A0A087XUD7_POEFO Loading...

STEAP2 metalloreductase

AlphaFold DB , UniProt , Accession A0A087XUD7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 509 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	32.3	Very low	25.9	Very low	235 Å²	235	153.4 Å²	153.4	100%	1.158	84%	0.841	S	S	*	*				0	102.2	0	-70.6	168.7	143.5	0	0	106.8
2	D	30.3	Very low	26	Very low	155 Å²	155	149.9 Å²	149.9	83%	0.829	84%	0.836	S	S	*	*			cis	-143.9	141.9	1	-79.9	-37.6	0	0	0	109.3
3	S	22.6	Very low	26.2	Very low	109 Å²	109	147.4 Å²	147.4	76%	0.762	83%	0.83	S	S	*	*			trans	-75.4	141.5	166.4	39.6	0	0	0	0	111
4	I	28	Very low	26.2	Very low	178 Å²	178	146.3 Å²	146.3	91%	0.913	83%	0.828	S	S	*	*			trans	-151	128.9	136.7	-91.6	144.3	0	0	0	108.5
5	S	22.9	Very low	26.1	Very low	99 Å²	99	149.4 Å²	149.4	69%	0.692	83%	0.829	S	S	*	*			trans	-111	139.7	175.2	150.4	0	0	0	0	107.9
6	M	26	Very low	26	Very low	142 Å²	142	151 Å²	151	70%	0.7	84%	0.835	S	S	*	*				172.1	135.7	115.3	-95.7	-157.1	-174.7	0	0	113.8
7	K	25.6	Very low	25.9	Very low	186 Å²	186	149.8 Å²	149.8	81%	0.809	83%	0.832	S	S	*	*			trans	62.9	127.7	143.7	-64.1	171.1	177	170.4	0	116.8
8	G	23.2	Very low	25.8	Very low	76 Å²	76	147.3 Å²	147.3	78%	0.784	84%	0.835	S	S	*	*			cis	138.2	111	17.2	0	0	0	0	0	106.9
9	C	22.6	Very low	25.8	Very low	128 Å²	128	145.9 Å²	145.9	87%	0.865	84%	0.835	S	S	*	*			trans	-161.4	125.8	156	-148	0	0	0	0	110.1
10	T	25	Very low	25.7	Very low	130 Å²	130	144.2 Å²	144.2	80%	0.798	83%	0.832	S	S	*	*			trans	-59.5	129.6	180	42.5	0	0	0	0	113.4
11	R	26.7	Very low	25.8	Very low	249 Å²	249	142 Å²	142	94%	0.94	83%	0.826	S	S	*	*			trans	-157	111.7	153.4	-104.6	172.9	-170.7	-173.7	1.9	110.4
12	S	27.2	Very low	25.5	Very low	112 Å²	112	139.8 Å²	139.8	78%	0.783	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-71.7	141.4	171.5	-48.1	0	0	0	0	110.6	V14	S12-V14 PolarHBondContact O-N 3.42Å
13	P	28.4	Very low	25.3	Very low	117 Å²	117	141.6 Å²	141.6	76%	0.76	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-81	119.1	171.9	30.6	-28.9	0	0	0	110.1
14	V	25.9	Very low	25.4	Very low	132 Å²	132	141.8 Å²	141.8	80%	0.8	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-70.3	121.3	171.8	171.7	0	0	0	0	108.8	S12	S12-V14 PolarHBondContact O-N 3.42Å
15	F	24.7	Very low	25.4	Very low	193 Å²	193	142 Å²	142	85%	0.846	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-72.1	121.6	166.5	-94.2	-92.9	0	0	0	109.6	T17	F15-T17 PolarHBondContact O-N 3.28Å
16	L	23.8	Very low	25.6	Very low	175 Å²	175	142.7 Å²	142.7	92%	0.916	81%	0.813	S	S	*	*			trans	-73.1	108.5	173.6	-78.1	155.8	0	0	0	110.2
17	T	24.9	Very low	25.8	Very low	130 Å²	130	141.9 Å²	141.9	80%	0.798	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-97.6	122.3	163	48.8	0	0	0	0	109.1	F15	F15-T17 PolarHBondContact O-N 3.28Å
18	A	24.4	Very low	25.9	Very low	106 Å²	106	137.8 Å²	137.8	88%	0.876	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-70.8	141.5	179.2	0	0	0	0	0	112.4
19	S	24.7	Very low	26	Very low	120 Å²	120	139.4 Å²	139.4	84%	0.839	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-72.2	145.9	-168.3	-50.1	0	0	0	0	114.9
20	S	25.1	Very low	26.2	Very low	112 Å²	112	141.4 Å²	141.4	78%	0.783	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-63.5	126	171	51.3	0	0	0	0	112.6
21	S	26.9	Very low	26.2	Very low	99 Å²	99	144.1 Å²	144.1	69%	0.692	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-76.5	124.2	169.2	52.3	0	0	0	0	111.2	F23	S21-F23 PolarHBondContact O-N 3.48Å
22	H	25.9	Very low	26.3	Very low	187 Å²	187	140 Å²	140	87%	0.866	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-54	123.1	168.3	-78.7	-91.1	0	0	0	111.6
23	F	25.6	Very low	26.2	Very low	193 Å²	193	141 Å²	141	85%	0.846	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-95.8	117.4	159.4	-94.3	-84.7	0	0	0	108.8	S21	S21-F23 PolarHBondContact O-N 3.48Å
24	S	24.7	Very low	26.2	Very low	113 Å²	113	142.6 Å²	142.6	79%	0.79	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-70.4	131.8	172.7	31.3	0	0	0	0	111.1
25	H	28.2	Very low	26.2	Very low	183 Å²	183	145.8 Å²	145.8	85%	0.847	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-70.8	142.7	168.6	-72.6	-77.5	0	0	0	111
26	P	28	Very low	26.4	Very low	114 Å²	114	142.9 Å²	142.9	74%	0.74	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-80.8	157	163.9	32.4	-28.9	0	0	0	110.9
27	P	30.7	Very low	26.7	Very low	125 Å²	125	138.9 Å²	138.9	81%	0.812	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-78.9	142.9	-162.6	31.7	-33.8	0	0	0	112.9	C29	P27-C29 PolarHBondContact O-N 3.17Å
28	A	27.9	Very low	27	Very low	99 Å²	99	141.1 Å²	141.1	82%	0.818	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-66.3	119.1	169.3	0	0	0	0	0	110.1	M30	A28-M30 PolarHBondContact O-N 3.15Å
29	C	24.3	Very low	27.3	Very low	110 Å²	110	141.6 Å²	141.6	74%	0.743	82%	0.815	S	S	*	*			trans	-81.1	103.8	169.2	-145.9	0	0	0	0	107.8	P27 F31	P27-C29 PolarHBondContact O-N 3.17Å; C29-F31 PolarHBondContact O-N 3.14Å
30	M	26.8	Very low	27.6	Very low	171 Å²	171	138.6 Å²	138.6	84%	0.842	80%	0.804	S	S	*	*			trans	-70.5	111.4	168.3	-85.3	-154.4	-117	0	0	109.3	A28	A28-M30 PolarHBondContact O-N 3.15Å
31	F	26.1	Very low	28	Very low	187 Å²	187	139.3 Å²	139.3	82%	0.82	81%	0.805	S	S	*	*			trans	-113.2	111.3	155.5	-88.2	-81.6	0	0	0	108.9	C29	C29-F31 PolarHBondContact O-N 3.14Å
32	H	27.6	Very low	28.4	Very low	163 Å²	163	139.9 Å²	139.9	76%	0.755	81%	0.81	S	S	*	*			trans	-61.7	127.4	164.5	-103.3	33.6	0	0	0	109.8
33	C	25.6	Very low	28.7	Very low	133 Å²	133	136.3 Å²	136.3	90%	0.899	81%	0.805	S	S	*	*			trans	-139	107.6	155.6	-123.8	0	0	0	0	109.3
34	N	27.7	Very low	29.4	Very low	149 Å²	149	133.2 Å²	133.2	80%	0.797	80%	0.796	S	S	*	*			trans	-73.2	122.2	171	-88	-23.4	0	0	0	110.6
35	K	26.6	Very low	30.2	Very low	200 Å²	200	133.4 Å²	133.4	87%	0.87	79%	0.792	S	S	*	*				173.6	140.6	124.6	-96.4	178.8	-177.6	-178.8	0	110.4
36	P	29.2	Very low	31.4	Very low	132 Å²	132	127.6 Å²	127.6	86%	0.857	77%	0.771	S	S	*	*			trans	-85.1	127.3	-178.6	33.8	-29.2	0	0	0	110
37	A	29	Very low	34	Very low	91 Å²	91	125.3 Å²	125.3	75%	0.752	76%	0.755	S	S	*	*			trans	-107.7	132.2	159.5	0	0	0	0	0	107.1	S39	A37-S39 PolarHBondContact O-N 3.27Å; A37-S39 VanDerWaalsContact O-N 3.07Å
38	D	31.2	Very low	37	Very low	176 Å²	176	121.4 Å²	121.4	94%	0.941	73%	0.729	S	S	*	*			trans	-38.1	108.1	-176.4	-80.1	-41.7	0	0	0	113.4
39	S	31.8	Very low	40.2	Very low	116 Å²	116	116.7 Å²	116.7	81%	0.811	69%	0.69	S	S	*	*			trans	-100.8	97.8	160.9	43.3	0	0	0	0	107.3	A37	A37-S39 PolarHBondContact O-N 3.27Å; A37-S39 VanDerWaalsContact O-N 3.07Å
40	G	29.9	Very low	43.7	Very low	58 Å²	58	111.4 Å²	111.4	60%	0.598	65%	0.654	S	S	*	*			trans	-55.2	152.6	163.2	0	0	0	0	0	110	S42	G40-S42 PolarHBondContact O-N 3.12Å
41	P	35	Very low	47.1	Very low	126 Å²	126	103.3 Å²	103.3	82%	0.818	61%	0.614	S	S	*	*			trans	-66.5	115.3	-177.7	27.6	-31.3	0	0	0	108.5	C43	P41-C43 PolarHBondContact O-N 3.06Å
42	S	34.8	Very low	50.5	Low	112 Å²	112	94.4 Å²	94.4	78%	0.783	58%	0.575	S	S	*	*			trans	-73	65	163.1	47.5	0	0	0	0	109	G40 L44	G40-S42 PolarHBondContact O-N 3.12Å; S42-L44 VanDerWaalsContact C-N 3.26Å; S42-L44 PolarHBondContact O-N 3.17Å
43	C	31.4	Very low	53.7	Low	112 Å²	112	86.8 Å²	86.8	76%	0.757	54%	0.541	S	S	*	.			trans	-72	89.6	166.7	-155.8	0	0	0	0	106.5	P41 V45	P41-C43 PolarHBondContact O-N 3.06Å; C43-V45 PolarHBondContact O-N 2.91Å
44	L	40.2	Very low	57	Low	128 Å²	128	82.6 Å²	82.6	67%	0.67	51%	0.513	S	S	*	.			trans	-59.1	104	176.8	-82.2	153.7	0	0	0	108.6	S42	S42-L44 VanDerWaalsContact C-N 3.26Å; S42-L44 PolarHBondContact O-N 3.17Å
45	V	41.7	Very low	60.2	Low	116 Å²	116	77.3 Å²	77.3	70%	0.703	49%	0.493	S	S	*	.			trans	-52.5	129	167.4	-177.1	0	0	0	0	107.4	C43 T47	C43-V45 PolarHBondContact O-N 2.91Å; V45-T47 PolarHBondContact O-N 3.1Å
46	P	54.9	Low	63.4	Low	61 Å²	61	73.3 Å²	73.3	40%	0.396	48%	0.482	S	S	.	.			trans	-57.1	106.3	178.9	-22.3	31	0	0	0	109.3	T48 K71	P46-T48 PolarHBondContact O-N 3.13Å; P46-K71 HydrophobicContact CB-CD 3.97Å; P46-K71 HydrophobicContact CB-CG 3.94Å
47	T	81.6	Confident	66.6	Low	66 Å²	66	68.9 Å²	68.9	41%	0.405	45%	0.449	S	S	.	.			trans	-68.5	119.6	-179	-58.4	0	0	0	0	106.9	V45 I104	V45-T47 PolarHBondContact O-N 3.1Å; T47-I104 HydrophobicContact CG2-CD1 4.2Å
48	T	93.2	Very high	69.8	Low	43 Å²	43	64.6 Å²	64.6	26%	0.264	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	125.6	178	-58.8	0	0	0	0	108.4	P46 K71 V73 K101 S102	P46-T48 PolarHBondContact O-N 3.13Å; T48-K71 CarbonylContact C-O 3.54Å; T48-K71 VanDerWaalsContact CA-O 3.32Å; T48-K71 WeakPolarHBondContact CA-O 3.22Å; T48-K71 HydrophobicContact CG2-CB 4.36Å; T48-V73 HydrophobicContact CG2-CG2 3.85Å; T48-K101 WeakPolarHBondContact CG2-O 3.2Å; T48-S102 WeakPolarHBondContact O-CB 3.26Å; T48-S102 PolarHBondContact O-OG 3.46Å
49	V	96.3	Very high	72.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.8	179.4	177.4	0	0	0	0	108.7	L65 F70 K71 V72 V73 F106 L198	V49-L65 HydrophobicContact CB-CD1 4.34Å; V49-L65 HydrophobicContact CB-CD2 4.45Å; V49-L65 HydrophobicContact CG1-CD1 3.91Å; V49-L65 HydrophobicContact CG1-CD2 4.42Å; V49-L65 HydrophobicContact CG2-CD2 4.24Å; V49-F70 HydrophobicContact CG2-CD1 4.08Å; V49-K71 PolarHBondContact N-O 2.74Å; V49-V72 WeakPolarHBondContact O-CA 3.3Å; V49-V73 PolarHBondContact O-N 2.84Å; V49-F106 HydrophobicContact CG1-CD2 3.45Å; V49-F106 VanDerWaalsContact CG1-CD2 3.45Å; V49-F106 HydrophobicContact CG1-CE2 3.56Å; V49-L198 HydrophobicContact CG2-CD1 4.23Å
50	A	97.3	Very high	75.8	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	144.8	172.7	0	0	0	0	0	110.9	V73 S102 I104 L105 F106	A50-V73 CarbonylContact C-O 3.43Å; A50-V73 VanDerWaalsContact CA-O 3.25Å; A50-V73 WeakPolarHBondContact CA-O 3.11Å; A50-S102 PolarHBondContact N-OG 2.93Å; A50-I104 PolarHBondContact N-O 3.05Å; A50-L105 HydrophobicContact CB-CD2 4.29Å; A50-L105 HydrophobicContact CB-CG 4.11Å; A50-L105 CarbonylContact O-C 3.55Å; A50-L105 VanDerWaalsContact O-CA 3.32Å; A50-L105 WeakPolarHBondContact O-CA 3.38Å; A50-F106 PolarHBondContact O-N 3.27Å
51	V	97.8	Very high	78.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	118.1	171.6	-172.8	0	0	0	0	108.1	S58 I61 L65 V72 V73 I74 G75 F106 A108	V51-S58 VanDerWaalsContact CG1-OG 3.26Å; V51-S58 WeakPolarHBondContact CG1-OG 3.27Å; V51-I61 HydrophobicContact CG1-CG2 4.13Å; V51-I61 HydrophobicContact CG2-CG2 4.14Å; V51-L65 HydrophobicContact CG2-CD1 4.3Å; V51-V72 HydrophobicContact CG2-CG1 4.04Å; V51-V73 PolarHBondContact N-O 3.07Å; V51-I74 HydrophobicContact CB-CD1 3.71Å; V51-I74 HydrophobicContact CG1-CD1 4.43Å; V51-I74 HydrophobicContact CG2-CD1 4.21Å; V51-I74 WeakPolarHBondContact O-CA 3.4Å; V51-G75 PolarHBondContact O-N 2.9Å; V51-F106 CarbonylContact C-O 3.56Å; V51-F106 WeakPolarHBondContact CA-O 3.45Å; V51-F106 HydrophobicContact CB-CB 4.43Å; V51-F106 HydrophobicContact CG1-CB 4.12Å; V51-F106 HydrophobicContact CG2-CB 4.2Å; V51-A108 HydrophobicContact CG1-CB 3.95Å
52	L	97.2	Very high	81.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	122.7	178.5	-53	-174.3	0	0	0	109.1	Y95 A98 I99 L105 F106 L107 A108 L117	L52-Y95 HydrophobicContact CB-CD1 4.21Å; L52-Y95 HydrophobicContact CB-CE1 4Å; L52-Y95 HydrophobicContact CD2-CD1 3.9Å; L52-Y95 HydrophobicContact CG-CD1 4.49Å; L52-A98 HydrophobicContact CD2-CB 4.27Å; L52-I99 HydrophobicContact CD1-CD1 4.19Å; L52-I99 HydrophobicContact CD1-CG1 4.05Å; L52-I99 HydrophobicContact CD2-CG1 4.04Å; L52-L105 HydrophobicContact CD1-CD2 3.98Å; L52-L105 HydrophobicContact CD2-CD2 4.36Å; L52-L105 HydrophobicContact CG-CD2 4.29Å; L52-F106 PolarHBondContact N-O 3.27Å; L52-L107 HydrophobicContact CB-CD2 4.14Å; L52-L107 HydrophobicContact CD1-CD2 3.73Å; L52-L107 HydrophobicContact CG-CD2 4.32Å; L52-A108 CarbonylContact O-C 3.58Å; L52-A108 WeakPolarHBondContact O-CA 3.32Å; L52-A108 PolarHBondContact O-N 3.03Å; L52-L117 HydrophobicContact CD1-CD2 4.3Å
53	G	95.9	Very high	84.6	Confident	4 Å²	4	41.2 Å²	41.2	4%	0.041	25%	0.247	C	C	.	.			trans	109.6	147.4	-172.5	0	0	0	0	0	111.7	S58 G75	G53-S58 WeakPolarHBondContact O-CB 3.49Å; G53-S58 PolarHBondContact O-OG 3.18Å; G53-G75 PolarHBondContact N-O 3.41Å
54	S	95.1	Very high	87.5	Confident	45 Å²	45	35.9 Å²	35.9	32%	0.315	21%	0.211	S	C	.	.			trans	-125.5	35.6	-173.3	61.3	0	0	0	0	113.1	S76	S54-S76 PolarHBondContact OG-OG 3.46Å; S54-S76 VanDerWaalsContact OG-OG 3.05Å
55	G	94.4	Very high	90.1	Very high	37 Å²	37	29.8 Å²	29.8	38%	0.381	18%	0.179	S	C	.	.	S	Bend	trans	-96.8	-171.1	177	0	0	0	0	0	113.6	F57 S58 K59	G55-F57 PolarHBondContact O-N 3.37Å; G55-S58 WeakPolarHBondContact O-CB 3.48Å; G55-S58 PolarHBondContact O-N 3.07Å; G55-S58 VanDerWaalsContact O-N 3.17Å; G55-K59 PolarHBondContact O-N 3.3Å
56	D	94.1	Very high	92.6	Very high	116 Å²	116	26.5 Å²	26.5	62%	0.62	16%	0.157	S	C	*	.	H	α-helix	trans	-58.8	-45.9	-174.2	-65.9	-31.5	0	0	0	113.4	S58 K59 S60	D56-S58 VanDerWaalsContact C-N 3.31Å; D56-S58 PolarHBondContact O-N 3.31Å; D56-K59 PolarHBondContact O-N 3.49Å; D56-S60 PolarHBondContact O-N 3.48Å; D56-S60 PolarHBondContact O-OG 2.89Å
57	F	95.1	Very high	94.4	Very high	39 Å²	39	30.4 Å²	30.4	17%	0.171	16%	0.164	C	C	.	.	H	α-helix	trans	-62.2	-40.5	178.6	-170.4	-88.4	0	0	0	111.9	G55 S60 I61 A108 V132 F162 I165 A167 M170	G55-F57 PolarHBondContact O-N 3.37Å; F57-S60 PolarHBondContact O-N 3.02Å; F57-I61 HydrophobicContact CD1-CG2 4.48Å; F57-I61 HydrophobicContact CE1-CB 4.36Å; F57-I61 HydrophobicContact CE1-CD1 4.24Å; F57-I61 HydrophobicContact CE1-CG2 4.46Å; F57-I61 WeakPolarHBondContact O-CG2 3.41Å; F57-I61 PolarHBondContact O-N 3.25Å; F57-A108 HydrophobicContact CD1-CB 4.33Å; F57-V132 HydrophobicContact CD1-CB 4.47Å; F57-V132 HydrophobicContact CD1-CG2 3.87Å; F57-V132 HydrophobicContact CE1-CB 3.78Å; F57-V132 HydrophobicContact CE1-CG1 3.91Å; F57-V132 HydrophobicContact CE1-CG2 3.63Å; F57-V132 HydrophobicContact CZ-CB 4.07Å; F57-V132 HydrophobicContact CZ-CG1 4.27Å; F57-V132 HydrophobicContact CZ-CG2 4.36Å; F57-F162 HydrophobicContact CZ-CB 4.19Å; F57-I165 WeakPolarHBondContact CE2-O 3.28Å; F57-A167 HydrophobicContact CB-CB 4.49Å; F57-A167 HydrophobicContact CD2-CB 4.3Å; F57-M170 HydrophobicContact CE2-CE 4.03Å; F57-M170 HydrophobicContact CZ-CE 3.71Å
58	S	95.9	Very high	94.8	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.007	16%	0.157	C	C	.	.	H	α-helix	trans	-60.7	-48.1	175.9	177.3	0	0	0	0	111	V51 G53 G55 D56 S60 I61 T62	V51-S58 VanDerWaalsContact CG1-OG 3.26Å; V51-S58 WeakPolarHBondContact CG1-OG 3.27Å; G53-S58 WeakPolarHBondContact O-CB 3.49Å; G53-S58 PolarHBondContact O-OG 3.18Å; G55-S58 WeakPolarHBondContact O-CB 3.48Å; G55-S58 PolarHBondContact O-N 3.07Å; G55-S58 VanDerWaalsContact O-N 3.17Å; D56-S58 VanDerWaalsContact C-N 3.31Å; D56-S58 PolarHBondContact O-N 3.31Å; S58-S60 VanDerWaalsContact C-N 3.31Å; S58-S60 PolarHBondContact O-N 3.27Å; S58-I61 WeakPolarHBondContact O-CG2 3.38Å; S58-I61 PolarHBondContact O-N 3.23Å; S58-T62 VanDerWaalsContact O-CB 3.27Å; S58-T62 WeakPolarHBondContact O-CB 3.5Å; S58-T62 PolarHBondContact O-N 2.78Å; S58-T62 PolarHBondContact O-OG1 3.4Å
59	K	95.2	Very high	94.8	Very high	62 Å²	62	29.8 Å²	29.8	27%	0.27	17%	0.173	S	C	.	.	H	α-helix	trans	-57	-45.8	174.7	179	172.8	-177.8	168.7	0	112.2	G55 D56 T62 I63 F85 F86	G55-K59 PolarHBondContact O-N 3.3Å; D56-K59 PolarHBondContact O-N 3.49Å; K59-T62 PolarHBondContact O-N 2.9Å; K59-I63 HydrophobicContact CG-CD1 3.93Å; K59-I63 VanDerWaalsContact O-CG1 3.31Å; K59-I63 WeakPolarHBondContact O-CG1 3.4Å; K59-I63 PolarHBondContact O-N 3.01Å; K59-F85 HydrophobicContact CB-CD1 3.94Å; K59-F85 HydrophobicContact CB-CE1 3.52Å; K59-F85 HydrophobicContact CB-CZ 4.28Å; K59-F85 HydrophobicContact CD-CD1 3.7Å; K59-F85 HydrophobicContact CD-CD2 4.12Å; K59-F85 HydrophobicContact CD-CE1 3.34Å; K59-F85 HydrophobicContact CD-CE2 3.79Å; K59-F85 HydrophobicContact CD-CG 4.08Å; K59-F85 HydrophobicContact CD-CZ 3.39Å; K59-F85 WeakPolarHBondContact CD-O 3.49Å; K59-F85 VanDerWaalsContact CE-O 3.26Å; K59-F85 WeakPolarHBondContact CE-O 3.2Å; K59-F85 HydrophobicContact CG-CD1 4.33Å; K59-F85 HydrophobicContact CG-CE1 4.05Å; K59-F85 HydrophobicContact CG-CZ 4.49Å; K59-F85 PolarHBondContact NZ-O 2.63Å; K59-F86 HydrophobicContact CB-CE1 4.1Å
60	S	94.8	Very high	94.7	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.007	18%	0.176	C	C	.	.	H	α-helix	trans	-64.7	-47.6	-178.6	-65.7	0	0	0	0	113.3	D56 F57 S58 T62 I63 R64 A167 Q171	D56-S60 PolarHBondContact O-N 3.48Å; D56-S60 PolarHBondContact O-OG 2.89Å; F57-S60 PolarHBondContact O-N 3.02Å; S58-S60 VanDerWaalsContact C-N 3.31Å; S58-S60 PolarHBondContact O-N 3.27Å; S60-T62 VanDerWaalsContact C-N 3.31Å; S60-T62 PolarHBondContact O-N 3.39Å; S60-I63 PolarHBondContact O-N 3.27Å; S60-R64 PolarHBondContact O-N 3.15Å; S60-R64 VanDerWaalsContact O-N 3.12Å; S60-A167 WeakPolarHBondContact CB-O 3.48Å; S60-A167 PolarHBondContact OG-O 3.06Å; S60-Q171 VanDerWaalsContact OG-CG 3.28Å; S60-Q171 WeakPolarHBondContact OG-CG 3.36Å; S60-Q171 PolarHBondContact OG-NE2 3.03Å
61	I	95.2	Very high	94.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67.3	-34.1	178.4	-164.4	171	0	0	0	111.4	V51 F57 S58 R64 L65 F106 M170	V51-I61 HydrophobicContact CG1-CG2 4.13Å; V51-I61 HydrophobicContact CG2-CG2 4.14Å; F57-I61 HydrophobicContact CD1-CG2 4.48Å; F57-I61 HydrophobicContact CE1-CB 4.36Å; F57-I61 HydrophobicContact CE1-CD1 4.24Å; F57-I61 HydrophobicContact CE1-CG2 4.46Å; F57-I61 WeakPolarHBondContact O-CG2 3.41Å; F57-I61 PolarHBondContact O-N 3.25Å; S58-I61 WeakPolarHBondContact O-CG2 3.38Å; S58-I61 PolarHBondContact O-N 3.23Å; I61-R64 WeakPolarHBondContact O-CB 3.46Å; I61-R64 PolarHBondContact O-N 2.68Å; I61-L65 HydrophobicContact CG1-CD1 4Å; I61-L65 HydrophobicContact CG1-CG 4.32Å; I61-L65 WeakPolarHBondContact O-CB 3.47Å; I61-L65 WeakPolarHBondContact O-CD1 3.3Å; I61-L65 VanDerWaalsContact O-CG 3.27Å; I61-L65 WeakPolarHBondContact O-CG 2.82Å; I61-L65 PolarHBondContact O-N 3.47Å; I61-F106 HydrophobicContact CD1-CD1 3.38Å; I61-F106 HydrophobicContact CD1-CD2 4.28Å; I61-F106 HydrophobicContact CD1-CE1 3.39Å; I61-F106 HydrophobicContact CD1-CE2 4.3Å; I61-F106 HydrophobicContact CD1-CG 3.84Å; I61-F106 HydrophobicContact CD1-CZ 3.88Å; I61-M170 HydrophobicContact CB-CG 4.04Å; I61-M170 HydrophobicContact CB-SD 4.41Å; I61-M170 HydrophobicContact CG1-CG 4.45Å; I61-M170 HydrophobicContact CG1-SD 4.19Å
62	T	95.6	Very high	94.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64	-46.7	174.7	-67.3	0	0	0	0	112.2	S58 K59 S60 R64 L65 L66 V72 I74 F86 V90	S58-T62 VanDerWaalsContact O-CB 3.27Å; S58-T62 WeakPolarHBondContact O-CB 3.5Å; S58-T62 PolarHBondContact O-N 2.78Å; S58-T62 PolarHBondContact O-OG1 3.4Å; K59-T62 PolarHBondContact O-N 2.9Å; S60-T62 VanDerWaalsContact C-N 3.31Å; S60-T62 PolarHBondContact O-N 3.39Å; T62-R64 PolarHBondContact O-N 2.84Å; T62-L65 PolarHBondContact O-N 3.22Å; T62-L66 HydrophobicContact CG2-CD1 4.04Å; T62-L66 HydrophobicContact CG2-CG 4.4Å; T62-L66 WeakPolarHBondContact O-CB 3.44Å; T62-L66 VanDerWaalsContact O-CG 3.24Å; T62-L66 WeakPolarHBondContact O-CG 3.47Å; T62-L66 PolarHBondContact O-N 3.26Å; T62-V72 HydrophobicContact CG2-CB 4.17Å; T62-V72 HydrophobicContact CG2-CG1 3.84Å; T62-V72 HydrophobicContact CG2-CG2 4.5Å; T62-I74 HydrophobicContact CG2-CD1 4.38Å; T62-I74 WeakPolarHBondContact OG1-CD1 3.32Å; T62-F86 HydrophobicContact CG2-CD1 4.02Å; T62-F86 HydrophobicContact CG2-CE1 4.49Å; T62-V90 HydrophobicContact CG2-CG1 4.21Å; T62-V90 HydrophobicContact CG2-CG2 3.72Å
63	I	93.8	Very high	94.5	Very high	34 Å²	34	37.3 Å²	37.3	17%	0.174	21%	0.207	C	C	.	.	H	α-helix	trans	-57.9	-40.9	175.3	-70.4	166.5	0	0	0	110.4	K59 S60 R67	K59-I63 HydrophobicContact CG-CD1 3.93Å; K59-I63 VanDerWaalsContact O-CG1 3.31Å; K59-I63 WeakPolarHBondContact O-CG1 3.4Å; K59-I63 PolarHBondContact O-N 3.01Å; S60-I63 PolarHBondContact O-N 3.27Å; I63-R67 WeakPolarHBondContact O-CB 3.49Å; I63-R67 VanDerWaalsContact O-CG 3.28Å; I63-R67 WeakPolarHBondContact O-CG 3.45Å; I63-R67 PolarHBondContact O-N 2.94Å; I63-R67 VanDerWaalsContact O-N 3.09Å
64	R	93.1	Very high	94.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.3	-51.1	178.3	-173.7	55.3	161.2	156.8	-23.4	112.5	S60 I61 T62 L66 R67 C68 M170 Q172 I173 L202 N203	S60-R64 PolarHBondContact O-N 3.15Å; S60-R64 VanDerWaalsContact O-N 3.12Å; I61-R64 WeakPolarHBondContact O-CB 3.46Å; I61-R64 PolarHBondContact O-N 2.68Å; T62-R64 PolarHBondContact O-N 2.84Å; R64-L66 VanDerWaalsContact C-N 3.34Å; R64-L66 PolarHBondContact O-N 3.15Å; R64-R67 PolarHBondContact O-N 3.32Å; R64-C68 PolarHBondContact O-N 3.41Å; R64-M170 HydrophobicContact CB-CG 4.42Å; R64-M170 WeakPolarHBondContact CB-O 3.21Å; R64-M170 HydrophobicContact CB-SD 4.46Å; R64-M170 HydrophobicContact CG-SD 4.27Å; R64-Q172 VanDerWaalsContact CZ-O 3.25Å; R64-Q172 PolarHBondContact NE-O 3.08Å; R64-Q172 PolarHBondContact NH2-O 3.38Å; R64-I173 PolarHBondContact NH1-O 2.87Å; R64-I173 PolarHBondContact NH2-O 2.81Å; R64-L202 HydrophobicContact CG-CB 4.43Å; R64-L202 HydrophobicContact CG-CD2 4.03Å; R64-L202 PolarHBondContact NE-O 2.99Å; R64-L202 VanDerWaalsContact NE-O 3.12Å; R64-L202 PolarHBondContact NH2-O 3.24Å; R64-N203 PolarHBondContact NH1-ND2 2.94Å
65	L	94.4	Very high	94.7	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-57.3	-46.4	177.7	-77.1	163.4	0	0	0	111.1	V49 V51 I61 T62 R67 C68 G69 F70 V72 L202	V49-L65 HydrophobicContact CB-CD1 4.34Å; V49-L65 HydrophobicContact CB-CD2 4.45Å; V49-L65 HydrophobicContact CG1-CD1 3.91Å; V49-L65 HydrophobicContact CG1-CD2 4.42Å; V49-L65 HydrophobicContact CG2-CD2 4.24Å; V51-L65 HydrophobicContact CG2-CD1 4.3Å; I61-L65 HydrophobicContact CG1-CD1 4Å; I61-L65 HydrophobicContact CG1-CG 4.32Å; I61-L65 WeakPolarHBondContact O-CB 3.47Å; I61-L65 WeakPolarHBondContact O-CD1 3.3Å; I61-L65 VanDerWaalsContact O-CG 3.27Å; I61-L65 WeakPolarHBondContact O-CG 2.82Å; I61-L65 PolarHBondContact O-N 3.47Å; T62-L65 PolarHBondContact O-N 3.22Å; L65-R67 PolarHBondContact O-N 3.36Å; L65-C68 CarbonylContact O-C 3.6Å; L65-C68 PolarHBondContact O-N 3.3Å; L65-G69 PolarHBondContact O-N 3.31Å; L65-F70 HydrophobicContact CB-CB 4.11Å; L65-F70 HydrophobicContact CD2-CB 4.11Å; L65-F70 HydrophobicContact CD2-CD1 4.44Å; L65-F70 HydrophobicContact CD2-CD2 3.89Å; L65-F70 HydrophobicContact CD2-CE2 4.39Å; L65-F70 HydrophobicContact CD2-CG 3.9Å; L65-F70 WeakPolarHBondContact O-CB 3.02Å; L65-F70 WeakPolarHBondContact O-CD2 3.46Å; L65-F70 PolarHBondContact O-N 3.1Å; L65-V72 HydrophobicContact CB-CG2 3.45Å; L65-V72 VanDerWaalsContact CB-CG2 3.45Å; L65-V72 HydrophobicContact CD1-CG1 4.46Å; L65-V72 HydrophobicContact CD1-CG2 4.07Å; L65-V72 HydrophobicContact CG-CG2 4.36Å; L65-L202 HydrophobicContact CD2-CD1 4.16Å; L65-L202 HydrophobicContact CD2-CD2 3.76Å; L65-L202 HydrophobicContact CD2-CG 4.46Å; L65-L202 HydrophobicContact CG-CD2 4.18Å
66	L	93.9	Very high	94.7	Very high	47 Å²	47	33.5 Å²	33.5	25%	0.246	17%	0.174	C	C	.	.	H	α-helix	trans	-60.4	-44.9	177.3	-70.6	170.7	0	0	0	112.4	T62 R64 C68 G69 V72 P87 V89 V90	T62-L66 HydrophobicContact CG2-CD1 4.04Å; T62-L66 HydrophobicContact CG2-CG 4.4Å; T62-L66 WeakPolarHBondContact O-CB 3.44Å; T62-L66 VanDerWaalsContact O-CG 3.24Å; T62-L66 WeakPolarHBondContact O-CG 3.47Å; T62-L66 PolarHBondContact O-N 3.26Å; R64-L66 VanDerWaalsContact C-N 3.34Å; R64-L66 PolarHBondContact O-N 3.15Å; L66-C68 PolarHBondContact O-N 3.45Å; L66-G69 PolarHBondContact O-N 3.06Å; L66-V72 HydrophobicContact CD2-CB 4.48Å; L66-V72 HydrophobicContact CD2-CG2 4.15Å; L66-V72 HydrophobicContact CG-CG2 4.18Å; L66-P87 HydrophobicContact CD1-CB 4.37Å; L66-P87 HydrophobicContact CD1-CG 4.04Å; L66-V89 HydrophobicContact CD1-CG1 4.03Å; L66-V89 HydrophobicContact CD2-CG1 4Å; L66-V90 HydrophobicContact CD1-CG2 3.56Å; L66-V90 HydrophobicContact CD2-CG2 4.19Å; L66-V90 HydrophobicContact CG-CG2 4.3Å
67	R	91.8	Very high	94.7	Very high	144 Å²	144	35.6 Å²	35.6	54%	0.543	17%	0.173	S	C	.	.	H	α-helix	trans	-64.4	-27.6	178.3	-75.4	173.4	173.2	180	0.7	112.9	I63 R64 L65 G69 Q171	I63-R67 WeakPolarHBondContact O-CB 3.49Å; I63-R67 VanDerWaalsContact O-CG 3.28Å; I63-R67 WeakPolarHBondContact O-CG 3.45Å; I63-R67 PolarHBondContact O-N 2.94Å; I63-R67 VanDerWaalsContact O-N 3.09Å; R64-R67 PolarHBondContact O-N 3.32Å; L65-R67 PolarHBondContact O-N 3.36Å; R67-G69 VanDerWaalsContact C-N 3.31Å; R67-Q171 PolarHBondContact NH1-O 3.27Å
68	C	91.6	Very high	94.6	Very high	39 Å²	39	41.4 Å²	41.4	26%	0.264	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	9	174.7	-67.7	0	0	0	0	113.2	R64 L65 L66 F70 Q201 L202	R64-C68 PolarHBondContact O-N 3.41Å; L65-C68 CarbonylContact O-C 3.6Å; L65-C68 PolarHBondContact O-N 3.3Å; L66-C68 PolarHBondContact O-N 3.45Å; C68-F70 HydrophobicContact CB-CD2 3.88Å; C68-F70 HydrophobicContact CB-CE2 3.87Å; C68-Q201 PolarHBondContact SG-O 3.42Å; C68-L202 HydrophobicContact CB-CD2 3.9Å
69	G	92.3	Very high	94.5	Very high	57 Å²	57	42.2 Å²	42.2	59%	0.588	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.5	9.4	172.9	0	0	0	0	0	115.8	L65 L66 R67	L65-G69 PolarHBondContact O-N 3.31Å; L66-G69 PolarHBondContact O-N 3.06Å; R67-G69 VanDerWaalsContact C-N 3.31Å
70	F	94.3	Very high	94.4	Very high	18 Å²	18	48 Å²	48	8%	0.079	22%	0.224	C	C	.	.			trans	-81	147.1	177.2	-65.3	-92.9	0	0	0	111.9	V49 L65 C68 L198 Q201 L202	V49-F70 HydrophobicContact CG2-CD1 4.08Å; L65-F70 HydrophobicContact CB-CB 4.11Å; L65-F70 HydrophobicContact CD2-CB 4.11Å; L65-F70 HydrophobicContact CD2-CD1 4.44Å; L65-F70 HydrophobicContact CD2-CD2 3.89Å; L65-F70 HydrophobicContact CD2-CE2 4.39Å; L65-F70 HydrophobicContact CD2-CG 3.9Å; L65-F70 WeakPolarHBondContact O-CB 3.02Å; L65-F70 WeakPolarHBondContact O-CD2 3.46Å; L65-F70 PolarHBondContact O-N 3.1Å; C68-F70 HydrophobicContact CB-CD2 3.88Å; C68-F70 HydrophobicContact CB-CE2 3.87Å; F70-L198 HydrophobicContact CZ-CG 4.46Å; F70-Q201 HydrophobicContact CE2-CB 4.07Å; F70-Q201 HydrophobicContact CZ-CB 3.81Å; F70-L202 HydrophobicContact CD2-CD2 4.19Å; F70-L202 HydrophobicContact CE2-CD2 3.9Å
71	K	95.3	Very high	94.3	Very high	121 Å²	121	52.7 Å²	52.7	53%	0.526	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	129.1	165.8	-68.8	-179.1	-179.7	178.9	0	108.5	P46 T48 V49	P46-K71 HydrophobicContact CB-CD 3.97Å; P46-K71 HydrophobicContact CB-CG 3.94Å; T48-K71 CarbonylContact C-O 3.54Å; T48-K71 VanDerWaalsContact CA-O 3.32Å; T48-K71 WeakPolarHBondContact CA-O 3.22Å; T48-K71 HydrophobicContact CG2-CB 4.36Å; V49-K71 PolarHBondContact N-O 2.74Å
72	V	96.1	Very high	94.1	Very high	9 Å²	9	53.1 Å²	53.1	6%	0.055	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	135.4	-176.4	-170.8	0	0	0	0	110.3	V49 V51 T62 L65 L66 I74	V49-V72 WeakPolarHBondContact O-CA 3.3Å; V51-V72 HydrophobicContact CG2-CG1 4.04Å; T62-V72 HydrophobicContact CG2-CB 4.17Å; T62-V72 HydrophobicContact CG2-CG1 3.84Å; T62-V72 HydrophobicContact CG2-CG2 4.5Å; L65-V72 HydrophobicContact CB-CG2 3.45Å; L65-V72 VanDerWaalsContact CB-CG2 3.45Å; L65-V72 HydrophobicContact CD1-CG1 4.46Å; L65-V72 HydrophobicContact CD1-CG2 4.07Å; L65-V72 HydrophobicContact CG-CG2 4.36Å; L66-V72 HydrophobicContact CD2-CB 4.48Å; L66-V72 HydrophobicContact CD2-CG2 4.15Å; L66-V72 HydrophobicContact CG-CG2 4.18Å; V72-I74 HydrophobicContact CG1-CD1 4.2Å
73	V	96.9	Very high	94	Very high	10 Å²	10	55.3 Å²	55.3	6%	0.061	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	133.5	171.2	-175.6	0	0	0	0	108.8	T48 V49 A50 V51 D91 A98 K101	T48-V73 HydrophobicContact CG2-CG2 3.85Å; V49-V73 PolarHBondContact O-N 2.84Å; A50-V73 CarbonylContact C-O 3.43Å; A50-V73 VanDerWaalsContact CA-O 3.25Å; A50-V73 WeakPolarHBondContact CA-O 3.11Å; V51-V73 PolarHBondContact N-O 3.07Å; V73-D91 WeakPolarHBondContact CA-O 3.46Å; V73-D91 HydrophobicContact CG1-CB 4.37Å; V73-A98 HydrophobicContact CG1-CB 3.82Å; V73-K101 HydrophobicContact CG1-CD 4.17Å; V73-K101 HydrophobicContact CG2-CB 4.21Å; V73-K101 HydrophobicContact CG2-CD 4.19Å
74	I	97.7	Very high	93.9	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	128.4	177.8	-59.1	-62.6	0	0	0	109.6	V51 T62 V72 F86 V90 D91 V92 S93	V51-I74 HydrophobicContact CB-CD1 3.71Å; V51-I74 HydrophobicContact CG1-CD1 4.43Å; V51-I74 HydrophobicContact CG2-CD1 4.21Å; V51-I74 WeakPolarHBondContact O-CA 3.4Å; T62-I74 HydrophobicContact CG2-CD1 4.38Å; T62-I74 WeakPolarHBondContact OG1-CD1 3.32Å; V72-I74 HydrophobicContact CG1-CD1 4.2Å; I74-F86 HydrophobicContact CD1-CD1 4.16Å; I74-F86 HydrophobicContact CD1-CE1 3.66Å; I74-F86 HydrophobicContact CD1-CZ 4.02Å; I74-F86 HydrophobicContact CG1-CD1 3.98Å; I74-F86 HydrophobicContact CG1-CD2 4.39Å; I74-F86 HydrophobicContact CG1-CE1 3.84Å; I74-F86 HydrophobicContact CG1-CE2 4.32Å; I74-F86 HydrophobicContact CG1-CG 4.25Å; I74-F86 HydrophobicContact CG1-CZ 4.05Å; I74-F86 HydrophobicContact CG2-CE2 3.93Å; I74-F86 HydrophobicContact CG2-CZ 3.97Å; I74-V90 HydrophobicContact CB-CG1 4.49Å; I74-V90 HydrophobicContact CD1-CG1 4.48Å; I74-V90 HydrophobicContact CG1-CG1 3.55Å; I74-D91 PolarHBondContact N-O 2.82Å; I74-V92 HydrophobicContact CB-CB 4.41Å; I74-V92 HydrophobicContact CB-CG1 4.2Å; I74-V92 HydrophobicContact CB-CG2 4.07Å; I74-V92 HydrophobicContact CG1-CG2 4.34Å; I74-V92 HydrophobicContact CG2-CG1 4.09Å; I74-S93 PolarHBondContact O-N 3.11Å
75	G	96.8	Very high	93.8	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	125.5	165.8	0	0	0	0	0	110.5	V51 G53 S93 Y95	V51-G75 PolarHBondContact O-N 2.9Å; G53-G75 PolarHBondContact N-O 3.41Å; G75-S93 WeakPolarHBondContact CA-O 3.47Å; G75-Y95 VanDerWaalsContact C-CE1 3.47Å; G75-Y95 WeakPolarHBondContact O-CE1 3.39Å
76	S	95.6	Very high	93.8	Very high	5 Å²	5	65.2 Å²	65.2	4%	0.035	31%	0.311	C	S	.	.			trans	-137.9	152	174.6	-173.5	0	0	0	0	111.8	S54 R78 S93	S54-S76 PolarHBondContact OG-OG 3.46Å; S54-S76 VanDerWaalsContact OG-OG 3.05Å; S76-R78 PolarHBondContact O-N 2.92Å; S76-R78 PolarHBondContact OG-N 2.77Å; S76-S93 PolarHBondContact N-O 3.49Å
77	R	93.1	Very high	93.7	Very high	161 Å²	161	65.4 Å²	65.4	61%	0.608	32%	0.315	S	S	*	.	S	Bend	trans	-62.9	-29.1	171	-65.9	176.7	-70.5	-178.5	-1.3	112.4	Y95	R77-Y95 HydrophobicContact CG-CD2 4.39Å; R77-Y95 HydrophobicContact CG-CE2 3.48Å; R77-Y95 VanDerWaalsContact CG-CE2 3.48Å
78	R	93.6	Very high	93.5	Very high	161 Å²	161	67.8 Å²	67.8	61%	0.608	33%	0.332	S	S	*	.	S	Bend	trans	-133.6	74.3	-178	-56	-164.2	-41.8	168	5.5	110.7	S76 K80 L81 A82	S76-R78 PolarHBondContact O-N 2.92Å; S76-R78 PolarHBondContact OG-N 2.77Å; R78-K80 VanDerWaalsContact C-N 3.32Å; R78-K80 PolarHBondContact O-N 3.46Å; R78-L81 HydrophobicContact CB-CB 4.42Å; R78-L81 HydrophobicContact CB-CD1 4.48Å; R78-L81 PolarHBondContact O-N 3.32Å; R78-L81 VanDerWaalsContact O-N 3.1Å; R78-A82 PolarHBondContact O-N 2.85Å
79	P	93.8	Very high	93.5	Very high	17 Å²	17	71.4 Å²	71.4	11%	0.11	35%	0.353	C	S	.	.	H	α-helix	trans	-59.1	-39.2	-171.2	20.9	-31.8	0	0	0	113.4	L81 A82 S83 V92 H94	P79-L81 PolarHBondContact O-N 3.11Å; P79-A82 PolarHBondContact O-N 3.48Å; P79-S83 WeakPolarHBondContact O-CB 3.27Å; P79-S83 PolarHBondContact O-N 2.99Å; P79-V92 HydrophobicContact CB-CG1 4.16Å; P79-V92 WeakPolarHBondContact CB-O 3.37Å; P79-H94 VanDerWaalsContact CD-CE1 3.44Å; P79-H94 WeakPolarHBondContact CD-CE1 3.38Å; P79-H94 WeakPolarHBondContact CG-NE2 3.39Å
80	K	92.9	Very high	93.5	Very high	184 Å²	184	69.3 Å²	69.3	80%	0.8	33%	0.328	S	S	*	.	H	α-helix	trans	-57	-32.7	177.7	-66.5	-176.1	178.9	-179.5	0	114	R78 S83	R78-K80 VanDerWaalsContact C-N 3.32Å; R78-K80 PolarHBondContact O-N 3.46Å; K80-S83 PolarHBondContact O-OG 3.32Å
81	L	92.1	Very high	93.5	Very high	100 Å²	100	71.4 Å²	71.4	52%	0.524	34%	0.341	S	S	.	.	H	α-helix	trans	-92.6	-33.2	-178.8	-72.3	158.5	0	0	0	111.1	R78 P79	R78-L81 HydrophobicContact CB-CB 4.42Å; R78-L81 HydrophobicContact CB-CD1 4.48Å; R78-L81 PolarHBondContact O-N 3.32Å; R78-L81 VanDerWaalsContact O-N 3.1Å; P79-L81 PolarHBondContact O-N 3.11Å
82	A	92.4	Very high	93.6	Very high	9 Å²	9	66.7 Å²	66.7	7%	0.074	32%	0.322	C	S	.	.	H	α-helix	trans	-70.1	-31.8	176.1	0	0	0	0	0	112.7	R78 P79 H84 F85 F86 V92	R78-A82 PolarHBondContact O-N 2.85Å; P79-A82 PolarHBondContact O-N 3.48Å; A82-H84 PolarHBondContact O-N 2.96Å; A82-H84 VanDerWaalsContact O-N 3.15Å; A82-F85 WeakPolarHBondContact O-CB 3.39Å; A82-F85 PolarHBondContact O-N 3.03Å; A82-F86 VanDerWaalsContact O-CD2 3.28Å; A82-F86 WeakPolarHBondContact O-CD2 3.35Å; A82-V92 HydrophobicContact CB-CG1 3.85Å
83	S	92.7	Very high	93.6	Very high	45 Å²	45	66.9 Å²	66.9	32%	0.315	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-54.6	-34.6	-178	60.3	0	0	0	0	113.5	P79 K80 F85 F86	P79-S83 WeakPolarHBondContact O-CB 3.27Å; P79-S83 PolarHBondContact O-N 2.99Å; K80-S83 PolarHBondContact O-OG 3.32Å; S83-F85 PolarHBondContact O-N 3.44Å; S83-F86 PolarHBondContact O-N 3.47Å
84	H	91.9	Very high	93.5	Very high	161 Å²	161	70.6 Å²	70.6	75%	0.745	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-66.4	-19.4	176.3	-65.9	-73	0	0	0	114	A82	A82-H84 PolarHBondContact O-N 2.96Å; A82-H84 VanDerWaalsContact O-N 3.15Å
85	F	91.8	Very high	93.4	Very high	72 Å²	72	71.6 Å²	71.6	32%	0.316	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-87.5	-17.7	-177.3	-164.2	-122.9	0	0	0	113.4	K59 A82 S83	K59-F85 HydrophobicContact CB-CD1 3.94Å; K59-F85 HydrophobicContact CB-CE1 3.52Å; K59-F85 HydrophobicContact CB-CZ 4.28Å; K59-F85 HydrophobicContact CD-CD1 3.7Å; K59-F85 HydrophobicContact CD-CD2 4.12Å; K59-F85 HydrophobicContact CD-CE1 3.34Å; K59-F85 HydrophobicContact CD-CE2 3.79Å; K59-F85 HydrophobicContact CD-CG 4.08Å; K59-F85 HydrophobicContact CD-CZ 3.39Å; K59-F85 WeakPolarHBondContact CD-O 3.49Å; K59-F85 VanDerWaalsContact CE-O 3.26Å; K59-F85 WeakPolarHBondContact CE-O 3.2Å; K59-F85 HydrophobicContact CG-CD1 4.33Å; K59-F85 HydrophobicContact CG-CE1 4.05Å; K59-F85 HydrophobicContact CG-CZ 4.49Å; K59-F85 PolarHBondContact NZ-O 2.63Å; A82-F85 WeakPolarHBondContact O-CB 3.39Å; A82-F85 PolarHBondContact O-N 3.03Å; S83-F85 PolarHBondContact O-N 3.44Å
86	F	93.8	Very high	93.4	Very high	10 Å²	10	75.4 Å²	75.4	4%	0.044	36%	0.362	C	S	.	.	S	Bend	trans	-110.8	157.6	-176.4	-65.1	-86.2	0	0	0	111.7	K59 T62 I74 A82 S83 V90 V92	K59-F86 HydrophobicContact CB-CE1 4.1Å; T62-F86 HydrophobicContact CG2-CD1 4.02Å; T62-F86 HydrophobicContact CG2-CE1 4.49Å; I74-F86 HydrophobicContact CD1-CD1 4.16Å; I74-F86 HydrophobicContact CD1-CE1 3.66Å; I74-F86 HydrophobicContact CD1-CZ 4.02Å; I74-F86 HydrophobicContact CG1-CD1 3.98Å; I74-F86 HydrophobicContact CG1-CD2 4.39Å; I74-F86 HydrophobicContact CG1-CE1 3.84Å; I74-F86 HydrophobicContact CG1-CE2 4.32Å; I74-F86 HydrophobicContact CG1-CG 4.25Å; I74-F86 HydrophobicContact CG1-CZ 4.05Å; I74-F86 HydrophobicContact CG2-CE2 3.93Å; I74-F86 HydrophobicContact CG2-CZ 3.97Å; A82-F86 VanDerWaalsContact O-CD2 3.28Å; A82-F86 WeakPolarHBondContact O-CD2 3.35Å; S83-F86 PolarHBondContact O-N 3.47Å; F86-V90 HydrophobicContact CB-CB 4.41Å; F86-V92 HydrophobicContact CB-CG2 4.27Å; F86-V92 HydrophobicContact CD2-CG2 4.07Å; F86-V92 HydrophobicContact CG-CG2 4.39Å
87	P	90.8	Very high	93.4	Very high	50 Å²	50	78.6 Å²	78.6	33%	0.325	38%	0.379	S	S	.	.			trans	-58.6	143.7	172.1	-23.1	34.7	0	0	0	112	L66 V89 V90	L66-P87 HydrophobicContact CD1-CB 4.37Å; L66-P87 HydrophobicContact CD1-CG 4.04Å; P87-V89 HydrophobicContact CB-CG1 4.15Å; P87-V89 PolarHBondContact O-N 2.98Å; P87-V90 HydrophobicContact CB-CG2 4.45Å; P87-V90 WeakPolarHBondContact O-CB 3.32Å; P87-V90 PolarHBondContact O-N 2.81Å
88	H	89.1	Confident	93.5	Very high	194 Å²	194	71 Å²	71	90%	0.898	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-18.6	-176.6	-60.7	-54.2	0	0	0	115.3	V90	H88-V90 PolarHBondContact O-N 3.48Å
89	V	90.9	Very high	93.6	Very high	116 Å²	116	63.3 Å²	63.3	70%	0.703	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-14.6	176.6	68.9	0	0	0	0	113.1	L66 P87	L66-V89 HydrophobicContact CD1-CG1 4.03Å; L66-V89 HydrophobicContact CD2-CG1 4Å; P87-V89 HydrophobicContact CB-CG1 4.15Å; P87-V89 PolarHBondContact O-N 2.98Å
90	V	93.1	Very high	93.7	Very high	12 Å²	12	68.8 Å²	68.8	7%	0.073	34%	0.343	C	S	.	.	S	Bend	trans	-92.1	128.2	-176	-177.2	0	0	0	0	110.2	T62 L66 I74 F86 P87 H88 V92	T62-V90 HydrophobicContact CG2-CG1 4.21Å; T62-V90 HydrophobicContact CG2-CG2 3.72Å; L66-V90 HydrophobicContact CD1-CG2 3.56Å; L66-V90 HydrophobicContact CD2-CG2 4.19Å; L66-V90 HydrophobicContact CG-CG2 4.3Å; I74-V90 HydrophobicContact CB-CG1 4.49Å; I74-V90 HydrophobicContact CD1-CG1 4.48Å; I74-V90 HydrophobicContact CG1-CG1 3.55Å; F86-V90 HydrophobicContact CB-CB 4.41Å; P87-V90 HydrophobicContact CB-CG2 4.45Å; P87-V90 WeakPolarHBondContact O-CB 3.32Å; P87-V90 PolarHBondContact O-N 2.81Å; H88-V90 PolarHBondContact O-N 3.48Å; V90-V92 HydrophobicContact CG1-CG2 4.36Å; V90-V92 PolarHBondContact O-N 2.89Å
91	D	93.6	Very high	93.8	Very high	63 Å²	63	64.9 Å²	64.9	34%	0.337	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	117.3	171.9	178.3	24.9	0	0	0	110.1	V73 I74 K101	V73-D91 WeakPolarHBondContact CA-O 3.46Å; V73-D91 HydrophobicContact CG1-CB 4.37Å; I74-D91 PolarHBondContact N-O 2.82Å; D91-K101 IonicContact OD2-NZ 4Å; D91-K101 PolarHBondContact OD2-NZ 3.47Å
92	V	96.2	Very high	93.9	Very high	22 Å²	22	60.4 Å²	60.4	13%	0.133	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	110.2	177.9	-173.9	0	0	0	0	108.6	I74 P79 A82 F86 V90	I74-V92 HydrophobicContact CB-CB 4.41Å; I74-V92 HydrophobicContact CB-CG1 4.2Å; I74-V92 HydrophobicContact CB-CG2 4.07Å; I74-V92 HydrophobicContact CG1-CG2 4.34Å; I74-V92 HydrophobicContact CG2-CG1 4.09Å; P79-V92 HydrophobicContact CB-CG1 4.16Å; P79-V92 WeakPolarHBondContact CB-O 3.37Å; A82-V92 HydrophobicContact CB-CG1 3.85Å; F86-V92 HydrophobicContact CB-CG2 4.27Å; F86-V92 HydrophobicContact CD2-CG2 4.07Å; F86-V92 HydrophobicContact CG-CG2 4.39Å; V90-V92 HydrophobicContact CG1-CG2 4.36Å; V90-V92 PolarHBondContact O-N 2.89Å
