A0A096NH89_PAPAN Loading...

RNA exonuclease 5

AlphaFold DB , UniProt , Accession A0A096NH89, Species PAPAN (Papio anubis, Olive baboon), Gene REXO5, Length 773 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	38.4	Very low	32.5	Very low	242 Å²	242	168.6 Å²	168.6	100%	1.192	86%	0.86	S	S	*	*				0	150	0	-87.5	-156	-124.3	0	0	107.9
2	E	30.3	Very low	32.2	Very low	189 Å²	189	164.6 Å²	164.6	88%	0.883	85%	0.853	S	S	*	*			trans	88.8	141.8	174	-66.4	-149.4	146.8	0	0	119.8
3	P	48.4	Very low	31.8	Very low	109 Å²	109	170.5 Å²	170.5	71%	0.708	86%	0.858	S	S	*	*			trans	-131.2	177.5	-138.8	33.1	-9.5	0	0	0	114.7
4	E	33.1	Very low	31.6	Very low	148 Å²	148	173.2 Å²	173.2	69%	0.692	86%	0.861	S	S	*	*			trans	44.2	115.5	144	-82.6	-164.8	-163.5	0	0	121.4
5	R	32	Very low	31.4	Very low	221 Å²	221	170.6 Å²	170.6	83%	0.834	86%	0.858	S	S	*	*				163.9	145.1	89.6	-106.2	159.4	-161	-156.1	5.2	115
6	A	30.4	Very low	31.2	Very low	95 Å²	95	175.2 Å²	175.2	79%	0.785	86%	0.862	S	S	*	*			trans	70.4	94.7	141.1	0	0	0	0	0	121.6
7	G	30.5	Very low	31.1	Very low	72 Å²	72	176.7 Å²	176.7	74%	0.742	86%	0.863	S	S	*	*				51.3	116.7	109.8	0	0	0	0	0	121.5
8	T	28.1	Very low	30.9	Very low	149 Å²	149	180.6 Å²	180.6	91%	0.914	87%	0.867	S	S	*	*				-160.1	127.2	126.7	-15.2	0	0	0	0	110.8
9	E	29.8	Very low	30.7	Very low	188 Å²	188	184.2 Å²	184.2	88%	0.879	87%	0.87	S	S	*	*			trans	-68.9	137.9	171.2	-73	-178.4	136.2	0	0	111.9
10	R	27.8	Very low	30.6	Very low	250 Å²	250	184.5 Å²	184.5	94%	0.943	87%	0.871	S	S	*	*			trans	-158.2	124.8	144.4	-104.1	172.7	-167.9	-167	4.1	109.8
11	H	28.5	Very low	30.5	Very low	192 Å²	192	180.1 Å²	180.1	89%	0.889	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-49.2	144.1	-175.9	-74.4	-65.3	0	0	0	116.9
12	P	29.2	Very low	30.2	Very low	120 Å²	120	174 Å²	174	78%	0.779	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-99.3	137.9	154	31.3	-20.1	0	0	0	112.4
13	R	26.8	Very low	30.4	Very low	241 Å²	241	172.5 Å²	172.5	91%	0.909	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-58.7	124.2	179.9	-67.7	169.5	169.8	175.2	-3.9	112.1	V15	R13-V15 PolarHBondContact O-N 3.28Å
14	K	29	Very low	29.9	Very low	209 Å²	209	176 Å²	176	91%	0.909	85%	0.847	S	S	*	*			trans	-73.7	113.7	167.1	-83.1	-178.6	177	175.1	0	110.6	R16	K14-R16 PolarHBondContact O-N 2.65Å
15	V	28.3	Very low	30.3	Very low	134 Å²	134	174 Å²	174	81%	0.812	84%	0.84	S	S	*	*			trans	-65.5	121.6	169.7	175.3	0	0	0	0	109.7	R13 K17	R13-V15 PolarHBondContact O-N 3.28Å; V15-K17 PolarHBondContact O-N 2.76Å
16	R	28.7	Very low	30.7	Very low	244 Å²	244	167.5 Å²	167.5	92%	0.921	83%	0.825	S	S	*	*			trans	-74.9	106.1	172.6	-87.1	178.5	166.3	170	-3.8	110	K14 R18	K14-R16 PolarHBondContact O-N 2.65Å; R16-R18 PolarHBondContact O-N 2.66Å
17	K	29.3	Very low	30.7	Very low	201 Å²	201	165.2 Å²	165.2	87%	0.874	81%	0.811	S	S	*	*			trans	-62.9	125.6	163.2	-81.1	179.9	173.8	178.9	0	109.6	V15 R19	V15-K17 PolarHBondContact O-N 2.76Å; K17-R19 PolarHBondContact O-N 3.49Å
18	R	28.1	Very low	31.1	Very low	247 Å²	247	164.8 Å²	164.8	93%	0.932	80%	0.8	S	S	*	*			trans	-61.8	121.4	168.7	-81.9	176.4	168.5	170.5	-4.2	109.1	R16 Q20	R16-R18 PolarHBondContact O-N 2.66Å; R18-Q20 PolarHBondContact O-N 3.33Å
19	R	27.2	Very low	31.5	Very low	249 Å²	249	160.7 Å²	160.7	94%	0.94	78%	0.781	S	S	*	*			trans	-74.3	115.2	167.4	-82	178.7	164.2	176.6	-5.5	108.5	K17	K17-R19 PolarHBondContact O-N 3.49Å
20	Q	27.8	Very low	31.8	Very low	190 Å²	190	157.8 Å²	157.8	89%	0.888	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-63.5	139.2	162	-95.2	168.4	-23.5	0	0	109.5	R18	R18-Q20 PolarHBondContact O-N 3.33Å
21	A	28.4	Very low	32.2	Very low	93 Å²	93	149.4 Å²	149.4	77%	0.769	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-70.8	147.2	169.6	0	0	0	0	0	110.1
22	P	32.2	Very low	32.7	Very low	112 Å²	112	146.1 Å²	146.1	73%	0.727	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-77.6	138.5	-170.2	30.1	-33	0	0	0	112.9	K24	P22-K24 PolarHBondContact O-N 2.98Å
23	N	35	Very low	33.1	Very low	158 Å²	158	147.4 Å²	147.4	85%	0.845	73%	0.732	S	S	*	*			trans	-76.2	52.5	-178.2	-142.9	15.3	0	0	0	112.6
24	K	38	Very low	33.3	Very low	183 Å²	183	139.6 Å²	139.6	80%	0.796	72%	0.719	S	S	*	*			trans	-98.9	9.2	-171.6	-105.7	-172	179.7	-171.9	0	115.5	P22	P22-K24 PolarHBondContact O-N 2.98Å
25	L	41.4	Very low	33.5	Very low	107 Å²	107	134 Å²	134	56%	0.56	71%	0.706	S	S	*	*	S	Bend	trans	-85.8	-29.8	-176.8	-125.8	86.8	0	0	0	113.8	L621	L25-L621 HydrophobicContact CD2-CD2 3.88Å
26	V	39.5	Very low	33.9	Very low	83 Å²	83	132.9 Å²	132.9	50%	0.503	69%	0.687	S	S	.	*	H	α-helix	trans	-71.9	-39.6	-173.1	-177.9	0	0	0	0	111.8	A28 A29 E30	V26-A28 PolarHBondContact O-N 3.18Å; V26-A29 PolarHBondContact O-N 3.28Å; V26-E30 WeakPolarHBondContact O-CG 3.33Å; V26-E30 PolarHBondContact O-N 3.09Å; V26-E30 VanDerWaalsContact O-N 3.12Å
27	G	30.5	Very low	34	Very low	48 Å²	48	127.7 Å²	127.7	50%	0.495	68%	0.678	S	S	.	*	H	α-helix	trans	-72.4	-27.4	-176.7	0	0	0	0	0	115.4	A31	G27-A31 PolarHBondContact O-N 3.23Å
28	A	39.4	Very low	34.1	Very low	62 Å²	62	125.3 Å²	125.3	51%	0.512	67%	0.673	S	S	.	*	H	α-helix	trans	-78.1	-33.8	175.6	0	0	0	0	0	111.9	V26 M32	V26-A28 PolarHBondContact O-N 3.18Å; A28-M32 WeakPolarHBondContact O-CB 2.92Å; A28-M32 WeakPolarHBondContact O-CG 3.35Å; A28-M32 PolarHBondContact O-N 2.99Å
29	A	36.8	Very low	34.3	Very low	63 Å²	63	121 Å²	121	52%	0.521	66%	0.664	S	S	.	*	H	α-helix	trans	-71	-32.4	175.5	0	0	0	0	0	112.6	V26 K33	V26-A29 PolarHBondContact O-N 3.28Å; A29-K33 PolarHBondContact O-N 3.04Å
30	E	36.8	Very low	34.6	Very low	127 Å²	127	117.8 Å²	117.8	59%	0.593	66%	0.66	S	S	*	*	H	α-helix	trans	-77.5	-39.5	178.3	-75.4	176.3	162.7	0	0	113	V26 M32 K33	V26-E30 WeakPolarHBondContact O-CG 3.33Å; V26-E30 PolarHBondContact O-N 3.09Å; V26-E30 VanDerWaalsContact O-N 3.12Å; E30-M32 VanDerWaalsContact C-N 3.28Å; E30-M32 PolarHBondContact O-N 3.15Å; E30-K33 WeakPolarHBondContact O-CB 3.33Å; E30-K33 PolarHBondContact O-N 3.41Å; E30-K33 VanDerWaalsContact O-N 3.12Å
31	A	35.5	Very low	34.6	Very low	74 Å²	74	113.3 Å²	113.3	61%	0.612	65%	0.649	S	S	*	*	H	α-helix	trans	-66.7	-29.3	174.2	0	0	0	0	0	112.8	G27 K33	G27-A31 PolarHBondContact O-N 3.23Å; A31-K33 VanDerWaalsContact C-N 3.32Å
32	M	39.8	Very low	34.7	Very low	124 Å²	124	117.3 Å²	117.3	61%	0.611	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-12.4	172.8	-77.7	-173.5	159.8	0	0	113.8	A28 E30	A28-M32 WeakPolarHBondContact O-CB 2.92Å; A28-M32 WeakPolarHBondContact O-CG 3.35Å; A28-M32 PolarHBondContact O-N 2.99Å; E30-M32 VanDerWaalsContact C-N 3.28Å; E30-M32 PolarHBondContact O-N 3.15Å
33	K	36.6	Very low	34.9	Very low	146 Å²	146	118.3 Å²	118.3	64%	0.635	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-40.6	178.5	-137.1	174.5	-178.8	-175.6	0	111.5	A29 E30 A31 S35 W36	A29-K33 PolarHBondContact O-N 3.04Å; E30-K33 WeakPolarHBondContact O-CB 3.33Å; E30-K33 PolarHBondContact O-N 3.41Å; E30-K33 VanDerWaalsContact O-N 3.12Å; A31-K33 VanDerWaalsContact C-N 3.32Å; K33-S35 VanDerWaalsContact C-N 3.35Å; K33-S35 PolarHBondContact O-N 3.18Å; K33-W36 PolarHBondContact O-N 2.73Å
34	A	31.9	Very low	35.3	Very low	78 Å²	78	118 Å²	118	65%	0.645	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-20.5	-174.6	0	0	0	0	0	115
35	S	31.5	Very low	35.7	Very low	90 Å²	90	112.6 Å²	112.6	63%	0.629	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-10.9	-179.4	-175.6	0	0	0	0	113.9	K33	K33-S35 VanDerWaalsContact C-N 3.35Å; K33-S35 PolarHBondContact O-N 3.18Å
36	W	38.6	Very low	36.4	Very low	112 Å²	112	114.6 Å²	114.6	42%	0.424	65%	0.646	S	S	.	*	T	Hydrogen-bonded Turn	trans	-118.8	-11.7	-167.1	-66.4	79.3	0	0	0	114.3	K33 L38 E39	K33-W36 PolarHBondContact O-N 2.73Å; W36-L38 PolarHBondContact O-N 2.82Å; W36-E39 PolarHBondContact O-N 2.8Å
37	D	29.7	Very low	37.4	Very low	135 Å²	135	115.4 Å²	115.4	72%	0.722	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	2.2	172.7	-71.9	-26.8	0	0	0	113.3
38	L	31.5	Very low	39.1	Very low	150 Å²	150	113.6 Å²	113.6	79%	0.785	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-11.2	177.6	-101.5	115.1	0	0	0	115.1	W36	W36-L38 PolarHBondContact O-N 2.82Å
39	E	32.9	Very low	40.6	Very low	157 Å²	157	116 Å²	116	73%	0.734	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-15.1	-175.7	-96.5	-176.2	170.4	0	0	114.9	W36	W36-E39 PolarHBondContact O-N 2.8Å
40	E	32.5	Very low	42.3	Very low	181 Å²	181	113.1 Å²	113.1	85%	0.846	60%	0.595	S	S	*	*	S	Bend	trans	-103.1	62.5	176.3	-83.8	-171.4	160.8	0	0	111.8
41	S	28.7	Very low	43.8	Very low	96 Å²	96	108.7 Å²	108.7	67%	0.671	58%	0.577	S	S	*	*			trans	-144.2	60.7	169.7	76.2	0	0	0	0	112.9
42	Q	30.5	Very low	45	Very low	177 Å²	177	106.6 Å²	106.6	83%	0.827	56%	0.557	S	S	*	*			trans	-133.4	133.6	156.1	-70.4	-143.9	3.1	0	0	111.7	E44	Q42-E44 PolarHBondContact O-N 2.88Å
43	P	35.5	Very low	45.6	Very low	134 Å²	134	104.2 Å²	104.2	87%	0.87	55%	0.546	S	S	*	.			trans	-79.9	97.3	177.2	30.6	-29.8	0	0	0	109.9
44	E	44.5	Very low	46.3	Very low	150 Å²	150	103 Å²	103	70%	0.701	55%	0.546	S	S	*	.			trans	-78.2	150.5	175.2	-74.5	176.1	159.6	0	0	112.4	Q42	Q42-E44 PolarHBondContact O-N 2.88Å
45	A	46.5	Very low	47.1	Very low	71 Å²	71	100.5 Å²	100.5	59%	0.587	52%	0.521	S	S	*	.			trans	-62.3	138.1	-175.8	0	0	0	0	0	112.4	K47	A45-K47 PolarHBondContact O-N 3.01Å
46	K	56.3	Low	47.9	Very low	149 Å²	149	101 Å²	101	65%	0.648	52%	0.52	S	S	*	.			trans	-69.5	86.5	-176.9	-64.4	176.9	-177	174.4	0	111.9	H93	K46-H93 PolarHBondContact O-CD2 3.17Å; K46-H93 PolarHBondContact O-CE1 2.86Å; K46-H93 PolarHBondContact O-ND1 3.36Å; K46-H93 PolarHBondContact O-NE2 2.96Å
47	K	59.1	Low	48.4	Very low	100 Å²	100	100.5 Å²	100.5	44%	0.435	53%	0.525	S	S	.	.			trans	-98.8	152.4	174.1	-70.5	-178.9	-179.7	173.6	0	112.6	A45 R49 H90 E765	A45-K47 PolarHBondContact O-N 3.01Å; K47-R49 PolarHBondContact O-N 3.4Å; K47-H90 WeakPolarHBondContact O-CB 3.35Å; K47-H90 PolarHBondContact O-CD2 2.93Å; K47-E765 HydrophobicContact CD-CG 4.07Å; K47-E765 WeakPolarHBondContact CE-OE1 3.39Å; K47-E765 IonicContact NZ-OE1 2.77Å; K47-E765 PolarHBondContact NZ-OE1 3.49Å
48	A	67.7	Low	49.8	Very low	9 Å²	9	99 Å²	99	7%	0.074	52%	0.517	C	S	.	.			trans	-63	130.7	176.3	0	0	0	0	0	111.1	F89 H93 L94 I761	A48-F89 WeakPolarHBondContact CA-O 3.38Å; A48-H93 HydrophobicContact CB-CB 4.3Å; A48-L94 HydrophobicContact CB-CD2 3.84Å; A48-L94 HydrophobicContact CB-CG 4.24Å; A48-I761 HydrophobicContact CB-CD1 4.18Å
49	R	70.8	Confident	51.7	Low	114 Å²	114	92 Å²	92	43%	0.43	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	146.9	-176.6	-166.2	-177.2	71.9	-177	-2	110.9	K47 L88 F89 E764	K47-R49 PolarHBondContact O-N 3.4Å; R49-L88 CarbonylContact O-C 3.51Å; R49-L88 WeakPolarHBondContact O-CA 3.23Å; R49-F89 HydrophobicContact CB-CB 4.11Å; R49-F89 HydrophobicContact CB-CD2 4.16Å; R49-F89 PolarHBondContact N-O 3.19Å; R49-F89 PolarHBondContact O-N 3.1Å; R49-E764 HydrophobicContact CG-CG 4.07Å; R49-E764 WeakPolarHBondContact CG-OE1 3.19Å
50	L	72.3	Confident	54	Low	2 Å²	2	88.6 Å²	88.6	1%	0.01	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	121.7	-178.2	-176	69.3	0	0	0	110.9	C86 Q87 L88 H126 M759 I761 E764	L50-C86 HydrophobicContact CD1-CB 4.36Å; L50-Q87 WeakPolarHBondContact CA-O 3.5Å; L50-L88 HydrophobicContact CD1-CD1 4.47Å; L50-H126 PolarHBondContact O-NE2 3.15Å; L50-M759 HydrophobicContact CD1-CE 4.29Å; L50-M759 HydrophobicContact CD1-SD 4.22Å; L50-M759 HydrophobicContact CD2-CB 4.44Å; L50-M759 HydrophobicContact CD2-CE 3.73Å; L50-M759 HydrophobicContact CD2-CG 3.49Å; L50-M759 VanDerWaalsContact CD2-CG 3.49Å; L50-M759 HydrophobicContact CD2-SD 3.61Å; L50-M759 HydrophobicContact CG-CE 4.36Å; L50-I761 HydrophobicContact CB-CD1 3.92Å; L50-I761 HydrophobicContact CB-CG1 4.3Å; L50-E764 PolarHBondContact N-OE1 3Å
51	S	67.4	Low	56.5	Low	33 Å²	33	80 Å²	80	23%	0.231	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	138.2	169.1	178.9	0	0	0	0	109.4	C86 Q87	S51-C86 CarbonylContact O-C 3.52Å; S51-C86 WeakPolarHBondContact O-CA 3.31Å; S51-Q87 PolarHBondContact N-O 3.08Å; S51-Q87 PolarHBondContact O-N 2.96Å
52	T	60.4	Low	59.3	Low	30 Å²	30	78 Å²	78	18%	0.184	41%	0.409	C	S	.	.			trans	-92.6	107.6	172.6	42.6	0	0	0	0	108.2	L54 F55 C86 H126 M759	T52-L54 PolarHBondContact O-N 3.25Å; T52-F55 HydrophobicContact CG2-CE2 3.71Å; T52-F55 HydrophobicContact CG2-CZ 3.56Å; T52-C86 HydrophobicContact CG2-CB 4.29Å; T52-H126 HydrophobicContact CG2-CB 3.92Å; T52-H126 WeakPolarHBondContact CG2-ND1 3.38Å; T52-H126 PolarHBondContact OG1-ND1 3.38Å; T52-H126 VanDerWaalsContact OG1-ND1 3.11Å; T52-M759 HydrophobicContact CG2-CE 4.13Å
53	I	53.9	Low	62	Low	75 Å²	75	70.5 Å²	70.5	39%	0.385	37%	0.374	S	S	.	.			trans	-76.6	115.6	177.8	-64.9	176.9	0	0	0	107.1	F55 W85 Q87	I53-F55 PolarHBondContact O-N 3.26Å; I53-W85 PolarHBondContact N-O 3.45Å; I53-Q87 HydrophobicContact CD1-CB 3.68Å; I53-Q87 HydrophobicContact CD1-CG 4.37Å; I53-Q87 HydrophobicContact CG1-CB 3.98Å
54	L	49.6	Very low	64.3	Low	119 Å²	119	69.6 Å²	69.6	62%	0.623	36%	0.362	S	S	*	.			trans	37.6	78.2	163.8	-71.2	159.3	0	0	0	114.3	T52 T56 A627	T52-L54 PolarHBondContact O-N 3.25Å; L54-T56 PolarHBondContact O-N 3.26Å; L54-T56 VanDerWaalsContact O-N 3.09Å; L54-A627 HydrophobicContact CD2-CB 4.04Å
55	F	49.1	Very low	66.2	Low	27 Å²	27	64.6 Å²	64.6	12%	0.118	34%	0.339	C	S	.	.			trans	-55.4	121.7	160.1	-68.7	-68.9	0	0	0	108.8	T52 I53 C59 V61 W85 F128	T52-F55 HydrophobicContact CG2-CE2 3.71Å; T52-F55 HydrophobicContact CG2-CZ 3.56Å; I53-F55 PolarHBondContact O-N 3.26Å; F55-C59 HydrophobicContact CB-CB 4.14Å; F55-C59 HydrophobicContact CD1-CB 4.4Å; F55-C59 HydrophobicContact CG-CB 4.31Å; F55-V61 HydrophobicContact CE1-CG2 4.18Å; F55-W85 AromaticContact CE1-CE3 3.95Å; F55-W85 HydrophobicContact CE1-CE3 3.95Å; F55-W85 HydrophobicContact CE1-CZ3 4.28Å; F55-W85 HydrophobicContact CZ-CE3 4.4Å; F55-W85 HydrophobicContact CZ-CZ3 4.44Å; F55-F128 HydrophobicContact CE1-CB 3.9Å; F55-F128 HydrophobicContact CZ-CB 4.14Å
56	T	48.4	Very low	68.2	Low	100 Å²	100	61.2 Å²	61.2	61%	0.613	31%	0.311	S	S	*	.			trans	-51.9	165.1	166.7	57	0	0	0	0	110.2	L54 N58 C59	L54-T56 PolarHBondContact O-N 3.26Å; L54-T56 VanDerWaalsContact O-N 3.09Å; T56-N58 PolarHBondContact O-N 3.39Å; T56-C59 PolarHBondContact O-N 3.26Å
57	D	50.3	Low	69.7	Low	101 Å²	101	54.4 Å²	54.4	54%	0.54	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-19.1	-173.4	-79.5	-27.6	0	0	0	115.6
58	N	57.5	Low	71	Confident	103 Å²	103	53.5 Å²	53.5	55%	0.551	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-12.5	-176.5	-65.5	-8.6	0	0	0	115.7	T56 E60	T56-N58 PolarHBondContact O-N 3.39Å; N58-E60 PolarHBondContact O-N 2.79Å; N58-E60 VanDerWaalsContact O-N 3.16Å
59	C	71.4	Confident	71.9	Confident	5 Å²	5	53.1 Å²	53.1	3%	0.034	28%	0.276	C	S	.	.			trans	50.5	32.3	-178.1	-49.3	0	0	0	0	114.9	F55 T56 R129 R676 H677	F55-C59 HydrophobicContact CB-CB 4.14Å; F55-C59 HydrophobicContact CD1-CB 4.4Å; F55-C59 HydrophobicContact CG-CB 4.31Å; T56-C59 PolarHBondContact O-N 3.26Å; C59-R129 WeakPolarHBondContact O-CB 3.49Å; C59-R129 PolarHBondContact O-N 3.5Å; C59-R676 WeakPolarHBondContact SG-CB 3.32Å; C59-H677 HydrophobicContact CB-CB 4.07Å
60	E	82.1	Confident	72.8	Confident	84 Å²	84	47.7 Å²	47.7	39%	0.393	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-98.5	133.5	179	-170.2	172.2	97.7	0	0	110.2	N58 R129	N58-E60 PolarHBondContact O-N 2.79Å; N58-E60 VanDerWaalsContact O-N 3.16Å; E60-R129 WeakPolarHBondContact CA-O 3.45Å; E60-R129 HydrophobicContact CB-CB 4.42Å
61	V	85.6	Confident	73.4	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.006	26%	0.264	C	S	.	.			trans	-116.2	124.6	177.5	178.2	0	0	0	0	107.9	F55 Q65 W85 F128 R129 P131	F55-V61 HydrophobicContact CE1-CG2 4.18Å; V61-Q65 HydrophobicContact CG1-CB 3.72Å; V61-W85 HydrophobicContact CG1-CD2 4.03Å; V61-W85 HydrophobicContact CG1-CG 4.5Å; V61-W85 HydrophobicContact CG1-CH2 4.27Å; V61-W85 HydrophobicContact CG1-CZ2 3.75Å; V61-W85 HydrophobicContact CG2-CD2 3.91Å; V61-W85 HydrophobicContact CG2-CE3 3.75Å; V61-W85 HydrophobicContact CG2-CG 4.48Å; V61-W85 HydrophobicContact CG2-CH2 4.35Å; V61-W85 HydrophobicContact CG2-CZ3 3.98Å; V61-F128 HydrophobicContact CB-CD2 3.61Å; V61-F128 HydrophobicContact CB-CE2 3.99Å; V61-F128 HydrophobicContact CB-CG 4.37Å; V61-F128 HydrophobicContact CG1-CD2 4.37Å; V61-F128 HydrophobicContact CG1-CE2 4.3Å; V61-F128 HydrophobicContact CG2-CB 3.86Å; V61-F128 HydrophobicContact CG2-CD2 3.61Å; V61-F128 HydrophobicContact CG2-CE2 4.31Å; V61-F128 HydrophobicContact CG2-CG 3.85Å; V61-R129 PolarHBondContact N-O 3.2Å; V61-P131 WeakPolarHBondContact O-CD 3.36Å
62	T	86.8	Confident	74.2	Confident	55 Å²	55	49.2 Å²	49.2	34%	0.337	26%	0.257	S	S	.	.			trans	-73.1	162.1	-179.7	68.7	0	0	0	0	111.6	D64 Q65 L66	T62-D64 PolarHBondContact O-N 3.02Å; T62-Q65 PolarHBondContact O-N 3.05Å; T62-Q65 WeakPolarHBondContact OG1-CB 3.33Å; T62-Q65 VanDerWaalsContact OG1-CG 3.29Å; T62-Q65 WeakPolarHBondContact OG1-CG 3.24Å; T62-Q65 PolarHBondContact OG1-N 3.18Å; T62-L66 PolarHBondContact O-N 3.16Å; T62-L66 VanDerWaalsContact O-N 3.09Å
63	H	87	Confident	75.4	Confident	18 Å²	18	48.2 Å²	48.2	8%	0.083	25%	0.252	C	S	.	.	H	α-helix	trans	-61.5	-36.2	175.3	-58.5	160.4	0	0	0	111.6	L66 C67 F137 D140 I141	H63-L66 WeakPolarHBondContact O-CB 3.35Å; H63-L66 PolarHBondContact O-N 3.03Å; H63-C67 WeakPolarHBondContact O-CB 3.23Å; H63-C67 PolarHBondContact O-N 3.2Å; H63-F137 AromaticContact CD2-CE2 3.91Å; H63-F137 AromaticContact CE1-CD2 3.89Å; H63-F137 AromaticContact NE2-CD2 3.7Å; H63-F137 AromaticContact NE2-CE2 3.61Å; H63-D140 HydrophobicContact CB-CB 3.81Å; H63-D140 IonicContact CE1-OD2 3.64Å; H63-D140 IonicContact ND1-OD2 3.59Å; H63-D140 PolarHBondContact ND1-OD2 3.34Å; H63-I141 HydrophobicContact CB-CG2 4.31Å
64	D	82.9	Confident	76.7	Confident	115 Å²	115	45.4 Å²	45.4	62%	0.615	24%	0.239	S	C	*	.	H	α-helix	trans	-63.5	-43.8	175.3	-60.9	-36.1	0	0	0	112	T62 L66 C67 E68	T62-D64 PolarHBondContact O-N 3.02Å; D64-L66 PolarHBondContact O-N 3.47Å; D64-C67 CarbonylContact O-C 3.6Å; D64-C67 WeakPolarHBondContact O-CA 3.43Å; D64-C67 VanDerWaalsContact O-CB 3.31Å; D64-C67 WeakPolarHBondContact O-CB 3.39Å; D64-C67 PolarHBondContact O-N 3.12Å; D64-C67 VanDerWaalsContact O-N 3.1Å; D64-E68 WeakPolarHBondContact O-CG 3.37Å; D64-E68 PolarHBondContact O-N 2.84Å
65	Q	85.9	Confident	77.8	Confident	46 Å²	46	41.1 Å²	41.1	22%	0.215	22%	0.216	C	C	.	.	H	α-helix	trans	-64	-30.1	176.3	-78.8	179.5	-36	0	0	112.9	V61 T62 L69 S84 W85	V61-Q65 HydrophobicContact CG1-CB 3.72Å; T62-Q65 PolarHBondContact O-N 3.05Å; T62-Q65 WeakPolarHBondContact OG1-CB 3.33Å; T62-Q65 VanDerWaalsContact OG1-CG 3.29Å; T62-Q65 WeakPolarHBondContact OG1-CG 3.24Å; T62-Q65 PolarHBondContact OG1-N 3.18Å; Q65-L69 PolarHBondContact O-N 2.83Å; Q65-S84 PolarHBondContact NE2-OG 3.32Å; Q65-W85 PolarHBondContact O-NE1 3.27Å
66	L	87.8	Confident	78.8	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-74.2	-40.2	172.2	-176	60.8	0	0	0	111.1	T62 H63 D64 E68 L69 L70 F128 L130 I141 L740 L742	T62-L66 PolarHBondContact O-N 3.16Å; T62-L66 VanDerWaalsContact O-N 3.09Å; H63-L66 WeakPolarHBondContact O-CB 3.35Å; H63-L66 PolarHBondContact O-N 3.03Å; D64-L66 PolarHBondContact O-N 3.47Å; L66-E68 VanDerWaalsContact C-N 3.33Å; L66-E68 PolarHBondContact O-N 2.91Å; L66-L69 HydrophobicContact CD1-CD2 4.38Å; L66-L69 WeakPolarHBondContact O-CB 3.31Å; L66-L69 PolarHBondContact O-N 2.79Å; L66-L70 WeakPolarHBondContact O-CG 3.37Å; L66-L70 PolarHBondContact O-N 3.27Å; L66-F128 HydrophobicContact CD1-CZ 4.33Å; L66-L130 HydrophobicContact CD2-CD2 4.46Å; L66-I141 HydrophobicContact CD2-CB 4.25Å; L66-I141 HydrophobicContact CD2-CG2 3.79Å; L66-L740 HydrophobicContact CD1-CD1 4.2Å; L66-L740 HydrophobicContact CD1-CD2 4.26Å; L66-L742 HydrophobicContact CD2-CD1 3.65Å; L66-L742 HydrophobicContact CD2-CD2 3.86Å; L66-L742 HydrophobicContact CD2-CG 4.42Å
67	C	87.4	Confident	79.1	Confident	6 Å²	6	44.9 Å²	44.9	4%	0.041	23%	0.229	C	C	.	.	H	α-helix	trans	-59.9	-42.8	173.9	-169.2	0	0	0	0	111.1	H63 D64 L69 L70 K71 I141	H63-C67 WeakPolarHBondContact O-CB 3.23Å; H63-C67 PolarHBondContact O-N 3.2Å; D64-C67 CarbonylContact O-C 3.6Å; D64-C67 WeakPolarHBondContact O-CA 3.43Å; D64-C67 VanDerWaalsContact O-CB 3.31Å; D64-C67 WeakPolarHBondContact O-CB 3.39Å; D64-C67 PolarHBondContact O-N 3.12Å; D64-C67 VanDerWaalsContact O-N 3.1Å; C67-L69 PolarHBondContact O-N 3.01Å; C67-L70 PolarHBondContact O-N 3.17Å; C67-K71 VanDerWaalsContact O-CG 3.31Å; C67-K71 WeakPolarHBondContact O-CG 3.47Å; C67-K71 PolarHBondContact O-N 3.22Å; C67-K71 WeakPolarHBondContact SG-CE 3.28Å; C67-I141 WeakPolarHBondContact CA-O 3.31Å; C67-I141 WeakPolarHBondContact CB-O 3.31Å; C67-I141 PolarHBondContact SG-O 3.38Å
68	E	86	Confident	79.4	Confident	81 Å²	81	42.6 Å²	42.6	38%	0.379	22%	0.222	S	C	.	.	H	α-helix	trans	-56.2	-47.2	172.3	-74.5	175	-172.5	0	0	112.5	D64 L66 L70 K71 Y72	D64-E68 WeakPolarHBondContact O-CG 3.37Å; D64-E68 PolarHBondContact O-N 2.84Å; L66-E68 VanDerWaalsContact C-N 3.33Å; L66-E68 PolarHBondContact O-N 2.91Å; E68-L70 VanDerWaalsContact C-N 3.34Å; E68-L70 PolarHBondContact O-N 2.82Å; E68-K71 PolarHBondContact O-N 3.49Å; E68-Y72 VanDerWaalsContact O-CB 3.3Å; E68-Y72 WeakPolarHBondContact O-CB 3.48Å; E68-Y72 PolarHBondContact O-N 2.83Å
69	L	87.9	Confident	79.2	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.9	-43.1	177	171.9	64.1	0	0	0	111.5	Q65 L66 C67 Y72 A73 P83 W85 L740 M759	Q65-L69 PolarHBondContact O-N 2.83Å; L66-L69 HydrophobicContact CD1-CD2 4.38Å; L66-L69 WeakPolarHBondContact O-CB 3.31Å; L66-L69 PolarHBondContact O-N 2.79Å; C67-L69 PolarHBondContact O-N 3.01Å; L69-Y72 PolarHBondContact O-N 3Å; L69-A73 WeakPolarHBondContact O-CB 3.48Å; L69-A73 PolarHBondContact O-N 3.45Å; L69-P83 HydrophobicContact CB-CB 4.38Å; L69-P83 HydrophobicContact CD1-CG 4.02Å; L69-W85 HydrophobicContact CB-CZ2 4.22Å; L69-W85 HydrophobicContact CD2-CH2 3.94Å; L69-W85 HydrophobicContact CD2-CZ2 3.71Å; L69-L740 HydrophobicContact CD2-CD1 4.47Å; L69-L740 HydrophobicContact CD2-CD2 4.43Å; L69-M759 HydrophobicContact CD2-SD 3.48Å; L69-M759 WeakPolarHBondContact CD2-SD 3.37Å
70	L	88.9	Confident	78.7	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66.8	-43.2	179.5	-67.6	177.4	0	0	0	111.7	L66 C67 E68 Y72 A73 V74 V97 V99 V422 F475 L740	L66-L70 WeakPolarHBondContact O-CG 3.37Å; L66-L70 PolarHBondContact O-N 3.27Å; C67-L70 PolarHBondContact O-N 3.17Å; E68-L70 VanDerWaalsContact C-N 3.34Å; E68-L70 PolarHBondContact O-N 2.82Å; L70-Y72 VanDerWaalsContact C-N 3.34Å; L70-A73 PolarHBondContact O-N 3.15Å; L70-V74 WeakPolarHBondContact O-CG2 3.49Å; L70-V74 PolarHBondContact O-N 2.85Å; L70-V97 HydrophobicContact CD2-CG1 4.06Å; L70-V99 HydrophobicContact CD2-CG2 3.81Å; L70-V422 HydrophobicContact CB-CG2 3.92Å; L70-F475 HydrophobicContact CB-CE2 4.42Å; L70-F475 HydrophobicContact CB-CZ 4.35Å; L70-F475 HydrophobicContact CD1-CZ 4.39Å; L70-F475 HydrophobicContact CD2-CE2 4.15Å; L70-F475 HydrophobicContact CD2-CZ 3.98Å; L70-F475 HydrophobicContact CG-CZ 4.47Å; L70-L740 HydrophobicContact CD2-CD1 3.51Å; L70-L740 HydrophobicContact CG-CD1 4.48Å
71	K	85.1	Confident	77.7	Confident	47 Å²	47	46.6 Å²	46.6	20%	0.204	25%	0.252	C	S	.	.	H	α-helix	trans	-58.6	-48.1	173	-69.9	178	-166.3	-174.9	0	110.8	C67 E68 A73 V74 L75 T420 V422	C67-K71 VanDerWaalsContact O-CG 3.31Å; C67-K71 WeakPolarHBondContact O-CG 3.47Å; C67-K71 PolarHBondContact O-N 3.22Å; C67-K71 WeakPolarHBondContact SG-CE 3.28Å; E68-K71 PolarHBondContact O-N 3.49Å; K71-A73 PolarHBondContact O-N 3.36Å; K71-V74 PolarHBondContact O-N 3.48Å; K71-L75 VanDerWaalsContact O-CB 3.23Å; K71-L75 WeakPolarHBondContact O-CB 3.29Å; K71-L75 WeakPolarHBondContact O-CG 3.31Å; K71-L75 PolarHBondContact O-N 3.02Å; K71-T420 WeakPolarHBondContact CE-O 3.28Å; K71-T420 PolarHBondContact NZ-O 3.25Å; K71-V422 HydrophobicContact CG-CG2 3.75Å
72	Y	84.6	Confident	77	Confident	20 Å²	20	53.5 Å²	53.5	8%	0.078	28%	0.282	C	S	.	.	H	α-helix	trans	-57.7	-52	176.7	-169.3	-99.9	0	0	0	109.9	E68 L69 L70 V74 L75 V80 P81 K82 P83 L88 Q91	E68-Y72 VanDerWaalsContact O-CB 3.3Å; E68-Y72 WeakPolarHBondContact O-CB 3.48Å; E68-Y72 PolarHBondContact O-N 2.83Å; L69-Y72 PolarHBondContact O-N 3Å; L70-Y72 VanDerWaalsContact C-N 3.34Å; Y72-V74 VanDerWaalsContact C-N 3.29Å; Y72-V74 PolarHBondContact O-N 3.09Å; Y72-L75 PolarHBondContact O-N 3.28Å; Y72-V80 HydrophobicContact CD2-CB 4.11Å; Y72-V80 HydrophobicContact CD2-CG1 4.27Å; Y72-P81 WeakPolarHBondContact CD2-O 3.33Å; Y72-K82 HydrophobicContact CE2-CB 4.29Å; Y72-K82 HydrophobicContact CE2-CG 3.7Å; Y72-P83 HydrophobicContact CD1-CG 4.46Å; Y72-L88 HydrophobicContact CD1-CB 4.47Å; Y72-L88 HydrophobicContact CD1-CD2 4.08Å; Y72-L88 HydrophobicContact CE1-CB 4.12Å; Y72-L88 HydrophobicContact CE1-CD2 4.12Å; Y72-Q91 HydrophobicContact CD1-CG 4.41Å; Y72-Q91 HydrophobicContact CE1-CB 4.27Å; Y72-Q91 HydrophobicContact CE1-CG 4.04Å; Y72-Q91 PolarHBondContact O-NE2 3.44Å; Y72-Q91 PolarHBondContact OH-OE1 2.88Å
73	A	84.9	Confident	76.6	Confident	10 Å²	10	51.2 Å²	51.2	8%	0.083	27%	0.268	C	S	.	.	H	α-helix	trans	-58.1	-36.3	-179.4	0	0	0	0	0	114	L69 L70 K71 L94 V97 L738	L69-A73 WeakPolarHBondContact O-CB 3.48Å; L69-A73 PolarHBondContact O-N 3.45Å; L70-A73 PolarHBondContact O-N 3.15Å; K71-A73 PolarHBondContact O-N 3.36Å; A73-L94 HydrophobicContact CB-CD1 4.26Å; A73-V97 HydrophobicContact CB-CG2 3.71Å; A73-L738 HydrophobicContact CB-CD2 3.72Å
74	V	81.1	Confident	75.8	Confident	16 Å²	16	54.3 Å²	54.3	10%	0.097	29%	0.292	C	S	.	.	H	α-helix	trans	-71.6	-45.6	177.6	168.3	0	0	0	0	112.8	L70 K71 Y72 G76 V422 C425 L426 V429 F475	L70-V74 WeakPolarHBondContact O-CG2 3.49Å; L70-V74 PolarHBondContact O-N 2.85Å; K71-V74 PolarHBondContact O-N 3.48Å; Y72-V74 VanDerWaalsContact C-N 3.29Å; Y72-V74 PolarHBondContact O-N 3.09Å; V74-G76 VanDerWaalsContact C-N 3.34Å; V74-G76 PolarHBondContact O-N 3.14Å; V74-V422 HydrophobicContact CG2-CG1 4.29Å; V74-C425 HydrophobicContact CG1-CB 4.18Å; V74-L426 HydrophobicContact CB-CD2 4.42Å; V74-L426 HydrophobicContact CG1-CD2 3.58Å; V74-L426 HydrophobicContact CG1-CG 3.84Å; V74-L426 HydrophobicContact CG2-CD2 3.88Å; V74-L426 HydrophobicContact CG2-CG 4.16Å; V74-V429 HydrophobicContact CG1-CG2 4.15Å; V74-F475 HydrophobicContact CG2-CD2 3.23Å; V74-F475 HydrophobicContact CG2-CE2 3.42Å; V74-F475 VanDerWaalsContact CG2-CE2 3.42Å; V74-F475 HydrophobicContact CG2-CG 4.27Å
75	L	74.1	Confident	75.4	Confident	28 Å²	28	49.6 Å²	49.6	15%	0.147	27%	0.265	C	S	.	.	H	α-helix	trans	-82.3	-7.7	-161.7	-82.1	-178.4	0	0	0	114.7	K71 Y72 K77 S78 V80 C425 V429	K71-L75 VanDerWaalsContact O-CB 3.23Å; K71-L75 WeakPolarHBondContact O-CB 3.29Å; K71-L75 WeakPolarHBondContact O-CG 3.31Å; K71-L75 PolarHBondContact O-N 3.02Å; Y72-L75 PolarHBondContact O-N 3.28Å; L75-K77 PolarHBondContact O-N 3.4Å; L75-S78 VanDerWaalsContact CB-OG 3.3Å; L75-S78 WeakPolarHBondContact CB-OG 3.44Å; L75-S78 PolarHBondContact O-N 3.36Å; L75-S78 PolarHBondContact O-OG 2.93Å; L75-V80 HydrophobicContact CB-CG2 3.6Å; L75-V80 HydrophobicContact CD1-CB 4.49Å; L75-V80 HydrophobicContact CD1-CG1 4.32Å; L75-V80 HydrophobicContact CD1-CG2 3.33Å; L75-V80 HydrophobicContact CG-CG2 4.11Å; L75-C425 HydrophobicContact CD1-CB 4Å; L75-C425 HydrophobicContact CD2-CB 3.75Å; L75-C425 HydrophobicContact CG-CB 3.77Å; L75-V429 HydrophobicContact CD2-CG1 4.11Å
76	G	69.4	Low	75	Confident	20 Å²	20	47.4 Å²	47.4	21%	0.206	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	-120.7	171.2	0	0	0	0	0	114.3	V74 S78 Q91	V74-G76 VanDerWaalsContact C-N 3.34Å; V74-G76 PolarHBondContact O-N 3.14Å; G76-S78 PolarHBondContact O-N 3.1Å; G76-Q91 VanDerWaalsContact CA-NE2 3.34Å; G76-Q91 PolarHBondContact O-NE2 2.94Å
77	K	54.5	Low	74.4	Confident	186 Å²	186	50.5 Å²	50.5	81%	0.809	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-0.9	-174.5	-70.5	-176.4	179.8	176.6	0	115.9	L75	L75-K77 PolarHBondContact O-N 3.4Å
78	S	56.2	Low	74	Confident	54 Å²	54	50.7 Å²	50.7	38%	0.378	27%	0.27	S	S	.	.	S	Bend	trans	-83.6	151.3	-178.8	51.5	0	0	0	0	111.4	L75 G76 V80	L75-S78 VanDerWaalsContact CB-OG 3.3Å; L75-S78 WeakPolarHBondContact CB-OG 3.44Å; L75-S78 PolarHBondContact O-N 3.36Å; L75-S78 PolarHBondContact O-OG 2.93Å; G76-S78 PolarHBondContact O-N 3.1Å; S78-V80 PolarHBondContact O-N 3.4Å; S78-V80 WeakPolarHBondContact OG-CG2 3.22Å
79	N	53	Low	73.4	Confident	140 Å²	140	49.4 Å²	49.4	75%	0.749	26%	0.263	S	S	*	.			trans	-72.6	60.9	-177.7	-77.6	-19	0	0	0	111.7
80	V	60.9	Low	72.7	Confident	31 Å²	31	53.5 Å²	53.5	19%	0.188	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-86.4	139.2	175.5	-171.4	0	0	0	0	108.6	Y72 L75 S78 K82	Y72-V80 HydrophobicContact CD2-CB 4.11Å; Y72-V80 HydrophobicContact CD2-CG1 4.27Å; L75-V80 HydrophobicContact CB-CG2 3.6Å; L75-V80 HydrophobicContact CD1-CB 4.49Å; L75-V80 HydrophobicContact CD1-CG1 4.32Å; L75-V80 HydrophobicContact CD1-CG2 3.33Å; L75-V80 HydrophobicContact CG-CG2 4.11Å; S78-V80 PolarHBondContact O-N 3.4Å; S78-V80 WeakPolarHBondContact OG-CG2 3.22Å; V80-K82 PolarHBondContact O-N 3.5Å
81	P	62.5	Low	72	Confident	105 Å²	105	54.3 Å²	54.3	68%	0.682	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-55.4	132.3	173.2	20.5	-31.6	0	0	0	110.8	Y72	Y72-P81 WeakPolarHBondContact CD2-O 3.33Å
82	K	70.9	Confident	71.3	Confident	145 Å²	145	56.8 Å²	56.8	63%	0.63	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-64.4	142.1	173.9	-69.8	175.7	-179.2	170.9	0	109.3	Y72 V80 S84	Y72-K82 HydrophobicContact CE2-CB 4.29Å; Y72-K82 HydrophobicContact CE2-CG 3.7Å; V80-K82 PolarHBondContact O-N 3.5Å; K82-S84 PolarHBondContact O-N 3.22Å
83	P	76.5	Confident	70.9	Confident	8 Å²	8	60.2 Å²	60.2	5%	0.052	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-58.2	135.9	179.4	18.7	-27.3	0	0	0	111	L69 Y72 W85 C86	L69-P83 HydrophobicContact CB-CB 4.38Å; L69-P83 HydrophobicContact CD1-CG 4.02Å; Y72-P83 HydrophobicContact CD1-CG 4.46Å; P83-W85 PolarHBondContact O-N 3.29Å; P83-C86 WeakPolarHBondContact CG-O 3.43Å
84	S	70.8	Confident	70.7	Confident	82 Å²	82	61 Å²	61	57%	0.573	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-14.7	-170.3	73	0	0	0	0	114.6	Q65 K82	Q65-S84 PolarHBondContact NE2-OG 3.32Å; K82-S84 PolarHBondContact O-N 3.22Å
85	W	75	Confident	70.6	Confident	16 Å²	16	64.9 Å²	64.9	6%	0.061	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.7	-6.3	-167.5	62.5	-86.7	0	0	0	113.3	I53 F55 V61 Q65 L69 P83 F128 M759	I53-W85 PolarHBondContact N-O 3.45Å; F55-W85 AromaticContact CE1-CE3 3.95Å; F55-W85 HydrophobicContact CE1-CE3 3.95Å; F55-W85 HydrophobicContact CE1-CZ3 4.28Å; F55-W85 HydrophobicContact CZ-CE3 4.4Å; F55-W85 HydrophobicContact CZ-CZ3 4.44Å; V61-W85 HydrophobicContact CG1-CD2 4.03Å; V61-W85 HydrophobicContact CG1-CG 4.5Å; V61-W85 HydrophobicContact CG1-CH2 4.27Å; V61-W85 HydrophobicContact CG1-CZ2 3.75Å; V61-W85 HydrophobicContact CG2-CD2 3.91Å; V61-W85 HydrophobicContact CG2-CE3 3.75Å; V61-W85 HydrophobicContact CG2-CG 4.48Å; V61-W85 HydrophobicContact CG2-CH2 4.35Å; V61-W85 HydrophobicContact CG2-CZ3 3.98Å; Q65-W85 PolarHBondContact O-NE1 3.27Å; L69-W85 HydrophobicContact CB-CZ2 4.22Å; L69-W85 HydrophobicContact CD2-CH2 3.94Å; L69-W85 HydrophobicContact CD2-CZ2 3.71Å; P83-W85 PolarHBondContact O-N 3.29Å; W85-F128 HydrophobicContact CH2-CD1 4.27Å; W85-F128 HydrophobicContact CH2-CE1 4.03Å; W85-F128 HydrophobicContact CH2-CZ 4.27Å; W85-F128 HydrophobicContact CZ3-CD1 4.19Å; W85-F128 HydrophobicContact CZ3-CE1 4.4Å; W85-M759 HydrophobicContact CH2-CE 3.48Å; W85-M759 VanDerWaalsContact CH2-CE 3.48Å; W85-M759 HydrophobicContact CH2-SD 4.03Å; W85-M759 HydrophobicContact CZ3-CE 3.46Å; W85-M759 VanDerWaalsContact CZ3-CE 3.46Å
86	C	77.3	Confident	71.3	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.007	34%	0.341	C	S	.	.			trans	-147.8	160.9	174	66.2	0	0	0	0	111.2	L50 S51 T52 P83 M759	L50-C86 HydrophobicContact CD1-CB 4.36Å; S51-C86 CarbonylContact O-C 3.52Å; S51-C86 WeakPolarHBondContact O-CA 3.31Å; T52-C86 HydrophobicContact CG2-CB 4.29Å; P83-C86 WeakPolarHBondContact CG-O 3.43Å; C86-M759 HydrophobicContact CB-CE 4.45Å
87	Q	75.1	Confident	72.3	Confident	65 Å²	65	64.1 Å²	64.1	30%	0.304	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	114.4	179.7	-171.5	171	15.7	0	0	109.4	L50 S51 I53 F89	L50-Q87 WeakPolarHBondContact CA-O 3.5Å; S51-Q87 PolarHBondContact N-O 3.08Å; S51-Q87 PolarHBondContact O-N 2.96Å; I53-Q87 HydrophobicContact CD1-CB 3.68Å; I53-Q87 HydrophobicContact CD1-CG 4.37Å; I53-Q87 HydrophobicContact CG1-CB 3.98Å; Q87-F89 HydrophobicContact CB-CE2 4.23Å; Q87-F89 HydrophobicContact CB-CZ 4.39Å; Q87-F89 HydrophobicContact CG-CD1 4.38Å; Q87-F89 HydrophobicContact CG-CD2 4.28Å; Q87-F89 HydrophobicContact CG-CE1 3.99Å; Q87-F89 HydrophobicContact CG-CE2 3.89Å; Q87-F89 HydrophobicContact CG-CZ 3.73Å
88	L	78.4	Confident	74.2	Confident	10 Å²	10	55.2 Å²	55.2	5%	0.052	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	103.6	171.4	-179.7	68.5	0	0	0	108.9	R49 L50 Y72 Q91 L94 I761	R49-L88 CarbonylContact O-C 3.51Å; R49-L88 WeakPolarHBondContact O-CA 3.23Å; L50-L88 HydrophobicContact CD1-CD1 4.47Å; Y72-L88 HydrophobicContact CD1-CB 4.47Å; Y72-L88 HydrophobicContact CD1-CD2 4.08Å; Y72-L88 HydrophobicContact CE1-CB 4.12Å; Y72-L88 HydrophobicContact CE1-CD2 4.12Å; L88-Q91 HydrophobicContact CD2-CB 3.79Å; L88-Q91 HydrophobicContact CD2-CG 3.71Å; L88-Q91 HydrophobicContact CG-CB 4.07Å; L88-L94 HydrophobicContact CD1-CD1 4.2Å; L88-L94 HydrophobicContact CD1-CD2 4.44Å; L88-L94 HydrophobicContact CD1-CG 4.47Å; L88-L94 HydrophobicContact CD2-CD1 3.46Å; L88-L94 VanDerWaalsContact CD2-CD1 3.46Å; L88-L94 HydrophobicContact CD2-CG 4.31Å; L88-L94 HydrophobicContact CG-CD1 4.38Å; L88-I761 HydrophobicContact CD1-CD1 3.56Å
89	F	73.9	Confident	76	Confident	53 Å²	53	52.7 Å²	52.7	23%	0.232	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	146.7	173.3	-58.6	-87.4	0	0	0	110.2	A48 R49 Q87 Q91	A48-F89 WeakPolarHBondContact CA-O 3.38Å; R49-F89 HydrophobicContact CB-CB 4.11Å; R49-F89 HydrophobicContact CB-CD2 4.16Å; R49-F89 PolarHBondContact N-O 3.19Å; R49-F89 PolarHBondContact O-N 3.1Å; Q87-F89 HydrophobicContact CB-CE2 4.23Å; Q87-F89 HydrophobicContact CB-CZ 4.39Å; Q87-F89 HydrophobicContact CG-CD1 4.38Å; Q87-F89 HydrophobicContact CG-CD2 4.28Å; Q87-F89 HydrophobicContact CG-CE1 3.99Å; Q87-F89 HydrophobicContact CG-CE2 3.89Å; Q87-F89 HydrophobicContact CG-CZ 3.73Å; F89-Q91 PolarHBondContact O-N 3.29Å; F89-Q91 VanDerWaalsContact O-N 3.11Å
90	H	73.8	Confident	78	Confident	86 Å²	86	46 Å²	46	40%	0.398	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	37.3	174.3	-55.9	-66.3	0	0	0	113.6	K47 N92 H93	K47-H90 WeakPolarHBondContact O-CB 3.35Å; K47-H90 PolarHBondContact O-CD2 2.93Å; H90-N92 PolarHBondContact O-N 3.45Å; H90-H93 WeakPolarHBondContact O-CB 3.49Å; H90-H93 PolarHBondContact O-CD2 3.37Å; H90-H93 PolarHBondContact O-N 2.98Å
91	Q	74.7	Confident	79.5	Confident	18 Å²	18	44.5 Å²	44.5	8%	0.084	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-46.9	-32.6	177.8	174.9	-161.2	-2.1	0	0	114.2	Y72 G76 L88 F89 H93 L94	Y72-Q91 HydrophobicContact CD1-CG 4.41Å; Y72-Q91 HydrophobicContact CE1-CB 4.27Å; Y72-Q91 HydrophobicContact CE1-CG 4.04Å; Y72-Q91 PolarHBondContact O-NE2 3.44Å; Y72-Q91 PolarHBondContact OH-OE1 2.88Å; G76-Q91 VanDerWaalsContact CA-NE2 3.34Å; G76-Q91 PolarHBondContact O-NE2 2.94Å; L88-Q91 HydrophobicContact CD2-CB 3.79Å; L88-Q91 HydrophobicContact CD2-CG 3.71Å; L88-Q91 HydrophobicContact CG-CB 4.07Å; F89-Q91 PolarHBondContact O-N 3.29Å; F89-Q91 VanDerWaalsContact O-N 3.11Å; Q91-H93 PolarHBondContact O-N 2.79Å; Q91-L94 WeakPolarHBondContact O-CB 3.49Å; Q91-L94 PolarHBondContact O-N 2.92Å
92	N	70.2	Confident	80.9	Confident	99 Å²	99	39.6 Å²	39.6	53%	0.529	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-60.5	-12.6	175.4	-63.6	-22.7	0	0	0	114	H90	H90-N92 PolarHBondContact O-N 3.45Å
93	H	74.7	Confident	81.8	Confident	92 Å²	92	36 Å²	36	43%	0.426	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-101.9	6.9	176.2	-61.2	-93.6	0	0	0	112.5	K46 A48 H90 Q91	K46-H93 PolarHBondContact O-CD2 3.17Å; K46-H93 PolarHBondContact O-CE1 2.86Å; K46-H93 PolarHBondContact O-ND1 3.36Å; K46-H93 PolarHBondContact O-NE2 2.96Å; A48-H93 HydrophobicContact CB-CB 4.3Å; H90-H93 WeakPolarHBondContact O-CB 3.49Å; H90-H93 PolarHBondContact O-CD2 3.37Å; H90-H93 PolarHBondContact O-N 2.98Å; Q91-H93 PolarHBondContact O-N 2.79Å
94	L	81.5	Confident	82.1	Confident	26 Å²	26	36.1 Å²	36.1	14%	0.136	19%	0.188	C	C	.	.			trans	-71.5	127.4	167.2	-76.2	-174.6	0	0	0	109.4	A48 A73 L88 Q91 G736 L738 I761	A48-L94 HydrophobicContact CB-CD2 3.84Å; A48-L94 HydrophobicContact CB-CG 4.24Å; A73-L94 HydrophobicContact CB-CD1 4.26Å; L88-L94 HydrophobicContact CD1-CD1 4.2Å; L88-L94 HydrophobicContact CD1-CD2 4.44Å; L88-L94 HydrophobicContact CD1-CG 4.47Å; L88-L94 HydrophobicContact CD2-CD1 3.46Å; L88-L94 VanDerWaalsContact CD2-CD1 3.46Å; L88-L94 HydrophobicContact CD2-CG 4.31Å; L88-L94 HydrophobicContact CG-CD1 4.38Å; Q91-L94 WeakPolarHBondContact O-CB 3.49Å; Q91-L94 PolarHBondContact O-N 2.92Å; L94-G736 WeakPolarHBondContact CA-O 3.48Å; L94-G736 WeakPolarHBondContact CD2-O 3.41Å; L94-L738 HydrophobicContact CD1-CB 4.1Å; L94-L738 HydrophobicContact CD1-CD2 4.33Å; L94-L738 HydrophobicContact CD2-CB 4Å; L94-I761 HydrophobicContact CD2-CD1 4.12Å; L94-I761 HydrophobicContact CD2-CG1 4.36Å; L94-I761 HydrophobicContact CD2-CG2 4.33Å
95	N	80	Confident	82.9	Confident	98 Å²	98	33.1 Å²	33.1	52%	0.524	16%	0.164	S	C	.	.			trans	-88.8	-45.6	-179.9	-70.9	-29.9	0	0	0	111.5	P735 G736	N95-P735 PolarHBondContact ND2-O 2.78Å; N95-G736 PolarHBondContact N-O 3.46Å
96	N	87.5	Confident	83.5	Confident	25 Å²	25	32.3 Å²	32.3	13%	0.134	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	160.1	-177.7	-56.3	-59.2	0	0	0	111.1	P474 T737 L738	N96-P474 CarbonylContact C-O 3.52Å; N96-P474 VanDerWaalsContact CA-O 3.26Å; N96-P474 WeakPolarHBondContact CA-O 3.27Å; N96-P474 WeakPolarHBondContact OD1-CA 3.5Å; N96-T737 HydrophobicContact CB-CG2 3.93Å; N96-T737 CarbonylContact O-C 3.38Å; N96-T737 VanDerWaalsContact O-CA 3.32Å; N96-T737 WeakPolarHBondContact O-CA 3.39Å; N96-L738 PolarHBondContact O-N 3.29Å
97	V	91.4	Very high	84.1	Confident	6 Å²	6	32.3 Å²	32.3	4%	0.036	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	126	169.5	-177.3	0	0	0	0	109.1	L70 A73 V99 P474 F475 S476 L738	L70-V97 HydrophobicContact CD2-CG1 4.06Å; A73-V97 HydrophobicContact CB-CG2 3.71Å; V97-V99 HydrophobicContact CG1-CG2 4.46Å; V97-P474 PolarHBondContact N-O 3.35Å; V97-F475 HydrophobicContact CB-CD2 3.55Å; V97-F475 HydrophobicContact CB-CE2 3.88Å; V97-F475 HydrophobicContact CB-CG 4.24Å; V97-F475 HydrophobicContact CG1-CD2 3.81Å; V97-F475 HydrophobicContact CG1-CE2 3.58Å; V97-F475 HydrophobicContact CG1-CZ 4.22Å; V97-F475 HydrophobicContact CG2-CD2 4.11Å; V97-F475 HydrophobicContact CG2-CE2 4.45Å; V97-F475 CarbonylContact O-C 3.58Å; V97-F475 WeakPolarHBondContact O-CA 3.48Å; V97-S476 PolarHBondContact O-N 2.87Å; V97-L738 WeakPolarHBondContact CA-O 3.13Å; V97-L738 HydrophobicContact CG1-CD2 4.46Å; V97-L738 HydrophobicContact CG2-CB 4.44Å
98	V	93.8	Very high	84.7	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	124.4	179.4	-175.5	0	0	0	0	110	F100 I470 S476 L733 T737 L738 C739 L740	V98-F100 HydrophobicContact CB-CE2 4.48Å; V98-F100 HydrophobicContact CG1-CD2 4.15Å; V98-F100 HydrophobicContact CG1-CE1 4.15Å; V98-F100 HydrophobicContact CG1-CE2 3.54Å; V98-F100 HydrophobicContact CG1-CZ 3.54Å; V98-I470 HydrophobicContact CG1-CD1 4.1Å; V98-I470 HydrophobicContact CG2-CG2 3.68Å; V98-S476 CarbonylContact C-O 3.51Å; V98-S476 WeakPolarHBondContact CA-O 3.34Å; V98-L733 HydrophobicContact CB-CD1 4.39Å; V98-L733 HydrophobicContact CG2-CD1 4.24Å; V98-L733 HydrophobicContact CG2-CD2 4.46Å; V98-T737 HydrophobicContact CB-CG2 4.29Å; V98-T737 HydrophobicContact CG2-CG2 3.67Å; V98-L738 PolarHBondContact N-O 2.81Å; V98-C739 WeakPolarHBondContact O-CA 3.44Å; V98-L740 PolarHBondContact O-N 3.34Å
99	V	95	Very high	85.2	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	113.6	178.2	-171.2	0	0	0	0	109.7	L70 V97 V101 F475 S476 I477 V478 L740 L742	L70-V99 HydrophobicContact CD2-CG2 3.81Å; V97-V99 HydrophobicContact CG1-CG2 4.46Å; V99-V101 HydrophobicContact CG1-CG2 4.14Å; V99-F475 HydrophobicContact CG2-CZ 4.47Å; V99-S476 PolarHBondContact N-O 3.07Å; V99-I477 HydrophobicContact CB-CG1 4.12Å; V99-I477 HydrophobicContact CG2-CG1 4.42Å; V99-I477 CarbonylContact O-C 3.53Å; V99-I477 WeakPolarHBondContact O-CA 3.47Å; V99-V478 PolarHBondContact O-N 3.23Å; V99-L740 CarbonylContact C-O 3.57Å; V99-L740 WeakPolarHBondContact CA-O 3.39Å; V99-L740 HydrophobicContact CG1-CB 4.19Å; V99-L740 HydrophobicContact CG2-CB 4.35Å; V99-L740 HydrophobicContact CG2-CD1 4.14Å; V99-L742 HydrophobicContact CG1-CD1 3.49Å; V99-L742 VanDerWaalsContact CG1-CD1 3.49Å; V99-L742 HydrophobicContact CG1-CG 4.04Å
100	F	94.3	Very high	86	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121.9	171.8	-64.5	-72.9	0	0	0	110.2	V98 I470 V478 F480 I726 L729 L733 C739 L740 I741 L742	V98-F100 HydrophobicContact CB-CE2 4.48Å; V98-F100 HydrophobicContact CG1-CD2 4.15Å; V98-F100 HydrophobicContact CG1-CE1 4.15Å; V98-F100 HydrophobicContact CG1-CE2 3.54Å; V98-F100 HydrophobicContact CG1-CZ 3.54Å; F100-I470 HydrophobicContact CE1-CD1 4.38Å; F100-I470 HydrophobicContact CZ-CD1 4.26Å; F100-V478 CarbonylContact C-O 3.49Å; F100-V478 WeakPolarHBondContact CA-O 2.99Å; F100-V478 HydrophobicContact CD1-CB 3.72Å; F100-V478 HydrophobicContact CD1-CG1 4.11Å; F100-V478 HydrophobicContact CD1-CG2 4.32Å; F100-V478 HydrophobicContact CE1-CB 3.9Å; F100-V478 HydrophobicContact CE1-CG1 4.19Å; F100-V478 HydrophobicContact CE1-CG2 4.04Å; F100-F480 AromaticContact CD1-CE2 3.84Å; F100-F480 HydrophobicContact CD1-CE2 3.84Å; F100-F480 HydrophobicContact CE1-CE2 4.38Å; F100-I726 HydrophobicContact CG-CG2 4.48Å; F100-L729 HydrophobicContact CE1-CD2 3.42Å; F100-L729 VanDerWaalsContact CE1-CD2 3.42Å; F100-L729 HydrophobicContact CE1-CG 4.34Å; F100-L729 HydrophobicContact CZ-CD2 3.6Å; F100-L729 HydrophobicContact CZ-CG 4.03Å; F100-L733 HydrophobicContact CE2-CD1 4.48Å; F100-C739 VanDerWaalsContact CE2-SG 3.58Å; F100-L740 PolarHBondContact N-O 2.85Å; F100-I741 HydrophobicContact CB-CG1 4.23Å; F100-I741 HydrophobicContact CB-CG2 4.49Å; F100-I741 HydrophobicContact CD2-CG1 4.16Å; F100-I741 CarbonylContact O-C 3.52Å; F100-I741 WeakPolarHBondContact O-CA 3.35Å; F100-L742 PolarHBondContact O-N 3.46Å
101	V	93.1	Very high	86.7	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	115.8	177.6	-179.1	0	0	0	0	109.5	V99 Q103 F137 L138 I477 V478 Q479 F480 L742 P744	V99-V101 HydrophobicContact CG1-CG2 4.14Å; V101-Q103 PolarHBondContact O-N 3.46Å; V101-F137 HydrophobicContact CG1-CD1 4.19Å; V101-F137 HydrophobicContact CG1-CE1 4.05Å; V101-F137 HydrophobicContact CG2-CE1 4.39Å; V101-L138 HydrophobicContact CB-CD2 4.48Å; V101-L138 HydrophobicContact CG1-CD2 4.4Å; V101-L138 HydrophobicContact CG2-CD2 3.83Å; V101-I477 HydrophobicContact CG2-CG2 4.33Å; V101-V478 PolarHBondContact N-O 2.86Å; V101-Q479 HydrophobicContact CB-CB 4.44Å; V101-Q479 HydrophobicContact CB-CG 4.41Å; V101-Q479 HydrophobicContact CG1-CG 4.47Å; V101-Q479 WeakPolarHBondContact O-CA 3.34Å; V101-F480 PolarHBondContact O-N 3.07Å; V101-L742 HydrophobicContact CG2-CD1 4.4Å; V101-P744 HydrophobicContact CG1-CG 3.8Å
102	L	91.6	Very high	87.3	Confident	2 Å²	2	25.2 Å²	25.2	1%	0.01	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	76.3	179.2	-52.2	-173.2	0	0	0	109.6	G104 M105 F480 F482 I726 I741 L742 L743 P744	L102-G104 PolarHBondContact O-N 2.96Å; L102-M105 HydrophobicContact CB-CB 4.2Å; L102-M105 HydrophobicContact CB-CG 4.27Å; L102-M105 HydrophobicContact CB-SD 3.97Å; L102-M105 HydrophobicContact CD1-SD 3.94Å; L102-M105 WeakPolarHBondContact O-CB 3.39Å; L102-M105 PolarHBondContact O-N 2.92Å; L102-M105 VanDerWaalsContact O-N 3.1Å; L102-F480 CarbonylContact C-O 3.58Å; L102-F480 HydrophobicContact CD2-CB 4.06Å; L102-F480 HydrophobicContact CD2-CD2 3.69Å; L102-F480 HydrophobicContact CD2-CG 4.3Å; L102-F482 HydrophobicContact CB-CD2 4.4Å; L102-F482 HydrophobicContact CB-CE2 4Å; L102-F482 HydrophobicContact CD2-CE2 3.95Å; L102-F482 HydrophobicContact CG-CE2 4.46Å; L102-I726 HydrophobicContact CD1-CD1 4.26Å; L102-I726 HydrophobicContact CD2-CD1 3.57Å; L102-I741 HydrophobicContact CD1-CG2 3.91Å; L102-I741 HydrophobicContact CG-CG2 4.18Å; L102-L742 PolarHBondContact N-O 2.96Å; L102-L743 HydrophobicContact CB-CG 4.34Å; L102-L743 HydrophobicContact CD1-CD1 4.03Å; L102-L743 HydrophobicContact CD1-CG 4.28Å; L102-P744 WeakPolarHBondContact O-CD 3.46Å
103	Q	88.7	Confident	88.1	Confident	70 Å²	70	21.3 Å²	21.3	33%	0.327	10%	0.104	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	131.3	-176.3	-173.1	65.4	12.6	0	0	110.8	V101 Q479 F480 F482	V101-Q103 PolarHBondContact O-N 3.46Å; Q103-Q479 HydrophobicContact CB-CG 4.38Å; Q103-F480 PolarHBondContact N-O 3.16Å; Q103-F482 PolarHBondContact O-N 2.94Å
104	G	83.1	Confident	88.8	Confident	10 Å²	10	17.1 Å²	17.1	10%	0.103	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	-0.9	-175.8	0	0	0	0	0	114.8	L102	L102-G104 PolarHBondContact O-N 2.96Å
105	M	87.6	Confident	89.1	Confident	18 Å²	18	18.1 Å²	18.1	9%	0.089	9%	0.09	C	C	.	.			trans	-102.5	151.6	171.5	-63.7	-170.6	171.8	0	0	111.8	L102 F117 F482 L743 G745	L102-M105 HydrophobicContact CB-CB 4.2Å; L102-M105 HydrophobicContact CB-CG 4.27Å; L102-M105 HydrophobicContact CB-SD 3.97Å; L102-M105 HydrophobicContact CD1-SD 3.94Å; L102-M105 WeakPolarHBondContact O-CB 3.39Å; L102-M105 PolarHBondContact O-N 2.92Å; L102-M105 VanDerWaalsContact O-N 3.1Å; M105-F117 HydrophobicContact SD-CZ 4.17Å; M105-F482 HydrophobicContact CE-CB 4.4Å; M105-F482 HydrophobicContact CE-CD1 3.75Å; M105-F482 HydrophobicContact CE-CD2 3.63Å; M105-F482 HydrophobicContact CE-CE1 3.84Å; M105-F482 HydrophobicContact CE-CE2 3.72Å; M105-F482 HydrophobicContact CE-CG 3.64Å; M105-F482 HydrophobicContact CE-CZ 3.83Å; M105-F482 HydrophobicContact CG-CD2 4Å; M105-F482 HydrophobicContact CG-CG 4.42Å; M105-F482 HydrophobicContact SD-CD2 4.09Å; M105-F482 HydrophobicContact SD-CE2 4.11Å; M105-L743 HydrophobicContact CB-CB 4.3Å; M105-L743 HydrophobicContact CB-CD2 3.9Å; M105-L743 HydrophobicContact CB-CG 3.94Å; M105-L743 CarbonylContact O-C 3.31Å; M105-G745 PolarHBondContact O-N 3.11Å
106	S	88.9	Confident	89.5	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.072	C	C	.	.			trans	-137.9	174.6	-179.6	70.5	0	0	0	0	111.3	L108 H109 F110	S106-L108 PolarHBondContact O-N 3.43Å; S106-L108 VanDerWaalsContact O-N 3.14Å; S106-L108 PolarHBondContact OG-N 3.29Å; S106-H109 PolarHBondContact N-ND1 3.44Å; S106-H109 VanDerWaalsContact N-ND1 3.12Å; S106-H109 WeakPolarHBondContact O-CB 3.49Å; S106-H109 PolarHBondContact O-N 3.36Å; S106-H109 PolarHBondContact OG-CE1 3.35Å; S106-H109 PolarHBondContact OG-ND1 2.96Å; S106-F110 PolarHBondContact O-N 2.95Å
107	Q	89.5	Confident	89.6	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-53.9	-34.1	175	-174.7	172.3	-3.3	0	0	112.5	H109 F110 Y111 H677 W681 S754 L756	Q107-H109 VanDerWaalsContact C-N 3.33Å; Q107-H109 PolarHBondContact O-N 2.99Å; Q107-F110 PolarHBondContact O-N 3.08Å; Q107-Y111 HydrophobicContact CG-CD2 3.84Å; Q107-Y111 HydrophobicContact CG-CE2 3.89Å; Q107-Y111 WeakPolarHBondContact O-CD2 3.46Å; Q107-Y111 PolarHBondContact O-N 2.91Å; Q107-H677 PolarHBondContact NE2-O 3.46Å; Q107-W681 HydrophobicContact CG-CD2 4.07Å; Q107-W681 HydrophobicContact CG-CE3 4.01Å; Q107-W681 HydrophobicContact CG-CZ3 4.37Å; Q107-W681 VanDerWaalsContact NE2-CB 3.34Å; Q107-S754 WeakPolarHBondContact CB-O 3.34Å; Q107-S754 PolarHBondContact N-O 2.85Å; Q107-S754 VanDerWaalsContact N-O 3.1Å; Q107-S754 PolarHBondContact OE1-OG 2.84Å; Q107-S754 VanDerWaalsContact OE1-OG 3.09Å; Q107-L756 HydrophobicContact CB-CB 4.1Å; Q107-L756 HydrophobicContact CG-CB 4.41Å; Q107-L756 HydrophobicContact CG-CD1 4.29Å
108	L	87.9	Confident	89.4	Confident	2 Å²	2	14.2 Å²	14.2	1%	0.01	7%	0.071	C	C	.	.	H	α-helix	trans	-59.4	-42.1	175.8	178.3	61.5	0	0	0	112.3	S106 R112 T490 M493 N494 M497 W681 L753	S106-L108 PolarHBondContact O-N 3.43Å; S106-L108 VanDerWaalsContact O-N 3.14Å; S106-L108 PolarHBondContact OG-N 3.29Å; L108-R112 WeakPolarHBondContact O-CB 3.39Å; L108-R112 PolarHBondContact O-N 2.95Å; L108-T490 HydrophobicContact CD2-CG2 4.31Å; L108-M493 HydrophobicContact CD2-CB 4.13Å; L108-N494 HydrophobicContact CD2-CB 4.02Å; L108-M497 HydrophobicContact CD1-CB 3.93Å; L108-M497 HydrophobicContact CD1-CG 4.2Å; L108-W681 HydrophobicContact CB-CH2 4.25Å; L108-W681 HydrophobicContact CB-CZ2 4.07Å; L108-W681 HydrophobicContact CD1-CH2 3.88Å; L108-W681 HydrophobicContact CD1-CZ2 4.06Å; L108-L753 HydrophobicContact CB-CD1 4.15Å; L108-L753 HydrophobicContact CD2-CD1 3.76Å
109	H	88.1	Confident	89	Confident	13 Å²	13	17.2 Å²	17.2	6%	0.06	9%	0.092	C	C	.	.	H	α-helix	trans	-67.2	-43.5	-179.3	-63.1	80.6	0	0	0	111.4	S106 Q107 Y111 R112 F113 F485	S106-H109 PolarHBondContact N-ND1 3.44Å; S106-H109 VanDerWaalsContact N-ND1 3.12Å; S106-H109 WeakPolarHBondContact O-CB 3.49Å; S106-H109 PolarHBondContact O-N 3.36Å; S106-H109 PolarHBondContact OG-CE1 3.35Å; S106-H109 PolarHBondContact OG-ND1 2.96Å; Q107-H109 VanDerWaalsContact C-N 3.33Å; Q107-H109 PolarHBondContact O-N 2.99Å; H109-Y111 PolarHBondContact O-N 3.35Å; H109-R112 PolarHBondContact O-N 3.27Å; H109-F113 WeakPolarHBondContact O-CD2 3.31Å; H109-F113 PolarHBondContact O-N 3.44Å; H109-F113 VanDerWaalsContact O-N 3.09Å; H109-F485 AromaticContact CD2-CD2 3.72Å; H109-F485 AromaticContact CD2-CE2 3.29Å; H109-F485 WeakPolarHBondContact CD2-CE2 3.26Å; H109-F485 AromaticContact NE2-CD2 3.07Å; H109-F485 WeakPolarHBondContact NE2-CD2 3.34Å; H109-F485 AromaticContact NE2-CE2 3.18Å; H109-F485 WeakPolarHBondContact NE2-CE2 3.39Å
110	F	90.3	Very high	88.7	Confident	1 Å²	1	17.3 Å²	17.3	0%	0.004	9%	0.092	C	C	.	.	H	α-helix	trans	-58.3	-48.4	178.9	-177.9	-98.7	0	0	0	111.4	S106 Q107 F113 Y114 F117 R121 L743 L756 L758	S106-F110 PolarHBondContact O-N 2.95Å; Q107-F110 PolarHBondContact O-N 3.08Å; F110-F113 CarbonylContact O-C 3.6Å; F110-F113 VanDerWaalsContact O-C 3.31Å; F110-F113 PolarHBondContact O-N 3.43Å; F110-Y114 HydrophobicContact CD1-CD2 4.22Å; F110-Y114 AromaticContact CE1-CD2 3.71Å; F110-Y114 HydrophobicContact CE1-CD2 3.71Å; F110-Y114 AromaticContact CE1-CE2 3.84Å; F110-Y114 HydrophobicContact CE1-CE2 3.84Å; F110-Y114 HydrophobicContact CZ-CD2 4.29Å; F110-Y114 HydrophobicContact CZ-CE2 4.36Å; F110-Y114 WeakPolarHBondContact O-CA 3.28Å; F110-Y114 PolarHBondContact O-N 3.22Å; F110-F117 HydrophobicContact CD2-CB 4.14Å; F110-F117 AromaticContact CD2-CD2 4Å; F110-F117 HydrophobicContact CD2-CD2 4Å; F110-F117 AromaticContact CD2-CG 3.98Å; F110-F117 HydrophobicContact CD2-CG 3.98Å; F110-F117 HydrophobicContact CE2-CB 3.85Å; F110-F117 HydrophobicContact CE2-CG 4.17Å; F110-R121 HydrophobicContact CZ-CB 4.37Å; F110-L743 HydrophobicContact CB-CD2 4Å; F110-L756 HydrophobicContact CB-CD2 3.71Å; F110-L756 HydrophobicContact CD1-CD2 3.41Å; F110-L756 VanDerWaalsContact CD1-CD2 3.41Å; F110-L756 HydrophobicContact CD2-CD2 3.97Å; F110-L756 HydrophobicContact CE1-CD2 3.96Å; F110-L756 HydrophobicContact CE2-CD2 4.46Å; F110-L756 HydrophobicContact CG-CD2 3.4Å; F110-L756 VanDerWaalsContact CG-CD2 3.4Å; F110-L756 HydrophobicContact CZ-CD2 4.46Å; F110-L758 HydrophobicContact CE2-CD2 3.92Å; F110-L758 HydrophobicContact CZ-CD2 4.24Å
111	Y	89	Confident	88.4	Confident	9 Å²	9	17.6 Å²	17.6	4%	0.035	9%	0.093	C	C	.	.	H	α-helix	trans	-78.3	-28.4	-179.1	-77.4	-67.6	0	0	0	114.4	Q107 H109 F113 Y114 H677 L678 W681	Q107-Y111 HydrophobicContact CG-CD2 3.84Å; Q107-Y111 HydrophobicContact CG-CE2 3.89Å; Q107-Y111 WeakPolarHBondContact O-CD2 3.46Å; Q107-Y111 PolarHBondContact O-N 2.91Å; H109-Y111 PolarHBondContact O-N 3.35Å; Y111-F113 VanDerWaalsContact C-N 3.26Å; Y111-F113 PolarHBondContact O-N 2.81Å; Y111-Y114 AromaticContact CD1-CD2 3.7Å; Y111-Y114 HydrophobicContact CD1-CD2 3.7Å; Y111-Y114 HydrophobicContact CD1-CE2 4.18Å; Y111-Y114 HydrophobicContact CD1-CG 4.4Å; Y111-Y114 AromaticContact CE1-CD2 3.77Å; Y111-Y114 HydrophobicContact CE1-CD2 3.77Å; Y111-Y114 AromaticContact CE1-CE2 3.77Å; Y111-Y114 HydrophobicContact CE1-CE2 3.77Å; Y111-H677 AromaticContact CZ-NE2 3.91Å; Y111-H677 PolarHBondContact OH-CD2 2.85Å; Y111-H677 PolarHBondContact OH-NE2 3.07Å; Y111-L678 HydrophobicContact CD1-CD1 4.15Å; Y111-L678 HydrophobicContact CD1-CD2 4.1Å; Y111-L678 HydrophobicContact CD2-CD1 4.02Å; Y111-L678 HydrophobicContact CE1-CB 4.43Å; Y111-L678 HydrophobicContact CE1-CD1 4.03Å; Y111-L678 HydrophobicContact CE1-CD2 3.58Å; Y111-L678 HydrophobicContact CE1-CG 4.22Å; Y111-L678 HydrophobicContact CE2-CB 4.4Å; Y111-L678 HydrophobicContact CE2-CD1 3.88Å; Y111-L678 HydrophobicContact CG-CD1 4.14Å; Y111-W681 AromaticContact CD2-CE3 3.96Å; Y111-W681 HydrophobicContact CD2-CE3 3.96Å; Y111-W681 AromaticContact CD2-CZ3 3.63Å; Y111-W681 HydrophobicContact CD2-CZ3 3.63Å; Y111-W681 HydrophobicContact CE2-CE3 4.42Å; Y111-W681 HydrophobicContact CG-CZ3 4.06Å
112	R	86.7	Confident	88.1	Confident	59 Å²	59	24 Å²	24	22%	0.223	12%	0.121	C	C	.	.	H	α-helix	trans	-61	-40	171.7	176.4	61.2	179.3	126.8	-1.9	111.3	L108 H109 M493	L108-R112 WeakPolarHBondContact O-CB 3.39Å; L108-R112 PolarHBondContact O-N 2.95Å; H109-R112 PolarHBondContact O-N 3.27Å; R112-M493 HydrophobicContact CB-CE 4.25Å; R112-M493 HydrophobicContact CG-CE 3.9Å
113	F	87.4	Confident	87.9	Confident	16 Å²	16	25.5 Å²	25.5	7%	0.07	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	35.9	-177.6	-54.1	-64.1	0	0	0	112.3	H109 F110 Y111 L115 E116 F117 M493 P715 K716 A719	H109-F113 WeakPolarHBondContact O-CD2 3.31Å; H109-F113 PolarHBondContact O-N 3.44Å; H109-F113 VanDerWaalsContact O-N 3.09Å; F110-F113 CarbonylContact O-C 3.6Å; F110-F113 VanDerWaalsContact O-C 3.31Å; F110-F113 PolarHBondContact O-N 3.43Å; Y111-F113 VanDerWaalsContact C-N 3.26Å; Y111-F113 PolarHBondContact O-N 2.81Å; F113-L115 VanDerWaalsContact C-N 3.27Å; F113-L115 PolarHBondContact O-N 2.99Å; F113-E116 WeakPolarHBondContact CA-OE2 3.43Å; F113-E116 HydrophobicContact CB-CB 4.21Å; F113-E116 HydrophobicContact CB-CG 4.48Å; F113-E116 WeakPolarHBondContact CB-OE2 3.17Å; F113-E116 WeakPolarHBondContact O-CB 3.19Å; F113-E116 PolarHBondContact O-N 3.4Å; F113-E116 VanDerWaalsContact O-N 3.08Å; F113-E116 VanDerWaalsContact O-OE2 3.05Å; F113-F117 HydrophobicContact CB-CD2 4.09Å; F113-F117 HydrophobicContact CB-CE2 4.01Å; F113-F117 WeakPolarHBondContact O-CD2 3.44Å; F113-F117 PolarHBondContact O-N 3.32Å; F113-F117 VanDerWaalsContact O-N 3.07Å; F113-M493 HydrophobicContact CE2-CE 4.3Å; F113-P715 HydrophobicContact CZ-CB 4.06Å; F113-K716 HydrophobicContact CD1-CB 4.27Å; F113-K716 HydrophobicContact CD1-CG 4.25Å; F113-K716 HydrophobicContact CE1-CB 4.02Å; F113-K716 HydrophobicContact CE1-CG 4.43Å; F113-A719 HydrophobicContact CB-CB 3.98Å; F113-A719 HydrophobicContact CD2-CB 4.01Å; F113-A719 HydrophobicContact CG-CB 3.96Å
114	Y	89.6	Confident	87.8	Confident	4 Å²	4	22.1 Å²	22.1	2%	0.016	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-36.1	-171.1	-176.3	-101.3	0	0	0	113.5	F110 Y111 R121 L588 E591 L592 D595	F110-Y114 HydrophobicContact CD1-CD2 4.22Å; F110-Y114 AromaticContact CE1-CD2 3.71Å; F110-Y114 HydrophobicContact CE1-CD2 3.71Å; F110-Y114 AromaticContact CE1-CE2 3.84Å; F110-Y114 HydrophobicContact CE1-CE2 3.84Å; F110-Y114 HydrophobicContact CZ-CD2 4.29Å; F110-Y114 HydrophobicContact CZ-CE2 4.36Å; F110-Y114 WeakPolarHBondContact O-CA 3.28Å; F110-Y114 PolarHBondContact O-N 3.22Å; Y111-Y114 AromaticContact CD1-CD2 3.7Å; Y111-Y114 HydrophobicContact CD1-CD2 3.7Å; Y111-Y114 HydrophobicContact CD1-CE2 4.18Å; Y111-Y114 HydrophobicContact CD1-CG 4.4Å; Y111-Y114 AromaticContact CE1-CD2 3.77Å; Y111-Y114 HydrophobicContact CE1-CD2 3.77Å; Y111-Y114 AromaticContact CE1-CE2 3.77Å; Y111-Y114 HydrophobicContact CE1-CE2 3.77Å; Y114-R121 VanDerWaalsContact CE1-CD 3.5Å; Y114-R121 HydrophobicContact CE2-CG 4.4Å; Y114-R121 WeakPolarHBondContact OH-CD 3.3Å; Y114-L588 HydrophobicContact CD1-CD1 3.43Å; Y114-L588 VanDerWaalsContact CD1-CD1 3.43Å; Y114-L588 HydrophobicContact CE1-CD1 4.02Å; Y114-L588 HydrophobicContact CG-CD1 4.18Å; Y114-E591 HydrophobicContact CE1-CB 4.49Å; Y114-L592 HydrophobicContact CE1-CD2 3.83Å; Y114-L592 HydrophobicContact CE1-CG 3.85Å; Y114-L592 HydrophobicContact CE2-CD2 4.28Å; Y114-L592 WeakPolarHBondContact OH-CD2 3.42Å; Y114-D595 PolarHBondContact OH-OD2 3.25Å
