A0A2K5LYV2_CERAT Loading...

Protein-serine/threonine kinase

AlphaFold DB , UniProt , Accession A0A2K5LYV2, Species CERAT (Cercocebus atys, Sooty mangabey), Gene BCKDK, Length 412 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	29.5	Very low	31.4	Very low	231 Å²	231	130.4 Å²	130.4	100%	1.138	82%	0.824	S	S	*	*				0	115.9	0	-165.7	175.5	-168.5	0	0	107.1
2	I	27.9	Very low	31.6	Very low	159 Å²	159	141.2 Å²	141.2	82%	0.815	84%	0.837	S	S	*	*			trans	64.6	135	161.7	-62	174.9	0	0	0	119.5
3	L	27.4	Very low	31.5	Very low	165 Å²	165	136.8 Å²	136.8	86%	0.864	84%	0.84	S	S	*	*			trans	-85.7	166.8	172.1	-66.6	79.3	0	0	0	112
4	A	30.4	Very low	31.4	Very low	94 Å²	94	132.5 Å²	132.5	78%	0.777	84%	0.836	S	S	*	*			trans	176	152	136.5	0	0	0	0	0	108.8
5	S	31.5	Very low	32	Very low	103 Å²	103	132.1 Å²	132.1	72%	0.72	84%	0.835	S	S	*	*			cis	170.2	-162.7	-2	57.5	0	0	0	0	106.2
6	V	32.1	Very low	32.9	Very low	127 Å²	127	130.8 Å²	130.8	77%	0.77	83%	0.828	S	S	*	*			trans	72.6	135.8	172.9	171.2	0	0	0	0	114.5
7	L	31.6	Very low	32.9	Very low	165 Å²	165	133.2 Å²	133.2	86%	0.864	83%	0.832	S	S	*	*			cis	-151.6	178.3	-21.6	-103.7	177.5	0	0	0	105.7
8	G	26.7	Very low	32.9	Very low	67 Å²	67	137.3 Å²	137.3	69%	0.691	83%	0.829	S	S	*	*			cis	128	110	6.9	0	0	0	0	0	110.7
9	S	29.9	Very low	32.9	Very low	132 Å²	132	137.1 Å²	137.1	92%	0.923	83%	0.831	S	S	*	*			trans	-109.6	166.3	-165.4	53.3	0	0	0	0	115.1
10	G	31.6	Very low	32.9	Very low	68 Å²	68	137.1 Å²	137.1	70%	0.701	83%	0.826	S	S	*	*			trans	-178.7	170.1	170.8	0	0	0	0	0	114.3
11	P	46.5	Very low	32.8	Very low	123 Å²	123	139.3 Å²	139.3	80%	0.799	83%	0.832	S	S	*	*				-139.1	151.1	-67.7	37.1	-23.5	0	0	0	117.4
12	R	33.5	Very low	32.9	Very low	260 Å²	260	131.6 Å²	131.6	98%	0.981	81%	0.812	S	S	*	*			trans	52.6	120.7	138	-66.5	-175	172.7	-164.8	-1.9	124.4
13	G	31.1	Very low	33.5	Very low	85 Å²	85	130 Å²	130	88%	0.876	81%	0.812	S	S	*	*			trans	178.5	152.3	145.1	0	0	0	0	0	109.4
14	G	30.3	Very low	33.7	Very low	76 Å²	76	129 Å²	129	78%	0.784	81%	0.813	S	S	*	*			cis	-163.5	170.2	-10.6	0	0	0	0	0	110.3
15	P	40	Very low	34	Very low	127 Å²	127	132.6 Å²	132.6	83%	0.825	82%	0.818	S	S	*	*			trans	-116.2	-172.3	-168.8	42.6	-32.2	0	0	0	114.2
16	P	46.9	Very low	34	Very low	110 Å²	110	132.4 Å²	132.4	71%	0.714	82%	0.822	S	S	*	*			cis	-132.3	174.5	-44.9	33.8	-16.6	0	0	0	113.4
17	L	32.1	Very low	34	Very low	173 Å²	173	133.9 Å²	133.9	91%	0.906	83%	0.825	S	S	*	*				165	148.4	127.8	-87.2	159.5	0	0	0	112.1
18	R	33.6	Very low	34.1	Very low	206 Å²	206	137.8 Å²	137.8	78%	0.777	83%	0.829	S	S	*	*			trans	-102.9	167.1	-176.2	-81	-179.2	165.2	-174.2	-4.3	112.1
19	P	32.6	Very low	34.4	Very low	134 Å²	134	138.6 Å²	138.6	87%	0.87	83%	0.829	S	S	*	*				-132.3	169.5	108.3	19.8	-0.8	0	0	0	114.8
20	L	33.6	Very low	34.8	Very low	137 Å²	137	144.1 Å²	144.1	72%	0.717	83%	0.829	S	S	*	*			trans	-106.6	140	178	-88.3	150.2	0	0	0	110.6
21	L	31	Very low	35	Very low	183 Å²	183	145.7 Å²	145.7	96%	0.958	83%	0.829	S	S	*	*			trans	-171.3	134.6	147.7	-99	143.9	0	0	0	108.4
22	G	30.4	Very low	34.8	Very low	70 Å²	70	143.7 Å²	143.7	72%	0.722	82%	0.815	S	S	*	*			trans	-104.2	-148.5	179	0	0	0	0	0	112
23	P	40.4	Very low	35.3	Very low	125 Å²	125	136.4 Å²	136.4	81%	0.812	80%	0.804	S	S	*	*			cis	-131	158.6	-17.2	39.3	-24.8	0	0	0	113.4
24	T	30.9	Very low	35.8	Very low	143 Å²	143	135.5 Å²	135.5	88%	0.877	79%	0.788	S	S	*	*			trans	-138.5	126.5	159.2	42.5	0	0	0	0	111.6
25	L	37.1	Very low	36.3	Very low	171 Å²	171	134.8 Å²	134.8	90%	0.895	77%	0.769	S	S	*	*			trans	-74	121.8	172.4	-80.2	122.1	0	0	0	110
26	A	32.8	Very low	36.6	Very low	98 Å²	98	133.9 Å²	133.9	81%	0.81	76%	0.757	S	S	*	*			trans	-110.8	108.1	162.3	0	0	0	0	0	108.9	R28	A26-R28 PolarHBondContact O-N 3.27Å
27	L	31.2	Very low	36.4	Very low	158 Å²	158	132.3 Å²	132.3	83%	0.827	75%	0.746	S	S	*	*			trans	-57.5	123.1	174.7	-105.4	72.6	0	0	0	110.1	A29	L27-A29 VanDerWaalsContact C-N 3.27Å; L27-A29 PolarHBondContact O-N 3.18Å
28	R	33.1	Very low	37	Very low	248 Å²	248	129.8 Å²	129.8	94%	0.936	73%	0.729	S	S	*	*			trans	-82.8	74.2	171.6	-158.6	177.7	-165.4	-179.8	5.5	109.9	A26 R30	A26-R28 PolarHBondContact O-N 3.27Å; R28-R30 PolarHBondContact O-N 3.32Å
29	A	33.5	Very low	37.5	Very low	84 Å²	84	125.8 Å²	125.8	69%	0.694	72%	0.719	S	S	*	*			trans	-64	116.3	175.9	0	0	0	0	0	110.7	L27	L27-A29 VanDerWaalsContact C-N 3.27Å; L27-A29 PolarHBondContact O-N 3.18Å
30	R	38.4	Very low	38.4	Very low	247 Å²	247	124.1 Å²	124.1	93%	0.932	71%	0.706	S	S	*	*			trans	-88.7	106.7	163.8	-83.7	-178.5	166.6	179.8	-4.3	108.4	R28	R28-R30 PolarHBondContact O-N 3.32Å
31	S	35.6	Very low	38.9	Very low	101 Å²	101	122.9 Å²	122.9	71%	0.706	70%	0.696	S	S	*	*			trans	-126.8	149.4	165.9	-72.5	0	0	0	0	108.5
32	T	41.8	Very low	39.2	Very low	82 Å²	82	118.1 Å²	118.1	50%	0.503	67%	0.67	S	S	.	*			cis	-163.7	99.3	-11.2	21.5	0	0	0	0	105.5	T35	T32-T35 WeakPolarHBondContact CB-OG1 3.22Å; T32-T35 HydrophobicContact CG2-CG2 4.31Å
33	S	44.4	Very low	39.8	Very low	107 Å²	107	117.1 Å²	117.1	75%	0.748	66%	0.655	S	S	*	*	H	α-helix	trans	-89.3	-10.3	178.6	92.2	0	0	0	0	114	T37	S33-T37 PolarHBondContact O-OG1 3.23Å
34	A	41.5	Very low	40.2	Very low	65 Å²	65	119.4 Å²	119.4	54%	0.537	65%	0.648	S	S	.	*	H	α-helix	trans	-88.1	-24.2	-177.1	0	0	0	0	0	113.6	T37 H38	A34-T37 WeakPolarHBondContact CA-OG1 3.19Å; A34-T37 PolarHBondContact O-OG1 2.58Å; A34-H38 PolarHBondContact O-N 3Å
35	T	41.9	Very low	40.8	Very low	62 Å²	62	118.1 Å²	118.1	38%	0.38	63%	0.632	S	S	.	*	H	α-helix	trans	-76.9	-40.1	176	49.9	0	0	0	0	111.3	T32 H38 H39	T32-T35 WeakPolarHBondContact CB-OG1 3.22Å; T32-T35 HydrophobicContact CG2-CG2 4.31Å; T35-H38 PolarHBondContact O-N 2.76Å; T35-H39 WeakPolarHBondContact O-CB 3.34Å; T35-H39 PolarHBondContact O-CD2 2.93Å; T35-H39 PolarHBondContact O-N 2.88Å
36	D	45.3	Very low	41	Very low	107 Å²	107	118.4 Å²	118.4	57%	0.572	62%	0.621	S	S	*	*	H	α-helix	trans	-65.1	-40.1	178.2	-74.3	-15.7	0	0	0	111.7	H39 V40	D36-H39 PolarHBondContact O-N 2.89Å; D36-V40 WeakPolarHBondContact O-CB 3.32Å; D36-V40 VanDerWaalsContact O-CG2 3.29Å; D36-V40 WeakPolarHBondContact O-CG2 3.48Å; D36-V40 PolarHBondContact O-N 3.06Å
37	T	44.5	Very low	41.5	Very low	78 Å²	78	117.3 Å²	117.3	48%	0.479	61%	0.608	S	S	.	*	H	α-helix	trans	-61.3	-44.7	172.2	46.1	0	0	0	0	111.7	S33 A34 H39 V40 E41	S33-T37 PolarHBondContact O-OG1 3.23Å; A34-T37 WeakPolarHBondContact CA-OG1 3.19Å; A34-T37 PolarHBondContact O-OG1 2.58Å; T37-H39 PolarHBondContact O-N 3.05Å; T37-V40 PolarHBondContact O-N 3.23Å; T37-E41 WeakPolarHBondContact O-CB 3.41Å; T37-E41 WeakPolarHBondContact O-CG 3.41Å; T37-E41 PolarHBondContact O-N 2.85Å
38	H	44.3	Very low	42.4	Very low	119 Å²	119	116 Å²	116	55%	0.551	60%	0.595	S	S	*	*	H	α-helix	trans	-64.4	-37.2	176.3	-103.2	-60.9	0	0	0	113.3	A34 T35 M42	A34-H38 PolarHBondContact O-N 3Å; T35-H38 PolarHBondContact O-N 2.76Å; H38-M42 WeakPolarHBondContact O-CB 3.44Å; H38-M42 PolarHBondContact O-N 2.68Å
39	H	44.1	Very low	43.2	Very low	123 Å²	123	109 Å²	109	57%	0.569	58%	0.58	S	S	*	*	H	α-helix	trans	-69.5	-38.6	175.8	-82.5	-67.3	0	0	0	111.9	T35 D36 T37 A43	T35-H39 WeakPolarHBondContact O-CB 3.34Å; T35-H39 PolarHBondContact O-CD2 2.93Å; T35-H39 PolarHBondContact O-N 2.88Å; D36-H39 PolarHBondContact O-N 2.89Å; T37-H39 PolarHBondContact O-N 3.05Å; H39-A43 WeakPolarHBondContact O-CB 3.5Å; H39-A43 PolarHBondContact O-N 2.71Å
40	V	51	Low	43.7	Very low	98 Å²	98	108.8 Å²	108.8	59%	0.594	57%	0.57	S	S	*	*	H	α-helix	trans	-68.2	-40.2	174.2	171	0	0	0	0	111.4	D36 T37 A43 R44	D36-V40 WeakPolarHBondContact O-CB 3.32Å; D36-V40 VanDerWaalsContact O-CG2 3.29Å; D36-V40 WeakPolarHBondContact O-CG2 3.48Å; D36-V40 PolarHBondContact O-N 3.06Å; T37-V40 PolarHBondContact O-N 3.23Å; V40-A43 PolarHBondContact O-N 3.07Å; V40-R44 WeakPolarHBondContact O-CB 3.42Å; V40-R44 PolarHBondContact O-N 3.47Å
41	E	43.7	Very low	44.4	Very low	111 Å²	111	100.4 Å²	100.4	52%	0.519	55%	0.546	S	S	.	.	H	α-helix	trans	-65	-50.4	174.2	-76.5	-177.4	143.8	0	0	111.6	T37 A43 R44 E45	T37-E41 WeakPolarHBondContact O-CB 3.41Å; T37-E41 WeakPolarHBondContact O-CG 3.41Å; T37-E41 PolarHBondContact O-N 2.85Å; E41-A43 VanDerWaalsContact C-N 3.3Å; E41-A43 PolarHBondContact O-N 3.41Å; E41-R44 CarbonylContact O-C 3.5Å; E41-R44 WeakPolarHBondContact O-CB 3.44Å; E41-R44 PolarHBondContact O-N 3.14Å; E41-R44 VanDerWaalsContact O-N 3.13Å; E41-E45 WeakPolarHBondContact O-CB 3.36Å; E41-E45 WeakPolarHBondContact O-CG 3.43Å; E41-E45 PolarHBondContact O-N 2.81Å
42	M	38.4	Very low	45.3	Very low	83 Å²	83	98.7 Å²	98.7	41%	0.409	53%	0.534	S	S	.	.	H	α-helix	trans	-64	-32.4	176	-77.9	-150.7	-68.2	0	0	113	H38 R46	H38-M42 WeakPolarHBondContact O-CB 3.44Å; H38-M42 PolarHBondContact O-N 2.68Å; M42-R46 VanDerWaalsContact O-CB 3.27Å; M42-R46 WeakPolarHBondContact O-CB 3.39Å; M42-R46 WeakPolarHBondContact O-CG 3.31Å; M42-R46 PolarHBondContact O-N 2.78Å
43	A	42.8	Very low	45.6	Very low	50 Å²	50	102.2 Å²	102.2	41%	0.413	54%	0.543	S	S	.	.	H	α-helix	trans	-67.4	-43	172.5	0	0	0	0	0	111.2	H39 V40 E41 R46 S47	H39-A43 WeakPolarHBondContact O-CB 3.5Å; H39-A43 PolarHBondContact O-N 2.71Å; V40-A43 PolarHBondContact O-N 3.07Å; E41-A43 VanDerWaalsContact C-N 3.3Å; E41-A43 PolarHBondContact O-N 3.41Å; A43-R46 PolarHBondContact O-N 3.27Å; A43-S47 WeakPolarHBondContact O-CB 3.48Å; A43-S47 PolarHBondContact O-N 3.07Å; A43-S47 PolarHBondContact O-OG 3.07Å
44	R	48.9	Very low	46	Very low	173 Å²	173	104.9 Å²	104.9	65%	0.653	54%	0.538	S	S	*	.	H	α-helix	trans	-66.4	-36.3	176.3	176.9	172.7	159.1	128.5	-7.8	112.3	V40 E41 K48	V40-R44 WeakPolarHBondContact O-CB 3.42Å; V40-R44 PolarHBondContact O-N 3.47Å; E41-R44 CarbonylContact O-C 3.5Å; E41-R44 WeakPolarHBondContact O-CB 3.44Å; E41-R44 PolarHBondContact O-N 3.14Å; E41-R44 VanDerWaalsContact O-N 3.13Å; R44-K48 WeakPolarHBondContact O-CB 3.42Å; R44-K48 VanDerWaalsContact O-CG 3.27Å; R44-K48 WeakPolarHBondContact O-CG 3.44Å; R44-K48 PolarHBondContact O-N 3.21Å
45	E	43.2	Very low	46.9	Very low	115 Å²	115	102.9 Å²	102.9	54%	0.537	52%	0.518	S	S	.	.	H	α-helix	trans	-68.8	-46.9	171.3	-73.4	-177.3	157.4	0	0	111.8	E41 S47 K48 T49	E41-E45 WeakPolarHBondContact O-CB 3.36Å; E41-E45 WeakPolarHBondContact O-CG 3.43Å; E41-E45 PolarHBondContact O-N 2.81Å; E45-S47 VanDerWaalsContact C-N 3.31Å; E45-S47 PolarHBondContact O-N 3.46Å; E45-K48 WeakPolarHBondContact O-CB 3.44Å; E45-K48 PolarHBondContact O-N 3.34Å; E45-K48 VanDerWaalsContact O-N 3.15Å; E45-T49 PolarHBondContact O-N 2.71Å; E45-T49 PolarHBondContact O-OG1 3.41Å
46	R	39.9	Very low	48.4	Very low	177 Å²	177	104.2 Å²	104.2	67%	0.668	52%	0.52	S	S	*	.	H	α-helix	trans	-58.8	-42.3	173.8	-75.6	171.2	179.3	-167.9	-0.8	111.8	M42 A43 T49 V50	M42-R46 VanDerWaalsContact O-CB 3.27Å; M42-R46 WeakPolarHBondContact O-CB 3.39Å; M42-R46 WeakPolarHBondContact O-CG 3.31Å; M42-R46 PolarHBondContact O-N 2.78Å; A43-R46 PolarHBondContact O-N 3.27Å; R46-T49 PolarHBondContact O-N 3.27Å; R46-V50 WeakPolarHBondContact O-CB 3.16Å; R46-V50 VanDerWaalsContact O-CG2 3.29Å; R46-V50 WeakPolarHBondContact O-CG2 3.44Å; R46-V50 PolarHBondContact O-N 3.11Å
47	S	44.4	Very low	50.1	Low	76 Å²	76	102.8 Å²	102.8	53%	0.531	52%	0.518	S	S	.	.	H	α-helix	trans	-61	-47.2	173	-65	0	0	0	0	111.7	A43 E45 T49 V50 T51	A43-S47 WeakPolarHBondContact O-CB 3.48Å; A43-S47 PolarHBondContact O-N 3.07Å; A43-S47 PolarHBondContact O-OG 3.07Å; E45-S47 VanDerWaalsContact C-N 3.31Å; E45-S47 PolarHBondContact O-N 3.46Å; S47-T49 VanDerWaalsContact C-N 3.33Å; S47-T49 PolarHBondContact O-N 3.19Å; S47-V50 PolarHBondContact O-N 3.3Å; S47-T51 VanDerWaalsContact O-CB 3.28Å; S47-T51 WeakPolarHBondContact O-CB 3.42Å; S47-T51 PolarHBondContact O-N 2.97Å; S47-T51 PolarHBondContact O-OG1 3.47Å
48	K	50.3	Low	52	Low	131 Å²	131	101 Å²	101	57%	0.57	51%	0.511	S	S	*	.	H	α-helix	trans	-56.5	-44.2	173.6	-76.6	170.1	173.8	-173.4	0	112.2	R44 E45 S52	R44-K48 WeakPolarHBondContact O-CB 3.42Å; R44-K48 VanDerWaalsContact O-CG 3.27Å; R44-K48 WeakPolarHBondContact O-CG 3.44Å; R44-K48 PolarHBondContact O-N 3.21Å; E45-K48 WeakPolarHBondContact O-CB 3.44Å; E45-K48 PolarHBondContact O-N 3.34Å; E45-K48 VanDerWaalsContact O-N 3.15Å; K48-S52 VanDerWaalsContact O-CB 3.28Å; K48-S52 WeakPolarHBondContact O-CB 3.31Å; K48-S52 PolarHBondContact O-N 3Å
49	T	49.7	Very low	54.1	Low	99 Å²	99	95.4 Å²	95.4	61%	0.607	49%	0.486	S	S	*	.	H	α-helix	trans	-68.5	-41.4	-178.8	-57.4	0	0	0	0	112	E45 R46 S47 S52 F53	E45-T49 PolarHBondContact O-N 2.71Å; E45-T49 PolarHBondContact O-OG1 3.41Å; R46-T49 PolarHBondContact O-N 3.27Å; S47-T49 VanDerWaalsContact C-N 3.33Å; S47-T49 PolarHBondContact O-N 3.19Å; T49-S52 WeakPolarHBondContact O-CB 3.2Å; T49-S52 PolarHBondContact O-N 3.41Å; T49-F53 PolarHBondContact O-N 2.86Å
50	V	43.6	Very low	56.3	Low	80 Å²	80	92.2 Å²	92.2	49%	0.485	47%	0.472	S	S	.	.	H	α-helix	trans	-65.7	-46.4	174.6	171.9	0	0	0	0	110.7	R46 S47 S52 F53 Y54	R46-V50 WeakPolarHBondContact O-CB 3.16Å; R46-V50 VanDerWaalsContact O-CG2 3.29Å; R46-V50 WeakPolarHBondContact O-CG2 3.44Å; R46-V50 PolarHBondContact O-N 3.11Å; S47-V50 PolarHBondContact O-N 3.3Å; V50-S52 VanDerWaalsContact C-N 3.28Å; V50-S52 PolarHBondContact O-N 2.63Å; V50-F53 PolarHBondContact O-N 3.47Å; V50-Y54 HydrophobicContact CG1-CD2 3.99Å; V50-Y54 HydrophobicContact CG1-CE2 3.77Å; V50-Y54 VanDerWaalsContact O-CD2 3.3Å; V50-Y54 WeakPolarHBondContact O-CD2 3.31Å; V50-Y54 PolarHBondContact O-N 3.19Å
51	T	52.4	Low	58.1	Low	71 Å²	71	90 Å²	90	44%	0.436	47%	0.465	S	S	.	.	H	α-helix	trans	-60.2	-36.8	173.4	-63.8	0	0	0	0	111.7	S47 N55	S47-T51 VanDerWaalsContact O-CB 3.28Å; S47-T51 WeakPolarHBondContact O-CB 3.42Å; S47-T51 PolarHBondContact O-N 2.97Å; S47-T51 PolarHBondContact O-OG1 3.47Å; T51-N55 VanDerWaalsContact CG2-ND2 3.28Å; T51-N55 WeakPolarHBondContact CG2-ND2 3.39Å; T51-N55 WeakPolarHBondContact O-CB 3.39Å; T51-N55 PolarHBondContact O-N 3.02Å; T51-N55 PolarHBondContact O-ND2 2.95Å
52	S	55.4	Low	60.3	Low	65 Å²	65	85.1 Å²	85.1	46%	0.455	44%	0.443	S	S	.	.	H	α-helix	trans	-61.8	-45.2	174.7	-169.7	0	0	0	0	111.7	K48 T49 V50 N55 Q56	K48-S52 VanDerWaalsContact O-CB 3.28Å; K48-S52 WeakPolarHBondContact O-CB 3.31Å; K48-S52 PolarHBondContact O-N 3Å; T49-S52 WeakPolarHBondContact O-CB 3.2Å; T49-S52 PolarHBondContact O-N 3.41Å; V50-S52 VanDerWaalsContact C-N 3.28Å; V50-S52 PolarHBondContact O-N 2.63Å; S52-N55 PolarHBondContact O-N 3.03Å; S52-Q56 WeakPolarHBondContact O-CB 3.47Å; S52-Q56 PolarHBondContact O-N 3.23Å
53	F	47	Very low	62.7	Low	156 Å²	156	81.5 Å²	81.5	68%	0.684	43%	0.427	S	S	*	.	H	α-helix	trans	-61.9	-46.3	-179	-169.9	-96.4	0	0	0	112.9	T49 V50 Q56	T49-F53 PolarHBondContact O-N 2.86Å; V50-F53 PolarHBondContact O-N 3.47Å; F53-Q56 PolarHBondContact O-N 3.08Å
54	Y	52.9	Low	65	Low	163 Å²	163	86.5 Å²	86.5	64%	0.639	44%	0.442	S	S	*	.	H	α-helix	trans	-69	-33.7	176	-73	-71.7	0	0	0	113.2	V50 Q56 S57 A58	V50-Y54 HydrophobicContact CG1-CD2 3.99Å; V50-Y54 HydrophobicContact CG1-CE2 3.77Å; V50-Y54 VanDerWaalsContact O-CD2 3.3Å; V50-Y54 WeakPolarHBondContact O-CD2 3.31Å; V50-Y54 PolarHBondContact O-N 3.19Å; Y54-Q56 VanDerWaalsContact C-N 3.31Å; Y54-S57 PolarHBondContact O-OG 3.4Å; Y54-A58 PolarHBondContact O-N 3.26Å
55	N	61.5	Low	66.8	Low	24 Å²	24	84 Å²	84	13%	0.128	44%	0.436	C	S	.	.	H	α-helix	trans	-70.3	-29.1	174.5	-82.2	-62.9	0	0	0	112.5	T51 S52 A58 I59 Q134	T51-N55 VanDerWaalsContact CG2-ND2 3.28Å; T51-N55 WeakPolarHBondContact CG2-ND2 3.39Å; T51-N55 WeakPolarHBondContact O-CB 3.39Å; T51-N55 PolarHBondContact O-N 3.02Å; T51-N55 PolarHBondContact O-ND2 2.95Å; S52-N55 PolarHBondContact O-N 3.03Å; N55-A58 PolarHBondContact O-N 3.25Å; N55-I59 HydrophobicContact CB-CD1 4.43Å; N55-I59 WeakPolarHBondContact O-CB 3.48Å; N55-I59 WeakPolarHBondContact O-CD1 3.29Å; N55-I59 WeakPolarHBondContact O-CG1 3.46Å; N55-I59 PolarHBondContact O-N 3.15Å; N55-Q134 PolarHBondContact ND2-NE2 2.84Å
56	Q	73.9	Confident	68.8	Low	90 Å²	90	83.9 Å²	83.9	42%	0.421	44%	0.444	S	S	.	.	H	α-helix	trans	-62.8	-47.7	-177.9	-171	150.8	0.2	0	0	111.6	S52 F53 Y54 I59 D60	S52-Q56 WeakPolarHBondContact O-CB 3.47Å; S52-Q56 PolarHBondContact O-N 3.23Å; F53-Q56 PolarHBondContact O-N 3.08Å; Y54-Q56 VanDerWaalsContact C-N 3.31Å; Q56-I59 PolarHBondContact O-N 3.24Å; Q56-D60 VanDerWaalsContact O-CG 3.31Å; Q56-D60 PolarHBondContact O-N 3Å
57	S	79.9	Confident	70.7	Confident	77 Å²	77	77.4 Å²	77.4	54%	0.538	43%	0.426	S	S	.	.	H	α-helix	trans	-66.3	-37	175.7	58.7	0	0	0	0	113.3	Y54 D60 A61	Y54-S57 PolarHBondContact O-OG 3.4Å; S57-D60 PolarHBondContact O-N 3.01Å; S57-A61 WeakPolarHBondContact O-CB 3.45Å; S57-A61 PolarHBondContact O-N 2.81Å
58	A	85.6	Confident	72.4	Confident	40 Å²	40	78 Å²	78	33%	0.331	43%	0.426	S	S	.	.	H	α-helix	trans	-65.3	-40.7	175.3	0	0	0	0	0	112.5	Y54 N55 A62 F133	Y54-A58 PolarHBondContact O-N 3.26Å; N55-A58 PolarHBondContact O-N 3.25Å; A58-A62 VanDerWaalsContact O-CB 3.29Å; A58-A62 WeakPolarHBondContact O-CB 3.42Å; A58-A62 PolarHBondContact O-N 3.46Å; A58-F133 HydrophobicContact CB-CE1 4.25Å
59	I	88.3	Confident	73.6	Confident	2 Å²	2	77.3 Å²	77.3	1%	0.01	42%	0.42	C	S	.	.	H	α-helix	trans	-63	-46.9	173.8	-72.1	162	0	0	0	110.3	N55 Q56 A62 A63 A103 I106 F133	N55-I59 HydrophobicContact CB-CD1 4.43Å; N55-I59 WeakPolarHBondContact O-CB 3.48Å; N55-I59 WeakPolarHBondContact O-CD1 3.29Å; N55-I59 WeakPolarHBondContact O-CG1 3.46Å; N55-I59 PolarHBondContact O-N 3.15Å; Q56-I59 PolarHBondContact O-N 3.24Å; I59-A62 PolarHBondContact O-N 2.82Å; I59-A63 WeakPolarHBondContact O-CB 3.4Å; I59-A63 PolarHBondContact O-N 3.26Å; I59-A103 HydrophobicContact CG2-CB 4.43Å; I59-I106 HydrophobicContact CD1-CD1 4.03Å; I59-I106 HydrophobicContact CD1-CG2 4.47Å; I59-I106 HydrophobicContact CG1-CD1 4.14Å; I59-I106 HydrophobicContact CG2-CB 4.11Å; I59-I106 HydrophobicContact CG2-CD1 4.21Å; I59-I106 HydrophobicContact CG2-CG2 3.83Å; I59-F133 HydrophobicContact CB-CE1 4.4Å; I59-F133 HydrophobicContact CD1-CD1 4.21Å; I59-F133 HydrophobicContact CG1-CD1 3.44Å; I59-F133 VanDerWaalsContact CG1-CD1 3.44Å; I59-F133 HydrophobicContact CG1-CD2 4.43Å; I59-F133 HydrophobicContact CG1-CE1 3.5Å; I59-F133 HydrophobicContact CG1-CE2 4.48Å; I59-F133 HydrophobicContact CG1-CG 3.94Å; I59-F133 HydrophobicContact CG1-CZ 4.04Å
60	D	89.2	Confident	74.8	Confident	55 Å²	55	73.8 Å²	73.8	29%	0.294	40%	0.398	S	S	.	.	H	α-helix	trans	-66.5	-44	-177	-67.8	-40.1	0	0	0	111.2	Q56 S57 A62 A63 E64 R110	Q56-D60 VanDerWaalsContact O-CG 3.31Å; Q56-D60 PolarHBondContact O-N 3Å; S57-D60 PolarHBondContact O-N 3.01Å; D60-A62 VanDerWaalsContact C-N 3.3Å; D60-A62 PolarHBondContact O-N 3.06Å; D60-A63 PolarHBondContact O-N 3.46Å; D60-A63 VanDerWaalsContact O-N 3.09Å; D60-E64 PolarHBondContact O-N 2.86Å; D60-E64 VanDerWaalsContact O-N 3.12Å; D60-R110 VanDerWaalsContact CG-NH1 3.28Å; D60-R110 IonicContact OD1-NH1 3.33Å; D60-R110 PolarHBondContact OD1-NH1 3.23Å; D60-R110 IonicContact OD2-NH1 2.87Å; D60-R110 PolarHBondContact OD2-NH1 3.47Å; D60-R110 VanDerWaalsContact OD2-NH1 3.14Å
61	A	89.4	Confident	76.4	Confident	53 Å²	53	71.2 Å²	71.2	44%	0.438	38%	0.382	S	S	.	.	H	α-helix	trans	-64.8	-29.1	173.8	0	0	0	0	0	113.7	S57	S57-A61 WeakPolarHBondContact O-CB 3.45Å; S57-A61 PolarHBondContact O-N 2.81Å
62	A	88.6	Confident	77.3	Confident	7 Å²	7	67.9 Å²	67.9	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-75.7	-34.1	171.2	0	0	0	0	0	112.1	A58 I59 D60 E64 K65 A103 F133	A58-A62 VanDerWaalsContact O-CB 3.29Å; A58-A62 WeakPolarHBondContact O-CB 3.42Å; A58-A62 PolarHBondContact O-N 3.46Å; I59-A62 PolarHBondContact O-N 2.82Å; D60-A62 VanDerWaalsContact C-N 3.3Å; D60-A62 PolarHBondContact O-N 3.06Å; A62-E64 VanDerWaalsContact C-N 3.3Å; A62-E64 PolarHBondContact O-N 3.48Å; A62-K65 WeakPolarHBondContact O-CB 3.33Å; A62-K65 PolarHBondContact O-N 3.38Å; A62-A103 HydrophobicContact CB-CB 3.7Å; A62-F133 HydrophobicContact CB-CE2 3.62Å; A62-F133 HydrophobicContact CB-CZ 3.73Å
63	A	89.9	Confident	77.7	Confident	8 Å²	8	66.7 Å²	66.7	7%	0.066	35%	0.352	C	S	.	.	H	α-helix	trans	-73.9	-17.6	179.7	0	0	0	0	0	113.7	I59 D60 A103 H104 K107	I59-A63 WeakPolarHBondContact O-CB 3.4Å; I59-A63 PolarHBondContact O-N 3.26Å; D60-A63 PolarHBondContact O-N 3.46Å; D60-A63 VanDerWaalsContact O-N 3.09Å; A63-A103 HydrophobicContact CB-CB 3.95Å; A63-H104 PolarHBondContact O-CD2 3.18Å; A63-H104 PolarHBondContact O-NE2 3.02Å; A63-H104 VanDerWaalsContact O-NE2 3.14Å; A63-K107 HydrophobicContact CB-CB 4.3Å; A63-K107 HydrophobicContact CB-CD 3.93Å
64	E	90.1	Very high	78.8	Confident	155 Å²	155	64.3 Å²	64.3	72%	0.724	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-19.8	171.6	-72.5	178	172.7	0	0	113.3	D60 A62	D60-E64 PolarHBondContact O-N 2.86Å; D60-E64 VanDerWaalsContact O-N 3.12Å; A62-E64 VanDerWaalsContact C-N 3.3Å; A62-E64 PolarHBondContact O-N 3.48Å
65	K	88.4	Confident	79.8	Confident	121 Å²	121	56.7 Å²	56.7	53%	0.526	31%	0.314	S	S	.	.	S	Bend	trans	-70.5	138.7	178.9	-64.5	173.9	-175.5	175.4	0	110.7	A62 V100 H104	A62-K65 WeakPolarHBondContact O-CB 3.33Å; A62-K65 PolarHBondContact O-N 3.38Å; K65-V100 HydrophobicContact CB-CG1 4.04Å; K65-V100 HydrophobicContact CB-CG2 4.02Å; K65-V100 HydrophobicContact CD-CG2 3.96Å; K65-H104 PolarHBondContact O-CE1 3.5Å; K65-H104 VanDerWaalsContact O-CE1 3.27Å; K65-H104 PolarHBondContact O-NE2 3.2Å
66	P	84.3	Confident	80.2	Confident	111 Å²	111	57.6 Å²	57.6	72%	0.721	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-69.1	135.2	170.6	29.5	-33.6	0	0	0	110.1
67	S	80.5	Confident	79.7	Confident	42 Å²	42	63 Å²	63	29%	0.294	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-78.1	124.4	172.4	60.4	0	0	0	0	110.5	R69	S67-R69 PolarHBondContact O-N 3.08Å
68	V	80.2	Confident	78.9	Confident	87 Å²	87	61.4 Å²	61.4	53%	0.527	33%	0.325	S	S	.	.			trans	-82	111.3	175.8	-175.5	0	0	0	0	109.5	Y93 E97 R101	V68-Y93 PolarHBondContact O-OH 3.23Å; V68-E97 WeakPolarHBondContact CB-OE1 3.16Å; V68-E97 VanDerWaalsContact N-CD 3.34Å; V68-E97 PolarHBondContact N-OE1 2.85Å; V68-E97 PolarHBondContact N-OE2 3.49Å; V68-R101 PolarHBondContact O-NH2 3.23Å
69	R	75.6	Confident	77.8	Confident	118 Å²	118	59.9 Å²	59.9	45%	0.445	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-86.1	132.8	176	-57.6	-163	-171.3	-170.6	3.7	112.3	S67 R411 I412	S67-R69 PolarHBondContact O-N 3.08Å; R69-R411 HydrophobicContact CB-CB 3.57Å; R69-R411 VanDerWaalsContact CD-O 3.29Å; R69-R411 WeakPolarHBondContact CD-O 3.46Å; R69-R411 PolarHBondContact NH1-O 2.88Å; R69-I412 WeakPolarHBondContact CA-O 3.25Å; R69-I412 WeakPolarHBondContact CB-O 3.28Å
70	L	74.4	Confident	76.7	Confident	25 Å²	25	69.4 Å²	69.4	13%	0.131	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-93.7	145.2	176.1	-72.2	175.7	0	0	0	111.2	M74 M75 Y93 L203 R411 I412	L70-M74 HydrophobicContact CD2-CB 4.12Å; L70-M74 HydrophobicContact CD2-CE 3.54Å; L70-M74 HydrophobicContact CD2-SD 3.98Å; L70-M75 HydrophobicContact CB-CG 4.14Å; L70-M75 HydrophobicContact CB-SD 4.49Å; L70-M75 HydrophobicContact CD1-CG 3.98Å; L70-Y93 HydrophobicContact CD1-CD1 3.99Å; L70-Y93 HydrophobicContact CD1-CE1 3.34Å; L70-Y93 HydrophobicContact CD1-CE2 4.05Å; L70-Y93 HydrophobicContact CD2-CE2 4.36Å; L70-Y93 HydrophobicContact CG-CE1 4.1Å; L70-Y93 HydrophobicContact CG-CE2 4.09Å; L70-Y93 WeakPolarHBondContact CG-OH 3.5Å; L70-L203 HydrophobicContact CD1-CD2 4.28Å; L70-R411 CarbonylContact O-C 3.58Å; L70-R411 WeakPolarHBondContact O-CA 3.39Å; L70-I412 PolarHBondContact N-O 3.06Å; L70-I412 VanDerWaalsContact N-O 3.12Å; L70-I412 PolarHBondContact O-N 3.44Å
71	T	76.4	Confident	75.7	Confident	26 Å²	26	69.1 Å²	69.1	16%	0.16	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-78.2	149.2	161.4	63.1	0	0	0	0	109.9	T73 M74 M75 R411	T71-T73 PolarHBondContact O-N 3.15Å; T71-T73 VanDerWaalsContact O-N 3.14Å; T71-M74 WeakPolarHBondContact O-CB 3.5Å; T71-M74 PolarHBondContact O-N 3.33Å; T71-M74 WeakPolarHBondContact OG1-CG 3.19Å; T71-M74 PolarHBondContact OG1-N 2.96Å; T71-M75 PolarHBondContact O-N 3.29Å; T71-R411 HydrophobicContact CG2-CG 4.14Å
72	P	70.8	Confident	74.6	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-52.5	-31.2	169.4	-26.7	33.1	0	0	0	113.3	M75 L76 I265 I403 F410 I412	P72-M75 WeakPolarHBondContact O-CB 3.21Å; P72-M75 PolarHBondContact O-N 3.06Å; P72-L76 PolarHBondContact O-N 2.82Å; P72-I265 HydrophobicContact CB-CD1 4.16Å; P72-I265 HydrophobicContact CG-CD1 4.18Å; P72-I403 HydrophobicContact CB-CB 4.26Å; P72-I403 HydrophobicContact CB-CD1 3.98Å; P72-I403 HydrophobicContact CB-CG1 3.75Å; P72-I403 HydrophobicContact CB-CG2 3.83Å; P72-I403 HydrophobicContact CG-CG1 4.33Å; P72-F410 HydrophobicContact CB-CZ 4.49Å; P72-F410 WeakPolarHBondContact CD-O 3.49Å; P72-F410 HydrophobicContact CG-CD1 4.47Å; P72-F410 HydrophobicContact CG-CD2 3.99Å; P72-F410 HydrophobicContact CG-CE1 3.93Å; P72-F410 HydrophobicContact CG-CE2 3.35Å; P72-F410 HydrophobicContact CG-CZ 3.34Å; P72-I412 HydrophobicContact CG-CD1 4.16Å
73	T	63.8	Low	74	Confident	41 Å²	41	81.7 Å²	81.7	25%	0.252	40%	0.404	S	S	.	.	H	α-helix	trans	-64.9	-42.4	175.7	-19.7	0	0	0	0	112	T71 M75 L76 Y77 I403	T71-T73 PolarHBondContact O-N 3.15Å; T71-T73 VanDerWaalsContact O-N 3.14Å; T73-M75 VanDerWaalsContact C-N 3.3Å; T73-M75 PolarHBondContact O-N 3.45Å; T73-L76 PolarHBondContact O-N 3.46Å; T73-Y77 HydrophobicContact CG2-CD2 4.22Å; T73-Y77 HydrophobicContact CG2-CE2 3.78Å; T73-Y77 WeakPolarHBondContact O-CD2 3.48Å; T73-Y77 PolarHBondContact O-N 3.26Å; T73-Y77 VanDerWaalsContact O-N 3.09Å; T73-I403 PolarHBondContact OG1-O 2.87Å
74	M	70.4	Confident	73.5	Confident	106 Å²	106	82.2 Å²	82.2	52%	0.522	41%	0.41	S	S	.	.	H	α-helix	trans	-63.6	-37.5	173.3	-69.9	170	77.7	0	0	111.6	L70 T71 S78	L70-M74 HydrophobicContact CD2-CB 4.12Å; L70-M74 HydrophobicContact CD2-CE 3.54Å; L70-M74 HydrophobicContact CD2-SD 3.98Å; T71-M74 WeakPolarHBondContact O-CB 3.5Å; T71-M74 PolarHBondContact O-N 3.33Å; T71-M74 WeakPolarHBondContact OG1-CG 3.19Å; T71-M74 PolarHBondContact OG1-N 2.96Å; M74-S78 WeakPolarHBondContact O-CB 3.47Å; M74-S78 PolarHBondContact O-N 3.36Å; M74-S78 VanDerWaalsContact O-N 3.13Å; M74-S78 PolarHBondContact O-OG 3.06Å
75	M	75	Confident	73.2	Confident	2 Å²	2	77.3 Å²	77.3	1%	0.01	39%	0.393	C	S	.	.	H	α-helix	trans	-64.8	-45.2	175.6	-63	175.2	68.8	0	0	111.3	L70 T71 P72 T73 Y77 S78 L203 H206 I221 I412	L70-M75 HydrophobicContact CB-CG 4.14Å; L70-M75 HydrophobicContact CB-SD 4.49Å; L70-M75 HydrophobicContact CD1-CG 3.98Å; T71-M75 PolarHBondContact O-N 3.29Å; P72-M75 WeakPolarHBondContact O-CB 3.21Å; P72-M75 PolarHBondContact O-N 3.06Å; T73-M75 VanDerWaalsContact C-N 3.3Å; T73-M75 PolarHBondContact O-N 3.45Å; M75-Y77 PolarHBondContact O-N 3.46Å; M75-S78 PolarHBondContact O-N 3.12Å; M75-S78 PolarHBondContact O-OG 2.84Å; M75-L203 HydrophobicContact CE-CD2 4Å; M75-L203 HydrophobicContact SD-CD2 4.15Å; M75-H206 HydrophobicContact CE-CB 3.48Å; M75-H206 VanDerWaalsContact CE-CB 3.48Å; M75-I221 HydrophobicContact CB-CD1 3.86Å; M75-I412 HydrophobicContact SD-CD1 3.8Å
76	L	69.3	Low	73.1	Confident	43 Å²	43	73 Å²	73	23%	0.225	38%	0.375	C	S	.	.	H	α-helix	trans	-55.7	-51.1	174.1	-81.8	176.6	0	0	0	112.6	P72 T73 S78 G79 V218 I221 I403	P72-L76 PolarHBondContact O-N 2.82Å; T73-L76 PolarHBondContact O-N 3.46Å; L76-S78 PolarHBondContact O-N 3.49Å; L76-G79 PolarHBondContact O-N 2.82Å; L76-G79 VanDerWaalsContact O-N 3.11Å; L76-V218 HydrophobicContact CD2-CB 4.08Å; L76-V218 HydrophobicContact CD2-CG1 4.41Å; L76-V218 HydrophobicContact CD2-CG2 4.45Å; L76-I221 HydrophobicContact CD1-CG2 4.41Å; L76-I221 HydrophobicContact CD2-CB 3.85Å; L76-I221 HydrophobicContact CD2-CD1 3.92Å; L76-I221 HydrophobicContact CD2-CG1 4.45Å; L76-I221 HydrophobicContact CD2-CG2 3.65Å; L76-I221 HydrophobicContact CG-CD1 3.74Å; L76-I221 HydrophobicContact CG-CG2 4.09Å; L76-I403 HydrophobicContact CD1-CG2 3.7Å
77	Y	63.4	Low	73.4	Confident	204 Å²	204	68.7 Å²	68.7	80%	0.8	35%	0.345	S	S	*	.	H	α-helix	trans	-69.6	-16.5	-178.8	-71.8	-58.9	0	0	0	113.7	T73 M75 G79	T73-Y77 HydrophobicContact CG2-CD2 4.22Å; T73-Y77 HydrophobicContact CG2-CE2 3.78Å; T73-Y77 WeakPolarHBondContact O-CD2 3.48Å; T73-Y77 PolarHBondContact O-N 3.26Å; T73-Y77 VanDerWaalsContact O-N 3.09Å; M75-Y77 PolarHBondContact O-N 3.46Å; Y77-G79 VanDerWaalsContact C-N 3.31Å
78	S	63.4	Low	74	Confident	43 Å²	43	68.1 Å²	68.1	30%	0.301	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-3.4	172.3	73	0	0	0	0	114.4	M74 M75 L76 H86	M74-S78 WeakPolarHBondContact O-CB 3.47Å; M74-S78 PolarHBondContact O-N 3.36Å; M74-S78 VanDerWaalsContact O-N 3.13Å; M74-S78 PolarHBondContact O-OG 3.06Å; M75-S78 PolarHBondContact O-N 3.12Å; M75-S78 PolarHBondContact O-OG 2.84Å; L76-S78 PolarHBondContact O-N 3.49Å; S78-H86 WeakPolarHBondContact O-CB 3.35Å
79	G	63.2	Low	74.5	Confident	8 Å²	8	71.4 Å²	71.4	8%	0.082	35%	0.346	C	S	.	.	S	Bend	trans	-93.3	2.2	-162.8	0	0	0	0	0	118.4	L76 Y77	L76-G79 PolarHBondContact O-N 2.82Å; L76-G79 VanDerWaalsContact O-N 3.11Å; Y77-G79 VanDerWaalsContact C-N 3.31Å
80	R	64	Low	75.3	Confident	202 Å²	202	66.4 Å²	66.4	76%	0.762	33%	0.329	S	S	*	.			trans	-146.5	109.5	-178.6	-67.1	-170	174.7	-166.7	-6	113.7
81	S	67.8	Low	76.2	Confident	50 Å²	50	65.2 Å²	65.2	35%	0.35	32%	0.323	S	S	.	.			trans	-143.7	134.1	160.4	-171.7	0	0	0	0	110	D83 G84 H86	S81-D83 WeakPolarHBondContact CB-OD1 3.36Å; S81-D83 PolarHBondContact O-N 3.13Å; S81-D83 PolarHBondContact OG-OD1 3.09Å; S81-G84 PolarHBondContact O-N 2.88Å; S81-H86 PolarHBondContact N-ND1 2.9Å; S81-H86 PolarHBondContact O-CE1 3.2Å; S81-H86 PolarHBondContact O-ND1 3.27Å
82	Q	67.7	Low	77	Confident	212 Å²	212	68.9 Å²	68.9	99%	0.991	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-22.2	-172.1	-68.6	-177.7	-10.2	0	0	113.9	G84	Q82-G84 VanDerWaalsContact C-N 3.34Å
83	D	74.5	Confident	78	Confident	112 Å²	112	70.9 Å²	70.9	60%	0.599	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-1.2	179.4	66.7	-14.3	0	0	0	114	S81 S85	S81-D83 WeakPolarHBondContact CB-OD1 3.36Å; S81-D83 PolarHBondContact O-N 3.13Å; S81-D83 PolarHBondContact OG-OD1 3.09Å; D83-S85 PolarHBondContact O-N 3.48Å; D83-S85 WeakPolarHBondContact OD1-CB 3.49Å; D83-S85 PolarHBondContact OD1-N 3.36Å; D83-S85 PolarHBondContact OD1-OG 2.91Å; D83-S85 WeakPolarHBondContact OD2-CB 3.4Å; D83-S85 PolarHBondContact OD2-OG 2.73Å
84	G	79.3	Confident	79.5	Confident	18 Å²	18	69.1 Å²	69.1	19%	0.186	33%	0.331	C	S	.	.	S	Bend	trans	71.2	-1	-175	0	0	0	0	0	115.2	S81 Q82 H86 L87	S81-G84 PolarHBondContact O-N 2.88Å; Q82-G84 VanDerWaalsContact C-N 3.34Å; G84-H86 PolarHBondContact O-N 3.31Å; G84-L87 WeakPolarHBondContact O-CB 3.46Å; G84-L87 PolarHBondContact O-N 3.04Å
85	S	85.3	Confident	80.6	Confident	53 Å²	53	65.7 Å²	65.7	37%	0.371	31%	0.313	S	S	.	.	H	α-helix	trans	-59.7	-26.6	-177.4	62.9	0	0	0	0	113.4	D83 L87 L88 K89	D83-S85 PolarHBondContact O-N 3.48Å; D83-S85 WeakPolarHBondContact OD1-CB 3.49Å; D83-S85 PolarHBondContact OD1-N 3.36Å; D83-S85 PolarHBondContact OD1-OG 2.91Å; D83-S85 WeakPolarHBondContact OD2-CB 3.4Å; D83-S85 PolarHBondContact OD2-OG 2.73Å; S85-L87 VanDerWaalsContact C-N 3.32Å; S85-L87 PolarHBondContact O-N 2.87Å; S85-L88 PolarHBondContact O-N 3.42Å; S85-K89 PolarHBondContact O-N 3.46Å
86	H	86.7	Confident	81.4	Confident	31 Å²	31	72.3 Å²	72.3	14%	0.144	34%	0.344	C	S	.	.	H	α-helix	trans	-63.7	-33	175.1	76.3	-81.9	0	0	0	113.2	S78 S81 G84 K89 S90	S78-H86 WeakPolarHBondContact O-CB 3.35Å; S81-H86 PolarHBondContact N-ND1 2.9Å; S81-H86 PolarHBondContact O-CE1 3.2Å; S81-H86 PolarHBondContact O-ND1 3.27Å; G84-H86 PolarHBondContact O-N 3.31Å; H86-K89 PolarHBondContact O-N 3.48Å; H86-S90 WeakPolarHBondContact O-CB 3.32Å; H86-S90 PolarHBondContact O-N 3.16Å