93	S	96.3	Very high	94	Very high	12 Å²	12	65.4 Å²	65.4	8%	0.084	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	178	-172.8	56.1	0	0	0	0	111.9	I74 G75 S76 A98	I74-S93 PolarHBondContact O-N 3.11Å; G75-S93 WeakPolarHBondContact CA-O 3.47Å; S76-S93 PolarHBondContact N-O 3.49Å; S93-A98 PolarHBondContact OG-N 2.98Å
94	H	96.2	Very high	94.2	Very high	89 Å²	89	63.7 Å²	63.7	41%	0.412	32%	0.316	S	S	.	.			trans	-66.6	161.5	170.7	-75.1	-77.7	0	0	0	110.6	P79 E96 D97 A98	P79-H94 VanDerWaalsContact CD-CE1 3.44Å; P79-H94 WeakPolarHBondContact CD-CE1 3.38Å; P79-H94 WeakPolarHBondContact CG-NE2 3.39Å; H94-E96 VanDerWaalsContact C-N 3.28Å; H94-E96 WeakPolarHBondContact CB-OE2 3.46Å; H94-E96 PolarHBondContact O-N 3.36Å; H94-D97 PolarHBondContact O-N 3.31Å; H94-A98 PolarHBondContact O-N 3.26Å; H94-A98 VanDerWaalsContact O-N 3.1Å
95	Y	95.8	Very high	94.5	Very high	20 Å²	20	56 Å²	56	8%	0.078	28%	0.28	C	S	.	.	H	α-helix	trans	-58.5	-42.6	-174.1	-72.3	-48.8	0	0	0	112.1	L52 G75 R77 D97 A98 I99 V116 L120	L52-Y95 HydrophobicContact CB-CD1 4.21Å; L52-Y95 HydrophobicContact CB-CE1 4Å; L52-Y95 HydrophobicContact CD2-CD1 3.9Å; L52-Y95 HydrophobicContact CG-CD1 4.49Å; G75-Y95 VanDerWaalsContact C-CE1 3.47Å; G75-Y95 WeakPolarHBondContact O-CE1 3.39Å; R77-Y95 HydrophobicContact CG-CD2 4.39Å; R77-Y95 HydrophobicContact CG-CE2 3.48Å; R77-Y95 VanDerWaalsContact CG-CE2 3.48Å; Y95-D97 VanDerWaalsContact C-N 3.31Å; Y95-D97 PolarHBondContact O-N 3.27Å; Y95-A98 PolarHBondContact O-N 3.35Å; Y95-I99 WeakPolarHBondContact O-CB 3.38Å; Y95-I99 VanDerWaalsContact O-CD1 3.3Å; Y95-I99 WeakPolarHBondContact O-CD1 3.47Å; Y95-I99 WeakPolarHBondContact O-CG1 3.16Å; Y95-I99 PolarHBondContact O-N 2.91Å; Y95-V116 HydrophobicContact CD2-CG1 4.14Å; Y95-V116 HydrophobicContact CE2-CG1 3.82Å; Y95-L120 HydrophobicContact CD2-CD1 4.26Å; Y95-L120 HydrophobicContact CG-CD1 4.17Å
96	E	95.4	Very high	94.8	Very high	81 Å²	81	52.6 Å²	52.6	38%	0.379	27%	0.265	S	S	.	.	H	α-helix	trans	-55.8	-45.8	-179.9	-61.5	77	-175.5	0	0	111.8	H94 K100 L120 L123	H94-E96 VanDerWaalsContact C-N 3.28Å; H94-E96 WeakPolarHBondContact CB-OE2 3.46Å; H94-E96 PolarHBondContact O-N 3.36Å; E96-K100 WeakPolarHBondContact O-CG 3.49Å; E96-K100 PolarHBondContact O-N 2.89Å; E96-L120 HydrophobicContact CG-CD2 3.6Å; E96-L123 HydrophobicContact CB-CD1 3.96Å; E96-L123 HydrophobicContact CG-CD1 4.18Å
97	D	95.2	Very high	95	Very high	72 Å²	72	52.1 Å²	52.1	39%	0.385	26%	0.263	S	S	.	.	H	α-helix	trans	-73.8	-40.1	-177.4	-63.6	-36	0	0	0	111.6	H94 Y95 I99 K100 K101	H94-D97 PolarHBondContact O-N 3.31Å; Y95-D97 VanDerWaalsContact C-N 3.31Å; Y95-D97 PolarHBondContact O-N 3.27Å; D97-I99 VanDerWaalsContact C-N 3.35Å; D97-K100 PolarHBondContact O-N 2.89Å; D97-K101 WeakPolarHBondContact O-CG 3.41Å
98	A	95.3	Very high	95.3	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-41.7	176.7	0	0	0	0	0	111.7	L52 V73 S93 H94 Y95 K100 K101	L52-A98 HydrophobicContact CD2-CB 4.27Å; V73-A98 HydrophobicContact CG1-CB 3.82Å; S93-A98 PolarHBondContact OG-N 2.98Å; H94-A98 PolarHBondContact O-N 3.26Å; H94-A98 VanDerWaalsContact O-N 3.1Å; Y95-A98 PolarHBondContact O-N 3.35Å; A98-K100 VanDerWaalsContact C-N 3.34Å; A98-K100 PolarHBondContact O-N 2.56Å; A98-K101 PolarHBondContact O-N 3.05Å
99	I	96.1	Very high	95.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.3	-39.2	179.5	-70.2	163.1	0	0	0	111.5	L52 Y95 D97 K101 L105 L120 L123 L124 K127	L52-I99 HydrophobicContact CD1-CD1 4.19Å; L52-I99 HydrophobicContact CD1-CG1 4.05Å; L52-I99 HydrophobicContact CD2-CG1 4.04Å; Y95-I99 WeakPolarHBondContact O-CB 3.38Å; Y95-I99 VanDerWaalsContact O-CD1 3.3Å; Y95-I99 WeakPolarHBondContact O-CD1 3.47Å; Y95-I99 WeakPolarHBondContact O-CG1 3.16Å; Y95-I99 PolarHBondContact O-N 2.91Å; D97-I99 VanDerWaalsContact C-N 3.35Å; I99-K101 PolarHBondContact O-N 2.9Å; I99-L105 HydrophobicContact CB-CD2 4.09Å; I99-L105 HydrophobicContact CG1-CD2 3.57Å; I99-L105 HydrophobicContact CG2-CD2 4.17Å; I99-L120 HydrophobicContact CD1-CB 4.07Å; I99-L120 HydrophobicContact CD1-CD1 3.8Å; I99-L120 HydrophobicContact CD1-CG 4.37Å; I99-L123 HydrophobicContact CB-CB 4.49Å; I99-L123 HydrophobicContact CG2-CB 3.62Å; I99-L123 WeakPolarHBondContact CG2-O 3.37Å; I99-L124 HydrophobicContact CB-CD2 4.49Å; I99-L124 HydrophobicContact CD1-CD2 3.69Å; I99-L124 HydrophobicContact CD1-CG 4.27Å; I99-L124 HydrophobicContact CG1-CD2 3.85Å; I99-L124 HydrophobicContact CG2-CD2 3.76Å; I99-K127 HydrophobicContact CG2-CD 3.81Å; I99-K127 VanDerWaalsContact O-CE 3.27Å; I99-K127 WeakPolarHBondContact O-CE 3.49Å; I99-K127 PolarHBondContact O-NZ 3.4Å
100	K	95.5	Very high	95.7	Very high	132 Å²	132	42.4 Å²	42.4	57%	0.574	21%	0.21	S	C	*	.	H	α-helix	trans	-65.7	-26.2	179.9	-73.1	169.4	-174.8	172.5	0	113.1	E96 D97 A98 L123	E96-K100 WeakPolarHBondContact O-CG 3.49Å; E96-K100 PolarHBondContact O-N 2.89Å; D97-K100 PolarHBondContact O-N 2.89Å; A98-K100 VanDerWaalsContact C-N 3.34Å; A98-K100 PolarHBondContact O-N 2.56Å; K100-L123 HydrophobicContact CG-CD2 4.46Å
101	K	94.9	Very high	95.8	Very high	103 Å²	103	42.6 Å²	42.6	45%	0.448	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-8.3	-174.6	-66.4	175	-167.6	-175.4	0	114.6	T48 V73 D91 D97 A98 I99	T48-K101 WeakPolarHBondContact CG2-O 3.2Å; V73-K101 HydrophobicContact CG1-CD 4.17Å; V73-K101 HydrophobicContact CG2-CB 4.21Å; V73-K101 HydrophobicContact CG2-CD 4.19Å; D91-K101 IonicContact OD2-NZ 4Å; D91-K101 PolarHBondContact OD2-NZ 3.47Å; D97-K101 WeakPolarHBondContact O-CG 3.41Å; A98-K101 PolarHBondContact O-N 3.05Å; I99-K101 PolarHBondContact O-N 2.9Å
102	S	94.9	Very high	95.9	Very high	5 Å²	5	43.7 Å²	43.7	4%	0.035	21%	0.213	C	C	.	.			trans	-146.4	153.1	-177.8	-175.9	0	0	0	0	113.5	T48 A50 I104 K127	T48-S102 WeakPolarHBondContact O-CB 3.26Å; T48-S102 PolarHBondContact O-OG 3.46Å; A50-S102 PolarHBondContact N-OG 2.93Å; S102-I104 PolarHBondContact OG-N 3.12Å; S102-I104 VanDerWaalsContact OG-N 3.1Å; S102-I104 PolarHBondContact OG-O 2.9Å; S102-K127 PolarHBondContact O-NZ 3.09Å
103	N	94.5	Very high	95.8	Very high	114 Å²	114	46.9 Å²	46.9	61%	0.61	23%	0.226	S	C	*	.	S	Bend	trans	-98.9	-12	171.5	-66.3	-25.6	0	0	0	113.2	K127 V128	N103-K127 PolarHBondContact OD1-NZ 3.11Å; N103-V128 PolarHBondContact O-N 3.15Å
104	I	97	Very high	95.8	Very high	10 Å²	10	46.3 Å²	46.3	5%	0.051	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	116.9	177.8	-56.2	174.4	0	0	0	107.9	T47 A50 S102 F106 V130 L194 I195 L198	T47-I104 HydrophobicContact CG2-CD1 4.2Å; A50-I104 PolarHBondContact N-O 3.05Å; S102-I104 PolarHBondContact OG-N 3.12Å; S102-I104 VanDerWaalsContact OG-N 3.1Å; S102-I104 PolarHBondContact OG-O 2.9Å; I104-F106 HydrophobicContact CG2-CE2 4.27Å; I104-V130 HydrophobicContact CG2-CG2 4.28Å; I104-L194 HydrophobicContact CD1-CD1 4.3Å; I104-L194 HydrophobicContact CD1-CD2 3.77Å; I104-L194 HydrophobicContact CD1-CG 4.05Å; I104-L194 HydrophobicContact CG1-CD2 4.01Å; I104-I195 HydrophobicContact CG2-CD1 3.83Å; I104-L198 HydrophobicContact CD1-CD1 4.22Å; I104-L198 HydrophobicContact CG2-CD1 4.24Å
105	L	97.7	Very high	95.5	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	117.4	-174.6	-58	91.4	0	0	0	110.5	A50 L52 I99 L124 K127 V128 L129 V130	A50-L105 HydrophobicContact CB-CD2 4.29Å; A50-L105 HydrophobicContact CB-CG 4.11Å; A50-L105 CarbonylContact O-C 3.55Å; A50-L105 VanDerWaalsContact O-CA 3.32Å; A50-L105 WeakPolarHBondContact O-CA 3.38Å; L52-L105 HydrophobicContact CD1-CD2 3.98Å; L52-L105 HydrophobicContact CD2-CD2 4.36Å; L52-L105 HydrophobicContact CG-CD2 4.29Å; I99-L105 HydrophobicContact CB-CD2 4.09Å; I99-L105 HydrophobicContact CG1-CD2 3.57Å; I99-L105 HydrophobicContact CG2-CD2 4.17Å; L105-L124 HydrophobicContact CD2-CD2 3.99Å; L105-K127 HydrophobicContact CD1-CB 3.57Å; L105-K127 HydrophobicContact CD1-CD 3.59Å; L105-K127 HydrophobicContact CD1-CG 4.11Å; L105-V128 PolarHBondContact N-O 3.29Å; L105-L129 HydrophobicContact CB-CD2 3.9Å; L105-L129 HydrophobicContact CD1-CD2 4.17Å; L105-L129 HydrophobicContact CG-CD2 4.45Å; L105-V130 PolarHBondContact O-N 2.82Å
106	F	98.1	Very high	95.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	122.6	168.8	-75.6	-93.4	0	0	0	110.2	V49 A50 V51 L52 I61 I104 A108 V130 V132 F162 L198	V49-F106 HydrophobicContact CG1-CD2 3.45Å; V49-F106 VanDerWaalsContact CG1-CD2 3.45Å; V49-F106 HydrophobicContact CG1-CE2 3.56Å; A50-F106 PolarHBondContact O-N 3.27Å; V51-F106 CarbonylContact C-O 3.56Å; V51-F106 WeakPolarHBondContact CA-O 3.45Å; V51-F106 HydrophobicContact CB-CB 4.43Å; V51-F106 HydrophobicContact CG1-CB 4.12Å; V51-F106 HydrophobicContact CG2-CB 4.2Å; L52-F106 PolarHBondContact N-O 3.27Å; I61-F106 HydrophobicContact CD1-CD1 3.38Å; I61-F106 HydrophobicContact CD1-CD2 4.28Å; I61-F106 HydrophobicContact CD1-CE1 3.39Å; I61-F106 HydrophobicContact CD1-CE2 4.3Å; I61-F106 HydrophobicContact CD1-CG 3.84Å; I61-F106 HydrophobicContact CD1-CZ 3.88Å; I104-F106 HydrophobicContact CG2-CE2 4.27Å; F106-A108 PolarHBondContact O-N 2.91Å; F106-V130 HydrophobicContact CD1-CB 3.75Å; F106-V130 HydrophobicContact CD1-CG1 3.74Å; F106-V130 HydrophobicContact CD1-CG2 4.38Å; F106-V130 HydrophobicContact CE1-CB 3.93Å; F106-V130 HydrophobicContact CE1-CG1 3.6Å; F106-V130 HydrophobicContact CE1-CG2 4.22Å; F106-V130 HydrophobicContact CG-CB 4.2Å; F106-V130 HydrophobicContact CZ-CB 4.48Å; F106-V130 HydrophobicContact CZ-CG1 4.39Å; F106-V130 HydrophobicContact CZ-CG2 4.3Å; F106-V132 HydrophobicContact CD1-CG1 3.87Å; F106-V132 HydrophobicContact CE1-CG1 4.5Å; F106-F162 AromaticContact CE1-CD2 3.6Å; F106-F162 HydrophobicContact CE1-CD2 3.6Å; F106-F162 AromaticContact CE1-CE2 3.68Å; F106-F162 HydrophobicContact CE1-CE2 3.68Å; F106-F162 HydrophobicContact CE1-CG 4.2Å; F106-F162 HydrophobicContact CE1-CZ 4.34Å; F106-F162 HydrophobicContact CZ-CD2 4.32Å; F106-F162 AromaticContact CZ-CE2 3.93Å; F106-F162 HydrophobicContact CZ-CE2 3.93Å; F106-F162 HydrophobicContact CZ-CZ 4.32Å; F106-L198 HydrophobicContact CE2-CD1 4.17Å; F106-L198 HydrophobicContact CE2-CD2 4.26Å; F106-L198 HydrophobicContact CZ-CD1 4.36Å; F106-L198 HydrophobicContact CZ-CD2 3.77Å
107	L	97.8	Very high	95.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	82.5	178.3	-71.2	172.4	0	0	0	110.8	L52 I109 L117 L129 V130 V132 L149	L52-L107 HydrophobicContact CB-CD2 4.14Å; L52-L107 HydrophobicContact CD1-CD2 3.73Å; L52-L107 HydrophobicContact CG-CD2 4.32Å; L107-I109 HydrophobicContact CB-CG1 4.46Å; L107-I109 HydrophobicContact CD2-CD1 4.4Å; L107-I109 PolarHBondContact O-N 2.73Å; L107-L117 HydrophobicContact CD1-CD1 4.27Å; L107-L117 HydrophobicContact CD2-CD1 3.97Å; L107-L117 HydrophobicContact CD2-CD2 4.16Å; L107-L129 HydrophobicContact CD1-CB 4.02Å; L107-L129 HydrophobicContact CD1-CD1 4.34Å; L107-L129 HydrophobicContact CD1-CD2 4.44Å; L107-V130 PolarHBondContact N-O 2.87Å; L107-V132 VanDerWaalsContact O-CG2 3.26Å; L107-V132 WeakPolarHBondContact O-CG2 3.45Å; L107-L149 HydrophobicContact CD1-CD1 3.91Å; L107-L149 HydrophobicContact CD1-CD2 3.26Å; L107-L149 HydrophobicContact CD1-CG 4.19Å
108	A	96.9	Very high	94.9	Very high	22 Å²	22	47.2 Å²	47.2	18%	0.182	23%	0.23	C	C	.	.			trans	-84.1	49.3	175.7	0	0	0	0	0	111.8	V51 L52 F57 F106 V132	V51-A108 HydrophobicContact CG1-CB 3.95Å; L52-A108 CarbonylContact O-C 3.58Å; L52-A108 WeakPolarHBondContact O-CA 3.32Å; L52-A108 PolarHBondContact O-N 3.03Å; F57-A108 HydrophobicContact CD1-CB 4.33Å; F106-A108 PolarHBondContact O-N 2.91Å; A108-V132 HydrophobicContact CB-CG2 4.49Å
109	I	94.9	Very high	94.7	Very high	23 Å²	23	53.1 Å²	53.1	12%	0.118	26%	0.262	C	S	.	.	S	Bend	trans	-127.3	147.6	176.8	57.8	172.5	0	0	0	109.9	L107 Y114 L117	L107-I109 HydrophobicContact CB-CG1 4.46Å; L107-I109 HydrophobicContact CD2-CD1 4.4Å; L107-I109 PolarHBondContact O-N 2.73Å; I109-Y114 HydrophobicContact CD1-CD1 3.91Å; I109-Y114 HydrophobicContact CD1-CE1 4.37Å; I109-Y114 HydrophobicContact CG1-CD1 4.06Å; I109-Y114 HydrophobicContact CG1-CE1 4.06Å; I109-L117 HydrophobicContact CD1-CD1 4.15Å; I109-L117 HydrophobicContact CD1-CD2 4.21Å; I109-L117 HydrophobicContact CD1-CG 4.18Å
110	H	94.9	Very high	94.6	Very high	111 Å²	111	53.3 Å²	53.3	51%	0.514	26%	0.263	S	S	.	.			trans	-72.1	149.6	174.8	-74.2	-81.2	0	0	0	111.2	E112 H113	H110-E112 WeakPolarHBondContact CB-OE2 3.35Å; H110-E112 PolarHBondContact O-N 2.68Å; H110-E112 VanDerWaalsContact O-N 3.15Å; H110-H113 PolarHBondContact O-N 3.03Å
111	R	95.3	Very high	94.5	Very high	15 Å²	15	49.9 Å²	49.9	6%	0.057	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-51.6	-38.5	-178.2	173.2	168.7	177	172.7	0.3	113.2	H113 Y114 Y141 E143 N145 Y148	R111-H113 PolarHBondContact O-N 3.19Å; R111-Y114 HydrophobicContact CB-CE2 4.24Å; R111-Y114 HydrophobicContact CG-CD2 4.2Å; R111-Y114 HydrophobicContact CG-CE2 4.12Å; R111-Y114 WeakPolarHBondContact O-CB 3.35Å; R111-Y114 PolarHBondContact O-N 3.12Å; R111-Y141 VanDerWaalsContact NH1-CB 3.26Å; R111-E143 IonicContact CZ-OE1 2.72Å; R111-E143 PolarHBondContact NH1-O 3Å; R111-E143 IonicContact NH2-OE1 3.66Å; R111-E143 PolarHBondContact NH2-OE1 3.35Å; R111-E143 IonicContact NH2-OE2 3.2Å; R111-N145 WeakPolarHBondContact CD-OD1 3.45Å; R111-N145 PolarHBondContact NH1-OD1 2.83Å; R111-Y148 HydrophobicContact CG-CD1 4.11Å; R111-Y148 HydrophobicContact CG-CE1 4.44Å
112	E	94.8	Very high	94.5	Very high	87 Å²	87	51.6 Å²	51.6	41%	0.407	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-59.3	-18	-179.9	-62.8	76.3	-164.1	0	0	113	H110 Y141	H110-E112 WeakPolarHBondContact CB-OE2 3.35Å; H110-E112 PolarHBondContact O-N 2.68Å; H110-E112 VanDerWaalsContact O-N 3.15Å; E112-Y141 PolarHBondContact OE1-OH 2.98Å
113	H	95.1	Very high	94.6	Very high	88 Å²	88	52.8 Å²	52.8	41%	0.407	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-109.1	11.3	-178.2	-54.8	94.9	0	0	0	113.4	H110 R111 S115 V116	H110-H113 PolarHBondContact O-N 3.03Å; R111-H113 PolarHBondContact O-N 3.19Å; H113-S115 PolarHBondContact O-N 2.73Å; H113-V116 PolarHBondContact O-N 2.72Å
114	Y	95	Very high	94.6	Very high	1 Å²	1	47.3 Å²	47.3	0%	0.004	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-62.8	-22.8	176.1	-74.3	-4.3	0	0	0	113.2	I109 R111 V116 L117 D131 S133 Y148 L149 L152	I109-Y114 HydrophobicContact CD1-CD1 3.91Å; I109-Y114 HydrophobicContact CD1-CE1 4.37Å; I109-Y114 HydrophobicContact CG1-CD1 4.06Å; I109-Y114 HydrophobicContact CG1-CE1 4.06Å; R111-Y114 HydrophobicContact CB-CE2 4.24Å; R111-Y114 HydrophobicContact CG-CD2 4.2Å; R111-Y114 HydrophobicContact CG-CE2 4.12Å; R111-Y114 WeakPolarHBondContact O-CB 3.35Å; R111-Y114 PolarHBondContact O-N 3.12Å; Y114-V116 PolarHBondContact O-N 3.03Å; Y114-V116 VanDerWaalsContact O-N 3.12Å; Y114-L117 VanDerWaalsContact O-CB 3.28Å; Y114-L117 WeakPolarHBondContact O-CB 3.32Å; Y114-L117 WeakPolarHBondContact O-CG 3.24Å; Y114-L117 PolarHBondContact O-N 2.83Å; Y114-D131 VanDerWaalsContact OH-CG 3.32Å; Y114-D131 PolarHBondContact OH-OD1 3.24Å; Y114-S133 PolarHBondContact OH-OG 2.87Å; Y114-S133 VanDerWaalsContact OH-OG 3.12Å; Y114-Y148 AromaticContact CD2-CD1 3.72Å; Y114-Y148 HydrophobicContact CD2-CD1 3.72Å; Y114-Y148 AromaticContact CD2-CE1 3.98Å; Y114-Y148 HydrophobicContact CD2-CE1 3.98Å; Y114-Y148 HydrophobicContact CE2-CD1 4.22Å; Y114-L149 HydrophobicContact CD2-CB 4.28Å; Y114-L149 HydrophobicContact CD2-CD1 4.04Å; Y114-L149 HydrophobicContact CE2-CB 3.81Å; Y114-L149 HydrophobicContact CE2-CD1 4.09Å; Y114-L149 HydrophobicContact CE2-CG 4.43Å; Y114-L149 HydrophobicContact CG-CD1 4.32Å; Y114-L152 WeakPolarHBondContact O-CD2 3.38Å
115	S	91.1	Very high	94.6	Very high	81 Å²	81	49.2 Å²	49.2	57%	0.566	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-55.5	-29.1	175.7	54.3	0	0	0	0	113.4	H113 L117 W118	H113-S115 PolarHBondContact O-N 2.73Å; S115-L117 PolarHBondContact O-N 2.89Å; S115-W118 VanDerWaalsContact O-CB 3.22Å; S115-W118 WeakPolarHBondContact O-CB 3.41Å; S115-W118 PolarHBondContact O-N 2.88Å
116	V	90.9	Very high	94.5	Very high	47 Å²	47	52.3 Å²	52.3	29%	0.285	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-62	-22.5	175.7	179.8	0	0	0	0	112.4	Y95 H113 Y114 W118	Y95-V116 HydrophobicContact CD2-CG1 4.14Å; Y95-V116 HydrophobicContact CE2-CG1 3.82Å; H113-V116 PolarHBondContact O-N 2.72Å; Y114-V116 PolarHBondContact O-N 3.03Å; Y114-V116 VanDerWaalsContact O-N 3.12Å; V116-W118 VanDerWaalsContact C-N 3.3Å
117	L	92.7	Very high	94.4	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-78.8	-13.2	178.1	-55.7	176.8	0	0	0	113	L52 L107 I109 Y114 S115 D119 L120 K121 L124 L149 L153	L52-L117 HydrophobicContact CD1-CD2 4.3Å; L107-L117 HydrophobicContact CD1-CD1 4.27Å; L107-L117 HydrophobicContact CD2-CD1 3.97Å; L107-L117 HydrophobicContact CD2-CD2 4.16Å; I109-L117 HydrophobicContact CD1-CD1 4.15Å; I109-L117 HydrophobicContact CD1-CD2 4.21Å; I109-L117 HydrophobicContact CD1-CG 4.18Å; Y114-L117 VanDerWaalsContact O-CB 3.28Å; Y114-L117 WeakPolarHBondContact O-CB 3.32Å; Y114-L117 WeakPolarHBondContact O-CG 3.24Å; Y114-L117 PolarHBondContact O-N 2.83Å; S115-L117 PolarHBondContact O-N 2.89Å; L117-D119 PolarHBondContact O-N 3.34Å; L117-L120 CarbonylContact O-C 3.55Å; L117-L120 PolarHBondContact O-N 3.25Å; L117-L120 VanDerWaalsContact O-N 3.1Å; L117-K121 PolarHBondContact O-N 2.78Å; L117-K121 VanDerWaalsContact O-N 3.13Å; L117-L124 HydrophobicContact CB-CD1 4.21Å; L117-L124 HydrophobicContact CD2-CD1 4.33Å; L117-L149 HydrophobicContact CD1-CD1 3.82Å; L117-L153 HydrophobicContact CB-CD1 4.25Å; L117-L153 HydrophobicContact CD1-CD1 4.06Å
118	W	89.8	Confident	94.4	Very high	151 Å²	151	54.3 Å²	54.3	57%	0.572	29%	0.293	S	S	*	.	S	Bend	trans	-60	-48.1	-176.6	-174.6	-96.7	0	0	0	111.9	S115 V116 L120 K121 L152	S115-W118 VanDerWaalsContact O-CB 3.22Å; S115-W118 WeakPolarHBondContact O-CB 3.41Å; S115-W118 PolarHBondContact O-N 2.88Å; V116-W118 VanDerWaalsContact C-N 3.3Å; W118-L120 PolarHBondContact O-N 2.96Å; W118-L120 VanDerWaalsContact O-N 3.15Å; W118-K121 VanDerWaalsContact O-CB 3.32Å; W118-K121 WeakPolarHBondContact O-CB 3.5Å; W118-K121 PolarHBondContact O-N 2.97Å; W118-L152 HydrophobicContact CE3-CD1 3.59Å; W118-L152 HydrophobicContact CE3-CG 4.39Å; W118-L152 HydrophobicContact CZ3-CD1 3.83Å
119	D	91	Very high	94.5	Very high	124 Å²	124	53.3 Å²	53.3	66%	0.663	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-20.2	179.4	-58.7	-31.8	0	0	0	112.2	L117 H122	L117-D119 PolarHBondContact O-N 3.34Å; D119-H122 PolarHBondContact O-CE1 3.1Å; D119-H122 PolarHBondContact O-ND1 2.6Å
120	L	94.3	Very high	94.6	Very high	5 Å²	5	52.2 Å²	52.2	3%	0.026	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-0.2	-177	-55	174.6	0	0	0	113.1	Y95 E96 I99 L117 W118 H122 L123 L124	Y95-L120 HydrophobicContact CD2-CD1 4.26Å; Y95-L120 HydrophobicContact CG-CD1 4.17Å; E96-L120 HydrophobicContact CG-CD2 3.6Å; I99-L120 HydrophobicContact CD1-CB 4.07Å; I99-L120 HydrophobicContact CD1-CD1 3.8Å; I99-L120 HydrophobicContact CD1-CG 4.37Å; L117-L120 CarbonylContact O-C 3.55Å; L117-L120 PolarHBondContact O-N 3.25Å; L117-L120 VanDerWaalsContact O-N 3.1Å; W118-L120 PolarHBondContact O-N 2.96Å; W118-L120 VanDerWaalsContact O-N 3.15Å; L120-H122 PolarHBondContact O-N 2.91Å; L120-H122 VanDerWaalsContact O-N 3.14Å; L120-L123 HydrophobicContact CD2-CD1 4.32Å; L120-L123 WeakPolarHBondContact O-CB 3.31Å; L120-L123 PolarHBondContact O-N 3.27Å; L120-L124 HydrophobicContact CB-CD1 4.34Å; L120-L124 WeakPolarHBondContact O-CG 3.13Å; L120-L124 PolarHBondContact O-N 2.6Å
121	K	93.9	Very high	94.8	Very high	60 Å²	60	46.9 Å²	46.9	26%	0.261	26%	0.255	S	S	.	.	H	α-helix	trans	-51	-43.2	-174.2	179.8	173.8	178	176.8	0	113	L117 W118 L123 L124 A125 L153 D155	L117-K121 PolarHBondContact O-N 2.78Å; L117-K121 VanDerWaalsContact O-N 3.13Å; W118-K121 VanDerWaalsContact O-CB 3.32Å; W118-K121 WeakPolarHBondContact O-CB 3.5Å; W118-K121 PolarHBondContact O-N 2.97Å; K121-L123 VanDerWaalsContact C-N 3.27Å; K121-L123 PolarHBondContact O-N 2.86Å; K121-L124 PolarHBondContact O-N 3.14Å; K121-L124 VanDerWaalsContact O-N 3.07Å; K121-A125 PolarHBondContact O-N 3.34Å; K121-L153 HydrophobicContact CB-CD2 3.88Å; K121-L153 HydrophobicContact CD-CD2 4.36Å; K121-L153 HydrophobicContact CG-CD2 3.79Å; K121-D155 WeakPolarHBondContact CE-OD2 3.3Å
122	H	94.6	Very high	94.9	Very high	138 Å²	138	46.8 Å²	46.8	64%	0.639	26%	0.255	S	S	*	.	H	α-helix	trans	-61.2	-33	178.9	70.3	-79	0	0	0	113.3	D119 L120	D119-H122 PolarHBondContact O-CE1 3.1Å; D119-H122 PolarHBondContact O-ND1 2.6Å; L120-H122 PolarHBondContact O-N 2.91Å; L120-H122 VanDerWaalsContact O-N 3.14Å
123	L	95.9	Very high	95	Very high	30 Å²	30	43 Å²	43	16%	0.157	24%	0.239	C	C	.	.	H	α-helix	trans	-80.2	-23.4	176.5	-59.4	178.1	0	0	0	112.4	E96 I99 K100 L120 K121 K127	E96-L123 HydrophobicContact CB-CD1 3.96Å; E96-L123 HydrophobicContact CG-CD1 4.18Å; I99-L123 HydrophobicContact CB-CB 4.49Å; I99-L123 HydrophobicContact CG2-CB 3.62Å; I99-L123 WeakPolarHBondContact CG2-O 3.37Å; K100-L123 HydrophobicContact CG-CD2 4.46Å; L120-L123 HydrophobicContact CD2-CD1 4.32Å; L120-L123 WeakPolarHBondContact O-CB 3.31Å; L120-L123 PolarHBondContact O-N 3.27Å; K121-L123 VanDerWaalsContact C-N 3.27Å; K121-L123 PolarHBondContact O-N 2.86Å; L123-K127 VanDerWaalsContact O-CD 3.3Å; L123-K127 WeakPolarHBondContact O-CD 3.39Å; L123-K127 WeakPolarHBondContact O-CE 3.15Å
124	L	96	Very high	95	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-86.7	-11.9	-177.2	-64.1	176.4	0	0	0	113.1	I99 L105 L117 L120 K121 G126 K127 L129 L153 S156	I99-L124 HydrophobicContact CB-CD2 4.49Å; I99-L124 HydrophobicContact CD1-CD2 3.69Å; I99-L124 HydrophobicContact CD1-CG 4.27Å; I99-L124 HydrophobicContact CG1-CD2 3.85Å; I99-L124 HydrophobicContact CG2-CD2 3.76Å; L105-L124 HydrophobicContact CD2-CD2 3.99Å; L117-L124 HydrophobicContact CB-CD1 4.21Å; L117-L124 HydrophobicContact CD2-CD1 4.33Å; L120-L124 HydrophobicContact CB-CD1 4.34Å; L120-L124 WeakPolarHBondContact O-CG 3.13Å; L120-L124 PolarHBondContact O-N 2.6Å; K121-L124 PolarHBondContact O-N 3.14Å; K121-L124 VanDerWaalsContact O-N 3.07Å; L124-G126 PolarHBondContact O-N 2.92Å; L124-K127 WeakPolarHBondContact O-CB 3.36Å; L124-K127 PolarHBondContact O-N 2.79Å; L124-K127 VanDerWaalsContact O-N 3.11Å; L124-L129 HydrophobicContact CD2-CD2 4.08Å; L124-L153 HydrophobicContact CD1-CD1 3.67Å; L124-L153 HydrophobicContact CD1-CD2 4.21Å; L124-S156 VanDerWaalsContact C-OG 3.23Å; L124-S156 PolarHBondContact O-OG 3.31Å
125	A	96.3	Very high	94.9	Very high	50 Å²	50	42.1 Å²	42.1	41%	0.413	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	131.8	178	0	0	0	0	0	111.9	K121 K127 D155	K121-A125 PolarHBondContact O-N 3.34Å; A125-K127 PolarHBondContact O-N 2.88Å; A125-D155 HydrophobicContact CB-CB 4.05Å
126	G	94.6	Very high	94.9	Very high	65 Å²	65	48.1 Å²	48.1	67%	0.67	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.2	-1.9	-178.9	0	0	0	0	0	115.7	L124 D155	L124-G126 PolarHBondContact O-N 2.92Å; G126-D155 PolarHBondContact N-O 3.07Å
127	K	96.8	Very high	95	Very high	24 Å²	24	55 Å²	55	10%	0.104	27%	0.268	C	S	.	.			trans	-88.2	156.5	-178.9	-59.1	-174.6	-179.2	-82	0	112.3	I99 S102 N103 L105 L123 L124 A125 V157	I99-K127 HydrophobicContact CG2-CD 3.81Å; I99-K127 VanDerWaalsContact O-CE 3.27Å; I99-K127 WeakPolarHBondContact O-CE 3.49Å; I99-K127 PolarHBondContact O-NZ 3.4Å; S102-K127 PolarHBondContact O-NZ 3.09Å; N103-K127 PolarHBondContact OD1-NZ 3.11Å; L105-K127 HydrophobicContact CD1-CB 3.57Å; L105-K127 HydrophobicContact CD1-CD 3.59Å; L105-K127 HydrophobicContact CD1-CG 4.11Å; L123-K127 VanDerWaalsContact O-CD 3.3Å; L123-K127 WeakPolarHBondContact O-CD 3.39Å; L123-K127 WeakPolarHBondContact O-CE 3.15Å; L124-K127 WeakPolarHBondContact O-CB 3.36Å; L124-K127 PolarHBondContact O-N 2.79Å; L124-K127 VanDerWaalsContact O-N 3.11Å; A125-K127 PolarHBondContact O-N 2.88Å; K127-V157 PolarHBondContact O-N 3.21Å
128	V	98.1	Very high	94.8	Very high	18 Å²	18	57.8 Å²	57.8	11%	0.109	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	115.2	175	-179.6	0	0	0	0	109.3	N103 L105 V157 V159 A191 L194 I195	N103-V128 PolarHBondContact O-N 3.15Å; L105-V128 PolarHBondContact N-O 3.29Å; V128-V157 CarbonylContact C-O 3.35Å; V128-V157 WeakPolarHBondContact CA-O 3.46Å; V128-V157 HydrophobicContact CG2-CB 4.49Å; V128-V159 HydrophobicContact CG1-CG2 3.8Å; V128-A191 HydrophobicContact CG1-CB 4.06Å; V128-A191 HydrophobicContact CG2-CB 3.99Å; V128-L194 HydrophobicContact CG2-CD2 4.35Å; V128-I195 HydrophobicContact CG1-CD1 4.11Å; V128-I195 HydrophobicContact CG1-CG1 4.13Å
129	L	98.1	Very high	94.7	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	114.4	179.3	-60.8	-177.6	0	0	0	109.9	L105 L107 L124 L149 L153 V157 V158 V159	L105-L129 HydrophobicContact CB-CD2 3.9Å; L105-L129 HydrophobicContact CD1-CD2 4.17Å; L105-L129 HydrophobicContact CG-CD2 4.45Å; L107-L129 HydrophobicContact CD1-CB 4.02Å; L107-L129 HydrophobicContact CD1-CD1 4.34Å; L107-L129 HydrophobicContact CD1-CD2 4.44Å; L124-L129 HydrophobicContact CD2-CD2 4.08Å; L129-L149 HydrophobicContact CB-CD2 4.47Å; L129-L153 HydrophobicContact CD1-CB 4.43Å; L129-L153 HydrophobicContact CD1-CD1 3.48Å; L129-L153 VanDerWaalsContact CD1-CD1 3.48Å; L129-V157 PolarHBondContact N-O 3.07Å; L129-V158 HydrophobicContact CB-CG2 4.42Å; L129-V158 CarbonylContact O-C 3.59Å; L129-V158 WeakPolarHBondContact O-CA 3.32Å; L129-V159 PolarHBondContact O-N 2.97Å
130	V	98.4	Very high	94.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	104.5	175.7	-170.2	0	0	0	0	109.1	I104 L105 F106 L107 V132 V159 F162 I195	I104-V130 HydrophobicContact CG2-CG2 4.28Å; L105-V130 PolarHBondContact O-N 2.82Å; F106-V130 HydrophobicContact CD1-CB 3.75Å; F106-V130 HydrophobicContact CD1-CG1 3.74Å; F106-V130 HydrophobicContact CD1-CG2 4.38Å; F106-V130 HydrophobicContact CE1-CB 3.93Å; F106-V130 HydrophobicContact CE1-CG1 3.6Å; F106-V130 HydrophobicContact CE1-CG2 4.22Å; F106-V130 HydrophobicContact CG-CB 4.2Å; F106-V130 HydrophobicContact CZ-CB 4.48Å; F106-V130 HydrophobicContact CZ-CG1 4.39Å; F106-V130 HydrophobicContact CZ-CG2 4.3Å; L107-V130 PolarHBondContact N-O 2.87Å; V130-V132 HydrophobicContact CG1-CG1 4.2Å; V130-V159 CarbonylContact C-O 3.5Å; V130-V159 VanDerWaalsContact CA-O 3.3Å; V130-V159 WeakPolarHBondContact CA-O 3.48Å; V130-F162 HydrophobicContact CG1-CD2 4.07Å; V130-F162 HydrophobicContact CG1-CE2 4.48Å; V130-I195 HydrophobicContact CG2-CD1 3.47Å; V130-I195 VanDerWaalsContact CG2-CD1 3.47Å; V130-I195 HydrophobicContact CG2-CG1 3.94Å
131	D	98.4	Very high	94.7	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	117.9	173.5	174.3	44.8	0	0	0	110.9	Y114 S133 A146 L149 V159 K160 G161	Y114-D131 VanDerWaalsContact OH-CG 3.32Å; Y114-D131 PolarHBondContact OH-OD1 3.24Å; D131-S133 WeakPolarHBondContact OD1-CB 3.45Å; D131-S133 PolarHBondContact OD1-N 3Å; D131-S133 PolarHBondContact OD1-OG 3.3Å; D131-S133 PolarHBondContact OD2-OG 3.34Å; D131-A146 HydrophobicContact CB-CB 4.32Å; D131-L149 HydrophobicContact CB-CD2 4Å; D131-V159 PolarHBondContact N-O 3.02Å; D131-K160 WeakPolarHBondContact OD2-CD 3.47Å; D131-K160 IonicContact OD2-NZ 3.48Å; D131-K160 PolarHBondContact OD2-NZ 2.9Å; D131-G161 PolarHBondContact O-N 2.68Å; D131-G161 VanDerWaalsContact O-N 3.16Å; D131-G161 VanDerWaalsContact O-O 3.12Å
132	V	97.4	Very high	94.6	Very high	12 Å²	12	59 Å²	59	7%	0.073	30%	0.304	C	S	.	.			trans	-109.6	7.3	179.4	-55.2	0	0	0	0	112.7	F57 F106 L107 A108 V130 G161 F162 N163	F57-V132 HydrophobicContact CD1-CB 4.47Å; F57-V132 HydrophobicContact CD1-CG2 3.87Å; F57-V132 HydrophobicContact CE1-CB 3.78Å; F57-V132 HydrophobicContact CE1-CG1 3.91Å; F57-V132 HydrophobicContact CE1-CG2 3.63Å; F57-V132 HydrophobicContact CZ-CB 4.07Å; F57-V132 HydrophobicContact CZ-CG1 4.27Å; F57-V132 HydrophobicContact CZ-CG2 4.36Å; F106-V132 HydrophobicContact CD1-CG1 3.87Å; F106-V132 HydrophobicContact CE1-CG1 4.5Å; L107-V132 VanDerWaalsContact O-CG2 3.26Å; L107-V132 WeakPolarHBondContact O-CG2 3.45Å; A108-V132 HydrophobicContact CB-CG2 4.49Å; V130-V132 HydrophobicContact CG1-CG1 4.2Å; V132-G161 WeakPolarHBondContact CA-O 3.31Å; V132-G161 WeakPolarHBondContact CG1-O 3.36Å; V132-F162 HydrophobicContact CG1-CB 4Å; V132-N163 WeakPolarHBondContact O-CB 3.41Å
133	S	96.5	Very high	94.6	Very high	8 Å²	8	55.2 Å²	55.2	6%	0.056	29%	0.286	C	S	.	.			trans	-72.5	154.9	-173.5	70.6	0	0	0	0	113.2	Y114 D131 N145 K160	Y114-S133 PolarHBondContact OH-OG 2.87Å; Y114-S133 VanDerWaalsContact OH-OG 3.12Å; D131-S133 WeakPolarHBondContact OD1-CB 3.45Å; D131-S133 PolarHBondContact OD1-N 3Å; D131-S133 PolarHBondContact OD1-OG 3.3Å; D131-S133 PolarHBondContact OD2-OG 3.34Å; S133-N145 VanDerWaalsContact OG-CB 3.24Å; S133-N145 WeakPolarHBondContact OG-CB 3.41Å; S133-N145 PolarHBondContact OG-ND2 2.89Å; S133-K160 PolarHBondContact O-NZ 3.46Å
134	N	94.9	Very high	94.7	Very high	53 Å²	53	53.9 Å²	53.9	28%	0.283	28%	0.28	S	S	.	.			trans	-129.5	152.3	168.9	-71.6	-48.1	0	0	0	109.8	N163 P222	N134-N163 PolarHBondContact ND2-O 3.32Å; N134-N163 WeakPolarHBondContact OD1-CB 3.28Å; N134-N163 PolarHBondContact OD1-ND2 3.37Å; N134-P222 WeakPolarHBondContact OD1-CG 3.33Å
135	N	94.1	Very high	94.7	Very high	17 Å²	17	53.9 Å²	53.9	9%	0.091	28%	0.28	C	S	.	.			trans	-82.6	158.6	169.6	-69.2	-38.3	0	0	0	111.1	Q140 N145 V223	N135-Q140 HydrophobicContact CB-CB 4.37Å; N135-N145 PolarHBondContact ND2-OD1 3.21Å; N135-N145 PolarHBondContact OD1-ND2 2.58Å; N135-N145 VanDerWaalsContact OD1-ND2 3.12Å; N135-N145 PolarHBondContact OD1-OD1 3.26Å; N135-V223 VanDerWaalsContact O-CG2 3.32Å; N135-V223 WeakPolarHBondContact O-CG2 3.26Å
136	R	91.3	Very high	94.8	Very high	208 Å²	208	51.5 Å²	51.5	79%	0.785	26%	0.26	S	S	*	.	S	Bend	trans	-78.5	-26.1	177.1	-66.8	-177.4	177.8	179.6	-0.3	112.1
137	R	91.3	Very high	94.9	Very high	192 Å²	192	51 Å²	51	73%	0.725	24%	0.24	S	C	*	.	S	Bend	trans	-141.4	150.6	-177	-59.4	-179.1	-176.2	176.4	0.7	109.4	Q140	R137-Q140 WeakPolarHBondContact O-CB 3.15Å; R137-Q140 PolarHBondContact O-N 2.88Å
138	V	89.4	Confident	94.9	Very high	58 Å²	58	53.6 Å²	53.6	35%	0.352	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	139	171.3	-179.5	0	0	0	0	108.7	Q140 V223 Q224	V138-Q140 PolarHBondContact O-N 2.93Å; V138-V223 HydrophobicContact CG2-CB 4.27Å; V138-V223 HydrophobicContact CG2-CG1 3.97Å; V138-Q224 HydrophobicContact CG2-CG 4.12Å
139	N	86.9	Confident	94.9	Very high	121 Å²	121	52.8 Å²	52.8	65%	0.647	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.1	33.3	-179.9	-56.8	-25.4	0	0	0	114.2	Y141	N139-Y141 PolarHBondContact O-N 3.37Å
140	Q	91.5	Very high	94.8	Very high	68 Å²	68	54.1 Å²	54.1	32%	0.318	26%	0.256	S	S	.	.	S	Bend	trans	-63.2	-31.3	172.7	-176.5	177.1	-20.6	0	0	112.2	N135 R137 V138	N135-Q140 HydrophobicContact CB-CB 4.37Å; R137-Q140 WeakPolarHBondContact O-CB 3.15Å; R137-Q140 PolarHBondContact O-N 2.88Å; V138-Q140 PolarHBondContact O-N 2.93Å
141	Y	94.1	Very high	94.7	Very high	74 Å²	74	58.2 Å²	58.2	29%	0.29	28%	0.284	S	S	.	.	S	Bend	trans	-132.8	156.3	179.9	-59.9	-70.6	0	0	0	110.5	R111 E112 N139	R111-Y141 VanDerWaalsContact NH1-CB 3.26Å; E112-Y141 PolarHBondContact OE1-OH 2.98Å; N139-Y141 PolarHBondContact O-N 3.37Å
142	P	92.6	Very high	94.6	Very high	102 Å²	102	59.3 Å²	59.3	66%	0.662	29%	0.29	S	S	*	.	S	Bend	trans	-69.3	-38.8	-177.4	7.6	-3.6	0	0	0	113.5	R216	P142-R216 PolarHBondContact O-NH1 2.86Å; P142-R216 VanDerWaalsContact O-NH1 3.11Å; P142-R216 PolarHBondContact O-NH2 3.39Å
143	E	94.4	Very high	94.5	Very high	60 Å²	60	58.7 Å²	58.7	28%	0.28	29%	0.287	S	S	.	.	S	Bend	trans	-104.7	157.4	175.8	72.4	-78	-177.8	0	0	112.2	R111 E147 Y148	R111-E143 IonicContact CZ-OE1 2.72Å; R111-E143 PolarHBondContact NH1-O 3Å; R111-E143 IonicContact NH2-OE1 3.66Å; R111-E143 PolarHBondContact NH2-OE1 3.35Å; R111-E143 IonicContact NH2-OE2 3.2Å; E143-E147 HydrophobicContact CB-CB 4.37Å; E143-Y148 VanDerWaalsContact OE1-CD2 3.27Å; E143-Y148 WeakPolarHBondContact OE1-CD2 3.46Å
144	S	96.7	Very high	94.4	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.014	31%	0.309	C	S	.	.			trans	-67.2	162.6	174.3	83.4	0	0	0	0	111.5	A146 E147 Y148 S215 E219	S144-A146 VanDerWaalsContact C-N 3.31Å; S144-A146 PolarHBondContact O-N 3.23Å; S144-A146 PolarHBondContact OG-N 3.04Å; S144-E147 WeakPolarHBondContact CB-OE2 3.32Å; S144-E147 PolarHBondContact N-OE2 3.02Å; S144-E147 PolarHBondContact O-N 2.67Å; S144-E147 VanDerWaalsContact OG-CB 3.32Å; S144-E147 WeakPolarHBondContact OG-CB 3.41Å; S144-E147 WeakPolarHBondContact OG-CG 3.47Å; S144-E147 PolarHBondContact OG-N 2.83Å; S144-E147 PolarHBondContact OG-OE2 2.86Å; S144-Y148 WeakPolarHBondContact O-CB 3.25Å; S144-Y148 PolarHBondContact O-N 3.01Å; S144-S215 VanDerWaalsContact CB-OG 3.31Å; S144-S215 WeakPolarHBondContact CB-OG 3.47Å; S144-S215 PolarHBondContact OG-OG 3.18Å; S144-E219 WeakPolarHBondContact CA-OE2 3.47Å; S144-E219 WeakPolarHBondContact CB-OE2 3.36Å
145	N	97.4	Very high	94.5	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-39.6	178.4	-57.8	-8.9	0	0	0	111	R111 S133 N135 Y148 L149 E219	R111-N145 WeakPolarHBondContact CD-OD1 3.45Å; R111-N145 PolarHBondContact NH1-OD1 2.83Å; S133-N145 VanDerWaalsContact OG-CB 3.24Å; S133-N145 WeakPolarHBondContact OG-CB 3.41Å; S133-N145 PolarHBondContact OG-ND2 2.89Å; N135-N145 PolarHBondContact ND2-OD1 3.21Å; N135-N145 PolarHBondContact OD1-ND2 2.58Å; N135-N145 VanDerWaalsContact OD1-ND2 3.12Å; N135-N145 PolarHBondContact OD1-OD1 3.26Å; N145-Y148 PolarHBondContact O-N 2.87Å; N145-L149 WeakPolarHBondContact O-CB 3.49Å; N145-L149 PolarHBondContact O-N 2.84Å; N145-E219 WeakPolarHBondContact CB-OE1 3.21Å; N145-E219 VanDerWaalsContact N-CD 3.34Å; N145-E219 PolarHBondContact N-OE1 3.1Å; N145-E219 PolarHBondContact N-OE2 3.21Å
146	A	97.5	Very high	94.6	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-70.5	-36.4	178.2	0	0	0	0	0	113.1	D131 S144 L149 A150 V158 K160 L212 E219	D131-A146 HydrophobicContact CB-CB 4.32Å; S144-A146 VanDerWaalsContact C-N 3.31Å; S144-A146 PolarHBondContact O-N 3.23Å; S144-A146 PolarHBondContact OG-N 3.04Å; A146-L149 PolarHBondContact O-N 3.16Å; A146-A150 WeakPolarHBondContact O-CB 3.32Å; A146-A150 PolarHBondContact O-N 3.18Å; A146-V158 HydrophobicContact CB-CG1 4.08Å; A146-K160 HydrophobicContact CB-CB 4.15Å; A146-K160 HydrophobicContact CB-CD 3.9Å; A146-L212 HydrophobicContact CB-CD1 3.92Å; A146-E219 PolarHBondContact N-OE1 2.96Å
147	E	97.4	Very high	94.9	Very high	55 Å²	55	56.2 Å²	56.2	26%	0.257	30%	0.295	S	S	.	.	H	α-helix	trans	-64.2	-44.4	173	-73.1	174.7	133.6	0	0	111	E143 S144 L149 A150 S151 R216	E143-E147 HydrophobicContact CB-CB 4.37Å; S144-E147 WeakPolarHBondContact CB-OE2 3.32Å; S144-E147 PolarHBondContact N-OE2 3.02Å; S144-E147 PolarHBondContact O-N 2.67Å; S144-E147 VanDerWaalsContact OG-CB 3.32Å; S144-E147 WeakPolarHBondContact OG-CB 3.41Å; S144-E147 WeakPolarHBondContact OG-CG 3.47Å; S144-E147 PolarHBondContact OG-N 2.83Å; S144-E147 PolarHBondContact OG-OE2 2.86Å; E147-L149 VanDerWaalsContact C-N 3.34Å; E147-L149 PolarHBondContact O-N 2.85Å; E147-A150 PolarHBondContact O-N 3.39Å; E147-S151 PolarHBondContact O-N 3.18Å; E147-R216 IonicContact OE2-NH2 3.83Å; E147-R216 PolarHBondContact OE2-NH2 3.22Å
148	Y	97.3	Very high	95.3	Very high	78 Å²	78	47.4 Å²	47.4	31%	0.306	26%	0.262	S	S	.	.	H	α-helix	trans	-63	-40	175.3	179.8	-117.3	0	0	0	112.4	R111 Y114 E143 S144 N145 A150 S151 L152	R111-Y148 HydrophobicContact CG-CD1 4.11Å; R111-Y148 HydrophobicContact CG-CE1 4.44Å; Y114-Y148 AromaticContact CD2-CD1 3.72Å; Y114-Y148 HydrophobicContact CD2-CD1 3.72Å; Y114-Y148 AromaticContact CD2-CE1 3.98Å; Y114-Y148 HydrophobicContact CD2-CE1 3.98Å; Y114-Y148 HydrophobicContact CE2-CD1 4.22Å; E143-Y148 VanDerWaalsContact OE1-CD2 3.27Å; E143-Y148 WeakPolarHBondContact OE1-CD2 3.46Å; S144-Y148 WeakPolarHBondContact O-CB 3.25Å; S144-Y148 PolarHBondContact O-N 3.01Å; N145-Y148 PolarHBondContact O-N 2.87Å; Y148-A150 VanDerWaalsContact C-N 3.33Å; Y148-A150 PolarHBondContact O-N 2.87Å; Y148-S151 PolarHBondContact O-N 3.1Å; Y148-S151 PolarHBondContact O-OG 2.77Å; Y148-L152 PolarHBondContact O-N 3.21Å; Y148-L152 VanDerWaalsContact O-N 3.07Å
149	L	97.3	Very high	95.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.7	-40.9	175.5	-178.7	66.9	0	0	0	111.7	L107 Y114 L117 L129 D131 N145 A146 E147 S151 L152 L153 V158	L107-L149 HydrophobicContact CD1-CD1 3.91Å; L107-L149 HydrophobicContact CD1-CD2 3.26Å; L107-L149 HydrophobicContact CD1-CG 4.19Å; Y114-L149 HydrophobicContact CD2-CB 4.28Å; Y114-L149 HydrophobicContact CD2-CD1 4.04Å; Y114-L149 HydrophobicContact CE2-CB 3.81Å; Y114-L149 HydrophobicContact CE2-CD1 4.09Å; Y114-L149 HydrophobicContact CE2-CG 4.43Å; Y114-L149 HydrophobicContact CG-CD1 4.32Å; L117-L149 HydrophobicContact CD1-CD1 3.82Å; L129-L149 HydrophobicContact CB-CD2 4.47Å; D131-L149 HydrophobicContact CB-CD2 4Å; N145-L149 WeakPolarHBondContact O-CB 3.49Å; N145-L149 PolarHBondContact O-N 2.84Å; A146-L149 PolarHBondContact O-N 3.16Å; E147-L149 VanDerWaalsContact C-N 3.34Å; E147-L149 PolarHBondContact O-N 2.85Å; L149-S151 VanDerWaalsContact C-N 3.34Å; L149-L152 PolarHBondContact O-N 3.46Å; L149-L153 HydrophobicContact CD1-CD1 3.95Å; L149-L153 PolarHBondContact O-N 2.86Å; L149-V158 HydrophobicContact CB-CG2 4.47Å; L149-V158 HydrophobicContact CD2-CG1 3.89Å; L149-V158 HydrophobicContact CD2-CG2 4.01Å; L149-V158 HydrophobicContact CG-CG1 4.47Å; L149-V158 HydrophobicContact CG-CG2 3.97Å
150	A	96.6	Very high	96.2	Very high	28 Å²	28	38.9 Å²	38.9	23%	0.231	22%	0.215	C	C	.	.	H	α-helix	trans	-66.4	-35.9	177.9	0	0	0	0	0	112.1	A146 E147 Y148 L152 L153 P154 V158 L212	A146-A150 WeakPolarHBondContact O-CB 3.32Å; A146-A150 PolarHBondContact O-N 3.18Å; E147-A150 PolarHBondContact O-N 3.39Å; Y148-A150 VanDerWaalsContact C-N 3.33Å; Y148-A150 PolarHBondContact O-N 2.87Å; A150-L152 VanDerWaalsContact C-N 3.35Å; A150-L153 CarbonylContact O-C 3.5Å; A150-L153 PolarHBondContact O-N 3.19Å; A150-P154 WeakPolarHBondContact O-CA 3.41Å; A150-V158 HydrophobicContact CB-CB 4.15Å; A150-V158 HydrophobicContact CB-CG2 3.89Å; A150-L212 HydrophobicContact CB-CD2 3.74Å