115	L	88.5	Confident	87.7	Confident	47 Å²	47	26 Å²	26	25%	0.246	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-36.8	178.1	-64.3	179.9	0	0	0	111	F113 F117 G118 D584 T587 L588 E591	F113-L115 VanDerWaalsContact C-N 3.27Å; F113-L115 PolarHBondContact O-N 2.99Å; L115-F117 VanDerWaalsContact C-N 3.35Å; L115-G118 PolarHBondContact O-N 3.16Å; L115-D584 HydrophobicContact CD1-CB 3.97Å; L115-T587 HydrophobicContact CD1-CG2 4.3Å; L115-T587 HydrophobicContact CD2-CG2 4.17Å; L115-L588 HydrophobicContact CD2-CD1 4.42Å; L115-E591 HydrophobicContact CD2-CB 4.12Å; L115-E591 HydrophobicContact CD2-CG 4.05Å
116	E	88.5	Confident	87.6	Confident	30 Å²	30	25.5 Å²	25.5	14%	0.14	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-29.8	179	-64.6	70.8	-158.2	0	0	112.5	F113 G118 K716 W720	F113-E116 WeakPolarHBondContact CA-OE2 3.43Å; F113-E116 HydrophobicContact CB-CB 4.21Å; F113-E116 HydrophobicContact CB-CG 4.48Å; F113-E116 WeakPolarHBondContact CB-OE2 3.17Å; F113-E116 WeakPolarHBondContact O-CB 3.19Å; F113-E116 PolarHBondContact O-N 3.4Å; F113-E116 VanDerWaalsContact O-N 3.08Å; F113-E116 VanDerWaalsContact O-OE2 3.05Å; E116-G118 PolarHBondContact O-N 3.32Å; E116-K716 HydrophobicContact CG-CG 3.92Å; E116-K716 WeakPolarHBondContact OE1-CE 3.26Å; E116-K716 IonicContact OE1-NZ 3.77Å; E116-W720 HydrophobicContact CB-CB 3.98Å; E116-W720 HydrophobicContact CG-CB 4Å
117	F	88.3	Confident	87.6	Confident	4 Å²	4	25.5 Å²	25.5	2%	0.018	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	15.8	174.1	-77.2	-69.3	0	0	0	114	M105 F110 F113 L115 C119 L120 R121 A719	M105-F117 HydrophobicContact SD-CZ 4.17Å; F110-F117 HydrophobicContact CD2-CB 4.14Å; F110-F117 AromaticContact CD2-CD2 4Å; F110-F117 HydrophobicContact CD2-CD2 4Å; F110-F117 AromaticContact CD2-CG 3.98Å; F110-F117 HydrophobicContact CD2-CG 3.98Å; F110-F117 HydrophobicContact CE2-CB 3.85Å; F110-F117 HydrophobicContact CE2-CG 4.17Å; F113-F117 HydrophobicContact CB-CD2 4.09Å; F113-F117 HydrophobicContact CB-CE2 4.01Å; F113-F117 WeakPolarHBondContact O-CD2 3.44Å; F113-F117 PolarHBondContact O-N 3.32Å; F113-F117 VanDerWaalsContact O-N 3.07Å; L115-F117 VanDerWaalsContact C-N 3.35Å; F117-C119 VanDerWaalsContact C-N 3.29Å; F117-C119 PolarHBondContact O-N 2.89Å; F117-C119 VanDerWaalsContact O-N 3.1Å; F117-L120 HydrophobicContact CD1-CD1 3.84Å; F117-L120 HydrophobicContact CD1-CG 4.45Å; F117-L120 HydrophobicContact CE1-CD1 4.21Å; F117-L120 PolarHBondContact O-N 2.78Å; F117-R121 WeakPolarHBondContact O-CB 3.28Å; F117-R121 PolarHBondContact O-N 3.39Å; F117-A719 HydrophobicContact CE2-CB 4.27Å; F117-A719 HydrophobicContact CZ-CB 4.31Å
118	G	86.8	Confident	87.5	Confident	14 Å²	14	25.5 Å²	25.5	14%	0.144	13%	0.127	C	C	.	.	H	α-helix	trans	-50	-40.1	-174.2	0	0	0	0	0	115.5	L115 E116 K122	L115-G118 PolarHBondContact O-N 3.16Å; E116-G118 PolarHBondContact O-N 3.32Å; G118-K122 WeakPolarHBondContact O-CB 3.39Å; G118-K122 VanDerWaalsContact O-CG 3.25Å; G118-K122 WeakPolarHBondContact O-CG 3.45Å; G118-K122 PolarHBondContact O-N 2.98Å
119	C	85.8	Confident	87.5	Confident	63 Å²	63	27.1 Å²	27.1	43%	0.426	13%	0.133	S	C	.	.	H	α-helix	trans	-62.3	-48.6	176.6	-66.8	0	0	0	0	112.1	F117 A123	F117-C119 VanDerWaalsContact C-N 3.29Å; F117-C119 PolarHBondContact O-N 2.89Å; F117-C119 VanDerWaalsContact O-N 3.1Å; C119-A123 WeakPolarHBondContact O-CB 3.45Å; C119-A123 PolarHBondContact O-N 2.97Å
120	L	88.7	Confident	87.5	Confident	2 Å²	2	26.5 Å²	26.5	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-71.3	-39.8	-178.5	-54.6	-172.1	0	0	0	110.9	F117 K122 A123 F124 I726 I741 L758	F117-L120 HydrophobicContact CD1-CD1 3.84Å; F117-L120 HydrophobicContact CD1-CG 4.45Å; F117-L120 HydrophobicContact CE1-CD1 4.21Å; F117-L120 PolarHBondContact O-N 2.78Å; L120-K122 VanDerWaalsContact C-N 3.35Å; L120-K122 PolarHBondContact O-N 3.26Å; L120-A123 PolarHBondContact O-N 3.15Å; L120-F124 HydrophobicContact CD2-CE2 4.32Å; L120-F124 WeakPolarHBondContact O-CD2 3.49Å; L120-F124 PolarHBondContact O-N 3.4Å; L120-F124 VanDerWaalsContact O-N 3.11Å; L120-I726 HydrophobicContact CD2-CB 4.2Å; L120-I726 HydrophobicContact CD2-CG2 3.86Å; L120-I741 HydrophobicContact CB-CD1 4.38Å; L120-I741 HydrophobicContact CD1-CD1 3.87Å; L120-I741 HydrophobicContact CD2-CD1 3.61Å; L120-I741 HydrophobicContact CG-CD1 4.15Å; L120-L758 HydrophobicContact CB-CD2 4.28Å
121	R	89.4	Confident	87.3	Confident	6 Å²	6	27.7 Å²	27.7	2%	0.023	14%	0.137	C	C	.	.	H	α-helix	trans	-59.6	-45.1	177.5	173.9	173	53.7	84.2	4.7	112.7	F110 Y114 F117 K127 E591 D595	F110-R121 HydrophobicContact CZ-CB 4.37Å; Y114-R121 VanDerWaalsContact CE1-CD 3.5Å; Y114-R121 HydrophobicContact CE2-CG 4.4Å; Y114-R121 WeakPolarHBondContact OH-CD 3.3Å; F117-R121 WeakPolarHBondContact O-CB 3.28Å; F117-R121 PolarHBondContact O-N 3.39Å; R121-K127 PolarHBondContact O-NZ 3.4Å; R121-E591 IonicContact CZ-OE2 3.67Å; R121-E591 PolarHBondContact NH1-O 3.3Å; R121-E591 IonicContact NH1-OE2 3.63Å; R121-E591 PolarHBondContact NH1-OE2 3.05Å; R121-E591 IonicContact NH2-OE2 2.85Å; R121-E591 PolarHBondContact NH2-OE2 3.42Å; R121-D595 WeakPolarHBondContact CD-OD2 3.18Å; R121-D595 WeakPolarHBondContact CG-OD2 3.44Å
122	K	87	Confident	87	Confident	133 Å²	133	29.5 Å²	29.5	58%	0.578	15%	0.15	S	C	*	.	H	α-helix	trans	-75.9	-35.8	-178.2	-67.3	179.3	-175.9	-170.5	0	111.8	G118 L120 E591	G118-K122 WeakPolarHBondContact O-CB 3.39Å; G118-K122 VanDerWaalsContact O-CG 3.25Å; G118-K122 WeakPolarHBondContact O-CG 3.45Å; G118-K122 PolarHBondContact O-N 2.98Å; L120-K122 VanDerWaalsContact C-N 3.35Å; L120-K122 PolarHBondContact O-N 3.26Å; K122-E591 WeakPolarHBondContact CE-OE2 3.21Å; K122-E591 IonicContact NZ-OE1 3.42Å; K122-E591 PolarHBondContact NZ-OE1 3.06Å; K122-E591 IonicContact NZ-OE2 3.98Å; K122-E591 PolarHBondContact NZ-OE2 3.19Å
123	A	86	Confident	86.6	Confident	34 Å²	34	27.2 Å²	27.2	28%	0.281	14%	0.143	S	C	.	.	H	α-helix	trans	-72.7	-30.6	-179.1	0	0	0	0	0	114	C119 L120 Y730	C119-A123 WeakPolarHBondContact O-CB 3.45Å; C119-A123 PolarHBondContact O-N 2.97Å; L120-A123 PolarHBondContact O-N 3.15Å; A123-Y730 HydrophobicContact CB-CD1 3.92Å; A123-Y730 HydrophobicContact CB-CE1 3.65Å
124	F	87.9	Confident	86	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.			trans	-109.8	112.2	-174.3	-66.2	-99.5	0	0	0	110.7	L120 K127 Y730 C739 I741 L758	L120-F124 HydrophobicContact CD2-CE2 4.32Å; L120-F124 WeakPolarHBondContact O-CD2 3.49Å; L120-F124 PolarHBondContact O-N 3.4Å; L120-F124 VanDerWaalsContact O-N 3.11Å; F124-K127 PolarHBondContact O-NZ 3.06Å; F124-Y730 HydrophobicContact CE1-CE2 4.28Å; F124-Y730 HydrophobicContact CE2-CD2 4.23Å; F124-Y730 HydrophobicContact CE2-CE2 4.38Å; F124-Y730 HydrophobicContact CE2-CG 4.28Å; F124-Y730 AromaticContact CZ-CD2 3.72Å; F124-Y730 HydrophobicContact CZ-CD2 3.72Å; F124-Y730 AromaticContact CZ-CE2 3.83Å; F124-Y730 HydrophobicContact CZ-CE2 3.83Å; F124-Y730 HydrophobicContact CZ-CG 4.21Å; F124-C739 HydrophobicContact CE1-CB 3.7Å; F124-C739 HydrophobicContact CZ-CB 4.05Å; F124-C739 WeakPolarHBondContact CZ-SG 3.48Å; F124-I741 HydrophobicContact CD2-CD1 4.06Å; F124-I741 HydrophobicContact CE1-CD1 4.18Å; F124-I741 HydrophobicContact CE1-CG1 3.97Å; F124-I741 HydrophobicContact CE2-CD1 3.35Å; F124-I741 HydrophobicContact CE2-CG1 4.07Å; F124-I741 HydrophobicContact CZ-CD1 3.42Å; F124-I741 VanDerWaalsContact CZ-CD1 3.42Å; F124-I741 HydrophobicContact CZ-CG1 3.64Å; F124-L758 HydrophobicContact CB-CB 3.83Å; F124-L758 HydrophobicContact CB-CD2 4.27Å; F124-L758 HydrophobicContact CD1-CB 4.15Å; F124-L758 HydrophobicContact CG-CB 3.98Å
125	R	80.1	Confident	85.1	Confident	92 Å²	92	34.4 Å²	34.4	35%	0.347	20%	0.196	S	C	.	.			trans	-65.5	-53.9	179.8	-178.2	174.5	175.7	-179.5	1.1	111.4	S596 E597	R125-S596 WeakPolarHBondContact CA-OG 3.39Å; R125-E597 WeakPolarHBondContact O-CG 3.36Å; R125-E597 VanDerWaalsContact O-OE1 3.05Å
126	H	85.5	Confident	84.6	Confident	6 Å²	6	33.8 Å²	33.8	3%	0.028	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	135.8	-169.1	-55.1	-78.1	0	0	0	111.1	L50 T52 M759	L50-H126 PolarHBondContact O-NE2 3.15Å; T52-H126 HydrophobicContact CG2-CB 3.92Å; T52-H126 WeakPolarHBondContact CG2-ND1 3.38Å; T52-H126 PolarHBondContact OG1-ND1 3.38Å; T52-H126 VanDerWaalsContact OG1-ND1 3.11Å; H126-M759 HydrophobicContact CB-CB 4.4Å; H126-M759 HydrophobicContact CB-CE 4.32Å; H126-M759 PolarHBondContact N-O 3.2Å; H126-M759 PolarHBondContact O-N 3.42Å
127	K	88.5	Confident	84.4	Confident	1 Å²	1	32.8 Å²	32.8	0%	0.004	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	135.8	-178.2	-58.9	176.9	-172.2	77.3	0	110.3	R121 F124 D595 E597 H677 G757 L758	R121-K127 PolarHBondContact O-NZ 3.4Å; F124-K127 PolarHBondContact O-NZ 3.06Å; K127-D595 IonicContact NZ-OD1 2.66Å; K127-D595 PolarHBondContact NZ-OD1 2.89Å; K127-D595 IonicContact NZ-OD2 2.71Å; K127-E597 HydrophobicContact CB-CG 4.25Å; K127-E597 HydrophobicContact CD-CG 4.13Å; K127-E597 HydrophobicContact CG-CG 4.18Å; K127-H677 WeakPolarHBondContact CB-CE1 3.47Å; K127-H677 PolarHBondContact O-ND1 3.05Å; K127-G757 CarbonylContact C-O 3.56Å; K127-G757 VanDerWaalsContact CA-O 3.32Å; K127-G757 WeakPolarHBondContact CA-O 3.48Å; K127-L758 HydrophobicContact CG-CG 4.38Å
128	F	88.1	Confident	84.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	156.7	-174.9	60.2	-90.6	0	0	0	112.3	F55 V61 L66 W85 L130 L740 L742 L756 G757 M759	F55-F128 HydrophobicContact CE1-CB 3.9Å; F55-F128 HydrophobicContact CZ-CB 4.14Å; V61-F128 HydrophobicContact CB-CD2 3.61Å; V61-F128 HydrophobicContact CB-CE2 3.99Å; V61-F128 HydrophobicContact CB-CG 4.37Å; V61-F128 HydrophobicContact CG1-CD2 4.37Å; V61-F128 HydrophobicContact CG1-CE2 4.3Å; V61-F128 HydrophobicContact CG2-CB 3.86Å; V61-F128 HydrophobicContact CG2-CD2 3.61Å; V61-F128 HydrophobicContact CG2-CE2 4.31Å; V61-F128 HydrophobicContact CG2-CG 3.85Å; L66-F128 HydrophobicContact CD1-CZ 4.33Å; W85-F128 HydrophobicContact CH2-CD1 4.27Å; W85-F128 HydrophobicContact CH2-CE1 4.03Å; W85-F128 HydrophobicContact CH2-CZ 4.27Å; W85-F128 HydrophobicContact CZ3-CD1 4.19Å; W85-F128 HydrophobicContact CZ3-CE1 4.4Å; F128-L130 HydrophobicContact CD2-CD2 4.27Å; F128-L130 HydrophobicContact CD2-CG 4.34Å; F128-L130 HydrophobicContact CE2-CD2 3.67Å; F128-L130 HydrophobicContact CE2-CG 3.97Å; F128-L740 HydrophobicContact CE1-CD2 4.47Å; F128-L740 HydrophobicContact CZ-CD2 4.5Å; F128-L742 HydrophobicContact CZ-CD2 4.22Å; F128-L756 WeakPolarHBondContact O-CD1 3.31Å; F128-G757 PolarHBondContact N-O 3.28Å; F128-G757 PolarHBondContact O-N 2.89Å; F128-M759 HydrophobicContact CE1-CB 4.13Å; F128-M759 HydrophobicContact CE1-CE 4.48Å
129	R	88.1	Confident	84	Confident	36 Å²	36	32.6 Å²	32.6	14%	0.136	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	143.7	177.2	-56.8	179.1	67.3	-157.4	-6.5	109.9	C59 E60 V61 H677 S754	C59-R129 WeakPolarHBondContact O-CB 3.49Å; C59-R129 PolarHBondContact O-N 3.5Å; E60-R129 WeakPolarHBondContact CA-O 3.45Å; E60-R129 HydrophobicContact CB-CB 4.42Å; V61-R129 PolarHBondContact N-O 3.2Å; R129-H677 HydrophobicContact CG-CB 3.63Å; R129-S754 PolarHBondContact NH2-OG 2.83Å
130	L	88.4	Confident	83.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	143.7	169.5	-71.1	165.6	0	0	0	109.1	L66 F128 F137 L742 S754 G755	L66-L130 HydrophobicContact CD2-CD2 4.46Å; F128-L130 HydrophobicContact CD2-CD2 4.27Å; F128-L130 HydrophobicContact CD2-CG 4.34Å; F128-L130 HydrophobicContact CE2-CD2 3.67Å; F128-L130 HydrophobicContact CE2-CG 3.97Å; L130-F137 HydrophobicContact CD1-CZ 4.39Å; L130-L742 HydrophobicContact CD1-CB 4.43Å; L130-L742 HydrophobicContact CD1-CD2 4.21Å; L130-S754 WeakPolarHBondContact O-CB 3.36Å; L130-G755 PolarHBondContact N-O 3.26Å; L130-G755 PolarHBondContact O-N 2.84Å
131	P	85.6	Confident	83.7	Confident	25 Å²	25	31.8 Å²	31.8	16%	0.162	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-59.6	160.1	168.7	28.1	-34.3	0	0	0	109.9	V61	V61-P131 WeakPolarHBondContact O-CD 3.36Å
132	P	81.3	Confident	83.4	Confident	47 Å²	47	31.6 Å²	31.6	31%	0.305	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-53.7	145	173.3	-24.4	34.2	0	0	0	111.4
133	P	78.9	Confident	83	Confident	12 Å²	12	26.7 Å²	26.7	8%	0.078	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-67.5	148.4	-172.3	29.1	-33	0	0	0	111	F137 P744	P133-F137 HydrophobicContact CB-CB 4.4Å; P133-F137 HydrophobicContact CB-CD2 4.42Å; P133-P744 HydrophobicContact CB-CB 4.14Å; P133-P744 VanDerWaalsContact CD-O 3.23Å; P133-P744 WeakPolarHBondContact CD-O 3.31Å
134	S	75	Confident	82.4	Confident	42 Å²	42	27 Å²	27	29%	0.294	16%	0.159	S	C	.	.			trans	-76.7	-171.2	169.5	73.4	0	0	0	0	111.1	D136 D140	S134-D136 VanDerWaalsContact C-N 3.28Å; S134-D136 PolarHBondContact OG-N 3.48Å; S134-D136 PolarHBondContact OG-O 3.03Å; S134-D140 WeakPolarHBondContact CB-OD2 3.3Å; S134-D140 PolarHBondContact OG-OD1 3.05Å; S134-D140 PolarHBondContact OG-OD2 3.31Å
135	S	71.3	Confident	80.9	Confident	128 Å²	128	35.4 Å²	35.4	90%	0.895	20%	0.198	S	C	*	.	S	Bend	trans	-66.7	-28.1	172.8	48.2	0	0	0	0	113.3
136	D	76.8	Confident	79	Confident	35 Å²	35	34.3 Å²	34.3	19%	0.187	20%	0.202	C	C	.	.			trans	-138.8	84.5	175.9	-167.1	-20.5	0	0	0	110.2	S134 L138 A139 D140	S134-D136 VanDerWaalsContact C-N 3.28Å; S134-D136 PolarHBondContact OG-N 3.48Å; S134-D136 PolarHBondContact OG-O 3.03Å; D136-L138 PolarHBondContact O-N 2.83Å; D136-L138 PolarHBondContact OD1-N 3.21Å; D136-A139 HydrophobicContact CB-CB 3.83Å; D136-A139 VanDerWaalsContact CG-CB 3.41Å; D136-A139 PolarHBondContact O-N 2.87Å; D136-A139 PolarHBondContact OD1-N 2.64Å; D136-D140 PolarHBondContact O-N 3.01Å; D136-D140 VanDerWaalsContact O-N 3.15Å
137	F	84.4	Confident	76.6	Confident	9 Å²	9	43 Å²	43	4%	0.039	24%	0.24	C	C	.	.	H	α-helix	trans	-57	-35.7	-179.3	174	-100.3	0	0	0	113	H63 V101 L130 P133 I141 L742 P744	H63-F137 AromaticContact CD2-CE2 3.91Å; H63-F137 AromaticContact CE1-CD2 3.89Å; H63-F137 AromaticContact NE2-CD2 3.7Å; H63-F137 AromaticContact NE2-CE2 3.61Å; V101-F137 HydrophobicContact CG1-CD1 4.19Å; V101-F137 HydrophobicContact CG1-CE1 4.05Å; V101-F137 HydrophobicContact CG2-CE1 4.39Å; L130-F137 HydrophobicContact CD1-CZ 4.39Å; P133-F137 HydrophobicContact CB-CB 4.4Å; P133-F137 HydrophobicContact CB-CD2 4.42Å; F137-I141 HydrophobicContact CD1-CD1 4.4Å; F137-I141 HydrophobicContact CD2-CG2 4.36Å; F137-I141 HydrophobicContact CE1-CD1 3.87Å; F137-I141 HydrophobicContact CE1-CG2 4.23Å; F137-I141 HydrophobicContact CE2-CG2 3.9Å; F137-I141 HydrophobicContact CZ-CD1 4.37Å; F137-I141 HydrophobicContact CZ-CG2 3.83Å; F137-I141 WeakPolarHBondContact O-CG2 3.38Å; F137-I141 PolarHBondContact O-N 2.76Å; F137-L742 HydrophobicContact CE1-CB 4.29Å; F137-L742 HydrophobicContact CE1-CD1 4.12Å; F137-L742 HydrophobicContact CZ-CB 4.12Å; F137-L742 HydrophobicContact CZ-CD1 3.99Å; F137-P744 HydrophobicContact CD1-CB 3.92Å; F137-P744 HydrophobicContact CD1-CG 3.68Å; F137-P744 HydrophobicContact CD2-CB 3.89Å; F137-P744 HydrophobicContact CE1-CB 4.05Å; F137-P744 HydrophobicContact CE1-CG 3.64Å; F137-P744 HydrophobicContact CE2-CB 4.01Å; F137-P744 HydrophobicContact CE2-CG 4.46Å; F137-P744 HydrophobicContact CG-CB 3.83Å; F137-P744 HydrophobicContact CG-CG 4.13Å; F137-P744 HydrophobicContact CZ-CB 4.09Å; F137-P744 HydrophobicContact CZ-CG 4.05Å
138	L	85.3	Confident	73.8	Confident	11 Å²	11	52.2 Å²	52.2	6%	0.058	28%	0.283	C	S	.	.	H	α-helix	trans	-72.1	-40.1	-179.6	-73.1	-175.6	0	0	0	111.6	V101 D136 D140 I141 V142 F435 L445 I477	V101-L138 HydrophobicContact CB-CD2 4.48Å; V101-L138 HydrophobicContact CG1-CD2 4.4Å; V101-L138 HydrophobicContact CG2-CD2 3.83Å; D136-L138 PolarHBondContact O-N 2.83Å; D136-L138 PolarHBondContact OD1-N 3.21Å; L138-D140 VanDerWaalsContact C-N 3.3Å; L138-D140 PolarHBondContact O-N 3.07Å; L138-I141 HydrophobicContact CD2-CD1 3.91Å; L138-I141 WeakPolarHBondContact O-CG1 3.35Å; L138-I141 PolarHBondContact O-N 2.72Å; L138-V142 WeakPolarHBondContact O-CB 3.46Å; L138-V142 VanDerWaalsContact O-CG2 3.28Å; L138-V142 WeakPolarHBondContact O-CG2 3.34Å; L138-V142 PolarHBondContact O-N 3.21Å; L138-V142 VanDerWaalsContact O-N 3.11Å; L138-F435 HydrophobicContact CD1-CE1 4.47Å; L138-F435 HydrophobicContact CD1-CE2 3.62Å; L138-F435 HydrophobicContact CD1-CZ 3.43Å; L138-F435 VanDerWaalsContact CD1-CZ 3.43Å; L138-L445 HydrophobicContact CD1-CD2 4.23Å; L138-I477 HydrophobicContact CD2-CG2 4.24Å
139	A	82.1	Confident	70.9	Confident	2 Å²	2	64 Å²	64	2%	0.017	33%	0.327	C	S	.	.	H	α-helix	trans	-59.8	-43.3	175.2	0	0	0	0	0	111.1	D136 V142 G143 L144	D136-A139 HydrophobicContact CB-CB 3.83Å; D136-A139 VanDerWaalsContact CG-CB 3.41Å; D136-A139 PolarHBondContact O-N 2.87Å; D136-A139 PolarHBondContact OD1-N 2.64Å; A139-V142 PolarHBondContact O-N 3.34Å; A139-G143 CarbonylContact O-C 3.56Å; A139-G143 WeakPolarHBondContact O-CA 3.46Å; A139-G143 PolarHBondContact O-N 2.67Å; A139-L144 HydrophobicContact CB-CB 4.07Å; A139-L144 PolarHBondContact O-N 3.17Å
140	D	81.9	Confident	68.1	Low	49 Å²	49	66.9 Å²	66.9	26%	0.262	36%	0.359	S	S	.	.	H	α-helix	trans	-60.9	-49.9	178.1	-68	-6	0	0	0	112.6	H63 S134 D136 L138 V142 G143	H63-D140 HydrophobicContact CB-CB 3.81Å; H63-D140 IonicContact CE1-OD2 3.64Å; H63-D140 IonicContact ND1-OD2 3.59Å; H63-D140 PolarHBondContact ND1-OD2 3.34Å; S134-D140 WeakPolarHBondContact CB-OD2 3.3Å; S134-D140 PolarHBondContact OG-OD1 3.05Å; S134-D140 PolarHBondContact OG-OD2 3.31Å; D136-D140 PolarHBondContact O-N 3.01Å; D136-D140 VanDerWaalsContact O-N 3.15Å; L138-D140 VanDerWaalsContact C-N 3.3Å; L138-D140 PolarHBondContact O-N 3.07Å; D140-V142 VanDerWaalsContact C-N 3.28Å; D140-V142 PolarHBondContact O-N 3.22Å; D140-G143 PolarHBondContact O-N 3.37Å
141	I	85.6	Confident	65.3	Low	0 Å²	0	70.8 Å²	70.8	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-73	-21	-175.2	68.9	174.5	0	0	0	112.9	H63 L66 C67 F137 L138 L742	H63-I141 HydrophobicContact CB-CG2 4.31Å; L66-I141 HydrophobicContact CD2-CB 4.25Å; L66-I141 HydrophobicContact CD2-CG2 3.79Å; C67-I141 WeakPolarHBondContact CA-O 3.31Å; C67-I141 WeakPolarHBondContact CB-O 3.31Å; C67-I141 PolarHBondContact SG-O 3.38Å; F137-I141 HydrophobicContact CD1-CD1 4.4Å; F137-I141 HydrophobicContact CD2-CG2 4.36Å; F137-I141 HydrophobicContact CE1-CD1 3.87Å; F137-I141 HydrophobicContact CE1-CG2 4.23Å; F137-I141 HydrophobicContact CE2-CG2 3.9Å; F137-I141 HydrophobicContact CZ-CD1 4.37Å; F137-I141 HydrophobicContact CZ-CG2 3.83Å; F137-I141 WeakPolarHBondContact O-CG2 3.38Å; F137-I141 PolarHBondContact O-N 2.76Å; L138-I141 HydrophobicContact CD2-CD1 3.91Å; L138-I141 WeakPolarHBondContact O-CG1 3.35Å; L138-I141 PolarHBondContact O-N 2.72Å; I141-L742 HydrophobicContact CD1-CD1 3.84Å
142	V	83.9	Confident	62.4	Low	1 Å²	1	77.1 Å²	77.1	1%	0.006	43%	0.431	C	S	.	.	H	α-helix	trans	-93.3	-15.4	175.3	178.9	0	0	0	0	111.3	L138 A139 D140 L144 V422 L423 L445 I477	L138-V142 WeakPolarHBondContact O-CB 3.46Å; L138-V142 VanDerWaalsContact O-CG2 3.28Å; L138-V142 WeakPolarHBondContact O-CG2 3.34Å; L138-V142 PolarHBondContact O-N 3.21Å; L138-V142 VanDerWaalsContact O-N 3.11Å; A139-V142 PolarHBondContact O-N 3.34Å; D140-V142 VanDerWaalsContact C-N 3.28Å; D140-V142 PolarHBondContact O-N 3.22Å; V142-L144 HydrophobicContact CG1-CD1 4.28Å; V142-L144 HydrophobicContact CG1-CG 4.13Å; V142-V422 HydrophobicContact CG1-CB 4.04Å; V142-V422 PolarHBondContact O-N 2.87Å; V142-L423 HydrophobicContact CG1-CD1 3.77Å; V142-L423 HydrophobicContact CG1-CG 3.94Å; V142-L445 HydrophobicContact CB-CD1 4.46Å; V142-L445 HydrophobicContact CG1-CD1 3.99Å; V142-L445 HydrophobicContact CG2-CD1 4.18Å; V142-I477 HydrophobicContact CG2-CD1 3.82Å
143	G	78.1	Confident	59.7	Low	30 Å²	30	82.7 Å²	82.7	31%	0.309	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	31.2	-178.2	0	0	0	0	0	114	A139 D140 S421	A139-G143 CarbonylContact O-C 3.56Å; A139-G143 WeakPolarHBondContact O-CA 3.46Å; A139-G143 PolarHBondContact O-N 2.67Å; D140-G143 PolarHBondContact O-N 3.37Å; G143-S421 WeakPolarHBondContact O-CB 3.46Å
144	L	73.1	Confident	57.3	Low	40 Å²	40	87.7 Å²	87.7	21%	0.209	49%	0.49	C	S	.	.			trans	-86.3	113.2	173.4	-71.7	172.4	0	0	0	109.5	A139 V142 T146 L423 L445	A139-L144 HydrophobicContact CB-CB 4.07Å; A139-L144 PolarHBondContact O-N 3.17Å; V142-L144 HydrophobicContact CG1-CD1 4.28Å; V142-L144 HydrophobicContact CG1-CG 4.13Å; L144-T146 PolarHBondContact O-N 3.46Å; L144-L423 HydrophobicContact CD1-CD1 3.71Å; L144-L423 HydrophobicContact CD2-CD1 3.66Å; L144-L423 HydrophobicContact CG-CD1 3.92Å; L144-L445 HydrophobicContact CD1-CD1 3.75Å
145	Q	56.7	Low	55.2	Low	177 Å²	177	95.2 Å²	95.2	83%	0.827	52%	0.518	S	S	*	.			trans	-77.2	119.2	174.1	-66.8	-172	-1.8	0	0	110.6	K147	Q145-K147 PolarHBondContact O-N 2.67Å; Q145-K147 VanDerWaalsContact O-N 3.15Å
146	T	40	Very low	52.8	Low	70 Å²	70	95.6 Å²	95.6	43%	0.429	52%	0.515	S	S	.	.			trans	-69.6	102.8	174.8	30.8	0	0	0	0	110.5	L144 Q148 E444	L144-T146 PolarHBondContact O-N 3.46Å; T146-Q148 PolarHBondContact O-N 3.24Å; T146-E444 VanDerWaalsContact CG2-CD 3.46Å; T146-E444 WeakPolarHBondContact CG2-OE2 3.39Å
147	K	35.4	Very low	50.3	Low	188 Å²	188	101.1 Å²	101.1	82%	0.817	54%	0.541	S	S	*	.			trans	-72.2	106.1	163.2	-77.3	-176.5	179.2	176.8	0	108.3	Q145 R149	Q145-K147 PolarHBondContact O-N 2.67Å; Q145-K147 VanDerWaalsContact O-N 3.15Å; K147-R149 PolarHBondContact O-N 3.05Å
148	Q	30.8	Very low	47.3	Very low	194 Å²	194	109 Å²	109	91%	0.907	58%	0.578	S	S	*	*			trans	-61	112.2	172.1	-73.7	-175.7	-0.7	0	0	110.3	T146	T146-Q148 PolarHBondContact O-N 3.24Å
149	R	26.3	Very low	44.4	Very low	248 Å²	248	112 Å²	112	94%	0.936	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-75.6	123.4	173.4	-73.8	-177.4	-176.2	-178	1.8	109.7	K147	K147-R149 PolarHBondContact O-N 3.05Å
150	A	28.7	Very low	41.8	Very low	97 Å²	97	118.4 Å²	118.4	80%	0.802	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-66.5	133.5	166.3	0	0	0	0	0	110
151	G	29.3	Very low	39	Very low	81 Å²	81	123.9 Å²	123.9	84%	0.835	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-86.3	140.2	173.2	0	0	0	0	0	112.2
152	D	26.3	Very low	36.9	Very low	158 Å²	158	129.2 Å²	129.2	85%	0.845	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-75	152.7	-170.3	-67.1	-57.5	0	0	0	116.8
153	L	23.1	Very low	34	Very low	165 Å²	165	134.4 Å²	134.4	86%	0.864	75%	0.753	S	S	*	*			trans	-162.7	163.5	131.7	-135.6	80.3	0	0	0	110.4
154	P	29	Very low	31.6	Very low	116 Å²	116	140.3 Å²	140.3	75%	0.753	78%	0.777	S	S	*	*				-110.2	168.3	-103.4	34.3	-15.9	0	0	0	115.6
155	K	30.4	Very low	29.3	Very low	201 Å²	201	143.6 Å²	143.6	87%	0.874	81%	0.81	S	S	*	*			trans	-49.2	143.5	-175.5	-62.9	168.9	174.1	175.9	0	117.5
156	T	21.7	Very low	28	Very low	136 Å²	136	144.4 Å²	144.4	83%	0.834	81%	0.811	S	S	*	*			trans	-150.5	122.6	130.9	-27.1	0	0	0	0	113.1
157	M	24.3	Very low	27.5	Very low	150 Å²	150	145.4 Å²	145.4	74%	0.739	83%	0.826	S	S	*	*			trans	47.3	122.4	148.3	-69.4	-177.1	75.6	0	0	125.4
158	E	22.1	Very low	27.5	Very low	175 Å²	175	143.1 Å²	143.1	82%	0.818	83%	0.828	S	S	*	*			trans	90.5	120.6	133.4	-73.8	-174.1	178.8	0	0	123.8
159	G	22.8	Very low	28.4	Very low	75 Å²	75	137.3 Å²	137.3	77%	0.773	80%	0.803	S	S	*	*			trans	108	146.9	141.8	0	0	0	0	0	118.5
160	P	28.2	Very low	29.6	Very low	136 Å²	136	130.8 Å²	130.8	88%	0.883	79%	0.786	S	S	*	*			trans	-99.5	153.4	-136.4	36.4	-32.9	0	0	0	118.7
161	L	23.5	Very low	31	Very low	163 Å²	163	127.7 Å²	127.7	85%	0.853	76%	0.756	S	S	*	*			trans	-78.2	175	170.7	-94.4	124.1	0	0	0	113.2
162	P	40.9	Very low	32.2	Very low	112 Å²	112	131.1 Å²	131.1	73%	0.727	75%	0.75	S	S	*	*			cis	-138.8	153.6	-1.4	26.9	-4.3	0	0	0	116.5
163	S	24.3	Very low	33.9	Very low	110 Å²	110	129.1 Å²	129.1	77%	0.769	74%	0.74	S	S	*	*	S	Bend	trans	-159.4	133	138.6	60.9	0	0	0	0	112.9
164	N	26.8	Very low	36.5	Very low	155 Å²	155	123 Å²	123	83%	0.829	71%	0.708	S	S	*	*			trans	63.9	86.1	166.2	-62.6	-13.1	0	0	0	118.5	K166	N164-K166 PolarHBondContact O-N 2.83Å; N164-K166 VanDerWaalsContact O-N 3.14Å
165	A	25.4	Very low	38.8	Very low	108 Å²	108	119 Å²	119	89%	0.893	68%	0.682	S	S	*	*			trans	-69.6	103.3	169.8	0	0	0	0	0	111.7
166	K	28.7	Very low	41.4	Very low	195 Å²	195	109.8 Å²	109.8	85%	0.848	64%	0.642	S	S	*	*			trans	-69.6	123.8	160.6	-75.9	176.7	177.5	173.5	0	108.7	N164 T168	N164-K166 PolarHBondContact O-N 2.83Å; N164-K166 VanDerWaalsContact O-N 3.14Å; K166-T168 PolarHBondContact O-N 3.09Å
167	A	29.8	Very low	44.4	Very low	90 Å²	90	103.9 Å²	103.9	74%	0.744	61%	0.605	S	S	*	*			trans	-65.6	116.3	165.9	0	0	0	0	0	108.9	I169	A167-I169 PolarHBondContact O-N 3.26Å
168	T	35.1	Very low	47.1	Very low	141 Å²	141	103.2 Å²	103.2	87%	0.865	60%	0.6	S	S	*	*			trans	-77.4	93.4	174.6	-48.4	0	0	0	0	108.5	K166 N170	K166-T168 PolarHBondContact O-N 3.09Å; T168-N170 PolarHBondContact O-N 2.83Å
169	I	50.8	Low	50	Low	72 Å²	72	97.6 Å²	97.6	37%	0.369	57%	0.573	S	S	.	*			trans	-63.1	129.2	172.3	-59.8	171.1	0	0	0	107.9	A167 L171	A167-I169 PolarHBondContact O-N 3.26Å; I169-L171 VanDerWaalsContact C-N 3.26Å; I169-L171 HydrophobicContact CB-CD2 4.34Å; I169-L171 HydrophobicContact CB-CG 4.38Å; I169-L171 HydrophobicContact CG2-CD2 3.92Å; I169-L171 HydrophobicContact CG2-CG 4.24Å; I169-L171 PolarHBondContact O-N 3.05Å
170	N	50.5	Low	53	Low	110 Å²	110	94.9 Å²	94.9	59%	0.588	54%	0.539	S	S	*	.			trans	-75.1	82.9	173.1	-171.2	-4.6	0	0	0	109.7	T168 Q172	T168-N170 PolarHBondContact O-N 2.83Å; N170-Q172 PolarHBondContact O-N 2.85Å; N170-Q172 PolarHBondContact OD1-N 3.31Å
171	L	58.1	Low	55.7	Low	33 Å²	33	89.8 Å²	89.8	17%	0.173	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	-67.1	-9.7	-175.2	-66.1	164.6	0	0	0	113.9	I169 N173 I177 K385 A388 E389	I169-L171 VanDerWaalsContact C-N 3.26Å; I169-L171 HydrophobicContact CB-CD2 4.34Å; I169-L171 HydrophobicContact CB-CG 4.38Å; I169-L171 HydrophobicContact CG2-CD2 3.92Å; I169-L171 HydrophobicContact CG2-CG 4.24Å; I169-L171 PolarHBondContact O-N 3.05Å; L171-N173 VanDerWaalsContact C-N 3.34Å; L171-N173 PolarHBondContact O-N 2.83Å; L171-I177 VanDerWaalsContact O-CB 3.3Å; L171-I177 WeakPolarHBondContact O-CB 3.33Å; L171-I177 WeakPolarHBondContact O-CG1 3.39Å; L171-I177 WeakPolarHBondContact O-CG2 3.32Å; L171-K385 HydrophobicContact CD1-CG 4.17Å; L171-A388 HydrophobicContact CD2-CB 3.64Å; L171-E389 HydrophobicContact CD1-CG 4.31Å; L171-E389 HydrophobicContact CD2-CG 4.18Å
172	Q	55.4	Low	58.3	Low	153 Å²	153	85.3 Å²	85.3	72%	0.715	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-72.9	-23.1	-175.7	-87.8	179.1	-23.3	0	0	114.1	N170	N170-Q172 PolarHBondContact O-N 2.85Å; N170-Q172 PolarHBondContact OD1-N 3.31Å
173	N	61.9	Low	60.3	Low	116 Å²	116	88.4 Å²	88.4	62%	0.62	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-98.3	0.1	180	-70.6	-13.2	0	0	0	113.8	L171	L171-N173 VanDerWaalsContact C-N 3.34Å; L171-N173 PolarHBondContact O-N 2.83Å
174	D	76.9	Confident	63.3	Low	37 Å²	37	90.1 Å²	90.1	20%	0.198	49%	0.49	C	S	.	.			trans	-70	132.7	178.4	178.4	-76.7	0	0	0	110.7	I176 I177 Q178 A388	D174-I176 VanDerWaalsContact C-N 3.26Å; D174-I176 PolarHBondContact O-N 3.43Å; D174-I176 WeakPolarHBondContact OD1-CA 3.19Å; D174-I176 WeakPolarHBondContact OD1-CB 3.37Å; D174-I176 PolarHBondContact OD1-N 3.09Å; D174-I177 HydrophobicContact CB-CB 4.2Å; D174-I177 HydrophobicContact CB-CG1 3.89Å; D174-I177 PolarHBondContact O-N 2.82Å; D174-I177 VanDerWaalsContact O-N 3.1Å; D174-I177 PolarHBondContact OD1-N 2.78Å; D174-Q178 WeakPolarHBondContact O-CG 3.22Å; D174-Q178 PolarHBondContact O-N 3.14Å; D174-A388 HydrophobicContact CB-CB 4.14Å
175	P	78.3	Confident	66.2	Low	32 Å²	32	83.7 Å²	83.7	21%	0.208	46%	0.456	C	S	.	.	H	α-helix	trans	-64.8	-27.7	-174.2	26.8	-35.7	0	0	0	113.3	K179 V334	P175-K179 WeakPolarHBondContact O-CB 2.85Å; P175-K179 PolarHBondContact O-N 3.24Å; P175-K179 VanDerWaalsContact O-N 3.13Å; P175-V334 HydrophobicContact CB-CG1 3.88Å; P175-V334 HydrophobicContact CG-CG1 4.19Å
176	I	83.4	Confident	69.2	Low	7 Å²	7	79.7 Å²	79.7	4%	0.036	43%	0.425	C	S	.	.	H	α-helix	trans	-72.3	-40.2	176.1	-50.9	179.1	0	0	0	109.4	D174 K179 Y180 F379 P384 I387	D174-I176 VanDerWaalsContact C-N 3.26Å; D174-I176 PolarHBondContact O-N 3.43Å; D174-I176 WeakPolarHBondContact OD1-CA 3.19Å; D174-I176 WeakPolarHBondContact OD1-CB 3.37Å; D174-I176 PolarHBondContact OD1-N 3.09Å; I176-K179 PolarHBondContact O-N 2.9Å; I176-Y180 HydrophobicContact CG2-CD2 3.85Å; I176-Y180 HydrophobicContact CG2-CE2 4.44Å; I176-Y180 PolarHBondContact O-N 3.48Å; I176-F379 HydrophobicContact CG2-CE2 3.67Å; I176-F379 HydrophobicContact CG2-CZ 3.82Å; I176-P384 HydrophobicContact CG2-CB 3.99Å; I176-I387 HydrophobicContact CD1-CB 4.42Å; I176-I387 HydrophobicContact CD1-CG2 3.61Å
177	I	84.8	Confident	72.3	Confident	11 Å²	11	70.7 Å²	70.7	6%	0.056	39%	0.386	C	S	.	.	H	α-helix	trans	-68.9	-37.7	175.6	-57.5	-61.8	0	0	0	111.7	L171 D174 K179 G181 P384 K385 A388	L171-I177 VanDerWaalsContact O-CB 3.3Å; L171-I177 WeakPolarHBondContact O-CB 3.33Å; L171-I177 WeakPolarHBondContact O-CG1 3.39Å; L171-I177 WeakPolarHBondContact O-CG2 3.32Å; D174-I177 HydrophobicContact CB-CB 4.2Å; D174-I177 HydrophobicContact CB-CG1 3.89Å; D174-I177 PolarHBondContact O-N 2.82Å; D174-I177 VanDerWaalsContact O-N 3.1Å; D174-I177 PolarHBondContact OD1-N 2.78Å; I177-K179 VanDerWaalsContact C-N 3.32Å; I177-K179 PolarHBondContact O-N 2.88Å; I177-G181 WeakPolarHBondContact O-CA 3.24Å; I177-G181 PolarHBondContact O-N 3.49Å; I177-P384 HydrophobicContact CD1-CB 4.05Å; I177-K385 HydrophobicContact CD1-CB 4.44Å; I177-A388 HydrophobicContact CD1-CB 3.92Å; I177-A388 HydrophobicContact CG1-CB 3.73Å
178	Q	82.1	Confident	75.2	Confident	136 Å²	136	69.4 Å²	69.4	64%	0.636	37%	0.369	S	S	*	.	H	α-helix	trans	-63.5	-38.1	174.6	-71.8	178.7	-1.4	0	0	112.2	D174	D174-Q178 WeakPolarHBondContact O-CG 3.22Å; D174-Q178 PolarHBondContact O-N 3.14Å
179	K	83.1	Confident	77.9	Confident	57 Å²	57	70.1 Å²	70.1	25%	0.248	36%	0.356	C	S	.	.	H	α-helix	trans	-79.7	-48.6	-178.3	-175	172.2	-179.4	178.2	0	113.5	P175 I176 I177 E196	P175-K179 WeakPolarHBondContact O-CB 2.85Å; P175-K179 PolarHBondContact O-N 3.24Å; P175-K179 VanDerWaalsContact O-N 3.13Å; I176-K179 PolarHBondContact O-N 2.9Å; I177-K179 VanDerWaalsContact C-N 3.32Å; I177-K179 PolarHBondContact O-N 2.88Å; K179-E196 WeakPolarHBondContact CE-OE1 3.38Å; K179-E196 IonicContact NZ-OE1 3.43Å; K179-E196 PolarHBondContact NZ-OE1 3.3Å; K179-E196 IonicContact NZ-OE2 3.87Å
180	Y	85.4	Confident	79.9	Confident	18 Å²	18	66.9 Å²	66.9	7%	0.071	34%	0.339	C	S	.	.	H	α-helix	trans	-106.6	-10.1	-171	-58.8	-71.9	0	0	0	113.7	I176 V185 R189 L332 F379 P384	I176-Y180 HydrophobicContact CG2-CD2 3.85Å; I176-Y180 HydrophobicContact CG2-CE2 4.44Å; I176-Y180 PolarHBondContact O-N 3.48Å; Y180-V185 WeakPolarHBondContact O-CG1 3.34Å; Y180-R189 HydrophobicContact CD1-CG 4.43Å; Y180-R189 WeakPolarHBondContact CE1-O 3.3Å; Y180-L332 HydrophobicContact CE2-CD1 4.02Å; Y180-F379 HydrophobicContact CD2-CE1 4.44Å; Y180-F379 AromaticContact CD2-CZ 3.73Å; Y180-F379 HydrophobicContact CD2-CZ 3.73Å; Y180-F379 HydrophobicContact CE2-CZ 4.03Å; Y180-F379 HydrophobicContact CG-CZ 4.17Å; Y180-P384 VanDerWaalsContact CB-CG 3.49Å; Y180-P384 HydrophobicContact CG-CG 4.4Å
181	G	84.6	Confident	82	Confident	29 Å²	29	63.1 Å²	63.1	30%	0.299	32%	0.319	S	S	.	.			trans	76.9	177	-173.4	0	0	0	0	0	112.9	I177 P384	I177-G181 WeakPolarHBondContact O-CA 3.24Å; I177-G181 PolarHBondContact O-N 3.49Å; G181-P384 VanDerWaalsContact O-CB 3.22Å; G181-P384 WeakPolarHBondContact O-CB 3.48Å
182	S	79	Confident	83.7	Confident	69 Å²	69	62.2 Å²	62.2	48%	0.483	31%	0.314	S	S	.	.	S	Bend	trans	-84.9	-6	-179.8	-42.4	0	0	0	0	114.5	K385	S182-K385 WeakPolarHBondContact O-CB 3.28Å
183	K	82.7	Confident	85.4	Confident	178 Å²	178	58 Å²	58	77%	0.774	30%	0.299	S	S	*	.	S	Bend	trans	-89.4	155	-179.8	-67.3	-174.6	-179.2	-179.3	0	110.4	V185 P384	K183-V185 PolarHBondContact O-N 3.09Å; K183-P384 WeakPolarHBondContact O-CD 3.44Å
184	K	86.1	Confident	86.7	Confident	145 Å²	145	60.1 Å²	60.1	63%	0.63	30%	0.303	S	S	*	.			trans	-60	133.6	170.6	-171.5	176.4	-179.1	171.9	0	109.2	L380 K381	K184-L380 WeakPolarHBondContact CE-O 3.39Å; K184-K381 VanDerWaalsContact CE-O 3.23Å; K184-K381 WeakPolarHBondContact CE-O 3.29Å; K184-K381 PolarHBondContact NZ-O 3.41Å
185	V	88.9	Confident	87.4	Confident	21 Å²	21	64.5 Å²	64.5	13%	0.127	32%	0.322	C	S	.	.			trans	-113.3	147	-179.4	-64.4	0	0	0	0	110.4	Y180 K183 R189 F379 P384	Y180-V185 WeakPolarHBondContact O-CG1 3.34Å; K183-V185 PolarHBondContact O-N 3.09Å; V185-R189 HydrophobicContact CB-CB 4.06Å; V185-R189 HydrophobicContact CB-CG 4.03Å; V185-R189 HydrophobicContact CG1-CG 4.02Å; V185-F379 HydrophobicContact CG2-CE1 3.88Å; V185-P384 HydrophobicContact CG1-CG 4.45Å; V185-P384 HydrophobicContact CG2-CG 4.14Å
186	G	88.4	Confident	87.9	Confident	23 Å²	23	65.1 Å²	65.1	24%	0.237	32%	0.322	C	S	.	.			trans	-77.5	167.1	172.4	0	0	0	0	0	112.4	T188 R189	G186-T188 VanDerWaalsContact C-N 3.27Å; G186-T188 PolarHBondContact O-N 2.92Å; G186-R189 PolarHBondContact O-N 3.1Å; G186-R189 VanDerWaalsContact O-N 3.12Å
187	L	92.2	Very high	88.3	Confident	7 Å²	7	65 Å²	65	4%	0.037	32%	0.322	C	S	.	.	H	α-helix	trans	-54.3	-43.2	179.6	176.7	165	0	0	0	111.8	R189 C190 L191 I222 D224 L228 V306 I327 L380	L187-R189 PolarHBondContact O-N 3.09Å; L187-R189 VanDerWaalsContact O-N 3.14Å; L187-C190 WeakPolarHBondContact O-CA 3.25Å; L187-C190 WeakPolarHBondContact O-CB 3.46Å; L187-C190 PolarHBondContact O-N 3.24Å; L187-L191 HydrophobicContact CD2-CD2 4.33Å; L187-L191 HydrophobicContact CD2-CG 4.42Å; L187-L191 PolarHBondContact O-N 3.45Å; L187-I222 HydrophobicContact CD2-CG2 3.97Å; L187-D224 PolarHBondContact N-OD1 3.2Å; L187-L228 HydrophobicContact CD1-CD2 3.5Å; L187-L228 HydrophobicContact CD1-CG 4.02Å; L187-L228 HydrophobicContact CG-CD2 4.2Å; L187-V306 HydrophobicContact CD2-CG1 4.49Å; L187-V306 HydrophobicContact CD2-CG2 4.04Å; L187-I327 HydrophobicContact CD2-CD1 4.47Å; L187-I327 HydrophobicContact CG-CD1 4.07Å; L187-L380 HydrophobicContact CB-CD1 4.2Å; L187-L380 HydrophobicContact CB-CD2 4.26Å
188	T	90.9	Very high	88.5	Confident	62 Å²	62	72.2 Å²	72.2	38%	0.38	35%	0.348	S	S	.	.	H	α-helix	trans	-57.2	-30.7	-179.2	50.3	0	0	0	0	113.1	G186 I222 D224	G186-T188 VanDerWaalsContact C-N 3.27Å; G186-T188 PolarHBondContact O-N 2.92Å; T188-I222 HydrophobicContact CG2-CG2 4.09Å; T188-D224 WeakPolarHBondContact CB-OD1 3.45Å; T188-D224 VanDerWaalsContact CG2-OD1 3.31Å; T188-D224 WeakPolarHBondContact CG2-OD1 3.23Å; T188-D224 PolarHBondContact N-OD1 3.08Å; T188-D224 PolarHBondContact OG1-OD1 3.47Å
189	R	91.6	Very high	88.9	Confident	157 Å²	157	70.2 Å²	70.2	59%	0.592	35%	0.345	S	S	*	.	H	α-helix	trans	-80.8	-17.1	177.9	-173.9	58	177.6	179.9	4.9	113.1	Y180 V185 G186 L187	Y180-R189 HydrophobicContact CD1-CG 4.43Å; Y180-R189 WeakPolarHBondContact CE1-O 3.3Å; V185-R189 HydrophobicContact CB-CB 4.06Å; V185-R189 HydrophobicContact CB-CG 4.03Å; V185-R189 HydrophobicContact CG1-CG 4.02Å; G186-R189 PolarHBondContact O-N 3.1Å; G186-R189 VanDerWaalsContact O-N 3.12Å; L187-R189 PolarHBondContact O-N 3.09Å; L187-R189 VanDerWaalsContact O-N 3.14Å
190	C	92.6	Very high	89.1	Confident	3 Å²	3	70.3 Å²	70.3	2%	0.02	35%	0.346	C	S	.	.	H	α-helix	trans	-88.9	-8.6	176.4	-66.4	0	0	0	0	113.3	L187 I327 L332	L187-C190 WeakPolarHBondContact O-CA 3.25Å; L187-C190 WeakPolarHBondContact O-CB 3.46Å; L187-C190 PolarHBondContact O-N 3.24Å; C190-I327 HydrophobicContact CB-CD1 4.1Å; C190-I327 HydrophobicContact CB-CG1 4.44Å; C190-L332 HydrophobicContact CB-CD1 4.16Å
191	L	94.9	Very high	89.3	Confident	32 Å²	32	75.4 Å²	75.4	17%	0.168	37%	0.37	C	S	.	.	S	Bend	trans	-66.7	140	174.8	-63.7	170.9	0	0	0	110.9	L187 I222 V306 I327	L187-L191 HydrophobicContact CD2-CD2 4.33Å; L187-L191 HydrophobicContact CD2-CG 4.42Å; L187-L191 PolarHBondContact O-N 3.45Å; L191-I222 HydrophobicContact CD1-CB 4.42Å; L191-I222 HydrophobicContact CD1-CG2 3.87Å; L191-V306 HydrophobicContact CD2-CG1 3.74Å; L191-V306 HydrophobicContact CD2-CG2 4.32Å; L191-I327 HydrophobicContact CD2-CD1 4.46Å; L191-I327 HydrophobicContact CD2-CG1 3.95Å
192	L	93.5	Very high	89.8	Confident	13 Å²	13	74.3 Å²	74.3	7%	0.068	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-66.9	133.7	172	-62.8	179.3	0	0	0	110.6	E196 M197 F202 V326 D328 L331	L192-E196 WeakPolarHBondContact CA-OE2 3.48Å; L192-E196 HydrophobicContact CB-CB 4.48Å; L192-E196 HydrophobicContact CD2-CB 4.44Å; L192-M197 HydrophobicContact CB-CG 3.73Å; L192-M197 HydrophobicContact CD1-CG 4.31Å; L192-F202 HydrophobicContact CD1-CD2 4.22Å; L192-F202 HydrophobicContact CD1-CE1 4.29Å; L192-F202 HydrophobicContact CD1-CE2 3.62Å; L192-F202 HydrophobicContact CD1-CZ 3.67Å; L192-V326 HydrophobicContact CD1-CB 4.4Å; L192-V326 HydrophobicContact CD1-CG1 3.99Å; L192-V326 PolarHBondContact N-O 3.43Å; L192-D328 HydrophobicContact CD1-CB 4.17Å; L192-L331 HydrophobicContact CD1-CD1 4.04Å; L192-L331 HydrophobicContact CD2-CB 4.41Å; L192-L331 HydrophobicContact CD2-CD1 3.89Å
193	T	92.4	Very high	90.4	Very high	65 Å²	65	71.1 Å²	71.1	40%	0.399	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-73	162.3	171	80	0	0	0	0	110.9	E195 E196 M197	T193-E195 PolarHBondContact O-N 2.87Å; T193-E195 PolarHBondContact OG1-N 3.33Å; T193-E195 PolarHBondContact OG1-OE2 3.17Å; T193-E196 PolarHBondContact N-OE2 2.76Å; T193-E196 PolarHBondContact O-N 2.92Å; T193-E196 VanDerWaalsContact O-N 3.14Å; T193-E196 WeakPolarHBondContact OG1-CG 3.48Å; T193-E196 PolarHBondContact OG1-N 3.47Å; T193-M197 WeakPolarHBondContact O-CB 3.47Å; T193-M197 WeakPolarHBondContact O-CG 3.47Å; T193-M197 PolarHBondContact O-N 3.39Å
194	K	89.4	Confident	90.8	Very high	161 Å²	161	63.9 Å²	63.9	70%	0.7	30%	0.304	S	S	*	.	H	α-helix	trans	-58.6	-35.6	175.7	-71.5	-177	178.6	177.3	0	112.1	R198	K194-R198 WeakPolarHBondContact O-CB 3.31Å; K194-R198 PolarHBondContact O-N 3.09Å
195	E	90.1	Very high	90.7	Very high	129 Å²	129	64.4 Å²	64.4	60%	0.603	31%	0.309	S	S	*	.	H	α-helix	trans	-68.3	-41.1	176.6	-63.4	70	-150.4	0	0	111.8	T193 R198 T199	T193-E195 PolarHBondContact O-N 2.87Å; T193-E195 PolarHBondContact OG1-N 3.33Å; T193-E195 PolarHBondContact OG1-OE2 3.17Å; E195-R198 WeakPolarHBondContact O-CB 3.28Å; E195-R198 PolarHBondContact O-N 3.42Å; E195-T199 WeakPolarHBondContact O-CB 3.3Å; E195-T199 PolarHBondContact O-N 3.45Å; E195-T199 PolarHBondContact O-OG1 3.45Å
196	E	90	Very high	90.2	Very high	44 Å²	44	67.1 Å²	67.1	21%	0.206	34%	0.341	C	S	.	.	H	α-helix	trans	-66.3	-46	175	-70.1	-179.5	133.1	0	0	110.9	K179 L192 T193 R198 T199 F200	K179-E196 WeakPolarHBondContact CE-OE1 3.38Å; K179-E196 IonicContact NZ-OE1 3.43Å; K179-E196 PolarHBondContact NZ-OE1 3.3Å; K179-E196 IonicContact NZ-OE2 3.87Å; L192-E196 WeakPolarHBondContact CA-OE2 3.48Å; L192-E196 HydrophobicContact CB-CB 4.48Å; L192-E196 HydrophobicContact CD2-CB 4.44Å; T193-E196 PolarHBondContact N-OE2 2.76Å; T193-E196 PolarHBondContact O-N 2.92Å; T193-E196 VanDerWaalsContact O-N 3.14Å; T193-E196 WeakPolarHBondContact OG1-CG 3.48Å; T193-E196 PolarHBondContact OG1-N 3.47Å; E196-R198 PolarHBondContact O-N 3.01Å; E196-T199 PolarHBondContact O-N 3.2Å; E196-T199 VanDerWaalsContact O-N 3.07Å; E196-F200 HydrophobicContact CB-CD2 4.43Å; E196-F200 WeakPolarHBondContact O-CD2 3.31Å; E196-F200 PolarHBondContact O-N 3.47Å
197	M	91.3	Very high	89.8	Confident	5 Å²	5	69.3 Å²	69.3	3%	0.025	34%	0.344	C	S	.	.	H	α-helix	trans	-55.2	-41	173.8	-71.8	-176.4	85.2	0	0	111.3	L192 T193 H201 F202 L204 V326	L192-M197 HydrophobicContact CB-CG 3.73Å; L192-M197 HydrophobicContact CD1-CG 4.31Å; T193-M197 WeakPolarHBondContact O-CB 3.47Å; T193-M197 WeakPolarHBondContact O-CG 3.47Å; T193-M197 PolarHBondContact O-N 3.39Å; M197-H201 PolarHBondContact O-N 3.21Å; M197-H201 VanDerWaalsContact O-N 3.13Å; M197-F202 HydrophobicContact CB-CB 3.89Å; M197-F202 HydrophobicContact CB-CG 4.38Å; M197-F202 HydrophobicContact CE-CB 3.9Å; M197-F202 HydrophobicContact CE-CD1 4.25Å; M197-F202 HydrophobicContact CE-CG 4.25Å; M197-F202 HydrophobicContact CG-CB 4.26Å; M197-F202 HydrophobicContact CG-CG 4.36Å; M197-F202 WeakPolarHBondContact O-CB 3.32Å; M197-F202 PolarHBondContact O-N 2.94Å; M197-L204 HydrophobicContact CB-CD1 4.17Å; M197-L204 HydrophobicContact CB-CD2 3.98Å; M197-L204 HydrophobicContact CB-CG 4.33Å; M197-L204 HydrophobicContact CE-CD2 4.1Å; M197-L204 HydrophobicContact SD-CD2 4.09Å; M197-V326 HydrophobicContact CE-CG2 4.14Å
198	R	90.1	Very high	89.1	Confident	163 Å²	163	73.7 Å²	73.7	62%	0.615	37%	0.373	S	S	*	.	H	α-helix	trans	-65.6	-45.1	174.8	-174.1	-179.4	-174.7	146.4	3.1	112.2	K194 E195 E196 F200 H201 L204 F207	K194-R198 WeakPolarHBondContact O-CB 3.31Å; K194-R198 PolarHBondContact O-N 3.09Å; E195-R198 WeakPolarHBondContact O-CB 3.28Å; E195-R198 PolarHBondContact O-N 3.42Å; E196-R198 PolarHBondContact O-N 3.01Å; R198-F200 VanDerWaalsContact C-N 3.32Å; R198-F200 PolarHBondContact O-N 2.99Å; R198-H201 PolarHBondContact O-N 3.46Å; R198-L204 HydrophobicContact CB-CD1 3.88Å; R198-F207 HydrophobicContact CG-CZ 4.07Å
199	T	89.1	Confident	88.4	Confident	93 Å²	93	77.9 Å²	77.9	57%	0.571	39%	0.388	S	S	*	.	H	α-helix	trans	-63	-39.6	-179.3	-57.8	0	0	0	0	111.6	E195 E196 H201	E195-T199 WeakPolarHBondContact O-CB 3.3Å; E195-T199 PolarHBondContact O-N 3.45Å; E195-T199 PolarHBondContact O-OG1 3.45Å; E196-T199 PolarHBondContact O-N 3.2Å; E196-T199 VanDerWaalsContact O-N 3.07Å; T199-H201 VanDerWaalsContact C-N 3.33Å; T199-H201 PolarHBondContact O-CE1 3.32Å; T199-H201 PolarHBondContact O-ND1 3.33Å
200	F	88.1	Confident	87.9	Confident	59 Å²	59	70.8 Å²	70.8	26%	0.259	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	18.9	179.5	-61.7	-67.8	0	0	0	113.5	E196 R198 F202 L331	E196-F200 HydrophobicContact CB-CD2 4.43Å; E196-F200 WeakPolarHBondContact O-CD2 3.31Å; E196-F200 PolarHBondContact O-N 3.47Å; R198-F200 VanDerWaalsContact C-N 3.32Å; R198-F200 PolarHBondContact O-N 2.99Å; F200-F202 VanDerWaalsContact C-N 3.28Å; F200-F202 HydrophobicContact CB-CD2 4Å; F200-F202 HydrophobicContact CB-CE2 3.95Å; F200-F202 PolarHBondContact O-N 2.97Å; F200-L331 HydrophobicContact CB-CD1 4.17Å; F200-L331 HydrophobicContact CD1-CD1 4.41Å; F200-L331 HydrophobicContact CD1-CD2 3.96Å; F200-L331 HydrophobicContact CD2-CD1 3.57Å; F200-L331 HydrophobicContact CD2-CD2 4.25Å; F200-L331 HydrophobicContact CE1-CD2 3.83Å; F200-L331 HydrophobicContact CE2-CD1 4.04Å; F200-L331 HydrophobicContact CE2-CD2 4.14Å; F200-L331 HydrophobicContact CG-CD1 3.79Å; F200-L331 HydrophobicContact CG-CD2 4.18Å; F200-L331 HydrophobicContact CZ-CD2 3.93Å
201	H	90.3	Very high	87.1	Confident	126 Å²	126	77.8 Å²	77.8	58%	0.583	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	31.5	170.1	-54.1	78.9	0	0	0	114.9	M197 R198 T199 R317	M197-H201 PolarHBondContact O-N 3.21Å; M197-H201 VanDerWaalsContact O-N 3.13Å; R198-H201 PolarHBondContact O-N 3.46Å; T199-H201 VanDerWaalsContact C-N 3.33Å; T199-H201 PolarHBondContact O-CE1 3.32Å; T199-H201 PolarHBondContact O-ND1 3.33Å; H201-R317 VanDerWaalsContact O-CZ 3.24Å; H201-R317 PolarHBondContact O-NE 2.85Å; H201-R317 PolarHBondContact O-NH2 3.02Å
202	F	93.4	Very high	86.7	Confident	6 Å²	6	83.4 Å²	83.4	3%	0.026	43%	0.425	C	S	.	.			trans	-66.5	148.6	169.4	-79	-98.7	0	0	0	111.2	L192 M197 F200 L204 L312 D313 L316 V326 D328 L331	L192-F202 HydrophobicContact CD1-CD2 4.22Å; L192-F202 HydrophobicContact CD1-CE1 4.29Å; L192-F202 HydrophobicContact CD1-CE2 3.62Å; L192-F202 HydrophobicContact CD1-CZ 3.67Å; M197-F202 HydrophobicContact CB-CB 3.89Å; M197-F202 HydrophobicContact CB-CG 4.38Å; M197-F202 HydrophobicContact CE-CB 3.9Å; M197-F202 HydrophobicContact CE-CD1 4.25Å; M197-F202 HydrophobicContact CE-CG 4.25Å; M197-F202 HydrophobicContact CG-CB 4.26Å; M197-F202 HydrophobicContact CG-CG 4.36Å; M197-F202 WeakPolarHBondContact O-CB 3.32Å; M197-F202 PolarHBondContact O-N 2.94Å; F200-F202 VanDerWaalsContact C-N 3.28Å; F200-F202 HydrophobicContact CB-CD2 4Å; F200-F202 HydrophobicContact CB-CE2 3.95Å; F200-F202 PolarHBondContact O-N 2.97Å; F202-L204 PolarHBondContact O-N 3.16Å; F202-L312 HydrophobicContact CE1-CB 4.03Å; F202-L312 HydrophobicContact CZ-CB 4.48Å; F202-D313 HydrophobicContact CD1-CB 3.99Å; F202-D313 HydrophobicContact CD2-CB 3.88Å; F202-D313 HydrophobicContact CE1-CB 3.94Å; F202-D313 VanDerWaalsContact CE1-N 3.3Å; F202-D313 HydrophobicContact CE2-CB 3.85Å; F202-D313 HydrophobicContact CG-CB 3.95Å; F202-D313 HydrophobicContact CZ-CB 3.88Å; F202-L316 HydrophobicContact CD1-CD1 4.1Å; F202-L316 HydrophobicContact CE1-CD1 4.44Å; F202-V326 HydrophobicContact CE1-CG1 3.8Å; F202-V326 HydrophobicContact CZ-CG1 4.29Å; F202-D328 HydrophobicContact CZ-CB 4.16Å; F202-D328 WeakPolarHBondContact CZ-OD2 3.43Å; F202-L331 HydrophobicContact CE2-CD1 4.2Å
203	P	92.6	Very high	86.6	Confident	1 Å²	1	84.6 Å²	84.6	1%	0.006	43%	0.43	C	S	.	.			trans	-60	123.7	172.2	-25.3	36.4	0	0	0	111.7	F213 L316 R317 I322	P203-F213 HydrophobicContact CB-CD2 3.73Å; P203-F213 HydrophobicContact CB-CE2 3.89Å; P203-F213 HydrophobicContact CG-CD2 4.12Å; P203-F213 HydrophobicContact CG-CE2 3.83Å; P203-L316 HydrophobicContact CG-CB 3.88Å; P203-R317 HydrophobicContact CG-CG 3.74Å; P203-I322 HydrophobicContact CB-CG1 3.77Å
204	L	90.3	Very high	86.6	Confident	26 Å²	26	85.3 Å²	85.3	14%	0.136	43%	0.431	C	S	.	.			trans	-129.2	146.9	-179.8	-71.5	175.8	0	0	0	110.7	M197 R198 F202 F207	M197-L204 HydrophobicContact CB-CD1 4.17Å; M197-L204 HydrophobicContact CB-CD2 3.98Å; M197-L204 HydrophobicContact CB-CG 4.33Å; M197-L204 HydrophobicContact CE-CD2 4.1Å; M197-L204 HydrophobicContact SD-CD2 4.09Å; R198-L204 HydrophobicContact CB-CD1 3.88Å; F202-L204 PolarHBondContact O-N 3.16Å; L204-F207 HydrophobicContact CB-CD2 3.56Å; L204-F207 HydrophobicContact CB-CE2 3.62Å; L204-F207 HydrophobicContact CD1-CE2 3.91Å; L204-F207 HydrophobicContact CD1-CZ 4.45Å; L204-F207 HydrophobicContact CG-CE2 4.44Å
205	Q	85.2	Confident	86.7	Confident	156 Å²	156	81.2 Å²	81.2	73%	0.729	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	137.5	179.2	-167.7	175.8	18.2	0	0	110.9
206	G	78	Confident	86.7	Confident	78 Å²	78	75.4 Å²	75.4	80%	0.804	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.2	2.1	177.8	0	0	0	0	0	115.5
207	F	80.4	Confident	86.4	Confident	70 Å²	70	79.4 Å²	79.4	31%	0.307	41%	0.407	S	S	.	.			trans	-90.8	136.2	172.4	-74.4	-96.6	0	0	0	111.3	R198 L204 E209 C210 E211	R198-F207 HydrophobicContact CG-CZ 4.07Å; L204-F207 HydrophobicContact CB-CD2 3.56Å; L204-F207 HydrophobicContact CB-CE2 3.62Å; L204-F207 HydrophobicContact CD1-CE2 3.91Å; L204-F207 HydrophobicContact CD1-CZ 4.45Å; L204-F207 HydrophobicContact CG-CE2 4.44Å; F207-E209 PolarHBondContact O-N 3.13Å; F207-E209 VanDerWaalsContact O-N 3.13Å; F207-C210 PolarHBondContact O-N 2.91Å; F207-E211 PolarHBondContact O-N 2.92Å
208	P	77.9	Confident	85.9	Confident	99 Å²	99	79.6 Å²	79.6	64%	0.643	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-55	-34.7	-177	-28	34.5	0	0	0	114.3	C210	P208-C210 PolarHBondContact O-N 3.22Å
209	E	75.4	Confident	85.4	Confident	149 Å²	149	78.3 Å²	78.3	70%	0.696	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-70.7	-17.3	-179.9	-63.9	176.5	-157.3	0	0	113.6	F207 R317	F207-E209 PolarHBondContact O-N 3.13Å; F207-E209 VanDerWaalsContact O-N 3.13Å; E209-R317 IonicContact OE2-NH1 3.8Å
210	C	81.5	Confident	85	Confident	9 Å²	9	74.7 Å²	74.7	6%	0.061	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-116	10.4	-174.7	-61.5	0	0	0	0	113	F207 P208 N212 F213 I322	F207-C210 PolarHBondContact O-N 2.91Å; P208-C210 PolarHBondContact O-N 3.22Å; C210-N212 PolarHBondContact O-N 3.29Å; C210-N212 VanDerWaalsContact O-N 3.1Å; C210-F213 HydrophobicContact CB-CB 4.41Å; C210-F213 HydrophobicContact CB-CD1 4.46Å; C210-F213 HydrophobicContact CB-CD2 4.27Å; C210-F213 HydrophobicContact CB-CG 4.14Å; C210-F213 WeakPolarHBondContact O-CB 3.42Å; C210-F213 PolarHBondContact O-N 3.1Å; C210-I322 HydrophobicContact CB-CD1 4.32Å
211	E	76.2	Confident	84.8	Confident	150 Å²	150	77.3 Å²	77.3	70%	0.701	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-32.3	-177.2	-77.6	178.4	-175.2	0	0	113.4	F207	F207-E211 PolarHBondContact O-N 2.92Å
212	N	84.7	Confident	84.8	Confident	149 Å²	149	72.6 Å²	72.6	80%	0.797	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	11.4	-179	-64.4	-54.4	0	0	0	113.9	C210	C210-N212 PolarHBondContact O-N 3.29Å; C210-N212 VanDerWaalsContact O-N 3.1Å
213	F	92.9	Very high	84.7	Confident	39 Å²	39	74.3 Å²	74.3	17%	0.171	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-88.6	145.4	-176.5	-76.2	31.7	0	0	0	111.1	P203 C210 R317 K320 I322	P203-F213 HydrophobicContact CB-CD2 3.73Å; P203-F213 HydrophobicContact CB-CE2 3.89Å; P203-F213 HydrophobicContact CG-CD2 4.12Å; P203-F213 HydrophobicContact CG-CE2 3.83Å; C210-F213 HydrophobicContact CB-CB 4.41Å; C210-F213 HydrophobicContact CB-CD1 4.46Å; C210-F213 HydrophobicContact CB-CD2 4.27Å; C210-F213 HydrophobicContact CB-CG 4.14Å; C210-F213 WeakPolarHBondContact O-CB 3.42Å; C210-F213 PolarHBondContact O-N 3.1Å; F213-R317 HydrophobicContact CE2-CG 4.4Å; F213-K320 CarbonylContact C-O 3.58Å; F213-K320 VanDerWaalsContact CA-O 3.25Å; F213-K320 WeakPolarHBondContact CA-O 3.34Å; F213-K320 WeakPolarHBondContact CB-O 3.47Å; F213-K320 HydrophobicContact CD1-CB 3.86Å; F213-K320 HydrophobicContact CD1-CG 4.33Å; F213-K320 VanDerWaalsContact CD2-C 3.47Å; F213-K320 HydrophobicContact CD2-CB 4.4Å; F213-K320 HydrophobicContact CE1-CB 3.95Å; F213-K320 HydrophobicContact CE1-CG 3.93Å; F213-K320 HydrophobicContact CE2-CB 4.49Å; F213-K320 HydrophobicContact CG-CB 4.1Å; F213-K320 HydrophobicContact CZ-CB 4.27Å; F213-K320 HydrophobicContact CZ-CG 4.2Å; F213-I322 HydrophobicContact CB-CD1 3.93Å; F213-I322 HydrophobicContact CB-CG1 3.92Å; F213-I322 HydrophobicContact CD2-CG1 4.36Å
214	L	92.6	Very high	84.5	Confident	80 Å²	80	78.6 Å²	78.6	42%	0.419	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	131	-179.1	-64.9	-179	0	0	0	111.8	Q294 K320 M321 I322	L214-Q294 HydrophobicContact CD1-CB 4.08Å; L214-Q294 HydrophobicContact CD1-CG 4.38Å; L214-K320 PolarHBondContact N-O 3.32Å; L214-M321 HydrophobicContact CB-CG 4.33Å; L214-M321 CarbonylContact O-C 3.56Å; L214-M321 WeakPolarHBondContact O-CA 3.3Å; L214-I322 PolarHBondContact O-N 3.02Å
215	L	91.8	Very high	84.5	Confident	75 Å²	75	84 Å²	84	39%	0.393	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	134.3	172.1	-165.6	72.1	0	0	0	111	K298 I322	L215-K298 WeakPolarHBondContact O-CE 3.21Å; L215-K298 PolarHBondContact O-NZ 3.39Å; L215-I322 WeakPolarHBondContact CA-O 3.49Å; L215-I322 HydrophobicContact CD1-CB 3.87Å; L215-I322 HydrophobicContact CD1-CG2 3.61Å
216	T	89.4	Confident	84.9	Confident	6 Å²	6	76.6 Å²	76.6	4%	0.037	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-62.2	158.7	166.6	53.8	0	0	0	0	111.4	C218 L301 M321 I322 H323	T216-C218 PolarHBondContact O-N 3.49Å; T216-L301 HydrophobicContact CG2-CD1 4.02Å; T216-M321 HydrophobicContact CG2-CE 3.49Å; T216-M321 VanDerWaalsContact CG2-CE 3.49Å; T216-I322 PolarHBondContact N-O 3.3Å; T216-I322 PolarHBondContact OG1-O 3.33Å; T216-H323 HydrophobicContact CG2-CB 3.97Å; T216-H323 PolarHBondContact OG1-ND1 3.45Å
217	K	84.5	Confident	85.7	Confident	129 Å²	129	74.6 Å²	74.6	56%	0.561	40%	0.404	S	S	*	.	S	Bend	trans	-76.7	19	178.3	-70	-177.3	179.4	176.9	0	114.2	N219 K298	K217-N219 PolarHBondContact O-N 3.15Å; K217-N219 VanDerWaalsContact O-N 3.12Å; K217-N219 PolarHBondContact O-OD1 3.15Å; K217-K298 HydrophobicContact CD-CG 4.16Å; K217-K298 HydrophobicContact CG-CD 4.16Å; K217-K298 HydrophobicContact CG-CG 3.7Å
218	C	79.1	Confident	86.5	Confident	9 Å²	9	71.4 Å²	71.4	6%	0.061	39%	0.391	C	S	.	.			trans	-86.8	92	-169.9	-52.4	0	0	0	0	110.5	T216 P302 P303 H323 P324 Y325	T216-C218 PolarHBondContact O-N 3.49Å; C218-P302 PolarHBondContact SG-O 2.83Å; C218-P303 CarbonylContact C-O 3.4Å; C218-P303 VanDerWaalsContact C-O 3.27Å; C218-P303 WeakPolarHBondContact CA-O 3.44Å; C218-P303 WeakPolarHBondContact CB-O 3.49Å; C218-H323 PolarHBondContact SG-CE1 3.41Å; C218-P324 HydrophobicContact CB-CG 4.23Å; C218-P324 WeakPolarHBondContact O-CG 3.31Å; C218-Y325 HydrophobicContact CB-CD2 3.95Å; C218-Y325 HydrophobicContact CB-CE2 3.97Å
219	N	80	Confident	87.4	Confident	136 Å²	136	67.7 Å²	67.7	73%	0.727	37%	0.365	S	S	*	.			trans	-124.7	8.8	179.3	62.5	-9.8	0	0	0	112.7	K217 P303	K217-N219 PolarHBondContact O-N 3.15Å; K217-N219 VanDerWaalsContact O-N 3.12Å; K217-N219 PolarHBondContact O-OD1 3.15Å; N219-P303 PolarHBondContact N-O 2.91Å; N219-P303 VanDerWaalsContact N-O 3.13Å
220	G	79.9	Confident	88.5	Confident	17 Å²	17	60.6 Å²	60.6	18%	0.175	33%	0.331	C	S	.	.	S	Bend	trans	-74.7	158.1	177.1	0	0	0	0	0	112.4	I222 P303 Y325	G220-I222 PolarHBondContact O-N 3.4Å; G220-P303 PolarHBondContact N-O 3.38Å; G220-Y325 PolarHBondContact O-OH 3.16Å
221	S	84.4	Confident	89.3	Confident	114 Å²	114	60.2 Å²	60.2	80%	0.797	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-72.2	122.5	172	-177.3	0	0	0	0	109.7
222	I	91.3	Very high	90.3	Very high	27 Å²	27	53.9 Å²	53.9	14%	0.138	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-79.7	127.9	177.4	-57.1	-59.6	0	0	0	110.5	L187 T188 L191 G220 D304 V306 Y325	L187-I222 HydrophobicContact CD2-CG2 3.97Å; T188-I222 HydrophobicContact CG2-CG2 4.09Å; L191-I222 HydrophobicContact CD1-CB 4.42Å; L191-I222 HydrophobicContact CD1-CG2 3.87Å; G220-I222 PolarHBondContact O-N 3.4Å; I222-D304 HydrophobicContact CD1-CB 4Å; I222-D304 WeakPolarHBondContact CD1-O 3.46Å; I222-V306 HydrophobicContact CD1-CG2 4.02Å; I222-V306 HydrophobicContact CG2-CG2 4.16Å; I222-Y325 HydrophobicContact CD1-CD1 4.15Å; I222-Y325 HydrophobicContact CD1-CD2 3.5Å; I222-Y325 HydrophobicContact CD1-CE1 4.34Å; I222-Y325 HydrophobicContact CD1-CE2 3.74Å; I222-Y325 HydrophobicContact CD1-CG 3.72Å; I222-Y325 HydrophobicContact CG1-CD1 3.44Å; I222-Y325 VanDerWaalsContact CG1-CD1 3.44Å; I222-Y325 HydrophobicContact CG1-CD2 3.74Å; I222-Y325 HydrophobicContact CG1-CE1 3.5Å; I222-Y325 VanDerWaalsContact CG1-CE1 3.5Å; I222-Y325 HydrophobicContact CG1-CE2 3.81Å; I222-Y325 HydrophobicContact CG1-CG 3.55Å
223	A	90.5	Very high	90.9	Very high	41 Å²	41	47 Å²	47	34%	0.339	26%	0.263	S	S	.	.			trans	-119.5	169.5	170	0	0	0	0	0	111.1	N225 S226	A223-N225 VanDerWaalsContact CB-OD1 3.25Å; A223-N225 WeakPolarHBondContact CB-OD1 3.23Å; A223-N225 PolarHBondContact O-N 2.88Å; A223-S226 PolarHBondContact N-OG 3.07Å; A223-S226 WeakPolarHBondContact O-CB 3.11Å; A223-S226 PolarHBondContact O-N 2.82Å; A223-S226 PolarHBondContact O-OG 3.24Å
224	D	89.6	Confident	91.1	Very high	92 Å²	92	45.7 Å²	45.7	49%	0.492	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-9.9	-176.1	-75.6	-21.7	0	0	0	114.5	L187 T188	L187-D224 PolarHBondContact N-OD1 3.2Å; T188-D224 WeakPolarHBondContact CB-OD1 3.45Å; T188-D224 VanDerWaalsContact CG2-OD1 3.31Å; T188-D224 WeakPolarHBondContact CG2-OD1 3.23Å; T188-D224 PolarHBondContact N-OD1 3.08Å; T188-D224 PolarHBondContact OG1-OD1 3.47Å
225	N	89.3	Confident	91.2	Very high	138 Å²	138	42.9 Å²	42.9	74%	0.738	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105	12.8	174.7	67	-29.2	0	0	0	113.4	A223	A223-N225 VanDerWaalsContact CB-OD1 3.25Å; A223-N225 WeakPolarHBondContact CB-OD1 3.23Å; A223-N225 PolarHBondContact O-N 2.88Å
226	S	94.2	Very high	91.4	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.014	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-66.9	144.5	177.9	-50.4	0	0	0	0	110.7	A223 L228 D304	A223-S226 PolarHBondContact N-OG 3.07Å; A223-S226 WeakPolarHBondContact O-CB 3.11Å; A223-S226 PolarHBondContact O-N 2.82Å; A223-S226 PolarHBondContact O-OG 3.24Å; S226-L228 PolarHBondContact O-N 3.33Å; S226-D304 WeakPolarHBondContact CB-O 3.45Å
