L160-L164 WeakPolarHBondContact O-CG 3.47Å; L160-L164 PolarHBondContact O-N 2.95Å
161	L	98.4	Very high	94.9	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.1	-44.2	177.6	-178.7	62.3	0	0	0	111.7	M122 L125 L129 A157 V158 N159 L164 C165 F175 L180 V184	M122-L161 HydrophobicContact CE-CD1 3.64Å; M122-L161 HydrophobicContact SD-CD1 3.97Å; L125-L161 HydrophobicContact CD2-CB 4.04Å; L125-L161 HydrophobicContact CD2-CD1 4.22Å; L129-L161 HydrophobicContact CD1-CD2 3.83Å; A157-L161 WeakPolarHBondContact O-CB 3.3Å; A157-L161 PolarHBondContact O-N 3.41Å; V158-L161 WeakPolarHBondContact O-CB 3.35Å; V158-L161 PolarHBondContact O-N 2.89Å; N159-L161 VanDerWaalsContact C-N 3.33Å; N159-L161 PolarHBondContact O-N 3.41Å; L161-L164 PolarHBondContact O-N 3.46Å; L161-C165 WeakPolarHBondContact O-CB 3.43Å; L161-C165 PolarHBondContact O-N 3.44Å; L161-C165 PolarHBondContact O-SG 3.3Å; L161-F175 HydrophobicContact CD1-CD2 4.19Å; L161-F175 HydrophobicContact CD2-CD2 3.91Å; L161-F175 HydrophobicContact CD2-CE2 3.86Å; L161-F175 HydrophobicContact CG-CD2 4.26Å; L161-L180 HydrophobicContact CD1-CD1 3.74Å; L161-L180 HydrophobicContact CD2-CD1 3.88Å; L161-L180 HydrophobicContact CG-CD1 4.49Å; L161-V184 HydrophobicContact CD2-CG2 4.02Å
162	W	97.2	Very high	95.2	Very high	24 Å²	24	20.8 Å²	20.8	9%	0.091	12%	0.119	C	C	.	.	H	α-helix	trans	-59	-52.4	176.3	172.3	23	0	0	0	111.2	V158 N159 L160 L164 C165 E166 H203 C204 T207 D343	V158-W162 WeakPolarHBondContact O-CB 3.37Å; V158-W162 PolarHBondContact O-N 2.97Å; N159-W162 PolarHBondContact O-N 3.47Å; L160-W162 VanDerWaalsContact C-N 3.32Å; L160-W162 PolarHBondContact O-N 2.97Å; W162-L164 VanDerWaalsContact C-N 3.28Å; W162-L164 PolarHBondContact O-N 2.93Å; W162-C165 PolarHBondContact O-N 3.06Å; W162-C165 VanDerWaalsContact O-N 3.13Å; W162-E166 WeakPolarHBondContact O-CB 3.35Å; W162-E166 PolarHBondContact O-N 3.36Å; W162-H203 HydrophobicContact CD2-CB 3.6Å; W162-H203 HydrophobicContact CE3-CB 3.57Å; W162-H203 HydrophobicContact CG-CB 4.34Å; W162-H203 HydrophobicContact CH2-CB 3.75Å; W162-H203 AromaticContact CH2-CD2 3.95Å; W162-H203 AromaticContact CH2-CE1 3.81Å; W162-H203 AromaticContact CH2-CG 3.45Å; W162-H203 VanDerWaalsContact CH2-CG 3.45Å; W162-H203 AromaticContact CH2-ND1 3.34Å; W162-H203 VanDerWaalsContact CH2-ND1 3.34Å; W162-H203 WeakPolarHBondContact CH2-ND1 3.26Å; W162-H203 HydrophobicContact CZ2-CB 3.79Å; W162-H203 AromaticContact CZ2-CG 3.77Å; W162-H203 AromaticContact CZ2-ND1 3.46Å; W162-H203 WeakPolarHBondContact CZ2-ND1 3.39Å; W162-H203 HydrophobicContact CZ3-CB 3.64Å; W162-H203 AromaticContact CZ3-CD2 3.93Å; W162-H203 AromaticContact CZ3-CG 3.63Å; W162-C204 HydrophobicContact CB-CB 3.99Å; W162-T207 VanDerWaalsContact CD1-OG1 3.22Å; W162-T207 PolarHBondContact NE1-OG1 3.32Å; W162-T207 VanDerWaalsContact NE1-OG1 3.11Å; W162-D343 WeakPolarHBondContact CZ3-OD2 3.37Å
163	N	95.8	Very high	95.4	Very high	18 Å²	18	21.9 Å²	21.9	10%	0.096	12%	0.124	C	C	.	.	H	α-helix	trans	-55.1	-44.1	179	-67.8	-11.2	0	0	0	112.1	R102 S105 N159 L160 S167	R102-N163 PolarHBondContact O-ND2 2.91Å; S105-N163 WeakPolarHBondContact OG-CB 3.48Å; S105-N163 PolarHBondContact OG-ND2 3.25Å; N159-N163 VanDerWaalsContact O-CG 3.27Å; N159-N163 PolarHBondContact O-N 3.47Å; N159-N163 PolarHBondContact O-OD1 3.41Å; L160-N163 PolarHBondContact O-N 3.2Å; N163-S167 WeakPolarHBondContact O-CB 3.23Å; N163-S167 PolarHBondContact O-N 3.39Å; N163-S167 PolarHBondContact O-OG 3.11Å
164	L	96.4	Very high	95.5	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65.4	-45.1	178.4	-65.3	178.4	0	0	0	111.7	C113 M116 V117 V121 M122 L125 L160 L161 W162 S167 S168 A171	C113-L164 HydrophobicContact CB-CD2 3.97Å; M116-L164 HydrophobicContact CB-CD2 3.86Å; M116-L164 HydrophobicContact SD-CD2 3.94Å; V117-L164 HydrophobicContact CG2-CD2 4.29Å; V121-L164 HydrophobicContact CG1-CD1 4.37Å; M122-L164 HydrophobicContact SD-CD1 3.78Å; L125-L164 HydrophobicContact CD2-CD1 4.14Å; L160-L164 HydrophobicContact CD1-CD1 4.16Å; L160-L164 HydrophobicContact CD1-CG 4.11Å; L160-L164 HydrophobicContact CG-CD1 4.18Å; L160-L164 VanDerWaalsContact O-CG 3.28Å; L160-L164 WeakPolarHBondContact O-CG 3.47Å; L160-L164 PolarHBondContact O-N 2.95Å; L161-L164 PolarHBondContact O-N 3.46Å; W162-L164 VanDerWaalsContact C-N 3.28Å; W162-L164 PolarHBondContact O-N 2.93Å; L164-S167 PolarHBondContact O-N 3.44Å; L164-S168 VanDerWaalsContact O-CB 3.29Å; L164-S168 WeakPolarHBondContact O-CB 3.46Å; L164-S168 PolarHBondContact O-N 3.15Å; L164-A171 HydrophobicContact CB-CB 4.02Å; L164-A171 WeakPolarHBondContact O-CB 3.23Å
165	C	96.3	Very high	95.6	Very high	6 Å²	6	24 Å²	24	4%	0.041	14%	0.135	C	C	.	.	H	α-helix	trans	-68.5	-33.8	179.3	-77.2	0	0	0	0	113.3	L161 W162 S167 V172 V208	L161-C165 WeakPolarHBondContact O-CB 3.43Å; L161-C165 PolarHBondContact O-N 3.44Å; L161-C165 PolarHBondContact O-SG 3.3Å; W162-C165 PolarHBondContact O-N 3.06Å; W162-C165 VanDerWaalsContact O-N 3.13Å; C165-S167 VanDerWaalsContact C-N 3.32Å; C165-V172 HydrophobicContact CB-CG2 4.11Å; C165-V172 VanDerWaalsContact O-CG2 3.27Å; C165-V172 WeakPolarHBondContact O-CG2 3.37Å; C165-V208 HydrophobicContact CB-CG1 3.72Å
166	E	92.3	Very high	95.6	Very high	59 Å²	59	24.2 Å²	24.2	28%	0.276	14%	0.136	S	C	.	.	H	α-helix	trans	-68.2	-35	175.5	-172.3	160.1	-119.8	0	0	111.7	R11 W162 T207	R11-E166 WeakPolarHBondContact CD-OE1 3.45Å; R11-E166 IonicContact CZ-OE1 3.58Å; R11-E166 IonicContact NH1-OE1 2.72Å; R11-E166 PolarHBondContact NH1-OE1 3.27Å; W162-E166 WeakPolarHBondContact O-CB 3.35Å; W162-E166 PolarHBondContact O-N 3.36Å; E166-T207 HydrophobicContact CB-CG2 3.88Å; E166-T207 HydrophobicContact CG-CG2 4.32Å
167	S	90.4	Very high	95.5	Very high	26 Å²	26	30.2 Å²	30.2	18%	0.182	16%	0.162	C	C	.	.	H	α-helix	trans	-98.3	-11.2	-173.9	-60.6	0	0	0	0	114.8	Q110 C113 N163 L164 C165	Q110-S167 WeakPolarHBondContact CG-O 3.4Å; C113-S167 VanDerWaalsContact CB-CB 3.43Å; N163-S167 WeakPolarHBondContact O-CB 3.23Å; N163-S167 PolarHBondContact O-N 3.39Å; N163-S167 PolarHBondContact O-OG 3.11Å; L164-S167 PolarHBondContact O-N 3.44Å; C165-S167 VanDerWaalsContact C-N 3.32Å
168	S	91	Very high	95.4	Very high	9 Å²	9	32.3 Å²	32.3	6%	0.063	18%	0.177	C	C	.	.			trans	-142.8	116.2	-172.8	-175.3	0	0	0	0	113.3	L164 Q170 A171 V172	L164-S168 VanDerWaalsContact O-CB 3.29Å; L164-S168 WeakPolarHBondContact O-CB 3.46Å; L164-S168 PolarHBondContact O-N 3.15Å; S168-Q170 PolarHBondContact O-N 3.02Å; S168-Q170 PolarHBondContact OG-N 3.43Å; S168-A171 WeakPolarHBondContact O-CB 3.38Å; S168-A171 PolarHBondContact O-N 3.01Å; S168-A171 PolarHBondContact OG-N 3.49Å; S168-V172 PolarHBondContact O-N 2.93Å; S168-V172 VanDerWaalsContact O-N 3.13Å
169	S	92	Very high	95.1	Very high	101 Å²	101	34 Å²	34	71%	0.706	20%	0.195	S	C	*	.	H	α-helix	trans	-61.4	-29	171.4	60.4	0	0	0	0	112.7	V172 S173	S169-V172 PolarHBondContact O-N 3.02Å; S169-S173 PolarHBondContact O-N 2.54Å
170	Q	94.3	Very high	95.1	Very high	101 Å²	101	33.9 Å²	33.9	47%	0.472	19%	0.194	S	C	.	.	H	α-helix	trans	-66.8	-40.4	172.6	-174.9	178	-7.1	0	0	111.4	V117 S168 V172 S173 L174	V117-Q170 HydrophobicContact CG1-CB 4.07Å; V117-Q170 HydrophobicContact CG1-CG 3.7Å; S168-Q170 PolarHBondContact O-N 3.02Å; S168-Q170 PolarHBondContact OG-N 3.43Å; Q170-V172 VanDerWaalsContact C-N 3.34Å; Q170-S173 PolarHBondContact O-N 3Å; Q170-L174 HydrophobicContact CG-CD1 4.36Å; Q170-L174 WeakPolarHBondContact O-CG 3.48Å; Q170-L174 PolarHBondContact O-N 3.22Å
171	A	96.2	Very high	94.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-41.9	173.5	0	0	0	0	0	111.5	V117 M122 L164 S168 S173 L174 F175	V117-A171 HydrophobicContact CG2-CB 3.86Å; M122-A171 HydrophobicContact SD-CB 4.43Å; L164-A171 HydrophobicContact CB-CB 4.02Å; L164-A171 WeakPolarHBondContact O-CB 3.23Å; S168-A171 WeakPolarHBondContact O-CB 3.38Å; S168-A171 PolarHBondContact O-N 3.01Å; S168-A171 PolarHBondContact OG-N 3.49Å; A171-S173 PolarHBondContact O-N 2.93Å; A171-L174 PolarHBondContact O-N 2.88Å; A171-F175 WeakPolarHBondContact O-CB 3.27Å; A171-F175 PolarHBondContact O-N 2.88Å
172	V	96.2	Very high	94.6	Very high	29 Å²	29	38.4 Å²	38.4	18%	0.176	22%	0.218	C	C	.	.	H	α-helix	trans	-60.6	-42.8	174	178.8	0	0	0	0	111.6	C165 S168 S169 Q170 L174 F175 N176 N212	C165-V172 HydrophobicContact CB-CG2 4.11Å; C165-V172 VanDerWaalsContact O-CG2 3.27Å; C165-V172 WeakPolarHBondContact O-CG2 3.37Å; S168-V172 PolarHBondContact O-N 2.93Å; S168-V172 VanDerWaalsContact O-N 3.13Å; S169-V172 PolarHBondContact O-N 3.02Å; Q170-V172 VanDerWaalsContact C-N 3.34Å; V172-L174 VanDerWaalsContact C-N 3.34Å; V172-L174 PolarHBondContact O-N 3.38Å; V172-F175 WeakPolarHBondContact O-CB 3.18Å; V172-F175 PolarHBondContact O-N 2.81Å; V172-N176 PolarHBondContact O-N 2.98Å; V172-N176 VanDerWaalsContact O-N 3.08Å; V172-N176 PolarHBondContact O-OD1 2.73Å; V172-N212 VanDerWaalsContact CG1-ND2 3.27Å; V172-N212 WeakPolarHBondContact CG1-ND2 3.47Å
173	S	95.4	Very high	94.5	Very high	36 Å²	36	38.1 Å²	38.1	25%	0.252	22%	0.218	S	C	.	.	H	α-helix	trans	-62.6	-40.5	175	-175.3	0	0	0	0	112.4	S169 Q170 A171 N176 K177	S169-S173 PolarHBondContact O-N 2.54Å; Q170-S173 PolarHBondContact O-N 3Å; A171-S173 PolarHBondContact O-N 2.93Å; S173-N176 PolarHBondContact O-N 3.08Å; S173-K177 WeakPolarHBondContact O-CG 3.46Å; S173-K177 PolarHBondContact O-N 3.27Å; S173-K177 VanDerWaalsContact O-N 3.1Å; S173-K177 PolarHBondContact OG-NZ 2.78Å
174	L	96.7	Very high	94.6	Very high	47 Å²	47	37.3 Å²	37.3	25%	0.246	21%	0.214	C	C	.	.	H	α-helix	trans	-68.2	-37.7	176.4	-70.8	170.9	0	0	0	111.7	V117 M122 Q170 A171 V172 N176 K177 S178	V117-L174 HydrophobicContact CG1-CD1 3.92Å; M122-L174 HydrophobicContact CB-CD1 4Å; M122-L174 HydrophobicContact CE-CB 3.99Å; M122-L174 HydrophobicContact CG-CD1 3.86Å; Q170-L174 HydrophobicContact CG-CD1 4.36Å; Q170-L174 WeakPolarHBondContact O-CG 3.48Å; Q170-L174 PolarHBondContact O-N 3.22Å; A171-L174 PolarHBondContact O-N 2.88Å; V172-L174 VanDerWaalsContact C-N 3.34Å; V172-L174 PolarHBondContact O-N 3.38Å; L174-N176 VanDerWaalsContact C-N 3.34Å; L174-N176 PolarHBondContact O-N 2.87Å; L174-K177 PolarHBondContact O-N 3.09Å; L174-S178 VanDerWaalsContact O-CB 3.24Å; L174-S178 WeakPolarHBondContact O-CB 3.31Å; L174-S178 PolarHBondContact O-N 2.97Å; L174-S178 PolarHBondContact O-OG 2.96Å
175	F	97.2	Very high	94.5	Very high	1 Å²	1	37.9 Å²	37.9	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-55.5	-49.7	173.1	178.3	-77.9	0	0	0	111.3	L161 A171 V172 G179 L180 L181 V184 V208 L215	L161-F175 HydrophobicContact CD1-CD2 4.19Å; L161-F175 HydrophobicContact CD2-CD2 3.91Å; L161-F175 HydrophobicContact CD2-CE2 3.86Å; L161-F175 HydrophobicContact CG-CD2 4.26Å; A171-F175 WeakPolarHBondContact O-CB 3.27Å; A171-F175 PolarHBondContact O-N 2.88Å; V172-F175 WeakPolarHBondContact O-CB 3.18Å; V172-F175 PolarHBondContact O-N 2.81Å; F175-G179 PolarHBondContact O-N 3.07Å; F175-L180 HydrophobicContact CB-CD1 4.35Å; F175-L180 HydrophobicContact CD1-CB 4.34Å; F175-L180 HydrophobicContact CD2-CB 3.52Å; F175-L180 HydrophobicContact CD2-CD1 3.8Å; F175-L180 HydrophobicContact CD2-CG 4.26Å; F175-L180 HydrophobicContact CE1-CB 4.31Å; F175-L180 HydrophobicContact CE2-CB 3.5Å; F175-L180 VanDerWaalsContact CE2-CB 3.5Å; F175-L180 HydrophobicContact CE2-CD1 4.45Å; F175-L180 HydrophobicContact CG-CB 3.94Å; F175-L180 HydrophobicContact CG-CD1 4.31Å; F175-L180 HydrophobicContact CZ-CB 3.9Å; F175-L180 PolarHBondContact O-N 2.95Å; F175-L181 HydrophobicContact CE1-CB 4.21Å; F175-L181 HydrophobicContact CZ-CB 4.44Å; F175-V184 HydrophobicContact CE2-CG2 3.88Å; F175-V184 HydrophobicContact CZ-CG2 4.22Å; F175-V208 HydrophobicContact CD1-CB 4.44Å; F175-V208 HydrophobicContact CD1-CG1 4.42Å; F175-V208 HydrophobicContact CD1-CG2 4.5Å; F175-V208 HydrophobicContact CD2-CG1 4.13Å; F175-V208 HydrophobicContact CE1-CB 4.32Å; F175-V208 HydrophobicContact CE1-CG2 3.9Å; F175-V208 HydrophobicContact CE2-CG1 4.21Å; F175-V208 HydrophobicContact CE2-CG2 4.38Å; F175-V208 HydrophobicContact CG-CG1 4.27Å; F175-V208 HydrophobicContact CZ-CG1 4.42Å; F175-V208 HydrophobicContact CZ-CG2 3.85Å; F175-L215 HydrophobicContact CD1-CD1 4.39Å; F175-L215 HydrophobicContact CE1-CD1 3.93Å; F175-L215 HydrophobicContact CE1-CD2 4.13Å
176	N	95.5	Very high	94.4	Very high	27 Å²	27	41.3 Å²	41.3	14%	0.144	23%	0.233	C	C	.	.	H	α-helix	trans	-60.3	-50.5	178.4	-67	-8.5	0	0	0	111	V172 S173 L174 S178 G179 N212 E214	V172-N176 PolarHBondContact O-N 2.98Å; V172-N176 VanDerWaalsContact O-N 3.08Å; V172-N176 PolarHBondContact O-OD1 2.73Å; S173-N176 PolarHBondContact O-N 3.08Å; L174-N176 VanDerWaalsContact C-N 3.34Å; L174-N176 PolarHBondContact O-N 2.87Å; N176-S178 VanDerWaalsContact C-N 3.35Å; N176-S178 PolarHBondContact O-N 3.22Å; N176-G179 PolarHBondContact O-N 2.91Å; N176-N212 PolarHBondContact ND2-OD1 3.06Å; N176-N212 VanDerWaalsContact ND2-OD1 3.15Å; N176-N212 PolarHBondContact OD1-ND2 3.29Å; N176-E214 HydrophobicContact CB-CG 4.4Å; N176-E214 PolarHBondContact ND2-OE2 3.09Å
177	K	94.4	Very high	94.6	Very high	147 Å²	147	38.5 Å²	38.5	64%	0.639	22%	0.22	S	C	*	.	H	α-helix	trans	-64.7	-35.7	-177.2	-73.3	168.5	-179.6	157.1	0	113.5	S173 L174 G179	S173-K177 WeakPolarHBondContact O-CG 3.46Å; S173-K177 PolarHBondContact O-N 3.27Å; S173-K177 VanDerWaalsContact O-N 3.1Å; S173-K177 PolarHBondContact OG-NZ 2.78Å; L174-K177 PolarHBondContact O-N 3.09Å; K177-G179 VanDerWaalsContact C-N 3.28Å; K177-G179 PolarHBondContact O-N 3.48Å
178	S	94.8	Very high	94.9	Very high	44 Å²	44	37.3 Å²	37.3	31%	0.308	21%	0.211	S	C	.	.	H	α-helix	trans	-81.3	-6	-178.6	-68.9	0	0	0	0	113.6	L174 N176	L174-S178 VanDerWaalsContact O-CB 3.24Å; L174-S178 WeakPolarHBondContact O-CB 3.31Å; L174-S178 PolarHBondContact O-N 2.97Å; L174-S178 PolarHBondContact O-OG 2.96Å; N176-S178 VanDerWaalsContact C-N 3.35Å; N176-S178 PolarHBondContact O-N 3.22Å
179	G	92.6	Very high	95.1	Very high	37 Å²	37	40.5 Å²	40.5	38%	0.381	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	36.5	-178.8	0	0	0	0	0	112.9	F175 N176 K177 L181 M183	F175-G179 PolarHBondContact O-N 3.07Å; N176-G179 PolarHBondContact O-N 2.91Å; K177-G179 VanDerWaalsContact C-N 3.28Å; K177-G179 PolarHBondContact O-N 3.48Å; G179-L181 PolarHBondContact O-N 3.13Å; G179-M183 WeakPolarHBondContact O-CE 3.37Å
180	L	95.7	Very high	95.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-70.2	-17.1	-175.5	-69.4	-176.5	0	0	0	114	M122 T126 L129 L161 F175 D182 M183 V184	M122-L180 HydrophobicContact CE-CD1 4.11Å; T126-L180 HydrophobicContact CG2-CD2 3.85Å; L129-L180 HydrophobicContact CD1-CD2 4.5Å; L161-L180 HydrophobicContact CD1-CD1 3.74Å; L161-L180 HydrophobicContact CD2-CD1 3.88Å; L161-L180 HydrophobicContact CG-CD1 4.49Å; F175-L180 HydrophobicContact CB-CD1 4.35Å; F175-L180 HydrophobicContact CD1-CB 4.34Å; F175-L180 HydrophobicContact CD2-CB 3.52Å; F175-L180 HydrophobicContact CD2-CD1 3.8Å; F175-L180 HydrophobicContact CD2-CG 4.26Å; F175-L180 HydrophobicContact CE1-CB 4.31Å; F175-L180 HydrophobicContact CE2-CB 3.5Å; F175-L180 VanDerWaalsContact CE2-CB 3.5Å; F175-L180 HydrophobicContact CE2-CD1 4.45Å; F175-L180 HydrophobicContact CG-CB 3.94Å; F175-L180 HydrophobicContact CG-CD1 4.31Å; F175-L180 HydrophobicContact CZ-CB 3.9Å; F175-L180 PolarHBondContact O-N 2.95Å; L180-D182 PolarHBondContact O-N 3.21Å; L180-M183 HydrophobicContact CD2-CE 3.71Å; L180-M183 HydrophobicContact CD2-SD 4.03Å; L180-M183 PolarHBondContact O-N 2.77Å; L180-V184 WeakPolarHBondContact O-CG2 3.45Å; L180-V184 PolarHBondContact O-N 2.92Å
181	L	94.8	Very high	95.1	Very high	11 Å²	11	35.6 Å²	35.6	6%	0.058	19%	0.187	C	C	.	.	H	α-helix	trans	-50.7	-53.4	-179.9	176.4	65.4	0	0	0	113.3	F175 G179 M183 V184 V185 L205 L215 M219 V223	F175-L181 HydrophobicContact CE1-CB 4.21Å; F175-L181 HydrophobicContact CZ-CB 4.44Å; G179-L181 PolarHBondContact O-N 3.13Å; L181-M183 VanDerWaalsContact C-N 3.26Å; L181-M183 PolarHBondContact O-N 3.22Å; L181-V184 PolarHBondContact O-N 3.46Å; L181-V185 HydrophobicContact CD1-CG2 4.17Å; L181-V185 HydrophobicContact CG-CG2 4.43Å; L181-V185 WeakPolarHBondContact O-CG2 3.43Å; L181-V185 PolarHBondContact O-N 3.11Å; L181-L205 HydrophobicContact CD1-CD2 3.73Å; L181-L215 HydrophobicContact CB-CD1 4.17Å; L181-L215 HydrophobicContact CD1-CD1 4.35Å; L181-L215 HydrophobicContact CD2-CD1 4.13Å; L181-L215 HydrophobicContact CG-CD1 4.45Å; L181-M219 HydrophobicContact CD1-CE 3.7Å; L181-M219 HydrophobicContact CD1-SD 4.48Å; L181-M219 HydrophobicContact CD2-CE 3.14Å; L181-M219 HydrophobicContact CD2-SD 4.16Å; L181-M219 HydrophobicContact CG-CE 4.03Å; L181-V223 HydrophobicContact CD2-CG2 4.08Å; L181-V223 HydrophobicContact CG-CG2 4.23Å
182	D	92.3	Very high	94.7	Very high	83 Å²	83	38.5 Å²	38.5	44%	0.444	21%	0.206	S	C	.	.	H	α-helix	trans	-65.2	-33.2	-175.2	-66.2	-40.3	0	0	0	111.6	L180 Q186	L180-D182 PolarHBondContact O-N 3.21Å; D182-Q186 WeakPolarHBondContact O-CG 3.22Å; D182-Q186 PolarHBondContact O-N 3.29Å
183	M	94.6	Very high	94.3	Very high	19 Å²	19	44.7 Å²	44.7	9%	0.094	23%	0.232	C	C	.	.	H	α-helix	trans	-67.6	-45.4	175.4	-75.7	168.3	-97.7	0	0	111.1	L129 R130 C133 G179 L180 L181 V185 Q186 C187	L129-M183 HydrophobicContact CB-SD 4.36Å; R130-M183 HydrophobicContact CB-SD 4Å; C133-M183 HydrophobicContact CB-CG 4.4Å; G179-M183 WeakPolarHBondContact O-CE 3.37Å; L180-M183 HydrophobicContact CD2-CE 3.71Å; L180-M183 HydrophobicContact CD2-SD 4.03Å; L180-M183 PolarHBondContact O-N 2.77Å; L181-M183 VanDerWaalsContact C-N 3.26Å; L181-M183 PolarHBondContact O-N 3.22Å; M183-V185 VanDerWaalsContact C-N 3.31Å; M183-V185 PolarHBondContact O-N 3.12Å; M183-Q186 WeakPolarHBondContact O-CB 3.32Å; M183-Q186 PolarHBondContact O-N 3Å; M183-C187 PolarHBondContact O-N 3.32Å; M183-C187 VanDerWaalsContact O-N 3.11Å; M183-C187 PolarHBondContact O-SG 2.64Å
184	V	96.8	Very high	94	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-65.5	-36	177.1	-177.7	0	0	0	0	111.3	L161 F175 L180 L181 C187 L188 A201 C204 L205	L161-V184 HydrophobicContact CD2-CG2 4.02Å; F175-V184 HydrophobicContact CE2-CG2 3.88Å; F175-V184 HydrophobicContact CZ-CG2 4.22Å; L180-V184 WeakPolarHBondContact O-CG2 3.45Å; L180-V184 PolarHBondContact O-N 2.92Å; L181-V184 PolarHBondContact O-N 3.46Å; V184-C187 WeakPolarHBondContact O-CB 3.32Å; V184-C187 PolarHBondContact O-N 3.47Å; V184-L188 PolarHBondContact O-N 2.52Å; V184-A201 HydrophobicContact CG1-CB 3.84Å; V184-A201 WeakPolarHBondContact CG1-O 3.36Å; V184-C204 HydrophobicContact CG1-CB 4.17Å; V184-L205 HydrophobicContact CB-CD2 4.24Å; V184-L205 HydrophobicContact CB-CG 4.48Å; V184-L205 HydrophobicContact CG1-CD1 4.18Å; V184-L205 HydrophobicContact CG1-CD2 3.9Å; V184-L205 HydrophobicContact CG1-CG 3.63Å
185	V	95.8	Very high	93.9	Very high	11 Å²	11	43.3 Å²	43.3	7%	0.067	22%	0.224	C	C	.	.	H	α-helix	trans	-64.2	-39.2	173.8	174.6	0	0	0	0	111.5	L181 M183 C187 L188 E189 L205 V223 A226	L181-V185 HydrophobicContact CD1-CG2 4.17Å; L181-V185 HydrophobicContact CG-CG2 4.43Å; L181-V185 WeakPolarHBondContact O-CG2 3.43Å; L181-V185 PolarHBondContact O-N 3.11Å; M183-V185 VanDerWaalsContact C-N 3.31Å; M183-V185 PolarHBondContact O-N 3.12Å; V185-C187 VanDerWaalsContact C-N 3.3Å; V185-C187 PolarHBondContact O-N 2.72Å; V185-L188 WeakPolarHBondContact O-CB 3.39Å; V185-L188 PolarHBondContact O-N 2.77Å; V185-L188 VanDerWaalsContact O-N 3.16Å; V185-E189 PolarHBondContact O-N 2.97Å; V185-L205 HydrophobicContact CG2-CD1 4.42Å; V185-L205 HydrophobicContact CG2-CD2 4.38Å; V185-V223 HydrophobicContact CG2-CB 4.41Å; V185-V223 HydrophobicContact CG2-CG1 4.04Å; V185-V223 HydrophobicContact CG2-CG2 3.88Å; V185-A226 HydrophobicContact CG1-CB 3.63Å
186	Q	94.6	Very high	93.6	Very high	79 Å²	79	47.1 Å²	47.1	37%	0.369	24%	0.241	S	C	.	.	H	α-helix	trans	-62.2	-37.3	173.6	-73.9	172.8	44.5	0	0	112.3	D182 M183 E189	D182-Q186 WeakPolarHBondContact O-CG 3.22Å; D182-Q186 PolarHBondContact O-N 3.29Å; M183-Q186 WeakPolarHBondContact O-CB 3.32Å; M183-Q186 PolarHBondContact O-N 3Å; Q186-E189 PolarHBondContact O-N 3.38Å
187	C	96.1	Very high	93.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65	-41	172.4	-64.6	0	0	0	0	111.9	V158 M183 V184 V185 E189 R190 L197 S198 A201	V158-C187 HydrophobicContact CG2-CB 4.36Å; M183-C187 PolarHBondContact O-N 3.32Å; M183-C187 VanDerWaalsContact O-N 3.11Å; M183-C187 PolarHBondContact O-SG 2.64Å; V184-C187 WeakPolarHBondContact O-CB 3.32Å; V184-C187 PolarHBondContact O-N 3.47Å; V185-C187 VanDerWaalsContact C-N 3.3Å; V185-C187 PolarHBondContact O-N 2.72Å; C187-E189 VanDerWaalsContact C-N 3.3Å; C187-E189 PolarHBondContact O-N 3.49Å; C187-R190 WeakPolarHBondContact O-CB 3.47Å; C187-R190 WeakPolarHBondContact O-CG 3.32Å; C187-R190 PolarHBondContact O-N 3Å; C187-L197 HydrophobicContact CB-CD1 3.93Å; C187-L197 HydrophobicContact CB-CD2 4.39Å; C187-L197 HydrophobicContact CB-CG 4.01Å; C187-S198 PolarHBondContact O-OG 3.08Å; C187-A201 HydrophobicContact CB-CB 3.79Å
188	L	96.8	Very high	93.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.8	-38	175.6	-179	74.3	0	0	0	112.3	V184 V185 R190 Y191 S198 A201 A202 L205 L227 V230 L243	V184-L188 PolarHBondContact O-N 2.52Å; V185-L188 WeakPolarHBondContact O-CB 3.39Å; V185-L188 PolarHBondContact O-N 2.77Å; V185-L188 VanDerWaalsContact O-N 3.16Å; L188-R190 PolarHBondContact O-N 3.37Å; L188-R190 VanDerWaalsContact O-N 3.13Å; L188-Y191 PolarHBondContact O-N 3.48Å; L188-S198 PolarHBondContact O-OG 3.21Å; L188-A201 HydrophobicContact CB-CB 4.1Å; L188-A202 HydrophobicContact CD1-CB 3.8Å; L188-L205 HydrophobicContact CB-CD1 4.38Å; L188-L205 HydrophobicContact CD2-CD1 3.87Å; L188-L227 HydrophobicContact CD2-CD2 3.86Å; L188-L227 HydrophobicContact CD2-CG 4.49Å; L188-V230 HydrophobicContact CD1-CG2 4.26Å; L188-V230 HydrophobicContact CD2-CG2 4.19Å; L188-V230 HydrophobicContact CG-CG2 4.02Å; L188-L243 HydrophobicContact CD1-CD1 3.76Å
189	E	94.6	Very high	93.7	Very high	77 Å²	77	37.7 Å²	37.7	36%	0.36	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-4.6	-179.2	-71.8	-167.8	126.2	0	0	113.8	V185 Q186 C187 Y191 P192 A226 K229	V185-E189 PolarHBondContact O-N 2.97Å; Q186-E189 PolarHBondContact O-N 3.38Å; C187-E189 VanDerWaalsContact C-N 3.3Å; C187-E189 PolarHBondContact O-N 3.49Å; E189-Y191 PolarHBondContact O-N 3.11Å; E189-P192 WeakPolarHBondContact O-CD 3.17Å; E189-A226 HydrophobicContact CG-CB 3.96Å; E189-K229 IonicContact OE1-NZ 2.97Å; E189-K229 PolarHBondContact OE1-NZ 3.02Å
190	R	92.9	Very high	93.9	Very high	57 Å²	57	36.2 Å²	36.2	22%	0.215	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-2.5	176.6	-55.1	-55.6	-64.4	168.1	-2	114	F136 E151 C187 L188 P192 H193 N194 L197 S198	F136-R190 HydrophobicContact CE2-CG 4.45Å; E151-R190 IonicContact OE1-CZ 2.7Å; E151-R190 VanDerWaalsContact OE1-CZ 3.24Å; E151-R190 IonicContact OE1-NE 2.87Å; E151-R190 PolarHBondContact OE1-NE 3.46Å; E151-R190 IonicContact OE1-NH2 2.72Å; E151-R190 PolarHBondContact OE1-NH2 3.28Å; C187-R190 WeakPolarHBondContact O-CB 3.47Å; C187-R190 WeakPolarHBondContact O-CG 3.32Å; C187-R190 PolarHBondContact O-N 3Å; L188-R190 PolarHBondContact O-N 3.37Å; L188-R190 VanDerWaalsContact O-N 3.13Å; R190-P192 VanDerWaalsContact C-N 3.3Å; R190-P192 VanDerWaalsContact O-CD 3.31Å; R190-P192 WeakPolarHBondContact O-CD 3.26Å; R190-H193 PolarHBondContact O-N 3.11Å; R190-N194 HydrophobicContact CB-CB 4.34Å; R190-N194 PolarHBondContact O-N 3.2Å; R190-L197 HydrophobicContact CB-CD2 4.26Å; R190-L197 HydrophobicContact CG-CD2 3.93Å; R190-S198 VanDerWaalsContact C-OG 3.32Å
191	Y	92.6	Very high	94	Very high	42 Å²	42	36.2 Å²	36.2	17%	0.165	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-27.5	-171.5	77.4	-88.4	0	0	0	116.9	L188 E189 H193 S198 V230 H240 L243	L188-Y191 PolarHBondContact O-N 3.48Å; E189-Y191 PolarHBondContact O-N 3.11Å; Y191-H193 PolarHBondContact O-N 2.93Å; Y191-S198 WeakPolarHBondContact CA-OG 3.35Å; Y191-S198 WeakPolarHBondContact CB-OG 3.36Å; Y191-S198 PolarHBondContact N-OG 3.47Å; Y191-V230 HydrophobicContact CD1-CG2 3.93Å; Y191-V230 HydrophobicContact CE1-CG2 4.13Å; Y191-H240 PolarHBondContact O-CE1 3.14Å; Y191-L243 VanDerWaalsContact CB-CD2 3.43Å; Y191-L243 HydrophobicContact CD2-CD2 4.48Å; Y191-L243 HydrophobicContact CG-CD2 4.1Å
192	P	89.3	Confident	94.2	Very high	61 Å²	61	35.8 Å²	35.8	40%	0.396	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-18.8	176.9	-21.2	35.5	0	0	0	114.1	E189 R190	E189-P192 WeakPolarHBondContact O-CD 3.17Å; R190-P192 VanDerWaalsContact C-N 3.3Å; R190-P192 VanDerWaalsContact O-CD 3.31Å; R190-P192 WeakPolarHBondContact O-CD 3.26Å
193	H	86.4	Confident	94.4	Very high	158 Å²	158	32.4 Å²	32.4	73%	0.731	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-128	-26.2	-173.2	-51.6	-46.4	0	0	0	112.7	R190 Y191	R190-H193 PolarHBondContact O-N 3.11Å; Y191-H193 PolarHBondContact O-N 2.93Å
194	N	90.4	Very high	94.6	Very high	25 Å²	25	31.5 Å²	31.5	13%	0.134	15%	0.153	C	C	.	.			trans	-142.4	86	178.8	-169.1	-23.5	0	0	0	109.9	E151 R190 E196 L197 S198	E151-N194 WeakPolarHBondContact OE2-CB 3.48Å; E151-N194 PolarHBondContact OE2-ND2 2.98Å; R190-N194 HydrophobicContact CB-CB 4.34Å; R190-N194 PolarHBondContact O-N 3.2Å; N194-E196 VanDerWaalsContact C-N 3.28Å; N194-E196 PolarHBondContact O-N 3.2Å; N194-E196 PolarHBondContact OD1-N 3.33Å; N194-L197 HydrophobicContact CB-CB 4.42Å; N194-L197 WeakPolarHBondContact OD1-CB 3.38Å; N194-L197 PolarHBondContact OD1-N 3.04Å; N194-S198 PolarHBondContact O-N 3.44Å; N194-S198 PolarHBondContact O-OG 3.39Å
195	V	92.9	Very high	94.6	Very high	30 Å²	30	31.6 Å²	31.6	18%	0.182	15%	0.154	C	C	.	.	H	α-helix	trans	-67.4	-31.1	179.7	69.4	0	0	0	0	111.7	S198 I199 A239 L243	V195-S198 CarbonylContact O-C 3.59Å; V195-S198 WeakPolarHBondContact O-CB 3.44Å; V195-S198 PolarHBondContact O-N 2.9Å; V195-I199 HydrophobicContact CG2-CD1 3.95Å; V195-I199 HydrophobicContact CG2-CG1 4.27Å; V195-I199 VanDerWaalsContact O-CG1 3.3Å; V195-I199 WeakPolarHBondContact O-CG1 3.46Å; V195-I199 PolarHBondContact O-N 3.1Å; V195-A239 HydrophobicContact CG1-CB 4.2Å; V195-A239 HydrophobicContact CG2-CB 4.15Å; V195-L243 HydrophobicContact CG2-CD2 4.27Å
196	E	91.5	Very high	94.6	Very high	80 Å²	80	31.7 Å²	31.7	37%	0.374	15%	0.153	S	C	.	.	H	α-helix	trans	-64.7	-51.9	-177.9	-56.8	-175.1	-169	0	0	111.8	N194 S198 I199 S200 R353	N194-E196 VanDerWaalsContact C-N 3.28Å; N194-E196 PolarHBondContact O-N 3.2Å; N194-E196 PolarHBondContact OD1-N 3.33Å; E196-S198 PolarHBondContact O-N 3.48Å; E196-I199 PolarHBondContact O-N 3.29Å; E196-I199 VanDerWaalsContact O-N 3.13Å; E196-S200 PolarHBondContact O-N 3.29Å; E196-S200 PolarHBondContact O-OG 2.88Å; E196-S200 VanDerWaalsContact O-OG 3.08Å; E196-R353 VanDerWaalsContact CD-NH1 3.3Å; E196-R353 IonicContact OE1-CZ 2.58Å; E196-R353 VanDerWaalsContact OE1-CZ 3.27Å; E196-R353 IonicContact OE1-NH1 3.66Å; E196-R353 PolarHBondContact OE1-NH1 2.62Å; E196-R353 IonicContact OE1-NH2 3.29Å; E196-R353 PolarHBondContact OE1-NH2 3.27Å; E196-R353 VanDerWaalsContact OE1-NH2 3.14Å; E196-R353 IonicContact OE2-CZ 3.71Å; E196-R353 IonicContact OE2-NH1 3.44Å; E196-R353 PolarHBondContact OE2-NH1 3.02Å; E196-R353 IonicContact OE2-NH2 2.87Å; E196-R353 PolarHBondContact OE2-NH2 2.66Å
197	L	94.4	Very high	94.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-56.7	-37.7	174	174.4	59.2	0	0	0	111.6	F136 E151 A154 N155 V158 C187 R190 N194 S200 A201	F136-L197 HydrophobicContact CE1-CD2 4.49Å; F136-L197 HydrophobicContact CZ-CD2 3.98Å; E151-L197 HydrophobicContact CB-CD2 4.19Å; E151-L197 HydrophobicContact CG-CD2 4.17Å; A154-L197 HydrophobicContact CB-CD1 4.01Å; A154-L197 HydrophobicContact CB-CD2 4.31Å; N155-L197 HydrophobicContact CB-CD1 4.12Å; N155-L197 WeakPolarHBondContact OD1-CA 3.42Å; V158-L197 HydrophobicContact CG2-CD1 4.33Å; C187-L197 HydrophobicContact CB-CD1 3.93Å; C187-L197 HydrophobicContact CB-CD2 4.39Å; C187-L197 HydrophobicContact CB-CG 4.01Å; R190-L197 HydrophobicContact CB-CD2 4.26Å; R190-L197 HydrophobicContact CG-CD2 3.93Å; N194-L197 HydrophobicContact CB-CB 4.42Å; N194-L197 WeakPolarHBondContact OD1-CB 3.38Å; N194-L197 PolarHBondContact OD1-N 3.04Å; L197-S200 PolarHBondContact O-N 3.48Å; L197-A201 WeakPolarHBondContact O-CB 3.3Å; L197-A201 PolarHBondContact O-N 2.96Å
198	S	96.9	Very high	94.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-71.8	-35.5	-179.3	-54.3	0	0	0	0	112.4	C187 L188 R190 Y191 N194 V195 E196 A201 A202 L243	C187-S198 PolarHBondContact O-OG 3.08Å; L188-S198 PolarHBondContact O-OG 3.21Å; R190-S198 VanDerWaalsContact C-OG 3.32Å; Y191-S198 WeakPolarHBondContact CA-OG 3.35Å; Y191-S198 WeakPolarHBondContact CB-OG 3.36Å; Y191-S198 PolarHBondContact N-OG 3.47Å; N194-S198 PolarHBondContact O-N 3.44Å; N194-S198 PolarHBondContact O-OG 3.39Å; V195-S198 CarbonylContact O-C 3.59Å; V195-S198 WeakPolarHBondContact O-CB 3.44Å; V195-S198 PolarHBondContact O-N 2.9Å; E196-S198 PolarHBondContact O-N 3.48Å; S198-A201 PolarHBondContact O-N 3.34Å; S198-A202 VanDerWaalsContact O-CB 3.29Å; S198-A202 WeakPolarHBondContact O-CB 3.38Å; S198-A202 PolarHBondContact O-N 3.41Å; S198-L243 WeakPolarHBondContact O-CD1 3.2Å
199	I	96.4	Very high	94.4	Very high	21 Å²	21	28.7 Å²	28.7	11%	0.108	14%	0.14	C	C	.	.	H	α-helix	trans	-65.1	-48.4	173.1	-73.8	166	0	0	0	109.7	V195 E196 A201 A202 H203 A239 L242 L243 L246	V195-I199 HydrophobicContact CG2-CD1 3.95Å; V195-I199 HydrophobicContact CG2-CG1 4.27Å; V195-I199 VanDerWaalsContact O-CG1 3.3Å; V195-I199 WeakPolarHBondContact O-CG1 3.46Å; V195-I199 PolarHBondContact O-N 3.1Å; E196-I199 PolarHBondContact O-N 3.29Å; E196-I199 VanDerWaalsContact O-N 3.13Å; I199-A201 VanDerWaalsContact C-N 3.27Å; I199-A201 PolarHBondContact O-N 3.37Å; I199-A202 PolarHBondContact O-N 2.87Å; I199-H203 VanDerWaalsContact CG2-CD2 3.49Å; I199-H203 WeakPolarHBondContact CG2-CD2 3.32Å; I199-H203 PolarHBondContact O-CD2 3.48Å; I199-H203 VanDerWaalsContact O-CD2 3.28Å; I199-H203 PolarHBondContact O-N 3.17Å; I199-A239 HydrophobicContact CD1-CB 3.84Å; I199-A239 WeakPolarHBondContact CD1-O 3.26Å; I199-L242 HydrophobicContact CG2-CD2 3.98Å; I199-L242 HydrophobicContact CG2-CG 4.48Å; I199-L243 HydrophobicContact CG1-CB 3.99Å; I199-L243 HydrophobicContact CG1-CD1 4.46Å; I199-L246 HydrophobicContact CG2-CD1 4.3Å
200	S	96.4	Very high	94.3	Very high	6 Å²	6	25.9 Å²	25.9	4%	0.042	13%	0.127	C	C	.	.	H	α-helix	trans	-54.9	-44.9	174.9	-53.4	0	0	0	0	111.2	N155 V158 N159 E196 L197 H203 C204	N155-S200 PolarHBondContact OD1-OG 2.94Å; V158-S200 VanDerWaalsContact CG1-C 3.45Å; V158-S200 WeakPolarHBondContact CG1-O 3.41Å; N159-S200 PolarHBondContact ND2-OG 3.49Å; N159-S200 WeakPolarHBondContact OD1-CB 3.42Å; N159-S200 PolarHBondContact OD1-OG 2.78Å; E196-S200 PolarHBondContact O-N 3.29Å; E196-S200 PolarHBondContact O-OG 2.88Å; E196-S200 VanDerWaalsContact O-OG 3.08Å; L197-S200 PolarHBondContact O-N 3.48Å; S200-H203 PolarHBondContact O-N 3.46Å; S200-C204 PolarHBondContact O-N 3.42Å
201	A	98.2	Very high	94	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.3	-42.1	175.7	0	0	0	0	0	112.6	V158 V184 C187 L188 L197 S198 I199 C204 L205	V158-A201 HydrophobicContact CG1-CB 4.32Å; V184-A201 HydrophobicContact CG1-CB 3.84Å; V184-A201 WeakPolarHBondContact CG1-O 3.36Å; C187-A201 HydrophobicContact CB-CB 3.79Å; L188-A201 HydrophobicContact CB-CB 4.1Å; L197-A201 WeakPolarHBondContact O-CB 3.3Å; L197-A201 PolarHBondContact O-N 2.96Å; S198-A201 PolarHBondContact O-N 3.34Å; I199-A201 VanDerWaalsContact C-N 3.27Å; I199-A201 PolarHBondContact O-N 3.37Å; A201-C204 PolarHBondContact O-N 3.03Å; A201-L205 WeakPolarHBondContact O-CB 3.34Å; A201-L205 VanDerWaalsContact O-CG 3.3Å; A201-L205 WeakPolarHBondContact O-CG 3.21Å; A201-L205 PolarHBondContact O-N 2.92Å
202	A	98.1	Very high	94	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.008	13%	0.133	C	C	.	.	H	α-helix	trans	-67.4	-37.5	178.4	0	0	0	0	0	112.3	L188 S198 I199 L205 H206 L243 L246	L188-A202 HydrophobicContact CD1-CB 3.8Å; S198-A202 VanDerWaalsContact O-CB 3.29Å; S198-A202 WeakPolarHBondContact O-CB 3.38Å; S198-A202 PolarHBondContact O-N 3.41Å; I199-A202 PolarHBondContact O-N 2.87Å; A202-L205 PolarHBondContact O-N 3.43Å; A202-H206 VanDerWaalsContact O-CB 3.27Å; A202-H206 WeakPolarHBondContact O-CB 3.31Å; A202-H206 PolarHBondContact O-N 2.98Å; A202-L243 HydrophobicContact CB-CD1 3.73Å; A202-L246 HydrophobicContact CB-CB 3.59Å; A202-L246 HydrophobicContact CB-CD1 3.89Å; A202-L246 HydrophobicContact CB-CG 4.39Å
203	H	97.1	Very high	94	Very high	13 Å²	13	27 Å²	27	6%	0.06	14%	0.141	C	C	.	.	H	α-helix	trans	-61.2	-48.4	171.2	-84.9	-74.9	0	0	0	111.3	W162 I199 S200 L205 H206 T207 L246	W162-H203 HydrophobicContact CD2-CB 3.6Å; W162-H203 HydrophobicContact CE3-CB 3.57Å; W162-H203 HydrophobicContact CG-CB 4.34Å; W162-H203 HydrophobicContact CH2-CB 3.75Å; W162-H203 AromaticContact CH2-CD2 3.95Å; W162-H203 AromaticContact CH2-CE1 3.81Å; W162-H203 AromaticContact CH2-CG 3.45Å; W162-H203 VanDerWaalsContact CH2-CG 3.45Å; W162-H203 AromaticContact CH2-ND1 3.34Å; W162-H203 VanDerWaalsContact CH2-ND1 3.34Å; W162-H203 WeakPolarHBondContact CH2-ND1 3.26Å; W162-H203 HydrophobicContact CZ2-CB 3.79Å; W162-H203 AromaticContact CZ2-CG 3.77Å; W162-H203 AromaticContact CZ2-ND1 3.46Å; W162-H203 WeakPolarHBondContact CZ2-ND1 3.39Å; W162-H203 HydrophobicContact CZ3-CB 3.64Å; W162-H203 AromaticContact CZ3-CD2 3.93Å; W162-H203 AromaticContact CZ3-CG 3.63Å; I199-H203 VanDerWaalsContact CG2-CD2 3.49Å; I199-H203 WeakPolarHBondContact CG2-CD2 3.32Å; I199-H203 PolarHBondContact O-CD2 3.48Å; I199-H203 VanDerWaalsContact O-CD2 3.28Å; I199-H203 PolarHBondContact O-N 3.17Å; S200-H203 PolarHBondContact O-N 3.46Å; H203-L205 PolarHBondContact O-N 2.91Å; H203-H206 PolarHBondContact O-N 3.4Å; H203-T207 WeakPolarHBondContact O-CB 3.46Å; H203-T207 PolarHBondContact O-N 3.47Å; H203-T207 PolarHBondContact O-OG1 3.5Å; H203-L246 VanDerWaalsContact CD2-CD1 3.47Å; H203-L246 WeakPolarHBondContact CD2-CD1 3.36Å; H203-L246 WeakPolarHBondContact NE2-CD1 3.15Å
204	C	97.7	Very high	94.2	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-57.4	-50.3	175.8	-171.7	0	0	0	0	111.1	V158 W162 V184 S200 A201 T207 V208	V158-C204 HydrophobicContact CG1-CB 4.17Å; W162-C204 HydrophobicContact CB-CB 3.99Å; V184-C204 HydrophobicContact CG1-CB 4.17Å; S200-C204 PolarHBondContact O-N 3.42Å; A201-C204 PolarHBondContact O-N 3.03Å; C204-T207 WeakPolarHBondContact O-CB 3.23Å; C204-T207 PolarHBondContact O-N 3.4Å; C204-V208 WeakPolarHBondContact O-CG2 3.43Å; C204-V208 PolarHBondContact O-N 3.34Å
205	L	97.1	Very high	94.3	Very high	3 Å²	3	22.3 Å²	22.3	2%	0.016	12%	0.119	C	C	.	.	H	α-helix	trans	-60.8	-46	179.8	-73.7	171.7	0	0	0	112.6	L181 V184 V185 L188 A201 A202 H203 T207 V208 T209 T250	L181-L205 HydrophobicContact CD1-CD2 3.73Å; V184-L205 HydrophobicContact CB-CD2 4.24Å; V184-L205 HydrophobicContact CB-CG 4.48Å; V184-L205 HydrophobicContact CG1-CD1 4.18Å; V184-L205 HydrophobicContact CG1-CD2 3.9Å; V184-L205 HydrophobicContact CG1-CG 3.63Å; V185-L205 HydrophobicContact CG2-CD1 4.42Å; V185-L205 HydrophobicContact CG2-CD2 4.38Å; L188-L205 HydrophobicContact CB-CD1 4.38Å; L188-L205 HydrophobicContact CD2-CD1 3.87Å; A201-L205 WeakPolarHBondContact O-CB 3.34Å; A201-L205 VanDerWaalsContact O-CG 3.3Å; A201-L205 WeakPolarHBondContact O-CG 3.21Å; A201-L205 PolarHBondContact O-N 2.92Å; A202-L205 PolarHBondContact O-N 3.43Å; H203-L205 PolarHBondContact O-N 2.91Å; L205-T207 PolarHBondContact O-N 3.41Å; L205-V208 PolarHBondContact O-N 3.45Å; L205-T209 WeakPolarHBondContact O-CB 3.28Å; L205-T209 VanDerWaalsContact O-CG2 3.25Å; L205-T209 WeakPolarHBondContact O-CG2 3.37Å; L205-T209 PolarHBondContact O-N 2.88Å; L205-T209 VanDerWaalsContact O-N 3.07Å; L205-T209 PolarHBondContact O-OG1 3.32Å; L205-T250 HydrophobicContact CB-CG2 4.1Å
206	H	95.8	Very high	94	Very high	13 Å²	13	22.3 Å²	22.3	6%	0.06	12%	0.118	C	C	.	.	H	α-helix	trans	-59.9	-38.5	178.2	-173.2	-162.1	0	0	0	110.8	R11 A202 H203 T209 L246 T250 N253	R11-H206 PolarHBondContact NH2-ND1 3.48Å; R11-H206 VanDerWaalsContact NH2-ND1 3.12Å; A202-H206 VanDerWaalsContact O-CB 3.27Å; A202-H206 WeakPolarHBondContact O-CB 3.31Å; A202-H206 PolarHBondContact O-N 2.98Å; H203-H206 PolarHBondContact O-N 3.4Å; H206-T209 PolarHBondContact O-OG1 2.94Å; H206-L246 HydrophobicContact CB-CD2 4.43Å; H206-T250 WeakPolarHBondContact CA-OG1 3.24Å; H206-T250 PolarHBondContact N-OG1 2.99Å; H206-N253 PolarHBondContact CD2-ND2 2.9Å; H206-N253 PolarHBondContact O-ND2 3.32Å
207	T	94.6	Very high	93.7	Very high	12 Å²	12	27.6 Å²	27.6	7%	0.074	14%	0.135	C	C	.	.	H	α-helix	trans	-67.5	-55	176.8	-49.7	0	0	0	0	112.2	R11 W162 E166 H203 C204 L205 T209 E210	R11-T207 VanDerWaalsContact CZ-OG1 3.31Å; R11-T207 PolarHBondContact NH1-OG1 3.49Å; W162-T207 VanDerWaalsContact CD1-OG1 3.22Å; W162-T207 PolarHBondContact NE1-OG1 3.32Å; W162-T207 VanDerWaalsContact NE1-OG1 3.11Å; E166-T207 HydrophobicContact CB-CG2 3.88Å; E166-T207 HydrophobicContact CG-CG2 4.32Å; H203-T207 WeakPolarHBondContact O-CB 3.46Å; H203-T207 PolarHBondContact O-N 3.47Å; H203-T207 PolarHBondContact O-OG1 3.5Å; C204-T207 WeakPolarHBondContact O-CB 3.23Å; C204-T207 PolarHBondContact O-N 3.4Å; L205-T207 PolarHBondContact O-N 3.41Å; T207-T209 PolarHBondContact O-N 3.01Å; T207-E210 WeakPolarHBondContact O-CB 3.27Å; T207-E210 PolarHBondContact O-N 2.88Å
208	V	95.4	Very high	93	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.006	16%	0.156	C	C	.	.	H	α-helix	trans	-72	-17.6	-172.7	-61.6	0	0	0	0	113.2	C165 F175 C204 L205 N212 L215	C165-V208 HydrophobicContact CB-CG1 3.72Å; F175-V208 HydrophobicContact CD1-CB 4.44Å; F175-V208 HydrophobicContact CD1-CG1 4.42Å; F175-V208 HydrophobicContact CD1-CG2 4.5Å; F175-V208 HydrophobicContact CD2-CG1 4.13Å; F175-V208 HydrophobicContact CE1-CB 4.32Å; F175-V208 HydrophobicContact CE1-CG2 3.9Å; F175-V208 HydrophobicContact CE2-CG1 4.21Å; F175-V208 HydrophobicContact CE2-CG2 4.38Å; F175-V208 HydrophobicContact CG-CG1 4.27Å; F175-V208 HydrophobicContact CZ-CG1 4.42Å; F175-V208 HydrophobicContact CZ-CG2 3.85Å; C204-V208 WeakPolarHBondContact O-CG2 3.43Å; C204-V208 PolarHBondContact O-N 3.34Å; L205-V208 PolarHBondContact O-N 3.45Å; V208-N212 WeakPolarHBondContact O-CB 3.33Å; V208-N212 PolarHBondContact O-ND2 3.27Å; V208-L215 HydrophobicContact CB-CD2 3.92Å; V208-L215 HydrophobicContact CG2-CD2 3.56Å; V208-L215 VanDerWaalsContact O-CD2 3.25Å; V208-L215 WeakPolarHBondContact O-CD2 3.48Å
209	T	94.5	Very high	92.4	Very high	2 Å²	2	32 Å²	32	1%	0.012	16%	0.163	C	C	.	.	H	α-helix	trans	-85.6	-14.4	175.5	55.2	0	0	0	0	113.5	L205 H206 T207 D211 L215 T250 N253	L205-T209 WeakPolarHBondContact O-CB 3.28Å; L205-T209 VanDerWaalsContact O-CG2 3.25Å; L205-T209 WeakPolarHBondContact O-CG2 3.37Å; L205-T209 PolarHBondContact O-N 2.88Å; L205-T209 VanDerWaalsContact O-N 3.07Å; L205-T209 PolarHBondContact O-OG1 3.32Å; H206-T209 PolarHBondContact O-OG1 2.94Å; T207-T209 PolarHBondContact O-N 3.01Å; T209-D211 PolarHBondContact O-N 3.3Å; T209-L215 HydrophobicContact CG2-CD2 4.02Å; T209-T250 HydrophobicContact CG2-CG2 3.95Å; T209-N253 PolarHBondContact OG1-ND2 3.19Å
210	E	91.1	Very high	91.8	Very high	19 Å²	19	34.1 Å²	34.1	9%	0.089	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	121.9	178.9	-168.2	179	166.8	0	0	110.5	K10 R11 T207 N212 N253	K10-E210 VanDerWaalsContact CA-OE1 3.24Å; K10-E210 WeakPolarHBondContact CA-OE1 3.41Å; R11-E210 VanDerWaalsContact CD-OE2 3.26Å; R11-E210 WeakPolarHBondContact CD-OE2 3.3Å; R11-E210 WeakPolarHBondContact CG-OE2 3.44Å; R11-E210 PolarHBondContact N-OE1 2.74Å; R11-E210 IonicContact NE-OE2 3.21Å; T207-E210 WeakPolarHBondContact O-CB 3.27Å; T207-E210 PolarHBondContact O-N 2.88Å; E210-N212 PolarHBondContact O-N 2.87Å; E210-N212 VanDerWaalsContact O-N 3.09Å; E210-N253 PolarHBondContact N-ND2 3.23Å
211	D	87.6	Confident	91.3	Very high	82 Å²	82	37.9 Å²	37.9	44%	0.439	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	33.1	179.4	-70.7	-19	0	0	0	114.9	K10 T209 P213	K10-D211 WeakPolarHBondContact CE-OD2 3.2Å; K10-D211 IonicContact NZ-OD2 3.72Å; K10-D211 PolarHBondContact NZ-OD2 3.4Å; T209-D211 PolarHBondContact O-N 3.3Å; D211-P213 VanDerWaalsContact O-CD 3.24Å; D211-P213 WeakPolarHBondContact O-CD 3.46Å