87	L	90.3	Very high	82.6	Confident	20 Å²	20	70.8 Å²	70.8	11%	0.105	34%	0.336	C	S	.	.	H	α-helix	trans	-66.6	-51.4	174.6	-59	171.4	0	0	0	110	G84 S85 K89 S90 A91 L210	G84-L87 WeakPolarHBondContact O-CB 3.46Å; G84-L87 PolarHBondContact O-N 3.04Å; S85-L87 VanDerWaalsContact C-N 3.32Å; S85-L87 PolarHBondContact O-N 2.87Å; L87-K89 PolarHBondContact O-N 3.22Å; L87-S90 CarbonylContact O-C 3.57Å; L87-S90 WeakPolarHBondContact O-CA 3.35Å; L87-S90 VanDerWaalsContact O-CB 3.31Å; L87-S90 WeakPolarHBondContact O-CB 3.38Å; L87-S90 PolarHBondContact O-N 3.32Å; L87-A91 WeakPolarHBondContact O-CB 3.4Å; L87-A91 PolarHBondContact O-N 3.1Å; L87-L210 HydrophobicContact CD2-CB 3.56Å
88	L	91.9	Very high	84.1	Confident	30 Å²	30	61.4 Å²	61.4	16%	0.157	30%	0.3	C	S	.	.	H	α-helix	trans	-59.4	-35	176.8	-57.8	-177.7	0	0	0	112.5	S85 R92 I142 D144 D148	S85-L88 PolarHBondContact O-N 3.42Å; L88-R92 WeakPolarHBondContact O-CB 3.47Å; L88-R92 WeakPolarHBondContact O-CD 3.31Å; L88-R92 WeakPolarHBondContact O-CG 3.29Å; L88-R92 PolarHBondContact O-N 2.96Å; L88-I142 HydrophobicContact CD2-CG2 4.38Å; L88-D144 VanDerWaalsContact CD2-O 3.32Å; L88-D144 WeakPolarHBondContact CD2-O 3.47Å; L88-D148 HydrophobicContact CD2-CB 3.89Å
89	K	90.6	Very high	85.6	Confident	156 Å²	156	60.1 Å²	60.1	68%	0.678	29%	0.29	S	S	*	.	H	α-helix	trans	-67.3	-42.1	173.5	-171.9	177.8	179.7	-179.6	0	111.9	S85 H86 L87 Y93	S85-K89 PolarHBondContact O-N 3.46Å; H86-K89 PolarHBondContact O-N 3.48Å; L87-K89 PolarHBondContact O-N 3.22Å; K89-Y93 WeakPolarHBondContact O-CB 2.75Å; K89-Y93 PolarHBondContact O-N 3.24Å; K89-Y93 VanDerWaalsContact O-N 3.12Å
90	S	92.1	Very high	87.1	Confident	13 Å²	13	60.1 Å²	60.1	9%	0.091	29%	0.289	C	S	.	.	H	α-helix	trans	-63.1	-46.3	175.1	-169.3	0	0	0	0	111.7	H86 L87 Y93 L94 H207	H86-S90 WeakPolarHBondContact O-CB 3.32Å; H86-S90 PolarHBondContact O-N 3.16Å; L87-S90 CarbonylContact O-C 3.57Å; L87-S90 WeakPolarHBondContact O-CA 3.35Å; L87-S90 VanDerWaalsContact O-CB 3.31Å; L87-S90 WeakPolarHBondContact O-CB 3.38Å; L87-S90 PolarHBondContact O-N 3.32Å; S90-Y93 WeakPolarHBondContact O-CB 3.34Å; S90-Y93 PolarHBondContact O-N 3.12Å; S90-L94 PolarHBondContact O-N 3.02Å; S90-H207 PolarHBondContact OG-ND1 3.23Å
91	A	93.6	Very high	88.6	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.5	-47.7	179.6	0	0	0	0	0	112.3	L87 Y93 L94 Q95 I142 D148	L87-A91 WeakPolarHBondContact O-CB 3.4Å; L87-A91 PolarHBondContact O-N 3.1Å; A91-Y93 VanDerWaalsContact C-N 3.32Å; A91-Y93 PolarHBondContact O-N 2.85Å; A91-L94 PolarHBondContact O-N 3.4Å; A91-Q95 WeakPolarHBondContact O-CB 3.29Å; A91-Q95 PolarHBondContact O-N 3.19Å; A91-I142 HydrophobicContact CB-CD1 3.79Å; A91-I142 HydrophobicContact CB-CG2 4.22Å; A91-D148 WeakPolarHBondContact CB-OD1 3.39Å
92	R	93.8	Very high	90	Very high	102 Å²	102	49.1 Å²	49.1	39%	0.385	24%	0.24	S	C	.	.	H	α-helix	trans	-62.3	-37.2	175.5	-72.3	168.9	-175.2	147.1	10.1	112.5	L88 Q95 Q96 I142 K143	L88-R92 WeakPolarHBondContact O-CB 3.47Å; L88-R92 WeakPolarHBondContact O-CD 3.31Å; L88-R92 WeakPolarHBondContact O-CG 3.29Å; L88-R92 PolarHBondContact O-N 2.96Å; R92-Q95 PolarHBondContact O-N 3.42Å; R92-Q96 WeakPolarHBondContact O-CG 3.38Å; R92-Q96 PolarHBondContact O-N 3.16Å; R92-Q96 VanDerWaalsContact O-N 3.16Å; R92-I142 HydrophobicContact CG-CB 4.39Å; R92-I142 PolarHBondContact NE-O 3.45Å; R92-I142 PolarHBondContact NH2-O 3.42Å; R92-K143 PolarHBondContact NH2-O 3.36Å
93	Y	92.4	Very high	91.3	Very high	43 Å²	43	39 Å²	39	17%	0.169	19%	0.193	C	C	.	.	H	α-helix	trans	-64.1	-46.1	173.8	169.9	-95.7	0	0	0	111.3	V68 L70 K89 S90 A91 Q95 Q96 E97 L203	V68-Y93 PolarHBondContact O-OH 3.23Å; L70-Y93 HydrophobicContact CD1-CD1 3.99Å; L70-Y93 HydrophobicContact CD1-CE1 3.34Å; L70-Y93 HydrophobicContact CD1-CE2 4.05Å; L70-Y93 HydrophobicContact CD2-CE2 4.36Å; L70-Y93 HydrophobicContact CG-CE1 4.1Å; L70-Y93 HydrophobicContact CG-CE2 4.09Å; L70-Y93 WeakPolarHBondContact CG-OH 3.5Å; K89-Y93 WeakPolarHBondContact O-CB 2.75Å; K89-Y93 PolarHBondContact O-N 3.24Å; K89-Y93 VanDerWaalsContact O-N 3.12Å; S90-Y93 WeakPolarHBondContact O-CB 3.34Å; S90-Y93 PolarHBondContact O-N 3.12Å; A91-Y93 VanDerWaalsContact C-N 3.32Å; A91-Y93 PolarHBondContact O-N 2.85Å; Y93-Q95 PolarHBondContact O-N 3.23Å; Y93-Q96 PolarHBondContact O-N 3.34Å; Y93-E97 HydrophobicContact CD2-CG 4.21Å; Y93-E97 HydrophobicContact CE1-CG 4.28Å; Y93-E97 HydrophobicContact CE2-CG 3.58Å; Y93-E97 WeakPolarHBondContact O-CB 3.47Å; Y93-E97 PolarHBondContact O-N 3.44Å; Y93-L203 HydrophobicContact CE1-CD1 4.19Å; Y93-L203 HydrophobicContact CE1-CD2 4.11Å
94	L	93.8	Very high	92.3	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-60.4	-43	173.7	-99.6	62.6	0	0	0	112.5	S90 A91 Q96 E97 L98 Y151 L203 H207	S90-L94 PolarHBondContact O-N 3.02Å; A91-L94 PolarHBondContact O-N 3.4Å; L94-Q96 PolarHBondContact O-N 2.85Å; L94-E97 PolarHBondContact O-N 2.91Å; L94-L98 HydrophobicContact CB-CD1 4.17Å; L94-L98 HydrophobicContact CB-CG 4.29Å; L94-L98 HydrophobicContact CD2-CD1 4.19Å; L94-L98 HydrophobicContact CG-CD1 4.02Å; L94-L98 HydrophobicContact CG-CG 4.17Å; L94-L98 WeakPolarHBondContact O-CB 3.48Å; L94-L98 WeakPolarHBondContact O-CG 3.33Å; L94-L98 PolarHBondContact O-N 3.46Å; L94-Y151 HydrophobicContact CB-CE1 3.95Å; L94-Y151 HydrophobicContact CD2-CE1 4.47Å; L94-L203 HydrophobicContact CD1-CB 4.26Å; L94-H207 HydrophobicContact CD1-CB 4.22Å; L94-H207 HydrophobicContact CD2-CB 3.45Å; L94-H207 VanDerWaalsContact CD2-CB 3.45Å; L94-H207 HydrophobicContact CG-CB 4.48Å
95	Q	94.6	Very high	93.1	Very high	34 Å²	34	36.4 Å²	36.4	16%	0.159	17%	0.171	C	C	.	.	H	α-helix	trans	-60.1	-30.9	178.4	-172	172.3	35.2	0	0	112.3	A91 R92 Y93 P99 F139 P140 I142 Y151	A91-Q95 WeakPolarHBondContact O-CB 3.29Å; A91-Q95 PolarHBondContact O-N 3.19Å; R92-Q95 PolarHBondContact O-N 3.42Å; Y93-Q95 PolarHBondContact O-N 3.23Å; Q95-P99 VanDerWaalsContact O-CD 3.3Å; Q95-P99 WeakPolarHBondContact O-CD 3.07Å; Q95-P99 WeakPolarHBondContact O-CG 3.47Å; Q95-F139 PolarHBondContact NE2-O 3.08Å; Q95-F139 VanDerWaalsContact NE2-O 3.09Å; Q95-P140 PolarHBondContact NE2-O 3.3Å; Q95-I142 HydrophobicContact CB-CD1 4.26Å; Q95-I142 VanDerWaalsContact OE1-N 3.07Å; Q95-Y151 WeakPolarHBondContact CA-OH 3.48Å; Q95-Y151 PolarHBondContact N-OH 3.01Å
96	Q	92.4	Very high	93.6	Very high	141 Å²	141	33.9 Å²	33.9	66%	0.659	15%	0.153	S	C	*	.	H	α-helix	trans	-81.9	-40.9	175.3	-69	173.9	3.2	0	0	112.8	R92 Y93 L94	R92-Q96 WeakPolarHBondContact O-CG 3.38Å; R92-Q96 PolarHBondContact O-N 3.16Å; R92-Q96 VanDerWaalsContact O-N 3.16Å; Y93-Q96 PolarHBondContact O-N 3.34Å; L94-Q96 PolarHBondContact O-N 2.85Å
97	E	92.9	Very high	94	Very high	12 Å²	12	36.8 Å²	36.8	6%	0.056	17%	0.165	C	C	.	.	H	α-helix	trans	-88.5	-37	-170.7	-84	-74.1	134.1	0	0	115.3	V68 Y93 L94 V100 R101	V68-E97 WeakPolarHBondContact CB-OE1 3.16Å; V68-E97 VanDerWaalsContact N-CD 3.34Å; V68-E97 PolarHBondContact N-OE1 2.85Å; V68-E97 PolarHBondContact N-OE2 3.49Å; Y93-E97 HydrophobicContact CD2-CG 4.21Å; Y93-E97 HydrophobicContact CE1-CG 4.28Å; Y93-E97 HydrophobicContact CE2-CG 3.58Å; Y93-E97 WeakPolarHBondContact O-CB 3.47Å; Y93-E97 PolarHBondContact O-N 3.44Å; L94-E97 PolarHBondContact O-N 2.91Å; E97-V100 PolarHBondContact O-N 3.09Å; E97-R101 WeakPolarHBondContact O-CG 3.3Å; E97-R101 PolarHBondContact O-N 3.01Å; E97-R101 IonicContact OE2-CZ 3.69Å; E97-R101 IonicContact OE2-NE 3.49Å; E97-R101 PolarHBondContact OE2-NE 3.31Å; E97-R101 IonicContact OE2-NH2 3.92Å; E97-R101 PolarHBondContact OE2-NH2 3.16Å
98	L	94.9	Very high	94.2	Very high	7 Å²	7	36.6 Å²	36.6	4%	0.037	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-44.2	-177.3	-65.1	-175.6	0	0	0	112.5	L94 V100 R101 I102 L136 I200	L94-L98 HydrophobicContact CB-CD1 4.17Å; L94-L98 HydrophobicContact CB-CG 4.29Å; L94-L98 HydrophobicContact CD2-CD1 4.19Å; L94-L98 HydrophobicContact CG-CD1 4.02Å; L94-L98 HydrophobicContact CG-CG 4.17Å; L94-L98 WeakPolarHBondContact O-CB 3.48Å; L94-L98 WeakPolarHBondContact O-CG 3.33Å; L94-L98 PolarHBondContact O-N 3.46Å; L98-V100 PolarHBondContact O-N 3.23Å; L98-R101 PolarHBondContact O-N 2.98Å; L98-I102 WeakPolarHBondContact O-CB 3.36Å; L98-I102 WeakPolarHBondContact O-CD1 3.36Å; L98-I102 WeakPolarHBondContact O-CG1 3.49Å; L98-I102 PolarHBondContact O-N 3.35Å; L98-L136 HydrophobicContact CB-CD1 3.91Å; L98-L136 HydrophobicContact CD1-CD2 4.38Å; L98-I200 HydrophobicContact CD2-CG2 4.1Å
99	P	96.1	Very high	94.3	Very high	15 Å²	15	35.6 Å²	35.6	10%	0.097	16%	0.163	C	C	.	.	H	α-helix	trans	-60	-42.4	175.5	-23.2	34	0	0	0	113.1	Q95 I102 A103 F133 L136	Q95-P99 VanDerWaalsContact O-CD 3.3Å; Q95-P99 WeakPolarHBondContact O-CD 3.07Å; Q95-P99 WeakPolarHBondContact O-CG 3.47Å; P99-I102 PolarHBondContact O-N 2.88Å; P99-A103 VanDerWaalsContact O-CB 3.3Å; P99-A103 WeakPolarHBondContact O-CB 3.46Å; P99-A103 PolarHBondContact O-N 2.86Å; P99-F133 HydrophobicContact CB-CD2 4.21Å; P99-F133 HydrophobicContact CB-CE2 3.92Å; P99-F133 WeakPolarHBondContact O-CD2 2.86Å; P99-F133 WeakPolarHBondContact O-CE2 3.02Å; P99-L136 HydrophobicContact CG-CB 4.12Å
100	V	95.3	Very high	94.4	Very high	9 Å²	9	32 Å²	32	6%	0.055	15%	0.145	C	C	.	.	H	α-helix	trans	-63.5	-50	179.7	173.9	0	0	0	0	110.9	K65 E97 L98 I102 A103 H104	K65-V100 HydrophobicContact CB-CG1 4.04Å; K65-V100 HydrophobicContact CB-CG2 4.02Å; K65-V100 HydrophobicContact CD-CG2 3.96Å; E97-V100 PolarHBondContact O-N 3.09Å; L98-V100 PolarHBondContact O-N 3.23Å; V100-I102 VanDerWaalsContact C-N 3.3Å; V100-I102 PolarHBondContact O-N 3.02Å; V100-A103 WeakPolarHBondContact O-CB 3.42Å; V100-A103 PolarHBondContact O-N 3.27Å; V100-H104 PolarHBondContact O-N 3.12Å
101	R	95.4	Very high	94.4	Very high	11 Å²	11	35.9 Å²	35.9	4%	0.042	17%	0.171	C	C	.	.	H	α-helix	trans	-63.4	-35.9	179.9	-67.1	171.9	178.2	-121	4.4	112	V68 E97 L98 R105 I200 I412	V68-R101 PolarHBondContact O-NH2 3.23Å; E97-R101 WeakPolarHBondContact O-CG 3.3Å; E97-R101 PolarHBondContact O-N 3.01Å; E97-R101 IonicContact OE2-CZ 3.69Å; E97-R101 IonicContact OE2-NE 3.49Å; E97-R101 PolarHBondContact OE2-NE 3.31Å; E97-R101 IonicContact OE2-NH2 3.92Å; E97-R101 PolarHBondContact OE2-NH2 3.16Å; L98-R101 PolarHBondContact O-N 2.98Å; R101-R105 PolarHBondContact O-N 3.41Å; R101-I200 HydrophobicContact CB-CD1 3.96Å; R101-I200 HydrophobicContact CB-CG1 3.94Å; R101-I412 PolarHBondContact NH1-O 3.11Å; R101-I412 PolarHBondContact NH1-OXT 3.45Å; R101-I412 PolarHBondContact NH2-O 2.97Å; R101-I412 PolarHBondContact NH2-OXT 3.3Å
102	I	96.3	Very high	94.3	Very high	10 Å²	10	36.6 Å²	36.6	5%	0.051	18%	0.175	C	C	.	.	H	α-helix	trans	-70.7	-41.7	174	-74.3	165.2	0	0	0	111.4	L98 P99 V100 H104 R105 I106 Y129 A132 F133 L136 I200	L98-I102 WeakPolarHBondContact O-CB 3.36Å; L98-I102 WeakPolarHBondContact O-CD1 3.36Å; L98-I102 WeakPolarHBondContact O-CG1 3.49Å; L98-I102 PolarHBondContact O-N 3.35Å; P99-I102 PolarHBondContact O-N 2.88Å; V100-I102 VanDerWaalsContact C-N 3.3Å; V100-I102 PolarHBondContact O-N 3.02Å; I102-H104 VanDerWaalsContact C-N 3.29Å; I102-H104 PolarHBondContact O-N 3.28Å; I102-R105 CarbonylContact O-C 3.44Å; I102-R105 WeakPolarHBondContact O-CA 3.35Å; I102-R105 WeakPolarHBondContact O-CB 3.36Å; I102-R105 PolarHBondContact O-N 3.14Å; I102-I106 HydrophobicContact CG2-CD1 3.94Å; I102-I106 HydrophobicContact CG2-CG1 4.34Å; I102-I106 WeakPolarHBondContact O-CG1 3.21Å; I102-I106 PolarHBondContact O-N 3.23Å; I102-Y129 HydrophobicContact CG1-CD1 4.39Å; I102-Y129 HydrophobicContact CG2-CD1 4.19Å; I102-Y129 WeakPolarHBondContact CG2-O 3.48Å; I102-A132 HydrophobicContact CD1-CB 4.11Å; I102-F133 HydrophobicContact CG2-CB 3.82Å; I102-F133 HydrophobicContact CG2-CD2 4.33Å; I102-L136 HydrophobicContact CD1-CD1 3.34Å; I102-I200 HydrophobicContact CG1-CD1 4.13Å
103	A	95.9	Very high	94.1	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.7	-39.4	175.6	0	0	0	0	0	111.9	I59 A62 A63 P99 V100 R105 I106 K107 F133	I59-A103 HydrophobicContact CG2-CB 4.43Å; A62-A103 HydrophobicContact CB-CB 3.7Å; A63-A103 HydrophobicContact CB-CB 3.95Å; P99-A103 VanDerWaalsContact O-CB 3.3Å; P99-A103 WeakPolarHBondContact O-CB 3.46Å; P99-A103 PolarHBondContact O-N 2.86Å; V100-A103 WeakPolarHBondContact O-CB 3.42Å; V100-A103 PolarHBondContact O-N 3.27Å; A103-R105 VanDerWaalsContact C-N 3.28Å; A103-R105 PolarHBondContact O-N 3.1Å; A103-I106 PolarHBondContact O-N 2.95Å; A103-K107 WeakPolarHBondContact O-CB 3.23Å; A103-K107 PolarHBondContact O-N 3.47Å; A103-F133 HydrophobicContact CB-CD2 4.17Å; A103-F133 HydrophobicContact CB-CE2 3.88Å
104	H	95.2	Very high	94	Very high	44 Å²	44	40.4 Å²	40.4	20%	0.204	20%	0.201	C	C	.	.	H	α-helix	trans	-61	-32.9	170.9	-62.6	159.6	0	0	0	113.3	A63 K65 V100 I102 G108	A63-H104 PolarHBondContact O-CD2 3.18Å; A63-H104 PolarHBondContact O-NE2 3.02Å; A63-H104 VanDerWaalsContact O-NE2 3.14Å; K65-H104 PolarHBondContact O-CE1 3.5Å; K65-H104 VanDerWaalsContact O-CE1 3.27Å; K65-H104 PolarHBondContact O-NE2 3.2Å; V100-H104 PolarHBondContact O-N 3.12Å; I102-H104 VanDerWaalsContact C-N 3.29Å; I102-H104 PolarHBondContact O-N 3.28Å; H104-G108 PolarHBondContact O-N 3.29Å; H104-G108 VanDerWaalsContact O-N 3.17Å
105	R	96.6	Very high	93.7	Very high	30 Å²	30	44.2 Å²	44.2	11%	0.113	22%	0.22	C	C	.	.	H	α-helix	trans	-72	-45.9	173.2	-67.8	-55.9	91	-142.7	-6.7	111.6	R101 I102 A103 K107 G108 F109 Y129 T193 S196	R101-R105 PolarHBondContact O-N 3.41Å; I102-R105 CarbonylContact O-C 3.44Å; I102-R105 WeakPolarHBondContact O-CA 3.35Å; I102-R105 WeakPolarHBondContact O-CB 3.36Å; I102-R105 PolarHBondContact O-N 3.14Å; A103-R105 VanDerWaalsContact C-N 3.28Å; A103-R105 PolarHBondContact O-N 3.1Å; R105-K107 VanDerWaalsContact C-N 3.32Å; R105-K107 PolarHBondContact O-N 3.4Å; R105-G108 CarbonylContact O-C 3.56Å; R105-G108 VanDerWaalsContact O-CA 3.29Å; R105-G108 WeakPolarHBondContact O-CA 3.37Å; R105-G108 PolarHBondContact O-N 2.68Å; R105-F109 VanDerWaalsContact O-CD2 3.27Å; R105-F109 WeakPolarHBondContact O-CD2 3.3Å; R105-F109 PolarHBondContact O-N 3.18Å; R105-Y129 HydrophobicContact CB-CD1 3.99Å; R105-Y129 HydrophobicContact CB-CE1 3.96Å; R105-Y129 HydrophobicContact CB-CG 4.42Å; R105-Y129 HydrophobicContact CG-CD1 4.47Å; R105-Y129 HydrophobicContact CG-CE1 3.98Å; R105-T193 PolarHBondContact NH1-OG1 2.82Å; R105-S196 WeakPolarHBondContact CD-OG 3.48Å; R105-S196 PolarHBondContact NE-OG 3.16Å
106	I	95.8	Very high	93.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-57.2	-46	176.3	-62.2	166.8	0	0	0	110.4	I59 I102 A103 G108 F109 R110 I130 F133	I59-I106 HydrophobicContact CD1-CD1 4.03Å; I59-I106 HydrophobicContact CD1-CG2 4.47Å; I59-I106 HydrophobicContact CG1-CD1 4.14Å; I59-I106 HydrophobicContact CG2-CB 4.11Å; I59-I106 HydrophobicContact CG2-CD1 4.21Å; I59-I106 HydrophobicContact CG2-CG2 3.83Å; I102-I106 HydrophobicContact CG2-CD1 3.94Å; I102-I106 HydrophobicContact CG2-CG1 4.34Å; I102-I106 WeakPolarHBondContact O-CG1 3.21Å; I102-I106 PolarHBondContact O-N 3.23Å; A103-I106 PolarHBondContact O-N 2.95Å; I106-G108 VanDerWaalsContact C-N 3.26Å; I106-G108 PolarHBondContact O-N 2.72Å; I106-F109 PolarHBondContact O-N 3Å; I106-F109 VanDerWaalsContact O-N 3.1Å; I106-R110 WeakPolarHBondContact O-CG 3.26Å; I106-R110 PolarHBondContact O-N 3.44Å; I106-I130 HydrophobicContact CD1-CG1 4.08Å; I106-I130 HydrophobicContact CG1-CG1 4.25Å; I106-I130 HydrophobicContact CG2-CG1 4.09Å; I106-F133 HydrophobicContact CD1-CB 3.79Å; I106-F133 HydrophobicContact CD1-CG 4.23Å
107	K	94.4	Very high	93.3	Very high	92 Å²	92	37 Å²	37	40%	0.4	19%	0.193	S	C	.	.	H	α-helix	trans	-57.7	-39.4	173.1	-171.7	167	-177.3	168.3	0	111.9	A63 A103 R105 R110 C111	A63-K107 HydrophobicContact CB-CB 4.3Å; A63-K107 HydrophobicContact CB-CD 3.93Å; A103-K107 WeakPolarHBondContact O-CB 3.23Å; A103-K107 PolarHBondContact O-N 3.47Å; R105-K107 VanDerWaalsContact C-N 3.32Å; R105-K107 PolarHBondContact O-N 3.4Å; K107-R110 PolarHBondContact O-N 2.98Å; K107-C111 PolarHBondContact O-N 3.47Å; K107-C111 VanDerWaalsContact O-N 3.09Å; K107-C111 PolarHBondContact O-SG 2.9Å
108	G	93.9	Very high	93.1	Very high	17 Å²	17	39.6 Å²	39.6	18%	0.175	21%	0.211	C	C	.	.	H	α-helix	trans	-58.5	-44.7	171.9	0	0	0	0	0	114	H104 R105 I106 C111 L112	H104-G108 PolarHBondContact O-N 3.29Å; H104-G108 VanDerWaalsContact O-N 3.17Å; R105-G108 CarbonylContact O-C 3.56Å; R105-G108 VanDerWaalsContact O-CA 3.29Å; R105-G108 WeakPolarHBondContact O-CA 3.37Å; R105-G108 PolarHBondContact O-N 2.68Å; I106-G108 VanDerWaalsContact C-N 3.26Å; I106-G108 PolarHBondContact O-N 2.72Å; G108-C111 PolarHBondContact O-N 2.85Å; G108-L112 PolarHBondContact O-N 2.96Å
109	F	94.2	Very high	93	Very high	8 Å²	8	39.9 Å²	39.9	4%	0.035	21%	0.213	C	C	.	.	H	α-helix	trans	-65	-40.2	174.4	-77.6	-84.7	0	0	0	112.3	R105 I106 C111 L112 I122 V125 H126 Y129 L169 F189	R105-F109 VanDerWaalsContact O-CD2 3.27Å; R105-F109 WeakPolarHBondContact O-CD2 3.3Å; R105-F109 PolarHBondContact O-N 3.18Å; I106-F109 PolarHBondContact O-N 3Å; I106-F109 VanDerWaalsContact O-N 3.1Å; F109-C111 PolarHBondContact O-N 2.64Å; F109-L112 HydrophobicContact CD1-CD1 3.96Å; F109-L112 WeakPolarHBondContact O-CB 3.41Å; F109-L112 PolarHBondContact O-N 2.89Å; F109-L112 VanDerWaalsContact O-N 3.17Å; F109-I122 HydrophobicContact CD1-CG2 4.06Å; F109-I122 HydrophobicContact CE1-CG2 4.12Å; F109-V125 HydrophobicContact CE1-CB 4.29Å; F109-V125 HydrophobicContact CE1-CG1 4.04Å; F109-V125 HydrophobicContact CE2-CG1 4.37Å; F109-V125 HydrophobicContact CZ-CB 4.25Å; F109-V125 HydrophobicContact CZ-CG1 3.51Å; F109-H126 HydrophobicContact CB-CB 4.11Å; F109-H126 VanDerWaalsContact CB-CD2 3.49Å; F109-H126 WeakPolarHBondContact CB-CD2 3.43Å; F109-H126 HydrophobicContact CD1-CB 3.86Å; F109-H126 HydrophobicContact CE1-CB 4.46Å; F109-H126 HydrophobicContact CG-CB 3.94Å; F109-Y129 HydrophobicContact CD2-CD2 4.25Å; F109-Y129 AromaticContact CE2-CD2 3.45Å; F109-Y129 HydrophobicContact CE2-CD2 3.45Å; F109-Y129 VanDerWaalsContact CE2-CD2 3.45Å; F109-Y129 AromaticContact CE2-CE2 3.58Å; F109-Y129 HydrophobicContact CE2-CE2 3.58Å; F109-Y129 HydrophobicContact CE2-CG 4.4Å; F109-Y129 HydrophobicContact CZ-CD2 4.05Å; F109-Y129 AromaticContact CZ-CE2 3.98Å; F109-Y129 HydrophobicContact CZ-CE2 3.98Å; F109-L169 HydrophobicContact CE1-CD2 3.95Å; F109-L169 HydrophobicContact CZ-CD2 3.98Å; F109-F189 HydrophobicContact CD1-CE2 4.42Å; F109-F189 HydrophobicContact CD1-CZ 4.03Å; F109-F189 AromaticContact CE1-CZ 3.74Å; F109-F189 HydrophobicContact CE1-CZ 3.74Å; F109-F189 HydrophobicContact CE2-CZ 4.3Å; F109-F189 HydrophobicContact CG-CE2 4.44Å; F109-F189 HydrophobicContact CG-CZ 4.43Å; F109-F189 AromaticContact CZ-CZ 3.87Å; F109-F189 HydrophobicContact CZ-CZ 3.87Å
110	R	92.7	Very high	92.9	Very high	81 Å²	81	43.9 Å²	43.9	31%	0.306	24%	0.238	S	C	.	.	H	α-helix	trans	-64.2	-22.9	176.1	-67.6	176.7	-178.1	-178.3	-1.6	113.5	D60 I106 K107	D60-R110 VanDerWaalsContact CG-NH1 3.28Å; D60-R110 IonicContact OD1-NH1 3.33Å; D60-R110 PolarHBondContact OD1-NH1 3.23Å; D60-R110 IonicContact OD2-NH1 2.87Å; D60-R110 PolarHBondContact OD2-NH1 3.47Å; D60-R110 VanDerWaalsContact OD2-NH1 3.14Å; I106-R110 WeakPolarHBondContact O-CG 3.26Å; I106-R110 PolarHBondContact O-N 3.44Å; K107-R110 PolarHBondContact O-N 2.98Å
111	C	91.5	Very high	92.8	Very high	95 Å²	95	45 Å²	45	64%	0.642	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	1.8	176.4	-66.4	0	0	0	0	114.2	K107 G108 F109	K107-C111 PolarHBondContact O-N 3.47Å; K107-C111 VanDerWaalsContact O-N 3.09Å; K107-C111 PolarHBondContact O-SG 2.9Å; G108-C111 PolarHBondContact O-N 2.85Å; F109-C111 PolarHBondContact O-N 2.64Å
112	L	91.4	Very high	92.8	Very high	15 Å²	15	44.5 Å²	44.5	8%	0.079	24%	0.244	C	C	.	.	S	Bend	trans	-68.5	145.8	173	-74.5	171.8	0	0	0	110.9	G108 F109 F114 I116 I122 L185 F189	G108-L112 PolarHBondContact O-N 2.96Å; F109-L112 HydrophobicContact CD1-CD1 3.96Å; F109-L112 WeakPolarHBondContact O-CB 3.41Å; F109-L112 PolarHBondContact O-N 2.89Å; F109-L112 VanDerWaalsContact O-N 3.17Å; L112-F114 PolarHBondContact O-N 3.25Å; L112-I116 HydrophobicContact CD1-CG2 4.24Å; L112-I116 HydrophobicContact CD2-CG2 4.45Å; L112-I122 HydrophobicContact CD1-CG2 3.87Å; L112-L185 HydrophobicContact CD2-CD2 4.23Å; L112-F189 HydrophobicContact CD1-CD2 4.45Å; L112-F189 HydrophobicContact CD1-CE1 4.33Å; L112-F189 HydrophobicContact CD1-CE2 3.96Å; L112-F189 HydrophobicContact CD1-CZ 3.9Å; L112-F189 HydrophobicContact CD2-CB 4.22Å; L112-F189 HydrophobicContact CD2-CD1 4.04Å; L112-F189 HydrophobicContact CD2-CD2 3.71Å; L112-F189 HydrophobicContact CD2-CE1 4.37Å; L112-F189 HydrophobicContact CD2-CE2 4.07Å; L112-F189 HydrophobicContact CD2-CG 3.7Å; L112-F189 HydrophobicContact CD2-CZ 4.39Å; L112-F189 HydrophobicContact CG-CD2 4.1Å; L112-F189 HydrophobicContact CG-CE2 4.04Å; L112-F189 HydrophobicContact CG-CZ 4.43Å
113	P	91.2	Very high	92.7	Very high	48 Å²	48	47.6 Å²	47.6	31%	0.312	26%	0.26	S	S	.	.			trans	-46.5	134.2	165.2	-29.4	33	0	0	0	111.7	I115 I116 G117 L185	P113-I115 VanDerWaalsContact C-N 3.26Å; P113-I115 PolarHBondContact O-N 3.25Å; P113-I115 VanDerWaalsContact O-N 3.13Å; P113-I116 HydrophobicContact CB-CD1 4.01Å; P113-I116 HydrophobicContact CB-CG1 4.18Å; P113-I116 HydrophobicContact CG-CD1 3.87Å; P113-I116 WeakPolarHBondContact O-CA 3.3Å; P113-I116 WeakPolarHBondContact O-CB 3.38Å; P113-I116 PolarHBondContact O-N 2.96Å; P113-G117 PolarHBondContact O-N 2.8Å; P113-L185 HydrophobicContact CG-CD1 3.82Å; P113-L185 HydrophobicContact CG-CD2 3.98Å
114	F	88.6	Confident	92.6	Very high	177 Å²	177	51.4 Å²	51.4	78%	0.776	28%	0.278	S	S	*	.	H	α-helix	trans	-51.5	-42.7	-172	-179.5	-100	0	0	0	113.1	L112 I116 G117 C118	L112-F114 PolarHBondContact O-N 3.25Å; F114-I116 PolarHBondContact O-N 3.12Å; F114-G117 PolarHBondContact O-N 2.97Å; F114-G117 VanDerWaalsContact O-N 3.16Å; F114-C118 WeakPolarHBondContact CZ-SG 3.39Å; F114-C118 WeakPolarHBondContact O-CB 3.43Å; F114-C118 PolarHBondContact O-N 2.99Å; F114-C118 PolarHBondContact O-SG 3.15Å; F114-C118 VanDerWaalsContact O-SG 3.4Å
115	I	88.8	Confident	92.6	Very high	83 Å²	83	49.3 Å²	49.3	43%	0.426	27%	0.268	S	S	.	.	H	α-helix	trans	-64.5	-23.3	178.5	-166.3	150.1	0	0	0	114.3	P113 H179	P113-I115 VanDerWaalsContact C-N 3.26Å; P113-I115 PolarHBondContact O-N 3.25Å; P113-I115 VanDerWaalsContact O-N 3.13Å; I115-H179 HydrophobicContact CD1-CB 3.59Å; I115-H179 HydrophobicContact CG1-CB 3.97Å; I115-H179 HydrophobicContact CG2-CB 4.12Å
116	I	89.3	Confident	92.6	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-84.1	-45.8	171.3	-54.2	175	0	0	0	109.8	L112 P113 F114 C118 N119 I122 L173 I180 V186	L112-I116 HydrophobicContact CD1-CG2 4.24Å; L112-I116 HydrophobicContact CD2-CG2 4.45Å; P113-I116 HydrophobicContact CB-CD1 4.01Å; P113-I116 HydrophobicContact CB-CG1 4.18Å; P113-I116 HydrophobicContact CG-CD1 3.87Å; P113-I116 WeakPolarHBondContact O-CA 3.3Å; P113-I116 WeakPolarHBondContact O-CB 3.38Å; P113-I116 PolarHBondContact O-N 2.96Å; F114-I116 PolarHBondContact O-N 3.12Å; I116-C118 PolarHBondContact O-N 3.31Å; I116-N119 WeakPolarHBondContact O-CB 3.26Å; I116-N119 PolarHBondContact O-N 2.73Å; I116-I122 HydrophobicContact CG2-CG1 4.42Å; I116-L173 HydrophobicContact CG2-CD2 3.5Å; I116-I180 HydrophobicContact CD1-CD1 3.52Å; I116-I180 HydrophobicContact CD1-CG1 3.8Å; I116-I180 HydrophobicContact CG1-CD1 3.95Å; I116-I180 HydrophobicContact CG1-CG1 4.05Å; I116-V186 HydrophobicContact CD1-CG2 4.29Å
117	G	88.4	Confident	92.5	Very high	23 Å²	23	53.2 Å²	53.2	24%	0.237	29%	0.287	C	S	.	.	H	α-helix	trans	-61.8	-27.6	-180	0	0	0	0	0	114.1	P113 F114	P113-G117 PolarHBondContact O-N 2.8Å; F114-G117 PolarHBondContact O-N 2.97Å; F114-G117 VanDerWaalsContact O-N 3.16Å
118	C	90.1	Very high	92.6	Very high	65 Å²	65	49.8 Å²	49.8	44%	0.439	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-4.9	175.1	-70.6	0	0	0	0	114.8	F114 I116	F114-C118 WeakPolarHBondContact CZ-SG 3.39Å; F114-C118 WeakPolarHBondContact O-CB 3.43Å; F114-C118 PolarHBondContact O-N 2.99Å; F114-C118 PolarHBondContact O-SG 3.15Å; F114-C118 VanDerWaalsContact O-SG 3.4Å; I116-C118 PolarHBondContact O-N 3.31Å
119	N	92.8	Very high	92.7	Very high	13 Å²	13	49.3 Å²	49.3	7%	0.07	27%	0.266	C	S	.	.	S	Bend	trans	-63.4	128.9	172.4	174.2	-84.8	0	0	0	109.5	I116 T121 I122 L123 G172 E175	I116-N119 WeakPolarHBondContact O-CB 3.26Å; I116-N119 PolarHBondContact O-N 2.73Å; N119-T121 VanDerWaalsContact C-N 3.25Å; N119-T121 PolarHBondContact O-N 2.92Å; N119-T121 WeakPolarHBondContact OD1-CA 3.32Å; N119-T121 VanDerWaalsContact OD1-CB 3.27Å; N119-T121 WeakPolarHBondContact OD1-CB 3.5Å; N119-T121 PolarHBondContact OD1-N 2.82Å; N119-I122 HydrophobicContact CB-CB 4.12Å; N119-I122 HydrophobicContact CB-CG1 3.89Å; N119-I122 PolarHBondContact O-N 2.91Å; N119-I122 VanDerWaalsContact O-N 3.12Å; N119-I122 PolarHBondContact OD1-N 3.05Å; N119-I122 VanDerWaalsContact OD1-N 3.11Å; N119-L123 WeakPolarHBondContact O-CB 3.36Å; N119-L123 PolarHBondContact O-N 3.07Å; N119-G172 VanDerWaalsContact OD1-CA 3.3Å; N119-G172 WeakPolarHBondContact OD1-CA 3.3Å; N119-E175 PolarHBondContact ND2-OE2 3.34Å
120	P	93.6	Very high	92.8	Very high	99 Å²	99	50.9 Å²	50.9	64%	0.643	27%	0.274	S	S	*	.	H	α-helix	trans	-56.5	-36.2	-174.9	-28.1	35.7	0	0	0	114.2	H124	P120-H124 WeakPolarHBondContact O-CB 3.34Å; P120-H124 PolarHBondContact O-N 3.42Å
121	T	93.9	Very high	92.9	Very high	32 Å²	32	52.8 Å²	52.8	20%	0.196	28%	0.282	C	S	.	.	H	α-helix	trans	-72.6	-40.8	179.7	-48.6	0	0	0	0	111.3	N119 H124 V125 L168	N119-T121 VanDerWaalsContact C-N 3.25Å; N119-T121 PolarHBondContact O-N 2.92Å; N119-T121 WeakPolarHBondContact OD1-CA 3.32Å; N119-T121 VanDerWaalsContact OD1-CB 3.27Å; N119-T121 WeakPolarHBondContact OD1-CB 3.5Å; N119-T121 PolarHBondContact OD1-N 2.82Å; T121-H124 PolarHBondContact O-N 3.49Å; T121-V125 WeakPolarHBondContact O-CG2 3.17Å; T121-V125 PolarHBondContact O-N 3.04Å; T121-V125 VanDerWaalsContact O-N 3.08Å; T121-L168 HydrophobicContact CG2-CB 3.9Å; T121-L168 HydrophobicContact CG2-CD2 3.83Å; T121-L168 HydrophobicContact CG2-CG 4.49Å; T121-L168 WeakPolarHBondContact CG2-O 3.39Å
122	I	93.9	Very high	93.2	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-65.8	-41.9	173.7	-58.9	-56.2	0	0	0	111.2	F109 L112 I116 N119 H124 V125 H126 L169 L173	F109-I122 HydrophobicContact CD1-CG2 4.06Å; F109-I122 HydrophobicContact CE1-CG2 4.12Å; L112-I122 HydrophobicContact CD1-CG2 3.87Å; I116-I122 HydrophobicContact CG2-CG1 4.42Å; N119-I122 HydrophobicContact CB-CB 4.12Å; N119-I122 HydrophobicContact CB-CG1 3.89Å; N119-I122 PolarHBondContact O-N 2.91Å; N119-I122 VanDerWaalsContact O-N 3.12Å; N119-I122 PolarHBondContact OD1-N 3.05Å; N119-I122 VanDerWaalsContact OD1-N 3.11Å; I122-H124 VanDerWaalsContact C-N 3.35Å; I122-V125 PolarHBondContact O-N 3.01Å; I122-H126 WeakPolarHBondContact O-CB 3.49Å; I122-H126 PolarHBondContact O-N 2.99Å; I122-L169 HydrophobicContact CD1-CD2 3.94Å; I122-L173 HydrophobicContact CD1-CD2 4.23Å; I122-L173 HydrophobicContact CD1-CG 3.93Å
123	L	93.7	Very high	93.4	Very high	75 Å²	75	47.8 Å²	47.8	39%	0.393	25%	0.249	S	C	.	.	H	α-helix	trans	-64.3	-39.4	176.2	-171	136.4	0	0	0	111.6	N119 H126 E127	N119-L123 WeakPolarHBondContact O-CB 3.36Å; N119-L123 PolarHBondContact O-N 3.07Å; L123-H126 WeakPolarHBondContact O-CB 3.15Å; L123-H126 PolarHBondContact O-N 3.48Å; L123-E127 HydrophobicContact CD2-CG 4.48Å; L123-E127 PolarHBondContact O-N 3.03Å
124	H	94.3	Very high	93.6	Very high	81 Å²	81	47.6 Å²	47.6	38%	0.375	24%	0.244	S	C	.	.	H	α-helix	trans	-60.1	-45.5	172.5	179.1	56.7	0	0	0	112.3	P120 T121 I122 H126 E127 L128	P120-H124 WeakPolarHBondContact O-CB 3.34Å; P120-H124 PolarHBondContact O-N 3.42Å; T121-H124 PolarHBondContact O-N 3.49Å; I122-H124 VanDerWaalsContact C-N 3.35Å; H124-H126 VanDerWaalsContact C-N 3.35Å; H124-H126 PolarHBondContact O-N 3.03Å; H124-E127 WeakPolarHBondContact O-CB 3.43Å; H124-E127 PolarHBondContact O-N 2.89Å; H124-L128 WeakPolarHBondContact O-CG 3.45Å; H124-L128 PolarHBondContact O-N 3.38Å
125	V	96.2	Very high	94	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.6	-39.3	175.8	178.6	0	0	0	0	111.5	F109 T121 I122 E127 L128 Y129 V165 L168 L169	F109-V125 HydrophobicContact CE1-CB 4.29Å; F109-V125 HydrophobicContact CE1-CG1 4.04Å; F109-V125 HydrophobicContact CE2-CG1 4.37Å; F109-V125 HydrophobicContact CZ-CB 4.25Å; F109-V125 HydrophobicContact CZ-CG1 3.51Å; T121-V125 WeakPolarHBondContact O-CG2 3.17Å; T121-V125 PolarHBondContact O-N 3.04Å; T121-V125 VanDerWaalsContact O-N 3.08Å; I122-V125 PolarHBondContact O-N 3.01Å; V125-E127 VanDerWaalsContact C-N 3.35Å; V125-E127 PolarHBondContact O-N 2.85Å; V125-L128 WeakPolarHBondContact O-CB 3.41Å; V125-L128 PolarHBondContact O-N 3Å; V125-Y129 HydrophobicContact CG1-CD2 4.05Å; V125-Y129 HydrophobicContact CG1-CE2 3.83Å; V125-Y129 WeakPolarHBondContact O-CD2 3.5Å; V125-Y129 PolarHBondContact O-N 2.86Å; V125-V165 HydrophobicContact CG1-CG1 3.84Å; V125-V165 HydrophobicContact CG1-CG2 4.37Å; V125-L168 HydrophobicContact CG2-CB 3.52Å; V125-L168 HydrophobicContact CG2-CD1 3.96Å; V125-L168 HydrophobicContact CG2-CG 4.39Å; V125-L169 HydrophobicContact CG1-CD2 4.22Å; V125-L169 HydrophobicContact CG1-CG 4.34Å
126	H	95.6	Very high	94.3	Very high	39 Å²	39	38.5 Å²	38.5	18%	0.181	20%	0.201	C	C	.	.	H	α-helix	trans	-60.3	-43.3	174.4	-179.2	-156	0	0	0	111.6	F109 I122 L123 H124 Y129 I130	F109-H126 HydrophobicContact CB-CB 4.11Å; F109-H126 VanDerWaalsContact CB-CD2 3.49Å; F109-H126 WeakPolarHBondContact CB-CD2 3.43Å; F109-H126 HydrophobicContact CD1-CB 3.86Å; F109-H126 HydrophobicContact CE1-CB 4.46Å; F109-H126 HydrophobicContact CG-CB 3.94Å; I122-H126 WeakPolarHBondContact O-CB 3.49Å; I122-H126 PolarHBondContact O-N 2.99Å; L123-H126 WeakPolarHBondContact O-CB 3.15Å; L123-H126 PolarHBondContact O-N 3.48Å; H124-H126 VanDerWaalsContact C-N 3.35Å; H124-H126 PolarHBondContact O-N 3.03Å; H126-Y129 PolarHBondContact O-N 2.84Å; H126-I130 WeakPolarHBondContact O-CG1 3.42Å; H126-I130 PolarHBondContact O-N 3.32Å; H126-I130 VanDerWaalsContact O-N 3.1Å
127	E	93.9	Very high	94.6	Very high	73 Å²	73	41.9 Å²	41.9	34%	0.341	22%	0.222	S	C	.	.	H	α-helix	trans	-62.1	-39.4	173	-76.5	-169.6	-156.4	0	0	113.1	L123 H124 V125 Y129 I130 R131	L123-E127 HydrophobicContact CD2-CG 4.48Å; L123-E127 PolarHBondContact O-N 3.03Å; H124-E127 WeakPolarHBondContact O-CB 3.43Å; H124-E127 PolarHBondContact O-N 2.89Å; V125-E127 VanDerWaalsContact C-N 3.35Å; V125-E127 PolarHBondContact O-N 2.85Å; E127-Y129 VanDerWaalsContact C-N 3.33Å; E127-Y129 PolarHBondContact O-N 3.46Å; E127-I130 PolarHBondContact O-N 2.9Å; E127-R131 WeakPolarHBondContact O-CB 3.4Å; E127-R131 VanDerWaalsContact O-CG 3.25Å; E127-R131 WeakPolarHBondContact O-CG 3.44Å; E127-R131 PolarHBondContact O-N 3.13Å; E127-R131 IonicContact OE2-CZ 3.37Å; E127-R131 IonicContact OE2-NE 3.56Å; E127-R131 IonicContact OE2-NH2 2.77Å; E127-R131 PolarHBondContact OE2-NH2 3.31Å
128	L	96.1	Very high	94.9	Very high	20 Å²	20	46.7 Å²	46.7	11%	0.105	24%	0.242	C	C	.	.	H	α-helix	trans	-58.4	-45.1	176.4	-71.7	175.1	0	0	0	111.3	H124 V125 R131 A132 H162 V165	H124-L128 WeakPolarHBondContact O-CG 3.45Å; H124-L128 PolarHBondContact O-N 3.38Å; V125-L128 WeakPolarHBondContact O-CB 3.41Å; V125-L128 PolarHBondContact O-N 3Å; L128-R131 PolarHBondContact O-N 3.48Å; L128-A132 WeakPolarHBondContact O-CB 3.23Å; L128-A132 PolarHBondContact O-N 3.35Å; L128-H162 PolarHBondContact O-NE2 3.44Å; L128-V165 HydrophobicContact CD1-CG2 4.33Å