227	P	94.5	Very high	91.7	Very high	35 Å²	35	42.4 Å²	42.4	23%	0.227	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-70.6	130.9	-172.6	27.5	-34.2	0	0	0	112.5	F229 P302 D304 V306	P227-F229 HydrophobicContact CB-CE2 3.8Å; P227-F229 HydrophobicContact CB-CZ 4.38Å; P227-F229 HydrophobicContact CG-CE2 3.98Å; P227-P302 HydrophobicContact CG-CG 3.75Å; P227-D304 WeakPolarHBondContact CD-OD2 3.46Å; P227-V306 PolarHBondContact O-N 2.83Å
228	L	96.8	Very high	92.1	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.016	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	137.5	175.8	-63.2	177.6	0	0	0	111.5	L187 S226 E252 V306 V308 I327 L373 Q377 L380	L187-L228 HydrophobicContact CD1-CD2 3.5Å; L187-L228 HydrophobicContact CD1-CG 4.02Å; L187-L228 HydrophobicContact CG-CD2 4.2Å; S226-L228 PolarHBondContact O-N 3.33Å; L228-E252 PolarHBondContact O-N 3.07Å; L228-V306 HydrophobicContact CD2-CB 3.92Å; L228-V306 HydrophobicContact CD2-CG1 3.76Å; L228-V308 HydrophobicContact CB-CG2 4.09Å; L228-V308 HydrophobicContact CD2-CG2 3.75Å; L228-V308 HydrophobicContact CG-CG2 4.36Å; L228-I327 HydrophobicContact CD2-CD1 4.12Å; L228-L373 HydrophobicContact CB-CD2 3.71Å; L228-Q377 HydrophobicContact CD1-CG 4.25Å; L228-L380 HydrophobicContact CD1-CD1 4.2Å
229	F	97.9	Very high	92.6	Very high	22 Å²	22	40.2 Å²	40.2	10%	0.096	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	118.9	174.3	-66.4	-93.6	0	0	0	110.9	P227 L249 V250 A251 L301 P302 A305 V306 L307 V308	P227-F229 HydrophobicContact CB-CE2 3.8Å; P227-F229 HydrophobicContact CB-CZ 4.38Å; P227-F229 HydrophobicContact CG-CE2 3.98Å; F229-L249 HydrophobicContact CB-CD1 4.01Å; F229-L249 HydrophobicContact CB-CG 4.46Å; F229-L249 HydrophobicContact CD1-CD2 4.2Å; F229-L249 HydrophobicContact CD1-CG 4.35Å; F229-V250 CarbonylContact C-O 3.43Å; F229-V250 VanDerWaalsContact CA-O 3.28Å; F229-V250 WeakPolarHBondContact CA-O 3.44Å; F229-A251 HydrophobicContact CD1-CB 4.17Å; F229-A251 HydrophobicContact CE1-CB 4Å; F229-L301 HydrophobicContact CB-CD2 4.13Å; F229-L301 HydrophobicContact CD1-CD2 4.14Å; F229-L301 HydrophobicContact CD2-CD2 3.93Å; F229-L301 HydrophobicContact CE2-CD2 4.37Å; F229-L301 HydrophobicContact CG-CD2 3.8Å; F229-P302 HydrophobicContact CE2-CG 3.85Å; F229-P302 HydrophobicContact CZ-CG 4.02Å; F229-A305 HydrophobicContact CD2-CB 3.84Å; F229-A305 HydrophobicContact CE2-CB 3.77Å; F229-V306 PolarHBondContact N-O 2.97Å; F229-L307 HydrophobicContact CB-CD2 4Å; F229-L307 CarbonylContact O-C 3.57Å; F229-L307 WeakPolarHBondContact O-CA 3.49Å; F229-V308 PolarHBondContact O-N 3.35Å
230	G	98	Very high	92.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	126.6	174.4	0	0	0	0	0	110	L249 V250 V308	G230-L249 CarbonylContact O-C 3.53Å; G230-L249 WeakPolarHBondContact O-CA 3.44Å; G230-V250 PolarHBondContact N-O 3.28Å; G230-V250 PolarHBondContact O-N 3.12Å; G230-V308 WeakPolarHBondContact CA-O 3.18Å
231	L	97.9	Very high	93.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	129.3	179.7	176.4	64.3	0	0	0	109.6	I247 L249 L307 V308 L312 L316 L319	L231-I247 HydrophobicContact CD1-CD1 3.81Å; L231-I247 HydrophobicContact CD1-CG1 3.66Å; L231-L249 HydrophobicContact CB-CD1 4.01Å; L231-L249 HydrophobicContact CD1-CD1 4.04Å; L231-L307 HydrophobicContact CB-CD2 4.48Å; L231-L307 HydrophobicContact CD2-CD1 4.02Å; L231-V308 PolarHBondContact N-O 3.02Å; L231-L312 HydrophobicContact CB-CD1 4.06Å; L231-L312 HydrophobicContact CD2-CD1 4Å; L231-L312 HydrophobicContact CG-CD1 4.07Å; L231-L316 HydrophobicContact CD2-CD2 4.45Å; L231-L319 HydrophobicContact CD1-CD1 4.4Å; L231-L319 HydrophobicContact CD2-CD1 3.83Å
232	D	97.6	Very high	93.8	Very high	17 Å²	17	44.4 Å²	44.4	9%	0.091	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	145.2	172.5	-169.3	66.4	0	0	0	110.1	S248 A365 D368 A369	D232-S248 PolarHBondContact N-O 3.05Å; D232-S248 VanDerWaalsContact N-O 3.16Å; D232-S248 PolarHBondContact O-N 3.5Å; D232-A365 HydrophobicContact CB-CB 4.28Å; D232-A365 VanDerWaalsContact OD2-CA 3.28Å; D232-A365 WeakPolarHBondContact OD2-CA 3.02Å; D232-A365 WeakPolarHBondContact OD2-CB 3.49Å; D232-D368 HydrophobicContact CB-CB 4.43Å; D232-A369 HydrophobicContact CB-CB 4.11Å
233	C	96.9	Very high	94	Very high	4 Å²	4	44.2 Å²	44.2	3%	0.027	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.2	-179.2	-63.4	0	0	0	0	112	M235 L244 R246 D315	C233-M235 HydrophobicContact CB-CE 4.45Å; C233-M235 HydrophobicContact CB-SD 4.48Å; C233-L244 HydrophobicContact CB-CD1 3.5Å; C233-R246 CarbonylContact C-O 3.45Å; C233-R246 VanDerWaalsContact CA-O 3.31Å; C233-R246 WeakPolarHBondContact CA-O 3.4Å; C233-D315 HydrophobicContact CB-CB 4.35Å; C233-D315 VanDerWaalsContact CB-OD1 3.23Å; C233-D315 WeakPolarHBondContact CB-OD1 3.31Å; C233-D315 PolarHBondContact N-OD1 3.41Å; C233-D315 VanDerWaalsContact N-OD1 3.13Å
234	E	96.4	Very high	94.3	Very high	13 Å²	13	42.6 Å²	42.6	6%	0.061	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	136.7	166.3	-59.4	-60.3	172.3	0	0	111	T245 R246 S276 I278 H363 A365	E234-T245 VanDerWaalsContact C-OG1 3.24Å; E234-T245 WeakPolarHBondContact O-CA 3.12Å; E234-T245 PolarHBondContact O-N 2.95Å; E234-T245 PolarHBondContact O-OG1 2.88Å; E234-R246 HydrophobicContact CB-CB 3.89Å; E234-R246 HydrophobicContact CG-CB 4.14Å; E234-R246 PolarHBondContact N-O 2.9Å; E234-R246 PolarHBondContact O-N 2.92Å; E234-R246 VanDerWaalsContact O-N 3.1Å; E234-S276 VanDerWaalsContact OE2-CA 3.23Å; E234-S276 WeakPolarHBondContact OE2-CA 3.39Å; E234-I278 HydrophobicContact CB-CG1 4.31Å; E234-H363 WeakPolarHBondContact OE1-CB 3.48Å; E234-A365 HydrophobicContact CG-CB 4.16Å
235	M	95.7	Very high	94.6	Very high	20 Å²	20	38.2 Å²	38.2	10%	0.099	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	157.9	-177.5	-50.7	83.8	149	0	0	112.7	C233 R242 E243 L314 A318	C233-M235 HydrophobicContact CB-CE 4.45Å; C233-M235 HydrophobicContact CB-SD 4.48Å; M235-R242 HydrophobicContact CB-CB 4.26Å; M235-E243 CarbonylContact C-O 3.56Å; M235-E243 VanDerWaalsContact CA-O 3.26Å; M235-E243 WeakPolarHBondContact CA-O 3.4Å; M235-E243 WeakPolarHBondContact CB-O 3.35Å; M235-L314 HydrophobicContact CE-CB 4.13Å; M235-A318 HydrophobicContact CE-CB 4.36Å; M235-A318 HydrophobicContact CG-CB 4.03Å
236	C	95.5	Very high	95	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	168.4	165.7	70.1	0	0	0	0	110.8	R242 E243 T245 I268 D270	C236-R242 VanDerWaalsContact O-CA 3.31Å; C236-R242 WeakPolarHBondContact O-CA 3.23Å; C236-E243 PolarHBondContact N-O 3.36Å; C236-E243 PolarHBondContact O-N 3.2Å; C236-T245 HydrophobicContact CB-CG2 3.61Å; C236-T245 WeakPolarHBondContact SG-CG2 3.41Å; C236-I268 HydrophobicContact CB-CG2 3.92Å; C236-D270 WeakPolarHBondContact CB-O 3.22Å
237	L	94.8	Very high	95.2	Very high	72 Å²	72	33.8 Å²	33.8	38%	0.377	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.3	173.8	-172.9	66	0	0	0	110.7	L269 D270	L237-L269 WeakPolarHBondContact O-CB 3.39Å; L237-L269 PolarHBondContact O-N 3.26Å; L237-D270 HydrophobicContact CB-CB 4.11Å; L237-D270 PolarHBondContact N-O 2.99Å; L237-D270 PolarHBondContact O-N 3.09Å; L237-D270 VanDerWaalsContact O-N 3.17Å
238	T	94.1	Very high	95.4	Very high	5 Å²	5	32.1 Å²	32.1	3%	0.031	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	177.5	173.9	82	0	0	0	0	110.8	K240 G241 E243 N266 K267 I268	T238-K240 PolarHBondContact O-N 3.12Å; T238-K240 PolarHBondContact OG1-N 2.94Å; T238-K240 VanDerWaalsContact OG1-N 3.16Å; T238-G241 PolarHBondContact N-O 3.34Å; T238-G241 PolarHBondContact O-N 3.19Å; T238-G241 VanDerWaalsContact O-N 3.11Å; T238-G241 PolarHBondContact OG1-O 3.47Å; T238-E243 VanDerWaalsContact CB-OE2 3.27Å; T238-E243 WeakPolarHBondContact CB-OE2 3.29Å; T238-E243 HydrophobicContact CG2-CB 4.1Å; T238-E243 HydrophobicContact CG2-CG 4.19Å; T238-E243 WeakPolarHBondContact CG2-OE2 3.42Å; T238-E243 PolarHBondContact OG1-OE2 2.89Å; T238-N266 HydrophobicContact CG2-CB 4.43Å; T238-K267 WeakPolarHBondContact CB-O 3.43Å; T238-I268 HydrophobicContact CG2-CG1 4.46Å
239	S	89.1	Confident	95.4	Very high	86 Å²	86	32 Å²	32	60%	0.601	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-11.9	174	55.3	0	0	0	0	114.4
240	K	86.3	Confident	95.4	Very high	165 Å²	165	31 Å²	31	72%	0.717	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.8	3.3	178.6	-65.5	-63.5	-173.8	177.1	0	113.3	T238	T238-K240 PolarHBondContact O-N 3.12Å; T238-K240 PolarHBondContact OG1-N 2.94Å; T238-K240 VanDerWaalsContact OG1-N 3.16Å
241	G	90.1	Very high	95.3	Very high	29 Å²	29	31.9 Å²	31.9	30%	0.299	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	109.2	-150	-176.4	0	0	0	0	0	111.8	T238	T238-G241 PolarHBondContact N-O 3.34Å; T238-G241 PolarHBondContact O-N 3.19Å; T238-G241 VanDerWaalsContact O-N 3.11Å; T238-G241 PolarHBondContact OG1-O 3.47Å
242	R	92.6	Very high	94.6	Very high	162 Å²	162	36.7 Å²	36.7	61%	0.611	18%	0.184	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	128.6	178	-66.5	-178.9	-179	-127.5	0.1	110.1	M235 C236	M235-R242 HydrophobicContact CB-CB 4.26Å; C236-R242 VanDerWaalsContact O-CA 3.31Å; C236-R242 WeakPolarHBondContact O-CA 3.23Å
243	E	95.3	Very high	93.8	Very high	23 Å²	23	39.4 Å²	39.4	11%	0.107	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	146.3	177.1	-70.3	-170.9	103.3	0	0	111.6	M235 C236 T238 P264 N266	M235-E243 CarbonylContact C-O 3.56Å; M235-E243 VanDerWaalsContact CA-O 3.26Å; M235-E243 WeakPolarHBondContact CA-O 3.4Å; M235-E243 WeakPolarHBondContact CB-O 3.35Å; C236-E243 PolarHBondContact N-O 3.36Å; C236-E243 PolarHBondContact O-N 3.2Å; T238-E243 VanDerWaalsContact CB-OE2 3.27Å; T238-E243 WeakPolarHBondContact CB-OE2 3.29Å; T238-E243 HydrophobicContact CG2-CB 4.1Å; T238-E243 HydrophobicContact CG2-CG 4.19Å; T238-E243 WeakPolarHBondContact CG2-OE2 3.42Å; T238-E243 PolarHBondContact OG1-OE2 2.89Å; E243-P264 HydrophobicContact CB-CB 4.25Å; E243-P264 HydrophobicContact CB-CG 4.4Å; E243-N266 PolarHBondContact OE1-ND2 3.33Å; E243-N266 VanDerWaalsContact OE2-CB 3.28Å; E243-N266 WeakPolarHBondContact OE2-CB 3.44Å; E243-N266 PolarHBondContact OE2-ND2 3.35Å
244	L	97.2	Very high	93.2	Very high	6 Å²	6	40.6 Å²	40.6	3%	0.031	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	134.1	-175.8	-175.1	68.7	0	0	0	112.7	C233 R246 I247 V262 L290 V293 A318 L319	C233-L244 HydrophobicContact CB-CD1 3.5Å; L244-R246 WeakPolarHBondContact CD1-O 3.09Å; L244-I247 HydrophobicContact CD1-CB 4.35Å; L244-V262 HydrophobicContact CD2-CB 4.29Å; L244-V262 HydrophobicContact CD2-CG1 4.33Å; L244-V262 HydrophobicContact CD2-CG2 3.81Å; L244-V262 HydrophobicContact CG-CB 4.19Å; L244-V262 HydrophobicContact CG-CG1 4.49Å; L244-V262 HydrophobicContact CG-CG2 4.08Å; L244-L290 HydrophobicContact CB-CD1 4.49Å; L244-L290 HydrophobicContact CD2-CD1 3.75Å; L244-V293 HydrophobicContact CD2-CG2 3.9Å; L244-A318 HydrophobicContact CB-CB 4.48Å; L244-L319 HydrophobicContact CD1-CD2 4.45Å; L244-L319 HydrophobicContact CD2-CD2 3.49Å; L244-L319 VanDerWaalsContact CD2-CD2 3.49Å; L244-L319 HydrophobicContact CD2-CG 4.37Å
245	T	96.8	Very high	93.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	-24.3	176	50.2	0	0	0	0	114.6	E234 C236 L261 V262 P264 L283	E234-T245 VanDerWaalsContact C-OG1 3.24Å; E234-T245 WeakPolarHBondContact O-CA 3.12Å; E234-T245 PolarHBondContact O-N 2.95Å; E234-T245 PolarHBondContact O-OG1 2.88Å; C236-T245 HydrophobicContact CB-CG2 3.61Å; C236-T245 WeakPolarHBondContact SG-CG2 3.41Å; T245-L261 WeakPolarHBondContact O-CA 3.16Å; T245-V262 WeakPolarHBondContact CA-O 3.48Å; T245-V262 PolarHBondContact O-N 3.11Å; T245-P264 HydrophobicContact CG2-CG 3.88Å; T245-L283 HydrophobicContact CG2-CD1 3.73Å
246	R	97.6	Very high	93.1	Very high	48 Å²	48	45.2 Å²	45.2	18%	0.181	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	146	168.5	-167.7	178.6	177.6	-167.5	-4.3	109.1	C233 E234 L244 D259 E260 L261 I278 D364	C233-R246 CarbonylContact C-O 3.45Å; C233-R246 VanDerWaalsContact CA-O 3.31Å; C233-R246 WeakPolarHBondContact CA-O 3.4Å; E234-R246 HydrophobicContact CB-CB 3.89Å; E234-R246 HydrophobicContact CG-CB 4.14Å; E234-R246 PolarHBondContact N-O 2.9Å; E234-R246 PolarHBondContact O-N 2.92Å; E234-R246 VanDerWaalsContact O-N 3.1Å; L244-R246 WeakPolarHBondContact CD1-O 3.09Å; R246-D259 IonicContact CZ-OD1 3.42Å; R246-D259 IonicContact CZ-OD2 3.57Å; R246-D259 IonicContact NE-OD1 3.94Å; R246-D259 PolarHBondContact NE-OD1 2.72Å; R246-D259 IonicContact NE-OD2 4Å; R246-D259 VanDerWaalsContact NH2-CG 3.32Å; R246-D259 IonicContact NH2-OD1 3.42Å; R246-D259 PolarHBondContact NH2-OD1 2.87Å; R246-D259 IonicContact NH2-OD2 3.26Å; R246-D259 PolarHBondContact NH2-OD2 3.31Å; R246-E260 CarbonylContact C-O 3.54Å; R246-E260 VanDerWaalsContact CA-O 3.26Å; R246-E260 WeakPolarHBondContact CA-O 3.44Å; R246-L261 HydrophobicContact CB-CD2 4.11Å; R246-L261 HydrophobicContact CG-CD2 4.08Å; R246-I278 HydrophobicContact CB-CD1 4.26Å; R246-D364 IonicContact CZ-OD1 3.66Å; R246-D364 IonicContact NH1-OD1 2.76Å; R246-D364 IonicContact NH2-OD1 2.99Å
247	I	97.9	Very high	93.1	Very high	0 Å²	0	48 Å²	48	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	134.4	171.7	178.2	-176.2	0	0	0	108.2	L231 L244 M258 D259 E260 V262 V293 L297 L319	L231-I247 HydrophobicContact CD1-CD1 3.81Å; L231-I247 HydrophobicContact CD1-CG1 3.66Å; L244-I247 HydrophobicContact CD1-CB 4.35Å; I247-M258 HydrophobicContact CD1-CE 4.11Å; I247-M258 HydrophobicContact CD1-SD 4.06Å; I247-M258 HydrophobicContact CG2-CE 3.71Å; I247-M258 HydrophobicContact CG2-SD 4.5Å; I247-D259 CarbonylContact O-C 3.55Å; I247-D259 WeakPolarHBondContact O-CA 3.28Å; I247-E260 HydrophobicContact CG2-CB 3.96Å; I247-E260 PolarHBondContact N-O 3.44Å; I247-E260 PolarHBondContact O-N 3.12Å; I247-V262 HydrophobicContact CG2-CG2 4.44Å; I247-V293 HydrophobicContact CG2-CB 4.12Å; I247-V293 HydrophobicContact CG2-CG1 3.96Å; I247-L297 HydrophobicContact CD1-CD2 4.14Å; I247-L319 HydrophobicContact CD1-CD1 4.26Å; I247-L319 HydrophobicContact CD1-CD2 3.71Å; I247-L319 HydrophobicContact CG1-CD2 4.49Å
248	S	97.9	Very high	93.2	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.7	169.1	-54.6	0	0	0	0	110.5	D232 M258 D259 A365 T366	D232-S248 PolarHBondContact N-O 3.05Å; D232-S248 VanDerWaalsContact N-O 3.16Å; D232-S248 PolarHBondContact O-N 3.5Å; S248-M258 CarbonylContact C-O 3.34Å; S248-M258 VanDerWaalsContact CA-O 3.24Å; S248-M258 WeakPolarHBondContact CA-O 3.26Å; S248-D259 PolarHBondContact OG-OD1 3.03Å; S248-A365 WeakPolarHBondContact OG-CB 3.38Å; S248-T366 WeakPolarHBondContact CB-OG1 3.49Å; S248-T366 PolarHBondContact OG-N 3.01Å; S248-T366 PolarHBondContact OG-OG1 2.8Å; S248-T366 VanDerWaalsContact OG-OG1 3.04Å
249	L	98	Very high	93.4	Very high	0 Å²	0	48 Å²	48	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127.5	173.4	-167.7	75.6	0	0	0	108.9	F229 G230 L231 V257 M258 L297 L300 L301 L307	F229-L249 HydrophobicContact CB-CD1 4.01Å; F229-L249 HydrophobicContact CB-CG 4.46Å; F229-L249 HydrophobicContact CD1-CD2 4.2Å; F229-L249 HydrophobicContact CD1-CG 4.35Å; G230-L249 CarbonylContact O-C 3.53Å; G230-L249 WeakPolarHBondContact O-CA 3.44Å; L231-L249 HydrophobicContact CB-CD1 4.01Å; L231-L249 HydrophobicContact CD1-CD1 4.04Å; L249-V257 HydrophobicContact CB-CG2 4.01Å; L249-V257 HydrophobicContact CD2-CG2 3.72Å; L249-V257 HydrophobicContact CG-CG2 3.86Å; L249-V257 VanDerWaalsContact O-CG2 3.31Å; L249-V257 WeakPolarHBondContact O-CG2 3.27Å; L249-V257 PolarHBondContact O-N 2.91Å; L249-M258 HydrophobicContact CB-CB 3.72Å; L249-M258 PolarHBondContact N-O 3.03Å; L249-M258 PolarHBondContact O-N 3.13Å; L249-L297 HydrophobicContact CD1-CD1 3.93Å; L249-L297 HydrophobicContact CD2-CD1 3.61Å; L249-L297 HydrophobicContact CG-CD1 4.29Å; L249-L300 HydrophobicContact CD2-CB 4.38Å; L249-L300 HydrophobicContact CD2-CD1 4.42Å; L249-L301 HydrophobicContact CD1-CD2 4.49Å; L249-L301 HydrophobicContact CD2-CD2 4.05Å; L249-L307 HydrophobicContact CD1-CD2 4.12Å
250	V	97.9	Very high	93.7	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.9	-179.5	179.5	0	0	0	0	108.2	F229 G230 C255 C256 T366 A369 R370 L373	F229-V250 CarbonylContact C-O 3.43Å; F229-V250 VanDerWaalsContact CA-O 3.28Å; F229-V250 WeakPolarHBondContact CA-O 3.44Å; G230-V250 PolarHBondContact N-O 3.28Å; G230-V250 PolarHBondContact O-N 3.12Å; V250-C255 CarbonylContact C-O 3.48Å; V250-C255 WeakPolarHBondContact CA-O 3.48Å; V250-C255 WeakPolarHBondContact CG1-O 3.24Å; V250-C256 HydrophobicContact CG2-CB 4.36Å; V250-T366 HydrophobicContact CG2-CG2 4.11Å; V250-A369 HydrophobicContact CB-CB 4.18Å; V250-A369 HydrophobicContact CG2-CB 3.61Å; V250-R370 HydrophobicContact CG1-CG 3.77Å; V250-R370 HydrophobicContact CG2-CG 4.14Å; V250-L373 HydrophobicContact CB-CD1 4.03Å; V250-L373 HydrophobicContact CG1-CD1 3.72Å; V250-L373 WeakPolarHBondContact O-CD1 3.45Å
251	A	95	Very high	94.3	Very high	19 Å²	19	41.5 Å²	41.5	16%	0.157	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	160.4	174.6	0	0	0	0	0	111.4	F229 G253 G254 C255 V257	F229-A251 HydrophobicContact CD1-CB 4.17Å; F229-A251 HydrophobicContact CE1-CB 4Å; A251-G253 PolarHBondContact O-N 3.31Å; A251-G254 PolarHBondContact O-N 3.21Å; A251-C255 PolarHBondContact N-O 3.42Å; A251-V257 HydrophobicContact CB-CG1 3.8Å
252	E	84.8	Confident	94.6	Very high	102 Å²	102	40.2 Å²	40.2	48%	0.477	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.3	126.9	170	-179.6	154.5	-127.4	0	0	111.4	L228 Q377	L228-E252 PolarHBondContact O-N 3.07Å; E252-Q377 PolarHBondContact OE1-NE2 2.99Å; E252-Q377 VanDerWaalsContact OE1-NE2 3.09Å
253	G	79.9	Confident	94.8	Very high	73 Å²	73	36.3 Å²	36.3	75%	0.753	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	101.4	-3.4	-170.3	0	0	0	0	0	114.5	A251	A251-G253 PolarHBondContact O-N 3.31Å
254	G	84.9	Confident	94.8	Very high	30 Å²	30	36 Å²	36	31%	0.309	22%	0.218	S	C	.	.	S	Bend	trans	87.3	6.2	171.4	0	0	0	0	0	114.8	A251 C256	A251-G254 PolarHBondContact O-N 3.21Å; G254-C256 PolarHBondContact O-N 3.14Å
255	C	92.8	Very high	94.4	Very high	82 Å²	82	41.9 Å²	41.9	55%	0.554	25%	0.245	S	C	*	.			trans	-74.6	122.3	176.6	-172.4	0	0	0	0	110.5	V250 A251 V257	V250-C255 CarbonylContact C-O 3.48Å; V250-C255 WeakPolarHBondContact CA-O 3.48Å; V250-C255 WeakPolarHBondContact CG1-O 3.24Å; A251-C255 PolarHBondContact N-O 3.42Å; C255-V257 PolarHBondContact O-N 2.89Å
256	C	96	Very high	94.3	Very high	48 Å²	48	44.2 Å²	44.2	32%	0.324	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	116.8	174.3	-176.5	0	0	0	0	109.7	V250 G254 M258 T366	V250-C256 HydrophobicContact CG2-CB 4.36Å; G254-C256 PolarHBondContact O-N 3.14Å; C256-M258 PolarHBondContact SG-O 3.42Å; C256-T366 HydrophobicContact CB-CG2 3.69Å
257	V	96.4	Very high	94.1	Very high	58 Å²	58	50 Å²	50	35%	0.352	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-11.7	-177.1	-65.5	0	0	0	0	112.8	L249 A251 C255	L249-V257 HydrophobicContact CB-CG2 4.01Å; L249-V257 HydrophobicContact CD2-CG2 3.72Å; L249-V257 HydrophobicContact CG-CG2 3.86Å; L249-V257 VanDerWaalsContact O-CG2 3.31Å; L249-V257 WeakPolarHBondContact O-CG2 3.27Å; L249-V257 PolarHBondContact O-N 2.91Å; A251-V257 HydrophobicContact CB-CG1 3.8Å; C255-V257 PolarHBondContact O-N 2.89Å
258	M	97.1	Very high	94	Very high	10 Å²	10	51.4 Å²	51.4	5%	0.049	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	131.6	173.4	-171.3	177.3	178.7	0	0	108.9	I247 S248 L249 C256 E260 V293 Q296 L297 L300	I247-M258 HydrophobicContact CD1-CE 4.11Å; I247-M258 HydrophobicContact CD1-SD 4.06Å; I247-M258 HydrophobicContact CG2-CE 3.71Å; I247-M258 HydrophobicContact CG2-SD 4.5Å; S248-M258 CarbonylContact C-O 3.34Å; S248-M258 VanDerWaalsContact CA-O 3.24Å; S248-M258 WeakPolarHBondContact CA-O 3.26Å; L249-M258 HydrophobicContact CB-CB 3.72Å; L249-M258 PolarHBondContact N-O 3.03Å; L249-M258 PolarHBondContact O-N 3.13Å; C256-M258 PolarHBondContact SG-O 3.42Å; M258-E260 HydrophobicContact CE-CB 4.22Å; M258-E260 HydrophobicContact CE-CG 3.95Å; M258-E260 HydrophobicContact CG-CG 3.95Å; M258-V293 HydrophobicContact CE-CB 3.5Å; M258-V293 VanDerWaalsContact CE-CB 3.5Å; M258-V293 HydrophobicContact CE-CG1 3.67Å; M258-Q296 HydrophobicContact CE-CB 3.97Å; M258-Q296 HydrophobicContact SD-CB 4.44Å; M258-L297 HydrophobicContact SD-CB 4.37Å; M258-L300 HydrophobicContact CB-CD1 3.91Å; M258-L300 HydrophobicContact CG-CD1 4.34Å; M258-L300 HydrophobicContact SD-CD1 4.11Å
259	D	96.8	Very high	93.8	Very high	67 Å²	67	56.9 Å²	56.9	36%	0.358	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	98.9	168.3	-178	33.6	0	0	0	108.6	R246 I247 S248	R246-D259 IonicContact CZ-OD1 3.42Å; R246-D259 IonicContact CZ-OD2 3.57Å; R246-D259 IonicContact NE-OD1 3.94Å; R246-D259 PolarHBondContact NE-OD1 2.72Å; R246-D259 IonicContact NE-OD2 4Å; R246-D259 VanDerWaalsContact NH2-CG 3.32Å; R246-D259 IonicContact NH2-OD1 3.42Å; R246-D259 PolarHBondContact NH2-OD1 2.87Å; R246-D259 IonicContact NH2-OD2 3.26Å; R246-D259 PolarHBondContact NH2-OD2 3.31Å; I247-D259 CarbonylContact O-C 3.55Å; I247-D259 WeakPolarHBondContact O-CA 3.28Å; S248-D259 PolarHBondContact OG-OD1 3.03Å
260	E	97.3	Very high	93.6	Very high	65 Å²	65	60.6 Å²	60.6	30%	0.304	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130.8	-166.5	-68.8	-69.3	169.8	0	0	111.3	R246 I247 M258 V293	R246-E260 CarbonylContact C-O 3.54Å; R246-E260 VanDerWaalsContact CA-O 3.26Å; R246-E260 WeakPolarHBondContact CA-O 3.44Å; I247-E260 HydrophobicContact CG2-CB 3.96Å; I247-E260 PolarHBondContact N-O 3.44Å; I247-E260 PolarHBondContact O-N 3.12Å; M258-E260 HydrophobicContact CE-CB 4.22Å; M258-E260 HydrophobicContact CE-CG 3.95Å; M258-E260 HydrophobicContact CG-CG 3.95Å; E260-V293 HydrophobicContact CB-CG1 3.87Å; E260-V293 HydrophobicContact CG-CG1 4.45Å
261	L	97.5	Very high	93.3	Very high	50 Å²	50	63 Å²	63	26%	0.262	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	139.1	168.5	-71.1	169.5	0	0	0	110	T245 R246 I278 I282 L283 V286 T288	T245-L261 WeakPolarHBondContact O-CA 3.16Å; R246-L261 HydrophobicContact CB-CD2 4.11Å; R246-L261 HydrophobicContact CG-CD2 4.08Å; L261-I278 HydrophobicContact CD2-CD1 3.59Å; L261-I282 HydrophobicContact CD1-CG2 3.54Å; L261-I282 HydrophobicContact CD2-CG2 4.02Å; L261-I282 HydrophobicContact CG-CG2 4.46Å; L261-L283 HydrophobicContact CB-CD2 4.49Å; L261-L283 HydrophobicContact CD2-CD2 4.4Å; L261-V286 HydrophobicContact CB-CG1 4.05Å; L261-V286 HydrophobicContact CB-CG2 3.75Å; L261-V286 HydrophobicContact CD1-CG2 3.93Å; L261-V286 HydrophobicContact CG-CG2 4.49Å; L261-V286 WeakPolarHBondContact O-CG1 3.48Å; L261-T288 VanDerWaalsContact O-CB 3.31Å; L261-T288 WeakPolarHBondContact O-CB 3.42Å
262	V	97.4	Very high	93.2	Very high	2 Å²	2	63.7 Å²	63.7	1%	0.012	35%	0.35	C	S	.	.			trans	-123.4	133.3	-176.9	-175.4	0	0	0	0	109.3	L244 T245 I247 P264 L283 V293	L244-V262 HydrophobicContact CD2-CB 4.29Å; L244-V262 HydrophobicContact CD2-CG1 4.33Å; L244-V262 HydrophobicContact CD2-CG2 3.81Å; L244-V262 HydrophobicContact CG-CB 4.19Å; L244-V262 HydrophobicContact CG-CG1 4.49Å; L244-V262 HydrophobicContact CG-CG2 4.08Å; T245-V262 WeakPolarHBondContact CA-O 3.48Å; T245-V262 PolarHBondContact O-N 3.11Å; I247-V262 HydrophobicContact CG2-CG2 4.44Å; V262-P264 VanDerWaalsContact O-CD 3.31Å; V262-P264 WeakPolarHBondContact O-CD 3.09Å; V262-L283 WeakPolarHBondContact O-CD2 2.88Å; V262-V293 HydrophobicContact CG2-CB 4.37Å; V262-V293 HydrophobicContact CG2-CG1 3.59Å; V262-V293 HydrophobicContact CG2-CG2 3.93Å
263	K	96.4	Very high	93.4	Very high	80 Å²	80	60.7 Å²	60.7	35%	0.348	34%	0.339	S	S	.	.			trans	-97	109.2	174.4	-175.7	166	-179	171.1	0	110.6	N284 V286 T288 K289	K263-N284 PolarHBondContact NZ-O 3.43Å; K263-V286 HydrophobicContact CB-CB 4.41Å; K263-V286 HydrophobicContact CB-CG1 4.13Å; K263-V286 WeakPolarHBondContact CD-O 3.42Å; K263-T288 PolarHBondContact N-O 3.22Å; K263-K289 VanDerWaalsContact O-CD 3.32Å; K263-K289 WeakPolarHBondContact O-CD 3.4Å; K263-K289 PolarHBondContact O-NZ 3.45Å; K263-K289 VanDerWaalsContact O-NZ 3.09Å
264	P	95	Very high	93.6	Very high	15 Å²	15	61.1 Å²	61.1	10%	0.097	33%	0.33	C	S	.	.			trans	-52.1	150.2	176.2	-25.5	32.2	0	0	0	112.9	E243 T245 V262 I268	E243-P264 HydrophobicContact CB-CB 4.25Å; E243-P264 HydrophobicContact CB-CG 4.4Å; T245-P264 HydrophobicContact CG2-CG 3.88Å; V262-P264 VanDerWaalsContact O-CD 3.31Å; V262-P264 WeakPolarHBondContact O-CD 3.09Å; P264-I268 HydrophobicContact CB-CG1 4.48Å; P264-I268 HydrophobicContact CG-CD1 4.05Å; P264-I268 HydrophobicContact CG-CG1 4.18Å
265	E	90.1	Very high	93.6	Very high	130 Å²	130	65.7 Å²	65.7	61%	0.607	34%	0.342	S	S	*	.	S	Bend	trans	-76.2	-37.5	175.5	-67.8	-178.3	176.8	0	0	111.4
266	N	93.9	Very high	93.4	Very high	49 Å²	49	61.9 Å²	61.9	26%	0.262	32%	0.316	S	S	.	.	S	Bend	trans	-83.9	158	179.2	-53.9	-78.8	0	0	0	111.5	T238 E243 I268	T238-N266 HydrophobicContact CG2-CB 4.43Å; E243-N266 PolarHBondContact OE1-ND2 3.33Å; E243-N266 VanDerWaalsContact OE2-CB 3.28Å; E243-N266 WeakPolarHBondContact OE2-CB 3.44Å; E243-N266 PolarHBondContact OE2-ND2 3.35Å; N266-I268 PolarHBondContact O-N 3.19Å
267	K	93	Very high	93	Very high	170 Å²	170	60.2 Å²	60.2	74%	0.739	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-63.1	124	175.3	-176	-179.9	176.5	-175.8	0	110.2	T238 L269	T238-K267 WeakPolarHBondContact CB-O 3.43Å; K267-L269 PolarHBondContact O-N 3.02Å
268	I	95.3	Very high	92.9	Very high	29 Å²	29	57.7 Å²	57.7	15%	0.149	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	124.9	173.3	-55.7	177.4	0	0	0	109	C236 T238 P264 N266 D270 Y271 L283	C236-I268 HydrophobicContact CB-CG2 3.92Å; T238-I268 HydrophobicContact CG2-CG1 4.46Å; P264-I268 HydrophobicContact CB-CG1 4.48Å; P264-I268 HydrophobicContact CG-CD1 4.05Å; P264-I268 HydrophobicContact CG-CG1 4.18Å; N266-I268 PolarHBondContact O-N 3.19Å; I268-D270 WeakPolarHBondContact CG2-O 3.5Å; I268-Y271 HydrophobicContact CB-CE1 4.4Å; I268-Y271 HydrophobicContact CB-CE2 4.38Å; I268-Y271 HydrophobicContact CD1-CD1 4.04Å; I268-Y271 HydrophobicContact CD1-CE1 3.46Å; I268-Y271 VanDerWaalsContact CD1-CE1 3.46Å; I268-Y271 HydrophobicContact CG2-CD1 4.05Å; I268-Y271 HydrophobicContact CG2-CD2 3.91Å; I268-Y271 HydrophobicContact CG2-CE1 4.06Å; I268-Y271 HydrophobicContact CG2-CE2 3.89Å; I268-Y271 HydrophobicContact CG2-CG 3.98Å; I268-L283 HydrophobicContact CD1-CD1 3.73Å
269	L	94.3	Very high	92.6	Very high	115 Å²	115	59 Å²	59	60%	0.602	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	-40.2	174	-60.7	178.7	0	0	0	110.7	L237 K267	L237-L269 WeakPolarHBondContact O-CB 3.39Å; L237-L269 PolarHBondContact O-N 3.26Å; K267-L269 PolarHBondContact O-N 3.02Å
270	D	93.8	Very high	92.5	Very high	79 Å²	79	61.8 Å²	61.8	42%	0.422	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	132.6	176.5	-171.8	-9.2	0	0	0	109.6	C236 L237 I268 L272	C236-D270 WeakPolarHBondContact CB-O 3.22Å; L237-D270 HydrophobicContact CB-CB 4.11Å; L237-D270 PolarHBondContact N-O 2.99Å; L237-D270 PolarHBondContact O-N 3.09Å; L237-D270 VanDerWaalsContact O-N 3.17Å; I268-D270 WeakPolarHBondContact CG2-O 3.5Å; D270-L272 VanDerWaalsContact C-N 3.3Å; D270-L272 HydrophobicContact CB-CD2 4.47Å; D270-L272 PolarHBondContact OD1-N 3.4Å
271	Y	91.8	Very high	92.3	Very high	50 Å²	50	67.1 Å²	67.1	20%	0.196	33%	0.331	C	S	.	.			trans	-80.3	-12.5	179.4	-71.4	-93.5	0	0	0	112.9	I268 T273 S276 I278 K280 L283	I268-Y271 HydrophobicContact CB-CE1 4.4Å; I268-Y271 HydrophobicContact CB-CE2 4.38Å; I268-Y271 HydrophobicContact CD1-CD1 4.04Å; I268-Y271 HydrophobicContact CD1-CE1 3.46Å; I268-Y271 VanDerWaalsContact CD1-CE1 3.46Å; I268-Y271 HydrophobicContact CG2-CD1 4.05Å; I268-Y271 HydrophobicContact CG2-CD2 3.91Å; I268-Y271 HydrophobicContact CG2-CE1 4.06Å; I268-Y271 HydrophobicContact CG2-CE2 3.89Å; I268-Y271 HydrophobicContact CG2-CG 3.98Å; Y271-T273 PolarHBondContact O-N 2.87Å; Y271-S276 PolarHBondContact O-OG 3.45Å; Y271-I278 WeakPolarHBondContact CB-O 3.19Å; Y271-I278 HydrophobicContact CD1-CG2 4.22Å; Y271-K280 HydrophobicContact CE1-CB 4.05Å; Y271-K280 HydrophobicContact CE2-CB 3.84Å; Y271-K280 HydrophobicContact CE2-CG 4.43Å; Y271-K280 WeakPolarHBondContact OH-CB 3.35Å; Y271-K280 VanDerWaalsContact OH-CG 3.3Å; Y271-K280 WeakPolarHBondContact OH-CG 3.41Å; Y271-L283 HydrophobicContact CD1-CD1 4.1Å; Y271-L283 HydrophobicContact CE1-CB 4.49Å; Y271-L283 HydrophobicContact CE1-CD1 3.91Å
272	L	92.5	Very high	92.1	Very high	33 Å²	33	68.1 Å²	68.1	17%	0.173	34%	0.336	C	S	.	.			trans	55.4	33.5	-175.2	-56.7	178.6	0	0	0	112.6	D270 S274 F275 S276	D270-L272 VanDerWaalsContact C-N 3.3Å; D270-L272 HydrophobicContact CB-CD2 4.47Å; D270-L272 PolarHBondContact OD1-N 3.4Å; L272-S274 PolarHBondContact O-N 2.95Å; L272-F275 HydrophobicContact CB-CD2 4.46Å; L272-F275 WeakPolarHBondContact O-CA 3.37Å; L272-F275 PolarHBondContact O-N 3.33Å; L272-S276 PolarHBondContact O-N 2.91Å; L272-S276 PolarHBondContact O-OG 2.93Å; L272-S276 VanDerWaalsContact O-OG 3.09Å
273	T	89.8	Confident	91.9	Very high	40 Å²	40	68.3 Å²	68.3	25%	0.245	34%	0.337	C	S	.	.	H	α-helix	trans	-53.8	-32.9	-168.9	-53.9	0	0	0	0	114.2	Y271 F275 G277 I278 T279 L361	Y271-T273 PolarHBondContact O-N 2.87Å; T273-F275 PolarHBondContact O-N 3.11Å; T273-G277 WeakPolarHBondContact O-CA 3.39Å; T273-G277 PolarHBondContact O-N 3.13Å; T273-I278 WeakPolarHBondContact CB-O 3.48Å; T273-I278 WeakPolarHBondContact CG2-O 3.31Å; T273-I278 PolarHBondContact OG1-O 3.34Å; T273-T279 HydrophobicContact CG2-CG2 3.68Å; T273-L361 HydrophobicContact CG2-CD1 4.11Å; T273-L361 HydrophobicContact CG2-CD2 3.79Å; T273-L361 HydrophobicContact CG2-CG 3.99Å
274	S	84.3	Confident	91.7	Very high	81 Å²	81	68.7 Å²	68.7	57%	0.566	34%	0.343	S	S	*	.	H	α-helix	trans	-65	-23.1	176.6	55.9	0	0	0	0	113.6	L272	L272-S274 PolarHBondContact O-N 2.95Å
275	F	84.9	Confident	91.7	Very high	127 Å²	127	72.8 Å²	72.8	56%	0.557	37%	0.369	S	S	*	.	H	α-helix	trans	-103.9	-44.9	177.4	-56.6	-77.7	0	0	0	110.6	L272 T273 H363	L272-F275 HydrophobicContact CB-CD2 4.46Å; L272-F275 WeakPolarHBondContact O-CA 3.37Å; L272-F275 PolarHBondContact O-N 3.33Å; T273-F275 PolarHBondContact O-N 3.11Å; F275-H363 WeakPolarHBondContact O-CB 3.2Å; F275-H363 PolarHBondContact O-CD2 3.42Å; F275-H363 PolarHBondContact O-N 2.71Å
276	S	86.9	Confident	92	Very high	2 Å²	2	67.3 Å²	67.3	1%	0.014	35%	0.345	C	S	.	.	H	α-helix	trans	-90.7	-18.7	-170.9	65.7	0	0	0	0	115.6	E234 Y271 L272 I278	E234-S276 VanDerWaalsContact OE2-CA 3.23Å; E234-S276 WeakPolarHBondContact OE2-CA 3.39Å; Y271-S276 PolarHBondContact O-OG 3.45Å; L272-S276 PolarHBondContact O-N 2.91Å; L272-S276 PolarHBondContact O-OG 2.93Å; L272-S276 VanDerWaalsContact O-OG 3.09Å; S276-I278 WeakPolarHBondContact O-CG1 3.37Å; S276-I278 PolarHBondContact O-N 2.98Å; S276-I278 WeakPolarHBondContact OG-CB 3.23Å; S276-I278 PolarHBondContact OG-N 3.27Å
277	G	89.3	Confident	92.1	Very high	13 Å²	13	70.5 Å²	70.5	13%	0.134	37%	0.366	C	S	.	.			trans	67.9	-3.7	-169.5	0	0	0	0	0	113.6	T273 L361	T273-G277 WeakPolarHBondContact O-CA 3.39Å; T273-G277 PolarHBondContact O-N 3.13Å; G277-L361 WeakPolarHBondContact CA-O 3.37Å
278	I	92.8	Very high	92.3	Very high	5 Å²	5	64 Å²	64	3%	0.026	34%	0.34	C	S	.	.			trans	-79.7	130.8	-176.4	-59	-56.2	0	0	0	110	E234 R246 L261 Y271 T273 S276 L283	E234-I278 HydrophobicContact CB-CG1 4.31Å; R246-I278 HydrophobicContact CB-CD1 4.26Å; L261-I278 HydrophobicContact CD2-CD1 3.59Å; Y271-I278 WeakPolarHBondContact CB-O 3.19Å; Y271-I278 HydrophobicContact CD1-CG2 4.22Å; T273-I278 WeakPolarHBondContact CB-O 3.48Å; T273-I278 WeakPolarHBondContact CG2-O 3.31Å; T273-I278 PolarHBondContact OG1-O 3.34Å; S276-I278 WeakPolarHBondContact O-CG1 3.37Å; S276-I278 PolarHBondContact O-N 2.98Å; S276-I278 WeakPolarHBondContact OG-CB 3.23Å; S276-I278 PolarHBondContact OG-N 3.27Å; I278-L283 HydrophobicContact CG2-CD1 3.42Å; I278-L283 VanDerWaalsContact CG2-CD1 3.42Å; I278-L283 HydrophobicContact CG2-CD2 4.16Å; I278-L283 HydrophobicContact CG2-CG 3.47Å; I278-L283 VanDerWaalsContact CG2-CG 3.47Å
279	T	92.5	Very high	92.4	Very high	37 Å²	37	65.8 Å²	65.8	23%	0.227	35%	0.347	C	S	.	.			trans	-119.7	159.8	174.5	68.3	0	0	0	0	110.9	T273 K281 I282 L283 L361	T273-T279 HydrophobicContact CG2-CG2 3.68Å; T279-K281 PolarHBondContact O-N 3.27Å; T279-I282 HydrophobicContact CG2-CD1 4.38Å; T279-I282 PolarHBondContact O-N 3.16Å; T279-I282 VanDerWaalsContact O-N 3.1Å; T279-I282 WeakPolarHBondContact OG1-CD1 3.41Å; T279-I282 WeakPolarHBondContact OG1-CG1 3.37Å; T279-I282 PolarHBondContact OG1-N 2.82Å; T279-L283 PolarHBondContact O-N 3.3Å; T279-L283 VanDerWaalsContact O-N 3.08Å; T279-L361 HydrophobicContact CG2-CD2 4.36Å
280	K	93	Very high	92.5	Very high	125 Å²	125	61.6 Å²	61.6	54%	0.543	33%	0.325	S	S	.	.	H	α-helix	trans	-53.2	-39	171.3	-176.1	168.1	-175.7	-174.9	0	112.4	Y271 I282 L283 N284	Y271-K280 HydrophobicContact CE1-CB 4.05Å; Y271-K280 HydrophobicContact CE2-CB 3.84Å; Y271-K280 HydrophobicContact CE2-CG 4.43Å; Y271-K280 WeakPolarHBondContact OH-CB 3.35Å; Y271-K280 VanDerWaalsContact OH-CG 3.3Å; Y271-K280 WeakPolarHBondContact OH-CG 3.41Å; K280-I282 PolarHBondContact O-N 3.17Å; K280-L283 PolarHBondContact O-N 2.74Å; K280-N284 WeakPolarHBondContact CG-OD1 3.42Å; K280-N284 WeakPolarHBondContact O-CB 3Å; K280-N284 PolarHBondContact O-N 3.17Å; K280-N284 PolarHBondContact O-ND2 2.91Å; K280-N284 PolarHBondContact O-OD1 3.26Å; K280-N284 VanDerWaalsContact O-OD1 3.1Å
281	K	94	Very high	92.6	Very high	178 Å²	178	64.3 Å²	64.3	77%	0.774	33%	0.333	S	S	*	.	H	α-helix	trans	-63.3	-41.6	179.3	-67.3	-178.2	179.3	178.9	0	111.5	T279 P285	T279-K281 PolarHBondContact O-N 3.27Å; K281-P285 VanDerWaalsContact O-CD 3.27Å; K281-P285 WeakPolarHBondContact O-CD 3.26Å
282	I	92.4	Very high	92.9	Very high	71 Å²	71	64.3 Å²	64.3	36%	0.364	34%	0.337	S	S	.	.	H	α-helix	trans	-65.7	-43.3	177.5	-67.5	166.9	0	0	0	111.1	L261 T279 K280 P285 V286	L261-I282 HydrophobicContact CD1-CG2 3.54Å; L261-I282 HydrophobicContact CD2-CG2 4.02Å; L261-I282 HydrophobicContact CG-CG2 4.46Å; T279-I282 HydrophobicContact CG2-CD1 4.38Å; T279-I282 PolarHBondContact O-N 3.16Å; T279-I282 VanDerWaalsContact O-N 3.1Å; T279-I282 WeakPolarHBondContact OG1-CD1 3.41Å; T279-I282 WeakPolarHBondContact OG1-CG1 3.37Å; T279-I282 PolarHBondContact OG1-N 2.82Å; K280-I282 PolarHBondContact O-N 3.17Å; I282-P285 WeakPolarHBondContact O-CD 3.31Å; I282-V286 WeakPolarHBondContact O-CG2 3.34Å
283	L	94.1	Very high	93.1	Very high	5 Å²	5	62.8 Å²	62.8	3%	0.026	33%	0.329	C	S	.	.	H	α-helix	trans	-83.2	-17.2	-177.5	-74	-175.9	0	0	0	115.4	T245 L261 V262 I268 Y271 I278 T279 K280 V286	T245-L283 HydrophobicContact CG2-CD1 3.73Å; L261-L283 HydrophobicContact CB-CD2 4.49Å; L261-L283 HydrophobicContact CD2-CD2 4.4Å; V262-L283 WeakPolarHBondContact O-CD2 2.88Å; I268-L283 HydrophobicContact CD1-CD1 3.73Å; Y271-L283 HydrophobicContact CD1-CD1 4.1Å; Y271-L283 HydrophobicContact CE1-CB 4.49Å; Y271-L283 HydrophobicContact CE1-CD1 3.91Å; I278-L283 HydrophobicContact CG2-CD1 3.42Å; I278-L283 VanDerWaalsContact CG2-CD1 3.42Å; I278-L283 HydrophobicContact CG2-CD2 4.16Å; I278-L283 HydrophobicContact CG2-CG 3.47Å; I278-L283 VanDerWaalsContact CG2-CG 3.47Å; T279-L283 PolarHBondContact O-N 3.3Å; T279-L283 VanDerWaalsContact O-N 3.08Å; K280-L283 PolarHBondContact O-N 2.74Å; L283-V286 HydrophobicContact CD2-CG2 4.25Å; L283-V286 PolarHBondContact O-N 2.63Å
284	N	92.5	Very high	93.5	Very high	89 Å²	89	61.6 Å²	61.6	48%	0.476	32%	0.32	S	S	.	.	S	Bend	trans	-54.7	-51.7	-179.9	-82.7	-14.1	0	0	0	113.6	K263 K280 V286	K263-N284 PolarHBondContact NZ-O 3.43Å; K280-N284 WeakPolarHBondContact CG-OD1 3.42Å; K280-N284 WeakPolarHBondContact O-CB 3Å; K280-N284 PolarHBondContact O-N 3.17Å; K280-N284 PolarHBondContact O-ND2 2.91Å; K280-N284 PolarHBondContact O-OD1 3.26Å; K280-N284 VanDerWaalsContact O-OD1 3.1Å; N284-V286 VanDerWaalsContact C-N 3.29Å; N284-V286 PolarHBondContact O-N 2.91Å
285	P	95.2	Very high	94	Very high	100 Å²	100	65.5 Å²	65.5	65%	0.649	32%	0.323	S	S	*	.	S	Bend	trans	-76	-13	-179.2	31.7	-37.3	0	0	0	113.9	K281 I282 T287	K281-P285 VanDerWaalsContact O-CD 3.27Å; K281-P285 WeakPolarHBondContact O-CD 3.26Å; I282-P285 WeakPolarHBondContact O-CD 3.31Å; P285-T287 PolarHBondContact O-N 2.96Å
286	V	96.1	Very high	94.6	Very high	16 Å²	16	63 Å²	63	10%	0.097	31%	0.313	C	S	.	.			trans	-70.4	128.7	-174.6	177.9	0	0	0	0	110.6	L261 K263 I282 L283 N284	L261-V286 HydrophobicContact CB-CG1 4.05Å; L261-V286 HydrophobicContact CB-CG2 3.75Å; L261-V286 HydrophobicContact CD1-CG2 3.93Å; L261-V286 HydrophobicContact CG-CG2 4.49Å; L261-V286 WeakPolarHBondContact O-CG1 3.48Å; K263-V286 HydrophobicContact CB-CB 4.41Å; K263-V286 HydrophobicContact CB-CG1 4.13Å; K263-V286 WeakPolarHBondContact CD-O 3.42Å; I282-V286 WeakPolarHBondContact O-CG2 3.34Å; L283-V286 HydrophobicContact CD2-CG2 4.25Å; L283-V286 PolarHBondContact O-N 2.63Å; N284-V286 VanDerWaalsContact C-N 3.29Å; N284-V286 PolarHBondContact O-N 2.91Å
287	T	95.4	Very high	95	Very high	115 Å²	115	63 Å²	63	71%	0.706	31%	0.313	S	S	*	.			trans	-107.4	-22.1	175.8	51.6	0	0	0	0	113.1	P285 K289	P285-T287 PolarHBondContact O-N 2.96Å; T287-K289 PolarHBondContact O-N 2.71Å
288	T	97.3	Very high	95.3	Very high	33 Å²	33	65.6 Å²	65.6	20%	0.202	32%	0.32	C	S	.	.			trans	-54	130.5	179.8	-50.2	0	0	0	0	111.6	L261 K263 D292 V293	L261-T288 VanDerWaalsContact O-CB 3.31Å; L261-T288 WeakPolarHBondContact O-CB 3.42Å; K263-T288 PolarHBondContact N-O 3.22Å; T288-D292 HydrophobicContact CG2-CB 4.05Å; T288-V293 HydrophobicContact CG2-CG1 3.83Å
289	K	97.1	Very high	95.4	Very high	67 Å²	67	69.2 Å²	69.2	29%	0.291	35%	0.351	S	S	.	.			trans	-110.1	165.6	-179.6	-61.2	-57.7	-177.9	175.3	0	111.6	K263 T287 K291 D292 V293	K263-K289 VanDerWaalsContact O-CD 3.32Å; K263-K289 WeakPolarHBondContact O-CD 3.4Å; K263-K289 PolarHBondContact O-NZ 3.45Å; K263-K289 VanDerWaalsContact O-NZ 3.09Å; T287-K289 PolarHBondContact O-N 2.71Å; K289-K291 PolarHBondContact O-N 2.72Å; K289-K291 VanDerWaalsContact O-N 3.16Å; K289-D292 WeakPolarHBondContact CB-OD2 3.5Å; K289-D292 PolarHBondContact N-OD2 2.86Å; K289-D292 WeakPolarHBondContact O-CB 3.38Å; K289-D292 PolarHBondContact O-N 2.97Å; K289-V293 PolarHBondContact O-N 3.46Å
290	L	96.7	Very high	95.5	Very high	27 Å²	27	71 Å²	71	14%	0.141	36%	0.359	C	S	.	.	H	α-helix	trans	-51.4	-40.8	177.5	179.8	61.4	0	0	0	112.1	L244 D292 V293 Q294 K320	L244-L290 HydrophobicContact CB-CD1 4.49Å; L244-L290 HydrophobicContact CD2-CD1 3.75Å; L290-D292 VanDerWaalsContact C-N 3.26Å; L290-D292 PolarHBondContact O-N 3.37Å; L290-V293 HydrophobicContact CD1-CG2 4.22Å; L290-V293 WeakPolarHBondContact O-CG2 3.2Å; L290-V293 PolarHBondContact O-N 2.82Å; L290-Q294 HydrophobicContact CD1-CG 4.21Å; L290-Q294 HydrophobicContact CG-CG 4.27Å; L290-Q294 WeakPolarHBondContact O-CB 3.33Å; L290-Q294 WeakPolarHBondContact O-CG 3.34Å; L290-Q294 PolarHBondContact O-N 3.08Å; L290-K320 HydrophobicContact CD2-CB 4.47Å; L290-K320 HydrophobicContact CD2-CD 3.84Å; L290-K320 HydrophobicContact CD2-CG 4.13Å
291	K	96.4	Very high	95.6	Very high	136 Å²	136	65.4 Å²	65.4	59%	0.591	34%	0.335	S	S	*	.	H	α-helix	trans	-63.9	-30.3	179.2	-64.6	-178.7	-177	176.3	0	113.5	K289 R295	K289-K291 PolarHBondContact O-N 2.72Å; K289-K291 VanDerWaalsContact O-N 3.16Å; K291-R295 WeakPolarHBondContact O-CB 3.22Å; K291-R295 PolarHBondContact O-N 3Å
292	D	97.1	Very high	95.6	Very high	51 Å²	51	58.9 Å²	58.9	27%	0.273	31%	0.31	S	S	.	.	H	α-helix	trans	-73.8	-48.1	-179	-56.7	-47.8	0	0	0	110	T288 K289 L290 Q294 R295 Q296	T288-D292 HydrophobicContact CG2-CB 4.05Å; K289-D292 WeakPolarHBondContact CB-OD2 3.5Å; K289-D292 PolarHBondContact N-OD2 2.86Å; K289-D292 WeakPolarHBondContact O-CB 3.38Å; K289-D292 PolarHBondContact O-N 2.97Å; L290-D292 VanDerWaalsContact C-N 3.26Å; L290-D292 PolarHBondContact O-N 3.37Å; D292-Q294 PolarHBondContact O-N 3.15Å; D292-R295 WeakPolarHBondContact O-CB 3.23Å; D292-R295 PolarHBondContact O-N 3.28Å; D292-R295 VanDerWaalsContact O-N 3.16Å; D292-R295 IonicContact OD1-NH1 3.69Å; D292-R295 IonicContact OD1-NH2 2.62Å; D292-Q296 WeakPolarHBondContact O-CG 3.44Å; D292-Q296 PolarHBondContact O-N 3.05Å
293	V	97.3	Very high	95.6	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.3	-36.1	176.6	-64.6	0	0	0	0	112.6	L244 I247 M258 E260 V262 T288 K289 L290 R295 Q296 L297	L244-V293 HydrophobicContact CD2-CG2 3.9Å; I247-V293 HydrophobicContact CG2-CB 4.12Å; I247-V293 HydrophobicContact CG2-CG1 3.96Å; M258-V293 HydrophobicContact CE-CB 3.5Å; M258-V293 VanDerWaalsContact CE-CB 3.5Å; M258-V293 HydrophobicContact CE-CG1 3.67Å; E260-V293 HydrophobicContact CB-CG1 3.87Å; E260-V293 HydrophobicContact CG-CG1 4.45Å; V262-V293 HydrophobicContact CG2-CB 4.37Å; V262-V293 HydrophobicContact CG2-CG1 3.59Å; V262-V293 HydrophobicContact CG2-CG2 3.93Å; T288-V293 HydrophobicContact CG2-CG1 3.83Å; K289-V293 PolarHBondContact O-N 3.46Å; L290-V293 HydrophobicContact CD1-CG2 4.22Å; L290-V293 WeakPolarHBondContact O-CG2 3.2Å; L290-V293 PolarHBondContact O-N 2.82Å; V293-R295 VanDerWaalsContact C-N 3.3Å; V293-R295 PolarHBondContact O-N 3.37Å; V293-Q296 PolarHBondContact O-N 3Å; V293-L297 VanDerWaalsContact O-CB 3.27Å; V293-L297 WeakPolarHBondContact O-CB 3.49Å; V293-L297 PolarHBondContact O-N 3Å
294	Q	97.4	Very high	95.6	Very high	15 Å²	15	60.8 Å²	60.8	7%	0.07	33%	0.325	C	S	.	.	H	α-helix	trans	-60.6	-39.9	172.6	-74.3	173	-30.2	0	0	112	L214 L290 D292 K298 L319 M321	L214-Q294 HydrophobicContact CD1-CB 4.08Å; L214-Q294 HydrophobicContact CD1-CG 4.38Å; L290-Q294 HydrophobicContact CD1-CG 4.21Å; L290-Q294 HydrophobicContact CG-CG 4.27Å; L290-Q294 WeakPolarHBondContact O-CB 3.33Å; L290-Q294 WeakPolarHBondContact O-CG 3.34Å; L290-Q294 PolarHBondContact O-N 3.08Å; D292-Q294 PolarHBondContact O-N 3.15Å; Q294-K298 VanDerWaalsContact O-CB 3.24Å; Q294-K298 WeakPolarHBondContact O-CB 3.33Å; Q294-K298 PolarHBondContact O-N 2.97Å; Q294-K298 VanDerWaalsContact O-N 3.08Å; Q294-L319 PolarHBondContact NE2-O 2.97Å; Q294-M321 HydrophobicContact CB-SD 4.01Å; Q294-M321 HydrophobicContact CG-CG 4.01Å; Q294-M321 HydrophobicContact CG-SD 3.77Å
295	R	96.4	Very high	95.8	Very high	164 Å²	164	56.5 Å²	56.5	62%	0.619	30%	0.302	S	S	*	.	H	α-helix	trans	-68	-44.3	178.1	-169.5	-171.1	-54.4	126.6	10.7	111.1	K291 D292 V293 K298 A299	K291-R295 WeakPolarHBondContact O-CB 3.22Å; K291-R295 PolarHBondContact O-N 3Å; D292-R295 WeakPolarHBondContact O-CB 3.23Å; D292-R295 PolarHBondContact O-N 3.28Å; D292-R295 VanDerWaalsContact O-N 3.16Å; D292-R295 IonicContact OD1-NH1 3.69Å; D292-R295 IonicContact OD1-NH2 2.62Å; V293-R295 VanDerWaalsContact C-N 3.3Å; V293-R295 PolarHBondContact O-N 3.37Å; R295-K298 PolarHBondContact O-N 3.29Å; R295-A299 PolarHBondContact O-N 3.3Å; R295-A299 VanDerWaalsContact O-N 3.15Å
296	Q	96.2	Very high	95.9	Very high	75 Å²	75	51.8 Å²	51.8	35%	0.35	27%	0.271	S	S	.	.	H	α-helix	trans	-62.7	-51	176.9	-72.2	171.5	-20.6	0	0	111.2	M258 D292 V293 K298 A299 L300	M258-Q296 HydrophobicContact CE-CB 3.97Å; M258-Q296 HydrophobicContact SD-CB 4.44Å; D292-Q296 WeakPolarHBondContact O-CG 3.44Å; D292-Q296 PolarHBondContact O-N 3.05Å; V293-Q296 PolarHBondContact O-N 3Å; Q296-K298 VanDerWaalsContact C-N 3.29Å; Q296-K298 PolarHBondContact O-N 2.81Å; Q296-A299 WeakPolarHBondContact O-CA 3.28Å; Q296-A299 WeakPolarHBondContact O-CB 3.14Å; Q296-A299 PolarHBondContact O-N 2.96Å; Q296-L300 WeakPolarHBondContact O-CG 3.3Å; Q296-L300 PolarHBondContact O-N 3.05Å
297	L	96.1	Very high	96	Very high	1 Å²	1	51 Å²	51	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-56.6	-43.3	178.1	-176.5	59.9	0	0	0	111.6	I247 L249 M258 V293 A299 L300 L301 L319 M321	I247-L297 HydrophobicContact CD1-CD2 4.14Å; L249-L297 HydrophobicContact CD1-CD1 3.93Å; L249-L297 HydrophobicContact CD2-CD1 3.61Å; L249-L297 HydrophobicContact CG-CD1 4.29Å; M258-L297 HydrophobicContact SD-CB 4.37Å; V293-L297 VanDerWaalsContact O-CB 3.27Å; V293-L297 WeakPolarHBondContact O-CB 3.49Å; V293-L297 PolarHBondContact O-N 3Å; L297-A299 VanDerWaalsContact C-N 3.26Å; L297-A299 PolarHBondContact O-N 3.46Å; L297-L300 PolarHBondContact O-N 2.56Å; L297-L301 HydrophobicContact CD1-CD1 3.83Å; L297-L301 HydrophobicContact CD1-CD2 4.46Å; L297-L301 HydrophobicContact CD1-CG 4.03Å; L297-L301 HydrophobicContact CG-CD1 3.96Å; L297-L301 HydrophobicContact CG-CG 4.5Å; L297-L301 WeakPolarHBondContact O-CG 3.48Å; L297-L301 PolarHBondContact O-N 3.05Å; L297-L301 VanDerWaalsContact O-N 3.16Å; L297-L319 HydrophobicContact CD2-CD1 4.31Å; L297-M321 HydrophobicContact CD2-CE 4.26Å; L297-M321 HydrophobicContact CD2-SD 3.81Å
298	K	94.7	Very high	96.1	Very high	68 Å²	68	45.6 Å²	45.6	30%	0.296	23%	0.233	S	C	.	.	H	α-helix	trans	-66.8	-23.5	177	-172	168.5	-177.1	161	0	114	L215 K217 Q294 R295 Q296	L215-K298 WeakPolarHBondContact O-CE 3.21Å; L215-K298 PolarHBondContact O-NZ 3.39Å; K217-K298 HydrophobicContact CD-CG 4.16Å; K217-K298 HydrophobicContact CG-CD 4.16Å; K217-K298 HydrophobicContact CG-CG 3.7Å; Q294-K298 VanDerWaalsContact O-CB 3.24Å; Q294-K298 WeakPolarHBondContact O-CB 3.33Å; Q294-K298 PolarHBondContact O-N 2.97Å; Q294-K298 VanDerWaalsContact O-N 3.08Å; R295-K298 PolarHBondContact O-N 3.29Å; Q296-K298 VanDerWaalsContact C-N 3.29Å; Q296-K298 PolarHBondContact O-N 2.81Å
299	A	94.7	Very high	96.1	Very high	80 Å²	80	44 Å²	44	66%	0.661	22%	0.223	S	C	*	.	H	α-helix	trans	-85.9	-32.2	176.3	0	0	0	0	0	112.3	R295 Q296 L297	R295-A299 PolarHBondContact O-N 3.3Å; R295-A299 VanDerWaalsContact O-N 3.15Å; Q296-A299 WeakPolarHBondContact O-CA 3.28Å; Q296-A299 WeakPolarHBondContact O-CB 3.14Å; Q296-A299 PolarHBondContact O-N 2.96Å; L297-A299 VanDerWaalsContact C-N 3.26Å; L297-A299 PolarHBondContact O-N 3.46Å
300	L	94.9	Very high	96	Very high	75 Å²	75	42.1 Å²	42.1	39%	0.393	22%	0.215	S	C	.	.	H	α-helix	trans	-76.6	-35.5	-179	-70.8	171.2	0	0	0	113.3	L249 M258 Q296 L297 P302	L249-L300 HydrophobicContact CD2-CB 4.38Å; L249-L300 HydrophobicContact CD2-CD1 4.42Å; M258-L300 HydrophobicContact CB-CD1 3.91Å; M258-L300 HydrophobicContact CG-CD1 4.34Å; M258-L300 HydrophobicContact SD-CD1 4.11Å; Q296-L300 WeakPolarHBondContact O-CG 3.3Å; Q296-L300 PolarHBondContact O-N 3.05Å; L297-L300 PolarHBondContact O-N 2.56Å; L300-P302 WeakPolarHBondContact O-CD 3.48Å
301	L	95.6	Very high	95.9	Very high	8 Å²	8	41.8 Å²	41.8	4%	0.042	22%	0.216	C	C	.	.	S	Bend	trans	-78.7	121.7	-175.9	-65.2	173.9	0	0	0	112	T216 F229 L249 L297 A305 L307	T216-L301 HydrophobicContact CG2-CD1 4.02Å; F229-L301 HydrophobicContact CB-CD2 4.13Å; F229-L301 HydrophobicContact CD1-CD2 4.14Å; F229-L301 HydrophobicContact CD2-CD2 3.93Å; F229-L301 HydrophobicContact CE2-CD2 4.37Å; F229-L301 HydrophobicContact CG-CD2 3.8Å; L249-L301 HydrophobicContact CD1-CD2 4.49Å; L249-L301 HydrophobicContact CD2-CD2 4.05Å; L297-L301 HydrophobicContact CD1-CD1 3.83Å; L297-L301 HydrophobicContact CD1-CD2 4.46Å; L297-L301 HydrophobicContact CD1-CG 4.03Å; L297-L301 HydrophobicContact CG-CD1 3.96Å; L297-L301 HydrophobicContact CG-CG 4.5Å; L297-L301 WeakPolarHBondContact O-CG 3.48Å; L297-L301 PolarHBondContact O-N 3.05Å; L297-L301 VanDerWaalsContact O-N 3.16Å; L301-A305 HydrophobicContact CB-CB 3.95Å; L301-A305 HydrophobicContact CD2-CB 3.97Å; L301-A305 HydrophobicContact CG-CB 4.49Å; L301-L307 HydrophobicContact CD1-CD1 4.49Å; L301-L307 HydrophobicContact CD1-CD2 4.06Å; L301-L307 HydrophobicContact CD2-CD2 3.82Å
302	P	94.2	Very high	95.9	Very high	40 Å²	40	35.3 Å²	35.3	26%	0.26	19%	0.188	S	C	.	.			trans	-67.2	166.7	171.9	27.3	-35.1	0	0	0	112.9	C218 P227 F229 L300 D304 A305	C218-P302 PolarHBondContact SG-O 2.83Å; P227-P302 HydrophobicContact CG-CG 3.75Å; F229-P302 HydrophobicContact CE2-CG 3.85Å; F229-P302 HydrophobicContact CZ-CG 4.02Å; L300-P302 WeakPolarHBondContact O-CD 3.48Å; P302-D304 PolarHBondContact O-N 3Å; P302-A305 HydrophobicContact CG-CB 3.89Å; P302-A305 VanDerWaalsContact O-CB 3.22Å; P302-A305 WeakPolarHBondContact O-CB 3.37Å; P302-A305 PolarHBondContact O-N 3.44Å; P302-A305 VanDerWaalsContact O-N 3.07Å
303	P	92.9	Very high	95.8	Very high	64 Å²	64	33.6 Å²	33.6	42%	0.416	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-27.8	-177.6	-26.7	36.6	0	0	0	115.1	C218 N219 G220	C218-P303 CarbonylContact C-O 3.4Å; C218-P303 VanDerWaalsContact C-O 3.27Å; C218-P303 WeakPolarHBondContact CA-O 3.44Å; C218-P303 WeakPolarHBondContact CB-O 3.49Å; N219-P303 PolarHBondContact N-O 2.91Å; N219-P303 VanDerWaalsContact N-O 3.13Å; G220-P303 PolarHBondContact N-O 3.38Å
304	D	93.9	Very high	95.6	Very high	52 Å²	52	37.4 Å²	37.4	28%	0.278	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	15	178.8	63.2	-26.7	0	0	0	112.6	I222 S226 P227 P302 V306	I222-D304 HydrophobicContact CD1-CB 4Å; I222-D304 WeakPolarHBondContact CD1-O 3.46Å; S226-D304 WeakPolarHBondContact CB-O 3.45Å; P227-D304 WeakPolarHBondContact CD-OD2 3.46Å; P302-D304 PolarHBondContact O-N 3Å; D304-V306 PolarHBondContact O-N 3.05Å
305	A	95.8	Very high	95.6	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.197	C	C	.	.			trans	-61.3	137.9	178.2	0	0	0	0	0	112.2	F229 L301 P302 H323	F229-A305 HydrophobicContact CD2-CB 3.84Å; F229-A305 HydrophobicContact CE2-CB 3.77Å; L301-A305 HydrophobicContact CB-CB 3.95Å; L301-A305 HydrophobicContact CD2-CB 3.97Å; L301-A305 HydrophobicContact CG-CB 4.49Å; P302-A305 HydrophobicContact CG-CB 3.89Å; P302-A305 VanDerWaalsContact O-CB 3.22Å; P302-A305 WeakPolarHBondContact O-CB 3.37Å; P302-A305 PolarHBondContact O-N 3.44Å; P302-A305 VanDerWaalsContact O-N 3.07Å; A305-H323 PolarHBondContact O-CE1 2.87Å; A305-H323 PolarHBondContact O-NE2 3.41Å
306	V	97.2	Very high	95.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	118.4	175.5	175.5	0	0	0	0	108.7	L187 L191 I222 P227 L228 F229 D304 Y325 I327	L187-V306 HydrophobicContact CD2-CG1 4.49Å; L187-V306 HydrophobicContact CD2-CG2 4.04Å; L191-V306 HydrophobicContact CD2-CG1 3.74Å; L191-V306 HydrophobicContact CD2-CG2 4.32Å; I222-V306 HydrophobicContact CD1-CG2 4.02Å; I222-V306 HydrophobicContact CG2-CG2 4.16Å; P227-V306 PolarHBondContact O-N 2.83Å; L228-V306 HydrophobicContact CD2-CB 3.92Å; L228-V306 HydrophobicContact CD2-CG1 3.76Å; F229-V306 PolarHBondContact N-O 2.97Å; D304-V306 PolarHBondContact O-N 3.05Å; V306-Y325 WeakPolarHBondContact CA-O 3.34Å; V306-I327 HydrophobicContact CG1-CD1 3.9Å; V306-I327 HydrophobicContact CG1-CG1 3.85Å
307	L	98	Very high	95.5	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	129.3	176.6	-67.9	-177.4	0	0	0	110.8	F229 L231 L249 L301 L312 L316 H323 Y325 V326 I327	F229-L307 HydrophobicContact CB-CD2 4Å; F229-L307 CarbonylContact O-C 3.57Å; F229-L307 WeakPolarHBondContact O-CA 3.49Å; L231-L307 HydrophobicContact CB-CD2 4.48Å; L231-L307 HydrophobicContact CD2-CD1 4.02Å; L249-L307 HydrophobicContact CD1-CD2 4.12Å; L301-L307 HydrophobicContact CD1-CD1 4.49Å; L301-L307 HydrophobicContact CD1-CD2 4.06Å; L301-L307 HydrophobicContact CD2-CD2 3.82Å; L307-L312 HydrophobicContact CB-CD2 3.97Å; L307-L316 HydrophobicContact CD1-CD2 4.18Å; L307-H323 HydrophobicContact CD1-CB 3.74Å; L307-H323 VanDerWaalsContact CD1-CG 3.48Å; L307-H323 VanDerWaalsContact CG-CD2 3.44Å; L307-H323 WeakPolarHBondContact CG-CD2 3.46Å; L307-H323 PolarHBondContact N-NE2 2.88Å; L307-Y325 PolarHBondContact N-O 3.22Å; L307-V326 WeakPolarHBondContact O-CA 3.5Å; L307-I327 PolarHBondContact O-N 3.19Å
308	V	98	Very high	95.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	128.4	175	-164.8	0	0	0	0	109	L228 F229 G230 L231 I327 T329 I372 L373 A376	L228-V308 HydrophobicContact CB-CG2 4.09Å; L228-V308 HydrophobicContact CD2-CG2 3.75Å; L228-V308 HydrophobicContact CG-CG2 4.36Å; F229-V308 PolarHBondContact O-N 3.35Å; G230-V308 WeakPolarHBondContact CA-O 3.18Å; L231-V308 PolarHBondContact N-O 3.02Å; V308-I327 VanDerWaalsContact CA-O 3.26Å; V308-I327 WeakPolarHBondContact CA-O 3.43Å; V308-I327 HydrophobicContact CG1-CB 4.33Å; V308-I327 HydrophobicContact CG1-CG2 4.32Å; V308-I327 HydrophobicContact CG2-CB 4.36Å; V308-T329 HydrophobicContact CG1-CG2 4Å; V308-I372 HydrophobicContact CB-CG2 4.1Å; V308-I372 HydrophobicContact CG1-CG2 3.56Å; V308-L373 HydrophobicContact CB-CD2 4.16Å; V308-L373 HydrophobicContact CG2-CD2 3.96Å; V308-A376 HydrophobicContact CG1-CB 3.63Å
309	G	97.1	Very high	95.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	-176.8	-179.7	0	0	0	0	0	113.3	I327 T329	G309-I327 PolarHBondContact N-O 3.1Å; G309-T329 PolarHBondContact O-N 2.81Å; G309-T329 PolarHBondContact O-OG1 3.26Å
310	H	96	Very high	95.6	Very high	27 Å²	27	26.6 Å²	26.6	13%	0.125	14%	0.139	C	C	.	.	S	Bend	trans	-131.3	102.9	172.8	-168.2	87.3	0	0	0	109.9	T329 F341 L343 I372	H310-T329 WeakPolarHBondContact CB-OG1 3.16Å; H310-T329 PolarHBondContact ND1-OG1 3.13Å; H310-F341 PolarHBondContact CE1-O 3.45Å; H310-F341 PolarHBondContact NE2-O 3.22Å; H310-L343 HydrophobicContact CB-CD1 4.32Å; H310-L343 PolarHBondContact NE2-N 2.85Å; H310-I372 HydrophobicContact CB-CD1 3.78Å; H310-I372 HydrophobicContact CB-CG1 3.95Å
311	S	94.4	Very high	95.6	Very high	21 Å²	21	23.1 Å²	23.1	15%	0.147	12%	0.121	C	C	.	.	S	Bend	trans	63	42.9	-163.2	-56.4	0	0	0	0	113.2	D313 L314 D328 S330 R340	S311-D313 PolarHBondContact O-N 2.84Å; S311-L314 PolarHBondContact O-N 3.46Å; S311-D328 WeakPolarHBondContact CA-OD2 3.35Å; S311-D328 PolarHBondContact N-OD1 2.9Å; S311-D328 PolarHBondContact N-OD2 3.46Å; S311-S330 PolarHBondContact N-OG 3.47Å; S311-R340 WeakPolarHBondContact OG-CD 3.34Å; S311-R340 PolarHBondContact OG-NH1 3.17Å
312	L	95.8	Very high	95.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-63.7	-14.3	-171.9	-165.4	68.6	0	0	0	113.3	F202 L231 L307 L314 D315 L316 V326 D328	F202-L312 HydrophobicContact CE1-CB 4.03Å; F202-L312 HydrophobicContact CZ-CB 4.48Å; L231-L312 HydrophobicContact CB-CD1 4.06Å; L231-L312 HydrophobicContact CD2-CD1 4Å; L231-L312 HydrophobicContact CG-CD1 4.07Å; L307-L312 HydrophobicContact CB-CD2 3.97Å; L312-L314 PolarHBondContact O-N 3.4Å; L312-D315 WeakPolarHBondContact CA-OD2 3.45Å; L312-D315 HydrophobicContact CD1-CB 3.81Å; L312-D315 PolarHBondContact O-N 3.42Å; L312-L316 HydrophobicContact CD2-CD1 4.29Å; L312-L316 HydrophobicContact CG-CD1 4.26Å; L312-L316 HydrophobicContact CG-CG 4.19Å; L312-L316 WeakPolarHBondContact O-CG 3.36Å; L312-L316 PolarHBondContact O-N 3.48Å; L312-V326 HydrophobicContact CD2-CG1 3.77Å; L312-V326 HydrophobicContact CD2-CG2 4.41Å; L312-D328 PolarHBondContact N-OD2 2.9Å
313	D	94.4	Very high	95.7	Very high	14 Å²	14	21.4 Å²	21.4	8%	0.075	11%	0.11	C	C	.	.	H	α-helix	trans	-56.4	-35.1	171.5	65.3	-87.8	0	0	0	112.2	F202 S311 R317 R340	F202-D313 HydrophobicContact CD1-CB 3.99Å; F202-D313 HydrophobicContact CD2-CB 3.88Å; F202-D313 HydrophobicContact CE1-CB 3.94Å; F202-D313 VanDerWaalsContact CE1-N 3.3Å; F202-D313 HydrophobicContact CE2-CB 3.85Å; F202-D313 HydrophobicContact CG-CB 3.95Å; F202-D313 HydrophobicContact CZ-CB 3.88Å; S311-D313 PolarHBondContact O-N 2.84Å; D313-R317 WeakPolarHBondContact O-CB 3.3Å; D313-R317 WeakPolarHBondContact O-CD 3.46Å; D313-R317 WeakPolarHBondContact O-CG 3.35Å; D313-R317 PolarHBondContact O-N 3.11Å; D313-R340 IonicContact OD1-CZ 3.94Å; D313-R340 IonicContact OD1-NH1 3.75Å; D313-R340 PolarHBondContact OD1-NH1 2.61Å; D313-R340 IonicContact OD1-NH2 3.53Å; D313-R340 PolarHBondContact OD1-NH2 3.16Å; D313-R340 VanDerWaalsContact OD1-NH2 3.11Å
314	L	94.4	Very high	95.7	Very high	80 Å²	80	20.8 Å²	20.8	42%	0.419	11%	0.106	S	C	.	.	H	α-helix	trans	-73.1	-43.1	178.6	-60.6	179.1	0	0	0	111.7	M235 S311 L312 R317 A318	M235-L314 HydrophobicContact CE-CB 4.13Å; S311-L314 PolarHBondContact O-N 3.46Å; L312-L314 PolarHBondContact O-N 3.4Å; L314-R317 PolarHBondContact O-N 3.19Å; L314-A318 PolarHBondContact O-N 2.89Å
315	D	96.9	Very high	95.8	Very high	7 Å²	7	21 Å²	21	4%	0.037	10%	0.103	C	C	.	.	H	α-helix	trans	-64	-49.3	179.5	-56.9	-74.4	0	0	0	111.4	C233 L312 R317 A318 L319	C233-D315 HydrophobicContact CB-CB 4.35Å; C233-D315 VanDerWaalsContact CB-OD1 3.23Å; C233-D315 WeakPolarHBondContact CB-OD1 3.31Å; C233-D315 PolarHBondContact N-OD1 3.41Å; C233-D315 VanDerWaalsContact N-OD1 3.13Å; L312-D315 WeakPolarHBondContact CA-OD2 3.45Å; L312-D315 HydrophobicContact CD1-CB 3.81Å; L312-D315 PolarHBondContact O-N 3.42Å; D315-R317 PolarHBondContact O-N 3.36Å; D315-A318 PolarHBondContact O-N 2.59Å; D315-A318 VanDerWaalsContact O-N 3.15Å; D315-L319 WeakPolarHBondContact O-CB 3.07Å; D315-L319 WeakPolarHBondContact O-CG 3.36Å; D315-L319 PolarHBondContact O-N 3.19Å