212	N	92	Very high	90.9	Very high	13 Å²	13	41.3 Å²	41.3	7%	0.07	23%	0.234	C	C	.	.			trans	-116.1	80.6	-176.9	-172.1	-9.5	0	0	0	113.2	V172 N176 V208 E210 E214 L215 L216	V172-N212 VanDerWaalsContact CG1-ND2 3.27Å; V172-N212 WeakPolarHBondContact CG1-ND2 3.47Å; N176-N212 PolarHBondContact ND2-OD1 3.06Å; N176-N212 VanDerWaalsContact ND2-OD1 3.15Å; N176-N212 PolarHBondContact OD1-ND2 3.29Å; V208-N212 WeakPolarHBondContact O-CB 3.33Å; V208-N212 PolarHBondContact O-ND2 3.27Å; E210-N212 PolarHBondContact O-N 2.87Å; E210-N212 VanDerWaalsContact O-N 3.09Å; N212-E214 PolarHBondContact O-N 3.49Å; N212-E214 PolarHBondContact OD1-N 2.92Å; N212-L215 HydrophobicContact CB-CB 4.2Å; N212-L215 VanDerWaalsContact CG-CB 3.43Å; N212-L215 VanDerWaalsContact ND2-CB 3.28Å; N212-L215 WeakPolarHBondContact ND2-CB 3.38Å; N212-L215 PolarHBondContact O-N 3.43Å; N212-L215 PolarHBondContact OD1-N 3.34Å; N212-L215 VanDerWaalsContact OD1-N 3.12Å; N212-L216 VanDerWaalsContact O-CG 3.26Å; N212-L216 WeakPolarHBondContact O-CG 3.27Å; N212-L216 PolarHBondContact O-N 2.92Å
213	P	89.9	Confident	90.6	Very high	87 Å²	87	41.4 Å²	41.4	57%	0.565	24%	0.235	S	C	*	.	H	α-helix	trans	-66.3	-21.1	-175.9	27.2	-35.7	0	0	0	113.9	D211 R217	D211-P213 VanDerWaalsContact O-CD 3.24Å; D211-P213 WeakPolarHBondContact O-CD 3.46Å; P213-R217 VanDerWaalsContact O-CG 3.31Å; P213-R217 WeakPolarHBondContact O-CG 3.35Å; P213-R217 PolarHBondContact O-N 2.88Å; P213-R217 PolarHBondContact O-NE 3.23Å
214	E	90.6	Very high	90.2	Very high	82 Å²	82	42.1 Å²	42.1	38%	0.383	24%	0.239	S	C	.	.	H	α-helix	trans	-68.8	-50.5	174.3	-177.1	-176.5	-166.1	0	0	111.1	N176 N212 R217	N176-E214 HydrophobicContact CB-CG 4.4Å; N176-E214 PolarHBondContact ND2-OE2 3.09Å; N212-E214 PolarHBondContact O-N 3.49Å; N212-E214 PolarHBondContact OD1-N 2.92Å; E214-R217 PolarHBondContact O-N 3.12Å
215	L	91.3	Very high	89.9	Confident	4 Å²	4	43.2 Å²	43.2	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-65	-43.4	177.6	-173.1	64.8	0	0	0	111.3	F175 L181 V208 T209 N212 R217 S218 M219	F175-L215 HydrophobicContact CD1-CD1 4.39Å; F175-L215 HydrophobicContact CE1-CD1 3.93Å; F175-L215 HydrophobicContact CE1-CD2 4.13Å; L181-L215 HydrophobicContact CB-CD1 4.17Å; L181-L215 HydrophobicContact CD1-CD1 4.35Å; L181-L215 HydrophobicContact CD2-CD1 4.13Å; L181-L215 HydrophobicContact CG-CD1 4.45Å; V208-L215 HydrophobicContact CB-CD2 3.92Å; V208-L215 HydrophobicContact CG2-CD2 3.56Å; V208-L215 VanDerWaalsContact O-CD2 3.25Å; V208-L215 WeakPolarHBondContact O-CD2 3.48Å; T209-L215 HydrophobicContact CG2-CD2 4.02Å; N212-L215 HydrophobicContact CB-CB 4.2Å; N212-L215 VanDerWaalsContact CG-CB 3.43Å; N212-L215 VanDerWaalsContact ND2-CB 3.28Å; N212-L215 WeakPolarHBondContact ND2-CB 3.38Å; N212-L215 PolarHBondContact O-N 3.43Å; N212-L215 PolarHBondContact OD1-N 3.34Å; N212-L215 VanDerWaalsContact OD1-N 3.12Å; L215-R217 PolarHBondContact O-N 2.86Å; L215-S218 WeakPolarHBondContact O-CA 3.18Å; L215-S218 WeakPolarHBondContact O-CB 3.45Å; L215-S218 PolarHBondContact O-N 2.71Å; L215-S218 PolarHBondContact O-OG 2.89Å; L215-M219 HydrophobicContact CD1-CE 3.79Å; L215-M219 HydrophobicContact CD2-CE 4.36Å; L215-M219 HydrophobicContact CG-CE 3.6Å; L215-M219 VanDerWaalsContact O-CE 3.23Å; L215-M219 WeakPolarHBondContact O-CE 3.41Å; L215-M219 PolarHBondContact O-N 3.16Å
216	L	88	Confident	89.8	Confident	30 Å²	30	43.1 Å²	43.1	16%	0.157	25%	0.249	C	C	.	.	H	α-helix	trans	-61	-28.1	-179.5	-68.5	177.1	0	0	0	113.4	N212 M254 S257	N212-L216 VanDerWaalsContact O-CG 3.26Å; N212-L216 WeakPolarHBondContact O-CG 3.27Å; N212-L216 PolarHBondContact O-N 2.92Å; L216-M254 HydrophobicContact CD2-CB 4.3Å; L216-M254 HydrophobicContact CD2-CG 3.65Å; L216-S257 PolarHBondContact O-OG 3.37Å; L216-S257 VanDerWaalsContact O-OG 3.05Å
217	R	85	Confident	89.8	Confident	191 Å²	191	42.6 Å²	42.6	72%	0.721	25%	0.247	S	C	*	.	H	α-helix	trans	-74.4	-23.1	172.4	-78.7	-179.5	-74.8	119.4	-11.3	113.8	P213 E214 L215	P213-R217 VanDerWaalsContact O-CG 3.31Å; P213-R217 WeakPolarHBondContact O-CG 3.35Å; P213-R217 PolarHBondContact O-N 2.88Å; P213-R217 PolarHBondContact O-NE 3.23Å; E214-R217 PolarHBondContact O-N 3.12Å; L215-R217 PolarHBondContact O-N 2.86Å
218	S	80.3	Confident	89.7	Confident	63 Å²	63	44.3 Å²	44.3	44%	0.441	25%	0.254	S	S	.	.	H	α-helix	trans	-88.7	-5.6	179.2	73.6	0	0	0	0	113.9	L215	L215-S218 WeakPolarHBondContact O-CA 3.18Å; L215-S218 WeakPolarHBondContact O-CB 3.45Å; L215-S218 PolarHBondContact O-N 2.71Å; L215-S218 PolarHBondContact O-OG 2.89Å
219	M	82.8	Confident	89.7	Confident	30 Å²	30	49.5 Å²	49.5	15%	0.148	28%	0.277	C	S	.	.			trans	-61.7	137	179.7	-67.6	-64.6	116.4	0	0	112.1	L181 L215 V223 M254	L181-M219 HydrophobicContact CD1-CE 3.7Å; L181-M219 HydrophobicContact CD1-SD 4.48Å; L181-M219 HydrophobicContact CD2-CE 3.14Å; L181-M219 HydrophobicContact CD2-SD 4.16Å; L181-M219 HydrophobicContact CG-CE 4.03Å; L215-M219 HydrophobicContact CD1-CE 3.79Å; L215-M219 HydrophobicContact CD2-CE 4.36Å; L215-M219 HydrophobicContact CG-CE 3.6Å; L215-M219 VanDerWaalsContact O-CE 3.23Å; L215-M219 WeakPolarHBondContact O-CE 3.41Å; L215-M219 PolarHBondContact O-N 3.16Å; M219-V223 HydrophobicContact SD-CB 4.48Å; M219-V223 HydrophobicContact SD-CG1 3.85Å; M219-M254 HydrophobicContact CB-CE 3.89Å; M219-M254 HydrophobicContact CG-CE 3.57Å; M219-M254 HydrophobicContact CG-CG 4.43Å; M219-M254 HydrophobicContact CG-SD 4.33Å; M219-M254 HydrophobicContact SD-CE 3.42Å; M219-M254 WeakPolarHBondContact SD-CE 3.32Å; M219-M254 HydrophobicContact SD-SD 3.81Å
220	N	84.2	Confident	89.8	Confident	64 Å²	64	49.5 Å²	49.5	34%	0.342	28%	0.276	S	S	.	.			trans	-128.4	174	-177.9	68	43.7	0	0	0	111.9	A222 V223 L224	N220-A222 VanDerWaalsContact C-N 3.25Å; N220-A222 PolarHBondContact O-N 2.99Å; N220-A222 WeakPolarHBondContact OD1-CA 3.38Å; N220-A222 VanDerWaalsContact OD1-CB 3.31Å; N220-A222 WeakPolarHBondContact OD1-CB 3.31Å; N220-A222 PolarHBondContact OD1-N 3.4Å; N220-V223 PolarHBondContact O-N 3.49Å; N220-V223 PolarHBondContact OD1-N 3.27Å; N220-L224 PolarHBondContact O-N 2.93Å
221	A	86.9	Confident	89.9	Confident	86 Å²	86	49.4 Å²	49.4	71%	0.711	28%	0.277	S	S	*	.	H	α-helix	trans	-64.9	-25.5	-178.8	0	0	0	0	0	113.8	G225	A221-G225 PolarHBondContact O-N 3.15Å
222	A	89.6	Confident	90.1	Very high	72 Å²	72	52 Å²	52	60%	0.595	29%	0.29	S	S	*	.	H	α-helix	trans	-71.8	-44.9	178.7	0	0	0	0	0	111.1	N220 G225 A226	N220-A222 VanDerWaalsContact C-N 3.25Å; N220-A222 PolarHBondContact O-N 2.99Å; N220-A222 WeakPolarHBondContact OD1-CA 3.38Å; N220-A222 VanDerWaalsContact OD1-CB 3.31Å; N220-A222 WeakPolarHBondContact OD1-CB 3.31Å; N220-A222 PolarHBondContact OD1-N 3.4Å; A222-G225 PolarHBondContact O-N 3.27Å; A222-A226 PolarHBondContact O-N 3.46Å
223	V	90.4	Very high	90.2	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.018	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-46.8	175.1	175.3	0	0	0	0	110.9	L181 V185 M219 N220 G225 A226 L227 M254	L181-V223 HydrophobicContact CD2-CG2 4.08Å; L181-V223 HydrophobicContact CG-CG2 4.23Å; V185-V223 HydrophobicContact CG2-CB 4.41Å; V185-V223 HydrophobicContact CG2-CG1 4.04Å; V185-V223 HydrophobicContact CG2-CG2 3.88Å; M219-V223 HydrophobicContact SD-CB 4.48Å; M219-V223 HydrophobicContact SD-CG1 3.85Å; N220-V223 PolarHBondContact O-N 3.49Å; N220-V223 PolarHBondContact OD1-N 3.27Å; V223-G225 VanDerWaalsContact C-N 3.32Å; V223-G225 PolarHBondContact O-N 3.27Å; V223-A226 PolarHBondContact O-N 3.3Å; V223-L227 HydrophobicContact CG1-CD1 4.17Å; V223-L227 WeakPolarHBondContact O-CG 3.45Å; V223-L227 PolarHBondContact O-N 3.49Å; V223-M254 HydrophobicContact CG1-CE 4.46Å
224	L	89.5	Confident	90.3	Very high	28 Å²	28	53.4 Å²	53.4	15%	0.147	30%	0.302	C	S	.	.	H	α-helix	trans	-59.4	-43.3	174.4	-75.4	173.5	0	0	0	111.9	N220 A226 L227 E228 M254 L258	N220-L224 PolarHBondContact O-N 2.93Å; L224-A226 VanDerWaalsContact C-N 3.35Å; L224-A226 PolarHBondContact O-N 2.73Å; L224-L227 PolarHBondContact O-N 3.26Å; L224-E228 WeakPolarHBondContact O-CB 3.37Å; L224-E228 WeakPolarHBondContact O-CG 3.48Å; L224-E228 PolarHBondContact O-N 3.42Å; L224-M254 HydrophobicContact CD2-CE 3.45Å; L224-M254 VanDerWaalsContact CD2-CE 3.45Å; L224-M254 HydrophobicContact CG-CE 3.97Å; L224-L258 HydrophobicContact CD1-CD2 4.3Å; L224-L258 HydrophobicContact CD2-CD2 3.61Å
225	G	91.9	Very high	90.3	Very high	22 Å²	22	53.8 Å²	53.8	23%	0.227	30%	0.304	C	S	.	.	H	α-helix	trans	-61.5	-39.3	176.8	0	0	0	0	0	113.2	A221 A222 V223 K229	A221-G225 PolarHBondContact O-N 3.15Å; A222-G225 PolarHBondContact O-N 3.27Å; V223-G225 VanDerWaalsContact C-N 3.32Å; V223-G225 PolarHBondContact O-N 3.27Å; G225-K229 VanDerWaalsContact O-CG 3.3Å; G225-K229 WeakPolarHBondContact O-CG 3.5Å; G225-K229 PolarHBondContact O-N 3.22Å
226	A	94.6	Very high	90.2	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.008	34%	0.335	C	S	.	.	H	α-helix	trans	-65	-45.9	175.5	0	0	0	0	0	111.7	V185 E189 A222 V223 L224 K229 V230	V185-A226 HydrophobicContact CG1-CB 3.63Å; E189-A226 HydrophobicContact CG-CB 3.96Å; A222-A226 PolarHBondContact O-N 3.46Å; V223-A226 PolarHBondContact O-N 3.3Å; L224-A226 VanDerWaalsContact C-N 3.35Å; L224-A226 PolarHBondContact O-N 2.73Å; A226-K229 PolarHBondContact O-N 2.82Å; A226-V230 PolarHBondContact O-N 3.42Å; A226-V230 VanDerWaalsContact O-N 3.14Å
227	L	94.9	Very high	90.5	Very high	3 Å²	3	58.2 Å²	58.2	2%	0.016	34%	0.34	C	S	.	.	H	α-helix	trans	-63.7	-41.7	176.2	-69.1	166.7	0	0	0	112.1	L188 V223 L224 K229 V230 L231 A247 T250 V251 M254	L188-L227 HydrophobicContact CD2-CD2 3.86Å; L188-L227 HydrophobicContact CD2-CG 4.49Å; V223-L227 HydrophobicContact CG1-CD1 4.17Å; V223-L227 WeakPolarHBondContact O-CG 3.45Å; V223-L227 PolarHBondContact O-N 3.49Å; L224-L227 PolarHBondContact O-N 3.26Å; L227-K229 VanDerWaalsContact C-N 3.35Å; L227-K229 PolarHBondContact O-N 3.1Å; L227-V230 PolarHBondContact O-N 3.23Å; L227-L231 WeakPolarHBondContact O-CG 3.4Å; L227-L231 PolarHBondContact O-N 3.01Å; L227-A247 HydrophobicContact CD2-CB 4.08Å; L227-T250 HydrophobicContact CD1-CG2 3.84Å; L227-T250 HydrophobicContact CD2-CG2 4.05Å; L227-V251 HydrophobicContact CB-CG2 3.82Å; L227-V251 HydrophobicContact CD1-CG2 4Å; L227-V251 HydrophobicContact CG-CG2 4.39Å; L227-M254 HydrophobicContact CD1-CE 4.36Å; L227-M254 HydrophobicContact CD1-SD 3.75Å
228	E	92.8	Very high	91	Very high	47 Å²	47	50.4 Å²	50.4	22%	0.22	31%	0.312	C	S	.	.	H	α-helix	trans	-59.7	-42.9	175	-78.2	179.8	-169.1	0	0	111.3	L224 V230 L231 L232 R262	L224-E228 WeakPolarHBondContact O-CB 3.37Å; L224-E228 WeakPolarHBondContact O-CG 3.48Å; L224-E228 PolarHBondContact O-N 3.42Å; E228-V230 VanDerWaalsContact C-N 3.34Å; E228-V230 PolarHBondContact O-N 3.03Å; E228-L231 PolarHBondContact O-N 3.31Å; E228-L232 WeakPolarHBondContact O-CB 3.26Å; E228-L232 VanDerWaalsContact O-CG 3.24Å; E228-L232 WeakPolarHBondContact O-CG 3.41Å; E228-L232 PolarHBondContact O-N 3.41Å; E228-R262 IonicContact OE1-CZ 3.86Å; E228-R262 IonicContact OE1-NH1 2.72Å; E228-R262 PolarHBondContact OE1-NH1 3.12Å; E228-R262 IonicContact OE1-NH2 3.52Å; E228-R262 IonicContact OE2-CZ 2.95Å; E228-R262 IonicContact OE2-NH1 3.61Å; E228-R262 PolarHBondContact OE2-NH1 2.98Å; E228-R262 IonicContact OE2-NH2 2.92Å; E228-R262 PolarHBondContact OE2-NH2 3.47Å
229	K	95.1	Very high	91.7	Very high	111 Å²	111	48 Å²	48	48%	0.483	30%	0.296	S	S	.	.	H	α-helix	trans	-60.9	-42.1	175.5	-71.1	170.2	-165.7	168.7	0	112.1	E189 G225 A226 L227 L232 S233	E189-K229 IonicContact OE1-NZ 2.97Å; E189-K229 PolarHBondContact OE1-NZ 3.02Å; G225-K229 VanDerWaalsContact O-CG 3.3Å; G225-K229 WeakPolarHBondContact O-CG 3.5Å; G225-K229 PolarHBondContact O-N 3.22Å; A226-K229 PolarHBondContact O-N 2.82Å; L227-K229 VanDerWaalsContact C-N 3.35Å; L227-K229 PolarHBondContact O-N 3.1Å; K229-L232 PolarHBondContact O-N 3.04Å; K229-S233 PolarHBondContact O-N 3.35Å; K229-S233 VanDerWaalsContact O-N 3.08Å
230	V	96.6	Very high	92.3	Very high	1 Å²	1	48 Å²	48	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-64.3	-49.4	177.6	173.1	0	0	0	0	110.4	L188 Y191 A226 L227 E228 L232 S233 L243 R244 A247	L188-V230 HydrophobicContact CD1-CG2 4.26Å; L188-V230 HydrophobicContact CD2-CG2 4.19Å; L188-V230 HydrophobicContact CG-CG2 4.02Å; Y191-V230 HydrophobicContact CD1-CG2 3.93Å; Y191-V230 HydrophobicContact CE1-CG2 4.13Å; A226-V230 PolarHBondContact O-N 3.42Å; A226-V230 VanDerWaalsContact O-N 3.14Å; L227-V230 PolarHBondContact O-N 3.23Å; E228-V230 VanDerWaalsContact C-N 3.34Å; E228-V230 PolarHBondContact O-N 3.03Å; V230-L232 VanDerWaalsContact C-N 3.27Å; V230-L232 PolarHBondContact O-N 3.14Å; V230-S233 VanDerWaalsContact O-CB 3.24Å; V230-S233 WeakPolarHBondContact O-CB 3.46Å; V230-S233 PolarHBondContact O-N 3.09Å; V230-S233 PolarHBondContact O-OG 3.14Å; V230-L243 HydrophobicContact CG1-CD1 4.18Å; V230-L243 HydrophobicContact CG1-CD2 4.09Å; V230-L243 HydrophobicContact CG1-CG 3.68Å; V230-R244 WeakPolarHBondContact O-CG 3.42Å; V230-A247 HydrophobicContact CB-CB 4.17Å; V230-A247 HydrophobicContact CG1-CB 3.67Å
231	L	94.1	Very high	93	Very high	18 Å²	18	46 Å²	46	9%	0.094	28%	0.284	C	S	.	.	H	α-helix	trans	-57.6	-39.4	177.9	-76.2	177.5	0	0	0	112.8	L227 E228 S233 R244 A247 A248 V251 T273	L227-L231 WeakPolarHBondContact O-CG 3.4Å; L227-L231 PolarHBondContact O-N 3.01Å; E228-L231 PolarHBondContact O-N 3.31Å; L231-S233 VanDerWaalsContact C-N 3.3Å; L231-R244 WeakPolarHBondContact CD2-O 3.46Å; L231-A247 HydrophobicContact CD2-CB 4.23Å; L231-A247 HydrophobicContact CG-CB 4.3Å; L231-A248 HydrophobicContact CD2-CB 3.76Å; L231-V251 HydrophobicContact CD1-CB 4.43Å; L231-V251 HydrophobicContact CD1-CG2 3.9Å; L231-T273 HydrophobicContact CD2-CG2 4.22Å
232	L	92.2	Very high	93.5	Very high	137 Å²	137	42.3 Å²	42.3	72%	0.717	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-2.1	179.9	-64.8	173.7	0	0	0	113.6	E228 K229 V230	E228-L232 WeakPolarHBondContact O-CB 3.26Å; E228-L232 VanDerWaalsContact O-CG 3.24Å; E228-L232 WeakPolarHBondContact O-CG 3.41Å; E228-L232 PolarHBondContact O-N 3.41Å; K229-L232 PolarHBondContact O-N 3.04Å; V230-L232 VanDerWaalsContact C-N 3.27Å; V230-L232 PolarHBondContact O-N 3.14Å
233	S	94.1	Very high	93.9	Very high	15 Å²	15	38.9 Å²	38.9	11%	0.105	22%	0.224	C	C	.	.			trans	-67.2	143.2	178.8	73.3	0	0	0	0	111.2	K229 V230 L231 R244	K229-S233 PolarHBondContact O-N 3.35Å; K229-S233 VanDerWaalsContact O-N 3.08Å; V230-S233 VanDerWaalsContact O-CB 3.24Å; V230-S233 WeakPolarHBondContact O-CB 3.46Å; V230-S233 PolarHBondContact O-N 3.09Å; V230-S233 PolarHBondContact O-OG 3.14Å; L231-S233 VanDerWaalsContact C-N 3.3Å; S233-R244 WeakPolarHBondContact O-CD 3.43Å; S233-R244 PolarHBondContact O-NH1 3.32Å
234	S	91	Very high	94.3	Very high	113 Å²	113	39.8 Å²	39.8	79%	0.79	23%	0.228	S	C	*	.			trans	-113.7	18	-177.1	66.8	0	0	0	0	113.4
235	Q	91.5	Very high	94.7	Very high	90 Å²	90	38.5 Å²	38.5	42%	0.421	22%	0.221	S	C	.	.			trans	-64.4	138.1	178.7	-66.5	-64.1	-9	0	0	110.4	H240 R244	Q235-H240 HydrophobicContact CB-CB 4.19Å; Q235-R244 PolarHBondContact O-NH1 3.3Å; Q235-R244 PolarHBondContact O-NH2 3.05Å
236	P	89.2	Confident	95	Very high	102 Å²	102	37.4 Å²	37.4	66%	0.662	21%	0.21	S	C	*	.			trans	-76	173.6	176.1	34.5	-35.2	0	0	0	110.7	H240	P236-H240 PolarHBondContact O-CD2 2.68Å
237	G	93.1	Very high	95.2	Very high	26 Å²	26	37.4 Å²	37.4	27%	0.268	21%	0.209	S	C	.	.	S	Bend	trans	97.2	148.4	178.7	0	0	0	0	0	113.6	H240 I241	G237-H240 PolarHBondContact O-N 2.86Å; G237-I241 WeakPolarHBondContact O-CD1 3.45Å; G237-I241 WeakPolarHBondContact O-CG1 3.46Å; G237-I241 PolarHBondContact O-N 3.01Å; G237-I241 VanDerWaalsContact O-N 3.14Å
238	M	96.3	Very high	95.3	Very high	27 Å²	27	37.2 Å²	37.2	13%	0.133	21%	0.209	C	C	.	.	H	α-helix	trans	-69.6	-34.3	-177.7	-54.8	-57.3	140.8	0	0	111.1	H240 I241 L242 L280 L285 E354 A357 L358	M238-H240 VanDerWaalsContact C-N 3.33Å; M238-H240 PolarHBondContact O-N 3.01Å; M238-I241 HydrophobicContact CE-CD1 4.11Å; M238-I241 WeakPolarHBondContact O-CB 3.49Å; M238-I241 PolarHBondContact O-N 2.89Å; M238-I241 VanDerWaalsContact O-N 3.16Å; M238-I241 HydrophobicContact SD-CD1 3.6Å; M238-L242 PolarHBondContact O-N 3.25Å; M238-L280 HydrophobicContact SD-CD1 4Å; M238-L285 HydrophobicContact CE-CD1 4.14Å; M238-E354 WeakPolarHBondContact CA-OE2 3.4Å; M238-E354 HydrophobicContact CB-CB 4.33Å; M238-E354 WeakPolarHBondContact CB-O 3.32Å; M238-E354 WeakPolarHBondContact CB-OE2 3.39Å; M238-E354 HydrophobicContact CG-CB 4.36Å; M238-E354 VanDerWaalsContact CG-OE2 3.31Å; M238-E354 WeakPolarHBondContact CG-OE2 3.44Å; M238-E354 PolarHBondContact N-OE2 3.45Å; M238-A357 HydrophobicContact CB-CB 4.1Å; M238-L358 HydrophobicContact CB-CB 4.13Å; M238-L358 HydrophobicContact CG-CB 3.99Å; M238-L358 HydrophobicContact SD-CB 4.05Å; M238-L358 HydrophobicContact SD-CD1 3.84Å; M238-L358 HydrophobicContact SD-CG 4.34Å
239	A	94.8	Very high	95.5	Very high	13 Å²	13	35 Å²	35	11%	0.107	20%	0.198	C	C	.	.	H	α-helix	trans	-56.3	-45.5	170.8	0	0	0	0	0	112.2	V195 I199 I241 L242 L243 E354	V195-A239 HydrophobicContact CG1-CB 4.2Å; V195-A239 HydrophobicContact CG2-CB 4.15Å; I199-A239 HydrophobicContact CD1-CB 3.84Å; I199-A239 WeakPolarHBondContact CD1-O 3.26Å; A239-I241 PolarHBondContact O-N 3.43Å; A239-L242 PolarHBondContact O-N 3.32Å; A239-L243 WeakPolarHBondContact O-CB 3.4Å; A239-L243 PolarHBondContact O-N 2.72Å; A239-E354 WeakPolarHBondContact CB-OE1 3.43Å; A239-E354 PolarHBondContact N-OE1 2.91Å; A239-E354 VanDerWaalsContact N-OE1 3.14Å
240	H	96.4	Very high	95.5	Very high	28 Å²	28	29.8 Å²	29.8	13%	0.13	18%	0.176	C	C	.	.	H	α-helix	trans	-70	-30.5	176.7	-77.7	-74	0	0	0	113.1	Y191 Q235 P236 G237 M238 R244	Y191-H240 PolarHBondContact O-CE1 3.14Å; Q235-H240 HydrophobicContact CB-CB 4.19Å; P236-H240 PolarHBondContact O-CD2 2.68Å; G237-H240 PolarHBondContact O-N 2.86Å; M238-H240 VanDerWaalsContact C-N 3.33Å; M238-H240 PolarHBondContact O-N 3.01Å; H240-R244 WeakPolarHBondContact O-CG 3.33Å; H240-R244 PolarHBondContact O-N 3.06Å
241	I	97.4	Very high	95.4	Very high	22 Å²	22	29.9 Å²	29.9	11%	0.113	18%	0.176	C	C	.	.	H	α-helix	trans	-66.2	-44.4	172.3	-67.4	156.4	0	0	0	110.7	G237 M238 A239 R244 T245 C277 L280 A361	G237-I241 WeakPolarHBondContact O-CD1 3.45Å; G237-I241 WeakPolarHBondContact O-CG1 3.46Å; G237-I241 PolarHBondContact O-N 3.01Å; G237-I241 VanDerWaalsContact O-N 3.14Å; M238-I241 HydrophobicContact CE-CD1 4.11Å; M238-I241 WeakPolarHBondContact O-CB 3.49Å; M238-I241 PolarHBondContact O-N 2.89Å; M238-I241 VanDerWaalsContact O-N 3.16Å; M238-I241 HydrophobicContact SD-CD1 3.6Å; A239-I241 PolarHBondContact O-N 3.43Å; I241-R244 PolarHBondContact O-N 3.36Å; I241-T245 WeakPolarHBondContact O-CB 3.38Å; I241-T245 PolarHBondContact O-N 3.31Å; I241-T245 PolarHBondContact O-OG1 3.32Å; I241-C277 HydrophobicContact CG2-CB 3.98Å; I241-L280 HydrophobicContact CD1-CD1 3.42Å; I241-L280 VanDerWaalsContact CD1-CD1 3.42Å; I241-L280 HydrophobicContact CG1-CD1 4.38Å; I241-L280 HydrophobicContact CG2-CD1 4.13Å; I241-A361 HydrophobicContact CG2-CB 4.11Å
242	L	97.9	Very high	95.4	Very high	9 Å²	9	29.7 Å²	29.7	5%	0.047	17%	0.174	C	C	.	.	H	α-helix	trans	-59.3	-48.5	174.1	174.9	58.9	0	0	0	111.1	I199 M238 A239 R244 T245 L246 A357 T360 A361	I199-L242 HydrophobicContact CG2-CD2 3.98Å; I199-L242 HydrophobicContact CG2-CG 4.48Å; M238-L242 PolarHBondContact O-N 3.25Å; A239-L242 PolarHBondContact O-N 3.32Å; L242-R244 PolarHBondContact O-N 3.27Å; L242-T245 WeakPolarHBondContact O-CB 3.39Å; L242-T245 PolarHBondContact O-N 3.39Å; L242-T245 VanDerWaalsContact O-N 3.07Å; L242-L246 HydrophobicContact CD1-CD1 3.93Å; L242-L246 HydrophobicContact CD1-CG 4.02Å; L242-L246 HydrophobicContact CG-CD1 3.92Å; L242-L246 HydrophobicContact CG-CG 4.46Å; L242-L246 WeakPolarHBondContact O-CG 3.44Å; L242-L246 PolarHBondContact O-N 3.31Å; L242-A357 HydrophobicContact CB-CB 4.24Å; L242-A357 HydrophobicContact CD2-CB 4.07Å; L242-T360 HydrophobicContact CD1-CG2 3.77Å; L242-T360 HydrophobicContact CD2-CG2 4.32Å; L242-A361 HydrophobicContact CB-CB 4.07Å; L242-A361 HydrophobicContact CD1-CB 4.1Å
243	L	98.4	Very high	95.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-54.7	-49.2	177.1	176.6	62.2	0	0	0	112.1	L188 Y191 V195 S198 I199 A202 V230 A239 T245 L246 A247	L188-L243 HydrophobicContact CD1-CD1 3.76Å; Y191-L243 VanDerWaalsContact CB-CD2 3.43Å; Y191-L243 HydrophobicContact CD2-CD2 4.48Å; Y191-L243 HydrophobicContact CG-CD2 4.1Å; V195-L243 HydrophobicContact CG2-CD2 4.27Å; S198-L243 WeakPolarHBondContact O-CD1 3.2Å; I199-L243 HydrophobicContact CG1-CB 3.99Å; I199-L243 HydrophobicContact CG1-CD1 4.46Å; A202-L243 HydrophobicContact CB-CD1 3.73Å; V230-L243 HydrophobicContact CG1-CD1 4.18Å; V230-L243 HydrophobicContact CG1-CD2 4.09Å; V230-L243 HydrophobicContact CG1-CG 3.68Å; A239-L243 WeakPolarHBondContact O-CB 3.4Å; A239-L243 PolarHBondContact O-N 2.72Å; L243-T245 VanDerWaalsContact C-N 3.3Å; L243-T245 PolarHBondContact O-N 3.39Å; L243-L246 PolarHBondContact O-N 3.19Å; L243-A247 PolarHBondContact O-N 3.32Å
244	R	98.3	Very high	95.2	Very high	23 Å²	23	23.9 Å²	23.9	9%	0.087	14%	0.143	C	C	.	.	H	α-helix	trans	-61	-39.8	176.5	-75.6	-174	-68.5	-117.9	-8.2	112	V230 L231 S233 Q235 H240 I241 L242 A247 A248 T273	V230-R244 WeakPolarHBondContact O-CG 3.42Å; L231-R244 WeakPolarHBondContact CD2-O 3.46Å; S233-R244 WeakPolarHBondContact O-CD 3.43Å; S233-R244 PolarHBondContact O-NH1 3.32Å; Q235-R244 PolarHBondContact O-NH1 3.3Å; Q235-R244 PolarHBondContact O-NH2 3.05Å; H240-R244 WeakPolarHBondContact O-CG 3.33Å; H240-R244 PolarHBondContact O-N 3.06Å; I241-R244 PolarHBondContact O-N 3.36Å; L242-R244 PolarHBondContact O-N 3.27Å; R244-A247 PolarHBondContact O-N 3.41Å; R244-A248 WeakPolarHBondContact O-CB 3.41Å; R244-A248 PolarHBondContact O-N 2.99Å; R244-T273 HydrophobicContact CB-CG2 3.73Å
245	T	98.3	Very high	95	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-64.4	-44.2	178.7	-56.6	0	0	0	0	111.8	I241 L242 L243 A248 G249 L274 T364 S365 I368	I241-T245 WeakPolarHBondContact O-CB 3.38Å; I241-T245 PolarHBondContact O-N 3.31Å; I241-T245 PolarHBondContact O-OG1 3.32Å; L242-T245 WeakPolarHBondContact O-CB 3.39Å; L242-T245 PolarHBondContact O-N 3.39Å; L242-T245 VanDerWaalsContact O-N 3.07Å; L243-T245 VanDerWaalsContact C-N 3.3Å; L243-T245 PolarHBondContact O-N 3.39Å; T245-A248 WeakPolarHBondContact O-CB 3.48Å; T245-A248 PolarHBondContact O-N 3.36Å; T245-G249 PolarHBondContact O-N 2.89Å; T245-L274 HydrophobicContact CG2-CD2 4.06Å; T245-T364 HydrophobicContact CG2-CG2 3.94Å; T245-S365 VanDerWaalsContact CG2-OG 3.25Å; T245-S365 WeakPolarHBondContact CG2-OG 3.49Å; T245-I368 HydrophobicContact CG2-CD1 4.25Å
246	L	98.1	Very high	94.7	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.8	-40	176.9	-68.3	165	0	0	0	112.1	I199 A202 H203 H206 L242 L243 A248 G249 T250 T364	I199-L246 HydrophobicContact CG2-CD1 4.3Å; A202-L246 HydrophobicContact CB-CB 3.59Å; A202-L246 HydrophobicContact CB-CD1 3.89Å; A202-L246 HydrophobicContact CB-CG 4.39Å; H203-L246 VanDerWaalsContact CD2-CD1 3.47Å; H203-L246 WeakPolarHBondContact CD2-CD1 3.36Å; H203-L246 WeakPolarHBondContact NE2-CD1 3.15Å; H206-L246 HydrophobicContact CB-CD2 4.43Å; L242-L246 HydrophobicContact CD1-CD1 3.93Å; L242-L246 HydrophobicContact CD1-CG 4.02Å; L242-L246 HydrophobicContact CG-CD1 3.92Å; L242-L246 HydrophobicContact CG-CG 4.46Å; L242-L246 WeakPolarHBondContact O-CG 3.44Å; L242-L246 PolarHBondContact O-N 3.31Å; L243-L246 PolarHBondContact O-N 3.19Å; L246-A248 VanDerWaalsContact C-N 3.3Å; L246-A248 PolarHBondContact O-N 2.68Å; L246-G249 PolarHBondContact O-N 2.92Å; L246-T250 PolarHBondContact O-N 2.99Å; L246-T250 PolarHBondContact O-OG1 2.95Å; L246-T364 HydrophobicContact CD2-CG2 4.22Å
247	A	97.9	Very high	94.4	Very high	0 Å²	0	18 Å²	18	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.8	-39.9	172	0	0	0	0	0	111.3	L227 V230 L231 L243 R244 G249 T250 V251	L227-A247 HydrophobicContact CD2-CB 4.08Å; V230-A247 HydrophobicContact CB-CB 4.17Å; V230-A247 HydrophobicContact CG1-CB 3.67Å; L231-A247 HydrophobicContact CD2-CB 4.23Å; L231-A247 HydrophobicContact CG-CB 4.3Å; L243-A247 PolarHBondContact O-N 3.32Å; R244-A247 PolarHBondContact O-N 3.41Å; A247-G249 PolarHBondContact O-N 3.3Å; A247-T250 PolarHBondContact O-N 2.94Å; A247-V251 WeakPolarHBondContact O-CG2 3.37Å; A247-V251 PolarHBondContact O-N 2.89Å
248	A	97.8	Very high	93.9	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.2	-42.4	176.1	0	0	0	0	0	111.8	L231 R244 T245 L246 V251 W252 V270 T273 L274	L231-A248 HydrophobicContact CD2-CB 3.76Å; R244-A248 WeakPolarHBondContact O-CB 3.41Å; R244-A248 PolarHBondContact O-N 2.99Å; T245-A248 WeakPolarHBondContact O-CB 3.48Å; T245-A248 PolarHBondContact O-N 3.36Å; L246-A248 VanDerWaalsContact C-N 3.3Å; L246-A248 PolarHBondContact O-N 2.68Å; A248-V251 PolarHBondContact O-N 3.07Å; A248-W252 WeakPolarHBondContact O-CB 3.44Å; A248-W252 PolarHBondContact O-N 2.58Å; A248-V270 HydrophobicContact CB-CG1 4Å; A248-T273 HydrophobicContact CB-CG2 4.21Å; A248-L274 HydrophobicContact CB-CD2 4.07Å
249	G	96.7	Very high	93.3	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.3	-44.3	173.5	0	0	0	0	0	112.9	T245 L246 A247 V251 W252 N253 I368	T245-G249 PolarHBondContact O-N 2.89Å; L246-G249 PolarHBondContact O-N 2.92Å; A247-G249 PolarHBondContact O-N 3.3Å; G249-V251 PolarHBondContact O-N 2.69Å; G249-W252 WeakPolarHBondContact O-CB 3.17Å; G249-W252 PolarHBondContact O-N 3.29Å; G249-N253 PolarHBondContact O-N 2.96Å; G249-I368 VanDerWaalsContact CA-CD1 3.43Å
250	T	96.1	Very high	92.7	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.012	15%	0.151	C	C	.	.	H	α-helix	trans	-60	-45.6	175.4	-53.9	0	0	0	0	111.3	L205 H206 T209 L227 L246 A247 W252 N253 M254	L205-T250 HydrophobicContact CB-CG2 4.1Å; H206-T250 WeakPolarHBondContact CA-OG1 3.24Å; H206-T250 PolarHBondContact N-OG1 2.99Å; T209-T250 HydrophobicContact CG2-CG2 3.95Å; L227-T250 HydrophobicContact CD1-CG2 3.84Å; L227-T250 HydrophobicContact CD2-CG2 4.05Å; L246-T250 PolarHBondContact O-N 2.99Å; L246-T250 PolarHBondContact O-OG1 2.95Å; A247-T250 PolarHBondContact O-N 2.94Å; T250-W252 VanDerWaalsContact C-N 3.33Å; T250-W252 PolarHBondContact O-N 3Å; T250-N253 PolarHBondContact O-N 3.4Å; T250-M254 HydrophobicContact CG2-SD 4Å; T250-M254 VanDerWaalsContact O-CG 3.25Å; T250-M254 WeakPolarHBondContact O-CG 3.42Å; T250-M254 PolarHBondContact O-N 3.11Å; T250-M254 VanDerWaalsContact O-N 3.09Å
251	V	94.8	Very high	92.1	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.018	19%	0.185	C	C	.	.	H	α-helix	trans	-64.1	-37.8	176.7	170.6	0	0	0	0	111.8	L227 L231 A247 A248 G249 M254 K255 T266 V270	L227-V251 HydrophobicContact CB-CG2 3.82Å; L227-V251 HydrophobicContact CD1-CG2 4Å; L227-V251 HydrophobicContact CG-CG2 4.39Å; L231-V251 HydrophobicContact CD1-CB 4.43Å; L231-V251 HydrophobicContact CD1-CG2 3.9Å; A247-V251 WeakPolarHBondContact O-CG2 3.37Å; A247-V251 PolarHBondContact O-N 2.89Å; A248-V251 PolarHBondContact O-N 3.07Å; G249-V251 PolarHBondContact O-N 2.69Å; V251-M254 CarbonylContact O-C 3.5Å; V251-M254 PolarHBondContact O-N 3.45Å; V251-K255 PolarHBondContact O-N 3.3Å; V251-T266 HydrophobicContact CG1-CG2 3.3Å; V251-V270 HydrophobicContact CB-CG2 4.05Å; V251-V270 HydrophobicContact CG1-CG2 3.65Å
252	W	93.3	Very high	91.4	Very high	14 Å²	14	31 Å²	31	5%	0.053	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-43.9	174	174.6	-103.4	0	0	0	112.2	A248 G249 T250 M254 K255 L267 I368 M372 V416	A248-W252 WeakPolarHBondContact O-CB 3.44Å; A248-W252 PolarHBondContact O-N 2.58Å; G249-W252 WeakPolarHBondContact O-CB 3.17Å; G249-W252 PolarHBondContact O-N 3.29Å; T250-W252 VanDerWaalsContact C-N 3.33Å; T250-W252 PolarHBondContact O-N 3Å; W252-M254 PolarHBondContact O-N 2.98Å; W252-K255 HydrophobicContact CD2-CD 3.87Å; W252-K255 HydrophobicContact CE3-CD 3.74Å; W252-K255 HydrophobicContact CH2-CD 3.47Å; W252-K255 VanDerWaalsContact CH2-CD 3.47Å; W252-K255 HydrophobicContact CZ2-CD 3.56Å; W252-K255 VanDerWaalsContact CZ2-CE 3.5Å; W252-K255 HydrophobicContact CZ3-CD 3.57Å; W252-K255 WeakPolarHBondContact O-CB 3.36Å; W252-K255 WeakPolarHBondContact O-CD 3.29Å; W252-K255 WeakPolarHBondContact O-CG 3.34Å; W252-K255 PolarHBondContact O-N 3.46Å; W252-L267 HydrophobicContact CE3-CD2 3.61Å; W252-L267 HydrophobicContact CZ3-CD2 3.56Å; W252-I368 HydrophobicContact CB-CG2 4.37Å; W252-I368 HydrophobicContact CG-CG2 4.31Å; W252-M372 HydrophobicContact CB-CE 4.5Å; W252-M372 HydrophobicContact CD2-CE 3.86Å; W252-M372 HydrophobicContact CD2-CG 3.73Å; W252-M372 HydrophobicContact CE3-CE 3.6Å; W252-M372 HydrophobicContact CE3-CG 3.79Å; W252-M372 HydrophobicContact CE3-SD 4.41Å; W252-M372 HydrophobicContact CG-CE 4.23Å; W252-M372 HydrophobicContact CH2-CB 3.97Å; W252-M372 HydrophobicContact CH2-CG 3.62Å; W252-M372 VanDerWaalsContact CZ2-CA 3.42Å; W252-M372 HydrophobicContact CZ2-CB 3.93Å; W252-M372 HydrophobicContact CZ2-CG 3.58Å; W252-M372 HydrophobicContact CZ3-CB 4.48Å; W252-M372 HydrophobicContact CZ3-CE 4.19Å; W252-M372 HydrophobicContact CZ3-CG 3.72Å; W252-M372 HydrophobicContact CZ3-SD 4.48Å; W252-V416 HydrophobicContact CH2-CG2 4.06Å; W252-V416 HydrophobicContact CZ3-CG2 4.03Å
253	N	92.6	Very high	90.7	Very high	28 Å²	28	33.9 Å²	33.9	15%	0.15	21%	0.213	C	C	.	.	H	α-helix	trans	-59.5	-32.4	174.5	-71.4	-8.8	0	0	0	111.6	H206 T209 E210 G249 T250 K255	H206-N253 PolarHBondContact CD2-ND2 2.9Å; H206-N253 PolarHBondContact O-ND2 3.32Å; T209-N253 PolarHBondContact OG1-ND2 3.19Å; E210-N253 PolarHBondContact N-ND2 3.23Å; G249-N253 PolarHBondContact O-N 2.96Å; T250-N253 PolarHBondContact O-N 3.4Å; N253-K255 VanDerWaalsContact C-N 3.33Å; N253-K255 PolarHBondContact O-N 3.2Å
254	M	89.3	Confident	90.2	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	4.6	178.3	-64.2	170.2	58.7	0	0	114.6	L216 M219 V223 L224 L227 T250 V251 W252 A256 S257 L258	L216-M254 HydrophobicContact CD2-CB 4.3Å; L216-M254 HydrophobicContact CD2-CG 3.65Å; M219-M254 HydrophobicContact CB-CE 3.89Å; M219-M254 HydrophobicContact CG-CE 3.57Å; M219-M254 HydrophobicContact CG-CG 4.43Å; M219-M254 HydrophobicContact CG-SD 4.33Å; M219-M254 HydrophobicContact SD-CE 3.42Å; M219-M254 WeakPolarHBondContact SD-CE 3.32Å; M219-M254 HydrophobicContact SD-SD 3.81Å; V223-M254 HydrophobicContact CG1-CE 4.46Å; L224-M254 HydrophobicContact CD2-CE 3.45Å; L224-M254 VanDerWaalsContact CD2-CE 3.45Å; L224-M254 HydrophobicContact CG-CE 3.97Å; L227-M254 HydrophobicContact CD1-CE 4.36Å; L227-M254 HydrophobicContact CD1-SD 3.75Å; T250-M254 HydrophobicContact CG2-SD 4Å; T250-M254 VanDerWaalsContact O-CG 3.25Å; T250-M254 WeakPolarHBondContact O-CG 3.42Å; T250-M254 PolarHBondContact O-N 3.11Å; T250-M254 VanDerWaalsContact O-N 3.09Å; V251-M254 CarbonylContact O-C 3.5Å; V251-M254 PolarHBondContact O-N 3.45Å; W252-M254 PolarHBondContact O-N 2.98Å; M254-A256 PolarHBondContact O-N 2.96Å; M254-S257 WeakPolarHBondContact O-CA 3.33Å; M254-S257 PolarHBondContact O-N 2.65Å; M254-L258 PolarHBondContact O-N 2.98Å
255	K	87.5	Confident	89.8	Confident	35 Å²	35	42.2 Å²	42.2	15%	0.152	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-55.4	-31.1	-171.1	69.4	-173	-168.5	-82.2	0	115.1	V251 W252 N253 S257 L258 Q263 L267 D376	V251-K255 PolarHBondContact O-N 3.3Å; W252-K255 HydrophobicContact CD2-CD 3.87Å; W252-K255 HydrophobicContact CE3-CD 3.74Å; W252-K255 HydrophobicContact CH2-CD 3.47Å; W252-K255 VanDerWaalsContact CH2-CD 3.47Å; W252-K255 HydrophobicContact CZ2-CD 3.56Å; W252-K255 VanDerWaalsContact CZ2-CE 3.5Å; W252-K255 HydrophobicContact CZ3-CD 3.57Å; W252-K255 WeakPolarHBondContact O-CB 3.36Å; W252-K255 WeakPolarHBondContact O-CD 3.29Å; W252-K255 WeakPolarHBondContact O-CG 3.34Å; W252-K255 PolarHBondContact O-N 3.46Å; N253-K255 VanDerWaalsContact C-N 3.33Å; N253-K255 PolarHBondContact O-N 3.2Å; K255-S257 VanDerWaalsContact C-N 3.34Å; K255-L258 PolarHBondContact O-N 2.96Å; K255-Q263 PolarHBondContact O-NE2 2.97Å; K255-L267 HydrophobicContact CB-CD2 4.48Å; K255-D376 WeakPolarHBondContact CE-OD2 3.27Å; K255-D376 IonicContact NZ-OD1 3.82Å; K255-D376 IonicContact NZ-OD2 3.84Å; K255-D376 PolarHBondContact NZ-OD2 2.68Å
256	A	84.4	Confident	89.3	Confident	93 Å²	93	43 Å²	43	77%	0.769	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-75.2	-23.1	178.2	0	0	0	0	0	113.1	M254	M254-A256 PolarHBondContact O-N 2.96Å
257	S	83.4	Confident	89	Confident	53 Å²	53	43.6 Å²	43.6	37%	0.371	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-89.8	-3.9	176.7	-57.1	0	0	0	0	112.7	L216 M254 K255	L216-S257 PolarHBondContact O-OG 3.37Å; L216-S257 VanDerWaalsContact O-OG 3.05Å; M254-S257 WeakPolarHBondContact O-CA 3.33Å; M254-S257 PolarHBondContact O-N 2.65Å; K255-S257 VanDerWaalsContact C-N 3.34Å
258	L	82.9	Confident	88.8	Confident	15 Å²	15	46.5 Å²	46.5	8%	0.079	29%	0.287	C	S	.	.	S	Bend	trans	-76.3	140.6	-180	-65	177.8	0	0	0	111.6	L224 M254 K255 A260 T266	L224-L258 HydrophobicContact CD1-CD2 4.3Å; L224-L258 HydrophobicContact CD2-CD2 3.61Å; M254-L258 PolarHBondContact O-N 2.98Å; K255-L258 PolarHBondContact O-N 2.96Å; L258-A260 PolarHBondContact O-N 3.41Å; L258-T266 HydrophobicContact CD1-CG2 3.68Å; L258-T266 HydrophobicContact CD2-CG2 4.48Å
259	P	82.9	Confident	88.6	Confident	73 Å²	73	48.1 Å²	48.1	47%	0.474	30%	0.3	S	S	.	.			trans	-60.1	131.9	170.5	-21.5	32.4	0	0	0	111.2	A261 R262 Q263	P259-A261 PolarHBondContact O-N 3.27Å; P259-R262 PolarHBondContact O-N 3.06Å; P259-Q263 PolarHBondContact O-N 3.08Å
260	A	82.8	Confident	88.6	Confident	87 Å²	87	48.1 Å²	48.1	72%	0.719	30%	0.3	S	S	*	.	H	α-helix	trans	-51.5	-36.7	-178.2	0	0	0	0	0	113.4	L258 R262 Q263	L258-A260 PolarHBondContact O-N 3.41Å; A260-R262 VanDerWaalsContact C-N 3.26Å; A260-R262 PolarHBondContact O-N 3.35Å; A260-Q263 PolarHBondContact O-N 3.35Å
261	A	82.9	Confident	88.6	Confident	101 Å²	101	48.2 Å²	48.2	84%	0.835	30%	0.301	S	S	*	.	H	α-helix	trans	-65.1	-24	178.9	0	0	0	0	0	114.5	P259	P259-A261 PolarHBondContact O-N 3.27Å
262	R	82.6	Confident	88.8	Confident	115 Å²	115	48.9 Å²	48.9	43%	0.434	31%	0.306	S	S	.	.	H	α-helix	trans	-107.4	-15.6	-179.6	-59.1	-174.8	96.9	-154.4	0.2	112.6	E228 P259 A260 A264 Q265 T266	E228-R262 IonicContact OE1-CZ 3.86Å; E228-R262 IonicContact OE1-NH1 2.72Å; E228-R262 PolarHBondContact OE1-NH1 3.12Å; E228-R262 IonicContact OE1-NH2 3.52Å; E228-R262 IonicContact OE2-CZ 2.95Å; E228-R262 IonicContact OE2-NH1 3.61Å; E228-R262 PolarHBondContact OE2-NH1 2.98Å; E228-R262 IonicContact OE2-NH2 2.92Å; E228-R262 PolarHBondContact OE2-NH2 3.47Å; P259-R262 PolarHBondContact O-N 3.06Å; A260-R262 VanDerWaalsContact C-N 3.26Å; A260-R262 PolarHBondContact O-N 3.35Å; R262-A264 PolarHBondContact O-N 3.27Å; R262-Q265 PolarHBondContact O-N 3.04Å; R262-Q265 VanDerWaalsContact O-N 3.12Å; R262-T266 PolarHBondContact O-N 2.95Å; R262-T266 PolarHBondContact O-OG1 3.26Å; R262-T266 VanDerWaalsContact O-OG1 3.1Å
263	Q	84.8	Confident	89	Confident	69 Å²	69	48.8 Å²	48.8	32%	0.322	31%	0.307	S	S	.	.	H	α-helix	trans	-52.9	-52.3	-173.1	-167.2	177.5	41.7	0	0	112.7	K255 P259 A260 Q265 T266 L267	K255-Q263 PolarHBondContact O-NE2 2.97Å; P259-Q263 PolarHBondContact O-N 3.08Å; A260-Q263 PolarHBondContact O-N 3.35Å; Q263-Q265 VanDerWaalsContact C-N 3.34Å; Q263-Q265 PolarHBondContact O-N 3.39Å; Q263-T266 PolarHBondContact O-N 3.13Å; Q263-L267 HydrophobicContact CG-CD1 4.08Å; Q263-L267 HydrophobicContact CG-CG 4.36Å; Q263-L267 WeakPolarHBondContact O-CB 3.49Å; Q263-L267 VanDerWaalsContact O-CG 3.23Å; Q263-L267 WeakPolarHBondContact O-CG 3.38Å; Q263-L267 PolarHBondContact O-N 3.38Å
264	A	86.9	Confident	89.2	Confident	60 Å²	60	47.5 Å²	47.5	50%	0.496	30%	0.3	S	S	.	.	H	α-helix	trans	-60.5	-41.3	179.8	0	0	0	0	0	113.1	R262 N268	R262-A264 PolarHBondContact O-N 3.27Å; A264-N268 WeakPolarHBondContact O-CB 3.27Å; A264-N268 PolarHBondContact O-N 3.29Å
265	Q	89.1	Confident	89.7	Confident	137 Å²	137	47.6 Å²	47.6	64%	0.64	30%	0.302	S	S	*	.	H	α-helix	trans	-65.8	-45.9	177.5	-176	-176.8	11.3	0	0	111.3	R262 Q263 N268 A269	R262-Q265 PolarHBondContact O-N 3.04Å; R262-Q265 VanDerWaalsContact O-N 3.12Å; Q263-Q265 VanDerWaalsContact C-N 3.34Å; Q263-Q265 PolarHBondContact O-N 3.39Å; Q265-N268 PolarHBondContact O-N 3.1Å; Q265-A269 PolarHBondContact O-N 3.4Å
266	T	89.5	Confident	90.1	Very high	16 Å²	16	51.5 Å²	51.5	10%	0.098	32%	0.32	C	S	.	.	H	α-helix	trans	-63.6	-44.7	178.6	-59.5	0	0	0	0	111.1	V251 L258 R262 Q263 N268 A269 V270	V251-T266 HydrophobicContact CG1-CG2 3.3Å; L258-T266 HydrophobicContact CD1-CG2 3.68Å; L258-T266 HydrophobicContact CD2-CG2 4.48Å; R262-T266 PolarHBondContact O-N 2.95Å; R262-T266 PolarHBondContact O-OG1 3.26Å; R262-T266 VanDerWaalsContact O-OG1 3.1Å; Q263-T266 PolarHBondContact O-N 3.13Å; T266-N268 VanDerWaalsContact C-N 3.33Å; T266-N268 PolarHBondContact O-N 2.67Å; T266-A269 WeakPolarHBondContact O-CB 3.47Å; T266-A269 PolarHBondContact O-N 3.45Å; T266-A269 VanDerWaalsContact O-N 3.17Å; T266-V270 WeakPolarHBondContact O-CG2 3.09Å; T266-V270 PolarHBondContact O-N 3.29Å
267	L	90.4	Very high	90.7	Very high	13 Å²	13	47.1 Å²	47.1	7%	0.068	28%	0.284	C	S	.	.	H	α-helix	trans	-61.2	-41.6	175.6	-70.6	-179.2	0	0	0	111.8	W252 K255 Q263 A269 V270 V271 V416	W252-L267 HydrophobicContact CE3-CD2 3.61Å; W252-L267 HydrophobicContact CZ3-CD2 3.56Å; K255-L267 HydrophobicContact CB-CD2 4.48Å; Q263-L267 HydrophobicContact CG-CD1 4.08Å; Q263-L267 HydrophobicContact CG-CG 4.36Å; Q263-L267 WeakPolarHBondContact O-CB 3.49Å; Q263-L267 VanDerWaalsContact O-CG 3.23Å; Q263-L267 WeakPolarHBondContact O-CG 3.38Å; Q263-L267 PolarHBondContact O-N 3.38Å; L267-A269 VanDerWaalsContact C-N 3.32Å; L267-A269 PolarHBondContact O-N 3.38Å; L267-V270 PolarHBondContact O-N 3.4Å; L267-V271 WeakPolarHBondContact O-CG2 3.24Å; L267-V271 PolarHBondContact O-N 2.91Å; L267-V416 HydrophobicContact CD1-CG2 4.2Å
268	N	93.2	Very high	91.4	Very high	62 Å²	62	44.8 Å²	44.8	33%	0.332	27%	0.267	S	S	.	.	H	α-helix	trans	-62.5	-40.1	175.2	-167.8	-84.9	0	0	0	112	A264 Q265 T266 V271 A272 H423	A264-N268 WeakPolarHBondContact O-CB 3.27Å; A264-N268 PolarHBondContact O-N 3.29Å; Q265-N268 PolarHBondContact O-N 3.1Å; T266-N268 VanDerWaalsContact C-N 3.33Å; T266-N268 PolarHBondContact O-N 2.67Å; N268-V271 PolarHBondContact O-N 3.48Å; N268-A272 VanDerWaalsContact O-CB 3.31Å; N268-A272 WeakPolarHBondContact O-CB 3.45Å; N268-A272 PolarHBondContact O-N 3.1Å; N268-H423 PolarHBondContact OD1-NE2 2.91Å
269	A	94.4	Very high	92	Very high	33 Å²	33	48.7 Å²	48.7	27%	0.273	29%	0.288	S	S	.	.	H	α-helix	trans	-66.5	-38.8	176.6	0	0	0	0	0	112.7	Q265 T266 L267 A272 T273	Q265-A269 PolarHBondContact O-N 3.4Å; T266-A269 WeakPolarHBondContact O-CB 3.47Å; T266-A269 PolarHBondContact O-N 3.45Å; T266-A269 VanDerWaalsContact O-N 3.17Å; L267-A269 VanDerWaalsContact C-N 3.32Å; L267-A269 PolarHBondContact O-N 3.38Å; A269-A272 PolarHBondContact O-N 3.42Å; A269-T273 PolarHBondContact O-N 3.06Å; A269-T273 PolarHBondContact O-OG1 3.23Å
270	V	96.6	Very high	92.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.5	-55.7	171.4	170.6	0	0	0	0	109.2	A248 V251 T266 L267 A272 T273 L274 M372	A248-V270 HydrophobicContact CB-CG1 4Å; V251-V270 HydrophobicContact CB-CG2 4.05Å; V251-V270 HydrophobicContact CG1-CG2 3.65Å; T266-V270 WeakPolarHBondContact O-CG2 3.09Å; T266-V270 PolarHBondContact O-N 3.29Å; L267-V270 PolarHBondContact O-N 3.4Å; V270-A272 VanDerWaalsContact C-N 3.31Å; V270-A272 PolarHBondContact O-N 3.02Å; V270-T273 VanDerWaalsContact O-CB 3.32Å; V270-T273 WeakPolarHBondContact O-CB 3.26Å; V270-T273 PolarHBondContact O-N 3.47Å; V270-L274 HydrophobicContact CG1-CD1 4.37Å; V270-L274 WeakPolarHBondContact O-CG 3.33Å; V270-L274 PolarHBondContact O-N 3.16Å; V270-M372 HydrophobicContact CG1-CE 3.41Å; V270-M372 VanDerWaalsContact CG1-CE 3.41Å
271	V	97.3	Very high	93.2	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.024	26%	0.259	C	S	.	.	H	α-helix	trans	-61.7	-37.8	-178.7	177.8	0	0	0	0	112.1	L267 N268 T273 L274 S275 M372 A419 L420 H423 I425	L267-V271 WeakPolarHBondContact O-CG2 3.24Å; L267-V271 PolarHBondContact O-N 2.91Å; N268-V271 PolarHBondContact O-N 3.48Å; V271-T273 VanDerWaalsContact C-N 3.29Å; V271-T273 PolarHBondContact O-N 3.17Å; V271-L274 PolarHBondContact O-N 3.32Å; V271-S275 WeakPolarHBondContact O-CB 3.42Å; V271-S275 PolarHBondContact O-N 3.15Å; V271-M372 HydrophobicContact CG2-CE 4.21Å; V271-M372 HydrophobicContact CG2-SD 4.07Å; V271-A419 HydrophobicContact CB-CB 4.13Å; V271-A419 HydrophobicContact CG1-CB 4.35Å; V271-A419 HydrophobicContact CG2-CB 3.88Å; V271-L420 HydrophobicContact CG1-CD2 4.08Å; V271-L420 HydrophobicContact CG2-CD2 4.22Å; V271-H423 HydrophobicContact CG1-CB 3.91Å; V271-I425 HydrophobicContact CG1-CD1 4.21Å; V271-I425 HydrophobicContact CG1-CG1 3.87Å