129	Y	97.1	Very high	95.2	Very high	7 Å²	7	44.9 Å²	44.9	3%	0.027	23%	0.227	C	C	.	.	H	α-helix	trans	-64.8	-39.3	175.5	-79.3	-76.3	0	0	0	112.8	I102 R105 F109 V125 H126 E127 A132 F133 V165	I102-Y129 HydrophobicContact CG1-CD1 4.39Å; I102-Y129 HydrophobicContact CG2-CD1 4.19Å; I102-Y129 WeakPolarHBondContact CG2-O 3.48Å; R105-Y129 HydrophobicContact CB-CD1 3.99Å; R105-Y129 HydrophobicContact CB-CE1 3.96Å; R105-Y129 HydrophobicContact CB-CG 4.42Å; R105-Y129 HydrophobicContact CG-CD1 4.47Å; R105-Y129 HydrophobicContact CG-CE1 3.98Å; F109-Y129 HydrophobicContact CD2-CD2 4.25Å; F109-Y129 AromaticContact CE2-CD2 3.45Å; F109-Y129 HydrophobicContact CE2-CD2 3.45Å; F109-Y129 VanDerWaalsContact CE2-CD2 3.45Å; F109-Y129 AromaticContact CE2-CE2 3.58Å; F109-Y129 HydrophobicContact CE2-CE2 3.58Å; F109-Y129 HydrophobicContact CE2-CG 4.4Å; F109-Y129 HydrophobicContact CZ-CD2 4.05Å; F109-Y129 AromaticContact CZ-CE2 3.98Å; F109-Y129 HydrophobicContact CZ-CE2 3.98Å; V125-Y129 HydrophobicContact CG1-CD2 4.05Å; V125-Y129 HydrophobicContact CG1-CE2 3.83Å; V125-Y129 WeakPolarHBondContact O-CD2 3.5Å; V125-Y129 PolarHBondContact O-N 2.86Å; H126-Y129 PolarHBondContact O-N 2.84Å; E127-Y129 VanDerWaalsContact C-N 3.33Å; E127-Y129 PolarHBondContact O-N 3.46Å; Y129-A132 PolarHBondContact O-N 3.24Å; Y129-F133 PolarHBondContact O-N 3.31Å; Y129-V165 HydrophobicContact CE2-CG1 4.31Å
130	I	95.1	Very high	95.4	Very high	40 Å²	40	47.5 Å²	47.5	21%	0.205	25%	0.245	C	C	.	.	H	α-helix	trans	-62.4	-46.4	175	-68.2	166.9	0	0	0	110.8	I106 H126 E127 A132 F133 Q134	I106-I130 HydrophobicContact CD1-CG1 4.08Å; I106-I130 HydrophobicContact CG1-CG1 4.25Å; I106-I130 HydrophobicContact CG2-CG1 4.09Å; H126-I130 WeakPolarHBondContact O-CG1 3.42Å; H126-I130 PolarHBondContact O-N 3.32Å; H126-I130 VanDerWaalsContact O-N 3.1Å; E127-I130 PolarHBondContact O-N 2.9Å; I130-A132 VanDerWaalsContact C-N 3.3Å; I130-A132 PolarHBondContact O-N 2.97Å; I130-F133 WeakPolarHBondContact O-CB 2.98Å; I130-F133 PolarHBondContact O-N 3.17Å; I130-Q134 WeakPolarHBondContact O-CG 3.39Å; I130-Q134 PolarHBondContact O-N 3.34Å
131	R	95.6	Very high	95.6	Very high	121 Å²	121	47.2 Å²	47.2	46%	0.457	24%	0.243	S	C	.	.	H	α-helix	trans	-63.8	-35.8	177.3	-66.5	171.8	-164.2	-164.4	7.4	111.8	E127 L128 K135	E127-R131 WeakPolarHBondContact O-CB 3.4Å; E127-R131 VanDerWaalsContact O-CG 3.25Å; E127-R131 WeakPolarHBondContact O-CG 3.44Å; E127-R131 PolarHBondContact O-N 3.13Å; E127-R131 IonicContact OE2-CZ 3.37Å; E127-R131 IonicContact OE2-NE 3.56Å; E127-R131 IonicContact OE2-NH2 2.77Å; E127-R131 PolarHBondContact OE2-NH2 3.31Å; L128-R131 PolarHBondContact O-N 3.48Å; R131-K135 WeakPolarHBondContact O-CB 2.82Å; R131-K135 WeakPolarHBondContact O-CG 2.96Å; R131-K135 PolarHBondContact O-N 2.65Å
132	A	96.8	Very high	95.7	Very high	2 Å²	2	46 Å²	46	2%	0.017	24%	0.235	C	C	.	.	H	α-helix	trans	-64.5	-44.8	173.6	0	0	0	0	0	111.9	I102 L128 Y129 I130 K135 L136 L158	I102-A132 HydrophobicContact CD1-CB 4.11Å; L128-A132 WeakPolarHBondContact O-CB 3.23Å; L128-A132 PolarHBondContact O-N 3.35Å; Y129-A132 PolarHBondContact O-N 3.24Å; I130-A132 VanDerWaalsContact C-N 3.3Å; I130-A132 PolarHBondContact O-N 2.97Å; A132-K135 PolarHBondContact O-N 2.82Å; A132-L136 WeakPolarHBondContact O-CB 2.88Å; A132-L136 WeakPolarHBondContact O-CD1 3.1Å; A132-L136 VanDerWaalsContact O-CG 3.26Å; A132-L136 WeakPolarHBondContact O-CG 2.96Å; A132-L136 PolarHBondContact O-N 2.58Å; A132-L158 HydrophobicContact CB-CD2 3.79Å
133	F	97	Very high	95.7	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.018	27%	0.267	C	S	.	.	H	α-helix	trans	-59.5	-46.5	176.7	-176.5	-92.6	0	0	0	112.3	A58 I59 A62 P99 I102 A103 I106 Y129 I130 L136 T137	A58-F133 HydrophobicContact CB-CE1 4.25Å; I59-F133 HydrophobicContact CB-CE1 4.4Å; I59-F133 HydrophobicContact CD1-CD1 4.21Å; I59-F133 HydrophobicContact CG1-CD1 3.44Å; I59-F133 VanDerWaalsContact CG1-CD1 3.44Å; I59-F133 HydrophobicContact CG1-CD2 4.43Å; I59-F133 HydrophobicContact CG1-CE1 3.5Å; I59-F133 HydrophobicContact CG1-CE2 4.48Å; I59-F133 HydrophobicContact CG1-CG 3.94Å; I59-F133 HydrophobicContact CG1-CZ 4.04Å; A62-F133 HydrophobicContact CB-CE2 3.62Å; A62-F133 HydrophobicContact CB-CZ 3.73Å; P99-F133 HydrophobicContact CB-CD2 4.21Å; P99-F133 HydrophobicContact CB-CE2 3.92Å; P99-F133 WeakPolarHBondContact O-CD2 2.86Å; P99-F133 WeakPolarHBondContact O-CE2 3.02Å; I102-F133 HydrophobicContact CG2-CB 3.82Å; I102-F133 HydrophobicContact CG2-CD2 4.33Å; A103-F133 HydrophobicContact CB-CD2 4.17Å; A103-F133 HydrophobicContact CB-CE2 3.88Å; I106-F133 HydrophobicContact CD1-CB 3.79Å; I106-F133 HydrophobicContact CD1-CG 4.23Å; Y129-F133 PolarHBondContact O-N 3.31Å; I130-F133 WeakPolarHBondContact O-CB 2.98Å; I130-F133 PolarHBondContact O-N 3.17Å; F133-L136 PolarHBondContact O-N 3.19Å; F133-T137 WeakPolarHBondContact O-CB 2.96Å; F133-T137 PolarHBondContact O-N 3.23Å; F133-T137 PolarHBondContact O-OG1 2.97Å
134	Q	94.9	Very high	95.7	Very high	44 Å²	44	53.6 Å²	53.6	21%	0.206	27%	0.268	C	S	.	.	H	α-helix	trans	-56.3	-61.1	175.1	-73.2	167.6	-24.7	0	0	110.7	N55 I130 L136 T137 D138	N55-Q134 PolarHBondContact ND2-NE2 2.84Å; I130-Q134 WeakPolarHBondContact O-CG 3.39Å; I130-Q134 PolarHBondContact O-N 3.34Å; Q134-L136 PolarHBondContact O-N 2.87Å; Q134-L136 VanDerWaalsContact O-N 3.07Å; Q134-T137 PolarHBondContact O-N 3.41Å; Q134-D138 WeakPolarHBondContact O-CB 3.5Å; Q134-D138 PolarHBondContact O-N 3.43Å
135	K	96.3	Very high	95.6	Very high	65 Å²	65	53.6 Å²	53.6	28%	0.283	27%	0.269	S	S	.	.	H	α-helix	trans	-52.6	-36.7	-179.8	-72.2	176	176.1	-171.9	0	113.5	R131 A132 F139 L154 Q157 L158 D161	R131-K135 WeakPolarHBondContact O-CB 2.82Å; R131-K135 WeakPolarHBondContact O-CG 2.96Å; R131-K135 PolarHBondContact O-N 2.65Å; A132-K135 PolarHBondContact O-N 2.82Å; K135-F139 PolarHBondContact O-N 3.24Å; K135-L154 HydrophobicContact CB-CD1 3.77Å; K135-L154 HydrophobicContact CD-CD1 3.91Å; K135-L154 HydrophobicContact CG-CD1 4.34Å; K135-L154 WeakPolarHBondContact O-CD2 3.33Å; K135-Q157 VanDerWaalsContact NZ-NE2 3.13Å; K135-L158 HydrophobicContact CD-CD2 3.9Å; K135-D161 IonicContact NZ-OD2 3.99Å; K135-D161 PolarHBondContact NZ-OD2 3Å
136	L	96	Very high	95.6	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.016	29%	0.293	C	S	.	.	H	α-helix	trans	-78.2	-31.5	-180	-72.6	166.3	0	0	0	113.7	L98 P99 I102 A132 F133 Q134 Y151 L154 L158	L98-L136 HydrophobicContact CB-CD1 3.91Å; L98-L136 HydrophobicContact CD1-CD2 4.38Å; P99-L136 HydrophobicContact CG-CB 4.12Å; I102-L136 HydrophobicContact CD1-CD1 3.34Å; A132-L136 WeakPolarHBondContact O-CB 2.88Å; A132-L136 WeakPolarHBondContact O-CD1 3.1Å; A132-L136 VanDerWaalsContact O-CG 3.26Å; A132-L136 WeakPolarHBondContact O-CG 2.96Å; A132-L136 PolarHBondContact O-N 2.58Å; F133-L136 PolarHBondContact O-N 3.19Å; Q134-L136 PolarHBondContact O-N 2.87Å; Q134-L136 VanDerWaalsContact O-N 3.07Å; L136-Y151 HydrophobicContact CD2-CE2 3.96Å; L136-Y151 WeakPolarHBondContact CD2-OH 3.34Å; L136-L154 HydrophobicContact CD2-CD2 4.14Å; L136-L158 HydrophobicContact CD1-CD1 3.95Å; L136-L158 HydrophobicContact CD2-CD1 3.76Å; L136-L158 HydrophobicContact CG-CD1 3.69Å
137	T	95.1	Very high	95.6	Very high	72 Å²	72	56.1 Å²	56.1	44%	0.442	29%	0.292	S	S	.	.	H	α-helix	trans	-84.6	-32	-179.4	-56.4	0	0	0	0	111.6	F133 Q134 F139	F133-T137 WeakPolarHBondContact O-CB 2.96Å; F133-T137 PolarHBondContact O-N 3.23Å; F133-T137 PolarHBondContact O-OG1 2.97Å; Q134-T137 PolarHBondContact O-N 3.41Å; T137-F139 PolarHBondContact O-N 2.81Å
138	D	95.2	Very high	95.7	Very high	124 Å²	124	52.6 Å²	52.6	66%	0.663	28%	0.276	S	S	*	.	S	Bend	trans	-73	-16.3	173.5	-63.4	-24.7	0	0	0	112.4	Q134	Q134-D138 WeakPolarHBondContact O-CB 3.5Å; Q134-D138 PolarHBondContact O-N 3.43Å
139	F	96.9	Very high	95.7	Very high	27 Å²	27	54.9 Å²	54.9	12%	0.118	29%	0.29	C	S	.	.	S	Bend	trans	-72.4	126.4	179.3	-165.4	-82.1	0	0	0	111.1	Q95 K135 T137 I142 D147 Q150 Y151 L154	Q95-F139 PolarHBondContact NE2-O 3.08Å; Q95-F139 VanDerWaalsContact NE2-O 3.09Å; K135-F139 PolarHBondContact O-N 3.24Å; T137-F139 PolarHBondContact O-N 2.81Å; F139-I142 HydrophobicContact CD1-CG1 4.34Å; F139-I142 HydrophobicContact CE1-CD1 4.42Å; F139-I142 HydrophobicContact CE1-CG1 3.86Å; F139-D147 WeakPolarHBondContact CZ-O 3.42Å; F139-Q150 HydrophobicContact CE2-CB 4.07Å; F139-Q150 HydrophobicContact CZ-CB 3.95Å; F139-Y151 AromaticContact CD1-CD2 3.55Å; F139-Y151 HydrophobicContact CD1-CD2 3.55Å; F139-Y151 HydrophobicContact CD1-CE2 4.24Å; F139-Y151 HydrophobicContact CD1-CG 4.42Å; F139-Y151 HydrophobicContact CD2-CD2 4.12Å; F139-Y151 AromaticContact CE1-CD2 3.76Å; F139-Y151 HydrophobicContact CE1-CD2 3.76Å; F139-Y151 HydrophobicContact CE1-CG 4.22Å; F139-Y151 HydrophobicContact CE2-CD2 4.28Å; F139-Y151 AromaticContact CG-CD2 3.77Å; F139-Y151 HydrophobicContact CG-CD2 3.77Å; F139-Y151 HydrophobicContact CG-CE2 4.32Å; F139-Y151 HydrophobicContact CZ-CD2 4.13Å; F139-Y151 HydrophobicContact CZ-CG 4.44Å; F139-L154 HydrophobicContact CB-CD2 4.13Å; F139-L154 HydrophobicContact CD2-CD2 3.78Å; F139-L154 HydrophobicContact CG-CD2 4.19Å
140	P	96.6	Very high	95.7	Very high	69 Å²	69	59.7 Å²	59.7	45%	0.448	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-64.7	153	-173	26.9	-35.9	0	0	0	113.1	Q95 I142	Q95-P140 PolarHBondContact NE2-O 3.3Å; P140-I142 PolarHBondContact O-N 2.97Å
141	P	97	Very high	95.8	Very high	93 Å²	93	57.8 Å²	57.8	60%	0.604	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-56.6	123.5	179.2	-26.3	35.1	0	0	0	112.7	K143	P141-K143 PolarHBondContact O-N 2.98Å
142	I	96.1	Very high	95.9	Very high	5 Å²	5	52.2 Å²	52.2	3%	0.026	28%	0.283	C	S	.	.			trans	-69.7	111.8	-172.6	-62.5	165.8	0	0	0	110.9	L88 A91 R92 Q95 F139 P140 D147 D148 Y151	L88-I142 HydrophobicContact CD2-CG2 4.38Å; A91-I142 HydrophobicContact CB-CD1 3.79Å; A91-I142 HydrophobicContact CB-CG2 4.22Å; R92-I142 HydrophobicContact CG-CB 4.39Å; R92-I142 PolarHBondContact NE-O 3.45Å; R92-I142 PolarHBondContact NH2-O 3.42Å; Q95-I142 HydrophobicContact CB-CD1 4.26Å; Q95-I142 VanDerWaalsContact OE1-N 3.07Å; F139-I142 HydrophobicContact CD1-CG1 4.34Å; F139-I142 HydrophobicContact CE1-CD1 4.42Å; F139-I142 HydrophobicContact CE1-CG1 3.86Å; P140-I142 PolarHBondContact O-N 2.97Å; I142-D147 HydrophobicContact CB-CB 4.29Å; I142-D147 HydrophobicContact CG1-CB 4.37Å; I142-D147 HydrophobicContact CG2-CB 3.95Å; I142-D148 HydrophobicContact CG2-CB 4.18Å; I142-Y151 HydrophobicContact CD1-CD1 3.67Å; I142-Y151 HydrophobicContact CD1-CD2 3.97Å; I142-Y151 HydrophobicContact CD1-CE1 4.21Å; I142-Y151 HydrophobicContact CD1-CE2 4.47Å; I142-Y151 HydrophobicContact CD1-CG 3.53Å
143	K	94.5	Very high	96	Very high	156 Å²	156	58 Å²	58	68%	0.678	31%	0.309	S	S	*	.			trans	-100.8	-43.4	-179.1	-67.7	163.6	-167.9	171.3	0	111.9	R92 P141 D147	R92-K143 PolarHBondContact NH2-O 3.36Å; P141-K143 PolarHBondContact O-N 2.98Å; K143-D147 WeakPolarHBondContact CB-OD2 3.48Å; K143-D147 PolarHBondContact N-OD2 2.9Å
144	D	94.4	Very high	96	Very high	80 Å²	80	58.8 Å²	58.8	43%	0.428	31%	0.314	S	S	.	.	S	Bend	trans	-134.1	-175.8	-171.9	66.9	43	0	0	0	113.7	L88 A146 D147 D148	L88-D144 VanDerWaalsContact CD2-O 3.32Å; L88-D144 WeakPolarHBondContact CD2-O 3.47Å; D144-A146 VanDerWaalsContact C-N 3.3Å; D144-A146 PolarHBondContact O-N 2.82Å; D144-A146 WeakPolarHBondContact OD1-CA 3.3Å; D144-A146 VanDerWaalsContact OD1-CB 3.31Å; D144-A146 WeakPolarHBondContact OD1-CB 3.19Å; D144-A146 PolarHBondContact OD1-N 3.39Å; D144-D147 PolarHBondContact N-OD2 2.9Å; D144-D147 PolarHBondContact OD1-N 2.79Å; D144-D148 WeakPolarHBondContact O-CB 3.14Å; D144-D148 PolarHBondContact O-N 2.66Å; D144-D148 VanDerWaalsContact O-N 3.14Å
145	Q	92	Very high	96.2	Very high	81 Å²	81	56.8 Å²	56.8	38%	0.379	31%	0.305	S	S	.	.	H	α-helix	trans	-72.1	-20.2	-176.6	-169.2	54.4	58.4	0	0	113.5	D148 T149	Q145-D148 PolarHBondContact NE2-OD2 3.12Å; Q145-T149 WeakPolarHBondContact O-CB 3.21Å; Q145-T149 PolarHBondContact O-N 3.3Å; Q145-T149 VanDerWaalsContact O-N 3.07Å; Q145-T149 PolarHBondContact O-OG1 3.2Å
146	A	95.1	Very high	96.3	Very high	61 Å²	61	59.7 Å²	59.7	50%	0.504	31%	0.314	S	S	.	.	H	α-helix	trans	-77.3	-44	175.1	0	0	0	0	0	110.5	D144 D148 T149 Q150	D144-A146 VanDerWaalsContact C-N 3.3Å; D144-A146 PolarHBondContact O-N 2.82Å; D144-A146 WeakPolarHBondContact OD1-CA 3.3Å; D144-A146 VanDerWaalsContact OD1-CB 3.31Å; D144-A146 WeakPolarHBondContact OD1-CB 3.19Å; D144-A146 PolarHBondContact OD1-N 3.39Å; A146-D148 VanDerWaalsContact C-N 3.33Å; A146-D148 PolarHBondContact O-N 3.26Å; A146-T149 PolarHBondContact O-N 3.45Å; A146-Q150 PolarHBondContact O-N 3.31Å; A146-Q150 VanDerWaalsContact O-N 3.07Å
147	D	96.4	Very high	96.4	Very high	31 Å²	31	64 Å²	64	17%	0.166	33%	0.334	C	S	.	.	H	α-helix	trans	-55.5	-49.3	170.6	-68.5	-30.8	0	0	0	110.8	F139 I142 K143 D144 T149 Q150 Y151	F139-D147 WeakPolarHBondContact CZ-O 3.42Å; I142-D147 HydrophobicContact CB-CB 4.29Å; I142-D147 HydrophobicContact CG1-CB 4.37Å; I142-D147 HydrophobicContact CG2-CB 3.95Å; K143-D147 WeakPolarHBondContact CB-OD2 3.48Å; K143-D147 PolarHBondContact N-OD2 2.9Å; D144-D147 PolarHBondContact N-OD2 2.9Å; D144-D147 PolarHBondContact OD1-N 2.79Å; D147-T149 VanDerWaalsContact C-N 3.34Å; D147-T149 PolarHBondContact O-N 2.9Å; D147-Q150 PolarHBondContact O-N 3.31Å; D147-Y151 WeakPolarHBondContact O-CB 3.39Å; D147-Y151 PolarHBondContact O-N 3.39Å
148	D	95.1	Very high	96.5	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.6	-41.8	177.9	173.9	82.4	0	0	0	112.7	L88 A91 I142 D144 Q145 A146 Q150 Y151 C152 H207 H211	L88-D148 HydrophobicContact CD2-CB 3.89Å; A91-D148 WeakPolarHBondContact CB-OD1 3.39Å; I142-D148 HydrophobicContact CG2-CB 4.18Å; D144-D148 WeakPolarHBondContact O-CB 3.14Å; D144-D148 PolarHBondContact O-N 2.66Å; D144-D148 VanDerWaalsContact O-N 3.14Å; Q145-D148 PolarHBondContact NE2-OD2 3.12Å; A146-D148 VanDerWaalsContact C-N 3.33Å; A146-D148 PolarHBondContact O-N 3.26Å; D148-Q150 PolarHBondContact O-N 2.81Å; D148-Y151 PolarHBondContact O-N 3.46Å; D148-C152 WeakPolarHBondContact O-CB 3.39Å; D148-C152 PolarHBondContact O-N 3.25Å; D148-C152 PolarHBondContact O-SG 3.25Å; D148-C152 VanDerWaalsContact O-SG 3.38Å; D148-H207 IonicContact OD1-CE1 3.25Å; D148-H207 PolarHBondContact OD1-CE1 2.94Å; D148-H207 VanDerWaalsContact OD1-CE1 3.25Å; D148-H207 IonicContact OD1-NE2 3.67Å; D148-H211 IonicContact OD2-CE1 3.08Å; D148-H211 PolarHBondContact OD2-CE1 3.13Å; D148-H211 IonicContact OD2-NE2 3.72Å
149	T	96.1	Very high	96.5	Very high	67 Å²	67	56.8 Å²	56.8	41%	0.411	29%	0.292	S	S	.	.	H	α-helix	trans	-63.8	-40.8	176.7	-59.3	0	0	0	0	111.8	Q145 A146 D147 Q153	Q145-T149 WeakPolarHBondContact O-CB 3.21Å; Q145-T149 PolarHBondContact O-N 3.3Å; Q145-T149 VanDerWaalsContact O-N 3.07Å; Q145-T149 PolarHBondContact O-OG1 3.2Å; A146-T149 PolarHBondContact O-N 3.45Å; D147-T149 VanDerWaalsContact C-N 3.34Å; D147-T149 PolarHBondContact O-N 2.9Å; T149-Q153 WeakPolarHBondContact O-CG 3.31Å; T149-Q153 PolarHBondContact O-N 3.29Å
150	Q	97.6	Very high	96.5	Very high	108 Å²	108	59.6 Å²	59.6	51%	0.505	31%	0.309	S	S	.	.	H	α-helix	trans	-68.9	-39.4	174.6	-68.6	-176.6	6.3	0	0	111.7	F139 A146 D147 D148 C152 Q153 L154	F139-Q150 HydrophobicContact CE2-CB 4.07Å; F139-Q150 HydrophobicContact CZ-CB 3.95Å; A146-Q150 PolarHBondContact O-N 3.31Å; A146-Q150 VanDerWaalsContact O-N 3.07Å; D147-Q150 PolarHBondContact O-N 3.31Å; D148-Q150 PolarHBondContact O-N 2.81Å; Q150-C152 VanDerWaalsContact C-N 3.33Å; Q150-C152 PolarHBondContact O-N 2.83Å; Q150-Q153 WeakPolarHBondContact O-CB 3.44Å; Q150-Q153 PolarHBondContact O-N 2.96Å; Q150-L154 PolarHBondContact O-N 3.44Å; Q150-L154 VanDerWaalsContact O-N 3.08Å
151	Y	97.6	Very high	96.4	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.3	-41.4	176	-168.2	-110.9	0	0	0	111.5	L94 Q95 L136 F139 I142 D147 D148 Q153 L154 V155	L94-Y151 HydrophobicContact CB-CE1 3.95Å; L94-Y151 HydrophobicContact CD2-CE1 4.47Å; Q95-Y151 WeakPolarHBondContact CA-OH 3.48Å; Q95-Y151 PolarHBondContact N-OH 3.01Å; L136-Y151 HydrophobicContact CD2-CE2 3.96Å; L136-Y151 WeakPolarHBondContact CD2-OH 3.34Å; F139-Y151 AromaticContact CD1-CD2 3.55Å; F139-Y151 HydrophobicContact CD1-CD2 3.55Å; F139-Y151 HydrophobicContact CD1-CE2 4.24Å; F139-Y151 HydrophobicContact CD1-CG 4.42Å; F139-Y151 HydrophobicContact CD2-CD2 4.12Å; F139-Y151 AromaticContact CE1-CD2 3.76Å; F139-Y151 HydrophobicContact CE1-CD2 3.76Å; F139-Y151 HydrophobicContact CE1-CG 4.22Å; F139-Y151 HydrophobicContact CE2-CD2 4.28Å; F139-Y151 AromaticContact CG-CD2 3.77Å; F139-Y151 HydrophobicContact CG-CD2 3.77Å; F139-Y151 HydrophobicContact CG-CE2 4.32Å; F139-Y151 HydrophobicContact CZ-CD2 4.13Å; F139-Y151 HydrophobicContact CZ-CG 4.44Å; I142-Y151 HydrophobicContact CD1-CD1 3.67Å; I142-Y151 HydrophobicContact CD1-CD2 3.97Å; I142-Y151 HydrophobicContact CD1-CE1 4.21Å; I142-Y151 HydrophobicContact CD1-CE2 4.47Å; I142-Y151 HydrophobicContact CD1-CG 3.53Å; D147-Y151 WeakPolarHBondContact O-CB 3.39Å; D147-Y151 PolarHBondContact O-N 3.39Å; D148-Y151 PolarHBondContact O-N 3.46Å; Y151-Q153 VanDerWaalsContact C-N 3.26Å; Y151-Q153 PolarHBondContact O-N 3.4Å; Y151-L154 HydrophobicContact CD2-CD2 4.34Å; Y151-L154 HydrophobicContact CE2-CD2 4.34Å; Y151-L154 WeakPolarHBondContact O-CB 3.36Å; Y151-L154 PolarHBondContact O-N 2.76Å; Y151-L154 VanDerWaalsContact O-N 3.15Å; Y151-V155 HydrophobicContact CD1-CG2 3.96Å; Y151-V155 HydrophobicContact CE1-CG2 3.69Å; Y151-V155 WeakPolarHBondContact O-CG2 3.43Å; Y151-V155 PolarHBondContact O-N 2.77Å
152	C	97.8	Very high	96.3	Very high	4 Å²	4	55.7 Å²	55.7	3%	0.027	28%	0.278	C	S	.	.	H	α-helix	trans	-58.4	-33.6	171.7	-78.1	0	0	0	0	113.2	D148 Q150 R156 H207 L208	D148-C152 WeakPolarHBondContact O-CB 3.39Å; D148-C152 PolarHBondContact O-N 3.25Å; D148-C152 PolarHBondContact O-SG 3.25Å; D148-C152 VanDerWaalsContact O-SG 3.38Å; Q150-C152 VanDerWaalsContact C-N 3.33Å; Q150-C152 PolarHBondContact O-N 2.83Å; C152-R156 WeakPolarHBondContact O-CB 3.18Å; C152-R156 VanDerWaalsContact O-CG 3.29Å; C152-R156 WeakPolarHBondContact O-CG 3.4Å; C152-R156 PolarHBondContact O-N 3.5Å; C152-H207 PolarHBondContact SG-NE2 3.32Å; C152-L208 HydrophobicContact CB-CD2 3.73Å; C152-L208 WeakPolarHBondContact O-CD2 3.41Å
153	Q	98.1	Very high	96.2	Very high	124 Å²	124	60 Å²	60	58%	0.579	30%	0.297	S	S	*	.	H	α-helix	trans	-69.8	-44.4	174.3	-66.4	174.6	7.6	0	0	111.3	T149 Q150 Y151 R156 Q157	T149-Q153 WeakPolarHBondContact O-CG 3.31Å; T149-Q153 PolarHBondContact O-N 3.29Å; Q150-Q153 WeakPolarHBondContact O-CB 3.44Å; Q150-Q153 PolarHBondContact O-N 2.96Å; Y151-Q153 VanDerWaalsContact C-N 3.26Å; Y151-Q153 PolarHBondContact O-N 3.4Å; Q153-R156 PolarHBondContact O-N 3.17Å; Q153-Q157 PolarHBondContact O-N 3.47Å
154	L	98.2	Very high	96	Very high	20 Å²	20	56.8 Å²	56.8	11%	0.105	29%	0.287	C	S	.	.	H	α-helix	trans	-58.6	-47.4	173.8	170.3	60.1	0	0	0	111.6	K135 L136 F139 Q150 Y151 R156 Q157 L158	K135-L154 HydrophobicContact CB-CD1 3.77Å; K135-L154 HydrophobicContact CD-CD1 3.91Å; K135-L154 HydrophobicContact CG-CD1 4.34Å; K135-L154 WeakPolarHBondContact O-CD2 3.33Å; L136-L154 HydrophobicContact CD2-CD2 4.14Å; F139-L154 HydrophobicContact CB-CD2 4.13Å; F139-L154 HydrophobicContact CD2-CD2 3.78Å; F139-L154 HydrophobicContact CG-CD2 4.19Å; Q150-L154 PolarHBondContact O-N 3.44Å; Q150-L154 VanDerWaalsContact O-N 3.08Å; Y151-L154 HydrophobicContact CD2-CD2 4.34Å; Y151-L154 HydrophobicContact CE2-CD2 4.34Å; Y151-L154 WeakPolarHBondContact O-CB 3.36Å; Y151-L154 PolarHBondContact O-N 2.76Å; Y151-L154 VanDerWaalsContact O-N 3.15Å; L154-R156 VanDerWaalsContact C-N 3.35Å; L154-R156 PolarHBondContact O-N 3.44Å; L154-Q157 WeakPolarHBondContact O-CB 3.34Å; L154-Q157 PolarHBondContact O-N 3.37Å; L154-L158 HydrophobicContact CD1-CD1 3.93Å; L154-L158 HydrophobicContact CD1-CG 3.95Å; L154-L158 HydrophobicContact CG-CD1 4.1Å; L154-L158 WeakPolarHBondContact O-CG 3.31Å; L154-L158 PolarHBondContact O-N 3.5Å
155	V	97.7	Very high	96	Very high	3 Å²	3	53 Å²	53	2%	0.018	27%	0.267	C	S	.	.	H	α-helix	trans	-62.4	-40.9	179.1	174.6	0	0	0	0	111.3	Y151 L158 L159 A204 L208	Y151-V155 HydrophobicContact CD1-CG2 3.96Å; Y151-V155 HydrophobicContact CE1-CG2 3.69Å; Y151-V155 WeakPolarHBondContact O-CG2 3.43Å; Y151-V155 PolarHBondContact O-N 2.77Å; V155-L158 PolarHBondContact O-N 3.27Å; V155-L159 HydrophobicContact CG1-CD1 4.25Å; V155-L159 WeakPolarHBondContact O-CG 3.36Å; V155-L159 PolarHBondContact O-N 2.78Å; V155-A204 HydrophobicContact CG1-CB 3.66Å; V155-L208 HydrophobicContact CB-CD2 4.49Å; V155-L208 HydrophobicContact CG1-CD1 4.03Å; V155-L208 HydrophobicContact CG1-CD2 4.44Å; V155-L208 HydrophobicContact CG1-CG 4.16Å
156	R	98.2	Very high	96.1	Very high	126 Å²	126	50.8 Å²	50.8	48%	0.475	26%	0.259	S	S	.	.	H	α-helix	trans	-60.7	-45.1	172.7	-76.5	179.3	-171.1	105	-0.8	112	C152 Q153 L154 L159 D160 L208	C152-R156 WeakPolarHBondContact O-CB 3.18Å; C152-R156 VanDerWaalsContact O-CG 3.29Å; C152-R156 WeakPolarHBondContact O-CG 3.4Å; C152-R156 PolarHBondContact O-N 3.5Å; Q153-R156 PolarHBondContact O-N 3.17Å; L154-R156 VanDerWaalsContact C-N 3.35Å; L154-R156 PolarHBondContact O-N 3.44Å; R156-L159 PolarHBondContact O-N 3.37Å; R156-D160 PolarHBondContact O-N 3.27Å; R156-L208 HydrophobicContact CG-CD1 3.61Å; R156-L208 HydrophobicContact CG-CD2 3.93Å; R156-L208 HydrophobicContact CG-CG 4.43Å
157	Q	98.1	Very high	95.8	Very high	93 Å²	93	50.7 Å²	50.7	44%	0.435	25%	0.252	S	S	.	.	H	α-helix	trans	-59	-49.5	176.4	-170.5	-169.7	18.6	0	0	110.9	K135 Q153 L154 L159 D160 D161	K135-Q157 VanDerWaalsContact NZ-NE2 3.13Å; Q153-Q157 PolarHBondContact O-N 3.47Å; L154-Q157 WeakPolarHBondContact O-CB 3.34Å; L154-Q157 PolarHBondContact O-N 3.37Å; Q157-L159 VanDerWaalsContact C-N 3.29Å; Q157-L159 PolarHBondContact O-N 3.31Å; Q157-D160 PolarHBondContact O-N 3.17Å; Q157-D160 VanDerWaalsContact O-N 3.12Å; Q157-D161 WeakPolarHBondContact O-CB 3.31Å; Q157-D161 VanDerWaalsContact O-CG 3.3Å; Q157-D161 PolarHBondContact O-N 2.95Å
158	L	97.4	Very high	95.6	Very high	18 Å²	18	51 Å²	51	9%	0.094	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-35.7	-179.4	-69	175.9	0	0	0	112.8	A132 K135 L136 L154 V155 D160 H162	A132-L158 HydrophobicContact CB-CD2 3.79Å; K135-L158 HydrophobicContact CD-CD2 3.9Å; L136-L158 HydrophobicContact CD1-CD1 3.95Å; L136-L158 HydrophobicContact CD2-CD1 3.76Å; L136-L158 HydrophobicContact CG-CD1 3.69Å; L154-L158 HydrophobicContact CD1-CD1 3.93Å; L154-L158 HydrophobicContact CD1-CG 3.95Å; L154-L158 HydrophobicContact CG-CD1 4.1Å; L154-L158 WeakPolarHBondContact O-CG 3.31Å; L154-L158 PolarHBondContact O-N 3.5Å; V155-L158 PolarHBondContact O-N 3.27Å; L158-D160 VanDerWaalsContact C-N 3.33Å; L158-H162 WeakPolarHBondContact O-CB 3.48Å; L158-H162 PolarHBondContact O-N 3.47Å; L158-H162 VanDerWaalsContact O-N 3.15Å; L158-H162 PolarHBondContact O-ND1 3.44Å
159	L	96.3	Very high	95.6	Very high	27 Å²	27	51 Å²	51	14%	0.141	25%	0.253	C	S	.	.	H	α-helix	trans	-67.4	-30	176.3	-75.9	174.2	0	0	0	113.8	V155 R156 Q157 R201 A204 L208	V155-L159 HydrophobicContact CG1-CD1 4.25Å; V155-L159 WeakPolarHBondContact O-CG 3.36Å; V155-L159 PolarHBondContact O-N 2.78Å; R156-L159 PolarHBondContact O-N 3.37Å; Q157-L159 VanDerWaalsContact C-N 3.29Å; Q157-L159 PolarHBondContact O-N 3.31Å; L159-R201 HydrophobicContact CD2-CB 4.3Å; L159-R201 HydrophobicContact CD2-CG 3.81Å; L159-R201 PolarHBondContact O-NH1 2.89Å; L159-A204 HydrophobicContact CD1-CB 4.05Å; L159-A204 HydrophobicContact CD2-CB 3.99Å; L159-A204 HydrophobicContact CG-CB 4.22Å; L159-L208 HydrophobicContact CD1-CD1 3.65Å
160	D	96.1	Very high	95.3	Very high	86 Å²	86	47.9 Å²	47.9	46%	0.46	24%	0.235	S	C	.	.	H	α-helix	trans	-83.1	-48.4	174.4	-167.3	70.7	0	0	0	111.6	R156 Q157 L158 H162 K163	R156-D160 PolarHBondContact O-N 3.27Å; Q157-D160 PolarHBondContact O-N 3.17Å; Q157-D160 VanDerWaalsContact O-N 3.12Å; L158-D160 VanDerWaalsContact C-N 3.33Å; D160-H162 PolarHBondContact O-N 2.76Å; D160-K163 WeakPolarHBondContact O-CB 3.31Å; D160-K163 WeakPolarHBondContact O-CD 3.29Å; D160-K163 VanDerWaalsContact O-CG 3.26Å; D160-K163 WeakPolarHBondContact O-CG 3.34Å; D160-K163 PolarHBondContact O-N 3.46Å; D160-K163 VanDerWaalsContact OD1-CD 3.3Å; D160-K163 WeakPolarHBondContact OD1-CD 3.43Å; D160-K163 IonicContact OD1-NZ 2.68Å; D160-K163 PolarHBondContact OD1-NZ 3Å; D160-K163 IonicContact OD2-NZ 3.99Å; D160-K163 PolarHBondContact OD2-NZ 2.96Å
161	D	94.8	Very high	94.9	Very high	61 Å²	61	45.8 Å²	45.8	33%	0.326	23%	0.225	S	C	.	.	H	α-helix	trans	-49	-32.2	173.9	-74.6	-7.4	0	0	0	111.3	K135 Q157	K135-D161 IonicContact NZ-OD2 3.99Å; K135-D161 PolarHBondContact NZ-OD2 3Å; Q157-D161 WeakPolarHBondContact O-CB 3.31Å; Q157-D161 VanDerWaalsContact O-CG 3.3Å; Q157-D161 PolarHBondContact O-N 2.95Å
162	H	95.8	Very high	94.6	Very high	19 Å²	19	45.8 Å²	45.8	9%	0.088	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	10.6	-177.2	-66.5	68.1	0	0	0	114.8	L128 L158 D160 D164 V165 R197	L128-H162 PolarHBondContact O-NE2 3.44Å; L158-H162 WeakPolarHBondContact O-CB 3.48Å; L158-H162 PolarHBondContact O-N 3.47Å; L158-H162 VanDerWaalsContact O-N 3.15Å; L158-H162 PolarHBondContact O-ND1 3.44Å; D160-H162 PolarHBondContact O-N 2.76Å; H162-D164 PolarHBondContact O-N 3.29Å; H162-V165 HydrophobicContact CB-CG2 3.93Å; H162-V165 WeakPolarHBondContact O-CB 3.31Å; H162-V165 WeakPolarHBondContact O-CG2 3.27Å; H162-V165 PolarHBondContact O-N 3.44Å; H162-R197 PolarHBondContact O-NE 3.13Å; H162-R197 PolarHBondContact O-NH2 3.42Å
163	K	92.1	Very high	94.3	Very high	95 Å²	95	45.7 Å²	45.7	41%	0.413	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-41.4	-173.6	71.9	-160.6	163.1	-158.8	0	113.1	D160 R197	D160-K163 WeakPolarHBondContact O-CB 3.31Å; D160-K163 WeakPolarHBondContact O-CD 3.29Å; D160-K163 VanDerWaalsContact O-CG 3.26Å; D160-K163 WeakPolarHBondContact O-CG 3.34Å; D160-K163 PolarHBondContact O-N 3.46Å; D160-K163 VanDerWaalsContact OD1-CD 3.3Å; D160-K163 WeakPolarHBondContact OD1-CD 3.43Å; D160-K163 IonicContact OD1-NZ 2.68Å; D160-K163 PolarHBondContact OD1-NZ 3Å; D160-K163 IonicContact OD2-NZ 3.99Å; D160-K163 PolarHBondContact OD2-NZ 2.96Å; K163-R197 PolarHBondContact O-NH2 3.03Å
164	D	92.1	Very high	93.7	Very high	88 Å²	88	45.7 Å²	45.7	47%	0.471	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	3.3	-174.4	-57.7	-53.9	0	0	0	114.4	H162 V166 T167 L168	H162-D164 PolarHBondContact O-N 3.29Å; D164-V166 PolarHBondContact O-N 2.75Å; D164-T167 WeakPolarHBondContact O-CA 3.35Å; D164-T167 VanDerWaalsContact O-CB 3.31Å; D164-T167 WeakPolarHBondContact O-CB 3.28Å; D164-T167 PolarHBondContact O-N 3.45Å; D164-L168 PolarHBondContact O-N 3.47Å
165	V	93.9	Very high	93	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-53	-32.4	-177.7	164.4	0	0	0	0	113.9	V125 L128 Y129 H162 L169	V125-V165 HydrophobicContact CG1-CG1 3.84Å; V125-V165 HydrophobicContact CG1-CG2 4.37Å; L128-V165 HydrophobicContact CD1-CG2 4.33Å; Y129-V165 HydrophobicContact CE2-CG1 4.31Å; H162-V165 HydrophobicContact CB-CG2 3.93Å; H162-V165 WeakPolarHBondContact O-CB 3.31Å; H162-V165 WeakPolarHBondContact O-CG2 3.27Å; H162-V165 PolarHBondContact O-N 3.44Å; V165-L169 HydrophobicContact CG1-CD1 3.98Å; V165-L169 HydrophobicContact CG1-CG 4.35Å; V165-L169 WeakPolarHBondContact O-CB 3.31Å; V165-L169 WeakPolarHBondContact O-CG 3.48Å; V165-L169 PolarHBondContact O-N 2.82Å
166	V	92.7	Very high	92.3	Very high	34 Å²	34	49.9 Å²	49.9	21%	0.206	24%	0.238	C	C	.	.	H	α-helix	trans	-69.9	-40.3	177.8	-174.3	0	0	0	0	111.2	D164 A170 L194 F368	D164-V166 PolarHBondContact O-N 2.75Å; V166-A170 WeakPolarHBondContact O-CB 3.34Å; V166-A170 PolarHBondContact O-N 3.43Å; V166-L194 HydrophobicContact CB-CD2 4.34Å; V166-L194 HydrophobicContact CG1-CD2 3.96Å; V166-L194 HydrophobicContact CG2-CD2 3.8Å; V166-F368 HydrophobicContact CG1-CD1 4.12Å
167	T	90.5	Very high	91.2	Very high	60 Å²	60	48 Å²	48	37%	0.368	23%	0.231	S	C	.	.	H	α-helix	trans	-63.5	-50.7	175	-51.6	0	0	0	0	110.5	D164 L169 A170 E171 F366	D164-T167 WeakPolarHBondContact O-CA 3.35Å; D164-T167 VanDerWaalsContact O-CB 3.31Å; D164-T167 WeakPolarHBondContact O-CB 3.28Å; D164-T167 PolarHBondContact O-N 3.45Å; T167-L169 VanDerWaalsContact C-N 3.34Å; T167-L169 PolarHBondContact O-N 3.43Å; T167-A170 WeakPolarHBondContact O-CB 3.41Å; T167-A170 PolarHBondContact O-N 2.84Å; T167-E171 WeakPolarHBondContact O-CG 3.5Å; T167-E171 PolarHBondContact O-N 3.38Å; T167-F366 HydrophobicContact CG2-CE2 4.01Å; T167-F366 HydrophobicContact CG2-CZ 4.48Å
168	L	92.5	Very high	90.2	Very high	37 Å²	37	52.9 Å²	52.9	19%	0.194	25%	0.251	C	S	.	.	H	α-helix	trans	-59.9	-41.4	179.1	-64.7	169.6	0	0	0	112.3	T121 V125 D164 E171 G172	T121-L168 HydrophobicContact CG2-CB 3.9Å; T121-L168 HydrophobicContact CG2-CD2 3.83Å; T121-L168 HydrophobicContact CG2-CG 4.49Å; T121-L168 WeakPolarHBondContact CG2-O 3.39Å; V125-L168 HydrophobicContact CG2-CB 3.52Å; V125-L168 HydrophobicContact CG2-CD1 3.96Å; V125-L168 HydrophobicContact CG2-CG 4.39Å; D164-L168 PolarHBondContact O-N 3.47Å; L168-E171 PolarHBondContact O-N 3.2Å; L168-G172 PolarHBondContact O-N 3.36Å
169	L	93.5	Very high	89.4	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64.4	-41.4	173.6	-76.7	175.6	0	0	0	112.1	F109 I122 V125 V165 T167 L173 F189 L190 T193	F109-L169 HydrophobicContact CE1-CD2 3.95Å; F109-L169 HydrophobicContact CZ-CD2 3.98Å; I122-L169 HydrophobicContact CD1-CD2 3.94Å; V125-L169 HydrophobicContact CG1-CD2 4.22Å; V125-L169 HydrophobicContact CG1-CG 4.34Å; V165-L169 HydrophobicContact CG1-CD1 3.98Å; V165-L169 HydrophobicContact CG1-CG 4.35Å; V165-L169 WeakPolarHBondContact O-CB 3.31Å; V165-L169 WeakPolarHBondContact O-CG 3.48Å; V165-L169 PolarHBondContact O-N 2.82Å; T167-L169 VanDerWaalsContact C-N 3.34Å; T167-L169 PolarHBondContact O-N 3.43Å; L169-L173 VanDerWaalsContact O-CB 3.24Å; L169-L173 WeakPolarHBondContact O-CB 3.48Å; L169-L173 WeakPolarHBondContact O-CD1 3.33Å; L169-L173 VanDerWaalsContact O-CG 3.23Å; L169-L173 WeakPolarHBondContact O-CG 3.36Å; L169-L173 PolarHBondContact O-N 2.99Å; L169-L173 VanDerWaalsContact O-N 3.11Å; L169-F189 HydrophobicContact CD2-CE1 4.1Å; L169-F189 HydrophobicContact CD2-CZ 4.38Å; L169-L190 HydrophobicContact CB-CD2 4.39Å; L169-L190 HydrophobicContact CD1-CD2 4.47Å; L169-T193 HydrophobicContact CD1-CG2 3.98Å
170	A	90.6	Very high	88.4	Confident	2 Å²	2	57.3 Å²	57.3	2%	0.017	27%	0.271	C	S	.	.	H	α-helix	trans	-64.2	-42.4	177.2	0	0	0	0	0	111.8	V166 T167 R174 H332 F366 F368	V166-A170 WeakPolarHBondContact O-CB 3.34Å; V166-A170 PolarHBondContact O-N 3.43Å; T167-A170 WeakPolarHBondContact O-CB 3.41Å; T167-A170 PolarHBondContact O-N 2.84Å; A170-R174 VanDerWaalsContact O-CB 3.27Å; A170-R174 WeakPolarHBondContact O-CB 3.4Å; A170-R174 PolarHBondContact O-N 2.99Å; A170-R174 VanDerWaalsContact O-N 3.14Å; A170-H332 PolarHBondContact O-NE2 3.18Å; A170-F366 HydrophobicContact CB-CB 3.79Å; A170-F366 HydrophobicContact CB-CD1 4.5Å; A170-F366 HydrophobicContact CB-CD2 3.85Å; A170-F366 HydrophobicContact CB-CG 3.8Å; A170-F368 HydrophobicContact CB-CD1 4.33Å; A170-F368 HydrophobicContact CB-CD2 3.96Å; A170-F368 HydrophobicContact CB-CE1 3.97Å; A170-F368 HydrophobicContact CB-CE2 3.57Å; A170-F368 HydrophobicContact CB-CG 4.33Å; A170-F368 HydrophobicContact CB-CZ 3.58Å