316	L	96.6	Very high	95.8	Very high	2 Å²	2	21 Å²	21	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-63.4	-31.6	179	-70.1	174.4	0	0	0	112.2	F202 P203 L231 L307 L312 K320 M321 H323 V326	F202-L316 HydrophobicContact CD1-CD1 4.1Å; F202-L316 HydrophobicContact CE1-CD1 4.44Å; P203-L316 HydrophobicContact CG-CB 3.88Å; L231-L316 HydrophobicContact CD2-CD2 4.45Å; L307-L316 HydrophobicContact CD1-CD2 4.18Å; L312-L316 HydrophobicContact CD2-CD1 4.29Å; L312-L316 HydrophobicContact CG-CD1 4.26Å; L312-L316 HydrophobicContact CG-CG 4.19Å; L312-L316 WeakPolarHBondContact O-CG 3.36Å; L312-L316 PolarHBondContact O-N 3.48Å; L316-K320 PolarHBondContact O-N 3.31Å; L316-M321 PolarHBondContact O-N 3.01Å; L316-H323 HydrophobicContact CD2-CB 4.4Å; L316-V326 HydrophobicContact CD1-CG2 4.27Å
317	R	94.6	Very high	95.8	Very high	77 Å²	77	21 Å²	21	29%	0.291	10%	0.103	S	C	.	.	H	α-helix	trans	-69.8	-44.5	172.5	-76.8	175.1	178.1	-93.4	0.2	112.4	H201 P203 E209 F213 D313 L314 D315 L319 K320	H201-R317 VanDerWaalsContact O-CZ 3.24Å; H201-R317 PolarHBondContact O-NE 2.85Å; H201-R317 PolarHBondContact O-NH2 3.02Å; P203-R317 HydrophobicContact CG-CG 3.74Å; E209-R317 IonicContact OE2-NH1 3.8Å; F213-R317 HydrophobicContact CE2-CG 4.4Å; D313-R317 WeakPolarHBondContact O-CB 3.3Å; D313-R317 WeakPolarHBondContact O-CD 3.46Å; D313-R317 WeakPolarHBondContact O-CG 3.35Å; D313-R317 PolarHBondContact O-N 3.11Å; L314-R317 PolarHBondContact O-N 3.19Å; D315-R317 PolarHBondContact O-N 3.36Å; R317-L319 VanDerWaalsContact C-N 3.27Å; R317-L319 PolarHBondContact O-N 3.41Å; R317-K320 PolarHBondContact O-N 2.83Å; R317-K320 VanDerWaalsContact O-N 3.08Å
318	A	94.8	Very high	95.7	Very high	9 Å²	9	21.1 Å²	21.1	7%	0.074	10%	0.104	C	C	.	.	H	α-helix	trans	-63.2	-37.6	175.2	0	0	0	0	0	111.6	M235 L244 L314 D315 K320	M235-A318 HydrophobicContact CE-CB 4.36Å; M235-A318 HydrophobicContact CG-CB 4.03Å; L244-A318 HydrophobicContact CB-CB 4.48Å; L314-A318 PolarHBondContact O-N 2.89Å; D315-A318 PolarHBondContact O-N 2.59Å; D315-A318 VanDerWaalsContact O-N 3.15Å; A318-K320 VanDerWaalsContact C-N 3.26Å; A318-K320 PolarHBondContact O-N 3.21Å
319	L	96.3	Very high	95.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-72.6	-16.3	174.1	-74.6	165.4	0	0	0	113.4	L231 L244 I247 Q294 L297 D315 R317 M321	L231-L319 HydrophobicContact CD1-CD1 4.4Å; L231-L319 HydrophobicContact CD2-CD1 3.83Å; L244-L319 HydrophobicContact CD1-CD2 4.45Å; L244-L319 HydrophobicContact CD2-CD2 3.49Å; L244-L319 VanDerWaalsContact CD2-CD2 3.49Å; L244-L319 HydrophobicContact CD2-CG 4.37Å; I247-L319 HydrophobicContact CD1-CD1 4.26Å; I247-L319 HydrophobicContact CD1-CD2 3.71Å; I247-L319 HydrophobicContact CG1-CD2 4.49Å; Q294-L319 PolarHBondContact NE2-O 2.97Å; L297-L319 HydrophobicContact CD2-CD1 4.31Å; D315-L319 WeakPolarHBondContact O-CB 3.07Å; D315-L319 WeakPolarHBondContact O-CG 3.36Å; D315-L319 PolarHBondContact O-N 3.19Å; R317-L319 VanDerWaalsContact C-N 3.27Å; R317-L319 PolarHBondContact O-N 3.41Å; L319-M321 HydrophobicContact CB-CB 4.26Å; L319-M321 HydrophobicContact CB-CG 4.28Å; L319-M321 WeakPolarHBondContact O-CG 3.35Å; L319-M321 PolarHBondContact O-N 3.5Å
320	K	95.1	Very high	95.4	Very high	82 Å²	82	21.1 Å²	21.1	36%	0.357	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	45.7	-170.2	-56.8	-179	-175.3	171.4	0	112	F213 L214 L290 L316 R317 A318	F213-K320 CarbonylContact C-O 3.58Å; F213-K320 VanDerWaalsContact CA-O 3.25Å; F213-K320 WeakPolarHBondContact CA-O 3.34Å; F213-K320 WeakPolarHBondContact CB-O 3.47Å; F213-K320 HydrophobicContact CD1-CB 3.86Å; F213-K320 HydrophobicContact CD1-CG 4.33Å; F213-K320 VanDerWaalsContact CD2-C 3.47Å; F213-K320 HydrophobicContact CD2-CB 4.4Å; F213-K320 HydrophobicContact CE1-CB 3.95Å; F213-K320 HydrophobicContact CE1-CG 3.93Å; F213-K320 HydrophobicContact CE2-CB 4.49Å; F213-K320 HydrophobicContact CG-CB 4.1Å; F213-K320 HydrophobicContact CZ-CB 4.27Å; F213-K320 HydrophobicContact CZ-CG 4.2Å; L214-K320 PolarHBondContact N-O 3.32Å; L290-K320 HydrophobicContact CD2-CB 4.47Å; L290-K320 HydrophobicContact CD2-CD 3.84Å; L290-K320 HydrophobicContact CD2-CG 4.13Å; L316-K320 PolarHBondContact O-N 3.31Å; R317-K320 PolarHBondContact O-N 2.83Å; R317-K320 VanDerWaalsContact O-N 3.08Å; A318-K320 VanDerWaalsContact C-N 3.26Å; A318-K320 PolarHBondContact O-N 3.21Å
321	M	95.7	Very high	95.1	Very high	1 Å²	1	20 Å²	20	1%	0.005	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	150.7	-179	-71.7	-170	65.6	0	0	112	L214 T216 Q294 L297 L316 L319	L214-M321 HydrophobicContact CB-CG 4.33Å; L214-M321 CarbonylContact O-C 3.56Å; L214-M321 WeakPolarHBondContact O-CA 3.3Å; T216-M321 HydrophobicContact CG2-CE 3.49Å; T216-M321 VanDerWaalsContact CG2-CE 3.49Å; Q294-M321 HydrophobicContact CB-SD 4.01Å; Q294-M321 HydrophobicContact CG-CG 4.01Å; Q294-M321 HydrophobicContact CG-SD 3.77Å; L297-M321 HydrophobicContact CD2-CE 4.26Å; L297-M321 HydrophobicContact CD2-SD 3.81Å; L316-M321 PolarHBondContact O-N 3.01Å; L319-M321 HydrophobicContact CB-CB 4.26Å; L319-M321 HydrophobicContact CB-CG 4.28Å; L319-M321 WeakPolarHBondContact O-CG 3.35Å; L319-M321 PolarHBondContact O-N 3.5Å
322	I	95.5	Very high	94.9	Very high	13 Å²	13	19.2 Å²	19.2	7%	0.067	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	128.4	173.4	-62	164.5	0	0	0	107.1	P203 C210 F213 L214 L215 T216	P203-I322 HydrophobicContact CB-CG1 3.77Å; C210-I322 HydrophobicContact CB-CD1 4.32Å; F213-I322 HydrophobicContact CB-CD1 3.93Å; F213-I322 HydrophobicContact CB-CG1 3.92Å; F213-I322 HydrophobicContact CD2-CG1 4.36Å; L214-I322 PolarHBondContact O-N 3.02Å; L215-I322 WeakPolarHBondContact CA-O 3.49Å; L215-I322 HydrophobicContact CD1-CB 3.87Å; L215-I322 HydrophobicContact CD1-CG2 3.61Å; T216-I322 PolarHBondContact N-O 3.3Å; T216-I322 PolarHBondContact OG1-O 3.33Å
323	H	95.8	Very high	94.6	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.093	C	C	.	.			trans	-130.5	128.9	175.6	-177.3	71.7	0	0	0	109.8	T216 C218 A305 L307 L316 Y325	T216-H323 HydrophobicContact CG2-CB 3.97Å; T216-H323 PolarHBondContact OG1-ND1 3.45Å; C218-H323 PolarHBondContact SG-CE1 3.41Å; A305-H323 PolarHBondContact O-CE1 2.87Å; A305-H323 PolarHBondContact O-NE2 3.41Å; L307-H323 HydrophobicContact CD1-CB 3.74Å; L307-H323 VanDerWaalsContact CD1-CG 3.48Å; L307-H323 VanDerWaalsContact CG-CD2 3.44Å; L307-H323 WeakPolarHBondContact CG-CD2 3.46Å; L307-H323 PolarHBondContact N-NE2 2.88Å; L316-H323 HydrophobicContact CD2-CB 4.4Å; H323-Y325 PolarHBondContact CD2-N 3.22Å; H323-Y325 PolarHBondContact CD2-O 3.11Å; H323-Y325 PolarHBondContact NE2-O 3.46Å
324	P	92.6	Very high	93.7	Very high	51 Å²	51	19.9 Å²	19.9	33%	0.331	10%	0.097	S	C	.	.	S	Bend	trans	-81.2	-19.6	-170.8	28.8	-33.4	0	0	0	115.1	C218	C218-P324 HydrophobicContact CB-CG 4.23Å; C218-P324 WeakPolarHBondContact O-CG 3.31Å
325	Y	96	Very high	92.7	Very high	55 Å²	55	16.6 Å²	16.6	22%	0.216	8%	0.079	C	C	.	.			trans	-117.9	88.8	-171.6	-49.9	-57.4	0	0	0	111.1	C218 G220 I222 V306 L307 H323	C218-Y325 HydrophobicContact CB-CD2 3.95Å; C218-Y325 HydrophobicContact CB-CE2 3.97Å; G220-Y325 PolarHBondContact O-OH 3.16Å; I222-Y325 HydrophobicContact CD1-CD1 4.15Å; I222-Y325 HydrophobicContact CD1-CD2 3.5Å; I222-Y325 HydrophobicContact CD1-CE1 4.34Å; I222-Y325 HydrophobicContact CD1-CE2 3.74Å; I222-Y325 HydrophobicContact CD1-CG 3.72Å; I222-Y325 HydrophobicContact CG1-CD1 3.44Å; I222-Y325 VanDerWaalsContact CG1-CD1 3.44Å; I222-Y325 HydrophobicContact CG1-CD2 3.74Å; I222-Y325 HydrophobicContact CG1-CE1 3.5Å; I222-Y325 VanDerWaalsContact CG1-CE1 3.5Å; I222-Y325 HydrophobicContact CG1-CE2 3.81Å; I222-Y325 HydrophobicContact CG1-CG 3.55Å; V306-Y325 WeakPolarHBondContact CA-O 3.34Å; L307-Y325 PolarHBondContact N-O 3.22Å; H323-Y325 PolarHBondContact CD2-N 3.22Å; H323-Y325 PolarHBondContact CD2-O 3.11Å; H323-Y325 PolarHBondContact NE2-O 3.46Å
326	V	97.2	Very high	91.2	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.4	-172.9	176.4	0	0	0	0	111.6	L192 M197 F202 L307 L312 L316	L192-V326 HydrophobicContact CD1-CB 4.4Å; L192-V326 HydrophobicContact CD1-CG1 3.99Å; L192-V326 PolarHBondContact N-O 3.43Å; M197-V326 HydrophobicContact CE-CG2 4.14Å; F202-V326 HydrophobicContact CE1-CG1 3.8Å; F202-V326 HydrophobicContact CZ-CG1 4.29Å; L307-V326 WeakPolarHBondContact O-CA 3.5Å; L312-V326 HydrophobicContact CD2-CG1 3.77Å; L312-V326 HydrophobicContact CD2-CG2 4.41Å; L316-V326 HydrophobicContact CD1-CG2 4.27Å
327	I	97	Very high	89.3	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	115.8	162.1	-59.7	-179.6	0	0	0	107.7	L187 C190 L191 L228 V306 L307 V308 G309 L332	L187-I327 HydrophobicContact CD2-CD1 4.47Å; L187-I327 HydrophobicContact CG-CD1 4.07Å; C190-I327 HydrophobicContact CB-CD1 4.1Å; C190-I327 HydrophobicContact CB-CG1 4.44Å; L191-I327 HydrophobicContact CD2-CD1 4.46Å; L191-I327 HydrophobicContact CD2-CG1 3.95Å; L228-I327 HydrophobicContact CD2-CD1 4.12Å; V306-I327 HydrophobicContact CG1-CD1 3.9Å; V306-I327 HydrophobicContact CG1-CG1 3.85Å; L307-I327 PolarHBondContact O-N 3.19Å; V308-I327 VanDerWaalsContact CA-O 3.26Å; V308-I327 WeakPolarHBondContact CA-O 3.43Å; V308-I327 HydrophobicContact CG1-CB 4.33Å; V308-I327 HydrophobicContact CG1-CG2 4.32Å; V308-I327 HydrophobicContact CG2-CB 4.36Å; G309-I327 PolarHBondContact N-O 3.1Å; I327-L332 HydrophobicContact CG2-CD2 4.13Å
328	D	96.4	Very high	87.8	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.011	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	113.4	174.7	-166.4	-47.1	0	0	0	110	L192 F202 S311 L312 S330 L331 L332	L192-D328 HydrophobicContact CD1-CB 4.17Å; F202-D328 HydrophobicContact CZ-CB 4.16Å; F202-D328 WeakPolarHBondContact CZ-OD2 3.43Å; S311-D328 WeakPolarHBondContact CA-OD2 3.35Å; S311-D328 PolarHBondContact N-OD1 2.9Å; S311-D328 PolarHBondContact N-OD2 3.46Å; L312-D328 PolarHBondContact N-OD2 2.9Å; D328-S330 PolarHBondContact O-N 2.85Å; D328-S330 WeakPolarHBondContact OD1-CA 3.42Å; D328-S330 WeakPolarHBondContact OD1-CB 3.31Å; D328-S330 PolarHBondContact OD1-N 2.83Å; D328-S330 PolarHBondContact OD1-OG 3.33Å; D328-L331 HydrophobicContact CB-CB 4.27Å; D328-L331 HydrophobicContact CB-CD1 4.14Å; D328-L331 HydrophobicContact CB-CG 4.16Å; D328-L331 CarbonylContact O-C 3.59Å; D328-L331 PolarHBondContact O-N 3.45Å; D328-L332 WeakPolarHBondContact O-CB 3.43Å; D328-L332 PolarHBondContact O-N 2.89Å
329	T	95.1	Very high	86.7	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.3	-29	-179.4	57	0	0	0	0	112.5	V308 G309 H310 L331 L332 Y333 I372 L375 A376	V308-T329 HydrophobicContact CG1-CG2 4Å; G309-T329 PolarHBondContact O-N 2.81Å; G309-T329 PolarHBondContact O-OG1 3.26Å; H310-T329 WeakPolarHBondContact CB-OG1 3.16Å; H310-T329 PolarHBondContact ND1-OG1 3.13Å; T329-L331 PolarHBondContact O-N 2.81Å; T329-L332 PolarHBondContact O-N 3.11Å; T329-Y333 VanDerWaalsContact O-CD2 3.28Å; T329-Y333 WeakPolarHBondContact O-CD2 3.43Å; T329-Y333 PolarHBondContact O-N 3.05Å; T329-I372 HydrophobicContact CG2-CG2 3.99Å; T329-L375 HydrophobicContact CG2-CB 4.24Å; T329-A376 HydrophobicContact CG2-CB 4.38Å
330	S	92.5	Very high	86.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-69.5	-21.9	175.7	77.5	0	0	0	0	113.3	S311 D328 R340	S311-S330 PolarHBondContact N-OG 3.47Å; D328-S330 PolarHBondContact O-N 2.85Å; D328-S330 WeakPolarHBondContact OD1-CA 3.42Å; D328-S330 WeakPolarHBondContact OD1-CB 3.31Å; D328-S330 PolarHBondContact OD1-N 2.83Å; D328-S330 PolarHBondContact OD1-OG 3.33Å; S330-R340 WeakPolarHBondContact OG-CD 3.37Å; S330-R340 PolarHBondContact OG-NE 3.1Å
331	L	91.1	Very high	85.7	Confident	5 Å²	5	35.6 Å²	35.6	3%	0.026	17%	0.174	C	C	.	.	H	α-helix	trans	-101	-19	174.6	-58.8	-179.9	0	0	0	112.5	L192 F200 F202 D328 T329	L192-L331 HydrophobicContact CD1-CD1 4.04Å; L192-L331 HydrophobicContact CD2-CB 4.41Å; L192-L331 HydrophobicContact CD2-CD1 3.89Å; F200-L331 HydrophobicContact CB-CD1 4.17Å; F200-L331 HydrophobicContact CD1-CD1 4.41Å; F200-L331 HydrophobicContact CD1-CD2 3.96Å; F200-L331 HydrophobicContact CD2-CD1 3.57Å; F200-L331 HydrophobicContact CD2-CD2 4.25Å; F200-L331 HydrophobicContact CE1-CD2 3.83Å; F200-L331 HydrophobicContact CE2-CD1 4.04Å; F200-L331 HydrophobicContact CE2-CD2 4.14Å; F200-L331 HydrophobicContact CG-CD1 3.79Å; F200-L331 HydrophobicContact CG-CD2 4.18Å; F200-L331 HydrophobicContact CZ-CD2 3.93Å; F202-L331 HydrophobicContact CE2-CD1 4.2Å; D328-L331 HydrophobicContact CB-CB 4.27Å; D328-L331 HydrophobicContact CB-CD1 4.14Å; D328-L331 HydrophobicContact CB-CG 4.16Å; D328-L331 CarbonylContact O-C 3.59Å; D328-L331 PolarHBondContact O-N 3.45Å; T329-L331 PolarHBondContact O-N 2.81Å
332	L	89.7	Confident	85.5	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-72.5	-40.3	172.6	-167.3	61.5	0	0	0	110.9	Y180 C190 I327 D328 T329 F379	Y180-L332 HydrophobicContact CE2-CD1 4.02Å; C190-L332 HydrophobicContact CB-CD1 4.16Å; I327-L332 HydrophobicContact CG2-CD2 4.13Å; D328-L332 WeakPolarHBondContact O-CB 3.43Å; D328-L332 PolarHBondContact O-N 2.89Å; T329-L332 PolarHBondContact O-N 3.11Å; L332-F379 HydrophobicContact CD1-CD1 3.84Å; L332-F379 HydrophobicContact CD1-CD2 4.09Å; L332-F379 HydrophobicContact CD1-CE1 3.75Å; L332-F379 HydrophobicContact CD1-CE2 4.01Å; L332-F379 HydrophobicContact CD1-CG 4.02Å; L332-F379 HydrophobicContact CD1-CZ 3.84Å; L332-F379 HydrophobicContact CD2-CB 3.75Å; L332-F379 HydrophobicContact CD2-CD1 4.19Å; L332-F379 HydrophobicContact CD2-CD2 4.06Å; L332-F379 HydrophobicContact CD2-CG 3.75Å; L332-F379 HydrophobicContact CG-CB 4.35Å; L332-F379 HydrophobicContact CG-CD1 4.17Å; L332-F379 HydrophobicContact CG-CD2 3.7Å; L332-F379 HydrophobicContact CG-CE1 4.41Å; L332-F379 HydrophobicContact CG-CE2 3.97Å; L332-F379 HydrophobicContact CG-CG 3.82Å; L332-F379 HydrophobicContact CG-CZ 4.32Å
333	Y	88.6	Confident	85.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-105.3	66.7	173.5	-59	-80.6	0	0	0	109.6	T329 F341 L346 I350 L375 F379 I387 L392	T329-Y333 VanDerWaalsContact O-CD2 3.28Å; T329-Y333 WeakPolarHBondContact O-CD2 3.43Å; T329-Y333 PolarHBondContact O-N 3.05Å; Y333-F341 WeakPolarHBondContact O-CD2 3.44Å; Y333-L346 HydrophobicContact CD2-CD1 3.97Å; Y333-L346 HydrophobicContact CG-CD1 4.22Å; Y333-L346 HydrophobicContact CG-CD2 4.13Å; Y333-I350 HydrophobicContact CD1-CD1 3.67Å; Y333-I350 HydrophobicContact CE1-CD1 3.31Å; Y333-I350 HydrophobicContact CE2-CD1 4.34Å; Y333-I350 HydrophobicContact CG-CD1 4.3Å; Y333-L375 HydrophobicContact CE2-CB 4.07Å; Y333-L375 PolarHBondContact OH-O 3.4Å; Y333-F379 HydrophobicContact CD1-CD2 4.48Å; Y333-F379 AromaticContact CE1-CD2 3.86Å; Y333-F379 HydrophobicContact CE1-CD2 3.86Å; Y333-F379 AromaticContact CZ-CD2 3.98Å; Y333-I387 HydrophobicContact CD1-CG2 3.57Å; Y333-I387 HydrophobicContact CE1-CB 4.48Å; Y333-I387 HydrophobicContact CE1-CD1 4.09Å; Y333-I387 HydrophobicContact CE1-CG1 4.11Å; Y333-I387 HydrophobicContact CE1-CG2 3.52Å; Y333-L392 HydrophobicContact CD1-CD1 3.8Å
334	V	76.8	Confident	85.2	Confident	29 Å²	29	47.3 Å²	47.3	18%	0.176	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-78.8	141.1	-174.5	69.6	0	0	0	0	111.8	P175	P175-V334 HydrophobicContact CB-CG1 3.88Å; P175-V334 HydrophobicContact CG-CG1 4.19Å
335	R	72.7	Confident	85.2	Confident	10 Å²	10	45.6 Å²	45.6	4%	0.038	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-80.7	166.3	169.5	-66.1	-160.5	174.8	-154.2	17.5	112	G338 R339 F341 E393 A396 E400	R335-G338 PolarHBondContact O-N 3.14Å; R335-R339 HydrophobicContact CB-CB 3.9Å; R335-R339 VanDerWaalsContact CB-O 3.23Å; R335-R339 WeakPolarHBondContact CB-O 3.47Å; R335-R339 HydrophobicContact CG-CB 4.3Å; R335-R339 PolarHBondContact N-O 2.87Å; R335-F341 HydrophobicContact CG-CD1 3.97Å; R335-F341 HydrophobicContact CG-CD2 3.92Å; R335-F341 HydrophobicContact CG-CE1 3.65Å; R335-F341 HydrophobicContact CG-CE2 3.6Å; R335-F341 HydrophobicContact CG-CG 4.08Å; R335-F341 HydrophobicContact CG-CZ 3.45Å; R335-F341 VanDerWaalsContact CG-CZ 3.45Å; R335-E393 VanDerWaalsContact CB-OE2 3.3Å; R335-E393 WeakPolarHBondContact CB-OE2 3.35Å; R335-E393 WeakPolarHBondContact CD-OE1 3.32Å; R335-E393 VanDerWaalsContact CD-OE2 3.28Å; R335-E393 WeakPolarHBondContact CD-OE2 3.5Å; R335-E393 WeakPolarHBondContact CG-OE2 3.01Å; R335-E393 IonicContact CZ-OE1 3.64Å; R335-E393 IonicContact NE-OE1 2.8Å; R335-E393 IonicContact NE-OE2 3.18Å; R335-E393 IonicContact NH1-OE1 3.38Å; R335-E393 PolarHBondContact NH1-OE1 3.17Å; R335-A396 VanDerWaalsContact NH2-CB 3.29Å; R335-E400 IonicContact CZ-OE1 3.48Å; R335-E400 IonicContact NH1-OE1 3.32Å; R335-E400 IonicContact NH2-OE1 3.83Å; R335-E400 PolarHBondContact NH2-OE1 3.29Å
336	E	64.6	Low	85	Confident	120 Å²	120	43 Å²	43	56%	0.561	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-53.4	143.6	163.8	-62.9	-171.4	172	0	0	111	G338	E336-G338 PolarHBondContact O-N 2.92Å
337	Q	58.4	Low	84.8	Confident	186 Å²	186	43 Å²	43	87%	0.869	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	63.8	13.9	-179.5	-50.8	163.5	9.7	0	0	115.4
338	G	63.1	Low	84.5	Confident	46 Å²	46	46.5 Å²	46.5	47%	0.474	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	82.1	16.1	172.7	0	0	0	0	0	115.2	R335 E336	R335-G338 PolarHBondContact O-N 3.14Å; E336-G338 PolarHBondContact O-N 2.92Å
339	R	70.5	Confident	84.2	Confident	142 Å²	142	47.9 Å²	47.9	54%	0.536	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-72.7	152	171.5	-64.2	174.2	68	178.8	-3.6	110.4	R335	R335-R339 HydrophobicContact CB-CB 3.9Å; R335-R339 VanDerWaalsContact CB-O 3.23Å; R335-R339 WeakPolarHBondContact CB-O 3.47Å; R335-R339 HydrophobicContact CG-CB 4.3Å; R335-R339 PolarHBondContact N-O 2.87Å
340	R	83.6	Confident	83.9	Confident	77 Å²	77	48.5 Å²	48.5	29%	0.291	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-102.1	133.9	179.1	-67.4	177.6	178.4	-179.3	0.2	110	S311 D313 S330	S311-R340 WeakPolarHBondContact OG-CD 3.34Å; S311-R340 PolarHBondContact OG-NH1 3.17Å; D313-R340 IonicContact OD1-CZ 3.94Å; D313-R340 IonicContact OD1-NH1 3.75Å; D313-R340 PolarHBondContact OD1-NH1 2.61Å; D313-R340 IonicContact OD1-NH2 3.53Å; D313-R340 PolarHBondContact OD1-NH2 3.16Å; D313-R340 VanDerWaalsContact OD1-NH2 3.11Å; S330-R340 WeakPolarHBondContact OG-CD 3.37Å; S330-R340 PolarHBondContact OG-NE 3.1Å
341	F	87.9	Confident	83.9	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.026	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-68.7	154.4	167.3	-68.2	-74.4	0	0	0	110.4	H310 Y333 R335 F345 L346 L392 A396	H310-F341 PolarHBondContact CE1-O 3.45Å; H310-F341 PolarHBondContact NE2-O 3.22Å; Y333-F341 WeakPolarHBondContact O-CD2 3.44Å; R335-F341 HydrophobicContact CG-CD1 3.97Å; R335-F341 HydrophobicContact CG-CD2 3.92Å; R335-F341 HydrophobicContact CG-CE1 3.65Å; R335-F341 HydrophobicContact CG-CE2 3.6Å; R335-F341 HydrophobicContact CG-CG 4.08Å; R335-F341 HydrophobicContact CG-CZ 3.45Å; R335-F341 VanDerWaalsContact CG-CZ 3.45Å; F341-F345 HydrophobicContact CB-CD1 4.01Å; F341-F345 AromaticContact CD1-CD1 3.49Å; F341-F345 HydrophobicContact CD1-CD1 3.49Å; F341-F345 VanDerWaalsContact CD1-CD1 3.49Å; F341-F345 AromaticContact CD1-CE1 3.47Å; F341-F345 HydrophobicContact CD1-CE1 3.47Å; F341-F345 VanDerWaalsContact CD1-CE1 3.47Å; F341-F345 HydrophobicContact CD1-CG 4.45Å; F341-F345 HydrophobicContact CD1-CZ 4.43Å; F341-F345 HydrophobicContact CE1-CD1 4.23Å; F341-F345 AromaticContact CE1-CE1 3.72Å; F341-F345 HydrophobicContact CE1-CE1 3.72Å; F341-F345 HydrophobicContact CE1-CZ 4.41Å; F341-F345 AromaticContact CG-CD1 3.91Å; F341-F345 HydrophobicContact CG-CD1 3.91Å; F341-F345 HydrophobicContact CG-CE1 4.08Å; F341-F345 HydrophobicContact CZ-CE1 4.48Å; F341-L346 HydrophobicContact CB-CD1 4.09Å; F341-L346 HydrophobicContact CB-CD2 3.82Å; F341-L346 HydrophobicContact CB-CG 3.78Å; F341-L346 HydrophobicContact CD2-CD2 3.86Å; F341-L346 HydrophobicContact CG-CD2 3.95Å; F341-L346 HydrophobicContact CG-CG 4.45Å; F341-L392 HydrophobicContact CE1-CB 4.31Å; F341-L392 HydrophobicContact CE2-CB 4Å; F341-L392 HydrophobicContact CE2-CD1 4.5Å; F341-L392 HydrophobicContact CZ-CB 3.68Å; F341-A396 HydrophobicContact CD1-CB 3.88Å; F341-A396 HydrophobicContact CE1-CB 3.52Å
342	K	90.4	Very high	83.8	Confident	162 Å²	162	52.6 Å²	52.6	70%	0.704	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-75.2	145.2	169.4	-64.3	-179.6	-179.9	175.9	0	110.1	K344 F345 L346	K342-K344 VanDerWaalsContact C-N 3.33Å; K342-K344 PolarHBondContact O-N 3.28Å; K342-F345 HydrophobicContact CB-CB 4.46Å; K342-F345 WeakPolarHBondContact O-CB 3.37Å; K342-F345 PolarHBondContact O-N 3.11Å; K342-F345 VanDerWaalsContact O-N 3.07Å; K342-L346 PolarHBondContact O-N 2.85Å
343	L	93.6	Very high	83.8	Confident	12 Å²	12	56.5 Å²	56.5	6%	0.063	28%	0.282	C	S	.	.	H	α-helix	trans	-55	-46.5	176.8	-175.1	62.8	0	0	0	112.5	H310 F345 L346 A347 I355 D368 I371 I372 L375	H310-L343 HydrophobicContact CB-CD1 4.32Å; H310-L343 PolarHBondContact NE2-N 2.85Å; L343-F345 PolarHBondContact O-N 3.42Å; L343-L346 PolarHBondContact O-N 3.15Å; L343-L346 VanDerWaalsContact O-N 3.07Å; L343-A347 WeakPolarHBondContact O-CB 3.38Å; L343-A347 PolarHBondContact O-N 2.9Å; L343-I355 HydrophobicContact CD2-CD1 4.18Å; L343-I355 HydrophobicContact CG-CD1 3.93Å; L343-D368 HydrophobicContact CD2-CB 3.73Å; L343-I371 HydrophobicContact CD1-CG2 4.01Å; L343-I371 HydrophobicContact CG-CG2 4.35Å; L343-I372 HydrophobicContact CD1-CG1 3.71Å; L343-I372 HydrophobicContact CD2-CD1 4.11Å; L343-I372 HydrophobicContact CD2-CG1 3.94Å; L343-I372 HydrophobicContact CG-CG1 4.5Å; L343-L375 HydrophobicContact CD1-CD1 3.65Å
344	K	91.7	Very high	83.8	Confident	86 Å²	86	61.3 Å²	61.3	37%	0.374	31%	0.308	S	S	.	.	H	α-helix	trans	-53.7	-39.2	176.1	-176	171.8	-173.7	161.8	0	113.6	K342 K348 I355 Q356	K342-K344 VanDerWaalsContact C-N 3.33Å; K342-K344 PolarHBondContact O-N 3.28Å; K344-K348 PolarHBondContact O-N 3.17Å; K344-I355 HydrophobicContact CB-CG1 4.31Å; K344-I355 WeakPolarHBondContact CE-O 3.41Å; K344-I355 HydrophobicContact CG-CG1 4.35Å; K344-Q356 HydrophobicContact CD-CB 4.39Å; K344-Q356 PolarHBondContact NZ-O 3.46Å
345	F	92.3	Very high	84.3	Confident	15 Å²	15	60.1 Å²	60.1	7%	0.066	30%	0.301	C	S	.	.	H	α-helix	trans	-67.1	-48.9	176.3	169.1	-93.9	0	0	0	110.9	F341 K342 L343 A347 K348 A349 L392 L395 A396 Q399	F341-F345 HydrophobicContact CB-CD1 4.01Å; F341-F345 AromaticContact CD1-CD1 3.49Å; F341-F345 HydrophobicContact CD1-CD1 3.49Å; F341-F345 VanDerWaalsContact CD1-CD1 3.49Å; F341-F345 AromaticContact CD1-CE1 3.47Å; F341-F345 HydrophobicContact CD1-CE1 3.47Å; F341-F345 VanDerWaalsContact CD1-CE1 3.47Å; F341-F345 HydrophobicContact CD1-CG 4.45Å; F341-F345 HydrophobicContact CD1-CZ 4.43Å; F341-F345 HydrophobicContact CE1-CD1 4.23Å; F341-F345 AromaticContact CE1-CE1 3.72Å; F341-F345 HydrophobicContact CE1-CE1 3.72Å; F341-F345 HydrophobicContact CE1-CZ 4.41Å; F341-F345 AromaticContact CG-CD1 3.91Å; F341-F345 HydrophobicContact CG-CD1 3.91Å; F341-F345 HydrophobicContact CG-CE1 4.08Å; F341-F345 HydrophobicContact CZ-CE1 4.48Å; K342-F345 HydrophobicContact CB-CB 4.46Å; K342-F345 WeakPolarHBondContact O-CB 3.37Å; K342-F345 PolarHBondContact O-N 3.11Å; K342-F345 VanDerWaalsContact O-N 3.07Å; L343-F345 PolarHBondContact O-N 3.42Å; F345-A347 PolarHBondContact O-N 2.82Å; F345-K348 PolarHBondContact O-N 3.04Å; F345-A349 HydrophobicContact CE1-CB 4.1Å; F345-A349 HydrophobicContact CE2-CB 4.21Å; F345-A349 HydrophobicContact CZ-CB 3.87Å; F345-A349 VanDerWaalsContact O-CB 3.3Å; F345-A349 WeakPolarHBondContact O-CB 3.49Å; F345-A349 PolarHBondContact O-N 3.29Å; F345-L392 HydrophobicContact CE1-CB 4.31Å; F345-L392 HydrophobicContact CE1-CD2 4.44Å; F345-L392 VanDerWaalsContact CZ-O 3.29Å; F345-L392 WeakPolarHBondContact CZ-O 3.39Å; F345-L395 HydrophobicContact CE2-CB 4.12Å; F345-L395 HydrophobicContact CZ-CB 3.85Å; F345-A396 HydrophobicContact CD1-CB 4.39Å; F345-A396 HydrophobicContact CD2-CB 4.1Å; F345-A396 HydrophobicContact CE1-CB 3.9Å; F345-A396 HydrophobicContact CE2-CB 3.62Å; F345-A396 HydrophobicContact CG-CB 4.49Å; F345-A396 HydrophobicContact CZ-CB 3.5Å; F345-Q399 VanDerWaalsContact CD2-OE1 3.31Å
346	L	92.6	Very high	84.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-41.6	-179.2	-66.8	177.8	0	0	0	111.9	Y333 F341 K342 L343 K348 A349 I350 L375 L392	Y333-L346 HydrophobicContact CD2-CD1 3.97Å; Y333-L346 HydrophobicContact CG-CD1 4.22Å; Y333-L346 HydrophobicContact CG-CD2 4.13Å; F341-L346 HydrophobicContact CB-CD1 4.09Å; F341-L346 HydrophobicContact CB-CD2 3.82Å; F341-L346 HydrophobicContact CB-CG 3.78Å; F341-L346 HydrophobicContact CD2-CD2 3.86Å; F341-L346 HydrophobicContact CG-CD2 3.95Å; F341-L346 HydrophobicContact CG-CG 4.45Å; K342-L346 PolarHBondContact O-N 2.85Å; L343-L346 PolarHBondContact O-N 3.15Å; L343-L346 VanDerWaalsContact O-N 3.07Å; L346-K348 VanDerWaalsContact C-N 3.3Å; L346-K348 PolarHBondContact O-N 3.26Å; L346-A349 PolarHBondContact O-N 2.88Å; L346-I350 HydrophobicContact CD2-CD1 4Å; L346-I350 VanDerWaalsContact O-CB 3.28Å; L346-I350 WeakPolarHBondContact O-CB 3.28Å; L346-I350 PolarHBondContact O-N 2.93Å; L346-L375 HydrophobicContact CB-CD1 3.76Å; L346-L375 HydrophobicContact CB-CD2 4.12Å; L346-L375 HydrophobicContact CD1-CD1 4.36Å; L346-L392 HydrophobicContact CD2-CD1 4.19Å
347	A	92.8	Very high	85.5	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.295	C	S	.	.	I	π-helix	trans	-55.7	-46.4	175.4	0	0	0	0	0	111.5	L343 F345 L351 G352 K353 I355 I371	L343-A347 WeakPolarHBondContact O-CB 3.38Å; L343-A347 PolarHBondContact O-N 2.9Å; F345-A347 PolarHBondContact O-N 2.82Å; A347-L351 CarbonylContact O-C 3.51Å; A347-L351 WeakPolarHBondContact O-CA 3.07Å; A347-L351 VanDerWaalsContact O-CB 3.31Å; A347-L351 WeakPolarHBondContact O-CB 3.27Å; A347-L351 PolarHBondContact O-N 2.99Å; A347-G352 PolarHBondContact O-N 3.23Å; A347-K353 CarbonylContact C-O 3.59Å; A347-K353 PolarHBondContact O-N 2.69Å; A347-K353 VanDerWaalsContact O-N 3.12Å; A347-I355 HydrophobicContact CB-CD1 3.77Å; A347-I355 HydrophobicContact CB-CG1 3.82Å; A347-I355 HydrophobicContact CB-CG2 4.38Å; A347-I371 HydrophobicContact CB-CG2 3.66Å
348	K	91.1	Very high	86	Confident	76 Å²	76	55 Å²	55	33%	0.33	29%	0.293	S	S	.	.	I	π-helix	trans	-71.5	-47.1	179.6	-172.3	59.8	168.9	-168.4	0	112.5	K344 F345 L346 G352 K353 D354	K344-K348 PolarHBondContact O-N 3.17Å; F345-K348 PolarHBondContact O-N 3.04Å; L346-K348 VanDerWaalsContact C-N 3.3Å; L346-K348 PolarHBondContact O-N 3.26Å; K348-G352 VanDerWaalsContact O-CA 3.23Å; K348-G352 WeakPolarHBondContact O-CA 3.45Å; K348-G352 PolarHBondContact O-N 2.85Å; K348-G352 VanDerWaalsContact O-N 3.16Å; K348-K353 WeakPolarHBondContact CA-O 3.17Å; K348-K353 PolarHBondContact N-O 3.15Å; K348-D354 WeakPolarHBondContact CD-OD1 3.43Å; K348-D354 VanDerWaalsContact CE-OD1 3.31Å; K348-D354 WeakPolarHBondContact CE-OD1 3.45Å; K348-D354 IonicContact NZ-OD1 2.8Å; K348-D354 PolarHBondContact NZ-OD1 3.01Å; K348-D354 IonicContact NZ-OD2 2.76Å; K348-D354 PolarHBondContact NZ-OD2 3.21Å
349	A	88.6	Confident	86.4	Confident	30 Å²	30	59.2 Å²	59.2	25%	0.248	30%	0.304	C	S	.	.	I	π-helix	trans	-71.4	-34.2	-173.8	0	0	0	0	0	113.1	F345 L346 L392 L395	F345-A349 HydrophobicContact CE1-CB 4.1Å; F345-A349 HydrophobicContact CE2-CB 4.21Å; F345-A349 HydrophobicContact CZ-CB 3.87Å; F345-A349 VanDerWaalsContact O-CB 3.3Å; F345-A349 WeakPolarHBondContact O-CB 3.49Å; F345-A349 PolarHBondContact O-N 3.29Å; L346-A349 PolarHBondContact O-N 2.88Å; A349-L392 HydrophobicContact CB-CD2 3.95Å; A349-L395 HydrophobicContact CB-CD1 4.47Å
350	I	90.6	Very high	86.6	Confident	14 Å²	14	59.7 Å²	59.7	7%	0.072	31%	0.306	C	S	.	.	I	π-helix	trans	-102.9	-45.3	-173.1	-58.6	-179.3	0	0	0	111.5	Y333 L346 L375 Y378 L390 L392	Y333-I350 HydrophobicContact CD1-CD1 3.67Å; Y333-I350 HydrophobicContact CE1-CD1 3.31Å; Y333-I350 HydrophobicContact CE2-CD1 4.34Å; Y333-I350 HydrophobicContact CG-CD1 4.3Å; L346-I350 HydrophobicContact CD2-CD1 4Å; L346-I350 VanDerWaalsContact O-CB 3.28Å; L346-I350 WeakPolarHBondContact O-CB 3.28Å; L346-I350 PolarHBondContact O-N 2.93Å; I350-L375 HydrophobicContact CB-CD2 3.85Å; I350-L375 HydrophobicContact CD1-CD2 3.94Å; I350-L375 HydrophobicContact CG1-CD2 4.4Å; I350-L375 HydrophobicContact CG2-CD2 4.01Å; I350-Y378 HydrophobicContact CG2-CD1 3.36Å; I350-Y378 HydrophobicContact CG2-CD2 4.01Å; I350-Y378 HydrophobicContact CG2-CE1 3.54Å; I350-Y378 HydrophobicContact CG2-CE2 4.17Å; I350-Y378 HydrophobicContact CG2-CG 3.62Å; I350-L390 HydrophobicContact CG1-CD1 4.34Å; I350-L392 HydrophobicContact CD1-CD1 3.93Å; I350-L392 HydrophobicContact CD1-CD2 4.25Å; I350-L392 HydrophobicContact CG1-CD1 4.48Å; I350-L392 HydrophobicContact CG1-CD2 3.9Å
351	L	91.1	Very high	86.4	Confident	40 Å²	40	61.7 Å²	61.7	21%	0.209	32%	0.322	C	S	.	.	I	π-helix	trans	-99.7	-10.4	-175.1	-52.3	175.5	0	0	0	112.6	A347 K353 I371 E374 L375 Y378	A347-L351 CarbonylContact O-C 3.51Å; A347-L351 WeakPolarHBondContact O-CA 3.07Å; A347-L351 VanDerWaalsContact O-CB 3.31Å; A347-L351 WeakPolarHBondContact O-CB 3.27Å; A347-L351 PolarHBondContact O-N 2.99Å; L351-K353 HydrophobicContact CB-CB 4.48Å; L351-K353 HydrophobicContact CB-CD 4.33Å; L351-K353 HydrophobicContact CB-CG 4.16Å; L351-K353 PolarHBondContact O-N 2.84Å; L351-I371 HydrophobicContact CD1-CD1 4.38Å; L351-I371 HydrophobicContact CD1-CG2 4.22Å; L351-E374 HydrophobicContact CD1-CB 3.61Å; L351-E374 HydrophobicContact CD2-CB 4.33Å; L351-L375 HydrophobicContact CD1-CD2 3.93Å; L351-L375 HydrophobicContact CD1-CG 3.92Å; L351-L375 HydrophobicContact CD2-CD2 4.41Å; L351-L375 HydrophobicContact CG-CD2 3.88Å; L351-L375 HydrophobicContact CG-CG 4.42Å; L351-Y378 HydrophobicContact CD2-CD2 4.08Å; L351-Y378 HydrophobicContact CD2-CG 4.38Å
352	G	88.6	Confident	86.1	Confident	50 Å²	50	62 Å²	62	52%	0.515	33%	0.326	S	S	.	.			trans	70.4	12.2	-175.4	0	0	0	0	0	114.1	A347 K348	A347-G352 PolarHBondContact O-N 3.23Å; K348-G352 VanDerWaalsContact O-CA 3.23Å; K348-G352 WeakPolarHBondContact O-CA 3.45Å; K348-G352 PolarHBondContact O-N 2.85Å; K348-G352 VanDerWaalsContact O-N 3.16Å
353	K	90.9	Very high	85.9	Confident	85 Å²	85	57.1 Å²	57.1	37%	0.37	31%	0.306	S	S	.	.			trans	-97.5	132.6	-174.1	-66.8	-176.8	174.8	-175.1	0	111.4	A347 K348 L351 I371 E374	A347-K353 CarbonylContact C-O 3.59Å; A347-K353 PolarHBondContact O-N 2.69Å; A347-K353 VanDerWaalsContact O-N 3.12Å; K348-K353 WeakPolarHBondContact CA-O 3.17Å; K348-K353 PolarHBondContact N-O 3.15Å; L351-K353 HydrophobicContact CB-CB 4.48Å; L351-K353 HydrophobicContact CB-CD 4.33Å; L351-K353 HydrophobicContact CB-CG 4.16Å; L351-K353 PolarHBondContact O-N 2.84Å; K353-I371 HydrophobicContact CB-CD1 4.26Å; K353-I371 HydrophobicContact CD-CD1 3.62Å; K353-E374 WeakPolarHBondContact CE-OE2 3.2Å; K353-E374 IonicContact NZ-OE1 2.66Å; K353-E374 PolarHBondContact NZ-OE1 3.41Å; K353-E374 IonicContact NZ-OE2 2.65Å; K353-E374 PolarHBondContact NZ-OE2 3.26Å
354	D	88.1	Confident	85.7	Confident	102 Å²	102	58.7 Å²	58.7	55%	0.545	32%	0.315	S	S	.	.			trans	-89.1	122.2	168.2	-63.6	-69.6	0	0	0	109	K348	K348-D354 WeakPolarHBondContact CD-OD1 3.43Å; K348-D354 VanDerWaalsContact CE-OD1 3.31Å; K348-D354 WeakPolarHBondContact CE-OD1 3.45Å; K348-D354 IonicContact NZ-OD1 2.8Å; K348-D354 PolarHBondContact NZ-OD1 3.01Å; K348-D354 IonicContact NZ-OD2 2.76Å; K348-D354 PolarHBondContact NZ-OD2 3.21Å
355	I	88.3	Confident	85.6	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.021	30%	0.297	C	S	.	.			trans	-125.9	164.5	178.9	62.1	161.9	0	0	0	109.2	L343 K344 A347 C357 E367 I371	L343-I355 HydrophobicContact CD2-CD1 4.18Å; L343-I355 HydrophobicContact CG-CD1 3.93Å; K344-I355 HydrophobicContact CB-CG1 4.31Å; K344-I355 WeakPolarHBondContact CE-O 3.41Å; K344-I355 HydrophobicContact CG-CG1 4.35Å; A347-I355 HydrophobicContact CB-CD1 3.77Å; A347-I355 HydrophobicContact CB-CG1 3.82Å; A347-I355 HydrophobicContact CB-CG2 4.38Å; I355-C357 VanDerWaalsContact C-N 3.34Å; I355-C357 PolarHBondContact O-N 3.07Å; I355-E367 HydrophobicContact CB-CG 4.42Å; I355-E367 HydrophobicContact CG2-CG 4.09Å; I355-I371 HydrophobicContact CD1-CG1 4.39Å; I355-I371 HydrophobicContact CD1-CG2 4.17Å; I355-I371 HydrophobicContact CG2-CD1 3.72Å; I355-I371 HydrophobicContact CG2-CG1 3.66Å
356	Q	84.4	Confident	85.7	Confident	35 Å²	35	54.1 Å²	54.1	16%	0.164	30%	0.295	C	S	.	.	S	Bend	trans	53.7	51.5	179.8	-55.4	170.6	-7.3	0	0	111.4	K344 H363 E367 D368	K344-Q356 HydrophobicContact CD-CB 4.39Å; K344-Q356 PolarHBondContact NZ-O 3.46Å; Q356-H363 HydrophobicContact CG-CB 4.48Å; Q356-H363 PolarHBondContact NE2-ND1 2.75Å; Q356-E367 PolarHBondContact N-OE2 2.89Å; Q356-D368 PolarHBondContact NE2-OD1 3.16Å; Q356-D368 PolarHBondContact NE2-OD2 2.97Å
357	C	77.6	Confident	85.8	Confident	47 Å²	47	56.2 Å²	56.2	32%	0.318	31%	0.305	S	S	.	.			trans	-67.9	139	-179.3	-61.1	0	0	0	0	110.8	I355 D359 R360	I355-C357 VanDerWaalsContact C-N 3.34Å; I355-C357 PolarHBondContact O-N 3.07Å; C357-D359 WeakPolarHBondContact CB-OD1 3.25Å; C357-D359 PolarHBondContact O-N 3.47Å; C357-D359 VanDerWaalsContact O-N 3.15Å; C357-R360 PolarHBondContact O-N 2.91Å; C357-R360 VanDerWaalsContact O-N 3.09Å
358	P	69.1	Low	85.9	Confident	127 Å²	127	56.4 Å²	56.4	83%	0.825	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-11.3	-170.9	27.4	-34.5	0	0	0	114.7	R360	P358-R360 VanDerWaalsContact C-N 3.26Å
359	D	71.1	Confident	86.1	Confident	133 Å²	133	52.8 Å²	52.8	71%	0.711	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-12.7	172.9	61.9	-38.9	0	0	0	113	C357	C357-D359 WeakPolarHBondContact CB-OD1 3.25Å; C357-D359 PolarHBondContact O-N 3.47Å; C357-D359 VanDerWaalsContact O-N 3.15Å
360	R	74.7	Confident	86.5	Confident	153 Å²	153	56.1 Å²	56.1	58%	0.577	30%	0.297	S	S	*	.	S	Bend	trans	-102	140.3	175.3	-66	-173.8	178.8	-173.3	1.1	111.6	C357 P358 G362	C357-R360 PolarHBondContact O-N 2.91Å; C357-R360 VanDerWaalsContact O-N 3.09Å; P358-R360 VanDerWaalsContact C-N 3.26Å; R360-G362 PolarHBondContact O-N 2.79Å
361	L	79.1	Confident	86.8	Confident	118 Å²	118	55.9 Å²	55.9	62%	0.618	30%	0.295	S	S	*	.	S	Bend	trans	-77.9	101.1	177.4	-175.2	70.1	0	0	0	109.9	T273 G277 T279	T273-L361 HydrophobicContact CG2-CD1 4.11Å; T273-L361 HydrophobicContact CG2-CD2 3.79Å; T273-L361 HydrophobicContact CG2-CG 3.99Å; G277-L361 WeakPolarHBondContact CA-O 3.37Å; T279-L361 HydrophobicContact CG2-CD2 4.36Å
362	G	81.1	Confident	87.1	Confident	12 Å²	12	54 Å²	54	12%	0.124	29%	0.285	C	S	.	.	S	Bend	trans	74.9	-176.5	179.9	0	0	0	0	0	114.1	R360	R360-G362 PolarHBondContact O-N 2.79Å
363	H	86.2	Confident	87.5	Confident	60 Å²	60	51.8 Å²	51.8	28%	0.278	26%	0.262	S	S	.	.			trans	-86.8	158.4	-175.9	-58.9	179.7	0	0	0	111.4	E234 F275 Q356 D368	E234-H363 WeakPolarHBondContact OE1-CB 3.48Å; F275-H363 WeakPolarHBondContact O-CB 3.2Å; F275-H363 PolarHBondContact O-CD2 3.42Å; F275-H363 PolarHBondContact O-N 2.71Å; Q356-H363 HydrophobicContact CG-CB 4.48Å; Q356-H363 PolarHBondContact NE2-ND1 2.75Å; H363-D368 IonicContact ND1-OD2 2.73Å
364	D	89	Confident	87.7	Confident	45 Å²	45	50.6 Å²	50.6	24%	0.241	26%	0.257	C	S	.	.			trans	-110.2	100.8	172.1	-178.6	5	0	0	0	108.8	R246 T366 E367 D368	R246-D364 IonicContact CZ-OD1 3.66Å; R246-D364 IonicContact NH1-OD1 2.76Å; R246-D364 IonicContact NH2-OD1 2.99Å; D364-T366 PolarHBondContact O-N 2.86Å; D364-T366 PolarHBondContact OD1-N 3.42Å; D364-T366 VanDerWaalsContact OD1-N 3.17Å; D364-E367 HydrophobicContact CB-CB 3.94Å; D364-E367 WeakPolarHBondContact O-CA 3.32Å; D364-E367 WeakPolarHBondContact O-CB 3.48Å; D364-E367 PolarHBondContact O-N 3.31Å; D364-D368 PolarHBondContact O-N 2.87Å
365	A	90.4	Very high	88.1	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-52.6	-28.3	-179.9	0	0	0	0	0	113.8	D232 E234 S248 A369	D232-A365 HydrophobicContact CB-CB 4.28Å; D232-A365 VanDerWaalsContact OD2-CA 3.28Å; D232-A365 WeakPolarHBondContact OD2-CA 3.02Å; D232-A365 WeakPolarHBondContact OD2-CB 3.49Å; E234-A365 HydrophobicContact CG-CB 4.16Å; S248-A365 WeakPolarHBondContact OG-CB 3.38Å; A365-A369 WeakPolarHBondContact O-CB 3.31Å; A365-A369 PolarHBondContact O-N 3.01Å
366	T	94.4	Very high	88.4	Confident	6 Å²	6	45.6 Å²	45.6	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-75.6	-36.9	175.8	-54.7	0	0	0	0	112.2	S248 V250 C256 D364 R370	S248-T366 WeakPolarHBondContact CB-OG1 3.49Å; S248-T366 PolarHBondContact OG-N 3.01Å; S248-T366 PolarHBondContact OG-OG1 2.8Å; S248-T366 VanDerWaalsContact OG-OG1 3.04Å; V250-T366 HydrophobicContact CG2-CG2 4.11Å; C256-T366 HydrophobicContact CB-CG2 3.69Å; D364-T366 PolarHBondContact O-N 2.86Å; D364-T366 PolarHBondContact OD1-N 3.42Å; D364-T366 VanDerWaalsContact OD1-N 3.17Å; T366-R370 WeakPolarHBondContact O-CG 3.44Å; T366-R370 PolarHBondContact O-N 3.41Å
367	E	94.5	Very high	88.9	Confident	44 Å²	44	47 Å²	47	21%	0.206	24%	0.237	C	C	.	.	H	α-helix	trans	-62.8	-49.3	171.6	177.9	175.5	-97.7	0	0	110.1	I355 Q356 D364 A369 R370 I371	I355-E367 HydrophobicContact CB-CG 4.42Å; I355-E367 HydrophobicContact CG2-CG 4.09Å; Q356-E367 PolarHBondContact N-OE2 2.89Å; D364-E367 HydrophobicContact CB-CB 3.94Å; D364-E367 WeakPolarHBondContact O-CA 3.32Å; D364-E367 WeakPolarHBondContact O-CB 3.48Å; D364-E367 PolarHBondContact O-N 3.31Å; E367-A369 PolarHBondContact O-N 2.9Å; E367-R370 PolarHBondContact O-N 3.49Å; E367-I371 VanDerWaalsContact O-CG1 3.31Å; E367-I371 WeakPolarHBondContact O-CG1 3.46Å; E367-I371 PolarHBondContact O-N 3.17Å
368	D	95.3	Very high	89.7	Confident	4 Å²	4	47 Å²	47	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-45.7	-178.5	-76.5	-3.8	0	0	0	111.1	D232 L343 Q356 H363 D364 R370 I371 I372	D232-D368 HydrophobicContact CB-CB 4.43Å; L343-D368 HydrophobicContact CD2-CB 3.73Å; Q356-D368 PolarHBondContact NE2-OD1 3.16Å; Q356-D368 PolarHBondContact NE2-OD2 2.97Å; H363-D368 IonicContact ND1-OD2 2.73Å; D364-D368 PolarHBondContact O-N 2.87Å; D368-R370 VanDerWaalsContact C-N 3.34Å; D368-R370 PolarHBondContact O-N 2.99Å; D368-I371 PolarHBondContact O-N 3.23Å; D368-I372 WeakPolarHBondContact O-CB 3.35Å; D368-I372 WeakPolarHBondContact O-CD1 3.4Å; D368-I372 WeakPolarHBondContact O-CG1 3.47Å; D368-I372 PolarHBondContact O-N 3.09Å
369	A	95.9	Very high	90.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.3	-36.8	175.7	0	0	0	0	0	113.7	D232 V250 A365 E367 L373	D232-A369 HydrophobicContact CB-CB 4.11Å; V250-A369 HydrophobicContact CB-CB 4.18Å; V250-A369 HydrophobicContact CG2-CB 3.61Å; A365-A369 WeakPolarHBondContact O-CB 3.31Å; A365-A369 PolarHBondContact O-N 3.01Å; E367-A369 PolarHBondContact O-N 2.9Å; A369-L373 PolarHBondContact O-N 3.43Å
370	R	96.3	Very high	91.9	Very high	100 Å²	100	36.1 Å²	36.1	38%	0.377	17%	0.166	S	C	.	.	H	α-helix	trans	-66.4	-45.7	173.9	-74.3	178.6	-147	138.1	4.5	111.5	V250 T366 E367 D368 I372 L373 E374	V250-R370 HydrophobicContact CG1-CG 3.77Å; V250-R370 HydrophobicContact CG2-CG 4.14Å; T366-R370 WeakPolarHBondContact O-CG 3.44Å; T366-R370 PolarHBondContact O-N 3.41Å; E367-R370 PolarHBondContact O-N 3.49Å; D368-R370 VanDerWaalsContact C-N 3.34Å; D368-R370 PolarHBondContact O-N 2.99Å; R370-I372 VanDerWaalsContact C-N 3.31Å; R370-I372 PolarHBondContact O-N 3.26Å; R370-L373 WeakPolarHBondContact O-CB 3.49Å; R370-L373 PolarHBondContact O-N 2.79Å; R370-E374 WeakPolarHBondContact O-CG 3.42Å; R370-E374 PolarHBondContact O-N 2.85Å
371	I	96.8	Very high	92.7	Very high	8 Å²	8	35 Å²	35	4%	0.041	17%	0.165	C	C	.	.	H	α-helix	trans	-63.5	-40.4	-179.2	-66.7	-69.2	0	0	0	111	L343 A347 L351 K353 I355 E367 D368 L373 E374 L375	L343-I371 HydrophobicContact CD1-CG2 4.01Å; L343-I371 HydrophobicContact CG-CG2 4.35Å; A347-I371 HydrophobicContact CB-CG2 3.66Å; L351-I371 HydrophobicContact CD1-CD1 4.38Å; L351-I371 HydrophobicContact CD1-CG2 4.22Å; K353-I371 HydrophobicContact CB-CD1 4.26Å; K353-I371 HydrophobicContact CD-CD1 3.62Å; I355-I371 HydrophobicContact CD1-CG1 4.39Å; I355-I371 HydrophobicContact CD1-CG2 4.17Å; I355-I371 HydrophobicContact CG2-CD1 3.72Å; I355-I371 HydrophobicContact CG2-CG1 3.66Å; E367-I371 VanDerWaalsContact O-CG1 3.31Å; E367-I371 WeakPolarHBondContact O-CG1 3.46Å; E367-I371 PolarHBondContact O-N 3.17Å; D368-I371 PolarHBondContact O-N 3.23Å; I371-L373 VanDerWaalsContact C-N 3.32Å; I371-L373 PolarHBondContact O-N 3.11Å; I371-E374 PolarHBondContact O-N 2.77Å; I371-L375 HydrophobicContact CG2-CD1 4.11Å; I371-L375 HydrophobicContact CG2-CG 4.39Å; I371-L375 WeakPolarHBondContact O-CB 3.37Å; I371-L375 VanDerWaalsContact O-CG 3.31Å; I371-L375 WeakPolarHBondContact O-CG 3.42Å; I371-L375 PolarHBondContact O-N 3.21Å
372	I	97.1	Very high	93.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-57.2	-45.5	175.1	-73.1	166.6	0	0	0	111.2	V308 H310 T329 L343 D368 R370 L375 A376	V308-I372 HydrophobicContact CB-CG2 4.1Å; V308-I372 HydrophobicContact CG1-CG2 3.56Å; H310-I372 HydrophobicContact CB-CD1 3.78Å; H310-I372 HydrophobicContact CB-CG1 3.95Å; T329-I372 HydrophobicContact CG2-CG2 3.99Å; L343-I372 HydrophobicContact CD1-CG1 3.71Å; L343-I372 HydrophobicContact CD2-CD1 4.11Å; L343-I372 HydrophobicContact CD2-CG1 3.94Å; L343-I372 HydrophobicContact CG-CG1 4.5Å; D368-I372 WeakPolarHBondContact O-CB 3.35Å; D368-I372 WeakPolarHBondContact O-CD1 3.4Å; D368-I372 WeakPolarHBondContact O-CG1 3.47Å; D368-I372 PolarHBondContact O-N 3.09Å; R370-I372 VanDerWaalsContact C-N 3.31Å; R370-I372 PolarHBondContact O-N 3.26Å; I372-L375 PolarHBondContact O-N 2.88Å; I372-A376 PolarHBondContact O-N 3.38Å; I372-A376 VanDerWaalsContact O-N 3.08Å
373	L	96.6	Very high	93.5	Very high	5 Å²	5	34 Å²	34	3%	0.026	15%	0.151	C	C	.	.	H	α-helix	trans	-63.1	-47.1	175.8	-80.4	173.4	0	0	0	112.1	L228 V250 V308 A369 R370 I371 L375 A376 Q377	L228-L373 HydrophobicContact CB-CD2 3.71Å; V250-L373 HydrophobicContact CB-CD1 4.03Å; V250-L373 HydrophobicContact CG1-CD1 3.72Å; V250-L373 WeakPolarHBondContact O-CD1 3.45Å; V308-L373 HydrophobicContact CB-CD2 4.16Å; V308-L373 HydrophobicContact CG2-CD2 3.96Å; A369-L373 PolarHBondContact O-N 3.43Å; R370-L373 WeakPolarHBondContact O-CB 3.49Å; R370-L373 PolarHBondContact O-N 2.79Å; I371-L373 VanDerWaalsContact C-N 3.32Å; I371-L373 PolarHBondContact O-N 3.11Å; L373-L375 VanDerWaalsContact C-N 3.27Å; L373-L375 PolarHBondContact O-N 3.46Å; L373-A376 PolarHBondContact O-N 3.46Å; L373-Q377 WeakPolarHBondContact O-CB 3.32Å; L373-Q377 VanDerWaalsContact O-CG 3.31Å; L373-Q377 WeakPolarHBondContact O-CG 3.5Å; L373-Q377 PolarHBondContact O-N 3.36Å
374	E	96.1	Very high	93.6	Very high	59 Å²	59	31.1 Å²	31.1	28%	0.276	14%	0.137	S	C	.	.	H	α-helix	trans	-60.5	-38.2	179	-72.1	-177.3	-154.4	0	0	112	L351 K353 R370 I371 Q377 Y378	L351-E374 HydrophobicContact CD1-CB 3.61Å; L351-E374 HydrophobicContact CD2-CB 4.33Å; K353-E374 WeakPolarHBondContact CE-OE2 3.2Å; K353-E374 IonicContact NZ-OE1 2.66Å; K353-E374 PolarHBondContact NZ-OE1 3.41Å; K353-E374 IonicContact NZ-OE2 2.65Å; K353-E374 PolarHBondContact NZ-OE2 3.26Å; R370-E374 WeakPolarHBondContact O-CG 3.42Å; R370-E374 PolarHBondContact O-N 2.85Å; I371-E374 PolarHBondContact O-N 2.77Å; E374-Q377 PolarHBondContact O-N 3.41Å; E374-Y378 VanDerWaalsContact O-CB 3.29Å; E374-Y378 WeakPolarHBondContact O-CB 3.26Å; E374-Y378 PolarHBondContact O-N 3.23Å
375	L	96.3	Very high	93.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.9	-50.4	174.2	-74.5	173.1	0	0	0	111.3	T329 Y333 L343 L346 I350 L351 I371 I372 L373 Q377 Y378 F379	T329-L375 HydrophobicContact CG2-CB 4.24Å; Y333-L375 HydrophobicContact CE2-CB 4.07Å; Y333-L375 PolarHBondContact OH-O 3.4Å; L343-L375 HydrophobicContact CD1-CD1 3.65Å; L346-L375 HydrophobicContact CB-CD1 3.76Å; L346-L375 HydrophobicContact CB-CD2 4.12Å; L346-L375 HydrophobicContact CD1-CD1 4.36Å; I350-L375 HydrophobicContact CB-CD2 3.85Å; I350-L375 HydrophobicContact CD1-CD2 3.94Å; I350-L375 HydrophobicContact CG1-CD2 4.4Å; I350-L375 HydrophobicContact CG2-CD2 4.01Å; L351-L375 HydrophobicContact CD1-CD2 3.93Å; L351-L375 HydrophobicContact CD1-CG 3.92Å; L351-L375 HydrophobicContact CD2-CD2 4.41Å; L351-L375 HydrophobicContact CG-CD2 3.88Å; L351-L375 HydrophobicContact CG-CG 4.42Å; I371-L375 HydrophobicContact CG2-CD1 4.11Å; I371-L375 HydrophobicContact CG2-CG 4.39Å; I371-L375 WeakPolarHBondContact O-CB 3.37Å; I371-L375 VanDerWaalsContact O-CG 3.31Å; I371-L375 WeakPolarHBondContact O-CG 3.42Å; I371-L375 PolarHBondContact O-N 3.21Å; I372-L375 PolarHBondContact O-N 2.88Å; L373-L375 VanDerWaalsContact C-N 3.27Å; L373-L375 PolarHBondContact O-N 3.46Å; L375-Q377 VanDerWaalsContact C-N 3.32Å; L375-Q377 PolarHBondContact O-N 3.09Å; L375-Y378 WeakPolarHBondContact O-CB 3.49Å; L375-Y378 PolarHBondContact O-N 3.24Å; L375-Y378 VanDerWaalsContact O-N 3.15Å; L375-F379 PolarHBondContact O-N 3.15Å
376	A	95.2	Very high	93.1	Very high	1 Å²	1	38 Å²	38	1%	0.008	17%	0.165	C	C	.	.	H	α-helix	trans	-59.3	-43.8	177.3	0	0	0	0	0	111.9	V308 T329 I372 L373 Y378 F379 L380	V308-A376 HydrophobicContact CG1-CB 3.63Å; T329-A376 HydrophobicContact CG2-CB 4.38Å; I372-A376 PolarHBondContact O-N 3.38Å; I372-A376 VanDerWaalsContact O-N 3.08Å; L373-A376 PolarHBondContact O-N 3.46Å; A376-Y378 VanDerWaalsContact C-N 3.34Å; A376-Y378 PolarHBondContact O-N 2.54Å; A376-F379 WeakPolarHBondContact O-CB 3.34Å; A376-F379 PolarHBondContact O-N 3.07Å; A376-L380 WeakPolarHBondContact O-CG 3.36Å; A376-L380 PolarHBondContact O-N 3.22Å
377	Q	94.1	Very high	92.7	Very high	65 Å²	65	37.7 Å²	37.7	30%	0.304	16%	0.164	S	C	.	.	H	α-helix	trans	-63.4	-38.4	175.7	-71.7	176.9	-21.7	0	0	112.3	L228 E252 L373 E374 L375 L380 K381	L228-Q377 HydrophobicContact CD1-CG 4.25Å; E252-Q377 PolarHBondContact OE1-NE2 2.99Å; E252-Q377 VanDerWaalsContact OE1-NE2 3.09Å; L373-Q377 WeakPolarHBondContact O-CB 3.32Å; L373-Q377 VanDerWaalsContact O-CG 3.31Å; L373-Q377 WeakPolarHBondContact O-CG 3.5Å; L373-Q377 PolarHBondContact O-N 3.36Å; E374-Q377 PolarHBondContact O-N 3.41Å; L375-Q377 VanDerWaalsContact C-N 3.32Å; L375-Q377 PolarHBondContact O-N 3.09Å; Q377-L380 PolarHBondContact O-N 3.38Å; Q377-K381 VanDerWaalsContact O-CB 3.22Å; Q377-K381 WeakPolarHBondContact O-CB 3.32Å; Q377-K381 PolarHBondContact O-N 3.22Å
378	Y	94.1	Very high	92.2	Very high	46 Å²	46	35.8 Å²	35.8	18%	0.18	16%	0.155	C	C	.	.	H	α-helix	trans	-61.3	-46.3	174.7	-171.2	-81.2	0	0	0	110.9	I350 L351 E374 L375 A376 L380 K381 Y382 I387 L390	I350-Y378 HydrophobicContact CG2-CD1 3.36Å; I350-Y378 HydrophobicContact CG2-CD2 4.01Å; I350-Y378 HydrophobicContact CG2-CE1 3.54Å; I350-Y378 HydrophobicContact CG2-CE2 4.17Å; I350-Y378 HydrophobicContact CG2-CG 3.62Å; L351-Y378 HydrophobicContact CD2-CD2 4.08Å; L351-Y378 HydrophobicContact CD2-CG 4.38Å; E374-Y378 VanDerWaalsContact O-CB 3.29Å; E374-Y378 WeakPolarHBondContact O-CB 3.26Å; E374-Y378 PolarHBondContact O-N 3.23Å; L375-Y378 WeakPolarHBondContact O-CB 3.49Å; L375-Y378 PolarHBondContact O-N 3.24Å; L375-Y378 VanDerWaalsContact O-N 3.15Å; A376-Y378 VanDerWaalsContact C-N 3.34Å; A376-Y378 PolarHBondContact O-N 2.54Å; Y378-L380 PolarHBondContact O-N 3.47Å; Y378-K381 PolarHBondContact O-N 3.38Å; Y378-Y382 AromaticContact CD1-CD2 3.82Å; Y378-Y382 HydrophobicContact CD1-CD2 3.82Å; Y378-Y382 AromaticContact CD2-CD2 3.64Å; Y378-Y382 HydrophobicContact CD2-CD2 3.64Å; Y378-Y382 AromaticContact CD2-CE2 3.52Å; Y378-Y382 HydrophobicContact CD2-CE2 3.52Å; Y378-Y382 AromaticContact CE1-CD2 3.72Å; Y378-Y382 HydrophobicContact CE1-CD2 3.72Å; Y378-Y382 HydrophobicContact CE1-CE2 4.42Å; Y378-Y382 HydrophobicContact CE1-CG 4.31Å; Y378-Y382 AromaticContact CE2-CD2 3.53Å; Y378-Y382 HydrophobicContact CE2-CD2 3.53Å; Y378-Y382 AromaticContact CE2-CE2 3.36Å; Y378-Y382 HydrophobicContact CE2-CE2 3.36Å; Y378-Y382 AromaticContact CG-CD2 3.77Å; Y378-Y382 HydrophobicContact CG-CD2 3.77Å; Y378-Y382 HydrophobicContact CG-CE2 4.11Å; Y378-Y382 AromaticContact CZ-CD2 3.57Å; Y378-Y382 AromaticContact CZ-CE2 3.86Å; Y378-Y382 WeakPolarHBondContact O-CD2 3.45Å; Y378-Y382 PolarHBondContact O-N 2.73Å; Y378-I387 HydrophobicContact CD1-CD1 3.58Å; Y378-I387 HydrophobicContact CE1-CD1 3.45Å; Y378-I387 VanDerWaalsContact CE1-CD1 3.45Å; Y378-L390 HydrophobicContact CE1-CD1 4.45Å
379	F	94.1	Very high	91.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.1	-48.7	175.4	-166.6	-83.7	0	0	0	111.7	I176 Y180 V185 L332 Y333 L375 A376 K381 G383 P384 I387	I176-F379 HydrophobicContact CG2-CE2 3.67Å; I176-F379 HydrophobicContact CG2-CZ 3.82Å; Y180-F379 HydrophobicContact CD2-CE1 4.44Å; Y180-F379 AromaticContact CD2-CZ 3.73Å; Y180-F379 HydrophobicContact CD2-CZ 3.73Å; Y180-F379 HydrophobicContact CE2-CZ 4.03Å; Y180-F379 HydrophobicContact CG-CZ 4.17Å; V185-F379 HydrophobicContact CG2-CE1 3.88Å; L332-F379 HydrophobicContact CD1-CD1 3.84Å; L332-F379 HydrophobicContact CD1-CD2 4.09Å; L332-F379 HydrophobicContact CD1-CE1 3.75Å; L332-F379 HydrophobicContact CD1-CE2 4.01Å; L332-F379 HydrophobicContact CD1-CG 4.02Å; L332-F379 HydrophobicContact CD1-CZ 3.84Å; L332-F379 HydrophobicContact CD2-CB 3.75Å; L332-F379 HydrophobicContact CD2-CD1 4.19Å; L332-F379 HydrophobicContact CD2-CD2 4.06Å; L332-F379 HydrophobicContact CD2-CG 3.75Å; L332-F379 HydrophobicContact CG-CB 4.35Å; L332-F379 HydrophobicContact CG-CD1 4.17Å; L332-F379 HydrophobicContact CG-CD2 3.7Å; L332-F379 HydrophobicContact CG-CE1 4.41Å; L332-F379 HydrophobicContact CG-CE2 3.97Å; L332-F379 HydrophobicContact CG-CG 3.82Å; L332-F379 HydrophobicContact CG-CZ 4.32Å; Y333-F379 HydrophobicContact CD1-CD2 4.48Å; Y333-F379 AromaticContact CE1-CD2 3.86Å; Y333-F379 HydrophobicContact CE1-CD2 3.86Å; Y333-F379 AromaticContact CZ-CD2 3.98Å; L375-F379 PolarHBondContact O-N 3.15Å; A376-F379 WeakPolarHBondContact O-CB 3.34Å; A376-F379 PolarHBondContact O-N 3.07Å; F379-K381 VanDerWaalsContact C-N 3.31Å; F379-K381 PolarHBondContact O-N 2.92Å; F379-G383 VanDerWaalsContact O-CA 3.24Å; F379-G383 WeakPolarHBondContact O-CA 3.4Å; F379-G383 PolarHBondContact O-N 3.18Å; F379-P384 HydrophobicContact CE1-CG 4.03Å; F379-P384 HydrophobicContact CZ-CB 4.25Å; F379-P384 HydrophobicContact CZ-CG 3.81Å; F379-I387 HydrophobicContact CD2-CG1 3.73Å; F379-I387 HydrophobicContact CE2-CG1 4.04Å
380	L	92.2	Very high	90.9	Very high	33 Å²	33	41.5 Å²	41.5	17%	0.173	18%	0.183	C	C	.	.	H	α-helix	trans	-65.7	-32.5	179.8	-67.1	174	0	0	0	112.5	K184 L187 L228 A376 Q377 Y378	K184-L380 WeakPolarHBondContact CE-O 3.39Å; L187-L380 HydrophobicContact CB-CD1 4.2Å; L187-L380 HydrophobicContact CB-CD2 4.26Å; L228-L380 HydrophobicContact CD1-CD1 4.2Å; A376-L380 WeakPolarHBondContact O-CG 3.36Å; A376-L380 PolarHBondContact O-N 3.22Å; Q377-L380 PolarHBondContact O-N 3.38Å; Y378-L380 PolarHBondContact O-N 3.47Å
381	K	91.8	Very high	90	Very high	130 Å²	130	40.4 Å²	40.4	57%	0.565	19%	0.185	S	C	*	.	H	α-helix	trans	-73.9	-48.9	-179.8	-176.8	174.2	177.9	-175.3	0	112.3	K184 Q377 Y378 F379	K184-K381 VanDerWaalsContact CE-O 3.23Å; K184-K381 WeakPolarHBondContact CE-O 3.29Å; K184-K381 PolarHBondContact NZ-O 3.41Å; Q377-K381 VanDerWaalsContact O-CB 3.22Å; Q377-K381 WeakPolarHBondContact O-CB 3.32Å; Q377-K381 PolarHBondContact O-N 3.22Å; Y378-K381 PolarHBondContact O-N 3.38Å; F379-K381 VanDerWaalsContact C-N 3.31Å; F379-K381 PolarHBondContact O-N 2.92Å
382	Y	89.3	Confident	89.2	Confident	105 Å²	105	40.5 Å²	40.5	41%	0.412	19%	0.185	S	C	.	.	H	α-helix	trans	-99.6	-22.6	-170	-64.9	-74.5	0	0	0	114.1	Y378 K386	Y378-Y382 AromaticContact CD1-CD2 3.82Å; Y378-Y382 HydrophobicContact CD1-CD2 3.82Å; Y378-Y382 AromaticContact CD2-CD2 3.64Å; Y378-Y382 HydrophobicContact CD2-CD2 3.64Å; Y378-Y382 AromaticContact CD2-CE2 3.52Å; Y378-Y382 HydrophobicContact CD2-CE2 3.52Å; Y378-Y382 AromaticContact CE1-CD2 3.72Å; Y378-Y382 HydrophobicContact CE1-CD2 3.72Å; Y378-Y382 HydrophobicContact CE1-CE2 4.42Å; Y378-Y382 HydrophobicContact CE1-CG 4.31Å; Y378-Y382 AromaticContact CE2-CD2 3.53Å; Y378-Y382 HydrophobicContact CE2-CD2 3.53Å; Y378-Y382 AromaticContact CE2-CE2 3.36Å; Y378-Y382 HydrophobicContact CE2-CE2 3.36Å; Y378-Y382 AromaticContact CG-CD2 3.77Å; Y378-Y382 HydrophobicContact CG-CD2 3.77Å; Y378-Y382 HydrophobicContact CG-CE2 4.11Å; Y378-Y382 AromaticContact CZ-CD2 3.57Å; Y378-Y382 AromaticContact CZ-CE2 3.86Å; Y378-Y382 WeakPolarHBondContact O-CD2 3.45Å; Y378-Y382 PolarHBondContact O-N 2.73Å; Y382-K386 HydrophobicContact CG-CG 4.48Å
383	G	88.8	Confident	88.1	Confident	2 Å²	2	42.5 Å²	42.5	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	79.1	165.4	174.8	0	0	0	0	0	115.2	F379 K385 K386 I387	F379-G383 VanDerWaalsContact O-CA 3.24Å; F379-G383 WeakPolarHBondContact O-CA 3.4Å; F379-G383 PolarHBondContact O-N 3.18Å; G383-K385 VanDerWaalsContact C-N 3.33Å; G383-K385 PolarHBondContact O-N 3.1Å; G383-K386 PolarHBondContact O-N 2.94Å; G383-K386 VanDerWaalsContact O-N 3.15Å; G383-I387 PolarHBondContact O-N 3.27Å
384	P	87.8	Confident	87	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-53.4	-41.6	-172.9	-28.8	34.5	0	0	0	114.9	I176 I177 Y180 G181 K183 V185 F379 K386 I387 A388	I176-P384 HydrophobicContact CG2-CB 3.99Å; I177-P384 HydrophobicContact CD1-CB 4.05Å; Y180-P384 VanDerWaalsContact CB-CG 3.49Å; Y180-P384 HydrophobicContact CG-CG 4.4Å; G181-P384 VanDerWaalsContact O-CB 3.22Å; G181-P384 WeakPolarHBondContact O-CB 3.48Å; K183-P384 WeakPolarHBondContact O-CD 3.44Å; V185-P384 HydrophobicContact CG1-CG 4.45Å; V185-P384 HydrophobicContact CG2-CG 4.14Å; F379-P384 HydrophobicContact CE1-CG 4.03Å; F379-P384 HydrophobicContact CZ-CB 4.25Å; F379-P384 HydrophobicContact CZ-CG 3.81Å; P384-K386 VanDerWaalsContact C-N 3.34Å; P384-K386 PolarHBondContact O-N 3.26Å; P384-I387 PolarHBondContact O-N 3.13Å; P384-I387 VanDerWaalsContact O-N 3.15Å; P384-A388 PolarHBondContact O-N 3.07Å
385	K	84.7	Confident	85.9	Confident	100 Å²	100	44.6 Å²	44.6	44%	0.435	21%	0.212	S	C	.	.	H	α-helix	trans	-57.4	-46	-179.9	-174.6	-179.8	176.9	-176.9	0	112.1	L171 I177 S182 G383 I387 A388 E389	L171-K385 HydrophobicContact CD1-CG 4.17Å; I177-K385 HydrophobicContact CD1-CB 4.44Å; S182-K385 WeakPolarHBondContact O-CB 3.28Å; G383-K385 VanDerWaalsContact C-N 3.33Å; G383-K385 PolarHBondContact O-N 3.1Å; K385-I387 VanDerWaalsContact C-N 3.27Å; K385-I387 PolarHBondContact O-N 3.47Å; K385-A388 PolarHBondContact O-N 3.4Å; K385-E389 WeakPolarHBondContact CE-OE1 3.39Å; K385-E389 WeakPolarHBondContact O-CG 3.44Å; K385-E389 PolarHBondContact O-N 3.31Å
386	K	84.7	Confident	84.5	Confident	89 Å²	89	44.6 Å²	44.6	39%	0.387	21%	0.212	S	C	.	.	H	α-helix	trans	-67.9	-32.6	-179	-172.8	57.3	175	175	0	111.6	Y382 G383 P384 E389	Y382-K386 HydrophobicContact CG-CG 4.48Å; G383-K386 PolarHBondContact O-N 2.94Å; G383-K386 VanDerWaalsContact O-N 3.15Å; P384-K386 VanDerWaalsContact C-N 3.34Å; P384-K386 PolarHBondContact O-N 3.26Å; K386-E389 WeakPolarHBondContact CD-OE2 3.38Å; K386-E389 IonicContact NZ-OE2 3.59Å
387	I	86.4	Confident	83.1	Confident	1 Å²	1	48 Å²	48	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-69.8	-46.7	176.2	-54.3	-47.8	0	0	0	111	I176 Y333 Y378 F379 G383 P384 K385 E389 L390 L392	I176-I387 HydrophobicContact CD1-CB 4.42Å; I176-I387 HydrophobicContact CD1-CG2 3.61Å; Y333-I387 HydrophobicContact CD1-CG2 3.57Å; Y333-I387 HydrophobicContact CE1-CB 4.48Å; Y333-I387 HydrophobicContact CE1-CD1 4.09Å; Y333-I387 HydrophobicContact CE1-CG1 4.11Å; Y333-I387 HydrophobicContact CE1-CG2 3.52Å; Y378-I387 HydrophobicContact CD1-CD1 3.58Å; Y378-I387 HydrophobicContact CE1-CD1 3.45Å; Y378-I387 VanDerWaalsContact CE1-CD1 3.45Å; F379-I387 HydrophobicContact CD2-CG1 3.73Å; F379-I387 HydrophobicContact CE2-CG1 4.04Å; G383-I387 PolarHBondContact O-N 3.27Å; P384-I387 PolarHBondContact O-N 3.13Å; P384-I387 VanDerWaalsContact O-N 3.15Å; K385-I387 VanDerWaalsContact C-N 3.27Å; K385-I387 PolarHBondContact O-N 3.47Å; I387-E389 VanDerWaalsContact C-N 3.26Å; I387-E389 PolarHBondContact O-N 2.87Å; I387-L390 VanDerWaalsContact O-CB 3.3Å; I387-L390 WeakPolarHBondContact O-CB 3.26Å; I387-L390 PolarHBondContact O-N 3.28Å; I387-L392 HydrophobicContact CG2-CD1 3.94Å
388	A	83.6	Confident	81.5	Confident	4 Å²	4	49.5 Å²	49.5	3%	0.033	24%	0.237	C	C	.	.	H	α-helix	trans	-60.6	-35.9	177.1	0	0	0	0	0	112.1	L171 D174 I177 P384 K385 L390 N391	L171-A388 HydrophobicContact CD2-CB 3.64Å; D174-A388 HydrophobicContact CB-CB 4.14Å; I177-A388 HydrophobicContact CD1-CB 3.92Å; I177-A388 HydrophobicContact CG1-CB 3.73Å; P384-A388 PolarHBondContact O-N 3.07Å; K385-A388 PolarHBondContact O-N 3.4Å; A388-L390 PolarHBondContact O-N 3.35Å; A388-N391 PolarHBondContact O-N 3.18Å; A388-N391 VanDerWaalsContact O-N 3.12Å