272	A	97.2	Very high	93.7	Very high	17 Å²	17	41.8 Å²	41.8	14%	0.14	22%	0.222	C	C	.	.	H	α-helix	trans	-59.1	-41	174	0	0	0	0	0	112	N268 A269 V270 S275 Q276 H423	N268-A272 VanDerWaalsContact O-CB 3.31Å; N268-A272 WeakPolarHBondContact O-CB 3.45Å; N268-A272 PolarHBondContact O-N 3.1Å; A269-A272 PolarHBondContact O-N 3.42Å; V270-A272 VanDerWaalsContact C-N 3.31Å; V270-A272 PolarHBondContact O-N 3.02Å; A272-S275 WeakPolarHBondContact O-CB 3.42Å; A272-S275 PolarHBondContact O-N 3.03Å; A272-Q276 VanDerWaalsContact O-CG 3.29Å; A272-Q276 WeakPolarHBondContact O-CG 3.44Å; A272-Q276 PolarHBondContact O-N 3.15Å; A272-H423 VanDerWaalsContact CB-CE1 3.4Å; A272-H423 WeakPolarHBondContact CB-CE1 3.22Å
273	T	97.6	Very high	94.2	Very high	12 Å²	12	36.4 Å²	36.4	7%	0.074	20%	0.202	C	C	.	.	H	α-helix	trans	-65.1	-46.7	177.9	-57.7	0	0	0	0	111.3	L231 R244 A248 A269 V270 V271 S275 Q276 C277	L231-T273 HydrophobicContact CD2-CG2 4.22Å; R244-T273 HydrophobicContact CB-CG2 3.73Å; A248-T273 HydrophobicContact CB-CG2 4.21Å; A269-T273 PolarHBondContact O-N 3.06Å; A269-T273 PolarHBondContact O-OG1 3.23Å; V270-T273 VanDerWaalsContact O-CB 3.32Å; V270-T273 WeakPolarHBondContact O-CB 3.26Å; V270-T273 PolarHBondContact O-N 3.47Å; V271-T273 VanDerWaalsContact C-N 3.29Å; V271-T273 PolarHBondContact O-N 3.17Å; T273-S275 VanDerWaalsContact C-N 3.3Å; T273-S275 PolarHBondContact O-N 2.85Å; T273-Q276 PolarHBondContact O-N 3Å; T273-C277 PolarHBondContact O-N 2.95Å
274	L	98.3	Very high	94.6	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-62.6	-41.7	176.8	-54.2	-175.7	0	0	0	110.8	T245 A248 V270 V271 Q276 C277 L278 I368 I369 M372	T245-L274 HydrophobicContact CG2-CD2 4.06Å; A248-L274 HydrophobicContact CB-CD2 4.07Å; V270-L274 HydrophobicContact CG1-CD1 4.37Å; V270-L274 WeakPolarHBondContact O-CG 3.33Å; V270-L274 PolarHBondContact O-N 3.16Å; V271-L274 PolarHBondContact O-N 3.32Å; L274-Q276 PolarHBondContact O-N 2.75Å; L274-C277 WeakPolarHBondContact O-CB 3.49Å; L274-C277 PolarHBondContact O-N 3.19Å; L274-L278 WeakPolarHBondContact O-CG 3.41Å; L274-L278 PolarHBondContact O-N 3.37Å; L274-I368 HydrophobicContact CD1-CB 4.04Å; L274-I368 HydrophobicContact CD1-CG2 3.59Å; L274-I368 HydrophobicContact CD2-CD1 3.96Å; L274-I369 HydrophobicContact CB-CD1 4.4Å; L274-I369 HydrophobicContact CD1-CD1 4.41Å; L274-I369 HydrophobicContact CD1-CG1 3.77Å; L274-M372 HydrophobicContact CD1-CE 3.87Å; L274-M372 HydrophobicContact CD1-SD 4.37Å
275	S	98.2	Very high	95	Very high	4 Å²	4	34.2 Å²	34.2	3%	0.028	19%	0.186	C	C	.	.	H	α-helix	trans	-58.5	-45.8	177.5	-170.9	0	0	0	0	112.3	V271 A272 T273 C277 L278 D279 H423 K428	V271-S275 WeakPolarHBondContact O-CB 3.42Å; V271-S275 PolarHBondContact O-N 3.15Å; A272-S275 WeakPolarHBondContact O-CB 3.42Å; A272-S275 PolarHBondContact O-N 3.03Å; T273-S275 VanDerWaalsContact C-N 3.3Å; T273-S275 PolarHBondContact O-N 2.85Å; S275-C277 VanDerWaalsContact C-N 3.33Å; S275-C277 PolarHBondContact O-N 3Å; S275-L278 PolarHBondContact O-N 2.82Å; S275-D279 PolarHBondContact O-N 3.39Å; S275-D279 VanDerWaalsContact O-N 3.13Å; S275-H423 PolarHBondContact OG-O 3.38Å; S275-K428 WeakPolarHBondContact OG-CE 3.17Å; S275-K428 PolarHBondContact OG-NZ 3.47Å
276	Q	96.7	Very high	95.3	Very high	116 Å²	116	27.7 Å²	27.7	54%	0.542	16%	0.155	S	C	.	.	H	α-helix	trans	-62.9	-37.3	176.3	-72	168.7	18.3	0	0	112.5	A272 T273 L274 D279	A272-Q276 VanDerWaalsContact O-CG 3.29Å; A272-Q276 WeakPolarHBondContact O-CG 3.44Å; A272-Q276 PolarHBondContact O-N 3.15Å; T273-Q276 PolarHBondContact O-N 3Å; L274-Q276 PolarHBondContact O-N 2.75Å; Q276-D279 PolarHBondContact O-N 3.34Å
277	C	97.1	Very high	95.5	Very high	1 Å²	1	27 Å²	27	1%	0.007	15%	0.151	C	C	.	.	H	α-helix	trans	-65.7	-42.4	175.6	-178.9	0	0	0	0	111.9	I241 T273 L274 S275 D279 L280 A361 Q362	I241-C277 HydrophobicContact CG2-CB 3.98Å; T273-C277 PolarHBondContact O-N 2.95Å; L274-C277 WeakPolarHBondContact O-CB 3.49Å; L274-C277 PolarHBondContact O-N 3.19Å; S275-C277 VanDerWaalsContact C-N 3.33Å; S275-C277 PolarHBondContact O-N 3Å; C277-D279 VanDerWaalsContact C-N 3.27Å; C277-D279 PolarHBondContact O-N 3.5Å; C277-L280 PolarHBondContact O-N 2.98Å; C277-A361 VanDerWaalsContact SG-CB 3.5Å; C277-A361 PolarHBondContact SG-O 3.11Å; C277-Q362 PolarHBondContact O-NE2 3.43Å
278	L	97.9	Very high	95.7	Very high	5 Å²	5	31.1 Å²	31.1	3%	0.026	17%	0.17	C	C	.	.	H	α-helix	trans	-70.2	-20.3	179.6	-64.2	179.5	0	0	0	113.4	L274 S275 L280 L366 I369 I425 K428 V429 K432	L274-L278 WeakPolarHBondContact O-CG 3.41Å; L274-L278 PolarHBondContact O-N 3.37Å; S275-L278 PolarHBondContact O-N 2.82Å; L278-L280 PolarHBondContact O-N 3.16Å; L278-L366 HydrophobicContact CD1-CD2 4.34Å; L278-L366 HydrophobicContact CD2-CD2 3.84Å; L278-L366 HydrophobicContact CD2-CG 3.96Å; L278-I369 HydrophobicContact CD1-CD1 3.67Å; L278-I425 HydrophobicContact CD1-CD1 4.34Å; L278-K428 HydrophobicContact CB-CB 4.17Å; L278-K428 HydrophobicContact CB-CD 4.5Å; L278-V429 HydrophobicContact CD1-CG2 4.13Å; L278-K432 HydrophobicContact CD2-CG 4.35Å; L278-K432 WeakPolarHBondContact O-CE 3.23Å; L278-K432 PolarHBondContact O-NZ 3.06Å
279	D	96.5	Very high	95.7	Very high	96 Å²	96	29.6 Å²	29.6	51%	0.513	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-20.3	175.4	-77	-29	0	0	0	114	S275 Q276 C277 D281 K428	S275-D279 PolarHBondContact O-N 3.39Å; S275-D279 VanDerWaalsContact O-N 3.13Å; Q276-D279 PolarHBondContact O-N 3.34Å; C277-D279 VanDerWaalsContact C-N 3.27Å; C277-D279 PolarHBondContact O-N 3.5Å; D279-D281 PolarHBondContact O-N 3.34Å; D279-K428 VanDerWaalsContact OD1-CD 3.27Å; D279-K428 WeakPolarHBondContact OD1-CD 3.04Å; D279-K428 WeakPolarHBondContact OD1-CE 3.44Å; D279-K428 IonicContact OD1-NZ 3.15Å; D279-K428 PolarHBondContact OD1-NZ 3.01Å; D279-K428 IonicContact OD2-NZ 2.69Å; D279-K428 PolarHBondContact OD2-NZ 3.34Å
280	L	95.9	Very high	95.6	Very high	41 Å²	41	29.9 Å²	29.9	22%	0.215	16%	0.156	C	C	.	.	S	Bend	trans	-76.4	119.9	-173.7	-61.2	168.6	0	0	0	111.4	M238 I241 C277 L278 A282 L285 L358 Q362 K432	M238-L280 HydrophobicContact SD-CD1 4Å; I241-L280 HydrophobicContact CD1-CD1 3.42Å; I241-L280 VanDerWaalsContact CD1-CD1 3.42Å; I241-L280 HydrophobicContact CG1-CD1 4.38Å; I241-L280 HydrophobicContact CG2-CD1 4.13Å; C277-L280 PolarHBondContact O-N 2.98Å; L278-L280 PolarHBondContact O-N 3.16Å; L280-A282 PolarHBondContact O-N 3.48Å; L280-L285 HydrophobicContact CB-CD1 3.87Å; L280-L285 HydrophobicContact CD2-CD1 4.28Å; L280-L358 HydrophobicContact CB-CD1 3.73Å; L280-L358 HydrophobicContact CD1-CD1 3.75Å; L280-L358 HydrophobicContact CG-CD1 4.41Å; L280-Q362 PolarHBondContact O-NE2 2.92Å; L280-K432 PolarHBondContact O-NZ 3.5Å
281	D	94.6	Very high	95.3	Very high	70 Å²	70	35.5 Å²	35.5	37%	0.374	18%	0.177	S	C	.	.			trans	-82.8	103.5	179.5	-169.9	-9.2	0	0	0	111.9	D279 G283 V284 L285	D279-D281 PolarHBondContact O-N 3.34Å; D281-G283 PolarHBondContact O-N 3.01Å; D281-G283 WeakPolarHBondContact OD1-CA 3.45Å; D281-G283 PolarHBondContact OD1-N 3.45Å; D281-V284 HydrophobicContact CB-CB 4.28Å; D281-V284 HydrophobicContact CB-CG2 4.19Å; D281-V284 PolarHBondContact O-N 2.86Å; D281-V284 VanDerWaalsContact O-N 3.08Å; D281-L285 WeakPolarHBondContact O-CG 3.38Å; D281-L285 PolarHBondContact O-N 3.33Å
282	A	93.4	Very high	95	Very high	5 Å²	5	37.3 Å²	37.3	4%	0.041	19%	0.192	C	C	.	.	H	α-helix	trans	-61.1	-29.2	176.1	0	0	0	0	0	112.7	L280 V284 I286 L358 L359	L280-A282 PolarHBondContact O-N 3.48Å; A282-V284 PolarHBondContact O-N 2.93Å; A282-I286 HydrophobicContact CB-CD1 4.16Å; A282-I286 VanDerWaalsContact O-CB 3.3Å; A282-I286 WeakPolarHBondContact O-CB 3.37Å; A282-I286 WeakPolarHBondContact O-CG1 3.35Å; A282-I286 PolarHBondContact O-N 2.97Å; A282-I286 VanDerWaalsContact O-N 3.11Å; A282-L358 HydrophobicContact CB-CD2 4.12Å; A282-L359 HydrophobicContact CB-CD2 3.86Å
283	G	92.2	Very high	94.7	Very high	2 Å²	2	36.6 Å²	36.6	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-67.7	-18.7	176.4	0	0	0	0	0	113.9	D281	D281-G283 PolarHBondContact O-N 3.01Å; D281-G283 WeakPolarHBondContact OD1-CA 3.45Å; D281-G283 PolarHBondContact OD1-N 3.45Å
284	V	94.4	Very high	94.1	Very high	51 Å²	51	38.9 Å²	38.9	31%	0.309	20%	0.196	S	C	.	.	H	α-helix	trans	-100	-47.2	175.2	175.2	0	0	0	0	110.8	D281 A282 I286 P287 E288	D281-V284 HydrophobicContact CB-CB 4.28Å; D281-V284 HydrophobicContact CB-CG2 4.19Å; D281-V284 PolarHBondContact O-N 2.86Å; D281-V284 VanDerWaalsContact O-N 3.08Å; A282-V284 PolarHBondContact O-N 2.93Å; V284-I286 PolarHBondContact O-N 3.36Å; V284-P287 WeakPolarHBondContact O-CD 3.46Å; V284-E288 WeakPolarHBondContact CG1-OE1 3.24Å; V284-E288 WeakPolarHBondContact O-CG 3.13Å; V284-E288 PolarHBondContact O-N 2.88Å
285	L	95.1	Very high	93.5	Very high	33 Å²	33	40.9 Å²	40.9	17%	0.173	21%	0.212	C	C	.	.	H	α-helix	trans	-69.2	-36	-173	-68.1	169.6	0	0	0	113.2	M238 L280 D281 E288 L289 L358	M238-L285 HydrophobicContact CE-CD1 4.14Å; L280-L285 HydrophobicContact CB-CD1 3.87Å; L280-L285 HydrophobicContact CD2-CD1 4.28Å; D281-L285 WeakPolarHBondContact O-CG 3.38Å; D281-L285 PolarHBondContact O-N 3.33Å; L285-E288 PolarHBondContact O-N 3.31Å; L285-L289 WeakPolarHBondContact O-CB 3.43Å; L285-L289 VanDerWaalsContact O-CG 3.3Å; L285-L289 WeakPolarHBondContact O-CG 3.46Å; L285-L289 PolarHBondContact O-N 3.32Å; L285-L358 HydrophobicContact CB-CD2 3.91Å; L285-L358 HydrophobicContact CD1-CD1 4.38Å; L285-L358 HydrophobicContact CD1-CD2 3.78Å
286	I	94.4	Very high	92.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.4	-50.5	179.5	-72.8	172.1	0	0	0	111.4	A282 V284 E288 L289 R290 A355 L359 V443 W450 M457	A282-I286 HydrophobicContact CB-CD1 4.16Å; A282-I286 VanDerWaalsContact O-CB 3.3Å; A282-I286 WeakPolarHBondContact O-CB 3.37Å; A282-I286 WeakPolarHBondContact O-CG1 3.35Å; A282-I286 PolarHBondContact O-N 2.97Å; A282-I286 VanDerWaalsContact O-N 3.11Å; V284-I286 PolarHBondContact O-N 3.36Å; I286-E288 VanDerWaalsContact C-N 3.29Å; I286-E288 PolarHBondContact O-N 2.95Å; I286-L289 PolarHBondContact O-N 2.95Å; I286-R290 PolarHBondContact O-N 3.5Å; I286-A355 HydrophobicContact CG1-CB 4.47Å; I286-L359 HydrophobicContact CD1-CD1 4.11Å; I286-L359 HydrophobicContact CD1-CD2 4.25Å; I286-L359 HydrophobicContact CD1-CG 4.4Å; I286-V443 HydrophobicContact CG2-CG1 4.47Å; I286-W450 HydrophobicContact CG2-CE3 4.19Å; I286-W450 HydrophobicContact CG2-CZ3 3.97Å; I286-M457 HydrophobicContact CD1-CE 4.49Å; I286-M457 HydrophobicContact CD1-CG 4.06Å; I286-M457 HydrophobicContact CD1-SD 3.53Å; I286-M457 VanDerWaalsContact CD1-SD 3.53Å
287	P	93.8	Very high	92	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.013	23%	0.227	C	C	.	.	H	α-helix	trans	-56.5	-38.5	170.8	-28.5	34.4	0	0	0	114.1	V284 R290 R291 E439 A440	V284-P287 WeakPolarHBondContact O-CD 3.46Å; P287-R290 PolarHBondContact O-N 2.7Å; P287-R291 WeakPolarHBondContact O-CG 3.39Å; P287-R291 PolarHBondContact O-N 2.99Å; P287-R291 PolarHBondContact O-NH1 2.93Å; P287-E439 HydrophobicContact CB-CG 4.32Å; P287-E439 HydrophobicContact CG-CG 4.08Å; P287-A440 HydrophobicContact CG-CB 3.96Å
288	E	94.6	Very high	91.1	Very high	98 Å²	98	51.6 Å²	51.6	46%	0.458	26%	0.257	S	S	.	.	H	α-helix	trans	-64.3	-47	177.5	-73.9	176.5	173.4	0	0	112.5	V284 L285 I286 R290 R291 A292	V284-E288 WeakPolarHBondContact CG1-OE1 3.24Å; V284-E288 WeakPolarHBondContact O-CG 3.13Å; V284-E288 PolarHBondContact O-N 2.88Å; L285-E288 PolarHBondContact O-N 3.31Å; I286-E288 VanDerWaalsContact C-N 3.29Å; I286-E288 PolarHBondContact O-N 2.95Å; E288-R290 VanDerWaalsContact C-N 3.3Å; E288-R290 PolarHBondContact O-N 3.38Å; E288-R291 PolarHBondContact O-N 3.28Å; E288-A292 PolarHBondContact O-N 3.34Å
289	L	93.9	Very high	89.9	Confident	30 Å²	30	56.1 Å²	56.1	16%	0.157	28%	0.281	C	S	.	.	H	α-helix	trans	-60.9	-40.4	175.9	-72.3	169.6	0	0	0	111.2	L285 I286 R291 A292 E293 E351 E354 A355 W450	L285-L289 WeakPolarHBondContact O-CB 3.43Å; L285-L289 VanDerWaalsContact O-CG 3.3Å; L285-L289 WeakPolarHBondContact O-CG 3.46Å; L285-L289 PolarHBondContact O-N 3.32Å; I286-L289 PolarHBondContact O-N 2.95Å; L289-R291 PolarHBondContact O-N 2.92Å; L289-A292 WeakPolarHBondContact O-CB 3.28Å; L289-A292 PolarHBondContact O-N 2.91Å; L289-E293 PolarHBondContact O-N 3.27Å; L289-E351 HydrophobicContact CB-CB 4.2Å; L289-E351 HydrophobicContact CD2-CB 4.39Å; L289-E351 HydrophobicContact CD2-CG 4.48Å; L289-E351 WeakPolarHBondContact O-CG 3.39Å; L289-E354 HydrophobicContact CD1-CB 4.2Å; L289-E354 HydrophobicContact CD2-CB 4.02Å; L289-A355 HydrophobicContact CD1-CB 3.8Å; L289-W450 HydrophobicContact CB-CH2 3.83Å; L289-W450 HydrophobicContact CB-CZ3 4.45Å
290	R	91.3	Very high	88.7	Confident	39 Å²	39	56.1 Å²	56.1	15%	0.147	29%	0.285	C	S	.	.	H	α-helix	trans	-61.4	-45.6	174.8	177.1	66.6	-170.2	152.5	6.1	112.4	I286 P287 E288 A292 E293 E294 V443 N447 W450	I286-R290 PolarHBondContact O-N 3.5Å; P287-R290 PolarHBondContact O-N 2.7Å; E288-R290 VanDerWaalsContact C-N 3.3Å; E288-R290 PolarHBondContact O-N 3.38Å; R290-A292 VanDerWaalsContact C-N 3.25Å; R290-A292 PolarHBondContact O-N 3.06Å; R290-E293 IonicContact CZ-OE2 3.78Å; R290-E293 IonicContact NH1-OE2 3.14Å; R290-E293 PolarHBondContact NH1-OE2 3.05Å; R290-E293 PolarHBondContact O-N 3.44Å; R290-E294 IonicContact CZ-OE1 3.88Å; R290-E294 VanDerWaalsContact CZ-OE1 3.23Å; R290-E294 IonicContact NE-OE1 3.29Å; R290-E294 PolarHBondContact NE-OE1 3.45Å; R290-E294 IonicContact NH2-OE1 2.71Å; R290-E294 PolarHBondContact NH2-OE1 3.37Å; R290-E294 WeakPolarHBondContact O-CG 3.45Å; R290-E294 PolarHBondContact O-N 3.17Å; R290-V443 HydrophobicContact CB-CG1 3.47Å; R290-V443 VanDerWaalsContact CB-CG1 3.47Å; R290-V443 HydrophobicContact CG-CG1 3.52Å; R290-N447 PolarHBondContact NH1-ND2 2.81Å; R290-W450 HydrophobicContact CB-CH2 4.21Å; R290-W450 HydrophobicContact CB-CZ3 4.23Å
291	R	91.6	Very high	87.4	Confident	119 Å²	119	56.7 Å²	56.7	45%	0.449	30%	0.295	S	S	.	.	H	α-helix	trans	-63.7	-34.4	178.4	-69.8	-177.1	-137.9	101.3	-4.6	111.5	P287 E288 L289 A295 E439	P287-R291 WeakPolarHBondContact O-CG 3.39Å; P287-R291 PolarHBondContact O-N 2.99Å; P287-R291 PolarHBondContact O-NH1 2.93Å; E288-R291 PolarHBondContact O-N 3.28Å; L289-R291 PolarHBondContact O-N 2.92Å; R291-A295 WeakPolarHBondContact O-CB 3.44Å; R291-A295 PolarHBondContact O-N 3.39Å; R291-E439 IonicContact CZ-OE1 3.14Å; R291-E439 IonicContact NH2-OE1 2.65Å; R291-E439 PolarHBondContact NH2-OE1 2.8Å
292	A	90.9	Very high	85.8	Confident	41 Å²	41	56 Å²	56	34%	0.339	30%	0.299	S	S	.	.	H	α-helix	trans	-65.6	-46.1	174.4	0	0	0	0	0	111.9	E288 L289 R290 E294 A295 N296 E351	E288-A292 PolarHBondContact O-N 3.34Å; L289-A292 WeakPolarHBondContact O-CB 3.28Å; L289-A292 PolarHBondContact O-N 2.91Å; R290-A292 VanDerWaalsContact C-N 3.25Å; R290-A292 PolarHBondContact O-N 3.06Å; A292-E294 VanDerWaalsContact C-N 3.32Å; A292-E294 PolarHBondContact O-N 3.35Å; A292-A295 PolarHBondContact O-N 3.25Å; A292-A295 VanDerWaalsContact O-N 3.16Å; A292-N296 PolarHBondContact O-N 2.83Å; A292-E351 HydrophobicContact CB-CG 4.17Å
293	E	89.3	Confident	84.3	Confident	3 Å²	3	59.6 Å²	59.6	1%	0.014	32%	0.321	C	S	.	.	H	α-helix	trans	-57.1	-45.5	175.9	-172	-174.5	-153.4	0	0	111.2	L289 R290 A295 N296 H297 E351 W450	L289-E293 PolarHBondContact O-N 3.27Å; R290-E293 IonicContact CZ-OE2 3.78Å; R290-E293 IonicContact NH1-OE2 3.14Å; R290-E293 PolarHBondContact NH1-OE2 3.05Å; R290-E293 PolarHBondContact O-N 3.44Å; E293-A295 PolarHBondContact O-N 2.88Å; E293-N296 PolarHBondContact O-N 2.84Å; E293-H297 PolarHBondContact O-N 2.81Å; E293-E351 HydrophobicContact CB-CB 4Å; E293-E351 HydrophobicContact CB-CG 3.98Å; E293-W450 PolarHBondContact OE1-NE1 2.99Å; E293-W450 VanDerWaalsContact OE2-CE2 3.25Å; E293-W450 VanDerWaalsContact OE2-CZ2 3.3Å; E293-W450 WeakPolarHBondContact OE2-CZ2 3.33Å; E293-W450 PolarHBondContact OE2-NE1 3.15Å
294	E	86.8	Confident	82.6	Confident	60 Å²	60	61.5 Å²	61.5	28%	0.28	34%	0.336	S	S	.	.	H	α-helix	trans	-64.8	-38.5	177.5	-71.1	-179.6	-176.4	0	0	113.3	R290 A292 R298	R290-E294 IonicContact CZ-OE1 3.88Å; R290-E294 VanDerWaalsContact CZ-OE1 3.23Å; R290-E294 IonicContact NE-OE1 3.29Å; R290-E294 PolarHBondContact NE-OE1 3.45Å; R290-E294 IonicContact NH2-OE1 2.71Å; R290-E294 PolarHBondContact NH2-OE1 3.37Å; R290-E294 WeakPolarHBondContact O-CG 3.45Å; R290-E294 PolarHBondContact O-N 3.17Å; A292-E294 VanDerWaalsContact C-N 3.32Å; A292-E294 PolarHBondContact O-N 3.35Å; E294-R298 VanDerWaalsContact O-CG 3.31Å; E294-R298 WeakPolarHBondContact O-CG 3.5Å; E294-R298 PolarHBondContact O-N 3.32Å; E294-R298 VanDerWaalsContact O-N 3.07Å; E294-R298 IonicContact OE2-NH2 2.67Å; E294-R298 PolarHBondContact OE2-NH2 3.28Å
295	A	85.9	Confident	80.6	Confident	42 Å²	42	66.3 Å²	66.3	35%	0.347	36%	0.355	S	S	.	.	H	α-helix	trans	-65.9	-41.1	176.2	0	0	0	0	0	111.1	R291 A292 E293 R298 N299	R291-A295 WeakPolarHBondContact O-CB 3.44Å; R291-A295 PolarHBondContact O-N 3.39Å; A292-A295 PolarHBondContact O-N 3.25Å; A292-A295 VanDerWaalsContact O-N 3.16Å; E293-A295 PolarHBondContact O-N 2.88Å; A295-R298 PolarHBondContact O-N 3.47Å; A295-N299 WeakPolarHBondContact O-CB 3.17Å; A295-N299 PolarHBondContact O-N 2.97Å; A295-N299 PolarHBondContact O-ND2 3.19Å
296	N	83.7	Confident	78.6	Confident	77 Å²	77	68.4 Å²	68.4	41%	0.412	38%	0.377	S	S	.	.	H	α-helix	trans	-63.8	-46.9	176.9	-75	-17.3	0	0	0	111.2	A292 E293 R298 N299 T300 E351	A292-N296 PolarHBondContact O-N 2.83Å; E293-N296 PolarHBondContact O-N 2.84Å; N296-R298 VanDerWaalsContact C-N 3.34Å; N296-R298 PolarHBondContact O-N 3.48Å; N296-N299 PolarHBondContact O-N 3.39Å; N296-T300 PolarHBondContact O-N 2.86Å; N296-T300 PolarHBondContact O-OG1 3.32Å; N296-E351 PolarHBondContact ND2-OE1 3.15Å
297	H	79.6	Confident	76.4	Confident	103 Å²	103	75 Å²	75	48%	0.477	41%	0.408	S	S	.	.	H	α-helix	trans	-58.8	-42.2	174.9	-71.8	177.9	0	0	0	113.1	E293 T300 A301	E293-H297 PolarHBondContact O-N 2.81Å; H297-T300 PolarHBondContact O-N 3.11Å; H297-A301 WeakPolarHBondContact O-CB 3.42Å; H297-A301 PolarHBondContact O-N 3.49Å
298	R	77	Confident	74	Confident	166 Å²	166	82.3 Å²	82.3	63%	0.626	44%	0.442	S	S	*	.	H	α-helix	trans	-64.5	-39.4	176.7	-71.9	176.7	-157.9	163.8	11.3	112.3	E294 A295 N296 A302	E294-R298 VanDerWaalsContact O-CG 3.31Å; E294-R298 WeakPolarHBondContact O-CG 3.5Å; E294-R298 PolarHBondContact O-N 3.32Å; E294-R298 VanDerWaalsContact O-N 3.07Å; E294-R298 IonicContact OE2-NH2 2.67Å; E294-R298 PolarHBondContact OE2-NH2 3.28Å; A295-R298 PolarHBondContact O-N 3.47Å; N296-R298 VanDerWaalsContact C-N 3.34Å; N296-R298 PolarHBondContact O-N 3.48Å; R298-A302 WeakPolarHBondContact O-CB 3.33Å; R298-A302 PolarHBondContact O-N 2.98Å
299	N	73.9	Confident	71.6	Confident	101 Å²	101	80.8 Å²	80.8	54%	0.54	45%	0.453	S	S	.	.	H	α-helix	trans	-67.6	-43.1	178.2	-70	-22.5	0	0	0	111.3	A295 N296 A302 V303	A295-N299 WeakPolarHBondContact O-CB 3.17Å; A295-N299 PolarHBondContact O-N 2.97Å; A295-N299 PolarHBondContact O-ND2 3.19Å; N296-N299 PolarHBondContact O-N 3.39Å; N299-A302 PolarHBondContact O-N 3.04Å; N299-V303 VanDerWaalsContact O-CG2 3.29Å; N299-V303 WeakPolarHBondContact O-CG2 3.41Å; N299-V303 PolarHBondContact O-N 3.37Å
300	T	70.8	Confident	69	Low	96 Å²	96	87.9 Å²	87.9	59%	0.589	49%	0.485	S	S	*	.	H	α-helix	trans	-64	-41.6	176.4	-46.1	0	0	0	0	111.6	N296 H297 V303 A304	N296-T300 PolarHBondContact O-N 2.86Å; N296-T300 PolarHBondContact O-OG1 3.32Å; H297-T300 PolarHBondContact O-N 3.11Å; T300-V303 PolarHBondContact O-N 3.03Å; T300-A304 WeakPolarHBondContact O-CB 3.49Å; T300-A304 PolarHBondContact O-N 3.34Å
301	A	68.3	Low	66.1	Low	52 Å²	52	91.1 Å²	91.1	43%	0.43	52%	0.52	S	S	.	.	H	α-helix	trans	-62.9	-41.9	174.8	0	0	0	0	0	112.5	H297 V303 A304 E305	H297-A301 WeakPolarHBondContact O-CB 3.42Å; H297-A301 PolarHBondContact O-N 3.49Å; A301-V303 VanDerWaalsContact C-N 3.34Å; A301-V303 PolarHBondContact O-N 2.89Å; A301-A304 PolarHBondContact O-N 3.26Å; A301-E305 WeakPolarHBondContact O-CG 3.31Å; A301-E305 PolarHBondContact O-N 3.46Å
302	A	61.9	Low	63.3	Low	56 Å²	56	89.9 Å²	89.9	46%	0.463	54%	0.535	S	S	.	.	H	α-helix	trans	-67	-32.8	176.9	0	0	0	0	0	113.1	R298 N299 A306	R298-A302 WeakPolarHBondContact O-CB 3.33Å; R298-A302 PolarHBondContact O-N 2.98Å; N299-A302 PolarHBondContact O-N 3.04Å; A302-A306 WeakPolarHBondContact O-CB 3.42Å; A302-A306 PolarHBondContact O-N 3.17Å; A302-A306 VanDerWaalsContact O-N 3.15Å
303	V	60.7	Low	60.7	Low	81 Å²	81	94.5 Å²	94.5	49%	0.491	56%	0.559	S	S	.	*	H	α-helix	trans	-71.1	-42.5	173.4	173.7	0	0	0	0	110.7	N299 T300 A301 E305 A306 E307	N299-V303 VanDerWaalsContact O-CG2 3.29Å; N299-V303 WeakPolarHBondContact O-CG2 3.41Å; N299-V303 PolarHBondContact O-N 3.37Å; T300-V303 PolarHBondContact O-N 3.03Å; A301-V303 VanDerWaalsContact C-N 3.34Å; A301-V303 PolarHBondContact O-N 2.89Å; V303-E305 VanDerWaalsContact C-N 3.34Å; V303-E305 PolarHBondContact O-N 2.97Å; V303-A306 PolarHBondContact O-N 2.96Å; V303-A306 VanDerWaalsContact O-N 3.12Å; V303-E307 HydrophobicContact CG1-CG 4.47Å; V303-E307 WeakPolarHBondContact O-CG 3.4Å; V303-E307 PolarHBondContact O-N 3.35Å
304	A	55.9	Low	57.7	Low	41 Å²	41	103.3 Å²	103.3	34%	0.339	60%	0.6	S	S	.	*	H	α-helix	trans	-62.6	-38.5	175.3	0	0	0	0	0	112.5	T300 A301 A306 E307 Q308	T300-A304 WeakPolarHBondContact O-CB 3.49Å; T300-A304 PolarHBondContact O-N 3.34Å; A301-A304 PolarHBondContact O-N 3.26Å; A304-A306 VanDerWaalsContact C-N 3.34Å; A304-E307 PolarHBondContact O-N 3.41Å; A304-Q308 VanDerWaalsContact O-CG 3.26Å; A304-Q308 WeakPolarHBondContact O-CG 3.31Å; A304-Q308 PolarHBondContact O-N 3.17Å
305	E	53.8	Low	55.1	Low	152 Å²	152	106.2 Å²	106.2	71%	0.71	62%	0.624	S	S	*	*	H	α-helix	trans	-67.9	-30.6	173.3	-75.6	-175.1	172.2	0	0	113	A301 V303	A301-E305 WeakPolarHBondContact O-CG 3.31Å; A301-E305 PolarHBondContact O-N 3.46Å; V303-E305 VanDerWaalsContact C-N 3.34Å; V303-E305 PolarHBondContact O-N 2.97Å
306	A	53.3	Low	52.3	Low	77 Å²	77	108.6 Å²	108.6	64%	0.636	64%	0.644	S	S	*	*	H	α-helix	trans	-76.3	-32	175.3	0	0	0	0	0	112.8	A302 V303 A304	A302-A306 WeakPolarHBondContact O-CB 3.42Å; A302-A306 PolarHBondContact O-N 3.17Å; A302-A306 VanDerWaalsContact O-N 3.15Å; V303-A306 PolarHBondContact O-N 2.96Å; V303-A306 VanDerWaalsContact O-N 3.12Å; A304-A306 VanDerWaalsContact C-N 3.34Å
307	E	48.1	Very low	49.6	Very low	140 Å²	140	114.1 Å²	114.1	65%	0.654	67%	0.667	S	S	*	*	H	α-helix	trans	-81.6	-23.3	177.5	-70.7	-176.8	166.1	0	0	113	V303 A304 G309 E310	V303-E307 HydrophobicContact CG1-CG 4.47Å; V303-E307 WeakPolarHBondContact O-CG 3.4Å; V303-E307 PolarHBondContact O-N 3.35Å; A304-E307 PolarHBondContact O-N 3.41Å; E307-G309 PolarHBondContact O-N 3.48Å; E307-E310 PolarHBondContact O-N 3.49Å
308	Q	43.2	Very low	47.1	Very low	155 Å²	155	118.2 Å²	118.2	72%	0.724	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	1.2	171.4	-77.1	173.7	28.3	0	0	114.5	A304 E310	A304-Q308 VanDerWaalsContact O-CG 3.26Å; A304-Q308 WeakPolarHBondContact O-CG 3.31Å; A304-Q308 PolarHBondContact O-N 3.17Å; Q308-E310 VanDerWaalsContact C-N 3.31Å
309	G	44.3	Very low	44.7	Very low	66 Å²	66	119.4 Å²	119.4	68%	0.68	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-19.2	166.3	0	0	0	0	0	114.3	E307	E307-G309 PolarHBondContact O-N 3.48Å
310	E	38.8	Very low	42.6	Very low	179 Å²	179	120.7 Å²	120.7	84%	0.836	70%	0.704	S	S	*	*	S	Bend	trans	-144.3	113.5	176.8	-72.7	-173.3	159.6	0	0	112	E307 Q308	E307-E310 PolarHBondContact O-N 3.49Å; Q308-E310 VanDerWaalsContact C-N 3.31Å
311	A	29.8	Very low	40.4	Very low	106 Å²	106	123.3 Å²	123.3	88%	0.876	71%	0.714	S	S	*	*			trans	96.6	136.6	167.2	0	0	0	0	0	118.1
312	A	33	Very low	38.5	Very low	93 Å²	93	129.1 Å²	129.1	77%	0.769	73%	0.732	S	S	*	*			trans	-95.8	143.1	-162.7	0	0	0	0	0	114
313	V	36.7	Very low	37	Very low	139 Å²	139	135.4 Å²	135.4	84%	0.842	75%	0.752	S	S	*	*			trans	60.8	105.6	146.5	-174.4	0	0	0	0	118.2
314	E	27.3	Very low	35.4	Very low	187 Å²	187	139.3 Å²	139.3	87%	0.874	77%	0.77	S	S	*	*			trans	-138.3	155.7	143.7	-82.9	-148.9	162.7	0	0	110.4
315	P	30.2	Very low	34	Very low	121 Å²	121	141.6 Å²	141.6	79%	0.786	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-84.5	148.2	-159.2	29.9	-25.1	0	0	0	113.6
316	A	27.5	Very low	32.8	Very low	93 Å²	93	140.3 Å²	140.3	77%	0.769	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-61.2	132	-176.9	0	0	0	0	0	113.2	E318	A316-E318 PolarHBondContact O-N 2.61Å
317	E	27.6	Very low	31.6	Very low	192 Å²	192	145.8 Å²	145.8	90%	0.897	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-69.7	116.6	160.3	-64.3	-177.4	165.1	0	0	108	E319	E317-E319 PolarHBondContact O-N 2.99Å
318	E	26.8	Very low	30.5	Very low	189 Å²	189	149 Å²	149	88%	0.883	82%	0.82	S	S	*	*			trans	-72.8	112.2	176.4	-70	-179.6	168.8	0	0	109.6	A316 M320	A316-E318 PolarHBondContact O-N 2.61Å; E318-M320 PolarHBondContact O-N 2.83Å
319	E	26.3	Very low	29.9	Very low	191 Å²	191	151.6 Å²	151.6	89%	0.893	83%	0.829	S	S	*	*			trans	-60.5	126	164	-66.7	-167.9	155.1	0	0	109.1	E317 D321	E317-E319 PolarHBondContact O-N 2.99Å; E319-D321 PolarHBondContact O-N 3.33Å
320	M	29.6	Very low	29	Very low	129 Å²	129	158.2 Å²	158.2	64%	0.635	84%	0.839	S	S	*	*			trans	-87.8	109.1	-178.7	-160.5	-178.2	77.8	0	0	109.5	E318 E322	E318-M320 PolarHBondContact O-N 2.83Å; M320-E322 PolarHBondContact O-N 3.07Å
321	D	24.4	Very low	28.5	Very low	151 Å²	151	158 Å²	158	81%	0.807	84%	0.844	S	S	*	*			trans	-57.8	120.8	163.8	-87.1	-41.6	0	0	0	109.9	E319 E323	E319-D321 PolarHBondContact O-N 3.33Å; D321-E323 PolarHBondContact O-N 3.26Å
322	E	30.2	Very low	28.3	Very low	173 Å²	173	155.8 Å²	155.8	81%	0.808	83%	0.832	S	S	*	*			trans	-80.7	96.1	164.4	-71.9	-174.7	167.9	0	0	108.6	M320 D324	M320-E322 PolarHBondContact O-N 3.07Å; E322-D324 PolarHBondContact O-N 3.34Å
323	E	29.6	Very low	28	Very low	188 Å²	188	161.4 Å²	161.4	88%	0.879	84%	0.839	S	S	*	*			trans	-74	107.7	168.4	-76.6	-165.3	157.7	0	0	110.7	D321 A325	D321-E323 PolarHBondContact O-N 3.26Å; E323-A325 PolarHBondContact O-N 3.45Å
324	D	27.8	Very low	27.4	Very low	164 Å²	164	160.7 Å²	160.7	88%	0.877	84%	0.835	S	S	*	*			trans	-64.8	110.6	165.3	-102	-33.4	0	0	0	110.4	E322	E322-D324 PolarHBondContact O-N 3.34Å
325	A	26.4	Very low	27.2	Very low	88 Å²	88	157.9 Å²	157.9	73%	0.727	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-87.1	136.6	164.1	0	0	0	0	0	110.7	E323	E323-A325 PolarHBondContact O-N 3.45Å
326	P	28.8	Very low	27.1	Very low	126 Å²	126	160.4 Å²	160.4	82%	0.818	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-74.4	131.1	-165.9	27.6	-33.5	0	0	0	113.6	K328	P326-K328 PolarHBondContact O-N 2.88Å
327	M	27	Very low	27.3	Very low	191 Å²	191	161 Å²	161	94%	0.941	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-56.2	119	175	-64.9	176.2	92.6	0	0	112.6
328	K	24.6	Very low	27.4	Very low	208 Å²	208	156.4 Å²	156.4	90%	0.904	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89.8	117.6	156.6	-86.9	179.9	179.3	170.3	0	109.5	P326 K330	P326-K328 PolarHBondContact O-N 2.88Å; K328-K330 PolarHBondContact O-N 3.32Å
329	K	31	Very low	27.7	Very low	209 Å²	209	149.4 Å²	149.4	91%	0.909	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-59.2	124	173.7	-73.6	179.2	175.1	178.1	0	111.5
330	K	25.9	Very low	28.3	Very low	205 Å²	205	143.3 Å²	143.3	89%	0.891	75%	0.749	S	S	*	*			trans	-136.9	135	150	-94.6	-176.2	176.6	177.4	0	109.6	K328	K328-K330 PolarHBondContact O-N 3.32Å
331	N	28.7	Very low	29.2	Very low	174 Å²	174	141.6 Å²	141.6	93%	0.93	74%	0.738	S	S	*	*			trans	-57.3	131.1	-177.9	-75.3	-13	0	0	0	112.5
332	G	25.5	Very low	30.2	Very low	61 Å²	61	135.3 Å²	135.3	63%	0.629	71%	0.706	S	S	*	*			trans	170.9	128.4	167.3	0	0	0	0	0	109.3	T334	G332-T334 PolarHBondContact O-N 2.99Å; G332-T334 VanDerWaalsContact O-N 3.14Å
333	K	26.4	Very low	30.9	Very low	211 Å²	211	129.6 Å²	129.6	92%	0.917	68%	0.68	S	S	*	*			trans	-38.4	114.8	-179.2	-97.9	172.3	165.8	179.1	0	112.1	T335	K333-T335 PolarHBondContact O-N 2.94Å
334	T	23.6	Very low	32	Very low	124 Å²	124	122.3 Å²	122.3	76%	0.761	65%	0.648	S	S	*	*			trans	-77	97.6	165.8	46.5	0	0	0	0	108.3	G332 K336	G332-T334 PolarHBondContact O-N 2.99Å; G332-T334 VanDerWaalsContact O-N 3.14Å; T334-K336 PolarHBondContact O-N 3.33Å; T334-K336 VanDerWaalsContact O-N 3.07Å
335	T	23.8	Very low	33.3	Very low	127 Å²	127	116.7 Å²	116.7	78%	0.779	62%	0.617	S	S	*	*			trans	-66.3	102.7	161.7	-19.1	0	0	0	0	106.3	K333 V337	K333-T335 PolarHBondContact O-N 2.94Å; T335-V337 PolarHBondContact O-N 3.35Å
336	K	28.1	Very low	34.4	Very low	174 Å²	174	116 Å²	116	76%	0.757	61%	0.606	S	S	*	*			trans	-68.4	96	173.4	-72.1	179.6	178.9	175.1	0	107.2	T334 D338	T334-K336 PolarHBondContact O-N 3.33Å; T334-K336 VanDerWaalsContact O-N 3.07Å; K336-D338 PolarHBondContact O-N 3.44Å
337	V	30.3	Very low	35.4	Very low	106 Å²	106	119.8 Å²	119.8	64%	0.642	60%	0.603	S	S	*	*			trans	-78.8	106.4	165.8	177.1	0	0	0	0	106.2	T335 T339	T335-V337 PolarHBondContact O-N 3.35Å; V337-T339 VanDerWaalsContact C-N 3.35Å; V337-T339 HydrophobicContact CG1-CG2 3.67Å; V337-T339 PolarHBondContact O-N 3.32Å
338	D	31.5	Very low	36.9	Very low	95 Å²	95	113.9 Å²	113.9	51%	0.508	59%	0.591	S	S	.	*			trans	-92	72.2	180	-150.1	-6.5	0	0	0	108.2	K336 D340 R459	K336-D338 PolarHBondContact O-N 3.44Å; D338-D340 PolarHBondContact O-N 3.42Å; D338-R459 IonicContact OD1-CZ 2.84Å; D338-R459 IonicContact OD1-NH2 2.98Å; D338-R459 PolarHBondContact OD1-NH2 3.25Å; D338-R459 IonicContact OD2-CZ 3.23Å; D338-R459 IonicContact OD2-NE 2.96Å; D338-R459 PolarHBondContact OD2-NE 3.19Å; D338-R459 IonicContact OD2-NH2 2.83Å; D338-R459 PolarHBondContact OD2-NH2 3.1Å
339	T	32.9	Very low	39.3	Very low	42 Å²	42	106.8 Å²	106.8	26%	0.258	56%	0.56	S	S	.	*			trans	-81	114.9	174.5	38.2	0	0	0	0	108.8	A106 V337 F341	A106-T339 WeakPolarHBondContact O-CG2 3.38Å; V337-T339 VanDerWaalsContact C-N 3.35Å; V337-T339 HydrophobicContact CG1-CG2 3.67Å; V337-T339 PolarHBondContact O-N 3.32Å; T339-F341 WeakPolarHBondContact O-CD2 3.34Å; T339-F341 WeakPolarHBondContact O-CE2 3.22Å; T339-F341 WeakPolarHBondContact O-CG 2.99Å; T339-F341 PolarHBondContact O-N 3.37Å; T339-F341 WeakPolarHBondContact OG1-CE2 3.35Å; T339-F341 WeakPolarHBondContact OG1-CZ 3.29Å
340	D	39.3	Very low	41.9	Very low	64 Å²	64	103.6 Å²	103.6	34%	0.342	55%	0.549	S	S	.	.			trans	-67	98.2	178	-167.1	-19.1	0	0	0	109.9	D338 S342 R456	D338-D340 PolarHBondContact O-N 3.42Å; D340-S342 PolarHBondContact O-N 3.12Å; D340-S342 WeakPolarHBondContact OD1-CB 3.35Å; D340-S342 PolarHBondContact OD1-N 2.86Å; D340-S342 PolarHBondContact OD1-OG 3.31Å; D340-R456 IonicContact OD1-CZ 3.87Å; D340-R456 IonicContact OD1-NH1 2.78Å; D340-R456 PolarHBondContact OD1-NH1 3.21Å; D340-R456 IonicContact OD1-NH2 3.58Å; D340-R456 PolarHBondContact OD1-NH2 3.13Å; D340-R456 IonicContact OD2-CZ 2.86Å; D340-R456 IonicContact OD2-NH1 2.82Å; D340-R456 PolarHBondContact OD2-NH1 3.06Å
341	F	48.3	Very low	45.1	Very low	93 Å²	93	94.9 Å²	94.9	41%	0.408	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-83.6	23.3	-178.1	-61.2	-68.1	0	0	0	113.9	T339 D343 L344	T339-F341 WeakPolarHBondContact O-CD2 3.34Å; T339-F341 WeakPolarHBondContact O-CE2 3.22Å; T339-F341 WeakPolarHBondContact O-CG 2.99Å; T339-F341 PolarHBondContact O-N 3.37Å; T339-F341 WeakPolarHBondContact OG1-CE2 3.35Å; T339-F341 WeakPolarHBondContact OG1-CZ 3.29Å; F341-D343 PolarHBondContact O-N 3.38Å; F341-D343 VanDerWaalsContact O-N 3.08Å; F341-L344 HydrophobicContact CB-CB 4.5Å; F341-L344 HydrophobicContact CB-CD1 4.24Å; F341-L344 HydrophobicContact CD1-CD1 3.36Å; F341-L344 HydrophobicContact CD1-CG 4.26Å; F341-L344 HydrophobicContact CE1-CD1 4.03Å; F341-L344 HydrophobicContact CG-CD1 4.16Å; F341-L344 PolarHBondContact O-N 2.98Å; F341-L344 VanDerWaalsContact O-N 3.09Å
342	S	44.2	Very low	48	Very low	19 Å²	19	86.7 Å²	86.7	13%	0.133	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-53.6	-30.9	-180	55.5	0	0	0	0	113	D340 L345	D340-S342 PolarHBondContact O-N 3.12Å; D340-S342 WeakPolarHBondContact OD1-CB 3.35Å; D340-S342 PolarHBondContact OD1-N 2.86Å; D340-S342 PolarHBondContact OD1-OG 3.31Å; S342-L345 WeakPolarHBondContact O-CD1 3.3Å; S342-L345 WeakPolarHBondContact O-CG 3.37Å
343	D	46.3	Very low	51	Low	52 Å²	52	88 Å²	88	28%	0.278	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-88.9	-5	-173.8	-57.2	-12.2	0	0	0	113.2	R102 W162 F341	R102-D343 VanDerWaalsContact NH1-C 3.33Å; R102-D343 PolarHBondContact NH1-O 3.29Å; R102-D343 PolarHBondContact NH2-O 3.45Å; W162-D343 WeakPolarHBondContact CZ3-OD2 3.37Å; F341-D343 PolarHBondContact O-N 3.38Å; F341-D343 VanDerWaalsContact O-N 3.08Å
344	L	52.2	Low	54.3	Low	36 Å²	36	79.8 Å²	79.8	19%	0.188	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-94.7	0.8	174.3	-61.4	-176.5	0	0	0	112.8	Q65 N103 F341	Q65-L344 HydrophobicContact CG-CD1 4.07Å; Q65-L344 HydrophobicContact CG-CD2 4.3Å; N103-L344 HydrophobicContact CB-CD2 4.46Å; N103-L344 VanDerWaalsContact CG-CD2 3.44Å; N103-L344 WeakPolarHBondContact OD1-CD2 3.48Å; F341-L344 HydrophobicContact CB-CB 4.5Å; F341-L344 HydrophobicContact CB-CD1 4.24Å; F341-L344 HydrophobicContact CD1-CD1 3.36Å; F341-L344 HydrophobicContact CD1-CG 4.26Å; F341-L344 HydrophobicContact CE1-CD1 4.03Å; F341-L344 HydrophobicContact CG-CD1 4.16Å; F341-L344 PolarHBondContact O-N 2.98Å; F341-L344 VanDerWaalsContact O-N 3.09Å
345	L	54.3	Low	57.6	Low	46 Å²	46	73.9 Å²	73.9	24%	0.241	38%	0.382	C	S	.	.			trans	-65	134.1	-179.2	-67.5	175.1	0	0	0	110.5	S342 L352 R353	S342-L345 WeakPolarHBondContact O-CD1 3.3Å; S342-L345 WeakPolarHBondContact O-CG 3.37Å; L345-L352 HydrophobicContact CD1-CD2 4.45Å; L345-L352 HydrophobicContact CD1-CG 4.26Å; L345-L352 HydrophobicContact CD2-CD2 3.88Å; L345-R353 HydrophobicContact CB-CG 4.41Å; L345-R353 HydrophobicContact CD1-CG 4.03Å
346	P	50	Low	61	Low	74 Å²	74	68.1 Å²	68.1	48%	0.481	35%	0.347	S	S	.	.			trans	-57	145.2	-179.8	-24.3	32	0	0	0	113.2	G348	P346-G348 PolarHBondContact O-N 3.35Å
347	R	49.9	Very low	64.2	Low	205 Å²	205	60.3 Å²	60.3	77%	0.774	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	109.7	165.6	-66.5	-175.9	-179.4	177.2	4.5	107.2	E95	E95-R347 IonicContact OE1-CZ 3.53Å; E95-R347 IonicContact OE1-NH2 3.59Å; E95-R347 PolarHBondContact OE1-NH2 3.1Å
348	G	57.6	Low	67.4	Low	66 Å²	66	55.2 Å²	55.2	68%	0.68	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	136.5	-3.9	-178.5	0	0	0	0	0	117	P346	P346-G348 PolarHBondContact O-N 3.35Å
349	K	76.2	Confident	70.5	Confident	59 Å²	59	50.8 Å²	50.8	26%	0.257	26%	0.26	S	S	.	.			trans	-114.8	64.2	176.7	-60.5	-173.1	178.9	-173.5	0	112.4	E351 L352 R353 S449	K349-E351 VanDerWaalsContact C-N 3.35Å; K349-E351 PolarHBondContact O-N 3.47Å; K349-L352 HydrophobicContact CB-CB 3.95Å; K349-L352 HydrophobicContact CB-CD2 4.35Å; K349-L352 HydrophobicContact CD-CD2 3.82Å; K349-L352 PolarHBondContact O-N 3.12Å; K349-R353 WeakPolarHBondContact O-CG 3.35Å; K349-R353 PolarHBondContact O-N 3.26Å; K349-R353 VanDerWaalsContact O-N 3.1Å; K349-S449 PolarHBondContact NZ-OG 3.39Å
350	E	85.7	Confident	73.5	Confident	143 Å²	143	49.2 Å²	49.2	67%	0.668	25%	0.25	S	C	*	.	H	α-helix	trans	-59.5	-43.2	-173	-169.5	171.5	177.7	0	0	112.3	L352 R353 E354	E350-L352 PolarHBondContact O-N 3.19Å; E350-R353 WeakPolarHBondContact O-CB 3.31Å; E350-R353 PolarHBondContact O-N 3.34Å; E350-R353 VanDerWaalsContact O-N 3.16Å; E350-E354 WeakPolarHBondContact O-CG 3.28Å; E350-E354 PolarHBondContact O-N 3.36Å
351	E	92.3	Very high	76.3	Confident	22 Å²	22	46.1 Å²	46.1	10%	0.103	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-36.7	-179.3	-64.5	85.2	172	0	0	112.7	L289 A292 E293 N296 K349 R353 E354 A355 W450	L289-E351 HydrophobicContact CB-CB 4.2Å; L289-E351 HydrophobicContact CD2-CB 4.39Å; L289-E351 HydrophobicContact CD2-CG 4.48Å; L289-E351 WeakPolarHBondContact O-CG 3.39Å; A292-E351 HydrophobicContact CB-CG 4.17Å; E293-E351 HydrophobicContact CB-CB 4Å; E293-E351 HydrophobicContact CB-CG 3.98Å; N296-E351 PolarHBondContact ND2-OE1 3.15Å; K349-E351 VanDerWaalsContact C-N 3.35Å; K349-E351 PolarHBondContact O-N 3.47Å; E351-R353 VanDerWaalsContact C-N 3.32Å; E351-E354 PolarHBondContact O-N 3.14Å; E351-A355 WeakPolarHBondContact O-CB 3.45Å; E351-A355 PolarHBondContact O-N 2.84Å; E351-W450 HydrophobicContact CB-CH2 4.35Å; E351-W450 HydrophobicContact CB-CZ2 4.17Å
352	L	89.7	Confident	78.7	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-66.8	-36.2	174.1	-180	59.6	0	0	0	111.3	L345 K349 E350 T356 S449 W450 L453	L345-L352 HydrophobicContact CD1-CD2 4.45Å; L345-L352 HydrophobicContact CD1-CG 4.26Å; L345-L352 HydrophobicContact CD2-CD2 3.88Å; K349-L352 HydrophobicContact CB-CB 3.95Å; K349-L352 HydrophobicContact CB-CD2 4.35Å; K349-L352 HydrophobicContact CD-CD2 3.82Å; K349-L352 PolarHBondContact O-N 3.12Å; E350-L352 PolarHBondContact O-N 3.19Å; L352-T356 WeakPolarHBondContact O-CB 3.34Å; L352-T356 PolarHBondContact O-N 3.48Å; L352-T356 PolarHBondContact O-OG1 3.21Å; L352-S449 WeakPolarHBondContact CD2-O 3.46Å; L352-W450 HydrophobicContact CB-CZ2 4.2Å; L352-W450 HydrophobicContact CD1-CD2 3.99Å; L352-W450 HydrophobicContact CD1-CG 4.06Å; L352-L453 HydrophobicContact CD1-CD1 3.85Å; L352-L453 HydrophobicContact CD1-CD2 4.26Å; L352-L453 HydrophobicContact CD1-CG 4.07Å
353	R	89.1	Confident	81.2	Confident	88 Å²	88	42.1 Å²	42.1	33%	0.332	21%	0.214	S	C	.	.	H	α-helix	trans	-68.4	-41.9	175.2	-67.9	176.9	75.9	-173.6	10.7	111.3	E196 L345 K349 E350 E351 T356 A357	E196-R353 VanDerWaalsContact CD-NH1 3.3Å; E196-R353 IonicContact OE1-CZ 2.58Å; E196-R353 VanDerWaalsContact OE1-CZ 3.27Å; E196-R353 IonicContact OE1-NH1 3.66Å; E196-R353 PolarHBondContact OE1-NH1 2.62Å; E196-R353 IonicContact OE1-NH2 3.29Å; E196-R353 PolarHBondContact OE1-NH2 3.27Å; E196-R353 VanDerWaalsContact OE1-NH2 3.14Å; E196-R353 IonicContact OE2-CZ 3.71Å; E196-R353 IonicContact OE2-NH1 3.44Å; E196-R353 PolarHBondContact OE2-NH1 3.02Å; E196-R353 IonicContact OE2-NH2 2.87Å; E196-R353 PolarHBondContact OE2-NH2 2.66Å; L345-R353 HydrophobicContact CB-CG 4.41Å; L345-R353 HydrophobicContact CD1-CG 4.03Å; K349-R353 WeakPolarHBondContact O-CG 3.35Å; K349-R353 PolarHBondContact O-N 3.26Å; K349-R353 VanDerWaalsContact O-N 3.1Å; E350-R353 WeakPolarHBondContact O-CB 3.31Å; E350-R353 PolarHBondContact O-N 3.34Å; E350-R353 VanDerWaalsContact O-N 3.16Å; E351-R353 VanDerWaalsContact C-N 3.32Å; R353-T356 PolarHBondContact O-N 3.25Å; R353-A357 WeakPolarHBondContact O-CB 3.19Å; R353-A357 PolarHBondContact O-N 3.08Å
354	E	94.3	Very high	83.6	Confident	39 Å²	39	40.2 Å²	40.2	18%	0.182	20%	0.204	C	C	.	.	H	α-helix	trans	-62	-43.9	173.4	-75.8	-73.8	120.5	0	0	111.7	M238 A239 L289 E350 E351 T356 A357 L358	M238-E354 WeakPolarHBondContact CA-OE2 3.4Å; M238-E354 HydrophobicContact CB-CB 4.33Å; M238-E354 WeakPolarHBondContact CB-O 3.32Å; M238-E354 WeakPolarHBondContact CB-OE2 3.39Å; M238-E354 HydrophobicContact CG-CB 4.36Å; M238-E354 VanDerWaalsContact CG-OE2 3.31Å; M238-E354 WeakPolarHBondContact CG-OE2 3.44Å; M238-E354 PolarHBondContact N-OE2 3.45Å; A239-E354 WeakPolarHBondContact CB-OE1 3.43Å; A239-E354 PolarHBondContact N-OE1 2.91Å; A239-E354 VanDerWaalsContact N-OE1 3.14Å; L289-E354 HydrophobicContact CD1-CB 4.2Å; L289-E354 HydrophobicContact CD2-CB 4.02Å; E350-E354 WeakPolarHBondContact O-CG 3.28Å; E350-E354 PolarHBondContact O-N 3.36Å; E351-E354 PolarHBondContact O-N 3.14Å; E354-T356 VanDerWaalsContact C-N 3.34Å; E354-T356 PolarHBondContact O-N 3.46Å; E354-A357 PolarHBondContact O-N 3.29Å; E354-L358 PolarHBondContact O-N 2.8Å
355	A	94.9	Very high	85.8	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.2	-40.4	175.4	0	0	0	0	0	111.9	I286 L289 E351 L358 L359 W450 L453	I286-A355 HydrophobicContact CG1-CB 4.47Å; L289-A355 HydrophobicContact CD1-CB 3.8Å; E351-A355 WeakPolarHBondContact O-CB 3.45Å; E351-A355 PolarHBondContact O-N 2.84Å; A355-L358 PolarHBondContact O-N 3.47Å; A355-L359 WeakPolarHBondContact O-CG 3.06Å; A355-L359 PolarHBondContact O-N 3.27Å; A355-W450 HydrophobicContact CB-CH2 4.15Å; A355-W450 HydrophobicContact CB-CZ3 3.96Å; A355-L453 HydrophobicContact CB-CD1 3.81Å; A355-L453 HydrophobicContact CB-CD2 4.36Å
356	T	93.5	Very high	87.9	Confident	7 Å²	7	36.3 Å²	36.3	4%	0.043	18%	0.184	C	C	.	.	H	α-helix	trans	-64.8	-46.7	175.5	-60.4	0	0	0	0	110.8	L352 R353 E354 L358 L359 T360	L352-T356 WeakPolarHBondContact O-CB 3.34Å; L352-T356 PolarHBondContact O-N 3.48Å; L352-T356 PolarHBondContact O-OG1 3.21Å; R353-T356 PolarHBondContact O-N 3.25Å; E354-T356 VanDerWaalsContact C-N 3.34Å; E354-T356 PolarHBondContact O-N 3.46Å; T356-L358 VanDerWaalsContact C-N 3.31Å; T356-L358 PolarHBondContact O-N 2.82Å; T356-L359 PolarHBondContact O-N 3.09Å; T356-T360 WeakPolarHBondContact O-CB 3.5Å; T356-T360 PolarHBondContact O-N 3.44Å; T356-T360 PolarHBondContact O-OG1 3.48Å; T356-T360 VanDerWaalsContact O-OG1 3.06Å