171	E	89.9	Confident	87.5	Confident	63 Å²	63	62.9 Å²	62.9	29%	0.294	29%	0.294	S	S	.	.	H	α-helix	trans	-66.2	-55.4	178.4	-72.1	171.4	165.8	0	0	112.1	T167 L168 L173 R174 E175 F366	T167-E171 WeakPolarHBondContact O-CG 3.5Å; T167-E171 PolarHBondContact O-N 3.38Å; L168-E171 PolarHBondContact O-N 3.2Å; E171-L173 PolarHBondContact O-N 3.44Å; E171-R174 WeakPolarHBondContact O-CB 3.41Å; E171-R174 PolarHBondContact O-N 3.22Å; E171-R174 VanDerWaalsContact O-N 3.11Å; E171-E175 PolarHBondContact O-N 2.95Å; E171-F366 HydrophobicContact CG-CE1 3.65Å; E171-F366 HydrophobicContact CG-CE2 4.31Å; E171-F366 HydrophobicContact CG-CZ 3.53Å; E171-F366 WeakPolarHBondContact OE1-CZ 3.41Å
172	G	90.4	Very high	87	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.7	-39.2	-177.5	0	0	0	0	0	113.5	N119 L168 R174 E175 S176	N119-G172 VanDerWaalsContact OD1-CA 3.3Å; N119-G172 WeakPolarHBondContact OD1-CA 3.3Å; L168-G172 PolarHBondContact O-N 3.36Å; G172-R174 VanDerWaalsContact C-N 3.35Å; G172-E175 PolarHBondContact O-N 3.42Å; G172-S176 PolarHBondContact O-N 3.1Å; G172-S176 VanDerWaalsContact O-N 3.17Å
173	L	90.4	Very high	86.4	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-70.4	-30.2	175.9	-69.3	172.4	0	0	0	112.5	I116 I122 L169 E171 E175 S176 R177 V186 L190	I116-L173 HydrophobicContact CG2-CD2 3.5Å; I122-L173 HydrophobicContact CD1-CD2 4.23Å; I122-L173 HydrophobicContact CD1-CG 3.93Å; L169-L173 VanDerWaalsContact O-CB 3.24Å; L169-L173 WeakPolarHBondContact O-CB 3.48Å; L169-L173 WeakPolarHBondContact O-CD1 3.33Å; L169-L173 VanDerWaalsContact O-CG 3.23Å; L169-L173 WeakPolarHBondContact O-CG 3.36Å; L169-L173 PolarHBondContact O-N 2.99Å; L169-L173 VanDerWaalsContact O-N 3.11Å; E171-L173 PolarHBondContact O-N 3.44Å; L173-E175 VanDerWaalsContact C-N 3.35Å; L173-S176 PolarHBondContact O-N 3.37Å; L173-R177 WeakPolarHBondContact O-CB 3.29Å; L173-R177 PolarHBondContact O-N 2.89Å; L173-V186 HydrophobicContact CD1-CG1 4.03Å; L173-V186 HydrophobicContact CD2-CG1 4.29Å; L173-L190 HydrophobicContact CD1-CD1 3.69Å; L173-L190 HydrophobicContact CD1-CD2 3.57Å; L173-L190 HydrophobicContact CD1-CG 3.68Å
174	R	87.1	Confident	86.1	Confident	124 Å²	124	69.2 Å²	69.2	47%	0.468	33%	0.328	S	S	.	.	H	α-helix	trans	-64.8	-41.2	176.2	-176.3	179.7	61.4	170.4	-2.9	111.2	A170 E171 G172 R177 H332	A170-R174 VanDerWaalsContact O-CB 3.27Å; A170-R174 WeakPolarHBondContact O-CB 3.4Å; A170-R174 PolarHBondContact O-N 2.99Å; A170-R174 VanDerWaalsContact O-N 3.14Å; E171-R174 WeakPolarHBondContact O-CB 3.41Å; E171-R174 PolarHBondContact O-N 3.22Å; E171-R174 VanDerWaalsContact O-N 3.11Å; G172-R174 VanDerWaalsContact C-N 3.35Å; R174-R177 WeakPolarHBondContact O-CB 3.46Å; R174-H332 PolarHBondContact N-NE2 2.84Å
175	E	83.8	Confident	86	Confident	105 Å²	105	67.7 Å²	67.7	49%	0.491	32%	0.319	S	S	.	.	H	α-helix	trans	-66.8	-46	177.4	-68.1	172.6	176.2	0	0	111.6	N119 E171 G172 L173 R177	N119-E175 PolarHBondContact ND2-OE2 3.34Å; E171-E175 PolarHBondContact O-N 2.95Å; G172-E175 PolarHBondContact O-N 3.42Å; L173-E175 VanDerWaalsContact C-N 3.35Å; E175-R177 VanDerWaalsContact C-N 3.3Å; E175-R177 PolarHBondContact O-N 3.49Å
176	S	83.1	Confident	85.8	Confident	7 Å²	7	68.3 Å²	68.3	5%	0.049	32%	0.323	C	S	.	.	H	α-helix	trans	-70	-22.5	178.3	-67.5	0	0	0	0	113.8	G172 L173 K178 H179	G172-S176 PolarHBondContact O-N 3.1Å; G172-S176 VanDerWaalsContact O-N 3.17Å; L173-S176 PolarHBondContact O-N 3.37Å; S176-K178 PolarHBondContact O-N 2.99Å; S176-H179 PolarHBondContact O-N 3.22Å; S176-H179 PolarHBondContact O-ND1 3.35Å
177	R	74.8	Confident	85.8	Confident	86 Å²	86	68.5 Å²	68.5	33%	0.325	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-46.5	-37.3	-171.5	-168.8	177.1	-178	179.1	6.2	115.1	L173 R174 E175 H179 I180 E183	L173-R177 WeakPolarHBondContact O-CB 3.29Å; L173-R177 PolarHBondContact O-N 2.89Å; R174-R177 WeakPolarHBondContact O-CB 3.46Å; E175-R177 VanDerWaalsContact C-N 3.3Å; E175-R177 PolarHBondContact O-N 3.49Å; R177-H179 PolarHBondContact O-N 2.88Å; R177-I180 WeakPolarHBondContact O-CB 3.39Å; R177-I180 PolarHBondContact O-N 2.87Å; R177-I180 VanDerWaalsContact O-N 3.11Å; R177-E183 IonicContact CZ-OE1 3.23Å; R177-E183 VanDerWaalsContact CZ-OE1 3.23Å; R177-E183 IonicContact NE-OE1 2.93Å; R177-E183 PolarHBondContact NE-OE1 3.03Å; R177-E183 IonicContact NH2-OE1 2.81Å; R177-E183 PolarHBondContact NH2-OE1 3.42Å; R177-E183 IonicContact NH2-OE2 3.3Å
178	K	77.1	Confident	85.9	Confident	195 Å²	195	72.9 Å²	72.9	85%	0.848	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-61.2	-16.1	179.6	-64.1	-177.9	-179	178.3	0	114.6	S176	S176-K178 PolarHBondContact O-N 2.99Å
179	H	80.5	Confident	86	Confident	110 Å²	110	71.6 Å²	71.6	51%	0.509	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-114.7	16.4	-178	-44.1	92.3	0	0	0	112.1	I115 S176 R177	I115-H179 HydrophobicContact CD1-CB 3.59Å; I115-H179 HydrophobicContact CG1-CB 3.97Å; I115-H179 HydrophobicContact CG2-CB 4.12Å; S176-H179 PolarHBondContact O-N 3.22Å; S176-H179 PolarHBondContact O-ND1 3.35Å; R177-H179 PolarHBondContact O-N 2.88Å
180	I	75.7	Confident	86.1	Confident	28 Å²	28	71.6 Å²	71.6	14%	0.144	32%	0.324	C	S	.	.			trans	-106.1	108.3	-178.3	-54.6	-174.2	0	0	0	107.9	I116 R177 D182 V186	I116-I180 HydrophobicContact CD1-CD1 3.52Å; I116-I180 HydrophobicContact CD1-CG1 3.8Å; I116-I180 HydrophobicContact CG1-CD1 3.95Å; I116-I180 HydrophobicContact CG1-CG1 4.05Å; R177-I180 WeakPolarHBondContact O-CB 3.39Å; R177-I180 PolarHBondContact O-N 2.87Å; R177-I180 VanDerWaalsContact O-N 3.11Å; I180-D182 VanDerWaalsContact CG2-O 3.28Å; I180-D182 WeakPolarHBondContact CG2-O 3.37Å; I180-V186 HydrophobicContact CD1-CG2 3.54Å; I180-V186 HydrophobicContact CG1-CG2 4.5Å; I180-V186 HydrophobicContact CG2-CG2 3.57Å
181	E	76.4	Confident	86.4	Confident	204 Å²	204	73 Å²	73	95%	0.953	33%	0.331	S	S	*	.	S	Bend	trans	-81	-28.9	175.6	-62	177.7	175.2	0	0	111.7
182	D	83.4	Confident	86.6	Confident	81 Å²	81	74.3 Å²	74.3	43%	0.433	34%	0.335	S	S	.	.			trans	-110.3	94	179.6	-176.1	-5.5	0	0	0	111.4	I180 M184 L185	I180-D182 VanDerWaalsContact CG2-O 3.28Å; I180-D182 WeakPolarHBondContact CG2-O 3.37Å; D182-M184 VanDerWaalsContact C-N 3.25Å; D182-M184 PolarHBondContact O-N 2.78Å; D182-M184 WeakPolarHBondContact OD1-CA 3.17Å; D182-M184 VanDerWaalsContact OD1-CB 3.25Å; D182-M184 WeakPolarHBondContact OD1-CB 3.37Å; D182-M184 PolarHBondContact OD1-N 3.28Å; D182-L185 HydrophobicContact CB-CB 4.13Å; D182-L185 PolarHBondContact O-N 3.17Å; D182-L185 PolarHBondContact OD1-N 3.23Å
183	E	83.1	Confident	86.9	Confident	95 Å²	95	74.4 Å²	74.4	44%	0.444	34%	0.336	S	S	.	.	H	α-helix	trans	-68.2	-23.7	174	-63.3	-159.8	131.3	0	0	112.6	R177 V186 R187	R177-E183 IonicContact CZ-OE1 3.23Å; R177-E183 VanDerWaalsContact CZ-OE1 3.23Å; R177-E183 IonicContact NE-OE1 2.93Å; R177-E183 PolarHBondContact NE-OE1 3.03Å; R177-E183 IonicContact NH2-OE1 2.81Å; R177-E183 PolarHBondContact NH2-OE1 3.42Å; R177-E183 IonicContact NH2-OE2 3.3Å; E183-V186 PolarHBondContact O-N 2.66Å; E183-R187 WeakPolarHBondContact O-CB 3.48Å; E183-R187 PolarHBondContact O-N 3.3Å
184	M	87.7	Confident	87.1	Confident	132 Å²	132	74.3 Å²	74.3	65%	0.65	34%	0.335	S	S	*	.	H	α-helix	trans	-69.4	-33.4	177	-69	-66.2	-67	0	0	111.7	D182 R187 Y188	D182-M184 VanDerWaalsContact C-N 3.25Å; D182-M184 PolarHBondContact O-N 2.78Å; D182-M184 WeakPolarHBondContact OD1-CA 3.17Å; D182-M184 VanDerWaalsContact OD1-CB 3.25Å; D182-M184 WeakPolarHBondContact OD1-CB 3.37Å; D182-M184 PolarHBondContact OD1-N 3.28Å; M184-R187 PolarHBondContact O-N 3.06Å; M184-Y188 VanDerWaalsContact O-CB 3.31Å; M184-Y188 WeakPolarHBondContact O-CB 3.47Å; M184-Y188 PolarHBondContact O-N 3.39Å
185	L	89.1	Confident	87.4	Confident	56 Å²	56	69.2 Å²	69.2	29%	0.293	32%	0.318	S	S	.	.	H	α-helix	trans	-60.5	-48.7	171.8	-173.7	157.7	0	0	0	111.2	L112 P113 D182 R187 Y188 F189	L112-L185 HydrophobicContact CD2-CD2 4.23Å; P113-L185 HydrophobicContact CG-CD1 3.82Å; P113-L185 HydrophobicContact CG-CD2 3.98Å; D182-L185 HydrophobicContact CB-CB 4.13Å; D182-L185 PolarHBondContact O-N 3.17Å; D182-L185 PolarHBondContact OD1-N 3.23Å; L185-R187 VanDerWaalsContact C-N 3.35Å; L185-Y188 PolarHBondContact O-N 2.84Å; L185-F189 WeakPolarHBondContact O-CB 3.25Å; L185-F189 PolarHBondContact O-N 3.3Å
186	V	89.3	Confident	88	Confident	13 Å²	13	65.3 Å²	65.3	8%	0.079	30%	0.303	C	S	.	.	H	α-helix	trans	-62.8	-45.2	179.2	-179.9	0	0	0	0	110.7	I116 L173 I180 E183 F189 L190	I116-V186 HydrophobicContact CD1-CG2 4.29Å; L173-V186 HydrophobicContact CD1-CG1 4.03Å; L173-V186 HydrophobicContact CD2-CG1 4.29Å; I180-V186 HydrophobicContact CD1-CG2 3.54Å; I180-V186 HydrophobicContact CG1-CG2 4.5Å; I180-V186 HydrophobicContact CG2-CG2 3.57Å; E183-V186 PolarHBondContact O-N 2.66Å; V186-F189 PolarHBondContact O-N 2.79Å; V186-L190 HydrophobicContact CG1-CD1 4.05Å; V186-L190 HydrophobicContact CG1-CG 4.47Å; V186-L190 WeakPolarHBondContact O-CB 3.28Å; V186-L190 PolarHBondContact O-N 3.15Å
187	R	92.2	Very high	88.6	Confident	38 Å²	38	65.6 Å²	65.6	14%	0.143	30%	0.302	C	S	.	.	H	α-helix	trans	-54.9	-53.1	175.3	-177.9	-174.6	176.4	65.3	50	111.2	E183 M184 L185 F189 L190 D191 M329 D330 R374	E183-R187 WeakPolarHBondContact O-CB 3.48Å; E183-R187 PolarHBondContact O-N 3.3Å; M184-R187 PolarHBondContact O-N 3.06Å; L185-R187 VanDerWaalsContact C-N 3.35Å; R187-F189 PolarHBondContact O-N 3.37Å; R187-L190 PolarHBondContact O-N 2.86Å; R187-D191 IonicContact CZ-OD2 3.71Å; R187-D191 IonicContact NE-OD2 3.45Å; R187-D191 IonicContact NH2-OD1 2.9Å; R187-D191 IonicContact NH2-OD2 3.21Å; R187-D191 PolarHBondContact NH2-OD2 3.2Å; R187-D191 WeakPolarHBondContact O-CB 3.28Å; R187-D191 PolarHBondContact O-N 3.38Å; R187-M329 PolarHBondContact NH1-O 2.85Å; R187-D330 IonicContact NH1-OD1 3.91Å; R187-D330 PolarHBondContact NH1-OD1 3Å; R187-R374 VanDerWaalsContact CZ-NH2 3.28Å; R187-R374 VanDerWaalsContact NH2-NH2 3.12Å
188	Y	93.8	Very high	89.5	Confident	152 Å²	152	61.5 Å²	61.5	60%	0.596	29%	0.287	S	S	*	.	H	α-helix	trans	-61.4	-42.9	179	177.4	-99.1	0	0	0	112.2	M184 L185 K192	M184-Y188 VanDerWaalsContact O-CB 3.31Å; M184-Y188 WeakPolarHBondContact O-CB 3.47Å; M184-Y188 PolarHBondContact O-N 3.39Å; L185-Y188 PolarHBondContact O-N 2.84Å; Y188-K192 HydrophobicContact CD1-CG 4.44Å; Y188-K192 HydrophobicContact CD2-CG 4.26Å; Y188-K192 HydrophobicContact CE1-CG 4.09Å; Y188-K192 HydrophobicContact CE2-CD 4.25Å; Y188-K192 HydrophobicContact CE2-CG 3.89Å; Y188-K192 WeakPolarHBondContact O-CB 3.28Å; Y188-K192 VanDerWaalsContact O-CG 3.26Å; Y188-K192 WeakPolarHBondContact O-CG 3.3Å; Y188-K192 PolarHBondContact O-N 3.03Å; Y188-K192 WeakPolarHBondContact OH-CE 3.27Å
189	F	94.9	Very high	90.2	Very high	11 Å²	11	52.2 Å²	52.2	5%	0.048	25%	0.247	C	C	.	.	H	α-helix	trans	-60.5	-45.6	176.2	169.1	-96.5	0	0	0	111.9	F109 L112 L169 L185 V186 R187 T193	F109-F189 HydrophobicContact CD1-CE2 4.42Å; F109-F189 HydrophobicContact CD1-CZ 4.03Å; F109-F189 AromaticContact CE1-CZ 3.74Å; F109-F189 HydrophobicContact CE1-CZ 3.74Å; F109-F189 HydrophobicContact CE2-CZ 4.3Å; F109-F189 HydrophobicContact CG-CE2 4.44Å; F109-F189 HydrophobicContact CG-CZ 4.43Å; F109-F189 AromaticContact CZ-CZ 3.87Å; F109-F189 HydrophobicContact CZ-CZ 3.87Å; L112-F189 HydrophobicContact CD1-CD2 4.45Å; L112-F189 HydrophobicContact CD1-CE1 4.33Å; L112-F189 HydrophobicContact CD1-CE2 3.96Å; L112-F189 HydrophobicContact CD1-CZ 3.9Å; L112-F189 HydrophobicContact CD2-CB 4.22Å; L112-F189 HydrophobicContact CD2-CD1 4.04Å; L112-F189 HydrophobicContact CD2-CD2 3.71Å; L112-F189 HydrophobicContact CD2-CE1 4.37Å; L112-F189 HydrophobicContact CD2-CE2 4.07Å; L112-F189 HydrophobicContact CD2-CG 3.7Å; L112-F189 HydrophobicContact CD2-CZ 4.39Å; L112-F189 HydrophobicContact CG-CD2 4.1Å; L112-F189 HydrophobicContact CG-CE2 4.04Å; L112-F189 HydrophobicContact CG-CZ 4.43Å; L169-F189 HydrophobicContact CD2-CE1 4.1Å; L169-F189 HydrophobicContact CD2-CZ 4.38Å; L185-F189 WeakPolarHBondContact O-CB 3.25Å; L185-F189 PolarHBondContact O-N 3.3Å; V186-F189 PolarHBondContact O-N 2.79Å; R187-F189 PolarHBondContact O-N 3.37Å; F189-T193 HydrophobicContact CZ-CG2 4.48Å; F189-T193 WeakPolarHBondContact O-CB 3.42Å; F189-T193 PolarHBondContact O-N 2.88Å; F189-T193 PolarHBondContact O-OG1 2.87Å
190	L	95.5	Very high	90.8	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-67.8	-50.3	178.4	-79.1	176.5	0	0	0	111.9	L169 L173 V186 R187 K192 T193 L194 Y331 F368	L169-L190 HydrophobicContact CB-CD2 4.39Å; L169-L190 HydrophobicContact CD1-CD2 4.47Å; L173-L190 HydrophobicContact CD1-CD1 3.69Å; L173-L190 HydrophobicContact CD1-CD2 3.57Å; L173-L190 HydrophobicContact CD1-CG 3.68Å; V186-L190 HydrophobicContact CG1-CD1 4.05Å; V186-L190 HydrophobicContact CG1-CG 4.47Å; V186-L190 WeakPolarHBondContact O-CB 3.28Å; V186-L190 PolarHBondContact O-N 3.15Å; R187-L190 PolarHBondContact O-N 2.86Å; L190-K192 VanDerWaalsContact C-N 3.28Å; L190-K192 PolarHBondContact O-N 3.39Å; L190-T193 PolarHBondContact O-N 2.96Å; L190-T193 VanDerWaalsContact O-N 3.13Å; L190-L194 HydrophobicContact CB-CD1 4.38Å; L190-L194 HydrophobicContact CD2-CD1 4.33Å; L190-L194 VanDerWaalsContact O-CB 3.32Å; L190-L194 WeakPolarHBondContact O-CB 3.5Å; L190-L194 VanDerWaalsContact O-CG 3.28Å; L190-L194 WeakPolarHBondContact O-CG 3.34Å; L190-L194 PolarHBondContact O-N 2.77Å; L190-Y331 HydrophobicContact CB-CD2 3.91Å; L190-Y331 HydrophobicContact CB-CE1 4.23Å; L190-Y331 HydrophobicContact CB-CE2 3.54Å; L190-Y331 HydrophobicContact CB-CG 4.39Å; L190-Y331 HydrophobicContact CD1-CD1 3.67Å; L190-Y331 HydrophobicContact CD1-CD2 3.57Å; L190-Y331 HydrophobicContact CD1-CE1 4.14Å; L190-Y331 HydrophobicContact CD1-CE2 4.07Å; L190-Y331 HydrophobicContact CD1-CG 3.35Å; L190-Y331 HydrophobicContact CG-CD2 4.41Å; L190-Y331 HydrophobicContact CG-CE2 4.47Å; L190-F368 HydrophobicContact CD1-CE1 4.01Å; L190-F368 HydrophobicContact CD1-CZ 3.66Å; L190-F368 HydrophobicContact CD2-CE1 4Å; L190-F368 HydrophobicContact CD2-CZ 4.25Å
191	D	95.4	Very high	91.8	Very high	31 Å²	31	49 Å²	49	17%	0.166	23%	0.23	C	C	.	.	H	α-helix	trans	-53.8	-46.7	177.8	-75.7	-22.4	0	0	0	110	R187 T195 Y331	R187-D191 IonicContact CZ-OD2 3.71Å; R187-D191 IonicContact NE-OD2 3.45Å; R187-D191 IonicContact NH2-OD1 2.9Å; R187-D191 IonicContact NH2-OD2 3.21Å; R187-D191 PolarHBondContact NH2-OD2 3.2Å; R187-D191 WeakPolarHBondContact O-CB 3.28Å; R187-D191 PolarHBondContact O-N 3.38Å; D191-T195 WeakPolarHBondContact O-CB 3.29Å; D191-T195 WeakPolarHBondContact O-CG2 3.45Å; D191-T195 PolarHBondContact O-N 2.88Å; D191-T195 PolarHBondContact O-OG1 3.45Å; D191-Y331 WeakPolarHBondContact OD1-CE2 3.11Å; D191-Y331 PolarHBondContact OD1-OH 2.79Å
192	K	95	Very high	92.6	Very high	91 Å²	91	39.2 Å²	39.2	40%	0.396	18%	0.184	S	C	.	.	H	α-helix	trans	-69.7	-38.8	177	-67.6	-64	-176.8	-172.1	0	113.9	Y188 L190 T195 S196	Y188-K192 HydrophobicContact CD1-CG 4.44Å; Y188-K192 HydrophobicContact CD2-CG 4.26Å; Y188-K192 HydrophobicContact CE1-CG 4.09Å; Y188-K192 HydrophobicContact CE2-CD 4.25Å; Y188-K192 HydrophobicContact CE2-CG 3.89Å; Y188-K192 WeakPolarHBondContact O-CB 3.28Å; Y188-K192 VanDerWaalsContact O-CG 3.26Å; Y188-K192 WeakPolarHBondContact O-CG 3.3Å; Y188-K192 PolarHBondContact O-N 3.03Å; Y188-K192 WeakPolarHBondContact OH-CE 3.27Å; L190-K192 VanDerWaalsContact C-N 3.28Å; L190-K192 PolarHBondContact O-N 3.39Å; K192-T195 PolarHBondContact O-OG1 3.39Å; K192-S196 WeakPolarHBondContact O-CB 3.41Å; K192-S196 PolarHBondContact O-N 2.75Å; K192-S196 VanDerWaalsContact O-N 3.12Å
193	T	95.8	Very high	93	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-76.7	-41.2	-175.3	-64.5	0	0	0	0	111.9	R105 L169 F189 L190 R197	R105-T193 PolarHBondContact NH1-OG1 2.82Å; L169-T193 HydrophobicContact CD1-CG2 3.98Å; F189-T193 HydrophobicContact CZ-CG2 4.48Å; F189-T193 WeakPolarHBondContact O-CB 3.42Å; F189-T193 PolarHBondContact O-N 2.88Å; F189-T193 PolarHBondContact O-OG1 2.87Å; L190-T193 PolarHBondContact O-N 2.96Å; L190-T193 VanDerWaalsContact O-N 3.13Å; T193-R197 VanDerWaalsContact O-CB 3.26Å; T193-R197 WeakPolarHBondContact O-CB 3.18Å; T193-R197 PolarHBondContact O-N 3.24Å
194	L	95.4	Very high	93.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-69.1	-43.7	178.4	-62.9	174.8	0	0	0	111.2	V166 L190 R197 L198 Y331 F368 T372 Y376	V166-L194 HydrophobicContact CB-CD2 4.34Å; V166-L194 HydrophobicContact CG1-CD2 3.96Å; V166-L194 HydrophobicContact CG2-CD2 3.8Å; L190-L194 HydrophobicContact CB-CD1 4.38Å; L190-L194 HydrophobicContact CD2-CD1 4.33Å; L190-L194 VanDerWaalsContact O-CB 3.32Å; L190-L194 WeakPolarHBondContact O-CB 3.5Å; L190-L194 VanDerWaalsContact O-CG 3.28Å; L190-L194 WeakPolarHBondContact O-CG 3.34Å; L190-L194 PolarHBondContact O-N 2.77Å; L194-R197 PolarHBondContact O-N 2.86Å; L194-L198 PolarHBondContact O-N 3.11Å; L194-Y331 HydrophobicContact CD1-CE1 3.75Å; L194-F368 HydrophobicContact CD1-CD1 4.32Å; L194-F368 HydrophobicContact CD1-CE1 4.31Å; L194-T372 HydrophobicContact CD1-CG2 4.19Å; L194-Y376 HydrophobicContact CB-CE1 3.97Å; L194-Y376 WeakPolarHBondContact O-CE1 3.44Å
195	T	94.6	Very high	94	Very high	18 Å²	18	26.8 Å²	26.8	11%	0.11	13%	0.125	C	C	.	.	H	α-helix	trans	-66.5	-42.5	176.9	54.8	0	0	0	0	112.4	D191 K192 R197 L198 G199 A375 Y376 Y379	D191-T195 WeakPolarHBondContact O-CB 3.29Å; D191-T195 WeakPolarHBondContact O-CG2 3.45Å; D191-T195 PolarHBondContact O-N 2.88Å; D191-T195 PolarHBondContact O-OG1 3.45Å; K192-T195 PolarHBondContact O-OG1 3.39Å; T195-R197 VanDerWaalsContact C-N 3.32Å; T195-R197 PolarHBondContact O-N 2.87Å; T195-L198 WeakPolarHBondContact O-CB 3.27Å; T195-L198 PolarHBondContact O-N 2.84Å; T195-G199 PolarHBondContact O-N 2.7Å; T195-A375 HydrophobicContact CG2-CB 3.96Å; T195-A375 VanDerWaalsContact CG2-O 3.23Å; T195-A375 WeakPolarHBondContact CG2-O 3.26Å; T195-Y376 HydrophobicContact CG2-CD1 4.2Å; T195-Y379 HydrophobicContact CG2-CG 4.06Å
196	S	94.8	Very high	94.2	Very high	23 Å²	23	24.3 Å²	24.3	16%	0.161	11%	0.112	C	C	.	.	H	α-helix	trans	-61.2	-39.9	172.9	176.1	0	0	0	0	112	R105 K192 G199 I200	R105-S196 WeakPolarHBondContact CD-OG 3.48Å; R105-S196 PolarHBondContact NE-OG 3.16Å; K192-S196 WeakPolarHBondContact O-CB 3.41Å; K192-S196 PolarHBondContact O-N 2.75Å; K192-S196 VanDerWaalsContact O-N 3.12Å; S196-G199 PolarHBondContact O-N 3.32Å; S196-I200 WeakPolarHBondContact O-CB 3.43Å; S196-I200 VanDerWaalsContact O-CG1 3.31Å; S196-I200 WeakPolarHBondContact O-CG1 3.37Å; S196-I200 PolarHBondContact O-N 2.96Å
197	R	95.4	Very high	94.5	Very high	12 Å²	12	23.7 Å²	23.7	5%	0.045	11%	0.108	C	C	.	.	H	α-helix	trans	-64.3	-40.7	173.2	-178.7	178.1	176	-87.1	6.5	112.1	H162 K163 T193 L194 T195 R201	H162-R197 PolarHBondContact O-NE 3.13Å; H162-R197 PolarHBondContact O-NH2 3.42Å; K163-R197 PolarHBondContact O-NH2 3.03Å; T193-R197 VanDerWaalsContact O-CB 3.26Å; T193-R197 WeakPolarHBondContact O-CB 3.18Å; T193-R197 PolarHBondContact O-N 3.24Å; L194-R197 PolarHBondContact O-N 2.86Å; T195-R197 VanDerWaalsContact C-N 3.32Å; T195-R197 PolarHBondContact O-N 2.87Å; R197-R201 HydrophobicContact CG-CG 4.49Å; R197-R201 WeakPolarHBondContact O-CB 3.44Å; R197-R201 VanDerWaalsContact O-CG 3.29Å; R197-R201 WeakPolarHBondContact O-CG 3.29Å; R197-R201 PolarHBondContact O-N 2.84Å
198	L	93.6	Very high	94.6	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-59.5	-50	174	176.6	62.7	0	0	0	110.5	L194 T195 I200 R201 M202 M267 Y271 Y376 Y379	L194-L198 PolarHBondContact O-N 3.11Å; T195-L198 WeakPolarHBondContact O-CB 3.27Å; T195-L198 PolarHBondContact O-N 2.84Å; L198-I200 PolarHBondContact O-N 2.86Å; L198-R201 PolarHBondContact O-N 2.93Å; L198-R201 VanDerWaalsContact O-N 3.17Å; L198-M202 HydrophobicContact CD1-CG 4.15Å; L198-M202 HydrophobicContact CD1-SD 4.11Å; L198-M202 HydrophobicContact CD2-SD 4.44Å; L198-M202 HydrophobicContact CG-CG 4.39Å; L198-M202 HydrophobicContact CG-SD 3.87Å; L198-M202 VanDerWaalsContact O-CG 3.31Å; L198-M202 WeakPolarHBondContact O-CG 3.44Å; L198-M202 PolarHBondContact O-N 3.2Å; L198-M267 HydrophobicContact CD1-CG 4.48Å; L198-M267 HydrophobicContact CD1-SD 4.24Å; L198-Y271 HydrophobicContact CD1-CD2 4.11Å; L198-Y271 HydrophobicContact CD1-CE2 4.08Å; L198-Y376 HydrophobicContact CB-CD1 4.31Å; L198-Y376 HydrophobicContact CB-CE1 3.93Å; L198-Y376 HydrophobicContact CD2-CD1 3.71Å; L198-Y376 HydrophobicContact CD2-CD2 3.93Å; L198-Y376 HydrophobicContact CD2-CE1 4.11Å; L198-Y376 HydrophobicContact CD2-CE2 4.32Å; L198-Y376 HydrophobicContact CD2-CG 3.61Å; L198-Y379 HydrophobicContact CD2-CD1 4.22Å
199	G	92.8	Very high	94.6	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59.1	-46	177.8	0	0	0	0	0	113.8	T195 S196 R201 M202 L203 Y379	T195-G199 PolarHBondContact O-N 2.7Å; S196-G199 PolarHBondContact O-N 3.32Å; G199-R201 VanDerWaalsContact C-N 3.34Å; G199-R201 PolarHBondContact O-N 2.88Å; G199-M202 PolarHBondContact O-N 3.19Å; G199-L203 WeakPolarHBondContact O-CG 3.28Å; G199-L203 PolarHBondContact O-N 2.66Å; G199-Y379 VanDerWaalsContact CA-OH 3.27Å; G199-Y379 WeakPolarHBondContact CA-OH 3.37Å
200	I	93.9	Very high	94.5	Very high	22 Å²	22	16.4 Å²	16.4	11%	0.113	8%	0.084	C	C	.	.	H	α-helix	trans	-56.5	-47.4	173.4	-73.8	164.4	0	0	0	110.8	L98 R101 I102 S196 L198 M202 L203 A204	L98-I200 HydrophobicContact CD2-CG2 4.1Å; R101-I200 HydrophobicContact CB-CD1 3.96Å; R101-I200 HydrophobicContact CB-CG1 3.94Å; I102-I200 HydrophobicContact CG1-CD1 4.13Å; S196-I200 WeakPolarHBondContact O-CB 3.43Å; S196-I200 VanDerWaalsContact O-CG1 3.31Å; S196-I200 WeakPolarHBondContact O-CG1 3.37Å; S196-I200 PolarHBondContact O-N 2.96Å; L198-I200 PolarHBondContact O-N 2.86Å; I200-M202 PolarHBondContact O-N 2.97Å; I200-L203 PolarHBondContact O-N 3.21Å; I200-A204 VanDerWaalsContact O-CB 3.23Å; I200-A204 WeakPolarHBondContact O-CB 3.36Å; I200-A204 PolarHBondContact O-N 2.9Å
201	R	95.6	Very high	94.3	Very high	47 Å²	47	19.5 Å²	19.5	18%	0.177	10%	0.098	C	C	.	.	H	α-helix	trans	-66.2	-36.6	178.9	-71.5	-179.2	71.3	80.9	0.8	112.3	L159 R197 L198 G199 T205 Y271	L159-R201 HydrophobicContact CD2-CB 4.3Å; L159-R201 HydrophobicContact CD2-CG 3.81Å; L159-R201 PolarHBondContact O-NH1 2.89Å; R197-R201 HydrophobicContact CG-CG 4.49Å; R197-R201 WeakPolarHBondContact O-CB 3.44Å; R197-R201 VanDerWaalsContact O-CG 3.29Å; R197-R201 WeakPolarHBondContact O-CG 3.29Å; R197-R201 PolarHBondContact O-N 2.84Å; L198-R201 PolarHBondContact O-N 2.93Å; L198-R201 VanDerWaalsContact O-N 3.17Å; G199-R201 VanDerWaalsContact C-N 3.34Å; G199-R201 PolarHBondContact O-N 2.88Å; R201-T205 WeakPolarHBondContact O-CB 3.42Å; R201-T205 PolarHBondContact O-N 2.82Å; R201-T205 PolarHBondContact O-OG1 2.94Å; R201-Y271 PolarHBondContact NE-OH 3.43Å
202	M	93.1	Very high	94	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.3	-48.9	175.3	-72.1	171.9	81.4	0	0	111.3	L198 G199 I200 H206 I220 I265 M267 P268 L380 I412	L198-M202 HydrophobicContact CD1-CG 4.15Å; L198-M202 HydrophobicContact CD1-SD 4.11Å; L198-M202 HydrophobicContact CD2-SD 4.44Å; L198-M202 HydrophobicContact CG-CG 4.39Å; L198-M202 HydrophobicContact CG-SD 3.87Å; L198-M202 VanDerWaalsContact O-CG 3.31Å; L198-M202 WeakPolarHBondContact O-CG 3.44Å; L198-M202 PolarHBondContact O-N 3.2Å; G199-M202 PolarHBondContact O-N 3.19Å; I200-M202 PolarHBondContact O-N 2.97Å; M202-H206 WeakPolarHBondContact O-CB 3.45Å; M202-H206 PolarHBondContact O-N 2.88Å; M202-I220 HydrophobicContact CB-CD1 4.04Å; M202-I220 HydrophobicContact CG-CD1 4.34Å; M202-I220 WeakPolarHBondContact O-CD1 3.39Å; M202-I265 HydrophobicContact CE-CB 4.4Å; M202-I265 HydrophobicContact CE-CD1 3.59Å; M202-I265 HydrophobicContact CE-CG2 3.96Å; M202-M267 HydrophobicContact CB-SD 4.44Å; M202-M267 HydrophobicContact CG-SD 3.57Å; M202-M267 VanDerWaalsContact CG-SD 3.57Å; M202-P268 HydrophobicContact CE-CG 4.23Å; M202-L380 HydrophobicContact CE-CD2 4.17Å; M202-L380 HydrophobicContact SD-CD2 4.3Å; M202-I412 HydrophobicContact CB-CG2 4.22Å; M202-I412 HydrophobicContact CE-CD1 3.57Å; M202-I412 HydrophobicContact CE-CG1 4.12Å; M202-I412 HydrophobicContact SD-CD1 4.45Å; M202-I412 HydrophobicContact SD-CG2 4.46Å
203	L	93.2	Very high	93.6	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.021	13%	0.133	C	C	.	.	H	α-helix	trans	-63.3	-49.1	177.9	-67.6	178.4	0	0	0	112.1	L70 M75 Y93 L94 G199 I200 H206 H207 I412	L70-L203 HydrophobicContact CD1-CD2 4.28Å; M75-L203 HydrophobicContact CE-CD2 4Å; M75-L203 HydrophobicContact SD-CD2 4.15Å; Y93-L203 HydrophobicContact CE1-CD1 4.19Å; Y93-L203 HydrophobicContact CE1-CD2 4.11Å; L94-L203 HydrophobicContact CD1-CB 4.26Å; G199-L203 WeakPolarHBondContact O-CG 3.28Å; G199-L203 PolarHBondContact O-N 2.66Å; I200-L203 PolarHBondContact O-N 3.21Å; L203-H206 PolarHBondContact O-N 2.86Å; L203-H207 PolarHBondContact O-N 2.96Å; L203-H207 VanDerWaalsContact O-N 3.1Å; L203-I412 HydrophobicContact CD2-CG2 4.32Å; L203-I412 HydrophobicContact CG-CG2 4.18Å
204	A	95.1	Very high	93.3	Very high	3 Å²	3	30.5 Å²	30.5	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-58.3	-49.4	178	0	0	0	0	0	112.3	V155 L159 I200 L208	V155-A204 HydrophobicContact CG1-CB 3.66Å; L159-A204 HydrophobicContact CD1-CB 4.05Å; L159-A204 HydrophobicContact CD2-CB 3.99Å; L159-A204 HydrophobicContact CG-CB 4.22Å; I200-A204 VanDerWaalsContact O-CB 3.23Å; I200-A204 WeakPolarHBondContact O-CB 3.36Å; I200-A204 PolarHBondContact O-N 2.9Å; A204-L208 WeakPolarHBondContact O-CG 3.35Å; A204-L208 PolarHBondContact O-N 3.19Å; A204-L208 VanDerWaalsContact O-N 3.16Å
205	T	95.5	Very high	93	Very high	39 Å²	39	35.7 Å²	35.7	24%	0.239	19%	0.187	C	C	.	.	H	α-helix	trans	-70.7	-33	-179.9	-45.5	0	0	0	0	111.5	R201 A209 I220 M267	R201-T205 WeakPolarHBondContact O-CB 3.42Å; R201-T205 PolarHBondContact O-N 2.82Å; R201-T205 PolarHBondContact O-OG1 2.94Å; T205-A209 WeakPolarHBondContact O-CB 3.06Å; T205-A209 PolarHBondContact O-N 3.31Å; T205-I220 HydrophobicContact CG2-CG2 3.59Å; T205-M267 HydrophobicContact CG2-CE 3.96Å
206	H	94	Very high	92.8	Very high	5 Å²	5	37.9 Å²	37.9	2%	0.023	20%	0.198	C	C	.	.	H	α-helix	trans	-59.7	-52.3	174.8	-178.8	80.3	0	0	0	111.1	M75 M202 L203 L208 A209 L210 V218 I220	M75-H206 HydrophobicContact CE-CB 3.48Å; M75-H206 VanDerWaalsContact CE-CB 3.48Å; M202-H206 WeakPolarHBondContact O-CB 3.45Å; M202-H206 PolarHBondContact O-N 2.88Å; L203-H206 PolarHBondContact O-N 2.86Å; H206-L208 PolarHBondContact O-N 3.2Å; H206-A209 CarbonylContact O-C 3.56Å; H206-A209 PolarHBondContact O-N 2.79Å; H206-A209 VanDerWaalsContact O-N 3.15Å; H206-L210 WeakPolarHBondContact O-CG 3.34Å; H206-L210 PolarHBondContact O-N 2.92Å; H206-V218 PolarHBondContact CE1-O 2.68Å; H206-I220 HydrophobicContact CB-CD1 4.13Å; H206-I220 HydrophobicContact CB-CG1 3.87Å
207	H	94.1	Very high	92.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57	-50.6	177.8	172.7	52.7	0	0	0	111.6	S90 L94 D148 C152 L203 A209 L210 H211	S90-H207 PolarHBondContact OG-ND1 3.23Å; L94-H207 HydrophobicContact CD1-CB 4.22Å; L94-H207 HydrophobicContact CD2-CB 3.45Å; L94-H207 VanDerWaalsContact CD2-CB 3.45Å; L94-H207 HydrophobicContact CG-CB 4.48Å; D148-H207 IonicContact OD1-CE1 3.25Å; D148-H207 PolarHBondContact OD1-CE1 2.94Å; D148-H207 VanDerWaalsContact OD1-CE1 3.25Å; D148-H207 IonicContact OD1-NE2 3.67Å; C152-H207 PolarHBondContact SG-NE2 3.32Å; L203-H207 PolarHBondContact O-N 2.96Å; L203-H207 VanDerWaalsContact O-N 3.1Å; H207-A209 PolarHBondContact O-N 2.97Å; H207-L210 WeakPolarHBondContact O-CB 3.41Å; H207-L210 PolarHBondContact O-N 3.36Å; H207-H211 AromaticContact CE1-NE2 3.64Å; H207-H211 PolarHBondContact O-CD2 3.35Å; H207-H211 VanDerWaalsContact O-CD2 3.26Å
208	L	95.3	Very high	92.5	Very high	18 Å²	18	40.3 Å²	40.3	9%	0.094	21%	0.208	C	C	.	.	H	α-helix	trans	-57.1	-36.9	176.9	-68.1	177.2	0	0	0	113.3	C152 V155 R156 L159 A204 H206	C152-L208 HydrophobicContact CB-CD2 3.73Å; C152-L208 WeakPolarHBondContact O-CD2 3.41Å; V155-L208 HydrophobicContact CB-CD2 4.49Å; V155-L208 HydrophobicContact CG1-CD1 4.03Å; V155-L208 HydrophobicContact CG1-CD2 4.44Å; V155-L208 HydrophobicContact CG1-CG 4.16Å; R156-L208 HydrophobicContact CG-CD1 3.61Å; R156-L208 HydrophobicContact CG-CD2 3.93Å; R156-L208 HydrophobicContact CG-CG 4.43Å; L159-L208 HydrophobicContact CD1-CD1 3.65Å; A204-L208 WeakPolarHBondContact O-CG 3.35Å; A204-L208 PolarHBondContact O-N 3.19Å; A204-L208 VanDerWaalsContact O-N 3.16Å; H206-L208 PolarHBondContact O-N 3.2Å
209	A	94.4	Very high	92.4	Very high	8 Å²	8	40.7 Å²	40.7	7%	0.066	21%	0.212	C	C	.	.	H	α-helix	trans	-80.1	-12.3	179.2	0	0	0	0	0	113.8	T205 H206 H207 H211 E212 I220	T205-A209 WeakPolarHBondContact O-CB 3.06Å; T205-A209 PolarHBondContact O-N 3.31Å; H206-A209 CarbonylContact O-C 3.56Å; H206-A209 PolarHBondContact O-N 2.79Å; H206-A209 VanDerWaalsContact O-N 3.15Å; H207-A209 PolarHBondContact O-N 2.97Å; A209-H211 PolarHBondContact O-N 3.19Å; A209-E212 PolarHBondContact O-N 2.94Å; A209-I220 HydrophobicContact CB-CG2 4.31Å
210	L	92	Very high	92.4	Very high	21 Å²	21	41.5 Å²	41.5	11%	0.11	22%	0.216	C	C	.	.	H	α-helix	trans	-68.4	-20.9	170.9	-70.5	173.8	0	0	0	112.1	L87 H206 H207 E212 V218	L87-L210 HydrophobicContact CD2-CB 3.56Å; H206-L210 WeakPolarHBondContact O-CG 3.34Å; H206-L210 PolarHBondContact O-N 2.92Å; H207-L210 WeakPolarHBondContact O-CB 3.41Å; H207-L210 PolarHBondContact O-N 3.36Å; L210-E212 VanDerWaalsContact C-N 3.3Å; L210-V218 HydrophobicContact CD2-CG1 4.33Å
211	H	90.6	Very high	92.3	Very high	66 Å²	66	40.5 Å²	40.5	31%	0.306	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-5.6	173	-57.5	-87.1	0	0	0	113.4	D148 H207 A209	D148-H211 IonicContact OD2-CE1 3.08Å; D148-H211 PolarHBondContact OD2-CE1 3.13Å; D148-H211 IonicContact OD2-NE2 3.72Å; H207-H211 AromaticContact CE1-NE2 3.64Å; H207-H211 PolarHBondContact O-CD2 3.35Å; H207-H211 VanDerWaalsContact O-CD2 3.26Å; A209-H211 PolarHBondContact O-N 3.19Å
212	E	89.9	Confident	92.3	Very high	89 Å²	89	38.9 Å²	38.9	42%	0.416	21%	0.207	S	C	.	.	S	Bend	trans	-102.2	118.3	-177.5	-58.6	180	128.5	0	0	110.3	A209 L210 K214	A209-E212 PolarHBondContact O-N 2.94Å; L210-E212 VanDerWaalsContact C-N 3.3Å; E212-K214 HydrophobicContact CB-CD 4.2Å; E212-K214 HydrophobicContact CB-CG 4.2Å; E212-K214 PolarHBondContact O-N 3.2Å; E212-K214 IonicContact OE1-NZ 2.86Å; E212-K214 PolarHBondContact OE1-NZ 3.44Å; E212-K214 VanDerWaalsContact OE2-CE 3.31Å; E212-K214 WeakPolarHBondContact OE2-CE 3.48Å; E212-K214 IonicContact OE2-NZ 2.63Å; E212-K214 PolarHBondContact OE2-NZ 2.68Å
213	D	86.3	Confident	92.2	Very high	165 Å²	165	41.5 Å²	41.5	88%	0.882	22%	0.223	S	C	*	.			trans	-77.3	77.1	171.3	-169.2	17	0	0	0	110.5
214	K	89.4	Confident	92.3	Very high	100 Å²	100	46.9 Å²	46.9	44%	0.435	24%	0.243	S	C	.	.			trans	-97.9	122.4	176.8	-78.8	174.5	-179.3	162.8	0	110.2	E212 F217	E212-K214 HydrophobicContact CB-CD 4.2Å; E212-K214 HydrophobicContact CB-CG 4.2Å; E212-K214 PolarHBondContact O-N 3.2Å; E212-K214 IonicContact OE1-NZ 2.86Å; E212-K214 PolarHBondContact OE1-NZ 3.44Å; E212-K214 VanDerWaalsContact OE2-CE 3.31Å; E212-K214 WeakPolarHBondContact OE2-CE 3.48Å; E212-K214 IonicContact OE2-NZ 2.63Å; E212-K214 PolarHBondContact OE2-NZ 2.68Å; K214-F217 HydrophobicContact CB-CB 4Å; K214-F217 HydrophobicContact CB-CD2 4.44Å; K214-F217 HydrophobicContact CB-CG 4.49Å; K214-F217 PolarHBondContact O-N 2.95Å
215	P	89.8	Confident	92.3	Very high	108 Å²	108	47.2 Å²	47.2	70%	0.701	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	145.8	177.2	27.8	-35.1	0	0	0	110.3	F217	P215-F217 WeakPolarHBondContact O-CD2 3.5Å; P215-F217 PolarHBondContact O-N 3.13Å