389	E	82.1	Confident	79.5	Confident	75 Å²	75	51.1 Å²	51.1	35%	0.35	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-23	173.2	-75.3	171.3	-171.9	0	0	113.9	L171 K385 K386 I387 N391	L171-E389 HydrophobicContact CD1-CG 4.31Å; L171-E389 HydrophobicContact CD2-CG 4.18Å; K385-E389 WeakPolarHBondContact CE-OE1 3.39Å; K385-E389 WeakPolarHBondContact O-CG 3.44Å; K385-E389 PolarHBondContact O-N 3.31Å; K386-E389 WeakPolarHBondContact CD-OE2 3.38Å; K386-E389 IonicContact NZ-OE2 3.59Å; I387-E389 VanDerWaalsContact C-N 3.26Å; I387-E389 PolarHBondContact O-N 2.87Å; E389-N391 PolarHBondContact O-N 2.91Å
390	L	80.9	Confident	77.6	Confident	48 Å²	48	55.4 Å²	55.4	25%	0.251	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-14.3	176.6	-63.4	173.1	0	0	0	112.8	I350 Y378 I387 A388 L392 L395	I350-L390 HydrophobicContact CG1-CD1 4.34Å; Y378-L390 HydrophobicContact CE1-CD1 4.45Å; I387-L390 VanDerWaalsContact O-CB 3.3Å; I387-L390 WeakPolarHBondContact O-CB 3.26Å; I387-L390 PolarHBondContact O-N 3.28Å; A388-L390 PolarHBondContact O-N 3.35Å; L390-L392 HydrophobicContact CB-CD2 4.08Å; L390-L392 HydrophobicContact CB-CG 4.3Å; L390-L392 HydrophobicContact CD1-CD2 4.49Å; L390-L392 PolarHBondContact O-N 2.98Å; L390-L395 WeakPolarHBondContact O-CD1 3.46Å
391	N	77.6	Confident	75.4	Confident	77 Å²	77	58.4 Å²	58.4	41%	0.412	28%	0.281	S	S	.	.			trans	45.8	57.9	-178.5	-165.6	-5.4	0	0	0	112.2	A388 E389 E393 A394 L395	A388-N391 PolarHBondContact O-N 3.18Å; A388-N391 VanDerWaalsContact O-N 3.12Å; E389-N391 PolarHBondContact O-N 2.91Å; N391-E393 PolarHBondContact O-N 3.14Å; N391-E393 VanDerWaalsContact O-N 3.15Å; N391-A394 HydrophobicContact CB-CB 4.33Å; N391-A394 VanDerWaalsContact CG-CB 3.45Å; N391-A394 WeakPolarHBondContact ND2-CB 3.43Å; N391-A394 PolarHBondContact O-N 3.37Å; N391-A394 VanDerWaalsContact O-N 3.1Å; N391-A394 WeakPolarHBondContact OD1-CB 3.47Å; N391-A394 PolarHBondContact OD1-N 3.03Å; N391-L395 PolarHBondContact O-N 3.41Å
392	L	79.6	Confident	72.9	Confident	10 Å²	10	58.6 Å²	58.6	5%	0.052	28%	0.284	C	S	.	.	H	α-helix	trans	-57.7	-29.6	-175.4	-64.6	174.8	0	0	0	112.5	Y333 F341 F345 L346 A349 I350 I387 L390 L395 A396	Y333-L392 HydrophobicContact CD1-CD1 3.8Å; F341-L392 HydrophobicContact CE1-CB 4.31Å; F341-L392 HydrophobicContact CE2-CB 4Å; F341-L392 HydrophobicContact CE2-CD1 4.5Å; F341-L392 HydrophobicContact CZ-CB 3.68Å; F345-L392 HydrophobicContact CE1-CB 4.31Å; F345-L392 HydrophobicContact CE1-CD2 4.44Å; F345-L392 VanDerWaalsContact CZ-O 3.29Å; F345-L392 WeakPolarHBondContact CZ-O 3.39Å; L346-L392 HydrophobicContact CD2-CD1 4.19Å; A349-L392 HydrophobicContact CB-CD2 3.95Å; I350-L392 HydrophobicContact CD1-CD1 3.93Å; I350-L392 HydrophobicContact CD1-CD2 4.25Å; I350-L392 HydrophobicContact CG1-CD1 4.48Å; I350-L392 HydrophobicContact CG1-CD2 3.9Å; I387-L392 HydrophobicContact CG2-CD1 3.94Å; L390-L392 HydrophobicContact CB-CD2 4.08Å; L390-L392 HydrophobicContact CB-CG 4.3Å; L390-L392 HydrophobicContact CD1-CD2 4.49Å; L390-L392 PolarHBondContact O-N 2.98Å; L392-L395 PolarHBondContact O-N 3.12Å; L392-A396 WeakPolarHBondContact O-CB 3.4Å; L392-A396 PolarHBondContact O-N 3.48Å
393	E	75.3	Confident	70.5	Confident	42 Å²	42	57.6 Å²	57.6	20%	0.196	30%	0.297	C	S	.	.	H	α-helix	trans	-65.9	-46.1	176.6	-162.3	64.7	-142.1	0	0	111.6	R335 N391 L395 A396 N397	R335-E393 VanDerWaalsContact CB-OE2 3.3Å; R335-E393 WeakPolarHBondContact CB-OE2 3.35Å; R335-E393 WeakPolarHBondContact CD-OE1 3.32Å; R335-E393 VanDerWaalsContact CD-OE2 3.28Å; R335-E393 WeakPolarHBondContact CD-OE2 3.5Å; R335-E393 WeakPolarHBondContact CG-OE2 3.01Å; R335-E393 IonicContact CZ-OE1 3.64Å; R335-E393 IonicContact NE-OE1 2.8Å; R335-E393 IonicContact NE-OE2 3.18Å; R335-E393 IonicContact NH1-OE1 3.38Å; R335-E393 PolarHBondContact NH1-OE1 3.17Å; N391-E393 PolarHBondContact O-N 3.14Å; N391-E393 VanDerWaalsContact O-N 3.15Å; E393-L395 VanDerWaalsContact C-N 3.34Å; E393-L395 PolarHBondContact O-N 3.12Å; E393-A396 PolarHBondContact O-N 3.38Å; E393-N397 PolarHBondContact O-N 2.67Å; E393-N397 PolarHBondContact O-ND2 2.81Å
394	A	71.8	Confident	68	Low	32 Å²	32	61.9 Å²	61.9	26%	0.264	33%	0.333	S	S	.	.	H	α-helix	trans	-61.2	-43.7	175.6	0	0	0	0	0	111.6	N391 A396 N397 H398	N391-A394 HydrophobicContact CB-CB 4.33Å; N391-A394 VanDerWaalsContact CG-CB 3.45Å; N391-A394 WeakPolarHBondContact ND2-CB 3.43Å; N391-A394 PolarHBondContact O-N 3.37Å; N391-A394 VanDerWaalsContact O-N 3.1Å; N391-A394 WeakPolarHBondContact OD1-CB 3.47Å; N391-A394 PolarHBondContact OD1-N 3.03Å; A394-A396 PolarHBondContact O-N 3.37Å; A394-N397 PolarHBondContact O-N 3.02Å; A394-H398 PolarHBondContact O-CD2 3.31Å; A394-H398 PolarHBondContact O-N 3.45Å; A394-H398 VanDerWaalsContact O-N 3.09Å
395	L	73.1	Confident	65.6	Low	76 Å²	76	64.8 Å²	64.8	40%	0.398	36%	0.363	S	S	.	.	H	α-helix	trans	-64.1	-38.3	177.9	-70.6	174.3	0	0	0	112.6	F345 A349 L390 N391 L392 E393 H398 Q399	F345-L395 HydrophobicContact CE2-CB 4.12Å; F345-L395 HydrophobicContact CZ-CB 3.85Å; A349-L395 HydrophobicContact CB-CD1 4.47Å; L390-L395 WeakPolarHBondContact O-CD1 3.46Å; N391-L395 PolarHBondContact O-N 3.41Å; L392-L395 PolarHBondContact O-N 3.12Å; E393-L395 VanDerWaalsContact C-N 3.34Å; E393-L395 PolarHBondContact O-N 3.12Å; L395-H398 PolarHBondContact O-N 3.29Å; L395-Q399 PolarHBondContact O-N 3.36Å; L395-Q399 VanDerWaalsContact O-N 3.09Å
396	A	66.9	Low	63	Low	1 Å²	1	68.4 Å²	68.4	1%	0.008	38%	0.382	C	S	.	.	H	α-helix	trans	-71	-38.3	179.1	0	0	0	0	0	112.4	R335 F341 F345 L392 E393 A394 H398 Q399 E400	R335-A396 VanDerWaalsContact NH2-CB 3.29Å; F341-A396 HydrophobicContact CD1-CB 3.88Å; F341-A396 HydrophobicContact CE1-CB 3.52Å; F345-A396 HydrophobicContact CD1-CB 4.39Å; F345-A396 HydrophobicContact CD2-CB 4.1Å; F345-A396 HydrophobicContact CE1-CB 3.9Å; F345-A396 HydrophobicContact CE2-CB 3.62Å; F345-A396 HydrophobicContact CG-CB 4.49Å; F345-A396 HydrophobicContact CZ-CB 3.5Å; L392-A396 WeakPolarHBondContact O-CB 3.4Å; L392-A396 PolarHBondContact O-N 3.48Å; E393-A396 PolarHBondContact O-N 3.38Å; A394-A396 PolarHBondContact O-N 3.37Å; A396-H398 VanDerWaalsContact C-N 3.29Å; A396-H398 PolarHBondContact O-N 3.4Å; A396-Q399 PolarHBondContact O-N 3.19Å; A396-E400 WeakPolarHBondContact O-CB 3.37Å; A396-E400 WeakPolarHBondContact O-CG 3.47Å; A396-E400 PolarHBondContact O-N 2.97Å
397	N	66.2	Low	60.2	Low	72 Å²	72	73.2 Å²	73.2	39%	0.385	41%	0.405	S	S	.	.	H	α-helix	trans	-61.5	-40.6	173.4	-67.3	-23	0	0	0	110.7	E393 A394 E400 I401	E393-N397 PolarHBondContact O-N 2.67Å; E393-N397 PolarHBondContact O-ND2 2.81Å; A394-N397 PolarHBondContact O-N 3.02Å; N397-E400 PolarHBondContact O-N 2.85Å; N397-I401 WeakPolarHBondContact O-CB 3.31Å; N397-I401 VanDerWaalsContact O-CD1 3.23Å; N397-I401 WeakPolarHBondContact O-CD1 3.29Å; N397-I401 WeakPolarHBondContact O-CG1 3.43Å; N397-I401 PolarHBondContact O-N 3.39Å; N397-I401 VanDerWaalsContact O-N 3.09Å
398	H	61	Low	57.7	Low	97 Å²	97	78.7 Å²	78.7	45%	0.449	44%	0.441	S	S	.	.	H	α-helix	trans	-63.1	-40.1	174	-73.9	-57.7	0	0	0	113.7	A394 L395 A396 Q402	A394-H398 PolarHBondContact O-CD2 3.31Å; A394-H398 PolarHBondContact O-N 3.45Å; A394-H398 VanDerWaalsContact O-N 3.09Å; L395-H398 PolarHBondContact O-N 3.29Å; A396-H398 VanDerWaalsContact C-N 3.29Å; A396-H398 PolarHBondContact O-N 3.4Å; H398-Q402 WeakPolarHBondContact O-CG 3.4Å; H398-Q402 PolarHBondContact O-N 3.4Å; H398-Q402 VanDerWaalsContact O-N 3.14Å
399	Q	52.7	Low	54.9	Low	80 Å²	80	89.9 Å²	89.9	37%	0.374	48%	0.482	S	S	.	.	H	α-helix	trans	-73.9	-35.2	177	-88.2	-166.9	2.7	0	0	113.6	F345 L395 A396 I401 Q402 A403	F345-Q399 VanDerWaalsContact CD2-OE1 3.31Å; L395-Q399 PolarHBondContact O-N 3.36Å; L395-Q399 VanDerWaalsContact O-N 3.09Å; A396-Q399 PolarHBondContact O-N 3.19Å; Q399-I401 VanDerWaalsContact C-N 3.29Å; Q399-I401 PolarHBondContact O-N 3.19Å; Q399-Q402 PolarHBondContact O-N 2.77Å; Q399-A403 VanDerWaalsContact O-CB 3.31Å; Q399-A403 WeakPolarHBondContact O-CB 3.33Å; Q399-A403 PolarHBondContact O-N 2.93Å
400	E	52.9	Low	52.1	Low	89 Å²	89	93.3 Å²	93.3	42%	0.416	50%	0.503	S	S	.	.	H	α-helix	trans	-66	-35	175.4	-74.9	175.9	-163.2	0	0	111.3	R335 A396 N397 A404	R335-E400 IonicContact CZ-OE1 3.48Å; R335-E400 IonicContact NH1-OE1 3.32Å; R335-E400 IonicContact NH2-OE1 3.83Å; R335-E400 PolarHBondContact NH2-OE1 3.29Å; A396-E400 WeakPolarHBondContact O-CB 3.37Å; A396-E400 WeakPolarHBondContact O-CG 3.47Å; A396-E400 PolarHBondContact O-N 2.97Å; N397-E400 PolarHBondContact O-N 2.85Å; E400-A404 PolarHBondContact O-N 3.4Å
401	I	47.1	Very low	49.8	Very low	96 Å²	96	97.7 Å²	97.7	49%	0.492	53%	0.532	S	S	.	.	H	α-helix	trans	-66.5	-40	171.7	-66.6	163.4	0	0	0	111.4	N397 Q399	N397-I401 WeakPolarHBondContact O-CB 3.31Å; N397-I401 VanDerWaalsContact O-CD1 3.23Å; N397-I401 WeakPolarHBondContact O-CD1 3.29Å; N397-I401 WeakPolarHBondContact O-CG1 3.43Å; N397-I401 PolarHBondContact O-N 3.39Å; N397-I401 VanDerWaalsContact O-N 3.09Å; Q399-I401 VanDerWaalsContact C-N 3.29Å; Q399-I401 PolarHBondContact O-N 3.19Å
402	Q	38.8	Very low	47.3	Very low	135 Å²	135	100.4 Å²	100.4	63%	0.631	55%	0.551	S	S	*	*	H	α-helix	trans	-74.4	-37.6	178.6	-73.9	177.9	5.5	0	0	113.5	H398 Q399 A404 G405	H398-Q402 WeakPolarHBondContact O-CG 3.4Å; H398-Q402 PolarHBondContact O-N 3.4Å; H398-Q402 VanDerWaalsContact O-N 3.14Å; Q399-Q402 PolarHBondContact O-N 2.77Å; Q402-A404 VanDerWaalsContact C-N 3.3Å; Q402-A404 PolarHBondContact O-N 2.77Å; Q402-G405 PolarHBondContact O-N 3.35Å
403	A	37.8	Very low	45.2	Very low	83 Å²	83	109 Å²	109	69%	0.686	59%	0.591	S	S	*	*	H	α-helix	trans	-71.9	-23.1	-179.7	0	0	0	0	0	113.2	Q399 G405	Q399-A403 VanDerWaalsContact O-CB 3.31Å; Q399-A403 WeakPolarHBondContact O-CB 3.33Å; Q399-A403 PolarHBondContact O-N 2.93Å; A403-G405 PolarHBondContact O-N 2.99Å
404	A	37.6	Very low	42.9	Very low	92 Å²	92	113.8 Å²	113.8	76%	0.76	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-6.5	172.1	0	0	0	0	0	113.5	E400 Q402	E400-A404 PolarHBondContact O-N 3.4Å; Q402-A404 VanDerWaalsContact C-N 3.3Å; Q402-A404 PolarHBondContact O-N 2.77Å
405	G	36.4	Very low	41.1	Very low	62 Å²	62	119.3 Å²	119.3	64%	0.639	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	8.7	-171.4	0	0	0	0	0	117.5	Q402 A403	Q402-G405 PolarHBondContact O-N 3.35Å; A403-G405 PolarHBondContact O-N 2.99Å
406	Q	30.6	Very low	39.1	Very low	176 Å²	176	122.5 Å²	122.5	82%	0.822	65%	0.654	S	S	*	*			trans	-125.8	99.8	-174.5	-71.3	-173.9	-6.6	0	0	114.6
407	E	26.1	Very low	37.5	Very low	190 Å²	190	129.1 Å²	129.1	89%	0.888	68%	0.684	S	S	*	*			trans	-102.6	149.3	136.6	-91.8	-157.3	168.3	0	0	108.6
408	P	33.3	Very low	36.3	Very low	115 Å²	115	130.1 Å²	130.1	75%	0.747	70%	0.695	S	S	*	*			trans	-85.5	131.8	-164.3	32.8	-31.4	0	0	0	111.7
409	R	24.8	Very low	35.8	Very low	240 Å²	240	131.2 Å²	131.2	91%	0.906	70%	0.704	S	S	*	*			trans	-164.6	113.8	147.2	-104.8	157.8	-161.9	-154.8	5.7	112
410	N	24	Very low	36.5	Very low	146 Å²	146	129 Å²	129	78%	0.781	70%	0.696	S	S	*	*			trans	42.7	109.2	150.6	-61.3	-2.7	0	0	0	119.7	T412	N410-T412 PolarHBondContact O-N 2.91Å
411	T	32.5	Very low	37.9	Very low	141 Å²	141	125 Å²	125	87%	0.865	68%	0.678	S	S	*	*			trans	-0.4	98.3	142.5	20.8	0	0	0	0	116.8
412	T	24.8	Very low	39.7	Very low	133 Å²	133	120.5 Å²	120.5	82%	0.816	66%	0.655	S	S	*	*				-159.7	138.3	124.2	-24.7	0	0	0	0	109.1	N410	N410-T412 PolarHBondContact O-N 2.91Å
413	E	36.3	Very low	41.8	Very low	190 Å²	190	114.2 Å²	114.2	89%	0.888	63%	0.626	S	S	*	*			trans	-48.9	123	-171.2	-61	166.8	150	0	0	115.3
414	I	26.8	Very low	43.9	Very low	144 Å²	144	114.8 Å²	114.8	74%	0.738	61%	0.614	S	S	*	*			trans	-143.4	117	156.8	-56.7	-178.1	0	0	0	109.8
415	L	32.5	Very low	45.9	Very low	148 Å²	148	110.6 Å²	110.6	78%	0.775	58%	0.579	S	S	*	*			trans	-56.7	123.3	171.3	-135.2	76.6	0	0	0	110.7
416	Q	32.1	Very low	48.1	Very low	142 Å²	142	107.7 Å²	107.7	66%	0.664	55%	0.549	S	S	*	.			trans	-124.4	125	169.8	-75.9	-170.8	-15.2	0	0	111.1	P418	Q416-P418 WeakPolarHBondContact O-CD 3.05Å
417	H	34.3	Very low	50.5	Low	140 Å²	140	102 Å²	102	65%	0.648	52%	0.524	S	S	*	.			trans	-94.7	112.1	-178	-66.1	-44.8	0	0	0	111.1	T420	H417-T420 PolarHBondContact O-OG1 3.47Å
418	P	39.9	Very low	53.1	Low	94 Å²	94	97.1 Å²	97.1	61%	0.61	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-10.5	-173.8	-14.3	30.1	0	0	0	116	Q416	Q416-P418 WeakPolarHBondContact O-CD 3.05Å
419	N	51	Low	55.3	Low	119 Å²	119	94.5 Å²	94.5	64%	0.636	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	13.3	-169.9	-76	-7.9	0	0	0	114.6	S421	N419-S421 PolarHBondContact O-N 3.07Å
420	T	66.5	Low	57.8	Low	35 Å²	35	86.5 Å²	86.5	22%	0.215	49%	0.485	C	S	.	.			trans	-73.2	119	-171.4	-47.8	0	0	0	0	111.1	K71 H417 E424	K71-T420 WeakPolarHBondContact CE-O 3.28Å; K71-T420 PolarHBondContact NZ-O 3.25Å; H417-T420 PolarHBondContact O-OG1 3.47Å; T420-E424 VanDerWaalsContact CA-OE2 3.28Å; T420-E424 WeakPolarHBondContact CA-OE2 3.48Å; T420-E424 HydrophobicContact CG2-CB 3.34Å; T420-E424 HydrophobicContact CG2-CG 4.47Å
421	S	83.7	Confident	60.6	Low	4 Å²	4	82.7 Å²	82.7	3%	0.028	46%	0.463	C	S	.	.			trans	-68.8	164.4	174.8	65.2	0	0	0	0	111.6	G143 N419 L423 E424 C425	G143-S421 WeakPolarHBondContact O-CB 3.46Å; N419-S421 PolarHBondContact O-N 3.07Å; S421-L423 PolarHBondContact O-N 3.41Å; S421-E424 PolarHBondContact O-N 2.91Å; S421-E424 VanDerWaalsContact O-N 3.16Å; S421-E424 WeakPolarHBondContact OG-CG 3.43Å; S421-E424 PolarHBondContact OG-N 3.17Å; S421-E424 PolarHBondContact OG-OE1 2.99Å; S421-C425 PolarHBondContact O-N 3Å; S421-C425 PolarHBondContact O-SG 2.66Å
422	V	83.3	Confident	63	Low	1 Å²	1	81.6 Å²	81.6	1%	0.006	45%	0.446	C	S	.	.	H	α-helix	trans	-58.9	-34.6	175.8	174.6	0	0	0	0	111	L70 K71 V74 V142 C425 L426 F475	L70-V422 HydrophobicContact CB-CG2 3.92Å; K71-V422 HydrophobicContact CG-CG2 3.75Å; V74-V422 HydrophobicContact CG2-CG1 4.29Å; V142-V422 HydrophobicContact CG1-CB 4.04Å; V142-V422 PolarHBondContact O-N 2.87Å; V422-C425 WeakPolarHBondContact O-CB 3.47Å; V422-C425 PolarHBondContact O-N 3.47Å; V422-L426 HydrophobicContact CG1-CD1 4.35Å; V422-L426 WeakPolarHBondContact O-CG 3.3Å; V422-L426 PolarHBondContact O-N 2.95Å; V422-F475 HydrophobicContact CG1-CE1 4.47Å; V422-F475 HydrophobicContact CG1-CE2 4.13Å; V422-F475 HydrophobicContact CG1-CZ 3.87Å
423	L	82.8	Confident	66	Low	4 Å²	4	75.3 Å²	75.3	2%	0.021	41%	0.407	C	S	.	.	H	α-helix	trans	-63.5	-48	174.4	-80.1	154.9	0	0	0	112.1	V142 L144 S421 C425 L426 D427 L433 L445 N450 C451	V142-L423 HydrophobicContact CG1-CD1 3.77Å; V142-L423 HydrophobicContact CG1-CG 3.94Å; L144-L423 HydrophobicContact CD1-CD1 3.71Å; L144-L423 HydrophobicContact CD2-CD1 3.66Å; L144-L423 HydrophobicContact CG-CD1 3.92Å; S421-L423 PolarHBondContact O-N 3.41Å; L423-C425 PolarHBondContact O-N 3.38Å; L423-L426 WeakPolarHBondContact O-CB 3.37Å; L423-L426 PolarHBondContact O-N 3.33Å; L423-L426 VanDerWaalsContact O-N 3.13Å; L423-D427 PolarHBondContact O-N 3.13Å; L423-L433 HydrophobicContact CD2-CB 4.1Å; L423-L433 HydrophobicContact CD2-CD2 3.84Å; L423-L433 HydrophobicContact CG-CD2 4.38Å; L423-L445 HydrophobicContact CD1-CD1 3.79Å; L423-N450 HydrophobicContact CD2-CB 4.35Å; L423-C451 HydrophobicContact CD2-CB 4.17Å
424	E	81.8	Confident	68.6	Low	95 Å²	95	66.2 Å²	66.2	44%	0.444	37%	0.365	S	S	.	.	H	α-helix	trans	-64.8	-30.5	176.8	-70.1	163.3	-139.9	0	0	112.1	T420 S421 D427 S428	T420-E424 VanDerWaalsContact CA-OE2 3.28Å; T420-E424 WeakPolarHBondContact CA-OE2 3.48Å; T420-E424 HydrophobicContact CG2-CB 3.34Å; T420-E424 HydrophobicContact CG2-CG 4.47Å; S421-E424 PolarHBondContact O-N 2.91Å; S421-E424 VanDerWaalsContact O-N 3.16Å; S421-E424 WeakPolarHBondContact OG-CG 3.43Å; S421-E424 PolarHBondContact OG-N 3.17Å; S421-E424 PolarHBondContact OG-OE1 2.99Å; E424-D427 PolarHBondContact O-N 2.91Å; E424-S428 PolarHBondContact O-N 2.88Å
425	C	80.9	Confident	71.7	Confident	4 Å²	4	59.4 Å²	59.4	3%	0.027	33%	0.33	C	S	.	.	H	α-helix	trans	-64.6	-46.9	171.9	-63.6	0	0	0	0	111.1	V74 L75 S421 V422 L423 D427 S428 V429	V74-C425 HydrophobicContact CG1-CB 4.18Å; L75-C425 HydrophobicContact CD1-CB 4Å; L75-C425 HydrophobicContact CD2-CB 3.75Å; L75-C425 HydrophobicContact CG-CB 3.77Å; S421-C425 PolarHBondContact O-N 3Å; S421-C425 PolarHBondContact O-SG 2.66Å; V422-C425 WeakPolarHBondContact O-CB 3.47Å; V422-C425 PolarHBondContact O-N 3.47Å; L423-C425 PolarHBondContact O-N 3.38Å; C425-D427 VanDerWaalsContact C-N 3.28Å; C425-D427 PolarHBondContact O-N 2.87Å; C425-S428 PolarHBondContact O-N 3.31Å; C425-S428 PolarHBondContact O-OG 2.99Å; C425-V429 PolarHBondContact O-N 2.75Å
426	L	81.8	Confident	74.5	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59.5	-40.4	175.5	-75.3	166	0	0	0	111.4	V74 V422 L423 S428 V429 G430 Q431 L433 F475	V74-L426 HydrophobicContact CB-CD2 4.42Å; V74-L426 HydrophobicContact CG1-CD2 3.58Å; V74-L426 HydrophobicContact CG1-CG 3.84Å; V74-L426 HydrophobicContact CG2-CD2 3.88Å; V74-L426 HydrophobicContact CG2-CG 4.16Å; V422-L426 HydrophobicContact CG1-CD1 4.35Å; V422-L426 WeakPolarHBondContact O-CG 3.3Å; V422-L426 PolarHBondContact O-N 2.95Å; L423-L426 WeakPolarHBondContact O-CB 3.37Å; L423-L426 PolarHBondContact O-N 3.33Å; L423-L426 VanDerWaalsContact O-N 3.13Å; L426-S428 PolarHBondContact O-N 2.88Å; L426-V429 CarbonylContact O-C 3.59Å; L426-V429 WeakPolarHBondContact O-CG2 3.36Å; L426-V429 PolarHBondContact O-N 3.09Å; L426-G430 PolarHBondContact O-N 3.16Å; L426-G430 VanDerWaalsContact O-N 3.09Å; L426-Q431 CarbonylContact C-O 3.54Å; L426-Q431 HydrophobicContact CD2-CB 3.8Å; L426-Q431 PolarHBondContact O-N 2.89Å; L426-L433 HydrophobicContact CD1-CB 3.77Å; L426-F475 HydrophobicContact CD1-CB 4.26Å; L426-F475 HydrophobicContact CD1-CD1 4.32Å; L426-F475 HydrophobicContact CD1-CG 4.19Å; L426-F475 HydrophobicContact CD2-CB 3.82Å; L426-F475 HydrophobicContact CD2-CD2 4.5Å; L426-F475 HydrophobicContact CD2-CG 4.29Å
427	D	81.7	Confident	77.3	Confident	57 Å²	57	45.6 Å²	45.6	31%	0.305	26%	0.261	S	S	.	.	H	α-helix	trans	-61.5	-43.7	176.3	-63.3	-31.4	0	0	0	112.6	L423 E424 C425 V429 G430 N450	L423-D427 PolarHBondContact O-N 3.13Å; E424-D427 PolarHBondContact O-N 2.91Å; C425-D427 VanDerWaalsContact C-N 3.28Å; C425-D427 PolarHBondContact O-N 2.87Å; D427-V429 PolarHBondContact O-N 2.81Å; D427-G430 PolarHBondContact O-N 2.9Å; D427-N450 WeakPolarHBondContact OD1-CB 3.46Å; D427-N450 PolarHBondContact OD1-ND2 3.28Å; D427-N450 PolarHBondContact OD1-OD1 3.29Å; D427-N450 PolarHBondContact OD2-ND2 3.1Å
428	S	80.4	Confident	79.7	Confident	87 Å²	87	42 Å²	42	61%	0.608	24%	0.242	S	C	*	.	H	α-helix	trans	-62.6	-26.3	179.8	76.6	0	0	0	0	113	E424 C425 L426	E424-S428 PolarHBondContact O-N 2.88Å; C425-S428 PolarHBondContact O-N 3.31Å; C425-S428 PolarHBondContact O-OG 2.99Å; L426-S428 PolarHBondContact O-N 2.88Å
429	V	78.6	Confident	81.3	Confident	61 Å²	61	42.8 Å²	42.8	37%	0.37	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	6.6	175.9	-59.7	0	0	0	0	112.9	V74 L75 C425 L426 D427 Q431	V74-V429 HydrophobicContact CG1-CG2 4.15Å; L75-V429 HydrophobicContact CD2-CG1 4.11Å; C425-V429 PolarHBondContact O-N 2.75Å; L426-V429 CarbonylContact O-C 3.59Å; L426-V429 WeakPolarHBondContact O-CG2 3.36Å; L426-V429 PolarHBondContact O-N 3.09Å; D427-V429 PolarHBondContact O-N 2.81Å; V429-Q431 VanDerWaalsContact C-N 3.28Å; V429-Q431 HydrophobicContact CG2-CB 4Å; V429-Q431 HydrophobicContact CG2-CG 3.84Å; V429-Q431 PolarHBondContact O-N 2.84Å
430	G	77.4	Confident	81.8	Confident	72 Å²	72	43.2 Å²	43.2	74%	0.742	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.2	22.8	178.6	0	0	0	0	0	114.5	L426 D427	L426-G430 PolarHBondContact O-N 3.16Å; L426-G430 VanDerWaalsContact O-N 3.09Å; D427-G430 PolarHBondContact O-N 2.9Å
431	Q	83.1	Confident	81.6	Confident	66 Å²	66	43.8 Å²	43.8	31%	0.308	24%	0.24	S	C	.	.			trans	-103.9	153.9	179.7	-65.7	-177.7	-5.7	0	0	111	L426 V429 P474	L426-Q431 CarbonylContact C-O 3.54Å; L426-Q431 HydrophobicContact CD2-CB 3.8Å; L426-Q431 PolarHBondContact O-N 2.89Å; V429-Q431 VanDerWaalsContact C-N 3.28Å; V429-Q431 HydrophobicContact CG2-CB 4Å; V429-Q431 HydrophobicContact CG2-CG 3.84Å; V429-Q431 PolarHBondContact O-N 2.84Å; Q431-P474 HydrophobicContact CB-CG 4.02Å; Q431-P474 HydrophobicContact CG-CG 3.86Å
432	K	84.2	Confident	80.5	Confident	117 Å²	117	45.3 Å²	45.3	51%	0.509	25%	0.253	S	S	.	.			trans	-111.7	145.4	174.6	-69.6	-175.2	179.8	-179.3	0	110.8
433	L	88	Confident	79.6	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	125.9	170.2	168.6	63.1	0	0	0	109.7	L423 L426 L445 N450 C451 Q452 F475 I477	L423-L433 HydrophobicContact CD2-CB 4.1Å; L423-L433 HydrophobicContact CD2-CD2 3.84Å; L423-L433 HydrophobicContact CG-CD2 4.38Å; L426-L433 HydrophobicContact CD1-CB 3.77Å; L433-L445 HydrophobicContact CD2-CD1 3.72Å; L433-L445 HydrophobicContact CD2-CD2 4.12Å; L433-L445 HydrophobicContact CD2-CG 4.09Å; L433-N450 PolarHBondContact N-O 3.18Å; L433-N450 VanDerWaalsContact N-O 3.11Å; L433-C451 HydrophobicContact CD2-CB 4.36Å; L433-C451 CarbonylContact O-C 3.5Å; L433-C451 WeakPolarHBondContact O-CA 3.38Å; L433-Q452 PolarHBondContact O-N 2.72Å; L433-F475 HydrophobicContact CD1-CD1 3.28Å; L433-F475 HydrophobicContact CD1-CE1 3.61Å; L433-F475 HydrophobicContact CD1-CG 4.45Å; L433-I477 HydrophobicContact CD1-CB 4.33Å; L433-I477 HydrophobicContact CD1-CD1 3.92Å; L433-I477 HydrophobicContact CD1-CG1 3.82Å; L433-I477 HydrophobicContact CD2-CD1 4.21Å
434	L	90.9	Very high	78.5	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	125.9	162.6	176.8	69	0	0	0	109.5	L436 Q452 I454 E469 F473 F475 S476 I477	L434-L436 HydrophobicContact CD1-CD2 3.88Å; L434-L436 HydrophobicContact CD1-CG 4.39Å; L434-L436 HydrophobicContact CD2-CD1 4.17Å; L434-L436 HydrophobicContact CD2-CD2 4.24Å; L434-L436 HydrophobicContact CD2-CG 4.1Å; L434-L436 HydrophobicContact CG-CD2 4.1Å; L434-L436 HydrophobicContact CG-CG 4.07Å; L434-Q452 HydrophobicContact CD1-CG 4.49Å; L434-I454 HydrophobicContact CD1-CD1 4.01Å; L434-I454 HydrophobicContact CD1-CG1 4.26Å; L434-E469 HydrophobicContact CD1-CB 4.41Å; L434-E469 HydrophobicContact CD2-CB 3.59Å; L434-F473 HydrophobicContact CB-CB 3.81Å; L434-F473 HydrophobicContact CB-CD1 3.84Å; L434-F473 HydrophobicContact CB-CD2 3.89Å; L434-F473 HydrophobicContact CB-CE1 4.41Å; L434-F473 HydrophobicContact CB-CE2 4.46Å; L434-F473 HydrophobicContact CB-CG 3.57Å; L434-F473 HydrophobicContact CD1-CD2 4.16Å; L434-F473 HydrophobicContact CD1-CE2 4.02Å; L434-F473 HydrophobicContact CD1-CZ 4.35Å; L434-F473 HydrophobicContact CD2-CB 4.42Å; L434-F473 HydrophobicContact CD2-CD2 3.8Å; L434-F473 HydrophobicContact CD2-CE2 4.39Å; L434-F473 HydrophobicContact CD2-CG 4.25Å; L434-F473 HydrophobicContact CG-CD2 4.15Å; L434-F473 HydrophobicContact CG-CG 4.34Å; L434-F475 PolarHBondContact N-O 2.87Å; L434-S476 CarbonylContact O-C 3.53Å; L434-S476 WeakPolarHBondContact O-CA 3.28Å; L434-I477 PolarHBondContact O-N 2.89Å
435	F	91	Very high	77.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	113.5	172.3	-177	-135	0	0	0	111	L138 T437 L445 A446 C451 Q452 T453 I454 I477 Q479	L138-F435 HydrophobicContact CD1-CE1 4.47Å; L138-F435 HydrophobicContact CD1-CE2 3.62Å; L138-F435 HydrophobicContact CD1-CZ 3.43Å; L138-F435 VanDerWaalsContact CD1-CZ 3.43Å; F435-T437 HydrophobicContact CD1-CG2 4.06Å; F435-T437 HydrophobicContact CE1-CG2 3.5Å; F435-T437 HydrophobicContact CZ-CG2 3.8Å; F435-L445 HydrophobicContact CB-CD2 4.49Å; F435-L445 HydrophobicContact CD1-CB 4.36Å; F435-L445 HydrophobicContact CD1-CD2 4.11Å; F435-L445 HydrophobicContact CD1-CG 4.26Å; F435-L445 HydrophobicContact CD2-CD2 3.82Å; F435-L445 HydrophobicContact CE1-CB 4.25Å; F435-L445 HydrophobicContact CE1-CD2 4.25Å; F435-L445 HydrophobicContact CE2-CD2 3.98Å; F435-L445 HydrophobicContact CG-CD2 3.89Å; F435-L445 HydrophobicContact CG-CG 4.37Å; F435-L445 HydrophobicContact CZ-CD2 4.2Å; F435-A446 HydrophobicContact CD1-CB 4.4Å; F435-A446 HydrophobicContact CE1-CB 4.38Å; F435-C451 WeakPolarHBondContact CB-SG 3.44Å; F435-Q452 PolarHBondContact N-O 2.86Å; F435-T453 HydrophobicContact CD1-CG2 3.83Å; F435-T453 CarbonylContact O-C 3.27Å; F435-T453 VanDerWaalsContact O-CA 3.26Å; F435-T453 WeakPolarHBondContact O-CA 3.39Å; F435-I454 PolarHBondContact O-N 2.99Å; F435-I477 WeakPolarHBondContact CA-O 3.46Å; F435-I477 HydrophobicContact CD2-CB 3.92Å; F435-I477 HydrophobicContact CD2-CG2 3.76Å; F435-I477 HydrophobicContact CE2-CG2 3.86Å; F435-Q479 HydrophobicContact CE2-CB 4.08Å
436	L	90.4	Very high	76.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	117.4	176.1	-57.5	-180	0	0	0	108.7	L434 I454 V462 Q465 A466 I477 V478 Q479	L434-L436 HydrophobicContact CD1-CD2 3.88Å; L434-L436 HydrophobicContact CD1-CG 4.39Å; L434-L436 HydrophobicContact CD2-CD1 4.17Å; L434-L436 HydrophobicContact CD2-CD2 4.24Å; L434-L436 HydrophobicContact CD2-CG 4.1Å; L434-L436 HydrophobicContact CG-CD2 4.1Å; L434-L436 HydrophobicContact CG-CG 4.07Å; L436-I454 HydrophobicContact CD2-CB 3.54Å; L436-I454 HydrophobicContact CD2-CD1 3.75Å; L436-I454 HydrophobicContact CD2-CG1 3.9Å; L436-I454 HydrophobicContact CD2-CG2 4.31Å; L436-V462 HydrophobicContact CB-CG1 4.18Å; L436-Q465 HydrophobicContact CD2-CB 4.43Å; L436-A466 HydrophobicContact CD1-CB 3.53Å; L436-I477 PolarHBondContact N-O 3.3Å; L436-V478 HydrophobicContact CB-CB 4.47Å; L436-V478 HydrophobicContact CB-CG1 4.17Å; L436-V478 HydrophobicContact CB-CG2 4.29Å; L436-V478 HydrophobicContact CD1-CG1 4.43Å; L436-V478 HydrophobicContact CD1-CG2 3.9Å; L436-V478 HydrophobicContact CG-CG2 4.35Å; L436-Q479 PolarHBondContact O-N 3.15Å
437	T	90.7	Very high	75.7	Confident	0 Å²	0	52 Å²	52	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	166.8	179.8	-168.9	0	0	0	0	111.3	F435 A442 T453 I454 K455 C456 Q479	F435-T437 HydrophobicContact CD1-CG2 4.06Å; F435-T437 HydrophobicContact CE1-CG2 3.5Å; F435-T437 HydrophobicContact CZ-CG2 3.8Å; T437-A442 HydrophobicContact CG2-CB 4.33Å; T437-T453 HydrophobicContact CG2-CG2 4.32Å; T437-I454 PolarHBondContact N-O 3.27Å; T437-K455 WeakPolarHBondContact O-CA 3.36Å; T437-C456 PolarHBondContact O-N 3.26Å; T437-Q479 PolarHBondContact OG1-OE1 3.27Å
438	R	85.6	Confident	75	Confident	65 Å²	65	50.8 Å²	50.8	25%	0.245	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	146.1	168.8	-71.8	178.5	66	-150.8	-3.1	110	I440 D441 C456 N459 V462	R438-I440 HydrophobicContact CB-CG1 4.29Å; R438-I440 PolarHBondContact O-N 3.45Å; R438-I440 VanDerWaalsContact O-N 3.15Å; R438-D441 WeakPolarHBondContact CB-OD2 3.29Å; R438-D441 PolarHBondContact O-N 3.23Å; R438-C456 CarbonylContact C-O 3.53Å; R438-C456 WeakPolarHBondContact CA-O 3.12Å; R438-N459 VanDerWaalsContact CD-OD1 3.25Å; R438-N459 WeakPolarHBondContact CD-OD1 3.28Å; R438-V462 HydrophobicContact CG-CG2 4.06Å
439	E	72.6	Confident	74.3	Confident	111 Å²	111	57.8 Å²	57.8	52%	0.519	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-54.1	-38.9	-176	-175	170	-153.4	0	0	113.6	D441 K455 C456	E439-D441 VanDerWaalsContact C-N 3.27Å; E439-D441 PolarHBondContact O-N 3.02Å; E439-K455 HydrophobicContact CB-CB 4.16Å; E439-K455 HydrophobicContact CG-CB 4.43Å; E439-K455 HydrophobicContact CG-CD 4.18Å; E439-C456 PolarHBondContact N-O 3.35Å
440	I	63.2	Low	74	Confident	127 Å²	127	57.4 Å²	57.4	65%	0.651	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-72.8	-14	179.2	57.6	166.9	0	0	0	114.5	R438	R438-I440 HydrophobicContact CB-CG1 4.29Å; R438-I440 PolarHBondContact O-N 3.45Å; R438-I440 VanDerWaalsContact O-N 3.15Å
441	D	62.4	Low	74.1	Confident	48 Å²	48	54.6 Å²	54.6	26%	0.257	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-112.3	13.5	-172.4	-58.5	-53.1	0	0	0	112.1	R438 E439 G443 S481	R438-D441 WeakPolarHBondContact CB-OD2 3.29Å; R438-D441 PolarHBondContact O-N 3.23Å; E439-D441 VanDerWaalsContact C-N 3.27Å; E439-D441 PolarHBondContact O-N 3.02Å; D441-G443 PolarHBondContact O-N 3.13Å; D441-S481 WeakPolarHBondContact OD2-CB 3.32Å; D441-S481 PolarHBondContact OD2-OG 3.4Å
442	A	60.6	Low	74.3	Confident	36 Å²	36	55.3 Å²	55.3	30%	0.298	29%	0.285	S	S	.	.			trans	-71.5	95.3	179.7	0	0	0	0	0	111.1	T437 A446 K455	T437-A442 HydrophobicContact CG2-CB 4.33Å; A442-A446 HydrophobicContact CB-CB 3.83Å; A442-K455 HydrophobicContact CB-CD 4.43Å
443	G	63.2	Low	74.4	Confident	32 Å²	32	51.4 Å²	51.4	33%	0.33	27%	0.271	S	S	.	.			trans	-77.2	-167.6	173	0	0	0	0	0	114	D441 L445 A446	D441-G443 PolarHBondContact O-N 3.13Å; G443-L445 PolarHBondContact O-N 3.45Å; G443-L445 VanDerWaalsContact O-N 3.09Å; G443-A446 WeakPolarHBondContact O-CB 3.37Å; G443-A446 PolarHBondContact O-N 3.29Å
444	E	60.4	Low	74.4	Confident	85 Å²	85	53 Å²	53	40%	0.397	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-59.3	-24.3	-177.6	-66.9	-166.5	163.9	0	0	113.8	T146 A446 S447	T146-E444 VanDerWaalsContact CG2-CD 3.46Å; T146-E444 WeakPolarHBondContact CG2-OE2 3.39Å; E444-A446 PolarHBondContact O-N 2.93Å; E444-S447 PolarHBondContact O-N 3.3Å; E444-S447 PolarHBondContact O-OG 3.46Å
445	L	63.1	Low	74.2	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.01	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-60.6	-29.5	175.3	-166.7	65.7	0	0	0	112.7	L138 V142 L144 L423 L433 F435 G443 S447 C451 I477	L138-L445 HydrophobicContact CD1-CD2 4.23Å; V142-L445 HydrophobicContact CB-CD1 4.46Å; V142-L445 HydrophobicContact CG1-CD1 3.99Å; V142-L445 HydrophobicContact CG2-CD1 4.18Å; L144-L445 HydrophobicContact CD1-CD1 3.75Å; L423-L445 HydrophobicContact CD1-CD1 3.79Å; L433-L445 HydrophobicContact CD2-CD1 3.72Å; L433-L445 HydrophobicContact CD2-CD2 4.12Å; L433-L445 HydrophobicContact CD2-CG 4.09Å; F435-L445 HydrophobicContact CB-CD2 4.49Å; F435-L445 HydrophobicContact CD1-CB 4.36Å; F435-L445 HydrophobicContact CD1-CD2 4.11Å; F435-L445 HydrophobicContact CD1-CG 4.26Å; F435-L445 HydrophobicContact CD2-CD2 3.82Å; F435-L445 HydrophobicContact CE1-CB 4.25Å; F435-L445 HydrophobicContact CE1-CD2 4.25Å; F435-L445 HydrophobicContact CE2-CD2 3.98Å; F435-L445 HydrophobicContact CG-CD2 3.89Å; F435-L445 HydrophobicContact CG-CG 4.37Å; F435-L445 HydrophobicContact CZ-CD2 4.2Å; G443-L445 PolarHBondContact O-N 3.45Å; G443-L445 VanDerWaalsContact O-N 3.09Å; L445-S447 VanDerWaalsContact C-N 3.26Å; L445-S447 PolarHBondContact O-N 2.82Å; L445-C451 WeakPolarHBondContact O-CB 3.39Å; L445-C451 PolarHBondContact O-SG 3.47Å; L445-I477 HydrophobicContact CD2-CD1 4Å
446	A	61.1	Low	74.1	Confident	25 Å²	25	58.4 Å²	58.4	21%	0.207	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-73.8	-15.7	-178.2	0	0	0	0	0	114	F435 A442 G443 E444 T453	F435-A446 HydrophobicContact CD1-CB 4.4Å; F435-A446 HydrophobicContact CE1-CB 4.38Å; A442-A446 HydrophobicContact CB-CB 3.83Å; G443-A446 WeakPolarHBondContact O-CB 3.37Å; G443-A446 PolarHBondContact O-N 3.29Å; E444-A446 PolarHBondContact O-N 2.93Å; A446-T453 WeakPolarHBondContact CA-OG1 3.42Å; A446-T453 HydrophobicContact CB-CG2 3.87Å
447	S	60.8	Low	73.9	Confident	99 Å²	99	64.3 Å²	64.3	69%	0.692	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-105	1.1	-177.2	49.2	0	0	0	0	113.5	E444 L445	E444-S447 PolarHBondContact O-N 3.3Å; E444-S447 PolarHBondContact O-OG 3.46Å; L445-S447 VanDerWaalsContact C-N 3.26Å; L445-S447 PolarHBondContact O-N 2.82Å
448	S	68.1	Low	73.7	Confident	32 Å²	32	66.6 Å²	66.6	22%	0.224	35%	0.349	C	S	.	.			trans	-74.9	134.9	175.1	-175.5	0	0	0	0	111.7	N450 C451	S448-N450 PolarHBondContact O-N 2.87Å; S448-N450 VanDerWaalsContact O-N 3.14Å; S448-C451 WeakPolarHBondContact O-CB 3.12Å; S448-C451 PolarHBondContact O-N 3.29Å
449	R	65	Low	73.9	Confident	235 Å²	235	64.4 Å²	64.4	89%	0.887	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.3	-177.9	-72.4	-174.4	176.2	-167.8	-1.5	113.7
450	N	71.6	Confident	74.6	Confident	53 Å²	53	64.7 Å²	64.7	28%	0.283	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	15.4	-174.9	-58.1	-35.8	0	0	0	113	L423 D427 L433 S448	L423-N450 HydrophobicContact CD2-CB 4.35Å; D427-N450 WeakPolarHBondContact OD1-CB 3.46Å; D427-N450 PolarHBondContact OD1-ND2 3.28Å; D427-N450 PolarHBondContact OD1-OD1 3.29Å; D427-N450 PolarHBondContact OD2-ND2 3.1Å; L433-N450 PolarHBondContact N-O 3.18Å; L433-N450 VanDerWaalsContact N-O 3.11Å; S448-N450 PolarHBondContact O-N 2.87Å; S448-N450 VanDerWaalsContact O-N 3.14Å
451	C	80.9	Confident	75.9	Confident	13 Å²	13	61.4 Å²	61.4	9%	0.088	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	116.1	174.6	-175	0	0	0	0	109.2	L423 L433 F435 L445 S448 T453	L423-C451 HydrophobicContact CD2-CB 4.17Å; L433-C451 HydrophobicContact CD2-CB 4.36Å; L433-C451 CarbonylContact O-C 3.5Å; L433-C451 WeakPolarHBondContact O-CA 3.38Å; F435-C451 WeakPolarHBondContact CB-SG 3.44Å; L445-C451 WeakPolarHBondContact O-CB 3.39Å; L445-C451 PolarHBondContact O-SG 3.47Å; S448-C451 WeakPolarHBondContact O-CB 3.12Å; S448-C451 PolarHBondContact O-N 3.29Å; C451-T453 PolarHBondContact O-N 3.31Å; C451-T453 PolarHBondContact SG-OG1 3.38Å; C451-T453 VanDerWaalsContact SG-OG1 3.41Å
452	Q	86.3	Confident	77.2	Confident	80 Å²	80	59.1 Å²	59.1	37%	0.374	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	105.4	167	179.4	164.3	-23.9	0	0	108.5	L433 L434 F435 F473	L433-Q452 PolarHBondContact O-N 2.72Å; L434-Q452 HydrophobicContact CD1-CG 4.49Å; F435-Q452 PolarHBondContact N-O 2.86Å; Q452-F473 HydrophobicContact CB-CE1 4.25Å; Q452-F473 HydrophobicContact CB-CZ 4.47Å; Q452-F473 VanDerWaalsContact CD-CZ 3.45Å; Q452-F473 HydrophobicContact CG-CZ 4.34Å
453	T	86.8	Confident	78.6	Confident	36 Å²	36	57.6 Å²	57.6	22%	0.221	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	126.5	-179.1	-58.4	0	0	0	0	111.4	F435 T437 A446 C451 K455	F435-T453 HydrophobicContact CD1-CG2 3.83Å; F435-T453 CarbonylContact O-C 3.27Å; F435-T453 VanDerWaalsContact O-CA 3.26Å; F435-T453 WeakPolarHBondContact O-CA 3.39Å; T437-T453 HydrophobicContact CG2-CG2 4.32Å; A446-T453 WeakPolarHBondContact CA-OG1 3.42Å; A446-T453 HydrophobicContact CB-CG2 3.87Å; C451-T453 PolarHBondContact O-N 3.31Å; C451-T453 PolarHBondContact SG-OG1 3.38Å; C451-T453 VanDerWaalsContact SG-OG1 3.41Å; T453-K455 HydrophobicContact CG2-CG 4.08Å
454	I	86.9	Confident	79.9	Confident	35 Å²	35	60.3 Å²	60.3	18%	0.179	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	118	169.2	-53.2	178.8	0	0	0	107.6	L434 F435 L436 T437 Q465 E469	L434-I454 HydrophobicContact CD1-CD1 4.01Å; L434-I454 HydrophobicContact CD1-CG1 4.26Å; F435-I454 PolarHBondContact O-N 2.99Å; L436-I454 HydrophobicContact CD2-CB 3.54Å; L436-I454 HydrophobicContact CD2-CD1 3.75Å; L436-I454 HydrophobicContact CD2-CG1 3.9Å; L436-I454 HydrophobicContact CD2-CG2 4.31Å; T437-I454 PolarHBondContact N-O 3.27Å; I454-Q465 HydrophobicContact CG2-CG 4.37Å; I454-E469 HydrophobicContact CD1-CB 4.45Å; I454-E469 HydrophobicContact CD1-CG 3.65Å
455	K	88.4	Confident	81.3	Confident	111 Å²	111	59.2 Å²	59.2	48%	0.483	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	129.6	179	-63.3	-175.6	-176.9	-176.5	0	109.2	T437 E439 A442 T453	T437-K455 WeakPolarHBondContact O-CA 3.36Å; E439-K455 HydrophobicContact CB-CB 4.16Å; E439-K455 HydrophobicContact CG-CB 4.43Å; E439-K455 HydrophobicContact CG-CD 4.18Å; A442-K455 HydrophobicContact CB-CD 4.43Å; T453-K455 HydrophobicContact CG2-CG 4.08Å
456	C	87.9	Confident	82.6	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.007	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	155.9	180	-57.9	0	0	0	0	111.2	T437 R438 E439 E461 V462	T437-C456 PolarHBondContact O-N 3.26Å; R438-C456 CarbonylContact C-O 3.53Å; R438-C456 WeakPolarHBondContact CA-O 3.12Å; E439-C456 PolarHBondContact N-O 3.35Å; C456-E461 HydrophobicContact CB-CB 3.97Å; C456-E461 HydrophobicContact CB-CG 3.84Å; C456-V462 HydrophobicContact CB-CB 4.5Å; C456-V462 HydrophobicContact CB-CG2 3.58Å
457	L	86.5	Confident	84	Confident	124 Å²	124	63.4 Å²	63.4	65%	0.649	31%	0.308	S	S	*	.	S	Bend	trans	-79.7	-28.4	179	-58.5	174.1	0	0	0	111.6	E461	L457-E461 WeakPolarHBondContact CB-OE2 3.18Å; L457-E461 PolarHBondContact N-OE2 2.8Å
458	S	86.9	Confident	85.3	Confident	48 Å²	48	63.1 Å²	63.1	34%	0.336	30%	0.302	S	S	.	.	S	Bend	trans	-142.5	158.1	-176.5	75.4	0	0	0	0	113.4	K460 E461 V462	S458-K460 PolarHBondContact O-N 3.35Å; S458-K460 VanDerWaalsContact O-N 3.14Å; S458-K460 PolarHBondContact OG-N 2.62Å; S458-E461 WeakPolarHBondContact O-CB 3.35Å; S458-E461 PolarHBondContact O-N 2.68Å; S458-E461 VanDerWaalsContact O-N 3.1Å; S458-E461 PolarHBondContact OG-N 3.25Å; S458-V462 WeakPolarHBondContact O-CG2 3.28Å; S458-V462 PolarHBondContact O-N 3.2Å
459	N	88.1	Confident	86.4	Confident	19 Å²	19	63.4 Å²	63.4	10%	0.102	30%	0.299	C	S	.	.	H	α-helix	trans	-57.6	-28.9	171.9	-72.7	-17.4	0	0	0	112.2	R438 E461 V462 L463 F480 S481 W722	R438-N459 VanDerWaalsContact CD-OD1 3.25Å; R438-N459 WeakPolarHBondContact CD-OD1 3.28Å; N459-E461 VanDerWaalsContact C-N 3.35Å; N459-V462 PolarHBondContact O-N 3.3Å; N459-L463 PolarHBondContact O-N 3.14Å; N459-F480 HydrophobicContact CB-CD1 3.98Å; N459-S481 PolarHBondContact ND2-O 2.76Å; N459-S481 PolarHBondContact OD1-N 3.02Å; N459-W722 HydrophobicContact CB-CH2 3.34Å; N459-W722 HydrophobicContact CB-CZ2 3.43Å; N459-W722 VanDerWaalsContact CB-CZ2 3.43Å; N459-W722 HydrophobicContact CB-CZ3 4.07Å; N459-W722 VanDerWaalsContact O-CH2 3.22Å; N459-W722 WeakPolarHBondContact O-CH2 3.47Å
460	K	88.6	Confident	87.6	Confident	118 Å²	118	52.3 Å²	52.3	51%	0.513	26%	0.258	S	S	.	.	H	α-helix	trans	-64.7	-44.5	178.6	-178	-173.5	168.3	-166.4	0	110.1	S458 L463 E464	S458-K460 PolarHBondContact O-N 3.35Å; S458-K460 VanDerWaalsContact O-N 3.14Å; S458-K460 PolarHBondContact OG-N 2.62Å; K460-L463 WeakPolarHBondContact O-CB 3.32Å; K460-L463 PolarHBondContact O-N 3.2Å; K460-E464 WeakPolarHBondContact CE-OE1 3.37Å; K460-E464 IonicContact NZ-OE1 3.24Å; K460-E464 WeakPolarHBondContact O-CG 3.46Å; K460-E464 PolarHBondContact O-N 3.36Å
461	E	89.7	Confident	88.3	Confident	58 Å²	58	53.2 Å²	53.2	27%	0.271	27%	0.267	S	S	.	.	H	α-helix	trans	-69.4	-40.3	177	-174.4	-179.2	-168.8	0	0	111.5	C456 L457 S458 N459 L463 E464 Q465	C456-E461 HydrophobicContact CB-CB 3.97Å; C456-E461 HydrophobicContact CB-CG 3.84Å; L457-E461 WeakPolarHBondContact CB-OE2 3.18Å; L457-E461 PolarHBondContact N-OE2 2.8Å; S458-E461 WeakPolarHBondContact O-CB 3.35Å; S458-E461 PolarHBondContact O-N 2.68Å; S458-E461 VanDerWaalsContact O-N 3.1Å; S458-E461 PolarHBondContact OG-N 3.25Å; N459-E461 VanDerWaalsContact C-N 3.35Å; E461-L463 PolarHBondContact O-N 3.13Å; E461-E464 PolarHBondContact O-N 3.5Å; E461-Q465 HydrophobicContact CG-CG 4.48Å; E461-Q465 WeakPolarHBondContact O-CG 3.43Å; E461-Q465 PolarHBondContact O-N 2.83Å
462	V	90.3	Very high	88.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-52.5	-44.5	170.6	174.4	0	0	0	0	110.7	L436 R438 C456 S458 N459 A466 V478 F480	L436-V462 HydrophobicContact CB-CG1 4.18Å; R438-V462 HydrophobicContact CG-CG2 4.06Å; C456-V462 HydrophobicContact CB-CB 4.5Å; C456-V462 HydrophobicContact CB-CG2 3.58Å; S458-V462 WeakPolarHBondContact O-CG2 3.28Å; S458-V462 PolarHBondContact O-N 3.2Å; N459-V462 PolarHBondContact O-N 3.3Å; V462-A466 WeakPolarHBondContact O-CB 3.08Å; V462-A466 PolarHBondContact O-N 3.11Å; V462-V478 HydrophobicContact CG1-CG1 3.6Å; V462-F480 HydrophobicContact CB-CD1 4.31Å; V462-F480 HydrophobicContact CB-CE1 4.03Å; V462-F480 HydrophobicContact CG1-CD1 4.01Å; V462-F480 HydrophobicContact CG1-CE1 3.66Å; V462-F480 HydrophobicContact CG1-CZ 4.22Å
463	L	90.3	Very high	88.6	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-67.4	-38	178.3	-174.7	76.7	0	0	0	112.8	N459 K460 E461 R467 F480 W722 K725 L729	N459-L463 PolarHBondContact O-N 3.14Å; K460-L463 WeakPolarHBondContact O-CB 3.32Å; K460-L463 PolarHBondContact O-N 3.2Å; E461-L463 PolarHBondContact O-N 3.13Å; L463-R467 WeakPolarHBondContact O-CG 3.42Å; L463-R467 PolarHBondContact O-N 3.09Å; L463-F480 HydrophobicContact CB-CE1 4.09Å; L463-F480 HydrophobicContact CB-CZ 4.39Å; L463-F480 HydrophobicContact CD1-CE1 4.42Å; L463-F480 HydrophobicContact CD1-CZ 3.97Å; L463-W722 HydrophobicContact CB-CZ3 4.32Å; L463-W722 HydrophobicContact CD2-CZ3 4.37Å; L463-K725 HydrophobicContact CD1-CB 4.49Å; L463-K725 HydrophobicContact CD2-CB 3.68Å; L463-K725 HydrophobicContact CD2-CD 3.81Å; L463-K725 HydrophobicContact CD2-CG 3.8Å; L463-L729 HydrophobicContact CD1-CB 4.15Å; L463-L729 HydrophobicContact CD1-CD2 3.89Å
464	E	89.7	Confident	88.5	Confident	88 Å²	88	55.9 Å²	55.9	41%	0.411	28%	0.281	S	S	.	.	H	α-helix	trans	-67.7	-45.7	178.9	-75.7	165.6	-179.7	0	0	110.7	K460 E461 R467	K460-E464 WeakPolarHBondContact CE-OE1 3.37Å; K460-E464 IonicContact NZ-OE1 3.24Å; K460-E464 WeakPolarHBondContact O-CG 3.46Å; K460-E464 PolarHBondContact O-N 3.36Å; E461-E464 PolarHBondContact O-N 3.5Å; E464-R467 PolarHBondContact O-N 3.3Å
465	Q	90.1	Very high	88.6	Confident	63 Å²	63	54.2 Å²	54.2	29%	0.294	27%	0.273	S	S	.	.	H	α-helix	trans	-63.6	-41.5	173.9	-65.5	-58.3	-24.6	0	0	111.8	L436 I454 E461 R467 V468 E469	L436-Q465 HydrophobicContact CD2-CB 4.43Å; I454-Q465 HydrophobicContact CG2-CG 4.37Å; E461-Q465 HydrophobicContact CG-CG 4.48Å; E461-Q465 WeakPolarHBondContact O-CG 3.43Å; E461-Q465 PolarHBondContact O-N 2.83Å; Q465-R467 PolarHBondContact O-N 3.18Å; Q465-R467 VanDerWaalsContact O-N 3.15Å; Q465-V468 PolarHBondContact O-N 3.01Å; Q465-E469 WeakPolarHBondContact O-CB 3.44Å; Q465-E469 WeakPolarHBondContact O-CG 3.44Å; Q465-E469 PolarHBondContact O-N 3.38Å
466	A	90.8	Very high	88.8	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-57.4	-31.5	176.9	0	0	0	0	0	113.7	L436 V462 I470 V478 L729	L436-A466 HydrophobicContact CD1-CB 3.53Å; V462-A466 WeakPolarHBondContact O-CB 3.08Å; V462-A466 PolarHBondContact O-N 3.11Å; A466-I470 HydrophobicContact CB-CD1 3.88Å; A466-I470 HydrophobicContact CB-CG1 4.37Å; A466-I470 VanDerWaalsContact O-CB 3.29Å; A466-I470 WeakPolarHBondContact O-CB 3.43Å; A466-I470 VanDerWaalsContact O-CD1 3.28Å; A466-I470 WeakPolarHBondContact O-CD1 3.27Å; A466-I470 WeakPolarHBondContact O-CG1 3.44Å; A466-I470 PolarHBondContact O-N 2.82Å; A466-V478 HydrophobicContact CB-CG1 4.22Å; A466-V478 HydrophobicContact CB-CG2 4.4Å; A466-L729 HydrophobicContact CB-CD1 4.46Å; A466-L729 HydrophobicContact CB-CD2 3.74Å
467	R	89.6	Confident	89.1	Confident	115 Å²	115	48.9 Å²	48.9	43%	0.434	25%	0.25	S	C	.	.	H	α-helix	trans	-70.8	-32.9	177.4	-71.7	171.4	-177.8	-179.9	1.1	113	L463 E464 Q465 L729	L463-R467 WeakPolarHBondContact O-CG 3.42Å; L463-R467 PolarHBondContact O-N 3.09Å; E464-R467 PolarHBondContact O-N 3.3Å; Q465-R467 PolarHBondContact O-N 3.18Å; Q465-R467 VanDerWaalsContact O-N 3.15Å; R467-L729 HydrophobicContact CB-CD1 4.42Å; R467-L729 HydrophobicContact CG-CD1 3.66Å
468	V	89.3	Confident	89.4	Confident	92 Å²	92	43 Å²	43	56%	0.558	22%	0.219	S	C	*	.	H	α-helix	trans	-86.8	-42.3	-176.3	-179.5	0	0	0	0	110.3	Q465	Q465-V468 PolarHBondContact O-N 3.01Å
469	E	90.5	Very high	89.7	Confident	38 Å²	38	41.2 Å²	41.2	18%	0.178	21%	0.205	C	C	.	.	H	α-helix	trans	-89.6	-39.1	-167	-62.5	-70.9	163.5	0	0	113.1	L434 I454 Q465 P471 L472 F473	L434-E469 HydrophobicContact CD1-CB 4.41Å; L434-E469 HydrophobicContact CD2-CB 3.59Å; I454-E469 HydrophobicContact CD1-CB 4.45Å; I454-E469 HydrophobicContact CD1-CG 3.65Å; Q465-E469 WeakPolarHBondContact O-CB 3.44Å; Q465-E469 WeakPolarHBondContact O-CG 3.44Å; Q465-E469 PolarHBondContact O-N 3.38Å; E469-P471 VanDerWaalsContact C-CD 3.42Å; E469-P471 VanDerWaalsContact C-N 3.33Å; E469-L472 WeakPolarHBondContact O-CA 3.3Å; E469-L472 WeakPolarHBondContact O-CB 3.36Å; E469-L472 PolarHBondContact O-N 3.33Å; E469-F473 WeakPolarHBondContact O-CD2 3.36Å
470	I	89.9	Confident	89.8	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.01	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-52.6	-42.9	-177	-68	171.9	0	0	0	113.3	V98 F100 A466 L472 F473 V478 L729 L733	V98-I470 HydrophobicContact CG1-CD1 4.1Å; V98-I470 HydrophobicContact CG2-CG2 3.68Å; F100-I470 HydrophobicContact CE1-CD1 4.38Å; F100-I470 HydrophobicContact CZ-CD1 4.26Å; A466-I470 HydrophobicContact CB-CD1 3.88Å; A466-I470 HydrophobicContact CB-CG1 4.37Å; A466-I470 VanDerWaalsContact O-CB 3.29Å; A466-I470 WeakPolarHBondContact O-CB 3.43Å; A466-I470 VanDerWaalsContact O-CD1 3.28Å; A466-I470 WeakPolarHBondContact O-CD1 3.27Å; A466-I470 WeakPolarHBondContact O-CG1 3.44Å; A466-I470 PolarHBondContact O-N 2.82Å; I470-L472 PolarHBondContact O-N 2.81Å; I470-L472 VanDerWaalsContact O-N 3.1Å; I470-F473 PolarHBondContact O-N 3.01Å; I470-F473 VanDerWaalsContact O-N 3.16Å; I470-F473 VanDerWaalsContact O-O 3.08Å; I470-V478 HydrophobicContact CD1-CG2 3.95Å; I470-V478 HydrophobicContact CG1-CG2 4.35Å; I470-L729 HydrophobicContact CD1-CD1 4.35Å; I470-L729 HydrophobicContact CD1-CD2 4.15Å; I470-L729 HydrophobicContact CD1-CG 4.5Å; I470-L733 HydrophobicContact CB-CD2 4.39Å; I470-L733 HydrophobicContact CD1-CD2 4.26Å; I470-L733 HydrophobicContact CG2-CD2 3.57Å
471	P	86.3	Confident	89.7	Confident	73 Å²	73	35.2 Å²	35.2	47%	0.474	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-61	-18.7	178	-24.1	35.5	0	0	0	114.7	E469	E469-P471 VanDerWaalsContact C-CD 3.42Å; E469-P471 VanDerWaalsContact C-N 3.33Å
472	L	86.2	Confident	89.4	Confident	121 Å²	121	34.3 Å²	34.3	63%	0.634	18%	0.175	S	C	*	.	G	3₁₀ helix	trans	-90.3	-11.9	-178.2	-52.8	177.8	0	0	0	112.6	E469 I470	E469-L472 WeakPolarHBondContact O-CA 3.3Å; E469-L472 WeakPolarHBondContact O-CB 3.36Å; E469-L472 PolarHBondContact O-N 3.33Å; I470-L472 PolarHBondContact O-N 2.81Å; I470-L472 VanDerWaalsContact O-N 3.1Å
473	F	87.8	Confident	88.7	Confident	25 Å²	25	44 Å²	44	11%	0.11	22%	0.217	C	C	.	.			trans	-124	129.9	-175.2	-69.8	-95.3	0	0	0	112.2	L434 Q452 E469 I470 F475	L434-F473 HydrophobicContact CB-CB 3.81Å; L434-F473 HydrophobicContact CB-CD1 3.84Å; L434-F473 HydrophobicContact CB-CD2 3.89Å; L434-F473 HydrophobicContact CB-CE1 4.41Å; L434-F473 HydrophobicContact CB-CE2 4.46Å; L434-F473 HydrophobicContact CB-CG 3.57Å; L434-F473 HydrophobicContact CD1-CD2 4.16Å; L434-F473 HydrophobicContact CD1-CE2 4.02Å; L434-F473 HydrophobicContact CD1-CZ 4.35Å; L434-F473 HydrophobicContact CD2-CB 4.42Å; L434-F473 HydrophobicContact CD2-CD2 3.8Å; L434-F473 HydrophobicContact CD2-CE2 4.39Å; L434-F473 HydrophobicContact CD2-CG 4.25Å; L434-F473 HydrophobicContact CG-CD2 4.15Å; L434-F473 HydrophobicContact CG-CG 4.34Å; Q452-F473 HydrophobicContact CB-CE1 4.25Å; Q452-F473 HydrophobicContact CB-CZ 4.47Å; Q452-F473 VanDerWaalsContact CD-CZ 3.45Å; Q452-F473 HydrophobicContact CG-CZ 4.34Å; E469-F473 WeakPolarHBondContact O-CD2 3.36Å; I470-F473 PolarHBondContact O-N 3.01Å; I470-F473 VanDerWaalsContact O-N 3.16Å; I470-F473 VanDerWaalsContact O-O 3.08Å; F473-F475 PolarHBondContact O-N 3.19Å
474	P	84.4	Confident	87.7	Confident	38 Å²	38	46.6 Å²	46.6	25%	0.247	24%	0.239	C	C	.	.	S	Bend	trans	-68.3	-24.5	178.9	28.2	-34.4	0	0	0	112.7	N96 V97 Q431	N96-P474 CarbonylContact C-O 3.52Å; N96-P474 VanDerWaalsContact CA-O 3.26Å; N96-P474 WeakPolarHBondContact CA-O 3.27Å; N96-P474 WeakPolarHBondContact OD1-CA 3.5Å; V97-P474 PolarHBondContact N-O 3.35Å; Q431-P474 HydrophobicContact CB-CG 4.02Å; Q431-P474 HydrophobicContact CG-CG 3.86Å
475	F	90.4	Very high	86.9	Confident	1 Å²	1	44.9 Å²	44.9	0%	0.004	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	122.4	177.5	-164.3	-70.7	0	0	0	110.6	L70 V74 V97 V99 V422 L426 L433 L434 F473 I477	L70-F475 HydrophobicContact CB-CE2 4.42Å; L70-F475 HydrophobicContact CB-CZ 4.35Å; L70-F475 HydrophobicContact CD1-CZ 4.39Å; L70-F475 HydrophobicContact CD2-CE2 4.15Å; L70-F475 HydrophobicContact CD2-CZ 3.98Å; L70-F475 HydrophobicContact CG-CZ 4.47Å; V74-F475 HydrophobicContact CG2-CD2 3.23Å; V74-F475 HydrophobicContact CG2-CE2 3.42Å; V74-F475 VanDerWaalsContact CG2-CE2 3.42Å; V74-F475 HydrophobicContact CG2-CG 4.27Å; V97-F475 HydrophobicContact CB-CD2 3.55Å; V97-F475 HydrophobicContact CB-CE2 3.88Å; V97-F475 HydrophobicContact CB-CG 4.24Å; V97-F475 HydrophobicContact CG1-CD2 3.81Å; V97-F475 HydrophobicContact CG1-CE2 3.58Å; V97-F475 HydrophobicContact CG1-CZ 4.22Å; V97-F475 HydrophobicContact CG2-CD2 4.11Å; V97-F475 HydrophobicContact CG2-CE2 4.45Å; V97-F475 CarbonylContact O-C 3.58Å; V97-F475 WeakPolarHBondContact O-CA 3.48Å; V99-F475 HydrophobicContact CG2-CZ 4.47Å; V422-F475 HydrophobicContact CG1-CE1 4.47Å; V422-F475 HydrophobicContact CG1-CE2 4.13Å; V422-F475 HydrophobicContact CG1-CZ 3.87Å; L426-F475 HydrophobicContact CD1-CB 4.26Å; L426-F475 HydrophobicContact CD1-CD1 4.32Å; L426-F475 HydrophobicContact CD1-CG 4.19Å; L426-F475 HydrophobicContact CD2-CB 3.82Å; L426-F475 HydrophobicContact CD2-CD2 4.5Å; L426-F475 HydrophobicContact CD2-CG 4.29Å; L433-F475 HydrophobicContact CD1-CD1 3.28Å; L433-F475 HydrophobicContact CD1-CE1 3.61Å; L433-F475 HydrophobicContact CD1-CG 4.45Å; L434-F475 PolarHBondContact N-O 2.87Å; F473-F475 PolarHBondContact O-N 3.19Å; F475-I477 HydrophobicContact CE1-CD1 4.04Å; F475-I477 HydrophobicContact CE1-CG1 3.82Å
476	S	92.5	Very high	86.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	132.3	-177	-61.5	0	0	0	0	112.2	V97 V98 V99 L434	V97-S476 PolarHBondContact O-N 2.87Å; V98-S476 CarbonylContact C-O 3.51Å; V98-S476 WeakPolarHBondContact CA-O 3.34Å; V99-S476 PolarHBondContact N-O 3.07Å; L434-S476 CarbonylContact O-C 3.53Å; L434-S476 WeakPolarHBondContact O-CA 3.28Å
477	I	93.1	Very high	85.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	125.8	166.5	-63	174	0	0	0	108.2	V99 V101 L138 V142 L433 L434 F435 L436 L445 F475	V99-I477 HydrophobicContact CB-CG1 4.12Å; V99-I477 HydrophobicContact CG2-CG1 4.42Å; V99-I477 CarbonylContact O-C 3.53Å; V99-I477 WeakPolarHBondContact O-CA 3.47Å; V101-I477 HydrophobicContact CG2-CG2 4.33Å; L138-I477 HydrophobicContact CD2-CG2 4.24Å; V142-I477 HydrophobicContact CG2-CD1 3.82Å; L433-I477 HydrophobicContact CD1-CB 4.33Å; L433-I477 HydrophobicContact CD1-CD1 3.92Å; L433-I477 HydrophobicContact CD1-CG1 3.82Å; L433-I477 HydrophobicContact CD2-CD1 4.21Å; L434-I477 PolarHBondContact O-N 2.89Å; F435-I477 WeakPolarHBondContact CA-O 3.46Å; F435-I477 HydrophobicContact CD2-CB 3.92Å; F435-I477 HydrophobicContact CD2-CG2 3.76Å; F435-I477 HydrophobicContact CE2-CG2 3.86Å; L436-I477 PolarHBondContact N-O 3.3Å; L445-I477 HydrophobicContact CD2-CD1 4Å; F475-I477 HydrophobicContact CE1-CD1 4.04Å; F475-I477 HydrophobicContact CE1-CG1 3.82Å
478	V	93.4	Very high	84.7	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	110.5	180	-175	0	0	0	0	109.4	V99 F100 V101 L436 V462 A466 I470 F480	V99-V478 PolarHBondContact O-N 3.23Å; F100-V478 CarbonylContact C-O 3.49Å; F100-V478 WeakPolarHBondContact CA-O 2.99Å; F100-V478 HydrophobicContact CD1-CB 3.72Å; F100-V478 HydrophobicContact CD1-CG1 4.11Å; F100-V478 HydrophobicContact CD1-CG2 4.32Å; F100-V478 HydrophobicContact CE1-CB 3.9Å; F100-V478 HydrophobicContact CE1-CG1 4.19Å; F100-V478 HydrophobicContact CE1-CG2 4.04Å; V101-V478 PolarHBondContact N-O 2.86Å; L436-V478 HydrophobicContact CB-CB 4.47Å; L436-V478 HydrophobicContact CB-CG1 4.17Å; L436-V478 HydrophobicContact CB-CG2 4.29Å; L436-V478 HydrophobicContact CD1-CG1 4.43Å; L436-V478 HydrophobicContact CD1-CG2 3.9Å; L436-V478 HydrophobicContact CG-CG2 4.35Å; V462-V478 HydrophobicContact CG1-CG1 3.6Å; A466-V478 HydrophobicContact CB-CG1 4.22Å; A466-V478 HydrophobicContact CB-CG2 4.4Å; I470-V478 HydrophobicContact CD1-CG2 3.95Å; I470-V478 HydrophobicContact CG1-CG2 4.35Å; V478-F480 HydrophobicContact CG1-CD2 4.43Å; V478-F480 HydrophobicContact CG1-CE1 4.44Å; V478-F480 HydrophobicContact CG1-CE2 3.77Å; V478-F480 HydrophobicContact CG1-CZ 3.77Å
479	Q	92.4	Very high	84.1	Confident	11 Å²	11	42.3 Å²	42.3	5%	0.051	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	122.2	-179.7	-176.8	-179.6	-19.7	0	0	111.1	V101 Q103 F435 L436 T437	V101-Q479 HydrophobicContact CB-CB 4.44Å; V101-Q479 HydrophobicContact CB-CG 4.41Å; V101-Q479 HydrophobicContact CG1-CG 4.47Å; V101-Q479 WeakPolarHBondContact O-CA 3.34Å; Q103-Q479 HydrophobicContact CB-CG 4.38Å; F435-Q479 HydrophobicContact CE2-CB 4.08Å; L436-Q479 PolarHBondContact O-N 3.15Å; T437-Q479 PolarHBondContact OG1-OE1 3.27Å
480	F	90	Very high	83.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.5	167.8	-62.2	-74.8	0	0	0	109.3	F100 V101 L102 Q103 N459 V462 L463 V478 F482 W722 I726	F100-F480 AromaticContact CD1-CE2 3.84Å; F100-F480 HydrophobicContact CD1-CE2 3.84Å; F100-F480 HydrophobicContact CE1-CE2 4.38Å; V101-F480 PolarHBondContact O-N 3.07Å; L102-F480 CarbonylContact C-O 3.58Å; L102-F480 HydrophobicContact CD2-CB 4.06Å; L102-F480 HydrophobicContact CD2-CD2 3.69Å; L102-F480 HydrophobicContact CD2-CG 4.3Å; Q103-F480 PolarHBondContact N-O 3.16Å; N459-F480 HydrophobicContact CB-CD1 3.98Å; V462-F480 HydrophobicContact CB-CD1 4.31Å; V462-F480 HydrophobicContact CB-CE1 4.03Å; V462-F480 HydrophobicContact CG1-CD1 4.01Å; V462-F480 HydrophobicContact CG1-CE1 3.66Å; V462-F480 HydrophobicContact CG1-CZ 4.22Å; L463-F480 HydrophobicContact CB-CE1 4.09Å; L463-F480 HydrophobicContact CB-CZ 4.39Å; L463-F480 HydrophobicContact CD1-CE1 4.42Å; L463-F480 HydrophobicContact CD1-CZ 3.97Å; V478-F480 HydrophobicContact CG1-CD2 4.43Å; V478-F480 HydrophobicContact CG1-CE1 4.44Å; V478-F480 HydrophobicContact CG1-CE2 3.77Å; V478-F480 HydrophobicContact CG1-CZ 3.77Å; F480-F482 HydrophobicContact CB-CD2 4.47Å; F480-F482 HydrophobicContact CB-CE2 3.59Å; F480-F482 HydrophobicContact CB-CZ 3.86Å; F480-W722 HydrophobicContact CD1-CE3 4.4Å; F480-W722 AromaticContact CD1-CZ3 3.9Å; F480-W722 HydrophobicContact CD1-CZ3 3.9Å; F480-W722 HydrophobicContact CE1-CE3 4.48Å; F480-W722 AromaticContact CE1-CZ3 3.76Å; F480-W722 HydrophobicContact CE1-CZ3 3.76Å; F480-I726 HydrophobicContact CD2-CD1 4.26Å; F480-I726 HydrophobicContact CD2-CG1 4.48Å; F480-I726 HydrophobicContact CE2-CD1 4.28Å; F480-I726 HydrophobicContact CE2-CG1 4.01Å; F480-I726 HydrophobicContact CZ-CG1 4.47Å
481	S	86.8	Confident	83.1	Confident	11 Å²	11	46.1 Å²	46.1	8%	0.077	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	120.7	-179.4	-57	0	0	0	0	111.2	D441 N459	D441-S481 WeakPolarHBondContact OD2-CB 3.32Å; D441-S481 PolarHBondContact OD2-OG 3.4Å; N459-S481 PolarHBondContact ND2-O 2.76Å; N459-S481 PolarHBondContact OD1-N 3.02Å
482	F	83.3	Confident	82.8	Confident	39 Å²	39	43.9 Å²	43.9	17%	0.171	23%	0.233	C	C	.	.			trans	-108.4	145	177.5	-58.6	-83.5	0	0	0	110	L102 Q103 M105 F480 A484 W722	L102-F482 HydrophobicContact CB-CD2 4.4Å; L102-F482 HydrophobicContact CB-CE2 4Å; L102-F482 HydrophobicContact CD2-CE2 3.95Å; L102-F482 HydrophobicContact CG-CE2 4.46Å; Q103-F482 PolarHBondContact O-N 2.94Å; M105-F482 HydrophobicContact CE-CB 4.4Å; M105-F482 HydrophobicContact CE-CD1 3.75Å; M105-F482 HydrophobicContact CE-CD2 3.63Å; M105-F482 HydrophobicContact CE-CE1 3.84Å; M105-F482 HydrophobicContact CE-CE2 3.72Å; M105-F482 HydrophobicContact CE-CG 3.64Å; M105-F482 HydrophobicContact CE-CZ 3.83Å; M105-F482 HydrophobicContact CG-CD2 4Å; M105-F482 HydrophobicContact CG-CG 4.42Å; M105-F482 HydrophobicContact SD-CD2 4.09Å; M105-F482 HydrophobicContact SD-CE2 4.11Å; F480-F482 HydrophobicContact CB-CD2 4.47Å; F480-F482 HydrophobicContact CB-CE2 3.59Å; F480-F482 HydrophobicContact CB-CZ 3.86Å; F482-A484 PolarHBondContact O-N 2.93Å; F482-A484 VanDerWaalsContact O-N 3.12Å; F482-W722 HydrophobicContact CE1-CB 4.2Å; F482-W722 AromaticContact CE1-CD1 3.62Å; F482-W722 AromaticContact CE1-CD2 4Å; F482-W722 HydrophobicContact CE1-CD2 4Å; F482-W722 AromaticContact CE1-CG 3.66Å; F482-W722 HydrophobicContact CE1-CG 3.66Å; F482-W722 AromaticContact CE1-NE1 3.91Å; F482-W722 HydrophobicContact CZ-CB 4.22Å; F482-W722 HydrophobicContact CZ-CD2 4.17Å; F482-W722 AromaticContact CZ-CG 3.99Å; F482-W722 HydrophobicContact CZ-CG 3.99Å
483	K	75.5	Confident	82.5	Confident	203 Å²	203	38.1 Å²	38.1	88%	0.883	20%	0.203	S	C	*	.	P	Polyproline II helix	trans	-63.7	116.6	174.6	-173.9	174.9	-178.9	177.4	0	108.4
484	A	69.9	Low	82.3	Confident	58 Å²	58	37.7 Å²	37.7	48%	0.479	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-59.5	141.8	173.4	0	0	0	0	0	109.9	F482	F482-A484 PolarHBondContact O-N 2.93Å; F482-A484 VanDerWaalsContact O-N 3.12Å