357	A	95.4	Very high	90.1	Very high	9 Å²	9	34.6 Å²	34.6	7%	0.074	17%	0.169	C	C	.	.	H	α-helix	trans	-60.5	-39.7	178.5	0	0	0	0	0	112.2	M238 L242 R353 E354 A361	M238-A357 HydrophobicContact CB-CB 4.1Å; L242-A357 HydrophobicContact CB-CB 4.24Å; L242-A357 HydrophobicContact CD2-CB 4.07Å; R353-A357 WeakPolarHBondContact O-CB 3.19Å; R353-A357 PolarHBondContact O-N 3.08Å; E354-A357 PolarHBondContact O-N 3.29Å; A357-A361 WeakPolarHBondContact O-CB 3.45Å; A357-A361 PolarHBondContact O-N 2.72Å
358	L	97.4	Very high	92.3	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-57.8	-53.1	174.3	171.5	61.7	0	0	0	111.6	M238 L280 A282 L285 E354 A355 T356 A361 Q362	M238-L358 HydrophobicContact CB-CB 4.13Å; M238-L358 HydrophobicContact CG-CB 3.99Å; M238-L358 HydrophobicContact SD-CB 4.05Å; M238-L358 HydrophobicContact SD-CD1 3.84Å; M238-L358 HydrophobicContact SD-CG 4.34Å; L280-L358 HydrophobicContact CB-CD1 3.73Å; L280-L358 HydrophobicContact CD1-CD1 3.75Å; L280-L358 HydrophobicContact CG-CD1 4.41Å; A282-L358 HydrophobicContact CB-CD2 4.12Å; L285-L358 HydrophobicContact CB-CD2 3.91Å; L285-L358 HydrophobicContact CD1-CD1 4.38Å; L285-L358 HydrophobicContact CD1-CD2 3.78Å; E354-L358 PolarHBondContact O-N 2.8Å; A355-L358 PolarHBondContact O-N 3.47Å; T356-L358 VanDerWaalsContact C-N 3.31Å; T356-L358 PolarHBondContact O-N 2.82Å; L358-A361 PolarHBondContact O-N 3.3Å; L358-Q362 HydrophobicContact CD1-CG 4.36Å; L358-Q362 WeakPolarHBondContact O-CG 3.34Å; L358-Q362 PolarHBondContact O-N 3.13Å
359	L	96.4	Very high	94.2	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-67.8	-39.7	-177	-64.6	179	0	0	0	111.6	A282 I286 A355 T356 Q362 Q363 L453 R456 M457 V460	A282-L359 HydrophobicContact CB-CD2 3.86Å; I286-L359 HydrophobicContact CD1-CD1 4.11Å; I286-L359 HydrophobicContact CD1-CD2 4.25Å; I286-L359 HydrophobicContact CD1-CG 4.4Å; A355-L359 WeakPolarHBondContact O-CG 3.06Å; A355-L359 PolarHBondContact O-N 3.27Å; T356-L359 PolarHBondContact O-N 3.09Å; L359-Q362 PolarHBondContact O-N 2.93Å; L359-Q363 WeakPolarHBondContact O-CB 3.46Å; L359-Q363 PolarHBondContact O-N 3.18Å; L359-L453 HydrophobicContact CD1-CB 4.2Å; L359-L453 HydrophobicContact CD1-CD2 4Å; L359-R456 HydrophobicContact CB-CB 4.16Å; L359-R456 HydrophobicContact CD1-CB 3.57Å; L359-R456 HydrophobicContact CG-CB 4.5Å; L359-M457 HydrophobicContact CD1-CG 3.82Å; L359-M457 HydrophobicContact CD2-CG 3.89Å; L359-V460 HydrophobicContact CB-CG2 4.35Å; L359-V460 HydrophobicContact CD2-CG2 4.26Å; L359-V460 WeakPolarHBondContact O-CG2 3.33Å
360	T	96.6	Very high	95	Very high	8 Å²	8	19 Å²	19	5%	0.049	9%	0.089	C	C	.	.	H	α-helix	trans	-64	-40.3	175.2	-59.9	0	0	0	0	111.4	L242 T356 Q363 T364	L242-T360 HydrophobicContact CD1-CG2 3.77Å; L242-T360 HydrophobicContact CD2-CG2 4.32Å; T356-T360 WeakPolarHBondContact O-CB 3.5Å; T356-T360 PolarHBondContact O-N 3.44Å; T356-T360 PolarHBondContact O-OG1 3.48Å; T356-T360 VanDerWaalsContact O-OG1 3.06Å; T360-Q363 PolarHBondContact O-N 3.24Å; T360-T364 VanDerWaalsContact O-CB 3.3Å; T360-T364 WeakPolarHBondContact O-CB 3.42Å; T360-T364 PolarHBondContact O-N 3.49Å; T360-T364 PolarHBondContact O-OG1 3.23Å
361	A	98	Very high	95.3	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-64.5	-41.6	176.2	0	0	0	0	0	111.7	I241 L242 C277 A357 L358 T364 S365	I241-A361 HydrophobicContact CG2-CB 4.11Å; L242-A361 HydrophobicContact CB-CB 4.07Å; L242-A361 HydrophobicContact CD1-CB 4.1Å; C277-A361 VanDerWaalsContact SG-CB 3.5Å; C277-A361 PolarHBondContact SG-O 3.11Å; A357-A361 WeakPolarHBondContact O-CB 3.45Å; A357-A361 PolarHBondContact O-N 2.72Å; L358-A361 PolarHBondContact O-N 3.3Å; A361-T364 PolarHBondContact O-N 3.2Å; A361-S365 WeakPolarHBondContact O-CB 3.46Å; A361-S365 PolarHBondContact O-N 3.39Å; A361-S365 PolarHBondContact O-OG 3.46Å
362	Q	98.3	Very high	95.3	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.009	6%	0.058	C	C	.	.	H	α-helix	trans	-66.3	-46	177.6	-73.2	-178.1	-16.7	0	0	111.8	C277 L280 L358 L359 T364 S365 L366 K432 V460	C277-Q362 PolarHBondContact O-NE2 3.43Å; L280-Q362 PolarHBondContact O-NE2 2.92Å; L358-Q362 HydrophobicContact CD1-CG 4.36Å; L358-Q362 WeakPolarHBondContact O-CG 3.34Å; L358-Q362 PolarHBondContact O-N 3.13Å; L359-Q362 PolarHBondContact O-N 2.93Å; Q362-T364 PolarHBondContact O-N 3.23Å; Q362-S365 PolarHBondContact O-N 3.43Å; Q362-L366 WeakPolarHBondContact O-CD1 3.45Å; Q362-L366 VanDerWaalsContact O-CG 3.24Å; Q362-L366 WeakPolarHBondContact O-CG 3.43Å; Q362-L366 PolarHBondContact O-N 3.04Å; Q362-L366 VanDerWaalsContact O-N 3.09Å; Q362-K432 VanDerWaalsContact NE2-NZ 3.14Å; Q362-V460 HydrophobicContact CB-CG1 4.07Å; Q362-V460 HydrophobicContact CB-CG2 4.25Å
363	Q	97.2	Very high	95.3	Very high	25 Å²	25	12.3 Å²	12.3	12%	0.117	6%	0.058	C	C	.	.	H	α-helix	trans	-55.5	-53.3	173.8	179.5	-176.6	-26.3	0	0	110.9	L359 T360 S365 L366 E367 R459 V460 R463	L359-Q363 WeakPolarHBondContact O-CB 3.46Å; L359-Q363 PolarHBondContact O-N 3.18Å; T360-Q363 PolarHBondContact O-N 3.24Å; Q363-S365 VanDerWaalsContact C-N 3.29Å; Q363-S365 PolarHBondContact O-N 3.46Å; Q363-L366 PolarHBondContact O-N 3.1Å; Q363-E367 WeakPolarHBondContact CG-OE1 3.2Å; Q363-E367 PolarHBondContact NE2-OE1 2.87Å; Q363-E367 WeakPolarHBondContact O-CG 3.4Å; Q363-E367 PolarHBondContact O-N 2.97Å; Q363-R459 VanDerWaalsContact OE1-CD 3.26Å; Q363-V460 HydrophobicContact CB-CG2 4.21Å; Q363-R463 HydrophobicContact CG-CG 4.19Å
364	T	97.2	Very high	94.9	Very high	12 Å²	12	8.6 Å²	8.6	7%	0.074	5%	0.046	C	C	.	.	H	α-helix	trans	-60.3	-40.2	-178.8	-54.6	0	0	0	0	111.1	T245 L246 T360 A361 Q362 L366 E367 I368	T245-T364 HydrophobicContact CG2-CG2 3.94Å; L246-T364 HydrophobicContact CD2-CG2 4.22Å; T360-T364 VanDerWaalsContact O-CB 3.3Å; T360-T364 WeakPolarHBondContact O-CB 3.42Å; T360-T364 PolarHBondContact O-N 3.49Å; T360-T364 PolarHBondContact O-OG1 3.23Å; A361-T364 PolarHBondContact O-N 3.2Å; Q362-T364 PolarHBondContact O-N 3.23Å; T364-L366 VanDerWaalsContact C-N 3.35Å; T364-L366 PolarHBondContact O-N 3.49Å; T364-E367 PolarHBondContact O-N 3.07Å; T364-I368 HydrophobicContact CG2-CD1 3.84Å; T364-I368 HydrophobicContact CG2-CG1 4.37Å; T364-I368 WeakPolarHBondContact O-CD1 3.44Å; T364-I368 VanDerWaalsContact O-CG1 3.23Å; T364-I368 WeakPolarHBondContact O-CG1 3.29Å; T364-I368 PolarHBondContact O-N 3.33Å
365	S	98.6	Very high	93.2	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-60.8	-44	177.6	-65.1	0	0	0	0	112.2	T245 A361 Q362 Q363 I368 I369	T245-S365 VanDerWaalsContact CG2-OG 3.25Å; T245-S365 WeakPolarHBondContact CG2-OG 3.49Å; A361-S365 WeakPolarHBondContact O-CB 3.46Å; A361-S365 PolarHBondContact O-N 3.39Å; A361-S365 PolarHBondContact O-OG 3.46Å; Q362-S365 PolarHBondContact O-N 3.43Å; Q363-S365 VanDerWaalsContact C-N 3.29Å; Q363-S365 PolarHBondContact O-N 3.46Å; S365-I368 PolarHBondContact O-N 2.92Å; S365-I369 WeakPolarHBondContact O-CD1 3.48Å; S365-I369 VanDerWaalsContact O-CG1 3.26Å; S365-I369 WeakPolarHBondContact O-CG1 3.18Å; S365-I369 PolarHBondContact O-N 3.27Å
366	L	98.2	Very high	90.9	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-65.8	-40.9	178.9	-65.8	163.8	0	0	0	111.4	L278 Q362 Q363 T364 I369 V370 V429 V460 R463 A464 C467	L278-L366 HydrophobicContact CD1-CD2 4.34Å; L278-L366 HydrophobicContact CD2-CD2 3.84Å; L278-L366 HydrophobicContact CD2-CG 3.96Å; Q362-L366 WeakPolarHBondContact O-CD1 3.45Å; Q362-L366 VanDerWaalsContact O-CG 3.24Å; Q362-L366 WeakPolarHBondContact O-CG 3.43Å; Q362-L366 PolarHBondContact O-N 3.04Å; Q362-L366 VanDerWaalsContact O-N 3.09Å; Q363-L366 PolarHBondContact O-N 3.1Å; T364-L366 VanDerWaalsContact C-N 3.35Å; T364-L366 PolarHBondContact O-N 3.49Å; L366-I369 PolarHBondContact O-N 3.4Å; L366-V370 WeakPolarHBondContact O-CG2 3.37Å; L366-V370 PolarHBondContact O-N 3.49Å; L366-V429 HydrophobicContact CD2-CG1 4.44Å; L366-V429 HydrophobicContact CD2-CG2 3.96Å; L366-V460 HydrophobicContact CD1-CG1 4.04Å; L366-R463 HydrophobicContact CB-CB 4.19Å; L366-R463 HydrophobicContact CD1-CB 4.1Å; L366-A464 HydrophobicContact CD1-CB 3.84Å; L366-A464 HydrophobicContact CD2-CB 4.18Å; L366-C467 HydrophobicContact CB-CB 4.36Å; L366-C467 HydrophobicContact CD2-CB 4.02Å
367	E	95.9	Very high	88.5	Confident	38 Å²	38	20.1 Å²	20.1	18%	0.178	12%	0.115	C	C	.	.	H	α-helix	trans	-64.8	-41.7	176.4	-69.5	170.6	179.9	0	0	111.8	F9 Q363 T364 I369 V370 N371 R463	F9-E367 HydrophobicContact CB-CB 4.16Å; F9-E367 HydrophobicContact CB-CG 4.29Å; F9-E367 HydrophobicContact CD1-CG 4.33Å; F9-E367 HydrophobicContact CD2-CB 4.28Å; F9-E367 HydrophobicContact CD2-CG 4.07Å; F9-E367 HydrophobicContact CG-CB 4.26Å; F9-E367 HydrophobicContact CG-CG 3.97Å; Q363-E367 WeakPolarHBondContact CG-OE1 3.2Å; Q363-E367 PolarHBondContact NE2-OE1 2.87Å; Q363-E367 WeakPolarHBondContact O-CG 3.4Å; Q363-E367 PolarHBondContact O-N 2.97Å; T364-E367 PolarHBondContact O-N 3.07Å; E367-I369 PolarHBondContact O-N 2.92Å; E367-V370 PolarHBondContact O-N 3.32Å; E367-N371 PolarHBondContact O-N 2.85Å; E367-R463 WeakPolarHBondContact OE1-CD 3.44Å; E367-R463 IonicContact OE1-NE 2.9Å; E367-R463 PolarHBondContact OE1-NE 3.35Å
368	I	96.2	Very high	85.6	Confident	3 Å²	3	25 Å²	25	2%	0.015	15%	0.146	C	C	.	.	H	α-helix	trans	-61.4	-44.7	174	-66.5	162.2	0	0	0	110.7	T245 G249 W252 L274 T364 S365 V370 N371 M372	T245-I368 HydrophobicContact CG2-CD1 4.25Å; G249-I368 VanDerWaalsContact CA-CD1 3.43Å; W252-I368 HydrophobicContact CB-CG2 4.37Å; W252-I368 HydrophobicContact CG-CG2 4.31Å; L274-I368 HydrophobicContact CD1-CB 4.04Å; L274-I368 HydrophobicContact CD1-CG2 3.59Å; L274-I368 HydrophobicContact CD2-CD1 3.96Å; T364-I368 HydrophobicContact CG2-CD1 3.84Å; T364-I368 HydrophobicContact CG2-CG1 4.37Å; T364-I368 WeakPolarHBondContact O-CD1 3.44Å; T364-I368 VanDerWaalsContact O-CG1 3.23Å; T364-I368 WeakPolarHBondContact O-CG1 3.29Å; T364-I368 PolarHBondContact O-N 3.33Å; S365-I368 PolarHBondContact O-N 2.92Å; I368-V370 PolarHBondContact O-N 3.06Å; I368-N371 CarbonylContact O-C 3.58Å; I368-N371 WeakPolarHBondContact O-CB 3.5Å; I368-N371 PolarHBondContact O-N 3.33Å; I368-N371 VanDerWaalsContact O-N 3.15Å; I368-M372 HydrophobicContact CG2-CE 3.71Å; I368-M372 WeakPolarHBondContact O-CG 3.24Å; I368-M372 PolarHBondContact O-N 3.05Å
369	I	96.6	Very high	82.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.2	-40.4	179.4	-66.4	158.7	0	0	0	111.2	L274 L278 S365 L366 E367 N371 M372 C373 L420 I425 C467 I471	L274-I369 HydrophobicContact CB-CD1 4.4Å; L274-I369 HydrophobicContact CD1-CD1 4.41Å; L274-I369 HydrophobicContact CD1-CG1 3.77Å; L278-I369 HydrophobicContact CD1-CD1 3.67Å; S365-I369 WeakPolarHBondContact O-CD1 3.48Å; S365-I369 VanDerWaalsContact O-CG1 3.26Å; S365-I369 WeakPolarHBondContact O-CG1 3.18Å; S365-I369 PolarHBondContact O-N 3.27Å; L366-I369 PolarHBondContact O-N 3.4Å; E367-I369 PolarHBondContact O-N 2.92Å; I369-N371 VanDerWaalsContact C-N 3.27Å; I369-N371 PolarHBondContact O-N 3.11Å; I369-M372 CarbonylContact O-C 3.6Å; I369-M372 WeakPolarHBondContact O-CA 3.31Å; I369-M372 VanDerWaalsContact O-CB 3.28Å; I369-M372 WeakPolarHBondContact O-CB 3.33Å; I369-M372 PolarHBondContact O-N 2.87Å; I369-C373 PolarHBondContact O-N 2.92Å; I369-C373 PolarHBondContact O-SG 3.04Å; I369-L420 HydrophobicContact CG2-CD2 4.26Å; I369-I425 HydrophobicContact CD1-CD1 4.39Å; I369-I425 HydrophobicContact CD1-CG2 3.81Å; I369-I425 HydrophobicContact CG1-CG2 4.44Å; I369-I425 HydrophobicContact CG2-CG2 4.09Å; I369-C467 WeakPolarHBondContact CG2-SG 3.3Å; I369-I471 HydrophobicContact CG2-CD1 4.26Å
370	V	94.1	Very high	79.8	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-59.4	-42.6	173.9	171.3	0	0	0	0	110.7	F9 L366 E367 I368 M372 C373 C374 C467	F9-V370 HydrophobicContact CD2-CB 3.56Å; F9-V370 HydrophobicContact CD2-CG1 3.41Å; F9-V370 VanDerWaalsContact CD2-CG1 3.41Å; F9-V370 HydrophobicContact CD2-CG2 3.79Å; F9-V370 HydrophobicContact CE2-CB 3.89Å; F9-V370 HydrophobicContact CE2-CG1 3.71Å; F9-V370 HydrophobicContact CE2-CG2 3.59Å; L366-V370 WeakPolarHBondContact O-CG2 3.37Å; L366-V370 PolarHBondContact O-N 3.49Å; E367-V370 PolarHBondContact O-N 3.32Å; I368-V370 PolarHBondContact O-N 3.06Å; V370-M372 VanDerWaalsContact C-N 3.26Å; V370-M372 PolarHBondContact O-N 3.33Å; V370-C373 CarbonylContact O-C 3.6Å; V370-C373 WeakPolarHBondContact O-CA 3.26Å; V370-C373 WeakPolarHBondContact O-CB 3.47Å; V370-C373 PolarHBondContact O-N 3.42Å; V370-C374 PolarHBondContact O-N 2.98Å; V370-C374 PolarHBondContact O-SG 3.47Å; V370-C467 VanDerWaalsContact CG2-CA 3.41Å; V370-C467 HydrophobicContact CG2-CB 3.71Å
371	N	92.1	Very high	76.9	Confident	18 Å²	18	38.2 Å²	38.2	10%	0.096	22%	0.219	C	C	.	.	H	α-helix	trans	-64.5	-30.2	175.2	-71.9	-12.5	0	0	0	112.4	K8 F9 E367 I368 I369 C373 C374	K8-N371 VanDerWaalsContact CA-OD1 3.27Å; K8-N371 WeakPolarHBondContact CA-OD1 3.39Å; K8-N371 WeakPolarHBondContact CB-OD1 3.4Å; F9-N371 PolarHBondContact N-OD1 3.32Å; F9-N371 PolarHBondContact O-ND2 2.7Å; F9-N371 PolarHBondContact O-OD1 3.36Å; E367-N371 PolarHBondContact O-N 2.85Å; I368-N371 CarbonylContact O-C 3.58Å; I368-N371 WeakPolarHBondContact O-CB 3.5Å; I368-N371 PolarHBondContact O-N 3.33Å; I368-N371 VanDerWaalsContact O-N 3.15Å; I369-N371 VanDerWaalsContact C-N 3.27Å; I369-N371 PolarHBondContact O-N 3.11Å; N371-C373 VanDerWaalsContact C-N 3.34Å; N371-C374 PolarHBondContact O-N 2.79Å
372	M	92	Very high	73.7	Confident	5 Å²	5	47 Å²	47	3%	0.025	26%	0.261	C	S	.	.	H	α-helix	trans	-66.9	-33.5	169.1	-64.1	174.7	174.8	0	0	112.9	W252 V270 V271 L274 I368 I369 V370 C374 L412 V416 L420	W252-M372 HydrophobicContact CB-CE 4.5Å; W252-M372 HydrophobicContact CD2-CE 3.86Å; W252-M372 HydrophobicContact CD2-CG 3.73Å; W252-M372 HydrophobicContact CE3-CE 3.6Å; W252-M372 HydrophobicContact CE3-CG 3.79Å; W252-M372 HydrophobicContact CE3-SD 4.41Å; W252-M372 HydrophobicContact CG-CE 4.23Å; W252-M372 HydrophobicContact CH2-CB 3.97Å; W252-M372 HydrophobicContact CH2-CG 3.62Å; W252-M372 VanDerWaalsContact CZ2-CA 3.42Å; W252-M372 HydrophobicContact CZ2-CB 3.93Å; W252-M372 HydrophobicContact CZ2-CG 3.58Å; W252-M372 HydrophobicContact CZ3-CB 4.48Å; W252-M372 HydrophobicContact CZ3-CE 4.19Å; W252-M372 HydrophobicContact CZ3-CG 3.72Å; W252-M372 HydrophobicContact CZ3-SD 4.48Å; V270-M372 HydrophobicContact CG1-CE 3.41Å; V270-M372 VanDerWaalsContact CG1-CE 3.41Å; V271-M372 HydrophobicContact CG2-CE 4.21Å; V271-M372 HydrophobicContact CG2-SD 4.07Å; L274-M372 HydrophobicContact CD1-CE 3.87Å; L274-M372 HydrophobicContact CD1-SD 4.37Å; I368-M372 HydrophobicContact CG2-CE 3.71Å; I368-M372 WeakPolarHBondContact O-CG 3.24Å; I368-M372 PolarHBondContact O-N 3.05Å; I369-M372 CarbonylContact O-C 3.6Å; I369-M372 WeakPolarHBondContact O-CA 3.31Å; I369-M372 VanDerWaalsContact O-CB 3.28Å; I369-M372 WeakPolarHBondContact O-CB 3.33Å; I369-M372 PolarHBondContact O-N 2.87Å; V370-M372 VanDerWaalsContact C-N 3.26Å; V370-M372 PolarHBondContact O-N 3.33Å; M372-C374 PolarHBondContact O-N 3.12Å; M372-L412 WeakPolarHBondContact O-CD2 3.35Å; M372-V416 HydrophobicContact CB-CG1 4.08Å; M372-L420 HydrophobicContact SD-CD2 4.35Å
373	C	89	Confident	70.9	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.007	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	6.9	175.8	-67.5	0	0	0	0	114.5	T6 I369 V370 N371 T474	T6-C373 PolarHBondContact OG1-O 2.89Å; T6-C373 VanDerWaalsContact OG1-O 3.12Å; I369-C373 PolarHBondContact O-N 2.92Å; I369-C373 PolarHBondContact O-SG 3.04Å; V370-C373 CarbonylContact O-C 3.6Å; V370-C373 WeakPolarHBondContact O-CA 3.26Å; V370-C373 WeakPolarHBondContact O-CB 3.47Å; V370-C373 PolarHBondContact O-N 3.42Å; N371-C373 VanDerWaalsContact C-N 3.34Å; C373-T474 HydrophobicContact CB-CG2 4.48Å; C373-T474 WeakPolarHBondContact O-CG2 3.37Å
374	C	80.6	Confident	67.9	Low	11 Å²	11	64.3 Å²	64.3	7%	0.074	33%	0.333	C	S	.	.	S	Bend	trans	-101	132.7	175.3	-63.3	0	0	0	0	109.8	T6 K8 V370 N371 M372	T6-C374 PolarHBondContact O-SG 3.3Å; T6-C374 VanDerWaalsContact O-SG 3.42Å; K8-C374 HydrophobicContact CD-CB 4.29Å; K8-C374 HydrophobicContact CG-CB 3.46Å; K8-C374 VanDerWaalsContact CG-CB 3.46Å; K8-C374 VanDerWaalsContact CG-SG 3.51Å; K8-C374 PolarHBondContact N-SG 3.12Å; V370-C374 PolarHBondContact O-N 2.98Å; V370-C374 PolarHBondContact O-SG 3.47Å; N371-C374 PolarHBondContact O-N 2.79Å; M372-C374 PolarHBondContact O-N 3.12Å
375	S	58.7	Low	65.1	Low	81 Å²	81	72.6 Å²	72.6	57%	0.566	37%	0.37	S	S	*	.			trans	-71.7	133.7	171.3	50.8	0	0	0	0	110.1	D377	S375-D377 PolarHBondContact O-N 3.21Å
376	D	47.1	Very low	61.7	Low	89 Å²	89	81.6 Å²	81.6	48%	0.476	41%	0.412	S	S	.	.			trans	-81.8	3.6	177.4	-79	-31.5	0	0	0	112.7	K8 K255	K8-D376 WeakPolarHBondContact CE-OD1 3.42Å; K8-D376 IonicContact NZ-OD1 2.69Å; K8-D376 PolarHBondContact NZ-OD1 3.03Å; K255-D376 WeakPolarHBondContact CE-OD2 3.27Å; K255-D376 IonicContact NZ-OD1 3.82Å; K255-D376 IonicContact NZ-OD2 3.84Å; K255-D376 PolarHBondContact NZ-OD2 2.68Å
377	D	42.5	Very low	58.7	Low	118 Å²	118	87.2 Å²	87.2	63%	0.631	45%	0.452	S	S	*	.	S	Bend	trans	-65.7	129.3	179.5	-101	-19.9	0	0	0	109.7	S375 S379	S375-D377 PolarHBondContact O-N 3.21Å; D377-S379 PolarHBondContact O-N 3.22Å; D377-S379 VanDerWaalsContact O-N 3.12Å
378	P	34.3	Very low	55.6	Low	112 Å²	112	90.4 Å²	90.4	73%	0.727	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-52.6	127.5	167.3	23.7	-29.9	0	0	0	106.2	D380	P378-D380 PolarHBondContact O-N 2.84Å
379	S	34.3	Very low	52.9	Low	46 Å²	46	95.5 Å²	95.5	32%	0.322	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-47.7	147.6	164.4	27.5	0	0	0	0	108.2	D377 D381	D377-S379 PolarHBondContact O-N 3.22Å; D377-S379 VanDerWaalsContact O-N 3.12Å; S379-D381 VanDerWaalsContact CB-CG 3.5Å; S379-D381 WeakPolarHBondContact CB-OD2 3.28Å; S379-D381 PolarHBondContact O-N 3.01Å; S379-D381 VanDerWaalsContact OG-CG 3.23Å; S379-D381 PolarHBondContact OG-OD2 3.15Å
380	D	37.7	Very low	49.8	Very low	130 Å²	130	102.7 Å²	102.7	70%	0.695	55%	0.553	S	S	*	*	S	Bend	trans	-53.3	27.1	166.1	-97	-39.9	0	0	0	113.5	P378 E382 W383	P378-D380 PolarHBondContact O-N 2.84Å; D380-E382 PolarHBondContact O-N 3.17Å; D380-W383 VanDerWaalsContact O-CD1 3.29Å; D380-W383 PolarHBondContact O-N 3.18Å; D380-W383 PolarHBondContact OD1-NE1 3.27Å
381	D	36.3	Very low	47.5	Very low	110 Å²	110	111.8 Å²	111.8	59%	0.588	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	7	178.8	-62.5	-25.8	0	0	0	112.1	S379	S379-D381 VanDerWaalsContact CB-CG 3.5Å; S379-D381 WeakPolarHBondContact CB-OD2 3.28Å; S379-D381 PolarHBondContact O-N 3.01Å; S379-D381 VanDerWaalsContact OG-CG 3.23Å; S379-D381 PolarHBondContact OG-OD2 3.15Å
382	E	31	Very low	44.8	Very low	185 Å²	185	116.2 Å²	116.2	86%	0.864	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	19.7	168	-77	-168.2	178.1	0	0	113.6	D380 E384	D380-E382 PolarHBondContact O-N 3.17Å; E382-E384 PolarHBondContact O-N 3.07Å
383	W	39.6	Very low	42.1	Very low	208 Å²	208	122.8 Å²	122.8	79%	0.788	66%	0.663	S	S	*	*			trans	-78.6	83.4	158.9	-69.6	81.2	0	0	0	108.1	D380 E385	D380-W383 VanDerWaalsContact O-CD1 3.29Å; D380-W383 PolarHBondContact O-N 3.18Å; D380-W383 PolarHBondContact OD1-NE1 3.27Å; W383-E385 PolarHBondContact O-N 2.83Å
384	E	33.5	Very low	39.4	Very low	183 Å²	183	130.3 Å²	130.3	86%	0.855	70%	0.702	S	S	*	*			trans	-48.5	135.5	168.9	-76	-128.4	157.8	0	0	110.4	E382 E386	E382-E384 PolarHBondContact O-N 3.07Å; E384-E386 PolarHBondContact O-N 3.33Å
385	E	38.6	Very low	37	Very low	185 Å²	185	133.3 Å²	133.3	86%	0.864	74%	0.735	S	S	*	*			trans	-60	100	178.7	-64.1	-172.8	161	0	0	111.3	W383	W383-E385 PolarHBondContact O-N 2.83Å
386	E	28	Very low	36.5	Very low	189 Å²	189	135.2 Å²	135.2	88%	0.883	75%	0.745	S	S	*	*			trans	-101.8	73.6	147.2	-71.9	-161.5	171.3	0	0	109.3	E384 S388	E384-E386 PolarHBondContact O-N 3.33Å; E386-S388 VanDerWaalsContact C-N 3.25Å; E386-S388 PolarHBondContact O-N 3.3Å
387	S	35.2	Very low	35.7	Very low	119 Å²	119	138.6 Å²	138.6	83%	0.832	76%	0.763	S	S	*	*			trans	-70.6	87.8	157.9	-164.4	0	0	0	0	108.6
388	S	31.2	Very low	35	Very low	104 Å²	104	136.6 Å²	136.6	73%	0.727	77%	0.771	S	S	*	*			trans	-110.4	101.9	164.8	168.6	0	0	0	0	108.8	E386 D390	E386-S388 VanDerWaalsContact C-N 3.25Å; E386-S388 PolarHBondContact O-N 3.3Å; S388-D390 PolarHBondContact O-N 3.24Å
389	S	38.4	Very low	34.9	Very low	110 Å²	110	139.5 Å²	139.5	77%	0.769	78%	0.779	S	S	*	*			trans	-59.4	120.5	164.6	54.2	0	0	0	0	111.2
390	D	32	Very low	34.6	Very low	152 Å²	152	143.7 Å²	143.7	81%	0.813	81%	0.807	S	S	*	*				-162.7	137.2	128.9	-143.7	-10.4	0	0	0	111.3	S388 S392	S388-D390 PolarHBondContact O-N 3.24Å; D390-S392 PolarHBondContact O-N 3.27Å
391	E	45.8	Very low	33.9	Very low	192 Å²	192	145.1 Å²	145.1	90%	0.897	82%	0.815	S	S	*	*			trans	-83.3	103.3	172.6	-78.8	-94.4	156.1	0	0	108.3
392	S	34.1	Very low	33.6	Very low	111 Å²	111	142.9 Å²	142.9	78%	0.776	82%	0.817	S	S	*	*			trans	-155.6	135.7	154.9	63.6	0	0	0	0	114.1	D390	D390-S392 PolarHBondContact O-N 3.27Å
393	D	36.4	Very low	33.3	Very low	143 Å²	143	141.6 Å²	141.6	77%	0.765	82%	0.816	S	S	*	*			trans	-57.1	160.7	-178.6	-156.9	3.5	0	0	0	116.6
394	L	33	Very low	32.6	Very low	159 Å²	159	138 Å²	138	83%	0.832	82%	0.823	S	S	*	*			trans	88.5	120	158.1	-52.2	173.4	0	0	0	121.7
395	G	29.1	Very low	32.3	Very low	73 Å²	73	132.5 Å²	132.5	75%	0.753	81%	0.814	S	S	*	*			trans	138.5	124.6	140.6	0	0	0	0	0	116.7
396	P	47.9	Very low	31.8	Very low	121 Å²	121	130.8 Å²	130.8	79%	0.786	81%	0.81	S	S	*	*			trans	-89.1	169.3	-178.6	37.3	-32.7	0	0	0	113
397	D	30.3	Very low	31.8	Very low	160 Å²	160	130 Å²	130	86%	0.856	81%	0.808	S	S	*	*			trans	94.7	100.4	172.5	-64	-18.4	0	0	0	117.4
398	G	28.4	Very low	31.5	Very low	77 Å²	77	127.5 Å²	127.5	79%	0.794	79%	0.791	S	S	*	*			trans	-153.7	73.9	163.4	0	0	0	0	0	109.3	C400	G398-C400 PolarHBondContact O-N 3.47Å; G398-C400 VanDerWaalsContact O-N 3.15Å
399	L	31.4	Very low	31.7	Very low	172 Å²	172	126.9 Å²	126.9	90%	0.901	79%	0.785	S	S	*	*			trans	-59.5	107.7	167.5	-83.4	150.4	0	0	0	109.3
400	C	28.3	Very low	32.1	Very low	135 Å²	135	125.7 Å²	125.7	91%	0.912	77%	0.769	S	S	*	*			trans	-111	97.8	156.9	-99.5	0	0	0	0	108.5	G398	G398-C400 PolarHBondContact O-N 3.47Å; G398-C400 VanDerWaalsContact O-N 3.15Å
401	D	24.3	Very low	33.3	Very low	160 Å²	160	122.7 Å²	122.7	86%	0.856	76%	0.759	S	S	*	*			trans	-71.3	142.2	164.5	-169	14.5	0	0	0	109.6
402	G	28.5	Very low	34.6	Very low	62 Å²	62	114.4 Å²	114.4	64%	0.639	72%	0.721	S	S	*	*			trans	96.9	52.8	160	0	0	0	0	0	119.6
403	L	25.6	Very low	36.8	Very low	159 Å²	159	112 Å²	112	83%	0.832	70%	0.704	S	S	*	*			trans	-115.7	70.9	153.5	-134.7	86.7	0	0	0	110.1	G405	L403-G405 PolarHBondContact O-N 2.96Å
404	S	24.2	Very low	39.1	Very low	133 Å²	133	108.7 Å²	108.7	93%	0.93	70%	0.696	S	S	*	*			trans	-70.7	108.6	168.7	176.5	0	0	0	0	108.8
405	G	26.6	Very low	41.7	Very low	66 Å²	66	106.4 Å²	106.4	68%	0.68	68%	0.682	S	S	*	*			trans	142.6	24.4	172.7	0	0	0	0	0	116.9	L403 M407	L403-G405 PolarHBondContact O-N 2.96Å; G405-M407 PolarHBondContact O-N 2.94Å
406	L	29.8	Very low	44.6	Very low	149 Å²	149	103.2 Å²	103.2	78%	0.78	65%	0.648	S	S	*	*			trans	-73.2	69.4	171	-131.5	144.7	0	0	0	109.8
407	M	26.8	Very low	46.6	Very low	172 Å²	172	99.2 Å²	99.2	85%	0.847	62%	0.619	S	S	*	*			trans	-103	101.4	172.3	-74.5	-72.1	104.1	0	0	109.3	G405	G405-M407 PolarHBondContact O-N 2.94Å
408	S	28.3	Very low	49.5	Very low	67 Å²	67	92.8 Å²	92.8	47%	0.469	59%	0.59	S	S	.	*			trans	22.4	108.4	159	-157.2	0	0	0	0	118.4	L410	S408-L410 PolarHBondContact O-N 3.25Å
409	P	36	Very low	52.6	Low	91 Å²	91	89.3 Å²	89.3	59%	0.591	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	25.8	177.9	31.8	-34.3	0	0	0	114.2
410	L	47.7	Very low	55.7	Low	85 Å²	85	81.2 Å²	81.2	45%	0.445	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.9	-1.7	-165.1	-65.5	170.2	0	0	0	114.9	K3 S408	K3-L410 HydrophobicContact CD-CD1 4.45Å; S408-L410 PolarHBondContact O-N 3.25Å
411	C	57.5	Low	58.9	Low	89 Å²	89	77.8 Å²	77.8	60%	0.601	48%	0.483	S	S	*	.	S	Bend	trans	-105	142	-179.8	-62.3	0	0	0	0	110.3
412	L	71.7	Confident	62.2	Low	19 Å²	19	76.2 Å²	76.2	10%	0.099	48%	0.475	C	S	.	.			trans	-56.9	151.7	168.8	-70.1	171.1	0	0	0	110.3	M372 A414 V416 Q417 L420 M475	M372-L412 WeakPolarHBondContact O-CD2 3.35Å; L412-A414 PolarHBondContact O-N 3.42Å; L412-V416 HydrophobicContact CD2-CG1 4.26Å; L412-Q417 HydrophobicContact CB-CB 4.03Å; L412-Q417 HydrophobicContact CD1-CB 4.43Å; L412-L420 HydrophobicContact CD1-CD1 3.95Å; L412-M475 HydrophobicContact CD1-CG 4.11Å
413	S	82.1	Confident	65.5	Low	60 Å²	60	75.4 Å²	75.4	42%	0.42	45%	0.454	S	S	.	.			trans	-54.4	140.1	164.7	60.9	0	0	0	0	109.3	E415 V416 Q417	S413-E415 PolarHBondContact O-N 3.44Å; S413-E415 VanDerWaalsContact O-N 3.1Å; S413-V416 PolarHBondContact O-N 2.69Å; S413-V416 WeakPolarHBondContact OG-CB 2.93Å; S413-V416 WeakPolarHBondContact OG-CG2 3.25Å; S413-V416 PolarHBondContact OG-N 2.93Å; S413-Q417 PolarHBondContact O-N 2.72Å
414	A	83.5	Confident	68.9	Low	73 Å²	73	69 Å²	69	60%	0.603	43%	0.427	S	S	*	.	H	α-helix	trans	-56.8	-31.4	-176.5	0	0	0	0	0	112.5	L412 G418	L412-A414 PolarHBondContact O-N 3.42Å; A414-G418 WeakPolarHBondContact O-CA 3.1Å; A414-G418 PolarHBondContact O-N 2.87Å
415	E	86.9	Confident	72.4	Confident	111 Å²	111	62.7 Å²	62.7	52%	0.519	38%	0.382	S	S	.	.	H	α-helix	trans	-64.8	-48.4	176.5	-63.6	77.2	-171.7	0	0	111.9	S413 A419	S413-E415 PolarHBondContact O-N 3.44Å; S413-E415 VanDerWaalsContact O-N 3.1Å; E415-A419 WeakPolarHBondContact O-CB 3.26Å; E415-A419 PolarHBondContact O-N 3.34Å
416	V	89.9	Confident	75.7	Confident	7 Å²	7	60.5 Å²	60.5	4%	0.042	36%	0.356	C	S	.	.	H	α-helix	trans	-66.8	-49.3	177.9	172.6	0	0	0	0	110.1	W252 L267 M372 L412 S413 G418 A419 L420	W252-V416 HydrophobicContact CH2-CG2 4.06Å; W252-V416 HydrophobicContact CZ3-CG2 4.03Å; L267-V416 HydrophobicContact CD1-CG2 4.2Å; M372-V416 HydrophobicContact CB-CG1 4.08Å; L412-V416 HydrophobicContact CD2-CG1 4.26Å; S413-V416 PolarHBondContact O-N 2.69Å; S413-V416 WeakPolarHBondContact OG-CB 2.93Å; S413-V416 WeakPolarHBondContact OG-CG2 3.25Å; S413-V416 PolarHBondContact OG-N 2.93Å; V416-G418 VanDerWaalsContact C-N 3.33Å; V416-G418 PolarHBondContact O-N 3.45Å; V416-A419 PolarHBondContact O-N 3.49Å; V416-L420 HydrophobicContact CG1-CD1 4.04Å; V416-L420 HydrophobicContact CG1-CG 4.32Å; V416-L420 WeakPolarHBondContact O-CG 3.35Å; V416-L420 PolarHBondContact O-N 3.22Å
417	Q	90.8	Very high	78.8	Confident	37 Å²	37	59.7 Å²	59.7	17%	0.173	35%	0.348	C	S	.	.	H	α-helix	trans	-57.2	-48	177.8	-174.7	175.7	-12.2	0	0	111.2	L412 S413 A419 L420 I421 M475 D476 S479	L412-Q417 HydrophobicContact CB-CB 4.03Å; L412-Q417 HydrophobicContact CD1-CB 4.43Å; S413-Q417 PolarHBondContact O-N 2.72Å; Q417-A419 VanDerWaalsContact C-N 3.35Å; Q417-A419 PolarHBondContact O-N 3.33Å; Q417-L420 PolarHBondContact O-N 3.18Å; Q417-I421 HydrophobicContact CG-CD1 3.82Å; Q417-I421 VanDerWaalsContact O-CG1 3.3Å; Q417-I421 WeakPolarHBondContact O-CG1 3.08Å; Q417-I421 PolarHBondContact O-N 3.32Å; Q417-M475 HydrophobicContact CG-CE 4.03Å; Q417-D476 PolarHBondContact NE2-OD2 3.34Å; Q417-S479 PolarHBondContact NE2-OG 2.83Å
418	G	91.3	Very high	82.2	Confident	24 Å²	24	53.2 Å²	53.2	25%	0.247	32%	0.316	C	S	.	.	H	α-helix	trans	-60.5	-42.2	177.6	0	0	0	0	0	112.5	A414 V416 N422	A414-G418 WeakPolarHBondContact O-CA 3.1Å; A414-G418 PolarHBondContact O-N 2.87Å; V416-G418 VanDerWaalsContact C-N 3.33Å; V416-G418 PolarHBondContact O-N 3.45Å; G418-N422 WeakPolarHBondContact O-CB 3.23Å; G418-N422 PolarHBondContact O-N 3.36Å; G418-N422 PolarHBondContact O-ND2 2.98Å; G418-N422 VanDerWaalsContact O-ND2 3.08Å
419	A	94.3	Very high	85.5	Confident	5 Å²	5	50 Å²	50	4%	0.041	29%	0.293	C	S	.	.	H	α-helix	trans	-64.1	-45.2	176.6	0	0	0	0	0	112.3	V271 E415 V416 Q417 I421 N422 H423	V271-A419 HydrophobicContact CB-CB 4.13Å; V271-A419 HydrophobicContact CG1-CB 4.35Å; V271-A419 HydrophobicContact CG2-CB 3.88Å; E415-A419 WeakPolarHBondContact O-CB 3.26Å; E415-A419 PolarHBondContact O-N 3.34Å; V416-A419 PolarHBondContact O-N 3.49Å; Q417-A419 VanDerWaalsContact C-N 3.35Å; Q417-A419 PolarHBondContact O-N 3.33Å; A419-I421 PolarHBondContact O-N 3.02Å; A419-N422 PolarHBondContact O-N 3.05Å; A419-H423 PolarHBondContact O-CD2 3.09Å; A419-H423 VanDerWaalsContact O-CD2 3.29Å; A419-H423 PolarHBondContact O-N 3.17Å
420	L	95.8	Very high	88.4	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-43.6	178.6	-66.7	176.9	0	0	0	111.8	V271 I369 M372 L412 V416 Q417 G424 I425	V271-L420 HydrophobicContact CG1-CD2 4.08Å; V271-L420 HydrophobicContact CG2-CD2 4.22Å; I369-L420 HydrophobicContact CG2-CD2 4.26Å; M372-L420 HydrophobicContact SD-CD2 4.35Å; L412-L420 HydrophobicContact CD1-CD1 3.95Å; V416-L420 HydrophobicContact CG1-CD1 4.04Å; V416-L420 HydrophobicContact CG1-CG 4.32Å; V416-L420 WeakPolarHBondContact O-CG 3.35Å; V416-L420 PolarHBondContact O-N 3.22Å; Q417-L420 PolarHBondContact O-N 3.18Å; L420-G424 PolarHBondContact O-N 3.27Å; L420-I425 HydrophobicContact CB-CB 4.28Å; L420-I425 HydrophobicContact CB-CG1 4.41Å; L420-I425 HydrophobicContact CD2-CB 4.1Å; L420-I425 HydrophobicContact CD2-CG1 3.86Å; L420-I425 HydrophobicContact CD2-CG2 4.04Å; L420-I425 WeakPolarHBondContact O-CB 3.38Å; L420-I425 WeakPolarHBondContact O-CG1 3.4Å; L420-I425 PolarHBondContact O-N 3.3Å
421	I	94.5	Very high	90.7	Very high	63 Å²	63	48.1 Å²	48.1	32%	0.323	28%	0.278	S	S	.	.	H	α-helix	trans	-67.1	-49	178.2	-65.7	169.1	0	0	0	110.8	Q417 A419 H423 G424 M475	Q417-I421 HydrophobicContact CG-CD1 3.82Å; Q417-I421 VanDerWaalsContact O-CG1 3.3Å; Q417-I421 WeakPolarHBondContact O-CG1 3.08Å; Q417-I421 PolarHBondContact O-N 3.32Å; A419-I421 PolarHBondContact O-N 3.02Å; I421-H423 PolarHBondContact O-N 3.47Å; I421-H423 VanDerWaalsContact O-N 3.12Å; I421-G424 PolarHBondContact O-N 2.88Å; I421-M475 HydrophobicContact CD1-CE 3.69Å; I421-M475 HydrophobicContact CG1-CE 3.37Å
422	N	95.2	Very high	92.5	Very high	127 Å²	127	45.2 Å²	45.2	68%	0.679	26%	0.255	S	S	*	.	H	α-helix	trans	-58.8	-29.2	-177.6	-74.5	-21.9	0	0	0	112.8	G418 A419	G418-N422 WeakPolarHBondContact O-CB 3.23Å; G418-N422 PolarHBondContact O-N 3.36Å; G418-N422 PolarHBondContact O-ND2 2.98Å; G418-N422 VanDerWaalsContact O-ND2 3.08Å; A419-N422 PolarHBondContact O-N 3.05Å
423	H	97	Very high	93.7	Very high	46 Å²	46	44.3 Å²	44.3	21%	0.213	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	7.2	178.8	-75.8	-66.7	0	0	0	113.9	N268 V271 A272 S275 A419 I421 I425 K428	N268-H423 PolarHBondContact OD1-NE2 2.91Å; V271-H423 HydrophobicContact CG1-CB 3.91Å; A272-H423 VanDerWaalsContact CB-CE1 3.4Å; A272-H423 WeakPolarHBondContact CB-CE1 3.22Å; S275-H423 PolarHBondContact OG-O 3.38Å; A419-H423 PolarHBondContact O-CD2 3.09Å; A419-H423 VanDerWaalsContact O-CD2 3.29Å; A419-H423 PolarHBondContact O-N 3.17Å; I421-H423 PolarHBondContact O-N 3.47Å; I421-H423 VanDerWaalsContact O-N 3.12Å; H423-I425 VanDerWaalsContact C-N 3.27Å; H423-I425 HydrophobicContact CB-CD1 4.47Å; H423-I425 HydrophobicContact CB-CG1 4.26Å; H423-I425 PolarHBondContact O-N 2.84Å; H423-K428 VanDerWaalsContact O-CE 3.29Å; H423-K428 WeakPolarHBondContact O-CE 3.49Å
424	G	96.4	Very high	94.1	Very high	24 Å²	24	44 Å²	44	25%	0.247	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	25.9	176.3	0	0	0	0	0	114.3	L420 I421 E427 K428	L420-G424 PolarHBondContact O-N 3.27Å; I421-G424 PolarHBondContact O-N 2.88Å; G424-E427 PolarHBondContact O-N 3.23Å; G424-K428 WeakPolarHBondContact O-CG 3.36Å; G424-K428 PolarHBondContact O-N 3.32Å; G424-K428 VanDerWaalsContact O-N 3.11Å
425	I	97.7	Very high	94.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-57	-44.3	-174	-63.3	-64.1	0	0	0	112.8	V271 L278 I369 L420 H423 E427 K428 V429 I471	V271-I425 HydrophobicContact CG1-CD1 4.21Å; V271-I425 HydrophobicContact CG1-CG1 3.87Å; L278-I425 HydrophobicContact CD1-CD1 4.34Å; I369-I425 HydrophobicContact CD1-CD1 4.39Å; I369-I425 HydrophobicContact CD1-CG2 3.81Å; I369-I425 HydrophobicContact CG1-CG2 4.44Å; I369-I425 HydrophobicContact CG2-CG2 4.09Å; L420-I425 HydrophobicContact CB-CB 4.28Å; L420-I425 HydrophobicContact CB-CG1 4.41Å; L420-I425 HydrophobicContact CD2-CB 4.1Å; L420-I425 HydrophobicContact CD2-CG1 3.86Å; L420-I425 HydrophobicContact CD2-CG2 4.04Å; L420-I425 WeakPolarHBondContact O-CB 3.38Å; L420-I425 WeakPolarHBondContact O-CG1 3.4Å; L420-I425 PolarHBondContact O-N 3.3Å; H423-I425 VanDerWaalsContact C-N 3.27Å; H423-I425 HydrophobicContact CB-CD1 4.47Å; H423-I425 HydrophobicContact CB-CG1 4.26Å; H423-I425 PolarHBondContact O-N 2.84Å; I425-E427 VanDerWaalsContact C-N 3.32Å; I425-E427 PolarHBondContact O-N 2.92Å; I425-K428 PolarHBondContact O-N 3.49Å; I425-V429 HydrophobicContact CG2-CG2 3.79Å; I425-V429 WeakPolarHBondContact O-CB 3.29Å; I425-V429 VanDerWaalsContact O-CG2 3.26Å; I425-V429 WeakPolarHBondContact O-CG2 3.28Å; I425-V429 PolarHBondContact O-N 2.88Å; I425-I471 HydrophobicContact CG2-CD1 4.1Å
426	P	96.2	Very high	94	Very high	20 Å²	20	39.8 Å²	39.8	13%	0.13	22%	0.218	C	C	.	.	H	α-helix	trans	-56.1	-43.4	179.2	-27.7	36.4	0	0	0	113.7	L430 I471 M475 L480	P426-L430 WeakPolarHBondContact O-CB 3.45Å; P426-L430 PolarHBondContact O-N 3.33Å; P426-I471 HydrophobicContact CB-CG2 4.2Å; P426-I471 HydrophobicContact CG-CG2 4.19Å; P426-M475 HydrophobicContact CG-CE 4.31Å; P426-M475 HydrophobicContact CG-SD 4.27Å; P426-L480 HydrophobicContact CB-CD2 4.02Å; P426-L480 HydrophobicContact CG-CD2 4.19Å
427	E	95.6	Very high	93.7	Very high	133 Å²	133	47.1 Å²	47.1	62%	0.621	25%	0.245	S	C	*	.	H	α-helix	trans	-68	-44.2	178.4	-174.5	-179	177.4	0	0	111.5	G424 I425 V429 L430 N431	G424-E427 PolarHBondContact O-N 3.23Å; I425-E427 VanDerWaalsContact C-N 3.32Å; I425-E427 PolarHBondContact O-N 2.92Å; E427-V429 PolarHBondContact O-N 2.9Å; E427-L430 WeakPolarHBondContact O-CB 3.42Å; E427-L430 PolarHBondContact O-N 2.91Å; E427-N431 VanDerWaalsContact O-CG 3.3Å; E427-N431 PolarHBondContact O-N 3.44Å; E427-N431 PolarHBondContact O-ND2 3.09Å
428	K	97.6	Very high	93.4	Very high	36 Å²	36	52.9 Å²	52.9	16%	0.157	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-42.3	178	-65.8	-179.7	-170.8	-157.5	0	111.9	S275 L278 D279 H423 G424 I425 N431 K432	S275-K428 WeakPolarHBondContact OG-CE 3.17Å; S275-K428 PolarHBondContact OG-NZ 3.47Å; L278-K428 HydrophobicContact CB-CB 4.17Å; L278-K428 HydrophobicContact CB-CD 4.5Å; D279-K428 VanDerWaalsContact OD1-CD 3.27Å; D279-K428 WeakPolarHBondContact OD1-CD 3.04Å; D279-K428 WeakPolarHBondContact OD1-CE 3.44Å; D279-K428 IonicContact OD1-NZ 3.15Å; D279-K428 PolarHBondContact OD1-NZ 3.01Å; D279-K428 IonicContact OD2-NZ 2.69Å; D279-K428 PolarHBondContact OD2-NZ 3.34Å; H423-K428 VanDerWaalsContact O-CE 3.29Å; H423-K428 WeakPolarHBondContact O-CE 3.49Å; G424-K428 WeakPolarHBondContact O-CG 3.36Å; G424-K428 PolarHBondContact O-N 3.32Å; G424-K428 VanDerWaalsContact O-N 3.11Å; I425-K428 PolarHBondContact O-N 3.49Å; K428-N431 PolarHBondContact O-N 3.25Å; K428-K432 WeakPolarHBondContact O-CG 3.49Å; K428-K432 PolarHBondContact O-N 2.88Å; K428-K432 VanDerWaalsContact O-N 3.1Å
429	V	97.9	Very high	93.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.3	-45.1	175.5	171.1	0	0	0	0	110.6	L278 L366 I425 E427 N431 K432 T433 A464 C467 L468 I471	L278-V429 HydrophobicContact CD1-CG2 4.13Å; L366-V429 HydrophobicContact CD2-CG1 4.44Å; L366-V429 HydrophobicContact CD2-CG2 3.96Å; I425-V429 HydrophobicContact CG2-CG2 3.79Å; I425-V429 WeakPolarHBondContact O-CB 3.29Å; I425-V429 VanDerWaalsContact O-CG2 3.26Å; I425-V429 WeakPolarHBondContact O-CG2 3.28Å; I425-V429 PolarHBondContact O-N 2.88Å; E427-V429 PolarHBondContact O-N 2.9Å; V429-N431 VanDerWaalsContact C-N 3.32Å; V429-N431 PolarHBondContact O-N 3.45Å; V429-K432 PolarHBondContact O-N 2.6Å; V429-K432 VanDerWaalsContact O-N 3.1Å; V429-T433 WeakPolarHBondContact O-CG2 3.28Å; V429-T433 PolarHBondContact O-N 3.47Å; V429-A464 VanDerWaalsContact CG1-O 3.31Å; V429-A464 WeakPolarHBondContact CG1-O 3.26Å; V429-C467 HydrophobicContact CG1-CB 3.86Å; V429-L468 HydrophobicContact CG1-CB 3.96Å; V429-I471 HydrophobicContact CB-CD1 4.25Å; V429-I471 HydrophobicContact CG1-CD1 4.34Å; V429-I471 HydrophobicContact CG2-CD1 3.99Å
430	L	96.7	Very high	93	Very high	37 Å²	37	56.1 Å²	56.1	19%	0.194	28%	0.279	C	S	.	.	H	α-helix	trans	-57.3	-45.9	175.7	-177.6	64.5	0	0	0	111.2	P426 E427 K432 T433 L468 A489	P426-L430 WeakPolarHBondContact O-CB 3.45Å; P426-L430 PolarHBondContact O-N 3.33Å; E427-L430 WeakPolarHBondContact O-CB 3.42Å; E427-L430 PolarHBondContact O-N 2.91Å; L430-K432 VanDerWaalsContact C-N 3.26Å; L430-K432 PolarHBondContact O-N 2.81Å; L430-T433 WeakPolarHBondContact O-CB 3.39Å; L430-T433 PolarHBondContact O-N 2.89Å; L430-T433 PolarHBondContact O-OG1 3.49Å; L430-L468 HydrophobicContact CD1-CD2 3.77Å; L430-A489 HydrophobicContact CD1-CB 4.15Å; L430-A489 HydrophobicContact CD2-CB 4.06Å
431	N	95.3	Very high	92.6	Very high	98 Å²	98	57.1 Å²	57.1	52%	0.524	29%	0.285	S	S	.	.	H	α-helix	trans	-58.9	-37.8	177	-69.8	-23.9	0	0	0	112.1	E427 K428 V429 T433 S434	E427-N431 VanDerWaalsContact O-CG 3.3Å; E427-N431 PolarHBondContact O-N 3.44Å; E427-N431 PolarHBondContact O-ND2 3.09Å; K428-N431 PolarHBondContact O-N 3.25Å; V429-N431 VanDerWaalsContact C-N 3.32Å; V429-N431 PolarHBondContact O-N 3.45Å; N431-T433 VanDerWaalsContact C-N 3.26Å; N431-T433 PolarHBondContact O-N 2.91Å; N431-S434 WeakPolarHBondContact O-CB 3.42Å; N431-S434 PolarHBondContact O-N 3.31Å; N431-S434 PolarHBondContact O-OG 3.26Å
432	K	96.1	Very high	92.4	Very high	28 Å²	28	57.5 Å²	57.5	12%	0.122	29%	0.288	C	S	.	.	H	α-helix	trans	-71.6	-12.6	177.3	-67.8	-66.2	172.4	-168	0	115.4	L278 L280 Q362 K428 V429 L430 S434 A464	L278-K432 HydrophobicContact CD2-CG 4.35Å; L278-K432 WeakPolarHBondContact O-CE 3.23Å; L278-K432 PolarHBondContact O-NZ 3.06Å; L280-K432 PolarHBondContact O-NZ 3.5Å; Q362-K432 VanDerWaalsContact NE2-NZ 3.14Å; K428-K432 WeakPolarHBondContact O-CG 3.49Å; K428-K432 PolarHBondContact O-N 2.88Å; K428-K432 VanDerWaalsContact O-N 3.1Å; V429-K432 PolarHBondContact O-N 2.6Å; V429-K432 VanDerWaalsContact O-N 3.1Å; L430-K432 VanDerWaalsContact C-N 3.26Å; L430-K432 PolarHBondContact O-N 2.81Å; K432-S434 PolarHBondContact O-N 3.27Å; K432-A464 HydrophobicContact CB-CB 3.67Å
433	T	96.1	Very high	92.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-15.5	171.1	69.6	0	0	0	0	112.7	V429 L430 N431 Q461 A464 L465 L468 H492	V429-T433 WeakPolarHBondContact O-CG2 3.28Å; V429-T433 PolarHBondContact O-N 3.47Å; L430-T433 WeakPolarHBondContact O-CB 3.39Å; L430-T433 PolarHBondContact O-N 2.89Å; L430-T433 PolarHBondContact O-OG1 3.49Å; N431-T433 VanDerWaalsContact C-N 3.26Å; N431-T433 PolarHBondContact O-N 2.91Å; T433-Q461 WeakPolarHBondContact O-CG 3.41Å; T433-Q461 PolarHBondContact O-NE2 3.19Å; T433-A464 HydrophobicContact CG2-CB 4.09Å; T433-L465 HydrophobicContact CG2-CD2 3.67Å; T433-L465 HydrophobicContact CG2-CG 3.94Å; T433-L468 HydrophobicContact CG2-CB 4.47Å; T433-L468 HydrophobicContact CG2-CD2 4.07Å; T433-H492 PolarHBondContact OG1-CD2 3.46Å; T433-H492 PolarHBondContact OG1-NE2 2.85Å
434	S	92	Very high	91.7	Very high	54 Å²	54	50.4 Å²	50.4	38%	0.378	25%	0.253	S	S	.	.	S	Bend	trans	-74	132.9	172.9	-55.1	0	0	0	0	109.7	N431 K432 H492	N431-S434 WeakPolarHBondContact O-CB 3.42Å; N431-S434 PolarHBondContact O-N 3.31Å; N431-S434 PolarHBondContact O-OG 3.26Å; K432-S434 PolarHBondContact O-N 3.27Å; S434-H492 PolarHBondContact OG-CE1 3.05Å
435	F	86.1	Confident	91.2	Very high	69 Å²	69	54.7 Å²	54.7	30%	0.303	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-69.2	144.2	173.4	-161.1	-107	0	0	0	110.3	T441 M457 Q458 Q461	F435-T441 WeakPolarHBondContact CE1-OG1 3.41Å; F435-M457 HydrophobicContact CE2-CB 4.1Å; F435-M457 HydrophobicContact CZ-CB 4.26Å; F435-Q458 HydrophobicContact CD2-CG 4.44Å; F435-Q458 HydrophobicContact CE2-CB 4.27Å; F435-Q458 HydrophobicContact CE2-CG 3.44Å; F435-Q458 VanDerWaalsContact CE2-CG 3.44Å; F435-Q458 HydrophobicContact CZ-CG 3.89Å; F435-Q461 HydrophobicContact CD2-CB 4.47Å
436	P	82.4	Confident	90.7	Very high	26 Å²	26	62 Å²	62	17%	0.169	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-56.2	154.6	177.1	-29.6	40	0	0	0	113.2	A440 M457	P436-A440 HydrophobicContact CB-CB 4.24Å; P436-M457 HydrophobicContact CB-SD 3.85Å; P436-M457 HydrophobicContact CG-CB 4.15Å; P436-M457 HydrophobicContact CG-CG 4.12Å; P436-M457 HydrophobicContact CG-SD 3.62Å
437	R	83.4	Confident	90	Very high	162 Å²	162	62.6 Å²	62.6	61%	0.611	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-57.8	155.2	-178.5	-60.4	-179.7	-171.8	172.7	5.3	111.7	E439 A440 T441	R437-E439 PolarHBondContact O-N 2.73Å; R437-E439 VanDerWaalsContact O-N 3.12Å; R437-A440 PolarHBondContact O-N 3.28Å; R437-A440 VanDerWaalsContact O-N 3.08Å; R437-T441 PolarHBondContact O-N 3.09Å