216	D	90.6	Very high	92.5	Very high	64 Å²	64	46.1 Å²	46.1	34%	0.342	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	12.2	-174.1	-59.8	-13.9	0	0	0	115.7	C222 T223 R224	D216-C222 CarbonylContact O-C 3.59Å; D216-C222 WeakPolarHBondContact O-CA 3.47Å; D216-T223 PolarHBondContact O-N 3.34Å; D216-T223 PolarHBondContact O-OG1 2.96Å; D216-T223 VanDerWaalsContact O-OG1 3.12Å; D216-R224 HydrophobicContact CB-CG 3.88Å; D216-R224 VanDerWaalsContact CG-CD 3.45Å; D216-R224 WeakPolarHBondContact OD1-CD 3.25Å; D216-R224 IonicContact OD1-NH1 3.34Å; D216-R224 PolarHBondContact OD1-NH1 3.16Å; D216-R224 WeakPolarHBondContact OD2-CD 3.3Å; D216-R224 WeakPolarHBondContact OD2-CG 3.32Å; D216-R224 IonicContact OD2-CZ 3.57Å; D216-R224 IonicContact OD2-NE 3.75Å; D216-R224 IonicContact OD2-NH1 2.71Å; D216-R224 PolarHBondContact OD2-NH1 3Å
217	F	92.2	Very high	92.7	Very high	70 Å²	70	45.9 Å²	45.9	31%	0.307	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	153.4	178.6	-80.3	-95	0	0	0	114	K214 P215 G219 I221 C222 P266	K214-F217 HydrophobicContact CB-CB 4Å; K214-F217 HydrophobicContact CB-CD2 4.44Å; K214-F217 HydrophobicContact CB-CG 4.49Å; K214-F217 PolarHBondContact O-N 2.95Å; P215-F217 WeakPolarHBondContact O-CD2 3.5Å; P215-F217 PolarHBondContact O-N 3.13Å; F217-G219 WeakPolarHBondContact CD1-O 3.36Å; F217-I221 CarbonylContact C-O 3.58Å; F217-I221 WeakPolarHBondContact CA-O 3.4Å; F217-C222 HydrophobicContact CD1-CB 4.05Å; F217-C222 HydrophobicContact CE1-CB 3.55Å; F217-C222 HydrophobicContact CE2-CB 4.21Å; F217-C222 HydrophobicContact CZ-CB 3.64Å; F217-P266 HydrophobicContact CE1-CG 4Å; F217-P266 HydrophobicContact CZ-CG 4.29Å
218	V	90.9	Very high	92.9	Very high	16 Å²	16	49.1 Å²	49.1	10%	0.097	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	97.2	166.1	179.4	0	0	0	0	106.9	L76 H206 L210 I220 I221 T223	L76-V218 HydrophobicContact CD2-CB 4.08Å; L76-V218 HydrophobicContact CD2-CG1 4.41Å; L76-V218 HydrophobicContact CD2-CG2 4.45Å; H206-V218 PolarHBondContact CE1-O 2.68Å; L210-V218 HydrophobicContact CD2-CG1 4.33Å; V218-I220 PolarHBondContact O-N 3.18Å; V218-I221 PolarHBondContact N-O 2.93Å; V218-I221 WeakPolarHBondContact O-CB 3.3Å; V218-I221 PolarHBondContact O-N 2.88Å; V218-T223 HydrophobicContact CG2-CG2 4.2Å
219	G	91.9	Very high	93	Very high	9 Å²	9	54.7 Å²	54.7	9%	0.093	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	-133.3	-162.6	0	0	0	0	0	110.5	F217 I221	F217-G219 WeakPolarHBondContact CD1-O 3.36Å; G219-I221 PolarHBondContact O-N 3.31Å
220	I	92.9	Very high	93.2	Very high	18 Å²	18	55 Å²	55	9%	0.092	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-2.9	174.4	62.8	174.2	0	0	0	115.3	M202 T205 H206 A209 V218 I265 P266 M267	M202-I220 HydrophobicContact CB-CD1 4.04Å; M202-I220 HydrophobicContact CG-CD1 4.34Å; M202-I220 WeakPolarHBondContact O-CD1 3.39Å; T205-I220 HydrophobicContact CG2-CG2 3.59Å; H206-I220 HydrophobicContact CB-CD1 4.13Å; H206-I220 HydrophobicContact CB-CG1 3.87Å; A209-I220 HydrophobicContact CB-CG2 4.31Å; V218-I220 PolarHBondContact O-N 3.18Å; I220-I265 HydrophobicContact CD1-CG2 3.74Å; I220-I265 HydrophobicContact CG1-CG2 4.03Å; I220-P266 WeakPolarHBondContact O-CD 3.33Å; I220-M267 HydrophobicContact CD1-CE 4.17Å; I220-M267 HydrophobicContact CG2-CE 4.27Å
221	I	92.6	Very high	93.5	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	116.3	-173.8	-46.7	-177.2	0	0	0	108.9	M75 L76 F217 V218 G219 I265 I403	M75-I221 HydrophobicContact CB-CD1 3.86Å; L76-I221 HydrophobicContact CD1-CG2 4.41Å; L76-I221 HydrophobicContact CD2-CB 3.85Å; L76-I221 HydrophobicContact CD2-CD1 3.92Å; L76-I221 HydrophobicContact CD2-CG1 4.45Å; L76-I221 HydrophobicContact CD2-CG2 3.65Å; L76-I221 HydrophobicContact CG-CD1 3.74Å; L76-I221 HydrophobicContact CG-CG2 4.09Å; F217-I221 CarbonylContact C-O 3.58Å; F217-I221 WeakPolarHBondContact CA-O 3.4Å; V218-I221 PolarHBondContact N-O 2.93Å; V218-I221 WeakPolarHBondContact O-CB 3.3Å; V218-I221 PolarHBondContact O-N 2.88Å; G219-I221 PolarHBondContact O-N 3.31Å; I221-I265 HydrophobicContact CG1-CD1 4.43Å; I221-I265 HydrophobicContact CG1-CG1 4.21Å; I221-I265 HydrophobicContact CG2-CG1 4.47Å; I221-I403 HydrophobicContact CG2-CD1 3.51Å
222	C	93.9	Very high	93.9	Very high	13 Å²	13	54.3 Å²	54.3	9%	0.088	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	122.8	176.2	-174.1	0	0	0	0	109.2	D216 F217 R224 L225 P263 F264 P266	D216-C222 CarbonylContact O-C 3.59Å; D216-C222 WeakPolarHBondContact O-CA 3.47Å; F217-C222 HydrophobicContact CD1-CB 4.05Å; F217-C222 HydrophobicContact CE1-CB 3.55Å; F217-C222 HydrophobicContact CE2-CB 4.21Å; F217-C222 HydrophobicContact CZ-CB 3.64Å; C222-R224 VanDerWaalsContact C-N 3.27Å; C222-R224 PolarHBondContact O-N 3.14Å; C222-L225 HydrophobicContact CB-CB 4.07Å; C222-L225 PolarHBondContact SG-N 3.12Å; C222-P263 CarbonylContact O-C 3.53Å; C222-P263 VanDerWaalsContact O-CA 3.31Å; C222-P263 WeakPolarHBondContact O-CA 3.46Å; C222-F264 PolarHBondContact N-O 3.26Å; C222-F264 PolarHBondContact O-N 3.01Å; C222-P266 HydrophobicContact CB-CG 4.18Å
223	T	91.7	Very high	94.3	Very high	56 Å²	56	55.1 Å²	55.1	34%	0.344	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	-17.8	-175.6	60.6	0	0	0	0	113.6	D216 V218	D216-T223 PolarHBondContact O-N 3.34Å; D216-T223 PolarHBondContact O-OG1 2.96Å; D216-T223 VanDerWaalsContact O-OG1 3.12Å; V218-T223 HydrophobicContact CG2-CG2 4.2Å
224	R	94.4	Very high	94.9	Very high	116 Å²	116	49 Å²	49	44%	0.438	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	48.5	-176.3	55.2	-167.8	-76	-118.6	17.2	112.7	D216 C222 S226 R261	D216-R224 HydrophobicContact CB-CG 3.88Å; D216-R224 VanDerWaalsContact CG-CD 3.45Å; D216-R224 WeakPolarHBondContact OD1-CD 3.25Å; D216-R224 IonicContact OD1-NH1 3.34Å; D216-R224 PolarHBondContact OD1-NH1 3.16Å; D216-R224 WeakPolarHBondContact OD2-CD 3.3Å; D216-R224 WeakPolarHBondContact OD2-CG 3.32Å; D216-R224 IonicContact OD2-CZ 3.57Å; D216-R224 IonicContact OD2-NE 3.75Å; D216-R224 IonicContact OD2-NH1 2.71Å; D216-R224 PolarHBondContact OD2-NH1 3Å; C222-R224 VanDerWaalsContact C-N 3.27Å; C222-R224 PolarHBondContact O-N 3.14Å; R224-S226 PolarHBondContact O-N 3.27Å; R224-R261 HydrophobicContact CB-CB 4.48Å; R224-R261 PolarHBondContact O-NE 2.99Å; R224-R261 PolarHBondContact O-NH2 3.45Å
225	L	96.8	Very high	95.3	Very high	11 Å²	11	44.8 Å²	44.8	6%	0.058	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	132.6	177	-179.6	131.8	0	0	0	109.9	C222 I230 R261 F262 F264 P266 L269	C222-L225 HydrophobicContact CB-CB 4.07Å; C222-L225 PolarHBondContact SG-N 3.12Å; L225-I230 HydrophobicContact CD1-CD1 4.49Å; L225-I230 HydrophobicContact CD2-CG2 4.4Å; L225-R261 VanDerWaalsContact O-CA 3.29Å; L225-R261 WeakPolarHBondContact O-CA 3.38Å; L225-F262 HydrophobicContact CD2-CE2 4.07Å; L225-F262 HydrophobicContact CD2-CZ 4.23Å; L225-F262 PolarHBondContact N-O 2.89Å; L225-F262 PolarHBondContact O-N 2.81Å; L225-F264 HydrophobicContact CB-CB 3.89Å; L225-F264 HydrophobicContact CD1-CB 4.21Å; L225-F264 HydrophobicContact CD1-CD1 4.46Å; L225-F264 HydrophobicContact CD2-CB 4.05Å; L225-F264 HydrophobicContact CD2-CD1 4.4Å; L225-F264 HydrophobicContact CD2-CG 4.45Å; L225-F264 HydrophobicContact CG-CB 4.25Å; L225-P266 HydrophobicContact CD1-CB 4.01Å; L225-P266 HydrophobicContact CD1-CG 3.86Å; L225-L269 HydrophobicContact CD2-CD1 4.44Å
226	S	98.1	Very high	95.7	Very high	15 Å²	15	43.8 Å²	43.8	11%	0.105	21%	0.209	C	C	.	.			trans	-102.8	115.4	170.3	178.5	0	0	0	0	108.8	R224 K228 K229 I230	R224-S226 PolarHBondContact O-N 3.27Å; S226-K228 PolarHBondContact O-N 3.18Å; S226-K229 PolarHBondContact O-N 3.36Å; S226-K229 VanDerWaalsContact O-N 3.16Å; S226-I230 PolarHBondContact O-N 3.37Å
227	P	98.2	Very high	96	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.7	-36.6	179.9	22.8	-32.1	0	0	0	111.3	K229 I230 I231 A260 F262 I302 L309	P227-K229 PolarHBondContact O-N 3.11Å; P227-I230 WeakPolarHBondContact O-CG2 3.37Å; P227-I230 PolarHBondContact O-N 3.28Å; P227-I231 WeakPolarHBondContact O-CB 3.31Å; P227-I231 VanDerWaalsContact O-CD1 3.3Å; P227-I231 WeakPolarHBondContact O-CD1 3.25Å; P227-I231 WeakPolarHBondContact O-CG1 3.37Å; P227-I231 PolarHBondContact O-N 3.45Å; P227-A260 WeakPolarHBondContact CD-O 3.5Å; P227-A260 HydrophobicContact CG-CB 4.29Å; P227-F262 HydrophobicContact CB-CZ 4.4Å; P227-F262 HydrophobicContact CG-CE1 3.96Å; P227-F262 HydrophobicContact CG-CZ 4.01Å; P227-I302 HydrophobicContact CB-CD1 4.22Å; P227-I302 HydrophobicContact CB-CG2 4.17Å; P227-I302 HydrophobicContact CG-CD1 4.26Å; P227-I302 HydrophobicContact CG-CG2 3.8Å; P227-L309 HydrophobicContact CB-CD1 4.14Å; P227-L309 HydrophobicContact CB-CD2 4.43Å; P227-L309 HydrophobicContact CG-CD1 4.3Å
228	K	98.6	Very high	96.3	Very high	69 Å²	69	40.8 Å²	40.8	30%	0.3	19%	0.193	S	C	.	.	H	α-helix	trans	-55.3	-50.9	174.1	173	167.3	173.1	176.8	0	112.2	S226 I230 I231 E232 I254 V258 I302	S226-K228 PolarHBondContact O-N 3.18Å; K228-I230 PolarHBondContact O-N 3.12Å; K228-I231 PolarHBondContact O-N 2.91Å; K228-E232 VanDerWaalsContact CE-CD 3.44Å; K228-E232 WeakPolarHBondContact CE-OE1 3.45Å; K228-E232 HydrophobicContact CG-CG 4.29Å; K228-E232 IonicContact NZ-OE1 2.85Å; K228-E232 WeakPolarHBondContact O-CG 3.23Å; K228-E232 PolarHBondContact O-N 2.82Å; K228-I254 HydrophobicContact CG-CD1 4.39Å; K228-V258 HydrophobicContact CD-CB 3.88Å; K228-V258 HydrophobicContact CD-CG1 4.24Å; K228-I302 HydrophobicContact CB-CD1 4.06Å
229	K	98.4	Very high	96.6	Very high	135 Å²	135	43 Å²	43	59%	0.587	20%	0.2	S	C	*	.	H	α-helix	trans	-63.6	-38.6	-177	-71.5	-163.7	171.3	-156.9	0	113.6	S226 P227 K233	S226-K229 PolarHBondContact O-N 3.36Å; S226-K229 VanDerWaalsContact O-N 3.16Å; P227-K229 PolarHBondContact O-N 3.11Å; K229-K233 PolarHBondContact O-N 3.36Å; K229-K233 VanDerWaalsContact O-N 3.1Å
230	I	98.2	Very high	96.8	Very high	14 Å²	14	50.1 Å²	50.1	7%	0.072	22%	0.224	C	C	.	.	H	α-helix	trans	-73.9	-33.3	177.2	-173.5	162.8	0	0	0	111.6	L225 S226 P227 K228 W234 P266 L269 L273	L225-I230 HydrophobicContact CD1-CD1 4.49Å; L225-I230 HydrophobicContact CD2-CG2 4.4Å; S226-I230 PolarHBondContact O-N 3.37Å; P227-I230 WeakPolarHBondContact O-CG2 3.37Å; P227-I230 PolarHBondContact O-N 3.28Å; K228-I230 PolarHBondContact O-N 3.12Å; I230-W234 PolarHBondContact O-N 3.19Å; I230-P266 HydrophobicContact CD1-CB 3.93Å; I230-L269 HydrophobicContact CD1-CB 3.72Å; I230-L269 HydrophobicContact CD1-CD1 4.24Å; I230-L269 HydrophobicContact CG1-CB 4.42Å; I230-L269 HydrophobicContact CG2-CD1 4.13Å; I230-L273 HydrophobicContact CG1-CD1 4.22Å; I230-L273 HydrophobicContact CG2-CD1 4.45Å
231	I	98.8	Very high	96.8	Very high	0 Å²	0	50 Å²	50	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.1	-48.9	170.1	-68.4	160.8	0	0	0	110.2	P227 K228 K233 W234 V235 I254 L273 I300 I302 I311	P227-I231 WeakPolarHBondContact O-CB 3.31Å; P227-I231 VanDerWaalsContact O-CD1 3.3Å; P227-I231 WeakPolarHBondContact O-CD1 3.25Å; P227-I231 WeakPolarHBondContact O-CG1 3.37Å; P227-I231 PolarHBondContact O-N 3.45Å; K228-I231 PolarHBondContact O-N 2.91Å; I231-K233 PolarHBondContact O-N 2.9Å; I231-W234 PolarHBondContact O-N 3.1Å; I231-W234 VanDerWaalsContact O-N 3.08Å; I231-V235 HydrophobicContact CG2-CG2 4.03Å; I231-V235 VanDerWaalsContact O-CG2 3.31Å; I231-V235 WeakPolarHBondContact O-CG2 3.46Å; I231-V235 PolarHBondContact O-N 3.29Å; I231-I254 HydrophobicContact CB-CD1 4.29Å; I231-I254 HydrophobicContact CG2-CD1 3.66Å; I231-I254 HydrophobicContact CG2-CG1 4.28Å; I231-L273 HydrophobicContact CG1-CD1 3.97Å; I231-L273 HydrophobicContact CG1-CD2 4.35Å; I231-I300 HydrophobicContact CD1-CG2 4.08Å; I231-I300 HydrophobicContact CG2-CD1 3.57Å; I231-I300 HydrophobicContact CG2-CG2 4.32Å; I231-I302 HydrophobicContact CD1-CD1 3.77Å; I231-I302 HydrophobicContact CD1-CG1 3.83Å; I231-I311 HydrophobicContact CD1-CD1 4.1Å; I231-I311 HydrophobicContact CD1-CG1 4.39Å; I231-I311 HydrophobicContact CD1-CG2 4.09Å; I231-I311 HydrophobicContact CG1-CD1 4.47Å
232	E	98.6	Very high	96.8	Very high	73 Å²	73	50 Å²	50	34%	0.341	22%	0.223	S	C	.	.	H	α-helix	trans	-55.2	-48.3	177.9	-72.6	170	146.2	0	0	112	K228 W234 V235 D236 I254	K228-E232 VanDerWaalsContact CE-CD 3.44Å; K228-E232 WeakPolarHBondContact CE-OE1 3.45Å; K228-E232 HydrophobicContact CG-CG 4.29Å; K228-E232 IonicContact NZ-OE1 2.85Å; K228-E232 WeakPolarHBondContact O-CG 3.23Å; K228-E232 PolarHBondContact O-N 2.82Å; E232-W234 VanDerWaalsContact C-N 3.27Å; E232-W234 PolarHBondContact O-N 2.9Å; E232-V235 WeakPolarHBondContact O-CB 3.29Å; E232-V235 PolarHBondContact O-N 3.37Å; E232-D236 PolarHBondContact O-N 2.94Å; E232-I254 HydrophobicContact CG-CD1 3.67Å
233	K	98.4	Very high	96.9	Very high	105 Å²	105	52.5 Å²	52.5	46%	0.457	23%	0.234	S	C	.	.	H	α-helix	trans	-49.1	-46.1	173.2	171.8	-165.1	169.7	-169.3	0	112.7	K229 I231 F237 D270	K229-K233 PolarHBondContact O-N 3.36Å; K229-K233 VanDerWaalsContact O-N 3.1Å; I231-K233 PolarHBondContact O-N 2.9Å; K233-F237 PolarHBondContact O-N 2.84Å; K233-D270 IonicContact NZ-OD1 3.72Å; K233-D270 PolarHBondContact NZ-OD1 3.09Å; K233-D270 IonicContact NZ-OD2 3.61Å
234	W	98.6	Very high	96.9	Very high	38 Å²	38	54.3 Å²	54.3	14%	0.144	24%	0.238	C	C	.	.	H	α-helix	trans	-84.3	-24.9	-176.6	-70	116.9	0	0	0	113.7	I230 I231 E232 F237 A238 D270 L273 P274 L277	I230-W234 PolarHBondContact O-N 3.19Å; I231-W234 PolarHBondContact O-N 3.1Å; I231-W234 VanDerWaalsContact O-N 3.08Å; E232-W234 VanDerWaalsContact C-N 3.27Å; E232-W234 PolarHBondContact O-N 2.9Å; W234-F237 HydrophobicContact CE3-CB 3.8Å; W234-F237 AromaticContact CE3-CD1 3.64Å; W234-F237 HydrophobicContact CE3-CD1 3.64Å; W234-F237 HydrophobicContact CE3-CE1 4.37Å; W234-F237 AromaticContact CE3-CG 3.78Å; W234-F237 HydrophobicContact CE3-CG 3.78Å; W234-F237 HydrophobicContact CZ3-CB 4.23Å; W234-F237 AromaticContact CZ3-CD1 3.74Å; W234-F237 HydrophobicContact CZ3-CD1 3.74Å; W234-F237 HydrophobicContact CZ3-CD2 4.27Å; W234-F237 HydrophobicContact CZ3-CE1 4.12Å; W234-F237 AromaticContact CZ3-CG 3.81Å; W234-F237 HydrophobicContact CZ3-CG 3.81Å; W234-F237 PolarHBondContact O-N 3.02Å; W234-A238 WeakPolarHBondContact O-CB 3.17Å; W234-A238 PolarHBondContact O-N 3.25Å; W234-D270 VanDerWaalsContact CE2-OD1 3.28Å; W234-D270 HydrophobicContact CZ2-CB 3.75Å; W234-D270 WeakPolarHBondContact CZ2-O 3.31Å; W234-D270 VanDerWaalsContact CZ2-OD1 3.3Å; W234-D270 WeakPolarHBondContact CZ2-OD1 3.22Å; W234-D270 PolarHBondContact NE1-OD1 2.94Å; W234-L273 HydrophobicContact CB-CB 4.05Å; W234-L273 HydrophobicContact CG-CB 4.16Å; W234-P274 HydrophobicContact CD2-CB 4.25Å; W234-P274 HydrophobicContact CD2-CG 4.03Å; W234-P274 HydrophobicContact CE3-CB 3.69Å; W234-P274 HydrophobicContact CE3-CG 3.78Å; W234-P274 HydrophobicContact CH2-CG 4.45Å; W234-P274 HydrophobicContact CZ3-CB 4.11Å; W234-P274 HydrophobicContact CZ3-CG 4.01Å; W234-L277 VanDerWaalsContact C-CD1 3.45Å; W234-L277 HydrophobicContact CB-CD1 3.74Å
235	V	98.6	Very high	96.5	Very high	11 Å²	11	50.4 Å²	50.4	7%	0.067	22%	0.224	C	C	.	.	H	α-helix	trans	-60.9	-50.3	166.4	164.4	0	0	0	0	109.7	I231 E232 F237 A238 R239 V252 L277 I300	I231-V235 HydrophobicContact CG2-CG2 4.03Å; I231-V235 VanDerWaalsContact O-CG2 3.31Å; I231-V235 WeakPolarHBondContact O-CG2 3.46Å; I231-V235 PolarHBondContact O-N 3.29Å; E232-V235 WeakPolarHBondContact O-CB 3.29Å; E232-V235 PolarHBondContact O-N 3.37Å; V235-F237 PolarHBondContact O-N 3.36Å; V235-A238 PolarHBondContact O-N 2.96Å; V235-R239 HydrophobicContact CG1-CG 4.14Å; V235-R239 WeakPolarHBondContact O-CB 3.3Å; V235-R239 VanDerWaalsContact O-CG 3.31Å; V235-R239 WeakPolarHBondContact O-CG 3.42Å; V235-R239 PolarHBondContact O-N 2.94Å; V235-V252 HydrophobicContact CB-CG2 4.38Å; V235-V252 HydrophobicContact CG1-CB 3.79Å; V235-V252 HydrophobicContact CG1-CG2 3.56Å; V235-V252 HydrophobicContact CG2-CB 3.97Å; V235-V252 HydrophobicContact CG2-CG1 3.79Å; V235-V252 HydrophobicContact CG2-CG2 3.93Å; V235-L277 HydrophobicContact CG2-CD1 4.05Å; V235-L277 HydrophobicContact CG2-CD2 4.02Å; V235-I300 HydrophobicContact CG2-CD1 4.3Å
236	D	98.1	Very high	96.1	Very high	87 Å²	87	50.5 Å²	50.5	47%	0.465	22%	0.224	S	C	.	.	H	α-helix	trans	-64.8	-29.6	-180	-67.2	-23.6	0	0	0	112.6	E232 R240	E232-D236 PolarHBondContact O-N 2.94Å; D236-R240 WeakPolarHBondContact O-CG 3.48Å; D236-R240 PolarHBondContact O-N 2.99Å; D236-R240 PolarHBondContact O-NE 3.21Å
237	F	96.7	Very high	95.8	Very high	71 Å²	71	52.9 Å²	52.9	31%	0.311	25%	0.251	S	S	.	.	H	α-helix	trans	-69.6	-53.9	170.8	174.2	-99.5	0	0	0	112.1	K233 W234 V235 R239 R240 L241 P274	K233-F237 PolarHBondContact O-N 2.84Å; W234-F237 HydrophobicContact CE3-CB 3.8Å; W234-F237 AromaticContact CE3-CD1 3.64Å; W234-F237 HydrophobicContact CE3-CD1 3.64Å; W234-F237 HydrophobicContact CE3-CE1 4.37Å; W234-F237 AromaticContact CE3-CG 3.78Å; W234-F237 HydrophobicContact CE3-CG 3.78Å; W234-F237 HydrophobicContact CZ3-CB 4.23Å; W234-F237 AromaticContact CZ3-CD1 3.74Å; W234-F237 HydrophobicContact CZ3-CD1 3.74Å; W234-F237 HydrophobicContact CZ3-CD2 4.27Å; W234-F237 HydrophobicContact CZ3-CE1 4.12Å; W234-F237 AromaticContact CZ3-CG 3.81Å; W234-F237 HydrophobicContact CZ3-CG 3.81Å; W234-F237 PolarHBondContact O-N 3.02Å; V235-F237 PolarHBondContact O-N 3.36Å; F237-R239 PolarHBondContact O-N 3.05Å; F237-R240 PolarHBondContact O-N 3.37Å; F237-L241 HydrophobicContact CD1-CD1 4.31Å; F237-L241 HydrophobicContact CE1-CD1 3.64Å; F237-L241 HydrophobicContact CE2-CD1 4.3Å; F237-L241 HydrophobicContact CZ-CD1 3.64Å; F237-L241 HydrophobicContact CZ-CG 4.44Å; F237-L241 PolarHBondContact O-N 2.88Å; F237-P274 HydrophobicContact CD1-CB 3.97Å; F237-P274 HydrophobicContact CE1-CB 4Å
238	A	97.1	Very high	95.7	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.3	-36.6	-177	0	0	0	0	0	112.4	W234 V235 L241 C242 L277 K278 M281	W234-A238 WeakPolarHBondContact O-CB 3.17Å; W234-A238 PolarHBondContact O-N 3.25Å; V235-A238 PolarHBondContact O-N 2.96Å; A238-L241 PolarHBondContact O-N 3.23Å; A238-C242 VanDerWaalsContact O-CB 3.28Å; A238-C242 WeakPolarHBondContact O-CB 3.35Å; A238-C242 PolarHBondContact O-N 3.28Å; A238-L277 HydrophobicContact CB-CB 3.7Å; A238-K278 HydrophobicContact CB-CG 4.47Å; A238-M281 HydrophobicContact CB-CE 3.87Å; A238-M281 HydrophobicContact CB-SD 3.59Å; A238-M281 VanDerWaalsContact CB-SD 3.59Å
239	R	97.3	Very high	95.6	Very high	62 Å²	62	51.8 Å²	51.8	23%	0.234	25%	0.248	C	C	.	.	H	α-helix	trans	-62.2	-43.6	174.7	-73.1	-172.3	72.1	-112.9	-15.8	111.7	V235 F237 L241 C242 E243 A249 P250 M281	V235-R239 HydrophobicContact CG1-CG 4.14Å; V235-R239 WeakPolarHBondContact O-CB 3.3Å; V235-R239 VanDerWaalsContact O-CG 3.31Å; V235-R239 WeakPolarHBondContact O-CG 3.42Å; V235-R239 PolarHBondContact O-N 2.94Å; F237-R239 PolarHBondContact O-N 3.05Å; R239-L241 PolarHBondContact O-N 3.08Å; R239-C242 PolarHBondContact O-N 2.99Å; R239-C242 VanDerWaalsContact O-N 3.17Å; R239-E243 IonicContact CZ-OE1 2.91Å; R239-E243 VanDerWaalsContact CZ-OE1 3.22Å; R239-E243 IonicContact NE-OE1 2.66Å; R239-E243 IonicContact NH1-OE1 3.22Å; R239-E243 IonicContact NH2-OE1 2.65Å; R239-E243 PolarHBondContact NH2-OE1 3.41Å; R239-E243 WeakPolarHBondContact O-CB 3.28Å; R239-E243 VanDerWaalsContact O-CG 3.31Å; R239-E243 WeakPolarHBondContact O-CG 3.2Å; R239-E243 PolarHBondContact O-N 3.48Å; R239-A249 HydrophobicContact CB-CB 4.07Å; R239-A249 HydrophobicContact CG-CB 4.08Å; R239-P250 PolarHBondContact NE-O 3.21Å; R239-M281 HydrophobicContact CG-CE 3.51Å; R239-M281 HydrophobicContact CG-SD 4Å
240	R	96.4	Very high	95.6	Very high	159 Å²	159	45.4 Å²	45.4	60%	0.6	22%	0.221	S	C	*	.	H	α-helix	trans	-60.9	-41.9	176.3	-79.4	179.3	-70.8	162.6	-3.2	113	D236 F237 C242 H244	D236-R240 WeakPolarHBondContact O-CG 3.48Å; D236-R240 PolarHBondContact O-N 2.99Å; D236-R240 PolarHBondContact O-NE 3.21Å; F237-R240 PolarHBondContact O-N 3.37Å; R240-C242 VanDerWaalsContact C-N 3.34Å; R240-H244 VanDerWaalsContact O-CB 3.28Å; R240-H244 WeakPolarHBondContact O-CB 3.32Å; R240-H244 PolarHBondContact O-N 3.4Å
241	L	92.8	Very high	95.6	Very high	16 Å²	16	53.6 Å²	53.6	8%	0.084	25%	0.251	C	S	.	.	H	α-helix	trans	-66.5	-37.4	175.1	-64.7	-179.2	0	0	0	112.2	F237 A238 R239 K245 K278 M363	F237-L241 HydrophobicContact CD1-CD1 4.31Å; F237-L241 HydrophobicContact CE1-CD1 3.64Å; F237-L241 HydrophobicContact CE2-CD1 4.3Å; F237-L241 HydrophobicContact CZ-CD1 3.64Å; F237-L241 HydrophobicContact CZ-CG 4.44Å; F237-L241 PolarHBondContact O-N 2.88Å; A238-L241 PolarHBondContact O-N 3.23Å; R239-L241 PolarHBondContact O-N 3.08Å; L241-K245 WeakPolarHBondContact O-CB 3.33Å; L241-K245 PolarHBondContact O-N 3.28Å; L241-K278 HydrophobicContact CD1-CD 4.18Å; L241-M363 HydrophobicContact CB-SD 3.73Å
242	C	94.4	Very high	95.6	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-70	-46.9	178.1	-174.1	0	0	0	0	111.7	A238 R239 R240 H244 K245 Y246 N248 A249 M281 M285 M363	A238-C242 VanDerWaalsContact O-CB 3.28Å; A238-C242 WeakPolarHBondContact O-CB 3.35Å; A238-C242 PolarHBondContact O-N 3.28Å; R239-C242 PolarHBondContact O-N 2.99Å; R239-C242 VanDerWaalsContact O-N 3.17Å; R240-C242 VanDerWaalsContact C-N 3.34Å; C242-H244 VanDerWaalsContact C-N 3.35Å; C242-H244 PolarHBondContact O-N 2.89Å; C242-K245 PolarHBondContact O-N 2.9Å; C242-K245 VanDerWaalsContact O-N 3.11Å; C242-Y246 WeakPolarHBondContact O-CD2 3.45Å; C242-Y246 PolarHBondContact O-N 3.32Å; C242-N248 CarbonylContact C-O 3.54Å; C242-A249 HydrophobicContact CB-CB 3.67Å; C242-M281 HydrophobicContact CB-CB 4.29Å; C242-M281 HydrophobicContact CB-SD 4.21Å; C242-M285 VanDerWaalsContact SG-CG 3.51Å; C242-M363 HydrophobicContact CB-CE 3.65Å; C242-M363 HydrophobicContact CB-SD 4.28Å
243	E	94.4	Very high	95.6	Very high	65 Å²	65	58.4 Å²	58.4	30%	0.304	27%	0.269	S	S	.	.	H	α-helix	trans	-58.4	-43.8	173.8	-75.3	161.8	-175.8	0	0	111.4	R239 K245 G247 A249	R239-E243 IonicContact CZ-OE1 2.91Å; R239-E243 VanDerWaalsContact CZ-OE1 3.22Å; R239-E243 IonicContact NE-OE1 2.66Å; R239-E243 IonicContact NH1-OE1 3.22Å; R239-E243 IonicContact NH2-OE1 2.65Å; R239-E243 PolarHBondContact NH2-OE1 3.41Å; R239-E243 WeakPolarHBondContact O-CB 3.28Å; R239-E243 VanDerWaalsContact O-CG 3.31Å; R239-E243 WeakPolarHBondContact O-CG 3.2Å; R239-E243 PolarHBondContact O-N 3.48Å; E243-K245 VanDerWaalsContact C-N 3.29Å; E243-K245 PolarHBondContact O-N 3.49Å; E243-G247 WeakPolarHBondContact O-CA 3.28Å; E243-G247 PolarHBondContact O-N 3.04Å; E243-A249 HydrophobicContact CG-CB 3.74Å
244	H	91.4	Very high	95.6	Very high	94 Å²	94	55.1 Å²	55.1	44%	0.435	26%	0.256	S	S	.	.	H	α-helix	trans	-61.3	-34.3	175.4	-176.7	-78.1	0	0	0	113.1	R240 C242	R240-H244 VanDerWaalsContact O-CB 3.28Å; R240-H244 WeakPolarHBondContact O-CB 3.32Å; R240-H244 PolarHBondContact O-N 3.4Å; C242-H244 VanDerWaalsContact C-N 3.35Å; C242-H244 PolarHBondContact O-N 2.89Å
245	K	87.3	Confident	95.6	Very high	33 Å²	33	56.6 Å²	56.6	14%	0.143	27%	0.267	C	S	.	.	H	α-helix	trans	-90.1	-37.9	-176.7	-176.5	175.4	175.1	-164.4	0	114.1	L241 C242 E243 E286 F349 M363 H364	L241-K245 WeakPolarHBondContact O-CB 3.33Å; L241-K245 PolarHBondContact O-N 3.28Å; C242-K245 PolarHBondContact O-N 2.9Å; C242-K245 VanDerWaalsContact O-N 3.11Å; E243-K245 VanDerWaalsContact C-N 3.29Å; E243-K245 PolarHBondContact O-N 3.49Å; K245-E286 IonicContact NZ-OE1 3.13Å; K245-F349 VanDerWaalsContact CE-CE1 3.47Å; K245-F349 VanDerWaalsContact CE-CZ 3.4Å; K245-M363 HydrophobicContact CD-CB 3.63Å; K245-M363 HydrophobicContact CD-CG 4.24Å; K245-H364 PolarHBondContact NZ-CD2 3.27Å; K245-H364 VanDerWaalsContact NZ-CD2 3.34Å; K245-H364 PolarHBondContact NZ-NE2 2.91Å
246	Y	88.8	Confident	95.6	Very high	13 Å²	13	58.4 Å²	58.4	5%	0.051	29%	0.288	C	S	.	.	H	α-helix	trans	-117.9	4.1	-171	-56.1	-83.8	0	0	0	113.4	C242 N248 M285 E286 M363	C242-Y246 WeakPolarHBondContact O-CD2 3.45Å; C242-Y246 PolarHBondContact O-N 3.32Å; Y246-N248 PolarHBondContact O-N 2.81Å; Y246-N248 VanDerWaalsContact O-N 3.13Å; Y246-M285 HydrophobicContact CD1-CB 3.89Å; Y246-M285 HydrophobicContact CD2-CB 4.02Å; Y246-M285 HydrophobicContact CD2-CG 3.94Å; Y246-M285 HydrophobicContact CE1-CB 4.24Å; Y246-M285 HydrophobicContact CE2-CB 4.35Å; Y246-M285 HydrophobicContact CG-CB 3.78Å; Y246-M285 HydrophobicContact CG-CG 3.96Å; Y246-E286 HydrophobicContact CE1-CG 3.88Å; Y246-E286 PolarHBondContact OH-OE1 2.9Å; Y246-M363 HydrophobicContact CE2-CG 4.16Å
247	G	91.4	Very high	95.6	Very high	65 Å²	65	59.2 Å²	59.2	67%	0.67	29%	0.288	S	S	*	.	S	Bend	trans	75	-10.9	-177.9	0	0	0	0	0	115.2	E243	E243-G247 WeakPolarHBondContact O-CA 3.28Å; E243-G247 PolarHBondContact O-N 3.04Å
248	N	95	Very high	95.7	Very high	44 Å²	44	58.3 Å²	58.3	24%	0.235	29%	0.289	C	S	.	.			trans	-154.2	168.4	176.6	-168	19.9	0	0	0	109.9	C242 Y246 M285 P292	C242-N248 CarbonylContact C-O 3.54Å; Y246-N248 PolarHBondContact O-N 2.81Å; Y246-N248 VanDerWaalsContact O-N 3.13Å; N248-M285 HydrophobicContact CB-CE 4.14Å; N248-P292 WeakPolarHBondContact CB-O 3.45Å; N248-P292 PolarHBondContact ND2-O 2.92Å
249	A	97.3	Very high	95.7	Very high	2 Å²	2	62.5 Å²	62.5	2%	0.017	32%	0.323	C	S	.	.			trans	-142.9	146.6	170.9	0	0	0	0	0	111.1	R239 C242 E243	R239-A249 HydrophobicContact CB-CB 4.07Å; R239-A249 HydrophobicContact CG-CB 4.08Å; C242-A249 HydrophobicContact CB-CB 3.67Å; E243-A249 HydrophobicContact CG-CB 3.74Å
250	P	98.1	Very high	95.7	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.006	32%	0.318	C	S	.	.			trans	-60.1	145.7	175.9	28.2	-35.7	0	0	0	110.8	R239 M281 T284 V295 P296 V298	R239-P250 PolarHBondContact NE-O 3.21Å; P250-M281 HydrophobicContact CG-CB 4.24Å; P250-M281 HydrophobicContact CG-CG 3.85Å; P250-T284 HydrophobicContact CB-CG2 4.04Å; P250-T284 HydrophobicContact CG-CG2 4.12Å; P250-V295 HydrophobicContact CB-CG2 3.83Å; P250-P296 VanDerWaalsContact CB-O 3.31Å; P250-P296 WeakPolarHBondContact CB-O 3.18Å; P250-V298 HydrophobicContact CB-CG2 4.24Å; P250-V298 HydrophobicContact CG-CG2 3.93Å
251	R	98.1	Very high	95.7	Very high	186 Å²	186	58.5 Å²	58.5	70%	0.702	31%	0.312	S	S	*	.			trans	-71.1	157.3	170.1	-58.9	178.2	175.1	-165.4	-1.5	108.8	D297 V298	R251-D297 WeakPolarHBondContact CB-OD1 3.41Å; R251-D297 CarbonylContact O-C 3.59Å; R251-D297 WeakPolarHBondContact O-CA 3.26Å; R251-V298 PolarHBondContact O-N 2.91Å
252	V	98.7	Very high	95.8	Very high	30 Å²	30	58.5 Å²	58.5	18%	0.182	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.5	179.2	-172.6	0	0	0	0	109.9	V235 I254 M281 V298 I300	V235-V252 HydrophobicContact CB-CG2 4.38Å; V235-V252 HydrophobicContact CG1-CB 3.79Å; V235-V252 HydrophobicContact CG1-CG2 3.56Å; V235-V252 HydrophobicContact CG2-CB 3.97Å; V235-V252 HydrophobicContact CG2-CG1 3.79Å; V235-V252 HydrophobicContact CG2-CG2 3.93Å; V252-I254 HydrophobicContact CG1-CG1 4.44Å; V252-M281 HydrophobicContact CG2-CE 3.82Å; V252-V298 VanDerWaalsContact CA-O 3.3Å; V252-V298 WeakPolarHBondContact CA-O 3.14Å; V252-V298 HydrophobicContact CG2-CB 4.3Å; V252-I300 HydrophobicContact CG1-CD1 3.45Å; V252-I300 VanDerWaalsContact CG1-CD1 3.45Å; V252-I300 HydrophobicContact CG1-CG1 3.74Å
253	R	98.6	Very high	95.7	Very high	144 Å²	144	60.1 Å²	60.1	54%	0.543	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	122.5	176	-66.9	-174.3	-64.7	-170.7	-6.6	109.9	D297 V298 V299 I300	R253-D297 WeakPolarHBondContact CD-OD2 3.49Å; R253-D297 HydrophobicContact CG-CB 4.37Å; R253-D297 WeakPolarHBondContact CG-OD2 3.11Å; R253-D297 IonicContact CZ-OD2 3.6Å; R253-D297 VanDerWaalsContact CZ-OD2 3.28Å; R253-D297 IonicContact NE-OD2 3.64Å; R253-D297 PolarHBondContact NE-OD2 3Å; R253-D297 IonicContact NH1-OD2 2.79Å; R253-D297 IonicContact NH2-OD2 3.39Å; R253-V298 PolarHBondContact N-O 3.3Å; R253-V299 WeakPolarHBondContact O-CA 3.45Å; R253-I300 PolarHBondContact O-N 3.37Å
254	I	98.8	Very high	95.6	Very high	36 Å²	36	57.3 Å²	57.3	19%	0.185	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123.9	-179.1	-49.4	175.3	0	0	0	109.5	K228 I231 E232 V252 V258 I300 I302	K228-I254 HydrophobicContact CG-CD1 4.39Å; I231-I254 HydrophobicContact CB-CD1 4.29Å; I231-I254 HydrophobicContact CG2-CD1 3.66Å; I231-I254 HydrophobicContact CG2-CG1 4.28Å; E232-I254 HydrophobicContact CG-CD1 3.67Å; V252-I254 HydrophobicContact CG1-CG1 4.44Å; I254-V258 HydrophobicContact CG2-CG1 4.11Å; I254-I300 CarbonylContact C-O 3.56Å; I254-I300 WeakPolarHBondContact CA-O 3.09Å; I254-I300 HydrophobicContact CG1-CB 4.47Å; I254-I302 HydrophobicContact CG2-CD1 3.64Å; I254-I302 HydrophobicContact CG2-CG1 4.11Å
255	N	98.5	Very high	95.7	Very high	69 Å²	69	53 Å²	53	37%	0.369	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	-178.9	179.7	65.6	28.3	0	0	0	112.4	I300 T301 I302	N255-I300 PolarHBondContact N-O 3.01Å; N255-I300 PolarHBondContact OD1-O 2.86Å; N255-T301 VanDerWaalsContact OD1-CA 3.29Å; N255-T301 WeakPolarHBondContact OD1-CA 3.38Å; N255-T301 VanDerWaalsContact OD1-CB 3.28Å; N255-T301 WeakPolarHBondContact OD1-CB 3.5Å; N255-T301 WeakPolarHBondContact OD1-CG2 3.48Å; N255-T301 PolarHBondContact OD1-OG1 2.81Å; N255-I302 PolarHBondContact O-N 3.1Å
256	G	98.4	Very high	96.1	Very high	49 Å²	49	52.2 Å²	52.2	51%	0.505	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	83.9	-141.7	-171.3	0	0	0	0	0	112.1	V258 I302	G256-V258 PolarHBondContact O-N 2.84Å; G256-I302 CarbonylContact C-O 3.6Å; G256-I302 WeakPolarHBondContact CA-O 3.2Å
257	H	98.4	Very high	96.4	Very high	104 Å²	104	52.9 Å²	52.9	48%	0.481	29%	0.291	S	S	.	.	S	Bend	trans	-76.8	57	-174.9	-59.9	99.8	0	0	0	113.1	A259 A260 I302 N304	H257-A259 PolarHBondContact O-N 2.95Å; H257-A259 VanDerWaalsContact O-N 3.12Å; H257-A260 HydrophobicContact CB-CB 4.16Å; H257-A260 VanDerWaalsContact O-CB 3.23Å; H257-A260 WeakPolarHBondContact O-CB 3.42Å; H257-A260 PolarHBondContact O-N 2.84Å; H257-I302 HydrophobicContact CB-CG2 4.48Å; H257-I302 PolarHBondContact N-O 2.94Å; H257-I302 PolarHBondContact ND1-O 2.87Å; H257-N304 HydrophobicContact CB-CB 4.24Å; H257-N304 PolarHBondContact ND1-N 3.09Å
258	V	97.8	Very high	96.6	Very high	52 Å²	52	49.9 Å²	49.9	32%	0.315	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-21.5	-177.3	-67.4	0	0	0	0	114.6	K228 I254 G256	K228-V258 HydrophobicContact CD-CB 3.88Å; K228-V258 HydrophobicContact CD-CG1 4.24Å; I254-V258 HydrophobicContact CG2-CG1 4.11Å; G256-V258 PolarHBondContact O-N 2.84Å
259	A	98.1	Very high	96.7	Very high	88 Å²	88	47.8 Å²	47.8	73%	0.727	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-3.5	177.7	0	0	0	0	0	113.9	H257	H257-A259 PolarHBondContact O-N 2.95Å; H257-A259 VanDerWaalsContact O-N 3.12Å
260	A	96.8	Very high	96.6	Very high	16 Å²	16	49.8 Å²	49.8	13%	0.132	26%	0.259	C	S	.	.			trans	-58.2	142.1	-177.3	0	0	0	0	0	112.1	P227 H257 F262 N304	P227-A260 WeakPolarHBondContact CD-O 3.5Å; P227-A260 HydrophobicContact CG-CB 4.29Å; H257-A260 HydrophobicContact CB-CB 4.16Å; H257-A260 VanDerWaalsContact O-CB 3.23Å; H257-A260 WeakPolarHBondContact O-CB 3.42Å; H257-A260 PolarHBondContact O-N 2.84Å; A260-F262 HydrophobicContact CB-CD1 4.34Å; A260-F262 HydrophobicContact CB-CE1 4.04Å; A260-N304 HydrophobicContact CB-CB 4.12Å
261	R	96.8	Very high	96.4	Very high	122 Å²	122	53.4 Å²	53.4	46%	0.46	27%	0.273	S	S	.	.			trans	-145.5	134.3	171.4	-47	-171.5	83.7	115.9	-3.7	109.7	R224 L225	R224-R261 HydrophobicContact CB-CB 4.48Å; R224-R261 PolarHBondContact O-NE 2.99Å; R224-R261 PolarHBondContact O-NH2 3.45Å; L225-R261 VanDerWaalsContact O-CA 3.29Å; L225-R261 WeakPolarHBondContact O-CA 3.38Å