485	F	72.1	Confident	82.2	Confident	52 Å²	52	38.1 Å²	38.1	23%	0.228	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-67.1	152.4	172.2	-66.7	-45.6	0	0	0	110.8	H109 L489 M493 P715	H109-F485 AromaticContact CD2-CD2 3.72Å; H109-F485 AromaticContact CD2-CE2 3.29Å; H109-F485 WeakPolarHBondContact CD2-CE2 3.26Å; H109-F485 AromaticContact NE2-CD2 3.07Å; H109-F485 WeakPolarHBondContact NE2-CD2 3.34Å; H109-F485 AromaticContact NE2-CE2 3.18Å; H109-F485 WeakPolarHBondContact NE2-CE2 3.39Å; F485-L489 HydrophobicContact CB-CB 4.28Å; F485-L489 HydrophobicContact CB-CD2 3.9Å; F485-L489 HydrophobicContact CD1-CD2 3.49Å; F485-L489 VanDerWaalsContact CD1-CD2 3.49Å; F485-L489 HydrophobicContact CE1-CD2 4.16Å; F485-L489 HydrophobicContact CG-CD2 3.75Å; F485-M493 HydrophobicContact CD2-CE 3.9Å; F485-M493 HydrophobicContact CD2-SD 3.37Å; F485-M493 WeakPolarHBondContact CD2-SD 3.46Å; F485-M493 HydrophobicContact CE2-CE 3.54Å; F485-M493 HydrophobicContact CE2-SD 3.48Å; F485-M493 WeakPolarHBondContact CE2-SD 2.96Å; F485-M493 HydrophobicContact CG-SD 4.18Å; F485-M493 HydrophobicContact CZ-SD 4.36Å; F485-P715 HydrophobicContact CE1-CB 4.17Å; F485-P715 HydrophobicContact CE1-CG 4.29Å; F485-P715 HydrophobicContact CZ-CB 3.9Å; F485-P715 HydrophobicContact CZ-CG 4.45Å
486	S	74.6	Confident	81.9	Confident	62 Å²	62	39.4 Å²	39.4	43%	0.434	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-60	152.1	173.4	69.9	0	0	0	0	109.9	I488 L489 T490	S486-I488 PolarHBondContact O-N 3.49Å; S486-L489 PolarHBondContact O-N 2.83Å; S486-L489 VanDerWaalsContact O-N 3.1Å; S486-L489 WeakPolarHBondContact OG-CB 3.45Å; S486-L489 PolarHBondContact OG-N 2.81Å; S486-T490 WeakPolarHBondContact O-CB 3.35Å; S486-T490 PolarHBondContact O-N 2.76Å; S486-T490 PolarHBondContact O-OG1 2.91Å
487	P	76.1	Confident	81.5	Confident	56 Å²	56	39.8 Å²	39.8	36%	0.364	21%	0.207	S	C	.	.	H	α-helix	trans	-54.7	-39.1	179.5	-27.3	34.8	0	0	0	112.9	T490 E491 H750	P487-T490 WeakPolarHBondContact O-CB 3.16Å; P487-T490 PolarHBondContact O-N 2.89Å; P487-E491 PolarHBondContact O-N 3Å; P487-H750 HydrophobicContact CB-CB 4.18Å; P487-H750 VanDerWaalsContact CB-CD2 3.48Å; P487-H750 WeakPolarHBondContact CB-CD2 3.39Å
488	I	74.5	Confident	81.1	Confident	84 Å²	84	41.7 Å²	41.7	43%	0.431	21%	0.214	S	C	.	.	H	α-helix	trans	-62.6	-48.2	176.9	-64.6	146.8	0	0	0	111.2	S486 T490 E491 E492 F702 A706	S486-I488 PolarHBondContact O-N 3.49Å; I488-T490 VanDerWaalsContact C-N 3.27Å; I488-T490 PolarHBondContact O-N 2.86Å; I488-E491 PolarHBondContact O-N 2.88Å; I488-E492 WeakPolarHBondContact O-CB 3.45Å; I488-E492 PolarHBondContact O-N 3.05Å; I488-F702 HydrophobicContact CD1-CE1 3.5Å; I488-F702 VanDerWaalsContact CD1-CE1 3.5Å; I488-F702 HydrophobicContact CD1-CZ 3.51Å; I488-F702 HydrophobicContact CG1-CE1 4.1Å; I488-F702 HydrophobicContact CG2-CE1 3.97Å; I488-A706 HydrophobicContact CG2-CB 4.41Å
489	L	76.1	Confident	80.7	Confident	15 Å²	15	44.5 Å²	44.5	8%	0.079	23%	0.229	C	C	.	.	H	α-helix	trans	-64.6	-36.9	179	-159.8	81.8	0	0	0	111.2	F485 S486 E492 M493 A706 L710	F485-L489 HydrophobicContact CB-CB 4.28Å; F485-L489 HydrophobicContact CB-CD2 3.9Å; F485-L489 HydrophobicContact CD1-CD2 3.49Å; F485-L489 VanDerWaalsContact CD1-CD2 3.49Å; F485-L489 HydrophobicContact CE1-CD2 4.16Å; F485-L489 HydrophobicContact CG-CD2 3.75Å; S486-L489 PolarHBondContact O-N 2.83Å; S486-L489 VanDerWaalsContact O-N 3.1Å; S486-L489 WeakPolarHBondContact OG-CB 3.45Å; S486-L489 PolarHBondContact OG-N 2.81Å; L489-E492 PolarHBondContact O-N 2.81Å; L489-M493 WeakPolarHBondContact O-CB 3.48Å; L489-M493 VanDerWaalsContact O-CG 3.23Å; L489-M493 WeakPolarHBondContact O-CG 3.45Å; L489-M493 PolarHBondContact O-N 3.01Å; L489-A706 HydrophobicContact CD1-CB 4.37Å; L489-L710 HydrophobicContact CD1-CD1 3.48Å; L489-L710 VanDerWaalsContact CD1-CD1 3.48Å; L489-L710 HydrophobicContact CD1-CG 3.62Å; L489-L710 HydrophobicContact CG-CD1 3.94Å; L489-L710 HydrophobicContact CG-CG 4.05Å
490	T	79.2	Confident	80.5	Confident	23 Å²	23	45 Å²	45	14%	0.141	23%	0.231	C	C	.	.	H	α-helix	trans	-64.7	-44.1	177.9	-57.6	0	0	0	0	111.3	L108 S486 P487 I488 M493 N494 L753	L108-T490 HydrophobicContact CD2-CG2 4.31Å; S486-T490 WeakPolarHBondContact O-CB 3.35Å; S486-T490 PolarHBondContact O-N 2.76Å; S486-T490 PolarHBondContact O-OG1 2.91Å; P487-T490 WeakPolarHBondContact O-CB 3.16Å; P487-T490 PolarHBondContact O-N 2.89Å; I488-T490 VanDerWaalsContact C-N 3.27Å; I488-T490 PolarHBondContact O-N 2.86Å; T490-M493 PolarHBondContact O-N 2.86Å; T490-N494 WeakPolarHBondContact O-CB 3.43Å; T490-N494 PolarHBondContact O-N 3.41Å; T490-L753 HydrophobicContact CG2-CD1 3.44Å; T490-L753 VanDerWaalsContact CG2-CD1 3.44Å; T490-L753 HydrophobicContact CG2-CG 4.38Å
491	E	80.5	Confident	80.4	Confident	96 Å²	96	46.2 Å²	46.2	45%	0.449	24%	0.235	S	C	.	.	H	α-helix	trans	-68	-41.7	176.6	-174.9	52.4	-145.1	0	0	111.7	P487 I488 M493 N494 K495 R498	P487-E491 PolarHBondContact O-N 3Å; I488-E491 PolarHBondContact O-N 2.88Å; E491-M493 VanDerWaalsContact C-N 3.33Å; E491-M493 PolarHBondContact O-N 2.83Å; E491-N494 WeakPolarHBondContact O-CB 3.45Å; E491-N494 PolarHBondContact O-N 2.87Å; E491-K495 WeakPolarHBondContact O-CB 3.43Å; E491-K495 PolarHBondContact O-N 2.82Å; E491-R498 IonicContact OE1-CZ 2.67Å; E491-R498 IonicContact OE1-NH1 2.99Å; E491-R498 IonicContact OE1-NH2 3.74Å; E491-R498 PolarHBondContact OE1-NH2 3.37Å
492	E	80.1	Confident	80.5	Confident	26 Å²	26	48.4 Å²	48.4	12%	0.121	25%	0.248	C	C	.	.	H	α-helix	trans	-63.1	-39.8	175	177.8	55.9	-158.5	0	0	111.7	I488 L489 K495 R496 L710	I488-E492 WeakPolarHBondContact O-CB 3.45Å; I488-E492 PolarHBondContact O-N 3.05Å; L489-E492 PolarHBondContact O-N 2.81Å; E492-K495 PolarHBondContact O-N 2.82Å; E492-K495 IonicContact OE2-NZ 3.89Å; E492-R496 WeakPolarHBondContact O-CB 3.47Å; E492-R496 WeakPolarHBondContact O-CG 3.27Å; E492-R496 PolarHBondContact O-N 2.97Å; E492-R496 WeakPolarHBondContact OE1-CG 3.48Å; E492-R496 IonicContact OE1-CZ 3.73Å; E492-R496 IonicContact OE1-NE 3.99Å; E492-R496 PolarHBondContact OE1-NE 3.05Å; E492-R496 IonicContact OE1-NH2 3.92Å; E492-L710 HydrophobicContact CB-CD1 4.33Å; E492-L710 HydrophobicContact CG-CD1 3.81Å
493	M	80.4	Confident	80.9	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-44.3	172	-80	174.9	69.4	0	0	112.1	L108 R112 F113 F485 L489 T490 E491 R496 M497 L710	L108-M493 HydrophobicContact CD2-CB 4.13Å; R112-M493 HydrophobicContact CB-CE 4.25Å; R112-M493 HydrophobicContact CG-CE 3.9Å; F113-M493 HydrophobicContact CE2-CE 4.3Å; F485-M493 HydrophobicContact CD2-CE 3.9Å; F485-M493 HydrophobicContact CD2-SD 3.37Å; F485-M493 WeakPolarHBondContact CD2-SD 3.46Å; F485-M493 HydrophobicContact CE2-CE 3.54Å; F485-M493 HydrophobicContact CE2-SD 3.48Å; F485-M493 WeakPolarHBondContact CE2-SD 2.96Å; F485-M493 HydrophobicContact CG-SD 4.18Å; F485-M493 HydrophobicContact CZ-SD 4.36Å; L489-M493 WeakPolarHBondContact O-CB 3.48Å; L489-M493 VanDerWaalsContact O-CG 3.23Å; L489-M493 WeakPolarHBondContact O-CG 3.45Å; L489-M493 PolarHBondContact O-N 3.01Å; T490-M493 PolarHBondContact O-N 2.86Å; E491-M493 VanDerWaalsContact C-N 3.33Å; E491-M493 PolarHBondContact O-N 2.83Å; M493-R496 PolarHBondContact O-N 2.79Å; M493-M497 WeakPolarHBondContact O-CB 3.35Å; M493-M497 PolarHBondContact O-N 2.55Å; M493-L710 HydrophobicContact CG-CD1 4.31Å; M493-L710 HydrophobicContact CG-CD2 3.65Å; M493-L710 HydrophobicContact CG-CG 4.5Å; M493-L710 HydrophobicContact SD-CD2 4.32Å
494	N	82.4	Confident	81.6	Confident	16 Å²	16	39 Å²	39	9%	0.086	21%	0.208	C	C	.	.	H	α-helix	trans	-61.4	-47.4	177.6	-170.6	11.3	0	0	0	110.7	L108 T490 E491 M497 R498	L108-N494 HydrophobicContact CD2-CB 4.02Å; T490-N494 WeakPolarHBondContact O-CB 3.43Å; T490-N494 PolarHBondContact O-N 3.41Å; E491-N494 WeakPolarHBondContact O-CB 3.45Å; E491-N494 PolarHBondContact O-N 2.87Å; N494-M497 WeakPolarHBondContact O-CB 3.23Å; N494-M497 PolarHBondContact O-N 2.93Å; N494-R498 VanDerWaalsContact CG-NH1 3.26Å; N494-R498 PolarHBondContact ND2-NH1 2.81Å; N494-R498 WeakPolarHBondContact O-CG 3.19Å; N494-R498 PolarHBondContact O-N 2.89Å; N494-R498 PolarHBondContact OD1-NH1 2.84Å
495	K	82.6	Confident	82.7	Confident	47 Å²	47	36.4 Å²	36.4	20%	0.204	19%	0.186	C	C	.	.	H	α-helix	trans	-58.3	-48.3	175.2	-176.3	-177.7	173.5	-166.6	0	112.5	E491 E492 M497 R498 I499	E491-K495 WeakPolarHBondContact O-CB 3.43Å; E491-K495 PolarHBondContact O-N 2.82Å; E492-K495 PolarHBondContact O-N 2.82Å; E492-K495 IonicContact OE2-NZ 3.89Å; K495-M497 VanDerWaalsContact C-N 3.3Å; K495-M497 PolarHBondContact O-N 3.15Å; K495-R498 WeakPolarHBondContact O-CB 3.43Å; K495-R498 PolarHBondContact O-N 3.38Å; K495-I499 HydrophobicContact CG-CD1 4.21Å; K495-I499 WeakPolarHBondContact O-CG1 3.4Å; K495-I499 PolarHBondContact O-N 3.01Å
496	R	83.6	Confident	83.7	Confident	28 Å²	28	34.5 Å²	34.5	11%	0.106	18%	0.179	C	C	.	.	H	α-helix	trans	-61.6	-38.2	175.5	-75.4	178	176	-132.3	-8.5	112.9	E492 M493 R498 I499 K500	E492-R496 WeakPolarHBondContact O-CB 3.47Å; E492-R496 WeakPolarHBondContact O-CG 3.27Å; E492-R496 PolarHBondContact O-N 2.97Å; E492-R496 WeakPolarHBondContact OE1-CG 3.48Å; E492-R496 IonicContact OE1-CZ 3.73Å; E492-R496 IonicContact OE1-NE 3.99Å; E492-R496 PolarHBondContact OE1-NE 3.05Å; E492-R496 IonicContact OE1-NH2 3.92Å; M493-R496 PolarHBondContact O-N 2.79Å; R496-R498 VanDerWaalsContact C-N 3.33Å; R496-I499 PolarHBondContact O-N 3.1Å; R496-K500 WeakPolarHBondContact O-CB 3.46Å; R496-K500 PolarHBondContact O-N 3.29Å
497	M	85.3	Confident	84.7	Confident	7 Å²	7	31.5 Å²	31.5	3%	0.034	16%	0.158	C	C	.	.	H	α-helix	trans	-64	-40.7	176.1	-169.9	64.8	-166.8	0	0	110.9	L108 M493 N494 K495 K500 W501 W681	L108-M497 HydrophobicContact CD1-CB 3.93Å; L108-M497 HydrophobicContact CD1-CG 4.2Å; M493-M497 WeakPolarHBondContact O-CB 3.35Å; M493-M497 PolarHBondContact O-N 2.55Å; N494-M497 WeakPolarHBondContact O-CB 3.23Å; N494-M497 PolarHBondContact O-N 2.93Å; K495-M497 VanDerWaalsContact C-N 3.3Å; K495-M497 PolarHBondContact O-N 3.15Å; M497-K500 PolarHBondContact O-N 2.89Å; M497-W501 HydrophobicContact CE-CE3 3.83Å; M497-W501 HydrophobicContact CE-CZ3 4.2Å; M497-W501 WeakPolarHBondContact O-CB 3.42Å; M497-W501 PolarHBondContact O-N 3.44Å; M497-W681 HydrophobicContact CG-CH2 4.25Å
498	R	84.3	Confident	85.5	Confident	40 Å²	40	32.9 Å²	32.9	15%	0.151	16%	0.157	C	C	.	.	H	α-helix	trans	-60.7	-46.6	173.4	-68.6	-170.9	-60.1	-97.1	12.2	112.2	E491 N494 K495 R496 W501 T502 L685 E688	E491-R498 IonicContact OE1-CZ 2.67Å; E491-R498 IonicContact OE1-NH1 2.99Å; E491-R498 IonicContact OE1-NH2 3.74Å; E491-R498 PolarHBondContact OE1-NH2 3.37Å; N494-R498 VanDerWaalsContact CG-NH1 3.26Å; N494-R498 PolarHBondContact ND2-NH1 2.81Å; N494-R498 WeakPolarHBondContact O-CG 3.19Å; N494-R498 PolarHBondContact O-N 2.89Å; N494-R498 PolarHBondContact OD1-NH1 2.84Å; K495-R498 WeakPolarHBondContact O-CB 3.43Å; K495-R498 PolarHBondContact O-N 3.38Å; R496-R498 VanDerWaalsContact C-N 3.33Å; R498-W501 PolarHBondContact O-N 3.43Å; R498-T502 WeakPolarHBondContact O-CB 3.2Å; R498-T502 PolarHBondContact O-N 3.48Å; R498-T502 PolarHBondContact O-OG1 3.37Å; R498-L685 HydrophobicContact CG-CD1 3.97Å; R498-E688 IonicContact CZ-OE1 3.52Å; R498-E688 IonicContact NE-OE1 2.86Å; R498-E688 IonicContact NH2-OE1 3.82Å; R498-E688 PolarHBondContact NH2-OE1 2.71Å
499	I	85.4	Confident	86.4	Confident	60 Å²	60	28.9 Å²	28.9	31%	0.308	14%	0.136	S	C	.	.	H	α-helix	trans	-62.3	-51.3	178.3	-65.2	166.1	0	0	0	109.8	K495 R496 W501 T502 E503 L581	K495-I499 HydrophobicContact CG-CD1 4.21Å; K495-I499 WeakPolarHBondContact O-CG1 3.4Å; K495-I499 PolarHBondContact O-N 3.01Å; R496-I499 PolarHBondContact O-N 3.1Å; I499-W501 VanDerWaalsContact C-N 3.28Å; I499-W501 PolarHBondContact O-N 3.05Å; I499-T502 WeakPolarHBondContact O-CB 3.35Å; I499-T502 PolarHBondContact O-N 2.82Å; I499-T502 VanDerWaalsContact O-N 3.12Å; I499-E503 HydrophobicContact CG2-CG 4.26Å; I499-E503 WeakPolarHBondContact CG2-OE1 3.36Å; I499-E503 WeakPolarHBondContact O-CG 3.37Å; I499-E503 PolarHBondContact O-N 3.38Å; I499-L581 HydrophobicContact CB-CD1 4.13Å; I499-L581 HydrophobicContact CG2-CD1 3.72Å
500	K	87.4	Confident	87.1	Confident	22 Å²	22	28.2 Å²	28.2	10%	0.096	13%	0.133	C	C	.	.	H	α-helix	trans	-53	-48.5	176.6	-177.4	175.6	-178.4	176.2	0	110.7	R496 M497 T502 E503 I504 L581	R496-K500 WeakPolarHBondContact O-CB 3.46Å; R496-K500 PolarHBondContact O-N 3.29Å; M497-K500 PolarHBondContact O-N 2.89Å; K500-T502 VanDerWaalsContact C-N 3.31Å; K500-T502 PolarHBondContact O-N 3.19Å; K500-E503 PolarHBondContact O-N 3.2Å; K500-I504 HydrophobicContact CG-CG2 4.42Å; K500-I504 VanDerWaalsContact O-CG2 3.27Å; K500-I504 WeakPolarHBondContact O-CG2 3.2Å; K500-I504 PolarHBondContact O-N 3.46Å; K500-L581 HydrophobicContact CB-CB 4.26Å; K500-L581 WeakPolarHBondContact CE-O 3.47Å; K500-L581 HydrophobicContact CG-CB 4.41Å
501	W	88.9	Confident	87.6	Confident	25 Å²	25	28.4 Å²	28.4	10%	0.095	14%	0.135	C	C	.	.	H	α-helix	trans	-66.1	-35.2	-177.9	-151.3	-97.3	0	0	0	113.7	M497 R498 I499 I504 S505 L552 L592 T674 L678 L682	M497-W501 HydrophobicContact CE-CE3 3.83Å; M497-W501 HydrophobicContact CE-CZ3 4.2Å; M497-W501 WeakPolarHBondContact O-CB 3.42Å; M497-W501 PolarHBondContact O-N 3.44Å; R498-W501 PolarHBondContact O-N 3.43Å; I499-W501 VanDerWaalsContact C-N 3.28Å; I499-W501 PolarHBondContact O-N 3.05Å; W501-I504 HydrophobicContact CD2-CD1 3.52Å; W501-I504 HydrophobicContact CD2-CG1 4.19Å; W501-I504 HydrophobicContact CE3-CD1 3.25Å; W501-I504 HydrophobicContact CE3-CG1 4.26Å; W501-I504 HydrophobicContact CG-CD1 4.26Å; W501-I504 HydrophobicContact CG-CG1 4.44Å; W501-I504 HydrophobicContact CH2-CD1 3.83Å; W501-I504 HydrophobicContact CZ2-CD1 4.09Å; W501-I504 HydrophobicContact CZ3-CD1 3.39Å; W501-I504 WeakPolarHBondContact O-CG1 3.29Å; W501-S505 WeakPolarHBondContact O-CB 3.4Å; W501-S505 PolarHBondContact O-N 2.88Å; W501-S505 PolarHBondContact O-OG 2.79Å; W501-L552 HydrophobicContact CH2-CD2 4.18Å; W501-L552 HydrophobicContact CZ2-CD2 4.09Å; W501-L592 HydrophobicContact CH2-CD1 3.9Å; W501-L592 HydrophobicContact CZ3-CD1 4.44Å; W501-T674 HydrophobicContact CH2-CG2 3.97Å; W501-T674 HydrophobicContact CZ2-CG2 3.41Å; W501-T674 VanDerWaalsContact CZ2-CG2 3.41Å; W501-L678 HydrophobicContact CH2-CD2 3.45Å; W501-L678 VanDerWaalsContact CH2-CD2 3.45Å; W501-L678 HydrophobicContact CH2-CG 4.36Å; W501-L678 HydrophobicContact CZ2-CD2 3.67Å; W501-L678 HydrophobicContact CZ2-CG 4.19Å; W501-L678 HydrophobicContact CZ3-CD2 4.3Å; W501-L682 HydrophobicContact CB-CD2 4.17Å; W501-L682 HydrophobicContact CD2-CD1 3.97Å; W501-L682 HydrophobicContact CD2-CD2 4.2Å; W501-L682 HydrophobicContact CG-CD1 4.03Å; W501-L682 HydrophobicContact CG-CD2 3.75Å; W501-L682 HydrophobicContact CZ2-CD1 3.8Å
502	T	88.9	Confident	88	Confident	57 Å²	57	24 Å²	24	35%	0.35	11%	0.114	S	C	.	.	H	α-helix	trans	-65.2	-46.6	173.8	-61.9	0	0	0	0	110.8	R498 I499 K500 S505 T506 Q548	R498-T502 WeakPolarHBondContact O-CB 3.2Å; R498-T502 PolarHBondContact O-N 3.48Å; R498-T502 PolarHBondContact O-OG1 3.37Å; I499-T502 WeakPolarHBondContact O-CB 3.35Å; I499-T502 PolarHBondContact O-N 2.82Å; I499-T502 VanDerWaalsContact O-N 3.12Å; K500-T502 VanDerWaalsContact C-N 3.31Å; K500-T502 PolarHBondContact O-N 3.19Å; T502-S505 CarbonylContact O-C 3.55Å; T502-S505 PolarHBondContact O-N 3.06Å; T502-T506 WeakPolarHBondContact O-CB 3.4Å; T502-T506 PolarHBondContact O-N 3.26Å; T502-T506 VanDerWaalsContact O-N 3.11Å; T502-T506 PolarHBondContact O-OG1 3.02Å; T502-Q548 HydrophobicContact CG2-CG 4.35Å
503	E	90.2	Very high	88.1	Confident	42 Å²	42	24.7 Å²	24.7	20%	0.196	12%	0.122	C	C	.	.	H	α-helix	trans	-65.1	-41.8	179.6	-71.2	179.6	175.6	0	0	112	I499 K500 S505 T506 P577 T579 T582	I499-E503 HydrophobicContact CG2-CG 4.26Å; I499-E503 WeakPolarHBondContact CG2-OE1 3.36Å; I499-E503 WeakPolarHBondContact O-CG 3.37Å; I499-E503 PolarHBondContact O-N 3.38Å; K500-E503 PolarHBondContact O-N 3.2Å; E503-S505 PolarHBondContact O-N 2.97Å; E503-T506 WeakPolarHBondContact O-CB 3.42Å; E503-T506 PolarHBondContact O-N 2.79Å; E503-P577 HydrophobicContact CB-CG 4.14Å; E503-P577 WeakPolarHBondContact O-CG 3.17Å; E503-T579 WeakPolarHBondContact OE2-CB 3.42Å; E503-T579 WeakPolarHBondContact OE2-CG2 3.24Å; E503-T579 PolarHBondContact OE2-OG1 3.36Å; E503-T582 HydrophobicContact CB-CG2 3.66Å; E503-T582 WeakPolarHBondContact OE2-CG2 3.07Å
504	I	91.3	Very high	87.9	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-68.1	-23.2	176.4	69.9	174.3	0	0	0	113.3	K500 W501 T506 L552 R576 T582 C585	K500-I504 HydrophobicContact CG-CG2 4.42Å; K500-I504 VanDerWaalsContact O-CG2 3.27Å; K500-I504 WeakPolarHBondContact O-CG2 3.2Å; K500-I504 PolarHBondContact O-N 3.46Å; W501-I504 HydrophobicContact CD2-CD1 3.52Å; W501-I504 HydrophobicContact CD2-CG1 4.19Å; W501-I504 HydrophobicContact CE3-CD1 3.25Å; W501-I504 HydrophobicContact CE3-CG1 4.26Å; W501-I504 HydrophobicContact CG-CD1 4.26Å; W501-I504 HydrophobicContact CG-CG1 4.44Å; W501-I504 HydrophobicContact CH2-CD1 3.83Å; W501-I504 HydrophobicContact CZ2-CD1 4.09Å; W501-I504 HydrophobicContact CZ3-CD1 3.39Å; W501-I504 WeakPolarHBondContact O-CG1 3.29Å; I504-T506 VanDerWaalsContact C-N 3.3Å; I504-L552 HydrophobicContact CB-CD1 4.17Å; I504-L552 HydrophobicContact CD1-CD1 4.1Å; I504-L552 HydrophobicContact CD1-CD2 3.84Å; I504-L552 HydrophobicContact CG1-CD1 3.92Å; I504-L552 WeakPolarHBondContact O-CD1 3.48Å; I504-R576 PolarHBondContact O-NE 2.95Å; I504-T582 HydrophobicContact CG2-CG2 4.22Å; I504-C585 WeakPolarHBondContact CG2-SG 3.48Å
505	S	93.1	Very high	87.5	Confident	4 Å²	4	40.2 Å²	40.2	3%	0.028	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	2.9	174.8	-52.4	0	0	0	0	112.1	W501 T502 E503 Y549	W501-S505 WeakPolarHBondContact O-CB 3.4Å; W501-S505 PolarHBondContact O-N 2.88Å; W501-S505 PolarHBondContact O-OG 2.79Å; T502-S505 CarbonylContact O-C 3.55Å; T502-S505 PolarHBondContact O-N 3.06Å; E503-S505 PolarHBondContact O-N 2.97Å; S505-Y549 PolarHBondContact O-N 2.85Å
506	T	93.8	Very high	87.2	Confident	12 Å²	12	38.7 Å²	38.7	7%	0.074	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	139.2	178.4	-60.4	0	0	0	0	110.6	T502 E503 I504 Y508 C546 I547 P577	T502-T506 WeakPolarHBondContact O-CB 3.4Å; T502-T506 PolarHBondContact O-N 3.26Å; T502-T506 VanDerWaalsContact O-N 3.11Å; T502-T506 PolarHBondContact O-OG1 3.02Å; E503-T506 WeakPolarHBondContact O-CB 3.42Å; E503-T506 PolarHBondContact O-N 2.79Å; I504-T506 VanDerWaalsContact C-N 3.3Å; T506-Y508 HydrophobicContact CG2-CE2 4.18Å; T506-C546 VanDerWaalsContact CG2-SG 3.55Å; T506-I547 CarbonylContact C-O 3.58Å; T506-I547 VanDerWaalsContact CA-O 3.3Å; T506-I547 WeakPolarHBondContact CA-O 3.45Å; T506-P577 WeakPolarHBondContact O-CD 3.06Å
507	V	95.2	Very high	87.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	133.1	-178.3	-177	0	0	0	0	109.3	I547 Y549 A555 I559 V574	V507-I547 PolarHBondContact N-O 3Å; V507-I547 WeakPolarHBondContact O-CD1 3Å; V507-I547 PolarHBondContact O-N 3.44Å; V507-Y549 HydrophobicContact CB-CE2 4.49Å; V507-Y549 HydrophobicContact CG2-CD2 4.28Å; V507-Y549 HydrophobicContact CG2-CE2 4.12Å; V507-A555 HydrophobicContact CG2-CB 3.78Å; V507-I559 HydrophobicContact CG1-CD1 4.48Å; V507-I559 HydrophobicContact CG1-CG1 3.89Å; V507-I559 HydrophobicContact CG2-CD1 3.99Å; V507-I559 HydrophobicContact CG2-CG1 4.04Å; V507-V574 HydrophobicContact CG1-CB 4.5Å; V507-V574 HydrophobicContact CG1-CG1 3.19Å
508	Y	93	Very high	87.1	Confident	84 Å²	84	45.7 Å²	45.7	33%	0.329	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	124.2	168.5	-78.8	-99	0	0	0	109	T506 V537 L545 C546 V574 Q575 P577	T506-Y508 HydrophobicContact CG2-CE2 4.18Å; Y508-V537 HydrophobicContact CE1-CG2 4.01Å; Y508-L545 CarbonylContact C-O 3.57Å; Y508-L545 WeakPolarHBondContact CA-O 3.5Å; Y508-C546 HydrophobicContact CD1-CB 4.17Å; Y508-C546 HydrophobicContact CE1-CB 3.76Å; Y508-C546 HydrophobicContact CE2-CB 4.44Å; Y508-V574 WeakPolarHBondContact O-CA 3.37Å; Y508-Q575 PolarHBondContact N-O 2.82Å; Y508-Q575 PolarHBondContact O-N 3.25Å; Y508-P577 HydrophobicContact CD2-CB 4.16Å; Y508-P577 HydrophobicContact CE2-CB 3.85Å; Y508-P577 HydrophobicContact CE2-CG 4.3Å
509	A	93.2	Very high	87.1	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	138.1	175.8	0	0	0	0	0	110.6	F512 F525 H544 L545 I547 K573 V574	A509-F512 HydrophobicContact CB-CE2 4.05Å; A509-F512 HydrophobicContact CB-CZ 3.81Å; A509-F512 WeakPolarHBondContact O-CE2 3.47Å; A509-F525 HydrophobicContact CB-CE1 3.72Å; A509-F525 HydrophobicContact CB-CE2 4.25Å; A509-F525 HydrophobicContact CB-CZ 3.3Å; A509-H544 CarbonylContact O-C 3.57Å; A509-H544 WeakPolarHBondContact O-CA 3.13Å; A509-L545 PolarHBondContact N-O 3.19Å; A509-L545 PolarHBondContact O-N 3.04Å; A509-I547 HydrophobicContact CB-CD1 4.07Å; A509-K573 CarbonylContact C-O 3.55Å; A509-K573 VanDerWaalsContact CA-O 3.31Å; A509-K573 WeakPolarHBondContact CA-O 3.34Å; A509-V574 HydrophobicContact CB-CG1 4.46Å; A509-V574 HydrophobicContact CB-CG2 3.94Å
510	G	91.1	Very high	87.2	Confident	1 Å²	1	53 Å²	53	1%	0.01	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.5	-178.4	174.7	0	0	0	0	0	111.8	K573	G510-K573 PolarHBondContact N-O 3.14Å; G510-K573 WeakPolarHBondContact O-CA 3.44Å; G510-K573 WeakPolarHBondContact O-CB 3.25Å; G510-K573 PolarHBondContact O-N 3.34Å; G510-K573 VanDerWaalsContact O-O 3.07Å
511	P	89.7	Confident	87.1	Confident	28 Å²	28	52.2 Å²	52.2	18%	0.182	26%	0.259	C	S	.	.	P	Polyproline II helix	cis	-77.3	147.5	4.1	30.2	-34.2	0	0	0	112.9	Q542 T570	P511-Q542 HydrophobicContact CB-CB 3.47Å; P511-Q542 VanDerWaalsContact CB-CB 3.47Å; P511-Q542 HydrophobicContact CB-CG 4.19Å; P511-T570 HydrophobicContact CG-CG2 4.3Å; P511-T570 WeakPolarHBondContact O-CG2 3.43Å
512	F	88	Confident	87.1	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.018	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-102.5	156	170.6	-61.1	-73.6	0	0	0	111.7	A509 C516 L521 F525 P543 L545 V567 I572	A509-F512 HydrophobicContact CB-CE2 4.05Å; A509-F512 HydrophobicContact CB-CZ 3.81Å; A509-F512 WeakPolarHBondContact O-CE2 3.47Å; F512-C516 HydrophobicContact CB-CB 4.26Å; F512-L521 HydrophobicContact CD1-CD1 3.96Å; F512-L521 HydrophobicContact CD1-CD2 3.82Å; F512-L521 HydrophobicContact CD2-CD1 4.37Å; F512-L521 HydrophobicContact CE1-CD1 4.11Å; F512-L521 HydrophobicContact CE1-CD2 3.38Å; F512-L521 HydrophobicContact CE1-CG 4.4Å; F512-L521 HydrophobicContact CG-CD1 4.09Å; F512-L521 HydrophobicContact CZ-CD1 4.4Å; F512-L521 HydrophobicContact CZ-CD2 3.99Å; F512-F525 HydrophobicContact CZ-CE2 4.01Å; F512-F525 HydrophobicContact CZ-CZ 4.17Å; F512-P543 HydrophobicContact CB-CG 4.18Å; F512-P543 PolarHBondContact N-O 3.3Å; F512-P543 WeakPolarHBondContact O-CD 3.47Å; F512-P543 VanDerWaalsContact O-CG 3.23Å; F512-P543 WeakPolarHBondContact O-CG 3.22Å; F512-L545 HydrophobicContact CD2-CB 4.37Å; F512-L545 HydrophobicContact CE2-CB 3.61Å; F512-L545 HydrophobicContact CZ-CB 4.44Å; F512-V567 HydrophobicContact CE1-CG1 4.47Å; F512-I572 HydrophobicContact CD1-CG2 3.94Å; F512-I572 HydrophobicContact CE1-CD1 4.17Å; F512-I572 HydrophobicContact CE1-CG2 3.68Å; F512-I572 HydrophobicContact CZ-CD1 4.38Å; F512-I572 HydrophobicContact CZ-CG2 4.41Å
513	S	82.4	Confident	87.1	Confident	40 Å²	40	61.8 Å²	61.8	28%	0.28	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-68.9	150.6	170.4	72.7	0	0	0	0	110.9	N515 C516	S513-N515 PolarHBondContact O-N 3.06Å; S513-N515 VanDerWaalsContact O-N 3.15Å; S513-C516 VanDerWaalsContact O-CB 3.26Å; S513-C516 WeakPolarHBondContact O-CB 3.21Å; S513-C516 PolarHBondContact O-N 3.11Å; S513-C516 VanDerWaalsContact O-N 3.13Å; S513-C516 PolarHBondContact OG-N 3.14Å
514	K	75.3	Confident	87.2	Confident	186 Å²	186	62.2 Å²	62.2	81%	0.809	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.6	179.2	-71.1	-175.6	177	-177.8	0	113.4
515	N	74.1	Confident	87.3	Confident	157 Å²	157	62.1 Å²	62.1	84%	0.84	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	11.5	-178.4	-62.2	-8.6	0	0	0	112.9	S513	S513-N515 PolarHBondContact O-N 3.06Å; S513-N515 VanDerWaalsContact O-N 3.15Å
516	C	77.1	Confident	87.2	Confident	15 Å²	15	67.5 Å²	67.5	10%	0.101	32%	0.317	C	S	.	.			trans	-60.4	139.7	-175.3	-173.2	0	0	0	0	111.9	F512 S513 L518 L521 D568	F512-C516 HydrophobicContact CB-CB 4.26Å; S513-C516 VanDerWaalsContact O-CB 3.26Å; S513-C516 WeakPolarHBondContact O-CB 3.21Å; S513-C516 PolarHBondContact O-N 3.11Å; S513-C516 VanDerWaalsContact O-N 3.13Å; S513-C516 PolarHBondContact OG-N 3.14Å; C516-L518 PolarHBondContact O-N 3.46Å; C516-L521 HydrophobicContact CB-CD1 4.26Å; C516-L521 WeakPolarHBondContact SG-CD1 3.46Å; C516-L521 VanDerWaalsContact SG-CG 3.53Å; C516-D568 PolarHBondContact SG-OD2 3.01Å
517	N	83.7	Confident	87.2	Confident	90 Å²	90	68.6 Å²	68.6	48%	0.481	33%	0.325	S	S	.	.			trans	-70.5	97	-179.6	-174	-33	0	0	0	110.9	R519 A520 L521	N517-R519 VanDerWaalsContact C-N 3.28Å; N517-R519 PolarHBondContact O-N 2.95Å; N517-R519 PolarHBondContact OD1-N 3.39Å; N517-A520 HydrophobicContact CB-CB 3.87Å; N517-A520 WeakPolarHBondContact O-CB 3.48Å; N517-A520 PolarHBondContact O-N 3.5Å; N517-A520 PolarHBondContact OD1-N 3.44Å; N517-L521 PolarHBondContact O-N 2.8Å
518	L	82.2	Confident	87.1	Confident	91 Å²	91	68.7 Å²	68.7	48%	0.476	33%	0.325	S	S	.	.	H	α-helix	trans	-47.2	-47.7	177.1	-80.2	130.3	0	0	0	112.8	C516 A520 L521 K522 F536	C516-L518 PolarHBondContact O-N 3.46Å; L518-A520 VanDerWaalsContact C-N 3.32Å; L518-A520 PolarHBondContact O-N 3.17Å; L518-L521 PolarHBondContact O-N 3.17Å; L518-K522 WeakPolarHBondContact O-CG 3.4Å; L518-K522 PolarHBondContact O-N 3.39Å; L518-F536 HydrophobicContact CD2-CD2 4.08Å; L518-F536 HydrophobicContact CD2-CE1 4.24Å; L518-F536 HydrophobicContact CD2-CE2 3.21Å; L518-F536 HydrophobicContact CD2-CZ 3.3Å; L518-F536 HydrophobicContact CG-CE2 4.41Å; L518-F536 HydrophobicContact CG-CZ 4.08Å
519	R	85.1	Confident	87.1	Confident	216 Å²	216	64.8 Å²	64.8	82%	0.815	31%	0.311	S	S	*	.	H	α-helix	trans	-64.7	-38.3	-178	-65.2	-175.6	-170.6	178.1	3.7	111.6	N517 R523	N517-R519 VanDerWaalsContact C-N 3.28Å; N517-R519 PolarHBondContact O-N 2.95Å; N517-R519 PolarHBondContact OD1-N 3.39Å; R519-R523 WeakPolarHBondContact O-CB 3.48Å; R519-R523 PolarHBondContact O-N 3.02Å
520	A	86.6	Confident	87	Confident	38 Å²	38	65.9 Å²	65.9	31%	0.314	32%	0.317	S	S	.	.	H	α-helix	trans	-65.8	-45.3	176.3	0	0	0	0	0	111.2	N517 L518 R523 L524	N517-A520 HydrophobicContact CB-CB 3.87Å; N517-A520 WeakPolarHBondContact O-CB 3.48Å; N517-A520 PolarHBondContact O-N 3.5Å; N517-A520 PolarHBondContact OD1-N 3.44Å; L518-A520 VanDerWaalsContact C-N 3.32Å; L518-A520 PolarHBondContact O-N 3.17Å; A520-R523 PolarHBondContact O-N 2.98Å; A520-L524 WeakPolarHBondContact O-CB 3.33Å; A520-L524 PolarHBondContact O-N 2.84Å
521	L	87.3	Confident	87	Confident	6 Å²	6	67.3 Å²	67.3	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-59	-48.9	173.5	-71.7	179.9	0	0	0	111.8	F512 C516 N517 L518 R523 L524 F525 F536 V567	F512-L521 HydrophobicContact CD1-CD1 3.96Å; F512-L521 HydrophobicContact CD1-CD2 3.82Å; F512-L521 HydrophobicContact CD2-CD1 4.37Å; F512-L521 HydrophobicContact CE1-CD1 4.11Å; F512-L521 HydrophobicContact CE1-CD2 3.38Å; F512-L521 HydrophobicContact CE1-CG 4.4Å; F512-L521 HydrophobicContact CG-CD1 4.09Å; F512-L521 HydrophobicContact CZ-CD1 4.4Å; F512-L521 HydrophobicContact CZ-CD2 3.99Å; C516-L521 HydrophobicContact CB-CD1 4.26Å; C516-L521 WeakPolarHBondContact SG-CD1 3.46Å; C516-L521 VanDerWaalsContact SG-CG 3.53Å; N517-L521 PolarHBondContact O-N 2.8Å; L518-L521 PolarHBondContact O-N 3.17Å; L521-R523 PolarHBondContact O-N 3.38Å; L521-L524 WeakPolarHBondContact O-CB 3.23Å; L521-L524 PolarHBondContact O-N 3.1Å; L521-F525 HydrophobicContact CD2-CE2 4.4Å; L521-F525 WeakPolarHBondContact O-CD2 3.42Å; L521-F525 PolarHBondContact O-N 3.45Å; L521-F536 HydrophobicContact CD1-CZ 4.39Å; L521-V567 HydrophobicContact CD2-CG1 3.9Å
522	K	88.3	Confident	87	Confident	92 Å²	92	71.2 Å²	71.2	40%	0.4	34%	0.342	S	S	.	.	H	α-helix	trans	-55.2	-43.1	177.5	-57.2	-144.8	171.7	173.6	0	110.8	L518 K526 M534	L518-K522 WeakPolarHBondContact O-CG 3.4Å; L518-K522 PolarHBondContact O-N 3.39Å; K522-K526 WeakPolarHBondContact O-CB 3.49Å; K522-K526 WeakPolarHBondContact O-CD 3.31Å; K522-K526 WeakPolarHBondContact O-CG 3.45Å; K522-K526 PolarHBondContact O-N 2.97Å; K522-K526 VanDerWaalsContact O-N 3.09Å; K522-M534 HydrophobicContact CB-CE 3.59Å; K522-M534 HydrophobicContact CD-CE 3.24Å; K522-M534 HydrophobicContact CG-CE 3.2Å
523	R	89.4	Confident	87	Confident	190 Å²	190	72.6 Å²	72.6	72%	0.717	35%	0.352	S	S	*	.	H	α-helix	trans	-69.1	-37.7	179	-175.7	175	61.6	176.9	-0.8	112	R519 A520 L521 S527	R519-R523 WeakPolarHBondContact O-CB 3.48Å; R519-R523 PolarHBondContact O-N 3.02Å; A520-R523 PolarHBondContact O-N 2.98Å; L521-R523 PolarHBondContact O-N 3.38Å; R523-S527 WeakPolarHBondContact O-CB 3.21Å; R523-S527 PolarHBondContact O-N 3.37Å; R523-S527 VanDerWaalsContact O-N 3.15Å
524	L	91.4	Very high	87.4	Confident	51 Å²	51	72.5 Å²	72.5	27%	0.267	35%	0.348	S	S	.	.	H	α-helix	trans	-61.7	-55.6	177.1	-178.6	62.7	0	0	0	111	A520 L521 K526 S527 F528 L562 V567	A520-L524 WeakPolarHBondContact O-CB 3.33Å; A520-L524 PolarHBondContact O-N 2.84Å; L521-L524 WeakPolarHBondContact O-CB 3.23Å; L521-L524 PolarHBondContact O-N 3.1Å; L524-K526 PolarHBondContact O-N 3.11Å; L524-S527 WeakPolarHBondContact O-CB 3.34Å; L524-S527 PolarHBondContact O-N 3.36Å; L524-S527 VanDerWaalsContact O-N 3.08Å; L524-S527 PolarHBondContact O-OG 2.81Å; L524-F528 HydrophobicContact CD1-CE2 4.36Å; L524-F528 VanDerWaalsContact O-CD2 3.27Å; L524-F528 WeakPolarHBondContact O-CD2 3.34Å; L524-F528 VanDerWaalsContact O-CE2 3.31Å; L524-F528 WeakPolarHBondContact O-CE2 3.33Å; L524-L562 HydrophobicContact CD1-CD2 4.03Å; L524-L562 HydrophobicContact CD2-CD2 4.01Å; L524-L562 HydrophobicContact CG-CD1 4.44Å; L524-L562 HydrophobicContact CG-CD2 4.11Å; L524-V567 HydrophobicContact CD2-CG2 4.43Å
525	F	92.6	Very high	88.1	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-67.1	-37.9	-179.4	-72.8	-82.2	0	0	0	112.5	A509 F512 L521 S527 F528 L545 I547 Y549 L562 I572	A509-F525 HydrophobicContact CB-CE1 3.72Å; A509-F525 HydrophobicContact CB-CE2 4.25Å; A509-F525 HydrophobicContact CB-CZ 3.3Å; F512-F525 HydrophobicContact CZ-CE2 4.01Å; F512-F525 HydrophobicContact CZ-CZ 4.17Å; L521-F525 HydrophobicContact CD2-CE2 4.4Å; L521-F525 WeakPolarHBondContact O-CD2 3.42Å; L521-F525 PolarHBondContact O-N 3.45Å; F525-S527 PolarHBondContact O-N 3.01Å; F525-S527 VanDerWaalsContact O-N 3.09Å; F525-F528 PolarHBondContact O-N 3.31Å; F525-L545 HydrophobicContact CD2-CD2 3.65Å; F525-L545 HydrophobicContact CE2-CD2 3.79Å; F525-L545 HydrophobicContact CG-CD2 4.38Å; F525-I547 HydrophobicContact CB-CG1 4.31Å; F525-I547 HydrophobicContact CB-CG2 4.5Å; F525-I547 HydrophobicContact CD1-CD1 3.65Å; F525-I547 HydrophobicContact CD1-CG1 3.93Å; F525-I547 HydrophobicContact CD2-CD1 4.44Å; F525-I547 HydrophobicContact CE1-CD1 3.68Å; F525-I547 HydrophobicContact CE1-CG1 4.46Å; F525-I547 HydrophobicContact CE2-CD1 4.49Å; F525-I547 HydrophobicContact CG-CD1 4.07Å; F525-I547 HydrophobicContact CG-CG1 4.01Å; F525-I547 HydrophobicContact CZ-CD1 4.15Å; F525-Y549 PolarHBondContact O-OH 3.3Å; F525-Y549 VanDerWaalsContact O-OH 3.13Å; F525-L562 HydrophobicContact CD1-CD1 3.81Å; F525-L562 HydrophobicContact CE1-CD1 3.32Å; F525-L562 HydrophobicContact CE2-CD1 4.48Å; F525-L562 HydrophobicContact CZ-CD1 3.69Å; F525-I572 HydrophobicContact CZ-CD1 4.49Å
526	K	92.7	Very high	88.5	Confident	117 Å²	117	63 Å²	63	51%	0.509	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-12.2	173.3	-73.7	179.1	178	-168	0	114.5	K522 L524 F528 V531 F605	K522-K526 WeakPolarHBondContact O-CB 3.49Å; K522-K526 WeakPolarHBondContact O-CD 3.31Å; K522-K526 WeakPolarHBondContact O-CG 3.45Å; K522-K526 PolarHBondContact O-N 2.97Å; K522-K526 VanDerWaalsContact O-N 3.09Å; L524-K526 PolarHBondContact O-N 3.11Å; K526-F528 VanDerWaalsContact C-N 3.28Å; K526-V531 HydrophobicContact CG-CG2 4Å; K526-F605 WeakPolarHBondContact O-CE1 3.22Å; K526-F605 WeakPolarHBondContact O-CZ 3.42Å
527	S	92.4	Very high	88.8	Confident	34 Å²	34	63.8 Å²	63.8	24%	0.238	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-10.8	178.9	73.3	0	0	0	0	113.7	R523 L524 F525 F605 K668	R523-S527 WeakPolarHBondContact O-CB 3.21Å; R523-S527 PolarHBondContact O-N 3.37Å; R523-S527 VanDerWaalsContact O-N 3.15Å; L524-S527 WeakPolarHBondContact O-CB 3.34Å; L524-S527 PolarHBondContact O-N 3.36Å; L524-S527 VanDerWaalsContact O-N 3.08Å; L524-S527 PolarHBondContact O-OG 2.81Å; F525-S527 PolarHBondContact O-N 3.01Å; F525-S527 VanDerWaalsContact O-N 3.09Å; S527-F605 WeakPolarHBondContact O-CD1 3.12Å; S527-F605 WeakPolarHBondContact O-CE1 3.45Å; S527-K668 VanDerWaalsContact O-CD 3.3Å; S527-K668 WeakPolarHBondContact O-CD 3.2Å; S527-K668 WeakPolarHBondContact OG-CE 3.18Å; S527-K668 PolarHBondContact OG-NZ 2.97Å
528	F	94.3	Very high	88.5	Confident	3 Å²	3	65.8 Å²	65.8	1%	0.013	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-24.3	-180	-62.8	-78	0	0	0	113.1	L524 F525 K526 Y549 L557 A558 S561 L562 Y603 K668	L524-F528 HydrophobicContact CD1-CE2 4.36Å; L524-F528 VanDerWaalsContact O-CD2 3.27Å; L524-F528 WeakPolarHBondContact O-CD2 3.34Å; L524-F528 VanDerWaalsContact O-CE2 3.31Å; L524-F528 WeakPolarHBondContact O-CE2 3.33Å; F525-F528 PolarHBondContact O-N 3.31Å; K526-F528 VanDerWaalsContact C-N 3.28Å; F528-Y549 HydrophobicContact CB-CE1 4.37Å; F528-L557 HydrophobicContact CD1-CD2 4.02Å; F528-L557 HydrophobicContact CD1-CG 3.82Å; F528-L557 HydrophobicContact CE1-CG 4.47Å; F528-A558 HydrophobicContact CB-CB 4.29Å; F528-A558 HydrophobicContact CD2-CB 4.16Å; F528-A558 HydrophobicContact CG-CB 4.12Å; F528-S561 WeakPolarHBondContact CE1-OG 3.31Å; F528-L562 HydrophobicContact CD2-CD1 4.34Å; F528-L562 HydrophobicContact CE2-CD1 3.58Å; F528-L562 HydrophobicContact CE2-CD2 3.9Å; F528-L562 HydrophobicContact CE2-CG 3.75Å; F528-L562 HydrophobicContact CZ-CD1 4.07Å; F528-L562 HydrophobicContact CZ-CD2 3.72Å; F528-L562 HydrophobicContact CZ-CG 3.68Å; F528-Y603 PolarHBondContact O-OH 2.98Å; F528-K668 HydrophobicContact CD1-CD 3.49Å; F528-K668 VanDerWaalsContact CD1-CD 3.49Å; F528-K668 HydrophobicContact CE1-CD 3.55Å; F528-K668 HydrophobicContact CG-CD 4.23Å; F528-K668 HydrophobicContact CZ-CD 4.31Å
529	G	92.4	Very high	88.1	Confident	2 Å²	2	70.4 Å²	70.4	2%	0.021	34%	0.339	C	S	.	.	S	Bend	trans	179.5	171.9	-176.1	0	0	0	0	0	114.9	Y603 F605	G529-Y603 VanDerWaalsContact CA-OH 3.3Å; G529-Y603 WeakPolarHBondContact CA-OH 3.3Å; G529-F605 VanDerWaalsContact C-CE2 3.42Å; G529-F605 VanDerWaalsContact CA-CE2 3.45Å
530	P	90.7	Very high	87.4	Confident	22 Å²	22	63 Å²	63	14%	0.143	32%	0.318	C	S	.	.			trans	-63.7	131.1	167.5	31.2	-38.2	0	0	0	110.9	E550 V551 Y642	P530-E550 HydrophobicContact CB-CB 4.22Å; P530-E550 HydrophobicContact CB-CG 4.01Å; P530-E550 HydrophobicContact CG-CB 3.87Å; P530-E550 HydrophobicContact CG-CG 4.23Å; P530-E550 PolarHBondContact O-N 3.42Å; P530-V551 HydrophobicContact CG-CG2 4.31Å; P530-Y642 HydrophobicContact CG-CD1 3.94Å; P530-Y642 HydrophobicContact CG-CE1 3.72Å
531	V	91.3	Very high	86.7	Confident	32 Å²	32	72.9 Å²	72.9	19%	0.194	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	121.9	-176	176.2	0	0	0	0	109.2	K526 S533 M534 I547 Y549	K526-V531 HydrophobicContact CG-CG2 4Å; V531-S533 WeakPolarHBondContact CG1-O 3.4Å; V531-M534 HydrophobicContact CG1-CB 4.07Å; V531-I547 HydrophobicContact CG1-CG2 3.83Å; V531-I547 HydrophobicContact CG2-CG2 4.1Å; V531-Y549 HydrophobicContact CG2-CD1 3.96Å; V531-Y549 HydrophobicContact CG2-CE1 3.77Å
532	Q	89.3	Confident	86.2	Confident	109 Å²	109	77.4 Å²	77.4	51%	0.509	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	-49.1	174.7	-68.6	-176.2	-17	0	0	111.3	Q548 E550	Q532-Q548 HydrophobicContact CB-CB 4.4Å; Q532-Q548 HydrophobicContact CB-CG 4.13Å; Q532-Q548 PolarHBondContact N-O 2.98Å; Q532-Q548 VanDerWaalsContact OE1-CD 3.3Å; Q532-E550 HydrophobicContact CG-CB 4.1Å; Q532-E550 HydrophobicContact CG-CG 3.28Å
533	S	89.6	Confident	86	Confident	34 Å²	34	73.9 Å²	73.9	24%	0.238	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	151.7	-178.5	79	0	0	0	0	110.7	V531 Q548	V531-S533 WeakPolarHBondContact CG1-O 3.4Å; S533-Q548 PolarHBondContact N-O 3.25Å; S533-Q548 PolarHBondContact O-N 2.95Å; S533-Q548 VanDerWaalsContact OG-CB 3.3Å; S533-Q548 WeakPolarHBondContact OG-CB 3.45Å; S533-Q548 PolarHBondContact OG-OE1 3.35Å
534	M	90.5	Very high	85.9	Confident	38 Å²	38	67.2 Å²	67.2	19%	0.187	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	113.7	177.7	-177	174.3	69.6	0	0	109.3	K522 V531 L545 C546 I547	K522-M534 HydrophobicContact CB-CE 3.59Å; K522-M534 HydrophobicContact CD-CE 3.24Å; K522-M534 HydrophobicContact CG-CE 3.2Å; V531-M534 HydrophobicContact CG1-CB 4.07Å; M534-L545 HydrophobicContact CG-CD1 3.63Å; M534-L545 HydrophobicContact CG-CD2 3.99Å; M534-L545 HydrophobicContact CG-CG 3.86Å; M534-L545 HydrophobicContact SD-CD1 4.33Å; M534-L545 HydrophobicContact SD-CD2 3.8Å; M534-L545 HydrophobicContact SD-CG 4.35Å; M534-C546 CarbonylContact C-O 3.55Å; M534-C546 VanDerWaalsContact CA-O 3.27Å; M534-C546 WeakPolarHBondContact CA-O 3.45Å; M534-I547 HydrophobicContact CG-CG1 4.02Å; M534-I547 HydrophobicContact SD-CG1 4.32Å
535	T	88.4	Confident	85.9	Confident	81 Å²	81	64.8 Å²	64.8	50%	0.497	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	138	-166	-47.4	0	0	0	0	110	C546	T535-C546 PolarHBondContact N-O 3.49Å; T535-C546 PolarHBondContact O-N 2.74Å
536	F	84.3	Confident	85.8	Confident	62 Å²	62	65.7 Å²	65.7	27%	0.272	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	131.8	172.7	-83.2	-97	0	0	0	110	L518 L521 L538 P543 H544 L545	L518-F536 HydrophobicContact CD2-CD2 4.08Å; L518-F536 HydrophobicContact CD2-CE1 4.24Å; L518-F536 HydrophobicContact CD2-CE2 3.21Å; L518-F536 HydrophobicContact CD2-CZ 3.3Å; L518-F536 HydrophobicContact CG-CE2 4.41Å; L518-F536 HydrophobicContact CG-CZ 4.08Å; L521-F536 HydrophobicContact CD1-CZ 4.39Å; F536-L538 HydrophobicContact CB-CD2 4.06Å; F536-L538 HydrophobicContact CB-CG 4.26Å; F536-L538 HydrophobicContact CD1-CD2 4.49Å; F536-P543 HydrophobicContact CD1-CB 4.31Å; F536-H544 WeakPolarHBondContact CA-O 3.4Å; F536-L545 HydrophobicContact CD1-CD1 4.41Å; F536-L545 HydrophobicContact CD2-CD1 3.72Å; F536-L545 HydrophobicContact CE1-CD1 4.25Å; F536-L545 HydrophobicContact CE2-CD1 3.48Å; F536-L545 VanDerWaalsContact CE2-CD1 3.48Å; F536-L545 HydrophobicContact CG-CD1 4.17Å; F536-L545 HydrophobicContact CZ-CD1 3.78Å
537	V	83	Confident	85.9	Confident	32 Å²	32	60.1 Å²	60.1	19%	0.194	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	106.2	169.1	-177.1	0	0	0	0	106.8	Y508 E539 H544 C546	Y508-V537 HydrophobicContact CE1-CG2 4.01Å; V537-E539 HydrophobicContact CG1-CB 4.44Å; V537-H544 HydrophobicContact CB-CB 4.36Å; V537-H544 PolarHBondContact N-O 3.05Å; V537-H544 PolarHBondContact O-N 3.04Å; V537-H544 VanDerWaalsContact O-N 3.14Å; V537-C546 HydrophobicContact CG2-CB 4.19Å
538	L	77.3	Confident	86	Confident	131 Å²	131	60.5 Å²	60.5	69%	0.686	30%	0.299	S	S	*	.			trans	-98.6	-5.1	-176	-58.7	178.3	0	0	0	112.6	F536 T540 P543	F536-L538 HydrophobicContact CB-CD2 4.06Å; F536-L538 HydrophobicContact CB-CG 4.26Å; F536-L538 HydrophobicContact CD1-CD2 4.49Å; L538-T540 PolarHBondContact O-N 3.18Å; L538-P543 HydrophobicContact CD2-CB 4.29Å
539	E	73.4	Confident	86	Confident	188 Å²	188	60.5 Å²	60.5	88%	0.879	30%	0.299	S	S	*	.	S	Bend	trans	-71.2	-15.9	-179.9	-66.1	161.7	-175.2	0	0	112.4	V537	V537-E539 HydrophobicContact CG1-CB 4.44Å
540	T	71.1	Confident	85.8	Confident	60 Å²	60	63.9 Å²	63.9	37%	0.368	31%	0.314	S	S	.	.	S	Bend	trans	-90.4	149.8	176.2	51.1	0	0	0	0	111.5	L538 Q542 H544	L538-T540 PolarHBondContact O-N 3.18Å; T540-Q542 WeakPolarHBondContact CB-O 3.4Å; T540-Q542 PolarHBondContact O-N 2.89Å; T540-Q542 PolarHBondContact OG1-O 3.03Å; T540-H544 PolarHBondContact OG1-ND1 2.81Å
541	R	71.6	Confident	85.8	Confident	246 Å²	246	63 Å²	63	93%	0.928	31%	0.308	S	S	*	.	S	Bend	trans	-51.5	-31.2	179.7	-173.8	178.3	178.1	156.4	0.4	113.8
542	Q	76.4	Confident	86	Confident	101 Å²	101	61.5 Å²	61.5	47%	0.472	30%	0.299	S	S	.	.	S	Bend	trans	-123.1	142.7	170.5	-69.8	174.8	-39.5	0	0	109.2	P511 T540 H544	P511-Q542 HydrophobicContact CB-CB 3.47Å; P511-Q542 VanDerWaalsContact CB-CB 3.47Å; P511-Q542 HydrophobicContact CB-CG 4.19Å; T540-Q542 WeakPolarHBondContact CB-O 3.4Å; T540-Q542 PolarHBondContact O-N 2.89Å; T540-Q542 PolarHBondContact OG1-O 3.03Å; Q542-H544 PolarHBondContact O-CE1 3.22Å; Q542-H544 PolarHBondContact O-N 3.25Å; Q542-H544 PolarHBondContact O-ND1 3.31Å
543	P	83.3	Confident	86.2	Confident	19 Å²	19	56.3 Å²	56.3	12%	0.123	28%	0.275	C	S	.	.			trans	-64.3	135	-175.8	25.2	-34.5	0	0	0	111.9	F512 F536 L538	F512-P543 HydrophobicContact CB-CG 4.18Å; F512-P543 PolarHBondContact N-O 3.3Å; F512-P543 WeakPolarHBondContact O-CD 3.47Å; F512-P543 VanDerWaalsContact O-CG 3.23Å; F512-P543 WeakPolarHBondContact O-CG 3.22Å; F536-P543 HydrophobicContact CD1-CB 4.31Å; L538-P543 HydrophobicContact CD2-CB 4.29Å
544	H	88.4	Confident	86.5	Confident	49 Å²	49	54.7 Å²	54.7	23%	0.227	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	156.8	169.1	-67.7	74.6	0	0	0	110	A509 F536 V537 T540 Q542	A509-H544 CarbonylContact O-C 3.57Å; A509-H544 WeakPolarHBondContact O-CA 3.13Å; F536-H544 WeakPolarHBondContact CA-O 3.4Å; V537-H544 HydrophobicContact CB-CB 4.36Å; V537-H544 PolarHBondContact N-O 3.05Å; V537-H544 PolarHBondContact O-N 3.04Å; V537-H544 VanDerWaalsContact O-N 3.14Å; T540-H544 PolarHBondContact OG1-ND1 2.81Å; Q542-H544 PolarHBondContact O-CE1 3.22Å; Q542-H544 PolarHBondContact O-N 3.25Å; Q542-H544 PolarHBondContact O-ND1 3.31Å
545	L	90.1	Very high	86.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123.7	175.9	-166.8	66	0	0	0	108.4	Y508 A509 F512 F525 M534 F536 I547	Y508-L545 CarbonylContact C-O 3.57Å; Y508-L545 WeakPolarHBondContact CA-O 3.5Å; A509-L545 PolarHBondContact N-O 3.19Å; A509-L545 PolarHBondContact O-N 3.04Å; F512-L545 HydrophobicContact CD2-CB 4.37Å; F512-L545 HydrophobicContact CE2-CB 3.61Å; F512-L545 HydrophobicContact CZ-CB 4.44Å; F525-L545 HydrophobicContact CD2-CD2 3.65Å; F525-L545 HydrophobicContact CE2-CD2 3.79Å; F525-L545 HydrophobicContact CG-CD2 4.38Å; M534-L545 HydrophobicContact CG-CD1 3.63Å; M534-L545 HydrophobicContact CG-CD2 3.99Å; M534-L545 HydrophobicContact CG-CG 3.86Å; M534-L545 HydrophobicContact SD-CD1 4.33Å; M534-L545 HydrophobicContact SD-CD2 3.8Å; M534-L545 HydrophobicContact SD-CG 4.35Å; F536-L545 HydrophobicContact CD1-CD1 4.41Å; F536-L545 HydrophobicContact CD2-CD1 3.72Å; F536-L545 HydrophobicContact CE1-CD1 4.25Å; F536-L545 HydrophobicContact CE2-CD1 3.48Å; F536-L545 VanDerWaalsContact CE2-CD1 3.48Å; F536-L545 HydrophobicContact CG-CD1 4.17Å; F536-L545 HydrophobicContact CZ-CD1 3.78Å; L545-I547 HydrophobicContact CB-CD1 4.02Å; L545-I547 HydrophobicContact CD2-CD1 3.85Å; L545-I547 HydrophobicContact CD2-CG1 3.88Å; L545-I547 HydrophobicContact CG-CD1 3.75Å; L545-I547 HydrophobicContact CG-CG1 3.85Å; L545-I547 WeakPolarHBondContact O-CD1 3.25Å
546	C	91.8	Very high	87.2	Confident	19 Å²	19	50.2 Å²	50.2	13%	0.128	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	119.7	169	177.8	0	0	0	0	108	T506 Y508 M534 T535 V537	T506-C546 VanDerWaalsContact CG2-SG 3.55Å; Y508-C546 HydrophobicContact CD1-CB 4.17Å; Y508-C546 HydrophobicContact CE1-CB 3.76Å; Y508-C546 HydrophobicContact CE2-CB 4.44Å; M534-C546 CarbonylContact C-O 3.55Å; M534-C546 VanDerWaalsContact CA-O 3.27Å; M534-C546 WeakPolarHBondContact CA-O 3.45Å; T535-C546 PolarHBondContact N-O 3.49Å; T535-C546 PolarHBondContact O-N 2.74Å; V537-C546 HydrophobicContact CG2-CB 4.19Å
547	I	94.4	Very high	87.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	120.8	-178.2	-50.3	95.6	0	0	0	108.9	T506 V507 A509 F525 V531 M534 L545 Y549	T506-I547 CarbonylContact C-O 3.58Å; T506-I547 VanDerWaalsContact CA-O 3.3Å; T506-I547 WeakPolarHBondContact CA-O 3.45Å; V507-I547 PolarHBondContact N-O 3Å; V507-I547 WeakPolarHBondContact O-CD1 3Å; V507-I547 PolarHBondContact O-N 3.44Å; A509-I547 HydrophobicContact CB-CD1 4.07Å; F525-I547 HydrophobicContact CB-CG1 4.31Å; F525-I547 HydrophobicContact CB-CG2 4.5Å; F525-I547 HydrophobicContact CD1-CD1 3.65Å; F525-I547 HydrophobicContact CD1-CG1 3.93Å; F525-I547 HydrophobicContact CD2-CD1 4.44Å; F525-I547 HydrophobicContact CE1-CD1 3.68Å; F525-I547 HydrophobicContact CE1-CG1 4.46Å; F525-I547 HydrophobicContact CE2-CD1 4.49Å; F525-I547 HydrophobicContact CG-CD1 4.07Å; F525-I547 HydrophobicContact CG-CG1 4.01Å; F525-I547 HydrophobicContact CZ-CD1 4.15Å; V531-I547 HydrophobicContact CG1-CG2 3.83Å; V531-I547 HydrophobicContact CG2-CG2 4.1Å; M534-I547 HydrophobicContact CG-CG1 4.02Å; M534-I547 HydrophobicContact SD-CG1 4.32Å; L545-I547 HydrophobicContact CB-CD1 4.02Å; L545-I547 HydrophobicContact CD2-CD1 3.85Å; L545-I547 HydrophobicContact CD2-CG1 3.88Å; L545-I547 HydrophobicContact CG-CD1 3.75Å; L545-I547 HydrophobicContact CG-CG1 3.85Å; L545-I547 WeakPolarHBondContact O-CD1 3.25Å; I547-Y549 HydrophobicContact CB-CE2 4.21Å; I547-Y549 HydrophobicContact CG2-CD2 4.09Å; I547-Y549 HydrophobicContact CG2-CE1 4.37Å; I547-Y549 HydrophobicContact CG2-CE2 3.68Å
548	Q	94.6	Very high	88.3	Confident	43 Å²	43	46.2 Å²	46.2	20%	0.201	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	114.9	173.4	-175.4	-176.8	-2.7	0	0	109.2	T502 Q532 S533	T502-Q548 HydrophobicContact CG2-CG 4.35Å; Q532-Q548 HydrophobicContact CB-CB 4.4Å; Q532-Q548 HydrophobicContact CB-CG 4.13Å; Q532-Q548 PolarHBondContact N-O 2.98Å; Q532-Q548 VanDerWaalsContact OE1-CD 3.3Å; S533-Q548 PolarHBondContact N-O 3.25Å; S533-Q548 PolarHBondContact O-N 2.95Å; S533-Q548 VanDerWaalsContact OG-CB 3.3Å; S533-Q548 WeakPolarHBondContact OG-CB 3.45Å; S533-Q548 PolarHBondContact OG-OE1 3.35Å
549	Y	93.7	Very high	89.2	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.008	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	153.9	176.3	-70.5	-85.2	0	0	0	111.6	S505 V507 F525 F528 V531 I547 V551 A554 A555 A558	S505-Y549 PolarHBondContact O-N 2.85Å; V507-Y549 HydrophobicContact CB-CE2 4.49Å; V507-Y549 HydrophobicContact CG2-CD2 4.28Å; V507-Y549 HydrophobicContact CG2-CE2 4.12Å; F525-Y549 PolarHBondContact O-OH 3.3Å; F525-Y549 VanDerWaalsContact O-OH 3.13Å; F528-Y549 HydrophobicContact CB-CE1 4.37Å; V531-Y549 HydrophobicContact CG2-CD1 3.96Å; V531-Y549 HydrophobicContact CG2-CE1 3.77Å; I547-Y549 HydrophobicContact CB-CE2 4.21Å; I547-Y549 HydrophobicContact CG2-CD2 4.09Å; I547-Y549 HydrophobicContact CG2-CE1 4.37Å; I547-Y549 HydrophobicContact CG2-CE2 3.68Å; Y549-V551 VanDerWaalsContact C-N 3.3Å; Y549-A554 HydrophobicContact CD1-CB 3.47Å; Y549-A554 VanDerWaalsContact CD1-CB 3.47Å; Y549-A554 HydrophobicContact CE1-CB 4.05Å; Y549-A554 HydrophobicContact CG-CB 3.86Å; Y549-A555 VanDerWaalsContact CD2-CA 3.49Å; Y549-A555 HydrophobicContact CD2-CB 3.73Å; Y549-A555 HydrophobicContact CE2-CB 4.48Å; Y549-A555 HydrophobicContact CG-CB 4.3Å; Y549-A558 HydrophobicContact CE2-CB 3.98Å; Y549-A558 WeakPolarHBondContact OH-CB 3.26Å
550	E	89	Confident	90.2	Very high	73 Å²	73	36.8 Å²	36.8	34%	0.341	17%	0.17	S	C	.	.	S	Bend	trans	-74.2	-22.4	173.1	-63.4	177	-165.7	0	0	113.1	P530 Q532 K640	P530-E550 HydrophobicContact CB-CB 4.22Å; P530-E550 HydrophobicContact CB-CG 4.01Å; P530-E550 HydrophobicContact CG-CB 3.87Å; P530-E550 HydrophobicContact CG-CG 4.23Å; P530-E550 PolarHBondContact O-N 3.42Å; Q532-E550 HydrophobicContact CG-CB 4.1Å; Q532-E550 HydrophobicContact CG-CG 3.28Å; E550-K640 IonicContact OE2-NZ 2.86Å; E550-K640 PolarHBondContact OE2-NZ 3.04Å
551	V	91.3	Very high	91.3	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.024	17%	0.168	C	C	.	.	S	Bend	trans	-132.6	138.5	-175.3	-63.7	0	0	0	0	110.1	P530 Y549 E553 A554 A555 Y603 Y642	P530-V551 HydrophobicContact CG-CG2 4.31Å; Y549-V551 VanDerWaalsContact C-N 3.3Å; V551-E553 PolarHBondContact O-N 3.09Å; V551-A554 HydrophobicContact CG2-CB 3.65Å; V551-A554 PolarHBondContact O-N 2.98Å; V551-A555 PolarHBondContact O-N 3.25Å; V551-Y603 HydrophobicContact CG2-CE2 3.86Å; V551-Y642 HydrophobicContact CG1-CE2 4.07Å
552	L	93.9	Very high	92.4	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-62.2	-33.6	-177.6	178.4	57.4	0	0	0	111.6	W501 I504 A554 A555 Q556 L592 L673 T674	W501-L552 HydrophobicContact CH2-CD2 4.18Å; W501-L552 HydrophobicContact CZ2-CD2 4.09Å; I504-L552 HydrophobicContact CB-CD1 4.17Å; I504-L552 HydrophobicContact CD1-CD1 4.1Å; I504-L552 HydrophobicContact CD1-CD2 3.84Å; I504-L552 HydrophobicContact CG1-CD1 3.92Å; I504-L552 WeakPolarHBondContact O-CD1 3.48Å; L552-A554 VanDerWaalsContact C-N 3.27Å; L552-A554 PolarHBondContact O-N 2.75Å; L552-A555 PolarHBondContact O-N 3.36Å; L552-Q556 PolarHBondContact O-N 3.49Å; L552-L592 HydrophobicContact CD2-CD1 4.18Å; L552-L673 HydrophobicContact CD2-CB 4.14Å; L552-L673 HydrophobicContact CD2-CD1 4.24Å; L552-L673 HydrophobicContact CG-CB 4.36Å; L552-L673 HydrophobicContact CG-CD1 3.86Å; L552-T674 HydrophobicContact CB-CG2 3.77Å; L552-T674 HydrophobicContact CD2-CG2 3.62Å; L552-T674 HydrophobicContact CG-CG2 4.25Å
553	E	95.1	Very high	93.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.5	-38.5	178.6	-66.7	81.9	-178	0	0	112.1	V551 L557 Y603 F644 R670 L673 T674 H679	V551-E553 PolarHBondContact O-N 3.09Å; E553-L557 WeakPolarHBondContact O-CB 3.44Å; E553-L557 PolarHBondContact O-N 3.31Å; E553-Y603 HydrophobicContact CB-CD1 3.7Å; E553-Y603 HydrophobicContact CB-CD2 3.96Å; E553-Y603 HydrophobicContact CB-CE1 4.23Å; E553-Y603 HydrophobicContact CB-CE2 4.46Å; E553-Y603 HydrophobicContact CB-CG 3.54Å; E553-Y603 HydrophobicContact CG-CD2 4.47Å; E553-Y603 HydrophobicContact CG-CG 4.1Å; E553-F644 HydrophobicContact CG-CE1 4.07Å; E553-R670 HydrophobicContact CB-CG 4.33Å; E553-R670 VanDerWaalsContact O-CD 3.22Å; E553-R670 WeakPolarHBondContact O-CD 3.21Å; E553-L673 HydrophobicContact CG-CB 4.25Å; E553-L673 HydrophobicContact CG-CG 4.45Å; E553-L673 PolarHBondContact OE1-N 2.97Å; E553-L673 VanDerWaalsContact OE1-N 3.1Å; E553-T674 PolarHBondContact OE1-N 3.14Å; E553-T674 PolarHBondContact OE1-OG1 3.37Å; E553-T674 PolarHBondContact OE2-OG1 3.49Å; E553-H679 IonicContact OE1-CE1 3.22Å; E553-H679 IonicContact OE1-NE2 2.75Å; E553-H679 PolarHBondContact OE1-NE2 3.14Å; E553-H679 IonicContact OE2-CE1 3.7Å; E553-H679 PolarHBondContact OE2-CE1 3.24Å; E553-H679 IonicContact OE2-NE2 3.69Å; E553-H679 PolarHBondContact OE2-NE2 3.36Å
554	A	95.5	Very high	93.6	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-70.7	-38.9	178	0	0	0	0	0	112.1	Y549 V551 L552 A558	Y549-A554 HydrophobicContact CD1-CB 3.47Å; Y549-A554 VanDerWaalsContact CD1-CB 3.47Å; Y549-A554 HydrophobicContact CE1-CB 4.05Å; Y549-A554 HydrophobicContact CG-CB 3.86Å; V551-A554 HydrophobicContact CG2-CB 3.65Å; V551-A554 PolarHBondContact O-N 2.98Å; L552-A554 VanDerWaalsContact C-N 3.27Å; L552-A554 PolarHBondContact O-N 2.75Å; A554-A558 WeakPolarHBondContact O-CB 3.36Å; A554-A558 PolarHBondContact O-N 2.8Å
555	A	95.8	Very high	93.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.9	-49.4	176.5	0	0	0	0	0	111.3	V507 Y549 V551 L552 A558 I559	V507-A555 HydrophobicContact CG2-CB 3.78Å; Y549-A555 VanDerWaalsContact CD2-CA 3.49Å; Y549-A555 HydrophobicContact CD2-CB 3.73Å; Y549-A555 HydrophobicContact CE2-CB 4.48Å; Y549-A555 HydrophobicContact CG-CB 4.3Å; V551-A555 PolarHBondContact O-N 3.25Å; L552-A555 PolarHBondContact O-N 3.36Å; A555-A558 PolarHBondContact O-N 3.45Å; A555-I559 WeakPolarHBondContact O-CG1 3.23Å; A555-I559 PolarHBondContact O-N 3.1Å; A555-I559 VanDerWaalsContact O-N 3.13Å
556	Q	96.5	Very high	93.7	Very high	24 Å²	24	32.1 Å²	32.1	11%	0.112	18%	0.178	C	C	.	.	H	α-helix	trans	-65.9	-42.5	178.2	-175.7	70.4	21.5	0	0	111.4	L552 A558 I559 E560 V589 L673	L552-Q556 PolarHBondContact O-N 3.49Å; Q556-A558 VanDerWaalsContact C-N 3.26Å; Q556-A558 PolarHBondContact O-N 2.91Å; Q556-I559 WeakPolarHBondContact O-CB 3.49Å; Q556-I559 PolarHBondContact O-N 3.46Å; Q556-I559 VanDerWaalsContact O-N 3.1Å; Q556-E560 HydrophobicContact CG-CG 4.43Å; Q556-E560 WeakPolarHBondContact CG-OE1 3.39Å; Q556-E560 PolarHBondContact NE2-OE1 3.29Å; Q556-E560 PolarHBondContact O-N 3.21Å; Q556-V589 HydrophobicContact CG-CG1 4.32Å; Q556-L673 HydrophobicContact CB-CD1 3.52Å; Q556-L673 HydrophobicContact CG-CD1 3.9Å
557	L	96.1	Very high	93.4	Very high	10 Å²	10	32.2 Å²	32.2	5%	0.052	18%	0.178	C	C	.	.	H	α-helix	trans	-60.4	-37.9	176.7	-178.3	63	0	0	0	111.8	F528 E553 S561 Y603 K668 R670	F528-L557 HydrophobicContact CD1-CD2 4.02Å; F528-L557 HydrophobicContact CD1-CG 3.82Å; F528-L557 HydrophobicContact CE1-CG 4.47Å; E553-L557 WeakPolarHBondContact O-CB 3.44Å; E553-L557 PolarHBondContact O-N 3.31Å; L557-S561 WeakPolarHBondContact O-CB 3.37Å; L557-S561 PolarHBondContact O-N 3.49Å; L557-S561 PolarHBondContact O-OG 3.39Å; L557-Y603 HydrophobicContact CD2-CE1 4.36Å; L557-K668 HydrophobicContact CD2-CB 4.02Å; L557-R670 HydrophobicContact CB-CG 4.35Å; L557-R670 HydrophobicContact CD1-CB 4.21Å
558	A	95.8	Very high	92.8	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.5	-38.1	175.4	0	0	0	0	0	112.3	F528 Y549 A554 A555 Q556 L562	F528-A558 HydrophobicContact CB-CB 4.29Å; F528-A558 HydrophobicContact CD2-CB 4.16Å; F528-A558 HydrophobicContact CG-CB 4.12Å; Y549-A558 HydrophobicContact CE2-CB 3.98Å; Y549-A558 WeakPolarHBondContact OH-CB 3.26Å; A554-A558 WeakPolarHBondContact O-CB 3.36Å; A554-A558 PolarHBondContact O-N 2.8Å; A555-A558 PolarHBondContact O-N 3.45Å; Q556-A558 VanDerWaalsContact C-N 3.26Å; Q556-A558 PolarHBondContact O-N 2.91Å; A558-L562 WeakPolarHBondContact O-CB 3.45Å; A558-L562 WeakPolarHBondContact O-CG 3.45Å; A558-L562 PolarHBondContact O-N 3.1Å
559	I	95.2	Very high	92.2	Very high	24 Å²	24	38.1 Å²	38.1	12%	0.123	23%	0.227	C	C	.	.	H	α-helix	trans	-63.6	-55.5	175	-69.3	162.7	0	0	0	110	V507 A555 Q556 S561 L562 D563 V574 R576	V507-I559 HydrophobicContact CG1-CD1 4.48Å; V507-I559 HydrophobicContact CG1-CG1 3.89Å; V507-I559 HydrophobicContact CG2-CD1 3.99Å; V507-I559 HydrophobicContact CG2-CG1 4.04Å; A555-I559 WeakPolarHBondContact O-CG1 3.23Å; A555-I559 PolarHBondContact O-N 3.1Å; A555-I559 VanDerWaalsContact O-N 3.13Å; Q556-I559 WeakPolarHBondContact O-CB 3.49Å; Q556-I559 PolarHBondContact O-N 3.46Å; Q556-I559 VanDerWaalsContact O-N 3.1Å; I559-S561 PolarHBondContact O-N 3.44Å; I559-L562 PolarHBondContact O-N 3.45Å; I559-D563 VanDerWaalsContact O-CB 3.23Å; I559-D563 WeakPolarHBondContact O-CB 3.48Å; I559-D563 PolarHBondContact O-N 3.49Å; I559-V574 HydrophobicContact CG1-CG1 4.03Å; I559-R576 HydrophobicContact CD1-CG 3.7Å; I559-R576 VanDerWaalsContact CD1-NH1 3.29Å
560	E	94.9	Very high	91.7	Very high	98 Å²	98	40 Å²	40	46%	0.458	24%	0.238	S	C	.	.	H	α-helix	trans	-60.1	-31.3	-178.8	-71.4	164.7	-172.4	0	0	113.3	Q556 R670	Q556-E560 HydrophobicContact CG-CG 4.43Å; Q556-E560 WeakPolarHBondContact CG-OE1 3.39Å; Q556-E560 PolarHBondContact NE2-OE1 3.29Å; Q556-E560 PolarHBondContact O-N 3.21Å; E560-R670 IonicContact OE1-CZ 3.85Å; E560-R670 IonicContact OE1-NH1 3.61Å; E560-R670 PolarHBondContact OE1-NH1 2.89Å; E560-R670 IonicContact OE1-NH2 3.11Å; E560-R670 PolarHBondContact OE1-NH2 3.34Å; E560-R670 IonicContact OE2-CZ 3.88Å; E560-R670 IonicContact OE2-NH1 3.74Å; E560-R670 PolarHBondContact OE2-NH1 3.5Å
561	S	94.4	Very high	91.8	Very high	45 Å²	45	40 Å²	40	32%	0.315	25%	0.246	S	C	.	.	H	α-helix	trans	-94.2	-16.4	-175.6	-58.7	0	0	0	0	114.5	F528 L557 I559 I565	F528-S561 WeakPolarHBondContact CE1-OG 3.31Å; L557-S561 WeakPolarHBondContact O-CB 3.37Å; L557-S561 PolarHBondContact O-N 3.49Å; L557-S561 PolarHBondContact O-OG 3.39Å; I559-S561 PolarHBondContact O-N 3.44Å; S561-I565 WeakPolarHBondContact O-CD1 3.35Å