151	S	95.9	Very high	96.5	Very high	86 Å²	86	35.6 Å²	35.6	60%	0.601	20%	0.2	S	C	*	.	H	α-helix	trans	-70	-32.1	174.7	73.2	0	0	0	0	112.7	E147 Y148 L149	E147-S151 PolarHBondContact O-N 3.18Å; Y148-S151 PolarHBondContact O-N 3.1Å; Y148-S151 PolarHBondContact O-OG 2.77Å; L149-S151 VanDerWaalsContact C-N 3.34Å
152	L	95.3	Very high	96.6	Very high	23 Å²	23	32.1 Å²	32.1	12%	0.12	19%	0.186	C	C	.	.	H	α-helix	trans	-70.4	-38.2	175	-169.5	68.8	0	0	0	112.3	Y114 W118 Y148 L149 A150 P154	Y114-L152 WeakPolarHBondContact O-CD2 3.38Å; W118-L152 HydrophobicContact CE3-CD1 3.59Å; W118-L152 HydrophobicContact CE3-CG 4.39Å; W118-L152 HydrophobicContact CZ3-CD1 3.83Å; Y148-L152 PolarHBondContact O-N 3.21Å; Y148-L152 VanDerWaalsContact O-N 3.07Å; L149-L152 PolarHBondContact O-N 3.46Å; A150-L152 VanDerWaalsContact C-N 3.35Å; L152-P154 VanDerWaalsContact C-CD 3.48Å; L152-P154 WeakPolarHBondContact O-CD 3.42Å
153	L	95.6	Very high	96.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.156	C	C	.	.			trans	-125.6	68.1	-173.3	-60.6	173.3	0	0	0	111.4	L117 K121 L124 L129 L149 A150 D155 S156	L117-L153 HydrophobicContact CB-CD1 4.25Å; L117-L153 HydrophobicContact CD1-CD1 4.06Å; K121-L153 HydrophobicContact CB-CD2 3.88Å; K121-L153 HydrophobicContact CD-CD2 4.36Å; K121-L153 HydrophobicContact CG-CD2 3.79Å; L124-L153 HydrophobicContact CD1-CD1 3.67Å; L124-L153 HydrophobicContact CD1-CD2 4.21Å; L129-L153 HydrophobicContact CD1-CB 4.43Å; L129-L153 HydrophobicContact CD1-CD1 3.48Å; L129-L153 VanDerWaalsContact CD1-CD1 3.48Å; L149-L153 HydrophobicContact CD1-CD1 3.95Å; L149-L153 PolarHBondContact O-N 2.86Å; A150-L153 CarbonylContact O-C 3.5Å; A150-L153 PolarHBondContact O-N 3.19Å; L153-D155 PolarHBondContact O-N 3.33Å; L153-S156 WeakPolarHBondContact O-CB 3.5Å; L153-S156 PolarHBondContact O-N 3.39Å
154	P	95.1	Very high	96.7	Very high	80 Å²	80	26.6 Å²	26.6	52%	0.519	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-24.9	-174.3	26.1	-36.5	0	0	0	113.9	A150 L152 S156	A150-P154 WeakPolarHBondContact O-CA 3.41Å; L152-P154 VanDerWaalsContact C-CD 3.48Å; L152-P154 WeakPolarHBondContact O-CD 3.42Å; P154-S156 PolarHBondContact O-N 3.48Å
155	D	96.4	Very high	96.5	Very high	99 Å²	99	26.7 Å²	26.7	53%	0.529	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-2.6	178.9	-52.4	-57.8	0	0	0	112.5	K121 A125 G126 L153	K121-D155 WeakPolarHBondContact CE-OD2 3.3Å; A125-D155 HydrophobicContact CB-CB 4.05Å; G126-D155 PolarHBondContact N-O 3.07Å; L153-D155 PolarHBondContact O-N 3.33Å
156	S	96.6	Very high	96.2	Very high	12 Å²	12	29.4 Å²	29.4	8%	0.084	17%	0.171	C	C	.	.	S	Bend	trans	-106.8	156.3	177.7	-58.1	0	0	0	0	111.1	L124 L153 P154	L124-S156 VanDerWaalsContact C-OG 3.23Å; L124-S156 PolarHBondContact O-OG 3.31Å; L153-S156 WeakPolarHBondContact O-CB 3.5Å; L153-S156 PolarHBondContact O-N 3.39Å; P154-S156 PolarHBondContact O-N 3.48Å
157	V	97.9	Very high	95.9	Very high	43 Å²	43	30.8 Å²	30.8	26%	0.261	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	109	177.1	-177.8	0	0	0	0	109.7	K127 V128 L129 A191	K127-V157 PolarHBondContact O-N 3.21Å; V128-V157 CarbonylContact C-O 3.35Å; V128-V157 WeakPolarHBondContact CA-O 3.46Å; V128-V157 HydrophobicContact CG2-CB 4.49Å; L129-V157 PolarHBondContact N-O 3.07Å; V157-A191 HydrophobicContact CB-CB 4.47Å; V157-A191 HydrophobicContact CG1-CB 3.43Å; V157-A191 VanDerWaalsContact CG1-CB 3.43Å
158	V	98.3	Very high	95.4	Very high	6 Å²	6	36.1 Å²	36.1	4%	0.036	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	135.5	179.7	179.9	0	0	0	0	111.5	L129 A146 L149 A150 S186 L212	L129-V158 HydrophobicContact CB-CG2 4.42Å; L129-V158 CarbonylContact O-C 3.59Å; L129-V158 WeakPolarHBondContact O-CA 3.32Å; A146-V158 HydrophobicContact CB-CG1 4.08Å; L149-V158 HydrophobicContact CB-CG2 4.47Å; L149-V158 HydrophobicContact CD2-CG1 3.89Å; L149-V158 HydrophobicContact CD2-CG2 4.01Å; L149-V158 HydrophobicContact CG-CG1 4.47Å; L149-V158 HydrophobicContact CG-CG2 3.97Å; A150-V158 HydrophobicContact CB-CB 4.15Å; A150-V158 HydrophobicContact CB-CG2 3.89Å; V158-S186 WeakPolarHBondContact O-CB 3.29Å; V158-S186 PolarHBondContact O-OG 3.4Å; V158-L212 HydrophobicContact CB-CD2 4.37Å; V158-L212 HydrophobicContact CG1-CD1 4.23Å; V158-L212 HydrophobicContact CG1-CD2 4.44Å
159	V	98.6	Very high	95	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	125.7	174.1	-177.3	0	0	0	0	108.5	V128 L129 V130 D131 I184 A191 I195	V128-V159 HydrophobicContact CG1-CG2 3.8Å; L129-V159 PolarHBondContact O-N 2.97Å; V130-V159 CarbonylContact C-O 3.5Å; V130-V159 VanDerWaalsContact CA-O 3.3Å; V130-V159 WeakPolarHBondContact CA-O 3.48Å; D131-V159 PolarHBondContact N-O 3.02Å; V159-I184 HydrophobicContact CG1-CG2 3.56Å; V159-A191 HydrophobicContact CG2-CB 3.77Å; V159-I195 HydrophobicContact CB-CG1 4.25Å; V159-I195 HydrophobicContact CG1-CB 4.08Å; V159-I195 HydrophobicContact CG1-CG1 3.98Å; V159-I195 HydrophobicContact CG1-CG2 4.1Å; V159-I195 HydrophobicContact CG2-CG1 4.1Å
160	K	98.5	Very high	94.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	132.5	168.6	-175.1	76	-166.4	-172	0	109.3	D131 S133 A146 I184 C185 I218 E219	D131-K160 WeakPolarHBondContact OD2-CD 3.47Å; D131-K160 IonicContact OD2-NZ 3.48Å; D131-K160 PolarHBondContact OD2-NZ 2.9Å; S133-K160 PolarHBondContact O-NZ 3.46Å; A146-K160 HydrophobicContact CB-CB 4.15Å; A146-K160 HydrophobicContact CB-CD 3.9Å; K160-I184 VanDerWaalsContact O-CA 3.31Å; K160-I184 WeakPolarHBondContact O-CA 3.15Å; K160-C185 VanDerWaalsContact CB-SG 3.57Å; K160-C185 PolarHBondContact N-O 2.78Å; K160-C185 PolarHBondContact O-N 2.86Å; K160-I218 HydrophobicContact CG-CB 4.35Å; K160-I218 HydrophobicContact CG-CD1 4.37Å; K160-I218 HydrophobicContact CG-CG2 4.09Å; K160-E219 HydrophobicContact CD-CG 4.21Å; K160-E219 VanDerWaalsContact NZ-CD 3.33Å; K160-E219 IonicContact NZ-OE1 2.74Å; K160-E219 PolarHBondContact NZ-OE1 3.32Å
161	G	97.2	Very high	94.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.194	C	C	.	.			trans	-173.6	172.4	172	0	0	0	0	0	113.4	D131 V132 N163	D131-G161 PolarHBondContact O-N 2.68Å; D131-G161 VanDerWaalsContact O-N 3.16Å; D131-G161 VanDerWaalsContact O-O 3.12Å; V132-G161 WeakPolarHBondContact CA-O 3.31Å; V132-G161 WeakPolarHBondContact CG1-O 3.36Å; G161-N163 PolarHBondContact O-N 2.94Å
162	F	96.4	Very high	93.6	Very high	1 Å²	1	33.1 Å²	33.1	0%	0.004	18%	0.177	C	C	.	.	S	Bend	trans	59.1	-3.3	174.3	-58.7	-92.3	0	0	0	117.5	F57 F106 V130 V132 I164 I165 M170 V182 I195 L198 A199 L202 F204	F57-F162 HydrophobicContact CZ-CB 4.19Å; F106-F162 AromaticContact CE1-CD2 3.6Å; F106-F162 HydrophobicContact CE1-CD2 3.6Å; F106-F162 AromaticContact CE1-CE2 3.68Å; F106-F162 HydrophobicContact CE1-CE2 3.68Å; F106-F162 HydrophobicContact CE1-CG 4.2Å; F106-F162 HydrophobicContact CE1-CZ 4.34Å; F106-F162 HydrophobicContact CZ-CD2 4.32Å; F106-F162 AromaticContact CZ-CE2 3.93Å; F106-F162 HydrophobicContact CZ-CE2 3.93Å; F106-F162 HydrophobicContact CZ-CZ 4.32Å; V130-F162 HydrophobicContact CG1-CD2 4.07Å; V130-F162 HydrophobicContact CG1-CE2 4.48Å; V132-F162 HydrophobicContact CG1-CB 4Å; F162-I164 PolarHBondContact O-N 3.32Å; F162-I165 PolarHBondContact O-N 2.92Å; F162-M170 HydrophobicContact CB-CE 4.24Å; F162-M170 HydrophobicContact CD1-CE 3.88Å; F162-V182 HydrophobicContact CD1-CG1 3.99Å; F162-V182 HydrophobicContact CD1-CG2 4.03Å; F162-V182 HydrophobicContact CD2-CG1 4.05Å; F162-V182 HydrophobicContact CE1-CG1 4.19Å; F162-V182 HydrophobicContact CE1-CG2 4.15Å; F162-V182 HydrophobicContact CE2-CG1 4.24Å; F162-V182 HydrophobicContact CG-CG1 3.94Å; F162-V182 HydrophobicContact CZ-CG1 4.32Å; F162-I195 HydrophobicContact CE2-CG2 3.84Å; F162-L198 HydrophobicContact CE2-CD2 4.47Å; F162-L198 HydrophobicContact CZ-CD2 3.9Å; F162-A199 HydrophobicContact CE1-CB 4.24Å; F162-A199 HydrophobicContact CZ-CB 3.77Å; F162-L202 HydrophobicContact CE1-CD1 3.97Å; F162-L202 HydrophobicContact CZ-CD1 4.2Å; F162-F204 HydrophobicContact CE1-CD2 4.06Å; F162-F204 HydrophobicContact CE1-CE2 4.38Å
163	N	95.1	Very high	92.7	Very high	6 Å²	6	35.5 Å²	35.5	3%	0.032	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-22.2	-178.4	70.8	-59	0	0	0	113.6	V132 N134 G161 I218	V132-N163 WeakPolarHBondContact O-CB 3.41Å; N134-N163 PolarHBondContact ND2-O 3.32Å; N134-N163 WeakPolarHBondContact OD1-CB 3.28Å; N134-N163 PolarHBondContact OD1-ND2 3.37Å; G161-N163 PolarHBondContact O-N 2.94Å; N163-I218 PolarHBondContact ND2-O 2.97Å; N163-I218 VanDerWaalsContact ND2-O 3.1Å; N163-I218 WeakPolarHBondContact OD1-CG2 3.48Å
164	I	93.6	Very high	91.7	Very high	40 Å²	40	43.4 Å²	43.4	21%	0.205	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-28.4	177	-57	-174.7	0	0	0	111.6	F162 S166 F183 I218 I221	F162-I164 PolarHBondContact O-N 3.32Å; I164-S166 PolarHBondContact O-N 3.09Å; I164-F183 HydrophobicContact CD1-CB 4.44Å; I164-F183 HydrophobicContact CD1-CD2 3.23Å; I164-F183 HydrophobicContact CD1-CE2 3.68Å; I164-F183 HydrophobicContact CD1-CG 4.13Å; I164-F183 HydrophobicContact CG1-CD2 4.49Å; I164-I218 HydrophobicContact CD1-CG2 4.47Å; I164-I221 HydrophobicContact CD1-CB 4Å; I164-I221 HydrophobicContact CD1-CD1 3.66Å; I164-I221 HydrophobicContact CD1-CG1 4.44Å; I164-I221 HydrophobicContact CD1-CG2 3.87Å
165	I	92.3	Very high	90.3	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.015	20%	0.199	C	C	.	.	S	Bend	trans	-74.2	122.4	-177	-48.2	-60.1	0	0	0	108.6	F57 F162 A169 M170 S179 V182 F204	F57-I165 WeakPolarHBondContact CE2-O 3.28Å; F162-I165 PolarHBondContact O-N 2.92Å; I165-A169 HydrophobicContact CG2-CB 4.11Å; I165-M170 HydrophobicContact CB-CE 3.77Å; I165-M170 HydrophobicContact CG1-CE 4.32Å; I165-M170 HydrophobicContact CG2-CB 4.17Å; I165-M170 HydrophobicContact CG2-CE 3.7Å; I165-M170 HydrophobicContact CG2-SD 4.39Å; I165-S179 VanDerWaalsContact CD1-O 3.22Å; I165-S179 WeakPolarHBondContact CD1-O 3.3Å; I165-S179 WeakPolarHBondContact CD1-OG 2.89Å; I165-V182 HydrophobicContact CD1-CG2 3.9Å; I165-V182 HydrophobicContact CG1-CG2 3.84Å; I165-F204 HydrophobicContact CD1-CD1 4.15Å; I165-F204 HydrophobicContact CD1-CE1 3.98Å; I165-F204 HydrophobicContact CG1-CE1 4.2Å; I165-F204 HydrophobicContact CG2-CE1 3.94Å; I165-F204 HydrophobicContact CG2-CZ 3.93Å
166	S	90.9	Very high	88.7	Confident	57 Å²	57	44.7 Å²	44.7	40%	0.399	21%	0.214	S	C	.	.			trans	-66.7	151.1	175.5	72.2	0	0	0	0	111	I164 W168 A169 M170	I164-S166 PolarHBondContact O-N 3.09Å; S166-W168 PolarHBondContact O-N 2.8Å; S166-W168 VanDerWaalsContact O-N 3.16Å; S166-A169 PolarHBondContact O-N 2.78Å; S166-A169 VanDerWaalsContact O-N 3.15Å; S166-A169 WeakPolarHBondContact OG-CB 3.29Å; S166-A169 PolarHBondContact OG-N 2.89Å; S166-A169 VanDerWaalsContact OG-N 3.11Å; S166-M170 WeakPolarHBondContact O-CB 3.36Å; S166-M170 PolarHBondContact O-N 3.06Å
167	A	90.9	Very high	87.2	Confident	30 Å²	30	49.1 Å²	49.1	25%	0.248	24%	0.237	C	C	.	.	H	α-helix	trans	-57.3	-31.4	175.8	0	0	0	0	0	112.2	F57 S60	F57-A167 HydrophobicContact CB-CB 4.49Å; F57-A167 HydrophobicContact CD2-CB 4.3Å; S60-A167 WeakPolarHBondContact CB-O 3.48Å; S60-A167 PolarHBondContact OG-O 3.06Å
168	W	88.3	Confident	85.3	Confident	167 Å²	167	52.5 Å²	52.5	63%	0.633	27%	0.269	S	S	*	.	H	α-helix	trans	-70.6	-47.1	175.9	-178.1	82.9	0	0	0	112.3	S166 M170 Q171 Q172	S166-W168 PolarHBondContact O-N 2.8Å; S166-W168 VanDerWaalsContact O-N 3.16Å; W168-M170 VanDerWaalsContact C-N 3.26Å; W168-M170 PolarHBondContact O-N 3.03Å; W168-Q171 PolarHBondContact O-N 2.95Å; W168-Q172 VanDerWaalsContact CE3-NE2 3.3Å; W168-Q172 VanDerWaalsContact CZ2-NE2 3.32Å
169	A	89.1	Confident	83.9	Confident	6 Å²	6	53.2 Å²	53.2	5%	0.05	27%	0.274	C	S	.	.	H	α-helix	trans	-63.1	-35.1	177.1	0	0	0	0	0	111.9	I165 S166 Q171 Q172	I165-A169 HydrophobicContact CG2-CB 4.11Å; S166-A169 PolarHBondContact O-N 2.78Å; S166-A169 VanDerWaalsContact O-N 3.15Å; S166-A169 WeakPolarHBondContact OG-CB 3.29Å; S166-A169 PolarHBondContact OG-N 2.89Å; S166-A169 VanDerWaalsContact OG-N 3.11Å; A169-Q171 PolarHBondContact O-N 3.5Å; A169-Q172 WeakPolarHBondContact O-CB 3.49Å; A169-Q172 PolarHBondContact O-N 3.48Å; A169-Q172 VanDerWaalsContact O-N 3.08Å
170	M	90.8	Very high	83.2	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.1	-29.8	177.7	-170.9	66.1	73.5	0	0	113.1	F57 I61 R64 F162 I165 S166 W168 Q172 F204	F57-M170 HydrophobicContact CE2-CE 4.03Å; F57-M170 HydrophobicContact CZ-CE 3.71Å; I61-M170 HydrophobicContact CB-CG 4.04Å; I61-M170 HydrophobicContact CB-SD 4.41Å; I61-M170 HydrophobicContact CG1-CG 4.45Å; I61-M170 HydrophobicContact CG1-SD 4.19Å; R64-M170 HydrophobicContact CB-CG 4.42Å; R64-M170 WeakPolarHBondContact CB-O 3.21Å; R64-M170 HydrophobicContact CB-SD 4.46Å; R64-M170 HydrophobicContact CG-SD 4.27Å; F162-M170 HydrophobicContact CB-CE 4.24Å; F162-M170 HydrophobicContact CD1-CE 3.88Å; I165-M170 HydrophobicContact CB-CE 3.77Å; I165-M170 HydrophobicContact CG1-CE 4.32Å; I165-M170 HydrophobicContact CG2-CB 4.17Å; I165-M170 HydrophobicContact CG2-CE 3.7Å; I165-M170 HydrophobicContact CG2-SD 4.39Å; S166-M170 WeakPolarHBondContact O-CB 3.36Å; S166-M170 PolarHBondContact O-N 3.06Å; W168-M170 VanDerWaalsContact C-N 3.26Å; W168-M170 PolarHBondContact O-N 3.03Å; M170-Q172 VanDerWaalsContact C-N 3.26Å; M170-Q172 PolarHBondContact O-N 3.48Å; M170-F204 HydrophobicContact CE-CE2 4.42Å; M170-F204 HydrophobicContact CE-CZ 4.36Å; M170-F204 HydrophobicContact SD-CE2 3.7Å; M170-F204 HydrophobicContact SD-CZ 3.74Å
171	Q	86.4	Confident	82.9	Confident	74 Å²	74	59.5 Å²	59.5	35%	0.346	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-16.8	178	-67.8	178.3	2.9	0	0	113.3	S60 R67 W168 A169	S60-Q171 VanDerWaalsContact OG-CG 3.28Å; S60-Q171 WeakPolarHBondContact OG-CG 3.36Å; S60-Q171 PolarHBondContact OG-NE2 3.03Å; R67-Q171 PolarHBondContact NH1-O 3.27Å; W168-Q171 PolarHBondContact O-N 2.95Å; A169-Q171 PolarHBondContact O-N 3.5Å
172	Q	83.1	Confident	82.8	Confident	49 Å²	49	59.6 Å²	59.6	23%	0.229	31%	0.307	C	S	.	.			trans	-84.6	142.2	-176.4	-59.4	-176.2	30	0	0	111.6	R64 W168 A169 M170	R64-Q172 VanDerWaalsContact CZ-O 3.25Å; R64-Q172 PolarHBondContact NE-O 3.08Å; R64-Q172 PolarHBondContact NH2-O 3.38Å; W168-Q172 VanDerWaalsContact CE3-NE2 3.3Å; W168-Q172 VanDerWaalsContact CZ2-NE2 3.32Å; A169-Q172 WeakPolarHBondContact O-CB 3.49Å; A169-Q172 PolarHBondContact O-N 3.48Å; A169-Q172 VanDerWaalsContact O-N 3.08Å; M170-Q172 VanDerWaalsContact C-N 3.26Å; M170-Q172 PolarHBondContact O-N 3.48Å
173	I	76.3	Confident	82.8	Confident	72 Å²	72	61.4 Å²	61.4	37%	0.369	32%	0.315	S	S	.	.	S	Bend	trans	-75	-32.4	179.8	-62.4	172.5	0	0	0	111.8	R64 N203	R64-I173 PolarHBondContact NH1-O 2.87Å; R64-I173 PolarHBondContact NH2-O 2.81Å; I173-N203 PolarHBondContact O-ND2 2.95Å
174	Y	73.8	Confident	83	Confident	166 Å²	166	61.1 Å²	61.1	65%	0.651	31%	0.313	S	S	*	.	S	Bend	trans	-136.4	91.1	174.7	-63.3	-73.8	0	0	0	107.3	K176 N203	Y174-K176 PolarHBondContact O-N 3.43Å; Y174-K176 VanDerWaalsContact O-N 3.09Å; Y174-N203 HydrophobicContact CD1-CB 4.46Å; Y174-N203 HydrophobicContact CE1-CB 4.37Å
175	P	66.6	Low	83.2	Confident	15 Å²	15	59.2 Å²	59.2	10%	0.097	30%	0.304	C	S	.	.			trans	-60.2	117.3	175.1	16.3	-20	0	0	0	108.3	D177 T180 F204	P175-D177 VanDerWaalsContact C-N 3.3Å; P175-T180 HydrophobicContact CB-CG2 4.48Å; P175-T180 HydrophobicContact CG-CG2 4.21Å; P175-T180 WeakPolarHBondContact O-CG2 3.42Å; P175-F204 HydrophobicContact CG-CD1 4.4Å; P175-F204 HydrophobicContact CG-CE1 3.87Å
176	K	61.9	Low	83.4	Confident	191 Å²	191	59.1 Å²	59.1	83%	0.83	30%	0.304	S	S	*	.			trans	-82.5	-8.4	-177.7	-69.2	-176.1	177.3	-178.5	0	113.3	Y174	Y174-K176 PolarHBondContact O-N 3.43Å; Y174-K176 VanDerWaalsContact O-N 3.09Å
177	D	64.9	Low	83.8	Confident	106 Å²	106	61.9 Å²	61.9	57%	0.567	31%	0.314	S	S	*	.	S	Bend	trans	-111.3	-174.1	-169.7	-59.2	-39.7	0	0	0	113.5	P175 S179	P175-D177 VanDerWaalsContact C-N 3.3Å; D177-S179 PolarHBondContact O-N 2.96Å
178	A	59.2	Low	84.1	Confident	114 Å²	114	62.2 Å²	62.2	94%	0.942	31%	0.314	S	S	*	.	S	Bend	trans	-60.9	26.4	-173.9	0	0	0	0	0	117.3
179	S	68.1	Low	84.5	Confident	21 Å²	21	59 Å²	59	15%	0.147	31%	0.309	C	S	.	.			trans	-138.4	44.1	-172.3	-178.3	0	0	0	0	111.7	I165 D177	I165-S179 VanDerWaalsContact CD1-O 3.22Å; I165-S179 WeakPolarHBondContact CD1-O 3.3Å; I165-S179 WeakPolarHBondContact CD1-OG 2.89Å; D177-S179 PolarHBondContact O-N 2.96Å
180	T	83.6	Confident	84.9	Confident	41 Å²	41	67.1 Å²	67.1	25%	0.252	34%	0.342	S	S	.	.			trans	-96.9	-21	175.9	55.1	0	0	0	0	113	P175 Q205	P175-T180 HydrophobicContact CB-CG2 4.48Å; P175-T180 HydrophobicContact CG-CG2 4.21Å; P175-T180 WeakPolarHBondContact O-CG2 3.42Å; T180-Q205 PolarHBondContact O-N 3.34Å
181	Q	91.9	Very high	85.1	Confident	91 Å²	91	67.3 Å²	67.3	43%	0.425	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	130.6	-177.6	-68.4	-175.7	-20.4	0	0	112	F183 Q205 V207	Q181-F183 HydrophobicContact CB-CE2 4.08Å; Q181-F183 HydrophobicContact CB-CZ 4.45Å; Q181-Q205 CarbonylContact C-O 3.45Å; Q181-Q205 VanDerWaalsContact CA-O 3.29Å; Q181-Q205 WeakPolarHBondContact CA-O 3.47Å; Q181-Q205 HydrophobicContact CG-CB 4.31Å; Q181-V207 HydrophobicContact CB-CG2 4.4Å; Q181-V207 HydrophobicContact CG-CG2 4.44Å
182	V	95.2	Very high	85.6	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.006	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	108.2	175.2	-179.4	0	0	0	0	108.3	F162 I165 I184 F204 Q205 P206 V207	F162-V182 HydrophobicContact CD1-CG1 3.99Å; F162-V182 HydrophobicContact CD1-CG2 4.03Å; F162-V182 HydrophobicContact CD2-CG1 4.05Å; F162-V182 HydrophobicContact CE1-CG1 4.19Å; F162-V182 HydrophobicContact CE1-CG2 4.15Å; F162-V182 HydrophobicContact CE2-CG1 4.24Å; F162-V182 HydrophobicContact CG-CG1 3.94Å; F162-V182 HydrophobicContact CZ-CG1 4.32Å; I165-V182 HydrophobicContact CD1-CG2 3.9Å; I165-V182 HydrophobicContact CG1-CG2 3.84Å; V182-I184 HydrophobicContact CG1-CD1 4.14Å; V182-I184 HydrophobicContact CG1-CG1 3.87Å; V182-F204 HydrophobicContact CG2-CB 3.6Å; V182-F204 HydrophobicContact CG2-CD1 4.03Å; V182-F204 HydrophobicContact CG2-CD2 4.23Å; V182-F204 HydrophobicContact CG2-CG 3.71Å; V182-Q205 PolarHBondContact N-O 3.12Å; V182-P206 CarbonylContact O-C 3.59Å; V182-P206 WeakPolarHBondContact O-CA 3.11Å; V182-V207 PolarHBondContact O-N 3.29Å
183	F	97	Very high	86.3	Confident	39 Å²	39	68.8 Å²	68.8	17%	0.171	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	128.7	177	-62.2	-94.3	0	0	0	109.4	I164 Q181 V207 M209 I218	I164-F183 HydrophobicContact CD1-CB 4.44Å; I164-F183 HydrophobicContact CD1-CD2 3.23Å; I164-F183 HydrophobicContact CD1-CE2 3.68Å; I164-F183 HydrophobicContact CD1-CG 4.13Å; I164-F183 HydrophobicContact CG1-CD2 4.49Å; Q181-F183 HydrophobicContact CB-CE2 4.08Å; Q181-F183 HydrophobicContact CB-CZ 4.45Å; F183-V207 HydrophobicContact CD1-CB 3.84Å; F183-V207 HydrophobicContact CD1-CG1 3.87Å; F183-V207 HydrophobicContact CD1-CG2 4.43Å; F183-V207 HydrophobicContact CE1-CB 4.16Å; F183-V207 HydrophobicContact CE1-CG1 4.02Å; F183-V207 HydrophobicContact CE1-CG2 4.32Å; F183-V207 HydrophobicContact CG-CB 4.43Å; F183-M209 HydrophobicContact CB-CG 3.89Å; F183-M209 HydrophobicContact CD1-CE 4.36Å; F183-M209 HydrophobicContact CD1-CG 3.84Å; F183-M209 HydrophobicContact CD1-SD 3.64Å; F183-M209 HydrophobicContact CE1-SD 4.3Å; F183-M209 HydrophobicContact CG-CG 4.35Å; F183-I218 HydrophobicContact CB-CD1 3.97Å; F183-I218 HydrophobicContact CB-CG1 4.06Å; F183-I218 HydrophobicContact CB-CG2 4.16Å
184	I	98.3	Very high	87.2	Confident	0 Å²	0	69 Å²	69	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	130.8	-172.2	-58	168.8	0	0	0	109.5	V159 K160 V182 R192 I195 M196 A199 P206 V207 M209	V159-I184 HydrophobicContact CG1-CG2 3.56Å; K160-I184 VanDerWaalsContact O-CA 3.31Å; K160-I184 WeakPolarHBondContact O-CA 3.15Å; V182-I184 HydrophobicContact CG1-CD1 4.14Å; V182-I184 HydrophobicContact CG1-CG1 3.87Å; I184-R192 HydrophobicContact CG2-CG 3.95Å; I184-I195 HydrophobicContact CD1-CG2 4.06Å; I184-I195 HydrophobicContact CG2-CG2 4.3Å; I184-M196 HydrophobicContact CB-CG 4.46Å; I184-M196 HydrophobicContact CD1-CB 4.28Å; I184-M196 HydrophobicContact CD1-CG 3.69Å; I184-A199 HydrophobicContact CD1-CB 4.25Å; I184-P206 HydrophobicContact CD1-CB 3.88Å; I184-V207 PolarHBondContact N-O 2.9Å; I184-M209 PolarHBondContact O-N 3.15Å
185	C	98.2	Very high	88.4	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	149.1	171	68.6	0	0	0	0	112.1	K160 M209 G210 P211 S215 I218	K160-C185 VanDerWaalsContact CB-SG 3.57Å; K160-C185 PolarHBondContact N-O 2.78Å; K160-C185 PolarHBondContact O-N 2.86Å; C185-M209 HydrophobicContact CB-CB 4.08Å; C185-G210 VanDerWaalsContact CA-O 3.29Å; C185-G210 WeakPolarHBondContact CA-O 3.39Å; C185-G210 VanDerWaalsContact CB-O 3.3Å; C185-G210 WeakPolarHBondContact CB-O 3.22Å; C185-P211 WeakPolarHBondContact CB-O 3.33Å; C185-S215 VanDerWaalsContact SG-CA 3.51Å; C185-S215 PolarHBondContact SG-N 3.23Å; C185-S215 VanDerWaalsContact SG-N 3.4Å; C185-I218 HydrophobicContact CB-CD1 4.05Å
186	S	98.1	Very high	89.9	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.014	32%	0.321	C	S	.	.			trans	-171	152.8	178.8	-176.7	0	0	0	0	109.6	V158 S188 R192 G210	V158-S186 WeakPolarHBondContact O-CB 3.29Å; V158-S186 PolarHBondContact O-OG 3.4Å; S186-S188 VanDerWaalsContact C-N 3.29Å; S186-S188 PolarHBondContact OG-N 3.27Å; S186-R192 PolarHBondContact O-NH1 3.03Å; S186-G210 PolarHBondContact N-O 3.31Å
187	D	97.6	Very high	91.5	Very high	115 Å²	115	56.5 Å²	56.5	62%	0.615	30%	0.301	S	S	*	.	S	Bend	trans	-77.2	-17.2	172.9	-60.2	-33	0	0	0	112.4	L212	D187-L212 WeakPolarHBondContact OD1-CB 3.33Å; D187-L212 PolarHBondContact OD1-N 3.08Å; D187-L212 WeakPolarHBondContact OD2-CB 3.32Å
188	S	97.6	Very high	93	Very high	36 Å²	36	51.7 Å²	51.7	25%	0.252	28%	0.275	S	S	.	.			trans	-93.8	110.6	173.1	177.5	0	0	0	0	111.2	S186 K190 A191 R192	S186-S188 VanDerWaalsContact C-N 3.29Å; S186-S188 PolarHBondContact OG-N 3.27Å; S188-K190 VanDerWaalsContact C-N 3.26Å; S188-K190 PolarHBondContact O-N 3.44Å; S188-A191 PolarHBondContact O-N 2.95Å; S188-A191 PolarHBondContact OG-N 3.27Å; S188-R192 WeakPolarHBondContact O-CB 3.49Å; S188-R192 PolarHBondContact O-N 3.4Å
189	I	96.9	Very high	94.7	Very high	101 Å²	101	46.3 Å²	46.3	52%	0.518	23%	0.23	S	C	.	.	H	α-helix	trans	-58.4	-40.9	176.5	-61.6	169.3	0	0	0	110.9	R192 Q193	I189-R192 PolarHBondContact O-N 3.17Å; I189-Q193 HydrophobicContact CG2-CG 4.46Å; I189-Q193 WeakPolarHBondContact O-CG 3.47Å; I189-Q193 PolarHBondContact O-N 3Å
190	K	97	Very high	96	Very high	175 Å²	175	50.8 Å²	50.8	76%	0.761	24%	0.244	S	C	*	.	H	α-helix	trans	-62.5	-47.5	179.8	-66.2	-177.2	-178.5	179	0	111.6	S188 Q193 L194	S188-K190 VanDerWaalsContact C-N 3.26Å; S188-K190 PolarHBondContact O-N 3.44Å; K190-Q193 PolarHBondContact O-N 3.43Å; K190-L194 WeakPolarHBondContact O-CB 3.23Å; K190-L194 PolarHBondContact O-N 2.97Å
191	A	96.6	Very high	96.4	Very high	4 Å²	4	52 Å²	52	3%	0.033	25%	0.246	C	C	.	.	H	α-helix	trans	-68	-38	178.9	0	0	0	0	0	111.6	V128 V157 V159 S188 L194 I195	V128-A191 HydrophobicContact CG1-CB 4.06Å; V128-A191 HydrophobicContact CG2-CB 3.99Å; V157-A191 HydrophobicContact CB-CB 4.47Å; V157-A191 HydrophobicContact CG1-CB 3.43Å; V157-A191 VanDerWaalsContact CG1-CB 3.43Å; V159-A191 HydrophobicContact CG2-CB 3.77Å; S188-A191 PolarHBondContact O-N 2.95Å; S188-A191 PolarHBondContact OG-N 3.27Å; A191-L194 WeakPolarHBondContact O-CB 3.35Å; A191-L194 PolarHBondContact O-N 3.35Å; A191-I195 WeakPolarHBondContact O-CG1 3.44Å; A191-I195 PolarHBondContact O-N 2.99Å
192	R	96	Very high	96.5	Very high	34 Å²	34	47.6 Å²	47.6	13%	0.128	23%	0.226	C	C	.	.	H	α-helix	trans	-59.6	-49.2	175.3	-164.4	161.9	74.6	-144.2	9.3	111.7	I184 S186 S188 I189 L194 I195 M196 D208 G210	I184-R192 HydrophobicContact CG2-CG 3.95Å; S186-R192 PolarHBondContact O-NH1 3.03Å; S188-R192 WeakPolarHBondContact O-CB 3.49Å; S188-R192 PolarHBondContact O-N 3.4Å; I189-R192 PolarHBondContact O-N 3.17Å; R192-L194 PolarHBondContact O-N 3.4Å; R192-I195 PolarHBondContact O-N 3.14Å; R192-M196 HydrophobicContact CG-SD 4.41Å; R192-M196 WeakPolarHBondContact O-CB 3.42Å; R192-M196 WeakPolarHBondContact O-CG 3.43Å; R192-M196 PolarHBondContact O-N 3.28Å; R192-D208 WeakPolarHBondContact CD-OD1 3.27Å; R192-D208 IonicContact CZ-OD1 3.47Å; R192-D208 IonicContact CZ-OD2 3.98Å; R192-D208 IonicContact NE-OD1 3.68Å; R192-D208 PolarHBondContact NE-OD1 2.83Å; R192-D208 IonicContact NE-OD2 3.33Å; R192-D208 PolarHBondContact NE-OD2 3.47Å; R192-D208 IonicContact NH2-OD1 2.77Å; R192-D208 IonicContact NH2-OD2 2.65Å; R192-D208 PolarHBondContact NH2-OD2 3Å; R192-G210 VanDerWaalsContact NH1-C 3.29Å; R192-G210 PolarHBondContact NH1-O 2.97Å
193	Q	97.1	Very high	96.3	Very high	121 Å²	121	50.6 Å²	50.6	57%	0.565	24%	0.242	S	C	*	.	H	α-helix	trans	-61.3	-41.7	176.6	-73.9	177.7	-18.8	0	0	112.6	I189 K190 M196 E197	I189-Q193 HydrophobicContact CG2-CG 4.46Å; I189-Q193 WeakPolarHBondContact O-CG 3.47Å; I189-Q193 PolarHBondContact O-N 3Å; K190-Q193 PolarHBondContact O-N 3.43Å; Q193-M196 PolarHBondContact O-N 2.91Å; Q193-E197 PolarHBondContact O-N 2.95Å
194	L	96.8	Very high	96.1	Very high	77 Å²	77	49 Å²	49	40%	0.403	24%	0.235	S	C	.	.	H	α-helix	trans	-58.8	-47.9	176.1	179.3	67.9	0	0	0	111.8	I104 V128 K190 A191 R192 E197 L198	I104-L194 HydrophobicContact CD1-CD1 4.3Å; I104-L194 HydrophobicContact CD1-CD2 3.77Å; I104-L194 HydrophobicContact CD1-CG 4.05Å; I104-L194 HydrophobicContact CG1-CD2 4.01Å; V128-L194 HydrophobicContact CG2-CD2 4.35Å; K190-L194 WeakPolarHBondContact O-CB 3.23Å; K190-L194 PolarHBondContact O-N 2.97Å; A191-L194 WeakPolarHBondContact O-CB 3.35Å; A191-L194 PolarHBondContact O-N 3.35Å; R192-L194 PolarHBondContact O-N 3.4Å; L194-E197 PolarHBondContact O-N 3.47Å; L194-L198 PolarHBondContact O-N 3.27Å
195	I	97.6	Very high	95.9	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-71.9	-31.8	-179.9	-61.7	-51.9	0	0	0	111.9	I104 V128 V130 V159 F162 I184 A191 R192 L198 A199	I104-I195 HydrophobicContact CG2-CD1 3.83Å; V128-I195 HydrophobicContact CG1-CD1 4.11Å; V128-I195 HydrophobicContact CG1-CG1 4.13Å; V130-I195 HydrophobicContact CG2-CD1 3.47Å; V130-I195 VanDerWaalsContact CG2-CD1 3.47Å; V130-I195 HydrophobicContact CG2-CG1 3.94Å; V159-I195 HydrophobicContact CB-CG1 4.25Å; V159-I195 HydrophobicContact CG1-CB 4.08Å; V159-I195 HydrophobicContact CG1-CG1 3.98Å; V159-I195 HydrophobicContact CG1-CG2 4.1Å; V159-I195 HydrophobicContact CG2-CG1 4.1Å; F162-I195 HydrophobicContact CE2-CG2 3.84Å; I184-I195 HydrophobicContact CD1-CG2 4.06Å; I184-I195 HydrophobicContact CG2-CG2 4.3Å; A191-I195 WeakPolarHBondContact O-CG1 3.44Å; A191-I195 PolarHBondContact O-N 2.99Å; R192-I195 PolarHBondContact O-N 3.14Å; I195-L198 PolarHBondContact O-N 2.85Å; I195-A199 WeakPolarHBondContact O-CB 3.31Å; I195-A199 PolarHBondContact O-N 3.18Å
196	M	97.5	Very high	95.8	Very high	22 Å²	22	55.6 Å²	55.6	11%	0.108	27%	0.268	C	S	.	.	H	α-helix	trans	-62.3	-43.8	171.1	-72.4	176.7	74.7	0	0	111.6	I184 R192 Q193 A199 R200 P206 D208	I184-M196 HydrophobicContact CB-CG 4.46Å; I184-M196 HydrophobicContact CD1-CB 4.28Å; I184-M196 HydrophobicContact CD1-CG 3.69Å; R192-M196 HydrophobicContact CG-SD 4.41Å; R192-M196 WeakPolarHBondContact O-CB 3.42Å; R192-M196 WeakPolarHBondContact O-CG 3.43Å; R192-M196 PolarHBondContact O-N 3.28Å; Q193-M196 PolarHBondContact O-N 2.91Å; M196-A199 WeakPolarHBondContact O-CB 3.44Å; M196-A199 PolarHBondContact O-N 3.25Å; M196-R200 WeakPolarHBondContact O-CG 3.26Å; M196-R200 PolarHBondContact O-N 2.94Å; M196-R200 VanDerWaalsContact O-N 3.08Å; M196-P206 HydrophobicContact CB-CB 3.99Å; M196-P206 HydrophobicContact CB-CG 4.25Å; M196-P206 HydrophobicContact CE-CB 4.24Å; M196-P206 HydrophobicContact CE-CG 4.41Å; M196-P206 HydrophobicContact CG-CB 3.98Å; M196-D208 HydrophobicContact CE-CB 3.88Å; M196-D208 HydrophobicContact SD-CB 3.87Å
197	E	96.6	Very high	95.7	Very high	87 Å²	87	57.6 Å²	57.6	41%	0.407	28%	0.28	S	S	.	.	H	α-helix	trans	-66.7	-42	177.8	-170.2	54.1	-149.4	0	0	111.8	Q193 L194 A199 R200 Q201	Q193-E197 PolarHBondContact O-N 2.95Å; L194-E197 PolarHBondContact O-N 3.47Å; E197-A199 VanDerWaalsContact C-N 3.28Å; E197-A199 PolarHBondContact O-N 3.21Å; E197-R200 WeakPolarHBondContact O-CB 3.46Å; E197-R200 PolarHBondContact O-N 3.27Å; E197-R200 VanDerWaalsContact O-N 3.08Å; E197-R200 IonicContact OE2-CZ 2.83Å; E197-R200 IonicContact OE2-NH1 2.68Å; E197-R200 PolarHBondContact OE2-NH1 3.34Å; E197-Q201 WeakPolarHBondContact O-CG 3.39Å; E197-Q201 PolarHBondContact O-N 3.35Å
198	L	95.8	Very high	95.7	Very high	5 Å²	5	55.5 Å²	55.5	3%	0.026	27%	0.269	C	S	.	.	H	α-helix	trans	-56.8	-43.7	172.2	-174.2	157.8	0	0	0	110.9	V49 F70 I104 F106 F162 L194 I195 R200 Q201 L202	V49-L198 HydrophobicContact CG2-CD1 4.23Å; F70-L198 HydrophobicContact CZ-CG 4.46Å; I104-L198 HydrophobicContact CD1-CD1 4.22Å; I104-L198 HydrophobicContact CG2-CD1 4.24Å; F106-L198 HydrophobicContact CE2-CD1 4.17Å; F106-L198 HydrophobicContact CE2-CD2 4.26Å; F106-L198 HydrophobicContact CZ-CD1 4.36Å; F106-L198 HydrophobicContact CZ-CD2 3.77Å; F162-L198 HydrophobicContact CE2-CD2 4.47Å; F162-L198 HydrophobicContact CZ-CD2 3.9Å; L194-L198 PolarHBondContact O-N 3.27Å; I195-L198 PolarHBondContact O-N 2.85Å; L198-R200 VanDerWaalsContact C-N 3.33Å; L198-R200 PolarHBondContact O-N 3.44Å; L198-Q201 PolarHBondContact O-N 3.35Å; L198-L202 HydrophobicContact CD2-CD1 3.45Å; L198-L202 VanDerWaalsContact CD2-CD1 3.45Å; L198-L202 HydrophobicContact CD2-CG 4.03Å; L198-L202 WeakPolarHBondContact O-CG 3.4Å; L198-L202 PolarHBondContact O-N 2.9Å
199	A	95.4	Very high	95.6	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.2	-38.4	176.1	0	0	0	0	0	112.7	F162 I184 I195 M196 E197 L202 N203 F204 P206	F162-A199 HydrophobicContact CE1-CB 4.24Å; F162-A199 HydrophobicContact CZ-CB 3.77Å; I184-A199 HydrophobicContact CD1-CB 4.25Å; I195-A199 WeakPolarHBondContact O-CB 3.31Å; I195-A199 PolarHBondContact O-N 3.18Å; M196-A199 WeakPolarHBondContact O-CB 3.44Å; M196-A199 PolarHBondContact O-N 3.25Å; E197-A199 VanDerWaalsContact C-N 3.28Å; E197-A199 PolarHBondContact O-N 3.21Å; A199-L202 CarbonylContact O-C 3.54Å; A199-L202 PolarHBondContact O-N 2.84Å; A199-N203 PolarHBondContact O-N 3.18Å; A199-F204 HydrophobicContact CB-CB 4.45Å; A199-F204 WeakPolarHBondContact O-CB 3.35Å; A199-F204 PolarHBondContact O-N 3.35Å; A199-P206 HydrophobicContact CB-CB 4.11Å
200	R	94.7	Very high	95.6	Very high	115 Å²	115	51.6 Å²	51.6	43%	0.434	25%	0.249	S	C	.	.	H	α-helix	trans	-64.3	-43.4	174.1	-64.6	-175.1	-169.7	101	4.3	111.9	M196 E197 L198 L202 N203 P206	M196-R200 WeakPolarHBondContact O-CG 3.26Å; M196-R200 PolarHBondContact O-N 2.94Å; M196-R200 VanDerWaalsContact O-N 3.08Å; E197-R200 WeakPolarHBondContact O-CB 3.46Å; E197-R200 PolarHBondContact O-N 3.27Å; E197-R200 VanDerWaalsContact O-N 3.08Å; E197-R200 IonicContact OE2-CZ 2.83Å; E197-R200 IonicContact OE2-NH1 2.68Å; E197-R200 PolarHBondContact OE2-NH1 3.34Å; L198-R200 VanDerWaalsContact C-N 3.33Å; L198-R200 PolarHBondContact O-N 3.44Å; R200-L202 PolarHBondContact O-N 3.13Å; R200-N203 WeakPolarHBondContact O-CA 3.27Å; R200-N203 PolarHBondContact O-N 3.25Å; R200-P206 HydrophobicContact CG-CG 3.7Å
201	Q	93.8	Very high	95.6	Very high	66 Å²	66	46.1 Å²	46.1	31%	0.308	23%	0.231	S	C	.	.	H	α-helix	trans	-63.7	-26.9	176.2	-68.2	175.6	-28.8	0	0	112.3	C68 F70 E197 L198 N203	C68-Q201 PolarHBondContact SG-O 3.42Å; F70-Q201 HydrophobicContact CE2-CB 4.07Å; F70-Q201 HydrophobicContact CZ-CB 3.81Å; E197-Q201 WeakPolarHBondContact O-CG 3.39Å; E197-Q201 PolarHBondContact O-N 3.35Å; L198-Q201 PolarHBondContact O-N 3.35Å; Q201-N203 PolarHBondContact O-N 3.26Å
202	L	92.4	Very high	95.7	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	18.5	169.2	-59.7	179.2	0	0	0	113.5	R64 L65 C68 F70 F162 L198 A199 R200 F204	R64-L202 HydrophobicContact CG-CB 4.43Å; R64-L202 HydrophobicContact CG-CD2 4.03Å; R64-L202 PolarHBondContact NE-O 2.99Å; R64-L202 VanDerWaalsContact NE-O 3.12Å; R64-L202 PolarHBondContact NH2-O 3.24Å; L65-L202 HydrophobicContact CD2-CD1 4.16Å; L65-L202 HydrophobicContact CD2-CD2 3.76Å; L65-L202 HydrophobicContact CD2-CG 4.46Å; L65-L202 HydrophobicContact CG-CD2 4.18Å; C68-L202 HydrophobicContact CB-CD2 3.9Å; F70-L202 HydrophobicContact CD2-CD2 4.19Å; F70-L202 HydrophobicContact CE2-CD2 3.9Å; F162-L202 HydrophobicContact CE1-CD1 3.97Å; F162-L202 HydrophobicContact CZ-CD1 4.2Å; L198-L202 HydrophobicContact CD2-CD1 3.45Å; L198-L202 VanDerWaalsContact CD2-CD1 3.45Å; L198-L202 HydrophobicContact CD2-CG 4.03Å; L198-L202 WeakPolarHBondContact O-CG 3.4Å; L198-L202 PolarHBondContact O-N 2.9Å; A199-L202 CarbonylContact O-C 3.54Å; A199-L202 PolarHBondContact O-N 2.84Å; R200-L202 PolarHBondContact O-N 3.13Å; L202-F204 HydrophobicContact CB-CD2 3.72Å; L202-F204 HydrophobicContact CB-CE2 4.03Å; L202-F204 VanDerWaalsContact O-CD2 3.28Å; L202-F204 WeakPolarHBondContact O-CD2 3.39Å; L202-F204 PolarHBondContact O-N 2.78Å
203	N	91.6	Very high	95.7	Very high	63 Å²	63	48 Å²	48	34%	0.337	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	35	-177.9	-49.1	-34.7	0	0	0	114.3	R64 I173 Y174 A199 R200 Q201	R64-N203 PolarHBondContact NH1-ND2 2.94Å; I173-N203 PolarHBondContact O-ND2 2.95Å; Y174-N203 HydrophobicContact CD1-CB 4.46Å; Y174-N203 HydrophobicContact CE1-CB 4.37Å; A199-N203 PolarHBondContact O-N 3.18Å; R200-N203 WeakPolarHBondContact O-CA 3.27Å; R200-N203 PolarHBondContact O-N 3.25Å; Q201-N203 PolarHBondContact O-N 3.26Å
204	F	93.1	Very high	95.7	Very high	7 Å²	7	45.6 Å²	45.6	3%	0.031	24%	0.239	C	C	.	.			trans	-103.2	163.4	169.2	-67.4	-70.9	0	0	0	111.2	F162 I165 M170 P175 V182 A199 L202 P206	F162-F204 HydrophobicContact CE1-CD2 4.06Å; F162-F204 HydrophobicContact CE1-CE2 4.38Å; I165-F204 HydrophobicContact CD1-CD1 4.15Å; I165-F204 HydrophobicContact CD1-CE1 3.98Å; I165-F204 HydrophobicContact CG1-CE1 4.2Å; I165-F204 HydrophobicContact CG2-CE1 3.94Å; I165-F204 HydrophobicContact CG2-CZ 3.93Å; M170-F204 HydrophobicContact CE-CE2 4.42Å; M170-F204 HydrophobicContact CE-CZ 4.36Å; M170-F204 HydrophobicContact SD-CE2 3.7Å; M170-F204 HydrophobicContact SD-CZ 3.74Å; P175-F204 HydrophobicContact CG-CD1 4.4Å; P175-F204 HydrophobicContact CG-CE1 3.87Å; V182-F204 HydrophobicContact CG2-CB 3.6Å; V182-F204 HydrophobicContact CG2-CD1 4.03Å; V182-F204 HydrophobicContact CG2-CD2 4.23Å; V182-F204 HydrophobicContact CG2-CG 3.71Å; A199-F204 HydrophobicContact CB-CB 4.45Å; A199-F204 WeakPolarHBondContact O-CB 3.35Å; A199-F204 PolarHBondContact O-N 3.35Å; L202-F204 HydrophobicContact CB-CD2 3.72Å; L202-F204 HydrophobicContact CB-CE2 4.03Å; L202-F204 VanDerWaalsContact O-CD2 3.28Å; L202-F204 WeakPolarHBondContact O-CD2 3.39Å; L202-F204 PolarHBondContact O-N 2.78Å; F204-P206 VanDerWaalsContact O-CD 3.22Å; F204-P206 WeakPolarHBondContact O-CD 3.49Å
205	Q	93.4	Very high	95.7	Very high	114 Å²	114	41.9 Å²	41.9	53%	0.533	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	97	174.9	-66	-179.6	-5.4	0	0	109.1	T180 Q181 V182	T180-Q205 PolarHBondContact O-N 3.34Å; Q181-Q205 CarbonylContact C-O 3.45Å; Q181-Q205 VanDerWaalsContact CA-O 3.29Å; Q181-Q205 WeakPolarHBondContact CA-O 3.47Å; Q181-Q205 HydrophobicContact CG-CB 4.31Å; V182-Q205 PolarHBondContact N-O 3.12Å
206	P	95.9	Very high	95.6	Very high	24 Å²	24	46.8 Å²	46.8	16%	0.156	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	139.5	178.4	29.6	-36.3	0	0	0	111.4	V182 I184 M196 A199 R200 F204	V182-P206 CarbonylContact O-C 3.59Å; V182-P206 WeakPolarHBondContact O-CA 3.11Å; I184-P206 HydrophobicContact CD1-CB 3.88Å; M196-P206 HydrophobicContact CB-CB 3.99Å; M196-P206 HydrophobicContact CB-CG 4.25Å; M196-P206 HydrophobicContact CE-CB 4.24Å; M196-P206 HydrophobicContact CE-CG 4.41Å; M196-P206 HydrophobicContact CG-CB 3.98Å; A199-P206 HydrophobicContact CB-CB 4.11Å; R200-P206 HydrophobicContact CG-CG 3.7Å; F204-P206 VanDerWaalsContact O-CD 3.22Å; F204-P206 WeakPolarHBondContact O-CD 3.49Å
207	V	96.4	Very high	95.5	Very high	44 Å²	44	52.5 Å²	52.5	27%	0.267	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	116.5	172.5	-178.5	0	0	0	0	107.9	Q181 V182 F183 I184 M209	Q181-V207 HydrophobicContact CB-CG2 4.4Å; Q181-V207 HydrophobicContact CG-CG2 4.44Å; V182-V207 PolarHBondContact O-N 3.29Å; F183-V207 HydrophobicContact CD1-CB 3.84Å; F183-V207 HydrophobicContact CD1-CG1 3.87Å; F183-V207 HydrophobicContact CD1-CG2 4.43Å; F183-V207 HydrophobicContact CE1-CB 4.16Å; F183-V207 HydrophobicContact CE1-CG1 4.02Å; F183-V207 HydrophobicContact CE1-CG2 4.32Å; F183-V207 HydrophobicContact CG-CB 4.43Å; I184-V207 PolarHBondContact N-O 2.9Å; V207-M209 HydrophobicContact CG1-SD 4.37Å; V207-M209 PolarHBondContact O-N 3.33Å
208	D	97.1	Very high	95.4	Very high	70 Å²	70	48.4 Å²	48.4	37%	0.374	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	115.1	174.7	-169.9	-7.8	0	0	0	109.5	R192 M196 G210	R192-D208 WeakPolarHBondContact CD-OD1 3.27Å; R192-D208 IonicContact CZ-OD1 3.47Å; R192-D208 IonicContact CZ-OD2 3.98Å; R192-D208 IonicContact NE-OD1 3.68Å; R192-D208 PolarHBondContact NE-OD1 2.83Å; R192-D208 IonicContact NE-OD2 3.33Å; R192-D208 PolarHBondContact NE-OD2 3.47Å; R192-D208 IonicContact NH2-OD1 2.77Å; R192-D208 IonicContact NH2-OD2 2.65Å; R192-D208 PolarHBondContact NH2-OD2 3Å; M196-D208 HydrophobicContact CE-CB 3.88Å; M196-D208 HydrophobicContact SD-CB 3.87Å; D208-G210 WeakPolarHBondContact OD1-CA 3.37Å; D208-G210 PolarHBondContact OD1-N 3.34Å