262	F	93.9	Very high	96.4	Very high	15 Å²	15	44.6 Å²	44.6	7%	0.066	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	163.6	-177.2	43.7	-92.9	0	0	0	110.6	L225 P227 A260 F264 N304 L309 H402	L225-F262 HydrophobicContact CD2-CE2 4.07Å; L225-F262 HydrophobicContact CD2-CZ 4.23Å; L225-F262 PolarHBondContact N-O 2.89Å; L225-F262 PolarHBondContact O-N 2.81Å; P227-F262 HydrophobicContact CB-CZ 4.4Å; P227-F262 HydrophobicContact CG-CE1 3.96Å; P227-F262 HydrophobicContact CG-CZ 4.01Å; A260-F262 HydrophobicContact CB-CD1 4.34Å; A260-F262 HydrophobicContact CB-CE1 4.04Å; F262-F264 HydrophobicContact CD2-CB 3.88Å; F262-F264 AromaticContact CD2-CD2 3.98Å; F262-F264 HydrophobicContact CD2-CD2 3.98Å; F262-F264 HydrophobicContact CD2-CG 4.23Å; F262-F264 HydrophobicContact CE2-CB 3.82Å; F262-F264 AromaticContact CE2-CD2 3.67Å; F262-F264 HydrophobicContact CE2-CD2 3.67Å; F262-F264 HydrophobicContact CE2-CE2 4.46Å; F262-F264 AromaticContact CE2-CG 3.83Å; F262-F264 HydrophobicContact CE2-CG 3.83Å; F262-F264 PolarHBondContact O-N 3.08Å; F262-N304 WeakPolarHBondContact CD1-OD1 3.15Å; F262-N304 WeakPolarHBondContact CE1-OD1 3.29Å; F262-L309 HydrophobicContact CE1-CD1 4.33Å; F262-L309 HydrophobicContact CE2-CD2 4.15Å; F262-L309 HydrophobicContact CZ-CB 4.41Å; F262-L309 HydrophobicContact CZ-CD1 3.81Å; F262-L309 HydrophobicContact CZ-CD2 3.82Å; F262-L309 HydrophobicContact CZ-CG 4.21Å; F262-H402 AromaticContact CD1-NE2 2.96Å; F262-H402 WeakPolarHBondContact CD1-NE2 3.21Å; F262-H402 AromaticContact CD2-CE1 2.96Å; F262-H402 WeakPolarHBondContact CD2-CE1 3.45Å; F262-H402 AromaticContact CD2-ND1 3.53Å; F262-H402 AromaticContact CD2-NE2 2.82Å; F262-H402 WeakPolarHBondContact CD2-NE2 3.35Å; F262-H402 AromaticContact CE1-NE2 3.02Å; F262-H402 WeakPolarHBondContact CE1-NE2 3.31Å; F262-H402 AromaticContact CE2-CE1 3.61Å; F262-H402 AromaticContact CE2-ND1 3.97Å; F262-H402 AromaticContact CE2-NE2 2.86Å; F262-H402 WeakPolarHBondContact CE2-NE2 3.33Å; F262-H402 AromaticContact CG-CE1 3.5Å; F262-H402 VanDerWaalsContact CG-CE1 3.5Å; F262-H402 WeakPolarHBondContact CG-CE1 3.41Å; F262-H402 AromaticContact CG-ND1 3.91Å; F262-H402 AromaticContact CG-NE2 2.88Å; F262-H402 WeakPolarHBondContact CG-NE2 3.19Å; F262-H402 AromaticContact CZ-NE2 2.98Å; F262-H402 WeakPolarHBondContact CZ-NE2 3.41Å
263	P	92.4	Very high	96.4	Very high	34 Å²	34	43.2 Å²	43.2	22%	0.221	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	124.8	170.8	-20.6	34	0	0	0	111.2	C222	C222-P263 CarbonylContact O-C 3.53Å; C222-P263 VanDerWaalsContact O-CA 3.31Å; C222-P263 WeakPolarHBondContact O-CA 3.46Å
264	F	93.3	Very high	96.3	Very high	7 Å²	7	36.7 Å²	36.7	3%	0.031	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	155.9	-179.3	-149.9	-101.7	0	0	0	113.3	C222 L225 F262 L269 L309 L400 R401 H402	C222-F264 PolarHBondContact N-O 3.26Å; C222-F264 PolarHBondContact O-N 3.01Å; L225-F264 HydrophobicContact CB-CB 3.89Å; L225-F264 HydrophobicContact CD1-CB 4.21Å; L225-F264 HydrophobicContact CD1-CD1 4.46Å; L225-F264 HydrophobicContact CD2-CB 4.05Å; L225-F264 HydrophobicContact CD2-CD1 4.4Å; L225-F264 HydrophobicContact CD2-CG 4.45Å; L225-F264 HydrophobicContact CG-CB 4.25Å; F262-F264 HydrophobicContact CD2-CB 3.88Å; F262-F264 AromaticContact CD2-CD2 3.98Å; F262-F264 HydrophobicContact CD2-CD2 3.98Å; F262-F264 HydrophobicContact CD2-CG 4.23Å; F262-F264 HydrophobicContact CE2-CB 3.82Å; F262-F264 AromaticContact CE2-CD2 3.67Å; F262-F264 HydrophobicContact CE2-CD2 3.67Å; F262-F264 HydrophobicContact CE2-CE2 4.46Å; F262-F264 AromaticContact CE2-CG 3.83Å; F262-F264 HydrophobicContact CE2-CG 3.83Å; F262-F264 PolarHBondContact O-N 3.08Å; F264-L269 HydrophobicContact CD1-CD1 3.97Å; F264-L269 HydrophobicContact CE1-CD1 3.79Å; F264-L269 HydrophobicContact CE1-CG 4.11Å; F264-L309 HydrophobicContact CZ-CD2 4.45Å; F264-L400 HydrophobicContact CE1-CD1 4.14Å; F264-L400 HydrophobicContact CE2-CB 4.47Å; F264-L400 HydrophobicContact CZ-CB 3.79Å; F264-L400 HydrophobicContact CZ-CD1 3.89Å; F264-R401 WeakPolarHBondContact CE2-O 3.33Å; F264-H402 AromaticContact CD2-CE1 3.83Å
265	I	94.1	Very high	96.2	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.015	21%	0.212	C	C	.	.			trans	-92.6	117.7	172.2	-48.1	-172.1	0	0	0	108.6	P72 M202 I220 I221 M267 P268 I403 F410 I412	P72-I265 HydrophobicContact CB-CD1 4.16Å; P72-I265 HydrophobicContact CG-CD1 4.18Å; M202-I265 HydrophobicContact CE-CB 4.4Å; M202-I265 HydrophobicContact CE-CD1 3.59Å; M202-I265 HydrophobicContact CE-CG2 3.96Å; I220-I265 HydrophobicContact CD1-CG2 3.74Å; I220-I265 HydrophobicContact CG1-CG2 4.03Å; I221-I265 HydrophobicContact CG1-CD1 4.43Å; I221-I265 HydrophobicContact CG1-CG1 4.21Å; I221-I265 HydrophobicContact CG2-CG1 4.47Å; I265-M267 HydrophobicContact CG2-CB 4.27Å; I265-M267 PolarHBondContact O-N 3Å; I265-P268 WeakPolarHBondContact O-CD 3.48Å; I265-I403 HydrophobicContact CG1-CD1 3.88Å; I265-F410 HydrophobicContact CD1-CZ 4.47Å; I265-I412 HydrophobicContact CD1-CD1 3.96Å
266	P	95.9	Very high	96.2	Very high	17 Å²	17	34.6 Å²	34.6	11%	0.11	20%	0.195	C	C	.	.	S	Bend	trans	-69.5	-30.9	-178	-16	28.8	0	0	0	113.7	F217 I220 C222 L225 I230 L269 D270	F217-P266 HydrophobicContact CE1-CG 4Å; F217-P266 HydrophobicContact CZ-CG 4.29Å; I220-P266 WeakPolarHBondContact O-CD 3.33Å; C222-P266 HydrophobicContact CB-CG 4.18Å; L225-P266 HydrophobicContact CD1-CB 4.01Å; L225-P266 HydrophobicContact CD1-CG 3.86Å; I230-P266 HydrophobicContact CD1-CB 3.93Å; P266-L269 WeakPolarHBondContact O-CA 3.31Å; P266-L269 WeakPolarHBondContact O-CB 3.47Å; P266-L269 PolarHBondContact O-N 2.95Å; P266-D270 PolarHBondContact O-N 3.26Å
267	M	94.8	Very high	96.2	Very high	26 Å²	26	32.3 Å²	32.3	13%	0.128	17%	0.171	C	C	.	.	H	α-helix	trans	-53.1	-42.1	-167.8	-174.2	-173.9	-64	0	0	115.2	L198 M202 T205 I220 I265 D270 Y271	L198-M267 HydrophobicContact CD1-CG 4.48Å; L198-M267 HydrophobicContact CD1-SD 4.24Å; M202-M267 HydrophobicContact CB-SD 4.44Å; M202-M267 HydrophobicContact CG-SD 3.57Å; M202-M267 VanDerWaalsContact CG-SD 3.57Å; T205-M267 HydrophobicContact CG2-CE 3.96Å; I220-M267 HydrophobicContact CD1-CE 4.17Å; I220-M267 HydrophobicContact CG2-CE 4.27Å; I265-M267 HydrophobicContact CG2-CB 4.27Å; I265-M267 PolarHBondContact O-N 3Å; M267-D270 WeakPolarHBondContact O-CB 3.32Å; M267-D270 PolarHBondContact O-N 3.48Å; M267-Y271 HydrophobicContact CG-CD2 4.34Å; M267-Y271 HydrophobicContact CG-CE2 4.05Å; M267-Y271 VanDerWaalsContact O-CD2 3.31Å; M267-Y271 WeakPolarHBondContact O-CD2 3.33Å; M267-Y271 PolarHBondContact O-N 3.06Å
268	P	94.4	Very high	96.1	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.019	15%	0.152	C	C	.	.	H	α-helix	trans	-66.3	-37.2	176.3	-21.8	35.7	0	0	0	113.1	M202 I265 D270 Y271 I272 L380	M202-P268 HydrophobicContact CE-CG 4.23Å; I265-P268 WeakPolarHBondContact O-CD 3.48Å; P268-D270 VanDerWaalsContact C-N 3.32Å; P268-Y271 PolarHBondContact O-N 3.4Å; P268-I272 VanDerWaalsContact O-CG1 3.3Å; P268-I272 WeakPolarHBondContact O-CG1 3.43Å; P268-I272 PolarHBondContact O-N 3.35Å; P268-L380 HydrophobicContact CB-CD1 3.39Å; P268-L380 HydrophobicContact CG-CD1 3.33Å
269	L	97.4	Very high	96.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.3	-35.6	174.9	-67.5	173.2	0	0	0	111.2	L225 I230 F264 P266 Y271 I272 L273 L309 I311 L398 L400	L225-L269 HydrophobicContact CD2-CD1 4.44Å; I230-L269 HydrophobicContact CD1-CB 3.72Å; I230-L269 HydrophobicContact CD1-CD1 4.24Å; I230-L269 HydrophobicContact CG1-CB 4.42Å; I230-L269 HydrophobicContact CG2-CD1 4.13Å; F264-L269 HydrophobicContact CD1-CD1 3.97Å; F264-L269 HydrophobicContact CE1-CD1 3.79Å; F264-L269 HydrophobicContact CE1-CG 4.11Å; P266-L269 WeakPolarHBondContact O-CA 3.31Å; P266-L269 WeakPolarHBondContact O-CB 3.47Å; P266-L269 PolarHBondContact O-N 2.95Å; L269-Y271 PolarHBondContact O-N 3.02Å; L269-I272 PolarHBondContact O-N 3.09Å; L269-L273 HydrophobicContact CB-CD1 3.94Å; L269-L273 HydrophobicContact CB-CG 4.28Å; L269-L273 HydrophobicContact CD2-CD1 4.26Å; L269-L273 HydrophobicContact CD2-CD2 4.5Å; L269-L273 HydrophobicContact CD2-CG 4.24Å; L269-L273 VanDerWaalsContact O-CB 3.31Å; L269-L273 WeakPolarHBondContact O-CB 3.5Å; L269-L273 WeakPolarHBondContact O-CG 3.45Å; L269-L273 PolarHBondContact O-N 2.74Å; L269-L309 HydrophobicContact CD1-CD2 4.43Å; L269-I311 HydrophobicContact CD2-CD1 3.89Å; L269-L398 HydrophobicContact CD2-CD2 3.97Å; L269-L400 HydrophobicContact CD2-CD1 3.7Å; L269-L400 HydrophobicContact CG-CD1 4.19Å
270	D	95.6	Very high	96.1	Very high	44 Å²	44	24.3 Å²	24.3	24%	0.235	12%	0.117	C	C	.	.	H	α-helix	trans	-63.2	-21.3	173.2	-72.9	-38.2	0	0	0	113.8	K233 W234 P266 M267 P268 P274	K233-D270 IonicContact NZ-OD1 3.72Å; K233-D270 PolarHBondContact NZ-OD1 3.09Å; K233-D270 IonicContact NZ-OD2 3.61Å; W234-D270 VanDerWaalsContact CE2-OD1 3.28Å; W234-D270 HydrophobicContact CZ2-CB 3.75Å; W234-D270 WeakPolarHBondContact CZ2-O 3.31Å; W234-D270 VanDerWaalsContact CZ2-OD1 3.3Å; W234-D270 WeakPolarHBondContact CZ2-OD1 3.22Å; W234-D270 PolarHBondContact NE1-OD1 2.94Å; P266-D270 PolarHBondContact O-N 3.26Å; M267-D270 WeakPolarHBondContact O-CB 3.32Å; M267-D270 PolarHBondContact O-N 3.48Å; P268-D270 VanDerWaalsContact C-N 3.32Å; D270-P274 WeakPolarHBondContact O-CG 3.46Å
271	Y	94.1	Very high	96.2	Very high	77 Å²	77	23.5 Å²	23.5	30%	0.302	11%	0.111	S	C	.	.	H	α-helix	trans	-90.4	-47.7	169.5	-78.3	-70.5	0	0	0	112.8	L198 R201 M267 P268 L269 Y376	L198-Y271 HydrophobicContact CD1-CD2 4.11Å; L198-Y271 HydrophobicContact CD1-CE2 4.08Å; R201-Y271 PolarHBondContact NE-OH 3.43Å; M267-Y271 HydrophobicContact CG-CD2 4.34Å; M267-Y271 HydrophobicContact CG-CE2 4.05Å; M267-Y271 VanDerWaalsContact O-CD2 3.31Å; M267-Y271 WeakPolarHBondContact O-CD2 3.33Å; M267-Y271 PolarHBondContact O-N 3.06Å; P268-Y271 PolarHBondContact O-N 3.4Å; L269-Y271 PolarHBondContact O-N 3.02Å; Y271-Y376 HydrophobicContact CD1-CE2 4.31Å; Y271-Y376 HydrophobicContact CD2-CE2 4.2Å; Y271-Y376 HydrophobicContact CG-CD2 4.42Å; Y271-Y376 AromaticContact CG-CE2 3.9Å; Y271-Y376 HydrophobicContact CG-CE2 3.9Å
272	I	98.1	Very high	96.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-76	-47.5	-168.3	-64.1	166.3	0	0	0	112	P268 L269 E275 L276 L398	P268-I272 VanDerWaalsContact O-CG1 3.3Å; P268-I272 WeakPolarHBondContact O-CG1 3.43Å; P268-I272 PolarHBondContact O-N 3.35Å; L269-I272 PolarHBondContact O-N 3.09Å; I272-E275 PolarHBondContact O-N 2.69Å; I272-L276 HydrophobicContact CG2-CD1 3.65Å; I272-L276 HydrophobicContact CG2-CG 3.94Å; I272-L276 WeakPolarHBondContact O-CG 3.48Å; I272-L276 PolarHBondContact O-N 3.33Å; I272-L276 VanDerWaalsContact O-N 3.13Å; I272-L398 HydrophobicContact CB-CD2 4.41Å; I272-L398 HydrophobicContact CD1-CD1 4.09Å; I272-L398 HydrophobicContact CG2-CD1 4.16Å; I272-L398 HydrophobicContact CG2-CD2 3.72Å
273	L	98.4	Very high	96.2	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-57.2	-48.6	-173.9	-65.9	175.8	0	0	0	113.7	I230 I231 W234 L269 E275 L276 L277 I311	I230-L273 HydrophobicContact CG1-CD1 4.22Å; I230-L273 HydrophobicContact CG2-CD1 4.45Å; I231-L273 HydrophobicContact CG1-CD1 3.97Å; I231-L273 HydrophobicContact CG1-CD2 4.35Å; W234-L273 HydrophobicContact CB-CB 4.05Å; W234-L273 HydrophobicContact CG-CB 4.16Å; L269-L273 HydrophobicContact CB-CD1 3.94Å; L269-L273 HydrophobicContact CB-CG 4.28Å; L269-L273 HydrophobicContact CD2-CD1 4.26Å; L269-L273 HydrophobicContact CD2-CD2 4.5Å; L269-L273 HydrophobicContact CD2-CG 4.24Å; L269-L273 VanDerWaalsContact O-CB 3.31Å; L269-L273 WeakPolarHBondContact O-CB 3.5Å; L269-L273 WeakPolarHBondContact O-CG 3.45Å; L269-L273 PolarHBondContact O-N 2.74Å; L273-E275 VanDerWaalsContact C-N 3.31Å; L273-E275 PolarHBondContact O-N 3.25Å; L273-L276 PolarHBondContact O-N 3.13Å; L273-L277 HydrophobicContact CB-CD1 4.45Å; L273-L277 VanDerWaalsContact O-CB 3.31Å; L273-L277 WeakPolarHBondContact O-CB 3.44Å; L273-L277 WeakPolarHBondContact O-CD1 3.38Å; L273-L277 WeakPolarHBondContact O-CG 3.35Å; L273-L277 PolarHBondContact O-N 3.37Å; L273-I311 HydrophobicContact CD2-CD1 4.14Å; L273-I311 HydrophobicContact CD2-CG2 4.42Å
274	P	96.9	Very high	96.5	Very high	8 Å²	8	17.7 Å²	17.7	5%	0.052	9%	0.09	C	C	.	.	H	α-helix	trans	-63.1	-33	178.7	22.5	-32.2	0	0	0	113.4	W234 F237 D270 K278	W234-P274 HydrophobicContact CD2-CB 4.25Å; W234-P274 HydrophobicContact CD2-CG 4.03Å; W234-P274 HydrophobicContact CE3-CB 3.69Å; W234-P274 HydrophobicContact CE3-CG 3.78Å; W234-P274 HydrophobicContact CH2-CG 4.45Å; W234-P274 HydrophobicContact CZ3-CB 4.11Å; W234-P274 HydrophobicContact CZ3-CG 4.01Å; F237-P274 HydrophobicContact CD1-CB 3.97Å; F237-P274 HydrophobicContact CE1-CB 4Å; D270-P274 WeakPolarHBondContact O-CG 3.46Å; P274-K278 WeakPolarHBondContact O-CB 3.28Å; P274-K278 VanDerWaalsContact O-CE 3.28Å; P274-K278 WeakPolarHBondContact O-CE 3.47Å; P274-K278 WeakPolarHBondContact O-CG 3.33Å; P274-K278 PolarHBondContact O-N 3.46Å
275	E	96.5	Very high	96.6	Very high	57 Å²	57	17.5 Å²	17.5	27%	0.266	9%	0.089	S	C	.	.	H	α-helix	trans	-67.4	-45.9	176.3	-65.4	-54.6	131.4	0	0	111.9	I272 L273 K278 N279 G369	I272-E275 PolarHBondContact O-N 2.69Å; L273-E275 VanDerWaalsContact C-N 3.31Å; L273-E275 PolarHBondContact O-N 3.25Å; E275-K278 VanDerWaalsContact CD-NZ 3.25Å; E275-K278 WeakPolarHBondContact OE1-CE 3.46Å; E275-K278 IonicContact OE1-NZ 2.66Å; E275-K278 PolarHBondContact OE1-NZ 3.34Å; E275-K278 IonicContact OE2-NZ 3.72Å; E275-K278 PolarHBondContact OE2-NZ 3.01Å; E275-N279 VanDerWaalsContact O-CG 3.29Å; E275-N279 PolarHBondContact O-N 3.03Å; E275-N279 VanDerWaalsContact O-N 3.13Å; E275-N279 PolarHBondContact O-ND2 3.45Å; E275-G369 WeakPolarHBondContact OE2-CA 3.48Å
276	L	98.4	Very high	96.6	Very high	3 Å²	3	19 Å²	19	2%	0.016	10%	0.096	C	C	.	.	H	α-helix	trans	-67.2	-40.6	178.6	-57.3	-174.4	0	0	0	112.1	I272 L273 N279 A280 I313 L370 L384 V396 L398	I272-L276 HydrophobicContact CG2-CD1 3.65Å; I272-L276 HydrophobicContact CG2-CG 3.94Å; I272-L276 WeakPolarHBondContact O-CG 3.48Å; I272-L276 PolarHBondContact O-N 3.33Å; I272-L276 VanDerWaalsContact O-N 3.13Å; L273-L276 PolarHBondContact O-N 3.13Å; L276-N279 PolarHBondContact O-N 2.94Å; L276-A280 PolarHBondContact O-N 3.3Å; L276-I313 HydrophobicContact CB-CD1 3.7Å; L276-I313 HydrophobicContact CD1-CD1 4.09Å; L276-L370 HydrophobicContact CD2-CD2 3.88Å; L276-L384 HydrophobicContact CD1-CD1 3.86Å; L276-L384 HydrophobicContact CD2-CD1 4.31Å; L276-L384 HydrophobicContact CD2-CD2 4.22Å; L276-V396 HydrophobicContact CD1-CG1 3.86Å; L276-V396 HydrophobicContact CD2-CG1 4.05Å; L276-V396 HydrophobicContact CG-CG1 4.47Å; L276-L398 HydrophobicContact CD1-CB 4.47Å
277	L	98.6	Very high	96.5	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-65.4	-43.2	177.3	-70.8	168.4	0	0	0	111.9	W234 V235 A238 L273 N279 A280 M281 I300 I313	W234-L277 VanDerWaalsContact C-CD1 3.45Å; W234-L277 HydrophobicContact CB-CD1 3.74Å; V235-L277 HydrophobicContact CG2-CD1 4.05Å; V235-L277 HydrophobicContact CG2-CD2 4.02Å; A238-L277 HydrophobicContact CB-CB 3.7Å; L273-L277 HydrophobicContact CB-CD1 4.45Å; L273-L277 VanDerWaalsContact O-CB 3.31Å; L273-L277 WeakPolarHBondContact O-CB 3.44Å; L273-L277 WeakPolarHBondContact O-CD1 3.38Å; L273-L277 WeakPolarHBondContact O-CG 3.35Å; L273-L277 PolarHBondContact O-N 3.37Å; L277-N279 VanDerWaalsContact C-N 3.31Å; L277-N279 PolarHBondContact O-N 2.96Å; L277-A280 PolarHBondContact O-N 2.94Å; L277-M281 HydrophobicContact CB-CE 4.47Å; L277-M281 HydrophobicContact CD2-CE 4.45Å; L277-M281 WeakPolarHBondContact O-CB 3.25Å; L277-M281 VanDerWaalsContact O-CG 3.23Å; L277-M281 WeakPolarHBondContact O-CG 3.18Å; L277-M281 PolarHBondContact O-N 2.69Å; L277-I300 HydrophobicContact CD2-CD1 3.73Å; L277-I313 HydrophobicContact CD2-CD1 4.43Å
278	K	96.9	Very high	96.6	Very high	21 Å²	21	21.8 Å²	21.8	9%	0.091	11%	0.113	C	C	.	.	H	α-helix	trans	-58.6	-44.1	174.1	-78.1	-178.6	-59.2	173.5	0	111.4	A238 L241 P274 E275 R282 M363	A238-K278 HydrophobicContact CB-CG 4.47Å; L241-K278 HydrophobicContact CD1-CD 4.18Å; P274-K278 WeakPolarHBondContact O-CB 3.28Å; P274-K278 VanDerWaalsContact O-CE 3.28Å; P274-K278 WeakPolarHBondContact O-CE 3.47Å; P274-K278 WeakPolarHBondContact O-CG 3.33Å; P274-K278 PolarHBondContact O-N 3.46Å; E275-K278 VanDerWaalsContact CD-NZ 3.25Å; E275-K278 WeakPolarHBondContact OE1-CE 3.46Å; E275-K278 IonicContact OE1-NZ 2.66Å; E275-K278 PolarHBondContact OE1-NZ 3.34Å; E275-K278 IonicContact OE2-NZ 3.72Å; E275-K278 PolarHBondContact OE2-NZ 3.01Å; K278-R282 WeakPolarHBondContact O-CB 3.27Å; K278-R282 PolarHBondContact O-N 3.25Å; K278-M363 HydrophobicContact CB-CE 4.03Å; K278-M363 HydrophobicContact CB-SD 4.35Å; K278-M363 HydrophobicContact CD-SD 4.42Å; K278-M363 HydrophobicContact CG-CE 4.04Å; K278-M363 HydrophobicContact CG-SD 3.91Å; K278-M363 WeakPolarHBondContact O-CE 3.39Å
279	N	97	Very high	96.4	Very high	52 Å²	52	23.5 Å²	23.5	28%	0.278	12%	0.122	S	C	.	.	H	α-helix	trans	-62.1	-49.8	178.2	-70.1	-21.2	0	0	0	112.2	E275 L276 L277 M281 R282 A283	E275-N279 VanDerWaalsContact O-CG 3.29Å; E275-N279 PolarHBondContact O-N 3.03Å; E275-N279 VanDerWaalsContact O-N 3.13Å; E275-N279 PolarHBondContact O-ND2 3.45Å; L276-N279 PolarHBondContact O-N 2.94Å; L277-N279 VanDerWaalsContact C-N 3.31Å; L277-N279 PolarHBondContact O-N 2.96Å; N279-M281 PolarHBondContact O-N 3.04Å; N279-R282 PolarHBondContact O-N 2.64Å; N279-A283 WeakPolarHBondContact O-CB 3.44Å; N279-A283 PolarHBondContact O-N 3.33Å
280	A	98.3	Very high	96.1	Very high	3 Å²	3	29.5 Å²	29.5	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-59.8	-45.5	178.5	0	0	0	0	0	112.5	L276 L277 T284 V298 I313 D315	L276-A280 PolarHBondContact O-N 3.3Å; L277-A280 PolarHBondContact O-N 2.94Å; A280-T284 WeakPolarHBondContact O-CB 3.36Å; A280-T284 PolarHBondContact O-N 2.85Å; A280-T284 PolarHBondContact O-OG1 3.34Å; A280-V298 HydrophobicContact CB-CG1 4.3Å; A280-V298 HydrophobicContact CB-CG2 4.26Å; A280-I313 HydrophobicContact CB-CG2 4.13Å; A280-D315 HydrophobicContact CB-CB 3.99Å
281	M	98.1	Very high	96	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.7	-44.7	177.9	-68.6	178.9	-173.4	0	0	111.8	A238 R239 C242 P250 V252 L277 N279 T284 M285 M363	A238-M281 HydrophobicContact CB-CE 3.87Å; A238-M281 HydrophobicContact CB-SD 3.59Å; A238-M281 VanDerWaalsContact CB-SD 3.59Å; R239-M281 HydrophobicContact CG-CE 3.51Å; R239-M281 HydrophobicContact CG-SD 4Å; C242-M281 HydrophobicContact CB-CB 4.29Å; C242-M281 HydrophobicContact CB-SD 4.21Å; P250-M281 HydrophobicContact CG-CB 4.24Å; P250-M281 HydrophobicContact CG-CG 3.85Å; V252-M281 HydrophobicContact CG2-CE 3.82Å; L277-M281 HydrophobicContact CB-CE 4.47Å; L277-M281 HydrophobicContact CD2-CE 4.45Å; L277-M281 WeakPolarHBondContact O-CB 3.25Å; L277-M281 VanDerWaalsContact O-CG 3.23Å; L277-M281 WeakPolarHBondContact O-CG 3.18Å; L277-M281 PolarHBondContact O-N 2.69Å; N279-M281 PolarHBondContact O-N 3.04Å; M281-T284 PolarHBondContact O-N 2.9Å; M281-M285 WeakPolarHBondContact O-CG 3.18Å; M281-M285 PolarHBondContact O-N 2.84Å; M281-M363 HydrophobicContact CB-CE 3.83Å
282	R	95.6	Very high	95.8	Very high	19 Å²	19	28.5 Å²	28.5	7%	0.072	16%	0.159	C	C	.	.	H	α-helix	trans	-57.8	-51.6	176.6	173.4	174.1	175.3	-123.5	-25.8	111.5	K278 N279 T284 M285 E286 T335 S339	K278-R282 WeakPolarHBondContact O-CB 3.27Å; K278-R282 PolarHBondContact O-N 3.25Å; N279-R282 PolarHBondContact O-N 2.64Å; R282-T284 VanDerWaalsContact C-N 3.28Å; R282-T284 PolarHBondContact O-N 2.63Å; R282-M285 PolarHBondContact O-N 2.84Å; R282-E286 HydrophobicContact CG-CG 4.35Å; R282-E286 VanDerWaalsContact CG-OE1 3.29Å; R282-E286 WeakPolarHBondContact CG-OE1 3.47Å; R282-E286 IonicContact CZ-OE1 3.11Å; R282-E286 IonicContact CZ-OE2 3.43Å; R282-E286 VanDerWaalsContact NE-CD 3.34Å; R282-E286 IonicContact NE-OE1 3.73Å; R282-E286 PolarHBondContact NE-OE1 2.96Å; R282-E286 IonicContact NE-OE2 2.73Å; R282-E286 PolarHBondContact NE-OE2 3.17Å; R282-E286 IonicContact NH2-OE1 3.27Å; R282-E286 IonicContact NH2-OE2 3.99Å; R282-E286 PolarHBondContact NH2-OE2 3.34Å; R282-E286 WeakPolarHBondContact O-CB 3.46Å; R282-E286 WeakPolarHBondContact O-CG 3.31Å; R282-E286 PolarHBondContact O-N 2.89Å; R282-T335 PolarHBondContact NH1-OG1 2.83Å; R282-T335 PolarHBondContact NH2-O 3.29Å; R282-T335 PolarHBondContact NH2-OG1 3.01Å; R282-S339 PolarHBondContact NH2-OG 2.92Å
283	A	96.1	Very high	95.5	Very high	29 Å²	29	36.8 Å²	36.8	24%	0.24	19%	0.191	C	C	.	.	H	α-helix	trans	-59.7	-42	179.2	0	0	0	0	0	111.1	N279 S287 G317	N279-A283 WeakPolarHBondContact O-CB 3.44Å; N279-A283 PolarHBondContact O-N 3.33Å; A283-S287 WeakPolarHBondContact O-CB 3.35Å; A283-S287 PolarHBondContact O-N 3.13Å; A283-S287 PolarHBondContact O-OG 3.4Å; A283-S287 VanDerWaalsContact O-OG 3.12Å; A283-G317 WeakPolarHBondContact O-CA 3.3Å
284	T	97.9	Very high	95.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.2	-44.9	177.2	-57.8	0	0	0	0	112.7	P250 A280 M281 R282 S287 H288 V295 P296	P250-T284 HydrophobicContact CB-CG2 4.04Å; P250-T284 HydrophobicContact CG-CG2 4.12Å; A280-T284 WeakPolarHBondContact O-CB 3.36Å; A280-T284 PolarHBondContact O-N 2.85Å; A280-T284 PolarHBondContact O-OG1 3.34Å; M281-T284 PolarHBondContact O-N 2.9Å; R282-T284 VanDerWaalsContact C-N 3.28Å; R282-T284 PolarHBondContact O-N 2.63Å; T284-S287 PolarHBondContact O-OG 2.95Å; T284-H288 PolarHBondContact O-N 2.89Å; T284-H288 PolarHBondContact O-ND1 3.36Å; T284-V295 HydrophobicContact CG2-CB 4.05Å; T284-V295 HydrophobicContact CG2-CG2 4.4Å; T284-P296 HydrophobicContact CG2-CG 4.02Å
285	M	95.9	Very high	95.4	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.015	22%	0.223	C	C	.	.	H	α-helix	trans	-70.5	-43.9	178.3	-63.5	-50.5	-65.9	0	0	112.2	C242 Y246 N248 M281 R282 S287 H288 P292 V295	C242-M285 VanDerWaalsContact SG-CG 3.51Å; Y246-M285 HydrophobicContact CD1-CB 3.89Å; Y246-M285 HydrophobicContact CD2-CB 4.02Å; Y246-M285 HydrophobicContact CD2-CG 3.94Å; Y246-M285 HydrophobicContact CE1-CB 4.24Å; Y246-M285 HydrophobicContact CE2-CB 4.35Å; Y246-M285 HydrophobicContact CG-CB 3.78Å; Y246-M285 HydrophobicContact CG-CG 3.96Å; N248-M285 HydrophobicContact CB-CE 4.14Å; M281-M285 WeakPolarHBondContact O-CG 3.18Å; M281-M285 PolarHBondContact O-N 2.84Å; R282-M285 PolarHBondContact O-N 2.84Å; M285-S287 PolarHBondContact O-N 2.99Å; M285-H288 CarbonylContact O-C 3.58Å; M285-H288 PolarHBondContact O-N 3.27Å; M285-H288 VanDerWaalsContact O-N 3.14Å; M285-P292 HydrophobicContact CE-CB 4.14Å; M285-V295 HydrophobicContact CE-CG1 4.18Å; M285-V295 HydrophobicContact SD-CB 4.34Å; M285-V295 HydrophobicContact SD-CG1 3.87Å; M285-V295 HydrophobicContact SD-CG2 3.88Å
286	E	93.8	Very high	95.4	Very high	34 Å²	34	41.9 Å²	41.9	16%	0.159	22%	0.222	C	C	.	.	H	α-helix	trans	-70	-19.9	-177.8	-69.9	177.7	-166.3	0	0	113	K245 Y246 R282 S339 I345	K245-E286 IonicContact NZ-OE1 3.13Å; Y246-E286 HydrophobicContact CE1-CG 3.88Å; Y246-E286 PolarHBondContact OH-OE1 2.9Å; R282-E286 HydrophobicContact CG-CG 4.35Å; R282-E286 VanDerWaalsContact CG-OE1 3.29Å; R282-E286 WeakPolarHBondContact CG-OE1 3.47Å; R282-E286 IonicContact CZ-OE1 3.11Å; R282-E286 IonicContact CZ-OE2 3.43Å; R282-E286 VanDerWaalsContact NE-CD 3.34Å; R282-E286 IonicContact NE-OE1 3.73Å; R282-E286 PolarHBondContact NE-OE1 2.96Å; R282-E286 IonicContact NE-OE2 2.73Å; R282-E286 PolarHBondContact NE-OE2 3.17Å; R282-E286 IonicContact NH2-OE1 3.27Å; R282-E286 IonicContact NH2-OE2 3.99Å; R282-E286 PolarHBondContact NH2-OE2 3.34Å; R282-E286 WeakPolarHBondContact O-CB 3.46Å; R282-E286 WeakPolarHBondContact O-CG 3.31Å; R282-E286 PolarHBondContact O-N 2.89Å; E286-S339 VanDerWaalsContact OE2-CB 3.28Å; E286-S339 WeakPolarHBondContact OE2-CB 3.4Å; E286-S339 PolarHBondContact OE2-OG 3.07Å; E286-I345 HydrophobicContact CG-CD1 4.28Å
287	S	94.7	Very high	95.4	Very high	54 Å²	54	43.9 Å²	43.9	38%	0.378	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-5.7	172	75	0	0	0	0	114.6	A283 T284 M285 G317	A283-S287 WeakPolarHBondContact O-CB 3.35Å; A283-S287 PolarHBondContact O-N 3.13Å; A283-S287 PolarHBondContact O-OG 3.4Å; A283-S287 VanDerWaalsContact O-OG 3.12Å; T284-S287 PolarHBondContact O-OG 2.95Å; M285-S287 PolarHBondContact O-N 2.99Å; S287-G317 WeakPolarHBondContact OG-CA 3.21Å
288	H	95.4	Very high	95.5	Very high	48 Å²	48	43.8 Å²	43.8	22%	0.222	23%	0.233	C	C	.	.			trans	-128.2	35.2	-176.5	-65.7	85.2	0	0	0	112.6	T284 M285 D290 T291 V295 P296 R316	T284-H288 PolarHBondContact O-N 2.89Å; T284-H288 PolarHBondContact O-ND1 3.36Å; M285-H288 CarbonylContact O-C 3.58Å; M285-H288 PolarHBondContact O-N 3.27Å; M285-H288 VanDerWaalsContact O-N 3.14Å; H288-D290 PolarHBondContact O-N 3.12Å; H288-D290 VanDerWaalsContact O-N 3.12Å; H288-T291 CarbonylContact O-C 3.21Å; H288-T291 VanDerWaalsContact O-C 3.27Å; H288-T291 PolarHBondContact O-N 2.89Å; H288-V295 HydrophobicContact CB-CG1 3.72Å; H288-P296 VanDerWaalsContact CE1-CD 3.46Å; H288-P296 WeakPolarHBondContact CE1-CD 3.35Å; H288-P296 WeakPolarHBondContact NE2-CD 3.45Å; H288-R316 PolarHBondContact CE1-O 3.12Å
289	L	91.1	Very high	95.5	Very high	40 Å²	40	44.1 Å²	44.1	21%	0.209	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-24.6	-177	-64.1	172.1	0	0	0	114.1	P292 I345	L289-P292 WeakPolarHBondContact O-CD 3.23Å; L289-I345 HydrophobicContact CD1-CD1 3.91Å; L289-I345 HydrophobicContact CD1-CG1 3.95Å; L289-I345 HydrophobicContact CD2-CD1 3.9Å; L289-I345 HydrophobicContact CD2-CG1 3.87Å
290	D	90.5	Very high	95.6	Very high	126 Å²	126	41.7 Å²	41.7	67%	0.674	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-18	178.8	-48.8	-44.2	0	0	0	112.5	H288 R344	H288-D290 PolarHBondContact O-N 3.12Å; H288-D290 VanDerWaalsContact O-N 3.12Å; D290-R344 IonicContact OD1-NH1 2.69Å
291	T	93.3	Very high	95.7	Very high	53 Å²	53	43 Å²	43	33%	0.325	23%	0.231	S	C	.	.			trans	-134.4	52.6	178.7	57.1	0	0	0	0	112.9	H288 Y293 N294	H288-T291 CarbonylContact O-C 3.21Å; H288-T291 VanDerWaalsContact O-C 3.27Å; H288-T291 PolarHBondContact O-N 2.89Å; T291-Y293 PolarHBondContact O-N 3.48Å; T291-Y293 VanDerWaalsContact O-N 3.09Å; T291-N294 CarbonylContact O-C 3.57Å; T291-N294 PolarHBondContact O-N 3.06Å
292	P	90.3	Very high	95.7	Very high	46 Å²	46	43 Å²	43	30%	0.299	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-20.6	-172	28	-36.1	0	0	0	113.2	N248 M285 L289	N248-P292 WeakPolarHBondContact CB-O 3.45Å; N248-P292 PolarHBondContact ND2-O 2.92Å; M285-P292 HydrophobicContact CE-CB 4.14Å; L289-P292 WeakPolarHBondContact O-CD 3.23Å
293	Y	91.6	Very high	95.8	Very high	175 Å²	175	43.7 Å²	43.7	69%	0.686	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-15.4	175.2	51.8	-91.3	0	0	0	113.8	T291	T291-Y293 PolarHBondContact O-N 3.48Å; T291-Y293 VanDerWaalsContact O-N 3.09Å
294	N	95	Very high	95.9	Very high	120 Å²	120	44.7 Å²	44.7	64%	0.642	24%	0.242	S	C	*	.	S	Bend	trans	-138.9	76.6	-178.2	-175.3	36.6	0	0	0	110.7	T291	T291-N294 CarbonylContact O-C 3.57Å; T291-N294 PolarHBondContact O-N 3.06Å
295	V	97.6	Very high	95.7	Very high	15 Å²	15	47.6 Å²	47.6	9%	0.091	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-103	149.9	179.7	-60.7	0	0	0	0	111.2	P250 T284 M285 H288	P250-V295 HydrophobicContact CB-CG2 3.83Å; T284-V295 HydrophobicContact CG2-CB 4.05Å; T284-V295 HydrophobicContact CG2-CG2 4.4Å; M285-V295 HydrophobicContact CE-CG1 4.18Å; M285-V295 HydrophobicContact SD-CB 4.34Å; M285-V295 HydrophobicContact SD-CG1 3.87Å; M285-V295 HydrophobicContact SD-CG2 3.88Å; H288-V295 HydrophobicContact CB-CG1 3.72Å
296	P	98.1	Very high	95.4	Very high	37 Å²	37	51.8 Å²	51.8	24%	0.24	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-66.8	145.6	-178.7	26.4	-35	0	0	0	113.1	P250 T284 H288 R316	P250-P296 VanDerWaalsContact CB-O 3.31Å; P250-P296 WeakPolarHBondContact CB-O 3.18Å; T284-P296 HydrophobicContact CG2-CG 4.02Å; H288-P296 VanDerWaalsContact CE1-CD 3.46Å; H288-P296 WeakPolarHBondContact CE1-CD 3.35Å; H288-P296 WeakPolarHBondContact NE2-CD 3.45Å; P296-R316 HydrophobicContact CB-CB 3.91Å; P296-R316 HydrophobicContact CB-CG 4.28Å; P296-R316 HydrophobicContact CG-CB 3.58Å; P296-R316 HydrophobicContact CG-CG 4.47Å
297	D	98.6	Very high	95.3	Very high	45 Å²	45	52.8 Å²	52.8	24%	0.241	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-62.4	137.3	176.7	-66	-9.8	0	0	0	112.3	R251 R253	R251-D297 WeakPolarHBondContact CB-OD1 3.41Å; R251-D297 CarbonylContact O-C 3.59Å; R251-D297 WeakPolarHBondContact O-CA 3.26Å; R253-D297 WeakPolarHBondContact CD-OD2 3.49Å; R253-D297 HydrophobicContact CG-CB 4.37Å; R253-D297 WeakPolarHBondContact CG-OD2 3.11Å; R253-D297 IonicContact CZ-OD2 3.6Å; R253-D297 VanDerWaalsContact CZ-OD2 3.28Å; R253-D297 IonicContact NE-OD2 3.64Å; R253-D297 PolarHBondContact NE-OD2 3Å; R253-D297 IonicContact NH1-OD2 2.79Å; R253-D297 IonicContact NH2-OD2 3.39Å
298	V	98.8	Very high	95.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	133.3	160.9	176.4	0	0	0	0	108.2	P250 R251 V252 R253 A280 I300 I313 D315	P250-V298 HydrophobicContact CB-CG2 4.24Å; P250-V298 HydrophobicContact CG-CG2 3.93Å; R251-V298 PolarHBondContact O-N 2.91Å; V252-V298 VanDerWaalsContact CA-O 3.3Å; V252-V298 WeakPolarHBondContact CA-O 3.14Å; V252-V298 HydrophobicContact CG2-CB 4.3Å; R253-V298 PolarHBondContact N-O 3.3Å; A280-V298 HydrophobicContact CB-CG1 4.3Å; A280-V298 HydrophobicContact CB-CG2 4.26Å; V298-I300 HydrophobicContact CG1-CG1 4.43Å; V298-I313 HydrophobicContact CG1-CG2 3.81Å; V298-D315 HydrophobicContact CG2-CB 4.49Å
299	V	98.9	Very high	95.3	Very high	28 Å²	28	49.1 Å²	49.1	17%	0.17	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	126.5	-178.1	-178.7	0	0	0	0	109.6	R253 S314	R253-V299 WeakPolarHBondContact O-CA 3.45Å; V299-S314 PolarHBondContact N-O 3.11Å; V299-S314 WeakPolarHBondContact O-CB 3.32Å; V299-S314 PolarHBondContact O-N 3.5Å
300	I	98.9	Very high	95.7	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.5	179.2	-55.9	-178.5	0	0	0	109.4	I231 V235 V252 R253 I254 N255 L277 V298 I311 R312 I313	I231-I300 HydrophobicContact CD1-CG2 4.08Å; I231-I300 HydrophobicContact CG2-CD1 3.57Å; I231-I300 HydrophobicContact CG2-CG2 4.32Å; V235-I300 HydrophobicContact CG2-CD1 4.3Å; V252-I300 HydrophobicContact CG1-CD1 3.45Å; V252-I300 VanDerWaalsContact CG1-CD1 3.45Å; V252-I300 HydrophobicContact CG1-CG1 3.74Å; R253-I300 PolarHBondContact O-N 3.37Å; I254-I300 CarbonylContact C-O 3.56Å; I254-I300 WeakPolarHBondContact CA-O 3.09Å; I254-I300 HydrophobicContact CG1-CB 4.47Å; N255-I300 PolarHBondContact N-O 3.01Å; N255-I300 PolarHBondContact OD1-O 2.86Å; L277-I300 HydrophobicContact CD2-CD1 3.73Å; V298-I300 HydrophobicContact CG1-CG1 4.43Å; I300-I311 HydrophobicContact CG2-CG2 3.8Å; I300-R312 CarbonylContact C-O 3.5Å; I300-R312 VanDerWaalsContact CA-O 3.25Å; I300-R312 WeakPolarHBondContact CA-O 3.28Å; I300-R312 WeakPolarHBondContact CG2-O 3.36Å; I300-I313 HydrophobicContact CD1-CG1 4.32Å; I300-I313 HydrophobicContact CG1-CG1 4.17Å; I300-I313 HydrophobicContact CG1-CG2 4.35Å; I300-I313 HydrophobicContact CG2-CG1 4.38Å
301	T	98.9	Very high	96.1	Very high	30 Å²	30	42.9 Å²	42.9	18%	0.184	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	122.3	177.4	-56.3	0	0	0	0	109.9	N255 R312	N255-T301 VanDerWaalsContact OD1-CA 3.29Å; N255-T301 WeakPolarHBondContact OD1-CA 3.38Å; N255-T301 VanDerWaalsContact OD1-CB 3.28Å; N255-T301 WeakPolarHBondContact OD1-CB 3.5Å; N255-T301 WeakPolarHBondContact OD1-CG2 3.48Å; N255-T301 PolarHBondContact OD1-OG1 2.81Å; T301-R312 PolarHBondContact N-O 3.29Å; T301-R312 PolarHBondContact O-N 2.97Å; T301-R312 PolarHBondContact OG1-NH2 2.82Å
302	I	98.9	Very high	96.4	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	117.9	175.2	-56.4	171.7	0	0	0	108.6	P227 K228 I231 I254 N255 G256 H257 L309	P227-I302 HydrophobicContact CB-CD1 4.22Å; P227-I302 HydrophobicContact CB-CG2 4.17Å; P227-I302 HydrophobicContact CG-CD1 4.26Å; P227-I302 HydrophobicContact CG-CG2 3.8Å; K228-I302 HydrophobicContact CB-CD1 4.06Å; I231-I302 HydrophobicContact CD1-CD1 3.77Å; I231-I302 HydrophobicContact CD1-CG1 3.83Å; I254-I302 HydrophobicContact CG2-CD1 3.64Å; I254-I302 HydrophobicContact CG2-CG1 4.11Å; N255-I302 PolarHBondContact O-N 3.1Å; G256-I302 CarbonylContact C-O 3.6Å; G256-I302 WeakPolarHBondContact CA-O 3.2Å; H257-I302 HydrophobicContact CB-CG2 4.48Å; H257-I302 PolarHBondContact N-O 2.94Å; H257-I302 PolarHBondContact ND1-O 2.87Å; I302-L309 HydrophobicContact CG2-CD1 4.12Å