562	L	94.7	Very high	91.8	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-125.2	-19.5	-172	-62.2	178.5	0	0	0	114	L524 F525 F528 A558 I559 G564 I565 I572 V574	L524-L562 HydrophobicContact CD1-CD2 4.03Å; L524-L562 HydrophobicContact CD2-CD2 4.01Å; L524-L562 HydrophobicContact CG-CD1 4.44Å; L524-L562 HydrophobicContact CG-CD2 4.11Å; F525-L562 HydrophobicContact CD1-CD1 3.81Å; F525-L562 HydrophobicContact CE1-CD1 3.32Å; F525-L562 HydrophobicContact CE2-CD1 4.48Å; F525-L562 HydrophobicContact CZ-CD1 3.69Å; F528-L562 HydrophobicContact CD2-CD1 4.34Å; F528-L562 HydrophobicContact CE2-CD1 3.58Å; F528-L562 HydrophobicContact CE2-CD2 3.9Å; F528-L562 HydrophobicContact CE2-CG 3.75Å; F528-L562 HydrophobicContact CZ-CD1 4.07Å; F528-L562 HydrophobicContact CZ-CD2 3.72Å; F528-L562 HydrophobicContact CZ-CG 3.68Å; A558-L562 WeakPolarHBondContact O-CB 3.45Å; A558-L562 WeakPolarHBondContact O-CG 3.45Å; A558-L562 PolarHBondContact O-N 3.1Å; I559-L562 PolarHBondContact O-N 3.45Å; L562-G564 PolarHBondContact O-N 3.12Å; L562-I565 WeakPolarHBondContact O-CB 3.47Å; L562-I565 PolarHBondContact O-N 3.41Å; L562-I565 VanDerWaalsContact O-N 3.11Å; L562-I572 HydrophobicContact CB-CD1 4.36Å; L562-V574 HydrophobicContact CB-CB 4.4Å; L562-V574 HydrophobicContact CB-CG2 3.74Å
563	D	94.6	Very high	91.8	Very high	81 Å²	81	45.5 Å²	45.5	43%	0.433	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	126.2	177.2	-167.5	48	0	0	0	110	I559 I565 K573 V574	I559-D563 VanDerWaalsContact O-CB 3.23Å; I559-D563 WeakPolarHBondContact O-CB 3.48Å; I559-D563 PolarHBondContact O-N 3.49Å; D563-I565 VanDerWaalsContact C-N 3.33Å; D563-I565 PolarHBondContact O-N 2.91Å; D563-K573 WeakPolarHBondContact OD1-CA 3.49Å; D563-K573 WeakPolarHBondContact OD1-CG 3.42Å; D563-V574 HydrophobicContact CB-CB 4.11Å; D563-V574 PolarHBondContact OD1-N 2.87Å
564	G	90.6	Very high	91.7	Very high	46 Å²	46	45.5 Å²	45.5	47%	0.474	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	2.1	-177.5	0	0	0	0	0	115.6	L562 C571 I572	L562-G564 PolarHBondContact O-N 3.12Å; G564-C571 VanDerWaalsContact C-SG 3.55Å; G564-C571 VanDerWaalsContact CA-SG 3.57Å; G564-C571 PolarHBondContact O-SG 3.1Å; G564-C571 VanDerWaalsContact O-SG 3.34Å; G564-I572 PolarHBondContact N-O 2.98Å
565	I	91.9	Very high	91.6	Very high	77 Å²	77	49.5 Å²	49.5	40%	0.395	29%	0.288	S	S	.	.			trans	-79.5	144.1	178.9	-67.1	-161.1	0	0	0	111.9	S561 L562 D563 V567 I572	S561-I565 WeakPolarHBondContact O-CD1 3.35Å; L562-I565 WeakPolarHBondContact O-CB 3.47Å; L562-I565 PolarHBondContact O-N 3.41Å; L562-I565 VanDerWaalsContact O-N 3.11Å; D563-I565 VanDerWaalsContact C-N 3.33Å; D563-I565 PolarHBondContact O-N 2.91Å; I565-V567 HydrophobicContact CG2-CG2 4.38Å; I565-V567 PolarHBondContact O-N 2.82Å; I565-I572 WeakPolarHBondContact O-CG1 2.98Å; I565-I572 PolarHBondContact O-N 2.84Å
566	L	88.6	Confident	91.4	Very high	123 Å²	123	51 Å²	51	64%	0.644	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	116	170	-77.2	158.8	0	0	0	111.3	T570	L566-T570 WeakPolarHBondContact CA-O 3.47Å
567	V	85.8	Confident	91	Very high	21 Å²	21	50.8 Å²	50.8	13%	0.127	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	120.2	170.9	-178.2	0	0	0	0	108.5	F512 L521 L524 I565 G569 T570 I572	F512-V567 HydrophobicContact CE1-CG1 4.47Å; L521-V567 HydrophobicContact CD2-CG1 3.9Å; L524-V567 HydrophobicContact CD2-CG2 4.43Å; I565-V567 HydrophobicContact CG2-CG2 4.38Å; I565-V567 PolarHBondContact O-N 2.82Å; V567-G569 PolarHBondContact O-N 3.25Å; V567-T570 PolarHBondContact N-O 3.06Å; V567-T570 PolarHBondContact O-N 2.85Å; V567-I572 HydrophobicContact CB-CG2 4.07Å; V567-I572 HydrophobicContact CG2-CD1 3.77Å; V567-I572 HydrophobicContact CG2-CG1 4.11Å; V567-I572 HydrophobicContact CG2-CG2 4.24Å
568	D	81.9	Confident	90.5	Very high	99 Å²	99	56 Å²	56	53%	0.529	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	41.4	-175	-62.7	-18.2	0	0	0	112.9	C516 T570	C516-D568 PolarHBondContact SG-OD2 3.01Å; D568-T570 VanDerWaalsContact C-N 3.26Å; D568-T570 PolarHBondContact O-N 3.12Å
569	G	80.4	Confident	89.8	Confident	68 Å²	68	58 Å²	58	70%	0.701	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	2.2	179.1	0	0	0	0	0	115.4	V567	V567-G569 PolarHBondContact O-N 3.25Å
570	T	84.6	Confident	89	Confident	40 Å²	40	63 Å²	63	25%	0.245	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.9	176.5	-52.5	0	0	0	0	110	P511 L566 V567 D568 I572	P511-T570 HydrophobicContact CG-CG2 4.3Å; P511-T570 WeakPolarHBondContact O-CG2 3.43Å; L566-T570 WeakPolarHBondContact CA-O 3.47Å; V567-T570 PolarHBondContact N-O 3.06Å; V567-T570 PolarHBondContact O-N 2.85Å; D568-T570 VanDerWaalsContact C-N 3.26Å; D568-T570 PolarHBondContact O-N 3.12Å; T570-I572 PolarHBondContact O-N 2.97Å
571	C	89.4	Confident	88.2	Confident	74 Å²	74	60 Å²	60	50%	0.5	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	118.6	171.4	-175	0	0	0	0	108.8	G564	G564-C571 VanDerWaalsContact C-SG 3.55Å; G564-C571 VanDerWaalsContact CA-SG 3.57Å; G564-C571 PolarHBondContact O-SG 3.1Å; G564-C571 VanDerWaalsContact O-SG 3.34Å
572	I	92.1	Very high	87.5	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-92.7	139	179	65.7	166.8	0	0	0	110.1	F512 F525 L562 G564 I565 V567 T570 V574	F512-I572 HydrophobicContact CD1-CG2 3.94Å; F512-I572 HydrophobicContact CE1-CD1 4.17Å; F512-I572 HydrophobicContact CE1-CG2 3.68Å; F512-I572 HydrophobicContact CZ-CD1 4.38Å; F512-I572 HydrophobicContact CZ-CG2 4.41Å; F525-I572 HydrophobicContact CZ-CD1 4.49Å; L562-I572 HydrophobicContact CB-CD1 4.36Å; G564-I572 PolarHBondContact N-O 2.98Å; I565-I572 WeakPolarHBondContact O-CG1 2.98Å; I565-I572 PolarHBondContact O-N 2.84Å; V567-I572 HydrophobicContact CB-CG2 4.07Å; V567-I572 HydrophobicContact CG2-CD1 3.77Å; V567-I572 HydrophobicContact CG2-CG1 4.11Å; V567-I572 HydrophobicContact CG2-CG2 4.24Å; T570-I572 PolarHBondContact O-N 2.97Å; I572-V574 HydrophobicContact CD1-CG2 3.75Å; I572-V574 HydrophobicContact CG1-CG2 4.02Å
573	K	93	Very high	87	Confident	119 Å²	119	63.9 Å²	63.9	52%	0.517	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	133.2	166.5	-166.3	175.6	-168.4	-164.5	0	109	A509 G510 D563	A509-K573 CarbonylContact C-O 3.55Å; A509-K573 VanDerWaalsContact CA-O 3.31Å; A509-K573 WeakPolarHBondContact CA-O 3.34Å; G510-K573 PolarHBondContact N-O 3.14Å; G510-K573 WeakPolarHBondContact O-CA 3.44Å; G510-K573 WeakPolarHBondContact O-CB 3.25Å; G510-K573 PolarHBondContact O-N 3.34Å; G510-K573 VanDerWaalsContact O-O 3.07Å; D563-K573 WeakPolarHBondContact OD1-CA 3.49Å; D563-K573 WeakPolarHBondContact OD1-CG 3.42Å
574	V	94.9	Very high	86.6	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.006	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	106.8	-177.8	-174.5	0	0	0	0	108.1	V507 Y508 A509 I559 L562 D563 I572	V507-V574 HydrophobicContact CG1-CB 4.5Å; V507-V574 HydrophobicContact CG1-CG1 3.19Å; Y508-V574 WeakPolarHBondContact O-CA 3.37Å; A509-V574 HydrophobicContact CB-CG1 4.46Å; A509-V574 HydrophobicContact CB-CG2 3.94Å; I559-V574 HydrophobicContact CG1-CG1 4.03Å; L562-V574 HydrophobicContact CB-CB 4.4Å; L562-V574 HydrophobicContact CB-CG2 3.74Å; D563-V574 HydrophobicContact CB-CB 4.11Å; D563-V574 PolarHBondContact OD1-N 2.87Å; I572-V574 HydrophobicContact CD1-CG2 3.75Å; I572-V574 HydrophobicContact CG1-CG2 4.02Å
575	Q	93.1	Very high	86.5	Confident	84 Å²	84	61.8 Å²	61.8	39%	0.393	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	162.9	-172.3	64.5	178.8	28.7	0	0	111.7	Y508	Y508-Q575 PolarHBondContact N-O 2.82Å; Y508-Q575 PolarHBondContact O-N 3.25Å
576	R	91.1	Very high	86.4	Confident	30 Å²	30	65.3 Å²	65.3	11%	0.113	36%	0.359	C	S	.	.			trans	-76.6	157.6	172.5	-72.3	-171.8	176.6	79.6	3.4	111.9	I504 I559	I504-R576 PolarHBondContact O-NE 2.95Å; I559-R576 HydrophobicContact CD1-CG 3.7Å; I559-R576 VanDerWaalsContact CD1-NH1 3.29Å
577	P	87	Confident	86.5	Confident	21 Å²	21	63 Å²	63	14%	0.136	35%	0.35	C	S	.	.			trans	-62.1	136	166.1	26.4	-32.5	0	0	0	110.6	E503 T506 Y508 T579 T582	E503-P577 HydrophobicContact CB-CG 4.14Å; E503-P577 WeakPolarHBondContact O-CG 3.17Å; T506-P577 WeakPolarHBondContact O-CD 3.06Å; Y508-P577 HydrophobicContact CD2-CB 4.16Å; Y508-P577 HydrophobicContact CE2-CB 3.85Å; Y508-P577 HydrophobicContact CE2-CG 4.3Å; P577-T579 HydrophobicContact CB-CG2 4.32Å; P577-T582 PolarHBondContact O-OG1 3.08Å
578	V	85.6	Confident	86.8	Confident	120 Å²	120	62.4 Å²	62.4	73%	0.727	35%	0.346	S	S	*	.			trans	-97.5	109.6	173.1	-175.9	0	0	0	0	108.2	L583	V578-L583 HydrophobicContact CG1-CD2 4.39Å
579	T	81.9	Confident	87.3	Confident	40 Å²	40	57.8 Å²	57.8	25%	0.245	32%	0.322	C	S	.	.			trans	-131.4	170.1	179.1	76.6	0	0	0	0	109	E503 P577 L581 T582 L583	E503-T579 WeakPolarHBondContact OE2-CB 3.42Å; E503-T579 WeakPolarHBondContact OE2-CG2 3.24Å; E503-T579 PolarHBondContact OE2-OG1 3.36Å; P577-T579 HydrophobicContact CB-CG2 4.32Å; T579-L581 PolarHBondContact O-N 3.18Å; T579-L581 VanDerWaalsContact O-N 3.15Å; T579-L581 PolarHBondContact OG1-N 2.99Å; T579-T582 PolarHBondContact N-OG1 3.28Å; T579-T582 PolarHBondContact O-N 3.24Å; T579-T582 VanDerWaalsContact O-N 3.09Å; T579-T582 PolarHBondContact O-OG1 2.93Å; T579-T582 PolarHBondContact OG1-N 3.06Å; T579-T582 PolarHBondContact OG1-OG1 3.38Å; T579-L583 PolarHBondContact O-N 3.47Å
580	E	78.9	Confident	87.8	Confident	130 Å²	130	59.5 Å²	59.5	61%	0.607	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-30.4	172.9	-173.8	-177.5	166.5	0	0	112.3	K711	E580-K711 IonicContact OE1-NZ 3.96Å
581	L	76.7	Confident	88.2	Confident	34 Å²	34	60.1 Å²	60.1	18%	0.178	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-17	-178.3	-62.8	177.3	0	0	0	113.3	I499 K500 T579	I499-L581 HydrophobicContact CB-CD1 4.13Å; I499-L581 HydrophobicContact CG2-CD1 3.72Å; K500-L581 HydrophobicContact CB-CB 4.26Å; K500-L581 WeakPolarHBondContact CE-O 3.47Å; K500-L581 HydrophobicContact CG-CB 4.41Å; T579-L581 PolarHBondContact O-N 3.18Å; T579-L581 VanDerWaalsContact O-N 3.15Å; T579-L581 PolarHBondContact OG1-N 2.99Å
582	T	81.1	Confident	88.3	Confident	9 Å²	9	56.7 Å²	56.7	6%	0.055	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	8.3	-174.9	62.7	0	0	0	0	115.2	E503 I504 P577 T579 D584 C585	E503-T582 HydrophobicContact CB-CG2 3.66Å; E503-T582 WeakPolarHBondContact OE2-CG2 3.07Å; I504-T582 HydrophobicContact CG2-CG2 4.22Å; P577-T582 PolarHBondContact O-OG1 3.08Å; T579-T582 PolarHBondContact N-OG1 3.28Å; T579-T582 PolarHBondContact O-N 3.24Å; T579-T582 VanDerWaalsContact O-N 3.09Å; T579-T582 PolarHBondContact O-OG1 2.93Å; T579-T582 PolarHBondContact OG1-N 3.06Å; T579-T582 PolarHBondContact OG1-OG1 3.38Å; T582-D584 VanDerWaalsContact C-N 3.29Å; T582-D584 PolarHBondContact O-N 3.43Å; T582-C585 WeakPolarHBondContact CA-SG 3.46Å; T582-C585 WeakPolarHBondContact CB-SG 3.22Å; T582-C585 VanDerWaalsContact CG2-SG 3.58Å; T582-C585 WeakPolarHBondContact O-CB 3.32Å; T582-C585 PolarHBondContact O-N 2.98Å; T582-C585 VanDerWaalsContact O-N 3.08Å; T582-C585 PolarHBondContact O-SG 3.34Å
583	L	84.4	Confident	88.2	Confident	124 Å²	124	59.4 Å²	59.4	65%	0.649	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-43.2	177.2	-66.5	175	0	0	0	112.8	V578 T579 C585	V578-L583 HydrophobicContact CG1-CD2 4.39Å; T579-L583 PolarHBondContact O-N 3.47Å; L583-C585 VanDerWaalsContact C-N 3.27Å; L583-C585 PolarHBondContact O-N 2.76Å
584	D	85.1	Confident	88	Confident	76 Å²	76	55.5 Å²	55.5	41%	0.406	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	17.6	-178.7	-55.5	-30.7	0	0	0	112.7	L115 T582 T587 L588	L115-D584 HydrophobicContact CD1-CB 3.97Å; T582-D584 VanDerWaalsContact C-N 3.29Å; T582-D584 PolarHBondContact O-N 3.43Å; D584-T587 PolarHBondContact O-N 3.09Å; D584-L588 WeakPolarHBondContact O-CB 3.37Å; D584-L588 PolarHBondContact O-N 3.03Å
585	C	88.4	Confident	87.7	Confident	6 Å²	6	55.6 Å²	55.6	4%	0.041	30%	0.298	C	S	.	.	H	α-helix	trans	-65.8	-43	-169.4	-88.1	0	0	0	0	114.7	I504 T582 L583 T587 L588 V589	I504-C585 WeakPolarHBondContact CG2-SG 3.48Å; T582-C585 WeakPolarHBondContact CA-SG 3.46Å; T582-C585 WeakPolarHBondContact CB-SG 3.22Å; T582-C585 VanDerWaalsContact CG2-SG 3.58Å; T582-C585 WeakPolarHBondContact O-CB 3.32Å; T582-C585 PolarHBondContact O-N 2.98Å; T582-C585 VanDerWaalsContact O-N 3.08Å; T582-C585 PolarHBondContact O-SG 3.34Å; L583-C585 VanDerWaalsContact C-N 3.27Å; L583-C585 PolarHBondContact O-N 2.76Å; C585-T587 VanDerWaalsContact C-N 3.34Å; C585-L588 PolarHBondContact O-N 2.91Å; C585-V589 WeakPolarHBondContact O-CB 3.1Å; C585-V589 VanDerWaalsContact O-CG2 3.31Å; C585-V589 WeakPolarHBondContact O-CG2 3.21Å; C585-V589 PolarHBondContact O-N 2.67Å
586	E	89.6	Confident	87.2	Confident	151 Å²	151	52.9 Å²	52.9	71%	0.706	29%	0.288	S	S	*	.	H	α-helix	trans	-62.5	-46.7	179.1	-67	-178	173.7	0	0	110.2	L588 V589 N590	E586-L588 VanDerWaalsContact C-N 3.31Å; E586-L588 PolarHBondContact O-N 3.34Å; E586-V589 PolarHBondContact O-N 2.93Å; E586-N590 WeakPolarHBondContact O-CB 3.13Å; E586-N590 PolarHBondContact O-N 2.77Å; E586-N590 PolarHBondContact O-ND2 3.03Å; E586-N590 PolarHBondContact O-OD1 2.79Å
587	T	92.1	Very high	86.8	Confident	76 Å²	76	52.3 Å²	52.3	47%	0.466	29%	0.287	S	S	.	.	H	α-helix	trans	-57	-44.3	173.5	-50.2	0	0	0	0	111.8	L115 D584 C585 N590 E591	L115-T587 HydrophobicContact CD1-CG2 4.3Å; L115-T587 HydrophobicContact CD2-CG2 4.17Å; D584-T587 PolarHBondContact O-N 3.09Å; C585-T587 VanDerWaalsContact C-N 3.34Å; T587-N590 PolarHBondContact O-N 3.27Å; T587-E591 WeakPolarHBondContact O-CB 3.48Å; T587-E591 VanDerWaalsContact O-CG 3.31Å; T587-E591 WeakPolarHBondContact O-CG 3.15Å; T587-E591 PolarHBondContact O-N 2.79Å
588	L	91.5	Very high	86.9	Confident	8 Å²	8	51.4 Å²	51.4	4%	0.042	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-45.5	177.7	177.6	62.6	0	0	0	112.2	Y114 L115 D584 C585 E586 E591 L592	Y114-L588 HydrophobicContact CD1-CD1 3.43Å; Y114-L588 VanDerWaalsContact CD1-CD1 3.43Å; Y114-L588 HydrophobicContact CE1-CD1 4.02Å; Y114-L588 HydrophobicContact CG-CD1 4.18Å; L115-L588 HydrophobicContact CD2-CD1 4.42Å; D584-L588 WeakPolarHBondContact O-CB 3.37Å; D584-L588 PolarHBondContact O-N 3.03Å; C585-L588 PolarHBondContact O-N 2.91Å; E586-L588 VanDerWaalsContact C-N 3.31Å; E586-L588 PolarHBondContact O-N 3.34Å; L588-E591 PolarHBondContact O-N 3.38Å; L588-L592 HydrophobicContact CD1-CD1 4.05Å; L588-L592 HydrophobicContact CD1-CG 4.19Å; L588-L592 HydrophobicContact CG-CD1 3.89Å; L588-L592 HydrophobicContact CG-CG 4.47Å; L588-L592 WeakPolarHBondContact O-CB 3.35Å; L588-L592 VanDerWaalsContact O-CG 3.26Å; L588-L592 WeakPolarHBondContact O-CG 3.04Å; L588-L592 PolarHBondContact O-N 2.94Å
589	V	92.1	Very high	86.8	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.012	27%	0.265	C	S	.	.	H	α-helix	trans	-62.9	-44.3	178.8	169.5	0	0	0	0	110.4	Q556 C585 E586 L592 E593 L673	Q556-V589 HydrophobicContact CG-CG1 4.32Å; C585-V589 WeakPolarHBondContact O-CB 3.1Å; C585-V589 VanDerWaalsContact O-CG2 3.31Å; C585-V589 WeakPolarHBondContact O-CG2 3.21Å; C585-V589 PolarHBondContact O-N 2.67Å; E586-V589 PolarHBondContact O-N 2.93Å; V589-L592 WeakPolarHBondContact O-CB 3.22Å; V589-L592 PolarHBondContact O-N 3.26Å; V589-E593 WeakPolarHBondContact O-CB 3.25Å; V589-E593 PolarHBondContact O-N 2.62Å; V589-L673 HydrophobicContact CG1-CD1 4.07Å; V589-L673 HydrophobicContact CG1-CD2 4.04Å
590	N	91.6	Very high	87	Confident	103 Å²	103	47.9 Å²	47.9	55%	0.551	26%	0.255	S	S	*	.	H	α-helix	trans	-64	-43.4	178.2	-66.5	-14.8	0	0	0	111.8	E586 T587 L592 E593 G594	E586-N590 WeakPolarHBondContact O-CB 3.13Å; E586-N590 PolarHBondContact O-N 2.77Å; E586-N590 PolarHBondContact O-ND2 3.03Å; E586-N590 PolarHBondContact O-OD1 2.79Å; T587-N590 PolarHBondContact O-N 3.27Å; N590-L592 VanDerWaalsContact C-N 3.32Å; N590-L592 PolarHBondContact O-N 3.01Å; N590-E593 PolarHBondContact O-N 2.9Å; N590-G594 PolarHBondContact O-N 3.1Å
591	E	92.5	Very high	87.5	Confident	54 Å²	54	42.1 Å²	42.1	25%	0.252	23%	0.229	S	C	.	.	H	α-helix	trans	-71.9	-26.6	178.3	-74	-70.1	170.7	0	0	113.1	Y114 L115 R121 K122 T587 L588 D595	Y114-E591 HydrophobicContact CE1-CB 4.49Å; L115-E591 HydrophobicContact CD2-CB 4.12Å; L115-E591 HydrophobicContact CD2-CG 4.05Å; R121-E591 IonicContact CZ-OE2 3.67Å; R121-E591 PolarHBondContact NH1-O 3.3Å; R121-E591 IonicContact NH1-OE2 3.63Å; R121-E591 PolarHBondContact NH1-OE2 3.05Å; R121-E591 IonicContact NH2-OE2 2.85Å; R121-E591 PolarHBondContact NH2-OE2 3.42Å; K122-E591 WeakPolarHBondContact CE-OE2 3.21Å; K122-E591 IonicContact NZ-OE1 3.42Å; K122-E591 PolarHBondContact NZ-OE1 3.06Å; K122-E591 IonicContact NZ-OE2 3.98Å; K122-E591 PolarHBondContact NZ-OE2 3.19Å; T587-E591 WeakPolarHBondContact O-CB 3.48Å; T587-E591 VanDerWaalsContact O-CG 3.31Å; T587-E591 WeakPolarHBondContact O-CG 3.15Å; T587-E591 PolarHBondContact O-N 2.79Å; L588-E591 PolarHBondContact O-N 3.38Å; E591-D595 PolarHBondContact O-N 2.81Å
592	L	92.2	Very high	88.3	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-71.3	-47.1	170.5	-86.6	169.6	0	0	0	111	Y114 W501 L552 L588 V589 N590 G594 D595 N598 L673 L678	Y114-L592 HydrophobicContact CE1-CD2 3.83Å; Y114-L592 HydrophobicContact CE1-CG 3.85Å; Y114-L592 HydrophobicContact CE2-CD2 4.28Å; Y114-L592 WeakPolarHBondContact OH-CD2 3.42Å; W501-L592 HydrophobicContact CH2-CD1 3.9Å; W501-L592 HydrophobicContact CZ3-CD1 4.44Å; L552-L592 HydrophobicContact CD2-CD1 4.18Å; L588-L592 HydrophobicContact CD1-CD1 4.05Å; L588-L592 HydrophobicContact CD1-CG 4.19Å; L588-L592 HydrophobicContact CG-CD1 3.89Å; L588-L592 HydrophobicContact CG-CG 4.47Å; L588-L592 WeakPolarHBondContact O-CB 3.35Å; L588-L592 VanDerWaalsContact O-CG 3.26Å; L588-L592 WeakPolarHBondContact O-CG 3.04Å; L588-L592 PolarHBondContact O-N 2.94Å; V589-L592 WeakPolarHBondContact O-CB 3.22Å; V589-L592 PolarHBondContact O-N 3.26Å; N590-L592 VanDerWaalsContact C-N 3.32Å; N590-L592 PolarHBondContact O-N 3.01Å; L592-G594 VanDerWaalsContact C-N 3.29Å; L592-G594 PolarHBondContact O-N 3.22Å; L592-D595 VanDerWaalsContact O-CB 3.22Å; L592-D595 WeakPolarHBondContact O-CB 3.48Å; L592-D595 PolarHBondContact O-N 2.74Å; L592-N598 PolarHBondContact O-ND2 2.92Å; L592-L673 WeakPolarHBondContact CB-O 3.3Å; L592-L673 WeakPolarHBondContact CD2-O 3.39Å; L592-L678 HydrophobicContact CD2-CD2 4.46Å
593	E	90.4	Very high	89	Confident	58 Å²	58	40 Å²	40	27%	0.271	22%	0.218	S	C	.	.	H	α-helix	trans	-58.9	-42	176.5	-172.3	152.7	-138.2	0	0	112	V589 N590 D595 R670 L673	V589-E593 WeakPolarHBondContact O-CB 3.25Å; V589-E593 PolarHBondContact O-N 2.62Å; N590-E593 PolarHBondContact O-N 2.9Å; E593-D595 VanDerWaalsContact C-N 3.27Å; E593-D595 PolarHBondContact O-N 2.65Å; E593-R670 IonicContact OE1-CZ 3.45Å; E593-R670 IonicContact OE1-NH2 2.69Å; E593-R670 PolarHBondContact OE1-NH2 3.5Å; E593-R670 IonicContact OE2-NH2 2.82Å; E593-R670 PolarHBondContact OE2-NH2 2.91Å; E593-L673 HydrophobicContact CB-CD2 3.58Å; E593-L673 HydrophobicContact CG-CD2 4.07Å
594	G	87.8	Confident	89.4	Confident	38 Å²	38	34.1 Å²	34.1	39%	0.392	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-3.6	175.8	0	0	0	0	0	115.2	N590 L592 Q599	N590-G594 PolarHBondContact O-N 3.1Å; L592-G594 VanDerWaalsContact C-N 3.29Å; L592-G594 PolarHBondContact O-N 3.22Å; G594-Q599 PolarHBondContact O-NE2 3.01Å
595	D	88.6	Confident	89.8	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.011	17%	0.173	C	C	.	.	S	Bend	trans	-65.6	135.7	178.2	-164.2	-60.7	0	0	0	110.3	Y114 R121 K127 E591 L592 E593 E597 N598 Q599	Y114-D595 PolarHBondContact OH-OD2 3.25Å; R121-D595 WeakPolarHBondContact CD-OD2 3.18Å; R121-D595 WeakPolarHBondContact CG-OD2 3.44Å; K127-D595 IonicContact NZ-OD1 2.66Å; K127-D595 PolarHBondContact NZ-OD1 2.89Å; K127-D595 IonicContact NZ-OD2 2.71Å; E591-D595 PolarHBondContact O-N 2.81Å; L592-D595 VanDerWaalsContact O-CB 3.22Å; L592-D595 WeakPolarHBondContact O-CB 3.48Å; L592-D595 PolarHBondContact O-N 2.74Å; E593-D595 VanDerWaalsContact C-N 3.27Å; E593-D595 PolarHBondContact O-N 2.65Å; D595-E597 PolarHBondContact O-N 3Å; D595-E597 VanDerWaalsContact O-N 3.14Å; D595-E597 PolarHBondContact OD1-N 3.1Å; D595-N598 HydrophobicContact CB-CB 4.5Å; D595-N598 WeakPolarHBondContact O-CA 3.33Å; D595-N598 WeakPolarHBondContact O-CB 3.42Å; D595-N598 PolarHBondContact O-N 3.01Å; D595-Q599 WeakPolarHBondContact O-CG 3.07Å; D595-Q599 PolarHBondContact O-N 3.18Å
596	S	83.4	Confident	89.7	Confident	27 Å²	27	33.6 Å²	33.6	19%	0.189	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-27	-178.4	47.2	0	0	0	0	113.7	R125 N598	R125-S596 WeakPolarHBondContact CA-OG 3.39Å; S596-N598 VanDerWaalsContact C-N 3.26Å; S596-N598 PolarHBondContact O-N 3.36Å
597	E	82.9	Confident	89.5	Confident	18 Å²	18	26.7 Å²	26.7	8%	0.084	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-29.9	172	-79.4	-72.3	102.8	0	0	112.5	R125 K127 D595 S601 K646 P675 H677	R125-E597 WeakPolarHBondContact O-CG 3.36Å; R125-E597 VanDerWaalsContact O-OE1 3.05Å; K127-E597 HydrophobicContact CB-CG 4.25Å; K127-E597 HydrophobicContact CD-CG 4.13Å; K127-E597 HydrophobicContact CG-CG 4.18Å; D595-E597 PolarHBondContact O-N 3Å; D595-E597 VanDerWaalsContact O-N 3.14Å; D595-E597 PolarHBondContact OD1-N 3.1Å; E597-S601 PolarHBondContact O-OG 3.42Å; E597-K646 PolarHBondContact O-NZ 3.49Å; E597-P675 HydrophobicContact CB-CB 4.09Å; E597-P675 HydrophobicContact CB-CG 4.17Å; E597-H677 IonicContact OE2-ND1 2.72Å
598	N	87.9	Confident	89.1	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.011	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	-30.8	-172.7	-71.7	-29.2	0	0	0	113.9	L592 D595 S596 G600 S601 A672 L673 P675	L592-N598 PolarHBondContact O-ND2 2.92Å; D595-N598 HydrophobicContact CB-CB 4.5Å; D595-N598 WeakPolarHBondContact O-CA 3.33Å; D595-N598 WeakPolarHBondContact O-CB 3.42Å; D595-N598 PolarHBondContact O-N 3.01Å; S596-N598 VanDerWaalsContact C-N 3.26Å; S596-N598 PolarHBondContact O-N 3.36Å; N598-G600 PolarHBondContact O-N 3.42Å; N598-S601 WeakPolarHBondContact O-CA 3.29Å; N598-S601 WeakPolarHBondContact O-CB 3.47Å; N598-S601 PolarHBondContact O-N 2.62Å; N598-A672 WeakPolarHBondContact CB-O 3.21Å; N598-L673 VanDerWaalsContact ND2-C 3.26Å; N598-L673 PolarHBondContact ND2-O 3.08Å; N598-P675 WeakPolarHBondContact OD1-CA 3.49Å
599	Q	83	Confident	88.5	Confident	82 Å²	82	30 Å²	30	38%	0.383	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-29.8	-176.5	-73.6	179.8	-1.3	0	0	114.6	G594 D595 F650	G594-Q599 PolarHBondContact O-NE2 3.01Å; D595-Q599 WeakPolarHBondContact O-CG 3.07Å; D595-Q599 PolarHBondContact O-N 3.18Å; Q599-F650 HydrophobicContact CB-CD2 4.45Å; Q599-F650 WeakPolarHBondContact O-CA 3.34Å; Q599-F650 VanDerWaalsContact O-CD2 3.24Å; Q599-F650 WeakPolarHBondContact O-CD2 3.18Å
600	G	86.2	Confident	87.8	Confident	5 Å²	5	33.9 Å²	33.9	5%	0.052	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	2.9	175.8	0	0	0	0	0	114.6	N598 K646 F647	N598-G600 PolarHBondContact O-N 3.42Å; G600-K646 CarbonylContact O-C 3.59Å; G600-K646 WeakPolarHBondContact O-CA 3.4Å; G600-F647 PolarHBondContact O-N 3.49Å
601	S	90.4	Very high	87.3	Confident	8 Å²	8	29.3 Å²	29.3	6%	0.056	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134.7	-167.4	-60.2	0	0	0	0	110.8	E597 N598 L645 K646 A672	E597-S601 PolarHBondContact O-OG 3.42Å; N598-S601 WeakPolarHBondContact O-CA 3.29Å; N598-S601 WeakPolarHBondContact O-CB 3.47Å; N598-S601 PolarHBondContact O-N 2.62Å; S601-L645 CarbonylContact C-O 3.58Å; S601-L645 VanDerWaalsContact CA-O 3.29Å; S601-L645 WeakPolarHBondContact CA-O 3.41Å; S601-K646 WeakPolarHBondContact OG-CD 3.39Å; S601-A672 WeakPolarHBondContact O-CB 3.47Å; S601-A672 PolarHBondContact O-N 2.55Å
602	I	93.3	Very high	86.6	Confident	0 Å²	0	27 Å²	27	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	144.7	173	66.6	177.7	0	0	0	111.2	L604 F644 L645 F647 A653 A656 L657 L660 R670	I602-L604 HydrophobicContact CD1-CD1 4.17Å; I602-L604 HydrophobicContact CD1-CD2 4.3Å; I602-L604 HydrophobicContact CD1-CG 4.28Å; I602-L604 HydrophobicContact CG1-CG 4.4Å; I602-F644 CarbonylContact O-C 3.57Å; I602-F644 WeakPolarHBondContact O-CA 3.48Å; I602-L645 HydrophobicContact CD1-CB 4.32Å; I602-L645 HydrophobicContact CD1-CD1 4.3Å; I602-L645 HydrophobicContact CG1-CB 3.84Å; I602-L645 HydrophobicContact CG1-CG 4.37Å; I602-L645 PolarHBondContact N-O 3.08Å; I602-L645 PolarHBondContact O-N 3.07Å; I602-F647 HydrophobicContact CD1-CE2 3.77Å; I602-F647 HydrophobicContact CD1-CZ 4.41Å; I602-F647 HydrophobicContact CG1-CE2 3.95Å; I602-A653 HydrophobicContact CG2-CB 3.94Å; I602-A656 HydrophobicContact CD1-CB 4.31Å; I602-L657 HydrophobicContact CD1-CB 4.39Å; I602-L657 HydrophobicContact CG2-CB 4.36Å; I602-L660 HydrophobicContact CD1-CD1 4.18Å; I602-R670 CarbonylContact C-O 3.48Å; I602-R670 WeakPolarHBondContact CA-O 3.17Å
603	Y	94.9	Very high	85.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	134.6	169.7	166.8	-99.1	0	0	0	110	F528 G529 V551 E553 L557 F605 Y642 F644 G669 R670	F528-Y603 PolarHBondContact O-OH 2.98Å; G529-Y603 VanDerWaalsContact CA-OH 3.3Å; G529-Y603 WeakPolarHBondContact CA-OH 3.3Å; V551-Y603 HydrophobicContact CG2-CE2 3.86Å; E553-Y603 HydrophobicContact CB-CD1 3.7Å; E553-Y603 HydrophobicContact CB-CD2 3.96Å; E553-Y603 HydrophobicContact CB-CE1 4.23Å; E553-Y603 HydrophobicContact CB-CE2 4.46Å; E553-Y603 HydrophobicContact CB-CG 3.54Å; E553-Y603 HydrophobicContact CG-CD2 4.47Å; E553-Y603 HydrophobicContact CG-CG 4.1Å; L557-Y603 HydrophobicContact CD2-CE1 4.36Å; Y603-F605 HydrophobicContact CE1-CB 4.07Å; Y603-Y642 HydrophobicContact CD2-CD2 4.04Å; Y603-Y642 AromaticContact CE2-CD2 3.53Å; Y603-Y642 HydrophobicContact CE2-CD2 3.53Å; Y603-Y642 HydrophobicContact CE2-CE2 4.31Å; Y603-Y642 AromaticContact CE2-CG 3.83Å; Y603-Y642 HydrophobicContact CE2-CG 3.83Å; Y603-F644 HydrophobicContact CD2-CD1 4.42Å; Y603-F644 AromaticContact CD2-CE1 3.79Å; Y603-F644 HydrophobicContact CD2-CE1 3.79Å; Y603-F644 HydrophobicContact CD2-CE2 4.42Å; Y603-F644 AromaticContact CD2-CZ 3.75Å; Y603-F644 HydrophobicContact CD2-CZ 3.75Å; Y603-F644 HydrophobicContact CG-CE1 4.22Å; Y603-G669 CarbonylContact O-C 3.53Å; Y603-G669 WeakPolarHBondContact O-CA 3.27Å; Y603-R670 HydrophobicContact CD1-CG 4.18Å; Y603-R670 PolarHBondContact N-O 3.18Å; Y603-R670 PolarHBondContact O-N 3.06Å
604	L	93.7	Very high	85.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	133.3	177.4	-61.6	167	0	0	0	110.4	I602 V607 Y642 C643 L645 L657 L660 K668	I602-L604 HydrophobicContact CD1-CD1 4.17Å; I602-L604 HydrophobicContact CD1-CD2 4.3Å; I602-L604 HydrophobicContact CD1-CG 4.28Å; I602-L604 HydrophobicContact CG1-CG 4.4Å; L604-V607 HydrophobicContact CB-CG2 4.11Å; L604-Y642 CarbonylContact O-C 3.55Å; L604-Y642 WeakPolarHBondContact O-CA 3.38Å; L604-Y642 WeakPolarHBondContact O-CB 3.48Å; L604-C643 PolarHBondContact N-O 3.08Å; L604-C643 PolarHBondContact O-N 2.98Å; L604-L645 HydrophobicContact CD1-CD1 3.55Å; L604-L645 HydrophobicContact CD1-CG 3.92Å; L604-L657 HydrophobicContact CD2-CD1 4.28Å; L604-L660 HydrophobicContact CD1-CD1 3.6Å; L604-L660 HydrophobicContact CD2-CB 4.13Å; L604-L660 HydrophobicContact CD2-CD1 4.23Å; L604-K668 CarbonylContact C-O 3.54Å; L604-K668 WeakPolarHBondContact CA-O 3.13Å
605	F	93.3	Very high	84.5	Confident	27 Å²	27	32 Å²	32	12%	0.118	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	149.9	175	-174.4	-92.1	0	0	0	111.6	K526 S527 G529 Y603 K641 K668	K526-F605 WeakPolarHBondContact O-CE1 3.22Å; K526-F605 WeakPolarHBondContact O-CZ 3.42Å; S527-F605 WeakPolarHBondContact O-CD1 3.12Å; S527-F605 WeakPolarHBondContact O-CE1 3.45Å; G529-F605 VanDerWaalsContact C-CE2 3.42Å; G529-F605 VanDerWaalsContact CA-CE2 3.45Å; Y603-F605 HydrophobicContact CE1-CB 4.07Å; F605-K641 HydrophobicContact CE2-CB 4.24Å; F605-K668 PolarHBondContact N-O 2.77Å; F605-K668 PolarHBondContact O-N 3.41Å
606	G	87.3	Confident	83.7	Confident	43 Å²	43	37.3 Å²	37.3	44%	0.443	21%	0.206	S	C	.	.	S	Bend	trans	93.8	16.4	-178.4	0	0	0	0	0	112.9	S608 K641 L667	G606-S608 PolarHBondContact O-N 3.48Å; G606-K641 PolarHBondContact N-O 3.3Å; G606-L667 WeakPolarHBondContact O-CD2 3.49Å
607	V	85.1	Confident	82.8	Confident	6 Å²	6	43.3 Å²	43.3	4%	0.036	23%	0.231	C	C	.	.			trans	-72.4	123.3	-174	-171.8	0	0	0	0	110.6	L604 F611 K612 K641	L604-V607 HydrophobicContact CB-CG2 4.11Å; V607-F611 HydrophobicContact CG1-CB 4.06Å; V607-F611 HydrophobicContact CG1-CD1 3.23Å; V607-F611 HydrophobicContact CG1-CE1 3.93Å; V607-F611 HydrophobicContact CG1-CG 3.95Å; V607-K612 HydrophobicContact CG1-CD 4.42Å; V607-K612 HydrophobicContact CG1-CG 3.64Å; V607-K641 PolarHBondContact N-O 2.99Å
608	S	82.8	Confident	81.9	Confident	55 Å²	55	47.9 Å²	47.9	39%	0.385	25%	0.252	S	S	.	.			trans	-81.5	157.6	175.2	65.7	0	0	0	0	111.7	G606 T610 F611 K612	G606-S608 PolarHBondContact O-N 3.48Å; S608-T610 PolarHBondContact O-N 2.94Å; S608-T610 PolarHBondContact OG-OG1 3.4Å; S608-F611 WeakPolarHBondContact O-CB 3.11Å; S608-F611 PolarHBondContact O-N 2.62Å; S608-F611 VanDerWaalsContact O-N 3.13Å; S608-F611 PolarHBondContact OG-N 2.92Å; S608-K612 WeakPolarHBondContact O-CG 3.04Å; S608-K612 PolarHBondContact O-N 3.46Å
609	E	78.9	Confident	80.5	Confident	98 Å²	98	51.4 Å²	51.4	46%	0.458	28%	0.275	S	S	.	.	H	α-helix	trans	-58.5	-38.3	174.3	-65.1	-54.7	127.5	0	0	111.8	F611 K612 E613	E609-F611 VanDerWaalsContact C-N 3.32Å; E609-F611 PolarHBondContact O-N 3.2Å; E609-K612 PolarHBondContact O-N 3.37Å; E609-K612 VanDerWaalsContact O-N 3.14Å; E609-K612 IonicContact OE1-NZ 3.13Å; E609-K612 PolarHBondContact OE1-NZ 2.81Å; E609-K612 IonicContact OE2-NZ 2.72Å; E609-E613 WeakPolarHBondContact O-CG 3.3Å; E609-E613 PolarHBondContact O-N 3.42Å
610	T	78.1	Confident	79.3	Confident	85 Å²	85	58.5 Å²	58.5	52%	0.521	30%	0.299	S	S	.	.	H	α-helix	trans	-60.8	-38.6	175.8	59.3	0	0	0	0	113	S608 K612 E613 Q614	S608-T610 PolarHBondContact O-N 2.94Å; S608-T610 PolarHBondContact OG-OG1 3.4Å; T610-K612 VanDerWaalsContact C-N 3.35Å; T610-E613 PolarHBondContact O-N 3.42Å; T610-Q614 WeakPolarHBondContact O-CB 3.26Å; T610-Q614 VanDerWaalsContact O-CG 3.31Å; T610-Q614 WeakPolarHBondContact O-CG 3.45Å; T610-Q614 PolarHBondContact O-N 3.33Å
611	F	80.1	Confident	78.4	Confident	7 Å²	7	61.4 Å²	61.4	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-65.9	-41.2	176.4	175.9	-87.5	0	0	0	110.9	V607 S608 E609 Q614 L615 L660 W665 L667	V607-F611 HydrophobicContact CG1-CB 4.06Å; V607-F611 HydrophobicContact CG1-CD1 3.23Å; V607-F611 HydrophobicContact CG1-CE1 3.93Å; V607-F611 HydrophobicContact CG1-CG 3.95Å; S608-F611 WeakPolarHBondContact O-CB 3.11Å; S608-F611 PolarHBondContact O-N 2.62Å; S608-F611 VanDerWaalsContact O-N 3.13Å; S608-F611 PolarHBondContact OG-N 2.92Å; E609-F611 VanDerWaalsContact C-N 3.32Å; E609-F611 PolarHBondContact O-N 3.2Å; F611-Q614 PolarHBondContact O-N 3.43Å; F611-L615 HydrophobicContact CE1-CD1 4.23Å; F611-L615 HydrophobicContact CZ-CD1 4.11Å; F611-L615 WeakPolarHBondContact O-CB 3.47Å; F611-L615 PolarHBondContact O-N 3.32Å; F611-L660 HydrophobicContact CE2-CD2 3.55Å; F611-L660 HydrophobicContact CZ-CD2 3.61Å; F611-W665 HydrophobicContact CD2-CD2 4.4Å; F611-W665 AromaticContact CD2-CE3 3.75Å; F611-W665 HydrophobicContact CD2-CE3 3.75Å; F611-W665 AromaticContact CD2-CH2 3.88Å; F611-W665 HydrophobicContact CD2-CH2 3.88Å; F611-W665 AromaticContact CD2-CZ3 3.48Å; F611-W665 HydrophobicContact CD2-CZ3 3.48Å; F611-W665 VanDerWaalsContact CD2-CZ3 3.48Å; F611-W665 HydrophobicContact CE2-CD2 4.3Å; F611-W665 HydrophobicContact CE2-CE3 4.09Å; F611-W665 HydrophobicContact CE2-CH2 4.31Å; F611-W665 HydrophobicContact CE2-CZ3 4.12Å; F611-L667 HydrophobicContact CE2-CD1 4.27Å; F611-L667 HydrophobicContact CZ-CD1 4.28Å
612	K	78.1	Confident	77.6	Confident	6 Å²	6	62 Å²	62	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-42	179	-59.1	176.5	-169.1	169.7	0	111.2	V607 S608 E609 T610 L615 L616 L630 Q639 K640	V607-K612 HydrophobicContact CG1-CD 4.42Å; V607-K612 HydrophobicContact CG1-CG 3.64Å; S608-K612 WeakPolarHBondContact O-CG 3.04Å; S608-K612 PolarHBondContact O-N 3.46Å; E609-K612 PolarHBondContact O-N 3.37Å; E609-K612 VanDerWaalsContact O-N 3.14Å; E609-K612 IonicContact OE1-NZ 3.13Å; E609-K612 PolarHBondContact OE1-NZ 2.81Å; E609-K612 IonicContact OE2-NZ 2.72Å; T610-K612 VanDerWaalsContact C-N 3.35Å; K612-L615 PolarHBondContact O-N 3.43Å; K612-L616 VanDerWaalsContact O-CG 3.28Å; K612-L616 WeakPolarHBondContact O-CG 3.13Å; K612-L616 PolarHBondContact O-N 2.77Å; K612-L616 VanDerWaalsContact O-N 3.07Å; K612-L630 HydrophobicContact CB-CD1 4.46Å; K612-L630 HydrophobicContact CD-CD1 4.43Å; K612-L630 HydrophobicContact CD-CD2 4.08Å; K612-L630 HydrophobicContact CG-CD2 4.14Å; K612-Q639 VanDerWaalsContact NZ-CB 3.28Å; K612-Q639 VanDerWaalsContact NZ-OE1 3.07Å; K612-K640 PolarHBondContact NZ-O 2.92Å
613	E	77.6	Confident	76.7	Confident	109 Å²	109	69 Å²	69	51%	0.509	35%	0.351	S	S	.	.	H	α-helix	trans	-61.7	-45.6	174.8	-71.9	172.2	179.9	0	0	111.4	E609 T610 L615 L616 Q617	E609-E613 WeakPolarHBondContact O-CG 3.3Å; E609-E613 PolarHBondContact O-N 3.42Å; T610-E613 PolarHBondContact O-N 3.42Å; E613-L615 PolarHBondContact O-N 3.09Å; E613-L616 PolarHBondContact O-N 3.42Å; E613-Q617 WeakPolarHBondContact O-CB 3.22Å; E613-Q617 VanDerWaalsContact O-CG 3.31Å; E613-Q617 WeakPolarHBondContact O-CG 3.31Å; E613-Q617 PolarHBondContact O-N 3.46Å
614	Q	74.6	Confident	75.8	Confident	88 Å²	88	70.6 Å²	70.6	41%	0.411	37%	0.367	S	S	.	.	H	α-helix	trans	-61.8	-42.2	176.5	-76.9	179.1	-36.6	0	0	112.5	T610 F611 L616 Q617 E618	T610-Q614 WeakPolarHBondContact O-CB 3.26Å; T610-Q614 VanDerWaalsContact O-CG 3.31Å; T610-Q614 WeakPolarHBondContact O-CG 3.45Å; T610-Q614 PolarHBondContact O-N 3.33Å; F611-Q614 PolarHBondContact O-N 3.43Å; Q614-L616 VanDerWaalsContact C-N 3.28Å; Q614-L616 PolarHBondContact O-N 3.28Å; Q614-Q617 PolarHBondContact O-N 2.89Å; Q614-E618 PolarHBondContact O-N 2.72Å
615	L	75.2	Confident	75.2	Confident	5 Å²	5	72.1 Å²	72.1	3%	0.026	38%	0.375	C	S	.	.	H	α-helix	trans	-65.9	-32	178.6	-158.5	89.4	0	0	0	112.3	F611 K612 E613 F622 L625 V628 L645	F611-L615 HydrophobicContact CE1-CD1 4.23Å; F611-L615 HydrophobicContact CZ-CD1 4.11Å; F611-L615 WeakPolarHBondContact O-CB 3.47Å; F611-L615 PolarHBondContact O-N 3.32Å; K612-L615 PolarHBondContact O-N 3.43Å; E613-L615 PolarHBondContact O-N 3.09Å; L615-F622 HydrophobicContact CD1-CD2 4.06Å; L615-F622 HydrophobicContact CD1-CE2 3.86Å; L615-L625 HydrophobicContact CG-CD2 4.5Å; L615-V628 HydrophobicContact CD2-CB 4.11Å; L615-V628 HydrophobicContact CD2-CG1 3.5Å; L615-V628 VanDerWaalsContact CD2-CG1 3.5Å; L615-V628 HydrophobicContact CD2-CG2 3.43Å; L615-V628 VanDerWaalsContact CD2-CG2 3.43Å; L615-V628 HydrophobicContact CG-CG2 4.25Å; L615-L645 HydrophobicContact CD1-CD1 4.49Å; L615-L645 HydrophobicContact CD2-CD1 4.46Å; L615-L645 HydrophobicContact CD2-CD2 3.49Å; L615-L645 VanDerWaalsContact CD2-CD2 3.49Å
616	L	70.3	Confident	74.4	Confident	112 Å²	112	74.9 Å²	74.9	59%	0.586	39%	0.388	S	S	*	.	H	α-helix	trans	-78	-33	175.4	-71.2	168.9	0	0	0	112.6	K612 E613 Q614 L630	K612-L616 VanDerWaalsContact O-CG 3.28Å; K612-L616 WeakPolarHBondContact O-CG 3.13Å; K612-L616 PolarHBondContact O-N 2.77Å; K612-L616 VanDerWaalsContact O-N 3.07Å; E613-L616 PolarHBondContact O-N 3.42Å; Q614-L616 VanDerWaalsContact C-N 3.28Å; Q614-L616 PolarHBondContact O-N 3.28Å; L616-L630 HydrophobicContact CD1-CD1 4.48Å
617	Q	65.9	Low	74	Confident	154 Å²	154	73.3 Å²	73.3	72%	0.72	37%	0.372	S	S	*	.	H	α-helix	trans	-80.7	-34.5	179.3	-72.9	180	1.8	0	0	112.9	E613 Q614 P619	E613-Q617 WeakPolarHBondContact O-CB 3.22Å; E613-Q617 VanDerWaalsContact O-CG 3.31Å; E613-Q617 WeakPolarHBondContact O-CG 3.31Å; E613-Q617 PolarHBondContact O-N 3.46Å; Q614-Q617 PolarHBondContact O-N 2.89Å; Q617-P619 VanDerWaalsContact C-CD 3.5Å; Q617-P619 WeakPolarHBondContact O-CD 3.39Å
618	E	63	Low	73.8	Confident	113 Å²	113	75.2 Å²	75.2	53%	0.528	38%	0.383	S	S	.	.			trans	-127.4	69.8	-178.1	-65.7	-174.2	177.4	0	0	111.8	Q614 R620 L621	Q614-E618 PolarHBondContact O-N 2.72Å; E618-R620 PolarHBondContact O-N 2.72Å; E618-L621 HydrophobicContact CB-CD1 3.84Å; E618-L621 HydrophobicContact CB-CG 3.87Å; E618-L621 WeakPolarHBondContact O-CB 3.34Å; E618-L621 WeakPolarHBondContact O-CD1 3.47Å; E618-L621 VanDerWaalsContact O-CG 3.29Å; E618-L621 WeakPolarHBondContact O-CG 3.21Å; E618-L621 PolarHBondContact O-N 3.4Å
619	P	58	Low	73.7	Confident	76 Å²	76	73.8 Å²	73.8	49%	0.494	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-61.9	-13	177.8	23.4	-32.4	0	0	0	113.5	Q617 L621	Q617-P619 VanDerWaalsContact C-CD 3.5Å; Q617-P619 WeakPolarHBondContact O-CD 3.39Å; P619-L621 VanDerWaalsContact C-N 3.27Å; P619-L621 PolarHBondContact O-N 3.41Å
620	R	58.7	Low	73.9	Confident	231 Å²	231	70.3 Å²	70.3	87%	0.872	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-77.7	-5.6	175.5	-58.2	-173.8	-171.8	-162.3	2.2	113.9	E618 F622	E618-R620 PolarHBondContact O-N 2.72Å; R620-F622 PolarHBondContact O-N 3Å
621	L	66.4	Low	74	Confident	66 Å²	66	66.6 Å²	66.6	35%	0.346	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-56.2	-31.3	176.2	-80.1	164.4	0	0	0	112.5	L25 E618 P619	L25-L621 HydrophobicContact CD2-CD2 3.88Å; E618-L621 HydrophobicContact CB-CD1 3.84Å; E618-L621 HydrophobicContact CB-CG 3.87Å; E618-L621 WeakPolarHBondContact O-CB 3.34Å; E618-L621 WeakPolarHBondContact O-CD1 3.47Å; E618-L621 VanDerWaalsContact O-CG 3.29Å; E618-L621 WeakPolarHBondContact O-CG 3.21Å; E618-L621 PolarHBondContact O-N 3.4Å; P619-L621 VanDerWaalsContact C-N 3.27Å; P619-L621 PolarHBondContact O-N 3.41Å
622	F	74.8	Confident	73.9	Confident	22 Å²	22	71.6 Å²	71.6	10%	0.096	35%	0.354	C	S	.	.	S	Bend	trans	-127.1	113.8	175.5	-56.8	-77.8	0	0	0	110.2	L615 R620 G624 L625 F647 A656 I659 L660	L615-F622 HydrophobicContact CD1-CD2 4.06Å; L615-F622 HydrophobicContact CD1-CE2 3.86Å; R620-F622 PolarHBondContact O-N 3Å; F622-G624 PolarHBondContact O-N 2.87Å; F622-L625 HydrophobicContact CB-CB 4.47Å; F622-L625 WeakPolarHBondContact O-CB 3.02Å; F622-L625 PolarHBondContact O-N 2.95Å; F622-F647 HydrophobicContact CB-CE1 3.67Å; F622-F647 HydrophobicContact CB-CZ 4.3Å; F622-F647 HydrophobicContact CG-CE1 4.36Å; F622-A656 HydrophobicContact CD1-CB 3.77Å; F622-A656 HydrophobicContact CE1-CB 4.2Å; F622-A656 HydrophobicContact CG-CB 4.31Å; F622-I659 HydrophobicContact CE1-CB 4.4Å; F622-I659 HydrophobicContact CE1-CD1 4.35Å; F622-I659 HydrophobicContact CE1-CG2 4.16Å; F622-L660 HydrophobicContact CE1-CD1 4.34Å; F622-L660 HydrophobicContact CE1-CD2 4.49Å; F622-L660 HydrophobicContact CE1-CG 4.22Å; F622-L660 HydrophobicContact CE2-CD1 4.37Å; F622-L660 HydrophobicContact CE2-CD2 4.31Å; F622-L660 HydrophobicContact CZ-CD1 3.93Å; F622-L660 HydrophobicContact CZ-CD2 3.65Å; F622-L660 HydrophobicContact CZ-CG 3.82Å
623	L	74.9	Confident	73.4	Confident	147 Å²	147	73.7 Å²	73.7	77%	0.77	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	131.9	175	-120.7	94.5	0	0	0	110.3
624	G	74.3	Confident	72.7	Confident	33 Å²	33	75.9 Å²	75.9	34%	0.34	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	13.5	177.6	0	0	0	0	0	115.5	F622 E626 F647 K648	F622-G624 PolarHBondContact O-N 2.87Å; G624-E626 PolarHBondContact O-N 3.49Å; G624-F647 CarbonylContact O-C 3.57Å; G624-F647 WeakPolarHBondContact O-CA 3.23Å; G624-K648 PolarHBondContact O-N 3.43Å
625	L	82.5	Confident	72.2	Confident	32 Å²	32	81.2 Å²	81.2	17%	0.168	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	119	169	-178.3	68.7	0	0	0	110.2	L615 F622 V628 L645 F647	L615-L625 HydrophobicContact CG-CD2 4.5Å; F622-L625 HydrophobicContact CB-CB 4.47Å; F622-L625 WeakPolarHBondContact O-CB 3.02Å; F622-L625 PolarHBondContact O-N 2.95Å; L625-V628 HydrophobicContact CD1-CG2 4.48Å; L625-V628 HydrophobicContact CD2-CG2 3.97Å; L625-V628 HydrophobicContact CG-CG2 4.49Å; L625-L645 HydrophobicContact CD1-CB 3.96Å; L625-F647 HydrophobicContact CB-CD1 4.15Å; L625-F647 HydrophobicContact CB-CE1 3.9Å; L625-F647 HydrophobicContact CD1-CD1 4.24Å; L625-F647 HydrophobicContact CD1-CE1 3.75Å; L625-F647 HydrophobicContact CD1-CE2 4.28Å; L625-F647 HydrophobicContact CD1-CZ 3.78Å; L625-F647 HydrophobicContact CG-CE1 4.43Å
626	E	76.2	Confident	71.8	Confident	84 Å²	84	85 Å²	85	39%	0.393	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-37.6	-179.2	-67.3	-176.3	155.8	0	0	112.3	G624 K646 K648	G624-E626 PolarHBondContact O-N 3.49Å; E626-K646 HydrophobicContact CB-CG 4.36Å; E626-K646 PolarHBondContact N-O 2.66Å; E626-K648 HydrophobicContact CG-CB 4.2Å; E626-K648 WeakPolarHBondContact OE1-CA 3.47Å
627	A	78	Confident	71.6	Confident	11 Å²	11	82.1 Å²	82.1	9%	0.091	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	148.1	-177	0	0	0	0	0	113.6	L54 K646 R676	L54-A627 HydrophobicContact CD2-CB 4.04Å; A627-K646 HydrophobicContact CB-CB 4.2Å; A627-K646 PolarHBondContact N-O 2.75Å; A627-K646 PolarHBondContact O-N 2.92Å; A627-R676 VanDerWaalsContact CB-NH2 3.27Å
628	V	81.6	Confident	71.9	Confident	46 Å²	46	82 Å²	82	28%	0.279	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123.9	175.9	-177.5	0	0	0	0	108.6	L615 L625 L630 L645	L615-V628 HydrophobicContact CD2-CB 4.11Å; L615-V628 HydrophobicContact CD2-CG1 3.5Å; L615-V628 VanDerWaalsContact CD2-CG1 3.5Å; L615-V628 HydrophobicContact CD2-CG2 3.43Å; L615-V628 VanDerWaalsContact CD2-CG2 3.43Å; L615-V628 HydrophobicContact CG-CG2 4.25Å; L625-V628 HydrophobicContact CD1-CG2 4.48Å; L625-V628 HydrophobicContact CD2-CG2 3.97Å; L625-V628 HydrophobicContact CG-CG2 4.49Å; V628-L630 HydrophobicContact CG1-CD2 4.05Å; V628-L630 HydrophobicContact CG1-CG 4.05Å; V628-L645 HydrophobicContact CB-CD2 4.3Å; V628-L645 HydrophobicContact CG1-CD2 3.85Å; V628-L645 HydrophobicContact CG2-CD2 4.12Å
629	I	81.3	Confident	72.5	Confident	25 Å²	25	79.7 Å²	79.7	13%	0.128	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	122.2	177.4	-41.3	175	0	0	0	109	P631 C643 F644 R676	I629-P631 WeakPolarHBondContact O-CD 3.37Å; I629-C643 VanDerWaalsContact O-CA 3.3Å; I629-C643 WeakPolarHBondContact O-CA 3.15Å; I629-C643 VanDerWaalsContact O-CB 3.27Å; I629-C643 WeakPolarHBondContact O-CB 3.4Å; I629-F644 HydrophobicContact CB-CB 4.05Å; I629-F644 HydrophobicContact CD1-CB 3.72Å; I629-F644 HydrophobicContact CD1-CG 4.43Å; I629-F644 HydrophobicContact CG1-CB 4.1Å; I629-F644 PolarHBondContact N-O 3.26Å; I629-F644 PolarHBondContact O-N 3.22Å; I629-R676 HydrophobicContact CD1-CG 3.63Å; I629-R676 VanDerWaalsContact CG1-CZ 3.47Å; I629-R676 VanDerWaalsContact CG1-NH2 3.3Å
630	L	82.4	Confident	73.6	Confident	25 Å²	25	78.2 Å²	78.2	13%	0.131	39%	0.392	C	S	.	.			trans	-117.5	89.4	179.5	-61.1	178.4	0	0	0	110.3	K612 L616 V628 K632 C643	K612-L630 HydrophobicContact CB-CD1 4.46Å; K612-L630 HydrophobicContact CD-CD1 4.43Å; K612-L630 HydrophobicContact CD-CD2 4.08Å; K612-L630 HydrophobicContact CG-CD2 4.14Å; L616-L630 HydrophobicContact CD1-CD1 4.48Å; V628-L630 HydrophobicContact CG1-CD2 4.05Å; V628-L630 HydrophobicContact CG1-CG 4.05Å; L630-K632 PolarHBondContact O-N 3.24Å; L630-C643 HydrophobicContact CD2-CB 3.59Å
631	P	80.3	Confident	74.9	Confident	6 Å²	6	74.3 Å²	74.3	4%	0.039	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-57.9	133.8	178.8	-28.1	38.8	0	0	0	112.1	I629 K640 Y642 F644	I629-P631 WeakPolarHBondContact O-CD 3.37Å; P631-K640 HydrophobicContact CB-CD 4.48Å; P631-K640 WeakPolarHBondContact O-CB 3.47Å; P631-K640 PolarHBondContact O-N 2.89Å; P631-Y642 HydrophobicContact CB-CE2 4.05Å; P631-Y642 HydrophobicContact CG-CD2 4.16Å; P631-Y642 HydrophobicContact CG-CE2 3.54Å; P631-F644 HydrophobicContact CG-CD2 4.45Å
632	K	77.8	Confident	76	Confident	112 Å²	112	71.4 Å²	71.4	49%	0.487	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-100.4	150.3	173.9	-62.5	174	-173.5	166.7	0	110.6	L630 K638 Q639	L630-K632 PolarHBondContact O-N 3.24Å; K632-K638 CarbonylContact C-O 3.53Å; K632-K638 WeakPolarHBondContact CA-O 3.43Å; K632-Q639 HydrophobicContact CG-CG 4.33Å
633	D	68.6	Low	76.7	Confident	50 Å²	50	70.4 Å²	70.4	27%	0.267	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-80.4	123	170.5	174.7	-10.4	0	0	0	109.2	K635 N636 G637 K638 K640	D633-K635 PolarHBondContact O-N 2.89Å; D633-K635 PolarHBondContact OD1-N 3.28Å; D633-N636 WeakPolarHBondContact CB-OD1 3.34Å; D633-N636 PolarHBondContact O-N 3.2Å; D633-N636 PolarHBondContact OD2-ND2 3.34Å; D633-N636 PolarHBondContact OD2-OD1 2.91Å; D633-G637 VanDerWaalsContact O-CA 3.27Å; D633-G637 WeakPolarHBondContact O-CA 3.44Å; D633-G637 PolarHBondContact O-N 3.31Å; D633-K638 PolarHBondContact N-O 3.3Å; D633-K640 HydrophobicContact CB-CG 4.34Å
634	L	62.8	Low	77.4	Confident	155 Å²	155	64 Å²	64	81%	0.812	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-23.1	-175.5	-66.9	169.2	0	0	0	112.9
635	K	64.3	Low	78.1	Confident	200 Å²	200	62.4 Å²	62.4	87%	0.87	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-29.6	-176.1	-64.5	-174.4	179.3	-176.6	0	113.6	D633	D633-K635 PolarHBondContact O-N 2.89Å; D633-K635 PolarHBondContact OD1-N 3.28Å
636	N	65.7	Low	78.2	Confident	86 Å²	86	62 Å²	62	46%	0.46	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.8	-1.4	-172.1	60.6	34.5	0	0	0	113.5	D633 K638	D633-N636 WeakPolarHBondContact CB-OD1 3.34Å; D633-N636 PolarHBondContact O-N 3.2Å; D633-N636 PolarHBondContact OD2-ND2 3.34Å; D633-N636 PolarHBondContact OD2-OD1 2.91Å; N636-K638 HydrophobicContact CB-CG 4.47Å; N636-K638 PolarHBondContact O-N 2.94Å; N636-K638 VanDerWaalsContact OD1-CB 3.31Å; N636-K638 WeakPolarHBondContact OD1-CB 3.4Å; N636-K638 PolarHBondContact OD1-N 3.19Å
637	G	65.3	Low	78.7	Confident	51 Å²	51	58 Å²	58	53%	0.526	29%	0.289	S	S	.	.			trans	66.6	-2.4	-179.1	0	0	0	0	0	114.8	D633	D633-G637 VanDerWaalsContact O-CA 3.27Å; D633-G637 WeakPolarHBondContact O-CA 3.44Å; D633-G637 PolarHBondContact O-N 3.31Å
638	K	73.5	Confident	78.8	Confident	151 Å²	151	62.2 Å²	62.2	66%	0.657	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-73.9	144.2	-177.5	-64.2	-173.2	178	-178.3	0	109.9	K632 D633 N636	K632-K638 CarbonylContact C-O 3.53Å; K632-K638 WeakPolarHBondContact CA-O 3.43Å; D633-K638 PolarHBondContact N-O 3.3Å; N636-K638 HydrophobicContact CB-CG 4.47Å; N636-K638 PolarHBondContact O-N 2.94Å; N636-K638 VanDerWaalsContact OD1-CB 3.31Å; N636-K638 WeakPolarHBondContact OD1-CB 3.4Å; N636-K638 PolarHBondContact OD1-N 3.19Å
639	Q	74.3	Confident	78.8	Confident	65 Å²	65	62.1 Å²	62.1	30%	0.304	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-66.8	138.5	174.3	-64.7	-177.8	-2.9	0	0	110.4	K612 K632	K612-Q639 VanDerWaalsContact NZ-CB 3.28Å; K612-Q639 VanDerWaalsContact NZ-OE1 3.07Å; K632-Q639 HydrophobicContact CG-CG 4.33Å
640	K	81.5	Confident	79.1	Confident	44 Å²	44	65.9 Å²	65.9	19%	0.191	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-71.7	163.6	175.5	-61.7	-165.6	179.7	-175.3	0	110.2	E550 K612 P631 D633 Y642	E550-K640 IonicContact OE2-NZ 2.86Å; E550-K640 PolarHBondContact OE2-NZ 3.04Å; K612-K640 PolarHBondContact NZ-O 2.92Å; P631-K640 HydrophobicContact CB-CD 4.48Å; P631-K640 WeakPolarHBondContact O-CB 3.47Å; P631-K640 PolarHBondContact O-N 2.89Å; D633-K640 HydrophobicContact CB-CG 4.34Å; K640-Y642 HydrophobicContact CB-CD1 3.64Å; K640-Y642 HydrophobicContact CB-CE1 3.54Å; K640-Y642 HydrophobicContact CD-CD1 4.27Å; K640-Y642 HydrophobicContact CD-CE1 3.33Å; K640-Y642 HydrophobicContact CG-CE1 4.05Å; K640-Y642 PolarHBondContact O-N 3.21Å
641	K	86.3	Confident	79.4	Confident	149 Å²	149	66.1 Å²	66.1	65%	0.648	33%	0.331	S	S	*	.	S	Bend	trans	-80.8	19.1	-179.5	-64.3	-170.7	176.6	-173.4	0	113.7	F605 G606 V607	F605-K641 HydrophobicContact CE2-CB 4.24Å; G606-K641 PolarHBondContact N-O 3.3Å; V607-K641 PolarHBondContact N-O 2.99Å
642	Y	90.1	Very high	79.8	Confident	6 Å²	6	66.5 Å²	66.5	2%	0.024	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	157.6	177.2	72.1	-88.3	0	0	0	110.4	P530 V551 Y603 L604 P631 K640 F644	P530-Y642 HydrophobicContact CG-CD1 3.94Å; P530-Y642 HydrophobicContact CG-CE1 3.72Å; V551-Y642 HydrophobicContact CG1-CE2 4.07Å; Y603-Y642 HydrophobicContact CD2-CD2 4.04Å; Y603-Y642 AromaticContact CE2-CD2 3.53Å; Y603-Y642 HydrophobicContact CE2-CD2 3.53Å; Y603-Y642 HydrophobicContact CE2-CE2 4.31Å; Y603-Y642 AromaticContact CE2-CG 3.83Å; Y603-Y642 HydrophobicContact CE2-CG 3.83Å; L604-Y642 CarbonylContact O-C 3.55Å; L604-Y642 WeakPolarHBondContact O-CA 3.38Å; L604-Y642 WeakPolarHBondContact O-CB 3.48Å; P631-Y642 HydrophobicContact CB-CE2 4.05Å; P631-Y642 HydrophobicContact CG-CD2 4.16Å; P631-Y642 HydrophobicContact CG-CE2 3.54Å; K640-Y642 HydrophobicContact CB-CD1 3.64Å; K640-Y642 HydrophobicContact CB-CE1 3.54Å; K640-Y642 HydrophobicContact CD-CD1 4.27Å; K640-Y642 HydrophobicContact CD-CE1 3.33Å; K640-Y642 HydrophobicContact CG-CE1 4.05Å; K640-Y642 PolarHBondContact O-N 3.21Å; Y642-F644 HydrophobicContact CD2-CE2 4.05Å; Y642-F644 HydrophobicContact CE2-CD2 4.46Å; Y642-F644 AromaticContact CE2-CE2 3.7Å; Y642-F644 HydrophobicContact CE2-CE2 3.7Å; Y642-F644 HydrophobicContact CE2-CZ 4.35Å
643	C	89.3	Confident	80.4	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.007	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	165.2	175.8	66.7	0	0	0	0	110.8	L604 I629 L630	L604-C643 PolarHBondContact N-O 3.08Å; L604-C643 PolarHBondContact O-N 2.98Å; I629-C643 VanDerWaalsContact O-CA 3.3Å; I629-C643 WeakPolarHBondContact O-CA 3.15Å; I629-C643 VanDerWaalsContact O-CB 3.27Å; I629-C643 WeakPolarHBondContact O-CB 3.4Å; L630-C643 HydrophobicContact CD2-CB 3.59Å
644	F	89.4	Confident	81.6	Confident	11 Å²	11	61.5 Å²	61.5	5%	0.048	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	135.1	165.6	-62.8	-93	0	0	0	110	E553 I602 Y603 I629 P631 Y642 A672 H679	E553-F644 HydrophobicContact CG-CE1 4.07Å; I602-F644 CarbonylContact O-C 3.57Å; I602-F644 WeakPolarHBondContact O-CA 3.48Å; Y603-F644 HydrophobicContact CD2-CD1 4.42Å; Y603-F644 AromaticContact CD2-CE1 3.79Å; Y603-F644 HydrophobicContact CD2-CE1 3.79Å; Y603-F644 HydrophobicContact CD2-CE2 4.42Å; Y603-F644 AromaticContact CD2-CZ 3.75Å; Y603-F644 HydrophobicContact CD2-CZ 3.75Å; Y603-F644 HydrophobicContact CG-CE1 4.22Å; I629-F644 HydrophobicContact CB-CB 4.05Å; I629-F644 HydrophobicContact CD1-CB 3.72Å; I629-F644 HydrophobicContact CD1-CG 4.43Å; I629-F644 HydrophobicContact CG1-CB 4.1Å; I629-F644 PolarHBondContact N-O 3.26Å; I629-F644 PolarHBondContact O-N 3.22Å; P631-F644 HydrophobicContact CG-CD2 4.45Å; Y642-F644 HydrophobicContact CD2-CE2 4.05Å; Y642-F644 HydrophobicContact CE2-CD2 4.46Å; Y642-F644 AromaticContact CE2-CE2 3.7Å; Y642-F644 HydrophobicContact CE2-CE2 3.7Å; Y642-F644 HydrophobicContact CE2-CZ 4.35Å; F644-A672 HydrophobicContact CD1-CB 4.03Å; F644-A672 HydrophobicContact CE1-CB 4.14Å; F644-H679 AromaticContact CE1-NE2 3.69Å; F644-H679 AromaticContact CE2-NE2 3.69Å; F644-H679 AromaticContact CZ-CD2 3.89Å; F644-H679 AromaticContact CZ-CE1 3.65Å; F644-H679 AromaticContact CZ-NE2 3.07Å; F644-H679 WeakPolarHBondContact CZ-NE2 3.37Å
645	L	88.3	Confident	82.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	128.6	174.7	-52.6	-173.7	0	0	0	108.5	S601 I602 L604 L615 L625 V628 F647 L660	S601-L645 CarbonylContact C-O 3.58Å; S601-L645 VanDerWaalsContact CA-O 3.29Å; S601-L645 WeakPolarHBondContact CA-O 3.41Å; I602-L645 HydrophobicContact CD1-CB 4.32Å; I602-L645 HydrophobicContact CD1-CD1 4.3Å; I602-L645 HydrophobicContact CG1-CB 3.84Å; I602-L645 HydrophobicContact CG1-CG 4.37Å; I602-L645 PolarHBondContact N-O 3.08Å; I602-L645 PolarHBondContact O-N 3.07Å; L604-L645 HydrophobicContact CD1-CD1 3.55Å; L604-L645 HydrophobicContact CD1-CG 3.92Å; L615-L645 HydrophobicContact CD1-CD1 4.49Å; L615-L645 HydrophobicContact CD2-CD1 4.46Å; L615-L645 HydrophobicContact CD2-CD2 3.49Å; L615-L645 VanDerWaalsContact CD2-CD2 3.49Å; L625-L645 HydrophobicContact CD1-CB 3.96Å; V628-L645 HydrophobicContact CB-CD2 4.3Å; V628-L645 HydrophobicContact CG1-CD2 3.85Å; V628-L645 HydrophobicContact CG2-CD2 4.12Å; L645-F647 HydrophobicContact CB-CD2 4.46Å; L645-F647 HydrophobicContact CB-CE2 3.6Å; L645-F647 HydrophobicContact CB-CZ 4.03Å; L645-F647 HydrophobicContact CD1-CZ 4.29Å; L645-L660 HydrophobicContact CD1-CD1 4.1Å
646	K	86.3	Confident	84	Confident	24 Å²	24	50.2 Å²	50.2	10%	0.104	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	131.1	176.3	178.8	74.5	179	-178.1	0	109.3	E597 G600 S601 E626 A627	E597-K646 PolarHBondContact O-NZ 3.49Å; G600-K646 CarbonylContact O-C 3.59Å; G600-K646 WeakPolarHBondContact O-CA 3.4Å; S601-K646 WeakPolarHBondContact OG-CD 3.39Å; E626-K646 HydrophobicContact CB-CG 4.36Å; E626-K646 PolarHBondContact N-O 2.66Å; A627-K646 HydrophobicContact CB-CB 4.2Å; A627-K646 PolarHBondContact N-O 2.75Å; A627-K646 PolarHBondContact O-N 2.92Å
647	F	86.1	Confident	85.3	Confident	1 Å²	1	46.8 Å²	46.8	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	156.1	178.8	-62	-90.1	0	0	0	110.7	G600 I602 F622 G624 L625 L645 S649 A653 A656	G600-F647 PolarHBondContact O-N 3.49Å; I602-F647 HydrophobicContact CD1-CE2 3.77Å; I602-F647 HydrophobicContact CD1-CZ 4.41Å; I602-F647 HydrophobicContact CG1-CE2 3.95Å; F622-F647 HydrophobicContact CB-CE1 3.67Å; F622-F647 HydrophobicContact CB-CZ 4.3Å; F622-F647 HydrophobicContact CG-CE1 4.36Å; G624-F647 CarbonylContact O-C 3.57Å; G624-F647 WeakPolarHBondContact O-CA 3.23Å; L625-F647 HydrophobicContact CB-CD1 4.15Å; L625-F647 HydrophobicContact CB-CE1 3.9Å; L625-F647 HydrophobicContact CD1-CD1 4.24Å; L625-F647 HydrophobicContact CD1-CE1 3.75Å; L625-F647 HydrophobicContact CD1-CE2 4.28Å; L625-F647 HydrophobicContact CD1-CZ 3.78Å; L625-F647 HydrophobicContact CG-CE1 4.43Å; L645-F647 HydrophobicContact CB-CD2 4.46Å; L645-F647 HydrophobicContact CB-CE2 3.6Å; L645-F647 HydrophobicContact CB-CZ 4.03Å; L645-F647 HydrophobicContact CD1-CZ 4.29Å; F647-S649 VanDerWaalsContact C-N 3.27Å; F647-S649 PolarHBondContact O-N 3.34Å; F647-A653 HydrophobicContact CB-CB 4.13Å; F647-A653 HydrophobicContact CD2-CB 3.74Å; F647-A653 HydrophobicContact CG-CB 4.16Å; F647-A656 HydrophobicContact CE1-CB 3.84Å; F647-A656 HydrophobicContact CE2-CB 3.91Å; F647-A656 HydrophobicContact CZ-CB 3.36Å
648	K	79.3	Confident	86.5	Confident	99 Å²	99	48.9 Å²	48.9	43%	0.43	23%	0.233	S	C	.	.	S	Bend	trans	-59.9	-34.7	177.8	-173.4	-179	175.2	-168.4	0	113.1	G624 E626	G624-K648 PolarHBondContact O-N 3.43Å; E626-K648 HydrophobicContact CG-CB 4.2Å; E626-K648 WeakPolarHBondContact OE1-CA 3.47Å
649	S	82.9	Confident	87.2	Confident	44 Å²	44	44.9 Å²	44.9	31%	0.308	22%	0.218	S	C	.	.	S	Bend	trans	-138.1	153.2	-177.8	68.9	0	0	0	0	112.8	F647 G651 S652 A653	F647-S649 VanDerWaalsContact C-N 3.27Å; F647-S649 PolarHBondContact O-N 3.34Å; S649-G651 VanDerWaalsContact C-N 3.27Å; S649-G651 PolarHBondContact O-N 2.82Å; S649-S652 PolarHBondContact O-N 3.45Å; S649-S652 PolarHBondContact OG-N 2.89Å; S649-S652 PolarHBondContact OG-OG 2.91Å; S649-A653 PolarHBondContact O-N 3.46Å
650	F	87.6	Confident	87.9	Confident	103 Å²	103	41.8 Å²	41.8	45%	0.452	20%	0.204	S	C	.	.	H	α-helix	trans	-56	-41.9	172.9	177.2	-91	0	0	0	111.6	Q599 S652 A653 Q654 H671	Q599-F650 HydrophobicContact CB-CD2 4.45Å; Q599-F650 WeakPolarHBondContact O-CA 3.34Å; Q599-F650 VanDerWaalsContact O-CD2 3.24Å; Q599-F650 WeakPolarHBondContact O-CD2 3.18Å; F650-S652 VanDerWaalsContact C-N 3.33Å; F650-S652 PolarHBondContact O-N 3.36Å; F650-A653 WeakPolarHBondContact O-CB 3.37Å; F650-A653 PolarHBondContact O-N 2.78Å; F650-Q654 HydrophobicContact CE1-CB 4.38Å; F650-Q654 WeakPolarHBondContact O-CB 3.38Å; F650-Q654 PolarHBondContact O-N 2.92Å; F650-H671 AromaticContact CD2-CE1 3.92Å; F650-H671 AromaticContact CE2-CD2 3.96Å; F650-H671 AromaticContact CE2-CE1 3.45Å; F650-H671 VanDerWaalsContact CE2-CE1 3.45Å; F650-H671 WeakPolarHBondContact CE2-CE1 3.36Å; F650-H671 AromaticContact CE2-ND1 3.97Å; F650-H671 AromaticContact CE2-NE2 3.45Å; F650-H671 WeakPolarHBondContact CE2-NE2 2.74Å; F650-H671 AromaticContact CZ-CE1 3.95Å; F650-H671 AromaticContact CZ-NE2 3.61Å
651	G	88.4	Confident	88.2	Confident	30 Å²	30	42.4 Å²	42.4	31%	0.309	21%	0.211	S	C	.	.	H	α-helix	trans	-60	-40.5	177.7	0	0	0	0	0	113.2	S649 Q654 R655	S649-G651 VanDerWaalsContact C-N 3.27Å; S649-G651 PolarHBondContact O-N 2.82Å; G651-Q654 PolarHBondContact O-N 2.97Å; G651-R655 WeakPolarHBondContact O-CG 3.17Å; G651-R655 PolarHBondContact O-N 3.2Å