438	E	84.9	Confident	89.4	Confident	158 Å²	158	60.3 Å²	60.3	74%	0.738	30%	0.299	S	S	*	.	H	α-helix	trans	-53.1	-36.2	178.8	-71.4	-172.4	167.8	0	0	112.7	A440 T441 N442	E438-A440 PolarHBondContact O-N 3.03Å; E438-T441 WeakPolarHBondContact O-CB 3.35Å; E438-T441 PolarHBondContact O-N 3.46Å; E438-T441 VanDerWaalsContact O-N 3.11Å; E438-N442 WeakPolarHBondContact O-CB 3.48Å; E438-N442 PolarHBondContact O-N 3.1Å; E438-N442 PolarHBondContact O-ND2 2.99Å; E438-N442 PolarHBondContact O-OD1 3.23Å
439	E	87.9	Confident	88.7	Confident	96 Å²	96	60 Å²	60	45%	0.449	30%	0.302	S	S	.	.	H	α-helix	trans	-55.5	-47.7	177.2	-173.2	179.6	-179	0	0	113	P287 R291 R437 T441 N442 V443	P287-E439 HydrophobicContact CB-CG 4.32Å; P287-E439 HydrophobicContact CG-CG 4.08Å; R291-E439 IonicContact CZ-OE1 3.14Å; R291-E439 IonicContact NH2-OE1 2.65Å; R291-E439 PolarHBondContact NH2-OE1 2.8Å; R437-E439 PolarHBondContact O-N 2.73Å; R437-E439 VanDerWaalsContact O-N 3.12Å; E439-T441 VanDerWaalsContact C-N 3.28Å; E439-T441 PolarHBondContact O-N 3.3Å; E439-N442 PolarHBondContact O-N 3.1Å; E439-V443 WeakPolarHBondContact O-CG2 3.37Å; E439-V443 PolarHBondContact O-N 3.4Å; E439-V443 VanDerWaalsContact O-N 3.09Å
440	A	88.4	Confident	88.2	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-65.3	-35.3	178.2	0	0	0	0	0	112	P287 P436 R437 E438 C444	P287-A440 HydrophobicContact CG-CB 3.96Å; P436-A440 HydrophobicContact CB-CB 4.24Å; R437-A440 PolarHBondContact O-N 3.28Å; R437-A440 VanDerWaalsContact O-N 3.08Å; E438-A440 PolarHBondContact O-N 3.03Å; A440-C444 PolarHBondContact O-N 2.9Å; A440-C444 PolarHBondContact O-SG 3.26Å
441	T	87.6	Confident	87.8	Confident	22 Å²	22	64.7 Å²	64.7	14%	0.135	32%	0.317	C	S	.	.	H	α-helix	trans	-70.3	-44.2	178.4	-54.3	0	0	0	0	111.2	F435 R437 E438 E439 C444 Q445	F435-T441 WeakPolarHBondContact CE1-OG1 3.41Å; R437-T441 PolarHBondContact O-N 3.09Å; E438-T441 WeakPolarHBondContact O-CB 3.35Å; E438-T441 PolarHBondContact O-N 3.46Å; E438-T441 VanDerWaalsContact O-N 3.11Å; E439-T441 VanDerWaalsContact C-N 3.28Å; E439-T441 PolarHBondContact O-N 3.3Å; T441-C444 PolarHBondContact O-N 3.35Å; T441-Q445 WeakPolarHBondContact O-CG 3.47Å; T441-Q445 PolarHBondContact O-N 3.37Å
442	N	89	Confident	87.4	Confident	71 Å²	71	61.9 Å²	61.9	38%	0.38	31%	0.305	S	S	.	.	H	α-helix	trans	-62.3	-47	179.9	-66.9	-15.4	0	0	0	111	E438 E439 C444 Q445 E446	E438-N442 WeakPolarHBondContact O-CB 3.48Å; E438-N442 PolarHBondContact O-N 3.1Å; E438-N442 PolarHBondContact O-ND2 2.99Å; E438-N442 PolarHBondContact O-OD1 3.23Å; E439-N442 PolarHBondContact O-N 3.1Å; N442-C444 PolarHBondContact O-N 2.93Å; N442-Q445 PolarHBondContact O-N 2.91Å; N442-E446 WeakPolarHBondContact O-CG 3.36Å; N442-E446 PolarHBondContact O-N 3.38Å
443	V	89.4	Confident	87.1	Confident	25 Å²	25	60.6 Å²	60.6	15%	0.152	30%	0.299	C	S	.	.	H	α-helix	trans	-52.7	-43.9	174.4	159.5	0	0	0	0	111.8	I286 R290 E439 W450	I286-V443 HydrophobicContact CG2-CG1 4.47Å; R290-V443 HydrophobicContact CB-CG1 3.47Å; R290-V443 VanDerWaalsContact CB-CG1 3.47Å; R290-V443 HydrophobicContact CG-CG1 3.52Å; E439-V443 WeakPolarHBondContact O-CG2 3.37Å; E439-V443 PolarHBondContact O-N 3.4Å; E439-V443 VanDerWaalsContact O-N 3.09Å; V443-W450 HydrophobicContact CG1-CE3 4.39Å
444	C	88.4	Confident	86.8	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-71.7	-31.5	179.6	-64.1	0	0	0	0	112.8	A440 T441 N442 W450 R451 S454	A440-C444 PolarHBondContact O-N 2.9Å; A440-C444 PolarHBondContact O-SG 3.26Å; T441-C444 PolarHBondContact O-N 3.35Å; N442-C444 PolarHBondContact O-N 2.93Å; C444-W450 CarbonylContact O-C 3.42Å; C444-R451 WeakPolarHBondContact O-CA 3.49Å; C444-R451 VanDerWaalsContact O-CG 3.29Å; C444-R451 WeakPolarHBondContact O-CG 3.46Å; C444-R451 PolarHBondContact O-N 3.3Å; C444-R451 VanDerWaalsContact O-N 3.11Å; C444-S454 VanDerWaalsContact CB-OG 3.26Å; C444-S454 WeakPolarHBondContact CB-OG 3.4Å
445	Q	87.4	Confident	86.6	Confident	114 Å²	114	66.6 Å²	66.6	53%	0.533	32%	0.316	S	S	.	.	H	α-helix	trans	-75.9	-38.4	-179.3	-73.2	-179.4	6.7	0	0	112.9	T441 N442 N447 R451	T441-Q445 WeakPolarHBondContact O-CG 3.47Å; T441-Q445 PolarHBondContact O-N 3.37Å; N442-Q445 PolarHBondContact O-N 2.91Å; Q445-N447 VanDerWaalsContact C-N 3.34Å; Q445-N447 PolarHBondContact O-N 3.35Å; Q445-R451 PolarHBondContact O-NE 3.43Å
446	E	86.9	Confident	86.8	Confident	154 Å²	154	64.2 Å²	64.2	72%	0.72	31%	0.305	S	S	*	.	H	α-helix	trans	-64.8	-35.4	-176.9	-73.5	174.3	-175.9	0	0	112.7	N442	N442-E446 WeakPolarHBondContact O-CG 3.36Å; N442-E446 PolarHBondContact O-N 3.38Å
447	N	80.1	Confident	87.3	Confident	32 Å²	32	63.1 Å²	63.1	17%	0.171	30%	0.298	C	S	.	.	S	Bend	trans	-105	119.8	-179.6	-172.8	-44.7	0	0	0	111.9	R290 Q445 S449 W450 R451	R290-N447 PolarHBondContact NH1-ND2 2.81Å; Q445-N447 VanDerWaalsContact C-N 3.34Å; Q445-N447 PolarHBondContact O-N 3.35Å; N447-S449 PolarHBondContact O-N 3.11Å; N447-S449 VanDerWaalsContact O-N 3.11Å; N447-S449 PolarHBondContact OD1-N 3.39Å; N447-S449 PolarHBondContact OD1-OG 3.25Å; N447-W450 HydrophobicContact CB-CB 4.27Å; N447-W450 HydrophobicContact CB-CG 4.4Å; N447-W450 PolarHBondContact O-N 3.11Å; N447-R451 PolarHBondContact O-N 3.44Å
448	P	83.6	Confident	87.6	Confident	84 Å²	84	59.8 Å²	59.8	55%	0.545	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-49.9	-40	179.2	-28.1	34.7	0	0	0	114.5	W450 R451	P448-W450 VanDerWaalsContact C-N 3.31Å; P448-W450 PolarHBondContact O-N 3.37Å; P448-R451 PolarHBondContact O-N 2.89Å
449	S	82.8	Confident	88	Confident	30 Å²	30	53.5 Å²	53.5	21%	0.21	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-74.8	-16.8	-177.8	62.4	0	0	0	0	114.9	K349 L352 N447	K349-S449 PolarHBondContact NZ-OG 3.39Å; L352-S449 WeakPolarHBondContact CD2-O 3.46Å; N447-S449 PolarHBondContact O-N 3.11Å; N447-S449 VanDerWaalsContact O-N 3.11Å; N447-S449 PolarHBondContact OD1-N 3.39Å; N447-S449 PolarHBondContact OD1-OG 3.25Å
450	W	88.7	Confident	88.3	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-97.9	-11.6	176.4	-72.4	62.7	0	0	0	112.7	I286 L289 R290 E293 E351 L352 A355 V443 C444 N447 P448 S452 L453	I286-W450 HydrophobicContact CG2-CE3 4.19Å; I286-W450 HydrophobicContact CG2-CZ3 3.97Å; L289-W450 HydrophobicContact CB-CH2 3.83Å; L289-W450 HydrophobicContact CB-CZ3 4.45Å; R290-W450 HydrophobicContact CB-CH2 4.21Å; R290-W450 HydrophobicContact CB-CZ3 4.23Å; E293-W450 PolarHBondContact OE1-NE1 2.99Å; E293-W450 VanDerWaalsContact OE2-CE2 3.25Å; E293-W450 VanDerWaalsContact OE2-CZ2 3.3Å; E293-W450 WeakPolarHBondContact OE2-CZ2 3.33Å; E293-W450 PolarHBondContact OE2-NE1 3.15Å; E351-W450 HydrophobicContact CB-CH2 4.35Å; E351-W450 HydrophobicContact CB-CZ2 4.17Å; L352-W450 HydrophobicContact CB-CZ2 4.2Å; L352-W450 HydrophobicContact CD1-CD2 3.99Å; L352-W450 HydrophobicContact CD1-CG 4.06Å; A355-W450 HydrophobicContact CB-CH2 4.15Å; A355-W450 HydrophobicContact CB-CZ3 3.96Å; V443-W450 HydrophobicContact CG1-CE3 4.39Å; C444-W450 CarbonylContact O-C 3.42Å; N447-W450 HydrophobicContact CB-CB 4.27Å; N447-W450 HydrophobicContact CB-CG 4.4Å; N447-W450 PolarHBondContact O-N 3.11Å; P448-W450 VanDerWaalsContact C-N 3.31Å; P448-W450 PolarHBondContact O-N 3.37Å; W450-S452 PolarHBondContact O-N 2.98Å; W450-L453 HydrophobicContact CB-CD1 4.37Å; W450-L453 HydrophobicContact CD2-CD1 3.92Å; W450-L453 HydrophobicContact CE3-CD1 3.26Å; W450-L453 HydrophobicContact CG-CD1 4.43Å; W450-L453 HydrophobicContact CZ3-CD1 3.75Å; W450-L453 VanDerWaalsContact O-CB 3.29Å; W450-L453 WeakPolarHBondContact O-CB 3.34Å; W450-L453 WeakPolarHBondContact O-CG 3.3Å; W450-L453 PolarHBondContact O-N 3.21Å
451	R	87.6	Confident	88.7	Confident	135 Å²	135	50.1 Å²	50.1	51%	0.509	24%	0.244	S	C	.	.	H	α-helix	trans	-55.9	-30.5	-177.4	-72.2	-178.1	-171.2	167.5	7.6	113.6	C444 Q445 N447 P448 L453 S454	C444-R451 WeakPolarHBondContact O-CA 3.49Å; C444-R451 VanDerWaalsContact O-CG 3.29Å; C444-R451 WeakPolarHBondContact O-CG 3.46Å; C444-R451 PolarHBondContact O-N 3.3Å; C444-R451 VanDerWaalsContact O-N 3.11Å; Q445-R451 PolarHBondContact O-NE 3.43Å; N447-R451 PolarHBondContact O-N 3.44Å; P448-R451 PolarHBondContact O-N 2.89Å; R451-L453 PolarHBondContact O-N 3.09Å; R451-S454 PolarHBondContact O-N 2.82Å
452	S	85.8	Confident	89	Confident	40 Å²	40	49.2 Å²	49.2	28%	0.28	24%	0.238	S	C	.	.	H	α-helix	trans	-61.6	-30.9	176.6	63	0	0	0	0	112.7	W450 S454 R455 R456	W450-S452 PolarHBondContact O-N 2.98Å; S452-S454 VanDerWaalsContact C-N 3.28Å; S452-S454 PolarHBondContact O-N 3.02Å; S452-R455 PolarHBondContact O-N 3.02Å; S452-R456 PolarHBondContact O-N 3.25Å
453	L	89.8	Confident	89.3	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-65.5	-31.1	-178	-61.3	178.6	0	0	0	112.1	L352 A355 L359 W450 R451 R455 R456 M457	L352-L453 HydrophobicContact CD1-CD1 3.85Å; L352-L453 HydrophobicContact CD1-CD2 4.26Å; L352-L453 HydrophobicContact CD1-CG 4.07Å; A355-L453 HydrophobicContact CB-CD1 3.81Å; A355-L453 HydrophobicContact CB-CD2 4.36Å; L359-L453 HydrophobicContact CD1-CB 4.2Å; L359-L453 HydrophobicContact CD1-CD2 4Å; W450-L453 HydrophobicContact CB-CD1 4.37Å; W450-L453 HydrophobicContact CD2-CD1 3.92Å; W450-L453 HydrophobicContact CE3-CD1 3.26Å; W450-L453 HydrophobicContact CG-CD1 4.43Å; W450-L453 HydrophobicContact CZ3-CD1 3.75Å; W450-L453 VanDerWaalsContact O-CB 3.29Å; W450-L453 WeakPolarHBondContact O-CB 3.34Å; W450-L453 WeakPolarHBondContact O-CG 3.3Å; W450-L453 PolarHBondContact O-N 3.21Å; R451-L453 PolarHBondContact O-N 3.09Å; L453-R455 VanDerWaalsContact C-N 3.3Å; L453-R455 PolarHBondContact O-N 3.38Å; L453-R456 CarbonylContact O-C 3.59Å; L453-R456 WeakPolarHBondContact O-CB 3.18Å; L453-R456 PolarHBondContact O-N 3.08Å; L453-R456 VanDerWaalsContact O-N 3.1Å; L453-M457 WeakPolarHBondContact O-CG 3.48Å; L453-M457 PolarHBondContact O-N 3.41Å
454	S	89.7	Confident	89.7	Confident	18 Å²	18	46.6 Å²	46.6	13%	0.126	22%	0.22	C	C	.	.	H	α-helix	trans	-57.8	-43.3	174.4	-61	0	0	0	0	112	C444 R451 S452 M457 Q458	C444-S454 VanDerWaalsContact CB-OG 3.26Å; C444-S454 WeakPolarHBondContact CB-OG 3.4Å; R451-S454 PolarHBondContact O-N 2.82Å; S452-S454 VanDerWaalsContact C-N 3.28Å; S452-S454 PolarHBondContact O-N 3.02Å; S454-M457 PolarHBondContact O-N 3.42Å; S454-Q458 WeakPolarHBondContact O-CG 3.26Å; S454-Q458 PolarHBondContact O-N 3.11Å; S454-Q458 VanDerWaalsContact O-N 3.12Å
455	R	88	Confident	90.2	Very high	163 Å²	163	46.6 Å²	46.6	62%	0.615	22%	0.22	S	C	*	.	H	α-helix	trans	-66.5	-39	175.2	-72.3	-173.7	-77.7	176.7	-5.1	111.7	S452 L453 Q458 R459	S452-R455 PolarHBondContact O-N 3.02Å; L453-R455 VanDerWaalsContact C-N 3.3Å; L453-R455 PolarHBondContact O-N 3.38Å; R455-Q458 WeakPolarHBondContact O-CB 3.43Å; R455-Q458 PolarHBondContact O-N 3.39Å; R455-R459 PolarHBondContact O-N 3.49Å
456	R	90.5	Very high	90.6	Very high	18 Å²	18	42.6 Å²	42.6	7%	0.068	20%	0.204	C	C	.	.	H	α-helix	trans	-64.8	-40.2	175.5	-66.7	-176.8	-173.5	-88.3	-3	112.4	D340 L359 S452 L453 Q458 R459 V460	D340-R456 IonicContact OD1-CZ 3.87Å; D340-R456 IonicContact OD1-NH1 2.78Å; D340-R456 PolarHBondContact OD1-NH1 3.21Å; D340-R456 IonicContact OD1-NH2 3.58Å; D340-R456 PolarHBondContact OD1-NH2 3.13Å; D340-R456 IonicContact OD2-CZ 2.86Å; D340-R456 IonicContact OD2-NH1 2.82Å; D340-R456 PolarHBondContact OD2-NH1 3.06Å; L359-R456 HydrophobicContact CB-CB 4.16Å; L359-R456 HydrophobicContact CD1-CB 3.57Å; L359-R456 HydrophobicContact CG-CB 4.5Å; S452-R456 PolarHBondContact O-N 3.25Å; L453-R456 CarbonylContact O-C 3.59Å; L453-R456 WeakPolarHBondContact O-CB 3.18Å; L453-R456 PolarHBondContact O-N 3.08Å; L453-R456 VanDerWaalsContact O-N 3.1Å; R456-Q458 VanDerWaalsContact C-N 3.33Å; R456-Q458 PolarHBondContact O-N 3.12Å; R456-R459 WeakPolarHBondContact O-CB 3.45Å; R456-R459 PolarHBondContact O-N 3.33Å; R456-R459 VanDerWaalsContact O-N 3.17Å; R456-V460 WeakPolarHBondContact O-CG2 3.49Å; R456-V460 PolarHBondContact O-N 2.66Å
457	M	92.9	Very high	91	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-61.5	-41.8	174.6	-71.6	-172.4	-69.4	0	0	111.4	I286 L359 F435 P436 L453 S454 R459 V460 Q461	I286-M457 HydrophobicContact CD1-CE 4.49Å; I286-M457 HydrophobicContact CD1-CG 4.06Å; I286-M457 HydrophobicContact CD1-SD 3.53Å; I286-M457 VanDerWaalsContact CD1-SD 3.53Å; L359-M457 HydrophobicContact CD1-CG 3.82Å; L359-M457 HydrophobicContact CD2-CG 3.89Å; F435-M457 HydrophobicContact CE2-CB 4.1Å; F435-M457 HydrophobicContact CZ-CB 4.26Å; P436-M457 HydrophobicContact CB-SD 3.85Å; P436-M457 HydrophobicContact CG-CB 4.15Å; P436-M457 HydrophobicContact CG-CG 4.12Å; P436-M457 HydrophobicContact CG-SD 3.62Å; L453-M457 WeakPolarHBondContact O-CG 3.48Å; L453-M457 PolarHBondContact O-N 3.41Å; S454-M457 PolarHBondContact O-N 3.42Å; M457-R459 VanDerWaalsContact C-N 3.31Å; M457-R459 PolarHBondContact O-N 3.27Å; M457-V460 PolarHBondContact O-N 3.38Å; M457-Q461 PolarHBondContact O-N 2.89Å
458	Q	91	Very high	91.8	Very high	92 Å²	92	34.1 Å²	34.1	43%	0.43	16%	0.163	S	C	.	.	H	α-helix	trans	-62.2	-39	173.7	-70.6	173.1	-20.5	0	0	111.9	F435 S454 R455 R456 Q461 S462	F435-Q458 HydrophobicContact CD2-CG 4.44Å; F435-Q458 HydrophobicContact CE2-CB 4.27Å; F435-Q458 HydrophobicContact CE2-CG 3.44Å; F435-Q458 VanDerWaalsContact CE2-CG 3.44Å; F435-Q458 HydrophobicContact CZ-CG 3.89Å; S454-Q458 WeakPolarHBondContact O-CG 3.26Å; S454-Q458 PolarHBondContact O-N 3.11Å; S454-Q458 VanDerWaalsContact O-N 3.12Å; R455-Q458 WeakPolarHBondContact O-CB 3.43Å; R455-Q458 PolarHBondContact O-N 3.39Å; R456-Q458 VanDerWaalsContact C-N 3.33Å; R456-Q458 PolarHBondContact O-N 3.12Å; Q458-Q461 WeakPolarHBondContact O-CB 3.36Å; Q458-Q461 PolarHBondContact O-N 3.36Å; Q458-S462 PolarHBondContact O-N 3.4Å; Q458-S462 PolarHBondContact O-OG 3.39Å
459	R	92.1	Very high	92.4	Very high	27 Å²	27	30.8 Å²	30.8	10%	0.102	14%	0.14	C	C	.	.	H	α-helix	trans	-65.6	-44.3	175.7	-164.1	178.3	-60	129.4	11.2	112.1	D338 Q363 R455 R456 M457 Q461 S462 R463	D338-R459 IonicContact OD1-CZ 2.84Å; D338-R459 IonicContact OD1-NH2 2.98Å; D338-R459 PolarHBondContact OD1-NH2 3.25Å; D338-R459 IonicContact OD2-CZ 3.23Å; D338-R459 IonicContact OD2-NE 2.96Å; D338-R459 PolarHBondContact OD2-NE 3.19Å; D338-R459 IonicContact OD2-NH2 2.83Å; D338-R459 PolarHBondContact OD2-NH2 3.1Å; Q363-R459 VanDerWaalsContact OE1-CD 3.26Å; R455-R459 PolarHBondContact O-N 3.49Å; R456-R459 WeakPolarHBondContact O-CB 3.45Å; R456-R459 PolarHBondContact O-N 3.33Å; R456-R459 VanDerWaalsContact O-N 3.17Å; M457-R459 VanDerWaalsContact C-N 3.31Å; M457-R459 PolarHBondContact O-N 3.27Å; R459-Q461 VanDerWaalsContact C-N 3.3Å; R459-Q461 PolarHBondContact O-N 2.91Å; R459-S462 PolarHBondContact O-N 3.41Å; R459-R463 HydrophobicContact CG-CG 4.38Å; R459-R463 WeakPolarHBondContact O-CB 3Å; R459-R463 VanDerWaalsContact O-CG 3.22Å; R459-R463 WeakPolarHBondContact O-CG 3.38Å; R459-R463 PolarHBondContact O-N 2.86Å
460	V	95.4	Very high	92.9	Very high	8 Å²	8	29.4 Å²	29.4	5%	0.048	13%	0.131	C	C	.	.	H	α-helix	trans	-57.7	-44.8	173.9	172.9	0	0	0	0	110.4	L359 Q362 Q363 L366 R456 M457 S462 R463 A464	L359-V460 HydrophobicContact CB-CG2 4.35Å; L359-V460 HydrophobicContact CD2-CG2 4.26Å; L359-V460 WeakPolarHBondContact O-CG2 3.33Å; Q362-V460 HydrophobicContact CB-CG1 4.07Å; Q362-V460 HydrophobicContact CB-CG2 4.25Å; Q363-V460 HydrophobicContact CB-CG2 4.21Å; L366-V460 HydrophobicContact CD1-CG1 4.04Å; R456-V460 WeakPolarHBondContact O-CG2 3.49Å; R456-V460 PolarHBondContact O-N 2.66Å; M457-V460 PolarHBondContact O-N 3.38Å; V460-S462 PolarHBondContact O-N 3.05Å; V460-R463 PolarHBondContact O-N 3.11Å; V460-A464 WeakPolarHBondContact O-CB 3.44Å; V460-A464 PolarHBondContact O-N 2.71Å
461	Q	95.8	Very high	93.1	Very high	17 Å²	17	29.5 Å²	29.5	8%	0.079	13%	0.131	C	C	.	.	H	α-helix	trans	-59.3	-48.5	176.9	-168.2	-170.4	22.9	0	0	112.1	T433 F435 M457 Q458 R459 R463 A464 L465 F509	T433-Q461 WeakPolarHBondContact O-CG 3.41Å; T433-Q461 PolarHBondContact O-NE2 3.19Å; F435-Q461 HydrophobicContact CD2-CB 4.47Å; M457-Q461 PolarHBondContact O-N 2.89Å; Q458-Q461 WeakPolarHBondContact O-CB 3.36Å; Q458-Q461 PolarHBondContact O-N 3.36Å; R459-Q461 VanDerWaalsContact C-N 3.3Å; R459-Q461 PolarHBondContact O-N 2.91Å; Q461-R463 PolarHBondContact O-N 3.48Å; Q461-A464 WeakPolarHBondContact O-CB 3.24Å; Q461-A464 PolarHBondContact O-N 3.32Å; Q461-L465 HydrophobicContact CG-CD1 4.49Å; Q461-L465 WeakPolarHBondContact O-CG 3.4Å; Q461-L465 PolarHBondContact O-N 3.41Å; Q461-F509 HydrophobicContact CG-CE2 4.44Å
462	S	94.4	Very high	93.3	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.021	11%	0.109	C	C	.	.	H	α-helix	trans	-66.2	-37.6	-179.4	-57.6	0	0	0	0	112.1	Q458 R459 V460 L465 T466 A512	Q458-S462 PolarHBondContact O-N 3.4Å; Q458-S462 PolarHBondContact O-OG 3.39Å; R459-S462 PolarHBondContact O-N 3.41Å; V460-S462 PolarHBondContact O-N 3.05Å; S462-L465 PolarHBondContact O-N 3.02Å; S462-T466 PolarHBondContact O-N 3.05Å; S462-T466 PolarHBondContact O-OG1 3.22Å; S462-A512 WeakPolarHBondContact O-CB 3.38Å
463	R	95.6	Very high	93.5	Very high	40 Å²	40	24 Å²	24	15%	0.151	11%	0.113	C	C	.	.	H	α-helix	trans	-67.4	-36	172.5	-68.6	-73.8	-177.8	-91.6	-10.5	111.9	F9 Q363 L366 E367 R459 V460 Q461 T466 C467 E508	F9-R463 VanDerWaalsContact CZ-CD 3.46Å; Q363-R463 HydrophobicContact CG-CG 4.19Å; L366-R463 HydrophobicContact CB-CB 4.19Å; L366-R463 HydrophobicContact CD1-CB 4.1Å; E367-R463 WeakPolarHBondContact OE1-CD 3.44Å; E367-R463 IonicContact OE1-NE 2.9Å; E367-R463 PolarHBondContact OE1-NE 3.35Å; R459-R463 HydrophobicContact CG-CG 4.38Å; R459-R463 WeakPolarHBondContact O-CB 3Å; R459-R463 VanDerWaalsContact O-CG 3.22Å; R459-R463 WeakPolarHBondContact O-CG 3.38Å; R459-R463 PolarHBondContact O-N 2.86Å; V460-R463 PolarHBondContact O-N 3.11Å; Q461-R463 PolarHBondContact O-N 3.48Å; R463-T466 PolarHBondContact O-N 3.24Å; R463-C467 VanDerWaalsContact O-CB 3.3Å; R463-C467 WeakPolarHBondContact O-CB 3.48Å; R463-C467 PolarHBondContact O-N 3.34Å; R463-E508 IonicContact CZ-OE1 3.96Å; R463-E508 VanDerWaalsContact CZ-OE1 3.29Å; R463-E508 IonicContact NH1-OE1 2.9Å; R463-E508 PolarHBondContact NH1-OE1 3.12Å; R463-E508 IonicContact NH2-OE1 3.28Å; R463-E508 PolarHBondContact NH2-OE1 3.08Å
464	A	98	Very high	93.4	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.8	-40.9	175.3	0	0	0	0	0	111.3	L366 V429 K432 T433 V460 Q461 C467 L468	L366-A464 HydrophobicContact CD1-CB 3.84Å; L366-A464 HydrophobicContact CD2-CB 4.18Å; V429-A464 VanDerWaalsContact CG1-O 3.31Å; V429-A464 WeakPolarHBondContact CG1-O 3.26Å; K432-A464 HydrophobicContact CB-CB 3.67Å; T433-A464 HydrophobicContact CG2-CB 4.09Å; V460-A464 WeakPolarHBondContact O-CB 3.44Å; V460-A464 PolarHBondContact O-N 2.71Å; Q461-A464 WeakPolarHBondContact O-CB 3.24Å; Q461-A464 PolarHBondContact O-N 3.32Å; A464-C467 WeakPolarHBondContact O-CB 3.27Å; A464-C467 PolarHBondContact O-N 3.09Å; A464-L468 WeakPolarHBondContact O-CB 3.46Å; A464-L468 PolarHBondContact O-N 2.91Å
465	L	97.7	Very high	93.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.7	-41.5	174.1	-72.9	164.2	0	0	0	111.9	T433 Q461 S462 C467 L468 H469 L493 L496 F509 A512 V513	T433-L465 HydrophobicContact CG2-CD2 3.67Å; T433-L465 HydrophobicContact CG2-CG 3.94Å; Q461-L465 HydrophobicContact CG-CD1 4.49Å; Q461-L465 WeakPolarHBondContact O-CG 3.4Å; Q461-L465 PolarHBondContact O-N 3.41Å; S462-L465 PolarHBondContact O-N 3.02Å; L465-C467 VanDerWaalsContact C-N 3.35Å; L465-L468 PolarHBondContact O-N 3.24Å; L465-H469 PolarHBondContact O-N 2.97Å; L465-L493 HydrophobicContact CD2-CD2 3.62Å; L465-L496 HydrophobicContact CD2-CD1 4.19Å; L465-F509 HydrophobicContact CD1-CD2 3.76Å; L465-F509 HydrophobicContact CD1-CE2 3.59Å; L465-F509 HydrophobicContact CD1-CZ 4.44Å; L465-A512 HydrophobicContact CB-CB 3.61Å; L465-A512 HydrophobicContact CD1-CB 4.38Å; L465-V513 HydrophobicContact CD1-CB 3.87Å; L465-V513 HydrophobicContact CD1-CG2 4.38Å; L465-V513 HydrophobicContact CD2-CB 4.15Å; L465-V513 HydrophobicContact CD2-CG2 3.99Å
466	T	95.4	Very high	93.4	Very high	30 Å²	30	20 Å²	20	18%	0.184	10%	0.103	C	C	.	.	H	α-helix	trans	-66.4	-38.3	175.5	-51.5	0	0	0	0	111.9	F9 S462 R463 H469 S470	F9-T466 HydrophobicContact CE2-CG2 3.58Å; F9-T466 HydrophobicContact CZ-CG2 3.52Å; S462-T466 PolarHBondContact O-N 3.05Å; S462-T466 PolarHBondContact O-OG1 3.22Å; R463-T466 PolarHBondContact O-N 3.24Å; T466-H469 WeakPolarHBondContact O-CB 3.43Å; T466-H469 PolarHBondContact O-N 3.04Å; T466-S470 PolarHBondContact O-N 2.91Å; T466-S470 PolarHBondContact O-OG 3.24Å
467	C	96.9	Very high	93.3	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.2	-44.3	172.7	-173.3	0	0	0	0	111.7	L366 I369 V370 V429 R463 A464 L465 H469 S470 I471	L366-C467 HydrophobicContact CB-CB 4.36Å; L366-C467 HydrophobicContact CD2-CB 4.02Å; I369-C467 WeakPolarHBondContact CG2-SG 3.3Å; V370-C467 VanDerWaalsContact CG2-CA 3.41Å; V370-C467 HydrophobicContact CG2-CB 3.71Å; V429-C467 HydrophobicContact CG1-CB 3.86Å; R463-C467 VanDerWaalsContact O-CB 3.3Å; R463-C467 WeakPolarHBondContact O-CB 3.48Å; R463-C467 PolarHBondContact O-N 3.34Å; A464-C467 WeakPolarHBondContact O-CB 3.27Å; A464-C467 PolarHBondContact O-N 3.09Å; L465-C467 VanDerWaalsContact C-N 3.35Å; C467-H469 PolarHBondContact O-N 3.05Å; C467-S470 WeakPolarHBondContact O-CB 3.48Å; C467-S470 PolarHBondContact O-N 3.45Å; C467-S470 VanDerWaalsContact O-N 3.14Å; C467-I471 WeakPolarHBondContact O-CG1 2.99Å; C467-I471 PolarHBondContact O-N 2.91Å
468	L	97.3	Very high	93.2	Very high	8 Å²	8	25 Å²	25	4%	0.042	13%	0.128	C	C	.	.	H	α-helix	trans	-61.2	-45.8	175.9	-176.9	61.9	0	0	0	111	V429 L430 T433 A464 L465 S470 I471 L472 L493 A516	V429-L468 HydrophobicContact CG1-CB 3.96Å; L430-L468 HydrophobicContact CD1-CD2 3.77Å; T433-L468 HydrophobicContact CG2-CB 4.47Å; T433-L468 HydrophobicContact CG2-CD2 4.07Å; A464-L468 WeakPolarHBondContact O-CB 3.46Å; A464-L468 PolarHBondContact O-N 2.91Å; L465-L468 PolarHBondContact O-N 3.24Å; L468-S470 VanDerWaalsContact C-N 3.25Å; L468-S470 PolarHBondContact O-N 3.19Å; L468-I471 PolarHBondContact O-N 2.91Å; L468-L472 HydrophobicContact CD1-CD1 4.18Å; L468-L472 HydrophobicContact CD1-CG 4.18Å; L468-L472 HydrophobicContact CD2-CD1 4.48Å; L468-L472 HydrophobicContact CG-CD1 3.81Å; L468-L472 HydrophobicContact CG-CG 4.28Å; L468-L472 WeakPolarHBondContact O-CB 3.47Å; L468-L472 WeakPolarHBondContact O-CG 3.35Å; L468-L472 PolarHBondContact O-N 3.45Å; L468-L493 HydrophobicContact CD2-CD1 4.19Å; L468-L493 HydrophobicContact CD2-CD2 4.02Å; L468-L493 HydrophobicContact CD2-CG 4.47Å; L468-A516 HydrophobicContact CD2-CB 4.42Å
469	H	94.3	Very high	93.1	Very high	14 Å²	14	22.2 Å²	22.2	7%	0.065	12%	0.118	C	C	.	.	H	α-helix	trans	-52.9	-44.4	173	168	62.6	0	0	0	112	L465 T466 C467 S473 S515 A516 R518 S519	L465-H469 PolarHBondContact O-N 2.97Å; T466-H469 WeakPolarHBondContact O-CB 3.43Å; T466-H469 PolarHBondContact O-N 3.04Å; C467-H469 PolarHBondContact O-N 3.05Å; H469-S473 PolarHBondContact CE1-OG 2.72Å; H469-S473 WeakPolarHBondContact O-CB 3.5Å; H469-S473 PolarHBondContact O-N 2.91Å; H469-S473 PolarHBondContact O-OG 2.85Å; H469-S515 PolarHBondContact ND1-O 3.36Å; H469-A516 HydrophobicContact CB-CB 4.07Å; H469-R518 PolarHBondContact CE1-NH2 3.2Å; H469-S519 PolarHBondContact CE1-OG 3.28Å; H469-S519 PolarHBondContact ND1-OG 3.32Å
470	S	93.3	Very high	93.1	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.014	12%	0.12	C	C	.	.	H	α-helix	trans	-68.6	-42.6	-178.5	-56.1	0	0	0	0	112.6	T466 C467 L468 S473 T474	T466-S470 PolarHBondContact O-N 2.91Å; T466-S470 PolarHBondContact O-OG 3.24Å; C467-S470 WeakPolarHBondContact O-CB 3.48Å; C467-S470 PolarHBondContact O-N 3.45Å; C467-S470 VanDerWaalsContact O-N 3.14Å; L468-S470 VanDerWaalsContact C-N 3.25Å; L468-S470 PolarHBondContact O-N 3.19Å; S470-S473 PolarHBondContact O-N 3.39Å; S470-T474 PolarHBondContact O-N 3.14Å; S470-T474 PolarHBondContact O-OG1 3.27Å
471	I	94.1	Very high	92.8	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-59.8	-51.4	173.4	-75.3	172.2	0	0	0	110.8	I369 I425 P426 V429 C467 L468 S473 T474 M475 L480	I369-I471 HydrophobicContact CG2-CD1 4.26Å; I425-I471 HydrophobicContact CG2-CD1 4.1Å; P426-I471 HydrophobicContact CB-CG2 4.2Å; P426-I471 HydrophobicContact CG-CG2 4.19Å; V429-I471 HydrophobicContact CB-CD1 4.25Å; V429-I471 HydrophobicContact CG1-CD1 4.34Å; V429-I471 HydrophobicContact CG2-CD1 3.99Å; C467-I471 WeakPolarHBondContact O-CG1 2.99Å; C467-I471 PolarHBondContact O-N 2.91Å; L468-I471 PolarHBondContact O-N 2.91Å; I471-S473 PolarHBondContact O-N 2.95Å; I471-T474 PolarHBondContact O-N 3.17Å; I471-T474 VanDerWaalsContact O-N 3.16Å; I471-T474 PolarHBondContact O-OG1 2.63Å; I471-M475 HydrophobicContact CG2-SD 3.72Å; I471-M475 WeakPolarHBondContact O-CB 3.49Å; I471-M475 PolarHBondContact O-N 2.87Å; I471-L480 HydrophobicContact CG2-CD2 3.65Å
472	L	92.5	Very high	92.6	Very high	10 Å²	10	24.4 Å²	24.4	5%	0.052	15%	0.15	C	C	.	.	H	α-helix	trans	-60	-33.1	178.6	-70.4	168.2	0	0	0	112.3	L468 T474 L480 L486 A516 L520 I523	L468-L472 HydrophobicContact CD1-CD1 4.18Å; L468-L472 HydrophobicContact CD1-CG 4.18Å; L468-L472 HydrophobicContact CD2-CD1 4.48Å; L468-L472 HydrophobicContact CG-CD1 3.81Å; L468-L472 HydrophobicContact CG-CG 4.28Å; L468-L472 WeakPolarHBondContact O-CB 3.47Å; L468-L472 WeakPolarHBondContact O-CG 3.35Å; L468-L472 PolarHBondContact O-N 3.45Å; L472-T474 VanDerWaalsContact C-N 3.31Å; L472-T474 PolarHBondContact O-N 3.1Å; L472-L480 HydrophobicContact CD2-CD1 3.95Å; L472-L486 HydrophobicContact CD2-CD2 4.47Å; L472-A516 WeakPolarHBondContact CD1-O 3.32Å; L472-L520 HydrophobicContact CD1-CB 3.84Å; L472-L520 HydrophobicContact CD2-CB 4.46Å; L472-L520 HydrophobicContact CD2-CD1 3.9Å; L472-I523 HydrophobicContact CB-CD1 4.08Å; L472-I523 HydrophobicContact CD2-CD1 3.79Å; L472-I523 VanDerWaalsContact O-CD1 3.26Å; L472-I523 WeakPolarHBondContact O-CD1 3.37Å
473	S	89.7	Confident	92.6	Very high	50 Å²	50	29.2 Å²	29.2	35%	0.35	17%	0.172	S	C	.	.	H	α-helix	trans	-79.3	-13.4	-177.7	-55.4	0	0	0	0	113.6	H469 S470 I471 S519	H469-S473 PolarHBondContact CE1-OG 2.72Å; H469-S473 WeakPolarHBondContact O-CB 3.5Å; H469-S473 PolarHBondContact O-N 2.91Å; H469-S473 PolarHBondContact O-OG 2.85Å; S470-S473 PolarHBondContact O-N 3.39Å; I471-S473 PolarHBondContact O-N 2.95Å; S473-S519 PolarHBondContact OG-OG 3.19Å
474	T	87.8	Confident	92.4	Very high	20 Å²	20	31 Å²	31	12%	0.123	20%	0.195	C	C	.	.	H	α-helix	trans	-123.5	-12.9	-171.7	54.2	0	0	0	0	114.9	C373 S470 I471 L472	C373-T474 HydrophobicContact CB-CG2 4.48Å; C373-T474 WeakPolarHBondContact O-CG2 3.37Å; S470-T474 PolarHBondContact O-N 3.14Å; S470-T474 PolarHBondContact O-OG1 3.27Å; I471-T474 PolarHBondContact O-N 3.17Å; I471-T474 VanDerWaalsContact O-N 3.16Å; I471-T474 PolarHBondContact O-OG1 2.63Å; L472-T474 VanDerWaalsContact C-N 3.31Å; L472-T474 PolarHBondContact O-N 3.1Å
475	M	88.8	Confident	92.1	Very high	12 Å²	12	33 Å²	33	6%	0.059	21%	0.211	C	C	.	.	S	Bend	trans	-111.9	150.7	-179.5	-61.3	-179.8	75.6	0	0	111.7	L412 Q417 I421 P426 I471 L480	L412-M475 HydrophobicContact CD1-CG 4.11Å; Q417-M475 HydrophobicContact CG-CE 4.03Å; I421-M475 HydrophobicContact CD1-CE 3.69Å; I421-M475 HydrophobicContact CG1-CE 3.37Å; P426-M475 HydrophobicContact CG-CE 4.31Å; P426-M475 HydrophobicContact CG-SD 4.27Å; I471-M475 HydrophobicContact CG2-SD 3.72Å; I471-M475 WeakPolarHBondContact O-CB 3.49Å; I471-M475 PolarHBondContact O-N 2.87Å; M475-L480 HydrophobicContact CB-CD1 4.28Å; M475-L480 HydrophobicContact CB-CD2 4.12Å; M475-L480 HydrophobicContact CB-CG 4.1Å; M475-L480 HydrophobicContact SD-CD2 4.21Å
476	D	87.8	Confident	91.9	Very high	65 Å²	65	33.1 Å²	33.1	35%	0.348	21%	0.212	S	C	.	.			trans	-79.2	160.9	176	64.2	91	0	0	0	112.6	Q417 E478 S479 L480	Q417-D476 PolarHBondContact NE2-OD2 3.34Å; D476-E478 VanDerWaalsContact C-N 3.28Å; D476-E478 PolarHBondContact O-N 3.48Å; D476-E478 WeakPolarHBondContact OD1-CB 3.38Å; D476-E478 PolarHBondContact OD1-N 3.45Å; D476-S479 VanDerWaalsContact CG-OG 3.28Å; D476-S479 PolarHBondContact O-N 3.46Å; D476-S479 PolarHBondContact OD1-N 3.48Å; D476-S479 PolarHBondContact OD1-OG 2.89Å; D476-S479 WeakPolarHBondContact OD2-CB 3.29Å; D476-S479 PolarHBondContact OD2-OG 2.93Å; D476-L480 VanDerWaalsContact O-CG 3.31Å; D476-L480 WeakPolarHBondContact O-CG 3.35Å; D476-L480 PolarHBondContact O-N 3.01Å
477	A	89.6	Confident	91.8	Very high	6 Å²	6	35.1 Å²	35.1	5%	0.05	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-36.5	-176.6	0	0	0	0	0	112.9	L480 G482 L486 I523 K527	A477-L480 PolarHBondContact O-N 3.46Å; A477-G482 WeakPolarHBondContact O-CA 3.5Å; A477-G482 PolarHBondContact O-N 2.86Å; A477-L486 HydrophobicContact CB-CD1 3.79Å; A477-I523 HydrophobicContact CB-CG2 3.86Å; A477-K527 HydrophobicContact CB-CD 4.27Å; A477-K527 HydrophobicContact CB-CG 4Å
478	E	89.8	Confident	91.6	Very high	120 Å²	120	37.1 Å²	37.1	56%	0.561	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-44.1	-178.6	-64.7	76.8	-175.9	0	0	111	D476 L480 G481 K527	D476-E478 VanDerWaalsContact C-N 3.28Å; D476-E478 PolarHBondContact O-N 3.48Å; D476-E478 WeakPolarHBondContact OD1-CB 3.38Å; D476-E478 PolarHBondContact OD1-N 3.45Å; E478-L480 PolarHBondContact O-N 3.35Å; E478-G481 PolarHBondContact O-N 3.34Å; E478-K527 IonicContact OE1-NZ 3.96Å; E478-K527 PolarHBondContact OE1-NZ 2.9Å; E478-K527 IonicContact OE2-NZ 2.77Å; E478-K527 PolarHBondContact OE2-NZ 3.43Å
479	S	89.3	Confident	91.4	Very high	33 Å²	33	37.2 Å²	37.2	23%	0.231	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-24.7	172.7	-69.4	0	0	0	0	113.8	Q417 D476	Q417-S479 PolarHBondContact NE2-OG 2.83Å; D476-S479 VanDerWaalsContact CG-OG 3.28Å; D476-S479 PolarHBondContact O-N 3.46Å; D476-S479 PolarHBondContact OD1-N 3.48Å; D476-S479 PolarHBondContact OD1-OG 2.89Å; D476-S479 WeakPolarHBondContact OD2-CB 3.29Å; D476-S479 PolarHBondContact OD2-OG 2.93Å
480	L	91.3	Very high	91.4	Very high	25 Å²	25	36.6 Å²	36.6	13%	0.131	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	10.5	-179.4	-65.5	169.2	0	0	0	113.6	P426 I471 L472 M475 D476 A477 E478 A485 L486 I523	P426-L480 HydrophobicContact CB-CD2 4.02Å; P426-L480 HydrophobicContact CG-CD2 4.19Å; I471-L480 HydrophobicContact CG2-CD2 3.65Å; L472-L480 HydrophobicContact CD2-CD1 3.95Å; M475-L480 HydrophobicContact CB-CD1 4.28Å; M475-L480 HydrophobicContact CB-CD2 4.12Å; M475-L480 HydrophobicContact CB-CG 4.1Å; M475-L480 HydrophobicContact SD-CD2 4.21Å; D476-L480 VanDerWaalsContact O-CG 3.31Å; D476-L480 WeakPolarHBondContact O-CG 3.35Å; D476-L480 PolarHBondContact O-N 3.01Å; A477-L480 PolarHBondContact O-N 3.46Å; E478-L480 PolarHBondContact O-N 3.35Å; L480-A485 VanDerWaalsContact O-CB 3.27Å; L480-A485 WeakPolarHBondContact O-CB 3.38Å; L480-L486 HydrophobicContact CB-CD2 4.22Å; L480-L486 HydrophobicContact CD1-CD2 4.26Å; L480-I523 HydrophobicContact CD1-CD1 4Å
481	G	90.2	Very high	91.3	Very high	54 Å²	54	42.3 Å²	42.3	56%	0.557	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.6	9.2	178.6	0	0	0	0	0	114.7	E478	E478-G481 PolarHBondContact O-N 3.34Å
482	G	91.9	Very high	91.3	Very high	20 Å²	20	44.2 Å²	44.2	21%	0.206	28%	0.275	C	S	.	.	H	α-helix	trans	72	-164	174.3	0	0	0	0	0	114.4	A477 A484 A485 L486	A477-G482 WeakPolarHBondContact O-CA 3.5Å; A477-G482 PolarHBondContact O-N 2.86Å; G482-A484 PolarHBondContact O-N 3.47Å; G482-A485 PolarHBondContact O-N 2.95Å; G482-L486 WeakPolarHBondContact O-CG 3.44Å; G482-L486 PolarHBondContact O-N 3.31Å; G482-L486 VanDerWaalsContact O-N 3.11Å
483	E	92.8	Very high	91.3	Very high	103 Å²	103	43.8 Å²	43.8	48%	0.481	27%	0.272	S	S	.	.	H	α-helix	trans	-55.9	-46.2	-170.6	178.4	172.9	179.8	0	0	113.9	A485 L486 Q487 I529	E483-A485 PolarHBondContact O-N 3.3Å; E483-L486 PolarHBondContact O-N 2.97Å; E483-Q487 HydrophobicContact CG-CG 4.49Å; E483-Q487 WeakPolarHBondContact O-CG 3.37Å; E483-Q487 PolarHBondContact O-N 3.32Å; E483-Q487 PolarHBondContact OE1-NE2 2.93Å; E483-I529 HydrophobicContact CB-CD1 4.03Å; E483-I529 HydrophobicContact CB-CG1 4.29Å; E483-I529 HydrophobicContact CG-CB 4.42Å; E483-I529 HydrophobicContact CG-CD1 4.01Å; E483-I529 HydrophobicContact CG-CG1 3.87Å; E483-I529 HydrophobicContact CG-CG2 3.73Å
484	A	91.8	Very high	91.4	Very high	77 Å²	77	41.5 Å²	41.5	64%	0.636	26%	0.256	S	S	*	.	H	α-helix	trans	-63.7	-41.2	-177.3	0	0	0	0	0	112.3	G482 G488	G482-A484 PolarHBondContact O-N 3.47Å; A484-G488 PolarHBondContact O-N 3.29Å
485	A	92.6	Very high	91.6	Very high	42 Å²	42	43.2 Å²	43.2	35%	0.347	27%	0.27	S	S	.	.	H	α-helix	trans	-67.4	-42.1	177.9	0	0	0	0	0	111.4	L480 G482 E483 G488 A489	L480-A485 VanDerWaalsContact O-CB 3.27Å; L480-A485 WeakPolarHBondContact O-CB 3.38Å; G482-A485 PolarHBondContact O-N 2.95Å; E483-A485 PolarHBondContact O-N 3.3Å; A485-G488 PolarHBondContact O-N 3.5Å; A485-A489 WeakPolarHBondContact O-CB 3.47Å; A485-A489 PolarHBondContact O-N 3.19Å
486	L	93.7	Very high	91.7	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-64.9	-40.9	177.7	-64.9	173.8	0	0	0	112.1	L472 A477 L480 G482 E483 A489 A490 L520 I523 I524 I529	L472-L486 HydrophobicContact CD2-CD2 4.47Å; A477-L486 HydrophobicContact CB-CD1 3.79Å; L480-L486 HydrophobicContact CB-CD2 4.22Å; L480-L486 HydrophobicContact CD1-CD2 4.26Å; G482-L486 WeakPolarHBondContact O-CG 3.44Å; G482-L486 PolarHBondContact O-N 3.31Å; G482-L486 VanDerWaalsContact O-N 3.11Å; E483-L486 PolarHBondContact O-N 2.97Å; L486-A489 PolarHBondContact O-N 3.45Å; L486-A490 WeakPolarHBondContact O-CB 3.23Å; L486-A490 PolarHBondContact O-N 3.19Å; L486-L520 HydrophobicContact CB-CD1 4.13Å; L486-L520 HydrophobicContact CD2-CD1 3.56Å; L486-L520 HydrophobicContact CG-CD1 4.43Å; L486-I523 HydrophobicContact CD1-CG2 3.75Å; L486-I523 HydrophobicContact CD2-CG2 4.45Å; L486-I524 HydrophobicContact CB-CG1 4.23Å; L486-I529 HydrophobicContact CD1-CD1 3.89Å
487	Q	91.9	Very high	91.7	Very high	72 Å²	72	41.1 Å²	41.1	34%	0.336	26%	0.258	S	S	.	.	H	α-helix	trans	-64.5	-43	174	-75.3	178.8	-4.7	0	0	111.8	E483 A490 Q491 I529	E483-Q487 HydrophobicContact CG-CG 4.49Å; E483-Q487 WeakPolarHBondContact O-CG 3.37Å; E483-Q487 PolarHBondContact O-N 3.32Å; E483-Q487 PolarHBondContact OE1-NE2 2.93Å; Q487-A490 PolarHBondContact O-N 2.93Å; Q487-Q491 PolarHBondContact O-N 3.39Å; Q487-I529 HydrophobicContact CG-CG2 3.9Å
488	G	92.9	Very high	91.6	Very high	42 Å²	42	42.8 Å²	42.8	43%	0.433	26%	0.264	S	S	.	.	H	α-helix	trans	-59.5	-46.3	175	0	0	0	0	0	112.3	A484 A485 A490 Q491 H492	A484-G488 PolarHBondContact O-N 3.29Å; A485-G488 PolarHBondContact O-N 3.5Å; G488-A490 VanDerWaalsContact C-N 3.29Å; G488-A490 PolarHBondContact O-N 3.08Å; G488-Q491 PolarHBondContact O-N 3.02Å; G488-H492 WeakPolarHBondContact O-CB 3.49Å; G488-H492 PolarHBondContact O-N 3.37Å
489	A	94.5	Very high	91.3	Very high	9 Å²	9	40 Å²	40	7%	0.074	27%	0.268	C	S	.	.	H	α-helix	trans	-61.1	-38.4	175.1	0	0	0	0	0	111.9	L430 A485 L486 H492 L493 L520	L430-A489 HydrophobicContact CD1-CB 4.15Å; L430-A489 HydrophobicContact CD2-CB 4.06Å; A485-A489 WeakPolarHBondContact O-CB 3.47Å; A485-A489 PolarHBondContact O-N 3.19Å; L486-A489 PolarHBondContact O-N 3.45Å; A489-H492 WeakPolarHBondContact O-CB 3.47Å; A489-H492 PolarHBondContact O-N 3.48Å; A489-L493 WeakPolarHBondContact O-CG 3.19Å; A489-L493 PolarHBondContact O-N 3.44Å; A489-L520 HydrophobicContact CB-CD1 4.5Å; A489-L520 HydrophobicContact CB-CD2 3.82Å
490	A	92.8	Very high	90.9	Very high	2 Å²	2	41.4 Å²	41.4	2%	0.017	28%	0.282	C	S	.	.	H	α-helix	trans	-71.6	-38.6	-178.1	0	0	0	0	0	112.1	L486 Q487 G488 H492 S494 L520 I524 C532	L486-A490 WeakPolarHBondContact O-CB 3.23Å; L486-A490 PolarHBondContact O-N 3.19Å; Q487-A490 PolarHBondContact O-N 2.93Å; G488-A490 VanDerWaalsContact C-N 3.29Å; G488-A490 PolarHBondContact O-N 3.08Å; A490-H492 VanDerWaalsContact C-N 3.33Å; A490-S494 VanDerWaalsContact O-CB 3.27Å; A490-S494 WeakPolarHBondContact O-CB 3.19Å; A490-S494 PolarHBondContact O-N 3.33Å; A490-S494 PolarHBondContact O-OG 2.88Å; A490-L520 VanDerWaalsContact CA-CD2 3.42Å; A490-L520 HydrophobicContact CB-CD2 3.62Å; A490-L520 HydrophobicContact CB-CG 4.29Å; A490-I524 HydrophobicContact CB-CD1 3.89Å; A490-C532 HydrophobicContact CB-CB 4.1Å; A490-C532 WeakPolarHBondContact CB-SG 3.47Å
491	Q	91.6	Very high	90.1	Very high	121 Å²	121	50.2 Å²	50.2	57%	0.565	32%	0.322	S	S	*	.	H	α-helix	trans	-62.5	-42.7	171.6	-175.9	60	36.8	0	0	111.2	Q487 G488 S494 S495	Q487-Q491 PolarHBondContact O-N 3.39Å; G488-Q491 PolarHBondContact O-N 3.02Å; Q491-S494 PolarHBondContact O-N 2.96Å; Q491-S495 PolarHBondContact O-N 3.49Å
492	H	93.9	Very high	89.6	Confident	42 Å²	42	53.8 Å²	53.8	19%	0.194	33%	0.325	C	S	.	.	H	α-helix	trans	-61	-54.9	177	179.5	61.9	0	0	0	112	T433 S434 G488 A489 A490 S494 S495 L496	T433-H492 PolarHBondContact OG1-CD2 3.46Å; T433-H492 PolarHBondContact OG1-NE2 2.85Å; S434-H492 PolarHBondContact OG-CE1 3.05Å; G488-H492 WeakPolarHBondContact O-CB 3.49Å; G488-H492 PolarHBondContact O-N 3.37Å; A489-H492 WeakPolarHBondContact O-CB 3.47Å; A489-H492 PolarHBondContact O-N 3.48Å; A490-H492 VanDerWaalsContact C-N 3.33Å; H492-S494 VanDerWaalsContact C-N 3.27Å; H492-S494 PolarHBondContact O-N 3.39Å; H492-S495 WeakPolarHBondContact O-CA 3.25Å; H492-S495 WeakPolarHBondContact O-CB 3.25Å; H492-S495 PolarHBondContact O-N 3.41Å; H492-S495 PolarHBondContact O-OG 2.8Å; H492-L496 PolarHBondContact O-N 3.42Å; H492-L496 VanDerWaalsContact O-N 3.11Å
493	L	93.7	Very high	88.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-60.3	-37.7	178.5	-66.4	-177.6	0	0	0	112.2	L465 L468 A489 S495 L496 V497 V513 A516 M517 L520	L465-L493 HydrophobicContact CD2-CD2 3.62Å; L468-L493 HydrophobicContact CD2-CD1 4.19Å; L468-L493 HydrophobicContact CD2-CD2 4.02Å; L468-L493 HydrophobicContact CD2-CG 4.47Å; A489-L493 WeakPolarHBondContact O-CG 3.19Å; A489-L493 PolarHBondContact O-N 3.44Å; L493-S495 VanDerWaalsContact C-N 3.31Å; L493-S495 PolarHBondContact O-N 2.94Å; L493-L496 HydrophobicContact CD2-CD1 4.14Å; L493-L496 PolarHBondContact O-N 3.07Å; L493-V497 PolarHBondContact O-N 3.46Å; L493-V513 HydrophobicContact CD2-CG2 4.35Å; L493-A516 HydrophobicContact CD1-CB 4.06Å; L493-M517 HydrophobicContact CB-CG 4.42Å; L493-M517 HydrophobicContact CD1-CB 4.32Å; L493-L520 HydrophobicContact CD1-CD2 3.91Å
494	S	90.9	Very high	88.4	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.014	31%	0.313	C	S	.	.	H	α-helix	trans	-62.3	-39.3	173.7	-60.8	0	0	0	0	111.7	A490 Q491 H492 L496 V497 F498	A490-S494 VanDerWaalsContact O-CB 3.27Å; A490-S494 WeakPolarHBondContact O-CB 3.19Å; A490-S494 PolarHBondContact O-N 3.33Å; A490-S494 PolarHBondContact O-OG 2.88Å; Q491-S494 PolarHBondContact O-N 2.96Å; H492-S494 VanDerWaalsContact C-N 3.27Å; H492-S494 PolarHBondContact O-N 3.39Å; S494-L496 VanDerWaalsContact C-N 3.31Å; S494-L496 PolarHBondContact O-N 2.87Å; S494-V497 PolarHBondContact O-N 2.96Å; S494-F498 WeakPolarHBondContact O-CB 3.38Å; S494-F498 WeakPolarHBondContact O-CD2 3.49Å; S494-F498 PolarHBondContact O-N 3.22Å
495	S	91.3	Very high	87.9	Confident	57 Å²	57	55.7 Å²	55.7	40%	0.399	32%	0.316	S	S	.	.	H	α-helix	trans	-66.4	-31.7	176.7	80.1	0	0	0	0	113	Q491 H492 L493 V497 G499	Q491-S495 PolarHBondContact O-N 3.49Å; H492-S495 WeakPolarHBondContact O-CA 3.25Å; H492-S495 WeakPolarHBondContact O-CB 3.25Å; H492-S495 PolarHBondContact O-N 3.41Å; H492-S495 PolarHBondContact O-OG 2.8Å; L493-S495 VanDerWaalsContact C-N 3.31Å; L493-S495 PolarHBondContact O-N 2.94Å; S495-V497 VanDerWaalsContact C-N 3.34Å; S495-V497 PolarHBondContact O-N 3.27Å; S495-G499 WeakPolarHBondContact O-CA 3.38Å; S495-G499 PolarHBondContact O-N 2.96Å
496	L	91.3	Very high	87.6	Confident	32 Å²	32	56.7 Å²	56.7	17%	0.168	32%	0.316	C	S	.	.	H	α-helix	trans	-68	-33.4	176.4	-65.6	179.7	0	0	0	112.7	L465 H492 L493 S494 F509 V513	L465-L496 HydrophobicContact CD2-CD1 4.19Å; H492-L496 PolarHBondContact O-N 3.42Å; H492-L496 VanDerWaalsContact O-N 3.11Å; L493-L496 HydrophobicContact CD2-CD1 4.14Å; L493-L496 PolarHBondContact O-N 3.07Å; S494-L496 VanDerWaalsContact C-N 3.31Å; S494-L496 PolarHBondContact O-N 2.87Å; L496-F509 HydrophobicContact CB-CZ 4.28Å; L496-V513 HydrophobicContact CB-CG2 4.41Å
497	V	88.4	Confident	87.3	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.006	34%	0.338	C	S	.	.	H	α-helix	trans	-88.9	-41.2	-179.1	-177.7	0	0	0	0	111.9	L493 S494 S495 I503 V513	L493-V497 PolarHBondContact O-N 3.46Å; S494-V497 PolarHBondContact O-N 2.96Å; S495-V497 VanDerWaalsContact C-N 3.34Å; S495-V497 PolarHBondContact O-N 3.27Å; V497-I503 HydrophobicContact CG1-CG1 4.46Å; V497-I503 HydrophobicContact CG1-CG2 4.33Å; V497-V513 HydrophobicContact CG2-CB 4.34Å; V497-V513 HydrophobicContact CG2-CG1 3.7Å; V497-V513 HydrophobicContact CG2-CG2 3.62Å