303	A	98.5	Very high	96.8	Very high	33 Å²	33	41.9 Å²	41.9	27%	0.273	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	135.1	164.3	0	0	0	0	0	110	I310	A303-I310 HydrophobicContact CB-CB 4.14Å; A303-I310 PolarHBondContact N-O 2.92Å; A303-I310 PolarHBondContact O-N 2.83Å
304	N	96.8	Very high	97.1	Very high	49 Å²	49	34.3 Å²	34.3	26%	0.262	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	125.2	-177.3	-178.8	85.6	0	0	0	107.7	H257 A260 F262 H402	H257-N304 HydrophobicContact CB-CB 4.24Å; H257-N304 PolarHBondContact ND1-N 3.09Å; A260-N304 HydrophobicContact CB-CB 4.12Å; F262-N304 WeakPolarHBondContact CD1-OD1 3.15Å; F262-N304 WeakPolarHBondContact CE1-OD1 3.29Å; N304-H402 PolarHBondContact OD1-NE2 3.1Å
305	N	94.2	Very high	97.3	Very high	61 Å²	61	29 Å²	29	33%	0.326	16%	0.162	S	C	.	.			trans	-141.9	178.8	179.4	66.5	73.5	0	0	0	110	V307 D308 H402	N305-V307 PolarHBondContact O-N 2.87Å; N305-V307 VanDerWaalsContact O-N 3.13Å; N305-V307 WeakPolarHBondContact OD1-CA 3.27Å; N305-V307 WeakPolarHBondContact OD1-CB 3.21Å; N305-V307 PolarHBondContact OD1-N 3.18Å; N305-D308 PolarHBondContact N-O 3.14Å; N305-D308 PolarHBondContact ND2-O 3.2Å; N305-D308 VanDerWaalsContact ND2-O 3.16Å; N305-D308 PolarHBondContact ND2-OD1 2.98Å; N305-D308 PolarHBondContact OD1-N 3.11Å; N305-H402 PolarHBondContact O-CD2 2.76Å
306	D	90.8	Very high	97.3	Very high	92 Å²	92	35.3 Å²	35.3	49%	0.492	18%	0.184	S	C	.	.	S	Bend	trans	-69.4	-6.6	-174.7	-70.1	23.7	0	0	0	115.2	G405 R406	D306-G405 WeakPolarHBondContact O-CA 3.42Å; D306-R406 HydrophobicContact CB-CG 4.44Å; D306-R406 PolarHBondContact O-N 3.12Å; D306-R406 IonicContact OD2-CZ 3.14Å; D306-R406 IonicContact OD2-NE 2.76Å; D306-R406 PolarHBondContact OD2-NE 2.97Å; D306-R406 IonicContact OD2-NH2 2.8Å; D306-R406 PolarHBondContact OD2-NH2 3.31Å
307	V	90.8	Very high	97.3	Very high	54 Å²	54	34 Å²	34	33%	0.327	18%	0.176	S	C	.	.	S	Bend	trans	-109.7	-52.6	-179	-175.9	0	0	0	0	110.7	N305 H402	N305-V307 PolarHBondContact O-N 2.87Å; N305-V307 VanDerWaalsContact O-N 3.13Å; N305-V307 WeakPolarHBondContact OD1-CA 3.27Å; N305-V307 WeakPolarHBondContact OD1-CB 3.21Å; N305-V307 PolarHBondContact OD1-N 3.18Å; V307-H402 PolarHBondContact O-N 2.86Å
308	D	94	Very high	97.2	Very high	24 Å²	24	33 Å²	33	13%	0.128	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	157.7	-173.9	73.9	-8.1	0	0	0	116.2	N305 I310 R399 L400	N305-D308 PolarHBondContact N-O 3.14Å; N305-D308 PolarHBondContact ND2-O 3.2Å; N305-D308 VanDerWaalsContact ND2-O 3.16Å; N305-D308 PolarHBondContact ND2-OD1 2.98Å; N305-D308 PolarHBondContact OD1-N 3.11Å; D308-I310 WeakPolarHBondContact OD1-CG1 3.24Å; D308-R399 VanDerWaalsContact OD2-CD 3.28Å; D308-R399 WeakPolarHBondContact OD2-CD 3.48Å; D308-R399 IonicContact OD2-NE 2.84Å; D308-L400 WeakPolarHBondContact CA-O 3.3Å; D308-L400 WeakPolarHBondContact CB-O 3.42Å
309	L	96.6	Very high	97.1	Very high	2 Å²	2	34 Å²	34	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	123.1	162.4	173.4	64.6	0	0	0	108.5	P227 F262 F264 L269 I302 I311 R399 L400	P227-L309 HydrophobicContact CB-CD1 4.14Å; P227-L309 HydrophobicContact CB-CD2 4.43Å; P227-L309 HydrophobicContact CG-CD1 4.3Å; F262-L309 HydrophobicContact CE1-CD1 4.33Å; F262-L309 HydrophobicContact CE2-CD2 4.15Å; F262-L309 HydrophobicContact CZ-CB 4.41Å; F262-L309 HydrophobicContact CZ-CD1 3.81Å; F262-L309 HydrophobicContact CZ-CD2 3.82Å; F262-L309 HydrophobicContact CZ-CG 4.21Å; F264-L309 HydrophobicContact CZ-CD2 4.45Å; L269-L309 HydrophobicContact CD1-CD2 4.43Å; I302-L309 HydrophobicContact CG2-CD1 4.12Å; L309-I311 HydrophobicContact CD1-CG1 4.36Å; L309-I311 HydrophobicContact CD2-CD1 4.14Å; L309-I311 HydrophobicContact CD2-CG1 4.46Å; L309-I311 HydrophobicContact CG-CD1 4.43Å; L309-I311 HydrophobicContact CG-CG1 4.21Å; L309-R399 WeakPolarHBondContact O-CA 3.44Å; L309-L400 PolarHBondContact N-O 2.79Å; L309-L400 PolarHBondContact O-N 2.55Å
310	I	98.6	Very high	97	Very high	33 Å²	33	34 Å²	34	17%	0.169	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	124.9	175.4	-47.2	176.8	0	0	0	108.8	A303 D308 L398 R399	A303-I310 HydrophobicContact CB-CB 4.14Å; A303-I310 PolarHBondContact N-O 2.92Å; A303-I310 PolarHBondContact O-N 2.83Å; D308-I310 WeakPolarHBondContact OD1-CG1 3.24Å; I310-L398 CarbonylContact C-O 3.6Å; I310-L398 WeakPolarHBondContact CA-O 3.42Å; I310-R399 HydrophobicContact CG1-CG 4.15Å; I310-R399 HydrophobicContact CG2-CG 4.27Å
311	I	98.8	Very high	96.9	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	107.5	172.3	-57.7	172.4	0	0	0	107.1	I231 L269 L273 I300 L309 I313 L398	I231-I311 HydrophobicContact CD1-CD1 4.1Å; I231-I311 HydrophobicContact CD1-CG1 4.39Å; I231-I311 HydrophobicContact CD1-CG2 4.09Å; I231-I311 HydrophobicContact CG1-CD1 4.47Å; L269-I311 HydrophobicContact CD2-CD1 3.89Å; L273-I311 HydrophobicContact CD2-CD1 4.14Å; L273-I311 HydrophobicContact CD2-CG2 4.42Å; I300-I311 HydrophobicContact CG2-CG2 3.8Å; L309-I311 HydrophobicContact CD1-CG1 4.36Å; L309-I311 HydrophobicContact CD2-CD1 4.14Å; L309-I311 HydrophobicContact CD2-CG1 4.46Å; L309-I311 HydrophobicContact CG-CD1 4.43Å; L309-I311 HydrophobicContact CG-CG1 4.21Å; I311-I313 HydrophobicContact CG2-CG1 4.16Å; I311-L398 HydrophobicContact CB-CB 4.45Å; I311-L398 HydrophobicContact CD1-CD2 4.47Å; I311-L398 PolarHBondContact N-O 3.37Å; I311-L398 PolarHBondContact O-N 3.2Å
312	R	98.9	Very high	96.7	Very high	74 Å²	74	40.4 Å²	40.4	28%	0.279	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	129.8	167.8	-177.3	-174.8	63.1	-174.8	-6.7	109.3	I300 T301 S314 D395 V396 Y397	I300-R312 CarbonylContact C-O 3.5Å; I300-R312 VanDerWaalsContact CA-O 3.25Å; I300-R312 WeakPolarHBondContact CA-O 3.28Å; I300-R312 WeakPolarHBondContact CG2-O 3.36Å; T301-R312 PolarHBondContact N-O 3.29Å; T301-R312 PolarHBondContact O-N 2.97Å; T301-R312 PolarHBondContact OG1-NH2 2.82Å; R312-S314 WeakPolarHBondContact CD-OG 3.45Å; R312-S314 PolarHBondContact NE-OG 2.86Å; R312-D395 IonicContact NH1-OD2 2.66Å; R312-V396 CarbonylContact C-O 3.36Å; R312-V396 VanDerWaalsContact CA-O 3.25Å; R312-V396 WeakPolarHBondContact CA-O 3.5Å; R312-Y397 HydrophobicContact CB-CD1 4.07Å; R312-Y397 HydrophobicContact CB-CE1 4.08Å; R312-Y397 VanDerWaalsContact CD-CE1 3.47Å; R312-Y397 VanDerWaalsContact CD-CZ 3.42Å; R312-Y397 WeakPolarHBondContact CD-OH 3.44Å; R312-Y397 HydrophobicContact CG-CD1 4.05Å; R312-Y397 HydrophobicContact CG-CE1 3.76Å; R312-Y397 HydrophobicContact CG-CE2 4.38Å; R312-Y397 HydrophobicContact CG-CG 4.47Å
313	I	98.9	Very high	96.6	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.015	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	116.6	170.4	-57.3	175.1	0	0	0	107.2	L276 L277 A280 V298 I300 I311 V396	L276-I313 HydrophobicContact CB-CD1 3.7Å; L276-I313 HydrophobicContact CD1-CD1 4.09Å; L277-I313 HydrophobicContact CD2-CD1 4.43Å; A280-I313 HydrophobicContact CB-CG2 4.13Å; V298-I313 HydrophobicContact CG1-CG2 3.81Å; I300-I313 HydrophobicContact CD1-CG1 4.32Å; I300-I313 HydrophobicContact CG1-CG1 4.17Å; I300-I313 HydrophobicContact CG1-CG2 4.35Å; I300-I313 HydrophobicContact CG2-CG1 4.38Å; I311-I313 HydrophobicContact CG2-CG1 4.16Å; I313-V396 PolarHBondContact N-O 2.92Å; I313-V396 PolarHBondContact O-N 2.9Å
314	S	98.9	Very high	96.4	Very high	16 Å²	16	47.5 Å²	47.5	11%	0.112	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	120.7	-176.7	-62.4	0	0	0	0	110	V299 R312 T394 D395	V299-S314 PolarHBondContact N-O 3.11Å; V299-S314 WeakPolarHBondContact O-CB 3.32Å; V299-S314 PolarHBondContact O-N 3.5Å; R312-S314 WeakPolarHBondContact CD-OG 3.45Å; R312-S314 PolarHBondContact NE-OG 2.86Å; S314-T394 WeakPolarHBondContact CA-O 3.46Å; S314-D395 WeakPolarHBondContact CB-OD1 3.23Å; S314-D395 PolarHBondContact OG-OD1 2.9Å
315	D	98.8	Very high	96.2	Very high	10 Å²	10	48.5 Å²	48.5	5%	0.053	25%	0.249	C	C	.	.			trans	-106.9	175.1	174.2	71.7	58.1	0	0	0	112.7	A280 V298 G317 G393 T394	A280-D315 HydrophobicContact CB-CB 3.99Å; V298-D315 HydrophobicContact CG2-CB 4.49Å; D315-G317 PolarHBondContact OD1-N 2.83Å; D315-G393 WeakPolarHBondContact OD1-CA 3.49Å; D315-T394 PolarHBondContact N-O 2.84Å; D315-T394 PolarHBondContact OD1-N 3.3Å; D315-T394 WeakPolarHBondContact OD2-CB 3.46Å; D315-T394 PolarHBondContact OD2-OG1 3.29Å
316	R	98.4	Very high	96.2	Very high	147 Å²	147	52.1 Å²	52.1	56%	0.555	27%	0.268	S	S	*	.			trans	-124.5	36.8	168.2	-67.5	-64.6	-179.8	131.3	-3.3	111	H288 P296 G318 I392	H288-R316 PolarHBondContact CE1-O 3.12Å; P296-R316 HydrophobicContact CB-CB 3.91Å; P296-R316 HydrophobicContact CB-CG 4.28Å; P296-R316 HydrophobicContact CG-CB 3.58Å; P296-R316 HydrophobicContact CG-CG 4.47Å; R316-G318 PolarHBondContact O-N 3.47Å; R316-I392 CarbonylContact C-O 3.59Å; R316-I392 WeakPolarHBondContact CA-O 3.44Å; R316-I392 VanDerWaalsContact NH1-CG2 3.35Å
317	G	97.4	Very high	96.3	Very high	8 Å²	8	53.2 Å²	53.2	8%	0.082	27%	0.266	C	S	.	.	S	Bend	trans	-83.4	27.6	-175.1	0	0	0	0	0	115.1	A283 S287 D315 G319	A283-G317 WeakPolarHBondContact O-CA 3.3Å; S287-G317 WeakPolarHBondContact OG-CA 3.21Å; D315-G317 PolarHBondContact OD1-N 2.83Å; G317-G319 PolarHBondContact O-N 3.4Å; G317-G319 VanDerWaalsContact O-N 3.13Å
318	G	96.1	Very high	96.5	Very high	25 Å²	25	51.5 Å²	51.5	26%	0.258	26%	0.255	S	S	.	.			trans	75.4	-9.2	-178.7	0	0	0	0	0	115.9	R316 G391 I392	R316-G318 PolarHBondContact O-N 3.47Å; G318-G391 WeakPolarHBondContact O-CA 3.38Å; G318-G391 PolarHBondContact O-N 2.97Å; G318-I392 PolarHBondContact N-O 2.95Å
319	G	96.5	Very high	96.6	Very high	22 Å²	22	51.6 Å²	51.6	23%	0.227	26%	0.255	C	S	.	.			trans	80.4	172.2	175.7	0	0	0	0	0	114.4	G317 G393	G317-G319 PolarHBondContact O-N 3.4Å; G317-G319 VanDerWaalsContact O-N 3.13Å; G319-G393 WeakPolarHBondContact CA-O 3.44Å
320	I	97.6	Very high	96.4	Very high	27 Å²	27	53.8 Å²	53.8	14%	0.138	27%	0.267	C	S	.	.			trans	-83.9	124.9	177	-54.9	173.5	0	0	0	108.8	D324 L325 V328 L386 S388 T394	I320-D324 HydrophobicContact CG2-CB 4.43Å; I320-L325 HydrophobicContact CG2-CB 4.37Å; I320-V328 HydrophobicContact CD1-CG1 4.26Å; I320-V328 HydrophobicContact CD1-CG2 4.25Å; I320-V328 HydrophobicContact CG2-CG1 3.55Å; I320-L386 HydrophobicContact CD1-CD1 3.91Å; I320-S388 WeakPolarHBondContact CA-OG 3.42Å; I320-S388 PolarHBondContact N-OG 3.47Å; I320-S388 PolarHBondContact O-OG 3.04Å; I320-T394 HydrophobicContact CD1-CG2 3.96Å; I320-T394 HydrophobicContact CG1-CG2 4.19Å
321	A	96.6	Very high	96.1	Very high	28 Å²	28	52.8 Å²	52.8	23%	0.231	26%	0.261	C	S	.	.			trans	-65	139.9	177.9	0	0	0	0	0	111.8	K323 D324 L325	A321-K323 HydrophobicContact CB-CG 4.24Å; A321-K323 PolarHBondContact O-N 3.29Å; A321-K323 VanDerWaalsContact O-N 3.1Å; A321-D324 PolarHBondContact O-N 3.05Å; A321-L325 PolarHBondContact O-N 2.93Å
322	H	95.3	Very high	95.7	Very high	138 Å²	138	53.9 Å²	53.9	64%	0.639	27%	0.266	S	S	*	.	H	α-helix	trans	-51.1	-38.7	-177.9	-71.8	-57.7	0	0	0	114	D324 L325 Q390	H322-D324 PolarHBondContact O-N 3.38Å; H322-L325 PolarHBondContact O-N 2.99Å; H322-Q390 PolarHBondContact CD2-OE1 3.43Å
323	K	95.6	Very high	95.3	Very high	165 Å²	165	52.1 Å²	52.1	72%	0.717	26%	0.261	S	S	*	.	H	α-helix	trans	-64.6	-16.8	177.4	68.8	174.7	-171.7	177.6	0	115.1	A321 R327	A321-K323 HydrophobicContact CB-CG 4.24Å; A321-K323 PolarHBondContact O-N 3.29Å; A321-K323 VanDerWaalsContact O-N 3.1Å; K323-R327 PolarHBondContact O-NE 3.32Å
324	D	95.1	Very high	94.9	Very high	18 Å²	18	54 Å²	54	10%	0.096	27%	0.272	C	S	.	.	H	α-helix	trans	-111.2	-14.7	-175.3	-62.7	-46.7	0	0	0	112	I320 A321 H322 D326 R327 V328 F333	I320-D324 HydrophobicContact CG2-CB 4.43Å; A321-D324 PolarHBondContact O-N 3.05Å; H322-D324 PolarHBondContact O-N 3.38Å; D324-D326 PolarHBondContact O-N 3.14Å; D324-R327 CarbonylContact O-C 3.58Å; D324-R327 WeakPolarHBondContact O-CA 3.22Å; D324-R327 PolarHBondContact O-N 3.35Å; D324-R327 IonicContact OD1-CZ 3.69Å; D324-R327 IonicContact OD1-NE 2.92Å; D324-R327 IonicContact OD1-NH2 2.7Å; D324-R327 PolarHBondContact OD1-NH2 2.87Å; D324-V328 VanDerWaalsContact O-CG1 3.26Å; D324-V328 WeakPolarHBondContact O-CG1 3.43Å; D324-V328 PolarHBondContact O-N 2.92Å; D324-F333 HydrophobicContact CB-CE1 4.42Å; D324-F333 HydrophobicContact CB-CZ 3.93Å
325	L	93.3	Very high	94.3	Very high	69 Å²	69	56.1 Å²	56.1	36%	0.361	29%	0.285	S	S	.	.	H	α-helix	trans	-58.3	-42.4	-170.5	-156.2	163.6	0	0	0	112.7	I320 A321 H322 R327 V328	I320-L325 HydrophobicContact CG2-CB 4.37Å; A321-L325 PolarHBondContact O-N 2.93Å; H322-L325 PolarHBondContact O-N 2.99Å; L325-R327 VanDerWaalsContact C-N 3.25Å; L325-R327 PolarHBondContact O-N 3.12Å; L325-V328 WeakPolarHBondContact O-CG2 3.22Å
326	D	93.3	Very high	93.4	Very high	137 Å²	137	55.9 Å²	55.9	73%	0.733	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-21	177.2	-58.8	-44.7	0	0	0	112.9	D324	D324-D326 PolarHBondContact O-N 3.14Å
327	R	93.4	Very high	92	Very high	115 Å²	115	55.1 Å²	55.1	43%	0.434	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-21.1	-171.6	-54.3	-170.1	-64.5	161.8	3.5	114.4	K323 D324 L325 M329 D330 F333	K323-R327 PolarHBondContact O-NE 3.32Å; D324-R327 CarbonylContact O-C 3.58Å; D324-R327 WeakPolarHBondContact O-CA 3.22Å; D324-R327 PolarHBondContact O-N 3.35Å; D324-R327 IonicContact OD1-CZ 3.69Å; D324-R327 IonicContact OD1-NE 2.92Å; D324-R327 IonicContact OD1-NH2 2.7Å; D324-R327 PolarHBondContact OD1-NH2 2.87Å; L325-R327 VanDerWaalsContact C-N 3.25Å; L325-R327 PolarHBondContact O-N 3.12Å; R327-M329 PolarHBondContact O-N 2.96Å; R327-D330 PolarHBondContact O-N 3.46Å; R327-F333 HydrophobicContact CB-CD1 4.33Å; R327-F333 HydrophobicContact CB-CD2 3.62Å; R327-F333 HydrophobicContact CB-CE1 4.42Å; R327-F333 HydrophobicContact CB-CE2 3.76Å; R327-F333 HydrophobicContact CB-CG 3.93Å; R327-F333 HydrophobicContact CB-CZ 4.15Å; R327-F333 WeakPolarHBondContact O-CB 3.27Å; R327-F333 WeakPolarHBondContact O-CD1 3.45Å; R327-F333 WeakPolarHBondContact O-CG 3.46Å
328	V	95	Very high	90.3	Very high	18 Å²	18	58.1 Å²	58.1	11%	0.109	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-16.3	177.3	-55.6	0	0	0	0	113.9	I320 D324 L325 F333 L370 L386	I320-V328 HydrophobicContact CD1-CG1 4.26Å; I320-V328 HydrophobicContact CD1-CG2 4.25Å; I320-V328 HydrophobicContact CG2-CG1 3.55Å; D324-V328 VanDerWaalsContact O-CG1 3.26Å; D324-V328 WeakPolarHBondContact O-CG1 3.43Å; D324-V328 PolarHBondContact O-N 2.92Å; L325-V328 WeakPolarHBondContact O-CG2 3.22Å; V328-F333 HydrophobicContact CG1-CE1 4.05Å; V328-L370 HydrophobicContact CB-CD1 3.94Å; V328-L370 HydrophobicContact CG2-CD1 4.19Å; V328-L370 WeakPolarHBondContact O-CB 3.49Å; V328-L370 WeakPolarHBondContact O-CD1 3.38Å; V328-L386 HydrophobicContact CG2-CD1 3.57Å
329	M	95.4	Very high	88.6	Confident	26 Å²	26	58 Å²	58	13%	0.128	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	1.1	-176.3	-88.1	-56.5	-176.1	0	0	113.9	R187 R327 L370 P371 R374 L386	R187-M329 PolarHBondContact NH1-O 2.85Å; R327-M329 PolarHBondContact O-N 2.96Å; M329-L370 HydrophobicContact SD-CB 4.49Å; M329-P371 WeakPolarHBondContact O-CB 3.38Å; M329-R374 PolarHBondContact O-NH2 2.97Å; M329-R374 HydrophobicContact SD-CB 4.47Å; M329-R374 PolarHBondContact SD-NE 3.29Å; M329-R374 VanDerWaalsContact SD-NE 3.35Å; M329-L386 HydrophobicContact CE-CD1 3.78Å; M329-L386 HydrophobicContact CE-CG 3.89Å
330	D	93.4	Very high	86.8	Confident	49 Å²	49	59.2 Å²	59.2	26%	0.262	31%	0.309	S	S	.	.	S	Bend	trans	-98.3	146.7	177.9	-62.2	-36.5	0	0	0	112.1	R187 R327 F333	R187-D330 IonicContact NH1-OD1 3.91Å; R187-D330 PolarHBondContact NH1-OD1 3Å; R327-D330 PolarHBondContact O-N 3.46Å; D330-F333 HydrophobicContact CB-CB 4.38Å; D330-F333 PolarHBondContact O-N 2.61Å
331	Y	92.5	Very high	84.9	Confident	12 Å²	12	65.4 Å²	65.4	5%	0.047	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	147.5	171	-67.3	-79.5	0	0	0	110.1	L190 D191 L194 F333 F368 P371	L190-Y331 HydrophobicContact CB-CD2 3.91Å; L190-Y331 HydrophobicContact CB-CE1 4.23Å; L190-Y331 HydrophobicContact CB-CE2 3.54Å; L190-Y331 HydrophobicContact CB-CG 4.39Å; L190-Y331 HydrophobicContact CD1-CD1 3.67Å; L190-Y331 HydrophobicContact CD1-CD2 3.57Å; L190-Y331 HydrophobicContact CD1-CE1 4.14Å; L190-Y331 HydrophobicContact CD1-CE2 4.07Å; L190-Y331 HydrophobicContact CD1-CG 3.35Å; L190-Y331 HydrophobicContact CG-CD2 4.41Å; L190-Y331 HydrophobicContact CG-CE2 4.47Å; D191-Y331 WeakPolarHBondContact OD1-CE2 3.11Å; D191-Y331 PolarHBondContact OD1-OH 2.79Å; L194-Y331 HydrophobicContact CD1-CE1 3.75Å; Y331-F333 PolarHBondContact O-N 3.16Å; Y331-F368 AromaticContact CD1-CD1 3.68Å; Y331-F368 HydrophobicContact CD1-CD1 3.68Å; Y331-F368 AromaticContact CD1-CD2 3.91Å; Y331-F368 HydrophobicContact CD1-CD2 3.91Å; Y331-F368 AromaticContact CD1-CE1 3.65Å; Y331-F368 HydrophobicContact CD1-CE1 3.65Å; Y331-F368 AromaticContact CD1-CE2 3.87Å; Y331-F368 HydrophobicContact CD1-CE2 3.87Å; Y331-F368 AromaticContact CD1-CG 3.81Å; Y331-F368 HydrophobicContact CD1-CG 3.81Å; Y331-F368 AromaticContact CD1-CZ 3.74Å; Y331-F368 HydrophobicContact CD1-CZ 3.74Å; Y331-F368 AromaticContact CE1-CD1 3.83Å; Y331-F368 HydrophobicContact CE1-CD1 3.83Å; Y331-F368 AromaticContact CE1-CE1 3.96Å; Y331-F368 HydrophobicContact CE1-CE1 3.96Å; Y331-F368 HydrophobicContact CE1-CG 4.27Å; Y331-F368 HydrophobicContact CE1-CZ 4.49Å; Y331-F368 HydrophobicContact CG-CE2 4.44Å; Y331-F368 HydrophobicContact CG-CZ 4.36Å; Y331-P371 HydrophobicContact CD1-CB 3.89Å; Y331-P371 HydrophobicContact CD1-CG 3.59Å; Y331-P371 HydrophobicContact CD2-CB 4.08Å; Y331-P371 HydrophobicContact CD2-CG 4.5Å; Y331-P371 HydrophobicContact CE1-CB 3.69Å; Y331-P371 HydrophobicContact CE1-CG 3.75Å; Y331-P371 HydrophobicContact CE2-CB 3.88Å; Y331-P371 HydrophobicContact CG-CB 4.09Å; Y331-P371 HydrophobicContact CG-CG 4.01Å
332	H	90.1	Very high	83	Confident	24 Å²	24	65.8 Å²	65.8	11%	0.111	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	-0.4	-176.5	-52.2	94.6	0	0	0	116	A170 R174 F366 F368	A170-H332 PolarHBondContact O-NE2 3.18Å; R174-H332 PolarHBondContact N-NE2 2.84Å; H332-F366 VanDerWaalsContact CA-O 3.28Å; H332-F366 WeakPolarHBondContact CA-O 3.49Å; H332-F368 AromaticContact CD2-CE2 3.93Å; H332-F368 AromaticContact CE1-CE2 3.61Å; H332-F368 AromaticContact CE1-CZ 3.82Å; H332-F368 AromaticContact ND1-CE2 3.92Å; H332-F368 AromaticContact NE2-CE2 3.61Å
333	F	91	Very high	81.2	Confident	37 Å²	37	64.2 Å²	64.2	16%	0.162	34%	0.338	C	S	.	.			trans	-78	126.2	167.9	-178.6	-92.9	0	0	0	110.5	D324 R327 V328 D330 Y331 T335 G367	D324-F333 HydrophobicContact CB-CE1 4.42Å; D324-F333 HydrophobicContact CB-CZ 3.93Å; R327-F333 HydrophobicContact CB-CD1 4.33Å; R327-F333 HydrophobicContact CB-CD2 3.62Å; R327-F333 HydrophobicContact CB-CE1 4.42Å; R327-F333 HydrophobicContact CB-CE2 3.76Å; R327-F333 HydrophobicContact CB-CG 3.93Å; R327-F333 HydrophobicContact CB-CZ 4.15Å; R327-F333 WeakPolarHBondContact O-CB 3.27Å; R327-F333 WeakPolarHBondContact O-CD1 3.45Å; R327-F333 WeakPolarHBondContact O-CG 3.46Å; V328-F333 HydrophobicContact CG1-CE1 4.05Å; D330-F333 HydrophobicContact CB-CB 4.38Å; D330-F333 PolarHBondContact O-N 2.61Å; Y331-F333 PolarHBondContact O-N 3.16Å; F333-T335 HydrophobicContact CE1-CG2 4.18Å; F333-T335 HydrophobicContact CZ-CG2 4.13Å; F333-G367 WeakPolarHBondContact O-CA 3.39Å
334	T	89.3	Confident	79.6	Confident	42 Å²	42	62.8 Å²	62.8	26%	0.258	33%	0.328	S	S	.	.			trans	-153.9	142.6	174.9	-176.1	0	0	0	0	111.2	A336	T334-A336 VanDerWaalsContact C-N 3.35Å; T334-A336 HydrophobicContact CG2-CB 4.42Å; T334-A336 VanDerWaalsContact OG1-CB 3.26Å; T334-A336 WeakPolarHBondContact OG1-CB 3.45Å; T334-A336 PolarHBondContact OG1-N 2.89Å; T334-A336 VanDerWaalsContact OG1-N 3.16Å
335	T	86.6	Confident	77.8	Confident	61 Å²	61	62.1 Å²	62.1	37%	0.374	32%	0.324	S	S	.	.	S	Bend	trans	-91.8	2.6	171.3	57.3	0	0	0	0	112.7	R282 F333 E337 A338 S339	R282-T335 PolarHBondContact NH1-OG1 2.83Å; R282-T335 PolarHBondContact NH2-O 3.29Å; R282-T335 PolarHBondContact NH2-OG1 3.01Å; F333-T335 HydrophobicContact CE1-CG2 4.18Å; F333-T335 HydrophobicContact CZ-CG2 4.13Å; T335-E337 VanDerWaalsContact C-N 3.34Å; T335-E337 PolarHBondContact O-N 3.31Å; T335-A338 PolarHBondContact O-N 3.39Å; T335-S339 PolarHBondContact O-N 3.37Å
336	A	80.3	Confident	75.7	Confident	6 Å²	6	61.5 Å²	61.5	5%	0.05	33%	0.325	C	S	.	.	H	α-helix	trans	-58.5	-41.1	-174.9	0	0	0	0	0	113.8	T334 A338 S339 T340 H364	T334-A336 VanDerWaalsContact C-N 3.35Å; T334-A336 HydrophobicContact CG2-CB 4.42Å; T334-A336 VanDerWaalsContact OG1-CB 3.26Å; T334-A336 WeakPolarHBondContact OG1-CB 3.45Å; T334-A336 PolarHBondContact OG1-N 2.89Å; T334-A336 VanDerWaalsContact OG1-N 3.16Å; A336-A338 VanDerWaalsContact C-N 3.29Å; A336-A338 PolarHBondContact O-N 3.32Å; A336-S339 PolarHBondContact O-N 2.89Å; A336-S339 VanDerWaalsContact O-N 3.13Å; A336-T340 PolarHBondContact O-N 2.84Å; A336-T340 PolarHBondContact O-OG1 3.19Å; A336-H364 HydrophobicContact CB-CB 4.08Å; A336-H364 VanDerWaalsContact CB-CG 3.46Å
337	E	69.1	Low	73.6	Confident	131 Å²	131	59.6 Å²	59.6	61%	0.612	32%	0.321	S	S	*	.	H	α-helix	trans	-66.8	-30.5	-175.9	-61.8	179.4	177.7	0	0	112.4	T335 T340 Q341	T335-E337 VanDerWaalsContact C-N 3.34Å; T335-E337 PolarHBondContact O-N 3.31Å; E337-T340 WeakPolarHBondContact CA-OG1 3.2Å; E337-T340 PolarHBondContact O-OG1 3.06Å; E337-Q341 WeakPolarHBondContact O-CG 3.46Å
338	A	61.8	Low	71.6	Confident	71 Å²	71	58 Å²	58	59%	0.587	32%	0.321	S	S	*	.	H	α-helix	trans	-69.6	-39.6	172.8	0	0	0	0	0	111.6	T335 A336 Q341	T335-A338 PolarHBondContact O-N 3.39Å; A336-A338 VanDerWaalsContact C-N 3.29Å; A336-A338 PolarHBondContact O-N 3.32Å; A338-Q341 PolarHBondContact O-N 3.33Å
339	S	59.9	Low	69.4	Low	21 Å²	21	59 Å²	59	15%	0.147	32%	0.324	C	S	.	.	H	α-helix	trans	-69.7	-33.6	178.3	-54.3	0	0	0	0	112.9	R282 E286 T335 A336 Q341 D342	R282-S339 PolarHBondContact NH2-OG 2.92Å; E286-S339 VanDerWaalsContact OE2-CB 3.28Å; E286-S339 WeakPolarHBondContact OE2-CB 3.4Å; E286-S339 PolarHBondContact OE2-OG 3.07Å; T335-S339 PolarHBondContact O-N 3.37Å; A336-S339 PolarHBondContact O-N 2.89Å; A336-S339 VanDerWaalsContact O-N 3.13Å; S339-Q341 PolarHBondContact O-N 3.3Å; S339-D342 PolarHBondContact O-N 2.95Å
340	T	59.3	Low	66.7	Low	48 Å²	48	61.4 Å²	61.4	29%	0.294	36%	0.355	S	S	.	.	H	α-helix	trans	-65.4	-24.8	174.5	43.9	0	0	0	0	113.3	A336 E337 S346 F349	A336-T340 PolarHBondContact O-N 2.84Å; A336-T340 PolarHBondContact O-OG1 3.19Å; E337-T340 WeakPolarHBondContact CA-OG1 3.2Å; E337-T340 PolarHBondContact O-OG1 3.06Å; T340-S346 PolarHBondContact O-OG 3.4Å; T340-F349 HydrophobicContact CG2-CE1 4.09Å; T340-F349 HydrophobicContact CG2-CE2 3.95Å; T340-F349 HydrophobicContact CG2-CZ 3.63Å
341	Q	56.1	Low	64	Low	158 Å²	158	67.6 Å²	67.6	74%	0.738	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-7.3	178.2	-67.4	177.1	12.1	0	0	113.6	E337 A338 S339 P343	E337-Q341 WeakPolarHBondContact O-CG 3.46Å; A338-Q341 PolarHBondContact O-N 3.33Å; S339-Q341 PolarHBondContact O-N 3.3Å; Q341-P343 WeakPolarHBondContact O-CD 3.37Å
342	D	58.4	Low	61.7	Low	35 Å²	35	70.6 Å²	70.6	19%	0.187	40%	0.398	C	S	.	.			trans	-69.5	120.9	175.1	-171.9	-40.2	0	0	0	109.7	S339 R344 I345 S346	S339-D342 PolarHBondContact O-N 2.95Å; D342-R344 PolarHBondContact O-N 3.27Å; D342-R344 VanDerWaalsContact O-N 3.07Å; D342-R344 VanDerWaalsContact OD1-CB 3.23Å; D342-R344 WeakPolarHBondContact OD1-CB 3.28Å; D342-R344 WeakPolarHBondContact OD1-CG 3.08Å; D342-R344 PolarHBondContact OD1-N 3.38Å; D342-R344 IonicContact OD1-NE 2.68Å; D342-R344 PolarHBondContact OD1-NE 3.13Å; D342-R344 VanDerWaalsContact OD1-NE 3.11Å; D342-R344 IonicContact OD1-NH2 3.81Å; D342-R344 IonicContact OD2-CZ 3.28Å; D342-R344 IonicContact OD2-NE 3.18Å; D342-R344 PolarHBondContact OD2-NE 2.79Å; D342-R344 IonicContact OD2-NH2 3.82Å; D342-R344 PolarHBondContact OD2-NH2 3.38Å; D342-I345 HydrophobicContact CB-CD1 4.16Å; D342-I345 HydrophobicContact CB-CG1 4Å; D342-I345 PolarHBondContact O-N 2.96Å; D342-S346 PolarHBondContact O-N 3.5Å
343	P	56.6	Low	59.2	Low	105 Å²	105	76 Å²	76	68%	0.682	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-10	-177.5	27.6	-35.5	0	0	0	113.8	Q341 P347	Q341-P343 WeakPolarHBondContact O-CD 3.37Å; P343-P347 WeakPolarHBondContact O-CD 3.44Å; P343-P347 WeakPolarHBondContact O-CG 3.36Å
344	R	61.6	Low	56.5	Low	136 Å²	136	81.8 Å²	81.8	51%	0.513	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-23.5	170.5	-59.4	174.1	-68.5	173.8	-1.6	112.7	D290 D342	D290-R344 IonicContact OD1-NH1 2.69Å; D342-R344 PolarHBondContact O-N 3.27Å; D342-R344 VanDerWaalsContact O-N 3.07Å; D342-R344 VanDerWaalsContact OD1-CB 3.23Å; D342-R344 WeakPolarHBondContact OD1-CB 3.28Å; D342-R344 WeakPolarHBondContact OD1-CG 3.08Å; D342-R344 PolarHBondContact OD1-N 3.38Å; D342-R344 IonicContact OD1-NE 2.68Å; D342-R344 PolarHBondContact OD1-NE 3.13Å; D342-R344 VanDerWaalsContact OD1-NE 3.11Å; D342-R344 IonicContact OD1-NH2 3.81Å; D342-R344 IonicContact OD2-CZ 3.28Å; D342-R344 IonicContact OD2-NE 3.18Å; D342-R344 PolarHBondContact OD2-NE 2.79Å; D342-R344 IonicContact OD2-NH2 3.82Å; D342-R344 PolarHBondContact OD2-NH2 3.38Å
345	I	58	Low	53.8	Low	4 Å²	4	87.8 Å²	87.8	2%	0.021	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-32.1	-179.1	-38	-178.2	0	0	0	111.2	E286 L289 D342 P347 L348 F349	E286-I345 HydrophobicContact CG-CD1 4.28Å; L289-I345 HydrophobicContact CD1-CD1 3.91Å; L289-I345 HydrophobicContact CD1-CG1 3.95Å; L289-I345 HydrophobicContact CD2-CD1 3.9Å; L289-I345 HydrophobicContact CD2-CG1 3.87Å; D342-I345 HydrophobicContact CB-CD1 4.16Å; D342-I345 HydrophobicContact CB-CG1 4Å; D342-I345 PolarHBondContact O-N 2.96Å; I345-P347 VanDerWaalsContact C-CD 3.42Å; I345-P347 VanDerWaalsContact C-N 3.35Å; I345-L348 VanDerWaalsContact O-CB 3.3Å; I345-L348 WeakPolarHBondContact O-CB 3.44Å; I345-L348 PolarHBondContact O-N 3.14Å; I345-F349 HydrophobicContact CB-CD2 4.44Å; I345-F349 HydrophobicContact CB-CE2 3.96Å; I345-F349 HydrophobicContact CG2-CD2 3.99Å; I345-F349 HydrophobicContact CG2-CE2 3.35Å; I345-F349 HydrophobicContact CG2-CZ 4.08Å; I345-F349 WeakPolarHBondContact O-CD2 3.37Å; I345-F349 PolarHBondContact O-N 3.49Å
346	S	48.6	Very low	51.3	Low	55 Å²	55	88.2 Å²	88.2	39%	0.385	49%	0.488	S	S	.	.	H	α-helix	trans	-46.3	-42.6	173.9	-92.7	0	0	0	0	115.7	T340 D342 L348 F349 G350	T340-S346 PolarHBondContact O-OG 3.4Å; D342-S346 PolarHBondContact O-N 3.5Å; S346-L348 PolarHBondContact O-N 3.17Å; S346-F349 PolarHBondContact O-N 3.29Å; S346-F349 VanDerWaalsContact O-N 3.12Å; S346-G350 PolarHBondContact O-N 3.31Å
347	P	49.8	Very low	48.7	Very low	98 Å²	98	90.9 Å²	90.9	64%	0.636	52%	0.516	S	S	*	.	H	α-helix	trans	-64.2	-25.1	177.6	-23.1	34.5	0	0	0	114.2	P343 I345	P343-P347 WeakPolarHBondContact O-CD 3.44Å; P343-P347 WeakPolarHBondContact O-CG 3.36Å; I345-P347 VanDerWaalsContact C-CD 3.42Å; I345-P347 VanDerWaalsContact C-N 3.35Å
348	L	51.3	Low	47	Very low	82 Å²	82	90.2 Å²	90.2	43%	0.429	53%	0.532	S	S	.	.	H	α-helix	trans	-77.7	-29.8	174.5	-102.1	154.6	0	0	0	112.1	I345 S346 L352	I345-L348 VanDerWaalsContact O-CB 3.3Å; I345-L348 WeakPolarHBondContact O-CB 3.44Å; I345-L348 PolarHBondContact O-N 3.14Å; S346-L348 PolarHBondContact O-N 3.17Å; L348-L352 WeakPolarHBondContact O-CD1 3.41Å
349	F	48.2	Very low	45.6	Very low	39 Å²	39	96 Å²	96	17%	0.171	55%	0.547	C	S	.	.	H	α-helix	trans	-76.9	-42.2	178.2	-71.9	-75.2	0	0	0	113.1	K245 T340 I345 S346 H351 L352	K245-F349 VanDerWaalsContact CE-CE1 3.47Å; K245-F349 VanDerWaalsContact CE-CZ 3.4Å; T340-F349 HydrophobicContact CG2-CE1 4.09Å; T340-F349 HydrophobicContact CG2-CE2 3.95Å; T340-F349 HydrophobicContact CG2-CZ 3.63Å; I345-F349 HydrophobicContact CB-CD2 4.44Å; I345-F349 HydrophobicContact CB-CE2 3.96Å; I345-F349 HydrophobicContact CG2-CD2 3.99Å; I345-F349 HydrophobicContact CG2-CE2 3.35Å; I345-F349 HydrophobicContact CG2-CZ 4.08Å; I345-F349 WeakPolarHBondContact O-CD2 3.37Å; I345-F349 PolarHBondContact O-N 3.49Å; S346-F349 PolarHBondContact O-N 3.29Å; S346-F349 VanDerWaalsContact O-N 3.12Å; F349-H351 PolarHBondContact O-N 3.17Å; F349-L352 PolarHBondContact O-N 3.46Å
350	G	38.8	Very low	44.7	Very low	76 Å²	76	97.5 Å²	97.5	78%	0.784	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-5.7	-165.5	0	0	0	0	0	117.6	S346	S346-G350 PolarHBondContact O-N 3.31Å
351	H	36.2	Very low	44.4	Very low	179 Å²	179	97.3 Å²	97.3	83%	0.829	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.8	-11.5	-179.1	-155.7	68.9	0	0	0	114.7	F349	F349-H351 PolarHBondContact O-N 3.17Å
352	L	44.1	Very low	44.9	Very low	74 Å²	74	94.2 Å²	94.2	39%	0.387	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-113.3	-21.2	-165.3	-81.6	140.1	0	0	0	115.3	L348 F349 M354 S356	L348-L352 WeakPolarHBondContact O-CD1 3.41Å; F349-L352 PolarHBondContact O-N 3.46Å; L352-M354 VanDerWaalsContact C-N 3.28Å; L352-M354 PolarHBondContact O-N 3.22Å; L352-S356 PolarHBondContact O-OG 3.11Å
353	D	38.8	Very low	45.5	Very low	139 Å²	139	92.9 Å²	92.9	74%	0.743	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-2.9	-172.9	-79	-25.3	0	0	0	115.4
354	M	34.7	Very low	46.2	Very low	158 Å²	158	89.8 Å²	89.8	78%	0.778	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-9.8	-173.2	-157.2	155.2	72.9	0	0	115.8	L352	L352-M354 VanDerWaalsContact C-N 3.28Å; L352-M354 PolarHBondContact O-N 3.22Å
355	H	32.5	Very low	46.9	Very low	168 Å²	168	85.3 Å²	85.3	78%	0.778	52%	0.524	S	S	*	.	S	Bend	trans	-142.6	21.6	-171.8	-69.1	97	0	0	0	116.2	G357	H355-G357 PolarHBondContact O-N 3.39Å
356	S	32.4	Very low	48	Very low	70 Å²	70	88 Å²	88	49%	0.49	54%	0.536	S	S	.	.			trans	-89.7	107.9	-178.5	-66.9	0	0	0	0	112.7	L352	L352-S356 PolarHBondContact O-OG 3.11Å
357	G	26.9	Very low	49.8	Very low	62 Å²	62	86.1 Å²	86.1	64%	0.639	52%	0.524	S	S	*	.			trans	-67	173.1	176	0	0	0	0	0	114.5	H355 Q359	H355-G357 PolarHBondContact O-N 3.39Å; G357-Q359 PolarHBondContact O-N 3.06Å
358	A	32.3	Very low	51.8	Low	116 Å²	116	82.4 Å²	82.4	96%	0.959	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	29.2	-162.6	0	0	0	0	0	118.8
359	Q	32.5	Very low	53.8	Low	194 Å²	194	79 Å²	79	91%	0.907	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.6	-7.5	-179.2	-67.8	-167.2	-4.9	0	0	115.8	G357	G357-Q359 PolarHBondContact O-N 3.06Å
360	S	41.5	Very low	56.1	Low	52 Å²	52	78.4 Å²	78.4	36%	0.364	48%	0.481	S	S	.	.			trans	-113.7	96.5	175.9	-157.9	0	0	0	0	110.7
361	G	54	Low	58.9	Low	43 Å²	43	74.8 Å²	74.8	44%	0.443	44%	0.444	S	S	.	.			trans	-74.9	150.7	174.5	0	0	0	0	0	111.8
362	P	65.3	Low	61.7	Low	94 Å²	94	67 Å²	67	61%	0.61	41%	0.409	S	S	*	.			trans	-65.5	144.1	-174.6	27.6	-35.7	0	0	0	112.3	H364	P362-H364 PolarHBondContact O-N 3.26Å; P362-H364 VanDerWaalsContact O-N 3.1Å
363	M	72	Confident	64.3	Low	7 Å²	7	63.6 Å²	63.6	3%	0.034	39%	0.392	C	S	.	.	S	Bend	trans	-60.9	-22.4	-178.1	-167.1	63.9	-177	0	0	113.5	L241 C242 K245 Y246 K278 M281	L241-M363 HydrophobicContact CB-SD 3.73Å; C242-M363 HydrophobicContact CB-CE 3.65Å; C242-M363 HydrophobicContact CB-SD 4.28Å; K245-M363 HydrophobicContact CD-CB 3.63Å; K245-M363 HydrophobicContact CD-CG 4.24Å; Y246-M363 HydrophobicContact CE2-CG 4.16Å; K278-M363 HydrophobicContact CB-CE 4.03Å; K278-M363 HydrophobicContact CB-SD 4.35Å; K278-M363 HydrophobicContact CD-SD 4.42Å; K278-M363 HydrophobicContact CG-CE 4.04Å; K278-M363 HydrophobicContact CG-SD 3.91Å; K278-M363 WeakPolarHBondContact O-CE 3.39Å; M281-M363 HydrophobicContact CB-CE 3.83Å