209	M	97	Very high	95.4	Very high	42 Å²	42	48.3 Å²	48.3	21%	0.207	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-9.6	176	-68.6	-67.4	-80.6	0	0	112.5	F183 I184 C185 V207 L214 Y217 I218	F183-M209 HydrophobicContact CB-CG 3.89Å; F183-M209 HydrophobicContact CD1-CE 4.36Å; F183-M209 HydrophobicContact CD1-CG 3.84Å; F183-M209 HydrophobicContact CD1-SD 3.64Å; F183-M209 HydrophobicContact CE1-SD 4.3Å; F183-M209 HydrophobicContact CG-CG 4.35Å; I184-M209 PolarHBondContact O-N 3.15Å; C185-M209 HydrophobicContact CB-CB 4.08Å; V207-M209 HydrophobicContact CG1-SD 4.37Å; V207-M209 PolarHBondContact O-N 3.33Å; M209-L214 WeakPolarHBondContact O-CD1 3.41Å; M209-Y217 HydrophobicContact CE-CD1 3.46Å; M209-Y217 VanDerWaalsContact CE-CD1 3.46Å; M209-Y217 HydrophobicContact CE-CE1 3.65Å; M209-I218 HydrophobicContact CB-CD1 3.95Å; M209-I218 HydrophobicContact CE-CG1 4.35Å; M209-I218 HydrophobicContact CG-CD1 3.85Å; M209-I218 HydrophobicContact CG-CG1 4.22Å
210	G	96.6	Very high	95.4	Very high	14 Å²	14	49.3 Å²	49.3	14%	0.144	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	95.2	-136.3	177.7	0	0	0	0	0	114.3	C185 S186 R192 D208	C185-G210 VanDerWaalsContact CA-O 3.29Å; C185-G210 WeakPolarHBondContact CA-O 3.39Å; C185-G210 VanDerWaalsContact CB-O 3.3Å; C185-G210 WeakPolarHBondContact CB-O 3.22Å; S186-G210 PolarHBondContact N-O 3.31Å; R192-G210 VanDerWaalsContact NH1-C 3.29Å; R192-G210 PolarHBondContact NH1-O 2.97Å; D208-G210 WeakPolarHBondContact OD1-CA 3.37Å; D208-G210 PolarHBondContact OD1-N 3.34Å
211	P	97.7	Very high	95.2	Very high	59 Å²	59	46.1 Å²	46.1	38%	0.383	24%	0.236	S	C	.	.	S	Bend	trans	-68.7	161.4	-171.8	29.8	-37.3	0	0	0	113.5	C185 S213 L214	C185-P211 WeakPolarHBondContact CB-O 3.33Å; P211-S213 PolarHBondContact O-N 3.34Å; P211-S213 VanDerWaalsContact O-N 3.15Å; P211-L214 HydrophobicContact CG-CD1 4.44Å; P211-L214 PolarHBondContact O-N 2.97Å; P211-L214 VanDerWaalsContact O-N 3.11Å
212	L	97.7	Very high	95.1	Very high	7 Å²	7	45.8 Å²	45.8	4%	0.037	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-63	-23.3	-176.3	-166	68.7	0	0	0	112.8	A146 A150 V158 D187 L214 S215	A146-L212 HydrophobicContact CB-CD1 3.92Å; A150-L212 HydrophobicContact CB-CD2 3.74Å; V158-L212 HydrophobicContact CB-CD2 4.37Å; V158-L212 HydrophobicContact CG1-CD1 4.23Å; V158-L212 HydrophobicContact CG1-CD2 4.44Å; D187-L212 WeakPolarHBondContact OD1-CB 3.33Å; D187-L212 PolarHBondContact OD1-N 3.08Å; D187-L212 WeakPolarHBondContact OD2-CB 3.32Å; L212-L214 PolarHBondContact O-N 2.85Å; L212-L214 VanDerWaalsContact O-N 3.09Å; L212-S215 WeakPolarHBondContact O-CB 3.44Å; L212-S215 PolarHBondContact O-N 3.49Å; L212-S215 PolarHBondContact O-OG 3.01Å
213	S	96.8	Very high	95	Very high	70 Å²	70	48.1 Å²	48.1	49%	0.49	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-58.5	-20.4	174.6	59.3	0	0	0	0	114.1	P211 S215	P211-S213 PolarHBondContact O-N 3.34Å; P211-S213 VanDerWaalsContact O-N 3.15Å; S213-S215 VanDerWaalsContact C-N 3.32Å
214	L	96.9	Very high	94.9	Very high	71 Å²	71	49.2 Å²	49.2	37%	0.372	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-84.9	-2.6	175	-71.2	171.5	0	0	0	113.9	M209 P211 L212 R216 Y217 I218	M209-L214 WeakPolarHBondContact O-CD1 3.41Å; P211-L214 HydrophobicContact CG-CD1 4.44Å; P211-L214 PolarHBondContact O-N 2.97Å; P211-L214 VanDerWaalsContact O-N 3.11Å; L212-L214 PolarHBondContact O-N 2.85Å; L212-L214 VanDerWaalsContact O-N 3.09Å; L214-R216 PolarHBondContact O-N 3.48Å; L214-Y217 WeakPolarHBondContact O-CB 3.44Å; L214-Y217 PolarHBondContact O-N 3.49Å; L214-Y217 VanDerWaalsContact O-N 3.07Å; L214-I218 PolarHBondContact O-N 2.86Å
215	S	96.9	Very high	94.8	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-57.5	-36.1	176.1	55	0	0	0	0	112.8	S144 C185 L212 S213 Y217 I218 E219	S144-S215 VanDerWaalsContact CB-OG 3.31Å; S144-S215 WeakPolarHBondContact CB-OG 3.47Å; S144-S215 PolarHBondContact OG-OG 3.18Å; C185-S215 VanDerWaalsContact SG-CA 3.51Å; C185-S215 PolarHBondContact SG-N 3.23Å; C185-S215 VanDerWaalsContact SG-N 3.4Å; L212-S215 WeakPolarHBondContact O-CB 3.44Å; L212-S215 PolarHBondContact O-N 3.49Å; L212-S215 PolarHBondContact O-OG 3.01Å; S213-S215 VanDerWaalsContact C-N 3.32Å; S215-Y217 VanDerWaalsContact C-N 3.28Å; S215-Y217 PolarHBondContact O-N 3.04Å; S215-I218 PolarHBondContact O-N 3.31Å; S215-I218 VanDerWaalsContact O-N 3.14Å; S215-E219 WeakPolarHBondContact O-CB 3.32Å; S215-E219 WeakPolarHBondContact O-CG 3.19Å; S215-E219 PolarHBondContact O-N 3.47Å
216	R	95.5	Very high	94.7	Very high	102 Å²	102	56.3 Å²	56.3	39%	0.385	29%	0.292	S	S	.	.	H	α-helix	trans	-57.9	-40.3	175.4	-171.6	179.6	-53.9	-163.4	1	112.6	P142 E147 L214 N220	P142-R216 PolarHBondContact O-NH1 2.86Å; P142-R216 VanDerWaalsContact O-NH1 3.11Å; P142-R216 PolarHBondContact O-NH2 3.39Å; E147-R216 IonicContact OE2-NH2 3.83Å; E147-R216 PolarHBondContact OE2-NH2 3.22Å; L214-R216 PolarHBondContact O-N 3.48Å; R216-N220 VanDerWaalsContact O-CG 3.29Å; R216-N220 PolarHBondContact O-N 3.02Å; R216-N220 PolarHBondContact O-ND2 3.48Å
217	Y	94.4	Very high	94.4	Very high	143 Å²	143	58.7 Å²	58.7	56%	0.561	31%	0.307	S	S	*	.	H	α-helix	trans	-64.7	-47.6	177	178.6	-97.1	0	0	0	110	M209 L214 S215 E219 N220 I221	M209-Y217 HydrophobicContact CE-CD1 3.46Å; M209-Y217 VanDerWaalsContact CE-CD1 3.46Å; M209-Y217 HydrophobicContact CE-CE1 3.65Å; L214-Y217 WeakPolarHBondContact O-CB 3.44Å; L214-Y217 PolarHBondContact O-N 3.49Å; L214-Y217 VanDerWaalsContact O-N 3.07Å; S215-Y217 VanDerWaalsContact C-N 3.28Å; S215-Y217 PolarHBondContact O-N 3.04Å; Y217-E219 VanDerWaalsContact C-N 3.33Å; Y217-E219 PolarHBondContact O-N 3.45Å; Y217-N220 PolarHBondContact O-N 3.33Å; Y217-I221 HydrophobicContact CD1-CD1 4.2Å; Y217-I221 HydrophobicContact CE1-CD1 3.91Å; Y217-I221 HydrophobicContact CE1-CG1 4.3Å; Y217-I221 WeakPolarHBondContact O-CG1 3.41Å; Y217-I221 PolarHBondContact O-N 3.28Å
218	I	95.6	Very high	94.1	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.5	-40	178.8	-60.4	175.4	0	0	0	112	K160 N163 I164 F183 C185 M209 L214 S215 N220 I221 P222	K160-I218 HydrophobicContact CG-CB 4.35Å; K160-I218 HydrophobicContact CG-CD1 4.37Å; K160-I218 HydrophobicContact CG-CG2 4.09Å; N163-I218 PolarHBondContact ND2-O 2.97Å; N163-I218 VanDerWaalsContact ND2-O 3.1Å; N163-I218 WeakPolarHBondContact OD1-CG2 3.48Å; I164-I218 HydrophobicContact CD1-CG2 4.47Å; F183-I218 HydrophobicContact CB-CD1 3.97Å; F183-I218 HydrophobicContact CB-CG1 4.06Å; F183-I218 HydrophobicContact CB-CG2 4.16Å; C185-I218 HydrophobicContact CB-CD1 4.05Å; M209-I218 HydrophobicContact CB-CD1 3.95Å; M209-I218 HydrophobicContact CE-CG1 4.35Å; M209-I218 HydrophobicContact CG-CD1 3.85Å; M209-I218 HydrophobicContact CG-CG1 4.22Å; L214-I218 PolarHBondContact O-N 2.86Å; S215-I218 PolarHBondContact O-N 3.31Å; S215-I218 VanDerWaalsContact O-N 3.14Å; I218-N220 VanDerWaalsContact C-N 3.31Å; I218-N220 PolarHBondContact O-N 3.23Å; I218-I221 PolarHBondContact O-N 2.83Å; I218-P222 WeakPolarHBondContact O-CD 3.32Å
219	E	95.8	Very high	94	Very high	3 Å²	3	58.7 Å²	58.7	1%	0.014	31%	0.306	C	S	.	.	H	α-helix	trans	-66.2	-30.5	177.7	-77.5	174	-164.7	0	0	113.7	S144 N145 A146 K160 S215 Y217 P222	S144-E219 WeakPolarHBondContact CA-OE2 3.47Å; S144-E219 WeakPolarHBondContact CB-OE2 3.36Å; N145-E219 WeakPolarHBondContact CB-OE1 3.21Å; N145-E219 VanDerWaalsContact N-CD 3.34Å; N145-E219 PolarHBondContact N-OE1 3.1Å; N145-E219 PolarHBondContact N-OE2 3.21Å; A146-E219 PolarHBondContact N-OE1 2.96Å; K160-E219 HydrophobicContact CD-CG 4.21Å; K160-E219 VanDerWaalsContact NZ-CD 3.33Å; K160-E219 IonicContact NZ-OE1 2.74Å; K160-E219 PolarHBondContact NZ-OE1 3.32Å; S215-E219 WeakPolarHBondContact O-CB 3.32Å; S215-E219 WeakPolarHBondContact O-CG 3.19Å; S215-E219 PolarHBondContact O-N 3.47Å; Y217-E219 VanDerWaalsContact C-N 3.33Å; Y217-E219 PolarHBondContact O-N 3.45Å; E219-P222 WeakPolarHBondContact O-CD 3.49Å
220	N	93.6	Very high	93.8	Very high	21 Å²	21	63.9 Å²	63.9	11%	0.112	33%	0.328	C	S	.	.	H	α-helix	trans	-81.6	-23.8	-178.6	-76.6	-27.9	0	0	0	112.9	R216 Y217 I218 V223 Q224	R216-N220 VanDerWaalsContact O-CG 3.29Å; R216-N220 PolarHBondContact O-N 3.02Å; R216-N220 PolarHBondContact O-ND2 3.48Å; Y217-N220 PolarHBondContact O-N 3.33Å; I218-N220 VanDerWaalsContact C-N 3.31Å; I218-N220 PolarHBondContact O-N 3.23Å; N220-V223 PolarHBondContact O-N 3.3Å; N220-Q224 VanDerWaalsContact O-CG 3.32Å; N220-Q224 WeakPolarHBondContact O-CG 3.42Å; N220-Q224 PolarHBondContact O-N 3.45Å
221	I	92.2	Very high	93.6	Very high	49 Å²	49	65.4 Å²	65.4	25%	0.251	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-51.8	-54.9	-179.3	-65.2	167	0	0	0	112.5	I164 Y217 I218 V223 Q224	I164-I221 HydrophobicContact CD1-CB 4Å; I164-I221 HydrophobicContact CD1-CD1 3.66Å; I164-I221 HydrophobicContact CD1-CG1 4.44Å; I164-I221 HydrophobicContact CD1-CG2 3.87Å; Y217-I221 HydrophobicContact CD1-CD1 4.2Å; Y217-I221 HydrophobicContact CE1-CD1 3.91Å; Y217-I221 HydrophobicContact CE1-CG1 4.3Å; Y217-I221 WeakPolarHBondContact O-CG1 3.41Å; Y217-I221 PolarHBondContact O-N 3.28Å; I218-I221 PolarHBondContact O-N 2.83Å; I221-V223 PolarHBondContact O-N 3.04Å; I221-Q224 PolarHBondContact O-N 3.44Å
222	P	91.1	Very high	93.5	Very high	58 Å²	58	62.7 Å²	62.7	38%	0.377	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-70.8	-16.9	-175.4	26.9	-34.2	0	0	0	113.9	N134 I218 E219	N134-P222 WeakPolarHBondContact OD1-CG 3.33Å; I218-P222 WeakPolarHBondContact O-CD 3.32Å; E219-P222 WeakPolarHBondContact O-CD 3.49Å
223	V	90.6	Very high	93.5	Very high	49 Å²	49	65.7 Å²	65.7	30%	0.297	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-88.9	-22.2	-179.2	-172.7	0	0	0	0	111.6	N135 V138 N220 I221	N135-V223 VanDerWaalsContact O-CG2 3.32Å; N135-V223 WeakPolarHBondContact O-CG2 3.26Å; V138-V223 HydrophobicContact CG2-CB 4.27Å; V138-V223 HydrophobicContact CG2-CG1 3.97Å; N220-V223 PolarHBondContact O-N 3.3Å; I221-V223 PolarHBondContact O-N 3.04Å
224	Q	89.8	Confident	93.4	Very high	87 Å²	87	68.2 Å²	68.2	41%	0.407	35%	0.351	S	S	.	.			trans	-85.5	125.3	-176.8	-72.8	178.3	3.6	0	0	111.9	V138 N220 I221 P227	V138-Q224 HydrophobicContact CG2-CG 4.12Å; N220-Q224 VanDerWaalsContact O-CG 3.32Å; N220-Q224 WeakPolarHBondContact O-CG 3.42Å; N220-Q224 PolarHBondContact O-N 3.45Å; I221-Q224 PolarHBondContact O-N 3.44Å; Q224-P227 HydrophobicContact CB-CG 4.28Å
225	L	90.6	Very high	93.4	Very high	132 Å²	132	66.4 Å²	66.4	69%	0.691	35%	0.346	S	S	*	.	S	Bend	trans	-104.8	110.5	170	-172.3	66.9	0	0	0	110
226	F	91.3	Very high	93.4	Very high	138 Å²	138	66.8 Å²	66.8	61%	0.605	35%	0.35	S	S	*	.	S	Bend	trans	42.3	56	176.5	-58	-68.7	0	0	0	115.4	G228 W229	F226-G228 VanDerWaalsContact C-N 3.32Å; F226-G228 PolarHBondContact O-N 3.44Å; F226-W229 HydrophobicContact CB-CB 3.96Å; F226-W229 HydrophobicContact CB-CG 4.17Å; F226-W229 AromaticContact CD1-CD1 3.88Å; F226-W229 PolarHBondContact O-N 3Å
227	P	89	Confident	93.5	Very high	74 Å²	74	65.4 Å²	65.4	48%	0.481	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-57.8	-41.7	-173.3	24.2	-34.7	0	0	0	113	Q224 W229	Q224-P227 HydrophobicContact CB-CG 4.28Å; P227-W229 VanDerWaalsContact C-N 3.28Å; P227-W229 PolarHBondContact O-N 2.92Å
228	G	89.9	Confident	93.7	Very high	29 Å²	29	61.2 Å²	61.2	30%	0.299	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-75.2	-7.2	178.9	0	0	0	0	0	115.5	F226 Q321	F226-G228 VanDerWaalsContact C-N 3.32Å; F226-G228 PolarHBondContact O-N 3.44Å; G228-Q321 WeakPolarHBondContact O-CG 3.43Å
229	W	94.8	Very high	93.8	Very high	85 Å²	85	63 Å²	63	32%	0.322	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-99.3	-17.1	-178.4	-68.1	84.4	0	0	0	113.6	F226 P227 G231 P232 V233 Q321 L324 I325	F226-W229 HydrophobicContact CB-CB 3.96Å; F226-W229 HydrophobicContact CB-CG 4.17Å; F226-W229 AromaticContact CD1-CD1 3.88Å; F226-W229 PolarHBondContact O-N 3Å; P227-W229 VanDerWaalsContact C-N 3.28Å; P227-W229 PolarHBondContact O-N 2.92Å; W229-G231 PolarHBondContact O-N 3.41Å; W229-P232 WeakPolarHBondContact O-CD 3.42Å; W229-V233 HydrophobicContact CB-CG2 4.22Å; W229-V233 HydrophobicContact CE3-CG2 4.43Å; W229-V233 VanDerWaalsContact O-CB 3.31Å; W229-V233 WeakPolarHBondContact O-CB 3.31Å; W229-V233 VanDerWaalsContact O-CG2 3.23Å; W229-V233 WeakPolarHBondContact O-CG2 3.46Å; W229-V233 PolarHBondContact O-N 3.28Å; W229-Q321 HydrophobicContact CD2-CB 4.15Å; W229-Q321 HydrophobicContact CD2-CG 3.68Å; W229-Q321 HydrophobicContact CE3-CB 3.99Å; W229-Q321 HydrophobicContact CE3-CG 4.05Å; W229-Q321 HydrophobicContact CG-CG 4.05Å; W229-Q321 HydrophobicContact CH2-CG 4.44Å; W229-Q321 HydrophobicContact CZ2-CG 4.11Å; W229-Q321 HydrophobicContact CZ3-CB 4.2Å; W229-Q321 HydrophobicContact CZ3-CG 4.41Å; W229-L324 HydrophobicContact CH2-CB 3.98Å; W229-L324 HydrophobicContact CH2-CD1 3.82Å; W229-L324 HydrophobicContact CZ2-CD1 4.14Å; W229-L324 HydrophobicContact CZ3-CB 4.47Å; W229-I325 HydrophobicContact CE3-CD1 4.25Å; W229-I325 HydrophobicContact CE3-CG1 4.33Å; W229-I325 HydrophobicContact CZ3-CD1 4.29Å; W229-I325 HydrophobicContact CZ3-CG1 3.88Å
230	K	92.4	Very high	93.9	Very high	151 Å²	151	64.7 Å²	64.7	66%	0.657	37%	0.369	S	S	*	.	H	α-helix	trans	-55.6	-51	-174.4	-67.2	-177.3	178.1	-178.8	0	112.8	L234	K230-L234 VanDerWaalsContact O-CB 3.27Å; K230-L234 WeakPolarHBondContact O-CB 3.28Å; K230-L234 PolarHBondContact O-N 3.16Å
231	G	92.9	Very high	94.1	Very high	45 Å²	45	69.4 Å²	69.4	46%	0.464	39%	0.393	S	S	.	.	H	α-helix	trans	-62.6	-55	178.4	0	0	0	0	0	112.9	W229 V233 L234 A235	W229-G231 PolarHBondContact O-N 3.41Å; G231-V233 PolarHBondContact O-N 3.28Å; G231-L234 PolarHBondContact O-N 2.97Å; G231-A235 WeakPolarHBondContact O-CB 3.35Å; G231-A235 PolarHBondContact O-N 3.18Å
232	P	96.1	Very high	94.3	Very high	3 Å²	3	72.7 Å²	72.7	2%	0.019	41%	0.405	C	S	.	.	H	α-helix	trans	-55.8	-43.6	177.2	-31.9	38.4	0	0	0	114.8	W229 A235 A236 Q321 L322 I325	W229-P232 WeakPolarHBondContact O-CD 3.42Å; P232-A235 PolarHBondContact O-N 2.9Å; P232-A236 WeakPolarHBondContact O-CB 3.45Å; P232-A236 PolarHBondContact O-N 2.68Å; P232-Q321 HydrophobicContact CB-CB 3.88Å; P232-Q321 HydrophobicContact CG-CB 3.64Å; P232-L322 HydrophobicContact CB-CD2 3.84Å; P232-L322 HydrophobicContact CB-CG 4.11Å; P232-L322 HydrophobicContact CG-CD2 4.29Å; P232-L322 HydrophobicContact CG-CG 4.16Å; P232-I325 HydrophobicContact CB-CD1 3.67Å
233	V	96.9	Very high	94.5	Very high	69 Å²	69	70.5 Å²	70.5	42%	0.418	39%	0.39	S	S	.	.	H	α-helix	trans	-66.1	-44.6	177.6	171.3	0	0	0	0	110.5	W229 G231 A235 A236 V237 I325	W229-V233 HydrophobicContact CB-CG2 4.22Å; W229-V233 HydrophobicContact CE3-CG2 4.43Å; W229-V233 VanDerWaalsContact O-CB 3.31Å; W229-V233 WeakPolarHBondContact O-CB 3.31Å; W229-V233 VanDerWaalsContact O-CG2 3.23Å; W229-V233 WeakPolarHBondContact O-CG2 3.46Å; W229-V233 PolarHBondContact O-N 3.28Å; G231-V233 PolarHBondContact O-N 3.28Å; V233-A235 VanDerWaalsContact C-N 3.34Å; V233-A235 PolarHBondContact O-N 2.97Å; V233-A236 PolarHBondContact O-N 3.37Å; V233-V237 HydrophobicContact CG1-CG2 4.34Å; V233-V237 WeakPolarHBondContact O-CB 3.06Å; V233-V237 VanDerWaalsContact O-CG2 3.31Å; V233-V237 WeakPolarHBondContact O-CG2 3.24Å; V233-V237 PolarHBondContact O-N 3.15Å; V233-I325 HydrophobicContact CG2-CD1 4.04Å
234	L	96.2	Very high	94.8	Very high	123 Å²	123	71.8 Å²	71.8	64%	0.644	39%	0.392	S	S	*	.	H	α-helix	trans	-60.1	-44.4	176.4	-178.5	64.1	0	0	0	111.5	K230 G231 V237 A238	K230-L234 VanDerWaalsContact O-CB 3.27Å; K230-L234 WeakPolarHBondContact O-CB 3.28Å; K230-L234 PolarHBondContact O-N 3.16Å; G231-L234 PolarHBondContact O-N 2.97Å; L234-V237 PolarHBondContact O-N 2.92Å; L234-A238 VanDerWaalsContact O-CB 3.29Å; L234-A238 WeakPolarHBondContact O-CB 3.46Å; L234-A238 PolarHBondContact O-N 2.84Å
235	A	95.9	Very high	95.1	Very high	33 Å²	33	69 Å²	69	27%	0.273	39%	0.386	S	S	.	.	H	α-helix	trans	-61.5	-45.7	176.6	0	0	0	0	0	111.8	G231 P232 V233 A238 L239	G231-A235 WeakPolarHBondContact O-CB 3.35Å; G231-A235 PolarHBondContact O-N 3.18Å; P232-A235 PolarHBondContact O-N 2.9Å; V233-A235 VanDerWaalsContact C-N 3.34Å; V233-A235 PolarHBondContact O-N 2.97Å; A235-A238 PolarHBondContact O-N 3.25Å; A235-L239 WeakPolarHBondContact O-CB 3.28Å; A235-L239 VanDerWaalsContact O-CG 3.26Å; A235-L239 WeakPolarHBondContact O-CG 3.29Å; A235-L239 PolarHBondContact O-N 3.37Å
236	A	97.8	Very high	95.3	Very high	8 Å²	8	64.1 Å²	64.1	7%	0.066	36%	0.359	C	S	.	.	H	α-helix	trans	-62.9	-44.1	178.1	0	0	0	0	0	112.4	P232 V233 S240 L283 I325	P232-A236 WeakPolarHBondContact O-CB 3.45Å; P232-A236 PolarHBondContact O-N 2.68Å; V233-A236 PolarHBondContact O-N 3.37Å; A236-S240 VanDerWaalsContact O-CB 3.28Å; A236-S240 WeakPolarHBondContact O-CB 3.36Å; A236-S240 PolarHBondContact O-N 3.16Å; A236-S240 PolarHBondContact O-OG 3.11Å; A236-L283 HydrophobicContact CB-CD1 3.89Å; A236-L283 HydrophobicContact CB-CD2 4.44Å; A236-I325 HydrophobicContact CB-CD1 4.46Å; A236-I325 HydrophobicContact CB-CG2 3.73Å
237	V	97.9	Very high	95.4	Very high	74 Å²	74	57.6 Å²	57.6	45%	0.448	33%	0.33	S	S	.	.	H	α-helix	trans	-63.3	-46.9	176	171.1	0	0	0	0	111.2	V233 L234 S240 I241	V233-V237 HydrophobicContact CG1-CG2 4.34Å; V233-V237 WeakPolarHBondContact O-CB 3.06Å; V233-V237 VanDerWaalsContact O-CG2 3.31Å; V233-V237 WeakPolarHBondContact O-CG2 3.24Å; V233-V237 PolarHBondContact O-N 3.15Å; L234-V237 PolarHBondContact O-N 2.92Å; V237-S240 PolarHBondContact O-N 2.94Å; V237-I241 HydrophobicContact CG1-CD1 3.82Å; V237-I241 HydrophobicContact CG1-CG1 4.46Å; V237-I241 WeakPolarHBondContact O-CG1 3.27Å; V237-I241 PolarHBondContact O-N 3.35Å
238	A	97.9	Very high	95.7	Very high	54 Å²	54	56.8 Å²	56.8	45%	0.446	32%	0.319	S	S	.	.	H	α-helix	trans	-61.2	-46.6	179	0	0	0	0	0	112	L234 A235 S240 I241 F242	L234-A238 VanDerWaalsContact O-CB 3.29Å; L234-A238 WeakPolarHBondContact O-CB 3.46Å; L234-A238 PolarHBondContact O-N 2.84Å; A235-A238 PolarHBondContact O-N 3.25Å; A238-S240 VanDerWaalsContact C-N 3.31Å; A238-S240 PolarHBondContact O-N 3.22Å; A238-I241 PolarHBondContact O-N 3.4Å; A238-F242 WeakPolarHBondContact O-CB 3.36Å; A238-F242 PolarHBondContact O-N 3.12Å
239	L	97.3	Very high	95.9	Very high	39 Å²	39	58.2 Å²	58.2	20%	0.204	32%	0.322	C	S	.	.	H	α-helix	trans	-62.5	-38.8	175.3	-71.6	172	0	0	0	111.6	A235 F242 F243 V279 T282 L283 L286	A235-L239 WeakPolarHBondContact O-CB 3.28Å; A235-L239 VanDerWaalsContact O-CG 3.26Å; A235-L239 WeakPolarHBondContact O-CG 3.29Å; A235-L239 PolarHBondContact O-N 3.37Å; L239-F242 PolarHBondContact O-N 3.31Å; L239-F243 HydrophobicContact CB-CD2 4.42Å; L239-F243 HydrophobicContact CD2-CE2 4.14Å; L239-F243 WeakPolarHBondContact O-CB 3.22Å; L239-F243 VanDerWaalsContact O-CD2 3.23Å; L239-F243 WeakPolarHBondContact O-CD2 3.48Å; L239-F243 PolarHBondContact O-N 3.09Å; L239-V279 HydrophobicContact CB-CG1 4.12Å; L239-V279 HydrophobicContact CB-CG2 4.34Å; L239-T282 HydrophobicContact CD1-CG2 3.91Å; L239-T282 HydrophobicContact CD2-CG2 4.27Å; L239-L283 HydrophobicContact CD1-CD2 3.88Å; L239-L283 HydrophobicContact CD1-CG 4.32Å; L239-L286 HydrophobicContact CD1-CD1 4.15Å
240	S	97.6	Very high	95.7	Very high	37 Å²	37	54.9 Å²	54.9	26%	0.259	31%	0.309	S	S	.	.	H	α-helix	trans	-65.2	-45.3	178.3	-59.3	0	0	0	0	111.7	A236 V237 A238 F242 F244	A236-S240 VanDerWaalsContact O-CB 3.28Å; A236-S240 WeakPolarHBondContact O-CB 3.36Å; A236-S240 PolarHBondContact O-N 3.16Å; A236-S240 PolarHBondContact O-OG 3.11Å; V237-S240 PolarHBondContact O-N 2.94Å; A238-S240 VanDerWaalsContact C-N 3.31Å; A238-S240 PolarHBondContact O-N 3.22Å; S240-F242 VanDerWaalsContact C-N 3.34Å; S240-F242 PolarHBondContact O-N 3.41Å; S240-F244 WeakPolarHBondContact O-CB 3.43Å; S240-F244 PolarHBondContact O-N 2.94Å
241	I	97.6	Very high	95.5	Very high	120 Å²	120	48.5 Å²	48.5	62%	0.615	28%	0.283	S	S	*	.	H	α-helix	trans	-60.7	-45.8	175.4	-68.1	167.2	0	0	0	110.3	V237 A238 G245	V237-I241 HydrophobicContact CG1-CD1 3.82Å; V237-I241 HydrophobicContact CG1-CG1 4.46Å; V237-I241 WeakPolarHBondContact O-CG1 3.27Å; V237-I241 PolarHBondContact O-N 3.35Å; A238-I241 PolarHBondContact O-N 3.4Å; I241-G245 PolarHBondContact O-N 2.9Å
242	F	96.8	Very high	95.5	Very high	119 Å²	119	46.4 Å²	46.4	52%	0.522	26%	0.261	S	S	.	.	H	α-helix	trans	-60.5	-54.5	179.6	174.5	-99.8	0	0	0	112.1	A238 L239 S240 G245 Y246	A238-F242 WeakPolarHBondContact O-CB 3.36Å; A238-F242 PolarHBondContact O-N 3.12Å; L239-F242 PolarHBondContact O-N 3.31Å; S240-F242 VanDerWaalsContact C-N 3.34Å; S240-F242 PolarHBondContact O-N 3.41Å; F242-G245 PolarHBondContact O-N 3.24Å; F242-Y246 WeakPolarHBondContact O-CB 3.29Å; F242-Y246 PolarHBondContact O-N 3.32Å
243	F	96.6	Very high	95.3	Very high	11 Å²	11	48.8 Å²	48.8	5%	0.048	27%	0.273	C	S	.	.	H	α-helix	trans	-72.3	-30.2	-176.9	-76.2	-64.2	0	0	0	113.4	L239 S247 T275 T278 V279 V451	L239-F243 HydrophobicContact CB-CD2 4.42Å; L239-F243 HydrophobicContact CD2-CE2 4.14Å; L239-F243 WeakPolarHBondContact O-CB 3.22Å; L239-F243 VanDerWaalsContact O-CD2 3.23Å; L239-F243 WeakPolarHBondContact O-CD2 3.48Å; L239-F243 PolarHBondContact O-N 3.09Å; F243-S247 WeakPolarHBondContact O-CB 3.4Å; F243-S247 PolarHBondContact O-N 3.45Å; F243-S247 PolarHBondContact O-OG 3.25Å; F243-T275 HydrophobicContact CB-CG2 4.13Å; F243-T278 HydrophobicContact CB-CG2 4.03Å; F243-T278 HydrophobicContact CD1-CG2 3.32Å; F243-T278 HydrophobicContact CD2-CG2 3.54Å; F243-T278 HydrophobicContact CE1-CG2 3.44Å; F243-T278 VanDerWaalsContact CE1-CG2 3.44Å; F243-T278 HydrophobicContact CE2-CG2 3.64Å; F243-T278 HydrophobicContact CG-CG2 3.37Å; F243-T278 HydrophobicContact CZ-CG2 3.6Å; F243-V279 HydrophobicContact CB-CG2 4.47Å; F243-V279 HydrophobicContact CD2-CG2 4.04Å; F243-V451 HydrophobicContact CE1-CB 4.48Å; F243-V451 HydrophobicContact CE1-CG1 3.97Å
244	F	96.6	Very high	95	Very high	76 Å²	76	46.5 Å²	46.5	33%	0.333	26%	0.257	S	S	.	.	H	α-helix	trans	-64.8	-49.8	170.7	-177.6	-88.4	0	0	0	110.6	S240 Y246 S247 F248 I267 I271 V272 T275	S240-F244 WeakPolarHBondContact O-CB 3.43Å; S240-F244 PolarHBondContact O-N 2.94Å; F244-Y246 VanDerWaalsContact C-N 3.33Å; F244-Y246 PolarHBondContact O-N 3.45Å; F244-S247 PolarHBondContact O-N 3.34Å; F244-F248 HydrophobicContact CE1-CB 4.5Å; F244-F248 WeakPolarHBondContact O-CB 3.43Å; F244-F248 PolarHBondContact O-N 3.44Å; F244-I267 HydrophobicContact CZ-CG2 4.05Å; F244-I271 HydrophobicContact CD2-CG2 3.67Å; F244-I271 HydrophobicContact CE2-CB 4.32Å; F244-I271 HydrophobicContact CE2-CG2 3.54Å; F244-I271 HydrophobicContact CG-CG2 4.38Å; F244-I271 HydrophobicContact CZ-CG2 4.15Å; F244-V272 HydrophobicContact CE2-CG2 4.5Å; F244-T275 WeakPolarHBondContact CA-OG1 3.48Å; F244-T275 HydrophobicContact CB-CG2 4.11Å
245	G	95.8	Very high	94.7	Very high	29 Å²	29	41 Å²	41	30%	0.299	23%	0.229	S	C	.	.	H	α-helix	trans	-59.7	-43.5	176.9	0	0	0	0	0	112.1	I241 F242 F248 V249	I241-G245 PolarHBondContact O-N 2.9Å; F242-G245 PolarHBondContact O-N 3.24Å; G245-F248 PolarHBondContact O-N 3.02Å; G245-V249 WeakPolarHBondContact O-CG2 3.34Å; G245-V249 PolarHBondContact O-N 3.31Å
246	Y	94.9	Very high	94.4	Very high	30 Å²	30	45 Å²	45	12%	0.118	24%	0.238	C	C	.	.	H	α-helix	trans	-57.8	-50.8	174.9	-175	-93.3	0	0	0	112.3	F242 F244 V249 R250 L445 P446 V451	F242-Y246 WeakPolarHBondContact O-CB 3.29Å; F242-Y246 PolarHBondContact O-N 3.32Å; F244-Y246 VanDerWaalsContact C-N 3.33Å; F244-Y246 PolarHBondContact O-N 3.45Å; Y246-V249 PolarHBondContact O-N 3.02Å; Y246-R250 VanDerWaalsContact CE1-NH1 3.35Å; Y246-R250 PolarHBondContact O-N 2.97Å; Y246-R250 VanDerWaalsContact O-N 3.13Å; Y246-L445 HydrophobicContact CE2-CB 4.29Å; Y246-L445 HydrophobicContact CE2-CD2 3.93Å; Y246-P446 WeakPolarHBondContact OH-CD 3.44Å; Y246-P446 WeakPolarHBondContact OH-CG 3.29Å; Y246-P446 PolarHBondContact OH-O 3.18Å; Y246-V451 HydrophobicContact CE1-CG2 4.29Å
247	S	93.4	Very high	94.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.2	-37.4	179.3	-54.4	0	0	0	0	111.5	F243 F244 R250 D251	F243-S247 WeakPolarHBondContact O-CB 3.4Å; F243-S247 PolarHBondContact O-N 3.45Å; F243-S247 PolarHBondContact O-OG 3.25Å; F244-S247 PolarHBondContact O-N 3.34Å; S247-R250 PolarHBondContact O-N 3.23Å; S247-D251 WeakPolarHBondContact O-CA 3.28Å; S247-D251 WeakPolarHBondContact O-CB 3.42Å; S247-D251 PolarHBondContact O-N 3.38Å
248	F	94.2	Very high	93.7	Very high	57 Å²	57	52.4 Å²	52.4	25%	0.25	27%	0.27	C	S	.	.	H	α-helix	trans	-62.6	-46.5	176.6	178.6	-101.3	0	0	0	112.1	F244 G245 R250 I252 I253 I267	F244-F248 HydrophobicContact CE1-CB 4.5Å; F244-F248 WeakPolarHBondContact O-CB 3.43Å; F244-F248 PolarHBondContact O-N 3.44Å; G245-F248 PolarHBondContact O-N 3.02Å; F248-R250 VanDerWaalsContact C-N 3.33Å; F248-R250 PolarHBondContact O-N 2.89Å; F248-I252 HydrophobicContact CD2-CB 4Å; F248-I252 HydrophobicContact CD2-CG1 3.79Å; F248-I252 HydrophobicContact CD2-CG2 4.46Å; F248-I252 HydrophobicContact CE2-CB 4.01Å; F248-I252 HydrophobicContact CE2-CG1 4.09Å; F248-I252 HydrophobicContact CE2-CG2 3.96Å; F248-I252 HydrophobicContact CZ-CG2 4.43Å; F248-I252 WeakPolarHBondContact O-CA 3.48Å; F248-I252 VanDerWaalsContact O-CB 3.3Å; F248-I252 WeakPolarHBondContact O-CB 3.22Å; F248-I252 PolarHBondContact O-N 3.07Å; F248-I253 HydrophobicContact CD1-CD1 4.46Å; F248-I253 HydrophobicContact CD1-CG1 4.01Å; F248-I253 HydrophobicContact CE1-CD1 3.65Å; F248-I253 HydrophobicContact CE1-CG1 3.69Å; F248-I253 HydrophobicContact CZ-CD1 3.91Å; F248-I253 HydrophobicContact CZ-CG1 4.3Å; F248-I253 PolarHBondContact O-N 2.89Å; F248-I253 VanDerWaalsContact O-N 3.11Å; F248-I267 HydrophobicContact CD2-CD1 4.37Å; F248-I267 HydrophobicContact CD2-CG1 4.41Å; F248-I267 HydrophobicContact CE2-CD1 3.83Å; F248-I267 HydrophobicContact CE2-CG1 4.33Å
249	V	93.6	Very high	93.1	Very high	59 Å²	59	54.9 Å²	54.9	36%	0.358	27%	0.272	S	S	.	.	I	π-helix	trans	-61.1	-44.2	176.7	170.9	0	0	0	0	110.8	G245 Y246 I253 H254 L445	G245-V249 WeakPolarHBondContact O-CG2 3.34Å; G245-V249 PolarHBondContact O-N 3.31Å; Y246-V249 PolarHBondContact O-N 3.02Å; V249-I253 WeakPolarHBondContact O-CB 3.42Å; V249-I253 PolarHBondContact O-N 3.02Å; V249-H254 PolarHBondContact O-N 2.93Å; V249-L445 HydrophobicContact CG1-CD1 4.19Å
250	R	91.2	Very high	92.6	Very high	15 Å²	15	62 Å²	62	6%	0.057	30%	0.302	C	S	.	.	I	π-helix	trans	-76.3	-41.5	-175.9	-164.6	-167.5	58.7	-134.9	-5	114	Y246 S247 F248 R442 P446 P447 S448	Y246-R250 VanDerWaalsContact CE1-NH1 3.35Å; Y246-R250 PolarHBondContact O-N 2.97Å; Y246-R250 VanDerWaalsContact O-N 3.13Å; S247-R250 PolarHBondContact O-N 3.23Å; F248-R250 VanDerWaalsContact C-N 3.33Å; F248-R250 PolarHBondContact O-N 2.89Å; R250-R442 HydrophobicContact CG-CB 3.77Å; R250-R442 HydrophobicContact CG-CG 4.4Å; R250-R442 VanDerWaalsContact O-CD 3.3Å; R250-R442 WeakPolarHBondContact O-CD 3.49Å; R250-R442 PolarHBondContact O-NH1 3.44Å; R250-P446 PolarHBondContact NH1-O 2.72Å; R250-P447 VanDerWaalsContact NH1-CA 3.29Å; R250-S448 PolarHBondContact NH2-OG 3.4Å
251	D	88.6	Confident	91.9	Very high	17 Å²	17	65.5 Å²	65.5	9%	0.091	31%	0.314	C	S	.	.	I	π-helix	trans	-97.7	-22.1	-168.2	-59	-21.2	0	0	0	112.2	S247 P255 I271 H274 R442	S247-D251 WeakPolarHBondContact O-CA 3.28Å; S247-D251 WeakPolarHBondContact O-CB 3.42Å; S247-D251 PolarHBondContact O-N 3.38Å; D251-P255 WeakPolarHBondContact O-CG 3.21Å; D251-I271 HydrophobicContact CB-CD1 3.69Å; D251-H274 IonicContact OD2-CE1 3.39Å; D251-H274 IonicContact OD2-ND1 3.06Å; D251-H274 PolarHBondContact OD2-ND1 2.94Å; D251-R442 IonicContact OD1-NH1 3.63Å
252	I	92	Very high	91.2	Very high	2 Å²	2	63.9 Å²	63.9	1%	0.01	31%	0.314	C	S	.	.	I	π-helix	trans	-111.3	-54.8	177.6	-50.6	-58.8	0	0	0	112	F248 P255 Y256 D263 F264 K266 I267 I271	F248-I252 HydrophobicContact CD2-CB 4Å; F248-I252 HydrophobicContact CD2-CG1 3.79Å; F248-I252 HydrophobicContact CD2-CG2 4.46Å; F248-I252 HydrophobicContact CE2-CB 4.01Å; F248-I252 HydrophobicContact CE2-CG1 4.09Å; F248-I252 HydrophobicContact CE2-CG2 3.96Å; F248-I252 HydrophobicContact CZ-CG2 4.43Å; F248-I252 WeakPolarHBondContact O-CA 3.48Å; F248-I252 VanDerWaalsContact O-CB 3.3Å; F248-I252 WeakPolarHBondContact O-CB 3.22Å; F248-I252 PolarHBondContact O-N 3.07Å; I252-P255 WeakPolarHBondContact O-CD 3.45Å; I252-Y256 VanDerWaalsContact O-CB 3.26Å; I252-Y256 WeakPolarHBondContact O-CB 3.37Å; I252-Y256 PolarHBondContact O-N 3.21Å; I252-D263 HydrophobicContact CD1-CB 4.41Å; I252-D263 WeakPolarHBondContact CD1-O 3.43Å; I252-F264 HydrophobicContact CG2-CD1 4.14Å; I252-F264 HydrophobicContact CG2-CE1 4.01Å; I252-F264 HydrophobicContact CG2-CG 4.48Å; I252-F264 HydrophobicContact CG2-CZ 4.25Å; I252-K266 HydrophobicContact CD1-CB 3.96Å; I252-I267 HydrophobicContact CD1-CG1 4.35Å; I252-I267 HydrophobicContact CG1-CG1 4.26Å; I252-I271 HydrophobicContact CD1-CD1 4.18Å; I252-I271 HydrophobicContact CD1-CG1 4.29Å; I252-I271 HydrophobicContact CG1-CD1 4.15Å; I252-I271 HydrophobicContact CG1-CG1 4.3Å
253	I	92.6	Very high	90.7	Very high	53 Å²	53	59.5 Å²	59.5	27%	0.272	30%	0.296	S	S	.	.	I	π-helix	trans	-69.7	-44.1	-172.5	-59.2	-61.3	0	0	0	111.8	F248 V249 Y256 V257	F248-I253 HydrophobicContact CD1-CD1 4.46Å; F248-I253 HydrophobicContact CD1-CG1 4.01Å; F248-I253 HydrophobicContact CE1-CD1 3.65Å; F248-I253 HydrophobicContact CE1-CG1 3.69Å; F248-I253 HydrophobicContact CZ-CD1 3.91Å; F248-I253 HydrophobicContact CZ-CG1 4.3Å; F248-I253 PolarHBondContact O-N 2.89Å; F248-I253 VanDerWaalsContact O-N 3.11Å; V249-I253 WeakPolarHBondContact O-CB 3.42Å; V249-I253 PolarHBondContact O-N 3.02Å; I253-Y256 PolarHBondContact O-N 3.25Å; I253-V257 HydrophobicContact CG2-CG2 4.01Å; I253-V257 VanDerWaalsContact O-CG2 3.31Å; I253-V257 WeakPolarHBondContact O-CG2 3.18Å; I253-V257 PolarHBondContact O-N 3.25Å
254	H	90.8	Very high	90.5	Very high	20 Å²	20	63.6 Å²	63.6	9%	0.093	31%	0.313	C	S	.	.	H	α-helix	trans	-59.1	-52.6	179.6	171.7	-79.8	0	0	0	113.2	V249 Y256 V257 K258 R442 F443	V249-H254 PolarHBondContact O-N 2.93Å; H254-Y256 VanDerWaalsContact C-N 3.29Å; H254-Y256 PolarHBondContact O-N 2.83Å; H254-V257 PolarHBondContact O-N 2.97Å; H254-K258 WeakPolarHBondContact O-CB 3.48Å; H254-K258 PolarHBondContact O-N 3.31Å; H254-R442 HydrophobicContact CB-CB 4.3Å; H254-F443 VanDerWaalsContact CA-CE2 3.49Å; H254-F443 HydrophobicContact CB-CD2 3.76Å; H254-F443 HydrophobicContact CB-CE2 3.42Å; H254-F443 VanDerWaalsContact CB-CE2 3.42Å; H254-F443 HydrophobicContact CB-CZ 3.95Å; H254-F443 AromaticContact CD2-CD1 3.57Å; H254-F443 AromaticContact CD2-CD2 3.72Å; H254-F443 AromaticContact CD2-CE1 3.53Å; H254-F443 AromaticContact CD2-CE2 3.71Å; H254-F443 AromaticContact CD2-CG 3.65Å; H254-F443 AromaticContact CD2-CZ 3.59Å; H254-F443 AromaticContact CG-CE2 3.95Å
255	P	89.1	Confident	90.2	Very high	8 Å²	8	66.5 Å²	66.5	5%	0.052	32%	0.323	C	S	.	.	H	α-helix	trans	-59.9	-37.2	175.2	-25.5	35.9	0	0	0	113.5	D251 I252 H259 K260	D251-P255 WeakPolarHBondContact O-CG 3.21Å; I252-P255 WeakPolarHBondContact O-CD 3.45Å; P255-H259 PolarHBondContact O-N 3.42Å; P255-K260 PolarHBondContact O-N 3.46Å
256	Y	90.8	Very high	90	Very high	118 Å²	118	67 Å²	67	46%	0.463	32%	0.317	S	S	.	.	H	α-helix	trans	-63.2	-43.7	177.3	-177.4	-101.9	0	0	0	112.2	I252 I253 H254 K260 Q261 F264	I252-Y256 VanDerWaalsContact O-CB 3.26Å; I252-Y256 WeakPolarHBondContact O-CB 3.37Å; I252-Y256 PolarHBondContact O-N 3.21Å; I253-Y256 PolarHBondContact O-N 3.25Å; H254-Y256 VanDerWaalsContact C-N 3.29Å; H254-Y256 PolarHBondContact O-N 2.83Å; Y256-K260 WeakPolarHBondContact O-CA 3.49Å; Y256-K260 PolarHBondContact O-N 2.92Å; Y256-K260 VanDerWaalsContact O-N 3.12Å; Y256-Q261 WeakPolarHBondContact CA-O 3.23Å; Y256-F264 HydrophobicContact CD2-CE2 4.15Å; Y256-F264 HydrophobicContact CE2-CE2 4.29Å
257	V	91.6	Very high	89.9	Confident	94 Å²	94	67.8 Å²	67.8	57%	0.57	32%	0.323	S	S	*	.	H	α-helix	trans	-71.4	-44.4	179.1	172.9	0	0	0	0	111.7	I253 H254 F443	I253-V257 HydrophobicContact CG2-CG2 4.01Å; I253-V257 VanDerWaalsContact O-CG2 3.31Å; I253-V257 WeakPolarHBondContact O-CG2 3.18Å; I253-V257 PolarHBondContact O-N 3.25Å; H254-V257 PolarHBondContact O-N 2.97Å; V257-F443 HydrophobicContact CB-CZ 4.37Å; V257-F443 HydrophobicContact CG1-CZ 4.42Å
258	K	88.8	Confident	89.9	Confident	142 Å²	142	71.7 Å²	71.7	62%	0.617	35%	0.348	S	S	*	.	H	α-helix	trans	-79.7	-42.2	-173.3	-170.1	174.1	178	178.9	0	113.4	H254	H254-K258 WeakPolarHBondContact O-CB 3.48Å; H254-K258 PolarHBondContact O-N 3.31Å
259	H	86.1	Confident	89.9	Confident	106 Å²	106	71.4 Å²	71.4	49%	0.491	35%	0.349	S	S	.	.	H	α-helix	trans	-116.4	-0.7	-171.1	-53.9	113.2	0	0	0	113.7	P255 Q261	P255-H259 PolarHBondContact O-N 3.42Å; H259-Q261 HydrophobicContact CB-CG 4.19Å; H259-Q261 PolarHBondContact O-N 3.23Å; H259-Q261 VanDerWaalsContact O-N 3.14Å
260	K	86	Confident	89.8	Confident	188 Å²	188	70.5 Å²	70.5	82%	0.817	34%	0.341	S	S	*	.			trans	55.1	25.8	-176.3	-61.3	-174.9	177.5	-179.6	0	114.1	P255 Y256	P255-K260 PolarHBondContact O-N 3.46Å; Y256-K260 WeakPolarHBondContact O-CA 3.49Å; Y256-K260 PolarHBondContact O-N 2.92Å; Y256-K260 VanDerWaalsContact O-N 3.12Å
261	Q	81.8	Confident	89.9	Confident	112 Å²	112	69.9 Å²	69.9	52%	0.523	34%	0.338	S	S	.	.			trans	-92.2	134.7	177.4	-69.9	176.8	-6.8	0	0	110.7	Y256 H259	Y256-Q261 WeakPolarHBondContact CA-O 3.23Å; H259-Q261 HydrophobicContact CB-CG 4.19Å; H259-Q261 PolarHBondContact O-N 3.23Å; H259-Q261 VanDerWaalsContact O-N 3.14Å
262	S	84.3	Confident	90.3	Very high	86 Å²	86	70.7 Å²	70.7	60%	0.601	34%	0.344	S	S	*	.			trans	-97.2	93.1	-178.4	61.8	0	0	0	0	112
263	D	86.8	Confident	90.4	Very high	27 Å²	27	71.3 Å²	71.3	14%	0.144	35%	0.347	C	S	.	.			trans	-95.4	23.2	-178.9	-80.3	-6.1	0	0	0	114	I252 Y265 K266	I252-D263 HydrophobicContact CD1-CB 4.41Å; I252-D263 WeakPolarHBondContact CD1-O 3.43Å; D263-Y265 PolarHBondContact O-N 3.4Å; D263-K266 HydrophobicContact CB-CD 4.01Å; D263-K266 HydrophobicContact CB-CG 4.43Å; D263-K266 WeakPolarHBondContact O-CB 3.35Å; D263-K266 WeakPolarHBondContact O-CG 3.49Å; D263-K266 PolarHBondContact O-N 3.03Å; D263-K266 IonicContact OD2-NZ 3.17Å; D263-K266 PolarHBondContact OD2-NZ 3.24Å
264	F	91.3	Very high	90.5	Very high	96 Å²	96	71.3 Å²	71.3	42%	0.421	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-59.1	-22.9	-174.5	-73.1	-89	0	0	0	114.4	I252 Y256 K266 I267	I252-F264 HydrophobicContact CG2-CD1 4.14Å; I252-F264 HydrophobicContact CG2-CE1 4.01Å; I252-F264 HydrophobicContact CG2-CG 4.48Å; I252-F264 HydrophobicContact CG2-CZ 4.25Å; Y256-F264 HydrophobicContact CD2-CE2 4.15Å; Y256-F264 HydrophobicContact CE2-CE2 4.29Å; F264-K266 PolarHBondContact O-N 3.4Å; F264-K266 VanDerWaalsContact O-N 3.15Å; F264-I267 HydrophobicContact CB-CD1 4.32Å; F264-I267 HydrophobicContact CD1-CD1 3.75Å; F264-I267 WeakPolarHBondContact O-CB 3.29Å; F264-I267 WeakPolarHBondContact O-CD1 3.49Å; F264-I267 VanDerWaalsContact O-CG1 3.3Å; F264-I267 WeakPolarHBondContact O-CG1 3.36Å; F264-I267 PolarHBondContact O-N 3.33Å; F264-I267 VanDerWaalsContact O-N 3.17Å
265	Y	90.8	Very high	90.8	Very high	137 Å²	137	70.8 Å²	70.8	54%	0.537	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-63.5	-17.1	176.1	75	-90.6	0	0	0	113.3	D263 I267 P268	D263-Y265 PolarHBondContact O-N 3.4Å; Y265-I267 VanDerWaalsContact C-N 3.28Å; Y265-I267 PolarHBondContact O-N 3.46Å; Y265-P268 VanDerWaalsContact O-CD 3.3Å; Y265-P268 WeakPolarHBondContact O-CD 3.42Å
266	K	91	Very high	91.1	Very high	41 Å²	41	71.5 Å²	71.5	18%	0.178	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-72.1	-20.4	176.9	-64.4	-176.2	179.8	165.1	0	112.8	I252 D263 F264 E270 I271	I252-K266 HydrophobicContact CD1-CB 3.96Å; D263-K266 HydrophobicContact CB-CD 4.01Å; D263-K266 HydrophobicContact CB-CG 4.43Å; D263-K266 WeakPolarHBondContact O-CB 3.35Å; D263-K266 WeakPolarHBondContact O-CG 3.49Å; D263-K266 PolarHBondContact O-N 3.03Å; D263-K266 IonicContact OD2-NZ 3.17Å; D263-K266 PolarHBondContact OD2-NZ 3.24Å; F264-K266 PolarHBondContact O-N 3.4Å; F264-K266 VanDerWaalsContact O-N 3.15Å; K266-E270 HydrophobicContact CB-CB 4.06Å; K266-E270 WeakPolarHBondContact CG-OE2 3.07Å; K266-E270 WeakPolarHBondContact O-CA 3.28Å; K266-E270 VanDerWaalsContact O-CB 3.27Å; K266-E270 WeakPolarHBondContact O-CB 3.38Å; K266-E270 PolarHBondContact O-N 3.41Å; K266-I271 PolarHBondContact O-N 3.08Å; K266-I271 VanDerWaalsContact O-N 3.11Å
267	I	93.1	Very high	91.4	Very high	46 Å²	46	67.4 Å²	67.4	24%	0.236	34%	0.335	C	S	.	.	I	π-helix	trans	-57.3	-51.8	-173.8	-63.5	167.8	0	0	0	113.1	F244 F248 I252 F264 Y265 I269	F244-I267 HydrophobicContact CZ-CG2 4.05Å; F248-I267 HydrophobicContact CD2-CD1 4.37Å; F248-I267 HydrophobicContact CD2-CG1 4.41Å; F248-I267 HydrophobicContact CE2-CD1 3.83Å; F248-I267 HydrophobicContact CE2-CG1 4.33Å; I252-I267 HydrophobicContact CD1-CG1 4.35Å; I252-I267 HydrophobicContact CG1-CG1 4.26Å; F264-I267 HydrophobicContact CB-CD1 4.32Å; F264-I267 HydrophobicContact CD1-CD1 3.75Å; F264-I267 WeakPolarHBondContact O-CB 3.29Å; F264-I267 WeakPolarHBondContact O-CD1 3.49Å; F264-I267 VanDerWaalsContact O-CG1 3.3Å; F264-I267 WeakPolarHBondContact O-CG1 3.36Å; F264-I267 PolarHBondContact O-N 3.33Å; F264-I267 VanDerWaalsContact O-N 3.17Å; Y265-I267 VanDerWaalsContact C-N 3.28Å; Y265-I267 PolarHBondContact O-N 3.46Å; I267-I269 VanDerWaalsContact C-N 3.34Å; I267-I269 PolarHBondContact O-N 2.98Å
268	P	94	Very high	91.7	Very high	82 Å²	82	63.2 Å²	63.2	53%	0.532	31%	0.31	S	S	.	.	I	π-helix	trans	-67.9	-29.3	-169.2	-23.7	36.8	0	0	0	114.8	Y265 V272	Y265-P268 VanDerWaalsContact O-CD 3.3Å; Y265-P268 WeakPolarHBondContact O-CD 3.42Å; P268-V272 WeakPolarHBondContact O-CG2 3.49Å
269	I	93.4	Very high	92.1	Very high	50 Å²	50	56.5 Å²	56.5	26%	0.256	28%	0.281	S	S	.	.	I	π-helix	trans	-119	-51.3	-175.4	-56.9	-64.9	0	0	0	112.1	I267 N273 Y336 L340	I267-I269 VanDerWaalsContact C-N 3.34Å; I267-I269 PolarHBondContact O-N 2.98Å; I269-N273 WeakPolarHBondContact O-CB 3.23Å; I269-N273 PolarHBondContact O-N 3.49Å; I269-Y336 HydrophobicContact CD1-CD1 4.1Å; I269-Y336 HydrophobicContact CD1-CE1 3.75Å; I269-Y336 HydrophobicContact CG2-CD1 3.99Å; I269-L340 HydrophobicContact CG2-CD2 4.3Å