498	F	88	Confident	87.1	Confident	40 Å²	40	61.2 Å²	61.2	18%	0.175	34%	0.337	C	S	.	.	H	α-helix	trans	-114.7	5.1	-169.6	-49.8	-70.5	0	0	0	114.3	S494 I503 M517 M533 Q537 L541	S494-F498 WeakPolarHBondContact O-CB 3.38Å; S494-F498 WeakPolarHBondContact O-CD2 3.49Å; S494-F498 PolarHBondContact O-N 3.22Å; F498-I503 HydrophobicContact CD1-CD1 4.39Å; F498-I503 HydrophobicContact CD1-CG1 4.48Å; F498-I503 HydrophobicContact CE1-CD1 4.18Å; F498-M517 HydrophobicContact CE2-CE 4.42Å; F498-M533 HydrophobicContact CE2-CE 3.62Å; F498-M533 HydrophobicContact CZ-CE 3.84Å; F498-Q537 HydrophobicContact CB-CG 4.38Å; F498-Q537 HydrophobicContact CD1-CB 4.44Å; F498-Q537 HydrophobicContact CD1-CG 4.33Å; F498-Q537 HydrophobicContact CD2-CB 4.1Å; F498-Q537 HydrophobicContact CD2-CG 3.86Å; F498-Q537 HydrophobicContact CE1-CB 4.27Å; F498-Q537 WeakPolarHBondContact CE1-O 3.43Å; F498-Q537 HydrophobicContact CE2-CB 3.97Å; F498-Q537 HydrophobicContact CE2-CG 4.25Å; F498-Q537 HydrophobicContact CG-CB 4.37Å; F498-Q537 HydrophobicContact CG-CG 3.93Å; F498-Q537 HydrophobicContact CZ-CB 4.05Å; F498-Q537 WeakPolarHBondContact CZ-O 3.25Å; F498-L541 HydrophobicContact CE1-CB 4.25Å; F498-L541 HydrophobicContact CZ-CB 3.98Å; F498-L541 HydrophobicContact CZ-CD1 4.49Å
499	G	83.6	Confident	87	Confident	61 Å²	61	59.9 Å²	59.9	63%	0.629	32%	0.32	S	S	*	.	S	Bend	trans	-77.8	-21.2	-179.7	0	0	0	0	0	114.4	S495	S495-G499 WeakPolarHBondContact O-CA 3.38Å; S495-G499 PolarHBondContact O-N 2.96Å
500	A	80.3	Confident	86.8	Confident	64 Å²	64	60.2 Å²	60.2	53%	0.529	32%	0.32	S	S	.	.	S	Bend	trans	-94.8	161.2	174.7	0	0	0	0	0	111.6	E502	A500-E502 PolarHBondContact O-N 3.04Å
501	E	74.9	Confident	86.7	Confident	210 Å²	210	63.8 Å²	63.8	98%	0.981	34%	0.336	S	S	*	.	S	Bend	trans	-60.9	-32.4	177.4	-68.9	-171.5	165.2	0	0	112.8
502	E	78.1	Confident	86.7	Confident	129 Å²	129	58.2 Å²	58.2	60%	0.603	31%	0.311	S	S	*	.	S	Bend	trans	-121	144	173.6	-67.1	-169.5	-178.9	0	0	110.8	A500 K505	A500-E502 PolarHBondContact O-N 3.04Å; E502-K505 IonicContact OE2-NZ 3.8Å; E502-K505 PolarHBondContact OE2-NZ 3.28Å
503	I	78.4	Confident	86.7	Confident	37 Å²	37	56.2 Å²	56.2	19%	0.19	30%	0.301	C	S	.	.			trans	-63	133.9	172.3	-69.3	168.8	0	0	0	108.9	V497 F498 L510 S540 A544	V497-I503 HydrophobicContact CG1-CG1 4.46Å; V497-I503 HydrophobicContact CG1-CG2 4.33Å; F498-I503 HydrophobicContact CD1-CD1 4.39Å; F498-I503 HydrophobicContact CD1-CG1 4.48Å; F498-I503 HydrophobicContact CE1-CD1 4.18Å; I503-L510 HydrophobicContact CG2-CD2 3.86Å; I503-S540 WeakPolarHBondContact CD1-O 3.44Å; I503-A544 HydrophobicContact CB-CB 4.42Å; I503-A544 HydrophobicContact CD1-CB 3.54Å; I503-A544 HydrophobicContact CG2-CB 4.17Å
504	P	81.4	Confident	86.7	Confident	40 Å²	40	56.4 Å²	56.4	26%	0.26	30%	0.302	S	S	.	.			trans	-52.7	140.1	177.2	-29	37.2	0	0	0	112.1	F509 L510	P504-F509 HydrophobicContact CB-CD1 3.84Å; P504-F509 HydrophobicContact CB-CE1 3.82Å; P504-F509 HydrophobicContact CG-CD1 4.32Å; P504-F509 HydrophobicContact CG-CE1 3.77Å; P504-L510 VanDerWaalsContact O-CD1 3.22Å; P504-L510 WeakPolarHBondContact O-CD1 3.5Å; P504-L510 WeakPolarHBondContact O-CD2 3.36Å; P504-L510 WeakPolarHBondContact O-CG 3.25Å
505	K	81.1	Confident	86.8	Confident	162 Å²	162	57 Å²	57	70%	0.704	31%	0.307	S	S	*	.			trans	-99.2	-4.3	-176.3	-66.1	173.4	-174	152.1	0	113.7	E502 E507	E502-K505 IonicContact OE2-NZ 3.8Å; E502-K505 PolarHBondContact OE2-NZ 3.28Å; K505-E507 PolarHBondContact O-N 2.92Å
506	D	86.3	Confident	87	Confident	63 Å²	63	54.3 Å²	54.3	34%	0.337	29%	0.288	S	S	.	.			trans	-70.1	120.1	178.7	-176.3	-98.2	0	0	0	110.2	E508 F509 L510	D506-E508 PolarHBondContact OD1-N 2.97Å; D506-F509 HydrophobicContact CB-CB 4.02Å; D506-F509 VanDerWaalsContact OD1-CB 3.31Å; D506-F509 WeakPolarHBondContact OD1-CB 3.45Å; D506-F509 PolarHBondContact OD1-N 3.25Å; D506-L510 WeakPolarHBondContact O-CB 3.46Å; D506-L510 VanDerWaalsContact O-CG 3.32Å; D506-L510 WeakPolarHBondContact O-CG 3.38Å; D506-L510 PolarHBondContact O-N 3.37Å
507	E	87.3	Confident	87.1	Confident	102 Å²	102	52.9 Å²	52.9	48%	0.477	28%	0.28	S	S	.	.	H	α-helix	trans	-65.8	-42.4	-171.5	-72.9	-177.9	170.1	0	0	112.5	K505 L510 E511 V550	K505-E507 PolarHBondContact O-N 2.92Å; E507-L510 PolarHBondContact O-N 3.31Å; E507-E511 WeakPolarHBondContact O-CB 3.32Å; E507-E511 PolarHBondContact O-N 2.94Å; E507-V550 HydrophobicContact CB-CG2 3.85Å; E507-V550 HydrophobicContact CG-CG2 3.76Å
508	E	87.8	Confident	87.3	Confident	69 Å²	69	54 Å²	54	32%	0.322	28%	0.284	S	S	.	.	H	α-helix	trans	-66.9	-45.2	-179.5	-176.2	176.8	-161.2	0	0	110.7	R463 D506 E511 A512	R463-E508 IonicContact CZ-OE1 3.96Å; R463-E508 VanDerWaalsContact CZ-OE1 3.29Å; R463-E508 IonicContact NH1-OE1 2.9Å; R463-E508 PolarHBondContact NH1-OE1 3.12Å; R463-E508 IonicContact NH2-OE1 3.28Å; R463-E508 PolarHBondContact NH2-OE1 3.08Å; D506-E508 PolarHBondContact OD1-N 2.97Å; E508-E511 PolarHBondContact O-N 2.89Å; E508-A512 WeakPolarHBondContact O-CB 3.48Å; E508-A512 PolarHBondContact O-N 2.83Å
509	F	90.9	Very high	87.6	Confident	15 Å²	15	52.4 Å²	52.4	7%	0.066	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-48.5	173.7	173.5	-93.9	0	0	0	111.9	Q461 L465 L496 P504 D506 E511 A512 V513	Q461-F509 HydrophobicContact CG-CE2 4.44Å; L465-F509 HydrophobicContact CD1-CD2 3.76Å; L465-F509 HydrophobicContact CD1-CE2 3.59Å; L465-F509 HydrophobicContact CD1-CZ 4.44Å; L496-F509 HydrophobicContact CB-CZ 4.28Å; P504-F509 HydrophobicContact CB-CD1 3.84Å; P504-F509 HydrophobicContact CB-CE1 3.82Å; P504-F509 HydrophobicContact CG-CD1 4.32Å; P504-F509 HydrophobicContact CG-CE1 3.77Å; D506-F509 HydrophobicContact CB-CB 4.02Å; D506-F509 VanDerWaalsContact OD1-CB 3.31Å; D506-F509 WeakPolarHBondContact OD1-CB 3.45Å; D506-F509 PolarHBondContact OD1-N 3.25Å; F509-E511 PolarHBondContact O-N 3.34Å; F509-A512 PolarHBondContact O-N 2.82Å; F509-V513 HydrophobicContact CD1-CG1 4.32Å; F509-V513 HydrophobicContact CE1-CB 4.45Å; F509-V513 HydrophobicContact CE1-CG1 3.97Å; F509-V513 HydrophobicContact CZ-CB 4.37Å; F509-V513 HydrophobicContact CZ-CG1 4.37Å; F509-V513 WeakPolarHBondContact O-CG1 3.46Å; F509-V513 PolarHBondContact O-N 3.01Å
510	L	90.4	Very high	88.1	Confident	16 Å²	16	49.5 Å²	49.5	8%	0.084	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-45	-180	-81.4	-179.7	0	0	0	111.8	I503 P504 D506 E507 A512 I514 V553	I503-L510 HydrophobicContact CG2-CD2 3.86Å; P504-L510 VanDerWaalsContact O-CD1 3.22Å; P504-L510 WeakPolarHBondContact O-CD1 3.5Å; P504-L510 WeakPolarHBondContact O-CD2 3.36Å; P504-L510 WeakPolarHBondContact O-CG 3.25Å; D506-L510 WeakPolarHBondContact O-CB 3.46Å; D506-L510 VanDerWaalsContact O-CG 3.32Å; D506-L510 WeakPolarHBondContact O-CG 3.38Å; D506-L510 PolarHBondContact O-N 3.37Å; E507-L510 PolarHBondContact O-N 3.31Å; L510-A512 VanDerWaalsContact C-N 3.34Å; L510-A512 PolarHBondContact O-N 2.79Å; L510-I514 HydrophobicContact CB-CD1 4.4Å; L510-I514 HydrophobicContact CD2-CD1 4.21Å; L510-I514 VanDerWaalsContact O-CB 3.23Å; L510-I514 WeakPolarHBondContact O-CB 3.23Å; L510-I514 WeakPolarHBondContact O-CD1 3.41Å; L510-I514 WeakPolarHBondContact O-CG1 3.33Å; L510-I514 PolarHBondContact O-N 3.22Å; L510-V553 HydrophobicContact CB-CG2 4.28Å
511	E	90.6	Very high	88.7	Confident	77 Å²	77	46.7 Å²	46.7	36%	0.36	23%	0.225	S	C	.	.	H	α-helix	trans	-59.1	-47.1	176.6	-178.6	167.7	-160.2	0	0	111.3	E507 E508 F509 S515 S552 V553	E507-E511 WeakPolarHBondContact O-CB 3.32Å; E507-E511 PolarHBondContact O-N 2.94Å; E508-E511 PolarHBondContact O-N 2.89Å; F509-E511 PolarHBondContact O-N 3.34Å; E511-S515 WeakPolarHBondContact O-CB 3.48Å; E511-S515 PolarHBondContact O-N 3.25Å; E511-S515 PolarHBondContact O-OG 2.93Å; E511-S552 VanDerWaalsContact OE1-CB 3.23Å; E511-S552 WeakPolarHBondContact OE1-CB 3.27Å; E511-S552 PolarHBondContact OE1-OG 3.31Å; E511-V553 HydrophobicContact CB-CG2 3.82Å
512	A	92.8	Very high	89.5	Confident	3 Å²	3	41.3 Å²	41.3	3%	0.025	20%	0.199	C	C	.	.	H	α-helix	trans	-66.5	-48.1	-178.9	0	0	0	0	0	112.5	S462 L465 E508 F509 L510 S515 A516	S462-A512 WeakPolarHBondContact O-CB 3.38Å; L465-A512 HydrophobicContact CB-CB 3.61Å; L465-A512 HydrophobicContact CD1-CB 4.38Å; E508-A512 WeakPolarHBondContact O-CB 3.48Å; E508-A512 PolarHBondContact O-N 2.83Å; F509-A512 PolarHBondContact O-N 2.82Å; L510-A512 VanDerWaalsContact C-N 3.34Å; L510-A512 PolarHBondContact O-N 2.79Å; A512-S515 PolarHBondContact O-N 2.79Å; A512-A516 WeakPolarHBondContact O-CB 3.4Å; A512-A516 PolarHBondContact O-N 2.9Å
513	V	94.1	Very high	90.1	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-68	-41.7	-177.4	73.2	0	0	0	0	112	L465 L493 L496 V497 F509 S515 A516 M517	L465-V513 HydrophobicContact CD1-CB 3.87Å; L465-V513 HydrophobicContact CD1-CG2 4.38Å; L465-V513 HydrophobicContact CD2-CB 4.15Å; L465-V513 HydrophobicContact CD2-CG2 3.99Å; L493-V513 HydrophobicContact CD2-CG2 4.35Å; L496-V513 HydrophobicContact CB-CG2 4.41Å; V497-V513 HydrophobicContact CG2-CB 4.34Å; V497-V513 HydrophobicContact CG2-CG1 3.7Å; V497-V513 HydrophobicContact CG2-CG2 3.62Å; F509-V513 HydrophobicContact CD1-CG1 4.32Å; F509-V513 HydrophobicContact CE1-CB 4.45Å; F509-V513 HydrophobicContact CE1-CG1 3.97Å; F509-V513 HydrophobicContact CZ-CB 4.37Å; F509-V513 HydrophobicContact CZ-CG1 4.37Å; F509-V513 WeakPolarHBondContact O-CG1 3.46Å; F509-V513 PolarHBondContact O-N 3.01Å; V513-S515 VanDerWaalsContact C-N 3.35Å; V513-A516 PolarHBondContact O-N 2.84Å; V513-M517 VanDerWaalsContact O-CB 3.28Å; V513-M517 WeakPolarHBondContact O-CB 3.46Å; V513-M517 PolarHBondContact O-N 3.08Å
514	I	92.2	Very high	90.7	Very high	4 Å²	4	34.4 Å²	34.4	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-70.4	-35.7	179.8	-62.1	171.5	0	0	0	109.9	L510 M517 R518 L541 V553 N556 A557 I560	L510-I514 HydrophobicContact CB-CD1 4.4Å; L510-I514 HydrophobicContact CD2-CD1 4.21Å; L510-I514 VanDerWaalsContact O-CB 3.23Å; L510-I514 WeakPolarHBondContact O-CB 3.23Å; L510-I514 WeakPolarHBondContact O-CD1 3.41Å; L510-I514 WeakPolarHBondContact O-CG1 3.33Å; L510-I514 PolarHBondContact O-N 3.22Å; I514-M517 PolarHBondContact O-N 3.49Å; I514-R518 WeakPolarHBondContact O-CB 3.27Å; I514-R518 PolarHBondContact O-N 3.49Å; I514-L541 HydrophobicContact CD1-CD1 3.89Å; I514-L541 HydrophobicContact CG1-CD1 4.08Å; I514-V553 HydrophobicContact CD1-CG1 3.69Å; I514-N556 HydrophobicContact CG2-CB 3.61Å; I514-A557 HydrophobicContact CG2-CB 4.48Å; I514-I560 HydrophobicContact CG2-CD1 3.69Å
515	S	93.3	Very high	91.1	Very high	15 Å²	15	33.4 Å²	33.4	11%	0.105	16%	0.162	C	C	.	.	H	α-helix	trans	-62.9	-45.4	172.8	-61.9	0	0	0	0	112.3	H469 E511 A512 V513 R518 S519 N556	H469-S515 PolarHBondContact ND1-O 3.36Å; E511-S515 WeakPolarHBondContact O-CB 3.48Å; E511-S515 PolarHBondContact O-N 3.25Å; E511-S515 PolarHBondContact O-OG 2.93Å; A512-S515 PolarHBondContact O-N 2.79Å; V513-S515 VanDerWaalsContact C-N 3.35Å; S515-R518 PolarHBondContact O-N 3.02Å; S515-S519 PolarHBondContact O-N 2.82Å; S515-S519 VanDerWaalsContact O-N 3.1Å; S515-N556 PolarHBondContact OG-ND2 3.36Å
516	A	95.1	Very high	91.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.6	-45.2	176.7	0	0	0	0	0	111.4	L468 H469 L472 L493 A512 V513 R518 S519 L520	L468-A516 HydrophobicContact CD2-CB 4.42Å; H469-A516 HydrophobicContact CB-CB 4.07Å; L472-A516 WeakPolarHBondContact CD1-O 3.32Å; L493-A516 HydrophobicContact CD1-CB 4.06Å; A512-A516 WeakPolarHBondContact O-CB 3.4Å; A512-A516 PolarHBondContact O-N 2.9Å; V513-A516 PolarHBondContact O-N 2.84Å; A516-R518 PolarHBondContact O-N 3.34Å; A516-S519 PolarHBondContact O-N 3.01Å; A516-L520 WeakPolarHBondContact O-CB 3.22Å; A516-L520 PolarHBondContact O-N 2.98Å
517	M	94.1	Very high	91.5	Very high	3 Å²	3	30.7 Å²	30.7	2%	0.015	16%	0.156	C	C	.	.	H	α-helix	trans	-63.5	-40.5	179.4	-159	169.7	76.5	0	0	111.5	L493 F498 V513 I514 L520 L521 M533 L541 I560	L493-M517 HydrophobicContact CB-CG 4.42Å; L493-M517 HydrophobicContact CD1-CB 4.32Å; F498-M517 HydrophobicContact CE2-CE 4.42Å; V513-M517 VanDerWaalsContact O-CB 3.28Å; V513-M517 WeakPolarHBondContact O-CB 3.46Å; V513-M517 PolarHBondContact O-N 3.08Å; I514-M517 PolarHBondContact O-N 3.49Å; M517-L520 PolarHBondContact O-N 2.87Å; M517-L521 HydrophobicContact CG-CD1 4.2Å; M517-L521 WeakPolarHBondContact O-CB 3.3Å; M517-L521 VanDerWaalsContact O-CG 3.26Å; M517-L521 WeakPolarHBondContact O-CG 3.36Å; M517-L521 PolarHBondContact O-N 3.35Å; M517-M533 HydrophobicContact CE-CE 3.77Å; M517-M533 HydrophobicContact CE-SD 3.95Å; M517-M533 HydrophobicContact SD-CE 4.44Å; M517-M533 HydrophobicContact SD-SD 4.38Å; M517-L541 HydrophobicContact CE-CD1 4.47Å; M517-L541 HydrophobicContact CE-CD2 3.79Å; M517-I560 HydrophobicContact CB-CD1 4.4Å; M517-I560 HydrophobicContact CE-CD1 3.79Å
518	R	93.2	Very high	91.4	Very high	23 Å²	23	31.9 Å²	31.9	9%	0.087	17%	0.166	C	C	.	.	H	α-helix	trans	-59.3	-51.7	173.1	-176.8	-174.8	60.6	75.6	0.2	111.8	H469 I514 S515 A516 L520 L521 Q522 N556 A559 I560 I563	H469-R518 PolarHBondContact CE1-NH2 3.2Å; I514-R518 WeakPolarHBondContact O-CB 3.27Å; I514-R518 PolarHBondContact O-N 3.49Å; S515-R518 PolarHBondContact O-N 3.02Å; A516-R518 PolarHBondContact O-N 3.34Å; R518-L520 VanDerWaalsContact C-N 3.3Å; R518-L520 PolarHBondContact O-N 3.49Å; R518-L521 PolarHBondContact O-N 3.11Å; R518-Q522 WeakPolarHBondContact O-CB 3.03Å; R518-Q522 PolarHBondContact O-N 2.78Å; R518-N556 WeakPolarHBondContact CD-OD1 3.35Å; R518-N556 PolarHBondContact NE-OD1 2.77Å; R518-A559 VanDerWaalsContact CD-CB 3.48Å; R518-A559 HydrophobicContact CG-CB 4.14Å; R518-I560 HydrophobicContact CB-CD1 4.06Å; R518-I560 HydrophobicContact CB-CG1 3.75Å; R518-I560 HydrophobicContact CG-CG1 4.16Å; R518-I563 HydrophobicContact CG-CD1 3.97Å
519	S	93.4	Very high	91.2	Very high	7 Å²	7	29.1 Å²	29.1	5%	0.049	15%	0.153	C	C	.	.	H	α-helix	trans	-61.1	-40.5	-180	-71.1	0	0	0	0	111.6	H469 S473 S515 A516 Q522 I523	H469-S519 PolarHBondContact CE1-OG 3.28Å; H469-S519 PolarHBondContact ND1-OG 3.32Å; S473-S519 PolarHBondContact OG-OG 3.19Å; S515-S519 PolarHBondContact O-N 2.82Å; S515-S519 VanDerWaalsContact O-N 3.1Å; A516-S519 PolarHBondContact O-N 3.01Å; S519-Q522 WeakPolarHBondContact O-CB 3.44Å; S519-Q522 PolarHBondContact O-N 3.28Å; S519-I523 WeakPolarHBondContact O-CG1 3.24Å; S519-I523 PolarHBondContact O-N 3.25Å
520	L	94.4	Very high	90.7	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-63	-49.6	176.9	-179.2	56.5	0	0	0	112.4	L472 L486 A489 A490 L493 A516 M517 R518 Q522 I523 I524	L472-L520 HydrophobicContact CD1-CB 3.84Å; L472-L520 HydrophobicContact CD2-CB 4.46Å; L472-L520 HydrophobicContact CD2-CD1 3.9Å; L486-L520 HydrophobicContact CB-CD1 4.13Å; L486-L520 HydrophobicContact CD2-CD1 3.56Å; L486-L520 HydrophobicContact CG-CD1 4.43Å; A489-L520 HydrophobicContact CB-CD1 4.5Å; A489-L520 HydrophobicContact CB-CD2 3.82Å; A490-L520 VanDerWaalsContact CA-CD2 3.42Å; A490-L520 HydrophobicContact CB-CD2 3.62Å; A490-L520 HydrophobicContact CB-CG 4.29Å; L493-L520 HydrophobicContact CD1-CD2 3.91Å; A516-L520 WeakPolarHBondContact O-CB 3.22Å; A516-L520 PolarHBondContact O-N 2.98Å; M517-L520 PolarHBondContact O-N 2.87Å; R518-L520 VanDerWaalsContact C-N 3.3Å; R518-L520 PolarHBondContact O-N 3.49Å; L520-Q522 PolarHBondContact O-N 2.91Å; L520-I523 WeakPolarHBondContact O-CB 3.09Å; L520-I523 PolarHBondContact O-N 3.24Å; L520-I523 VanDerWaalsContact O-N 3.11Å; L520-I524 HydrophobicContact CD1-CD1 4.21Å; L520-I524 HydrophobicContact CD1-CG1 4.46Å; L520-I524 HydrophobicContact CG-CD1 4.01Å; L520-I524 WeakPolarHBondContact O-CG1 3.46Å; L520-I524 PolarHBondContact O-N 3.46Å
521	L	92.1	Very high	89.9	Confident	5 Å²	5	33 Å²	33	3%	0.026	18%	0.18	C	C	.	.	H	α-helix	trans	-63.3	-33.2	179.3	-71.2	171.8	0	0	0	111.9	M517 R518 I523 I524 A525 C532 M533 I560 I563	M517-L521 HydrophobicContact CG-CD1 4.2Å; M517-L521 WeakPolarHBondContact O-CB 3.3Å; M517-L521 VanDerWaalsContact O-CG 3.26Å; M517-L521 WeakPolarHBondContact O-CG 3.36Å; M517-L521 PolarHBondContact O-N 3.35Å; R518-L521 PolarHBondContact O-N 3.11Å; L521-I523 VanDerWaalsContact C-N 3.35Å; L521-I524 HydrophobicContact CD2-CD1 4.47Å; L521-I524 PolarHBondContact O-N 3.31Å; L521-A525 VanDerWaalsContact O-CB 3.3Å; L521-A525 WeakPolarHBondContact O-CB 3.47Å; L521-A525 PolarHBondContact O-N 2.8Å; L521-C532 VanDerWaalsContact CD2-SG 3.56Å; L521-M533 HydrophobicContact CD1-SD 3.63Å; L521-I560 HydrophobicContact CD1-CB 4.5Å; L521-I560 HydrophobicContact CD1-CG1 4.22Å; L521-I560 HydrophobicContact CD1-CG2 3.71Å; L521-I563 HydrophobicContact CB-CG2 4.25Å
522	Q	91.7	Very high	89.1	Confident	96 Å²	96	30.9 Å²	30.9	45%	0.449	17%	0.173	S	C	.	.	H	α-helix	trans	-61.9	-42	173.7	-174.6	63.6	75.6	0	0	111.9	R518 S519 L520 S526 I563	R518-Q522 WeakPolarHBondContact O-CB 3.03Å; R518-Q522 PolarHBondContact O-N 2.78Å; S519-Q522 WeakPolarHBondContact O-CB 3.44Å; S519-Q522 PolarHBondContact O-N 3.28Å; L520-Q522 PolarHBondContact O-N 2.91Å; Q522-S526 WeakPolarHBondContact O-CB 3.49Å; Q522-S526 PolarHBondContact O-N 2.73Å; Q522-I563 HydrophobicContact CB-CD1 4.04Å
523	I	91.8	Very high	88.6	Confident	18 Å²	18	31.4 Å²	31.4	9%	0.092	18%	0.175	C	C	.	.	H	α-helix	trans	-65.1	-49.7	175.5	-60.8	168.5	0	0	0	109.9	L472 A477 L480 L486 S519 L520 L521 A525 S526 K527	L472-I523 HydrophobicContact CB-CD1 4.08Å; L472-I523 HydrophobicContact CD2-CD1 3.79Å; L472-I523 VanDerWaalsContact O-CD1 3.26Å; L472-I523 WeakPolarHBondContact O-CD1 3.37Å; A477-I523 HydrophobicContact CB-CG2 3.86Å; L480-I523 HydrophobicContact CD1-CD1 4Å; L486-I523 HydrophobicContact CD1-CG2 3.75Å; L486-I523 HydrophobicContact CD2-CG2 4.45Å; S519-I523 WeakPolarHBondContact O-CG1 3.24Å; S519-I523 PolarHBondContact O-N 3.25Å; L520-I523 WeakPolarHBondContact O-CB 3.09Å; L520-I523 PolarHBondContact O-N 3.24Å; L520-I523 VanDerWaalsContact O-N 3.11Å; L521-I523 VanDerWaalsContact C-N 3.35Å; I523-A525 VanDerWaalsContact C-N 3.34Å; I523-A525 PolarHBondContact O-N 3.38Å; I523-S526 PolarHBondContact O-N 3.32Å; I523-S526 VanDerWaalsContact O-N 3.11Å; I523-S526 PolarHBondContact O-OG 3.35Å; I523-K527 PolarHBondContact O-N 2.94Å
524	I	90.8	Very high	88.1	Confident	4 Å²	4	34.3 Å²	34.3	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-53.5	-50.6	178.9	-74	174.3	0	0	0	110.6	L486 A490 L520 L521 S526 K527 N528 I529	L486-I524 HydrophobicContact CB-CG1 4.23Å; A490-I524 HydrophobicContact CB-CD1 3.89Å; L520-I524 HydrophobicContact CD1-CD1 4.21Å; L520-I524 HydrophobicContact CD1-CG1 4.46Å; L520-I524 HydrophobicContact CG-CD1 4.01Å; L520-I524 WeakPolarHBondContact O-CG1 3.46Å; L520-I524 PolarHBondContact O-N 3.46Å; L521-I524 HydrophobicContact CD2-CD1 4.47Å; L521-I524 PolarHBondContact O-N 3.31Å; I524-S526 PolarHBondContact O-N 3.27Å; I524-K527 PolarHBondContact O-N 3.38Å; I524-N528 PolarHBondContact O-N 3.5Å; I524-I529 HydrophobicContact CB-CB 4.37Å; I524-I529 HydrophobicContact CG2-CB 3.82Å; I524-I529 HydrophobicContact CG2-CG2 4.03Å; I524-I529 WeakPolarHBondContact CG2-O 3.33Å; I524-I529 PolarHBondContact O-N 3.33Å
525	A	89.3	Confident	87.6	Confident	18 Å²	18	36.1 Å²	36.1	15%	0.149	21%	0.205	C	C	.	.	H	α-helix	trans	-62.1	-42.3	177.8	0	0	0	0	0	112.2	L521 I523 K527 N528 I563	L521-A525 VanDerWaalsContact O-CB 3.3Å; L521-A525 WeakPolarHBondContact O-CB 3.47Å; L521-A525 PolarHBondContact O-N 2.8Å; I523-A525 VanDerWaalsContact C-N 3.34Å; I523-A525 PolarHBondContact O-N 3.38Å; A525-K527 PolarHBondContact O-N 2.62Å; A525-N528 PolarHBondContact O-N 3.46Å; A525-N528 VanDerWaalsContact O-N 3.14Å; A525-I563 HydrophobicContact CB-CG2 3.66Å
526	S	89.3	Confident	87.1	Confident	76 Å²	76	41.8 Å²	41.8	53%	0.531	23%	0.23	S	C	.	.	H	α-helix	trans	-64.5	-27.3	179.8	76.6	0	0	0	0	113.8	Q522 I523 I524	Q522-S526 WeakPolarHBondContact O-CB 3.49Å; Q522-S526 PolarHBondContact O-N 2.73Å; I523-S526 PolarHBondContact O-N 3.32Å; I523-S526 VanDerWaalsContact O-N 3.11Å; I523-S526 PolarHBondContact O-OG 3.35Å; I524-S526 PolarHBondContact O-N 3.27Å
527	K	87.5	Confident	86.8	Confident	92 Å²	92	43.7 Å²	43.7	40%	0.4	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	3.1	178.6	-65	-72.1	-176.5	157.8	0	112.9	A477 E478 I523 I524 A525 I529	A477-K527 HydrophobicContact CB-CD 4.27Å; A477-K527 HydrophobicContact CB-CG 4Å; E478-K527 IonicContact OE1-NZ 3.96Å; E478-K527 PolarHBondContact OE1-NZ 2.9Å; E478-K527 IonicContact OE2-NZ 2.77Å; E478-K527 PolarHBondContact OE2-NZ 3.43Å; I523-K527 PolarHBondContact O-N 2.94Å; I524-K527 PolarHBondContact O-N 3.38Å; A525-K527 PolarHBondContact O-N 2.62Å; K527-I529 HydrophobicContact CB-CD1 3.9Å; K527-I529 HydrophobicContact CB-CG1 3.97Å; K527-I529 PolarHBondContact O-N 3.37Å
528	N	84.8	Confident	86.4	Confident	127 Å²	127	43.7 Å²	43.7	68%	0.679	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	37.5	-174.2	-54	-71.3	0	0	0	113.2	I524 A525	I524-N528 PolarHBondContact O-N 3.5Å; A525-N528 PolarHBondContact O-N 3.46Å; A525-N528 VanDerWaalsContact O-N 3.14Å
529	I	84.4	Confident	86	Confident	11 Å²	11	45.6 Å²	45.6	6%	0.056	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-78.1	141.6	171.8	-63.9	166.3	0	0	0	108	E483 L486 Q487 I524 K527 Q531	E483-I529 HydrophobicContact CB-CD1 4.03Å; E483-I529 HydrophobicContact CB-CG1 4.29Å; E483-I529 HydrophobicContact CG-CB 4.42Å; E483-I529 HydrophobicContact CG-CD1 4.01Å; E483-I529 HydrophobicContact CG-CG1 3.87Å; E483-I529 HydrophobicContact CG-CG2 3.73Å; L486-I529 HydrophobicContact CD1-CD1 3.89Å; Q487-I529 HydrophobicContact CG-CG2 3.9Å; I524-I529 HydrophobicContact CB-CB 4.37Å; I524-I529 HydrophobicContact CG2-CB 3.82Å; I524-I529 HydrophobicContact CG2-CG2 4.03Å; I524-I529 WeakPolarHBondContact CG2-O 3.33Å; I524-I529 PolarHBondContact O-N 3.33Å; K527-I529 HydrophobicContact CB-CD1 3.9Å; K527-I529 HydrophobicContact CB-CG1 3.97Å; K527-I529 PolarHBondContact O-N 3.37Å; I529-Q531 PolarHBondContact O-N 2.83Å
530	S	80.1	Confident	85.7	Confident	78 Å²	78	47.8 Å²	47.8	55%	0.545	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-53.8	136.8	-178.5	-60.2	0	0	0	0	113	C532	S530-C532 PolarHBondContact O-N 3.08Å
531	Q	72.9	Confident	85.4	Confident	36 Å²	36	47.9 Å²	47.9	17%	0.168	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-57	132.8	176.9	-175.7	84	41.6	0	0	111.2	I529 T564 L568	I529-Q531 PolarHBondContact O-N 2.83Å; Q531-T564 HydrophobicContact CG-CG2 4.3Å; Q531-T564 PolarHBondContact NE2-OG1 3.04Å; Q531-T564 PolarHBondContact OE1-O 3.33Å; Q531-L568 HydrophobicContact CG-CD2 4.47Å
532	C	74.2	Confident	85	Confident	32 Å²	32	48.2 Å²	48.2	22%	0.216	27%	0.268	C	S	.	.			trans	-105.5	-1.9	-175.9	62.3	0	0	0	0	114.8	A490 L521 S530	A490-C532 HydrophobicContact CB-CB 4.1Å; A490-C532 WeakPolarHBondContact CB-SG 3.47Å; L521-C532 VanDerWaalsContact CD2-SG 3.56Å; S530-C532 PolarHBondContact O-N 3.08Å
533	M	81.1	Confident	84.6	Confident	13 Å²	13	48.6 Å²	48.6	6%	0.064	27%	0.27	C	S	.	.			trans	-108.3	138.5	-178.1	-65.6	-170.9	72.1	0	0	111.9	F498 M517 L521 Q537 L538 L541 I560	F498-M533 HydrophobicContact CE2-CE 3.62Å; F498-M533 HydrophobicContact CZ-CE 3.84Å; M517-M533 HydrophobicContact CE-CE 3.77Å; M517-M533 HydrophobicContact CE-SD 3.95Å; M517-M533 HydrophobicContact SD-CE 4.44Å; M517-M533 HydrophobicContact SD-SD 4.38Å; L521-M533 HydrophobicContact CD1-SD 3.63Å; M533-Q537 HydrophobicContact CE-CB 4.02Å; M533-L538 HydrophobicContact CB-CD2 4.14Å; M533-L538 HydrophobicContact CB-CG 4.28Å; M533-L538 HydrophobicContact CE-CD2 3.91Å; M533-L538 HydrophobicContact SD-CD2 3.86Å; M533-L541 HydrophobicContact CE-CD2 4.5Å; M533-I560 HydrophobicContact SD-CG2 4.13Å
534	T	84.6	Confident	84.2	Confident	62 Å²	62	49.1 Å²	49.1	38%	0.38	28%	0.277	S	S	.	.			trans	-79.7	155	174.5	69.9	0	0	0	0	111.6	Q536 Q537 L538	T534-Q536 PolarHBondContact O-N 3.28Å; T534-Q537 PolarHBondContact O-N 2.95Å; T534-Q537 VanDerWaalsContact O-N 3.11Å; T534-Q537 VanDerWaalsContact OG1-CG 3.32Å; T534-Q537 WeakPolarHBondContact OG1-CG 3.45Å; T534-Q537 PolarHBondContact OG1-N 2.72Å; T534-Q537 PolarHBondContact OG1-OE1 2.81Å; T534-L538 WeakPolarHBondContact O-CG 3.39Å; T534-L538 PolarHBondContact O-N 3.49Å; T534-L538 VanDerWaalsContact O-N 3.13Å
535	P	81.1	Confident	83.7	Confident	42 Å²	42	49.2 Å²	49.2	27%	0.273	28%	0.278	S	S	.	.	H	α-helix	trans	-52.5	-39.3	173	-27.7	35.9	0	0	0	113	L538 M539 T577 M580	P535-L538 PolarHBondContact O-N 3.27Å; P535-M539 WeakPolarHBondContact O-CG 3.47Å; P535-M539 PolarHBondContact O-N 3.36Å; P535-T577 HydrophobicContact CB-CG2 3.94Å; P535-T577 HydrophobicContact CG-CG2 3.87Å; P535-M580 HydrophobicContact CB-CE 4.02Å
536	Q	84.3	Confident	83.3	Confident	133 Å²	133	51.6 Å²	51.6	62%	0.621	29%	0.291	S	S	*	.	H	α-helix	trans	-64.1	-43.8	178.9	-68	75.6	10.9	0	0	111.6	T534 L538 M539 S540	T534-Q536 PolarHBondContact O-N 3.28Å; Q536-L538 VanDerWaalsContact C-N 3.34Å; Q536-L538 PolarHBondContact O-N 2.98Å; Q536-M539 PolarHBondContact O-N 3.11Å; Q536-S540 PolarHBondContact O-N 3.3Å; Q536-S540 PolarHBondContact O-OG 3.28Å; Q536-S540 VanDerWaalsContact O-OG 3.11Å
537	Q	88.3	Confident	83	Confident	41 Å²	41	56.9 Å²	56.9	19%	0.192	30%	0.299	C	S	.	.	H	α-helix	trans	-62.7	-40.3	177	-73.6	168	-33.9	0	0	112.1	F498 M533 T534 S540 L541	F498-Q537 HydrophobicContact CB-CG 4.38Å; F498-Q537 HydrophobicContact CD1-CB 4.44Å; F498-Q537 HydrophobicContact CD1-CG 4.33Å; F498-Q537 HydrophobicContact CD2-CB 4.1Å; F498-Q537 HydrophobicContact CD2-CG 3.86Å; F498-Q537 HydrophobicContact CE1-CB 4.27Å; F498-Q537 WeakPolarHBondContact CE1-O 3.43Å; F498-Q537 HydrophobicContact CE2-CB 3.97Å; F498-Q537 HydrophobicContact CE2-CG 4.25Å; F498-Q537 HydrophobicContact CG-CB 4.37Å; F498-Q537 HydrophobicContact CG-CG 3.93Å; F498-Q537 HydrophobicContact CZ-CB 4.05Å; F498-Q537 WeakPolarHBondContact CZ-O 3.25Å; M533-Q537 HydrophobicContact CE-CB 4.02Å; T534-Q537 PolarHBondContact O-N 2.95Å; T534-Q537 VanDerWaalsContact O-N 3.11Å; T534-Q537 VanDerWaalsContact OG1-CG 3.32Å; T534-Q537 WeakPolarHBondContact OG1-CG 3.45Å; T534-Q537 PolarHBondContact OG1-N 2.72Å; T534-Q537 PolarHBondContact OG1-OE1 2.81Å; Q537-S540 PolarHBondContact O-N 3.43Å; Q537-L541 WeakPolarHBondContact O-CB 3.16Å; Q537-L541 PolarHBondContact O-N 3Å
538	L	85.1	Confident	82.9	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-63.1	-42.3	176.5	-64.7	167.5	0	0	0	111.9	M533 T534 P535 Q536 L541 S542 I560 L561 T564 I581	M533-L538 HydrophobicContact CB-CD2 4.14Å; M533-L538 HydrophobicContact CB-CG 4.28Å; M533-L538 HydrophobicContact CE-CD2 3.91Å; M533-L538 HydrophobicContact SD-CD2 3.86Å; T534-L538 WeakPolarHBondContact O-CG 3.39Å; T534-L538 PolarHBondContact O-N 3.49Å; T534-L538 VanDerWaalsContact O-N 3.13Å; P535-L538 PolarHBondContact O-N 3.27Å; Q536-L538 VanDerWaalsContact C-N 3.34Å; Q536-L538 PolarHBondContact O-N 2.98Å; L538-L541 PolarHBondContact O-N 3.35Å; L538-S542 WeakPolarHBondContact O-CB 3.5Å; L538-S542 PolarHBondContact O-N 2.83Å; L538-I560 HydrophobicContact CD2-CG2 4.16Å; L538-L561 HydrophobicContact CB-CD2 3.94Å; L538-L561 HydrophobicContact CD2-CD2 4.3Å; L538-T564 HydrophobicContact CD1-CG2 3.39Å; L538-T564 HydrophobicContact CD2-CG2 3.9Å; L538-T564 HydrophobicContact CG-CG2 4.28Å; L538-I581 HydrophobicContact CD1-CD1 4.23Å
539	M	85.9	Confident	83	Confident	63 Å²	63	53.9 Å²	53.9	31%	0.31	29%	0.289	S	S	.	.	H	α-helix	trans	-69.1	-42.3	178.3	-65.7	-49.9	-61.8	0	0	111.8	P535 Q536 L541 S542 E543 M580 A584	P535-M539 WeakPolarHBondContact O-CG 3.47Å; P535-M539 PolarHBondContact O-N 3.36Å; Q536-M539 PolarHBondContact O-N 3.11Å; M539-L541 VanDerWaalsContact C-N 3.32Å; M539-L541 PolarHBondContact O-N 3.5Å; M539-S542 PolarHBondContact O-N 2.96Å; M539-E543 WeakPolarHBondContact O-CB 3.31Å; M539-E543 PolarHBondContact O-N 3.06Å; M539-M580 HydrophobicContact CG-SD 4.49Å; M539-M580 HydrophobicContact SD-CB 3.86Å; M539-A584 HydrophobicContact CE-CB 4.36Å
540	S	86.8	Confident	83.2	Confident	53 Å²	53	54.6 Å²	54.6	37%	0.371	29%	0.294	S	S	.	.	H	α-helix	trans	-60.5	-41	173.8	-62.8	0	0	0	0	112	I503 Q536 Q537 E543 A544	I503-S540 WeakPolarHBondContact CD1-O 3.44Å; Q536-S540 PolarHBondContact O-N 3.3Å; Q536-S540 PolarHBondContact O-OG 3.28Å; Q536-S540 VanDerWaalsContact O-OG 3.11Å; Q537-S540 PolarHBondContact O-N 3.43Å; S540-E543 PolarHBondContact O-N 2.89Å; S540-A544 WeakPolarHBondContact O-CB 3.38Å; S540-A544 PolarHBondContact O-N 3.38Å
541	L	86.5	Confident	83.7	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-61.6	-47.5	174.4	-177.6	64.4	0	0	0	111.6	F498 I514 M517 M533 Q537 L538 M539 E543 A544 A545 A557 I560	F498-L541 HydrophobicContact CE1-CB 4.25Å; F498-L541 HydrophobicContact CZ-CB 3.98Å; F498-L541 HydrophobicContact CZ-CD1 4.49Å; I514-L541 HydrophobicContact CD1-CD1 3.89Å; I514-L541 HydrophobicContact CG1-CD1 4.08Å; M517-L541 HydrophobicContact CE-CD1 4.47Å; M517-L541 HydrophobicContact CE-CD2 3.79Å; M533-L541 HydrophobicContact CE-CD2 4.5Å; Q537-L541 WeakPolarHBondContact O-CB 3.16Å; Q537-L541 PolarHBondContact O-N 3Å; L538-L541 PolarHBondContact O-N 3.35Å; M539-L541 VanDerWaalsContact C-N 3.32Å; M539-L541 PolarHBondContact O-N 3.5Å; L541-E543 VanDerWaalsContact C-N 3.34Å; L541-E543 PolarHBondContact O-N 3.05Å; L541-A544 PolarHBondContact O-N 3.49Å; L541-A545 VanDerWaalsContact O-CB 3.26Å; L541-A545 WeakPolarHBondContact O-CB 3.44Å; L541-A545 PolarHBondContact O-N 3.42Å; L541-A557 HydrophobicContact CG-CB 4.19Å; L541-I560 HydrophobicContact CD2-CB 4.18Å; L541-I560 HydrophobicContact CD2-CD1 3.88Å; L541-I560 HydrophobicContact CD2-CG2 3.78Å
542	S	84.1	Confident	84.5	Confident	12 Å²	12	53.5 Å²	53.5	8%	0.084	29%	0.287	C	S	.	.	H	α-helix	trans	-60.2	-44.4	179	-174.2	0	0	0	0	111.6	L538 M539 A545 T546	L538-S542 WeakPolarHBondContact O-CB 3.5Å; L538-S542 PolarHBondContact O-N 2.83Å; M539-S542 PolarHBondContact O-N 2.96Å; S542-A545 PolarHBondContact O-N 2.69Å; S542-T546 WeakPolarHBondContact O-CB 3.34Å; S542-T546 PolarHBondContact O-N 3.45Å; S542-T546 PolarHBondContact O-OG1 3.2Å
543	E	84.1	Confident	85.3	Confident	104 Å²	104	52 Å²	52	49%	0.486	28%	0.278	S	S	.	.	H	α-helix	trans	-65.7	-45.1	178.7	-177.2	168.6	-160.7	0	0	112.2	M539 S540 L541 T546 R547	M539-E543 WeakPolarHBondContact O-CB 3.31Å; M539-E543 PolarHBondContact O-N 3.06Å; S540-E543 PolarHBondContact O-N 2.89Å; L541-E543 VanDerWaalsContact C-N 3.34Å; L541-E543 PolarHBondContact O-N 3.05Å; E543-T546 PolarHBondContact O-N 3.14Å; E543-R547 WeakPolarHBondContact O-CG 3.2Å; E543-R547 PolarHBondContact O-N 3.37Å; E543-R547 IonicContact OE1-CZ 3.83Å; E543-R547 IonicContact OE1-NE 2.88Å; E543-R547 IonicContact OE1-NH2 3.86Å; E543-R547 PolarHBondContact OE1-NH2 3.22Å
544	A	82.4	Confident	85.8	Confident	30 Å²	30	52.2 Å²	52.2	25%	0.248	28%	0.278	C	S	.	.	H	α-helix	trans	-62.6	-44.8	176.7	0	0	0	0	0	111.8	I503 S540 L541 T546 R547 C548	I503-A544 HydrophobicContact CB-CB 4.42Å; I503-A544 HydrophobicContact CD1-CB 3.54Å; I503-A544 HydrophobicContact CG2-CB 4.17Å; S540-A544 WeakPolarHBondContact O-CB 3.38Å; S540-A544 PolarHBondContact O-N 3.38Å; L541-A544 PolarHBondContact O-N 3.49Å; A544-T546 PolarHBondContact O-N 3.34Å; A544-R547 PolarHBondContact O-N 2.93Å; A544-C548 PolarHBondContact O-N 3.32Å
545	A	80.6	Confident	86.2	Confident	5 Å²	5	50.5 Å²	50.5	4%	0.041	27%	0.267	C	S	.	.	H	α-helix	trans	-62.8	-41.3	178.2	0	0	0	0	0	111.9	L541 S542 R547 C548 V553 R554 A557	L541-A545 VanDerWaalsContact O-CB 3.26Å; L541-A545 WeakPolarHBondContact O-CB 3.44Å; L541-A545 PolarHBondContact O-N 3.42Å; S542-A545 PolarHBondContact O-N 2.69Å; A545-R547 PolarHBondContact O-N 3.29Å; A545-R547 VanDerWaalsContact O-N 3.12Å; A545-C548 WeakPolarHBondContact O-CB 3.36Å; A545-C548 PolarHBondContact O-N 3.04Å; A545-V553 HydrophobicContact CB-CG1 4.41Å; A545-R554 WeakPolarHBondContact O-CD 3.39Å; A545-R554 WeakPolarHBondContact O-CG 3.34Å; A545-A557 HydrophobicContact CB-CB 3.31Å
546	T	81.4	Confident	86.7	Confident	68 Å²	68	49 Å²	49	42%	0.417	26%	0.257	S	S	.	.	H	α-helix	trans	-62.4	-23.9	179.4	-50.1	0	0	0	0	112.7	S542 E543 A544	S542-T546 WeakPolarHBondContact O-CB 3.34Å; S542-T546 PolarHBondContact O-N 3.45Å; S542-T546 PolarHBondContact O-OG1 3.2Å; E543-T546 PolarHBondContact O-N 3.14Å; A544-T546 PolarHBondContact O-N 3.34Å
547	R	82.6	Confident	87.1	Confident	187 Å²	187	42.8 Å²	42.8	71%	0.706	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-5.3	176.8	-61.7	174.9	-173.9	-164	2.8	113.5	E543 A544 A545	E543-R547 WeakPolarHBondContact O-CG 3.2Å; E543-R547 PolarHBondContact O-N 3.37Å; E543-R547 IonicContact OE1-CZ 3.83Å; E543-R547 IonicContact OE1-NE 2.88Å; E543-R547 IonicContact OE1-NH2 3.86Å; E543-R547 PolarHBondContact OE1-NH2 3.22Å; A544-R547 PolarHBondContact O-N 2.93Å; A545-R547 PolarHBondContact O-N 3.29Å; A545-R547 VanDerWaalsContact O-N 3.12Å
548	C	85.3	Confident	87.4	Confident	16 Å²	16	41.1 Å²	41.1	11%	0.108	22%	0.221	C	C	.	.			trans	-88.6	130.4	-178.3	-173.6	0	0	0	0	110.6	A544 A545 V550 V553 R554	A544-C548 PolarHBondContact O-N 3.32Å; A545-C548 WeakPolarHBondContact O-CB 3.36Å; A545-C548 PolarHBondContact O-N 3.04Å; C548-V550 PolarHBondContact O-N 3.34Å; C548-V553 HydrophobicContact CB-CG1 4.06Å; C548-R554 WeakPolarHBondContact O-CD 2.82Å; C548-R554 PolarHBondContact O-NH1 2.92Å
549	D	87.9	Confident	87.8	Confident	140 Å²	140	41.4 Å²	41.4	75%	0.749	22%	0.223	S	C	*	.			trans	-73.2	-19.7	179.2	-71.7	-36.2	0	0	0	112.4	V551 R554	D549-V551 PolarHBondContact O-N 3.33Å; D549-R554 VanDerWaalsContact C-NH1 3.26Å; D549-R554 PolarHBondContact O-NH1 3.36Å
550	V	88.7	Confident	88.1	Confident	26 Å²	26	38.4 Å²	38.4	16%	0.158	21%	0.208	C	C	.	.			trans	-73	113.7	-179.4	-173.1	0	0	0	0	111.2	E507 C548 S552 V553 R554	E507-V550 HydrophobicContact CB-CG2 3.85Å; E507-V550 HydrophobicContact CG-CG2 3.76Å; C548-V550 PolarHBondContact O-N 3.34Å; V550-S552 VanDerWaalsContact CG1-OG 3.23Å; V550-S552 WeakPolarHBondContact CG1-OG 3.45Å; V550-S552 PolarHBondContact O-N 2.9Å; V550-V553 HydrophobicContact CB-CB 4.15Å; V550-V553 HydrophobicContact CB-CG2 3.92Å; V550-V553 HydrophobicContact CG1-CB 4.36Å; V550-V553 HydrophobicContact CG1-CG2 3.91Å; V550-V553 PolarHBondContact O-N 3.16Å; V550-R554 PolarHBondContact O-N 2.91Å
551	V	90.4	Very high	88.4	Confident	55 Å²	55	35.9 Å²	35.9	33%	0.333	19%	0.191	S	C	.	.	H	α-helix	trans	-60.3	-43	-176.8	174.3	0	0	0	0	112.2	D549 V553 R554 V555 D594 V597	D549-V551 PolarHBondContact O-N 3.33Å; V551-V553 PolarHBondContact O-N 3.46Å; V551-R554 PolarHBondContact O-N 3.34Å; V551-R554 VanDerWaalsContact O-N 3.14Å; V551-V555 HydrophobicContact CG1-CG2 4.24Å; V551-V555 WeakPolarHBondContact O-CG2 3.41Å; V551-V555 PolarHBondContact O-N 3.07Å; V551-D594 HydrophobicContact CG2-CB 4.39Å; V551-V597 HydrophobicContact CG1-CG2 3.84Å
552	S	88.8	Confident	88.8	Confident	36 Å²	36	35.9 Å²	35.9	25%	0.252	19%	0.191	S	C	.	.	H	α-helix	trans	-63	-40.6	-178.9	52.9	0	0	0	0	112.4	E511 V550 R554 V555 N556	E511-S552 VanDerWaalsContact OE1-CB 3.23Å; E511-S552 WeakPolarHBondContact OE1-CB 3.27Å; E511-S552 PolarHBondContact OE1-OG 3.31Å; V550-S552 VanDerWaalsContact CG1-OG 3.23Å; V550-S552 WeakPolarHBondContact CG1-OG 3.45Å; V550-S552 PolarHBondContact O-N 2.9Å; S552-R554 VanDerWaalsContact C-N 3.31Å; S552-R554 PolarHBondContact O-N 3.47Å; S552-V555 PolarHBondContact O-N 3.17Å; S552-N556 WeakPolarHBondContact O-CB 3.39Å; S552-N556 VanDerWaalsContact O-CG 3.26Å; S552-N556 PolarHBondContact O-N 2.84Å; S552-N556 PolarHBondContact O-ND2 2.9Å; S552-N556 VanDerWaalsContact O-ND2 3.08Å
553	V	90.6	Very high	89.1	Confident	2 Å²	2	36 Å²	36	1%	0.012	19%	0.191	C	C	.	.	H	α-helix	trans	-55.7	-47.4	171.8	168.2	0	0	0	0	110.6	L510 E511 I514 A545 C548 V550 V551 N556 A557	L510-V553 HydrophobicContact CB-CG2 4.28Å; E511-V553 HydrophobicContact CB-CG2 3.82Å; I514-V553 HydrophobicContact CD1-CG1 3.69Å; A545-V553 HydrophobicContact CB-CG1 4.41Å; C548-V553 HydrophobicContact CB-CG1 4.06Å; V550-V553 HydrophobicContact CB-CB 4.15Å; V550-V553 HydrophobicContact CB-CG2 3.92Å; V550-V553 HydrophobicContact CG1-CB 4.36Å; V550-V553 HydrophobicContact CG1-CG2 3.91Å; V550-V553 PolarHBondContact O-N 3.16Å; V551-V553 PolarHBondContact O-N 3.46Å; V553-N556 PolarHBondContact O-N 3.27Å; V553-A557 WeakPolarHBondContact O-CB 3.41Å; V553-A557 PolarHBondContact O-N 2.85Å
554	R	93.1	Very high	89.5	Confident	17 Å²	17	31 Å²	31	6%	0.064	17%	0.168	C	C	.	.	H	α-helix	trans	-64.7	-46.1	179.8	-58.1	-154.5	-61.3	-72.8	-3.3	112.4	A545 C548 D549 V550 V551 S552 N556 A557 V558 D592 V597	A545-R554 WeakPolarHBondContact O-CD 3.39Å; A545-R554 WeakPolarHBondContact O-CG 3.34Å; C548-R554 WeakPolarHBondContact O-CD 2.82Å; C548-R554 PolarHBondContact O-NH1 2.92Å; D549-R554 VanDerWaalsContact C-NH1 3.26Å; D549-R554 PolarHBondContact O-NH1 3.36Å; V550-R554 PolarHBondContact O-N 2.91Å; V551-R554 PolarHBondContact O-N 3.34Å; V551-R554 VanDerWaalsContact O-N 3.14Å; S552-R554 VanDerWaalsContact C-N 3.31Å; S552-R554 PolarHBondContact O-N 3.47Å; R554-N556 VanDerWaalsContact C-N 3.35Å; R554-N556 PolarHBondContact O-N 3.43Å; R554-A557 PolarHBondContact O-N 3.22Å; R554-V558 WeakPolarHBondContact O-CB 3.49Å; R554-V558 WeakPolarHBondContact O-CG2 3.39Å; R554-V558 PolarHBondContact O-N 2.95Å; R554-D592 IonicContact CZ-OD1 2.73Å; R554-D592 IonicContact CZ-OD2 3.13Å; R554-D592 IonicContact NE-OD1 2.81Å; R554-D592 IonicContact NE-OD2 2.88Å; R554-D592 PolarHBondContact NE-OD2 3.49Å; R554-D592 IonicContact NH2-OD1 2.6Å; R554-D592 PolarHBondContact NH2-OD1 2.78Å; R554-D592 IonicContact NH2-OD2 3.91Å; R554-V597 HydrophobicContact CB-CG1 3.97Å; R554-V597 HydrophobicContact CB-CG2 4.1Å
555	V	91.8	Very high	89.9	Confident	26 Å²	26	29.6 Å²	29.6	16%	0.158	16%	0.156	C	C	.	.	H	α-helix	trans	-56.8	-49.2	174.7	170.8	0	0	0	0	110.4	V551 S552 A557 V558 A559 V596 V597 E600	V551-V555 HydrophobicContact CG1-CG2 4.24Å; V551-V555 WeakPolarHBondContact O-CG2 3.41Å; V551-V555 PolarHBondContact O-N 3.07Å; S552-V555 PolarHBondContact O-N 3.17Å; V555-A557 PolarHBondContact O-N 3.44Å; V555-V558 PolarHBondContact O-N 2.98Å; V555-A559 WeakPolarHBondContact O-CB 3.36Å; V555-A559 PolarHBondContact O-N 3.32Å; V555-V596 HydrophobicContact CG2-CG1 4.13Å; V555-V597 HydrophobicContact CG2-CG2 3.89Å; V555-E600 HydrophobicContact CG1-CB 4.32Å; V555-E600 HydrophobicContact CG1-CG 3.96Å
556	N	92.5	Very high	90.4	Very high	11 Å²	11	30.9 Å²	30.9	6%	0.059	16%	0.164	C	C	.	.	H	α-helix	trans	-66.3	-39.4	-177.4	-71.2	-41.8	0	0	0	112.6	I514 S515 R518 S552 V553 R554 A559 I560	I514-N556 HydrophobicContact CG2-CB 3.61Å; S515-N556 PolarHBondContact OG-ND2 3.36Å; R518-N556 WeakPolarHBondContact CD-OD1 3.35Å; R518-N556 PolarHBondContact NE-OD1 2.77Å; S552-N556 WeakPolarHBondContact O-CB 3.39Å; S552-N556 VanDerWaalsContact O-CG 3.26Å; S552-N556 PolarHBondContact O-N 2.84Å; S552-N556 PolarHBondContact O-ND2 2.9Å; S552-N556 VanDerWaalsContact O-ND2 3.08Å; V553-N556 PolarHBondContact O-N 3.27Å; R554-N556 VanDerWaalsContact C-N 3.35Å; R554-N556 PolarHBondContact O-N 3.43Å; N556-A559 PolarHBondContact O-N 3.45Å; N556-I560 VanDerWaalsContact O-CG1 3.31Å; N556-I560 WeakPolarHBondContact O-CG1 3.49Å; N556-I560 PolarHBondContact O-N 3.07Å
557	A	93.1	Very high	90.8	Very high	2 Å²	2	28.5 Å²	28.5	2%	0.017	15%	0.15	C	C	.	.	H	α-helix	trans	-64.4	-42.3	176.7	0	0	0	0	0	112	I514 L541 A545 V553 R554 V555 I560 L561	I514-A557 HydrophobicContact CG2-CB 4.48Å; L541-A557 HydrophobicContact CG-CB 4.19Å; A545-A557 HydrophobicContact CB-CB 3.31Å; V553-A557 WeakPolarHBondContact O-CB 3.41Å; V553-A557 PolarHBondContact O-N 2.85Å; R554-A557 PolarHBondContact O-N 3.22Å; V555-A557 PolarHBondContact O-N 3.44Å; A557-I560 WeakPolarHBondContact O-CB 3.43Å; A557-I560 PolarHBondContact O-N 3.41Å; A557-L561 WeakPolarHBondContact O-CG 3.39Å; A557-L561 PolarHBondContact O-N 2.67Å; A557-L561 VanDerWaalsContact O-N 3.14Å
558	V	93.6	Very high	91.2	Very high	6 Å²	6	20.4 Å²	20.4	4%	0.036	12%	0.12	C	C	.	.	H	α-helix	trans	-62.3	-43.2	174.7	168.7	0	0	0	0	111.3	R554 V555 I560 L561 G562 L585 V588 V597 E600 A601 A604	R554-V558 WeakPolarHBondContact O-CB 3.49Å; R554-V558 WeakPolarHBondContact O-CG2 3.39Å; R554-V558 PolarHBondContact O-N 2.95Å; V555-V558 PolarHBondContact O-N 2.98Å; V558-I560 VanDerWaalsContact C-N 3.34Å; V558-I560 PolarHBondContact O-N 3.31Å; V558-L561 WeakPolarHBondContact O-CB 3.3Å; V558-L561 PolarHBondContact O-N 2.95Å; V558-G562 PolarHBondContact O-N 3.33Å; V558-L585 HydrophobicContact CG1-CD2 3.72Å; V558-V588 HydrophobicContact CG2-CB 4.45Å; V558-V588 HydrophobicContact CG2-CG1 3.83Å; V558-V588 HydrophobicContact CG2-CG2 4.41Å; V558-V597 HydrophobicContact CG2-CG1 4.41Å; V558-E600 HydrophobicContact CB-CG 4.4Å; V558-E600 HydrophobicContact CG1-CB 4.24Å; V558-E600 HydrophobicContact CG1-CG 3.95Å; V558-A601 HydrophobicContact CG1-CB 3.72Å; V558-A604 HydrophobicContact CG1-CB 4.24Å