364	H	71.4	Confident	67.1	Low	40 Å²	40	59.3 Å²	59.3	19%	0.185	37%	0.365	C	S	.	.	S	Bend	trans	-133.6	137.4	169.7	47.9	53.6	0	0	0	109.5	K245 A336 P362	K245-H364 PolarHBondContact NZ-CD2 3.27Å; K245-H364 VanDerWaalsContact NZ-CD2 3.34Å; K245-H364 PolarHBondContact NZ-NE2 2.91Å; A336-H364 HydrophobicContact CB-CB 4.08Å; A336-H364 VanDerWaalsContact CB-CG 3.46Å; P362-H364 PolarHBondContact O-N 3.26Å; P362-H364 VanDerWaalsContact O-N 3.1Å
365	G	76.1	Confident	70	Confident	42 Å²	42	52 Å²	52	43%	0.433	33%	0.33	S	S	.	.			trans	-103.3	-155.6	174.3	0	0	0	0	0	112.6	G367	G365-G367 PolarHBondContact O-N 3Å
366	F	80.4	Confident	73.1	Confident	61 Å²	61	44.3 Å²	44.3	27%	0.268	29%	0.294	S	S	.	.	S	Bend	trans	-66.7	24	-178.9	-53.9	-87.2	0	0	0	115.9	T167 A170 E171 H332 F368	T167-F366 HydrophobicContact CG2-CE2 4.01Å; T167-F366 HydrophobicContact CG2-CZ 4.48Å; A170-F366 HydrophobicContact CB-CB 3.79Å; A170-F366 HydrophobicContact CB-CD1 4.5Å; A170-F366 HydrophobicContact CB-CD2 3.85Å; A170-F366 HydrophobicContact CB-CG 3.8Å; E171-F366 HydrophobicContact CG-CE1 3.65Å; E171-F366 HydrophobicContact CG-CE2 4.31Å; E171-F366 HydrophobicContact CG-CZ 3.53Å; E171-F366 WeakPolarHBondContact OE1-CZ 3.41Å; H332-F366 VanDerWaalsContact CA-O 3.28Å; H332-F366 WeakPolarHBondContact CA-O 3.49Å; F366-F368 HydrophobicContact CB-CD2 4.09Å; F366-F368 HydrophobicContact CB-CE2 4.49Å; F366-F368 WeakPolarHBondContact O-CD2 3.43Å
367	G	86.8	Confident	76.2	Confident	14 Å²	14	41 Å²	41	14%	0.144	27%	0.271	C	S	.	.	S	Bend	trans	71.8	28.7	-176	0	0	0	0	0	114.5	F333 G365	F333-G367 WeakPolarHBondContact O-CA 3.39Å; G365-G367 PolarHBondContact O-N 3Å
368	F	92.6	Very high	79.4	Confident	20 Å²	20	42.9 Å²	42.9	9%	0.088	26%	0.263	C	S	.	.			trans	-97.1	-16.4	-176.7	-91.2	-125.4	0	0	0	114.5	V166 A170 L190 L194 Y331 H332 F366 T372	V166-F368 HydrophobicContact CG1-CD1 4.12Å; A170-F368 HydrophobicContact CB-CD1 4.33Å; A170-F368 HydrophobicContact CB-CD2 3.96Å; A170-F368 HydrophobicContact CB-CE1 3.97Å; A170-F368 HydrophobicContact CB-CE2 3.57Å; A170-F368 HydrophobicContact CB-CG 4.33Å; A170-F368 HydrophobicContact CB-CZ 3.58Å; L190-F368 HydrophobicContact CD1-CE1 4.01Å; L190-F368 HydrophobicContact CD1-CZ 3.66Å; L190-F368 HydrophobicContact CD2-CE1 4Å; L190-F368 HydrophobicContact CD2-CZ 4.25Å; L194-F368 HydrophobicContact CD1-CD1 4.32Å; L194-F368 HydrophobicContact CD1-CE1 4.31Å; Y331-F368 AromaticContact CD1-CD1 3.68Å; Y331-F368 HydrophobicContact CD1-CD1 3.68Å; Y331-F368 AromaticContact CD1-CD2 3.91Å; Y331-F368 HydrophobicContact CD1-CD2 3.91Å; Y331-F368 AromaticContact CD1-CE1 3.65Å; Y331-F368 HydrophobicContact CD1-CE1 3.65Å; Y331-F368 AromaticContact CD1-CE2 3.87Å; Y331-F368 HydrophobicContact CD1-CE2 3.87Å; Y331-F368 AromaticContact CD1-CG 3.81Å; Y331-F368 HydrophobicContact CD1-CG 3.81Å; Y331-F368 AromaticContact CD1-CZ 3.74Å; Y331-F368 HydrophobicContact CD1-CZ 3.74Å; Y331-F368 AromaticContact CE1-CD1 3.83Å; Y331-F368 HydrophobicContact CE1-CD1 3.83Å; Y331-F368 AromaticContact CE1-CE1 3.96Å; Y331-F368 HydrophobicContact CE1-CE1 3.96Å; Y331-F368 HydrophobicContact CE1-CG 4.27Å; Y331-F368 HydrophobicContact CE1-CZ 4.49Å; Y331-F368 HydrophobicContact CG-CE2 4.44Å; Y331-F368 HydrophobicContact CG-CZ 4.36Å; H332-F368 AromaticContact CD2-CE2 3.93Å; H332-F368 AromaticContact CE1-CE2 3.61Å; H332-F368 AromaticContact CE1-CZ 3.82Å; H332-F368 AromaticContact ND1-CE2 3.92Å; H332-F368 AromaticContact NE2-CE2 3.61Å; F366-F368 HydrophobicContact CB-CD2 4.09Å; F366-F368 HydrophobicContact CB-CE2 4.49Å; F366-F368 WeakPolarHBondContact O-CD2 3.43Å; F368-T372 WeakPolarHBondContact O-CB 3.29Å; F368-T372 PolarHBondContact O-N 3.16Å; F368-T372 PolarHBondContact O-OG1 3.39Å
369	G	93.3	Very high	82.3	Confident	10 Å²	10	38.8 Å²	38.8	10%	0.103	22%	0.223	C	C	.	.	H	α-helix	trans	-60.4	-55.7	-167.9	0	0	0	0	0	114.2	E275 S373	E275-G369 WeakPolarHBondContact OE2-CA 3.48Å; G369-S373 WeakPolarHBondContact O-CB 3.26Å; G369-S373 PolarHBondContact O-N 3.4Å; G369-S373 PolarHBondContact O-OG 2.96Å
370	L	96.1	Very high	85.1	Confident	27 Å²	27	29.8 Å²	29.8	14%	0.141	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-53.6	178.5	-69.3	175.3	0	0	0	113.7	L276 V328 M329 T372 S373 R374 L386	L276-L370 HydrophobicContact CD2-CD2 3.88Å; V328-L370 HydrophobicContact CB-CD1 3.94Å; V328-L370 HydrophobicContact CG2-CD1 4.19Å; V328-L370 WeakPolarHBondContact O-CB 3.49Å; V328-L370 WeakPolarHBondContact O-CD1 3.38Å; M329-L370 HydrophobicContact SD-CB 4.49Å; L370-T372 PolarHBondContact O-N 2.8Å; L370-S373 PolarHBondContact O-N 2.91Å; L370-R374 PolarHBondContact O-N 3.45Å; L370-L386 HydrophobicContact CD1-CD1 4.38Å; L370-L386 HydrophobicContact CD2-CD2 4.37Å
371	P	96.8	Very high	87.4	Confident	1 Å²	1	29 Å²	29	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-61.2	-44.1	-179	20.9	-32.6	0	0	0	112.6	M329 Y331 S373 R374 A375	M329-P371 WeakPolarHBondContact O-CB 3.38Å; Y331-P371 HydrophobicContact CD1-CB 3.89Å; Y331-P371 HydrophobicContact CD1-CG 3.59Å; Y331-P371 HydrophobicContact CD2-CB 4.08Å; Y331-P371 HydrophobicContact CD2-CG 4.5Å; Y331-P371 HydrophobicContact CE1-CB 3.69Å; Y331-P371 HydrophobicContact CE1-CG 3.75Å; Y331-P371 HydrophobicContact CE2-CB 3.88Å; Y331-P371 HydrophobicContact CG-CB 4.09Å; Y331-P371 HydrophobicContact CG-CG 4.01Å; P371-S373 PolarHBondContact O-N 2.88Å; P371-R374 PolarHBondContact O-N 2.84Å; P371-A375 WeakPolarHBondContact O-CB 3.28Å; P371-A375 PolarHBondContact O-N 2.97Å
372	T	95.9	Very high	89.3	Confident	15 Å²	15	27.7 Å²	27.7	9%	0.092	17%	0.168	C	C	.	.	H	α-helix	trans	-62.9	-41.9	177	-51.3	0	0	0	0	111.6	L194 F368 L370 R374 A375 Y376	L194-T372 HydrophobicContact CD1-CG2 4.19Å; F368-T372 WeakPolarHBondContact O-CB 3.29Å; F368-T372 PolarHBondContact O-N 3.16Å; F368-T372 PolarHBondContact O-OG1 3.39Å; L370-T372 PolarHBondContact O-N 2.8Å; T372-R374 VanDerWaalsContact C-N 3.35Å; T372-R374 PolarHBondContact O-N 3.35Å; T372-A375 PolarHBondContact O-N 3.44Å; T372-Y376 HydrophobicContact CG2-CD1 4.2Å; T372-Y376 HydrophobicContact CG2-CD2 4.07Å; T372-Y376 HydrophobicContact CG2-CE1 3.76Å; T372-Y376 HydrophobicContact CG2-CE2 3.62Å; T372-Y376 HydrophobicContact CG2-CG 4.35Å; T372-Y376 VanDerWaalsContact CG2-CZ 3.45Å; T372-Y376 WeakPolarHBondContact O-CB 3.2Å; T372-Y376 VanDerWaalsContact O-CG 3.27Å; T372-Y376 PolarHBondContact O-N 3.03Å
373	S	97.6	Very high	90.9	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-63.4	-40.1	179.2	-66.1	0	0	0	0	112.5	G369 L370 P371 A377	G369-S373 WeakPolarHBondContact O-CB 3.26Å; G369-S373 PolarHBondContact O-N 3.4Å; G369-S373 PolarHBondContact O-OG 2.96Å; L370-S373 PolarHBondContact O-N 2.91Å; P371-S373 PolarHBondContact O-N 2.88Å; S373-A377 WeakPolarHBondContact O-CB 3.37Å; S373-A377 PolarHBondContact O-N 3.45Å
374	R	97.8	Very high	92.1	Very high	49 Å²	49	24.5 Å²	24.5	19%	0.185	15%	0.148	C	C	.	.	H	α-helix	trans	-65.3	-50	174	178.3	172.9	52.4	158.7	-5.5	111.6	R187 M329 L370 P371 T372 Y376 A377 E378 L384	R187-R374 VanDerWaalsContact CZ-NH2 3.28Å; R187-R374 VanDerWaalsContact NH2-NH2 3.12Å; M329-R374 PolarHBondContact O-NH2 2.97Å; M329-R374 HydrophobicContact SD-CB 4.47Å; M329-R374 PolarHBondContact SD-NE 3.29Å; M329-R374 VanDerWaalsContact SD-NE 3.35Å; L370-R374 PolarHBondContact O-N 3.45Å; P371-R374 PolarHBondContact O-N 2.84Å; T372-R374 VanDerWaalsContact C-N 3.35Å; T372-R374 PolarHBondContact O-N 3.35Å; R374-Y376 PolarHBondContact O-N 3.13Å; R374-A377 PolarHBondContact O-N 2.79Å; R374-A377 VanDerWaalsContact O-N 3.08Å; R374-E378 VanDerWaalsContact CD-OE1 3.28Å; R374-E378 WeakPolarHBondContact CD-OE1 3.43Å; R374-E378 HydrophobicContact CG-CG 4.21Å; R374-E378 WeakPolarHBondContact CG-OE1 3.08Å; R374-E378 WeakPolarHBondContact O-CG 3.23Å; R374-E378 PolarHBondContact O-N 2.88Å; R374-L384 HydrophobicContact CB-CB 3.95Å; R374-L384 HydrophobicContact CB-CD2 4.08Å; R374-L384 HydrophobicContact CG-CB 4.29Å
375	A	96.6	Very high	93.4	Very high	5 Å²	5	27 Å²	27	4%	0.041	16%	0.16	C	C	.	.	H	α-helix	trans	-57.4	-38.7	179.2	0	0	0	0	0	111.9	T195 P371 T372 Y379	T195-A375 HydrophobicContact CG2-CB 3.96Å; T195-A375 VanDerWaalsContact CG2-O 3.23Å; T195-A375 WeakPolarHBondContact CG2-O 3.26Å; P371-A375 WeakPolarHBondContact O-CB 3.28Å; P371-A375 PolarHBondContact O-N 2.97Å; T372-A375 PolarHBondContact O-N 3.44Å; A375-Y379 WeakPolarHBondContact O-CB 3.37Å; A375-Y379 PolarHBondContact O-N 3.36Å
376	Y	96.9	Very high	94.5	Very high	5 Å²	5	26.7 Å²	26.7	2%	0.02	15%	0.148	C	C	.	.	H	α-helix	trans	-68.6	-42.8	174.7	-71.1	-1.5	0	0	0	112.7	L194 T195 L198 Y271 T372 R374 L380	L194-Y376 HydrophobicContact CB-CE1 3.97Å; L194-Y376 WeakPolarHBondContact O-CE1 3.44Å; T195-Y376 HydrophobicContact CG2-CD1 4.2Å; L198-Y376 HydrophobicContact CB-CD1 4.31Å; L198-Y376 HydrophobicContact CB-CE1 3.93Å; L198-Y376 HydrophobicContact CD2-CD1 3.71Å; L198-Y376 HydrophobicContact CD2-CD2 3.93Å; L198-Y376 HydrophobicContact CD2-CE1 4.11Å; L198-Y376 HydrophobicContact CD2-CE2 4.32Å; L198-Y376 HydrophobicContact CD2-CG 3.61Å; Y271-Y376 HydrophobicContact CD1-CE2 4.31Å; Y271-Y376 HydrophobicContact CD2-CE2 4.2Å; Y271-Y376 HydrophobicContact CG-CD2 4.42Å; Y271-Y376 AromaticContact CG-CE2 3.9Å; Y271-Y376 HydrophobicContact CG-CE2 3.9Å; T372-Y376 HydrophobicContact CG2-CD1 4.2Å; T372-Y376 HydrophobicContact CG2-CD2 4.07Å; T372-Y376 HydrophobicContact CG2-CE1 3.76Å; T372-Y376 HydrophobicContact CG2-CE2 3.62Å; T372-Y376 HydrophobicContact CG2-CG 4.35Å; T372-Y376 VanDerWaalsContact CG2-CZ 3.45Å; T372-Y376 WeakPolarHBondContact O-CB 3.2Å; T372-Y376 VanDerWaalsContact O-CG 3.27Å; T372-Y376 PolarHBondContact O-N 3.03Å; R374-Y376 PolarHBondContact O-N 3.13Å; Y376-L380 WeakPolarHBondContact O-CD1 3.47Å; Y376-L380 VanDerWaalsContact O-CG 3.25Å; Y376-L380 WeakPolarHBondContact O-CG 3.28Å; Y376-L380 PolarHBondContact O-N 2.94Å
377	A	96.6	Very high	95.3	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-46.8	176.5	0	0	0	0	0	111.7	S373 R374 L380 G381 G382 L384 L398 L400	S373-A377 WeakPolarHBondContact O-CB 3.37Å; S373-A377 PolarHBondContact O-N 3.45Å; R374-A377 PolarHBondContact O-N 2.79Å; R374-A377 VanDerWaalsContact O-N 3.08Å; A377-L380 CarbonylContact O-C 3.54Å; A377-L380 PolarHBondContact O-N 3.48Å; A377-G381 PolarHBondContact O-N 3.27Å; A377-G382 CarbonylContact O-C 3.27Å; A377-G382 VanDerWaalsContact O-CA 3.27Å; A377-G382 WeakPolarHBondContact O-CA 3.27Å; A377-G382 PolarHBondContact O-N 3.37Å; A377-L384 HydrophobicContact CB-CB 4.5Å; A377-L398 HydrophobicContact CB-CD1 3.84Å; A377-L400 HydrophobicContact CB-CD2 4.04Å
378	E	95.4	Very high	95.9	Very high	103 Å²	103	30 Å²	30	48%	0.481	16%	0.164	S	C	.	.	H	α-helix	trans	-65.2	-41.1	179.1	-70.6	173.6	-174.8	0	0	112.5	R374 L380 G381	R374-E378 VanDerWaalsContact CD-OE1 3.28Å; R374-E378 WeakPolarHBondContact CD-OE1 3.43Å; R374-E378 HydrophobicContact CG-CG 4.21Å; R374-E378 WeakPolarHBondContact CG-OE1 3.08Å; R374-E378 WeakPolarHBondContact O-CG 3.23Å; R374-E378 PolarHBondContact O-N 2.88Å; E378-L380 PolarHBondContact O-N 2.73Å; E378-G381 PolarHBondContact O-N 3.35Å
379	Y	92.6	Very high	96.1	Very high	30 Å²	30	33.2 Å²	33.2	12%	0.118	18%	0.182	C	C	.	.	H	α-helix	trans	-58.9	-28.7	174.6	170.6	-112	0	0	0	113	T195 L198 G199 A375 G381 I412	T195-Y379 HydrophobicContact CG2-CG 4.06Å; L198-Y379 HydrophobicContact CD2-CD1 4.22Å; G199-Y379 VanDerWaalsContact CA-OH 3.27Å; G199-Y379 WeakPolarHBondContact CA-OH 3.37Å; A375-Y379 WeakPolarHBondContact O-CB 3.37Å; A375-Y379 PolarHBondContact O-N 3.36Å; Y379-G381 VanDerWaalsContact C-N 3.34Å; Y379-I412 WeakPolarHBondContact OH-CA 3.46Å; Y379-I412 PolarHBondContact OH-OXT 3.2Å
380	L	91.1	Very high	96.3	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.021	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	20	177.6	-56.9	167.8	0	0	0	112.4	M202 P268 Y376 A377 E378 G382 L400 F410	M202-L380 HydrophobicContact CE-CD2 4.17Å; M202-L380 HydrophobicContact SD-CD2 4.3Å; P268-L380 HydrophobicContact CB-CD1 3.39Å; P268-L380 HydrophobicContact CG-CD1 3.33Å; Y376-L380 WeakPolarHBondContact O-CD1 3.47Å; Y376-L380 VanDerWaalsContact O-CG 3.25Å; Y376-L380 WeakPolarHBondContact O-CG 3.28Å; Y376-L380 PolarHBondContact O-N 2.94Å; A377-L380 CarbonylContact O-C 3.54Å; A377-L380 PolarHBondContact O-N 3.48Å; E378-L380 PolarHBondContact O-N 2.73Å; L380-G382 PolarHBondContact O-N 3.11Å; L380-L400 HydrophobicContact CB-CD2 4.4Å; L380-L400 HydrophobicContact CD1-CD2 4.42Å; L380-F410 VanDerWaalsContact C-CB 3.43Å; L380-F410 HydrophobicContact CB-CD2 4.2Å; L380-F410 HydrophobicContact CB-CE2 4.41Å; L380-F410 HydrophobicContact CB-CG 4.3Å; L380-F410 HydrophobicContact CD2-CD2 3.62Å; L380-F410 HydrophobicContact CD2-CE2 3.44Å; L380-F410 VanDerWaalsContact CD2-CE2 3.44Å; L380-F410 HydrophobicContact CD2-CZ 4.22Å; L380-F410 HydrophobicContact CG-CE2 4.48Å; L380-F410 VanDerWaalsContact O-CB 3.3Å; L380-F410 WeakPolarHBondContact O-CB 3.43Å; L380-F410 WeakPolarHBondContact O-CD1 3.47Å; L380-F410 WeakPolarHBondContact O-CG 3.49Å
381	G	89.7	Confident	96.2	Very high	35 Å²	35	39.1 Å²	39.1	36%	0.361	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	11.6	177.4	0	0	0	0	0	114.9	A377 E378 Y379 R401	A377-G381 PolarHBondContact O-N 3.27Å; E378-G381 PolarHBondContact O-N 3.35Å; Y379-G381 VanDerWaalsContact C-N 3.34Å; G381-R401 WeakPolarHBondContact O-CD 3.26Å; G381-R401 WeakPolarHBondContact O-CG 3.35Å; G381-R401 PolarHBondContact O-NE 2.74Å
382	G	94.9	Very high	96.3	Very high	17 Å²	17	43 Å²	43	18%	0.175	24%	0.243	C	C	.	.			trans	-99.6	-156.2	176.4	0	0	0	0	0	113	A377 L380 R399	A377-G382 CarbonylContact O-C 3.27Å; A377-G382 VanDerWaalsContact O-CA 3.27Å; A377-G382 WeakPolarHBondContact O-CA 3.27Å; A377-G382 PolarHBondContact O-N 3.37Å; L380-G382 PolarHBondContact O-N 3.11Å; G382-R399 CarbonylContact C-O 3.55Å; G382-R399 WeakPolarHBondContact CA-O 3.41Å
383	S	97.7	Very high	96.4	Very high	27 Å²	27	42.4 Å²	42.4	19%	0.189	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	161.1	176.6	56.3	0	0	0	0	112.4	R399	S383-R399 PolarHBondContact N-O 2.76Å; S383-R399 PolarHBondContact O-N 3.13Å
384	L	98.5	Very high	96.4	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.037	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	118.9	168	-174.5	70.6	0	0	0	109.2	L276 R374 A377 V396 Y397 L398	L276-L384 HydrophobicContact CD1-CD1 3.86Å; L276-L384 HydrophobicContact CD2-CD1 4.31Å; L276-L384 HydrophobicContact CD2-CD2 4.22Å; R374-L384 HydrophobicContact CB-CB 3.95Å; R374-L384 HydrophobicContact CB-CD2 4.08Å; R374-L384 HydrophobicContact CG-CB 4.29Å; A377-L384 HydrophobicContact CB-CB 4.5Å; L384-V396 HydrophobicContact CD1-CG1 3.62Å; L384-V396 HydrophobicContact CG-CG1 4.42Å; L384-Y397 WeakPolarHBondContact CA-O 3.38Å; L384-L398 HydrophobicContact CD1-CB 4.1Å; L384-L398 HydrophobicContact CD1-CD1 4.31Å
385	Q	98.4	Very high	96.5	Very high	92 Å²	92	41.9 Å²	41.9	43%	0.43	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.8	-178.4	-65.1	175.2	-17.1	0	0	110.7	Y397	Q385-Y397 PolarHBondContact N-O 2.85Å; Q385-Y397 PolarHBondContact O-N 3.39Å
386	L	98	Very high	96.6	Very high	35 Å²	35	42.2 Å²	42.2	18%	0.183	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	142.7	176.5	-57.6	177.8	0	0	0	109.7	I320 V328 M329 L370 V396	I320-L386 HydrophobicContact CD1-CD1 3.91Å; V328-L386 HydrophobicContact CG2-CD1 3.57Å; M329-L386 HydrophobicContact CE-CD1 3.78Å; M329-L386 HydrophobicContact CE-CG 3.89Å; L370-L386 HydrophobicContact CD1-CD1 4.38Å; L370-L386 HydrophobicContact CD2-CD2 4.37Å; L386-V396 HydrophobicContact CD2-CB 4.2Å; L386-V396 HydrophobicContact CD2-CG1 3.88Å; L386-V396 HydrophobicContact CD2-CG2 3.68Å
387	Q	98.4	Very high	96.7	Very high	111 Å²	111	44.5 Å²	44.5	52%	0.519	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	109.4	168.1	-68.1	-64.8	-33.9	0	0	107.6	D395 Y397	Q387-D395 HydrophobicContact CB-CB 4.16Å; Q387-D395 PolarHBondContact N-O 3.41Å; Q387-D395 PolarHBondContact O-N 2.98Å; Q387-Y397 HydrophobicContact CB-CE2 4.28Å; Q387-Y397 HydrophobicContact CG-CD2 4.35Å; Q387-Y397 HydrophobicContact CG-CE2 3.93Å
388	S	98.2	Very high	96.8	Very high	33 Å²	33	44.6 Å²	44.6	23%	0.231	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.8	179.2	-175.7	0	0	0	0	110.4	I320	I320-S388 WeakPolarHBondContact CA-OG 3.42Å; I320-S388 PolarHBondContact N-OG 3.47Å; I320-S388 PolarHBondContact O-OG 3.04Å
389	L	97.9	Very high	96.9	Very high	88 Å²	88	43 Å²	43	46%	0.461	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	83.1	166.8	-64.2	86.3	0	0	0	106.6	G391 I392 G393	L389-G391 PolarHBondContact O-N 2.69Å; L389-I392 HydrophobicContact CB-CB 4Å; L389-I392 WeakPolarHBondContact O-CA 3.34Å; L389-I392 WeakPolarHBondContact O-CB 3.4Å; L389-I392 PolarHBondContact O-N 3.35Å; L389-G393 CarbonylContact C-O 3.55Å; L389-G393 WeakPolarHBondContact CA-O 3.44Å; L389-G393 PolarHBondContact N-O 2.85Å; L389-G393 PolarHBondContact O-N 3.43Å
390	Q	96.7	Very high	97	Very high	100 Å²	100	41.7 Å²	41.7	47%	0.467	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	131.5	-175.2	-175.6	174.6	-22.4	0	0	111.1	H322	H322-Q390 PolarHBondContact CD2-OE1 3.43Å
391	G	95.3	Very high	97	Very high	62 Å²	62	44.8 Å²	44.8	64%	0.639	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	89	-8.9	-170	0	0	0	0	0	114.5	G318 L389	G318-G391 WeakPolarHBondContact O-CA 3.38Å; G318-G391 PolarHBondContact O-N 2.97Å; L389-G391 PolarHBondContact O-N 2.69Å
392	I	97.5	Very high	97	Very high	83 Å²	83	43.5 Å²	43.5	43%	0.426	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.2	-54.6	-175.4	-57.3	-65	0	0	0	112.7	R316 G318 L389	R316-I392 CarbonylContact C-O 3.59Å; R316-I392 WeakPolarHBondContact CA-O 3.44Å; R316-I392 VanDerWaalsContact NH1-CG2 3.35Å; G318-I392 PolarHBondContact N-O 2.95Å; L389-I392 HydrophobicContact CB-CB 4Å; L389-I392 WeakPolarHBondContact O-CA 3.34Å; L389-I392 WeakPolarHBondContact O-CB 3.4Å; L389-I392 PolarHBondContact O-N 3.35Å
393	G	98.1	Very high	96.4	Very high	2 Å²	2	42.9 Å²	42.9	2%	0.021	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164	-176.3	-171.8	0	0	0	0	0	113.9	D315 G319 L389	D315-G393 WeakPolarHBondContact OD1-CA 3.49Å; G319-G393 WeakPolarHBondContact CA-O 3.44Å; L389-G393 CarbonylContact C-O 3.55Å; L389-G393 WeakPolarHBondContact CA-O 3.44Å; L389-G393 PolarHBondContact N-O 2.85Å; L389-G393 PolarHBondContact O-N 3.43Å
394	T	98.8	Very high	94.9	Very high	10 Å²	10	46.2 Å²	46.2	6%	0.061	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.4	179	-36.3	0	0	0	0	111.2	S314 D315 I320 V396	S314-T394 WeakPolarHBondContact CA-O 3.46Å; D315-T394 PolarHBondContact N-O 2.84Å; D315-T394 PolarHBondContact OD1-N 3.3Å; D315-T394 WeakPolarHBondContact OD2-CB 3.46Å; D315-T394 PolarHBondContact OD2-OG1 3.29Å; I320-T394 HydrophobicContact CD1-CG2 3.96Å; I320-T394 HydrophobicContact CG1-CG2 4.19Å; T394-V396 HydrophobicContact CG2-CG2 4.37Å
395	D	98.8	Very high	93.1	Very high	30 Å²	30	47 Å²	47	16%	0.16	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	127.2	160.9	-82.6	-5.9	0	0	0	109.4	R312 S314 Q387 Y397	R312-D395 IonicContact NH1-OD2 2.66Å; S314-D395 WeakPolarHBondContact CB-OD1 3.23Å; S314-D395 PolarHBondContact OG-OD1 2.9Å; Q387-D395 HydrophobicContact CB-CB 4.16Å; Q387-D395 PolarHBondContact N-O 3.41Å; Q387-D395 PolarHBondContact O-N 2.98Å; D395-Y397 HydrophobicContact CB-CD2 4.24Å; D395-Y397 HydrophobicContact CB-CE2 3.46Å; D395-Y397 VanDerWaalsContact CB-CE2 3.46Å; D395-Y397 PolarHBondContact OD2-OH 3.25Å
396	V	98.8	Very high	91.1	Very high	13 Å²	13	52.6 Å²	52.6	8%	0.079	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	124	172.2	-174.7	0	0	0	0	109.3	L276 R312 I313 L384 L386 T394	L276-V396 HydrophobicContact CD1-CG1 3.86Å; L276-V396 HydrophobicContact CD2-CG1 4.05Å; L276-V396 HydrophobicContact CG-CG1 4.47Å; R312-V396 CarbonylContact C-O 3.36Å; R312-V396 VanDerWaalsContact CA-O 3.25Å; R312-V396 WeakPolarHBondContact CA-O 3.5Å; I313-V396 PolarHBondContact N-O 2.92Å; I313-V396 PolarHBondContact O-N 2.9Å; L384-V396 HydrophobicContact CD1-CG1 3.62Å; L384-V396 HydrophobicContact CG-CG1 4.42Å; L386-V396 HydrophobicContact CD2-CB 4.2Å; L386-V396 HydrophobicContact CD2-CG1 3.88Å; L386-V396 HydrophobicContact CD2-CG2 3.68Å; T394-V396 HydrophobicContact CG2-CG2 4.37Å
397	Y	98.8	Very high	89.4	Confident	52 Å²	52	56 Å²	56	20%	0.204	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	105.3	179.6	-64.1	-98.8	0	0	0	109.9	R312 L384 Q385 Q387 D395	R312-Y397 HydrophobicContact CB-CD1 4.07Å; R312-Y397 HydrophobicContact CB-CE1 4.08Å; R312-Y397 VanDerWaalsContact CD-CE1 3.47Å; R312-Y397 VanDerWaalsContact CD-CZ 3.42Å; R312-Y397 WeakPolarHBondContact CD-OH 3.44Å; R312-Y397 HydrophobicContact CG-CD1 4.05Å; R312-Y397 HydrophobicContact CG-CE1 3.76Å; R312-Y397 HydrophobicContact CG-CE2 4.38Å; R312-Y397 HydrophobicContact CG-CG 4.47Å; L384-Y397 WeakPolarHBondContact CA-O 3.38Å; Q385-Y397 PolarHBondContact N-O 2.85Å; Q385-Y397 PolarHBondContact O-N 3.39Å; Q387-Y397 HydrophobicContact CB-CE2 4.28Å; Q387-Y397 HydrophobicContact CG-CD2 4.35Å; Q387-Y397 HydrophobicContact CG-CE2 3.93Å; D395-Y397 HydrophobicContact CB-CD2 4.24Å; D395-Y397 HydrophobicContact CB-CE2 3.46Å; D395-Y397 VanDerWaalsContact CB-CE2 3.46Å; D395-Y397 PolarHBondContact OD2-OH 3.25Å
398	L	98.8	Very high	87.6	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.01	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	127.6	167.9	173.8	63.7	0	0	0	109.2	L269 I272 L276 I310 I311 A377 L384 L400	L269-L398 HydrophobicContact CD2-CD2 3.97Å; I272-L398 HydrophobicContact CB-CD2 4.41Å; I272-L398 HydrophobicContact CD1-CD1 4.09Å; I272-L398 HydrophobicContact CG2-CD1 4.16Å; I272-L398 HydrophobicContact CG2-CD2 3.72Å; L276-L398 HydrophobicContact CD1-CB 4.47Å; I310-L398 CarbonylContact C-O 3.6Å; I310-L398 WeakPolarHBondContact CA-O 3.42Å; I311-L398 HydrophobicContact CB-CB 4.45Å; I311-L398 HydrophobicContact CD1-CD2 4.47Å; I311-L398 PolarHBondContact N-O 3.37Å; I311-L398 PolarHBondContact O-N 3.2Å; A377-L398 HydrophobicContact CB-CD1 3.84Å; L384-L398 HydrophobicContact CD1-CB 4.1Å; L384-L398 HydrophobicContact CD1-CD1 4.31Å; L398-L400 HydrophobicContact CD1-CD2 4.21Å; L398-L400 HydrophobicContact CD1-CG 4.1Å; L398-L400 HydrophobicContact CD2-CD1 4.35Å; L398-L400 HydrophobicContact CG-CG 4.3Å
399	R	98.1	Very high	86	Confident	69 Å²	69	56.1 Å²	56.1	26%	0.26	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	136.4	169.4	-61.7	-170.5	170.9	87.1	-2.1	110	D308 L309 I310 G382 S383	D308-R399 VanDerWaalsContact OD2-CD 3.28Å; D308-R399 WeakPolarHBondContact OD2-CD 3.48Å; D308-R399 IonicContact OD2-NE 2.84Å; L309-R399 WeakPolarHBondContact O-CA 3.44Å; I310-R399 HydrophobicContact CG1-CG 4.15Å; I310-R399 HydrophobicContact CG2-CG 4.27Å; G382-R399 CarbonylContact C-O 3.55Å; G382-R399 WeakPolarHBondContact CA-O 3.41Å; S383-R399 PolarHBondContact N-O 2.76Å; S383-R399 PolarHBondContact O-N 3.13Å
400	L	95.1	Very high	84.9	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	132	173.3	-62.9	172.9	0	0	0	110	F264 L269 D308 L309 A377 L380 L398	F264-L400 HydrophobicContact CE1-CD1 4.14Å; F264-L400 HydrophobicContact CE2-CB 4.47Å; F264-L400 HydrophobicContact CZ-CB 3.79Å; F264-L400 HydrophobicContact CZ-CD1 3.89Å; L269-L400 HydrophobicContact CD2-CD1 3.7Å; L269-L400 HydrophobicContact CG-CD1 4.19Å; D308-L400 WeakPolarHBondContact CA-O 3.3Å; D308-L400 WeakPolarHBondContact CB-O 3.42Å; L309-L400 PolarHBondContact N-O 2.79Å; L309-L400 PolarHBondContact O-N 2.55Å; A377-L400 HydrophobicContact CB-CD2 4.04Å; L380-L400 HydrophobicContact CB-CD2 4.4Å; L380-L400 HydrophobicContact CD1-CD2 4.42Å; L398-L400 HydrophobicContact CD1-CD2 4.21Å; L398-L400 HydrophobicContact CD1-CG 4.1Å; L398-L400 HydrophobicContact CD2-CD1 4.35Å; L398-L400 HydrophobicContact CG-CG 4.3Å
401	R	91.7	Very high	83.8	Confident	68 Å²	68	54 Å²	54	26%	0.257	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	146.6	178.4	-73.9	-179.9	177.4	-109.8	-23.9	111.9	F264 G381 E407 E408 F410	F264-R401 WeakPolarHBondContact CE2-O 3.33Å; G381-R401 WeakPolarHBondContact O-CD 3.26Å; G381-R401 WeakPolarHBondContact O-CG 3.35Å; G381-R401 PolarHBondContact O-NE 2.74Å; R401-E407 IonicContact CZ-OE2 3.18Å; R401-E407 VanDerWaalsContact CZ-OE2 3.3Å; R401-E407 IonicContact NH1-OE2 3.69Å; R401-E407 PolarHBondContact NH1-OE2 3.38Å; R401-E407 IonicContact NH2-OE2 3.72Å; R401-E407 PolarHBondContact NH2-OE2 3.4Å; R401-E408 PolarHBondContact NH1-O 3.44Å; R401-F410 HydrophobicContact CB-CD1 4.21Å
402	H	88.4	Confident	82.6	Confident	9 Å²	9	51.1 Å²	51.1	4%	0.042	23%	0.233	C	C	.	.			trans	-69.8	159.5	170.1	-75.9	-67.9	0	0	0	112.7	F262 F264 N304 N305 V307	F262-H402 AromaticContact CD1-NE2 2.96Å; F262-H402 WeakPolarHBondContact CD1-NE2 3.21Å; F262-H402 AromaticContact CD2-CE1 2.96Å; F262-H402 WeakPolarHBondContact CD2-CE1 3.45Å; F262-H402 AromaticContact CD2-ND1 3.53Å; F262-H402 AromaticContact CD2-NE2 2.82Å; F262-H402 WeakPolarHBondContact CD2-NE2 3.35Å; F262-H402 AromaticContact CE1-NE2 3.02Å; F262-H402 WeakPolarHBondContact CE1-NE2 3.31Å; F262-H402 AromaticContact CE2-CE1 3.61Å; F262-H402 AromaticContact CE2-ND1 3.97Å; F262-H402 AromaticContact CE2-NE2 2.86Å; F262-H402 WeakPolarHBondContact CE2-NE2 3.33Å; F262-H402 AromaticContact CG-CE1 3.5Å; F262-H402 VanDerWaalsContact CG-CE1 3.5Å; F262-H402 WeakPolarHBondContact CG-CE1 3.41Å; F262-H402 AromaticContact CG-ND1 3.91Å; F262-H402 AromaticContact CG-NE2 2.88Å; F262-H402 WeakPolarHBondContact CG-NE2 3.19Å; F262-H402 AromaticContact CZ-NE2 2.98Å; F262-H402 WeakPolarHBondContact CZ-NE2 3.41Å; F264-H402 AromaticContact CD2-CE1 3.83Å; N304-H402 PolarHBondContact OD1-NE2 3.1Å; N305-H402 PolarHBondContact O-CD2 2.76Å; V307-H402 PolarHBondContact O-N 2.86Å
403	I	82.3	Confident	81.9	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.015	22%	0.223	C	C	.	.	S	Bend	trans	-73.6	-33.5	176.4	-69.2	-179.2	0	0	0	111.6	P72 T73 L76 I221 I265	P72-I403 HydrophobicContact CB-CB 4.26Å; P72-I403 HydrophobicContact CB-CD1 3.98Å; P72-I403 HydrophobicContact CB-CG1 3.75Å; P72-I403 HydrophobicContact CB-CG2 3.83Å; P72-I403 HydrophobicContact CG-CG1 4.33Å; T73-I403 PolarHBondContact OG1-O 2.87Å; L76-I403 HydrophobicContact CD1-CG2 3.7Å; I221-I403 HydrophobicContact CG2-CD1 3.51Å; I265-I403 HydrophobicContact CG1-CD1 3.88Å
404	D	66.9	Low	81	Confident	98 Å²	98	52 Å²	52	52%	0.524	23%	0.234	S	C	.	.	S	Bend	trans	-114.7	15.3	-173.1	55.9	-21.2	0	0	0	112.4
405	G	59.8	Low	80	Confident	23 Å²	23	54.3 Å²	54.3	24%	0.237	24%	0.243	C	C	.	.			trans	-60.2	156.6	178.1	0	0	0	0	0	112.9	D306 E407	D306-G405 WeakPolarHBondContact O-CA 3.42Å; G405-E407 PolarHBondContact O-N 3.19Å
406	R	57.4	Low	78.9	Confident	210 Å²	210	55.8 Å²	55.8	79%	0.792	25%	0.248	S	C	*	.	S	Bend	trans	-70.6	-12.8	-177.2	-56.3	-173.9	-170	-153.3	4.8	114.3	D306	D306-R406 HydrophobicContact CB-CG 4.44Å; D306-R406 PolarHBondContact O-N 3.12Å; D306-R406 IonicContact OD2-CZ 3.14Å; D306-R406 IonicContact OD2-NE 2.76Å; D306-R406 PolarHBondContact OD2-NE 2.97Å; D306-R406 IonicContact OD2-NH2 2.8Å; D306-R406 PolarHBondContact OD2-NH2 3.31Å
407	E	62.2	Low	77.7	Confident	107 Å²	107	58.4 Å²	58.4	50%	0.5	26%	0.259	S	S	.	.	S	Bend	trans	-98.7	174.5	176.6	-68.9	-163	176.8	0	0	112.5	R401 G405 S409	R401-E407 IonicContact CZ-OE2 3.18Å; R401-E407 VanDerWaalsContact CZ-OE2 3.3Å; R401-E407 IonicContact NH1-OE2 3.69Å; R401-E407 PolarHBondContact NH1-OE2 3.38Å; R401-E407 IonicContact NH2-OE2 3.72Å; R401-E407 PolarHBondContact NH2-OE2 3.4Å; G405-E407 PolarHBondContact O-N 3.19Å; E407-S409 PolarHBondContact O-N 2.93Å
408	E	60.3	Low	76.3	Confident	127 Å²	127	58.9 Å²	58.9	59%	0.593	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-57.1	123.2	174.4	-165.4	179.6	172.7	0	0	111.7	R401 R411	R401-E408 PolarHBondContact NH1-O 3.44Å; E408-R411 IonicContact OE1-CZ 3.95Å; E408-R411 IonicContact OE1-NE 3.52Å; E408-R411 PolarHBondContact OE1-NE 2.7Å; E408-R411 IonicContact OE1-NH2 2.87Å; E408-R411 PolarHBondContact OE1-NH2 2.91Å
409	S	64.4	Low	74.7	Confident	18 Å²	18	62.9 Å²	62.9	13%	0.126	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-69.3	148.9	177.6	-168.4	0	0	0	0	111.4	E407	E407-S409 PolarHBondContact O-N 2.93Å
410	F	74.3	Confident	72.9	Confident	16 Å²	16	62.5 Å²	62.5	7%	0.07	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-64.1	156	174.4	64.6	-92	0	0	0	111.8	P72 I265 L380 R401 I412	P72-F410 HydrophobicContact CB-CZ 4.49Å; P72-F410 WeakPolarHBondContact CD-O 3.49Å; P72-F410 HydrophobicContact CG-CD1 4.47Å; P72-F410 HydrophobicContact CG-CD2 3.99Å; P72-F410 HydrophobicContact CG-CE1 3.93Å; P72-F410 HydrophobicContact CG-CE2 3.35Å; P72-F410 HydrophobicContact CG-CZ 3.34Å; I265-F410 HydrophobicContact CD1-CZ 4.47Å; L380-F410 VanDerWaalsContact C-CB 3.43Å; L380-F410 HydrophobicContact CB-CD2 4.2Å; L380-F410 HydrophobicContact CB-CE2 4.41Å; L380-F410 HydrophobicContact CB-CG 4.3Å; L380-F410 HydrophobicContact CD2-CD2 3.62Å; L380-F410 HydrophobicContact CD2-CE2 3.44Å; L380-F410 VanDerWaalsContact CD2-CE2 3.44Å; L380-F410 HydrophobicContact CD2-CZ 4.22Å; L380-F410 HydrophobicContact CG-CE2 4.48Å; L380-F410 VanDerWaalsContact O-CB 3.3Å; L380-F410 WeakPolarHBondContact O-CB 3.43Å; L380-F410 WeakPolarHBondContact O-CD1 3.47Å; L380-F410 WeakPolarHBondContact O-CG 3.49Å; R401-F410 HydrophobicContact CB-CD1 4.21Å; F410-I412 HydrophobicContact CD2-CG1 4.13Å; F410-I412 HydrophobicContact CE2-CD1 4.04Å; F410-I412 HydrophobicContact CE2-CG1 3.95Å
411	R	74.3	Confident	71	Confident	127 Å²	127	67.3 Å²	67.3	48%	0.479	30%	0.304	S	S	.	.			trans	-122.6	124.1	-176.5	-46	-172.6	-172.7	-170.3	4.2	111.2	R69 L70 T71 E408	R69-R411 HydrophobicContact CB-CB 3.57Å; R69-R411 VanDerWaalsContact CD-O 3.29Å; R69-R411 WeakPolarHBondContact CD-O 3.46Å; R69-R411 PolarHBondContact NH1-O 2.88Å; L70-R411 CarbonylContact O-C 3.58Å; L70-R411 WeakPolarHBondContact O-CA 3.39Å; T71-R411 HydrophobicContact CG2-CG 4.14Å; E408-R411 IonicContact OE1-CZ 3.95Å; E408-R411 IonicContact OE1-NE 3.52Å; E408-R411 PolarHBondContact OE1-NE 2.7Å; E408-R411 IonicContact OE1-NH2 2.87Å; E408-R411 PolarHBondContact OE1-NH2 2.91Å
412	I	70.4	Confident	69.1	Low	2 Å²	2	67.3 Å²	67.3	1%	0.01	31%	0.308	C	S	.	.			trans	-87.2	0	-176.8	-59.9	164.2	0	0	0	110.6	R69 L70 P72 M75 R101 M202 L203 I265 Y379 F410	R69-I412 WeakPolarHBondContact CA-O 3.25Å; R69-I412 WeakPolarHBondContact CB-O 3.28Å; L70-I412 PolarHBondContact N-O 3.06Å; L70-I412 VanDerWaalsContact N-O 3.12Å; L70-I412 PolarHBondContact O-N 3.44Å; P72-I412 HydrophobicContact CG-CD1 4.16Å; M75-I412 HydrophobicContact SD-CD1 3.8Å; R101-I412 PolarHBondContact NH1-O 3.11Å; R101-I412 PolarHBondContact NH1-OXT 3.45Å; R101-I412 PolarHBondContact NH2-O 2.97Å; R101-I412 PolarHBondContact NH2-OXT 3.3Å; M202-I412 HydrophobicContact CB-CG2 4.22Å; M202-I412 HydrophobicContact CE-CD1 3.57Å; M202-I412 HydrophobicContact CE-CG1 4.12Å; M202-I412 HydrophobicContact SD-CD1 4.45Å; M202-I412 HydrophobicContact SD-CG2 4.46Å; L203-I412 HydrophobicContact CD2-CG2 4.32Å; L203-I412 HydrophobicContact CG-CG2 4.18Å; I265-I412 HydrophobicContact CD1-CD1 3.96Å; Y379-I412 WeakPolarHBondContact OH-CA 3.46Å; Y379-I412 PolarHBondContact OH-OXT 3.2Å; F410-I412 HydrophobicContact CD2-CG1 4.13Å; F410-I412 HydrophobicContact CE2-CD1 4.04Å; F410-I412 HydrophobicContact CE2-CG1 3.95Å

Retrieved 412 of 412 residues in 708 ms (Link to these results)

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