270	E	91.6	Very high	92.7	Very high	41 Å²	41	51.7 Å²	51.7	19%	0.192	26%	0.259	C	S	.	.	I	π-helix	trans	-73.4	-49.3	-170.8	-162.2	173.4	147.8	0	0	111.9	K266 V272 N273 H274 R343	K266-E270 HydrophobicContact CB-CB 4.06Å; K266-E270 WeakPolarHBondContact CG-OE2 3.07Å; K266-E270 WeakPolarHBondContact O-CA 3.28Å; K266-E270 VanDerWaalsContact O-CB 3.27Å; K266-E270 WeakPolarHBondContact O-CB 3.38Å; K266-E270 PolarHBondContact O-N 3.41Å; E270-V272 VanDerWaalsContact C-N 3.32Å; E270-V272 PolarHBondContact O-N 2.81Å; E270-N273 CarbonylContact O-C 3.51Å; E270-N273 PolarHBondContact O-N 2.97Å; E270-N273 VanDerWaalsContact O-N 3.14Å; E270-H274 PolarHBondContact O-CD2 3.07Å; E270-H274 PolarHBondContact O-N 2.76Å; E270-R343 IonicContact OE2-NH1 3.4Å
271	I	93.9	Very high	93.2	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	23%	0.225	C	C	.	.	I	π-helix	trans	-64.4	-39.6	178	-57.6	-60.3	0	0	0	111	F244 D251 I252 K266 H274 T275	F244-I271 HydrophobicContact CD2-CG2 3.67Å; F244-I271 HydrophobicContact CE2-CB 4.32Å; F244-I271 HydrophobicContact CE2-CG2 3.54Å; F244-I271 HydrophobicContact CG-CG2 4.38Å; F244-I271 HydrophobicContact CZ-CG2 4.15Å; D251-I271 HydrophobicContact CB-CD1 3.69Å; I252-I271 HydrophobicContact CD1-CD1 4.18Å; I252-I271 HydrophobicContact CD1-CG1 4.29Å; I252-I271 HydrophobicContact CG1-CD1 4.15Å; I252-I271 HydrophobicContact CG1-CG1 4.3Å; K266-I271 PolarHBondContact O-N 3.08Å; K266-I271 VanDerWaalsContact O-N 3.11Å; I271-H274 PolarHBondContact O-N 2.96Å; I271-T275 WeakPolarHBondContact O-CB 3.31Å; I271-T275 PolarHBondContact O-N 3.4Å; I271-T275 PolarHBondContact O-OG1 3.24Å
272	V	95.9	Very high	94	Very high	35 Å²	35	38.7 Å²	38.7	21%	0.212	20%	0.203	C	C	.	.	H	α-helix	trans	-61.8	-46.2	173.5	176.1	0	0	0	0	110.2	F244 P268 E270 H274 T275 L276 Y336	F244-V272 HydrophobicContact CE2-CG2 4.5Å; P268-V272 WeakPolarHBondContact O-CG2 3.49Å; E270-V272 VanDerWaalsContact C-N 3.32Å; E270-V272 PolarHBondContact O-N 2.81Å; V272-H274 VanDerWaalsContact C-N 3.26Å; V272-H274 PolarHBondContact O-N 3.43Å; V272-T275 PolarHBondContact O-N 3.04Å; V272-L276 HydrophobicContact CG1-CD1 3.73Å; V272-L276 HydrophobicContact CG1-CG 3.96Å; V272-L276 WeakPolarHBondContact O-CG 3.26Å; V272-L276 PolarHBondContact O-N 3.48Å; V272-Y336 HydrophobicContact CB-CD1 4.44Å; V272-Y336 HydrophobicContact CB-CE1 3.96Å; V272-Y336 HydrophobicContact CG1-CD1 4.14Å; V272-Y336 HydrophobicContact CG1-CE1 3.59Å; V272-Y336 HydrophobicContact CG1-CE2 4.48Å
273	N	95.8	Very high	94.7	Very high	14 Å²	14	34.6 Å²	34.6	8%	0.075	17%	0.174	C	C	.	.	H	α-helix	trans	-71.1	-16.4	179.8	-158.8	33.9	0	0	0	114.1	I269 E270 P277 H333 Y336 S337	I269-N273 WeakPolarHBondContact O-CB 3.23Å; I269-N273 PolarHBondContact O-N 3.49Å; E270-N273 CarbonylContact O-C 3.51Å; E270-N273 PolarHBondContact O-N 2.97Å; E270-N273 VanDerWaalsContact O-N 3.14Å; N273-P277 WeakPolarHBondContact O-CD 3.38Å; N273-P277 WeakPolarHBondContact O-CG 3.37Å; N273-H333 PolarHBondContact OD1-ND1 2.94Å; N273-H333 PolarHBondContact OD1-O 3.42Å; N273-Y336 HydrophobicContact CB-CD1 4.34Å; N273-Y336 WeakPolarHBondContact OD1-CB 3.39Å; N273-S337 PolarHBondContact ND2-OG 3.36Å; N273-S337 VanDerWaalsContact ND2-OG 3.09Å; N273-S337 PolarHBondContact OD1-OG 2.92Å
274	H	93.4	Very high	95.2	Very high	53 Å²	53	33.6 Å²	33.6	25%	0.245	17%	0.168	C	C	.	.	H	α-helix	trans	-79	-35.7	166.3	-70.5	-176	0	0	0	111.9	D251 E270 I271 V272 T278	D251-H274 IonicContact OD2-CE1 3.39Å; D251-H274 IonicContact OD2-ND1 3.06Å; D251-H274 PolarHBondContact OD2-ND1 2.94Å; E270-H274 PolarHBondContact O-CD2 3.07Å; E270-H274 PolarHBondContact O-N 2.76Å; I271-H274 PolarHBondContact O-N 2.96Å; V272-H274 VanDerWaalsContact C-N 3.26Å; V272-H274 PolarHBondContact O-N 3.43Å; H274-T278 WeakPolarHBondContact O-CB 3.32Å; H274-T278 PolarHBondContact O-OG1 3.45Å
275	T	96.4	Very high	95.5	Very high	9 Å²	9	29 Å²	29	6%	0.055	15%	0.148	C	C	.	.	H	α-helix	trans	-77	-46.9	-175.4	-55.2	0	0	0	0	112	F243 F244 I271 V272 T278 V279	F243-T275 HydrophobicContact CB-CG2 4.13Å; F244-T275 WeakPolarHBondContact CA-OG1 3.48Å; F244-T275 HydrophobicContact CB-CG2 4.11Å; I271-T275 WeakPolarHBondContact O-CB 3.31Å; I271-T275 PolarHBondContact O-N 3.4Å; I271-T275 PolarHBondContact O-OG1 3.24Å; V272-T275 PolarHBondContact O-N 3.04Å; T275-T278 WeakPolarHBondContact O-CB 3.36Å; T275-T278 PolarHBondContact O-N 3.27Å; T275-V279 HydrophobicContact CG2-CG2 3.99Å; T275-V279 WeakPolarHBondContact O-CG2 3.38Å; T275-V279 PolarHBondContact O-N 3.49Å
276	L	97.1	Very high	95.9	Very high	23 Å²	23	24.2 Å²	24.2	12%	0.12	13%	0.132	C	C	.	.	H	α-helix	trans	-53.4	-55.7	-176.6	-69.2	171.5	0	0	0	114.2	V272 T278 V279 A280 L329 V332 H333 Y336	V272-L276 HydrophobicContact CG1-CD1 3.73Å; V272-L276 HydrophobicContact CG1-CG 3.96Å; V272-L276 WeakPolarHBondContact O-CG 3.26Å; V272-L276 PolarHBondContact O-N 3.48Å; L276-T278 VanDerWaalsContact C-N 3.3Å; L276-T278 PolarHBondContact O-N 2.52Å; L276-V279 PolarHBondContact O-N 3Å; L276-A280 WeakPolarHBondContact O-CB 3.31Å; L276-A280 PolarHBondContact O-N 3.08Å; L276-L329 HydrophobicContact CD2-CD2 3.73Å; L276-V332 HydrophobicContact CD1-CB 4.22Å; L276-V332 HydrophobicContact CD1-CG1 3.62Å; L276-V332 HydrophobicContact CD2-CG1 4.4Å; L276-H333 HydrophobicContact CB-CB 3.98Å; L276-Y336 HydrophobicContact CD1-CD2 3.97Å; L276-Y336 HydrophobicContact CD1-CE2 4.21Å; L276-Y336 HydrophobicContact CD1-CG 4.24Å
277	P	96.8	Very high	96.2	Very high	32 Å²	32	22.8 Å²	22.8	21%	0.208	13%	0.127	C	C	.	.	H	α-helix	trans	-66.1	-34.8	-179.1	26.1	-34.2	0	0	0	112	N273 A280 I281 H333	N273-P277 WeakPolarHBondContact O-CD 3.38Å; N273-P277 WeakPolarHBondContact O-CG 3.37Å; P277-A280 PolarHBondContact O-N 3.31Å; P277-I281 WeakPolarHBondContact O-CG2 3.27Å; P277-I281 PolarHBondContact O-N 2.92Å; P277-H333 HydrophobicContact CB-CB 4.5Å
278	T	96.8	Very high	96.4	Very high	7 Å²	7	21.4 Å²	21.4	4%	0.043	12%	0.119	C	C	.	.	H	α-helix	trans	-61.7	-47.1	177.2	-65	0	0	0	0	111.5	F243 H274 T275 L276 I281 T282 S452	F243-T278 HydrophobicContact CB-CG2 4.03Å; F243-T278 HydrophobicContact CD1-CG2 3.32Å; F243-T278 HydrophobicContact CD2-CG2 3.54Å; F243-T278 HydrophobicContact CE1-CG2 3.44Å; F243-T278 VanDerWaalsContact CE1-CG2 3.44Å; F243-T278 HydrophobicContact CE2-CG2 3.64Å; F243-T278 HydrophobicContact CG-CG2 3.37Å; F243-T278 HydrophobicContact CZ-CG2 3.6Å; H274-T278 WeakPolarHBondContact O-CB 3.32Å; H274-T278 PolarHBondContact O-OG1 3.45Å; T275-T278 WeakPolarHBondContact O-CB 3.36Å; T275-T278 PolarHBondContact O-N 3.27Å; L276-T278 VanDerWaalsContact C-N 3.3Å; L276-T278 PolarHBondContact O-N 2.52Å; T278-I281 WeakPolarHBondContact O-CG2 3.32Å; T278-T282 WeakPolarHBondContact O-CB 3.48Å; T278-T282 PolarHBondContact O-N 3.24Å; T278-T282 PolarHBondContact O-OG1 3.02Å; T278-S452 VanDerWaalsContact CG2-CB 3.42Å
279	V	97.9	Very high	96.5	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-69	-41.4	176.5	179.7	0	0	0	0	110.3	L239 F243 T275 L276 T282 L283 L329	L239-V279 HydrophobicContact CB-CG1 4.12Å; L239-V279 HydrophobicContact CB-CG2 4.34Å; F243-V279 HydrophobicContact CB-CG2 4.47Å; F243-V279 HydrophobicContact CD2-CG2 4.04Å; T275-V279 HydrophobicContact CG2-CG2 3.99Å; T275-V279 WeakPolarHBondContact O-CG2 3.38Å; T275-V279 PolarHBondContact O-N 3.49Å; L276-V279 PolarHBondContact O-N 3Å; V279-T282 PolarHBondContact O-N 3.07Å; V279-L283 HydrophobicContact CG1-CD1 3.82Å; V279-L283 HydrophobicContact CG1-CG 4.15Å; V279-L283 WeakPolarHBondContact O-CB 3.32Å; V279-L283 VanDerWaalsContact O-CG 3.28Å; V279-L283 WeakPolarHBondContact O-CG 3.37Å; V279-L283 PolarHBondContact O-N 3.02Å; V279-L329 HydrophobicContact CB-CD1 3.98Å; V279-L329 HydrophobicContact CG1-CD1 3.45Å; V279-L329 VanDerWaalsContact CG1-CD1 3.45Å
280	A	98.3	Very high	96.7	Very high	5 Å²	5	17 Å²	17	4%	0.041	9%	0.091	C	C	.	.	H	α-helix	trans	-57.8	-54.4	178.8	0	0	0	0	0	111.8	L276 P277 T282 L283 L284 S326 L329 A330	L276-A280 WeakPolarHBondContact O-CB 3.31Å; L276-A280 PolarHBondContact O-N 3.08Å; P277-A280 PolarHBondContact O-N 3.31Å; A280-T282 VanDerWaalsContact C-N 3.3Å; A280-T282 PolarHBondContact O-N 3.08Å; A280-L283 PolarHBondContact O-N 2.98Å; A280-L284 PolarHBondContact O-N 3.44Å; A280-S326 PolarHBondContact O-OG 3Å; A280-L329 HydrophobicContact CB-CB 3.89Å; A280-A330 HydrophobicContact CB-CB 4.27Å
281	I	97.9	Very high	96.7	Very high	18 Å²	18	15.6 Å²	15.6	9%	0.092	9%	0.088	C	C	.	.	H	α-helix	trans	-66	-33.6	-178.7	-159.8	174.4	0	0	0	112.2	P277 T278 L284 A285 L420 A423 L453 P456	P277-I281 WeakPolarHBondContact O-CG2 3.27Å; P277-I281 PolarHBondContact O-N 2.92Å; T278-I281 WeakPolarHBondContact O-CG2 3.32Å; I281-L284 PolarHBondContact O-N 2.86Å; I281-A285 WeakPolarHBondContact O-CB 3.39Å; I281-A285 PolarHBondContact O-N 3.29Å; I281-L420 HydrophobicContact CG1-CD1 4.39Å; I281-A423 HydrophobicContact CD1-CB 4.01Å; I281-A423 HydrophobicContact CG1-CB 4.26Å; I281-L453 HydrophobicContact CD1-CD2 3.91Å; I281-P456 HydrophobicContact CD1-CB 4.34Å; I281-P456 HydrophobicContact CD1-CG 4Å; I281-P456 HydrophobicContact CG1-CB 4.37Å; I281-P456 HydrophobicContact CG1-CG 3.77Å; I281-P456 HydrophobicContact CG2-CG 4.38Å
282	T	97.9	Very high	96.8	Very high	10 Å²	10	16.6 Å²	16.6	6%	0.061	9%	0.092	C	C	.	.	H	α-helix	trans	-65	-46.8	174.7	-58.5	0	0	0	0	111	L239 T278 V279 A280 L284 A285 L286 L455	L239-T282 HydrophobicContact CD1-CG2 3.91Å; L239-T282 HydrophobicContact CD2-CG2 4.27Å; T278-T282 WeakPolarHBondContact O-CB 3.48Å; T278-T282 PolarHBondContact O-N 3.24Å; T278-T282 PolarHBondContact O-OG1 3.02Å; V279-T282 PolarHBondContact O-N 3.07Å; A280-T282 VanDerWaalsContact C-N 3.3Å; A280-T282 PolarHBondContact O-N 3.08Å; T282-L284 PolarHBondContact O-N 2.75Å; T282-A285 PolarHBondContact O-N 3.39Å; T282-L286 HydrophobicContact CG2-CD1 4.42Å; T282-L286 WeakPolarHBondContact O-CG 3.49Å; T282-L286 PolarHBondContact O-N 3.49Å; T282-L455 HydrophobicContact CG2-CD2 3.91Å
283	L	98.1	Very high	96.8	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62.8	-41.6	176.2	-70.6	173.5	0	0	0	111.5	A236 L239 V279 A280 A285 L286 V287 L322 I325 L329	A236-L283 HydrophobicContact CB-CD1 3.89Å; A236-L283 HydrophobicContact CB-CD2 4.44Å; L239-L283 HydrophobicContact CD1-CD2 3.88Å; L239-L283 HydrophobicContact CD1-CG 4.32Å; V279-L283 HydrophobicContact CG1-CD1 3.82Å; V279-L283 HydrophobicContact CG1-CG 4.15Å; V279-L283 WeakPolarHBondContact O-CB 3.32Å; V279-L283 VanDerWaalsContact O-CG 3.28Å; V279-L283 WeakPolarHBondContact O-CG 3.37Å; V279-L283 PolarHBondContact O-N 3.02Å; A280-L283 PolarHBondContact O-N 2.98Å; L283-A285 VanDerWaalsContact C-N 3.33Å; L283-A285 PolarHBondContact O-N 2.93Å; L283-L286 HydrophobicContact CD2-CD1 4.41Å; L283-L286 PolarHBondContact O-N 3.41Å; L283-V287 WeakPolarHBondContact O-CG2 3.5Å; L283-V287 PolarHBondContact O-N 3.45Å; L283-V287 VanDerWaalsContact O-N 3.09Å; L283-L322 HydrophobicContact CD2-CD2 3.8Å; L283-I325 HydrophobicContact CD1-CB 4.27Å; L283-I325 HydrophobicContact CD1-CG2 3.68Å; L283-L329 HydrophobicContact CD1-CD1 3.82Å
284	L	97.9	Very high	96.7	Very high	5 Å²	5	17.3 Å²	17.3	3%	0.026	10%	0.095	C	C	.	.	H	α-helix	trans	-59.8	-43.6	174.5	-169	60.6	0	0	0	111.4	A280 I281 T282 L286 V287 Y288 S326 M388 L420	A280-L284 PolarHBondContact O-N 3.44Å; I281-L284 PolarHBondContact O-N 2.86Å; T282-L284 PolarHBondContact O-N 2.75Å; L284-L286 VanDerWaalsContact C-N 3.35Å; L284-L286 PolarHBondContact O-N 2.67Å; L284-V287 WeakPolarHBondContact O-CB 3.37Å; L284-V287 PolarHBondContact O-N 2.91Å; L284-Y288 HydrophobicContact CD1-CE2 3.76Å; L284-Y288 HydrophobicContact CG-CE2 4.07Å; L284-Y288 WeakPolarHBondContact O-CD2 3.49Å; L284-S326 WeakPolarHBondContact CB-OG 3.22Å; L284-M388 HydrophobicContact CD1-CE 4.39Å; L284-M388 HydrophobicContact CD2-CE 4.25Å; L284-M388 HydrophobicContact CD2-SD 4.19Å; L284-L420 HydrophobicContact CB-CD1 4.28Å; L284-L420 HydrophobicContact CD2-CB 4.2Å; L284-L420 HydrophobicContact CD2-CD1 4.01Å; L284-L420 HydrophobicContact CG-CB 4.44Å; L284-L420 HydrophobicContact CG-CD1 4.01Å
285	A	98.2	Very high	96.7	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-63.7	-39.5	175.9	0	0	0	0	0	112.2	I281 T282 L283 V287 Y288 L289 L420 L455 P456 V459	I281-A285 WeakPolarHBondContact O-CB 3.39Å; I281-A285 PolarHBondContact O-N 3.29Å; T282-A285 PolarHBondContact O-N 3.39Å; L283-A285 VanDerWaalsContact C-N 3.33Å; L283-A285 PolarHBondContact O-N 2.93Å; A285-V287 VanDerWaalsContact C-N 3.28Å; A285-V287 PolarHBondContact O-N 3.42Å; A285-Y288 PolarHBondContact O-N 2.91Å; A285-L289 WeakPolarHBondContact O-CB 3.33Å; A285-L289 PolarHBondContact O-N 3.2Å; A285-L420 HydrophobicContact CB-CD1 4.19Å; A285-L455 HydrophobicContact CB-CD2 4.02Å; A285-L455 HydrophobicContact CB-CG 3.95Å; A285-P456 HydrophobicContact CB-CB 4.33Å; A285-P456 HydrophobicContact CB-CG 3.97Å; A285-V459 HydrophobicContact CB-CG2 4.29Å
286	L	97.9	Very high	96.6	Very high	36 Å²	36	16.5 Å²	16.5	19%	0.188	10%	0.098	C	C	.	.	H	α-helix	trans	-63.1	-31.1	176.3	-71.1	173	0	0	0	113	L239 T282 L283 L284 L289 A290 W315 L455	L239-L286 HydrophobicContact CD1-CD1 4.15Å; T282-L286 HydrophobicContact CG2-CD1 4.42Å; T282-L286 WeakPolarHBondContact O-CG 3.49Å; T282-L286 PolarHBondContact O-N 3.49Å; L283-L286 HydrophobicContact CD2-CD1 4.41Å; L283-L286 PolarHBondContact O-N 3.41Å; L284-L286 VanDerWaalsContact C-N 3.35Å; L284-L286 PolarHBondContact O-N 2.67Å; L286-L289 HydrophobicContact CD2-CD2 4.36Å; L286-A290 PolarHBondContact O-N 3.45Å; L286-W315 HydrophobicContact CB-CZ2 4.14Å; L286-W315 HydrophobicContact CD2-CH2 4.28Å; L286-W315 HydrophobicContact CD2-CZ2 3.79Å; L286-W315 WeakPolarHBondContact O-CZ2 3.28Å; L286-W315 PolarHBondContact O-NE1 3.21Å; L286-L455 HydrophobicContact CD2-CD2 3.95Å; L286-L455 HydrophobicContact CG-CD2 4.06Å
287	V	97.7	Very high	96.4	Very high	12 Å²	12	17 Å²	17	7%	0.073	10%	0.1	C	C	.	.	H	α-helix	trans	-58	-49.8	173	171.5	0	0	0	0	110.6	L283 L284 A285 R319 L322	L283-V287 WeakPolarHBondContact O-CG2 3.5Å; L283-V287 PolarHBondContact O-N 3.45Å; L283-V287 VanDerWaalsContact O-N 3.09Å; L284-V287 WeakPolarHBondContact O-CB 3.37Å; L284-V287 PolarHBondContact O-N 2.91Å; A285-V287 VanDerWaalsContact C-N 3.28Å; A285-V287 PolarHBondContact O-N 3.42Å; V287-R319 HydrophobicContact CG1-CB 4.17Å; V287-R319 HydrophobicContact CG1-CG 4.27Å; V287-R319 WeakPolarHBondContact O-CD 3.04Å; V287-L322 HydrophobicContact CG2-CB 3.6Å
288	Y	97.1	Very high	96.2	Very high	17 Å²	17	15.7 Å²	15.7	7%	0.067	9%	0.091	C	C	.	.	H	α-helix	trans	-81.7	-28.4	-174.9	-63.9	-65.6	0	0	0	113.4	L284 A285 A290 G291 Q292 Q412 G416 Y417 L420	L284-Y288 HydrophobicContact CD1-CE2 3.76Å; L284-Y288 HydrophobicContact CG-CE2 4.07Å; L284-Y288 WeakPolarHBondContact O-CD2 3.49Å; A285-Y288 PolarHBondContact O-N 2.91Å; Y288-A290 VanDerWaalsContact C-N 3.34Å; Y288-A290 PolarHBondContact O-N 2.73Å; Y288-G291 PolarHBondContact O-N 3.33Å; Y288-Q292 PolarHBondContact O-N 3.41Å; Y288-Q412 PolarHBondContact OH-O 2.91Å; Y288-G416 VanDerWaalsContact CZ-C 3.44Å; Y288-G416 WeakPolarHBondContact OH-CA 3.3Å; Y288-Y417 HydrophobicContact CD1-CD1 4.5Å; Y288-Y417 AromaticContact CD1-CD2 3.98Å; Y288-Y417 HydrophobicContact CD1-CD2 3.98Å; Y288-Y417 HydrophobicContact CD1-CE1 4.26Å; Y288-Y417 AromaticContact CD1-CE2 3.68Å; Y288-Y417 HydrophobicContact CD1-CE2 3.68Å; Y288-Y417 HydrophobicContact CD1-CG 4.37Å; Y288-Y417 AromaticContact CD1-CZ 3.84Å; Y288-Y417 HydrophobicContact CE1-CD2 4.36Å; Y288-Y417 HydrophobicContact CE1-CE2 4.41Å; Y288-Y417 HydrophobicContact CG-CD1 4.39Å; Y288-Y417 HydrophobicContact CG-CE1 4.08Å; Y288-Y417 HydrophobicContact CG-CE2 4.32Å; Y288-Y417 PolarHBondContact O-OH 2.89Å; Y288-L420 HydrophobicContact CD2-CB 4.34Å; Y288-L420 HydrophobicContact CD2-CD2 3.95Å; Y288-L420 HydrophobicContact CE2-CB 4.4Å
289	L	97.3	Very high	96	Very high	38 Å²	38	16.9 Å²	16.9	20%	0.199	10%	0.097	C	C	.	.	H	α-helix	trans	-59.9	-42.4	176.4	179.7	57.7	0	0	0	112	A285 L286 G291 Q292 L293 W315 L455 V459	A285-L289 WeakPolarHBondContact O-CB 3.33Å; A285-L289 PolarHBondContact O-N 3.2Å; L286-L289 HydrophobicContact CD2-CD2 4.36Å; L289-G291 VanDerWaalsContact C-N 3.25Å; L289-G291 PolarHBondContact O-N 3.29Å; L289-Q292 WeakPolarHBondContact O-CB 3.07Å; L289-Q292 PolarHBondContact O-N 2.71Å; L289-L293 HydrophobicContact CD1-CD1 4.46Å; L289-L293 HydrophobicContact CD1-CG 4.17Å; L289-L293 HydrophobicContact CG-CD1 4.17Å; L289-L293 HydrophobicContact CG-CG 4.34Å; L289-L293 WeakPolarHBondContact O-CG 3.45Å; L289-L293 PolarHBondContact O-N 3.19Å; L289-W315 HydrophobicContact CB-CH2 4.23Å; L289-W315 HydrophobicContact CB-CZ2 4.31Å; L289-W315 HydrophobicContact CD2-CH2 3.82Å; L289-W315 HydrophobicContact CD2-CZ2 4.45Å; L289-W315 HydrophobicContact CG-CH2 3.86Å; L289-W315 HydrophobicContact CG-CZ2 4.44Å; L289-L455 HydrophobicContact CD2-CD1 3.95Å; L289-V459 HydrophobicContact CB-CG2 3.89Å; L289-V459 HydrophobicContact CD1-CG2 4.19Å; L289-V459 HydrophobicContact CG-CG2 4.49Å
290	A	95.9	Very high	95.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-55.9	-42	178.2	0	0	0	0	0	112	L286 Y288 Q292 L293 A294 W315 L316 R319	L286-A290 PolarHBondContact O-N 3.45Å; Y288-A290 VanDerWaalsContact C-N 3.34Å; Y288-A290 PolarHBondContact O-N 2.73Å; A290-Q292 VanDerWaalsContact C-N 3.35Å; A290-Q292 PolarHBondContact O-N 2.88Å; A290-L293 PolarHBondContact O-N 2.74Å; A290-A294 PolarHBondContact O-N 2.93Å; A290-W315 HydrophobicContact CB-CD2 3.69Å; A290-W315 HydrophobicContact CB-CE3 4.13Å; A290-W315 HydrophobicContact CB-CG 4Å; A290-W315 HydrophobicContact CB-CZ2 4.09Å; A290-L316 HydrophobicContact CB-CD2 3.84Å; A290-R319 HydrophobicContact CB-CG 4.47Å
291	G	93.4	Very high	95.4	Very high	13 Å²	13	29.1 Å²	29.1	13%	0.134	14%	0.144	C	C	.	.	H	α-helix	trans	-66.2	-35.1	177.1	0	0	0	0	0	113.1	Y288 L289 A294 A295	Y288-G291 PolarHBondContact O-N 3.33Å; L289-G291 VanDerWaalsContact C-N 3.25Å; L289-G291 PolarHBondContact O-N 3.29Å; G291-A294 PolarHBondContact O-N 2.87Å; G291-A295 PolarHBondContact O-N 2.93Å
292	Q	95.1	Very high	95	Very high	21 Å²	21	28.3 Å²	28.3	10%	0.098	14%	0.14	C	C	.	.	H	α-helix	trans	-70.1	-40.8	175.5	-66.2	-175.5	12.4	0	0	112.3	Y288 L289 A290 A294 A295 A296 Y417 V459	Y288-Q292 PolarHBondContact O-N 3.41Å; L289-Q292 WeakPolarHBondContact O-CB 3.07Å; L289-Q292 PolarHBondContact O-N 2.71Å; A290-Q292 VanDerWaalsContact C-N 3.35Å; A290-Q292 PolarHBondContact O-N 2.88Å; Q292-A294 VanDerWaalsContact C-N 3.31Å; Q292-A294 PolarHBondContact O-N 3.25Å; Q292-A295 PolarHBondContact O-N 3.5Å; Q292-A296 WeakPolarHBondContact O-CB 3.32Å; Q292-A296 PolarHBondContact O-N 3.47Å; Q292-Y417 WeakPolarHBondContact CG-OH 3.49Å; Q292-Y417 PolarHBondContact NE2-OH 3.46Å; Q292-V459 PolarHBondContact NE2-O 3.02Å; Q292-V459 PolarHBondContact OE1-O 2.75Å
293	L	95.8	Very high	94.6	Very high	64 Å²	64	28.3 Å²	28.3	34%	0.335	14%	0.14	S	C	.	.	H	α-helix	trans	-63.3	-39	174.5	-67.3	175.4	0	0	0	111.4	L289 A290 A296 H297 W311 L312 W315	L289-L293 HydrophobicContact CD1-CD1 4.46Å; L289-L293 HydrophobicContact CD1-CG 4.17Å; L289-L293 HydrophobicContact CG-CD1 4.17Å; L289-L293 HydrophobicContact CG-CG 4.34Å; L289-L293 WeakPolarHBondContact O-CG 3.45Å; L289-L293 PolarHBondContact O-N 3.19Å; A290-L293 PolarHBondContact O-N 2.74Å; L293-A296 PolarHBondContact O-N 3.43Å; L293-H297 VanDerWaalsContact O-CB 3.32Å; L293-H297 WeakPolarHBondContact O-CB 3.15Å; L293-H297 PolarHBondContact O-N 3.12Å; L293-W311 HydrophobicContact CD1-CH2 4.43Å; L293-W311 HydrophobicContact CD1-CZ3 4.45Å; L293-L312 HydrophobicContact CB-CD1 4.16Å; L293-W315 HydrophobicContact CD1-CE3 4.43Å; L293-W315 HydrophobicContact CD1-CH2 3.97Å; L293-W315 HydrophobicContact CD1-CZ3 3.47Å; L293-W315 VanDerWaalsContact CD1-CZ3 3.47Å
294	A	94.2	Very high	94.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.5	-41	173.3	0	0	0	0	0	112.4	A290 G291 Q292 H297 Q298 F308 L312 L316 T507	A290-A294 PolarHBondContact O-N 2.93Å; G291-A294 PolarHBondContact O-N 2.87Å; Q292-A294 VanDerWaalsContact C-N 3.31Å; Q292-A294 PolarHBondContact O-N 3.25Å; A294-H297 PolarHBondContact O-N 3.42Å; A294-Q298 WeakPolarHBondContact O-CG 3.32Å; A294-Q298 PolarHBondContact O-N 3.4Å; A294-F308 HydrophobicContact CB-CE1 3.97Å; A294-F308 HydrophobicContact CB-CZ 3.98Å; A294-L312 HydrophobicContact CB-CD2 4.4Å; A294-L316 HydrophobicContact CB-CD1 4.2Å; A294-L316 HydrophobicContact CB-CD2 4.24Å; A294-T507 HydrophobicContact CB-CG2 3.99Å
295	A	93.1	Very high	93.8	Very high	6 Å²	6	36.4 Å²	36.4	5%	0.05	17%	0.173	C	C	.	.	H	α-helix	trans	-65.8	-42.8	174.5	0	0	0	0	0	112.2	G291 Q292 H297 Q298 L299 M466 L475	G291-A295 PolarHBondContact O-N 2.93Å; Q292-A295 PolarHBondContact O-N 3.5Å; A295-H297 VanDerWaalsContact C-N 3.34Å; A295-H297 PolarHBondContact O-N 2.93Å; A295-Q298 PolarHBondContact O-N 3.02Å; A295-L299 WeakPolarHBondContact O-CG 3.42Å; A295-L299 PolarHBondContact O-N 3.09Å; A295-M466 HydrophobicContact CB-SD 4.38Å; A295-L475 HydrophobicContact CB-CD1 4.33Å; A295-L475 HydrophobicContact CB-CD2 3.99Å
296	A	93.7	Very high	93.4	Very high	40 Å²	40	40.8 Å²	40.8	33%	0.331	19%	0.192	S	C	.	.	H	α-helix	trans	-62	-41.7	175.3	0	0	0	0	0	111.6	Q292 L293 Q298 L299 Y300 M466	Q292-A296 WeakPolarHBondContact O-CB 3.32Å; Q292-A296 PolarHBondContact O-N 3.47Å; L293-A296 PolarHBondContact O-N 3.43Å; A296-Q298 PolarHBondContact O-N 3.22Å; A296-L299 PolarHBondContact O-N 3.21Å; A296-Y300 WeakPolarHBondContact O-CB 3.21Å; A296-Y300 PolarHBondContact O-N 3.47Å; A296-M466 HydrophobicContact CB-CE 4.06Å
297	H	93.3	Very high	93	Very high	33 Å²	33	47.1 Å²	47.1	15%	0.153	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-45.1	174.1	-178.4	-83.3	0	0	0	111.8	L293 A294 A295 L299 Y300 Y301 F308	L293-H297 VanDerWaalsContact O-CB 3.32Å; L293-H297 WeakPolarHBondContact O-CB 3.15Å; L293-H297 PolarHBondContact O-N 3.12Å; A294-H297 PolarHBondContact O-N 3.42Å; A295-H297 VanDerWaalsContact C-N 3.34Å; A295-H297 PolarHBondContact O-N 2.93Å; H297-L299 PolarHBondContact O-N 3.36Å; H297-Y300 PolarHBondContact O-N 2.98Å; H297-Y301 AromaticContact CD2-CD2 3.86Å; H297-Y301 AromaticContact CD2-CE2 3.53Å; H297-Y301 AromaticContact CE1-CD2 3.49Å; H297-Y301 VanDerWaalsContact CE1-CD2 3.49Å; H297-Y301 WeakPolarHBondContact CE1-CD2 3.47Å; H297-Y301 AromaticContact CE1-CE2 3.67Å; H297-Y301 AromaticContact CG-CD2 3.96Å; H297-Y301 AromaticContact ND1-CD2 3.74Å; H297-Y301 AromaticContact NE2-CD2 3.56Å; H297-Y301 AromaticContact NE2-CE2 3.22Å; H297-Y301 WeakPolarHBondContact NE2-CE2 3.5Å; H297-Y301 VanDerWaalsContact O-CD2 3.29Å; H297-Y301 WeakPolarHBondContact O-CD2 3.03Å; H297-Y301 PolarHBondContact O-N 3.31Å; H297-Y301 VanDerWaalsContact O-N 3.08Å; H297-F308 HydrophobicContact CB-CD1 4.42Å; H297-F308 HydrophobicContact CB-CE1 4.17Å; H297-F308 AromaticContact CE1-CD1 3.92Å; H297-F308 AromaticContact CG-CD1 3.96Å; H297-F308 AromaticContact ND1-CD1 3.58Å; H297-F308 AromaticContact ND1-CE1 3.57Å
298	Q	93.3	Very high	92.8	Very high	4 Å²	4	48 Å²	48	2%	0.019	22%	0.224	C	C	.	.	H	α-helix	trans	-61.8	-41.9	175.6	-75.1	179.7	-15.9	0	0	112.3	A294 A295 A296 G302 F308 L475 I478 T507	A294-Q298 WeakPolarHBondContact O-CG 3.32Å; A294-Q298 PolarHBondContact O-N 3.4Å; A295-Q298 PolarHBondContact O-N 3.02Å; A296-Q298 PolarHBondContact O-N 3.22Å; Q298-G302 WeakPolarHBondContact O-CA 3.3Å; Q298-G302 PolarHBondContact O-N 3.48Å; Q298-F308 HydrophobicContact CG-CE1 4.44Å; Q298-F308 HydrophobicContact CG-CZ 4.29Å; Q298-L475 HydrophobicContact CB-CD1 4.22Å; Q298-I478 HydrophobicContact CB-CG2 4.43Å; Q298-T507 VanDerWaalsContact CD-CG2 3.49Å; Q298-T507 PolarHBondContact NE2-OG1 3.36Å
299	L	92.4	Very high	92.7	Very high	32 Å²	32	49.4 Å²	49.4	17%	0.168	23%	0.234	C	C	.	.	H	α-helix	trans	-67	-39.5	177.7	-75.4	166.1	0	0	0	112.6	A295 A296 H297 M466 V471 K474 L475 I478	A295-L299 WeakPolarHBondContact O-CG 3.42Å; A295-L299 PolarHBondContact O-N 3.09Å; A296-L299 PolarHBondContact O-N 3.21Å; H297-L299 PolarHBondContact O-N 3.36Å; L299-M466 HydrophobicContact CD1-CE 4Å; L299-M466 HydrophobicContact CD1-SD 3.62Å; L299-V471 HydrophobicContact CD1-CG1 3.59Å; L299-K474 HydrophobicContact CD2-CB 4.31Å; L299-K474 HydrophobicContact CD2-CD 4.19Å; L299-K474 HydrophobicContact CD2-CG 4.08Å; L299-L475 HydrophobicContact CD2-CB 4.15Å; L299-L475 HydrophobicContact CG-CD1 4.18Å; L299-I478 HydrophobicContact CD2-CD1 4.11Å
300	Y	92.9	Very high	92.5	Very high	182 Å²	182	54.6 Å²	54.6	71%	0.714	26%	0.257	S	S	*	.	H	α-helix	trans	-64.4	-45.7	178.6	178.6	-97.3	0	0	0	111.7	A296 H297	A296-Y300 WeakPolarHBondContact O-CB 3.21Å; A296-Y300 PolarHBondContact O-N 3.47Å; H297-Y300 PolarHBondContact O-N 2.98Å
301	Y	90.4	Very high	92.4	Very high	80 Å²	80	62 Å²	62	31%	0.314	29%	0.285	S	S	.	.	H	α-helix	trans	-85.5	-14.4	179.6	-70.9	-67	0	0	0	114.3	H297 T303 K306	H297-Y301 AromaticContact CD2-CD2 3.86Å; H297-Y301 AromaticContact CD2-CE2 3.53Å; H297-Y301 AromaticContact CE1-CD2 3.49Å; H297-Y301 VanDerWaalsContact CE1-CD2 3.49Å; H297-Y301 WeakPolarHBondContact CE1-CD2 3.47Å; H297-Y301 AromaticContact CE1-CE2 3.67Å; H297-Y301 AromaticContact CG-CD2 3.96Å; H297-Y301 AromaticContact ND1-CD2 3.74Å; H297-Y301 AromaticContact NE2-CD2 3.56Å; H297-Y301 AromaticContact NE2-CE2 3.22Å; H297-Y301 WeakPolarHBondContact NE2-CE2 3.5Å; H297-Y301 VanDerWaalsContact O-CD2 3.29Å; H297-Y301 WeakPolarHBondContact O-CD2 3.03Å; H297-Y301 PolarHBondContact O-N 3.31Å; H297-Y301 VanDerWaalsContact O-N 3.08Å; Y301-T303 PolarHBondContact O-N 3.21Å; Y301-K306 HydrophobicContact CD1-CD 3.77Å; Y301-K306 HydrophobicContact CD2-CD 3.87Å; Y301-K306 HydrophobicContact CE1-CD 3.98Å; Y301-K306 HydrophobicContact CE2-CD 4.08Å; Y301-K306 HydrophobicContact CG-CD 3.71Å; Y301-K306 PolarHBondContact OH-NZ 2.96Å
302	G	90.4	Very high	92.4	Very high	2 Å²	2	61.5 Å²	61.5	2%	0.021	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	18.9	179.3	0	0	0	0	0	114.3	Q298 D483 T484	Q298-G302 WeakPolarHBondContact O-CA 3.3Å; Q298-G302 PolarHBondContact O-N 3.48Å; G302-D483 WeakPolarHBondContact O-CA 3.39Å; G302-T484 WeakPolarHBondContact CA-OG1 3.33Å; G302-T484 PolarHBondContact O-N 2.74Å
303	T	89.4	Confident	92.4	Very high	10 Å²	10	63.9 Å²	63.9	6%	0.061	29%	0.291	C	S	.	.			trans	-151.1	148.4	-178.5	-172.7	0	0	0	0	110.9	Y301 Y305 K306 D483	Y301-T303 PolarHBondContact O-N 3.21Å; T303-Y305 WeakPolarHBondContact OG1-CD2 3.48Å; T303-Y305 PolarHBondContact OG1-N 2.89Å; T303-K306 HydrophobicContact CG2-CB 4.12Å; T303-D483 WeakPolarHBondContact CB-OD2 3.36Å; T303-D483 PolarHBondContact OG1-OD2 3.21Å
304	K	89.5	Confident	92.2	Very high	49 Å²	49	63.9 Å²	63.9	21%	0.213	30%	0.296	C	S	.	.	S	Bend	trans	-90.8	-10.8	173.6	71.2	177.1	179.8	-176.7	0	113.6	I478 R479 P503	K304-I478 HydrophobicContact CB-CG2 4.35Å; K304-R479 WeakPolarHBondContact CD-O 3.23Å; K304-R479 PolarHBondContact NZ-O 3.37Å; K304-P503 HydrophobicContact CD-CG 4.02Å
305	Y	88.9	Confident	92.2	Very high	125 Å²	125	66.5 Å²	66.5	49%	0.49	31%	0.306	S	S	.	.			trans	-85.5	-9.6	-172.4	-58.3	-66.4	0	0	0	113.5	T303	T303-Y305 WeakPolarHBondContact OG1-CD2 3.48Å; T303-Y305 PolarHBondContact OG1-N 2.89Å
306	K	89	Confident	92.3	Very high	92 Å²	92	66.5 Å²	66.5	40%	0.4	31%	0.305	S	S	.	.	S	Bend	trans	-76.9	126	173.5	-167.3	174.8	-175.5	176.4	0	109.1	Y301 T303	Y301-K306 HydrophobicContact CD1-CD 3.77Å; Y301-K306 HydrophobicContact CD2-CD 3.87Å; Y301-K306 HydrophobicContact CE1-CD 3.98Å; Y301-K306 HydrophobicContact CE2-CD 4.08Å; Y301-K306 HydrophobicContact CG-CD 3.71Å; Y301-K306 PolarHBondContact OH-NZ 2.96Å; T303-K306 HydrophobicContact CG2-CB 4.12Å
307	Q	91.1	Very high	92.3	Very high	170 Å²	170	70.7 Å²	70.7	79%	0.794	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-60.3	144.4	175	-67.8	178.7	-8.1	0	0	110.6
308	F	93.6	Very high	92.3	Very high	31 Å²	31	70.3 Å²	70.3	14%	0.136	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-72.7	151	172.9	-66.9	-63.1	0	0	0	110.2	A294 H297 Q298 L312 L316 V506 T507	A294-F308 HydrophobicContact CB-CE1 3.97Å; A294-F308 HydrophobicContact CB-CZ 3.98Å; H297-F308 HydrophobicContact CB-CD1 4.42Å; H297-F308 HydrophobicContact CB-CE1 4.17Å; H297-F308 AromaticContact CE1-CD1 3.92Å; H297-F308 AromaticContact CG-CD1 3.96Å; H297-F308 AromaticContact ND1-CD1 3.58Å; H297-F308 AromaticContact ND1-CE1 3.57Å; Q298-F308 HydrophobicContact CG-CE1 4.44Å; Q298-F308 HydrophobicContact CG-CZ 4.29Å; F308-L312 HydrophobicContact CB-CD2 4.43Å; F308-L312 HydrophobicContact CD1-CD2 3.8Å; F308-L312 HydrophobicContact CE1-CD2 4.45Å; F308-L312 HydrophobicContact CG-CD2 4.31Å; F308-L316 HydrophobicContact CD2-CD1 4.28Å; F308-L316 HydrophobicContact CE2-CD1 4.49Å; F308-V506 HydrophobicContact CD2-CG1 3.61Å; F308-V506 HydrophobicContact CE2-CB 4.24Å; F308-V506 HydrophobicContact CE2-CG1 3.58Å; F308-T507 HydrophobicContact CZ-CG2 4.12Å
309	P	94.8	Very high	92.5	Very high	45 Å²	45	70.6 Å²	70.6	29%	0.292	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-62	144.4	170.6	28.5	-34.8	0	0	0	110	W311 L312 E313	P309-W311 HydrophobicContact CG-CD2 4.47Å; P309-W311 HydrophobicContact CG-CZ2 3.95Å; P309-W311 PolarHBondContact O-N 2.93Å; P309-W311 VanDerWaalsContact O-N 3.07Å; P309-L312 HydrophobicContact CG-CB 3.93Å; P309-L312 PolarHBondContact O-N 3.42Å; P309-E313 PolarHBondContact O-N 3.28Å; P309-E313 VanDerWaalsContact O-N 3.09Å
310	H	92.9	Very high	92.6	Very high	148 Å²	148	73.8 Å²	73.8	69%	0.685	33%	0.332	S	S	*	.	H	α-helix	trans	-54.9	-32.9	-172.5	-73.5	-53.7	0	0	0	114.7	E313 S314	H310-E313 IonicContact ND1-OE2 2.56Å; H310-S314 WeakPolarHBondContact O-CB 3.42Å; H310-S314 PolarHBondContact O-N 2.83Å; H310-S314 PolarHBondContact O-OG 3.21Å
311	W	94	Very high	92.8	Very high	155 Å²	155	66.5 Å²	66.5	59%	0.587	31%	0.305	S	S	*	.	H	α-helix	trans	-65.1	-39.1	176.8	66	-99.9	0	0	0	112.1	L293 P309 W315	L293-W311 HydrophobicContact CD1-CH2 4.43Å; L293-W311 HydrophobicContact CD1-CZ3 4.45Å; P309-W311 HydrophobicContact CG-CD2 4.47Å; P309-W311 HydrophobicContact CG-CZ2 3.95Å; P309-W311 PolarHBondContact O-N 2.93Å; P309-W311 VanDerWaalsContact O-N 3.07Å; W311-W315 HydrophobicContact CE3-CE3 4.38Å; W311-W315 AromaticContact CZ3-CE3 3.98Å; W311-W315 HydrophobicContact CZ3-CE3 3.98Å; W311-W315 HydrophobicContact CZ3-CZ3 4.18Å; W311-W315 WeakPolarHBondContact O-CB 3.2Å; W311-W315 PolarHBondContact O-N 3.25Å; W311-W315 VanDerWaalsContact O-N 3.13Å
312	L	93.4	Very high	93.1	Very high	3 Å²	3	63 Å²	63	2%	0.016	29%	0.292	C	S	.	.	H	α-helix	trans	-74.8	-41.7	179.9	-178.8	59.1	0	0	0	110	L293 A294 F308 P309 S314 W315 L316	L293-L312 HydrophobicContact CB-CD1 4.16Å; A294-L312 HydrophobicContact CB-CD2 4.4Å; F308-L312 HydrophobicContact CB-CD2 4.43Å; F308-L312 HydrophobicContact CD1-CD2 3.8Å; F308-L312 HydrophobicContact CE1-CD2 4.45Å; F308-L312 HydrophobicContact CG-CD2 4.31Å; P309-L312 HydrophobicContact CG-CB 3.93Å; P309-L312 PolarHBondContact O-N 3.42Å; L312-S314 PolarHBondContact O-N 3.4Å; L312-W315 HydrophobicContact CD1-CE3 4.27Å; L312-W315 PolarHBondContact O-N 3.47Å; L312-L316 HydrophobicContact CD1-CD1 4.47Å; L312-L316 HydrophobicContact CD1-CG 4.26Å; L312-L316 HydrophobicContact CG-CD1 4.06Å; L312-L316 HydrophobicContact CG-CG 4.33Å; L312-L316 WeakPolarHBondContact O-CB 3.42Å; L312-L316 WeakPolarHBondContact O-CG 3.34Å; L312-L316 PolarHBondContact O-N 3.42Å
313	E	93.3	Very high	93.4	Very high	71 Å²	71	64 Å²	64	33%	0.332	30%	0.302	S	S	.	.	H	α-helix	trans	-57.9	-49	174.6	-176.8	-180	-164	0	0	111.8	P309 H310 W315 L316 Q317	P309-E313 PolarHBondContact O-N 3.28Å; P309-E313 VanDerWaalsContact O-N 3.09Å; H310-E313 IonicContact ND1-OE2 2.56Å; E313-W315 VanDerWaalsContact C-N 3.27Å; E313-W315 PolarHBondContact O-N 2.85Å; E313-L316 PolarHBondContact O-N 3.18Å; E313-Q317 WeakPolarHBondContact O-CG 3.5Å; E313-Q317 PolarHBondContact O-N 3.36Å
314	S	92.3	Very high	93.8	Very high	64 Å²	64	65.6 Å²	65.6	45%	0.448	31%	0.31	S	S	.	.	H	α-helix	trans	-60.6	-38.4	178	-57.3	0	0	0	0	111.9	H310 L312 S318	H310-S314 WeakPolarHBondContact O-CB 3.42Å; H310-S314 PolarHBondContact O-N 2.83Å; H310-S314 PolarHBondContact O-OG 3.21Å; L312-S314 PolarHBondContact O-N 3.4Å; S314-S318 WeakPolarHBondContact O-CB 3.45Å; S314-S318 PolarHBondContact O-N 2.74Å; S314-S318 PolarHBondContact O-OG 3.37Å
315	W	95.2	Very high	94.3	Very high	55 Å²	55	64.2 Å²	64.2	21%	0.208	30%	0.304	C	S	.	.	H	α-helix	trans	-68.8	-43.9	176.5	-174.5	11.7	0	0	0	112	L286 L289 A290 L293 W311 L312 E313 Q317 S318 R319	L286-W315 HydrophobicContact CB-CZ2 4.14Å; L286-W315 HydrophobicContact CD2-CH2 4.28Å; L286-W315 HydrophobicContact CD2-CZ2 3.79Å; L286-W315 WeakPolarHBondContact O-CZ2 3.28Å; L286-W315 PolarHBondContact O-NE1 3.21Å; L289-W315 HydrophobicContact CB-CH2 4.23Å; L289-W315 HydrophobicContact CB-CZ2 4.31Å; L289-W315 HydrophobicContact CD2-CH2 3.82Å; L289-W315 HydrophobicContact CD2-CZ2 4.45Å; L289-W315 HydrophobicContact CG-CH2 3.86Å; L289-W315 HydrophobicContact CG-CZ2 4.44Å; A290-W315 HydrophobicContact CB-CD2 3.69Å; A290-W315 HydrophobicContact CB-CE3 4.13Å; A290-W315 HydrophobicContact CB-CG 4Å; A290-W315 HydrophobicContact CB-CZ2 4.09Å; L293-W315 HydrophobicContact CD1-CE3 4.43Å; L293-W315 HydrophobicContact CD1-CH2 3.97Å; L293-W315 HydrophobicContact CD1-CZ3 3.47Å; L293-W315 VanDerWaalsContact CD1-CZ3 3.47Å; W311-W315 HydrophobicContact CE3-CE3 4.38Å; W311-W315 AromaticContact CZ3-CE3 3.98Å; W311-W315 HydrophobicContact CZ3-CE3 3.98Å; W311-W315 HydrophobicContact CZ3-CZ3 4.18Å; W311-W315 WeakPolarHBondContact O-CB 3.2Å; W311-W315 PolarHBondContact O-N 3.25Å; W311-W315 VanDerWaalsContact O-N 3.13Å; L312-W315 HydrophobicContact CD1-CE3 4.27Å; L312-W315 PolarHBondContact O-N 3.47Å; E313-W315 VanDerWaalsContact C-N 3.27Å; E313-W315 PolarHBondContact O-N 2.85Å; W315-Q317 VanDerWaalsContact C-N 3.26Å; W315-Q317 PolarHBondContact O-N 3.13Å; W315-S318 WeakPolarHBondContact O-CB 3.33Å; W315-S318 PolarHBondContact O-N 3.06Å; W315-R319 PolarHBondContact O-N 3.44Å
316	L	94.1	Very high	94.7	Very high	6 Å²	6	58.2 Å²	58.2	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-59.4	-37.3	176.8	-69.6	168.6	0	0	0	111.9	A290 A294 F308 L312 E313 S318 R319 V506	A290-L316 HydrophobicContact CB-CD2 3.84Å; A294-L316 HydrophobicContact CB-CD1 4.2Å; A294-L316 HydrophobicContact CB-CD2 4.24Å; F308-L316 HydrophobicContact CD2-CD1 4.28Å; F308-L316 HydrophobicContact CE2-CD1 4.49Å; L312-L316 HydrophobicContact CD1-CD1 4.47Å; L312-L316 HydrophobicContact CD1-CG 4.26Å; L312-L316 HydrophobicContact CG-CD1 4.06Å; L312-L316 HydrophobicContact CG-CG 4.33Å; L312-L316 WeakPolarHBondContact O-CB 3.42Å; L312-L316 WeakPolarHBondContact O-CG 3.34Å; L312-L316 PolarHBondContact O-N 3.42Å; E313-L316 PolarHBondContact O-N 3.18Å; L316-S318 VanDerWaalsContact C-N 3.27Å; L316-S318 PolarHBondContact O-N 3.49Å; L316-R319 PolarHBondContact O-NE 2.97Å; L316-V506 HydrophobicContact CD1-CG1 3.78Å
317	Q	93.3	Very high	95.1	Very high	128 Å²	128	56.2 Å²	56.2	60%	0.598	27%	0.273	S	S	*	.	H	α-helix	trans	-69.8	-23.2	175.5	-69	175.1	8.4	0	0	113.3	E313 W315 Q321	E313-Q317 WeakPolarHBondContact O-CG 3.5Å; E313-Q317 PolarHBondContact O-N 3.36Å; W315-Q317 VanDerWaalsContact C-N 3.26Å; W315-Q317 PolarHBondContact O-N 3.13Å; Q317-Q321 PolarHBondContact O-OE1 3.49Å
318	S	94.9	Very high	95.5	Very high	25 Å²	25	54.3 Å²	54.3	18%	0.175	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-0.8	-175.6	-60.5	0	0	0	0	114	S314 W315 L316 K320 Q321 L322	S314-S318 WeakPolarHBondContact O-CB 3.45Å; S314-S318 PolarHBondContact O-N 2.74Å; S314-S318 PolarHBondContact O-OG 3.37Å; W315-S318 WeakPolarHBondContact O-CB 3.33Å; W315-S318 PolarHBondContact O-N 3.06Å; L316-S318 VanDerWaalsContact C-N 3.27Å; L316-S318 PolarHBondContact O-N 3.49Å; S318-K320 PolarHBondContact O-N 3.47Å; S318-Q321 PolarHBondContact O-N 2.94Å; S318-Q321 PolarHBondContact O-OE1 3.23Å; S318-L322 WeakPolarHBondContact O-CG 3.38Å; S318-L322 PolarHBondContact O-N 2.91Å
319	R	95.7	Very high	95.7	Very high	9 Å²	9	53.7 Å²	53.7	3%	0.034	26%	0.26	C	S	.	.	H	α-helix	trans	-60.3	-41.1	-175.2	-80.2	-175.8	-74.2	-169.4	7	113.8	V287 A290 W315 L316 Q321 L322 G323 V506 M509	V287-R319 HydrophobicContact CG1-CB 4.17Å; V287-R319 HydrophobicContact CG1-CG 4.27Å; V287-R319 WeakPolarHBondContact O-CD 3.04Å; A290-R319 HydrophobicContact CB-CG 4.47Å; W315-R319 PolarHBondContact O-N 3.44Å; L316-R319 PolarHBondContact O-NE 2.97Å; R319-Q321 VanDerWaalsContact C-N 3.31Å; R319-Q321 PolarHBondContact O-N 3.27Å; R319-L322 PolarHBondContact O-N 3.01Å; R319-G323 PolarHBondContact O-N 2.91Å; R319-V506 PolarHBondContact NH2-O 3.11Å; R319-M509 WeakPolarHBondContact CD-OXT 3.43Å; R319-M509 VanDerWaalsContact NE-C 3.31Å; R319-M509 PolarHBondContact NE-O 3Å; R319-M509 PolarHBondContact NE-OXT 3.36Å; R319-M509 PolarHBondContact NH1-O 3.22Å; R319-M509 VanDerWaalsContact NH2-CA 3.29Å; R319-M509 PolarHBondContact NH2-O 3.08Å; R319-M509 PolarHBondContact NH2-OXT 3.35Å
320	K	95.5	Very high	95.9	Very high	99 Å²	99	52.1 Å²	52.1	43%	0.43	25%	0.251	S	S	.	.	H	α-helix	trans	-56.3	-48.3	176.6	179.2	179.7	-178.5	170.4	0	111	S318 G323 L324 S395	S318-K320 PolarHBondContact O-N 3.47Å; K320-G323 PolarHBondContact O-N 3.35Å; K320-L324 HydrophobicContact CG-CD1 4.16Å; K320-L324 VanDerWaalsContact O-CG 3.32Å; K320-L324 WeakPolarHBondContact O-CG 3.41Å; K320-L324 PolarHBondContact O-N 3.44Å; K320-S395 VanDerWaalsContact CE-O 3.27Å; K320-S395 WeakPolarHBondContact CE-O 3.29Å; K320-S395 PolarHBondContact NZ-O 3.49Å
321	Q	96.9	Very high	96.1	Very high	29 Å²	29	46.3 Å²	46.3	14%	0.136	23%	0.228	C	C	.	.	H	α-helix	trans	-68.8	-42	-177.7	-66.7	82.2	-6.3	0	0	111.3	G228 W229 P232 Q317 S318 R319 G323 L324 I325	G228-Q321 WeakPolarHBondContact O-CG 3.43Å; W229-Q321 HydrophobicContact CD2-CB 4.15Å; W229-Q321 HydrophobicContact CD2-CG 3.68Å; W229-Q321 HydrophobicContact CE3-CB 3.99Å; W229-Q321 HydrophobicContact CE3-CG 4.05Å; W229-Q321 HydrophobicContact CG-CG 4.05Å; W229-Q321 HydrophobicContact CH2-CG 4.44Å; W229-Q321 HydrophobicContact CZ2-CG 4.11Å; W229-Q321 HydrophobicContact CZ3-CB 4.2Å; W229-Q321 HydrophobicContact CZ3-CG 4.41Å; P232-Q321 HydrophobicContact CB-CB 3.88Å; P232-Q321 HydrophobicContact CG-CB 3.64Å; Q317-Q321 PolarHBondContact O-OE1 3.49Å; S318-Q321 PolarHBondContact O-N 2.94Å; S318-Q321 PolarHBondContact O-OE1 3.23Å; R319-Q321 VanDerWaalsContact C-N 3.31Å; R319-Q321 PolarHBondContact O-N 3.27Å; Q321-G323 VanDerWaalsContact C-N 3.35Å; Q321-G323 PolarHBondContact O-N 2.79Å; Q321-L324 PolarHBondContact O-N 3.09Å; Q321-I325 VanDerWaalsContact O-CG1 3.32Å; Q321-I325 WeakPolarHBondContact O-CG1 3.38Å; Q321-I325 PolarHBondContact O-N 3.03Å