559	A	92.9	Very high	91.4	Very high	7 Å²	7	19.8 Å²	19.8	6%	0.058	12%	0.116	C	C	.	.	H	α-helix	trans	-62.5	-39.5	175.8	0	0	0	0	0	112.2	R518 V555 N556 L561 G562 I563 E600	R518-A559 VanDerWaalsContact CD-CB 3.48Å; R518-A559 HydrophobicContact CG-CB 4.14Å; V555-A559 WeakPolarHBondContact O-CB 3.36Å; V555-A559 PolarHBondContact O-N 3.32Å; N556-A559 PolarHBondContact O-N 3.45Å; A559-L561 VanDerWaalsContact C-N 3.31Å; A559-L561 PolarHBondContact O-N 3.42Å; A559-G562 PolarHBondContact O-N 3.18Å; A559-G562 VanDerWaalsContact O-N 3.14Å; A559-I563 WeakPolarHBondContact O-CD1 3.21Å; A559-I563 VanDerWaalsContact O-CG1 3.27Å; A559-I563 WeakPolarHBondContact O-CG1 3.35Å; A559-I563 PolarHBondContact O-N 3.32Å; A559-E600 HydrophobicContact CB-CG 4.44Å; A559-E600 WeakPolarHBondContact CB-OE1 3.4Å
560	I	93.3	Very high	91.4	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59	-42.6	174.2	-73.1	164	0	0	0	111.3	I514 M517 R518 L521 M533 L538 L541 N556 A557 V558 G562 T564	I514-I560 HydrophobicContact CG2-CD1 3.69Å; M517-I560 HydrophobicContact CB-CD1 4.4Å; M517-I560 HydrophobicContact CE-CD1 3.79Å; R518-I560 HydrophobicContact CB-CD1 4.06Å; R518-I560 HydrophobicContact CB-CG1 3.75Å; R518-I560 HydrophobicContact CG-CG1 4.16Å; L521-I560 HydrophobicContact CD1-CB 4.5Å; L521-I560 HydrophobicContact CD1-CG1 4.22Å; L521-I560 HydrophobicContact CD1-CG2 3.71Å; M533-I560 HydrophobicContact SD-CG2 4.13Å; L538-I560 HydrophobicContact CD2-CG2 4.16Å; L541-I560 HydrophobicContact CD2-CB 4.18Å; L541-I560 HydrophobicContact CD2-CD1 3.88Å; L541-I560 HydrophobicContact CD2-CG2 3.78Å; N556-I560 VanDerWaalsContact O-CG1 3.31Å; N556-I560 WeakPolarHBondContact O-CG1 3.49Å; N556-I560 PolarHBondContact O-N 3.07Å; A557-I560 WeakPolarHBondContact O-CB 3.43Å; A557-I560 PolarHBondContact O-N 3.41Å; V558-I560 VanDerWaalsContact C-N 3.34Å; V558-I560 PolarHBondContact O-N 3.31Å; I560-G562 VanDerWaalsContact C-N 3.34Å; I560-T564 WeakPolarHBondContact O-CB 3.3Å; I560-T564 PolarHBondContact O-N 2.85Å; I560-T564 PolarHBondContact O-OG1 3.01Å
561	L	93.6	Very high	91.3	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-62.4	-41.7	174.8	-66.3	176.3	0	0	0	111.6	L538 A557 V558 A559 G565 I581 A584 L585	L538-L561 HydrophobicContact CB-CD2 3.94Å; L538-L561 HydrophobicContact CD2-CD2 4.3Å; A557-L561 WeakPolarHBondContact O-CG 3.39Å; A557-L561 PolarHBondContact O-N 2.67Å; A557-L561 VanDerWaalsContact O-N 3.14Å; V558-L561 WeakPolarHBondContact O-CB 3.3Å; V558-L561 PolarHBondContact O-N 2.95Å; A559-L561 VanDerWaalsContact C-N 3.31Å; A559-L561 PolarHBondContact O-N 3.42Å; L561-G565 PolarHBondContact O-N 2.9Å; L561-I581 HydrophobicContact CB-CG2 4.23Å; L561-I581 HydrophobicContact CD2-CG1 4.45Å; L561-A584 HydrophobicContact CD1-CB 4.32Å; L561-L585 HydrophobicContact CB-CD2 3.98Å; L561-L585 HydrophobicContact CB-CG 4.36Å; L561-L585 HydrophobicContact CD1-CD2 4.1Å; L561-L585 HydrophobicContact CD1-CG 4.47Å
562	G	93.3	Very high	91.2	Very high	2 Å²	2	29.2 Å²	29.2	2%	0.021	15%	0.145	C	C	.	.	H	α-helix	trans	-61.1	-53.4	176.4	0	0	0	0	0	113	V558 A559 I560 T564 G565 S566 V608	V558-G562 PolarHBondContact O-N 3.33Å; A559-G562 PolarHBondContact O-N 3.18Å; A559-G562 VanDerWaalsContact O-N 3.14Å; I560-G562 VanDerWaalsContact C-N 3.34Å; G562-T564 VanDerWaalsContact C-N 3.35Å; G562-T564 PolarHBondContact O-N 3.06Å; G562-G565 PolarHBondContact O-N 3.48Å; G562-S566 WeakPolarHBondContact O-CB 3.45Å; G562-S566 PolarHBondContact O-N 2.84Å; G562-S566 PolarHBondContact O-OG 3.03Å; G562-V608 WeakPolarHBondContact O-CG2 3.15Å
563	I	91.7	Very high	91.2	Very high	15 Å²	15	31 Å²	31	8%	0.077	17%	0.169	C	C	.	.	H	α-helix	trans	-57.6	-50	179	-66.4	161.4	0	0	0	110.2	R518 L521 Q522 A525 A559 S566 T567	R518-I563 HydrophobicContact CG-CD1 3.97Å; L521-I563 HydrophobicContact CB-CG2 4.25Å; Q522-I563 HydrophobicContact CB-CD1 4.04Å; A525-I563 HydrophobicContact CB-CG2 3.66Å; A559-I563 WeakPolarHBondContact O-CD1 3.21Å; A559-I563 VanDerWaalsContact O-CG1 3.27Å; A559-I563 WeakPolarHBondContact O-CG1 3.35Å; A559-I563 PolarHBondContact O-N 3.32Å; I563-S566 PolarHBondContact O-N 3.22Å; I563-S566 PolarHBondContact O-OG 2.86Å; I563-T567 PolarHBondContact O-N 3.32Å; I563-T567 PolarHBondContact O-OG1 3.37Å; I563-T567 VanDerWaalsContact O-OG1 3.06Å
564	T	91.3	Very high	91.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.5	-49.6	179.8	-63.3	0	0	0	0	111.8	Q531 L538 I560 G562 S566 T567 L568 I581	Q531-T564 HydrophobicContact CG-CG2 4.3Å; Q531-T564 PolarHBondContact NE2-OG1 3.04Å; Q531-T564 PolarHBondContact OE1-O 3.33Å; L538-T564 HydrophobicContact CD1-CG2 3.39Å; L538-T564 HydrophobicContact CD2-CG2 3.9Å; L538-T564 HydrophobicContact CG-CG2 4.28Å; I560-T564 WeakPolarHBondContact O-CB 3.3Å; I560-T564 PolarHBondContact O-N 2.85Å; I560-T564 PolarHBondContact O-OG1 3.01Å; G562-T564 VanDerWaalsContact C-N 3.35Å; G562-T564 PolarHBondContact O-N 3.06Å; T564-S566 VanDerWaalsContact C-N 3.31Å; T564-S566 PolarHBondContact O-N 3.08Å; T564-T567 WeakPolarHBondContact O-CB 3.46Å; T564-T567 PolarHBondContact O-N 3.25Å; T564-T567 VanDerWaalsContact O-N 3.09Å; T564-L568 HydrophobicContact CG2-CD1 3.74Å; T564-L568 HydrophobicContact CG2-CG 4.28Å; T564-L568 WeakPolarHBondContact O-CG 3.41Å; T564-L568 PolarHBondContact O-N 2.84Å; T564-I581 HydrophobicContact CG2-CD1 4.35Å
565	G	91.9	Very high	91.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.2	-37	-179	0	0	0	0	0	112.3	L561 G562 T567 L568 A569 L578	L561-G565 PolarHBondContact O-N 2.9Å; G562-G565 PolarHBondContact O-N 3.48Å; G565-T567 PolarHBondContact O-N 3.4Å; G565-L568 PolarHBondContact O-N 2.95Å; G565-A569 WeakPolarHBondContact O-CB 3.46Å; G565-A569 PolarHBondContact O-N 3.45Å; G565-L578 VanDerWaalsContact O-CD2 3.3Å; G565-L578 WeakPolarHBondContact O-CD2 3.42Å
566	S	91.1	Very high	91.3	Very high	31 Å²	31	37.6 Å²	37.6	22%	0.217	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-26.9	175.8	76.8	0	0	0	0	113.3	G562 I563 T564	G562-S566 WeakPolarHBondContact O-CB 3.45Å; G562-S566 PolarHBondContact O-N 2.84Å; G562-S566 PolarHBondContact O-OG 3.03Å; I563-S566 PolarHBondContact O-N 3.22Å; I563-S566 PolarHBondContact O-OG 2.86Å; T564-S566 VanDerWaalsContact C-N 3.31Å; T564-S566 PolarHBondContact O-N 3.08Å
567	T	89.6	Confident	91.2	Very high	19 Å²	19	38.1 Å²	38.1	12%	0.117	21%	0.205	C	C	.	.	H	α-helix	trans	-78.8	-49.2	175.3	-54.2	0	0	0	0	109.9	I563 T564 G565 A569 K570	I563-T567 PolarHBondContact O-N 3.32Å; I563-T567 PolarHBondContact O-OG1 3.37Å; I563-T567 VanDerWaalsContact O-OG1 3.06Å; T564-T567 WeakPolarHBondContact O-CB 3.46Å; T564-T567 PolarHBondContact O-N 3.25Å; T564-T567 VanDerWaalsContact O-N 3.09Å; G565-T567 PolarHBondContact O-N 3.4Å; T567-A569 VanDerWaalsContact C-N 3.26Å; T567-A569 PolarHBondContact O-N 2.94Å; T567-K570 PolarHBondContact O-N 3.44Å; T567-K570 VanDerWaalsContact O-N 3.16Å
568	L	89.9	Confident	91.3	Very high	17 Å²	17	38 Å²	38	9%	0.089	20%	0.204	C	C	.	.	H	α-helix	trans	-61.7	-30.1	177.4	-68.5	173.8	0	0	0	113.4	Q531 T564 G565 K570 E571 T574 T577 L578 I581	Q531-L568 HydrophobicContact CG-CD2 4.47Å; T564-L568 HydrophobicContact CG2-CD1 3.74Å; T564-L568 HydrophobicContact CG2-CG 4.28Å; T564-L568 WeakPolarHBondContact O-CG 3.41Å; T564-L568 PolarHBondContact O-N 2.84Å; G565-L568 PolarHBondContact O-N 2.95Å; L568-K570 PolarHBondContact O-N 3.21Å; L568-E571 PolarHBondContact O-N 3.12Å; L568-T574 HydrophobicContact CB-CG2 4.19Å; L568-T574 HydrophobicContact CD2-CG2 3.95Å; L568-T574 PolarHBondContact O-OG1 3.47Å; L568-T577 HydrophobicContact CD1-CG2 3.69Å; L568-L578 HydrophobicContact CB-CD2 3.99Å; L568-I581 HydrophobicContact CD1-CD1 4.04Å
569	A	90.6	Very high	91.3	Very high	3 Å²	3	40 Å²	40	3%	0.025	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-23.5	176.2	0	0	0	0	0	113.7	G565 T567 L578 A615	G565-A569 WeakPolarHBondContact O-CB 3.46Å; G565-A569 PolarHBondContact O-N 3.45Å; T567-A569 VanDerWaalsContact C-N 3.26Å; T567-A569 PolarHBondContact O-N 2.94Å; A569-L578 HydrophobicContact CB-CD1 4.46Å; A569-L578 HydrophobicContact CB-CD2 4.46Å; A569-A615 HydrophobicContact CB-CB 3.81Å
570	K	87.9	Confident	91.3	Very high	146 Å²	146	43.2 Å²	43.2	64%	0.635	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-8.4	-179.8	-57.1	172.3	-171.6	168.8	0	112.9	T567 L568	T567-K570 PolarHBondContact O-N 3.44Å; T567-K570 VanDerWaalsContact O-N 3.16Å; L568-K570 PolarHBondContact O-N 3.21Å
571	E	87	Confident	91.3	Very high	80 Å²	80	43.2 Å²	43.2	37%	0.374	23%	0.227	S	C	.	.	S	Bend	trans	-101.9	141.4	-178.7	-66	-177.4	-173.8	0	0	111	L568 T574 E614	L568-E571 PolarHBondContact O-N 3.12Å; E571-T574 HydrophobicContact CB-CG2 3.82Å; E571-T574 PolarHBondContact O-OG1 3.35Å; E571-E614 WeakPolarHBondContact O-CG 3.22Å
572	K	88.1	Confident	91.4	Very high	193 Å²	193	43.2 Å²	43.2	84%	0.839	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	145.4	-179.4	-65.4	-173	177.4	-174.3	0	111.9
573	G	88.8	Confident	91.4	Very high	72 Å²	72	47.3 Å²	47.3	74%	0.742	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.4	24.1	175.6	0	0	0	0	0	114.1	E614	G573-E614 PolarHBondContact N-OE1 3.03Å; G573-E614 PolarHBondContact N-OE2 3.45Å; G573-E614 VanDerWaalsContact N-OE2 3.15Å
574	T	91.9	Very high	91.4	Very high	11 Å²	11	47 Å²	47	7%	0.067	25%	0.248	C	C	.	.			trans	-106.2	-1.9	-178.2	61.8	0	0	0	0	113.1	L568 E571 E576 T577 L578 E614	L568-T574 HydrophobicContact CB-CG2 4.19Å; L568-T574 HydrophobicContact CD2-CG2 3.95Å; L568-T574 PolarHBondContact O-OG1 3.47Å; E571-T574 HydrophobicContact CB-CG2 3.82Å; E571-T574 PolarHBondContact O-OG1 3.35Å; T574-E576 VanDerWaalsContact C-N 3.27Å; T574-E576 PolarHBondContact O-N 3.35Å; T574-E576 VanDerWaalsContact O-N 3.11Å; T574-T577 PolarHBondContact O-N 3.38Å; T574-L578 WeakPolarHBondContact O-CG 3.3Å; T574-L578 PolarHBondContact O-N 3.2Å; T574-L578 WeakPolarHBondContact OG1-CD1 3.49Å; T574-E614 PolarHBondContact N-OE2 3.45Å
575	V	93.6	Very high	91.6	Very high	21 Å²	21	47 Å²	47	13%	0.127	25%	0.248	C	C	.	.	H	α-helix	trans	-43.8	-48.1	179.7	179.3	0	0	0	0	113.1	L578 Q579 E614 M617 A618	V575-L578 PolarHBondContact O-N 3.2Å; V575-Q579 VanDerWaalsContact CG1-NE2 3.28Å; V575-Q579 VanDerWaalsContact O-CG 3.29Å; V575-Q579 WeakPolarHBondContact O-CG 3.49Å; V575-Q579 PolarHBondContact O-N 3.23Å; V575-E614 HydrophobicContact CG2-CB 4.18Å; V575-E614 HydrophobicContact CG2-CG 4.43Å; V575-E614 WeakPolarHBondContact CG2-OE2 3.46Å; V575-E614 PolarHBondContact N-OE2 3.02Å; V575-M617 HydrophobicContact CG1-CB 4.37Å; V575-M617 HydrophobicContact CG1-CG 4.21Å; V575-M617 HydrophobicContact CG1-SD 4.38Å; V575-M617 HydrophobicContact CG2-CB 4.12Å; V575-M617 HydrophobicContact CG2-CG 4.3Å; V575-M617 HydrophobicContact CG2-SD 3.88Å; V575-A618 HydrophobicContact CG1-CB 4.21Å
576	E	92	Very high	91.8	Very high	153 Å²	153	48.2 Å²	48.2	72%	0.715	26%	0.255	S	S	*	.	H	α-helix	trans	-64.9	-43	-178	-66.8	-175.8	177.3	0	0	112	T574 Q579 M580	T574-E576 VanDerWaalsContact C-N 3.27Å; T574-E576 PolarHBondContact O-N 3.35Å; T574-E576 VanDerWaalsContact O-N 3.11Å; E576-Q579 WeakPolarHBondContact O-CB 3.34Å; E576-Q579 PolarHBondContact O-N 2.88Å; E576-M580 WeakPolarHBondContact O-CG 3.38Å; E576-M580 PolarHBondContact O-N 2.99Å
577	T	91.1	Very high	91.9	Very high	22 Å²	22	51.7 Å²	51.7	14%	0.135	27%	0.268	C	S	.	.	H	α-helix	trans	-64.8	-42.6	176.2	-55	0	0	0	0	111.4	P535 L568 T574 Q579 M580 I581	P535-T577 HydrophobicContact CB-CG2 3.94Å; P535-T577 HydrophobicContact CG-CG2 3.87Å; L568-T577 HydrophobicContact CD1-CG2 3.69Å; T574-T577 PolarHBondContact O-N 3.38Å; T577-Q579 VanDerWaalsContact C-N 3.29Å; T577-Q579 PolarHBondContact O-N 3.08Å; T577-M580 PolarHBondContact O-N 3.23Å; T577-M580 VanDerWaalsContact O-N 3.15Å; T577-I581 HydrophobicContact CG2-CD1 4.07Å; T577-I581 WeakPolarHBondContact O-CG1 3.38Å; T577-I581 PolarHBondContact O-N 3.13Å
578	L	94	Very high	92.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.7	-34.7	175.9	-67.2	170.9	0	0	0	112	G565 L568 A569 T574 V575 G582 V608 E614 A615 A618	G565-L578 VanDerWaalsContact O-CD2 3.3Å; G565-L578 WeakPolarHBondContact O-CD2 3.42Å; L568-L578 HydrophobicContact CB-CD2 3.99Å; A569-L578 HydrophobicContact CB-CD1 4.46Å; A569-L578 HydrophobicContact CB-CD2 4.46Å; T574-L578 WeakPolarHBondContact O-CG 3.3Å; T574-L578 PolarHBondContact O-N 3.2Å; T574-L578 WeakPolarHBondContact OG1-CD1 3.49Å; V575-L578 PolarHBondContact O-N 3.2Å; L578-G582 PolarHBondContact O-N 2.83Å; L578-V608 HydrophobicContact CD2-CG1 3.92Å; L578-E614 HydrophobicContact CD1-CB 3.84Å; L578-A615 HydrophobicContact CD1-CB 4.37Å; L578-A618 HydrophobicContact CB-CB 3.68Å
579	Q	94	Very high	92.4	Very high	47 Å²	47	50.5 Å²	50.5	22%	0.22	26%	0.261	C	S	.	.	H	α-helix	trans	-64.4	-44.8	171.4	-73	171	23.4	0	0	111.8	V575 E576 T577 G582 N583 A618 N621 L622	V575-Q579 VanDerWaalsContact CG1-NE2 3.28Å; V575-Q579 VanDerWaalsContact O-CG 3.29Å; V575-Q579 WeakPolarHBondContact O-CG 3.49Å; V575-Q579 PolarHBondContact O-N 3.23Å; E576-Q579 WeakPolarHBondContact O-CB 3.34Å; E576-Q579 PolarHBondContact O-N 2.88Å; T577-Q579 VanDerWaalsContact C-N 3.29Å; T577-Q579 PolarHBondContact O-N 3.08Å; Q579-G582 PolarHBondContact O-N 2.72Å; Q579-N583 WeakPolarHBondContact O-CB 3.4Å; Q579-N583 PolarHBondContact O-N 3.38Å; Q579-N583 PolarHBondContact O-ND2 3.49Å; Q579-A618 HydrophobicContact CG-CB 3.84Å; Q579-N621 HydrophobicContact CG-CB 4.29Å; Q579-N621 VanDerWaalsContact NE2-CB 3.31Å; Q579-N621 PolarHBondContact NE2-ND2 2.72Å; Q579-L622 HydrophobicContact CB-CD2 4.18Å; Q579-L622 HydrophobicContact CB-CG 4.37Å; Q579-L622 HydrophobicContact CG-CD2 4.45Å; Q579-L622 HydrophobicContact CG-CG 4.2Å; Q579-L622 WeakPolarHBondContact O-CD2 3.48Å
580	M	92.1	Very high	92.5	Very high	74 Å²	74	54 Å²	54	37%	0.365	28%	0.282	S	S	.	.	H	α-helix	trans	-60.7	-47.1	176.9	-69.5	-172.9	-72.4	0	0	111.4	P535 M539 E576 T577 N583 A584	P535-M580 HydrophobicContact CB-CE 4.02Å; M539-M580 HydrophobicContact CG-SD 4.49Å; M539-M580 HydrophobicContact SD-CB 3.86Å; E576-M580 WeakPolarHBondContact O-CG 3.38Å; E576-M580 PolarHBondContact O-N 2.99Å; T577-M580 PolarHBondContact O-N 3.23Å; T577-M580 VanDerWaalsContact O-N 3.15Å; M580-N583 PolarHBondContact O-N 3.03Å; M580-A584 PolarHBondContact O-N 3.42Å
581	I	93.7	Very high	92.7	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-59.5	-49.7	175.9	-69.5	171.3	0	0	0	110.7	L538 L561 T564 L568 T577 N583 A584 L585 V608	L538-I581 HydrophobicContact CD1-CD1 4.23Å; L561-I581 HydrophobicContact CB-CG2 4.23Å; L561-I581 HydrophobicContact CD2-CG1 4.45Å; T564-I581 HydrophobicContact CG2-CD1 4.35Å; L568-I581 HydrophobicContact CD1-CD1 4.04Å; T577-I581 HydrophobicContact CG2-CD1 4.07Å; T577-I581 WeakPolarHBondContact O-CG1 3.38Å; T577-I581 PolarHBondContact O-N 3.13Å; I581-N583 PolarHBondContact O-N 3.39Å; I581-A584 PolarHBondContact O-N 2.95Å; I581-L585 HydrophobicContact CG2-CD1 3.74Å; I581-L585 HydrophobicContact CG2-CG 4.23Å; I581-L585 WeakPolarHBondContact O-CB 3.5Å; I581-L585 WeakPolarHBondContact O-CG 3.42Å; I581-L585 PolarHBondContact O-N 3.07Å; I581-V608 HydrophobicContact CG2-CG2 4.37Å
582	G	94.9	Very high	93	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-62.8	-39.1	-179	0	0	0	0	0	113.3	L578 Q579 L586	L578-G582 PolarHBondContact O-N 2.83Å; Q579-G582 PolarHBondContact O-N 2.72Å; G582-L586 WeakPolarHBondContact O-CB 3.44Å; G582-L586 PolarHBondContact O-N 2.96Å
583	N	93.5	Very high	93.1	Very high	87 Å²	87	48.6 Å²	48.6	47%	0.465	27%	0.265	S	S	.	.	H	α-helix	trans	-62.8	-45.9	173.2	-85.5	-42.1	0	0	0	112	Q579 M580 I581 L586 Q587 L622	Q579-N583 WeakPolarHBondContact O-CB 3.4Å; Q579-N583 PolarHBondContact O-N 3.38Å; Q579-N583 PolarHBondContact O-ND2 3.49Å; M580-N583 PolarHBondContact O-N 3.03Å; I581-N583 PolarHBondContact O-N 3.39Å; N583-L586 PolarHBondContact O-N 3.33Å; N583-Q587 WeakPolarHBondContact O-CB 3.45Å; N583-Q587 PolarHBondContact O-N 3.36Å; N583-L622 HydrophobicContact CB-CD2 4.27Å; N583-L622 WeakPolarHBondContact ND2-CD2 3.48Å; N583-L622 WeakPolarHBondContact OD1-CD2 3.33Å
584	A	93.4	Very high	93.3	Very high	8 Å²	8	46 Å²	46	7%	0.066	23%	0.234	C	C	.	.	H	α-helix	trans	-61.4	-49.5	178.6	0	0	0	0	0	111.2	M539 L561 M580 I581 L586 Q587 V588	M539-A584 HydrophobicContact CE-CB 4.36Å; L561-A584 HydrophobicContact CD1-CB 4.32Å; M580-A584 PolarHBondContact O-N 3.42Å; I581-A584 PolarHBondContact O-N 2.95Å; A584-L586 PolarHBondContact O-N 3.18Å; A584-Q587 WeakPolarHBondContact O-CB 3.37Å; A584-Q587 PolarHBondContact O-N 3.45Å; A584-V588 WeakPolarHBondContact O-CG2 3.29Å; A584-V588 PolarHBondContact O-N 3.4Å
585	L	95.4	Very high	93.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.6	-43.6	177.5	-70	175.6	0	0	0	112.1	V558 L561 I581 Q587 V588 A589 A604 L605 V608	V558-L585 HydrophobicContact CG1-CD2 3.72Å; L561-L585 HydrophobicContact CB-CD2 3.98Å; L561-L585 HydrophobicContact CB-CG 4.36Å; L561-L585 HydrophobicContact CD1-CD2 4.1Å; L561-L585 HydrophobicContact CD1-CG 4.47Å; I581-L585 HydrophobicContact CG2-CD1 3.74Å; I581-L585 HydrophobicContact CG2-CG 4.23Å; I581-L585 WeakPolarHBondContact O-CB 3.5Å; I581-L585 WeakPolarHBondContact O-CG 3.42Å; I581-L585 PolarHBondContact O-N 3.07Å; L585-Q587 VanDerWaalsContact C-N 3.34Å; L585-Q587 PolarHBondContact O-N 2.77Å; L585-V588 PolarHBondContact O-N 3.41Å; L585-A589 VanDerWaalsContact O-CB 3.28Å; L585-A589 WeakPolarHBondContact O-CB 3.39Å; L585-A589 PolarHBondContact O-N 2.84Å; L585-A604 HydrophobicContact CD1-CB 3.93Å; L585-A604 HydrophobicContact CD2-CB 3.76Å; L585-L605 HydrophobicContact CB-CD1 4.34Å; L585-L605 HydrophobicContact CB-CD2 3.69Å; L585-L605 HydrophobicContact CB-CG 3.74Å; L585-L605 HydrophobicContact CD1-CD2 4.02Å; L585-L605 HydrophobicContact CD1-CG 4.19Å; L585-V608 HydrophobicContact CD1-CG2 4.2Å
586	L	95.3	Very high	93.2	Very high	26 Å²	26	46.1 Å²	46.1	14%	0.136	24%	0.235	C	C	.	.	H	α-helix	trans	-65	-38	178.1	-176.5	65.1	0	0	0	112.1	G582 N583 A584 T590 L605 A627 L628 L631	G582-L586 WeakPolarHBondContact O-CB 3.44Å; G582-L586 PolarHBondContact O-N 2.96Å; N583-L586 PolarHBondContact O-N 3.33Å; A584-L586 PolarHBondContact O-N 3.18Å; L586-T590 WeakPolarHBondContact O-CB 3.33Å; L586-T590 PolarHBondContact O-N 3Å; L586-T590 VanDerWaalsContact O-N 3.15Å; L586-T590 PolarHBondContact O-OG1 3.32Å; L586-L605 HydrophobicContact CD1-CD1 4.47Å; L586-A627 HydrophobicContact CD1-CB 4.03Å; L586-A627 HydrophobicContact CD2-CB 3.63Å; L586-A627 HydrophobicContact CG-CB 4.44Å; L586-L628 HydrophobicContact CD1-CD2 4.41Å; L586-L631 HydrophobicContact CD1-CD2 4.48Å
587	Q	93.6	Very high	93.3	Very high	104 Å²	104	38.9 Å²	38.9	49%	0.486	20%	0.201	S	C	.	.	H	α-helix	trans	-61.7	-47.7	174.2	179.3	176.7	-19.6	0	0	110.8	N583 A584 L585 T590 R591	N583-Q587 WeakPolarHBondContact O-CB 3.45Å; N583-Q587 PolarHBondContact O-N 3.36Å; A584-Q587 WeakPolarHBondContact O-CB 3.37Å; A584-Q587 PolarHBondContact O-N 3.45Å; L585-Q587 VanDerWaalsContact C-N 3.34Å; L585-Q587 PolarHBondContact O-N 2.77Å; Q587-T590 PolarHBondContact O-N 3.41Å; Q587-R591 VanDerWaalsContact O-CB 3.3Å; Q587-R591 WeakPolarHBondContact O-CB 3.28Å; Q587-R591 WeakPolarHBondContact O-CG 3.45Å; Q587-R591 PolarHBondContact O-N 3.4Å
588	V	94.2	Very high	93.5	Very high	10 Å²	10	38 Å²	38	6%	0.061	20%	0.195	C	C	.	.	H	α-helix	trans	-62.9	-50.1	178	176.4	0	0	0	0	110.7	V558 A584 L585 T590 R591 D592 V597 N598 A601	V558-V588 HydrophobicContact CG2-CB 4.45Å; V558-V588 HydrophobicContact CG2-CG1 3.83Å; V558-V588 HydrophobicContact CG2-CG2 4.41Å; A584-V588 WeakPolarHBondContact O-CG2 3.29Å; A584-V588 PolarHBondContact O-N 3.4Å; L585-V588 PolarHBondContact O-N 3.41Å; V588-T590 PolarHBondContact O-N 3.44Å; V588-R591 PolarHBondContact O-N 3.03Å; V588-D592 HydrophobicContact CG1-CB 4.17Å; V588-D592 WeakPolarHBondContact O-CB 3.38Å; V588-D592 PolarHBondContact O-N 2.82Å; V588-V597 HydrophobicContact CG1-CG1 3.59Å; V588-N598 PolarHBondContact O-OD1 3.3Å; V588-A601 HydrophobicContact CB-CB 4.08Å; V588-A601 HydrophobicContact CG1-CB 3.86Å
589	A	95.3	Very high	93.5	Very high	2 Å²	2	38 Å²	38	2%	0.017	20%	0.195	C	C	.	.	H	α-helix	trans	-57.3	-23.7	179.2	0	0	0	0	0	114.4	L585 N598 A601 L602 L631	L585-A589 VanDerWaalsContact O-CB 3.28Å; L585-A589 WeakPolarHBondContact O-CB 3.39Å; L585-A589 PolarHBondContact O-N 2.84Å; A589-N598 VanDerWaalsContact C-OD1 3.22Å; A589-N598 PolarHBondContact O-OD1 3.47Å; A589-A601 HydrophobicContact CB-CB 3.8Å; A589-L602 HydrophobicContact CB-CD2 4.12Å; A589-L602 HydrophobicContact CB-CG 4.03Å; A589-L631 HydrophobicContact CB-CD2 3.98Å
590	T	93	Very high	93.5	Very high	76 Å²	76	36.8 Å²	36.8	47%	0.466	19%	0.19	S	C	.	.	H	α-helix	trans	-98.6	-34.9	-178.6	-53.4	0	0	0	0	112.7	L586 Q587 V588 L631	L586-T590 WeakPolarHBondContact O-CB 3.33Å; L586-T590 PolarHBondContact O-N 3Å; L586-T590 VanDerWaalsContact O-N 3.15Å; L586-T590 PolarHBondContact O-OG1 3.32Å; Q587-T590 PolarHBondContact O-N 3.41Å; V588-T590 PolarHBondContact O-N 3.44Å; T590-L631 HydrophobicContact CG2-CD1 4.36Å
591	R	92.2	Very high	93.7	Very high	195 Å²	195	33.3 Å²	33.3	74%	0.736	17%	0.172	S	C	*	.	H	α-helix	trans	-113.7	-15.5	-165	-60.2	-170.6	179.9	-169.2	0.1	114.7	Q587 V588 S593	Q587-R591 VanDerWaalsContact O-CB 3.3Å; Q587-R591 WeakPolarHBondContact O-CB 3.28Å; Q587-R591 WeakPolarHBondContact O-CG 3.45Å; Q587-R591 PolarHBondContact O-N 3.4Å; V588-R591 PolarHBondContact O-N 3.03Å; R591-S593 PolarHBondContact O-N 3.34Å
592	D	93.3	Very high	93.9	Very high	19 Å²	19	33.2 Å²	33.2	10%	0.102	17%	0.172	C	C	.	.			trans	-64.4	140.8	-177.7	-159	-72	0	0	0	110.8	R554 V588 D594 V597 N598 K638	R554-D592 IonicContact CZ-OD1 2.73Å; R554-D592 IonicContact CZ-OD2 3.13Å; R554-D592 IonicContact NE-OD1 2.81Å; R554-D592 IonicContact NE-OD2 2.88Å; R554-D592 PolarHBondContact NE-OD2 3.49Å; R554-D592 IonicContact NH2-OD1 2.6Å; R554-D592 PolarHBondContact NH2-OD1 2.78Å; R554-D592 IonicContact NH2-OD2 3.91Å; V588-D592 HydrophobicContact CG1-CB 4.17Å; V588-D592 WeakPolarHBondContact O-CB 3.38Å; V588-D592 PolarHBondContact O-N 2.82Å; D592-D594 VanDerWaalsContact C-N 3.29Å; D592-D594 PolarHBondContact O-N 2.87Å; D592-D594 PolarHBondContact OD1-N 3.48Å; D592-V597 HydrophobicContact CB-CB 4.15Å; D592-V597 HydrophobicContact CB-CG1 4.08Å; D592-V597 WeakPolarHBondContact OD2-CG1 3.46Å; D592-N598 PolarHBondContact N-OD1 3.14Å; D592-N598 PolarHBondContact O-ND2 3.14Å; D592-K638 PolarHBondContact O-NZ 3.46Å
593	S	90.8	Very high	93.9	Very high	91 Å²	91	34 Å²	34	64%	0.636	18%	0.176	S	C	*	.	S	Bend	trans	-66.5	-33.9	178.9	66.3	0	0	0	0	111.6	R591 K638	R591-S593 PolarHBondContact O-N 3.34Å; S593-K638 PolarHBondContact O-NZ 3.23Å
594	D	91.6	Very high	94	Very high	18 Å²	18	30 Å²	30	10%	0.096	16%	0.155	C	C	.	.	S	Bend	trans	-94.9	131.5	-175.3	-168.1	-89.3	0	0	0	113.1	V551 D592 V596 V597 N598 K646 Y647	V551-D594 HydrophobicContact CG2-CB 4.39Å; D592-D594 VanDerWaalsContact C-N 3.29Å; D592-D594 PolarHBondContact O-N 2.87Å; D592-D594 PolarHBondContact OD1-N 3.48Å; D594-V596 VanDerWaalsContact C-N 3.33Å; D594-V596 PolarHBondContact O-N 3.45Å; D594-V596 WeakPolarHBondContact OD1-CA 3.32Å; D594-V596 VanDerWaalsContact OD1-CB 3.25Å; D594-V596 WeakPolarHBondContact OD1-CB 3.31Å; D594-V596 PolarHBondContact OD1-N 3.47Å; D594-V597 HydrophobicContact CB-CG2 4Å; D594-V597 PolarHBondContact O-N 3.16Å; D594-N598 PolarHBondContact O-N 3.42Å; D594-N598 VanDerWaalsContact O-N 3.14Å; D594-N598 PolarHBondContact O-ND2 2.65Å; D594-K646 IonicContact OD2-NZ 2.64Å; D594-Y647 PolarHBondContact OD2-OH 2.89Å
595	L	92	Very high	94.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.8	-30.1	-175.8	-172.7	60.3	0	0	0	113.2	N598 G599 F635 K638 I639 Y647 L655	L595-N598 PolarHBondContact O-N 2.94Å; L595-G599 PolarHBondContact O-N 3.42Å; L595-F635 HydrophobicContact CD1-CD2 3.98Å; L595-F635 HydrophobicContact CD1-CE2 3.58Å; L595-F635 HydrophobicContact CD1-CZ 4.34Å; L595-K638 HydrophobicContact CD1-CB 4.12Å; L595-K638 HydrophobicContact CD1-CD 3.93Å; L595-K638 HydrophobicContact CD1-CG 3.97Å; L595-I639 HydrophobicContact CD1-CG1 4.14Å; L595-I639 HydrophobicContact CD2-CB 4.4Å; L595-I639 HydrophobicContact CD2-CG1 3.88Å; L595-I639 HydrophobicContact CG-CG1 4.42Å; L595-Y647 HydrophobicContact CB-CE1 4.3Å; L595-Y647 HydrophobicContact CB-CE2 3.71Å; L595-Y647 WeakPolarHBondContact CB-OH 3.4Å; L595-Y647 HydrophobicContact CD2-CD2 4.25Å; L595-Y647 HydrophobicContact CD2-CE2 3.91Å; L595-Y647 HydrophobicContact CG-CE2 4.47Å; L595-Y647 PolarHBondContact N-OH 3.11Å; L595-L655 HydrophobicContact CB-CD1 4.47Å; L595-L655 HydrophobicContact CD2-CD1 3.71Å; L595-L655 HydrophobicContact CG-CD1 3.76Å; L595-L655 HydrophobicContact CG-CD2 4.04Å; L595-L655 WeakPolarHBondContact O-CD2 3.39Å
596	V	92	Very high	94.1	Very high	35 Å²	35	30.4 Å²	30.4	21%	0.212	16%	0.155	C	C	.	.	H	α-helix	trans	-67.3	-43.2	176.8	178.8	0	0	0	0	110.1	V555 D594 N598 G599 E600 Y647 Q651	V555-V596 HydrophobicContact CG2-CG1 4.13Å; D594-V596 VanDerWaalsContact C-N 3.33Å; D594-V596 PolarHBondContact O-N 3.45Å; D594-V596 WeakPolarHBondContact OD1-CA 3.32Å; D594-V596 VanDerWaalsContact OD1-CB 3.25Å; D594-V596 WeakPolarHBondContact OD1-CB 3.31Å; D594-V596 PolarHBondContact OD1-N 3.47Å; V596-N598 PolarHBondContact O-N 3.13Å; V596-G599 PolarHBondContact O-N 3.06Å; V596-G599 VanDerWaalsContact O-N 3.17Å; V596-E600 PolarHBondContact O-N 2.73Å; V596-Y647 HydrophobicContact CG2-CD1 3.82Å; V596-Y647 HydrophobicContact CG2-CE1 3.71Å; V596-Q651 HydrophobicContact CG2-CG 4.48Å
597	V	93.8	Very high	94.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.5	-42.3	175.9	-172.5	0	0	0	0	111	V551 R554 V555 V558 V588 D592 D594 G599 E600 A601	V551-V597 HydrophobicContact CG1-CG2 3.84Å; R554-V597 HydrophobicContact CB-CG1 3.97Å; R554-V597 HydrophobicContact CB-CG2 4.1Å; V555-V597 HydrophobicContact CG2-CG2 3.89Å; V558-V597 HydrophobicContact CG2-CG1 4.41Å; V588-V597 HydrophobicContact CG1-CG1 3.59Å; D592-V597 HydrophobicContact CB-CB 4.15Å; D592-V597 HydrophobicContact CB-CG1 4.08Å; D592-V597 WeakPolarHBondContact OD2-CG1 3.46Å; D594-V597 HydrophobicContact CB-CG2 4Å; D594-V597 PolarHBondContact O-N 3.16Å; V597-G599 VanDerWaalsContact C-N 3.28Å; V597-G599 PolarHBondContact O-N 3.1Å; V597-E600 PolarHBondContact O-N 2.72Å; V597-A601 WeakPolarHBondContact O-CB 3.37Å; V597-A601 PolarHBondContact O-N 2.73Å
598	N	94.9	Very high	94.1	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.016	15%	0.147	C	C	.	.	H	α-helix	trans	-60.1	-41	174.5	-70.4	-63.2	0	0	0	111.7	V588 A589 D592 D594 L595 V596 L602 F635 K638	V588-N598 PolarHBondContact O-OD1 3.3Å; A589-N598 VanDerWaalsContact C-OD1 3.22Å; A589-N598 PolarHBondContact O-OD1 3.47Å; D592-N598 PolarHBondContact N-OD1 3.14Å; D592-N598 PolarHBondContact O-ND2 3.14Å; D594-N598 PolarHBondContact O-N 3.42Å; D594-N598 VanDerWaalsContact O-N 3.14Å; D594-N598 PolarHBondContact O-ND2 2.65Å; L595-N598 PolarHBondContact O-N 2.94Å; V596-N598 PolarHBondContact O-N 3.13Å; N598-L602 WeakPolarHBondContact O-CG 3.49Å; N598-L602 PolarHBondContact O-N 3.45Å; N598-F635 HydrophobicContact CB-CD2 4.46Å; N598-F635 HydrophobicContact CB-CE2 4.12Å; N598-K638 PolarHBondContact ND2-NZ 2.96Å
599	G	94.6	Very high	94.1	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.6	-50.2	177.2	0	0	0	0	0	112.6	L595 V596 V597 A601 L602 D603 I658	L595-G599 PolarHBondContact O-N 3.42Å; V596-G599 PolarHBondContact O-N 3.06Å; V596-G599 VanDerWaalsContact O-N 3.17Å; V597-G599 VanDerWaalsContact C-N 3.28Å; V597-G599 PolarHBondContact O-N 3.1Å; G599-A601 VanDerWaalsContact C-N 3.25Å; G599-A601 PolarHBondContact O-N 2.9Å; G599-L602 WeakPolarHBondContact O-CB 3.41Å; G599-L602 PolarHBondContact O-N 2.89Å; G599-L602 VanDerWaalsContact O-N 3.1Å; G599-D603 PolarHBondContact O-N 3.32Å; G599-I658 WeakPolarHBondContact O-CD1 3.48Å
600	E	94.9	Very high	93.9	Very high	23 Å²	23	30.3 Å²	30.3	11%	0.107	16%	0.164	C	C	.	.	H	α-helix	trans	-59.4	-38.8	177.9	-170.8	67.7	-162.5	0	0	111.3	V555 V558 A559 V596 V597 L602 D603 A604	V555-E600 HydrophobicContact CG1-CB 4.32Å; V555-E600 HydrophobicContact CG1-CG 3.96Å; V558-E600 HydrophobicContact CB-CG 4.4Å; V558-E600 HydrophobicContact CG1-CB 4.24Å; V558-E600 HydrophobicContact CG1-CG 3.95Å; A559-E600 HydrophobicContact CB-CG 4.44Å; A559-E600 WeakPolarHBondContact CB-OE1 3.4Å; V596-E600 PolarHBondContact O-N 2.73Å; V597-E600 PolarHBondContact O-N 2.72Å; E600-L602 VanDerWaalsContact C-N 3.31Å; E600-L602 PolarHBondContact O-N 2.64Å; E600-D603 PolarHBondContact O-N 3.4Å; E600-A604 WeakPolarHBondContact O-CB 3.48Å; E600-A604 PolarHBondContact O-N 3.41Å
601	A	96.3	Very high	93.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.6	-34.2	177.5	0	0	0	0	0	112.9	V558 V588 A589 V597 G599 L605	V558-A601 HydrophobicContact CG1-CB 3.72Å; V588-A601 HydrophobicContact CB-CB 4.08Å; V588-A601 HydrophobicContact CG1-CB 3.86Å; A589-A601 HydrophobicContact CB-CB 3.8Å; V597-A601 WeakPolarHBondContact O-CB 3.37Å; V597-A601 PolarHBondContact O-N 2.73Å; G599-A601 VanDerWaalsContact C-N 3.25Å; G599-A601 PolarHBondContact O-N 2.9Å; A601-L605 WeakPolarHBondContact O-CG 3.38Å; A601-L605 PolarHBondContact O-N 3.16Å
602	L	97.1	Very high	93.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-69.7	-42.2	172.4	-73.2	167.6	0	0	0	111.9	A589 N598 G599 E600 L605 F606 L628 L631 F635 I658 L662	A589-L602 HydrophobicContact CB-CD2 4.12Å; A589-L602 HydrophobicContact CB-CG 4.03Å; N598-L602 WeakPolarHBondContact O-CG 3.49Å; N598-L602 PolarHBondContact O-N 3.45Å; G599-L602 WeakPolarHBondContact O-CB 3.41Å; G599-L602 PolarHBondContact O-N 2.89Å; G599-L602 VanDerWaalsContact O-N 3.1Å; E600-L602 VanDerWaalsContact C-N 3.31Å; E600-L602 PolarHBondContact O-N 2.64Å; L602-L605 HydrophobicContact CD2-CD1 4.42Å; L602-L605 WeakPolarHBondContact O-CB 3.29Å; L602-L605 PolarHBondContact O-N 2.97Å; L602-F606 HydrophobicContact CB-CE1 4.46Å; L602-F606 HydrophobicContact CB-CE2 4.24Å; L602-F606 HydrophobicContact CB-CZ 3.86Å; L602-F606 WeakPolarHBondContact O-CD1 3.42Å; L602-F606 VanDerWaalsContact O-CD2 3.31Å; L602-F606 WeakPolarHBondContact O-CD2 2.98Å; L602-F606 WeakPolarHBondContact O-CE1 3.29Å; L602-F606 WeakPolarHBondContact O-CE2 3.36Å; L602-F606 WeakPolarHBondContact O-CG 3.48Å; L602-F606 WeakPolarHBondContact O-CZ 3.33Å; L602-F606 PolarHBondContact O-N 2.97Å; L602-L628 HydrophobicContact CD2-CD2 4.04Å; L602-L631 HydrophobicContact CD2-CD2 3.81Å; L602-F635 HydrophobicContact CD1-CD1 3.98Å; L602-F635 HydrophobicContact CD1-CD2 3.78Å; L602-F635 HydrophobicContact CD1-CE1 3.96Å; L602-F635 HydrophobicContact CD1-CE2 3.78Å; L602-F635 HydrophobicContact CD1-CG 3.88Å; L602-F635 HydrophobicContact CD1-CZ 3.87Å; L602-I658 HydrophobicContact CB-CG2 3.74Å; L602-I658 HydrophobicContact CD1-CG2 4.05Å; L602-L662 HydrophobicContact CD1-CD2 4.33Å; L602-L662 HydrophobicContact CD2-CD1 4.2Å
603	D	95.5	Very high	93	Very high	18 Å²	18	30.6 Å²	30.6	10%	0.096	18%	0.175	C	C	.	.	H	α-helix	trans	-61.7	-45.4	177.2	-154.5	55.5	0	0	0	111	M1 G599 E600 L605 F606 D607 I658	M1-D603 PolarHBondContact N-OD2 3.44Å; G599-D603 PolarHBondContact O-N 3.32Å; E600-D603 PolarHBondContact O-N 3.4Å; D603-L605 VanDerWaalsContact C-N 3.33Å; D603-L605 PolarHBondContact O-N 2.87Å; D603-F606 WeakPolarHBondContact O-CA 3.4Å; D603-F606 WeakPolarHBondContact O-CB 3.27Å; D603-F606 PolarHBondContact O-N 3.21Å; D603-D607 PolarHBondContact O-N 3.43Å; D603-I658 HydrophobicContact CB-CG1 4.46Å
604	A	95.6	Very high	93.1	Very high	2 Å²	2	27.9 Å²	27.9	2%	0.017	15%	0.152	C	C	.	.	H	α-helix	trans	-58.6	-40.7	172.6	0	0	0	0	0	112.6	V558 L585 E600 F606 D607 V608	V558-A604 HydrophobicContact CG1-CB 4.24Å; L585-A604 HydrophobicContact CD1-CB 3.93Å; L585-A604 HydrophobicContact CD2-CB 3.76Å; E600-A604 WeakPolarHBondContact O-CB 3.48Å; E600-A604 PolarHBondContact O-N 3.41Å; A604-F606 VanDerWaalsContact C-N 3.29Å; A604-F606 PolarHBondContact O-N 3.23Å; A604-D607 PolarHBondContact O-N 3.25Å; A604-V608 WeakPolarHBondContact O-CB 3.44Å; A604-V608 WeakPolarHBondContact O-CG2 3.19Å; A604-V608 PolarHBondContact O-N 3.48Å
605	L	96.6	Very high	93.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-38.1	173.9	-78.3	168.3	0	0	0	111.9	L585 L586 A601 L602 D603 F609 L624 L628	L585-L605 HydrophobicContact CB-CD1 4.34Å; L585-L605 HydrophobicContact CB-CD2 3.69Å; L585-L605 HydrophobicContact CB-CG 3.74Å; L585-L605 HydrophobicContact CD1-CD2 4.02Å; L585-L605 HydrophobicContact CD1-CG 4.19Å; L586-L605 HydrophobicContact CD1-CD1 4.47Å; A601-L605 WeakPolarHBondContact O-CG 3.38Å; A601-L605 PolarHBondContact O-N 3.16Å; L602-L605 HydrophobicContact CD2-CD1 4.42Å; L602-L605 WeakPolarHBondContact O-CB 3.29Å; L602-L605 PolarHBondContact O-N 2.97Å; D603-L605 VanDerWaalsContact C-N 3.33Å; D603-L605 PolarHBondContact O-N 2.87Å; L605-F609 HydrophobicContact CD2-CD2 3.95Å; L605-F609 HydrophobicContact CD2-CE2 3.72Å; L605-F609 WeakPolarHBondContact O-CB 3.3Å; L605-F609 WeakPolarHBondContact O-CD2 3.43Å; L605-F609 PolarHBondContact O-N 3.06Å; L605-F609 VanDerWaalsContact O-N 3.14Å; L605-L624 HydrophobicContact CD2-CD1 4.27Å; L605-L628 HydrophobicContact CD1-CD2 4.27Å
606	F	94.8	Very high	93.2	Very high	16 Å²	16	31.1 Å²	31.1	7%	0.07	17%	0.167	C	C	.	.	H	α-helix	trans	-65.1	-44	177.1	-51.8	-27.3	0	0	0	110.4	L602 D603 A604 A610 I658 N661 L662 F665	L602-F606 HydrophobicContact CB-CE1 4.46Å; L602-F606 HydrophobicContact CB-CE2 4.24Å; L602-F606 HydrophobicContact CB-CZ 3.86Å; L602-F606 WeakPolarHBondContact O-CD1 3.42Å; L602-F606 VanDerWaalsContact O-CD2 3.31Å; L602-F606 WeakPolarHBondContact O-CD2 2.98Å; L602-F606 WeakPolarHBondContact O-CE1 3.29Å; L602-F606 WeakPolarHBondContact O-CE2 3.36Å; L602-F606 WeakPolarHBondContact O-CG 3.48Å; L602-F606 WeakPolarHBondContact O-CZ 3.33Å; L602-F606 PolarHBondContact O-N 2.97Å; D603-F606 WeakPolarHBondContact O-CA 3.4Å; D603-F606 WeakPolarHBondContact O-CB 3.27Å; D603-F606 PolarHBondContact O-N 3.21Å; A604-F606 VanDerWaalsContact C-N 3.29Å; A604-F606 PolarHBondContact O-N 3.23Å; F606-A610 WeakPolarHBondContact O-CA 3.45Å; F606-A610 WeakPolarHBondContact O-CB 3.44Å; F606-A610 PolarHBondContact O-N 3.26Å; F606-I658 HydrophobicContact CE2-CG2 4.17Å; F606-N661 HydrophobicContact CD2-CB 3.94Å; F606-N661 HydrophobicContact CE2-CB 3.72Å; F606-L662 HydrophobicContact CE1-CB 4.4Å; F606-L662 HydrophobicContact CE1-CD1 3.88Å; F606-L662 VanDerWaalsContact CZ-CA 3.44Å; F606-L662 HydrophobicContact CZ-CB 3.73Å; F606-L662 HydrophobicContact CZ-CD1 3.97Å; F606-L662 HydrophobicContact CZ-CG 4.44Å; F606-F665 HydrophobicContact CB-CD2 4.5Å; F606-F665 HydrophobicContact CD1-CB 3.87Å; F606-F665 AromaticContact CD1-CD1 3.55Å; F606-F665 HydrophobicContact CD1-CD1 3.55Å; F606-F665 HydrophobicContact CD1-CD2 4.24Å; F606-F665 HydrophobicContact CD1-CE1 4.15Å; F606-F665 AromaticContact CD1-CG 3.61Å; F606-F665 HydrophobicContact CD1-CG 3.61Å; F606-F665 HydrophobicContact CE1-CB 4.06Å; F606-F665 AromaticContact CE1-CD1 3.97Å; F606-F665 HydrophobicContact CE1-CD1 3.97Å; F606-F665 HydrophobicContact CE1-CG 4.17Å; F606-F665 HydrophobicContact CG-CG 4.36Å
607	D	93.3	Very high	93.2	Very high	86 Å²	86	34.1 Å²	34.1	46%	0.46	18%	0.18	S	C	.	.	H	α-helix	trans	-66.9	-42.1	-179.6	-71	-19.2	0	0	0	112.6	D603 A604	D603-D607 PolarHBondContact O-N 3.43Å; A604-D607 PolarHBondContact O-N 3.25Å
608	V	94.3	Very high	93.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-68.6	-38.3	-179.4	175	0	0	0	0	112.1	G562 L578 I581 L585 A604 A615	G562-V608 WeakPolarHBondContact O-CG2 3.15Å; L578-V608 HydrophobicContact CD2-CG1 3.92Å; I581-V608 HydrophobicContact CG2-CG2 4.37Å; L585-V608 HydrophobicContact CD1-CG2 4.2Å; A604-V608 WeakPolarHBondContact O-CB 3.44Å; A604-V608 WeakPolarHBondContact O-CG2 3.19Å; A604-V608 PolarHBondContact O-N 3.48Å; V608-A615 WeakPolarHBondContact O-CB 3.43Å
609	F	95.2	Very high	93.2	Very high	8 Å²	8	34.5 Å²	34.5	4%	0.035	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	16.6	-173.3	-62.9	-75.1	0	0	0	113.4	L605 A615 A618 A619 L622 L624 F665	L605-F609 HydrophobicContact CD2-CD2 3.95Å; L605-F609 HydrophobicContact CD2-CE2 3.72Å; L605-F609 WeakPolarHBondContact O-CB 3.3Å; L605-F609 WeakPolarHBondContact O-CD2 3.43Å; L605-F609 PolarHBondContact O-N 3.06Å; L605-F609 VanDerWaalsContact O-N 3.14Å; F609-A615 HydrophobicContact CD1-CB 4.01Å; F609-A615 VanDerWaalsContact CD1-O 3.3Å; F609-A615 WeakPolarHBondContact CD1-O 3.48Å; F609-A618 HydrophobicContact CE1-CB 3.93Å; F609-A619 HydrophobicContact CD1-CB 3.78Å; F609-A619 HydrophobicContact CE1-CB 4.14Å; F609-A619 HydrophobicContact CG-CB 4.48Å; F609-L622 HydrophobicContact CE1-CD1 4.28Å; F609-L622 HydrophobicContact CE2-CD1 4.4Å; F609-L622 HydrophobicContact CZ-CD1 3.66Å; F609-L624 HydrophobicContact CB-CD2 4.09Å; F609-L624 HydrophobicContact CD1-CD2 4.3Å; F609-L624 HydrophobicContact CD2-CD2 3.68Å; F609-L624 HydrophobicContact CE2-CD2 4.17Å; F609-L624 HydrophobicContact CG-CD2 3.76Å; F609-F665 HydrophobicContact CB-CE1 4.45Å; F609-F665 HydrophobicContact CB-CZ 3.74Å; F609-F665 WeakPolarHBondContact O-CZ 3.5Å
610	A	90.4	Very high	93	Very high	47 Å²	47	39.1 Å²	39.1	39%	0.388	20%	0.204	S	C	.	.	S	Bend	trans	-67.4	-42.6	176	0	0	0	0	0	112.1	F606 Y668	F606-A610 WeakPolarHBondContact O-CA 3.45Å; F606-A610 WeakPolarHBondContact O-CB 3.44Å; F606-A610 PolarHBondContact O-N 3.26Å; A610-Y668 PolarHBondContact O-OH 3.45Å
611	D	84.6	Confident	92.9	Very high	118 Å²	118	42.5 Å²	42.5	63%	0.631	22%	0.223	S	C	*	.	S	Bend	trans	-155.3	149.1	-168.8	-168.8	13.8	0	0	0	111.5
612	G	86.4	Confident	92.8	Very high	14 Å²	14	43.5 Å²	43.5	14%	0.144	23%	0.228	C	C	.	.			trans	114.2	135	177.7	0	0	0	0	0	115.3	E614 A615 E616	G612-E614 VanDerWaalsContact C-N 3.28Å; G612-E614 PolarHBondContact O-N 3.38Å; G612-A615 PolarHBondContact O-N 2.91Å; G612-E616 PolarHBondContact O-N 3.43Å
613	E	89.1	Confident	92.6	Very high	163 Å²	163	48.5 Å²	48.5	76%	0.762	26%	0.255	S	S	*	.	H	α-helix	trans	-58.7	-38.4	-179.3	-67.3	-174.9	170.4	0	0	112.6	E616 M617	E613-E616 PolarHBondContact O-N 3.23Å; E613-M617 WeakPolarHBondContact O-CB 3.31Å; E613-M617 PolarHBondContact O-N 3.4Å
614	E	93	Very high	92.5	Very high	35 Å²	35	47.8 Å²	47.8	16%	0.164	25%	0.251	C	S	.	.	H	α-helix	trans	-70.1	-39.5	-179.4	-63.2	-92.2	159.3	0	0	110.8	E571 G573 T574 V575 L578 G612 M617 A618	E571-E614 WeakPolarHBondContact O-CG 3.22Å; G573-E614 PolarHBondContact N-OE1 3.03Å; G573-E614 PolarHBondContact N-OE2 3.45Å; G573-E614 VanDerWaalsContact N-OE2 3.15Å; T574-E614 PolarHBondContact N-OE2 3.45Å; V575-E614 HydrophobicContact CG2-CB 4.18Å; V575-E614 HydrophobicContact CG2-CG 4.43Å; V575-E614 WeakPolarHBondContact CG2-OE2 3.46Å; V575-E614 PolarHBondContact N-OE2 3.02Å; L578-E614 HydrophobicContact CD1-CB 3.84Å; G612-E614 VanDerWaalsContact C-N 3.28Å; G612-E614 PolarHBondContact O-N 3.38Å; E614-M617 PolarHBondContact O-N 2.91Å; E614-A618 WeakPolarHBondContact O-CB 3.3Å; E614-A618 PolarHBondContact O-N 3.31Å
615	A	93.1	Very high	92.5	Very high	2 Å²	2	49 Å²	49	2%	0.017	26%	0.257	C	S	.	.	H	α-helix	trans	-66.1	-42.4	173.9	0	0	0	0	0	111.8	A569 L578 V608 F609 G612 M617 A618 A619	A569-A615 HydrophobicContact CB-CB 3.81Å; L578-A615 HydrophobicContact CD1-CB 4.37Å; V608-A615 WeakPolarHBondContact O-CB 3.43Å; F609-A615 HydrophobicContact CD1-CB 4.01Å; F609-A615 VanDerWaalsContact CD1-O 3.3Å; F609-A615 WeakPolarHBondContact CD1-O 3.48Å; G612-A615 PolarHBondContact O-N 2.91Å; A615-M617 VanDerWaalsContact C-N 3.33Å; A615-M617 PolarHBondContact O-N 3.03Å; A615-A618 PolarHBondContact O-N 3.19Å; A615-A619 VanDerWaalsContact O-CB 3.3Å; A615-A619 WeakPolarHBondContact O-CB 3.43Å; A615-A619 PolarHBondContact O-N 2.9Å
616	E	92	Very high	92.4	Very high	84 Å²	84	52.7 Å²	52.7	39%	0.393	28%	0.281	S	S	.	.	H	α-helix	trans	-60.5	-42.1	173.9	-73.7	-169.2	-174.5	0	0	112.4	G612 E613 A619 K620	G612-E616 PolarHBondContact O-N 3.43Å; E613-E616 PolarHBondContact O-N 3.23Å; E616-A619 PolarHBondContact O-N 3.42Å; E616-K620 WeakPolarHBondContact O-CG 3.48Å; E616-K620 PolarHBondContact O-N 3.44Å; E616-K620 VanDerWaalsContact O-N 3.15Å