322	L	97.1	Very high	96.3	Very high	7 Å²	7	40.4 Å²	40.4	4%	0.037	21%	0.209	C	C	.	.	H	α-helix	trans	-58.4	-45.6	173.8	-72.4	171.8	0	0	0	111.8	P232 L283 V287 S318 R319 L324 I325 S326	P232-L322 HydrophobicContact CB-CD2 3.84Å; P232-L322 HydrophobicContact CB-CG 4.11Å; P232-L322 HydrophobicContact CG-CD2 4.29Å; P232-L322 HydrophobicContact CG-CG 4.16Å; L283-L322 HydrophobicContact CD2-CD2 3.8Å; V287-L322 HydrophobicContact CG2-CB 3.6Å; S318-L322 WeakPolarHBondContact O-CG 3.38Å; S318-L322 PolarHBondContact O-N 2.91Å; R319-L322 PolarHBondContact O-N 3.01Å; L322-L324 PolarHBondContact O-N 2.94Å; L322-I325 PolarHBondContact O-N 3.35Å; L322-S326 WeakPolarHBondContact O-CB 3.42Å; L322-S326 PolarHBondContact O-N 3.36Å
323	G	97.2	Very high	96.5	Very high	23 Å²	23	41.8 Å²	41.8	24%	0.237	22%	0.215	C	C	.	.	H	α-helix	trans	-63	-40.2	177.3	0	0	0	0	0	113.1	R319 K320 Q321 S326 F327	R319-G323 PolarHBondContact O-N 2.91Å; K320-G323 PolarHBondContact O-N 3.35Å; Q321-G323 VanDerWaalsContact C-N 3.35Å; Q321-G323 PolarHBondContact O-N 2.79Å; G323-S326 WeakPolarHBondContact O-CB 3.49Å; G323-S326 PolarHBondContact O-N 2.87Å; G323-F327 WeakPolarHBondContact O-CB 3.46Å; G323-F327 PolarHBondContact O-N 3.29Å
324	L	97.9	Very high	96.7	Very high	43 Å²	43	40.7 Å²	40.7	23%	0.225	21%	0.211	C	C	.	.	H	α-helix	trans	-67.3	-40.2	176.6	-71.9	172	0	0	0	112.7	W229 K320 Q321 L322 F327 F328 A392	W229-L324 HydrophobicContact CH2-CB 3.98Å; W229-L324 HydrophobicContact CH2-CD1 3.82Å; W229-L324 HydrophobicContact CZ2-CD1 4.14Å; W229-L324 HydrophobicContact CZ3-CB 4.47Å; K320-L324 HydrophobicContact CG-CD1 4.16Å; K320-L324 VanDerWaalsContact O-CG 3.32Å; K320-L324 WeakPolarHBondContact O-CG 3.41Å; K320-L324 PolarHBondContact O-N 3.44Å; Q321-L324 PolarHBondContact O-N 3.09Å; L322-L324 PolarHBondContact O-N 2.94Å; L324-F327 PolarHBondContact O-N 3.44Å; L324-F328 PolarHBondContact O-N 2.89Å; L324-A392 HydrophobicContact CD2-CB 4.35Å
325	I	98.3	Very high	96.9	Very high	20 Å²	20	43.2 Å²	43.2	10%	0.103	22%	0.219	C	C	.	.	H	α-helix	trans	-66	-43.2	174.6	-62.8	168.8	0	0	0	110.2	W229 P232 V233 A236 L283 Q321 L322 F327 F328 L329	W229-I325 HydrophobicContact CE3-CD1 4.25Å; W229-I325 HydrophobicContact CE3-CG1 4.33Å; W229-I325 HydrophobicContact CZ3-CD1 4.29Å; W229-I325 HydrophobicContact CZ3-CG1 3.88Å; P232-I325 HydrophobicContact CB-CD1 3.67Å; V233-I325 HydrophobicContact CG2-CD1 4.04Å; A236-I325 HydrophobicContact CB-CD1 4.46Å; A236-I325 HydrophobicContact CB-CG2 3.73Å; L283-I325 HydrophobicContact CD1-CB 4.27Å; L283-I325 HydrophobicContact CD1-CG2 3.68Å; Q321-I325 VanDerWaalsContact O-CG1 3.32Å; Q321-I325 WeakPolarHBondContact O-CG1 3.38Å; Q321-I325 PolarHBondContact O-N 3.03Å; L322-I325 PolarHBondContact O-N 3.35Å; I325-F327 VanDerWaalsContact C-N 3.31Å; I325-F327 PolarHBondContact O-N 3.03Å; I325-F328 PolarHBondContact O-N 2.96Å; I325-L329 HydrophobicContact CG2-CD1 4.07Å; I325-L329 HydrophobicContact CG2-CG 4.3Å; I325-L329 WeakPolarHBondContact O-CG 3.26Å; I325-L329 PolarHBondContact O-N 3.29Å
326	S	98.3	Very high	97	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-55.3	-46.8	174	173.8	0	0	0	0	111.8	A280 L284 L322 G323 L329 A330 M388	A280-S326 PolarHBondContact O-OG 3Å; L284-S326 WeakPolarHBondContact CB-OG 3.22Å; L322-S326 WeakPolarHBondContact O-CB 3.42Å; L322-S326 PolarHBondContact O-N 3.36Å; G323-S326 WeakPolarHBondContact O-CB 3.49Å; G323-S326 PolarHBondContact O-N 2.87Å; S326-L329 PolarHBondContact O-N 2.91Å; S326-A330 WeakPolarHBondContact O-CB 3.33Å; S326-A330 PolarHBondContact O-N 3.34Å; S326-M388 VanDerWaalsContact OG-CE 3.29Å; S326-M388 WeakPolarHBondContact OG-CE 3.38Å
327	F	98.3	Very high	97.1	Very high	50 Å²	50	45.2 Å²	45.2	22%	0.219	23%	0.233	C	C	.	.	H	α-helix	trans	-62.4	-44.9	177.2	170.5	-106	0	0	0	112.1	G323 L324 I325 L329 A330 A331 F385 M388 S389 A392	G323-F327 WeakPolarHBondContact O-CB 3.46Å; G323-F327 PolarHBondContact O-N 3.29Å; L324-F327 PolarHBondContact O-N 3.44Å; I325-F327 VanDerWaalsContact C-N 3.31Å; I325-F327 PolarHBondContact O-N 3.03Å; F327-L329 PolarHBondContact O-N 3.09Å; F327-A330 PolarHBondContact O-N 2.89Å; F327-A331 PolarHBondContact O-N 3.37Å; F327-F385 HydrophobicContact CD2-CE2 4.1Å; F327-F385 HydrophobicContact CE2-CD2 4.22Å; F327-F385 AromaticContact CE2-CE2 3.5Å; F327-F385 HydrophobicContact CE2-CE2 3.5Å; F327-F385 VanDerWaalsContact CE2-CE2 3.5Å; F327-F385 AromaticContact CE2-CZ 3.88Å; F327-F385 HydrophobicContact CE2-CZ 3.88Å; F327-F385 HydrophobicContact CZ-CE2 4.2Å; F327-F385 HydrophobicContact CZ-CZ 4.25Å; F327-M388 HydrophobicContact CB-CE 4.3Å; F327-M388 HydrophobicContact CD2-CB 3.95Å; F327-S389 WeakPolarHBondContact CE2-OG 3.38Å; F327-A392 HydrophobicContact CB-CB 4.45Å; F327-A392 HydrophobicContact CD1-CB 3.6Å; F327-A392 HydrophobicContact CD2-CB 4.15Å; F327-A392 HydrophobicContact CE1-CB 3.79Å; F327-A392 HydrophobicContact CE2-CB 4.31Å; F327-A392 HydrophobicContact CG-CB 3.78Å; F327-A392 HydrophobicContact CZ-CB 4.14Å
328	F	98.3	Very high	97.2	Very high	129 Å²	129	45.1 Å²	45.1	57%	0.566	24%	0.235	S	C	*	.	H	α-helix	trans	-58.3	-48.5	176.7	171.5	-102.9	0	0	0	111.8	L324 I325 A330 A331 V332	L324-F328 PolarHBondContact O-N 2.89Å; I325-F328 PolarHBondContact O-N 2.96Å; F328-A330 VanDerWaalsContact C-N 3.32Å; F328-A330 PolarHBondContact O-N 3.36Å; F328-A331 WeakPolarHBondContact O-CB 3.38Å; F328-A331 PolarHBondContact O-N 2.81Å; F328-V332 HydrophobicContact CD2-CG2 4.39Å; F328-V332 HydrophobicContact CE1-CG2 4.15Å; F328-V332 HydrophobicContact CE2-CG2 3.95Å; F328-V332 HydrophobicContact CZ-CG2 3.82Å; F328-V332 WeakPolarHBondContact O-CG2 3.31Å; F328-V332 PolarHBondContact O-N 2.95Å
329	L	98.4	Very high	97.2	Very high	18 Å²	18	45.4 Å²	45.4	9%	0.094	24%	0.238	C	C	.	.	H	α-helix	trans	-64.2	-36.8	178.7	-65.9	176.1	0	0	0	112.3	L276 V279 A280 L283 I325 S326 F327 V332 H333	L276-L329 HydrophobicContact CD2-CD2 3.73Å; V279-L329 HydrophobicContact CB-CD1 3.98Å; V279-L329 HydrophobicContact CG1-CD1 3.45Å; V279-L329 VanDerWaalsContact CG1-CD1 3.45Å; A280-L329 HydrophobicContact CB-CB 3.89Å; L283-L329 HydrophobicContact CD1-CD1 3.82Å; I325-L329 HydrophobicContact CG2-CD1 4.07Å; I325-L329 HydrophobicContact CG2-CG 4.3Å; I325-L329 WeakPolarHBondContact O-CG 3.26Å; I325-L329 PolarHBondContact O-N 3.29Å; S326-L329 PolarHBondContact O-N 2.91Å; F327-L329 PolarHBondContact O-N 3.09Å; L329-V332 PolarHBondContact O-N 2.59Å; L329-H333 WeakPolarHBondContact O-CB 3.19Å; L329-H333 PolarHBondContact O-N 2.91Å
330	A	98.1	Very high	97	Very high	13 Å²	13	47.4 Å²	47.4	11%	0.107	25%	0.249	C	C	.	.	H	α-helix	trans	-64.3	-41.8	173.5	0	0	0	0	0	112.2	A280 S326 F327 F328 H333 I334 F385 M388	A280-A330 HydrophobicContact CB-CB 4.27Å; S326-A330 WeakPolarHBondContact O-CB 3.33Å; S326-A330 PolarHBondContact O-N 3.34Å; F327-A330 PolarHBondContact O-N 2.89Å; F328-A330 VanDerWaalsContact C-N 3.32Å; F328-A330 PolarHBondContact O-N 3.36Å; A330-H333 WeakPolarHBondContact O-CB 3.32Å; A330-H333 PolarHBondContact O-N 3.41Å; A330-I334 WeakPolarHBondContact O-CG1 3.35Å; A330-I334 PolarHBondContact O-N 2.94Å; A330-F385 HydrophobicContact CB-CD2 4.5Å; A330-M388 HydrophobicContact CB-CE 4.13Å; A330-M388 HydrophobicContact CB-SD 4.22Å
331	A	98.2	Very high	96.9	Very high	26 Å²	26	47.5 Å²	47.5	22%	0.215	26%	0.26	C	S	.	.	H	α-helix	trans	-62.4	-43.8	175.8	0	0	0	0	0	111.7	F327 F328 I334 L335 F385	F327-A331 PolarHBondContact O-N 3.37Å; F328-A331 WeakPolarHBondContact O-CB 3.38Å; F328-A331 PolarHBondContact O-N 2.81Å; A331-I334 PolarHBondContact O-N 3.46Å; A331-L335 PolarHBondContact O-N 2.94Å; A331-F385 HydrophobicContact CB-CE2 3.81Å; A331-F385 HydrophobicContact CB-CZ 4.09Å
332	V	98.1	Very high	96.7	Very high	30 Å²	30	53.3 Å²	53.3	18%	0.182	29%	0.291	C	S	.	.	H	α-helix	trans	-64.7	-42.4	175.8	-178.4	0	0	0	0	110.5	L276 F328 L329 I334 L335 Y336	L276-V332 HydrophobicContact CD1-CB 4.22Å; L276-V332 HydrophobicContact CD1-CG1 3.62Å; L276-V332 HydrophobicContact CD2-CG1 4.4Å; F328-V332 HydrophobicContact CD2-CG2 4.39Å; F328-V332 HydrophobicContact CE1-CG2 4.15Å; F328-V332 HydrophobicContact CE2-CG2 3.95Å; F328-V332 HydrophobicContact CZ-CG2 3.82Å; F328-V332 WeakPolarHBondContact O-CG2 3.31Å; F328-V332 PolarHBondContact O-N 2.95Å; L329-V332 PolarHBondContact O-N 2.59Å; V332-I334 VanDerWaalsContact C-N 3.27Å; V332-I334 PolarHBondContact O-N 3.18Å; V332-L335 WeakPolarHBondContact O-CB 3.21Å; V332-L335 PolarHBondContact O-N 2.7Å; V332-L335 VanDerWaalsContact O-N 3.09Å; V332-Y336 HydrophobicContact CG1-CD2 3.68Å; V332-Y336 HydrophobicContact CG1-CE2 3.53Å; V332-Y336 VanDerWaalsContact O-CD2 3.28Å; V332-Y336 WeakPolarHBondContact O-CD2 3.1Å; V332-Y336 PolarHBondContact O-N 3.23Å
333	H	97.4	Very high	96.5	Very high	32 Å²	32	54.7 Å²	54.7	15%	0.148	30%	0.295	C	S	.	.	H	α-helix	trans	-55.5	-40.1	174.6	163.9	60.1	0	0	0	112.7	N273 L276 P277 L329 A330 Y336 S337	N273-H333 PolarHBondContact OD1-ND1 2.94Å; N273-H333 PolarHBondContact OD1-O 3.42Å; L276-H333 HydrophobicContact CB-CB 3.98Å; P277-H333 HydrophobicContact CB-CB 4.5Å; L329-H333 WeakPolarHBondContact O-CB 3.19Å; L329-H333 PolarHBondContact O-N 2.91Å; A330-H333 WeakPolarHBondContact O-CB 3.32Å; A330-H333 PolarHBondContact O-N 3.41Å; H333-Y336 PolarHBondContact O-N 3.37Å; H333-S337 PolarHBondContact CE1-OG 3.43Å; H333-S337 PolarHBondContact ND1-OG 3.5Å; H333-S337 WeakPolarHBondContact O-CB 3.38Å; H333-S337 PolarHBondContact O-N 2.89Å; H333-S337 PolarHBondContact O-OG 2.91Å
334	I	97.3	Very high	96.3	Very high	48 Å²	48	61.3 Å²	61.3	25%	0.246	32%	0.318	C	S	.	.	H	α-helix	trans	-62.7	-46	175.7	-70.5	167.7	0	0	0	110.9	A330 A331 V332 Y336 S337 L338 F385	A330-I334 WeakPolarHBondContact O-CG1 3.35Å; A330-I334 PolarHBondContact O-N 2.94Å; A331-I334 PolarHBondContact O-N 3.46Å; V332-I334 VanDerWaalsContact C-N 3.27Å; V332-I334 PolarHBondContact O-N 3.18Å; I334-Y336 VanDerWaalsContact C-N 3.31Å; I334-Y336 PolarHBondContact O-N 3.26Å; I334-S337 PolarHBondContact O-N 2.92Å; I334-L338 HydrophobicContact CG2-CD1 3.7Å; I334-L338 HydrophobicContact CG2-CG 4.14Å; I334-L338 WeakPolarHBondContact O-CB 3.49Å; I334-L338 VanDerWaalsContact O-CG 3.29Å; I334-L338 WeakPolarHBondContact O-CG 3.45Å; I334-L338 PolarHBondContact O-N 3.4Å; I334-F385 HydrophobicContact CD1-CB 3.64Å; I334-F385 HydrophobicContact CD1-CD1 3.49Å; I334-F385 VanDerWaalsContact CD1-CD1 3.49Å; I334-F385 HydrophobicContact CD1-CD2 3.28Å; I334-F385 HydrophobicContact CD1-CE1 3.9Å; I334-F385 HydrophobicContact CD1-CE2 3.71Å; I334-F385 HydrophobicContact CD1-CG 3.15Å; I334-F385 HydrophobicContact CD1-CZ 4Å
335	L	96.9	Very high	96	Very high	117 Å²	117	60.8 Å²	60.8	61%	0.613	32%	0.318	S	S	*	.	H	α-helix	trans	-59.6	-43.6	177.8	-64.6	175.3	0	0	0	111.6	A331 V332 S339	A331-L335 PolarHBondContact O-N 2.94Å; V332-L335 WeakPolarHBondContact O-CB 3.21Å; V332-L335 PolarHBondContact O-N 2.7Å; V332-L335 VanDerWaalsContact O-N 3.09Å; L335-S339 WeakPolarHBondContact O-CB 2.91Å; L335-S339 PolarHBondContact O-N 3.39Å; L335-S339 VanDerWaalsContact O-N 3.1Å
336	Y	96.5	Very high	95.6	Very high	67 Å²	67	62.9 Å²	62.9	26%	0.263	33%	0.327	S	S	.	.	H	α-helix	trans	-63.5	-43.2	175.9	-85.5	-109.2	0	0	0	111.5	I269 V272 N273 L276 V332 H333 I334 S339 L340	I269-Y336 HydrophobicContact CD1-CD1 4.1Å; I269-Y336 HydrophobicContact CD1-CE1 3.75Å; I269-Y336 HydrophobicContact CG2-CD1 3.99Å; V272-Y336 HydrophobicContact CB-CD1 4.44Å; V272-Y336 HydrophobicContact CB-CE1 3.96Å; V272-Y336 HydrophobicContact CG1-CD1 4.14Å; V272-Y336 HydrophobicContact CG1-CE1 3.59Å; V272-Y336 HydrophobicContact CG1-CE2 4.48Å; N273-Y336 HydrophobicContact CB-CD1 4.34Å; N273-Y336 WeakPolarHBondContact OD1-CB 3.39Å; L276-Y336 HydrophobicContact CD1-CD2 3.97Å; L276-Y336 HydrophobicContact CD1-CE2 4.21Å; L276-Y336 HydrophobicContact CD1-CG 4.24Å; V332-Y336 HydrophobicContact CG1-CD2 3.68Å; V332-Y336 HydrophobicContact CG1-CE2 3.53Å; V332-Y336 VanDerWaalsContact O-CD2 3.28Å; V332-Y336 WeakPolarHBondContact O-CD2 3.1Å; V332-Y336 PolarHBondContact O-N 3.23Å; H333-Y336 PolarHBondContact O-N 3.37Å; I334-Y336 VanDerWaalsContact C-N 3.31Å; I334-Y336 PolarHBondContact O-N 3.26Å; Y336-S339 PolarHBondContact O-N 3.37Å; Y336-S339 PolarHBondContact O-OG 2.91Å; Y336-L340 PolarHBondContact O-N 3.44Å
337	S	96.1	Very high	95.4	Very high	37 Å²	37	71.2 Å²	71.2	26%	0.259	36%	0.359	S	S	.	.	H	α-helix	trans	-66.9	-41.3	-179.2	-59.7	0	0	0	0	112.6	N273 H333 I334 S339 L340	N273-S337 PolarHBondContact ND2-OG 3.36Å; N273-S337 VanDerWaalsContact ND2-OG 3.09Å; N273-S337 PolarHBondContact OD1-OG 2.92Å; H333-S337 PolarHBondContact CE1-OG 3.43Å; H333-S337 PolarHBondContact ND1-OG 3.5Å; H333-S337 WeakPolarHBondContact O-CB 3.38Å; H333-S337 PolarHBondContact O-N 2.89Å; H333-S337 PolarHBondContact O-OG 2.91Å; I334-S337 PolarHBondContact O-N 2.92Å; S337-S339 PolarHBondContact O-N 3.38Å; S337-L340 WeakPolarHBondContact O-CB 3.46Å; S337-L340 VanDerWaalsContact O-CG 3.3Å; S337-L340 WeakPolarHBondContact O-CG 3.5Å; S337-L340 PolarHBondContact O-N 3.39Å
338	L	95.4	Very high	95.2	Very high	125 Å²	125	75.6 Å²	75.6	65%	0.654	38%	0.375	S	S	*	.	H	α-helix	trans	-66.6	-25.7	174	-68.2	175	0	0	0	112.5	I334 P341	I334-L338 HydrophobicContact CG2-CD1 3.7Å; I334-L338 HydrophobicContact CG2-CG 4.14Å; I334-L338 WeakPolarHBondContact O-CB 3.49Å; I334-L338 VanDerWaalsContact O-CG 3.29Å; I334-L338 WeakPolarHBondContact O-CG 3.45Å; I334-L338 PolarHBondContact O-N 3.4Å; L338-P341 WeakPolarHBondContact O-CD 3.46Å
339	S	94.8	Very high	94.9	Very high	32 Å²	32	74.1 Å²	74.1	22%	0.224	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-10.3	177.9	79.1	0	0	0	0	114.3	L335 Y336 S337 L342	L335-S339 WeakPolarHBondContact O-CB 2.91Å; L335-S339 PolarHBondContact O-N 3.39Å; L335-S339 VanDerWaalsContact O-N 3.1Å; Y336-S339 PolarHBondContact O-N 3.37Å; Y336-S339 PolarHBondContact O-OG 2.91Å; S337-S339 PolarHBondContact O-N 3.38Å; S339-L342 WeakPolarHBondContact O-CB 3.44Å; S339-L342 PolarHBondContact O-N 3.5Å
340	L	91.9	Very high	94.6	Very high	50 Å²	50	79.1 Å²	79.1	26%	0.262	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-55.1	-45.8	-175.8	-64.1	172	0	0	0	113.2	I269 Y336 S337 L342 R343 E346	I269-L340 HydrophobicContact CG2-CD2 4.3Å; Y336-L340 PolarHBondContact O-N 3.44Å; S337-L340 WeakPolarHBondContact O-CB 3.46Å; S337-L340 VanDerWaalsContact O-CG 3.3Å; S337-L340 WeakPolarHBondContact O-CG 3.5Å; S337-L340 PolarHBondContact O-N 3.39Å; L340-L342 PolarHBondContact O-N 2.92Å; L340-R343 VanDerWaalsContact CD2-CZ 3.41Å; L340-R343 WeakPolarHBondContact O-CB 3.26Å; L340-R343 WeakPolarHBondContact O-CG 3.17Å; L340-R343 PolarHBondContact O-N 3.01Å; L340-R343 PolarHBondContact O-NE 3Å; L340-E346 VanDerWaalsContact O-CG 3.3Å; L340-E346 WeakPolarHBondContact O-CG 3.39Å
341	P	93	Very high	94.4	Very high	102 Å²	102	82.8 Å²	82.8	66%	0.662	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-67.4	-20.3	179.8	-19.7	34	0	0	0	114	L338 R343	L338-P341 WeakPolarHBondContact O-CD 3.46Å; P341-R343 VanDerWaalsContact C-N 3.26Å; P341-R343 PolarHBondContact O-N 3.47Å
342	L	92.3	Very high	94.3	Very high	151 Å²	151	86.2 Å²	86.2	79%	0.791	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-78.7	-11.8	-179.3	-57.9	176.2	0	0	0	112.5	S339 L340	S339-L342 WeakPolarHBondContact O-CB 3.44Å; S339-L342 PolarHBondContact O-N 3.5Å; L340-L342 PolarHBondContact O-N 2.92Å
343	R	93.5	Very high	94	Very high	35 Å²	35	88.3 Å²	88.3	13%	0.132	44%	0.443	C	S	.	.			trans	-73.2	136.2	-176.7	-59.1	-172.4	-61	173.6	2.8	111.1	E270 L340 P341 S345 E346 R347	E270-R343 IonicContact OE2-NH1 3.4Å; L340-R343 VanDerWaalsContact CD2-CZ 3.41Å; L340-R343 WeakPolarHBondContact O-CB 3.26Å; L340-R343 WeakPolarHBondContact O-CG 3.17Å; L340-R343 PolarHBondContact O-N 3.01Å; L340-R343 PolarHBondContact O-NE 3Å; P341-R343 VanDerWaalsContact C-N 3.26Å; P341-R343 PolarHBondContact O-N 3.47Å; R343-S345 PolarHBondContact O-N 3.31Å; R343-E346 HydrophobicContact CB-CB 4.44Å; R343-E346 HydrophobicContact CB-CG 4.26Å; R343-E346 IonicContact CZ-OE1 2.89Å; R343-E346 IonicContact NH2-OE1 3.01Å; R343-E346 PolarHBondContact NH2-OE1 3.15Å; R343-E346 PolarHBondContact O-N 3.11Å; R343-R347 PolarHBondContact O-N 3.03Å; R343-R347 VanDerWaalsContact O-N 3.12Å
344	K	93.5	Very high	93.8	Very high	162 Å²	162	88.8 Å²	88.8	70%	0.704	45%	0.452	S	S	*	.	H	α-helix	trans	-58.7	-36	173.1	-70.3	-171.9	178.5	-178.2	0	112.4	R347 Y348	K344-R347 PolarHBondContact O-N 3.39Å; K344-Y348 HydrophobicContact CB-CE2 4.16Å; K344-Y348 WeakPolarHBondContact O-CD2 3.49Å; K344-Y348 PolarHBondContact O-N 2.89Å
345	S	91.3	Very high	93.6	Very high	33 Å²	33	94.3 Å²	94.3	23%	0.231	47%	0.471	C	S	.	.	H	α-helix	trans	-61.2	-45.4	178.4	57.4	0	0	0	0	112.4	R343 Y348 L349	R343-S345 PolarHBondContact O-N 3.31Å; S345-Y348 PolarHBondContact O-N 3.15Å; S345-L349 PolarHBondContact O-N 3.08Å
346	E	90.6	Very high	93.4	Very high	63 Å²	63	94.9 Å²	94.9	29%	0.294	47%	0.471	S	S	.	.	H	α-helix	trans	-65.8	-40.6	176.4	-70.2	-54.2	142.4	0	0	111.5	L340 R343 Y348 L349 L350	L340-E346 VanDerWaalsContact O-CG 3.3Å; L340-E346 WeakPolarHBondContact O-CG 3.39Å; R343-E346 HydrophobicContact CB-CB 4.44Å; R343-E346 HydrophobicContact CB-CG 4.26Å; R343-E346 IonicContact CZ-OE1 2.89Å; R343-E346 IonicContact NH2-OE1 3.01Å; R343-E346 PolarHBondContact NH2-OE1 3.15Å; R343-E346 PolarHBondContact O-N 3.11Å; E346-Y348 VanDerWaalsContact C-N 3.33Å; E346-Y348 PolarHBondContact O-N 2.87Å; E346-L349 PolarHBondContact O-N 3.38Å; E346-L350 WeakPolarHBondContact O-CB 3.39Å; E346-L350 PolarHBondContact O-N 2.91Å
347	R	93.2	Very high	93.2	Very high	176 Å²	176	94.3 Å²	94.3	66%	0.664	47%	0.471	S	S	*	.	H	α-helix	trans	-59.4	-44.1	175.5	-176.3	176.9	176.1	173.8	-0.5	112	R343 K344 L351	R343-R347 PolarHBondContact O-N 3.03Å; R343-R347 VanDerWaalsContact O-N 3.12Å; K344-R347 PolarHBondContact O-N 3.39Å; R347-L351 HydrophobicContact CG-CD1 4.23Å; R347-L351 VanDerWaalsContact O-CG 3.28Å; R347-L351 WeakPolarHBondContact O-CG 3.46Å; R347-L351 PolarHBondContact O-N 3.32Å; R347-L351 VanDerWaalsContact O-N 3.08Å
348	Y	93.9	Very high	93.1	Very high	142 Å²	142	98.5 Å²	98.5	56%	0.557	49%	0.489	S	S	*	.	H	α-helix	trans	-67.5	-38.9	176.7	-68.4	-48.5	0	0	0	112.2	K344 S345 E346 L351 N352	K344-Y348 HydrophobicContact CB-CE2 4.16Å; K344-Y348 WeakPolarHBondContact O-CD2 3.49Å; K344-Y348 PolarHBondContact O-N 2.89Å; S345-Y348 PolarHBondContact O-N 3.15Å; E346-Y348 VanDerWaalsContact C-N 3.33Å; E346-Y348 PolarHBondContact O-N 2.87Å; Y348-L351 PolarHBondContact O-N 3.08Å; Y348-N352 WeakPolarHBondContact O-CB 3.35Å; Y348-N352 VanDerWaalsContact O-CG 3.24Å; Y348-N352 PolarHBondContact O-N 3.2Å; Y348-N352 PolarHBondContact O-ND2 3.44Å
349	L	91.8	Very high	93	Very high	97 Å²	97	99.8 Å²	99.8	51%	0.508	49%	0.491	S	S	.	.	H	α-helix	trans	-60.3	-49	175.3	-176.9	63.6	0	0	0	111.1	S345 E346 L351 N352 T353	S345-L349 PolarHBondContact O-N 3.08Å; E346-L349 PolarHBondContact O-N 3.38Å; L349-L351 VanDerWaalsContact C-N 3.35Å; L349-L351 PolarHBondContact O-N 2.94Å; L349-N352 PolarHBondContact O-N 3.48Å; L349-T353 PolarHBondContact O-N 3.22Å; L349-T353 PolarHBondContact O-OG1 2.9Å
350	L	92.9	Very high	92.9	Very high	124 Å²	124	101.1 Å²	101.1	65%	0.649	50%	0.504	S	S	*	.	H	α-helix	trans	-60	-42.7	178.2	-176.1	141.9	0	0	0	112.3	E346 T353 A354	E346-L350 WeakPolarHBondContact O-CB 3.39Å; E346-L350 PolarHBondContact O-N 2.91Å; L350-T353 PolarHBondContact O-N 3.45Å; L350-A354 WeakPolarHBondContact O-CB 3.31Å; L350-A354 PolarHBondContact O-N 3.31Å
351	L	94.6	Very high	92.9	Very high	90 Å²	90	105.8 Å²	105.8	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-63.6	-42.8	175.9	-73.1	169	0	0	0	112.2	R347 Y348 L349 A354 Y355	R347-L351 HydrophobicContact CG-CD1 4.23Å; R347-L351 VanDerWaalsContact O-CG 3.28Å; R347-L351 WeakPolarHBondContact O-CG 3.46Å; R347-L351 PolarHBondContact O-N 3.32Å; R347-L351 VanDerWaalsContact O-N 3.08Å; Y348-L351 PolarHBondContact O-N 3.08Å; L349-L351 VanDerWaalsContact C-N 3.35Å; L349-L351 PolarHBondContact O-N 2.94Å; L351-A354 PolarHBondContact O-N 3Å; L351-Y355 WeakPolarHBondContact O-CB 3.43Å; L351-Y355 PolarHBondContact O-N 3.06Å
352	N	94.8	Very high	92.9	Very high	98 Å²	98	105.2 Å²	105.2	52%	0.524	52%	0.52	S	S	.	.	H	α-helix	trans	-65.5	-43	178.1	-72.7	-14.8	0	0	0	111.6	Y348 L349 Y355 Q356	Y348-N352 WeakPolarHBondContact O-CB 3.35Å; Y348-N352 VanDerWaalsContact O-CG 3.24Å; Y348-N352 PolarHBondContact O-N 3.2Å; Y348-N352 PolarHBondContact O-ND2 3.44Å; L349-N352 PolarHBondContact O-N 3.48Å; N352-Y355 PolarHBondContact O-N 3.24Å; N352-Q356 WeakPolarHBondContact O-CG 3.3Å; N352-Q356 PolarHBondContact O-N 3.39Å
353	T	92	Very high	92.5	Very high	74 Å²	74	107.3 Å²	107.3	45%	0.454	53%	0.526	S	S	.	.	H	α-helix	trans	-63.5	-42.5	176.7	-53.5	0	0	0	0	111.3	L349 L350 Y355 Q356 Q357	L349-T353 PolarHBondContact O-N 3.22Å; L349-T353 PolarHBondContact O-OG1 2.9Å; L350-T353 PolarHBondContact O-N 3.45Å; T353-Y355 PolarHBondContact O-N 3.47Å; T353-Q356 PolarHBondContact O-N 2.84Å; T353-Q357 WeakPolarHBondContact O-CB 3.31Å; T353-Q357 PolarHBondContact O-N 3.18Å
354	A	92.6	Very high	92.2	Very high	41 Å²	41	111.4 Å²	111.4	34%	0.339	55%	0.55	S	S	.	*	H	α-helix	trans	-62.7	-42.2	175.9	0	0	0	0	0	112	L350 L351 Q357 I358	L350-A354 WeakPolarHBondContact O-CB 3.31Å; L350-A354 PolarHBondContact O-N 3.31Å; L351-A354 PolarHBondContact O-N 3Å; A354-Q357 PolarHBondContact O-N 2.86Å; A354-I358 WeakPolarHBondContact O-CG1 3.39Å; A354-I358 PolarHBondContact O-N 3.21Å; A354-I358 VanDerWaalsContact O-N 3.11Å
355	Y	93.6	Very high	92	Very high	164 Å²	164	107.6 Å²	107.6	64%	0.643	54%	0.544	S	S	*	.	H	α-helix	trans	-62.4	-44.5	175.6	-179.1	-98.5	0	0	0	112.1	L351 N352 T353 Q357 I358 H359	L351-Y355 WeakPolarHBondContact O-CB 3.43Å; L351-Y355 PolarHBondContact O-N 3.06Å; N352-Y355 PolarHBondContact O-N 3.24Å; T353-Y355 PolarHBondContact O-N 3.47Å; Y355-Q357 PolarHBondContact O-N 2.9Å; Y355-I358 PolarHBondContact O-N 3.45Å; Y355-H359 PolarHBondContact O-N 3.35Å
356	Q	92.8	Very high	92	Very high	129 Å²	129	113.5 Å²	113.5	60%	0.603	56%	0.561	S	S	*	*	H	α-helix	trans	-63.4	-39.4	176.2	-73.7	175.4	-9.8	0	0	112.4	N352 T353 H359 A360	N352-Q356 WeakPolarHBondContact O-CG 3.3Å; N352-Q356 PolarHBondContact O-N 3.39Å; T353-Q356 PolarHBondContact O-N 2.84Å; Q356-H359 PolarHBondContact O-N 2.97Å; Q356-A360 WeakPolarHBondContact O-CB 3.5Å; Q356-A360 PolarHBondContact O-N 3.08Å
357	Q	92.4	Very high	92.1	Very high	55 Å²	55	114.1 Å²	114.1	26%	0.257	57%	0.566	S	S	.	*	H	α-helix	trans	-61	-46	176.9	-176.1	-176.5	-29.1	0	0	111.6	T353 A354 Y355 H359 A360 N361 I362 S365	T353-Q357 WeakPolarHBondContact O-CB 3.31Å; T353-Q357 PolarHBondContact O-N 3.18Å; A354-Q357 PolarHBondContact O-N 2.86Å; Y355-Q357 PolarHBondContact O-N 2.9Å; Q357-H359 VanDerWaalsContact C-N 3.34Å; Q357-A360 PolarHBondContact O-N 3.43Å; Q357-N361 PolarHBondContact O-N 2.86Å; Q357-I362 HydrophobicContact CG-CB 4Å; Q357-I362 HydrophobicContact CG-CG2 4.4Å; Q357-I362 WeakPolarHBondContact CG-O 3.21Å; Q357-I362 PolarHBondContact NE2-O 2.9Å; Q357-I362 PolarHBondContact O-N 3.03Å; Q357-S365 PolarHBondContact OE1-OG 2.95Å; Q357-S365 VanDerWaalsContact OE1-OG 3.04Å
358	I	93.8	Very high	92.1	Very high	126 Å²	126	110.4 Å²	110.4	65%	0.646	56%	0.557	S	S	*	*	H	α-helix	trans	-62.4	-44.5	177	-66.1	165.4	0	0	0	110	A354 Y355 A360 N361	A354-I358 WeakPolarHBondContact O-CG1 3.39Å; A354-I358 PolarHBondContact O-N 3.21Å; A354-I358 VanDerWaalsContact O-N 3.11Å; Y355-I358 PolarHBondContact O-N 3.45Å; I358-A360 PolarHBondContact O-N 3.37Å; I358-N361 PolarHBondContact O-N 3.29Å; I358-N361 VanDerWaalsContact O-N 3.08Å
359	H	93.2	Very high	92	Very high	152 Å²	152	107 Å²	107	70%	0.704	55%	0.546	S	S	*	.	H	α-helix	trans	-64.2	-31.3	179.6	-163.9	64.8	0	0	0	113	Y355 Q356 Q357 N361	Y355-H359 PolarHBondContact O-N 3.35Å; Q356-H359 PolarHBondContact O-N 2.97Å; Q357-H359 VanDerWaalsContact C-N 3.34Å; H359-N361 VanDerWaalsContact C-N 3.29Å; H359-N361 PolarHBondContact O-N 2.84Å
360	A	93	Very high	91.9	Very high	60 Å²	60	106.5 Å²	106.5	50%	0.496	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	1	175.9	0	0	0	0	0	114.1	Q356 Q357 I358 I362	Q356-A360 WeakPolarHBondContact O-CB 3.5Å; Q356-A360 PolarHBondContact O-N 3.08Å; Q357-A360 PolarHBondContact O-N 3.43Å; I358-A360 PolarHBondContact O-N 3.37Å; A360-I362 HydrophobicContact CB-CD1 3.81Å; A360-I362 HydrophobicContact CB-CG1 3.94Å; A360-I362 PolarHBondContact O-N 3.04Å
361	N	93.4	Very high	92	Very high	147 Å²	147	102.6 Å²	102.6	79%	0.786	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	36.3	-174.9	-74.2	-26.6	0	0	0	113.9	Q357 I358 H359	Q357-N361 PolarHBondContact O-N 2.86Å; I358-N361 PolarHBondContact O-N 3.29Å; I358-N361 VanDerWaalsContact O-N 3.08Å; H359-N361 VanDerWaalsContact C-N 3.29Å; H359-N361 PolarHBondContact O-N 2.84Å
362	I	91.3	Very high	92	Very high	91 Å²	91	105.4 Å²	105.4	47%	0.467	53%	0.527	S	S	.	.			trans	-92	109.1	177.7	-60.4	169.2	0	0	0	109.3	Q357 A360	Q357-I362 HydrophobicContact CG-CB 4Å; Q357-I362 HydrophobicContact CG-CG2 4.4Å; Q357-I362 WeakPolarHBondContact CG-O 3.21Å; Q357-I362 PolarHBondContact NE2-O 2.9Å; Q357-I362 PolarHBondContact O-N 3.03Å; A360-I362 HydrophobicContact CB-CD1 3.81Å; A360-I362 HydrophobicContact CB-CG1 3.94Å; A360-I362 PolarHBondContact O-N 3.04Å
363	E	85.2	Confident	92	Very high	194 Å²	194	102 Å²	102	91%	0.907	51%	0.507	S	S	*	.	S	Bend	trans	-70.2	-39.1	-177.9	-65.7	-176.4	173.1	0	0	113.2
364	N	87.4	Confident	92.1	Very high	121 Å²	121	100.9 Å²	100.9	65%	0.647	50%	0.499	S	S	*	.			trans	-132.7	120.2	-178	-171.4	11.4	0	0	0	111.6	W366	N364-W366 WeakPolarHBondContact OD1-CB 3.5Å; N364-W366 PolarHBondContact OD1-N 2.97Å
365	S	87.8	Confident	92.3	Very high	82 Å²	82	104.8 Å²	104.8	57%	0.573	51%	0.511	S	S	*	.			trans	-100.7	10.1	176.2	50.7	0	0	0	0	113.2	Q357 N367	Q357-S365 PolarHBondContact OE1-OG 2.95Å; Q357-S365 VanDerWaalsContact OE1-OG 3.04Å; S365-N367 PolarHBondContact O-N 3.3Å
366	W	91.5	Very high	92.5	Very high	157 Å²	157	100.3 Å²	100.3	60%	0.595	50%	0.497	S	S	*	.			trans	-60.8	123	178.7	-177.5	-91.1	0	0	0	112.3	N364 E368 V371	N364-W366 WeakPolarHBondContact OD1-CB 3.5Å; N364-W366 PolarHBondContact OD1-N 2.97Å; W366-E368 PolarHBondContact NE1-OE2 3.31Å; W366-V371 HydrophobicContact CD2-CG2 4.33Å; W366-V371 HydrophobicContact CE3-CG2 4.28Å; W366-V371 HydrophobicContact CH2-CB 4.36Å; W366-V371 HydrophobicContact CH2-CG1 3.86Å; W366-V371 HydrophobicContact CH2-CG2 3.81Å; W366-V371 HydrophobicContact CZ2-CB 4.2Å; W366-V371 HydrophobicContact CZ2-CG1 3.97Å; W366-V371 HydrophobicContact CZ2-CG2 3.85Å; W366-V371 HydrophobicContact CZ3-CG2 4.03Å
367	N	92.5	Very high	92.6	Very high	76 Å²	76	96.6 Å²	96.6	41%	0.406	48%	0.477	S	S	.	.			trans	-120.8	105.7	172.7	-174	-26	0	0	0	110	S365 E369 E370 V371	S365-N367 PolarHBondContact O-N 3.3Å; N367-E369 VanDerWaalsContact C-N 3.3Å; N367-E369 PolarHBondContact O-N 2.85Å; N367-E369 PolarHBondContact OD1-N 2.91Å; N367-E369 VanDerWaalsContact OD1-N 3.12Å; N367-E370 HydrophobicContact CB-CB 4.24Å; N367-E370 HydrophobicContact CB-CG 4.27Å; N367-E370 PolarHBondContact O-N 3.3Å; N367-E370 PolarHBondContact OD1-N 3.25Å; N367-V371 WeakPolarHBondContact O-CG2 3.32Å; N367-V371 PolarHBondContact O-N 3.4Å; N367-V371 VanDerWaalsContact O-N 3.08Å
368	E	93.8	Very high	92.8	Very high	99 Å²	99	96.9 Å²	96.9	46%	0.463	48%	0.483	S	S	.	.	H	α-helix	trans	-54.8	-43.6	-177.5	-167.7	64.8	-156.3	0	0	112.2	W366 E370 V371 W372	W366-E368 PolarHBondContact NE1-OE2 3.31Å; E368-E370 PolarHBondContact O-N 2.9Å; E368-V371 PolarHBondContact O-N 3.11Å; E368-W372 VanDerWaalsContact O-CD1 3.23Å; E368-W372 PolarHBondContact O-N 3Å; E368-W372 PolarHBondContact OE1-NE1 2.79Å
369	E	92.3	Very high	93	Very high	69 Å²	69	94.1 Å²	94.1	32%	0.322	48%	0.475	S	S	.	.	H	α-helix	trans	-64.3	-41.7	-178.3	-176.9	177.2	177	0	0	111.8	N367 R373 W432 R433	N367-E369 VanDerWaalsContact C-N 3.3Å; N367-E369 PolarHBondContact O-N 2.85Å; N367-E369 PolarHBondContact OD1-N 2.91Å; N367-E369 VanDerWaalsContact OD1-N 3.12Å; E369-R373 WeakPolarHBondContact O-CB 3.46Å; E369-R373 PolarHBondContact O-N 3.2Å; E369-W432 HydrophobicContact CG-CZ2 4.4Å; E369-W432 PolarHBondContact OE1-NE1 3.36Å; E369-R433 VanDerWaalsContact CD-NH2 3.26Å; E369-R433 IonicContact OE1-CZ 3.8Å; E369-R433 IonicContact OE1-NE 3.74Å; E369-R433 PolarHBondContact OE1-NE 3.34Å; E369-R433 IonicContact OE1-NH2 3.85Å; E369-R433 PolarHBondContact OE1-NH2 3.32Å; E369-R433 IonicContact OE2-CZ 2.8Å; E369-R433 IonicContact OE2-NH2 2.76Å; E369-R433 PolarHBondContact OE2-NH2 3.14Å
370	E	89.4	Confident	93.2	Very high	87 Å²	87	89 Å²	89	41%	0.407	45%	0.451	S	S	.	.	H	α-helix	trans	-70.2	-35.8	179	-67.4	-151.2	117.1	0	0	112.7	N367 E368 R373 V374	N367-E370 HydrophobicContact CB-CB 4.24Å; N367-E370 HydrophobicContact CB-CG 4.27Å; N367-E370 PolarHBondContact O-N 3.3Å; N367-E370 PolarHBondContact OD1-N 3.25Å; E368-E370 PolarHBondContact O-N 2.9Å; E370-R373 PolarHBondContact O-N 3.13Å; E370-R373 IonicContact OE1-CZ 2.75Å; E370-R373 IonicContact OE1-NH1 3.69Å; E370-R373 PolarHBondContact OE1-NH1 3.37Å; E370-R373 IonicContact OE1-NH2 3.02Å; E370-R373 PolarHBondContact OE1-NH2 3.27Å; E370-V374 WeakPolarHBondContact O-CG2 3.42Å; E370-V374 PolarHBondContact O-N 3.46Å; E370-V374 VanDerWaalsContact O-N 3.07Å
371	V	95.3	Very high	93.4	Very high	43 Å²	43	87 Å²	87	26%	0.261	44%	0.435	S	S	.	.	H	α-helix	trans	-62.4	-53.6	174.6	172.9	0	0	0	0	109.8	W366 N367 E368 R373 V374 E375	W366-V371 HydrophobicContact CD2-CG2 4.33Å; W366-V371 HydrophobicContact CE3-CG2 4.28Å; W366-V371 HydrophobicContact CH2-CB 4.36Å; W366-V371 HydrophobicContact CH2-CG1 3.86Å; W366-V371 HydrophobicContact CH2-CG2 3.81Å; W366-V371 HydrophobicContact CZ2-CB 4.2Å; W366-V371 HydrophobicContact CZ2-CG1 3.97Å; W366-V371 HydrophobicContact CZ2-CG2 3.85Å; W366-V371 HydrophobicContact CZ3-CG2 4.03Å; N367-V371 WeakPolarHBondContact O-CG2 3.32Å; N367-V371 PolarHBondContact O-N 3.4Å; N367-V371 VanDerWaalsContact O-N 3.08Å; E368-V371 PolarHBondContact O-N 3.11Å; V371-R373 VanDerWaalsContact C-N 3.28Å; V371-R373 PolarHBondContact O-N 3.45Å; V371-V374 PolarHBondContact O-N 2.99Å; V371-V374 VanDerWaalsContact O-N 3.1Å; V371-E375 HydrophobicContact CG1-CG 4.25Å; V371-E375 WeakPolarHBondContact O-CG 3.44Å; V371-E375 PolarHBondContact O-N 2.96Å
372	W	95	Very high	93.6	Very high	149 Å²	149	85.5 Å²	85.5	56%	0.564	43%	0.426	S	S	*	.	H	α-helix	trans	-56.7	-42	177.2	-84.9	101.9	0	0	0	112.7	E368 V374 M376	E368-W372 VanDerWaalsContact O-CD1 3.23Å; E368-W372 PolarHBondContact O-N 3Å; E368-W372 PolarHBondContact OE1-NE1 2.79Å; W372-V374 VanDerWaalsContact C-N 3.35Å; W372-V374 PolarHBondContact O-N 3.47Å; W372-M376 HydrophobicContact CE3-CG 4.33Å; W372-M376 WeakPolarHBondContact O-CB 3.37Å; W372-M376 WeakPolarHBondContact O-CG 3.34Å; W372-M376 PolarHBondContact O-N 2.8Å
373	R	94.6	Very high	93.9	Very high	26 Å²	26	85.2 Å²	85.2	10%	0.098	42%	0.424	C	S	.	.	H	α-helix	trans	-56	-50.8	176.2	-178.3	-172.1	65.9	-157.3	-4.9	110.9	E369 E370 V371 Y377 L429 W432	E369-R373 WeakPolarHBondContact O-CB 3.46Å; E369-R373 PolarHBondContact O-N 3.2Å; E370-R373 PolarHBondContact O-N 3.13Å; E370-R373 IonicContact OE1-CZ 2.75Å; E370-R373 IonicContact OE1-NH1 3.69Å; E370-R373 PolarHBondContact OE1-NH1 3.37Å; E370-R373 IonicContact OE1-NH2 3.02Å; E370-R373 PolarHBondContact OE1-NH2 3.27Å; V371-R373 VanDerWaalsContact C-N 3.28Å; V371-R373 PolarHBondContact O-N 3.45Å; R373-Y377 HydrophobicContact CG-CD1 4.3Å; R373-Y377 WeakPolarHBondContact O-CD1 3.33Å; R373-Y377 PolarHBondContact O-N 2.92Å; R373-L429 WeakPolarHBondContact CG-O 3.4Å; R373-W432 HydrophobicContact CB-CD2 4.49Å; R373-W432 VanDerWaalsContact CD-CB 3.45Å; R373-W432 HydrophobicContact CG-CB 4.06Å; R373-W432 HydrophobicContact CG-CD2 4.13Å; R373-W432 HydrophobicContact CG-CE3 4.1Å; R373-W432 HydrophobicContact CG-CG 4.12Å
374	V	94.4	Very high	94.5	Very high	50 Å²	50	76.3 Å²	76.3	30%	0.303	38%	0.383	S	S	.	.	H	α-helix	trans	-64.9	-50.8	-177.1	174.4	0	0	0	0	111.8	E370 V371 W372 M376 Y377 V378	E370-V374 WeakPolarHBondContact O-CG2 3.42Å; E370-V374 PolarHBondContact O-N 3.46Å; E370-V374 VanDerWaalsContact O-N 3.07Å; V371-V374 PolarHBondContact O-N 2.99Å; V371-V374 VanDerWaalsContact O-N 3.1Å; W372-V374 VanDerWaalsContact C-N 3.35Å; W372-V374 PolarHBondContact O-N 3.47Å; V374-M376 VanDerWaalsContact C-N 3.26Å; V374-M376 PolarHBondContact O-N 3.05Å; V374-Y377 VanDerWaalsContact CA-CE1 3.46Å; V374-Y377 HydrophobicContact CB-CE1 4.12Å; V374-Y377 HydrophobicContact CG1-CE1 4.42Å; V374-Y377 HydrophobicContact CG2-CE1 3.88Å; V374-Y377 PolarHBondContact O-N 3.31Å; V374-V378 HydrophobicContact CG1-CG2 4.23Å; V374-V378 WeakPolarHBondContact O-CB 3.37Å; V374-V378 VanDerWaalsContact O-CG2 3.23Å; V374-V378 WeakPolarHBondContact O-CG2 3.5Å; V374-V378 PolarHBondContact O-N 3.21Å
375	E	96.6	Very high	95	Very high	123 Å²	123	73.3 Å²	73.3	58%	0.575	36%	0.364	S	S	*	.	H	α-helix	trans	-57.4	-41.9	179.6	-65.9	-55.4	142.8	0	0	111.6	V371 S379	V371-E375 HydrophobicContact CG1-CG 4.25Å; V371-E375 WeakPolarHBondContact O-CG 3.44Å; V371-E375 PolarHBondContact O-N 2.96Å; E375-S379 VanDerWaalsContact O-CB 3.28Å; E375-S379 WeakPolarHBondContact O-CB 3.33Å; E375-S379 PolarHBondContact O-N 3.35Å; E375-S379 VanDerWaalsContact O-N 3.1Å
376	M	96.3	Very high	95.4	Very high	71 Å²	71	71.4 Å²	71.4	35%	0.35	36%	0.358	S	S	.	.	H	α-helix	trans	-67.7	-55.7	179.9	-72.7	-68.9	-71.4	0	0	112.3	W372 V374 V378 S379 F380 L429	W372-M376 HydrophobicContact CE3-CG 4.33Å; W372-M376 WeakPolarHBondContact O-CB 3.37Å; W372-M376 WeakPolarHBondContact O-CG 3.34Å; W372-M376 PolarHBondContact O-N 2.8Å; V374-M376 VanDerWaalsContact C-N 3.26Å; V374-M376 PolarHBondContact O-N 3.05Å; M376-V378 VanDerWaalsContact C-N 3.28Å; M376-V378 PolarHBondContact O-N 3.04Å; M376-S379 PolarHBondContact O-N 3.33Å; M376-F380 HydrophobicContact CE-CD2 4.4Å; M376-F380 HydrophobicContact CE-CE2 3.62Å; M376-F380 HydrophobicContact CE-CZ 4.43Å; M376-F380 VanDerWaalsContact O-CD2 3.26Å; M376-F380 WeakPolarHBondContact O-CD2 3.42Å; M376-F380 PolarHBondContact O-N 3.41Å; M376-L429 HydrophobicContact CB-CD1 4.09Å
377	Y	95.8	Very high	95.7	Very high	50 Å²	50	65.5 Å²	65.5	20%	0.196	34%	0.338	C	S	.	.	H	α-helix	trans	-65.4	-34.7	-176	79	-111.5	0	0	0	111.5	R373 V374 F380 G381 H426 F430	R373-Y377 HydrophobicContact CG-CD1 4.3Å; R373-Y377 WeakPolarHBondContact O-CD1 3.33Å; R373-Y377 PolarHBondContact O-N 2.92Å; V374-Y377 VanDerWaalsContact CA-CE1 3.46Å; V374-Y377 HydrophobicContact CB-CE1 4.12Å; V374-Y377 HydrophobicContact CG1-CE1 4.42Å; V374-Y377 HydrophobicContact CG2-CE1 3.88Å; V374-Y377 PolarHBondContact O-N 3.31Å; Y377-F380 PolarHBondContact O-N 2.94Å; Y377-G381 PolarHBondContact O-N 3.06Å; Y377-H426 AromaticContact CD2-CE1 3.86Å; Y377-H426 AromaticContact CD2-ND1 3.98Å; Y377-H426 PolarHBondContact O-ND1 2.91Å; Y377-F430 HydrophobicContact CD1-CB 4.37Å; Y377-F430 HydrophobicContact CD2-CB 4.47Å; Y377-F430 HydrophobicContact CE1-CD2 4.26Å; Y377-F430 HydrophobicContact CE2-CD2 4.26Å; Y377-F430 HydrophobicContact CG-CB 4.22Å
378	V	96.9	Very high	95.9	Very high	62 Å²	62	62.5 Å²	62.5	38%	0.376	32%	0.321	S	S	.	.	H	α-helix	trans	-62.5	-47.6	176.3	171.9	0	0	0	0	110.6	V374 M376 F380 G381 I382	V374-V378 HydrophobicContact CG1-CG2 4.23Å; V374-V378 WeakPolarHBondContact O-CB 3.37Å; V374-V378 VanDerWaalsContact O-CG2 3.23Å; V374-V378 WeakPolarHBondContact O-CG2 3.5Å; V374-V378 PolarHBondContact O-N 3.21Å; M376-V378 VanDerWaalsContact C-N 3.28Å; M376-V378 PolarHBondContact O-N 3.04Å; V378-F380 PolarHBondContact O-N 3.33Å; V378-G381 PolarHBondContact O-N 3.43Å; V378-G381 VanDerWaalsContact O-N 3.15Å; V378-I382 HydrophobicContact CG1-CD1 4.05Å; V378-I382 WeakPolarHBondContact O-CG1 3.49Å; V378-I382 PolarHBondContact O-N 3.05Å
379	S	97.6	Very high	96.1	Very high	68 Å²	68	59 Å²	59	48%	0.476	31%	0.308	S	S	.	.	H	α-helix	trans	-59.1	-46.1	177.6	-178.1	0	0	0	0	112.6	E375 M376 G381 I382 M383	E375-S379 VanDerWaalsContact O-CB 3.28Å; E375-S379 WeakPolarHBondContact O-CB 3.33Å; E375-S379 PolarHBondContact O-N 3.35Å; E375-S379 VanDerWaalsContact O-N 3.1Å; M376-S379 PolarHBondContact O-N 3.33Å; S379-G381 VanDerWaalsContact C-N 3.31Å; S379-G381 PolarHBondContact O-N 2.8Å; S379-I382 PolarHBondContact O-N 3.41Å; S379-M383 PolarHBondContact O-N 3.26Å
380	F	97.7	Very high	96.3	Very high	45 Å²	45	58.9 Å²	58.9	20%	0.197	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-36.3	175.7	-85	-103.7	0	0	0	112.4	M376 Y377 V378 M383 S384 I422 I425 H426 L429	M376-F380 HydrophobicContact CE-CD2 4.4Å; M376-F380 HydrophobicContact CE-CE2 3.62Å; M376-F380 HydrophobicContact CE-CZ 4.43Å; M376-F380 VanDerWaalsContact O-CD2 3.26Å; M376-F380 WeakPolarHBondContact O-CD2 3.42Å; M376-F380 PolarHBondContact O-N 3.41Å; Y377-F380 PolarHBondContact O-N 2.94Å; V378-F380 PolarHBondContact O-N 3.33Å; F380-M383 HydrophobicContact CD1-CE 3.96Å; F380-M383 HydrophobicContact CE1-CE 4.03Å; F380-M383 HydrophobicContact CG-CE 4.38Å; F380-M383 PolarHBondContact O-N 3.43Å; F380-S384 WeakPolarHBondContact O-CB 3.09Å; F380-S384 PolarHBondContact O-N 3.27Å; F380-I422 HydrophobicContact CB-CG2 4.29Å; F380-I422 HydrophobicContact CD1-CG2 3.82Å; F380-I422 HydrophobicContact CG-CG2 4.47Å; F380-I422 VanDerWaalsContact O-CG2 3.23Å; F380-I422 WeakPolarHBondContact O-CG2 3.27Å; F380-I425 HydrophobicContact CD1-CB 3.92Å; F380-I425 HydrophobicContact CD1-CG2 3.47Å; F380-I425 VanDerWaalsContact CD1-CG2 3.47Å; F380-I425 HydrophobicContact CE1-CB 4.18Å; F380-I425 HydrophobicContact CE1-CD1 4.15Å; F380-I425 HydrophobicContact CE1-CG2 3.54Å; F380-I425 HydrophobicContact CG-CG2 4.09Å; F380-I425 HydrophobicContact CZ-CG2 4.17Å; F380-H426 HydrophobicContact CB-CB 4.03Å; F380-L429 HydrophobicContact CD2-CD1 3.99Å; F380-L429 HydrophobicContact CE2-CD1 4.32Å; F380-L429 HydrophobicContact CG-CD1 4.24Å
381	G	97.3	Very high	96.5	Very high	17 Å²	17	55.4 Å²	55.4	18%	0.175	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-46	174.3	0	0	0	0	0	112.3	Y377 V378 S379 S384 F385	Y377-G381 PolarHBondContact O-N 3.06Å; V378-G381 PolarHBondContact O-N 3.43Å; V378-G381 VanDerWaalsContact O-N 3.15Å; S379-G381 VanDerWaalsContact C-N 3.31Å; S379-G381 PolarHBondContact O-N 2.8Å; G381-S384 PolarHBondContact O-N 3.42Å; G381-F385 PolarHBondContact O-N 2.99Å
382	I	97.7	Very high	96.6	Very high	115 Å²	115	54 Å²	54	59%	0.59	29%	0.286	S	S	*	.	H	α-helix	trans	-62.8	-46.3	177.2	-65	166.5	0	0	0	110.8	V378 S379 S384 F385 G386	V378-I382 HydrophobicContact CG1-CD1 4.05Å; V378-I382 WeakPolarHBondContact O-CG1 3.49Å; V378-I382 PolarHBondContact O-N 3.05Å; S379-I382 PolarHBondContact O-N 3.41Å; I382-S384 PolarHBondContact O-N 2.89Å; I382-F385 PolarHBondContact O-N 3.21Å; I382-G386 PolarHBondContact O-N 2.95Å
383	M	97.6	Very high	96.7	Very high	86 Å²	86	51 Å²	51	42%	0.424	28%	0.28	S	S	.	.	H	α-helix	trans	-62.2	-43.3	178.5	-178.2	169.3	53.4	0	0	112	S379 F380 F385 G386 L387 I422	S379-M383 PolarHBondContact O-N 3.26Å; F380-M383 HydrophobicContact CD1-CE 3.96Å; F380-M383 HydrophobicContact CE1-CE 4.03Å; F380-M383 HydrophobicContact CG-CE 4.38Å; F380-M383 PolarHBondContact O-N 3.43Å; M383-F385 PolarHBondContact O-N 2.96Å; M383-G386 PolarHBondContact O-N 2.9Å; M383-L387 PolarHBondContact O-N 3Å; M383-L387 VanDerWaalsContact O-N 3.13Å; M383-I422 HydrophobicContact CB-CG2 4.21Å; M383-I422 HydrophobicContact CE-CD1 3.76Å; M383-I422 HydrophobicContact CE-CG1 4.02Å; M383-I422 HydrophobicContact CE-CG2 3.66Å; M383-I422 HydrophobicContact CG-CD1 4.06Å; M383-I422 HydrophobicContact CG-CG2 4.25Å; M383-I422 HydrophobicContact SD-CD1 4Å
384	S	97.4	Very high	96.7	Very high	7 Å²	7	50 Å²	50	5%	0.049	28%	0.277	C	S	.	.	H	α-helix	trans	-59.9	-46.6	175.9	-176	0	0	0	0	111.4	F380 G381 I382 G386 L387 M388 A419 A423	F380-S384 WeakPolarHBondContact O-CB 3.09Å; F380-S384 PolarHBondContact O-N 3.27Å; G381-S384 PolarHBondContact O-N 3.42Å; I382-S384 PolarHBondContact O-N 2.89Å; S384-G386 VanDerWaalsContact C-N 3.34Å; S384-G386 PolarHBondContact O-N 3.44Å; S384-L387 PolarHBondContact O-N 3.47Å; S384-M388 WeakPolarHBondContact O-CG 3.43Å; S384-M388 PolarHBondContact O-N 3.45Å; S384-A419 PolarHBondContact OG-O 3.48Å; S384-A423 WeakPolarHBondContact OG-CB 3.47Å
385	F	97.3	Very high	96.6	Very high	57 Å²	57	48.3 Å²	48.3	25%	0.25	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-38	178	-178.2	-108.3	0	0	0	113	F327 A330 A331 I334 G381 I382 M383 L387 M388 S389	F327-F385 HydrophobicContact CD2-CE2 4.1Å; F327-F385 HydrophobicContact CE2-CD2 4.22Å; F327-F385 AromaticContact CE2-CE2 3.5Å; F327-F385 HydrophobicContact CE2-CE2 3.5Å; F327-F385 VanDerWaalsContact CE2-CE2 3.5Å; F327-F385 AromaticContact CE2-CZ 3.88Å; F327-F385 HydrophobicContact CE2-CZ 3.88Å; F327-F385 HydrophobicContact CZ-CE2 4.2Å; F327-F385 HydrophobicContact CZ-CZ 4.25Å; A330-F385 HydrophobicContact CB-CD2 4.5Å; A331-F385 HydrophobicContact CB-CE2 3.81Å; A331-F385 HydrophobicContact CB-CZ 4.09Å; I334-F385 HydrophobicContact CD1-CB 3.64Å; I334-F385 HydrophobicContact CD1-CD1 3.49Å; I334-F385 VanDerWaalsContact CD1-CD1 3.49Å; I334-F385 HydrophobicContact CD1-CD2 3.28Å; I334-F385 HydrophobicContact CD1-CE1 3.9Å; I334-F385 HydrophobicContact CD1-CE2 3.71Å; I334-F385 HydrophobicContact CD1-CG 3.15Å; I334-F385 HydrophobicContact CD1-CZ 4Å; G381-F385 PolarHBondContact O-N 2.99Å; I382-F385 PolarHBondContact O-N 3.21Å; M383-F385 PolarHBondContact O-N 2.96Å; F385-L387 VanDerWaalsContact C-N 3.33Å; F385-L387 PolarHBondContact O-N 2.85Å; F385-M388 PolarHBondContact O-N 3.17Å; F385-S389 WeakPolarHBondContact O-CB 3.29Å; F385-S389 PolarHBondContact O-N 3.26Å; F385-S389 PolarHBondContact O-OG 2.9Å
386	G	97.5	Very high	96.5	Very high	43 Å²	43	46.2 Å²	46.2	44%	0.443	26%	0.259	S	S	.	.	H	α-helix	trans	-58.1	-44.9	173.5	0	0	0	0	0	112.2	I382 M383 S384 S389 L390	I382-G386 PolarHBondContact O-N 2.95Å; M383-G386 PolarHBondContact O-N 2.9Å; S384-G386 VanDerWaalsContact C-N 3.34Å; S384-G386 PolarHBondContact O-N 3.44Å; G386-S389 WeakPolarHBondContact O-CB 3.38Å; G386-S389 PolarHBondContact O-N 3.31Å; G386-L390 PolarHBondContact O-N 2.71Å
387	L	97	Very high	96.2	Very high	33 Å²	33	46.7 Å²	46.7	17%	0.173	27%	0.268	C	S	.	.	H	α-helix	trans	-66.6	-44.4	175.3	-67.4	172.7	0	0	0	112.2	M383 S384 F385 S389 L390 L391 I418 A419 I422	M383-L387 PolarHBondContact O-N 3Å; M383-L387 VanDerWaalsContact O-N 3.13Å; S384-L387 PolarHBondContact O-N 3.47Å; F385-L387 VanDerWaalsContact C-N 3.33Å; F385-L387 PolarHBondContact O-N 2.85Å; L387-S389 PolarHBondContact O-N 2.91Å; L387-L390 WeakPolarHBondContact O-CB 3.41Å; L387-L390 PolarHBondContact O-N 3.48Å; L387-L390 VanDerWaalsContact O-N 3.1Å; L387-L391 WeakPolarHBondContact O-CG 3.39Å; L387-L391 PolarHBondContact O-N 3.47Å; L387-L391 VanDerWaalsContact O-N 3.13Å; L387-I418 HydrophobicContact CD1-CG2 3.78Å; L387-A419 HydrophobicContact CB-CB 3.76Å; L387-A419 HydrophobicContact CD1-CB 4.24Å; L387-I422 HydrophobicContact CD1-CD1 3.59Å
388	M	96.8	Very high	96	Very high	12 Å²	12	48.4 Å²	48.4	6%	0.059	29%	0.287	C	S	.	.	H	α-helix	trans	-61.3	-34.5	176.6	-68.7	-177.9	73.8	0	0	112.4	L284 S326 F327 A330 S384 F385 L390 L391 A392 A419	L284-M388 HydrophobicContact CD1-CE 4.39Å; L284-M388 HydrophobicContact CD2-CE 4.25Å; L284-M388 HydrophobicContact CD2-SD 4.19Å; S326-M388 VanDerWaalsContact OG-CE 3.29Å; S326-M388 WeakPolarHBondContact OG-CE 3.38Å; F327-M388 HydrophobicContact CB-CE 4.3Å; F327-M388 HydrophobicContact CD2-CB 3.95Å; A330-M388 HydrophobicContact CB-CE 4.13Å; A330-M388 HydrophobicContact CB-SD 4.22Å; S384-M388 WeakPolarHBondContact O-CG 3.43Å; S384-M388 PolarHBondContact O-N 3.45Å; F385-M388 PolarHBondContact O-N 3.17Å; M388-L390 VanDerWaalsContact C-N 3.33Å; M388-L390 PolarHBondContact O-N 2.93Å; M388-L391 WeakPolarHBondContact O-CB 3.48Å; M388-L391 PolarHBondContact O-N 3.49Å; M388-A392 PolarHBondContact O-N 2.96Å; M388-A419 HydrophobicContact CG-CB 4.28Å
389	S	97.6	Very high	95.8	Very high	25 Å²	25	48 Å²	48	18%	0.175	28%	0.282	C	S	.	.	H	α-helix	trans	-62	-41.1	174.3	-59.5	0	0	0	0	111.4	F327 F385 G386 L387 A392 I393	F327-S389 WeakPolarHBondContact CE2-OG 3.38Å; F385-S389 WeakPolarHBondContact O-CB 3.29Å; F385-S389 PolarHBondContact O-N 3.26Å; F385-S389 PolarHBondContact O-OG 2.9Å; G386-S389 WeakPolarHBondContact O-CB 3.38Å; G386-S389 PolarHBondContact O-N 3.31Å; L387-S389 PolarHBondContact O-N 2.91Å; S389-A392 PolarHBondContact O-N 3.13Å; S389-I393 VanDerWaalsContact O-CG1 3.24Å; S389-I393 WeakPolarHBondContact O-CG1 3.28Å; S389-I393 PolarHBondContact O-N 2.93Å
390	L	95.9	Very high	95.6	Very high	67 Å²	67	46.3 Å²	46.3	35%	0.351	27%	0.271	S	S	.	.	H	α-helix	trans	-63.9	-40.2	175.2	-174.6	68.1	0	0	0	112.1	G386 L387 M388 A392 I393 T394 I411 L415	G386-L390 PolarHBondContact O-N 2.71Å; L387-L390 WeakPolarHBondContact O-CB 3.41Å; L387-L390 PolarHBondContact O-N 3.48Å; L387-L390 VanDerWaalsContact O-N 3.1Å; M388-L390 VanDerWaalsContact C-N 3.33Å; M388-L390 PolarHBondContact O-N 2.93Å; L390-A392 VanDerWaalsContact C-N 3.33Å; L390-A392 PolarHBondContact O-N 3.06Å; L390-I393 PolarHBondContact O-N 3.28Å; L390-T394 WeakPolarHBondContact O-CG2 3.41Å; L390-T394 PolarHBondContact O-N 3.4Å; L390-T394 PolarHBondContact O-OG1 3.49Å; L390-I411 HydrophobicContact CD2-CG2 4.48Å; L390-I411 HydrophobicContact CG-CG2 4.3Å; L390-L415 HydrophobicContact CD2-CD1 3.48Å; L390-L415 VanDerWaalsContact CD2-CD1 3.48Å
391	L	95.1	Very high	95.3	Very high	14 Å²	14	50.7 Å²	50.7	7%	0.073	30%	0.296	C	S	.	.	H	α-helix	trans	-62.8	-39.9	174.5	-57.5	175.4	0	0	0	111.8	L387 M388 T394 S395 I411 Q412 A419	L387-L391 WeakPolarHBondContact O-CG 3.39Å; L387-L391 PolarHBondContact O-N 3.47Å; L387-L391 VanDerWaalsContact O-N 3.13Å; M388-L391 WeakPolarHBondContact O-CB 3.48Å; M388-L391 PolarHBondContact O-N 3.49Å; L391-T394 PolarHBondContact O-OG1 3.26Å; L391-S395 PolarHBondContact O-N 3.48Å; L391-S395 PolarHBondContact O-OG 3.37Å; L391-I411 HydrophobicContact CD2-CG2 3.91Å; L391-I411 WeakPolarHBondContact CD2-O 3.26Å; L391-Q412 PolarHBondContact O-NE2 3.49Å; L391-A419 HydrophobicContact CD1-CB 4.31Å
392	A	95.9	Very high	95.2	Very high	14 Å²	14	54 Å²	54	12%	0.116	32%	0.317	C	S	.	.	H	α-helix	trans	-68.6	-44.2	178.2	0	0	0	0	0	112	L324 F327 M388 S389 L390 T394 S395	L324-A392 HydrophobicContact CD2-CB 4.35Å; F327-A392 HydrophobicContact CB-CB 4.45Å; F327-A392 HydrophobicContact CD1-CB 3.6Å; F327-A392 HydrophobicContact CD2-CB 4.15Å; F327-A392 HydrophobicContact CE1-CB 3.79Å; F327-A392 HydrophobicContact CE2-CB 4.31Å; F327-A392 HydrophobicContact CG-CB 3.78Å; F327-A392 HydrophobicContact CZ-CB 4.14Å; M388-A392 PolarHBondContact O-N 2.96Å; S389-A392 PolarHBondContact O-N 3.13Å; L390-A392 VanDerWaalsContact C-N 3.33Å; L390-A392 PolarHBondContact O-N 3.06Å; A392-T394 PolarHBondContact O-N 2.9Å; A392-S395 VanDerWaalsContact O-CB 3.26Å; A392-S395 WeakPolarHBondContact O-CB 3.29Å; A392-S395 PolarHBondContact O-N 2.83Å; A392-S395 VanDerWaalsContact O-N 3.11Å
393	I	96.5	Very high	95	Very high	85 Å²	85	50.8 Å²	50.8	44%	0.436	30%	0.3	S	S	.	.	H	α-helix	trans	-61.5	-45.2	178	-70.5	164.8	0	0	0	110.6	S389 L390 S395 I396 I399	S389-I393 VanDerWaalsContact O-CG1 3.24Å; S389-I393 WeakPolarHBondContact O-CG1 3.28Å; S389-I393 PolarHBondContact O-N 2.93Å; L390-I393 PolarHBondContact O-N 3.28Å; I393-S395 PolarHBondContact O-N 2.94Å; I393-S395 VanDerWaalsContact O-N 3.15Å; I393-I396 WeakPolarHBondContact O-CB 3.39Å; I393-I396 VanDerWaalsContact O-CG1 3.28Å; I393-I396 WeakPolarHBondContact O-CG1 3.47Å; I393-I396 PolarHBondContact O-N 3.13Å; I393-I396 VanDerWaalsContact O-N 3.08Å; I393-I399 HydrophobicContact CG2-CD1 3.42Å; I393-I399 VanDerWaalsContact CG2-CD1 3.42Å
394	T	95	Very high	94.9	Very high	6 Å²	6	50.4 Å²	50.4	4%	0.037	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-8.5	178.7	52.9	0	0	0	0	114	L390 L391 A392 I396 I399 L403 I411 Q412	L390-T394 WeakPolarHBondContact O-CG2 3.41Å; L390-T394 PolarHBondContact O-N 3.4Å; L390-T394 PolarHBondContact O-OG1 3.49Å; L391-T394 PolarHBondContact O-OG1 3.26Å; A392-T394 PolarHBondContact O-N 2.9Å; T394-I396 VanDerWaalsContact C-N 3.32Å; T394-I399 HydrophobicContact CG2-CG2 4.27Å; T394-L403 HydrophobicContact CG2-CD1 4.07Å; T394-I411 HydrophobicContact CG2-CD1 3.8Å; T394-I411 HydrophobicContact CG2-CG2 4.03Å; T394-I411 WeakPolarHBondContact OG1-CG2 3.34Å; T394-Q412 PolarHBondContact OG1-NE2 3.33Å
395	S	93.7	Very high	94.5	Very high	14 Å²	14	54.5 Å²	54.5	10%	0.098	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-10.5	171.7	-64.5	0	0	0	0	113.6	K320 L391 A392 I393	K320-S395 VanDerWaalsContact CE-O 3.27Å; K320-S395 WeakPolarHBondContact CE-O 3.29Å; K320-S395 PolarHBondContact NZ-O 3.49Å; L391-S395 PolarHBondContact O-N 3.48Å; L391-S395 PolarHBondContact O-OG 3.37Å; A392-S395 VanDerWaalsContact O-CB 3.26Å; A392-S395 WeakPolarHBondContact O-CB 3.29Å; A392-S395 PolarHBondContact O-N 2.83Å; A392-S395 VanDerWaalsContact O-N 3.11Å; I393-S395 PolarHBondContact O-N 2.94Å; I393-S395 VanDerWaalsContact O-N 3.15Å
396	I	94.1	Very high	94.3	Very high	79 Å²	79	62.1 Å²	62.1	41%	0.405	34%	0.342	S	S	.	.	S	Bend	trans	-70.9	128.5	175.8	-59.3	172.4	0	0	0	108.8	I393 T394 S398 I399 S400	I393-I396 WeakPolarHBondContact O-CB 3.39Å; I393-I396 VanDerWaalsContact O-CG1 3.28Å; I393-I396 WeakPolarHBondContact O-CG1 3.47Å; I393-I396 PolarHBondContact O-N 3.13Å; I393-I396 VanDerWaalsContact O-N 3.08Å; T394-I396 VanDerWaalsContact C-N 3.32Å; I396-S398 VanDerWaalsContact C-N 3.3Å; I396-S398 WeakPolarHBondContact CG2-OG 3.36Å; I396-S398 PolarHBondContact O-N 3.12Å; I396-I399 HydrophobicContact CB-CD1 4.42Å; I396-I399 HydrophobicContact CD1-CD1 4.32Å; I396-I399 PolarHBondContact O-N 3.46Å; I396-I399 VanDerWaalsContact O-N 3.08Å; I396-S400 PolarHBondContact O-N 2.9Å
397	P	90.5	Very high	94.2	Very high	81 Å²	81	64.1 Å²	64.1	53%	0.526	34%	0.339	S	S	.	.	H	α-helix	trans	-55.7	-37.5	-174.8	-28.3	35.4	0	0	0	115.1	I399 S400 N401	P397-I399 VanDerWaalsContact C-N 3.3Å; P397-I399 PolarHBondContact O-N 3.18Å; P397-S400 PolarHBondContact O-N 2.96Å; P397-N401 WeakPolarHBondContact O-CB 3.24Å; P397-N401 PolarHBondContact O-N 3.37Å; P397-N401 PolarHBondContact O-ND2 3.17Å
398	S	91.1	Very high	94.1	Very high	87 Å²	87	63.9 Å²	63.9	61%	0.608	34%	0.337	S	S	*	.	H	α-helix	trans	-61.5	-37.6	178.4	52	0	0	0	0	112.8	I396	I396-S398 VanDerWaalsContact C-N 3.3Å; I396-S398 WeakPolarHBondContact CG2-OG 3.36Å; I396-S398 PolarHBondContact O-N 3.12Å
399	I	93.3	Very high	93.9	Very high	53 Å²	53	64.6 Å²	64.6	27%	0.272	34%	0.343	S	S	.	.	H	α-helix	trans	-82.6	-44.1	178.9	-60.1	175.5	0	0	0	110.1	I393 T394 I396 P397 N401 S402 L403	I393-I399 HydrophobicContact CG2-CD1 3.42Å; I393-I399 VanDerWaalsContact CG2-CD1 3.42Å; T394-I399 HydrophobicContact CG2-CG2 4.27Å; I396-I399 HydrophobicContact CB-CD1 4.42Å; I396-I399 HydrophobicContact CD1-CD1 4.32Å; I396-I399 PolarHBondContact O-N 3.46Å; I396-I399 VanDerWaalsContact O-N 3.08Å; P397-I399 VanDerWaalsContact C-N 3.3Å; P397-I399 PolarHBondContact O-N 3.18Å; I399-N401 PolarHBondContact O-N 3.03Å; I399-S402 PolarHBondContact O-N 3.48Å; I399-S402 PolarHBondContact O-OG 3.15Å; I399-L403 HydrophobicContact CG2-CD1 4.3Å; I399-L403 WeakPolarHBondContact O-CG 3.43Å; I399-L403 PolarHBondContact O-N 3.01Å
400	S	92.3	Very high	93.8	Very high	33 Å²	33	68.8 Å²	68.8	23%	0.231	36%	0.358	C	S	.	.	H	α-helix	trans	-59.7	-32.4	177.8	-177.1	0	0	0	0	112.4	I396 P397 F408	I396-S400 PolarHBondContact O-N 2.9Å; P397-S400 PolarHBondContact O-N 2.96Å; S400-F408 WeakPolarHBondContact OG-CE2 3.2Å
401	N	91.9	Very high	93.7	Very high	136 Å²	136	66.7 Å²	66.7	73%	0.727	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-14.9	178.4	-68.2	-14.8	0	0	0	113.2	P397 I399	P397-N401 WeakPolarHBondContact O-CB 3.24Å; P397-N401 PolarHBondContact O-N 3.37Å; P397-N401 PolarHBondContact O-ND2 3.17Å; I399-N401 PolarHBondContact O-N 3.03Å
402	S	94.9	Very high	93.7	Very high	88 Å²	88	67.9 Å²	67.9	62%	0.615	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-16.1	176.3	69.7	0	0	0	0	113.4	I399	I399-S402 PolarHBondContact O-N 3.48Å; I399-S402 PolarHBondContact O-OG 3.15Å
403	L	92.8	Very high	93.6	Very high	46 Å²	46	68.7 Å²	68.7	24%	0.241	36%	0.356	C	S	.	.	S	Bend	trans	-91.1	142	-178.9	-63.2	175.1	0	0	0	111.2	T394 I399 E407 I411	T394-L403 HydrophobicContact CG2-CD1 4.07Å; I399-L403 HydrophobicContact CG2-CD1 4.3Å; I399-L403 WeakPolarHBondContact O-CG 3.43Å; I399-L403 PolarHBondContact O-N 3.01Å; L403-E407 WeakPolarHBondContact CA-OE2 3.42Å; L403-E407 HydrophobicContact CB-CB 4.28Å; L403-E407 HydrophobicContact CD2-CB 4.24Å; L403-I411 HydrophobicContact CD1-CD1 4.07Å
404	N	95.3	Very high	93.5	Very high	78 Å²	78	67.7 Å²	67.7	42%	0.417	35%	0.354	S	S	.	.			trans	-75.2	166.6	168.2	69.5	52.2	0	0	0	111	R406 E407 F408	N404-R406 VanDerWaalsContact C-N 3.27Å; N404-R406 PolarHBondContact O-N 3.11Å; N404-R406 WeakPolarHBondContact OD1-CA 3.39Å; N404-R406 WeakPolarHBondContact OD1-CB 3.31Å; N404-R406 PolarHBondContact OD1-N 3.42Å; N404-E407 VanDerWaalsContact CG-CD 3.42Å; N404-E407 PolarHBondContact N-OE2 3.36Å; N404-E407 PolarHBondContact ND2-OE1 3.2Å; N404-E407 PolarHBondContact ND2-OE2 2.89Å; N404-E407 PolarHBondContact O-N 2.92Å; N404-E407 WeakPolarHBondContact OD1-CG 3.38Å; N404-E407 PolarHBondContact OD1-N 3.3Å; N404-F408 WeakPolarHBondContact O-CB 3.34Å; N404-F408 PolarHBondContact O-N 3.14Å
405	W	89.6	Confident	93.5	Very high	94 Å²	94	68.8 Å²	68.8	36%	0.356	36%	0.36	S	S	.	.	H	α-helix	trans	-62.4	-31.3	-176.5	-176	-110	0	0	0	113.8	F408 S409 I508 M509	W405-F408 HydrophobicContact CE3-CD1 4.22Å; W405-F408 AromaticContact CZ3-CD1 3.97Å; W405-F408 HydrophobicContact CZ3-CD1 3.97Å; W405-F408 HydrophobicContact CZ3-CE1 4.28Å; W405-S409 WeakPolarHBondContact O-CB 3.45Å; W405-S409 PolarHBondContact O-N 2.86Å; W405-I508 HydrophobicContact CZ2-CB 4.24Å; W405-I508 HydrophobicContact CZ2-CG2 4.28Å; W405-M509 HydrophobicContact CH2-CG 4.26Å; W405-M509 HydrophobicContact CZ3-CE 4.41Å
406	R	94.1	Very high	93.7	Very high	217 Å²	217	68.1 Å²	68.1	82%	0.819	36%	0.355	S	S	*	.	H	α-helix	trans	-70.1	-44.4	179	-68.5	-177.2	176.1	176.9	-0.4	111	N404 F410	N404-R406 VanDerWaalsContact C-N 3.27Å; N404-R406 PolarHBondContact O-N 3.11Å; N404-R406 WeakPolarHBondContact OD1-CA 3.39Å; N404-R406 WeakPolarHBondContact OD1-CB 3.31Å; N404-R406 PolarHBondContact OD1-N 3.42Å; R406-F410 VanDerWaalsContact O-CB 3.31Å; R406-F410 WeakPolarHBondContact O-CB 3.49Å; R406-F410 PolarHBondContact O-N 3.29Å
407	E	95.3	Very high	93.8	Very high	84 Å²	84	66 Å²	66	39%	0.393	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-49.2	175.1	-71	158	-173.7	0	0	111	L403 N404 S409 F410 I411	L403-E407 WeakPolarHBondContact CA-OE2 3.42Å; L403-E407 HydrophobicContact CB-CB 4.28Å; L403-E407 HydrophobicContact CD2-CB 4.24Å; N404-E407 VanDerWaalsContact CG-CD 3.42Å; N404-E407 PolarHBondContact N-OE2 3.36Å; N404-E407 PolarHBondContact ND2-OE1 3.2Å; N404-E407 PolarHBondContact ND2-OE2 2.89Å; N404-E407 PolarHBondContact O-N 2.92Å; N404-E407 WeakPolarHBondContact OD1-CG 3.38Å; N404-E407 PolarHBondContact OD1-N 3.3Å; E407-S409 PolarHBondContact O-N 2.99Å; E407-F410 PolarHBondContact O-N 3.05Å; E407-I411 WeakPolarHBondContact O-CG1 3.44Å; E407-I411 PolarHBondContact O-N 3.11Å
408	F	93.6	Very high	94.2	Very high	29 Å²	29	65.3 Å²	65.3	13%	0.127	33%	0.334	C	S	.	.	H	α-helix	trans	-59.8	-46.3	178.7	-177	-94.1	0	0	0	111.7	S400 N404 W405 I411 Q412	S400-F408 WeakPolarHBondContact OG-CE2 3.2Å; N404-F408 WeakPolarHBondContact O-CB 3.34Å; N404-F408 PolarHBondContact O-N 3.14Å; W405-F408 HydrophobicContact CE3-CD1 4.22Å; W405-F408 AromaticContact CZ3-CD1 3.97Å; W405-F408 HydrophobicContact CZ3-CD1 3.97Å; W405-F408 HydrophobicContact CZ3-CE1 4.28Å; F408-I411 PolarHBondContact O-N 3.34Å; F408-Q412 HydrophobicContact CD1-CG 4.28Å; F408-Q412 HydrophobicContact CD2-CG 4.26Å; F408-Q412 HydrophobicContact CE1-CB 4.35Å; F408-Q412 HydrophobicContact CE1-CG 3.89Å; F408-Q412 HydrophobicContact CE2-CG 3.86Å; F408-Q412 HydrophobicContact CG-CG 4.46Å; F408-Q412 HydrophobicContact CZ-CG 3.67Å; F408-Q412 WeakPolarHBondContact O-CB 3.42Å; F408-Q412 WeakPolarHBondContact O-CG 3.42Å; F408-Q412 PolarHBondContact O-N 3.34Å
409	S	92.8	Very high	94.5	Very high	27 Å²	27	61.2 Å²	61.2	19%	0.189	31%	0.305	C	S	.	.	H	α-helix	trans	-66.3	-39.9	178.2	-178.9	0	0	0	0	112.1	W405 E407 I411 T413 I508	W405-S409 WeakPolarHBondContact O-CB 3.45Å; W405-S409 PolarHBondContact O-N 2.86Å; E407-S409 PolarHBondContact O-N 2.99Å; S409-I411 VanDerWaalsContact C-N 3.33Å; S409-I411 PolarHBondContact O-N 3.09Å; S409-T413 WeakPolarHBondContact O-CA 3.36Å; S409-T413 WeakPolarHBondContact O-CB 3.3Å; S409-T413 PolarHBondContact O-N 3.3Å; S409-T413 PolarHBondContact O-OG1 3.03Å; S409-I508 WeakPolarHBondContact OG-CG2 3.35Å
410	F	96.1	Very high	94.7	Very high	112 Å²	112	58.7 Å²	58.7	49%	0.491	29%	0.292	S	S	.	.	I	π-helix	trans	-58.3	-45.7	174.9	175.3	-100.2	0	0	0	111.6	R406 E407 T414 L415	R406-F410 VanDerWaalsContact O-CB 3.31Å; R406-F410 WeakPolarHBondContact O-CB 3.49Å; R406-F410 PolarHBondContact O-N 3.29Å; E407-F410 PolarHBondContact O-N 3.05Å; F410-T414 HydrophobicContact CD2-CG2 4.32Å; F410-T414 HydrophobicContact CE2-CG2 4.05Å; F410-T414 WeakPolarHBondContact O-CA 3.46Å; F410-T414 WeakPolarHBondContact O-CB 3.48Å; F410-T414 PolarHBondContact O-N 3.28Å; F410-L415 HydrophobicContact CD1-CD1 4.47Å; F410-L415 HydrophobicContact CD1-CG 4.46Å; F410-L415 HydrophobicContact CE1-CD1 4.04Å; F410-L415 HydrophobicContact CE1-CD2 4.21Å; F410-L415 HydrophobicContact CE1-CG 4Å; F410-L415 HydrophobicContact CZ-CD2 4.23Å; F410-L415 HydrophobicContact CZ-CG 4.41Å; F410-L415 PolarHBondContact O-N 3.12Å; F410-L415 VanDerWaalsContact O-N 3.08Å
411	I	94.6	Very high	95	Very high	24 Å²	24	60.7 Å²	60.7	12%	0.123	30%	0.299	C	S	.	.	I	π-helix	trans	-68.2	-57.5	179.4	-62.1	168.4	0	0	0	110.3	L390 L391 T394 L403 E407 F408 S409 T413 L415 G416	L390-I411 HydrophobicContact CD2-CG2 4.48Å; L390-I411 HydrophobicContact CG-CG2 4.3Å; L391-I411 HydrophobicContact CD2-CG2 3.91Å; L391-I411 WeakPolarHBondContact CD2-O 3.26Å; T394-I411 HydrophobicContact CG2-CD1 3.8Å; T394-I411 HydrophobicContact CG2-CG2 4.03Å; T394-I411 WeakPolarHBondContact OG1-CG2 3.34Å; L403-I411 HydrophobicContact CD1-CD1 4.07Å; E407-I411 WeakPolarHBondContact O-CG1 3.44Å; E407-I411 PolarHBondContact O-N 3.11Å; F408-I411 PolarHBondContact O-N 3.34Å; S409-I411 VanDerWaalsContact C-N 3.33Å; S409-I411 PolarHBondContact O-N 3.09Å; I411-T413 PolarHBondContact O-N 3.09Å; I411-L415 HydrophobicContact CG1-CD1 4.31Å; I411-L415 HydrophobicContact CG2-CD1 4.49Å; I411-L415 WeakPolarHBondContact O-CB 3.48Å; I411-L415 PolarHBondContact O-N 2.82Å; I411-G416 PolarHBondContact O-N 3.21Å
412	Q	94.4	Very high	95.3	Very high	39 Å²	39	55 Å²	55	18%	0.182	27%	0.269	C	S	.	.	I	π-helix	trans	-71.4	-29.1	-171.6	-66.9	-66.7	-29.8	0	0	113.6	Y288 L391 T394 F408	Y288-Q412 PolarHBondContact OH-O 2.91Å; L391-Q412 PolarHBondContact O-NE2 3.49Å; T394-Q412 PolarHBondContact OG1-NE2 3.33Å; F408-Q412 HydrophobicContact CD1-CG 4.28Å; F408-Q412 HydrophobicContact CD2-CG 4.26Å; F408-Q412 HydrophobicContact CE1-CB 4.35Å; F408-Q412 HydrophobicContact CE1-CG 3.89Å; F408-Q412 HydrophobicContact CE2-CG 3.86Å; F408-Q412 HydrophobicContact CG-CG 4.46Å; F408-Q412 HydrophobicContact CZ-CG 3.67Å; F408-Q412 WeakPolarHBondContact O-CB 3.42Å; F408-Q412 WeakPolarHBondContact O-CG 3.42Å; F408-Q412 PolarHBondContact O-N 3.34Å
413	T	93.4	Very high	95.4	Very high	31 Å²	31	51.3 Å²	51.3	19%	0.19	24%	0.244	C	C	.	.	I	π-helix	trans	-96.1	-62.6	177.9	-51.5	0	0	0	0	111.8	S409 I411 G416 Y417	S409-T413 WeakPolarHBondContact O-CA 3.36Å; S409-T413 WeakPolarHBondContact O-CB 3.3Å; S409-T413 PolarHBondContact O-N 3.3Å; S409-T413 PolarHBondContact O-OG1 3.03Å; I411-T413 PolarHBondContact O-N 3.09Å; T413-G416 PolarHBondContact O-N 2.9Å; T413-Y417 HydrophobicContact CG2-CD2 4.23Å; T413-Y417 HydrophobicContact CG2-CE2 4.24Å; T413-Y417 VanDerWaalsContact O-CD2 3.26Å; T413-Y417 WeakPolarHBondContact O-CD2 3.3Å; T413-Y417 PolarHBondContact O-N 3.18Å
414	T	94.8	Very high	95.6	Very high	64 Å²	64	49.2 Å²	49.2	39%	0.393	23%	0.233	S	C	.	.	I	π-helix	trans	-70.5	-55.5	-170.8	-52.3	0	0	0	0	111.8	F410 G416 Y417 I418	F410-T414 HydrophobicContact CD2-CG2 4.32Å; F410-T414 HydrophobicContact CE2-CG2 4.05Å; F410-T414 WeakPolarHBondContact O-CA 3.46Å; F410-T414 WeakPolarHBondContact O-CB 3.48Å; F410-T414 PolarHBondContact O-N 3.28Å; T414-G416 PolarHBondContact O-N 3.44Å; T414-Y417 PolarHBondContact O-N 3.05Å; T414-I418 HydrophobicContact CG2-CD1 4.16Å; T414-I418 WeakPolarHBondContact O-CG1 3.27Å; T414-I418 PolarHBondContact O-N 3.22Å; T414-I418 VanDerWaalsContact O-N 3.13Å
415	L	96.1	Very high	95.7	Very high	29 Å²	29	48 Å²	48	15%	0.152	23%	0.226	C	C	.	.	I	π-helix	trans	-64.9	-29.2	176.6	-59.6	-178.9	0	0	0	111.4	L390 F410 I411 I418 A419	L390-L415 HydrophobicContact CD2-CD1 3.48Å; L390-L415 VanDerWaalsContact CD2-CD1 3.48Å; F410-L415 HydrophobicContact CD1-CD1 4.47Å; F410-L415 HydrophobicContact CD1-CG 4.46Å; F410-L415 HydrophobicContact CE1-CD1 4.04Å; F410-L415 HydrophobicContact CE1-CD2 4.21Å; F410-L415 HydrophobicContact CE1-CG 4Å; F410-L415 HydrophobicContact CZ-CD2 4.23Å; F410-L415 HydrophobicContact CZ-CG 4.41Å; F410-L415 PolarHBondContact O-N 3.12Å; F410-L415 VanDerWaalsContact O-N 3.08Å; I411-L415 HydrophobicContact CG1-CD1 4.31Å; I411-L415 HydrophobicContact CG2-CD1 4.49Å; I411-L415 WeakPolarHBondContact O-CB 3.48Å; I411-L415 PolarHBondContact O-N 2.82Å; L415-I418 HydrophobicContact CD2-CD1 4.26Å; L415-I418 PolarHBondContact O-N 3.29Å; L415-A419 WeakPolarHBondContact O-CB 3.44Å; L415-A419 PolarHBondContact O-N 3.39Å
416	G	96.3	Very high	96.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-55.7	-55.1	170.5	0	0	0	0	0	115.2	Y288 I411 T413 T414 I418 A419 L420	Y288-G416 VanDerWaalsContact CZ-C 3.44Å; Y288-G416 WeakPolarHBondContact OH-CA 3.3Å; I411-G416 PolarHBondContact O-N 3.21Å; T413-G416 PolarHBondContact O-N 2.9Å; T414-G416 PolarHBondContact O-N 3.44Å; G416-I418 VanDerWaalsContact C-N 3.3Å; G416-I418 PolarHBondContact O-N 3.45Å; G416-A419 WeakPolarHBondContact O-CB 3.46Å; G416-A419 PolarHBondContact O-N 2.91Å; G416-L420 PolarHBondContact O-N 3.03Å
417	Y	96.9	Very high	96.1	Very high	33 Å²	33	35.6 Å²	35.6	13%	0.129	18%	0.184	C	C	.	.	H	α-helix	trans	-64.2	-35.3	175.9	-86.5	-75.5	0	0	0	112.4	Y288 Q292 T413 T414 L420 L421 V459 K463	Y288-Y417 HydrophobicContact CD1-CD1 4.5Å; Y288-Y417 AromaticContact CD1-CD2 3.98Å; Y288-Y417 HydrophobicContact CD1-CD2 3.98Å; Y288-Y417 HydrophobicContact CD1-CE1 4.26Å; Y288-Y417 AromaticContact CD1-CE2 3.68Å; Y288-Y417 HydrophobicContact CD1-CE2 3.68Å; Y288-Y417 HydrophobicContact CD1-CG 4.37Å; Y288-Y417 AromaticContact CD1-CZ 3.84Å; Y288-Y417 HydrophobicContact CE1-CD2 4.36Å; Y288-Y417 HydrophobicContact CE1-CE2 4.41Å; Y288-Y417 HydrophobicContact CG-CD1 4.39Å; Y288-Y417 HydrophobicContact CG-CE1 4.08Å; Y288-Y417 HydrophobicContact CG-CE2 4.32Å; Y288-Y417 PolarHBondContact O-OH 2.89Å; Q292-Y417 WeakPolarHBondContact CG-OH 3.49Å; Q292-Y417 PolarHBondContact NE2-OH 3.46Å; T413-Y417 HydrophobicContact CG2-CD2 4.23Å; T413-Y417 HydrophobicContact CG2-CE2 4.24Å; T413-Y417 VanDerWaalsContact O-CD2 3.26Å; T413-Y417 WeakPolarHBondContact O-CD2 3.3Å; T413-Y417 PolarHBondContact O-N 3.18Å; T414-Y417 PolarHBondContact O-N 3.05Å; Y417-L420 PolarHBondContact O-N 2.85Å; Y417-L421 WeakPolarHBondContact O-CB 3.13Å; Y417-L421 PolarHBondContact O-N 3.02Å; Y417-V459 HydrophobicContact CE1-CG1 4.22Å; Y417-K463 HydrophobicContact CD1-CB 4.13Å; Y417-K463 HydrophobicContact CD1-CD 4.29Å; Y417-K463 HydrophobicContact CD1-CG 3.83Å; Y417-K463 HydrophobicContact CD2-CD 4.33Å; Y417-K463 HydrophobicContact CE1-CB 3.76Å; Y417-K463 HydrophobicContact CE1-CD 3.89Å; Y417-K463 HydrophobicContact CE1-CG 3.73Å; Y417-K463 HydrophobicContact CE2-CD 3.99Å; Y417-K463 HydrophobicContact CG-CD 4.5Å; Y417-K463 HydrophobicContact CG-CG 4.27Å
418	I	97.8	Very high	96.1	Very high	68 Å²	68	36.1 Å²	36.1	35%	0.349	19%	0.189	S	C	.	.	H	α-helix	trans	-64.8	-41.6	175	-66.4	168.5	0	0	0	110.4	L387 T414 L415 G416 L420 L421 I422	L387-I418 HydrophobicContact CD1-CG2 3.78Å; T414-I418 HydrophobicContact CG2-CD1 4.16Å; T414-I418 WeakPolarHBondContact O-CG1 3.27Å; T414-I418 PolarHBondContact O-N 3.22Å; T414-I418 VanDerWaalsContact O-N 3.13Å; L415-I418 HydrophobicContact CD2-CD1 4.26Å; L415-I418 PolarHBondContact O-N 3.29Å; G416-I418 VanDerWaalsContact C-N 3.3Å; G416-I418 PolarHBondContact O-N 3.45Å; I418-L420 PolarHBondContact O-N 3.09Å; I418-L421 PolarHBondContact O-N 2.88Å; I418-I422 HydrophobicContact CG2-CD1 3.59Å; I418-I422 HydrophobicContact CG2-CG1 4.37Å; I418-I422 VanDerWaalsContact O-CG1 3.31Å; I418-I422 WeakPolarHBondContact O-CG1 3.45Å; I418-I422 PolarHBondContact O-N 2.89Å
419	A	97.8	Very high	96.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.1	-44	175.5	0	0	0	0	0	111.8	S384 L387 M388 L391 L415 G416 I422 A423	S384-A419 PolarHBondContact OG-O 3.48Å; L387-A419 HydrophobicContact CB-CB 3.76Å; L387-A419 HydrophobicContact CD1-CB 4.24Å; M388-A419 HydrophobicContact CG-CB 4.28Å; L391-A419 HydrophobicContact CD1-CB 4.31Å; L415-A419 WeakPolarHBondContact O-CB 3.44Å; L415-A419 PolarHBondContact O-N 3.39Å; G416-A419 WeakPolarHBondContact O-CB 3.46Å; G416-A419 PolarHBondContact O-N 2.91Å; A419-I422 PolarHBondContact O-N 3.23Å; A419-A423 VanDerWaalsContact O-CB 3.29Å; A419-A423 WeakPolarHBondContact O-CB 3.26Å; A419-A423 PolarHBondContact O-N 3.47Å
420	L	98.1	Very high	96.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.8	-42.4	175.3	179.9	66.2	0	0	0	111.9	I281 L284 A285 Y288 G416 Y417 I418 A423 T424 P456 V459 I460	I281-L420 HydrophobicContact CG1-CD1 4.39Å; L284-L420 HydrophobicContact CB-CD1 4.28Å; L284-L420 HydrophobicContact CD2-CB 4.2Å; L284-L420 HydrophobicContact CD2-CD1 4.01Å; L284-L420 HydrophobicContact CG-CB 4.44Å; L284-L420 HydrophobicContact CG-CD1 4.01Å; A285-L420 HydrophobicContact CB-CD1 4.19Å; Y288-L420 HydrophobicContact CD2-CB 4.34Å; Y288-L420 HydrophobicContact CD2-CD2 3.95Å; Y288-L420 HydrophobicContact CE2-CB 4.4Å; G416-L420 PolarHBondContact O-N 3.03Å; Y417-L420 PolarHBondContact O-N 2.85Å; I418-L420 PolarHBondContact O-N 3.09Å; L420-A423 PolarHBondContact O-N 3.46Å; L420-T424 WeakPolarHBondContact O-CB 3.45Å; L420-T424 PolarHBondContact O-N 3.31Å; L420-T424 PolarHBondContact O-OG1 3.21Å; L420-P456 HydrophobicContact CD1-CB 4.09Å; L420-V459 HydrophobicContact CD2-CB 4.3Å; L420-V459 HydrophobicContact CD2-CG1 3.72Å; L420-I460 HydrophobicContact CD2-CG1 4.31Å; L420-I460 HydrophobicContact CG-CD1 4.49Å; L420-I460 HydrophobicContact CG-CG1 4.44Å
421	L	98.1	Very high	95.7	Very high	75 Å²	75	33 Å²	33	39%	0.393	17%	0.173	S	C	.	.	H	α-helix	trans	-60.8	-50.7	176.9	177	64.3	0	0	0	111.3	Y417 I418 A423 T424 I425 I460	Y417-L421 WeakPolarHBondContact O-CB 3.13Å; Y417-L421 PolarHBondContact O-N 3.02Å; I418-L421 PolarHBondContact O-N 2.88Å; L421-A423 VanDerWaalsContact C-N 3.35Å; L421-A423 PolarHBondContact O-N 2.89Å; L421-T424 WeakPolarHBondContact O-CB 3Å; L421-T424 PolarHBondContact O-N 3.02Å; L421-T424 VanDerWaalsContact O-N 3.17Å; L421-I425 HydrophobicContact CD1-CD1 4.16Å; L421-I425 HydrophobicContact CG-CD1 4.04Å; L421-I425 WeakPolarHBondContact O-CG1 3.28Å; L421-I425 PolarHBondContact O-N 3.39Å; L421-I460 HydrophobicContact CB-CD1 4.43Å; L421-I460 HydrophobicContact CD1-CD1 4Å; L421-I460 HydrophobicContact CD1-CG2 4.15Å
422	I	98.1	Very high	95.3	Very high	16 Å²	16	36.9 Å²	36.9	8%	0.082	19%	0.186	C	C	.	.	H	α-helix	trans	-65.2	-39	-179.7	-66.2	166	0	0	0	110.8	F380 M383 L387 I418 A419 T424 I425 H426	F380-I422 HydrophobicContact CB-CG2 4.29Å; F380-I422 HydrophobicContact CD1-CG2 3.82Å; F380-I422 HydrophobicContact CG-CG2 4.47Å; F380-I422 VanDerWaalsContact O-CG2 3.23Å; F380-I422 WeakPolarHBondContact O-CG2 3.27Å; M383-I422 HydrophobicContact CB-CG2 4.21Å; M383-I422 HydrophobicContact CE-CD1 3.76Å; M383-I422 HydrophobicContact CE-CG1 4.02Å; M383-I422 HydrophobicContact CE-CG2 3.66Å; M383-I422 HydrophobicContact CG-CD1 4.06Å; M383-I422 HydrophobicContact CG-CG2 4.25Å; M383-I422 HydrophobicContact SD-CD1 4Å; L387-I422 HydrophobicContact CD1-CD1 3.59Å; I418-I422 HydrophobicContact CG2-CD1 3.59Å; I418-I422 HydrophobicContact CG2-CG1 4.37Å; I418-I422 VanDerWaalsContact O-CG1 3.31Å; I418-I422 WeakPolarHBondContact O-CG1 3.45Å; I418-I422 PolarHBondContact O-N 2.89Å; A419-I422 PolarHBondContact O-N 3.23Å; I422-T424 VanDerWaalsContact C-N 3.31Å; I422-T424 PolarHBondContact O-N 3.49Å; I422-I425 PolarHBondContact O-N 3.21Å; I422-H426 WeakPolarHBondContact O-CB 3.31Å; I422-H426 PolarHBondContact O-N 3.42Å
423	A	97.8	Very high	94.9	Very high	11 Å²	11	42 Å²	42	9%	0.091	20%	0.204	C	C	.	.	H	α-helix	trans	-60.7	-40.9	173.3	0	0	0	0	0	112	I281 S384 A419 L420 L421 H426 G427	I281-A423 HydrophobicContact CD1-CB 4.01Å; I281-A423 HydrophobicContact CG1-CB 4.26Å; S384-A423 WeakPolarHBondContact OG-CB 3.47Å; A419-A423 VanDerWaalsContact O-CB 3.29Å; A419-A423 WeakPolarHBondContact O-CB 3.26Å; A419-A423 PolarHBondContact O-N 3.47Å; L420-A423 PolarHBondContact O-N 3.46Å; L421-A423 VanDerWaalsContact C-N 3.35Å; L421-A423 PolarHBondContact O-N 2.89Å; A423-H426 WeakPolarHBondContact O-CB 3.37Å; A423-H426 PolarHBondContact O-N 3.49Å; A423-G427 PolarHBondContact O-N 2.79Å; A423-G427 VanDerWaalsContact O-N 3.09Å
424	T	97.6	Very high	94.4	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.018	21%	0.214	C	C	.	.	H	α-helix	trans	-67.6	-42.2	178.4	-54.9	0	0	0	0	110.4	L420 L421 I422 G427 L428 L453 P456 V457 I460	L420-T424 WeakPolarHBondContact O-CB 3.45Å; L420-T424 PolarHBondContact O-N 3.31Å; L420-T424 PolarHBondContact O-OG1 3.21Å; L421-T424 WeakPolarHBondContact O-CB 3Å; L421-T424 PolarHBondContact O-N 3.02Å; L421-T424 VanDerWaalsContact O-N 3.17Å; I422-T424 VanDerWaalsContact C-N 3.31Å; I422-T424 PolarHBondContact O-N 3.49Å; T424-G427 PolarHBondContact O-N 3.39Å; T424-L428 HydrophobicContact CG2-CD1 4.12Å; T424-L428 HydrophobicContact CG2-CG 4.45Å; T424-L428 VanDerWaalsContact O-CG 3.31Å; T424-L428 WeakPolarHBondContact O-CG 3.26Å; T424-L428 PolarHBondContact O-N 3.25Å; T424-L453 HydrophobicContact CG2-CD2 3.92Å; T424-P456 HydrophobicContact CG2-CB 4.27Å; T424-P456 WeakPolarHBondContact OG1-CB 3.44Å; T424-V457 HydrophobicContact CG2-CG2 3.71Å; T424-I460 HydrophobicContact CG2-CD1 4.02Å; T424-I460 WeakPolarHBondContact OG1-CD1 3.2Å
425	I	97.2	Very high	93.6	Very high	51 Å²	51	43.8 Å²	43.8	26%	0.262	21%	0.206	S	C	.	.	H	α-helix	trans	-62.2	-42.7	174.5	-66.9	167	0	0	0	110.8	F380 L421 I422 G427 L428 L429	F380-I425 HydrophobicContact CD1-CB 3.92Å; F380-I425 HydrophobicContact CD1-CG2 3.47Å; F380-I425 VanDerWaalsContact CD1-CG2 3.47Å; F380-I425 HydrophobicContact CE1-CB 4.18Å; F380-I425 HydrophobicContact CE1-CD1 4.15Å; F380-I425 HydrophobicContact CE1-CG2 3.54Å; F380-I425 HydrophobicContact CG-CG2 4.09Å; F380-I425 HydrophobicContact CZ-CG2 4.17Å; L421-I425 HydrophobicContact CD1-CD1 4.16Å; L421-I425 HydrophobicContact CG-CD1 4.04Å; L421-I425 WeakPolarHBondContact O-CG1 3.28Å; L421-I425 PolarHBondContact O-N 3.39Å; I422-I425 PolarHBondContact O-N 3.21Å; I425-G427 VanDerWaalsContact C-N 3.33Å; I425-G427 PolarHBondContact O-N 2.85Å; I425-L428 PolarHBondContact O-N 2.94Å; I425-L429 HydrophobicContact CG2-CD1 3.58Å; I425-L429 HydrophobicContact CG2-CG 3.97Å; I425-L429 WeakPolarHBondContact O-CB 3.42Å; I425-L429 VanDerWaalsContact O-CG 3.26Å; I425-L429 WeakPolarHBondContact O-CG 3.43Å; I425-L429 PolarHBondContact O-N 3.46Å
426	H	96.6	Very high	93	Very high	41 Å²	41	49.4 Å²	49.4	19%	0.19	24%	0.236	C	C	.	.	H	α-helix	trans	-53	-48.7	172.5	162.3	75.6	0	0	0	111.7	Y377 F380 I422 A423 F430	Y377-H426 AromaticContact CD2-CE1 3.86Å; Y377-H426 AromaticContact CD2-ND1 3.98Å; Y377-H426 PolarHBondContact O-ND1 2.91Å; F380-H426 HydrophobicContact CB-CB 4.03Å; I422-H426 WeakPolarHBondContact O-CB 3.31Å; I422-H426 PolarHBondContact O-N 3.42Å; A423-H426 WeakPolarHBondContact O-CB 3.37Å; A423-H426 PolarHBondContact O-N 3.49Å; H426-F430 WeakPolarHBondContact O-CB 3.49Å; H426-F430 PolarHBondContact O-N 3.41Å
427	G	94.7	Very high	92.5	Very high	11 Å²	11	53.3 Å²	53.3	11%	0.113	26%	0.256	C	S	.	.	H	α-helix	trans	-67.4	-37.4	177.5	0	0	0	0	0	114.2	A423 T424 I425 F430 G431	A423-G427 PolarHBondContact O-N 2.79Å; A423-G427 VanDerWaalsContact O-N 3.09Å; T424-G427 PolarHBondContact O-N 3.39Å; I425-G427 VanDerWaalsContact C-N 3.33Å; I425-G427 PolarHBondContact O-N 2.85Å; G427-F430 PolarHBondContact O-N 3.33Å; G427-G431 PolarHBondContact O-N 3.1Å
428	L	94.7	Very high	91.8	Very high	94 Å²	94	60 Å²	60	49%	0.492	29%	0.289	S	S	.	.	H	α-helix	trans	-67.1	-43.7	177.1	-72.5	170.4	0	0	0	111.8	T424 I425 F430 G431 W432 L453	T424-L428 HydrophobicContact CG2-CD1 4.12Å; T424-L428 HydrophobicContact CG2-CG 4.45Å; T424-L428 VanDerWaalsContact O-CG 3.31Å; T424-L428 WeakPolarHBondContact O-CG 3.26Å; T424-L428 PolarHBondContact O-N 3.25Å; I425-L428 PolarHBondContact O-N 2.94Å; L428-F430 VanDerWaalsContact C-N 3.32Å; L428-G431 PolarHBondContact O-N 3.32Å; L428-W432 PolarHBondContact O-N 3.31Å; L428-L453 HydrophobicContact CD2-CD1 3.96Å; L428-L453 HydrophobicContact CG-CD1 4.19Å
429	L	94.5	Very high	91	Very high	29 Å²	29	64.2 Å²	64.2	15%	0.152	31%	0.312	C	S	.	.	H	α-helix	trans	-66.6	-34.3	176.5	-68.9	171.9	0	0	0	111.9	R373 M376 F380 I425 G431 W432	R373-L429 WeakPolarHBondContact CG-O 3.4Å; M376-L429 HydrophobicContact CB-CD1 4.09Å; F380-L429 HydrophobicContact CD2-CD1 3.99Å; F380-L429 HydrophobicContact CE2-CD1 4.32Å; F380-L429 HydrophobicContact CG-CD1 4.24Å; I425-L429 HydrophobicContact CG2-CD1 3.58Å; I425-L429 HydrophobicContact CG2-CG 3.97Å; I425-L429 WeakPolarHBondContact O-CB 3.42Å; I425-L429 VanDerWaalsContact O-CG 3.26Å; I425-L429 WeakPolarHBondContact O-CG 3.43Å; I425-L429 PolarHBondContact O-N 3.46Å; L429-G431 VanDerWaalsContact C-N 3.34Å; L429-W432 HydrophobicContact CD2-CE3 4.07Å; L429-W432 HydrophobicContact CD2-CZ3 3.71Å
430	F	92.6	Very high	90.2	Very high	72 Å²	72	65.5 Å²	65.5	32%	0.316	32%	0.322	S	S	.	.	H	α-helix	trans	-62.9	-41.1	170.7	171.8	-97.9	0	0	0	112.1	Y377 H426 G427 L428 F449	Y377-F430 HydrophobicContact CD1-CB 4.37Å; Y377-F430 HydrophobicContact CD2-CB 4.47Å; Y377-F430 HydrophobicContact CE1-CD2 4.26Å; Y377-F430 HydrophobicContact CE2-CD2 4.26Å; Y377-F430 HydrophobicContact CG-CB 4.22Å; H426-F430 WeakPolarHBondContact O-CB 3.49Å; H426-F430 PolarHBondContact O-N 3.41Å; G427-F430 PolarHBondContact O-N 3.33Å; L428-F430 VanDerWaalsContact C-N 3.32Å; F430-F449 HydrophobicContact CD1-CB 4.49Å; F430-F449 HydrophobicContact CD1-CD1 4.39Å; F430-F449 HydrophobicContact CD1-CG 4.43Å; F430-F449 HydrophobicContact CE1-CD1 4.17Å
431	G	87.1	Confident	89.6	Confident	1 Å²	1	70 Å²	70	1%	0.01	34%	0.34	C	S	.	.	H	α-helix	trans	-67.7	-42.2	176.2	0	0	0	0	0	113.2	G427 L428 L429 R433 R434 F449	G427-G431 PolarHBondContact O-N 3.1Å; L428-G431 PolarHBondContact O-N 3.32Å; L429-G431 VanDerWaalsContact C-N 3.34Å; G431-R433 PolarHBondContact O-N 3.13Å; G431-R434 WeakPolarHBondContact O-CA 3.39Å; G431-R434 WeakPolarHBondContact O-CB 3.44Å; G431-R434 PolarHBondContact O-N 2.72Å; G431-F449 VanDerWaalsContact CA-CE2 3.47Å