617	M	92.4	Very high	92.5	Very high	98 Å²	98	53.2 Å²	53.2	48%	0.483	29%	0.288	S	S	.	.	H	α-helix	trans	-65.9	-44.6	177.8	-166.4	177.7	-55.3	0	0	111.2	V575 E613 E614 A615 K620 N621	V575-M617 HydrophobicContact CG1-CB 4.37Å; V575-M617 HydrophobicContact CG1-CG 4.21Å; V575-M617 HydrophobicContact CG1-SD 4.38Å; V575-M617 HydrophobicContact CG2-CB 4.12Å; V575-M617 HydrophobicContact CG2-CG 4.3Å; V575-M617 HydrophobicContact CG2-SD 3.88Å; E613-M617 WeakPolarHBondContact O-CB 3.31Å; E613-M617 PolarHBondContact O-N 3.4Å; E614-M617 PolarHBondContact O-N 2.91Å; A615-M617 VanDerWaalsContact C-N 3.33Å; A615-M617 PolarHBondContact O-N 3.03Å; M617-K620 PolarHBondContact O-N 2.87Å; M617-N621 VanDerWaalsContact O-CG 3.32Å; M617-N621 PolarHBondContact O-N 3.1Å; M617-N621 VanDerWaalsContact O-N 3.1Å
618	A	94.6	Very high	92.6	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.9	-44.1	175.1	0	0	0	0	0	112	V575 L578 Q579 F609 E614 A615 K620 N621 L622	V575-A618 HydrophobicContact CG1-CB 4.21Å; L578-A618 HydrophobicContact CB-CB 3.68Å; Q579-A618 HydrophobicContact CG-CB 3.84Å; F609-A618 HydrophobicContact CE1-CB 3.93Å; E614-A618 WeakPolarHBondContact O-CB 3.3Å; E614-A618 PolarHBondContact O-N 3.31Å; A615-A618 PolarHBondContact O-N 3.19Å; A618-K620 VanDerWaalsContact C-N 3.28Å; A618-K620 PolarHBondContact O-N 3.12Å; A618-N621 PolarHBondContact O-N 3.14Å; A618-N621 VanDerWaalsContact O-N 3.16Å; A618-L622 WeakPolarHBondContact O-CB 3.45Å; A618-L622 VanDerWaalsContact O-CG 3.25Å; A618-L622 WeakPolarHBondContact O-CG 3.4Å; A618-L622 PolarHBondContact O-N 3.43Å
619	A	93.6	Very high	92.7	Very high	11 Å²	11	53.6 Å²	53.6	9%	0.091	29%	0.286	C	S	.	.	H	α-helix	trans	-60.2	-36.5	178.1	0	0	0	0	0	112.8	F609 A615 E616 N623 L624	F609-A619 HydrophobicContact CD1-CB 3.78Å; F609-A619 HydrophobicContact CE1-CB 4.14Å; F609-A619 HydrophobicContact CG-CB 4.48Å; A615-A619 VanDerWaalsContact O-CB 3.3Å; A615-A619 WeakPolarHBondContact O-CB 3.43Å; A615-A619 PolarHBondContact O-N 2.9Å; E616-A619 PolarHBondContact O-N 3.42Å; A619-N623 PolarHBondContact O-N 2.87Å; A619-L624 HydrophobicContact CB-CB 4.21Å; A619-L624 HydrophobicContact CB-CD2 4.01Å; A619-L624 WeakPolarHBondContact O-CB 3.34Å; A619-L624 PolarHBondContact O-N 3.3Å
620	K	90.6	Very high	92.8	Very high	96 Å²	96	56.5 Å²	56.5	42%	0.417	31%	0.311	S	S	.	.	H	α-helix	trans	-66	-49.7	173.5	-71.4	166.1	-168.7	160.4	0	111	E616 M617 A618 L622 N623	E616-K620 WeakPolarHBondContact O-CG 3.48Å; E616-K620 PolarHBondContact O-N 3.44Å; E616-K620 VanDerWaalsContact O-N 3.15Å; M617-K620 PolarHBondContact O-N 2.87Å; A618-K620 VanDerWaalsContact C-N 3.28Å; A618-K620 PolarHBondContact O-N 3.12Å; K620-L622 PolarHBondContact O-N 2.73Å; K620-N623 PolarHBondContact O-N 3.29Å
621	N	92.9	Very high	93	Very high	95 Å²	95	54.7 Å²	54.7	51%	0.508	30%	0.295	S	S	.	.	H	α-helix	trans	-63.5	-31.8	-178.8	-67.1	-10.3	0	0	0	112.1	Q579 M617 A618 N623	Q579-N621 HydrophobicContact CG-CB 4.29Å; Q579-N621 VanDerWaalsContact NE2-CB 3.31Å; Q579-N621 PolarHBondContact NE2-ND2 2.72Å; M617-N621 VanDerWaalsContact O-CG 3.32Å; M617-N621 PolarHBondContact O-N 3.1Å; M617-N621 VanDerWaalsContact O-N 3.1Å; A618-N621 PolarHBondContact O-N 3.14Å; A618-N621 VanDerWaalsContact O-N 3.16Å; N621-N623 VanDerWaalsContact C-N 3.31Å; N621-N623 PolarHBondContact O-N 3.42Å
622	L	93.1	Very high	93.5	Very high	20 Å²	20	52 Å²	52	11%	0.105	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-13	174.7	-72.2	173.5	0	0	0	114.7	Q579 N583 F609 A618 K620 L624	Q579-L622 HydrophobicContact CB-CD2 4.18Å; Q579-L622 HydrophobicContact CB-CG 4.37Å; Q579-L622 HydrophobicContact CG-CD2 4.45Å; Q579-L622 HydrophobicContact CG-CG 4.2Å; Q579-L622 WeakPolarHBondContact O-CD2 3.48Å; N583-L622 HydrophobicContact CB-CD2 4.27Å; N583-L622 WeakPolarHBondContact ND2-CD2 3.48Å; N583-L622 WeakPolarHBondContact OD1-CD2 3.33Å; F609-L622 HydrophobicContact CE1-CD1 4.28Å; F609-L622 HydrophobicContact CE2-CD1 4.4Å; F609-L622 HydrophobicContact CZ-CD1 3.66Å; A618-L622 WeakPolarHBondContact O-CB 3.45Å; A618-L622 VanDerWaalsContact O-CG 3.25Å; A618-L622 WeakPolarHBondContact O-CG 3.4Å; A618-L622 PolarHBondContact O-N 3.43Å; K620-L622 PolarHBondContact O-N 2.73Å; L622-L624 HydrophobicContact CB-CB 4.41Å; L622-L624 PolarHBondContact O-N 3.09Å
623	N	93.5	Very high	94	Very high	106 Å²	106	55.1 Å²	55.1	57%	0.567	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	44.5	-165.4	-61.6	-74.6	0	0	0	112.1	A619 K620 N621 L625 P626 A627	A619-N623 PolarHBondContact O-N 2.87Å; K620-N623 PolarHBondContact O-N 3.29Å; N621-N623 VanDerWaalsContact C-N 3.31Å; N621-N623 PolarHBondContact O-N 3.42Å; N623-L625 PolarHBondContact O-N 2.98Å; N623-P626 HydrophobicContact CB-CG 4.35Å; N623-P626 VanDerWaalsContact O-CD 3.26Å; N623-P626 WeakPolarHBondContact O-CD 3.43Å; N623-A627 PolarHBondContact O-N 3Å
624	L	94.4	Very high	94.2	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-60.7	-41.7	-172.4	-176.5	61.7	0	0	0	112.6	L605 F609 A619 L622 A627 L628 F665 L669	L605-L624 HydrophobicContact CD2-CD1 4.27Å; F609-L624 HydrophobicContact CB-CD2 4.09Å; F609-L624 HydrophobicContact CD1-CD2 4.3Å; F609-L624 HydrophobicContact CD2-CD2 3.68Å; F609-L624 HydrophobicContact CE2-CD2 4.17Å; F609-L624 HydrophobicContact CG-CD2 3.76Å; A619-L624 HydrophobicContact CB-CB 4.21Å; A619-L624 HydrophobicContact CB-CD2 4.01Å; A619-L624 WeakPolarHBondContact O-CB 3.34Å; A619-L624 PolarHBondContact O-N 3.3Å; L622-L624 HydrophobicContact CB-CB 4.41Å; L622-L624 PolarHBondContact O-N 3.09Å; L624-A627 PolarHBondContact O-N 3.47Å; L624-L628 HydrophobicContact CD1-CD1 4.1Å; L624-L628 HydrophobicContact CD1-CD2 4.39Å; L624-L628 HydrophobicContact CD1-CG 3.99Å; L624-L628 HydrophobicContact CD2-CD1 4.48Å; L624-L628 HydrophobicContact CG-CD1 3.93Å; L624-L628 HydrophobicContact CG-CG 4.21Å; L624-L628 WeakPolarHBondContact O-CG 3.31Å; L624-L628 PolarHBondContact O-N 3.19Å; L624-F665 HydrophobicContact CD2-CE1 4.45Å; L624-L669 HydrophobicContact CD2-CD1 4.37Å; L624-L669 HydrophobicContact CG-CD1 4.39Å
625	L	94.6	Very high	94.2	Very high	28 Å²	28	50 Å²	50	15%	0.147	28%	0.277	C	S	.	.	H	α-helix	trans	-60.7	-52.7	-179.2	169.9	63.5	0	0	0	112.9	N623 A627 L628 K629 I666 L669 E670 V673	N623-L625 PolarHBondContact O-N 2.98Å; L625-A627 VanDerWaalsContact C-N 3.28Å; L625-A627 PolarHBondContact O-N 3.22Å; L625-L628 PolarHBondContact O-N 3.44Å; L625-K629 HydrophobicContact CD1-CD 4.31Å; L625-K629 HydrophobicContact CD1-CG 4.31Å; L625-K629 PolarHBondContact O-N 3.11Å; L625-K629 VanDerWaalsContact O-N 3.07Å; L625-I666 HydrophobicContact CD1-CG2 3.93Å; L625-L669 HydrophobicContact CB-CB 4.28Å; L625-L669 HydrophobicContact CB-CD1 4.21Å; L625-L669 HydrophobicContact CD1-CB 4.02Å; L625-E670 HydrophobicContact CD1-CG 4.03Å; L625-E670 HydrophobicContact CD2-CG 4.1Å; L625-V673 HydrophobicContact CD2-CG2 4.14Å
626	P	95.1	Very high	94.2	Very high	77 Å²	77	55.4 Å²	55.4	50%	0.5	30%	0.301	S	S	.	.	H	α-helix	trans	-53	-43.3	171.4	-28.8	32.8	0	0	0	113.8	N623 K629 A630	N623-P626 HydrophobicContact CB-CG 4.35Å; N623-P626 VanDerWaalsContact O-CD 3.26Å; N623-P626 WeakPolarHBondContact O-CD 3.43Å; P626-K629 PolarHBondContact O-N 3.03Å; P626-A630 PolarHBondContact O-N 3.42Å; P626-A630 VanDerWaalsContact O-N 3.12Å
627	A	96.3	Very high	94.2	Very high	28 Å²	28	54.1 Å²	54.1	23%	0.231	30%	0.304	C	S	.	.	H	α-helix	trans	-64.7	-46.5	-178.9	0	0	0	0	0	112.4	L586 N623 L624 L625 K629 A630 L631	L586-A627 HydrophobicContact CD1-CB 4.03Å; L586-A627 HydrophobicContact CD2-CB 3.63Å; L586-A627 HydrophobicContact CG-CB 4.44Å; N623-A627 PolarHBondContact O-N 3Å; L624-A627 PolarHBondContact O-N 3.47Å; L625-A627 VanDerWaalsContact C-N 3.28Å; L625-A627 PolarHBondContact O-N 3.22Å; A627-K629 VanDerWaalsContact C-N 3.33Å; A627-K629 PolarHBondContact O-N 3.16Å; A627-A630 WeakPolarHBondContact O-CB 3.34Å; A627-A630 PolarHBondContact O-N 3.06Å; A627-A630 VanDerWaalsContact O-N 3.17Å; A627-L631 WeakPolarHBondContact O-CB 3.49Å; A627-L631 PolarHBondContact O-N 3.14Å
628	L	96.5	Very high	94.1	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.2	-35.1	178.1	-68.1	-179.1	0	0	0	112.5	L586 L602 L605 L624 L625 A630 L631 Q632 L662 F665 I666 L669	L586-L628 HydrophobicContact CD1-CD2 4.41Å; L602-L628 HydrophobicContact CD2-CD2 4.04Å; L605-L628 HydrophobicContact CD1-CD2 4.27Å; L624-L628 HydrophobicContact CD1-CD1 4.1Å; L624-L628 HydrophobicContact CD1-CD2 4.39Å; L624-L628 HydrophobicContact CD1-CG 3.99Å; L624-L628 HydrophobicContact CD2-CD1 4.48Å; L624-L628 HydrophobicContact CG-CD1 3.93Å; L624-L628 HydrophobicContact CG-CG 4.21Å; L624-L628 WeakPolarHBondContact O-CG 3.31Å; L624-L628 PolarHBondContact O-N 3.19Å; L625-L628 PolarHBondContact O-N 3.44Å; L628-A630 VanDerWaalsContact C-N 3.33Å; L628-A630 PolarHBondContact O-N 3.34Å; L628-L631 PolarHBondContact O-N 3.3Å; L628-Q632 WeakPolarHBondContact O-CB 3.4Å; L628-Q632 PolarHBondContact O-N 3.25Å; L628-L662 HydrophobicContact CB-CD1 4.26Å; L628-L662 HydrophobicContact CD1-CD1 4.48Å; L628-L662 HydrophobicContact CD2-CD1 4.06Å; L628-F665 HydrophobicContact CD1-CD1 3.78Å; L628-F665 HydrophobicContact CD1-CE1 3.95Å; L628-I666 HydrophobicContact CB-CD1 4.18Å; L628-I666 HydrophobicContact CB-CG1 3.93Å; L628-L669 HydrophobicContact CD1-CD1 4.07Å
629	K	96.2	Very high	93.9	Very high	94 Å²	94	52.1 Å²	52.1	41%	0.409	29%	0.293	S	S	.	.	H	α-helix	trans	-62.4	-39.5	172.5	-80.2	-177	171.1	-178.6	0	112.6	L625 P626 A627 P633 I666 E670	L625-K629 HydrophobicContact CD1-CD 4.31Å; L625-K629 HydrophobicContact CD1-CG 4.31Å; L625-K629 PolarHBondContact O-N 3.11Å; L625-K629 VanDerWaalsContact O-N 3.07Å; P626-K629 PolarHBondContact O-N 3.03Å; A627-K629 VanDerWaalsContact C-N 3.33Å; A627-K629 PolarHBondContact O-N 3.16Å; K629-P633 WeakPolarHBondContact O-CD 3.46Å; K629-I666 HydrophobicContact CG-CG2 3.94Å; K629-E670 WeakPolarHBondContact CE-OE1 3.48Å; K629-E670 IonicContact NZ-OE1 3.85Å; K629-E670 PolarHBondContact NZ-OE1 3.34Å
630	A	95.8	Very high	93.7	Very high	68 Å²	68	61 Å²	61	56%	0.562	33%	0.325	S	S	*	.	H	α-helix	trans	-69.7	-37	175.8	0	0	0	0	0	111.9	P626 A627 L628 P633	P626-A630 PolarHBondContact O-N 3.42Å; P626-A630 VanDerWaalsContact O-N 3.12Å; A627-A630 WeakPolarHBondContact O-CB 3.34Å; A627-A630 PolarHBondContact O-N 3.06Å; A627-A630 VanDerWaalsContact O-N 3.17Å; L628-A630 VanDerWaalsContact C-N 3.33Å; L628-A630 PolarHBondContact O-N 3.34Å; A630-P633 WeakPolarHBondContact O-CD 3.34Å; A630-P633 WeakPolarHBondContact O-CG 3.31Å
631	L	95.6	Very high	93.5	Very high	10 Å²	10	64.7 Å²	64.7	5%	0.052	34%	0.341	C	S	.	.	H	α-helix	trans	-75.5	-35	-178.3	-176.8	58	0	0	0	113.5	L586 A589 T590 L602 A627 L628 V634 F635	L586-L631 HydrophobicContact CD1-CD2 4.48Å; A589-L631 HydrophobicContact CB-CD2 3.98Å; T590-L631 HydrophobicContact CG2-CD1 4.36Å; L602-L631 HydrophobicContact CD2-CD2 3.81Å; A627-L631 WeakPolarHBondContact O-CB 3.49Å; A627-L631 PolarHBondContact O-N 3.14Å; L628-L631 PolarHBondContact O-N 3.3Å; L631-V634 HydrophobicContact CD1-CB 4.46Å; L631-V634 WeakPolarHBondContact O-CA 3.35Å; L631-V634 WeakPolarHBondContact O-CB 3.4Å; L631-V634 PolarHBondContact O-N 2.85Å; L631-F635 PolarHBondContact O-N 2.87Å
632	Q	95.7	Very high	93.2	Very high	62 Å²	62	62.5 Å²	62.5	29%	0.29	33%	0.328	S	S	.	.	H	α-helix	trans	-49.8	-51.1	-177.2	-176	-177.1	47.1	0	0	115	L628 V634 K636 L662 I666	L628-Q632 WeakPolarHBondContact O-CB 3.4Å; L628-Q632 PolarHBondContact O-N 3.25Å; Q632-V634 VanDerWaalsContact C-N 3.31Å; Q632-V634 PolarHBondContact O-N 3Å; Q632-K636 WeakPolarHBondContact O-CB 3.42Å; Q632-K636 PolarHBondContact O-N 3.21Å; Q632-K636 VanDerWaalsContact O-N 3.13Å; Q632-L662 HydrophobicContact CB-CD2 3.99Å; Q632-L662 HydrophobicContact CB-CG 4.42Å; Q632-L662 HydrophobicContact CG-CD2 4.12Å; Q632-L662 HydrophobicContact CG-CG 4.38Å; Q632-I666 HydrophobicContact CB-CD1 3.98Å; Q632-I666 HydrophobicContact CG-CD1 4.32Å
633	P	95.2	Very high	92.2	Very high	78 Å²	78	61.8 Å²	61.8	51%	0.506	33%	0.325	S	S	.	.	H	α-helix	trans	-66.3	-33.3	177.8	25.8	-34.7	0	0	0	112.6	K629 A630 A637	K629-P633 WeakPolarHBondContact O-CD 3.46Å; A630-P633 WeakPolarHBondContact O-CD 3.34Å; A630-P633 WeakPolarHBondContact O-CG 3.31Å; P633-A637 WeakPolarHBondContact O-CB 3.36Å; P633-A637 PolarHBondContact O-N 3.45Å
634	V	93.5	Very high	91.2	Very high	85 Å²	85	68 Å²	68	52%	0.515	34%	0.34	S	S	.	.	H	α-helix	trans	-66.9	-49.7	178.7	179.8	0	0	0	0	110.5	L631 Q632 K636 A637 K638	L631-V634 HydrophobicContact CD1-CB 4.46Å; L631-V634 WeakPolarHBondContact O-CA 3.35Å; L631-V634 WeakPolarHBondContact O-CB 3.4Å; L631-V634 PolarHBondContact O-N 2.85Å; Q632-V634 VanDerWaalsContact C-N 3.31Å; Q632-V634 PolarHBondContact O-N 3Å; V634-K636 PolarHBondContact O-N 3.37Å; V634-A637 PolarHBondContact O-N 3.4Å; V634-A637 VanDerWaalsContact O-N 3.17Å; V634-K638 PolarHBondContact O-N 3.13Å
635	F	93.5	Very high	90.1	Very high	5 Å²	5	72 Å²	72	2%	0.022	38%	0.383	C	S	.	.	H	α-helix	trans	-60.9	-43.8	178.4	-173.3	-109.7	0	0	0	111.7	L595 N598 L602 L631 A637 K638 I639 L655 I658 K659 L662	L595-F635 HydrophobicContact CD1-CD2 3.98Å; L595-F635 HydrophobicContact CD1-CE2 3.58Å; L595-F635 HydrophobicContact CD1-CZ 4.34Å; N598-F635 HydrophobicContact CB-CD2 4.46Å; N598-F635 HydrophobicContact CB-CE2 4.12Å; L602-F635 HydrophobicContact CD1-CD1 3.98Å; L602-F635 HydrophobicContact CD1-CD2 3.78Å; L602-F635 HydrophobicContact CD1-CE1 3.96Å; L602-F635 HydrophobicContact CD1-CE2 3.78Å; L602-F635 HydrophobicContact CD1-CG 3.88Å; L602-F635 HydrophobicContact CD1-CZ 3.87Å; L631-F635 PolarHBondContact O-N 2.87Å; F635-A637 VanDerWaalsContact C-N 3.33Å; F635-A637 PolarHBondContact O-N 3.43Å; F635-K638 PolarHBondContact O-N 3.45Å; F635-I639 HydrophobicContact CD1-CD1 3.83Å; F635-I639 HydrophobicContact CE1-CD1 3.44Å; F635-I639 VanDerWaalsContact CE1-CD1 3.44Å; F635-I639 HydrophobicContact CE1-CG1 4.33Å; F635-I639 HydrophobicContact CZ-CD1 3.91Å; F635-I639 HydrophobicContact CZ-CG1 4.42Å; F635-I639 PolarHBondContact O-N 2.96Å; F635-L655 HydrophobicContact CZ-CD2 4.07Å; F635-I658 HydrophobicContact CE1-CG2 4.01Å; F635-I658 HydrophobicContact CZ-CG2 4.05Å; F635-K659 HydrophobicContact CE1-CB 4.26Å; F635-L662 HydrophobicContact CD1-CD2 4.48Å
636	K	93.7	Very high	89.6	Confident	116 Å²	116	76.5 Å²	76.5	50%	0.504	40%	0.401	S	S	.	.	H	α-helix	trans	-60.3	-41.2	174.9	-176	179.1	-179.8	-180	0	112.3	Q632 V634 R640	Q632-K636 WeakPolarHBondContact O-CB 3.42Å; Q632-K636 PolarHBondContact O-N 3.21Å; Q632-K636 VanDerWaalsContact O-N 3.13Å; V634-K636 PolarHBondContact O-N 3.37Å; K636-R640 WeakPolarHBondContact O-CG 3.44Å; K636-R640 PolarHBondContact O-N 3.48Å
637	A	91.8	Very high	89.1	Confident	57 Å²	57	73.9 Å²	73.9	47%	0.471	38%	0.381	S	S	.	.	H	α-helix	trans	-66.8	-39.9	176.7	0	0	0	0	0	111.6	P633 V634 F635 R640 K641	P633-A637 WeakPolarHBondContact O-CB 3.36Å; P633-A637 PolarHBondContact O-N 3.45Å; V634-A637 PolarHBondContact O-N 3.4Å; V634-A637 VanDerWaalsContact O-N 3.17Å; F635-A637 VanDerWaalsContact C-N 3.33Å; F635-A637 PolarHBondContact O-N 3.43Å; A637-R640 PolarHBondContact O-N 3.32Å; A637-K641 WeakPolarHBondContact O-CB 3.35Å; A637-K641 PolarHBondContact O-N 2.93Å
638	K	90.1	Very high	88.5	Confident	41 Å²	41	74.6 Å²	74.6	18%	0.178	38%	0.384	C	S	.	.	H	α-helix	trans	-63	-46.6	178.2	-159.1	174.7	177.2	-176.6	0	111.9	D592 S593 L595 N598 V634 F635 R640 K641 E642	D592-K638 PolarHBondContact O-NZ 3.46Å; S593-K638 PolarHBondContact O-NZ 3.23Å; L595-K638 HydrophobicContact CD1-CB 4.12Å; L595-K638 HydrophobicContact CD1-CD 3.93Å; L595-K638 HydrophobicContact CD1-CG 3.97Å; N598-K638 PolarHBondContact ND2-NZ 2.96Å; V634-K638 PolarHBondContact O-N 3.13Å; F635-K638 PolarHBondContact O-N 3.45Å; K638-R640 VanDerWaalsContact C-N 3.32Å; K638-R640 PolarHBondContact O-N 3.39Å; K638-K641 PolarHBondContact O-N 3.23Å; K638-E642 VanDerWaalsContact CE-CD 3.49Å; K638-E642 WeakPolarHBondContact CE-OE1 3.42Å; K638-E642 WeakPolarHBondContact CE-OE2 3.5Å; K638-E642 HydrophobicContact CG-CG 4.34Å; K638-E642 VanDerWaalsContact CG-OE1 3.31Å; K638-E642 WeakPolarHBondContact CG-OE1 3.37Å; K638-E642 WeakPolarHBondContact O-CB 3.41Å; K638-E642 PolarHBondContact O-N 3.23Å
639	I	90.3	Very high	87.8	Confident	15 Å²	15	79.4 Å²	79.4	8%	0.077	42%	0.415	C	S	.	.	H	α-helix	trans	-55.4	-46.3	172.6	-67.7	168.6	0	0	0	111.2	L595 F635 K641 G643 L655 K659	L595-I639 HydrophobicContact CD1-CG1 4.14Å; L595-I639 HydrophobicContact CD2-CB 4.4Å; L595-I639 HydrophobicContact CD2-CG1 3.88Å; L595-I639 HydrophobicContact CG-CG1 4.42Å; F635-I639 HydrophobicContact CD1-CD1 3.83Å; F635-I639 HydrophobicContact CE1-CD1 3.44Å; F635-I639 VanDerWaalsContact CE1-CD1 3.44Å; F635-I639 HydrophobicContact CE1-CG1 4.33Å; F635-I639 HydrophobicContact CZ-CD1 3.91Å; F635-I639 HydrophobicContact CZ-CG1 4.42Å; F635-I639 PolarHBondContact O-N 2.96Å; I639-K641 VanDerWaalsContact C-N 3.34Å; I639-K641 PolarHBondContact O-N 3.44Å; I639-G643 VanDerWaalsContact O-CA 3.23Å; I639-G643 WeakPolarHBondContact O-CA 3.35Å; I639-G643 PolarHBondContact O-N 3.32Å; I639-L655 HydrophobicContact CD1-CB 4.33Å; I639-K659 HydrophobicContact CD1-CB 4.02Å; I639-K659 HydrophobicContact CD1-CD 4.21Å; I639-K659 HydrophobicContact CD1-CG 4.44Å
640	R	88.9	Confident	87.1	Confident	197 Å²	197	79.9 Å²	79.9	74%	0.743	42%	0.419	S	S	*	.	H	α-helix	trans	-66.1	-34.9	-179.3	-71.9	-178.8	69.9	170.6	5.4	113.3	K636 A637 K638	K636-R640 WeakPolarHBondContact O-CG 3.44Å; K636-R640 PolarHBondContact O-N 3.48Å; A637-R640 PolarHBondContact O-N 3.32Å; K638-R640 VanDerWaalsContact C-N 3.32Å; K638-R640 PolarHBondContact O-N 3.39Å
641	K	87.6	Confident	86.6	Confident	175 Å²	175	80.2 Å²	80.2	76%	0.761	41%	0.409	S	S	*	.	H	α-helix	trans	-81.5	-44	-176.2	-174.5	-175.4	176.5	-170.2	0	112.2	A637 K638 I639	A637-K641 WeakPolarHBondContact O-CB 3.35Å; A637-K641 PolarHBondContact O-N 2.93Å; K638-K641 PolarHBondContact O-N 3.23Å; I639-K641 VanDerWaalsContact C-N 3.34Å; I639-K641 PolarHBondContact O-N 3.44Å
642	E	85.4	Confident	86.2	Confident	49 Å²	49	81.9 Å²	81.9	23%	0.229	42%	0.418	C	S	.	.	H	α-helix	trans	-101.7	-18.5	-171.3	-61.8	176.8	-158.1	0	0	113	K638 R644 K646 Y647	K638-E642 VanDerWaalsContact CE-CD 3.49Å; K638-E642 WeakPolarHBondContact CE-OE1 3.42Å; K638-E642 WeakPolarHBondContact CE-OE2 3.5Å; K638-E642 HydrophobicContact CG-CG 4.34Å; K638-E642 VanDerWaalsContact CG-OE1 3.31Å; K638-E642 WeakPolarHBondContact CG-OE1 3.37Å; K638-E642 WeakPolarHBondContact O-CB 3.41Å; K638-E642 PolarHBondContact O-N 3.23Å; E642-R644 PolarHBondContact O-N 3.31Å; E642-K646 WeakPolarHBondContact O-CB 3.24Å; E642-Y647 HydrophobicContact CB-CE2 4.16Å
643	G	72.6	Confident	85.8	Confident	4 Å²	4	82.4 Å²	82.4	4%	0.041	43%	0.427	C	S	.	.	H	α-helix	trans	-63.9	-36.3	-174	0	0	0	0	0	114.1	I639 G645	I639-G643 VanDerWaalsContact O-CA 3.23Å; I639-G643 WeakPolarHBondContact O-CA 3.35Å; I639-G643 PolarHBondContact O-N 3.32Å; G643-G645 PolarHBondContact O-N 3.5Å
644	R	72.2	Confident	85.5	Confident	236 Å²	236	81.8 Å²	81.8	89%	0.891	42%	0.422	S	S	*	.	H	α-helix	trans	-78.5	108.7	179.4	-68	-176.2	-178.2	-178.4	-2	110.2	E642	E642-R644 PolarHBondContact O-N 3.31Å
645	G	72.5	Confident	85.4	Confident	88 Å²	88	77.9 Å²	77.9	91%	0.907	40%	0.399	S	S	*	.	H	α-helix	trans	95.9	-13.6	169.9	0	0	0	0	0	116.3	G643	G643-G645 PolarHBondContact O-N 3.5Å
646	K	82.8	Confident	85.2	Confident	122 Å²	122	80.5 Å²	80.5	53%	0.53	41%	0.413	S	S	.	.	H	α-helix	trans	-100.3	-27.7	177.1	-167.3	-179.1	173	-157.9	0	113.9	D594 E642	D594-K646 IonicContact OD2-NZ 2.64Å; E642-K646 WeakPolarHBondContact O-CB 3.24Å
647	Y	84.8	Confident	85.1	Confident	22 Å²	22	78.8 Å²	78.8	9%	0.086	41%	0.409	C	S	.	.	S	Bend	trans	-121.1	147.9	-172.7	-63.8	-74.4	0	0	0	111.3	D594 L595 V596 E642	D594-Y647 PolarHBondContact OD2-OH 2.89Å; L595-Y647 HydrophobicContact CB-CE1 4.3Å; L595-Y647 HydrophobicContact CB-CE2 3.71Å; L595-Y647 WeakPolarHBondContact CB-OH 3.4Å; L595-Y647 HydrophobicContact CD2-CD2 4.25Å; L595-Y647 HydrophobicContact CD2-CE2 3.91Å; L595-Y647 HydrophobicContact CG-CE2 4.47Å; L595-Y647 PolarHBondContact N-OH 3.11Å; V596-Y647 HydrophobicContact CG2-CD1 3.82Å; V596-Y647 HydrophobicContact CG2-CE1 3.71Å; E642-Y647 HydrophobicContact CB-CE2 4.16Å
648	S	83.9	Confident	85.3	Confident	42 Å²	42	76.3 Å²	76.3	29%	0.294	39%	0.388	S	S	.	.			trans	-71.1	159.3	178.2	86	0	0	0	0	111.8	Q650 Q651 L652	S648-Q650 PolarHBondContact O-N 2.84Å; S648-Q650 PolarHBondContact OG-N 3.42Å; S648-Q650 PolarHBondContact OG-OE1 3.21Å; S648-Q651 PolarHBondContact O-N 3.04Å; S648-Q651 VanDerWaalsContact O-N 3.13Å; S648-Q651 PolarHBondContact OG-N 3.39Å; S648-L652 WeakPolarHBondContact O-CG 3.09Å; S648-L652 PolarHBondContact O-N 2.87Å
649	P	82.5	Confident	85.4	Confident	101 Å²	101	77.8 Å²	77.8	66%	0.656	39%	0.394	S	S	*	.	H	α-helix	trans	-53.6	-39.8	174.8	-26.7	35.6	0	0	0	113.3	L652 C653	P649-L652 PolarHBondContact O-N 3.09Å; P649-C653 PolarHBondContact O-N 3.06Å
650	Q	80.9	Confident	85.6	Confident	104 Å²	104	80.7 Å²	80.7	49%	0.486	41%	0.409	S	S	.	.	H	α-helix	trans	-65.9	-43.7	178	-59.2	83.1	1.3	0	0	111.7	S648 L652 C653 V654	S648-Q650 PolarHBondContact O-N 2.84Å; S648-Q650 PolarHBondContact OG-N 3.42Å; S648-Q650 PolarHBondContact OG-OE1 3.21Å; Q650-L652 VanDerWaalsContact C-N 3.33Å; Q650-L652 PolarHBondContact O-N 2.82Å; Q650-C653 WeakPolarHBondContact O-CB 3.46Å; Q650-C653 PolarHBondContact O-N 3.14Å; Q650-V654 WeakPolarHBondContact O-CG2 3.38Å; Q650-V654 PolarHBondContact O-N 3.2Å; Q650-V654 VanDerWaalsContact O-N 3.13Å
651	Q	85.1	Confident	85.9	Confident	76 Å²	76	74 Å²	74	36%	0.355	39%	0.388	S	S	.	.	H	α-helix	trans	-62.7	-41.4	176.3	-70.3	174.2	-35.2	0	0	111.4	V596 S648 V654 L655	V596-Q651 HydrophobicContact CG2-CG 4.48Å; S648-Q651 PolarHBondContact O-N 3.04Å; S648-Q651 VanDerWaalsContact O-N 3.13Å; S648-Q651 PolarHBondContact OG-N 3.39Å; Q651-V654 PolarHBondContact O-N 3.48Å; Q651-L655 VanDerWaalsContact O-CG 3.26Å; Q651-L655 WeakPolarHBondContact O-CG 3.45Å; Q651-L655 PolarHBondContact O-N 3.31Å
652	L	87.1	Confident	86.3	Confident	44 Å²	44	65.8 Å²	65.8	23%	0.23	35%	0.352	C	S	.	.	H	α-helix	trans	-63.7	-40.7	176.8	-69.2	175.5	0	0	0	112.2	S648 P649 Q650 V654 L655 D656	S648-L652 WeakPolarHBondContact O-CG 3.09Å; S648-L652 PolarHBondContact O-N 2.87Å; P649-L652 PolarHBondContact O-N 3.09Å; Q650-L652 VanDerWaalsContact C-N 3.33Å; Q650-L652 PolarHBondContact O-N 2.82Å; L652-V654 PolarHBondContact O-N 2.68Å; L652-L655 PolarHBondContact O-N 3.18Å; L652-D656 WeakPolarHBondContact O-CB 3.24Å; L652-D656 PolarHBondContact O-N 2.69Å
653	C	88.5	Confident	86.7	Confident	73 Å²	73	72.5 Å²	72.5	49%	0.493	38%	0.376	S	S	.	.	H	α-helix	trans	-58.4	-46.4	174.9	-177.4	0	0	0	0	111.6	P649 Q650 L655 D656 N657	P649-C653 PolarHBondContact O-N 3.06Å; Q650-C653 WeakPolarHBondContact O-CB 3.46Å; Q650-C653 PolarHBondContact O-N 3.14Å; C653-L655 PolarHBondContact O-N 3Å; C653-D656 PolarHBondContact O-N 2.72Å; C653-N657 PolarHBondContact O-N 2.92Å; C653-N657 PolarHBondContact O-ND2 2.94Å
654	V	87.7	Confident	87.8	Confident	65 Å²	65	80.7 Å²	80.7	39%	0.394	41%	0.405	S	S	.	.	H	α-helix	trans	-61.2	-46.4	176	175	0	0	0	0	111.2	Q650 Q651 L652 D656 N657 I658	Q650-V654 WeakPolarHBondContact O-CG2 3.38Å; Q650-V654 PolarHBondContact O-N 3.2Å; Q650-V654 VanDerWaalsContact O-N 3.13Å; Q651-V654 PolarHBondContact O-N 3.48Å; L652-V654 PolarHBondContact O-N 2.68Å; V654-D656 VanDerWaalsContact C-N 3.32Å; V654-D656 PolarHBondContact O-N 3.3Å; V654-N657 WeakPolarHBondContact O-CB 3.39Å; V654-N657 PolarHBondContact O-N 2.95Å; V654-I658 HydrophobicContact CG1-CD1 3.86Å; V654-I658 WeakPolarHBondContact O-CD1 3.46Å; V654-I658 WeakPolarHBondContact O-CG1 3.3Å; V654-I658 PolarHBondContact O-N 3.18Å
655	L	91.3	Very high	88.9	Confident	4 Å²	4	70.3 Å²	70.3	2%	0.021	37%	0.367	C	S	.	.	H	α-helix	trans	-64.1	-35.9	179	-70.3	169	0	0	0	112.9	L595 F635 I639 Q651 L652 C653 I658 K659	L595-L655 HydrophobicContact CB-CD1 4.47Å; L595-L655 HydrophobicContact CD2-CD1 3.71Å; L595-L655 HydrophobicContact CG-CD1 3.76Å; L595-L655 HydrophobicContact CG-CD2 4.04Å; L595-L655 WeakPolarHBondContact O-CD2 3.39Å; F635-L655 HydrophobicContact CZ-CD2 4.07Å; I639-L655 HydrophobicContact CD1-CB 4.33Å; Q651-L655 VanDerWaalsContact O-CG 3.26Å; Q651-L655 WeakPolarHBondContact O-CG 3.45Å; Q651-L655 PolarHBondContact O-N 3.31Å; L652-L655 PolarHBondContact O-N 3.18Å; C653-L655 PolarHBondContact O-N 3Å; L655-I658 HydrophobicContact CD2-CD1 4.48Å; L655-I658 PolarHBondContact O-N 3.37Å; L655-K659 WeakPolarHBondContact O-CB 3.44Å; L655-K659 PolarHBondContact O-N 2.91Å
656	D	89.9	Confident	90	Very high	59 Å²	59	66.6 Å²	66.6	32%	0.316	33%	0.326	S	S	.	.	H	α-helix	trans	-69.2	-36.8	175.6	-84.9	-24.7	0	0	0	112.2	L652 C653 V654 K659 I660	L652-D656 WeakPolarHBondContact O-CB 3.24Å; L652-D656 PolarHBondContact O-N 2.69Å; C653-D656 PolarHBondContact O-N 2.72Å; V654-D656 VanDerWaalsContact C-N 3.32Å; V654-D656 PolarHBondContact O-N 3.3Å; D656-K659 WeakPolarHBondContact O-CB 3.36Å; D656-K659 PolarHBondContact O-N 3.25Å; D656-K659 WeakPolarHBondContact OD1-CE 3.37Å; D656-K659 IonicContact OD1-NZ 2.64Å; D656-K659 PolarHBondContact OD1-NZ 3.37Å; D656-I660 WeakPolarHBondContact O-CG1 3.31Å; D656-I660 PolarHBondContact O-N 3.47Å
657	N	92.2	Very high	90.5	Very high	80 Å²	80	61.9 Å²	61.9	43%	0.428	31%	0.312	S	S	.	.	H	α-helix	trans	-61.7	-45.3	170.5	-74.2	-30.7	0	0	0	111.4	C653 V654 K659 I660 N661	C653-N657 PolarHBondContact O-N 2.92Å; C653-N657 PolarHBondContact O-ND2 2.94Å; V654-N657 WeakPolarHBondContact O-CB 3.39Å; V654-N657 PolarHBondContact O-N 2.95Å; N657-K659 VanDerWaalsContact C-N 3.31Å; N657-K659 PolarHBondContact O-N 2.98Å; N657-I660 PolarHBondContact O-N 3.16Å; N657-I660 VanDerWaalsContact O-N 3.15Å; N657-N661 WeakPolarHBondContact O-CB 3.36Å; N657-N661 PolarHBondContact O-N 3.37Å
658	I	94.2	Very high	90.8	Very high	6 Å²	6	65.2 Å²	65.2	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-60.9	-41.4	176.4	-67.5	159.1	0	0	0	110.8	G599 L602 D603 F606 F635 V654 L655 I660 N661 L662	G599-I658 WeakPolarHBondContact O-CD1 3.48Å; L602-I658 HydrophobicContact CB-CG2 3.74Å; L602-I658 HydrophobicContact CD1-CG2 4.05Å; D603-I658 HydrophobicContact CB-CG1 4.46Å; F606-I658 HydrophobicContact CE2-CG2 4.17Å; F635-I658 HydrophobicContact CE1-CG2 4.01Å; F635-I658 HydrophobicContact CZ-CG2 4.05Å; V654-I658 HydrophobicContact CG1-CD1 3.86Å; V654-I658 WeakPolarHBondContact O-CD1 3.46Å; V654-I658 WeakPolarHBondContact O-CG1 3.3Å; V654-I658 PolarHBondContact O-N 3.18Å; L655-I658 HydrophobicContact CD2-CD1 4.48Å; L655-I658 PolarHBondContact O-N 3.37Å; I658-I660 VanDerWaalsContact C-N 3.33Å; I658-I660 PolarHBondContact O-N 3.05Å; I658-N661 PolarHBondContact O-N 3.32Å; I658-L662 WeakPolarHBondContact O-CB 3.46Å; I658-L662 PolarHBondContact O-N 3.31Å
659	K	93.8	Very high	91.1	Very high	71 Å²	71	64.3 Å²	64.3	31%	0.309	32%	0.317	S	S	.	.	H	α-helix	trans	-60	-41.2	175.4	177.7	-168.7	73.1	-162.3	0	112.2	F635 I639 L655 D656 N657 R663	F635-K659 HydrophobicContact CE1-CB 4.26Å; I639-K659 HydrophobicContact CD1-CB 4.02Å; I639-K659 HydrophobicContact CD1-CD 4.21Å; I639-K659 HydrophobicContact CD1-CG 4.44Å; L655-K659 WeakPolarHBondContact O-CB 3.44Å; L655-K659 PolarHBondContact O-N 2.91Å; D656-K659 WeakPolarHBondContact O-CB 3.36Å; D656-K659 PolarHBondContact O-N 3.25Å; D656-K659 WeakPolarHBondContact OD1-CE 3.37Å; D656-K659 IonicContact OD1-NZ 2.64Å; D656-K659 PolarHBondContact OD1-NZ 3.37Å; N657-K659 VanDerWaalsContact C-N 3.31Å; N657-K659 PolarHBondContact O-N 2.98Å; K659-R663 PolarHBondContact O-N 2.98Å
660	I	93.8	Very high	91.4	Very high	76 Å²	76	62.8 Å²	62.8	39%	0.39	30%	0.301	S	S	.	.	H	α-helix	trans	-67.6	-46.4	176.1	-67.9	165.9	0	0	0	110.1	D656 N657 I658 L662 R663 R664	D656-I660 WeakPolarHBondContact O-CG1 3.31Å; D656-I660 PolarHBondContact O-N 3.47Å; N657-I660 PolarHBondContact O-N 3.16Å; N657-I660 VanDerWaalsContact O-N 3.15Å; I658-I660 VanDerWaalsContact C-N 3.33Å; I658-I660 PolarHBondContact O-N 3.05Å; I660-L662 VanDerWaalsContact C-N 3.34Å; I660-L662 PolarHBondContact O-N 2.97Å; I660-R663 WeakPolarHBondContact O-CB 3.49Å; I660-R663 PolarHBondContact O-N 3.05Å; I660-R664 PolarHBondContact O-N 3.07Å; I660-R664 VanDerWaalsContact O-N 3.13Å
661	N	94.3	Very high	91.6	Very high	57 Å²	57	64.6 Å²	64.6	31%	0.305	31%	0.308	S	S	.	.	H	α-helix	trans	-62.7	-39.4	179.7	-72.9	-11.8	0	0	0	111.9	F606 N657 I658 R663 R664 F665	F606-N661 HydrophobicContact CD2-CB 3.94Å; F606-N661 HydrophobicContact CE2-CB 3.72Å; N657-N661 WeakPolarHBondContact O-CB 3.36Å; N657-N661 PolarHBondContact O-N 3.37Å; I658-N661 PolarHBondContact O-N 3.32Å; N661-R663 VanDerWaalsContact C-N 3.3Å; N661-R663 PolarHBondContact O-N 3.47Å; N661-R664 PolarHBondContact O-N 2.71Å; N661-R664 VanDerWaalsContact O-N 3.09Å; N661-F665 VanDerWaalsContact O-CB 3.3Å; N661-F665 WeakPolarHBondContact O-CB 3.39Å; N661-F665 PolarHBondContact O-N 3.4Å
662	L	96.4	Very high	91.1	Very high	2 Å²	2	62.3 Å²	62.3	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-55.7	-44.9	174	-179.1	54.3	0	0	0	111.9	L602 F606 L628 Q632 F635 I658 I660 F665 I666	L602-L662 HydrophobicContact CD1-CD2 4.33Å; L602-L662 HydrophobicContact CD2-CD1 4.2Å; F606-L662 HydrophobicContact CE1-CB 4.4Å; F606-L662 HydrophobicContact CE1-CD1 3.88Å; F606-L662 VanDerWaalsContact CZ-CA 3.44Å; F606-L662 HydrophobicContact CZ-CB 3.73Å; F606-L662 HydrophobicContact CZ-CD1 3.97Å; F606-L662 HydrophobicContact CZ-CG 4.44Å; L628-L662 HydrophobicContact CB-CD1 4.26Å; L628-L662 HydrophobicContact CD1-CD1 4.48Å; L628-L662 HydrophobicContact CD2-CD1 4.06Å; Q632-L662 HydrophobicContact CB-CD2 3.99Å; Q632-L662 HydrophobicContact CB-CG 4.42Å; Q632-L662 HydrophobicContact CG-CD2 4.12Å; Q632-L662 HydrophobicContact CG-CG 4.38Å; F635-L662 HydrophobicContact CD1-CD2 4.48Å; I658-L662 WeakPolarHBondContact O-CB 3.46Å; I658-L662 PolarHBondContact O-N 3.31Å; I660-L662 VanDerWaalsContact C-N 3.34Å; I660-L662 PolarHBondContact O-N 2.97Å; L662-F665 PolarHBondContact O-N 3.25Å; L662-I666 HydrophobicContact CD1-CD1 4.02Å; L662-I666 HydrophobicContact CD1-CG1 4.29Å; L662-I666 HydrophobicContact CG-CD1 4.14Å; L662-I666 VanDerWaalsContact O-CG1 3.29Å; L662-I666 WeakPolarHBondContact O-CG1 3.24Å; L662-I666 PolarHBondContact O-N 2.97Å
663	R	95	Very high	90.3	Very high	191 Å²	191	63.6 Å²	63.6	72%	0.721	31%	0.314	S	S	*	.	H	α-helix	trans	-63.8	-43.5	177.4	-175.2	-177.8	179.6	-174.2	-0.1	111.5	K659 I660 N661 G667	K659-R663 PolarHBondContact O-N 2.98Å; I660-R663 WeakPolarHBondContact O-CB 3.49Å; I660-R663 PolarHBondContact O-N 3.05Å; N661-R663 VanDerWaalsContact C-N 3.3Å; N661-R663 PolarHBondContact O-N 3.47Å; R663-G667 PolarHBondContact O-N 3.16Å
664	R	94.8	Very high	89.1	Confident	175 Å²	175	66.5 Å²	66.5	66%	0.66	32%	0.318	S	S	*	.	H	α-helix	trans	-64.8	-43.9	179	-69	174.9	175.3	173	-2.2	111.1	I660 N661 G667 Y668	I660-R664 PolarHBondContact O-N 3.07Å; I660-R664 VanDerWaalsContact O-N 3.13Å; N661-R664 PolarHBondContact O-N 2.71Å; N661-R664 VanDerWaalsContact O-N 3.09Å; R664-G667 CarbonylContact O-C 3.59Å; R664-G667 WeakPolarHBondContact O-CA 3.31Å; R664-G667 PolarHBondContact O-N 2.99Å; R664-G667 VanDerWaalsContact O-N 3.15Å; R664-Y668 PolarHBondContact O-N 3.43Å
665	F	95.6	Very high	87.7	Confident	19 Å²	19	69.4 Å²	69.4	8%	0.083	33%	0.332	C	S	.	.	H	α-helix	trans	-67.1	-39.7	-178.5	-168.1	-108.1	0	0	0	112.7	F606 F609 L624 L628 N661 L662 G667 Y668 L669	F606-F665 HydrophobicContact CB-CD2 4.5Å; F606-F665 HydrophobicContact CD1-CB 3.87Å; F606-F665 AromaticContact CD1-CD1 3.55Å; F606-F665 HydrophobicContact CD1-CD1 3.55Å; F606-F665 HydrophobicContact CD1-CD2 4.24Å; F606-F665 HydrophobicContact CD1-CE1 4.15Å; F606-F665 AromaticContact CD1-CG 3.61Å; F606-F665 HydrophobicContact CD1-CG 3.61Å; F606-F665 HydrophobicContact CE1-CB 4.06Å; F606-F665 AromaticContact CE1-CD1 3.97Å; F606-F665 HydrophobicContact CE1-CD1 3.97Å; F606-F665 HydrophobicContact CE1-CG 4.17Å; F606-F665 HydrophobicContact CG-CG 4.36Å; F609-F665 HydrophobicContact CB-CE1 4.45Å; F609-F665 HydrophobicContact CB-CZ 3.74Å; F609-F665 WeakPolarHBondContact O-CZ 3.5Å; L624-F665 HydrophobicContact CD2-CE1 4.45Å; L628-F665 HydrophobicContact CD1-CD1 3.78Å; L628-F665 HydrophobicContact CD1-CE1 3.95Å; N661-F665 VanDerWaalsContact O-CB 3.3Å; N661-F665 WeakPolarHBondContact O-CB 3.39Å; N661-F665 PolarHBondContact O-N 3.4Å; L662-F665 PolarHBondContact O-N 3.25Å; F665-G667 VanDerWaalsContact C-N 3.29Å; F665-G667 PolarHBondContact O-N 3.32Å; F665-Y668 AromaticContact CD2-CD1 3.99Å; F665-Y668 HydrophobicContact CD2-CD1 3.99Å; F665-Y668 AromaticContact CE2-CD1 3.75Å; F665-Y668 HydrophobicContact CE2-CD1 3.75Å; F665-Y668 HydrophobicContact CE2-CE1 4.09Å; F665-Y668 HydrophobicContact CZ-CD1 4.45Å; F665-Y668 WeakPolarHBondContact O-CB 3.3Å; F665-Y668 PolarHBondContact O-N 2.78Å; F665-Y668 VanDerWaalsContact O-N 3.13Å; F665-L669 HydrophobicContact CD1-CD1 4.07Å; F665-L669 HydrophobicContact CD1-CG 4.38Å; F665-L669 HydrophobicContact CE1-CD1 3.69Å; F665-L669 HydrophobicContact CE1-CD2 4.38Å; F665-L669 HydrophobicContact CE1-CG 4.03Å; F665-L669 HydrophobicContact CZ-CD1 4.35Å; F665-L669 HydrophobicContact CZ-CD2 4.22Å; F665-L669 HydrophobicContact CZ-CG 4.27Å; F665-L669 PolarHBondContact O-N 3.44Å
666	I	95.1	Very high	85.9	Confident	9 Å²	9	74.2 Å²	74.2	5%	0.046	36%	0.356	C	S	.	.	H	α-helix	trans	-57.8	-44.9	170.2	-71.3	166.8	0	0	0	110.6	L625 L628 K629 Q632 L662 Y668 L669 E670	L625-I666 HydrophobicContact CD1-CG2 3.93Å; L628-I666 HydrophobicContact CB-CD1 4.18Å; L628-I666 HydrophobicContact CB-CG1 3.93Å; K629-I666 HydrophobicContact CG-CG2 3.94Å; Q632-I666 HydrophobicContact CB-CD1 3.98Å; Q632-I666 HydrophobicContact CG-CD1 4.32Å; L662-I666 HydrophobicContact CD1-CD1 4.02Å; L662-I666 HydrophobicContact CD1-CG1 4.29Å; L662-I666 HydrophobicContact CG-CD1 4.14Å; L662-I666 VanDerWaalsContact O-CG1 3.29Å; L662-I666 WeakPolarHBondContact O-CG1 3.24Å; L662-I666 PolarHBondContact O-N 2.97Å; I666-Y668 VanDerWaalsContact C-N 3.3Å; I666-Y668 PolarHBondContact O-N 3.37Å; I666-L669 PolarHBondContact O-N 3.08Å; I666-E670 WeakPolarHBondContact O-CG 3.46Å; I666-E670 PolarHBondContact O-N 2.84Å
667	G	92.9	Very high	84	Confident	24 Å²	24	76.8 Å²	76.8	25%	0.247	37%	0.374	C	S	.	.	H	α-helix	trans	-64.3	-32.2	176.8	0	0	0	0	0	113.6	R663 R664 F665 K671	R663-G667 PolarHBondContact O-N 3.16Å; R664-G667 CarbonylContact O-C 3.59Å; R664-G667 WeakPolarHBondContact O-CA 3.31Å; R664-G667 PolarHBondContact O-N 2.99Å; R664-G667 VanDerWaalsContact O-N 3.15Å; F665-G667 VanDerWaalsContact C-N 3.29Å; F665-G667 PolarHBondContact O-N 3.32Å; G667-K671 WeakPolarHBondContact O-CG 3.26Å; G667-K671 PolarHBondContact O-N 2.94Å
668	Y	91.7	Very high	81.5	Confident	92 Å²	92	80.1 Å²	80.1	36%	0.361	40%	0.404	S	S	.	.	H	α-helix	trans	-64.5	-52.3	172.4	165.5	-108.2	0	0	0	111.5	A610 R664 F665 I666 E670 K671 G672	A610-Y668 PolarHBondContact O-OH 3.45Å; R664-Y668 PolarHBondContact O-N 3.43Å; F665-Y668 AromaticContact CD2-CD1 3.99Å; F665-Y668 HydrophobicContact CD2-CD1 3.99Å; F665-Y668 AromaticContact CE2-CD1 3.75Å; F665-Y668 HydrophobicContact CE2-CD1 3.75Å; F665-Y668 HydrophobicContact CE2-CE1 4.09Å; F665-Y668 HydrophobicContact CZ-CD1 4.45Å; F665-Y668 WeakPolarHBondContact O-CB 3.3Å; F665-Y668 PolarHBondContact O-N 2.78Å; F665-Y668 VanDerWaalsContact O-N 3.13Å; I666-Y668 VanDerWaalsContact C-N 3.3Å; I666-Y668 PolarHBondContact O-N 3.37Å; Y668-E670 VanDerWaalsContact C-N 3.28Å; Y668-E670 PolarHBondContact O-N 3.04Å; Y668-K671 WeakPolarHBondContact O-CB 3.47Å; Y668-K671 PolarHBondContact O-N 3.47Å; Y668-G672 PolarHBondContact O-N 3.31Å; Y668-G672 VanDerWaalsContact O-N 3.14Å
669	L	89.4	Confident	80.9	Confident	23 Å²	23	83.8 Å²	83.8	12%	0.12	42%	0.423	C	S	.	.	H	α-helix	trans	-59.9	-37	178.6	-68.9	178	0	0	0	112.6	L624 L625 L628 F665 I666 K671 G672 V673	L624-L669 HydrophobicContact CD2-CD1 4.37Å; L624-L669 HydrophobicContact CG-CD1 4.39Å; L625-L669 HydrophobicContact CB-CB 4.28Å; L625-L669 HydrophobicContact CB-CD1 4.21Å; L625-L669 HydrophobicContact CD1-CB 4.02Å; L628-L669 HydrophobicContact CD1-CD1 4.07Å; F665-L669 HydrophobicContact CD1-CD1 4.07Å; F665-L669 HydrophobicContact CD1-CG 4.38Å; F665-L669 HydrophobicContact CE1-CD1 3.69Å; F665-L669 HydrophobicContact CE1-CD2 4.38Å; F665-L669 HydrophobicContact CE1-CG 4.03Å; F665-L669 HydrophobicContact CZ-CD1 4.35Å; F665-L669 HydrophobicContact CZ-CD2 4.22Å; F665-L669 HydrophobicContact CZ-CG 4.27Å; F665-L669 PolarHBondContact O-N 3.44Å; I666-L669 PolarHBondContact O-N 3.08Å; L669-K671 VanDerWaalsContact C-N 3.32Å; L669-K671 PolarHBondContact O-N 3.33Å; L669-G672 PolarHBondContact O-N 2.98Å; L669-V673 WeakPolarHBondContact O-CG2 3.18Å; L669-V673 PolarHBondContact O-N 2.94Å; L669-V673 VanDerWaalsContact O-N 3.08Å
670	E	90.5	Very high	80.2	Confident	68 Å²	68	84.5 Å²	84.5	32%	0.318	43%	0.429	S	S	.	.	H	α-helix	trans	-61.6	-37.2	175.1	-75.5	-178.4	158.4	0	0	113.3	L625 K629 I666 Y668 K674	L625-E670 HydrophobicContact CD1-CG 4.03Å; L625-E670 HydrophobicContact CD2-CG 4.1Å; K629-E670 WeakPolarHBondContact CE-OE1 3.48Å; K629-E670 IonicContact NZ-OE1 3.85Å; K629-E670 PolarHBondContact NZ-OE1 3.34Å; I666-E670 WeakPolarHBondContact O-CG 3.46Å; I666-E670 PolarHBondContact O-N 2.84Å; Y668-E670 VanDerWaalsContact C-N 3.28Å; Y668-E670 PolarHBondContact O-N 3.04Å; E670-K674 WeakPolarHBondContact O-CG 3.29Å; E670-K674 PolarHBondContact O-N 3.44Å
671	K	85.1	Confident	79.4	Confident	143 Å²	143	84.9 Å²	84.9	62%	0.622	43%	0.431	S	S	*	.	H	α-helix	trans	-69.2	-41.8	175.9	-70.5	175.7	-178.9	-179.3	0	110.9	G667 Y668 L669 V673 K674 N675	G667-K671 WeakPolarHBondContact O-CG 3.26Å; G667-K671 PolarHBondContact O-N 2.94Å; Y668-K671 WeakPolarHBondContact O-CB 3.47Å; Y668-K671 PolarHBondContact O-N 3.47Å; L669-K671 VanDerWaalsContact C-N 3.32Å; L669-K671 PolarHBondContact O-N 3.33Å; K671-V673 PolarHBondContact O-N 3Å; K671-K674 PolarHBondContact O-N 3.15Å; K671-N675 PolarHBondContact O-N 3.33Å; K671-N675 VanDerWaalsContact O-N 3.1Å
672	G	74.4	Confident	78.5	Confident	28 Å²	28	86.6 Å²	86.6	29%	0.289	44%	0.438	S	S	.	.	H	α-helix	trans	-56.3	-47.8	175.6	0	0	0	0	0	112.4	Y668 L669 K674 N675 L676	Y668-G672 PolarHBondContact O-N 3.31Å; Y668-G672 VanDerWaalsContact O-N 3.14Å; L669-G672 PolarHBondContact O-N 2.98Å; G672-K674 VanDerWaalsContact C-N 3.32Å; G672-K674 PolarHBondContact O-N 3.04Å; G672-N675 PolarHBondContact O-N 2.79Å; G672-L676 WeakPolarHBondContact O-CD1 3.37Å; G672-L676 PolarHBondContact O-N 3.27Å
673	V	69.9	Low	77.4	Confident	71 Å²	71	91.9 Å²	91.9	43%	0.43	47%	0.465	S	S	.	.	H	α-helix	trans	-62.3	-36.8	178.2	175.7	0	0	0	0	112.6	L625 L669 K671 T677	L625-V673 HydrophobicContact CD2-CG2 4.14Å; L669-V673 WeakPolarHBondContact O-CG2 3.18Å; L669-V673 PolarHBondContact O-N 2.94Å; L669-V673 VanDerWaalsContact O-N 3.08Å; K671-V673 PolarHBondContact O-N 3Å; V673-T677 PolarHBondContact O-N 3.49Å; V673-T677 PolarHBondContact O-OG1 3.06Å
674	K	62.9	Low	76.3	Confident	134 Å²	134	85.3 Å²	85.3	58%	0.583	45%	0.448	S	S	*	.	H	α-helix	trans	-70.5	-35.5	179.2	-74.4	176.3	-178.4	178.1	0	113.4	E670 K671 G672 L676 T677 S678	E670-K674 WeakPolarHBondContact O-CG 3.29Å; E670-K674 PolarHBondContact O-N 3.44Å; K671-K674 PolarHBondContact O-N 3.15Å; G672-K674 VanDerWaalsContact C-N 3.32Å; G672-K674 PolarHBondContact O-N 3.04Å; K674-L676 VanDerWaalsContact C-N 3.25Å; K674-L676 PolarHBondContact O-N 3.05Å; K674-T677 WeakPolarHBondContact CA-OG1 3.47Å; K674-T677 PolarHBondContact O-N 3.18Å; K674-T677 PolarHBondContact O-OG1 2.93Å; K674-S678 PolarHBondContact O-N 3.12Å; K674-S678 PolarHBondContact O-OG 2.98Å
675	N	59.4	Low	74.9	Confident	126 Å²	126	78.9 Å²	78.9	67%	0.674	43%	0.433	S	S	*	.	H	α-helix	trans	-72.5	-16.7	179.6	-70	-9.8	0	0	0	113.7	K671 G672	K671-N675 PolarHBondContact O-N 3.33Å; K671-N675 VanDerWaalsContact O-N 3.1Å; G672-N675 PolarHBondContact O-N 2.79Å
676	L	52.3	Low	73.3	Confident	104 Å²	104	83.5 Å²	83.5	55%	0.545	46%	0.46	S	S	.	.	H	α-helix	trans	-97.8	-16.2	177.5	-79.6	150.2	0	0	0	113.6	G672 K674	G672-L676 WeakPolarHBondContact O-CD1 3.37Å; G672-L676 PolarHBondContact O-N 3.27Å; K674-L676 VanDerWaalsContact C-N 3.25Å; K674-L676 PolarHBondContact O-N 3.05Å
677	T	50.6	Low	71.5	Confident	113 Å²	113	89.7 Å²	89.7	69%	0.693	49%	0.494	S	S	*	.	H	α-helix	trans	-101.3	-3.9	178.2	44.7	0	0	0	0	112.8	V673 K674	V673-T677 PolarHBondContact O-N 3.49Å; V673-T677 PolarHBondContact O-OG1 3.06Å; K674-T677 WeakPolarHBondContact CA-OG1 3.47Å; K674-T677 PolarHBondContact O-N 3.18Å; K674-T677 PolarHBondContact O-OG1 2.93Å
678	S	39.3	Very low	69.6	Low	150 Å²	150	95.6 Å²	95.6	100%	1.049	52%	0.517	S	S	*	.			trans	-101.3	0	167.4	-50.5	0	0	0	0	108.8	K674	K674-S678 PolarHBondContact O-N 3.12Å; K674-S678 PolarHBondContact O-OG 2.98Å

Retrieved 678 of 678 residues in 153.1 ms (Link to these results)

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