432	W	87.7	Confident	89	Confident	106 Å²	106	70.6 Å²	70.6	40%	0.402	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	42.4	-119.7	-178.1	-160	-103.8	0	0	0	111.9	E369 R373 L428 L429	E369-W432 HydrophobicContact CG-CZ2 4.4Å; E369-W432 PolarHBondContact OE1-NE1 3.36Å; R373-W432 HydrophobicContact CB-CD2 4.49Å; R373-W432 VanDerWaalsContact CD-CB 3.45Å; R373-W432 HydrophobicContact CG-CB 4.06Å; R373-W432 HydrophobicContact CG-CD2 4.13Å; R373-W432 HydrophobicContact CG-CE3 4.1Å; R373-W432 HydrophobicContact CG-CG 4.12Å; L428-W432 PolarHBondContact O-N 3.31Å; L429-W432 HydrophobicContact CD2-CE3 4.07Å; L429-W432 HydrophobicContact CD2-CZ3 3.71Å
433	R	84.9	Confident	88.5	Confident	147 Å²	147	74.5 Å²	74.5	56%	0.555	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-80.6	-16.4	176	-67.4	-179.7	-163.1	-164	9.8	114.4	E369 G431 A435 L436 D437	E369-R433 VanDerWaalsContact CD-NH2 3.26Å; E369-R433 IonicContact OE1-CZ 3.8Å; E369-R433 IonicContact OE1-NE 3.74Å; E369-R433 PolarHBondContact OE1-NE 3.34Å; E369-R433 IonicContact OE1-NH2 3.85Å; E369-R433 PolarHBondContact OE1-NH2 3.32Å; E369-R433 IonicContact OE2-CZ 2.8Å; E369-R433 IonicContact OE2-NH2 2.76Å; E369-R433 PolarHBondContact OE2-NH2 3.14Å; G431-R433 PolarHBondContact O-N 3.13Å; R433-A435 PolarHBondContact O-N 3.35Å; R433-L436 PolarHBondContact O-N 3.18Å; R433-D437 PolarHBondContact O-N 2.68Å
434	R	82.8	Confident	88	Confident	105 Å²	105	84.4 Å²	84.4	40%	0.396	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-63.8	-16.1	-176	-58.3	176.7	174.1	165.9	-2.9	114	G431 L436 D437 A440 F449	G431-R434 WeakPolarHBondContact O-CA 3.39Å; G431-R434 WeakPolarHBondContact O-CB 3.44Å; G431-R434 PolarHBondContact O-N 2.72Å; R434-L436 VanDerWaalsContact C-N 3.29Å; R434-D437 WeakPolarHBondContact CA-OD2 3.42Å; R434-A440 WeakPolarHBondContact O-CB 3.37Å; R434-F449 HydrophobicContact CB-CZ 4.35Å
435	A	79.3	Confident	87.6	Confident	28 Å²	28	86.9 Å²	86.9	23%	0.231	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-73.1	-24.6	173.8	0	0	0	0	0	112.7	R433 Y441 F449 V450	R433-A435 PolarHBondContact O-N 3.35Å; A435-Y441 WeakPolarHBondContact O-CE2 3.39Å; A435-Y441 PolarHBondContact O-OH 3.18Å; A435-F449 HydrophobicContact CB-CE2 4.01Å; A435-F449 HydrophobicContact CB-CZ 4.12Å; A435-V450 HydrophobicContact CB-CG2 4.12Å
436	L	82.8	Confident	87.3	Confident	147 Å²	147	86.1 Å²	86.1	77%	0.77	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-12.6	-176.2	-59.5	173.6	0	0	0	112.6	R433 R434 E438	R433-L436 PolarHBondContact O-N 3.18Å; R434-L436 VanDerWaalsContact C-N 3.29Å; L436-E438 PolarHBondContact O-N 3.09Å
437	D	85.3	Confident	87	Confident	81 Å²	81	84.6 Å²	84.6	43%	0.433	40%	0.395	S	S	.	.			trans	-72.9	122.2	178.9	-66.3	-24.6	0	0	0	110.8	R433 R434 D439 A440 Y441	R433-D437 PolarHBondContact O-N 2.68Å; R434-D437 WeakPolarHBondContact CA-OD2 3.42Å; D437-D439 VanDerWaalsContact C-N 3.27Å; D437-D439 PolarHBondContact O-N 3.4Å; D437-A440 HydrophobicContact CB-CB 4.36Å; D437-A440 VanDerWaalsContact O-CB 3.26Å; D437-A440 WeakPolarHBondContact O-CB 3.3Å; D437-A440 PolarHBondContact O-N 3.37Å; D437-A440 VanDerWaalsContact O-N 3.11Å; D437-Y441 WeakPolarHBondContact O-CD2 3.34Å
438	E	82.1	Confident	86.7	Confident	175 Å²	175	84.6 Å²	84.6	82%	0.818	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-61.8	-35.1	180	-64.9	-173.8	171.9	0	0	112.2	L436 A440 Y441	L436-E438 PolarHBondContact O-N 3.09Å; E438-A440 PolarHBondContact O-N 3.1Å; E438-A440 VanDerWaalsContact O-N 3.12Å; E438-Y441 PolarHBondContact O-N 2.81Å
439	D	80.6	Confident	86.4	Confident	156 Å²	156	81.3 Å²	81.3	83%	0.834	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-64	-17.5	177.9	-71.4	-37.3	0	0	0	113.6	D437 Y441	D437-D439 VanDerWaalsContact C-N 3.27Å; D437-D439 PolarHBondContact O-N 3.4Å; D439-Y441 VanDerWaalsContact C-N 3.29Å
440	A	80.9	Confident	86.2	Confident	26 Å²	26	82.3 Å²	82.3	22%	0.215	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-76	-17.2	176.6	0	0	0	0	0	112.7	R434 D437 E438 R442 P447	R434-A440 WeakPolarHBondContact O-CB 3.37Å; D437-A440 HydrophobicContact CB-CB 4.36Å; D437-A440 VanDerWaalsContact O-CB 3.26Å; D437-A440 WeakPolarHBondContact O-CB 3.3Å; D437-A440 PolarHBondContact O-N 3.37Å; D437-A440 VanDerWaalsContact O-N 3.11Å; E438-A440 PolarHBondContact O-N 3.1Å; E438-A440 VanDerWaalsContact O-N 3.12Å; A440-R442 PolarHBondContact O-N 2.87Å; A440-P447 HydrophobicContact CB-CG 3.76Å
441	Y	86.6	Confident	86.2	Confident	96 Å²	96	81.2 Å²	81.2	38%	0.376	38%	0.382	S	S	.	.			trans	-91	72.1	-176.9	-69.3	-102	0	0	0	112.2	A435 D437 E438 D439 F443 Y444 P446	A435-Y441 WeakPolarHBondContact O-CE2 3.39Å; A435-Y441 PolarHBondContact O-OH 3.18Å; D437-Y441 WeakPolarHBondContact O-CD2 3.34Å; E438-Y441 PolarHBondContact O-N 2.81Å; D439-Y441 VanDerWaalsContact C-N 3.29Å; Y441-F443 PolarHBondContact O-N 2.85Å; Y441-Y444 PolarHBondContact O-N 2.81Å; Y441-P446 HydrophobicContact CD1-CB 4.14Å; Y441-P446 HydrophobicContact CE1-CB 3.73Å
442	R	85.9	Confident	86.5	Confident	87 Å²	87	81.5 Å²	81.5	33%	0.328	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-71.6	126.2	178.7	-65.1	178.2	-176.7	178.3	4.7	111.1	R250 D251 H254 A440 Y444 L445	R250-R442 HydrophobicContact CG-CB 3.77Å; R250-R442 HydrophobicContact CG-CG 4.4Å; R250-R442 VanDerWaalsContact O-CD 3.3Å; R250-R442 WeakPolarHBondContact O-CD 3.49Å; R250-R442 PolarHBondContact O-NH1 3.44Å; D251-R442 IonicContact OD1-NH1 3.63Å; H254-R442 HydrophobicContact CB-CB 4.3Å; A440-R442 PolarHBondContact O-N 2.87Å; R442-Y444 PolarHBondContact O-N 3.2Å; R442-L445 VanDerWaalsContact O-CB 3.3Å; R442-L445 WeakPolarHBondContact O-CB 3.32Å; R442-L445 PolarHBondContact O-N 3.45Å
443	F	87.4	Confident	86.9	Confident	97 Å²	97	77 Å²	77	43%	0.425	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	35.9	-171.4	-62.3	-42.3	0	0	0	113.8	H254 V257 Y441 L445	H254-F443 VanDerWaalsContact CA-CE2 3.49Å; H254-F443 HydrophobicContact CB-CD2 3.76Å; H254-F443 HydrophobicContact CB-CE2 3.42Å; H254-F443 VanDerWaalsContact CB-CE2 3.42Å; H254-F443 HydrophobicContact CB-CZ 3.95Å; H254-F443 AromaticContact CD2-CD1 3.57Å; H254-F443 AromaticContact CD2-CD2 3.72Å; H254-F443 AromaticContact CD2-CE1 3.53Å; H254-F443 AromaticContact CD2-CE2 3.71Å; H254-F443 AromaticContact CD2-CG 3.65Å; H254-F443 AromaticContact CD2-CZ 3.59Å; H254-F443 AromaticContact CG-CE2 3.95Å; V257-F443 HydrophobicContact CB-CZ 4.37Å; V257-F443 HydrophobicContact CG1-CZ 4.42Å; Y441-F443 PolarHBondContact O-N 2.85Å; F443-L445 HydrophobicContact CB-CD1 4.47Å; F443-L445 PolarHBondContact O-N 3.06Å
444	Y	86.9	Confident	87.4	Confident	220 Å²	220	72.6 Å²	72.6	86%	0.863	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	6.9	-173.6	-52.6	-83.3	0	0	0	114.5	Y441 R442	Y441-Y444 PolarHBondContact O-N 2.81Å; R442-Y444 PolarHBondContact O-N 3.2Å
445	L	88.4	Confident	88	Confident	54 Å²	54	70 Å²	70	28%	0.283	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-85.5	124.2	176.5	-62.6	168.9	0	0	0	109.1	Y246 V249 R442 F443	Y246-L445 HydrophobicContact CE2-CB 4.29Å; Y246-L445 HydrophobicContact CE2-CD2 3.93Å; V249-L445 HydrophobicContact CG1-CD1 4.19Å; R442-L445 VanDerWaalsContact O-CB 3.3Å; R442-L445 WeakPolarHBondContact O-CB 3.32Å; R442-L445 PolarHBondContact O-N 3.45Å; F443-L445 HydrophobicContact CB-CD1 4.47Å; F443-L445 PolarHBondContact O-N 3.06Å
446	P	91.9	Very high	88.9	Confident	35 Å²	35	68.7 Å²	68.7	23%	0.227	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-64	163.1	177.9	22.5	-31.5	0	0	0	112.9	Y246 R250 Y441 V450 V451	Y246-P446 WeakPolarHBondContact OH-CD 3.44Å; Y246-P446 WeakPolarHBondContact OH-CG 3.29Å; Y246-P446 PolarHBondContact OH-O 3.18Å; R250-P446 PolarHBondContact NH1-O 2.72Å; Y441-P446 HydrophobicContact CD1-CB 4.14Å; Y441-P446 HydrophobicContact CE1-CB 3.73Å; P446-V450 HydrophobicContact CB-CB 4.35Å; P446-V450 HydrophobicContact CB-CG1 4.42Å; P446-V451 HydrophobicContact CB-CG2 4.43Å; P446-V451 HydrophobicContact CG-CG2 3.68Å
447	P	90.1	Very high	89.6	Confident	10 Å²	10	64.1 Å²	64.1	7%	0.065	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-55.5	149.9	168	-25.3	35.6	0	0	0	112.3	R250 A440 F449 V450 V451	R250-P447 VanDerWaalsContact NH1-CA 3.29Å; A440-P447 HydrophobicContact CB-CG 3.76Å; P447-F449 VanDerWaalsContact C-N 3.28Å; P447-F449 HydrophobicContact CB-CD1 3.58Å; P447-F449 HydrophobicContact CB-CE1 3.2Å; P447-F449 HydrophobicContact CB-CG 4.45Å; P447-F449 HydrophobicContact CB-CZ 3.81Å; P447-F449 HydrophobicContact CG-CE1 3.99Å; P447-F449 HydrophobicContact CG-CZ 4.25Å; P447-F449 PolarHBondContact O-N 3.01Å; P447-V450 HydrophobicContact CB-CG2 4.14Å; P447-V450 HydrophobicContact CG-CG2 4.34Å; P447-V450 WeakPolarHBondContact O-CB 3.49Å; P447-V450 PolarHBondContact O-N 3.15Å; P447-V451 PolarHBondContact O-N 2.94Å
448	S	88.5	Confident	90.1	Very high	10 Å²	10	64.1 Å²	64.1	7%	0.07	33%	0.329	C	S	.	.	H	α-helix	trans	-71.7	-33.6	-165.9	36.1	0	0	0	0	110	R250 V450 V451 S452	R250-S448 PolarHBondContact NH2-OG 3.4Å; S448-V450 VanDerWaalsContact C-N 3.29Å; S448-V450 PolarHBondContact O-N 3.39Å; S448-V451 PolarHBondContact O-N 3.44Å; S448-S452 WeakPolarHBondContact O-CB 3.18Å; S448-S452 PolarHBondContact O-N 3.46Å; S448-S452 PolarHBondContact O-OG 3.47Å
449	F	87.8	Confident	90.9	Very high	26 Å²	26	55.8 Å²	55.8	11%	0.114	29%	0.29	C	S	.	.	H	α-helix	trans	-62.2	-34.3	174.1	72.4	-97	0	0	0	112.2	F430 G431 R434 A435 P447 S452 L453	F430-F449 HydrophobicContact CD1-CB 4.49Å; F430-F449 HydrophobicContact CD1-CD1 4.39Å; F430-F449 HydrophobicContact CD1-CG 4.43Å; F430-F449 HydrophobicContact CE1-CD1 4.17Å; G431-F449 VanDerWaalsContact CA-CE2 3.47Å; R434-F449 HydrophobicContact CB-CZ 4.35Å; A435-F449 HydrophobicContact CB-CE2 4.01Å; A435-F449 HydrophobicContact CB-CZ 4.12Å; P447-F449 VanDerWaalsContact C-N 3.28Å; P447-F449 HydrophobicContact CB-CD1 3.58Å; P447-F449 HydrophobicContact CB-CE1 3.2Å; P447-F449 HydrophobicContact CB-CG 4.45Å; P447-F449 HydrophobicContact CB-CZ 3.81Å; P447-F449 HydrophobicContact CG-CE1 3.99Å; P447-F449 HydrophobicContact CG-CZ 4.25Å; P447-F449 PolarHBondContact O-N 3.01Å; F449-S452 VanDerWaalsContact CA-OG 3.29Å; F449-S452 WeakPolarHBondContact CA-OG 3.44Å; F449-S452 PolarHBondContact O-N 3.32Å; F449-S452 PolarHBondContact O-OG 3.03Å; F449-L453 HydrophobicContact CD2-CD1 4.08Å; F449-L453 VanDerWaalsContact O-CB 3.27Å; F449-L453 WeakPolarHBondContact O-CB 3.42Å; F449-L453 WeakPolarHBondContact O-CD1 3.33Å; F449-L453 WeakPolarHBondContact O-CG 3.06Å; F449-L453 PolarHBondContact O-N 3.25Å
450	V	91.6	Very high	91.7	Very high	49 Å²	49	49.9 Å²	49.9	30%	0.297	26%	0.258	S	S	.	.	H	α-helix	trans	-65.6	-46.8	177.7	177.5	0	0	0	0	110	A435 P446 P447 S448 S452 L453 A454	A435-V450 HydrophobicContact CB-CG2 4.12Å; P446-V450 HydrophobicContact CB-CB 4.35Å; P446-V450 HydrophobicContact CB-CG1 4.42Å; P447-V450 HydrophobicContact CB-CG2 4.14Å; P447-V450 HydrophobicContact CG-CG2 4.34Å; P447-V450 WeakPolarHBondContact O-CB 3.49Å; P447-V450 PolarHBondContact O-N 3.15Å; S448-V450 VanDerWaalsContact C-N 3.29Å; S448-V450 PolarHBondContact O-N 3.39Å; V450-S452 VanDerWaalsContact C-N 3.33Å; V450-S452 PolarHBondContact O-N 2.98Å; V450-L453 PolarHBondContact O-N 3.29Å; V450-A454 PolarHBondContact O-N 3.25Å
451	V	92.3	Very high	92.4	Very high	50 Å²	50	53.8 Å²	53.8	30%	0.303	28%	0.275	S	S	.	.	H	α-helix	trans	-62.4	-42.6	176.9	-175.2	0	0	0	0	110.8	F243 Y246 P446 P447 S448 L453	F243-V451 HydrophobicContact CE1-CB 4.48Å; F243-V451 HydrophobicContact CE1-CG1 3.97Å; Y246-V451 HydrophobicContact CE1-CG2 4.29Å; P446-V451 HydrophobicContact CB-CG2 4.43Å; P446-V451 HydrophobicContact CG-CG2 3.68Å; P447-V451 PolarHBondContact O-N 2.94Å; S448-V451 PolarHBondContact O-N 3.44Å; V451-L453 PolarHBondContact O-N 3.26Å
452	S	93.1	Very high	92.8	Very high	7 Å²	7	50 Å²	50	5%	0.049	27%	0.265	C	S	.	.	H	α-helix	trans	-70.4	-31	-177.8	72.4	0	0	0	0	113.8	T278 S448 F449 V450 P456	T278-S452 VanDerWaalsContact CG2-CB 3.42Å; S448-S452 WeakPolarHBondContact O-CB 3.18Å; S448-S452 PolarHBondContact O-N 3.46Å; S448-S452 PolarHBondContact O-OG 3.47Å; F449-S452 VanDerWaalsContact CA-OG 3.29Å; F449-S452 WeakPolarHBondContact CA-OG 3.44Å; F449-S452 PolarHBondContact O-N 3.32Å; F449-S452 PolarHBondContact O-OG 3.03Å; V450-S452 VanDerWaalsContact C-N 3.33Å; V450-S452 PolarHBondContact O-N 2.98Å; S452-P456 WeakPolarHBondContact O-CD 3.43Å; S452-P456 WeakPolarHBondContact O-CG 3.23Å
453	L	94.9	Very high	93.2	Very high	10 Å²	10	48.6 Å²	48.6	5%	0.052	26%	0.261	C	S	.	.	H	α-helix	trans	-82.8	-18.2	-176.8	-70.8	167.3	0	0	0	113.3	I281 T424 L428 F449 V450 V451 L455 P456 V457	I281-L453 HydrophobicContact CD1-CD2 3.91Å; T424-L453 HydrophobicContact CG2-CD2 3.92Å; L428-L453 HydrophobicContact CD2-CD1 3.96Å; L428-L453 HydrophobicContact CG-CD1 4.19Å; F449-L453 HydrophobicContact CD2-CD1 4.08Å; F449-L453 VanDerWaalsContact O-CB 3.27Å; F449-L453 WeakPolarHBondContact O-CB 3.42Å; F449-L453 WeakPolarHBondContact O-CD1 3.33Å; F449-L453 WeakPolarHBondContact O-CG 3.06Å; F449-L453 PolarHBondContact O-N 3.25Å; V450-L453 PolarHBondContact O-N 3.29Å; V451-L453 PolarHBondContact O-N 3.26Å; L453-L455 PolarHBondContact O-N 3.46Å; L453-P456 WeakPolarHBondContact O-CD 3.26Å; L453-V457 WeakPolarHBondContact O-CB 3.38Å; L453-V457 WeakPolarHBondContact O-CG2 3.45Å; L453-V457 PolarHBondContact O-N 3.45Å
454	A	95.2	Very high	93.6	Very high	56 Å²	56	48 Å²	48	46%	0.463	27%	0.265	S	S	.	.	H	α-helix	trans	-54.7	-51	179.6	0	0	0	0	0	112.3	V450 V457 C458	V450-A454 PolarHBondContact O-N 3.25Å; A454-V457 PolarHBondContact O-N 3.26Å; A454-C458 PolarHBondContact O-N 2.65Å; A454-C458 PolarHBondContact O-SG 3.42Å
455	L	96.9	Very high	93.9	Very high	51 Å²	51	42.2 Å²	42.2	27%	0.267	25%	0.249	S	C	.	.	H	α-helix	trans	-65.6	-51.5	-179.1	177.7	71.2	0	0	0	113.1	T282 A285 L286 L289 L453 V457 C458 V459	T282-L455 HydrophobicContact CG2-CD2 3.91Å; A285-L455 HydrophobicContact CB-CD2 4.02Å; A285-L455 HydrophobicContact CB-CG 3.95Å; L286-L455 HydrophobicContact CD2-CD2 3.95Å; L286-L455 HydrophobicContact CG-CD2 4.06Å; L289-L455 HydrophobicContact CD2-CD1 3.95Å; L453-L455 PolarHBondContact O-N 3.46Å; L455-V457 VanDerWaalsContact C-N 3.31Å; L455-V457 PolarHBondContact O-N 3.25Å; L455-C458 PolarHBondContact O-N 3.27Å; L455-V459 HydrophobicContact CD1-CG2 4.43Å; L455-V459 WeakPolarHBondContact O-CG2 3.3Å; L455-V459 PolarHBondContact O-N 3.05Å
456	P	97.6	Very high	94	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-52.3	-44.5	173.3	-27.4	32.1	0	0	0	113.8	I281 A285 L420 T424 S452 L453 V459 I460	I281-P456 HydrophobicContact CD1-CB 4.34Å; I281-P456 HydrophobicContact CD1-CG 4Å; I281-P456 HydrophobicContact CG1-CB 4.37Å; I281-P456 HydrophobicContact CG1-CG 3.77Å; I281-P456 HydrophobicContact CG2-CG 4.38Å; A285-P456 HydrophobicContact CB-CB 4.33Å; A285-P456 HydrophobicContact CB-CG 3.97Å; L420-P456 HydrophobicContact CD1-CB 4.09Å; T424-P456 HydrophobicContact CG2-CB 4.27Å; T424-P456 WeakPolarHBondContact OG1-CB 3.44Å; S452-P456 WeakPolarHBondContact O-CD 3.43Å; S452-P456 WeakPolarHBondContact O-CG 3.23Å; L453-P456 WeakPolarHBondContact O-CD 3.26Å; P456-V459 PolarHBondContact O-N 3.01Å; P456-I460 VanDerWaalsContact O-CG1 3.31Å; P456-I460 WeakPolarHBondContact O-CG1 3.37Å; P456-I460 PolarHBondContact O-N 3.28Å
457	V	97.2	Very high	94	Very high	50 Å²	50	45.2 Å²	45.2	30%	0.303	26%	0.262	S	S	.	.	H	α-helix	trans	-63	-45.9	178	170.8	0	0	0	0	110.7	T424 L453 A454 L455 V459 I460 L461	T424-V457 HydrophobicContact CG2-CG2 3.71Å; L453-V457 WeakPolarHBondContact O-CB 3.38Å; L453-V457 WeakPolarHBondContact O-CG2 3.45Å; L453-V457 PolarHBondContact O-N 3.45Å; A454-V457 PolarHBondContact O-N 3.26Å; L455-V457 VanDerWaalsContact C-N 3.31Å; L455-V457 PolarHBondContact O-N 3.25Å; V457-V459 VanDerWaalsContact C-N 3.3Å; V457-V459 PolarHBondContact O-N 2.75Å; V457-I460 PolarHBondContact O-N 3.29Å; V457-L461 HydrophobicContact CG1-CD1 3.91Å; V457-L461 HydrophobicContact CG1-CG 4.34Å; V457-L461 WeakPolarHBondContact O-CB 3.46Å; V457-L461 VanDerWaalsContact O-CG 3.32Å; V457-L461 WeakPolarHBondContact O-CG 3.32Å; V457-L461 PolarHBondContact O-N 3.36Å
458	C	96.7	Very high	94.2	Very high	81 Å²	81	48.4 Å²	48.4	55%	0.547	28%	0.278	S	S	.	.	H	α-helix	trans	-58.3	-41.5	175	-69.9	0	0	0	0	112.4	A454 L455 L461 G462	A454-C458 PolarHBondContact O-N 2.65Å; A454-C458 PolarHBondContact O-SG 3.42Å; L455-C458 PolarHBondContact O-N 3.27Å; C458-L461 PolarHBondContact O-N 3.33Å; C458-G462 PolarHBondContact O-N 2.77Å
459	V	97.8	Very high	94.4	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.006	31%	0.308	C	S	.	.	H	α-helix	trans	-65.9	-42.2	177.3	172.4	0	0	0	0	111	A285 L289 Q292 Y417 L420 L455 P456 V457 G462 K463	A285-V459 HydrophobicContact CB-CG2 4.29Å; L289-V459 HydrophobicContact CB-CG2 3.89Å; L289-V459 HydrophobicContact CD1-CG2 4.19Å; L289-V459 HydrophobicContact CG-CG2 4.49Å; Q292-V459 PolarHBondContact NE2-O 3.02Å; Q292-V459 PolarHBondContact OE1-O 2.75Å; Y417-V459 HydrophobicContact CE1-CG1 4.22Å; L420-V459 HydrophobicContact CD2-CB 4.3Å; L420-V459 HydrophobicContact CD2-CG1 3.72Å; L455-V459 HydrophobicContact CD1-CG2 4.43Å; L455-V459 WeakPolarHBondContact O-CG2 3.3Å; L455-V459 PolarHBondContact O-N 3.05Å; P456-V459 PolarHBondContact O-N 3.01Å; V457-V459 VanDerWaalsContact C-N 3.3Å; V457-V459 PolarHBondContact O-N 2.75Å; V459-G462 PolarHBondContact O-N 3.02Å; V459-K463 WeakPolarHBondContact O-CB 3.23Å; V459-K463 PolarHBondContact O-N 3.46Å
460	I	97.4	Very high	94.5	Very high	32 Å²	32	56.4 Å²	56.4	16%	0.164	33%	0.334	C	S	.	.	H	α-helix	trans	-63.8	-46.3	176.8	-68.3	162.4	0	0	0	110.4	L420 L421 T424 P456 V457 G462 K463 V464	L420-I460 HydrophobicContact CD2-CG1 4.31Å; L420-I460 HydrophobicContact CG-CD1 4.49Å; L420-I460 HydrophobicContact CG-CG1 4.44Å; L421-I460 HydrophobicContact CB-CD1 4.43Å; L421-I460 HydrophobicContact CD1-CD1 4Å; L421-I460 HydrophobicContact CD1-CG2 4.15Å; T424-I460 HydrophobicContact CG2-CD1 4.02Å; T424-I460 WeakPolarHBondContact OG1-CD1 3.2Å; P456-I460 VanDerWaalsContact O-CG1 3.31Å; P456-I460 WeakPolarHBondContact O-CG1 3.37Å; P456-I460 PolarHBondContact O-N 3.28Å; V457-I460 PolarHBondContact O-N 3.29Å; I460-G462 PolarHBondContact O-N 2.97Å; I460-K463 WeakPolarHBondContact O-CB 3.4Å; I460-K463 PolarHBondContact O-N 3.1Å; I460-K463 VanDerWaalsContact O-N 3.13Å; I460-V464 WeakPolarHBondContact O-CG2 3.11Å; I460-V464 PolarHBondContact O-N 3.1Å
461	L	96.5	Very high	94.5	Very high	108 Å²	108	55.7 Å²	55.7	57%	0.565	33%	0.329	S	S	*	.	H	α-helix	trans	-61.4	-43.7	176.8	-69.3	173.1	0	0	0	111.9	V457 C458 K463 V464 L465	V457-L461 HydrophobicContact CG1-CD1 3.91Å; V457-L461 HydrophobicContact CG1-CG 4.34Å; V457-L461 WeakPolarHBondContact O-CB 3.46Å; V457-L461 VanDerWaalsContact O-CG 3.32Å; V457-L461 WeakPolarHBondContact O-CG 3.32Å; V457-L461 PolarHBondContact O-N 3.36Å; C458-L461 PolarHBondContact O-N 3.33Å; L461-K463 VanDerWaalsContact C-N 3.26Å; L461-K463 PolarHBondContact O-N 3.07Å; L461-V464 PolarHBondContact O-N 3.46Å; L461-L465 PolarHBondContact O-N 3.02Å
462	G	95.1	Very high	94.3	Very high	17 Å²	17	54.5 Å²	54.5	18%	0.175	33%	0.327	C	S	.	.	H	α-helix	trans	-59.9	-37.2	174.4	0	0	0	0	0	112.3	C458 V459 I460 L465 M466	C458-G462 PolarHBondContact O-N 2.77Å; V459-G462 PolarHBondContact O-N 3.02Å; I460-G462 PolarHBondContact O-N 2.97Å; G462-L465 PolarHBondContact O-N 3.05Å; G462-M466 VanDerWaalsContact O-CG 3.23Å; G462-M466 WeakPolarHBondContact O-CG 3.28Å; G462-M466 PolarHBondContact O-N 3.45Å
463	K	94.5	Very high	94.2	Very high	57 Å²	57	59.7 Å²	59.7	25%	0.248	35%	0.35	C	S	.	.	H	α-helix	trans	-65.9	-44.5	174.2	-177.5	57.7	171.5	-179.1	0	111.7	Y417 V459 I460 L461 L465 M466 L467	Y417-K463 HydrophobicContact CD1-CB 4.13Å; Y417-K463 HydrophobicContact CD1-CD 4.29Å; Y417-K463 HydrophobicContact CD1-CG 3.83Å; Y417-K463 HydrophobicContact CD2-CD 4.33Å; Y417-K463 HydrophobicContact CE1-CB 3.76Å; Y417-K463 HydrophobicContact CE1-CD 3.89Å; Y417-K463 HydrophobicContact CE1-CG 3.73Å; Y417-K463 HydrophobicContact CE2-CD 3.99Å; Y417-K463 HydrophobicContact CG-CD 4.5Å; Y417-K463 HydrophobicContact CG-CG 4.27Å; V459-K463 WeakPolarHBondContact O-CB 3.23Å; V459-K463 PolarHBondContact O-N 3.46Å; I460-K463 WeakPolarHBondContact O-CB 3.4Å; I460-K463 PolarHBondContact O-N 3.1Å; I460-K463 VanDerWaalsContact O-N 3.13Å; L461-K463 VanDerWaalsContact C-N 3.26Å; L461-K463 PolarHBondContact O-N 3.07Å; K463-L465 VanDerWaalsContact C-N 3.34Å; K463-L465 PolarHBondContact O-N 2.87Å; K463-M466 PolarHBondContact O-N 3.42Å; K463-L467 HydrophobicContact CD-CD1 4.4Å; K463-L467 HydrophobicContact CD-CG 4.36Å; K463-L467 HydrophobicContact CG-CD1 4.14Å; K463-L467 VanDerWaalsContact O-CG 3.32Å; K463-L467 WeakPolarHBondContact O-CG 3.1Å; K463-L467 PolarHBondContact O-N 2.98Å
464	V	95	Very high	94	Very high	84 Å²	84	63.7 Å²	63.7	51%	0.509	37%	0.367	S	S	.	.	H	α-helix	trans	-59.5	-45.8	176.8	172.8	0	0	0	0	110.5	I460 L461 M466 L467 L468	I460-V464 WeakPolarHBondContact O-CG2 3.11Å; I460-V464 PolarHBondContact O-N 3.1Å; L461-V464 PolarHBondContact O-N 3.46Å; V464-M466 VanDerWaalsContact C-N 3.31Å; V464-M466 PolarHBondContact O-N 2.98Å; V464-L467 PolarHBondContact O-N 2.96Å; V464-L467 VanDerWaalsContact O-N 3.09Å; V464-L468 PolarHBondContact O-N 3.32Å
465	L	94.2	Very high	93.8	Very high	99 Å²	99	61.7 Å²	61.7	52%	0.518	35%	0.349	S	S	.	.	H	α-helix	trans	-57.5	-42.6	175.7	-178.1	66.5	0	0	0	112.1	L461 G462 K463 L467 L468	L461-L465 PolarHBondContact O-N 3.02Å; G462-L465 PolarHBondContact O-N 3.05Å; K463-L465 VanDerWaalsContact C-N 3.34Å; K463-L465 PolarHBondContact O-N 2.87Å; L465-L467 VanDerWaalsContact C-N 3.29Å; L465-L467 PolarHBondContact O-N 2.91Å; L465-L468 HydrophobicContact CD1-CD1 3.82Å; L465-L468 WeakPolarHBondContact O-CB 3.22Å; L465-L468 PolarHBondContact O-N 3.22Å
466	M	90.6	Very high	93.5	Very high	35 Å²	35	64 Å²	64	17%	0.172	36%	0.357	C	S	.	.	H	α-helix	trans	-71.6	-21.8	178.5	-69.2	-72	177.2	0	0	113.7	A295 A296 L299 G462 K463 V464 V471 G472	A295-M466 HydrophobicContact CB-SD 4.38Å; A296-M466 HydrophobicContact CB-CE 4.06Å; L299-M466 HydrophobicContact CD1-CE 4Å; L299-M466 HydrophobicContact CD1-SD 3.62Å; G462-M466 VanDerWaalsContact O-CG 3.23Å; G462-M466 WeakPolarHBondContact O-CG 3.28Å; G462-M466 PolarHBondContact O-N 3.45Å; K463-M466 PolarHBondContact O-N 3.42Å; V464-M466 VanDerWaalsContact C-N 3.31Å; V464-M466 PolarHBondContact O-N 2.98Å; M466-V471 HydrophobicContact SD-CG1 3.74Å; M466-G472 PolarHBondContact O-N 3.23Å
467	L	91.5	Very high	93.2	Very high	117 Å²	117	67.5 Å²	67.5	61%	0.613	37%	0.374	S	S	*	.	H	α-helix	trans	-84.2	-13.4	176.4	-72	172.7	0	0	0	113	K463 V464 L465	K463-L467 HydrophobicContact CD-CD1 4.4Å; K463-L467 HydrophobicContact CD-CG 4.36Å; K463-L467 HydrophobicContact CG-CD1 4.14Å; K463-L467 VanDerWaalsContact O-CG 3.32Å; K463-L467 WeakPolarHBondContact O-CG 3.1Å; K463-L467 PolarHBondContact O-N 2.98Å; V464-L467 PolarHBondContact O-N 2.96Å; V464-L467 VanDerWaalsContact O-N 3.09Å; L465-L467 VanDerWaalsContact C-N 3.29Å; L465-L467 PolarHBondContact O-N 2.91Å
468	L	94.4	Very high	92.8	Very high	77 Å²	77	65.1 Å²	65.1	40%	0.403	36%	0.36	S	S	.	.	S	Bend	trans	-57	137.1	175.6	-72.5	166.4	0	0	0	110.5	V464 L465 C470 V471 G472	V464-L468 PolarHBondContact O-N 3.32Å; L465-L468 HydrophobicContact CD1-CD1 3.82Å; L465-L468 WeakPolarHBondContact O-CB 3.22Å; L465-L468 PolarHBondContact O-N 3.22Å; L468-C470 PolarHBondContact O-N 2.95Å; L468-C470 VanDerWaalsContact O-N 3.08Å; L468-V471 PolarHBondContact O-N 3.41Å; L468-G472 PolarHBondContact O-N 3.42Å
469	P	91.4	Very high	92.5	Very high	108 Å²	108	65.1 Å²	65.1	70%	0.701	35%	0.348	S	S	*	.	H	α-helix	trans	-52.9	-38.4	-172.1	-29.3	34.5	0	0	0	114.4	H473	P469-H473 WeakPolarHBondContact O-CB 3.42Å; P469-H473 PolarHBondContact O-N 3.12Å
470	C	90.6	Very high	92.1	Very high	96 Å²	96	72.7 Å²	72.7	65%	0.649	38%	0.381	S	S	*	.	H	α-helix	trans	-64.2	-42.6	179.3	53	0	0	0	0	113	L468	L468-C470 PolarHBondContact O-N 2.95Å; L468-C470 VanDerWaalsContact O-N 3.08Å
471	V	90.6	Very high	91.6	Very high	34 Å²	34	72.4 Å²	72.4	21%	0.206	39%	0.385	C	S	.	.	H	α-helix	trans	-80.3	-47.2	-179.1	-177.6	0	0	0	0	110.5	L299 M466 L468 H473 K474 L475	L299-V471 HydrophobicContact CD1-CG1 3.59Å; M466-V471 HydrophobicContact SD-CG1 3.74Å; L468-V471 PolarHBondContact O-N 3.41Å; V471-H473 PolarHBondContact O-N 3.34Å; V471-K474 PolarHBondContact O-N 3.12Å; V471-L475 WeakPolarHBondContact O-CB 3.35Å; V471-L475 PolarHBondContact O-N 3.35Å
472	G	89.9	Confident	91	Very high	24 Å²	24	70.2 Å²	70.2	25%	0.247	37%	0.374	C	S	.	.	H	α-helix	trans	-61.5	-42.2	-178.7	0	0	0	0	0	112.6	M466 L468 L475 H476	M466-G472 PolarHBondContact O-N 3.23Å; L468-G472 PolarHBondContact O-N 3.42Å; G472-L475 PolarHBondContact O-N 3.08Å; G472-H476 WeakPolarHBondContact O-CB 3.43Å; G472-H476 PolarHBondContact O-N 3.37Å
473	H	90.7	Very high	90.3	Very high	117 Å²	117	70.5 Å²	70.5	54%	0.542	37%	0.372	S	S	.	.	H	α-helix	trans	-64.6	-44.9	177.6	-168	81.9	0	0	0	111.8	P469 V471 H476 Q477	P469-H473 WeakPolarHBondContact O-CB 3.42Å; P469-H473 PolarHBondContact O-N 3.12Å; V471-H473 PolarHBondContact O-N 3.34Å; H473-H476 WeakPolarHBondContact O-CB 3.41Å; H473-H476 PolarHBondContact O-N 3.45Å; H473-Q477 PolarHBondContact CD2-NE2 2.94Å; H473-Q477 PolarHBondContact NE2-NE2 3.34Å; H473-Q477 WeakPolarHBondContact O-CG 3.42Å; H473-Q477 PolarHBondContact O-N 2.8Å
474	K	90.6	Very high	89.4	Confident	94 Å²	94	71.5 Å²	71.5	41%	0.409	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-44.9	176.9	-173.9	174.9	179.9	-178.8	0	111.7	L299 V471 H476 Q477 I478	L299-K474 HydrophobicContact CD2-CB 4.31Å; L299-K474 HydrophobicContact CD2-CD 4.19Å; L299-K474 HydrophobicContact CD2-CG 4.08Å; V471-K474 PolarHBondContact O-N 3.12Å; K474-H476 VanDerWaalsContact C-N 3.32Å; K474-H476 PolarHBondContact O-N 3.3Å; K474-Q477 PolarHBondContact O-N 3.46Å; K474-I478 HydrophobicContact CG-CD1 4.18Å; K474-I478 WeakPolarHBondContact O-CG1 3.28Å; K474-I478 PolarHBondContact O-N 3Å
475	L	90.9	Very high	88.2	Confident	14 Å²	14	68.6 Å²	68.6	7%	0.073	37%	0.366	C	S	.	.	H	α-helix	trans	-61.6	-41.2	176.8	-177.1	62.5	0	0	0	111.6	A295 Q298 L299 V471 G472 I478 R479	A295-L475 HydrophobicContact CB-CD1 4.33Å; A295-L475 HydrophobicContact CB-CD2 3.99Å; Q298-L475 HydrophobicContact CB-CD1 4.22Å; L299-L475 HydrophobicContact CD2-CB 4.15Å; L299-L475 HydrophobicContact CG-CD1 4.18Å; V471-L475 WeakPolarHBondContact O-CB 3.35Å; V471-L475 PolarHBondContact O-N 3.35Å; G472-L475 PolarHBondContact O-N 3.08Å; L475-I478 PolarHBondContact O-N 3.33Å; L475-R479 VanDerWaalsContact O-CG 3.31Å; L475-R479 WeakPolarHBondContact O-CG 3.43Å; L475-R479 PolarHBondContact O-N 2.97Å
476	H	90.3	Very high	86.5	Confident	98 Å²	98	70.3 Å²	70.3	45%	0.454	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-43.7	175.9	-173.7	57.5	0	0	0	112.2	G472 H473 K474 R479 K480	G472-H476 WeakPolarHBondContact O-CB 3.43Å; G472-H476 PolarHBondContact O-N 3.37Å; H473-H476 WeakPolarHBondContact O-CB 3.41Å; H473-H476 PolarHBondContact O-N 3.45Å; K474-H476 VanDerWaalsContact C-N 3.32Å; K474-H476 PolarHBondContact O-N 3.3Å; H476-R479 PolarHBondContact O-N 3.08Å; H476-K480 VanDerWaalsContact NE2-CE 3.29Å; H476-K480 WeakPolarHBondContact NE2-CE 3.39Å; H476-K480 PolarHBondContact O-N 3.21Å
477	Q	91	Very high	84.8	Confident	75 Å²	75	72.6 Å²	72.6	35%	0.35	40%	0.402	S	S	.	.	H	α-helix	trans	-61.8	-44.3	175.6	-70.3	-179.2	-6.3	0	0	111.9	H473 K474 R479 K480 G481 L482	H473-Q477 PolarHBondContact CD2-NE2 2.94Å; H473-Q477 PolarHBondContact NE2-NE2 3.34Å; H473-Q477 WeakPolarHBondContact O-CG 3.42Å; H473-Q477 PolarHBondContact O-N 2.8Å; K474-Q477 PolarHBondContact O-N 3.46Å; Q477-R479 VanDerWaalsContact C-N 3.31Å; Q477-R479 PolarHBondContact O-N 2.9Å; Q477-K480 CarbonylContact O-C 3.5Å; Q477-K480 WeakPolarHBondContact O-CB 3.33Å; Q477-K480 PolarHBondContact O-N 3.47Å; Q477-K480 VanDerWaalsContact O-N 3.16Å; Q477-G481 PolarHBondContact O-N 2.98Å; Q477-G481 VanDerWaalsContact O-N 3.12Å; Q477-L482 HydrophobicContact CB-CB 4.02Å; Q477-L482 HydrophobicContact CB-CD2 3.75Å; Q477-L482 VanDerWaalsContact O-CB 3.23Å; Q477-L482 WeakPolarHBondContact O-CB 3.1Å; Q477-L482 PolarHBondContact O-N 3.32Å
478	I	90.1	Very high	82.8	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-59.6	-43.4	176.1	-67.7	165.1	0	0	0	110.6	Q298 L299 K304 K474 L475 K480 G481	Q298-I478 HydrophobicContact CB-CG2 4.43Å; L299-I478 HydrophobicContact CD2-CD1 4.11Å; K304-I478 HydrophobicContact CB-CG2 4.35Å; K474-I478 HydrophobicContact CG-CD1 4.18Å; K474-I478 WeakPolarHBondContact O-CG1 3.28Å; K474-I478 PolarHBondContact O-N 3Å; L475-I478 PolarHBondContact O-N 3.33Å; I478-K480 VanDerWaalsContact C-N 3.32Å; I478-K480 PolarHBondContact O-N 3.48Å; I478-G481 WeakPolarHBondContact O-CA 3.46Å; I478-G481 PolarHBondContact O-N 3.44Å
479	R	88.6	Confident	80.4	Confident	80 Å²	80	75.4 Å²	75.4	30%	0.302	42%	0.424	S	S	.	.	H	α-helix	trans	-65.6	-34.2	177.4	-72.4	173.2	177.4	-172.5	-3.8	112.6	K304 L475 H476 Q477 G481	K304-R479 WeakPolarHBondContact CD-O 3.23Å; K304-R479 PolarHBondContact NZ-O 3.37Å; L475-R479 VanDerWaalsContact O-CG 3.31Å; L475-R479 WeakPolarHBondContact O-CG 3.43Å; L475-R479 PolarHBondContact O-N 2.97Å; H476-R479 PolarHBondContact O-N 3.08Å; Q477-R479 VanDerWaalsContact C-N 3.31Å; Q477-R479 PolarHBondContact O-N 2.9Å; R479-G481 PolarHBondContact O-N 3.04Å
480	K	89.6	Confident	78.2	Confident	161 Å²	161	81 Å²	81	70%	0.7	43%	0.431	S	S	*	.	H	α-helix	trans	-68.7	-14.3	169.8	-76.6	-174.5	168.9	-176.2	0	113.9	H476 Q477 I478	H476-K480 VanDerWaalsContact NE2-CE 3.29Å; H476-K480 WeakPolarHBondContact NE2-CE 3.39Å; H476-K480 PolarHBondContact O-N 3.21Å; Q477-K480 CarbonylContact O-C 3.5Å; Q477-K480 WeakPolarHBondContact O-CB 3.33Å; Q477-K480 PolarHBondContact O-N 3.47Å; Q477-K480 VanDerWaalsContact O-N 3.16Å; I478-K480 VanDerWaalsContact C-N 3.32Å; I478-K480 PolarHBondContact O-N 3.48Å
481	G	86.5	Confident	76.1	Confident	25 Å²	25	85.3 Å²	85.3	26%	0.258	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	115.5	10.8	175	0	0	0	0	0	114.9	Q477 I478 R479 D483	Q477-G481 PolarHBondContact O-N 2.98Å; Q477-G481 VanDerWaalsContact O-N 3.12Å; I478-G481 WeakPolarHBondContact O-CA 3.46Å; I478-G481 PolarHBondContact O-N 3.44Å; R479-G481 PolarHBondContact O-N 3.04Å; G481-D483 PolarHBondContact O-N 2.97Å
482	L	83.9	Confident	73.7	Confident	62 Å²	62	91.2 Å²	91.2	33%	0.325	46%	0.463	S	S	.	.			trans	-59.3	128.7	168.8	-177.2	71.6	0	0	0	109.7	Q477 T484	Q477-L482 HydrophobicContact CB-CB 4.02Å; Q477-L482 HydrophobicContact CB-CD2 3.75Å; Q477-L482 VanDerWaalsContact O-CB 3.23Å; Q477-L482 WeakPolarHBondContact O-CB 3.1Å; Q477-L482 PolarHBondContact O-N 3.32Å; L482-T484 HydrophobicContact CD1-CG2 4.37Å; L482-T484 HydrophobicContact CD2-CG2 3.74Å; L482-T484 HydrophobicContact CG-CG2 3.87Å
483	D	81.3	Confident	71.1	Confident	24 Å²	24	98 Å²	98	13%	0.128	49%	0.488	C	S	.	.			trans	-119.5	106.1	172.8	-160.9	-33.4	0	0	0	108.8	G302 T303 G481 S485	G302-D483 WeakPolarHBondContact O-CA 3.39Å; T303-D483 WeakPolarHBondContact CB-OD2 3.36Å; T303-D483 PolarHBondContact OG1-OD2 3.21Å; G481-D483 PolarHBondContact O-N 2.97Å; D483-S485 WeakPolarHBondContact OD1-CB 3.38Å; D483-S485 PolarHBondContact OD1-N 3.49Å; D483-S485 PolarHBondContact OD1-OG 3.02Å
484	T	76.1	Confident	69.3	Low	78 Å²	78	97.4 Å²	97.4	48%	0.479	50%	0.495	S	S	.	.			trans	-99.3	11.5	175	64.3	0	0	0	0	112	G302 L482	G302-T484 WeakPolarHBondContact CA-OG1 3.33Å; G302-T484 PolarHBondContact O-N 2.74Å; L482-T484 HydrophobicContact CD1-CG2 4.37Å; L482-T484 HydrophobicContact CD2-CG2 3.74Å; L482-T484 HydrophobicContact CG-CG2 3.87Å
485	S	69.8	Low	66.6	Low	22 Å²	22	99.4 Å²	99.4	15%	0.154	52%	0.515	C	S	.	.			trans	-68.5	144.3	179.9	70.9	0	0	0	0	110.6	D483 C487 K488	D483-S485 WeakPolarHBondContact OD1-CB 3.38Å; D483-S485 PolarHBondContact OD1-N 3.49Å; D483-S485 PolarHBondContact OD1-OG 3.02Å; S485-C487 PolarHBondContact O-N 3.5Å; S485-K488 PolarHBondContact O-N 3.3Å
486	P	58.6	Low	64	Low	135 Å²	135	102 Å²	102	88%	0.877	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-62.5	-9.6	176.9	22.9	-31.5	0	0	0	113.1	K488	P486-K488 PolarHBondContact O-N 3.4Å
487	C	53.7	Low	61.6	Low	84 Å²	84	103.3 Å²	103.3	57%	0.568	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-80.7	6.1	179	-140.4	0	0	0	0	113.8	S485 A489 R490	S485-C487 PolarHBondContact O-N 3.5Å; C487-A489 PolarHBondContact O-N 3.49Å; C487-A489 VanDerWaalsContact O-N 3.15Å; C487-R490 PolarHBondContact O-N 3.29Å
488	K	50.4	Low	58.7	Low	155 Å²	155	104.7 Å²	104.7	67%	0.674	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-57.4	-26	177.5	-146.9	176.3	-174.3	179.3	0	113	S485 P486 R490	S485-K488 PolarHBondContact O-N 3.3Å; P486-K488 PolarHBondContact O-N 3.4Å; K488-R490 VanDerWaalsContact C-N 3.34Å; K488-R490 PolarHBondContact O-N 3.28Å
489	A	44.4	Very low	56.3	Low	97 Å²	97	108.5 Å²	108.5	80%	0.802	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-76.1	-9.5	-177.9	0	0	0	0	0	115.4	C487	C487-A489 PolarHBondContact O-N 3.49Å; C487-A489 VanDerWaalsContact O-N 3.15Å
490	R	44.3	Very low	53.8	Low	226 Å²	226	111.7 Å²	111.7	85%	0.853	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-108.1	1.6	-175.8	-122.4	-178.2	-161.1	-177.3	5	115.2	C487 K488	C487-R490 PolarHBondContact O-N 3.29Å; K488-R490 VanDerWaalsContact C-N 3.34Å; K488-R490 PolarHBondContact O-N 3.28Å
491	R	47.4	Very low	51.1	Low	186 Å²	186	111.1 Å²	111.1	70%	0.702	65%	0.647	S	S	*	*			trans	-106.6	58.3	-177	-145.7	-173.2	-64.7	-132.2	7.5	110.8
492	L	40.6	Very low	48.5	Very low	159 Å²	159	113.4 Å²	113.4	83%	0.832	66%	0.658	S	S	*	*			trans	-111	101.5	158.3	-91	153.7	0	0	0	106.2
493	E	34	Very low	46.2	Very low	166 Å²	166	112.5 Å²	112.5	78%	0.776	66%	0.657	S	S	*	*			trans	66.6	161.8	174.2	-62.9	-62	132.4	0	0	118.5
494	P	53.7	Low	44	Very low	104 Å²	104	117.2 Å²	117.2	68%	0.675	68%	0.678	S	S	*	*			cis	-135.1	-165	-31	27	-4.3	0	0	0	112.9
495	V	32.8	Very low	42.3	Very low	136 Å²	136	122.2 Å²	122.2	82%	0.824	69%	0.688	S	S	*	*			trans	104.2	108.5	152.8	-167.4	0	0	0	0	118.7
496	G	36.1	Very low	41	Very low	68 Å²	68	123.1 Å²	123.1	70%	0.701	69%	0.693	S	S	*	*				71.7	104.7	125.6	0	0	0	0	0	119.6
497	S	40.2	Very low	39.8	Very low	127 Å²	127	117.3 Å²	117.3	89%	0.888	65%	0.654	S	S	*	*			trans	32.6	89.4	147.9	-160.6	0	0	0	0	118.3
498	A	31.1	Very low	38.9	Very low	103 Å²	103	115.1 Å²	115.1	85%	0.851	64%	0.637	S	S	*	*			trans	-145.2	71.5	150.7	0	0	0	0	0	108.7
499	A	39.8	Very low	38.2	Very low	80 Å²	80	113 Å²	113	66%	0.661	63%	0.631	S	S	*	*			trans	-74.3	145.8	163.9	0	0	0	0	0	109.5
500	N	36.5	Very low	37.9	Very low	148 Å²	148	113.9 Å²	113.9	79%	0.791	62%	0.622	S	S	*	*			trans	95.1	80.9	168.1	-51.8	-29.8	0	0	0	115.9
501	I	32.3	Very low	37.5	Very low	149 Å²	149	107.9 Å²	107.9	76%	0.764	61%	0.61	S	S	*	*				-163.4	118.3	115.4	-82.9	138.1	0	0	0	106.1
502	S	30.9	Very low	37	Very low	72 Å²	72	103.6 Å²	103.6	50%	0.503	61%	0.605	S	S	.	*			trans	-69.5	126.4	174.9	175.3	0	0	0	0	110	E504 R505	S502-E504 PolarHBondContact O-N 3.33Å; S502-E504 PolarHBondContact OG-N 3.31Å; S502-R505 PolarHBondContact O-N 3.23Å
503	P	36.4	Very low	36.8	Very low	44 Å²	44	100.4 Å²	100.4	29%	0.286	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.3	-3.6	178.5	25.2	-32.3	0	0	0	114	K304 R505 T507	K304-P503 HydrophobicContact CD-CG 4.02Å; P503-R505 VanDerWaalsContact C-N 3.3Å; P503-R505 PolarHBondContact O-N 2.95Å; P503-T507 PolarHBondContact O-OG1 3.36Å
504	E	34.9	Very low	36.9	Very low	123 Å²	123	96.3 Å²	96.3	58%	0.575	58%	0.58	S	S	*	*	H	α-helix	trans	-68.2	-27.5	173.5	-123.3	174.8	179.2	0	0	113	S502	S502-E504 PolarHBondContact O-N 3.33Å; S502-E504 PolarHBondContact OG-N 3.31Å
505	R	41.2	Very low	35.8	Very low	182 Å²	182	95.7 Å²	95.7	69%	0.687	57%	0.574	S	S	*	*	H	α-helix	trans	-73	-26.8	179.5	-91.8	-171	-177.2	-175	1.9	114.2	S502 P503	S502-R505 PolarHBondContact O-N 3.23Å; P503-R505 VanDerWaalsContact C-N 3.3Å; P503-R505 PolarHBondContact O-N 2.95Å
506	V	41.3	Very low	36	Very low	42 Å²	42	92.9 Å²	92.9	26%	0.255	56%	0.556	S	S	.	*	H	α-helix	trans	-90.3	-32.4	-168.8	-174.2	0	0	0	0	112	F308 L316 R319	F308-V506 HydrophobicContact CD2-CG1 3.61Å; F308-V506 HydrophobicContact CE2-CB 4.24Å; F308-V506 HydrophobicContact CE2-CG1 3.58Å; L316-V506 HydrophobicContact CD1-CG1 3.78Å; R319-V506 PolarHBondContact NH2-O 3.11Å
507	T	33.4	Very low	36	Very low	12 Å²	12	94.8 Å²	94.8	7%	0.074	55%	0.545	C	S	.	.	H	α-helix	trans	-87.9	-9.2	-176.2	3.1	0	0	0	0	116.5	A294 Q298 F308 P503	A294-T507 HydrophobicContact CB-CG2 3.99Å; Q298-T507 VanDerWaalsContact CD-CG2 3.49Å; Q298-T507 PolarHBondContact NE2-OG1 3.36Å; F308-T507 HydrophobicContact CZ-CG2 4.12Å; P503-T507 PolarHBondContact O-OG1 3.36Å
508	I	35.5	Very low	35.7	Very low	38 Å²	38	92.1 Å²	92.1	20%	0.195	52%	0.516	C	S	.	.	H	α-helix	trans	-127.9	-2.3	-170.3	-56.4	168	0	0	0	113.2	W405 S409	W405-I508 HydrophobicContact CZ2-CB 4.24Å; W405-I508 HydrophobicContact CZ2-CG2 4.28Å; S409-I508 WeakPolarHBondContact OG-CG2 3.35Å
509	M	34.8	Very low	36.1	Very low	112 Å²	112	91.1 Å²	91.1	55%	0.552	49%	0.486	S	S	*	.			trans	-66.8	0	161.3	-83.2	-170.1	160.8	0	0	111.9	R319 W405	R319-M509 WeakPolarHBondContact CD-OXT 3.43Å; R319-M509 VanDerWaalsContact NE-C 3.31Å; R319-M509 PolarHBondContact NE-O 3Å; R319-M509 PolarHBondContact NE-OXT 3.36Å; R319-M509 PolarHBondContact NH1-O 3.22Å; R319-M509 VanDerWaalsContact NH2-CA 3.29Å; R319-M509 PolarHBondContact NH2-O 3.08Å; R319-M509 PolarHBondContact NH2-OXT 3.35Å; W405-M509 HydrophobicContact CH2-CG 4.26Å; W405-M509 HydrophobicContact CZ3-CE 4.41Å

Retrieved 509 of 509 residues in 149.3 ms (Link to these results)

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