652	S	88.3	Confident	88.2	Confident	15 Å²	15	36.6 Å²	36.6	11%	0.105	19%	0.194	C	C	.	.	H	α-helix	trans	-67.8	-41.6	176.1	-54.6	0	0	0	0	111.6	S649 F650 R655 A656	S649-S652 PolarHBondContact O-N 3.45Å; S649-S652 PolarHBondContact OG-N 2.89Å; S649-S652 PolarHBondContact OG-OG 2.91Å; F650-S652 VanDerWaalsContact C-N 3.33Å; F650-S652 PolarHBondContact O-N 3.36Å; S652-R655 PolarHBondContact O-N 3.4Å; S652-R655 PolarHBondContact OG-NH2 3.42Å; S652-A656 WeakPolarHBondContact O-CB 3.48Å; S652-A656 PolarHBondContact O-N 2.84Å
653	A	90.6	Very high	87.3	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.3	-45.7	174.5	0	0	0	0	0	112.2	I602 F647 S649 F650 A656 L657	I602-A653 HydrophobicContact CG2-CB 3.94Å; F647-A653 HydrophobicContact CB-CB 4.13Å; F647-A653 HydrophobicContact CD2-CB 3.74Å; F647-A653 HydrophobicContact CG-CB 4.16Å; S649-A653 PolarHBondContact O-N 3.46Å; F650-A653 WeakPolarHBondContact O-CB 3.37Å; F650-A653 PolarHBondContact O-N 2.78Å; A653-A656 PolarHBondContact O-N 3.41Å; A653-L657 WeakPolarHBondContact O-CB 3.12Å; A653-L657 PolarHBondContact O-N 3.39Å
654	Q	92.3	Very high	86.4	Confident	57 Å²	57	52.1 Å²	52.1	27%	0.266	27%	0.268	S	S	.	.	H	α-helix	trans	-64.1	-42.6	178.7	-174.8	63.2	59.5	0	0	112	F650 G651 L657 N658 H671	F650-Q654 HydrophobicContact CE1-CB 4.38Å; F650-Q654 WeakPolarHBondContact O-CB 3.38Å; F650-Q654 PolarHBondContact O-N 2.92Å; G651-Q654 PolarHBondContact O-N 2.97Å; Q654-L657 PolarHBondContact O-N 3.17Å; Q654-N658 PolarHBondContact NE2-OD1 3.48Å; Q654-N658 VanDerWaalsContact O-CG 3.23Å; Q654-N658 PolarHBondContact O-N 2.95Å; Q654-N658 PolarHBondContact O-OD1 2.85Å; Q654-H671 PolarHBondContact OE1-NE2 3.48Å
655	R	89.2	Confident	85.9	Confident	115 Å²	115	56 Å²	56	43%	0.434	28%	0.282	S	S	.	.	H	α-helix	trans	-61.5	-47.2	175.4	-74.9	-171.3	-63.2	-100.5	5.1	111.5	G651 S652 L657 N658 I659	G651-R655 WeakPolarHBondContact O-CG 3.17Å; G651-R655 PolarHBondContact O-N 3.2Å; S652-R655 PolarHBondContact O-N 3.4Å; S652-R655 PolarHBondContact OG-NH2 3.42Å; R655-L657 VanDerWaalsContact C-N 3.31Å; R655-L657 PolarHBondContact O-N 2.92Å; R655-N658 PolarHBondContact O-N 3.44Å; R655-I659 WeakPolarHBondContact O-CG1 3.39Å; R655-I659 PolarHBondContact O-N 2.85Å; R655-I659 VanDerWaalsContact O-N 3.1Å
656	A	90.3	Very high	85.8	Confident	3 Å²	3	63.8 Å²	63.8	3%	0.025	32%	0.316	C	S	.	.	H	α-helix	trans	-60.3	-43	176.9	0	0	0	0	0	111.5	I602 F622 F647 S652 A653 N658 I659 L660	I602-A656 HydrophobicContact CD1-CB 4.31Å; F622-A656 HydrophobicContact CD1-CB 3.77Å; F622-A656 HydrophobicContact CE1-CB 4.2Å; F622-A656 HydrophobicContact CG-CB 4.31Å; F647-A656 HydrophobicContact CE1-CB 3.84Å; F647-A656 HydrophobicContact CE2-CB 3.91Å; F647-A656 HydrophobicContact CZ-CB 3.36Å; S652-A656 WeakPolarHBondContact O-CB 3.48Å; S652-A656 PolarHBondContact O-N 2.84Å; A653-A656 PolarHBondContact O-N 3.41Å; A656-N658 PolarHBondContact O-N 3.43Å; A656-I659 PolarHBondContact O-N 2.97Å; A656-L660 HydrophobicContact CB-CD1 4.49Å; A656-L660 WeakPolarHBondContact O-CB 3.34Å; A656-L660 WeakPolarHBondContact O-CD1 3.27Å; A656-L660 WeakPolarHBondContact O-CG 3.31Å; A656-L660 PolarHBondContact O-N 3.17Å
657	L	92	Very high	86	Confident	14 Å²	14	63.7 Å²	63.7	7%	0.073	32%	0.317	C	S	.	.	H	α-helix	trans	-59.8	-45.5	176.8	-175.7	62.3	0	0	0	111.9	I602 L604 A653 Q654 R655 I659 L660 T661	I602-L657 HydrophobicContact CD1-CB 4.39Å; I602-L657 HydrophobicContact CG2-CB 4.36Å; L604-L657 HydrophobicContact CD2-CD1 4.28Å; A653-L657 WeakPolarHBondContact O-CB 3.12Å; A653-L657 PolarHBondContact O-N 3.39Å; Q654-L657 PolarHBondContact O-N 3.17Å; R655-L657 VanDerWaalsContact C-N 3.31Å; R655-L657 PolarHBondContact O-N 2.92Å; L657-I659 VanDerWaalsContact C-N 3.34Å; L657-I659 PolarHBondContact O-N 3.41Å; L657-L660 PolarHBondContact O-N 3.33Å; L657-T661 HydrophobicContact CD1-CG2 3.77Å; L657-T661 HydrophobicContact CG-CG2 4.34Å; L657-T661 WeakPolarHBondContact O-CB 3.42Å; L657-T661 WeakPolarHBondContact O-CG2 3.32Å; L657-T661 PolarHBondContact O-N 2.9Å; L657-T661 PolarHBondContact O-OG1 3.44Å
658	N	90.4	Very high	86.3	Confident	94 Å²	94	66.6 Å²	66.6	50%	0.503	33%	0.33	S	S	.	.	H	α-helix	trans	-61.6	-39.1	177.6	-68.6	-8.1	0	0	0	112.6	Q654 R655 A656 G662	Q654-N658 PolarHBondContact NE2-OD1 3.48Å; Q654-N658 VanDerWaalsContact O-CG 3.23Å; Q654-N658 PolarHBondContact O-N 2.95Å; Q654-N658 PolarHBondContact O-OD1 2.85Å; R655-N658 PolarHBondContact O-N 3.44Å; A656-N658 PolarHBondContact O-N 3.43Å; N658-G662 WeakPolarHBondContact O-CA 3.48Å; N658-G662 PolarHBondContact O-N 3.35Å
659	I	88.3	Confident	87	Confident	67 Å²	67	62.5 Å²	62.5	34%	0.344	32%	0.315	S	S	.	.	H	α-helix	trans	-67.1	-47.5	176.7	-66.7	164.8	0	0	0	110.6	F622 R655 A656 L657 G662	F622-I659 HydrophobicContact CE1-CB 4.4Å; F622-I659 HydrophobicContact CE1-CD1 4.35Å; F622-I659 HydrophobicContact CE1-CG2 4.16Å; R655-I659 WeakPolarHBondContact O-CG1 3.39Å; R655-I659 PolarHBondContact O-N 2.85Å; R655-I659 VanDerWaalsContact O-N 3.1Å; A656-I659 PolarHBondContact O-N 2.97Å; L657-I659 VanDerWaalsContact C-N 3.34Å; L657-I659 PolarHBondContact O-N 3.41Å; I659-G662 PolarHBondContact O-N 2.95Å
660	L	89	Confident	87.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-74	-29.8	-173.1	-69.4	166.9	0	0	0	113	I602 L604 F611 F622 L645 A656 L657 W665 L667	I602-L660 HydrophobicContact CD1-CD1 4.18Å; L604-L660 HydrophobicContact CD1-CD1 3.6Å; L604-L660 HydrophobicContact CD2-CB 4.13Å; L604-L660 HydrophobicContact CD2-CD1 4.23Å; F611-L660 HydrophobicContact CE2-CD2 3.55Å; F611-L660 HydrophobicContact CZ-CD2 3.61Å; F622-L660 HydrophobicContact CE1-CD1 4.34Å; F622-L660 HydrophobicContact CE1-CD2 4.49Å; F622-L660 HydrophobicContact CE1-CG 4.22Å; F622-L660 HydrophobicContact CE2-CD1 4.37Å; F622-L660 HydrophobicContact CE2-CD2 4.31Å; F622-L660 HydrophobicContact CZ-CD1 3.93Å; F622-L660 HydrophobicContact CZ-CD2 3.65Å; F622-L660 HydrophobicContact CZ-CG 3.82Å; L645-L660 HydrophobicContact CD1-CD1 4.1Å; A656-L660 HydrophobicContact CB-CD1 4.49Å; A656-L660 WeakPolarHBondContact O-CB 3.34Å; A656-L660 WeakPolarHBondContact O-CD1 3.27Å; A656-L660 WeakPolarHBondContact O-CG 3.31Å; A656-L660 PolarHBondContact O-N 3.17Å; L657-L660 PolarHBondContact O-N 3.33Å; L660-W665 HydrophobicContact CD2-CG 4.16Å; L660-W665 VanDerWaalsContact O-CB 3.26Å; L660-W665 WeakPolarHBondContact O-CB 3.49Å; L660-L667 HydrophobicContact CD2-CD1 4.25Å; L660-L667 WeakPolarHBondContact O-CB 3.5Å; L660-L667 PolarHBondContact O-N 3.21Å
661	T	88.8	Confident	87.9	Confident	57 Å²	57	56.7 Å²	56.7	35%	0.35	28%	0.284	S	S	.	.	H	α-helix	trans	-87.8	-11.3	173	58.6	0	0	0	0	112.9	L657 L667	L657-T661 HydrophobicContact CD1-CG2 3.77Å; L657-T661 HydrophobicContact CG-CG2 4.34Å; L657-T661 WeakPolarHBondContact O-CB 3.42Å; L657-T661 WeakPolarHBondContact O-CG2 3.32Å; L657-T661 PolarHBondContact O-N 2.9Å; L657-T661 PolarHBondContact O-OG1 3.44Å; T661-L667 WeakPolarHBondContact CA-O 3.33Å
662	G	85.3	Confident	88.1	Confident	27 Å²	27	55.4 Å²	55.4	28%	0.278	27%	0.271	S	S	.	.	S	Bend	trans	-71.8	-171.3	-179.5	0	0	0	0	0	114.6	N658 I659 D664 K666	N658-G662 WeakPolarHBondContact O-CA 3.48Å; N658-G662 PolarHBondContact O-N 3.35Å; I659-G662 PolarHBondContact O-N 2.95Å; G662-D664 PolarHBondContact O-N 3.1Å; G662-K666 WeakPolarHBondContact O-CA 3.45Å; G662-K666 PolarHBondContact O-N 3.29Å
663	K	72.1	Confident	88.4	Confident	189 Å²	189	54.7 Å²	54.7	82%	0.822	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.8	-170.4	-69.7	-177.6	-179.7	175.8	0	114.2	K666	K663-K666 VanDerWaalsContact O-CE 3.23Å; K663-K666 WeakPolarHBondContact O-CE 3.31Å
664	D	70.5	Confident	88.3	Confident	145 Å²	145	54.9 Å²	54.9	78%	0.775	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-44	-172.3	-60.3	-41.7	0	0	0	112.5	G662	G662-D664 PolarHBondContact O-N 3.1Å
665	W	78.9	Confident	88	Confident	91 Å²	91	52.2 Å²	52.2	35%	0.345	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-32.8	-174.3	-66.1	101.5	0	0	0	113.3	F611 L660 L667	F611-W665 HydrophobicContact CD2-CD2 4.4Å; F611-W665 AromaticContact CD2-CE3 3.75Å; F611-W665 HydrophobicContact CD2-CE3 3.75Å; F611-W665 AromaticContact CD2-CH2 3.88Å; F611-W665 HydrophobicContact CD2-CH2 3.88Å; F611-W665 AromaticContact CD2-CZ3 3.48Å; F611-W665 HydrophobicContact CD2-CZ3 3.48Å; F611-W665 VanDerWaalsContact CD2-CZ3 3.48Å; F611-W665 HydrophobicContact CE2-CD2 4.3Å; F611-W665 HydrophobicContact CE2-CE3 4.09Å; F611-W665 HydrophobicContact CE2-CH2 4.31Å; F611-W665 HydrophobicContact CE2-CZ3 4.12Å; L660-W665 HydrophobicContact CD2-CG 4.16Å; L660-W665 VanDerWaalsContact O-CB 3.26Å; L660-W665 WeakPolarHBondContact O-CB 3.49Å; W665-L667 HydrophobicContact CB-CG 4.19Å; W665-L667 PolarHBondContact O-N 2.73Å; W665-L667 VanDerWaalsContact O-N 3.09Å
666	K	85.1	Confident	87.5	Confident	164 Å²	164	48.8 Å²	48.8	71%	0.713	24%	0.241	S	C	*	.			trans	51.3	30.9	179.8	-56	179.3	-179.1	177.7	0	113.5	G662 K663	G662-K666 WeakPolarHBondContact O-CA 3.45Å; G662-K666 PolarHBondContact O-N 3.29Å; K663-K666 VanDerWaalsContact O-CE 3.23Å; K663-K666 WeakPolarHBondContact O-CE 3.31Å
667	L	90.3	Very high	87.1	Confident	22 Å²	22	48.7 Å²	48.7	12%	0.115	24%	0.24	C	C	.	.			trans	-73.3	159	173.6	-61.9	176.9	0	0	0	109.5	G606 F611 L660 T661 W665	G606-L667 WeakPolarHBondContact O-CD2 3.49Å; F611-L667 HydrophobicContact CE2-CD1 4.27Å; F611-L667 HydrophobicContact CZ-CD1 4.28Å; L660-L667 HydrophobicContact CD2-CD1 4.25Å; L660-L667 WeakPolarHBondContact O-CB 3.5Å; L660-L667 PolarHBondContact O-N 3.21Å; T661-L667 WeakPolarHBondContact CA-O 3.33Å; W665-L667 HydrophobicContact CB-CG 4.19Å; W665-L667 PolarHBondContact O-N 2.73Å; W665-L667 VanDerWaalsContact O-N 3.09Å
668	K	92.6	Very high	86.8	Confident	63 Å²	63	48 Å²	48	27%	0.274	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	129.7	171	-62.8	-148.5	-176.4	-178.3	0	108.7	S527 F528 L557 L604 F605	S527-K668 VanDerWaalsContact O-CD 3.3Å; S527-K668 WeakPolarHBondContact O-CD 3.2Å; S527-K668 WeakPolarHBondContact OG-CE 3.18Å; S527-K668 PolarHBondContact OG-NZ 2.97Å; F528-K668 HydrophobicContact CD1-CD 3.49Å; F528-K668 VanDerWaalsContact CD1-CD 3.49Å; F528-K668 HydrophobicContact CE1-CD 3.55Å; F528-K668 HydrophobicContact CG-CD 4.23Å; F528-K668 HydrophobicContact CZ-CD 4.31Å; L557-K668 HydrophobicContact CD2-CB 4.02Å; L604-K668 CarbonylContact C-O 3.54Å; L604-K668 WeakPolarHBondContact CA-O 3.13Å; F605-K668 PolarHBondContact N-O 2.77Å; F605-K668 PolarHBondContact O-N 3.41Å
669	G	94.1	Very high	86.3	Confident	13 Å²	13	44.5 Å²	44.5	13%	0.134	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	167.3	-177.9	0	0	0	0	0	113.6	Y603	Y603-G669 CarbonylContact O-C 3.53Å; Y603-G669 WeakPolarHBondContact O-CA 3.27Å
670	R	94.9	Very high	85.8	Confident	8 Å²	8	41.7 Å²	41.7	3%	0.03	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	173.5	177.1	58.5	161.6	-52.2	122.6	-2.3	109.9	E553 L557 E560 E593 I602 Y603	E553-R670 HydrophobicContact CB-CG 4.33Å; E553-R670 VanDerWaalsContact O-CD 3.22Å; E553-R670 WeakPolarHBondContact O-CD 3.21Å; L557-R670 HydrophobicContact CB-CG 4.35Å; L557-R670 HydrophobicContact CD1-CB 4.21Å; E560-R670 IonicContact OE1-CZ 3.85Å; E560-R670 IonicContact OE1-NH1 3.61Å; E560-R670 PolarHBondContact OE1-NH1 2.89Å; E560-R670 IonicContact OE1-NH2 3.11Å; E560-R670 PolarHBondContact OE1-NH2 3.34Å; E560-R670 IonicContact OE2-CZ 3.88Å; E560-R670 IonicContact OE2-NH1 3.74Å; E560-R670 PolarHBondContact OE2-NH1 3.5Å; E593-R670 IonicContact OE1-CZ 3.45Å; E593-R670 IonicContact OE1-NH2 2.69Å; E593-R670 PolarHBondContact OE1-NH2 3.5Å; E593-R670 IonicContact OE2-NH2 2.82Å; E593-R670 PolarHBondContact OE2-NH2 2.91Å; I602-R670 CarbonylContact C-O 3.48Å; I602-R670 WeakPolarHBondContact CA-O 3.17Å; Y603-R670 HydrophobicContact CD1-CG 4.18Å; Y603-R670 PolarHBondContact N-O 3.18Å; Y603-R670 PolarHBondContact O-N 3.06Å
671	H	95.1	Very high	85.3	Confident	17 Å²	17	42.4 Å²	42.4	8%	0.079	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	142.6	162.7	-69.4	-70.8	0	0	0	111	F650 Q654	F650-H671 AromaticContact CD2-CE1 3.92Å; F650-H671 AromaticContact CE2-CD2 3.96Å; F650-H671 AromaticContact CE2-CE1 3.45Å; F650-H671 VanDerWaalsContact CE2-CE1 3.45Å; F650-H671 WeakPolarHBondContact CE2-CE1 3.36Å; F650-H671 AromaticContact CE2-ND1 3.97Å; F650-H671 AromaticContact CE2-NE2 3.45Å; F650-H671 WeakPolarHBondContact CE2-NE2 2.74Å; F650-H671 AromaticContact CZ-CE1 3.95Å; F650-H671 AromaticContact CZ-NE2 3.61Å; Q654-H671 PolarHBondContact OE1-NE2 3.48Å
672	A	92.9	Very high	84.8	Confident	2 Å²	2	41.4 Å²	41.4	2%	0.017	20%	0.199	C	C	.	.			trans	-67	145.1	179.7	0	0	0	0	0	110	N598 S601 F644	N598-A672 WeakPolarHBondContact CB-O 3.21Å; S601-A672 WeakPolarHBondContact O-CB 3.47Å; S601-A672 PolarHBondContact O-N 2.55Å; F644-A672 HydrophobicContact CD1-CB 4.03Å; F644-A672 HydrophobicContact CE1-CB 4.14Å
673	L	93.1	Very high	84.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	20%	0.203	C	C	.	.			trans	-104.8	-26.4	177.9	-68.6	176.2	0	0	0	111.2	L552 E553 Q556 V589 L592 E593 N598	L552-L673 HydrophobicContact CD2-CB 4.14Å; L552-L673 HydrophobicContact CD2-CD1 4.24Å; L552-L673 HydrophobicContact CG-CB 4.36Å; L552-L673 HydrophobicContact CG-CD1 3.86Å; E553-L673 HydrophobicContact CG-CB 4.25Å; E553-L673 HydrophobicContact CG-CG 4.45Å; E553-L673 PolarHBondContact OE1-N 2.97Å; E553-L673 VanDerWaalsContact OE1-N 3.1Å; Q556-L673 HydrophobicContact CB-CD1 3.52Å; Q556-L673 HydrophobicContact CG-CD1 3.9Å; V589-L673 HydrophobicContact CG1-CD1 4.07Å; V589-L673 HydrophobicContact CG1-CD2 4.04Å; L592-L673 WeakPolarHBondContact CB-O 3.3Å; L592-L673 WeakPolarHBondContact CD2-O 3.39Å; E593-L673 HydrophobicContact CB-CD2 3.58Å; E593-L673 HydrophobicContact CG-CD2 4.07Å; N598-L673 VanDerWaalsContact ND2-C 3.26Å; N598-L673 PolarHBondContact ND2-O 3.08Å
674	T	89.6	Confident	83.5	Confident	4 Å²	4	38.8 Å²	38.8	3%	0.025	20%	0.196	C	C	.	.	S	Bend	trans	-120	121.4	-167.3	56.4	0	0	0	0	109.7	W501 L552 E553 L678 H679	W501-T674 HydrophobicContact CH2-CG2 3.97Å; W501-T674 HydrophobicContact CZ2-CG2 3.41Å; W501-T674 VanDerWaalsContact CZ2-CG2 3.41Å; L552-T674 HydrophobicContact CB-CG2 3.77Å; L552-T674 HydrophobicContact CD2-CG2 3.62Å; L552-T674 HydrophobicContact CG-CG2 4.25Å; E553-T674 PolarHBondContact OE1-N 3.14Å; E553-T674 PolarHBondContact OE1-OG1 3.37Å; E553-T674 PolarHBondContact OE2-OG1 3.49Å; T674-L678 HydrophobicContact CG2-CD2 4.46Å; T674-H679 PolarHBondContact O-CD2 3.15Å; T674-H679 VanDerWaalsContact O-CD2 3.22Å; T674-H679 PolarHBondContact OG1-CD2 3.13Å; T674-H679 PolarHBondContact OG1-CE1 2.84Å; T674-H679 PolarHBondContact OG1-NE2 3.24Å
675	P	85.5	Confident	82.8	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.006	17%	0.168	C	C	.	.			trans	-59	154.5	-179.9	-27.1	36	0	0	0	111.8	E597 N598 H677 L678 H679	E597-P675 HydrophobicContact CB-CB 4.09Å; E597-P675 HydrophobicContact CB-CG 4.17Å; N598-P675 WeakPolarHBondContact OD1-CA 3.49Å; P675-H677 VanDerWaalsContact C-N 3.3Å; P675-H677 WeakPolarHBondContact CB-CE1 3.2Å; P675-H677 PolarHBondContact O-N 3.01Å; P675-L678 HydrophobicContact CB-CB 4.45Å; P675-L678 WeakPolarHBondContact O-CA 3.42Å; P675-L678 WeakPolarHBondContact O-CB 3.35Å; P675-L678 PolarHBondContact O-N 2.97Å; P675-H679 PolarHBondContact O-N 3.32Å
676	R	79.3	Confident	81.3	Confident	43 Å²	43	34.4 Å²	34.4	16%	0.162	19%	0.185	C	C	.	.	H	α-helix	trans	-56.6	-43.2	-176	-59.7	-178.5	176.2	-155.5	-11.9	113	C59 A627 I629 L678 H679 A680	C59-R676 WeakPolarHBondContact SG-CB 3.32Å; A627-R676 VanDerWaalsContact CB-NH2 3.27Å; I629-R676 HydrophobicContact CD1-CG 3.63Å; I629-R676 VanDerWaalsContact CG1-CZ 3.47Å; I629-R676 VanDerWaalsContact CG1-NH2 3.3Å; R676-L678 VanDerWaalsContact C-N 3.29Å; R676-L678 PolarHBondContact O-N 3.33Å; R676-H679 WeakPolarHBondContact O-CB 3.39Å; R676-H679 PolarHBondContact O-N 3.47Å; R676-A680 PolarHBondContact O-N 3.09Å
677	H	81.4	Confident	79.3	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-66.4	-30.6	178.2	56.9	-87.4	0	0	0	112.8	C59 Q107 Y111 K127 R129 E597 P675 W681	C59-H677 HydrophobicContact CB-CB 4.07Å; Q107-H677 PolarHBondContact NE2-O 3.46Å; Y111-H677 AromaticContact CZ-NE2 3.91Å; Y111-H677 PolarHBondContact OH-CD2 2.85Å; Y111-H677 PolarHBondContact OH-NE2 3.07Å; K127-H677 WeakPolarHBondContact CB-CE1 3.47Å; K127-H677 PolarHBondContact O-ND1 3.05Å; R129-H677 HydrophobicContact CG-CB 3.63Å; E597-H677 IonicContact OE2-ND1 2.72Å; P675-H677 VanDerWaalsContact C-N 3.3Å; P675-H677 WeakPolarHBondContact CB-CE1 3.2Å; P675-H677 PolarHBondContact O-N 3.01Å; H677-W681 VanDerWaalsContact O-CB 3.31Å; H677-W681 WeakPolarHBondContact O-CB 3.35Å; H677-W681 PolarHBondContact O-N 3.02Å
678	L	85.4	Confident	77	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-70.4	-47.3	173	-178.3	53.2	0	0	0	110.8	Y111 W501 L592 T674 P675 R676 A680 W681 L682	Y111-L678 HydrophobicContact CD1-CD1 4.15Å; Y111-L678 HydrophobicContact CD1-CD2 4.1Å; Y111-L678 HydrophobicContact CD2-CD1 4.02Å; Y111-L678 HydrophobicContact CE1-CB 4.43Å; Y111-L678 HydrophobicContact CE1-CD1 4.03Å; Y111-L678 HydrophobicContact CE1-CD2 3.58Å; Y111-L678 HydrophobicContact CE1-CG 4.22Å; Y111-L678 HydrophobicContact CE2-CB 4.4Å; Y111-L678 HydrophobicContact CE2-CD1 3.88Å; Y111-L678 HydrophobicContact CG-CD1 4.14Å; W501-L678 HydrophobicContact CH2-CD2 3.45Å; W501-L678 VanDerWaalsContact CH2-CD2 3.45Å; W501-L678 HydrophobicContact CH2-CG 4.36Å; W501-L678 HydrophobicContact CZ2-CD2 3.67Å; W501-L678 HydrophobicContact CZ2-CG 4.19Å; W501-L678 HydrophobicContact CZ3-CD2 4.3Å; L592-L678 HydrophobicContact CD2-CD2 4.46Å; T674-L678 HydrophobicContact CG2-CD2 4.46Å; P675-L678 HydrophobicContact CB-CB 4.45Å; P675-L678 WeakPolarHBondContact O-CA 3.42Å; P675-L678 WeakPolarHBondContact O-CB 3.35Å; P675-L678 PolarHBondContact O-N 2.97Å; R676-L678 VanDerWaalsContact C-N 3.29Å; R676-L678 PolarHBondContact O-N 3.33Å; L678-A680 VanDerWaalsContact C-N 3.3Å; L678-A680 PolarHBondContact O-N 2.89Å; L678-W681 HydrophobicContact CD1-CE3 3.66Å; L678-W681 HydrophobicContact CD1-CZ3 4.04Å; L678-W681 PolarHBondContact O-N 3.13Å; L678-L682 HydrophobicContact CD1-CD1 3.72Å; L678-L682 HydrophobicContact CD1-CD2 4.48Å; L678-L682 HydrophobicContact CD1-CG 3.94Å; L678-L682 HydrophobicContact CG-CD1 3.73Å; L678-L682 HydrophobicContact CG-CG 4.41Å; L678-L682 WeakPolarHBondContact O-CB 3.46Å; L678-L682 WeakPolarHBondContact O-CD1 3.44Å; L678-L682 VanDerWaalsContact O-CG 3.25Å; L678-L682 WeakPolarHBondContact O-CG 3.39Å; L678-L682 PolarHBondContact O-N 3.3Å
679	H	79.1	Confident	74.2	Confident	21 Å²	21	38.8 Å²	38.8	10%	0.097	23%	0.234	C	C	.	.	H	α-helix	trans	-54.5	-44.2	173.4	-95.9	-60.1	0	0	0	112.7	E553 F644 T674 P675 R676 R683	E553-H679 IonicContact OE1-CE1 3.22Å; E553-H679 IonicContact OE1-NE2 2.75Å; E553-H679 PolarHBondContact OE1-NE2 3.14Å; E553-H679 IonicContact OE2-CE1 3.7Å; E553-H679 PolarHBondContact OE2-CE1 3.24Å; E553-H679 IonicContact OE2-NE2 3.69Å; E553-H679 PolarHBondContact OE2-NE2 3.36Å; F644-H679 AromaticContact CE1-NE2 3.69Å; F644-H679 AromaticContact CE2-NE2 3.69Å; F644-H679 AromaticContact CZ-CD2 3.89Å; F644-H679 AromaticContact CZ-CE1 3.65Å; F644-H679 AromaticContact CZ-NE2 3.07Å; F644-H679 WeakPolarHBondContact CZ-NE2 3.37Å; T674-H679 PolarHBondContact O-CD2 3.15Å; T674-H679 VanDerWaalsContact O-CD2 3.22Å; T674-H679 PolarHBondContact OG1-CD2 3.13Å; T674-H679 PolarHBondContact OG1-CE1 2.84Å; T674-H679 PolarHBondContact OG1-NE2 3.24Å; P675-H679 PolarHBondContact O-N 3.32Å; R676-H679 WeakPolarHBondContact O-CB 3.39Å; R676-H679 PolarHBondContact O-N 3.47Å; H679-R683 WeakPolarHBondContact O-CG 2.96Å; H679-R683 PolarHBondContact O-N 3.1Å; H679-R683 PolarHBondContact O-NE 3.21Å
680	A	77.8	Confident	71.4	Confident	8 Å²	8	49.6 Å²	49.6	7%	0.066	27%	0.271	C	S	.	.	H	α-helix	trans	-65.8	-44.7	177.2	0	0	0	0	0	111.8	R676 L678 L682 R683 G684	R676-A680 PolarHBondContact O-N 3.09Å; L678-A680 VanDerWaalsContact C-N 3.3Å; L678-A680 PolarHBondContact O-N 2.89Å; A680-L682 PolarHBondContact O-N 3.47Å; A680-R683 PolarHBondContact O-N 3.09Å; A680-G684 PolarHBondContact O-N 3.24Å
681	W	79.7	Confident	68.5	Low	15 Å²	15	58.7 Å²	58.7	6%	0.057	31%	0.305	C	S	.	.	H	α-helix	trans	-62.4	-43.5	179.3	179.6	45.6	0	0	0	112.4	Q107 L108 Y111 M497 H677 L678 R683 G684	Q107-W681 HydrophobicContact CG-CD2 4.07Å; Q107-W681 HydrophobicContact CG-CE3 4.01Å; Q107-W681 HydrophobicContact CG-CZ3 4.37Å; Q107-W681 VanDerWaalsContact NE2-CB 3.34Å; L108-W681 HydrophobicContact CB-CH2 4.25Å; L108-W681 HydrophobicContact CB-CZ2 4.07Å; L108-W681 HydrophobicContact CD1-CH2 3.88Å; L108-W681 HydrophobicContact CD1-CZ2 4.06Å; Y111-W681 AromaticContact CD2-CE3 3.96Å; Y111-W681 HydrophobicContact CD2-CE3 3.96Å; Y111-W681 AromaticContact CD2-CZ3 3.63Å; Y111-W681 HydrophobicContact CD2-CZ3 3.63Å; Y111-W681 HydrophobicContact CE2-CE3 4.42Å; Y111-W681 HydrophobicContact CG-CZ3 4.06Å; M497-W681 HydrophobicContact CG-CH2 4.25Å; H677-W681 VanDerWaalsContact O-CB 3.31Å; H677-W681 WeakPolarHBondContact O-CB 3.35Å; H677-W681 PolarHBondContact O-N 3.02Å; L678-W681 HydrophobicContact CD1-CE3 3.66Å; L678-W681 HydrophobicContact CD1-CZ3 4.04Å; L678-W681 PolarHBondContact O-N 3.13Å; W681-R683 VanDerWaalsContact C-N 3.34Å; W681-R683 PolarHBondContact O-N 2.94Å; W681-G684 PolarHBondContact O-N 2.82Å
682	L	77.9	Confident	65.3	Low	35 Å²	35	63.2 Å²	63.2	18%	0.183	34%	0.336	C	S	.	.	H	α-helix	trans	-68.5	-31.2	179.4	-67.2	162.3	0	0	0	113.2	W501 L678 A680 G684 L685	W501-L682 HydrophobicContact CB-CD2 4.17Å; W501-L682 HydrophobicContact CD2-CD1 3.97Å; W501-L682 HydrophobicContact CD2-CD2 4.2Å; W501-L682 HydrophobicContact CG-CD1 4.03Å; W501-L682 HydrophobicContact CG-CD2 3.75Å; W501-L682 HydrophobicContact CZ2-CD1 3.8Å; L678-L682 HydrophobicContact CD1-CD1 3.72Å; L678-L682 HydrophobicContact CD1-CD2 4.48Å; L678-L682 HydrophobicContact CD1-CG 3.94Å; L678-L682 HydrophobicContact CG-CD1 3.73Å; L678-L682 HydrophobicContact CG-CG 4.41Å; L678-L682 WeakPolarHBondContact O-CB 3.46Å; L678-L682 WeakPolarHBondContact O-CD1 3.44Å; L678-L682 VanDerWaalsContact O-CG 3.25Å; L678-L682 WeakPolarHBondContact O-CG 3.39Å; L678-L682 PolarHBondContact O-N 3.3Å; A680-L682 PolarHBondContact O-N 3.47Å; L682-G684 VanDerWaalsContact C-N 3.34Å; L682-L685 HydrophobicContact CD2-CD1 4.36Å
683	R	70.4	Confident	62.4	Low	96 Å²	96	68.3 Å²	68.3	36%	0.362	38%	0.378	S	S	.	.	H	α-helix	trans	-71.3	-26.7	175.6	-78.8	-174.5	-68.5	176.5	2.6	113.6	H679 A680 W681 L685	H679-R683 WeakPolarHBondContact O-CG 2.96Å; H679-R683 PolarHBondContact O-N 3.1Å; H679-R683 PolarHBondContact O-NE 3.21Å; A680-R683 PolarHBondContact O-N 3.09Å; W681-R683 VanDerWaalsContact C-N 3.34Å; W681-R683 PolarHBondContact O-N 2.94Å; R683-L685 VanDerWaalsContact C-N 3.28Å; R683-L685 PolarHBondContact O-N 3.22Å
684	G	59.6	Low	59.6	Low	65 Å²	65	72 Å²	72	67%	0.67	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-6.4	178.9	0	0	0	0	0	114.5	A680 W681 L682	A680-G684 PolarHBondContact O-N 3.24Å; W681-G684 PolarHBondContact O-N 2.82Å; L682-G684 VanDerWaalsContact C-N 3.34Å
685	L	56.9	Low	56.6	Low	37 Å²	37	78.8 Å²	78.8	19%	0.194	45%	0.451	C	S	.	.	S	Bend	trans	-83.7	131.1	-179.1	-68.6	164.5	0	0	0	110.5	R498 L682 R683 S687	R498-L685 HydrophobicContact CG-CD1 3.97Å; L682-L685 HydrophobicContact CD2-CD1 4.36Å; R683-L685 VanDerWaalsContact C-N 3.28Å; R683-L685 PolarHBondContact O-N 3.22Å; L685-S687 PolarHBondContact O-N 3.34Å
686	P	46.6	Very low	54.2	Low	107 Å²	107	90.6 Å²	90.6	70%	0.695	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-58	137.2	175.5	-18.9	29.3	0	0	0	110.9	E688	P686-E688 PolarHBondContact O-N 2.89Å
687	S	41.9	Very low	51.9	Low	120 Å²	120	93.1 Å²	93.1	84%	0.839	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-70.7	119.3	171.7	-57.4	0	0	0	0	109.4	L685	L685-S687 PolarHBondContact O-N 3.34Å
688	E	42.9	Very low	49.7	Very low	112 Å²	112	98.1 Å²	98.1	52%	0.523	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-62.6	138.6	170.9	-82.6	-178.3	-162.9	0	0	110.2	R498 P686	R498-E688 IonicContact CZ-OE1 3.52Å; R498-E688 IonicContact NE-OE1 2.86Å; R498-E688 IonicContact NH2-OE1 3.82Å; R498-E688 PolarHBondContact NH2-OE1 2.71Å; P686-E688 PolarHBondContact O-N 2.89Å
689	S	33.2	Very low	47.7	Very low	110 Å²	110	100.2 Å²	100.2	77%	0.769	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-63.1	136.2	173	52.3	0	0	0	0	109.8	R691	S689-R691 PolarHBondContact O-N 3.11Å
690	R	36.9	Very low	46	Very low	240 Å²	240	102.5 Å²	102.5	91%	0.906	58%	0.577	S	S	*	*			trans	-40.8	120.1	-179.8	-79.4	178.2	174.6	176.6	-2.2	111.8
691	R	32.8	Very low	44.6	Very low	198 Å²	198	107 Å²	107	75%	0.747	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-94.6	133.2	151.8	-70.2	-172.3	-176.2	-171.5	1.1	108.6	S689 A693	S689-R691 PolarHBondContact O-N 3.11Å; R691-A693 PolarHBondContact O-N 3.02Å
692	P	27.5	Very low	43.1	Very low	112 Å²	112	112.1 Å²	112.1	73%	0.727	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-59.2	137.8	172.9	-17.3	29.2	0	0	0	110.1	G694	P692-G694 PolarHBondContact O-N 2.93Å
693	A	33.6	Very low	41.7	Very low	109 Å²	109	113.7 Å²	113.7	90%	0.901	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	121.9	165.8	0	0	0	0	0	108.2	R691	R691-A693 PolarHBondContact O-N 3.02Å
694	G	34.3	Very low	40.9	Very low	77 Å²	77	112.7 Å²	112.7	79%	0.794	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	140.8	-21.5	170.4	0	0	0	0	0	117.7	P692	P692-G694 PolarHBondContact O-N 2.93Å
695	L	26.2	Very low	40.7	Very low	148 Å²	148	115.3 Å²	115.3	78%	0.775	63%	0.629	S	S	*	*			trans	-98.2	105.3	174.5	-91.8	94.2	0	0	0	111.5	V697	L695-V697 HydrophobicContact CB-CG2 4.28Å; L695-V697 PolarHBondContact O-N 3.26Å
696	R	35.5	Very low	40.6	Very low	249 Å²	249	114.2 Å²	114.2	94%	0.94	63%	0.625	S	S	*	*			trans	-66.4	84.6	155.3	-80.7	-171.5	-177.9	-171.6	1.7	107.8	V698	R696-V698 PolarHBondContact O-N 2.86Å
697	V	31.2	Very low	40.9	Very low	95 Å²	95	110.7 Å²	110.7	58%	0.576	60%	0.6	S	S	*	*			trans	-69.7	109.7	160.9	-178.9	0	0	0	0	105.4	L695 P699	L695-V697 HydrophobicContact CB-CG2 4.28Å; L695-V697 PolarHBondContact O-N 3.26Å; V697-P699 WeakPolarHBondContact O-CD 3.47Å; V697-P699 VanDerWaalsContact O-N 3.15Å
698	V	35.1	Very low	41.7	Very low	106 Å²	106	111.1 Å²	111.1	64%	0.642	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-51.1	118.6	167.4	174.4	0	0	0	0	106.5	R696	R696-V698 PolarHBondContact O-N 2.86Å
699	P	42.6	Very low	42.3	Very low	44 Å²	44	109.8 Å²	109.8	29%	0.286	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-53.7	140.2	178.5	-21.7	30.6	0	0	0	108.5	V697 E703 Q704 L707	V697-P699 WeakPolarHBondContact O-CD 3.47Å; V697-P699 VanDerWaalsContact O-N 3.15Å; P699-E703 HydrophobicContact CB-CB 3.6Å; P699-E703 WeakPolarHBondContact CB-OE2 3.44Å; P699-Q704 HydrophobicContact CB-CG 4.11Å; P699-Q704 WeakPolarHBondContact O-CG 3.16Å; P699-Q704 PolarHBondContact O-NE2 2.85Å; P699-L707 HydrophobicContact CB-CD1 4.24Å; P699-L707 HydrophobicContact CG-CD1 4Å
700	P	43	Very low	43.3	Very low	70 Å²	70	105.7 Å²	105.7	46%	0.455	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-49.4	149.4	174.3	12.8	-23.7	0	0	0	110.3	F702 E703 Q704	P700-F702 PolarHBondContact O-N 3.41Å; P700-E703 HydrophobicContact CG-CB 4.34Å; P700-E703 HydrophobicContact CG-CG 3.99Å; P700-E703 WeakPolarHBondContact O-CA 3.33Å; P700-E703 WeakPolarHBondContact O-CB 3.48Å; P700-E703 PolarHBondContact O-N 3.12Å; P700-Q704 PolarHBondContact O-N 3.37Å
701	P	48.5	Very low	44.1	Very low	102 Å²	102	99.9 Å²	99.9	66%	0.662	54%	0.539	S	S	*	.	H	α-helix	trans	-49.1	-35.1	-171.4	-28.1	33.2	0	0	0	114	Q704 E705	P701-Q704 WeakPolarHBondContact O-CB 2.92Å; P701-Q704 PolarHBondContact O-N 2.91Å; P701-E705 PolarHBondContact O-N 3.2Å; P701-E705 VanDerWaalsContact O-N 3.17Å
702	F	48.6	Very low	45.1	Very low	123 Å²	123	95.9 Å²	95.9	54%	0.539	53%	0.532	S	S	.	.	H	α-helix	trans	-68.5	-35.6	176.8	-169.4	-106.1	0	0	0	114.6	I488 P700 Q704 A706	I488-F702 HydrophobicContact CD1-CE1 3.5Å; I488-F702 VanDerWaalsContact CD1-CE1 3.5Å; I488-F702 HydrophobicContact CD1-CZ 3.51Å; I488-F702 HydrophobicContact CG1-CE1 4.1Å; I488-F702 HydrophobicContact CG2-CE1 3.97Å; P700-F702 PolarHBondContact O-N 3.41Å; F702-Q704 VanDerWaalsContact C-N 3.29Å; F702-A706 PolarHBondContact O-N 2.92Å
703	E	48.1	Very low	46.4	Very low	68 Å²	68	95.5 Å²	95.5	32%	0.318	52%	0.523	S	S	.	.	H	α-helix	trans	-68.1	-31.8	171	-75.9	-174.8	-178.3	0	0	110.6	P699 P700 A706 L707	P699-E703 HydrophobicContact CB-CB 3.6Å; P699-E703 WeakPolarHBondContact CB-OE2 3.44Å; P700-E703 HydrophobicContact CG-CB 4.34Å; P700-E703 HydrophobicContact CG-CG 3.99Å; P700-E703 WeakPolarHBondContact O-CA 3.33Å; P700-E703 WeakPolarHBondContact O-CB 3.48Å; P700-E703 PolarHBondContact O-N 3.12Å; E703-A706 PolarHBondContact O-N 2.94Å; E703-L707 VanDerWaalsContact O-CB 3.29Å; E703-L707 WeakPolarHBondContact O-CB 3.23Å; E703-L707 WeakPolarHBondContact O-CD1 3.44Å; E703-L707 PolarHBondContact O-N 3.29Å
704	Q	54.1	Low	47.8	Very low	75 Å²	75	97 Å²	97	35%	0.35	51%	0.511	S	S	.	.	H	α-helix	trans	-67.8	-38	176.7	-61.3	-178.1	13	0	0	113	P699 P700 P701 F702 L707 Q708	P699-Q704 HydrophobicContact CB-CG 4.11Å; P699-Q704 WeakPolarHBondContact O-CG 3.16Å; P699-Q704 PolarHBondContact O-NE2 2.85Å; P700-Q704 PolarHBondContact O-N 3.37Å; P701-Q704 WeakPolarHBondContact O-CB 2.92Å; P701-Q704 PolarHBondContact O-N 2.91Å; F702-Q704 VanDerWaalsContact C-N 3.29Å; Q704-L707 WeakPolarHBondContact O-CB 3.42Å; Q704-L707 PolarHBondContact O-N 2.84Å; Q704-Q708 WeakPolarHBondContact O-CG 3.37Å; Q704-Q708 PolarHBondContact O-N 3.37Å
705	E	55.5	Low	49.5	Very low	120 Å²	120	94.8 Å²	94.8	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-66.6	-40.9	173.6	-74.3	179.1	166.6	0	0	112.1	P701 L707 Q708 T709	P701-E705 PolarHBondContact O-N 3.2Å; P701-E705 VanDerWaalsContact O-N 3.17Å; E705-L707 VanDerWaalsContact C-N 3.3Å; E705-L707 PolarHBondContact O-N 2.98Å; E705-Q708 PolarHBondContact O-N 2.83Å; E705-T709 PolarHBondContact O-N 2.88Å; E705-T709 PolarHBondContact O-OG1 2.86Å
706	A	55.5	Low	51.6	Low	14 Å²	14	91.7 Å²	91.7	12%	0.116	46%	0.463	C	S	.	.	H	α-helix	trans	-63	-38.5	172.6	0	0	0	0	0	111.7	I488 L489 F702 E703 T709 L710	I488-A706 HydrophobicContact CG2-CB 4.41Å; L489-A706 HydrophobicContact CD1-CB 4.37Å; F702-A706 PolarHBondContact O-N 2.92Å; E703-A706 PolarHBondContact O-N 2.94Å; A706-T709 PolarHBondContact O-N 2.81Å; A706-L710 WeakPolarHBondContact O-CB 3.43Å; A706-L710 PolarHBondContact O-N 2.95Å
707	L	52.5	Low	53.4	Low	33 Å²	33	83.7 Å²	83.7	17%	0.173	44%	0.439	C	S	.	.	H	α-helix	trans	-60.2	-44.9	172	-105.2	128.3	0	0	0	112.5	P699 E703 Q704 E705 T709 L710 K711	P699-L707 HydrophobicContact CB-CD1 4.24Å; P699-L707 HydrophobicContact CG-CD1 4Å; E703-L707 VanDerWaalsContact O-CB 3.29Å; E703-L707 WeakPolarHBondContact O-CB 3.23Å; E703-L707 WeakPolarHBondContact O-CD1 3.44Å; E703-L707 PolarHBondContact O-N 3.29Å; Q704-L707 WeakPolarHBondContact O-CB 3.42Å; Q704-L707 PolarHBondContact O-N 2.84Å; E705-L707 VanDerWaalsContact C-N 3.3Å; E705-L707 PolarHBondContact O-N 2.98Å; L707-T709 VanDerWaalsContact C-N 3.35Å; L707-L710 PolarHBondContact O-N 3.34Å; L707-K711 WeakPolarHBondContact O-CB 3.06Å; L707-K711 WeakPolarHBondContact O-CG 3.35Å; L707-K711 PolarHBondContact O-N 3.38Å
708	Q	57.4	Low	55.4	Low	129 Å²	129	80.7 Å²	80.7	60%	0.603	42%	0.424	S	S	*	.	H	α-helix	trans	-65	-40	176.7	-73.4	-179.8	13.4	0	0	111.4	Q704 E705 L710 K711 L712	Q704-Q708 WeakPolarHBondContact O-CG 3.37Å; Q704-Q708 PolarHBondContact O-N 3.37Å; E705-Q708 PolarHBondContact O-N 2.83Å; Q708-L710 VanDerWaalsContact C-N 3.33Å; Q708-L710 PolarHBondContact O-N 3.45Å; Q708-K711 PolarHBondContact O-N 3.18Å; Q708-L712 PolarHBondContact O-N 2.87Å
709	T	56.1	Low	57.4	Low	84 Å²	84	75.9 Å²	75.9	52%	0.515	40%	0.395	S	S	.	.	H	α-helix	trans	-65.3	-34.8	175.7	-50.4	0	0	0	0	112.3	E705 A706 L707	E705-T709 PolarHBondContact O-N 2.88Å; E705-T709 PolarHBondContact O-OG1 2.86Å; A706-T709 PolarHBondContact O-N 2.81Å; L707-T709 VanDerWaalsContact C-N 3.35Å
710	L	54.4	Low	59.2	Low	23 Å²	23	79.8 Å²	79.8	12%	0.12	40%	0.404	C	S	.	.	H	α-helix	trans	-76.2	-25.4	174.2	-99.1	150.3	0	0	0	114.1	L489 E492 M493 A706 L707 Q708	L489-L710 HydrophobicContact CD1-CD1 3.48Å; L489-L710 VanDerWaalsContact CD1-CD1 3.48Å; L489-L710 HydrophobicContact CD1-CG 3.62Å; L489-L710 HydrophobicContact CG-CD1 3.94Å; L489-L710 HydrophobicContact CG-CG 4.05Å; E492-L710 HydrophobicContact CB-CD1 4.33Å; E492-L710 HydrophobicContact CG-CD1 3.81Å; M493-L710 HydrophobicContact CG-CD1 4.31Å; M493-L710 HydrophobicContact CG-CD2 3.65Å; M493-L710 HydrophobicContact CG-CG 4.5Å; M493-L710 HydrophobicContact SD-CD2 4.32Å; A706-L710 WeakPolarHBondContact O-CB 3.43Å; A706-L710 PolarHBondContact O-N 2.95Å; L707-L710 PolarHBondContact O-N 3.34Å; Q708-L710 VanDerWaalsContact C-N 3.33Å; Q708-L710 PolarHBondContact O-N 3.45Å
711	K	52.7	Low	61.1	Low	119 Å²	119	82.8 Å²	82.8	52%	0.517	41%	0.406	S	S	.	.	H	α-helix	trans	-79.6	-18.9	176.1	-79.9	-175.5	177.3	-166.3	0	113	E580 L707 Q708 D713	E580-K711 IonicContact OE1-NZ 3.96Å; L707-K711 WeakPolarHBondContact O-CB 3.06Å; L707-K711 WeakPolarHBondContact O-CG 3.35Å; L707-K711 PolarHBondContact O-N 3.38Å; Q708-K711 PolarHBondContact O-N 3.18Å; K711-D713 PolarHBondContact O-N 2.98Å
712	L	54.9	Low	62.7	Low	114 Å²	114	79.4 Å²	79.4	60%	0.597	38%	0.381	S	S	*	.	S	Bend	trans	-63.2	117.1	167.8	-104.5	84.1	0	0	0	108.6	Q708 H714 P715	Q708-L712 PolarHBondContact O-N 2.87Å; L712-H714 PolarHBondContact O-N 3.33Å; L712-P715 WeakPolarHBondContact O-CD 3.26Å
713	D	55.6	Low	64.4	Low	103 Å²	103	73.5 Å²	73.5	55%	0.551	36%	0.355	S	S	*	.	S	Bend	trans	-57.6	-3.7	177.2	-83.6	-44.4	0	0	0	114.8	K711 K716 I717	K711-D713 PolarHBondContact O-N 2.98Å; D713-K716 PolarHBondContact O-N 2.96Å; D713-I717 HydrophobicContact CB-CD1 3.79Å; D713-I717 HydrophobicContact CB-CG1 4.25Å; D713-I717 WeakPolarHBondContact O-CB 3.45Å; D713-I717 WeakPolarHBondContact O-CD1 3.17Å; D713-I717 WeakPolarHBondContact O-CG1 3.49Å; D713-I717 PolarHBondContact O-N 3.43Å
714	H	63	Low	66.3	Low	140 Å²	140	76.1 Å²	76.1	65%	0.648	36%	0.362	S	S	*	.	H	α-helix	trans	-54.8	-46.3	-175.9	-169.8	-82	0	0	0	114.1	L712 A718	L712-H714 PolarHBondContact O-N 3.33Å; H714-A718 WeakPolarHBondContact O-CB 3.13Å; H714-A718 PolarHBondContact O-N 3.04Å
715	P	69.1	Low	67.9	Low	32 Å²	32	75 Å²	75	21%	0.208	36%	0.356	C	S	.	.	H	α-helix	trans	-69.8	-35.1	177.4	-18.2	33.6	0	0	0	113.7	F113 F485 L712 A718 A719	F113-P715 HydrophobicContact CZ-CB 4.06Å; F485-P715 HydrophobicContact CE1-CB 4.17Å; F485-P715 HydrophobicContact CE1-CG 4.29Å; F485-P715 HydrophobicContact CZ-CB 3.9Å; F485-P715 HydrophobicContact CZ-CG 4.45Å; L712-P715 WeakPolarHBondContact O-CD 3.26Å; P715-A718 PolarHBondContact O-N 3.03Å; P715-A719 WeakPolarHBondContact O-CB 3.27Å; P715-A719 PolarHBondContact O-N 3.01Å
716	K	69.4	Low	69.5	Low	82 Å²	82	69.3 Å²	69.3	36%	0.357	33%	0.329	S	S	.	.	H	α-helix	trans	-64.7	-46.6	174.8	-170	-176.5	-173.8	-176.7	0	110.7	F113 E116 D713 A718 A719 W720	F113-K716 HydrophobicContact CD1-CB 4.27Å; F113-K716 HydrophobicContact CD1-CG 4.25Å; F113-K716 HydrophobicContact CE1-CB 4.02Å; F113-K716 HydrophobicContact CE1-CG 4.43Å; E116-K716 HydrophobicContact CG-CG 3.92Å; E116-K716 WeakPolarHBondContact OE1-CE 3.26Å; E116-K716 IonicContact OE1-NZ 3.77Å; D713-K716 PolarHBondContact O-N 2.96Å; K716-A718 VanDerWaalsContact C-N 3.33Å; K716-A718 PolarHBondContact O-N 3.22Å; K716-A719 PolarHBondContact O-N 3.04Å; K716-W720 WeakPolarHBondContact O-CB 3.3Å; K716-W720 PolarHBondContact O-N 2.86Å
717	I	73.8	Confident	71	Confident	81 Å²	81	68.8 Å²	68.8	42%	0.415	33%	0.325	S	S	.	.	H	α-helix	trans	-61.2	-41.8	174.7	-67.3	164.2	0	0	0	110.8	D713 R721	D713-I717 HydrophobicContact CB-CD1 3.79Å; D713-I717 HydrophobicContact CB-CG1 4.25Å; D713-I717 WeakPolarHBondContact O-CB 3.45Å; D713-I717 WeakPolarHBondContact O-CD1 3.17Å; D713-I717 WeakPolarHBondContact O-CG1 3.49Å; D713-I717 PolarHBondContact O-N 3.43Å; I717-R721 WeakPolarHBondContact O-CB 3.46Å; I717-R721 PolarHBondContact O-N 2.98Å
718	A	74.1	Confident	72.7	Confident	32 Å²	32	72.8 Å²	72.8	26%	0.264	34%	0.341	S	S	.	.	H	α-helix	trans	-63.5	-49.1	177	0	0	0	0	0	111.6	H714 P715 K716 W720 R721 W722	H714-A718 WeakPolarHBondContact O-CB 3.13Å; H714-A718 PolarHBondContact O-N 3.04Å; P715-A718 PolarHBondContact O-N 3.03Å; K716-A718 VanDerWaalsContact C-N 3.33Å; K716-A718 PolarHBondContact O-N 3.22Å; A718-W720 PolarHBondContact O-N 3.31Å; A718-R721 PolarHBondContact O-N 2.77Å; A718-W722 WeakPolarHBondContact O-CB 3.45Å; A718-W722 PolarHBondContact O-N 2.81Å
719	A	75.6	Confident	74.2	Confident	5 Å²	5	66.7 Å²	66.7	4%	0.041	31%	0.312	C	S	.	.	H	α-helix	trans	-58.5	-48.4	177.2	0	0	0	0	0	111.6	F113 F117 P715 K716 R721 W722 G723	F113-A719 HydrophobicContact CB-CB 3.98Å; F113-A719 HydrophobicContact CD2-CB 4.01Å; F113-A719 HydrophobicContact CG-CB 3.96Å; F117-A719 HydrophobicContact CE2-CB 4.27Å; F117-A719 HydrophobicContact CZ-CB 4.31Å; P715-A719 WeakPolarHBondContact O-CB 3.27Å; P715-A719 PolarHBondContact O-N 3.01Å; K716-A719 PolarHBondContact O-N 3.04Å; A719-R721 PolarHBondContact O-N 3.19Å; A719-W722 PolarHBondContact O-N 2.8Å; A719-G723 PolarHBondContact O-N 3.27Å
720	W	80.7	Confident	75.7	Confident	127 Å²	127	63.5 Å²	63.5	48%	0.481	29%	0.291	S	S	.	.	H	α-helix	trans	-58.9	-48.9	176.3	176.8	81.8	0	0	0	112.5	E116 K716 A718 W722 R724	E116-W720 HydrophobicContact CB-CB 3.98Å; E116-W720 HydrophobicContact CG-CB 4Å; K716-W720 WeakPolarHBondContact O-CB 3.3Å; K716-W720 PolarHBondContact O-N 2.86Å; A718-W720 PolarHBondContact O-N 3.31Å; W720-W722 VanDerWaalsContact C-N 3.34Å; W720-W722 PolarHBondContact O-N 2.73Å; W720-R724 WeakPolarHBondContact O-CB 3.45Å; W720-R724 PolarHBondContact O-N 3.37Å
721	R	83.1	Confident	77.3	Confident	132 Å²	132	67.7 Å²	67.7	50%	0.498	31%	0.313	S	S	.	.	H	α-helix	trans	-61.2	-43.9	-179	-176.1	-176.4	-68.6	175.7	-2	111.1	I717 A718 A719 K725	I717-R721 WeakPolarHBondContact O-CB 3.46Å; I717-R721 PolarHBondContact O-N 2.98Å; A718-R721 PolarHBondContact O-N 2.77Å; A719-R721 PolarHBondContact O-N 3.19Å; R721-K725 HydrophobicContact CG-CD 4.16Å; R721-K725 WeakPolarHBondContact O-CB 3.5Å; R721-K725 WeakPolarHBondContact O-CG 3.42Å; R721-K725 PolarHBondContact O-N 3.35Å
722	W	82.9	Confident	78.9	Confident	31 Å²	31	65.4 Å²	65.4	12%	0.117	31%	0.313	C	S	.	.	H	α-helix	trans	-76.5	-40	-178.2	-78.8	105.6	0	0	0	112.9	N459 L463 F480 F482 A718 A719 W720 R724 K725 I726	N459-W722 HydrophobicContact CB-CH2 3.34Å; N459-W722 HydrophobicContact CB-CZ2 3.43Å; N459-W722 VanDerWaalsContact CB-CZ2 3.43Å; N459-W722 HydrophobicContact CB-CZ3 4.07Å; N459-W722 VanDerWaalsContact O-CH2 3.22Å; N459-W722 WeakPolarHBondContact O-CH2 3.47Å; L463-W722 HydrophobicContact CB-CZ3 4.32Å; L463-W722 HydrophobicContact CD2-CZ3 4.37Å; F480-W722 HydrophobicContact CD1-CE3 4.4Å; F480-W722 AromaticContact CD1-CZ3 3.9Å; F480-W722 HydrophobicContact CD1-CZ3 3.9Å; F480-W722 HydrophobicContact CE1-CE3 4.48Å; F480-W722 AromaticContact CE1-CZ3 3.76Å; F480-W722 HydrophobicContact CE1-CZ3 3.76Å; F482-W722 HydrophobicContact CE1-CB 4.2Å; F482-W722 AromaticContact CE1-CD1 3.62Å; F482-W722 AromaticContact CE1-CD2 4Å; F482-W722 HydrophobicContact CE1-CD2 4Å; F482-W722 AromaticContact CE1-CG 3.66Å; F482-W722 HydrophobicContact CE1-CG 3.66Å; F482-W722 AromaticContact CE1-NE1 3.91Å; F482-W722 HydrophobicContact CZ-CB 4.22Å; F482-W722 HydrophobicContact CZ-CD2 4.17Å; F482-W722 AromaticContact CZ-CG 3.99Å; F482-W722 HydrophobicContact CZ-CG 3.99Å; A718-W722 WeakPolarHBondContact O-CB 3.45Å; A718-W722 PolarHBondContact O-N 2.81Å; A719-W722 PolarHBondContact O-N 2.8Å; W720-W722 VanDerWaalsContact C-N 3.34Å; W720-W722 PolarHBondContact O-N 2.73Å; W722-R724 VanDerWaalsContact C-N 3.29Å; W722-R724 PolarHBondContact O-N 3.08Å; W722-K725 HydrophobicContact CD2-CD 4.33Å; W722-K725 HydrophobicContact CE3-CB 4.31Å; W722-K725 HydrophobicContact CE3-CD 4.1Å; W722-K725 HydrophobicContact CH2-CD 4.26Å; W722-K725 HydrophobicContact CZ3-CD 4.07Å; W722-K725 PolarHBondContact O-N 3.31Å; W722-I726 WeakPolarHBondContact O-CB 3.39Å; W722-I726 WeakPolarHBondContact O-CG1 3.33Å; W722-I726 PolarHBondContact O-N 3.42Å
723	G	84.4	Confident	80.5	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-56.2	-43.6	171.6	0	0	0	0	0	111.9	A719 G727	A719-G723 PolarHBondContact O-N 3.27Å; G723-G727 PolarHBondContact O-N 3.26Å
724	R	86.8	Confident	81.9	Confident	123 Å²	123	58.4 Å²	58.4	46%	0.464	28%	0.279	S	S	.	.	H	α-helix	trans	-68.8	-40.5	175.5	-166	178.2	-169.3	-171.1	4	112.9	W720 W722 G727 K728	W720-R724 WeakPolarHBondContact O-CB 3.45Å; W720-R724 PolarHBondContact O-N 3.37Å; W722-R724 VanDerWaalsContact C-N 3.29Å; W722-R724 PolarHBondContact O-N 3.08Å; R724-G727 PolarHBondContact O-N 2.6Å; R724-K728 WeakPolarHBondContact O-CG 3.45Å; R724-K728 PolarHBondContact O-N 3.18Å
725	K	88.9	Confident	83	Confident	51 Å²	51	54.5 Å²	54.5	22%	0.222	27%	0.267	C	S	.	.	H	α-helix	trans	-64.2	-46.2	179.2	-83.9	174.5	171.9	-161.5	0	112.3	L463 R721 W722 K728 L729	L463-K725 HydrophobicContact CD1-CB 4.49Å; L463-K725 HydrophobicContact CD2-CB 3.68Å; L463-K725 HydrophobicContact CD2-CD 3.81Å; L463-K725 HydrophobicContact CD2-CG 3.8Å; R721-K725 HydrophobicContact CG-CD 4.16Å; R721-K725 WeakPolarHBondContact O-CB 3.5Å; R721-K725 WeakPolarHBondContact O-CG 3.42Å; R721-K725 PolarHBondContact O-N 3.35Å; W722-K725 HydrophobicContact CD2-CD 4.33Å; W722-K725 HydrophobicContact CE3-CB 4.31Å; W722-K725 HydrophobicContact CE3-CD 4.1Å; W722-K725 HydrophobicContact CH2-CD 4.26Å; W722-K725 HydrophobicContact CZ3-CD 4.07Å; W722-K725 PolarHBondContact O-N 3.31Å; K725-K728 PolarHBondContact O-N 2.86Å; K725-L729 PolarHBondContact O-N 3.15Å; K725-L729 VanDerWaalsContact O-N 3.11Å
726	I	88.2	Confident	83.8	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-66.7	-41.9	176.4	-63.6	162.9	0	0	0	109.6	F100 L102 L120 F480 W722 K728 L729 Y730 I741	F100-I726 HydrophobicContact CG-CG2 4.48Å; L102-I726 HydrophobicContact CD1-CD1 4.26Å; L102-I726 HydrophobicContact CD2-CD1 3.57Å; L120-I726 HydrophobicContact CD2-CB 4.2Å; L120-I726 HydrophobicContact CD2-CG2 3.86Å; F480-I726 HydrophobicContact CD2-CD1 4.26Å; F480-I726 HydrophobicContact CD2-CG1 4.48Å; F480-I726 HydrophobicContact CE2-CD1 4.28Å; F480-I726 HydrophobicContact CE2-CG1 4.01Å; F480-I726 HydrophobicContact CZ-CG1 4.47Å; W722-I726 WeakPolarHBondContact O-CB 3.39Å; W722-I726 WeakPolarHBondContact O-CG1 3.33Å; W722-I726 PolarHBondContact O-N 3.42Å; I726-K728 VanDerWaalsContact C-N 3.32Å; I726-K728 PolarHBondContact O-N 2.84Å; I726-L729 WeakPolarHBondContact O-CB 3.29Å; I726-L729 PolarHBondContact O-N 2.95Å; I726-L729 VanDerWaalsContact O-N 3.1Å; I726-Y730 PolarHBondContact O-N 3.5Å; I726-I741 HydrophobicContact CG2-CD1 4.1Å
727	G	86.7	Confident	84.7	Confident	2 Å²	2	49.8 Å²	49.8	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-58.3	-41.1	174.1	0	0	0	0	0	113.3	G723 R724 L729 Y730 N731	G723-G727 PolarHBondContact O-N 3.26Å; R724-G727 PolarHBondContact O-N 2.6Å; G727-L729 PolarHBondContact O-N 3.35Å; G727-Y730 PolarHBondContact O-N 3.09Å; G727-N731 WeakPolarHBondContact O-CB 3.2Å; G727-N731 VanDerWaalsContact O-CG 3.24Å; G727-N731 PolarHBondContact O-N 2.9Å
728	K	88.3	Confident	85.6	Confident	118 Å²	118	45.9 Å²	45.9	51%	0.513	23%	0.227	S	C	.	.	H	α-helix	trans	-63.2	-40	173.6	-76.1	-177.4	178.5	-166.5	0	112.6	R724 K725 I726 N731 S732	R724-K728 WeakPolarHBondContact O-CG 3.45Å; R724-K728 PolarHBondContact O-N 3.18Å; K725-K728 PolarHBondContact O-N 2.86Å; I726-K728 VanDerWaalsContact C-N 3.32Å; I726-K728 PolarHBondContact O-N 2.84Å; K728-N731 PolarHBondContact O-N 2.99Å; K728-S732 PolarHBondContact O-N 3.24Å
729	L	89.1	Confident	86.5	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-66.2	-43.9	176.2	177.5	62.6	0	0	0	111.2	F100 L463 A466 R467 I470 K725 I726 G727 N731 S732 L733	F100-L729 HydrophobicContact CE1-CD2 3.42Å; F100-L729 VanDerWaalsContact CE1-CD2 3.42Å; F100-L729 HydrophobicContact CE1-CG 4.34Å; F100-L729 HydrophobicContact CZ-CD2 3.6Å; F100-L729 HydrophobicContact CZ-CG 4.03Å; L463-L729 HydrophobicContact CD1-CB 4.15Å; L463-L729 HydrophobicContact CD1-CD2 3.89Å; A466-L729 HydrophobicContact CB-CD1 4.46Å; A466-L729 HydrophobicContact CB-CD2 3.74Å; R467-L729 HydrophobicContact CB-CD1 4.42Å; R467-L729 HydrophobicContact CG-CD1 3.66Å; I470-L729 HydrophobicContact CD1-CD1 4.35Å; I470-L729 HydrophobicContact CD1-CD2 4.15Å; I470-L729 HydrophobicContact CD1-CG 4.5Å; K725-L729 PolarHBondContact O-N 3.15Å; K725-L729 VanDerWaalsContact O-N 3.11Å; I726-L729 WeakPolarHBondContact O-CB 3.29Å; I726-L729 PolarHBondContact O-N 2.95Å; I726-L729 VanDerWaalsContact O-N 3.1Å; G727-L729 PolarHBondContact O-N 3.35Å; L729-N731 VanDerWaalsContact C-N 3.29Å; L729-N731 PolarHBondContact O-N 3.23Å; L729-S732 PolarHBondContact O-N 3.18Å; L729-S732 PolarHBondContact O-OG 3.23Å; L729-L733 WeakPolarHBondContact O-CG 3.48Å; L729-L733 PolarHBondContact O-N 3.19Å
730	Y	88.6	Confident	87.4	Confident	16 Å²	16	44.1 Å²	44.1	6%	0.063	21%	0.212	C	C	.	.	H	α-helix	trans	-56	-45.3	172.9	174.4	-104.3	0	0	0	111.6	A123 F124 I726 G727 S732 L733 C739 K762	A123-Y730 HydrophobicContact CB-CD1 3.92Å; A123-Y730 HydrophobicContact CB-CE1 3.65Å; F124-Y730 HydrophobicContact CE1-CE2 4.28Å; F124-Y730 HydrophobicContact CE2-CD2 4.23Å; F124-Y730 HydrophobicContact CE2-CE2 4.38Å; F124-Y730 HydrophobicContact CE2-CG 4.28Å; F124-Y730 AromaticContact CZ-CD2 3.72Å; F124-Y730 HydrophobicContact CZ-CD2 3.72Å; F124-Y730 AromaticContact CZ-CE2 3.83Å; F124-Y730 HydrophobicContact CZ-CE2 3.83Å; F124-Y730 HydrophobicContact CZ-CG 4.21Å; I726-Y730 PolarHBondContact O-N 3.5Å; G727-Y730 PolarHBondContact O-N 3.09Å; Y730-S732 PolarHBondContact O-N 3.27Å; Y730-L733 HydrophobicContact CD2-CD1 4.11Å; Y730-L733 WeakPolarHBondContact O-CB 3.48Å; Y730-L733 PolarHBondContact O-N 2.9Å; Y730-L733 VanDerWaalsContact O-N 3.09Å; Y730-C739 HydrophobicContact CD2-CB 3.98Å; Y730-C739 HydrophobicContact CE2-CB 3.72Å; Y730-K762 HydrophobicContact CE2-CB 4.31Å; Y730-K762 PolarHBondContact O-NZ 3.13Å
731	N	86.8	Confident	88	Confident	111 Å²	111	38.1 Å²	38.1	59%	0.594	19%	0.189	S	C	*	.	H	α-helix	trans	-66.2	-15.9	177	-69.7	-8.1	0	0	0	113.9	G727 K728 L729 K762	G727-N731 WeakPolarHBondContact O-CB 3.2Å; G727-N731 VanDerWaalsContact O-CG 3.24Å; G727-N731 PolarHBondContact O-N 2.9Å; K728-N731 PolarHBondContact O-N 2.99Å; L729-N731 VanDerWaalsContact C-N 3.29Å; L729-N731 PolarHBondContact O-N 3.23Å; N731-K762 PolarHBondContact O-NZ 3.15Å
732	S	86.8	Confident	88.6	Confident	72 Å²	72	31.8 Å²	31.8	50%	0.503	17%	0.166	S	C	.	.	H	α-helix	trans	-94	-7.4	172.7	65.7	0	0	0	0	114.5	K728 L729 Y730	K728-S732 PolarHBondContact O-N 3.24Å; L729-S732 PolarHBondContact O-N 3.18Å; L729-S732 PolarHBondContact O-OG 3.23Å; Y730-S732 PolarHBondContact O-N 3.27Å
733	L	88.4	Confident	89.1	Confident	11 Å²	11	30.4 Å²	30.4	6%	0.058	16%	0.161	C	C	.	.	S	Bend	trans	-66	162.8	178.1	-60	-179.9	0	0	0	112.4	V98 F100 I470 L729 Y730 T737 K762	V98-L733 HydrophobicContact CB-CD1 4.39Å; V98-L733 HydrophobicContact CG2-CD1 4.24Å; V98-L733 HydrophobicContact CG2-CD2 4.46Å; F100-L733 HydrophobicContact CE2-CD1 4.48Å; I470-L733 HydrophobicContact CB-CD2 4.39Å; I470-L733 HydrophobicContact CD1-CD2 4.26Å; I470-L733 HydrophobicContact CG2-CD2 3.57Å; L729-L733 WeakPolarHBondContact O-CG 3.48Å; L729-L733 PolarHBondContact O-N 3.19Å; Y730-L733 HydrophobicContact CD2-CD1 4.11Å; Y730-L733 WeakPolarHBondContact O-CB 3.48Å; Y730-L733 PolarHBondContact O-N 2.9Å; Y730-L733 VanDerWaalsContact O-N 3.09Å; L733-T737 HydrophobicContact CD1-CG2 4.07Å; L733-K762 HydrophobicContact CB-CD 4.07Å; L733-K762 WeakPolarHBondContact O-CD 3.2Å; L733-K762 VanDerWaalsContact O-CE 3.28Å; L733-K762 WeakPolarHBondContact O-CE 3.5Å; L733-K762 PolarHBondContact O-NZ 2.93Å
734	C	85.3	Confident	89.3	Confident	58 Å²	58	30.4 Å²	30.4	39%	0.392	16%	0.161	S	C	.	.	P	Polyproline II helix	trans	-72.4	147.9	175.2	-64.6	0	0	0	0	111.3	T737	C734-T737 VanDerWaalsContact O-CB 3.3Å; C734-T737 WeakPolarHBondContact O-CB 3.39Å; C734-T737 PolarHBondContact O-N 3.33Å; C734-T737 PolarHBondContact O-OG1 3.17Å
735	P	86.4	Confident	89.3	Confident	59 Å²	59	24.7 Å²	24.7	38%	0.383	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	149	168.7	-25.9	35.7	0	0	0	111.9	N95 T737 E763	N95-P735 PolarHBondContact ND2-O 2.78Å; P735-T737 VanDerWaalsContact C-N 3.26Å; P735-T737 PolarHBondContact O-N 3.43Å; P735-E763 HydrophobicContact CB-CB 4.36Å; P735-E763 WeakPolarHBondContact CB-OE2 3.23Å; P735-E763 VanDerWaalsContact CG-OE2 3.28Å; P735-E763 WeakPolarHBondContact CG-OE2 3.26Å
736	G	84.9	Confident	88.9	Confident	13 Å²	13	23.6 Å²	23.6	13%	0.134	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	14.3	-177.5	0	0	0	0	0	114.7	L94 N95 K762	L94-G736 WeakPolarHBondContact CA-O 3.48Å; L94-G736 WeakPolarHBondContact CD2-O 3.41Å; N95-G736 PolarHBondContact N-O 3.46Å; G736-K762 PolarHBondContact N-O 2.77Å
737	T	89.9	Confident	88.2	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	122.6	172.5	-60.2	0	0	0	0	110.2	N96 V98 L733 C734 P735 C739 I761 K762	N96-T737 HydrophobicContact CB-CG2 3.93Å; N96-T737 CarbonylContact O-C 3.38Å; N96-T737 VanDerWaalsContact O-CA 3.32Å; N96-T737 WeakPolarHBondContact O-CA 3.39Å; V98-T737 HydrophobicContact CB-CG2 4.29Å; V98-T737 HydrophobicContact CG2-CG2 3.67Å; L733-T737 HydrophobicContact CD1-CG2 4.07Å; C734-T737 VanDerWaalsContact O-CB 3.3Å; C734-T737 WeakPolarHBondContact O-CB 3.39Å; C734-T737 PolarHBondContact O-N 3.33Å; C734-T737 PolarHBondContact O-OG1 3.17Å; P735-T737 VanDerWaalsContact C-N 3.26Å; P735-T737 PolarHBondContact O-N 3.43Å; T737-C739 PolarHBondContact O-N 3.27Å; T737-I761 WeakPolarHBondContact O-CA 3.41Å; T737-K762 PolarHBondContact O-N 3.35Å
738	L	91.6	Very high	87.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	120.4	168.3	176	64.4	0	0	0	108.7	A73 L94 N96 V97 V98 M759 I761	A73-L738 HydrophobicContact CB-CD2 3.72Å; L94-L738 HydrophobicContact CD1-CB 4.1Å; L94-L738 HydrophobicContact CD1-CD2 4.33Å; L94-L738 HydrophobicContact CD2-CB 4Å; N96-L738 PolarHBondContact O-N 3.29Å; V97-L738 WeakPolarHBondContact CA-O 3.13Å; V97-L738 HydrophobicContact CG1-CD2 4.46Å; V97-L738 HydrophobicContact CG2-CB 4.44Å; V98-L738 PolarHBondContact N-O 2.81Å; L738-M759 HydrophobicContact CD1-CG 4.23Å; L738-I761 HydrophobicContact CD1-CG1 4Å
739	C	93.3	Very high	85.4	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	131.5	-177.2	-168.5	0	0	0	0	111	V98 F100 F124 Y730 T737 M759 G760	V98-C739 WeakPolarHBondContact O-CA 3.44Å; F100-C739 VanDerWaalsContact CE2-SG 3.58Å; F124-C739 HydrophobicContact CE1-CB 3.7Å; F124-C739 HydrophobicContact CZ-CB 4.05Å; F124-C739 WeakPolarHBondContact CZ-SG 3.48Å; Y730-C739 HydrophobicContact CD2-CB 3.98Å; Y730-C739 HydrophobicContact CE2-CB 3.72Å; T737-C739 PolarHBondContact O-N 3.27Å; C739-M759 WeakPolarHBondContact O-CA 3.45Å; C739-G760 PolarHBondContact N-O 3.35Å; C739-G760 PolarHBondContact O-N 2.94Å; C739-G760 VanDerWaalsContact O-N 3.13Å
740	L	94.3	Very high	83.7	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.9	176.3	-73.2	158.3	0	0	0	109.1	L66 L69 L70 V98 V99 F100 F128 L742 L758 M759	L66-L740 HydrophobicContact CD1-CD1 4.2Å; L66-L740 HydrophobicContact CD1-CD2 4.26Å; L69-L740 HydrophobicContact CD2-CD1 4.47Å; L69-L740 HydrophobicContact CD2-CD2 4.43Å; L70-L740 HydrophobicContact CD2-CD1 3.51Å; L70-L740 HydrophobicContact CG-CD1 4.48Å; V98-L740 PolarHBondContact O-N 3.34Å; V99-L740 CarbonylContact C-O 3.57Å; V99-L740 WeakPolarHBondContact CA-O 3.39Å; V99-L740 HydrophobicContact CG1-CB 4.19Å; V99-L740 HydrophobicContact CG2-CB 4.35Å; V99-L740 HydrophobicContact CG2-CD1 4.14Å; F100-L740 PolarHBondContact N-O 2.85Å; F128-L740 HydrophobicContact CE1-CD2 4.47Å; F128-L740 HydrophobicContact CZ-CD2 4.5Å; L740-L742 HydrophobicContact CB-CD2 4.48Å; L740-L758 CarbonylContact C-O 3.52Å; L740-L758 WeakPolarHBondContact CA-O 3.46Å; L740-M759 HydrophobicContact CD2-CB 3.74Å; L740-M759 HydrophobicContact CD2-CG 3.58Å; L740-M759 HydrophobicContact CD2-SD 3.89Å; L740-M759 HydrophobicContact CG-CG 4.4Å
741	I	94.3	Very high	82.5	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114.4	169.2	-54.4	-174.6	0	0	0	107.9	F100 L102 L120 F124 I726 L743 G757 L758	F100-I741 HydrophobicContact CB-CG1 4.23Å; F100-I741 HydrophobicContact CB-CG2 4.49Å; F100-I741 HydrophobicContact CD2-CG1 4.16Å; F100-I741 CarbonylContact O-C 3.52Å; F100-I741 WeakPolarHBondContact O-CA 3.35Å; L102-I741 HydrophobicContact CD1-CG2 3.91Å; L102-I741 HydrophobicContact CG-CG2 4.18Å; L120-I741 HydrophobicContact CB-CD1 4.38Å; L120-I741 HydrophobicContact CD1-CD1 3.87Å; L120-I741 HydrophobicContact CD2-CD1 3.61Å; L120-I741 HydrophobicContact CG-CD1 4.15Å; F124-I741 HydrophobicContact CD2-CD1 4.06Å; F124-I741 HydrophobicContact CE1-CD1 4.18Å; F124-I741 HydrophobicContact CE1-CG1 3.97Å; F124-I741 HydrophobicContact CE2-CD1 3.35Å; F124-I741 HydrophobicContact CE2-CG1 4.07Å; F124-I741 HydrophobicContact CZ-CD1 3.42Å; F124-I741 VanDerWaalsContact CZ-CD1 3.42Å; F124-I741 HydrophobicContact CZ-CG1 3.64Å; I726-I741 HydrophobicContact CG2-CD1 4.1Å; I741-L743 HydrophobicContact CG2-CD1 4.04Å; I741-G757 CarbonylContact O-C 3.57Å; I741-G757 WeakPolarHBondContact O-CA 3.41Å; I741-L758 HydrophobicContact CB-CB 4.19Å; I741-L758 HydrophobicContact CB-CD1 4.2Å; I741-L758 HydrophobicContact CG2-CD1 4.28Å; I741-L758 PolarHBondContact N-O 3.01Å; I741-L758 PolarHBondContact O-N 3.32Å
742	L	94.3	Very high	81.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.9	-175.4	-52.2	176.4	0	0	0	109.4	L66 V99 F100 V101 L102 F128 L130 F137 I141 L740 P744	L66-L742 HydrophobicContact CD2-CD1 3.65Å; L66-L742 HydrophobicContact CD2-CD2 3.86Å; L66-L742 HydrophobicContact CD2-CG 4.42Å; V99-L742 HydrophobicContact CG1-CD1 3.49Å; V99-L742 VanDerWaalsContact CG1-CD1 3.49Å; V99-L742 HydrophobicContact CG1-CG 4.04Å; F100-L742 PolarHBondContact O-N 3.46Å; V101-L742 HydrophobicContact CG2-CD1 4.4Å; L102-L742 PolarHBondContact N-O 2.96Å; F128-L742 HydrophobicContact CZ-CD2 4.22Å; L130-L742 HydrophobicContact CD1-CB 4.43Å; L130-L742 HydrophobicContact CD1-CD2 4.21Å; F137-L742 HydrophobicContact CE1-CB 4.29Å; F137-L742 HydrophobicContact CE1-CD1 4.12Å; F137-L742 HydrophobicContact CZ-CB 4.12Å; F137-L742 HydrophobicContact CZ-CD1 3.99Å; I141-L742 HydrophobicContact CD1-CD1 3.84Å; L740-L742 HydrophobicContact CB-CD2 4.48Å; L742-P744 WeakPolarHBondContact O-CD 3.37Å
743	L	93.2	Very high	81.6	Confident	2 Å²	2	38 Å²	38	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	98.7	167	-71.7	73	0	0	0	105.7	L102 M105 F110 I741 G745 G755 L756 L758	L102-L743 HydrophobicContact CB-CG 4.34Å; L102-L743 HydrophobicContact CD1-CD1 4.03Å; L102-L743 HydrophobicContact CD1-CG 4.28Å; M105-L743 HydrophobicContact CB-CB 4.3Å; M105-L743 HydrophobicContact CB-CD2 3.9Å; M105-L743 HydrophobicContact CB-CG 3.94Å; M105-L743 CarbonylContact O-C 3.31Å; F110-L743 HydrophobicContact CB-CD2 4Å; I741-L743 HydrophobicContact CG2-CD1 4.04Å; L743-G745 PolarHBondContact O-N 3.46Å; L743-G755 CarbonylContact O-C 3.54Å; L743-G755 WeakPolarHBondContact O-CA 3.36Å; L743-L756 HydrophobicContact CB-CB 4.36Å; L743-L756 WeakPolarHBondContact CB-O 3.48Å; L743-L756 PolarHBondContact N-O 3.17Å; L743-L756 PolarHBondContact O-N 2.89Å; L743-L758 HydrophobicContact CD1-CD1 3.81Å
744	P	89.3	Confident	81.5	Confident	0 Å²	0	38 Å²	38	0%	0	23%	0.228	C	C	.	.			trans	-61.8	-19.6	-166.8	-27.1	37.8	0	0	0	114.6	V101 L102 P133 F137 L742	V101-P744 HydrophobicContact CG1-CG 3.8Å; L102-P744 WeakPolarHBondContact O-CD 3.46Å; P133-P744 HydrophobicContact CB-CB 4.14Å; P133-P744 VanDerWaalsContact CD-O 3.23Å; P133-P744 WeakPolarHBondContact CD-O 3.31Å; F137-P744 HydrophobicContact CD1-CB 3.92Å; F137-P744 HydrophobicContact CD1-CG 3.68Å; F137-P744 HydrophobicContact CD2-CB 3.89Å; F137-P744 HydrophobicContact CE1-CB 4.05Å; F137-P744 HydrophobicContact CE1-CG 3.64Å; F137-P744 HydrophobicContact CE2-CB 4.01Å; F137-P744 HydrophobicContact CE2-CG 4.46Å; F137-P744 HydrophobicContact CG-CB 3.83Å; F137-P744 HydrophobicContact CG-CG 4.13Å; F137-P744 HydrophobicContact CZ-CB 4.09Å; F137-P744 HydrophobicContact CZ-CG 4.05Å; L742-P744 WeakPolarHBondContact O-CD 3.37Å
745	G	87.6	Confident	81.7	Confident	3 Å²	3	35.2 Å²	35.2	3%	0.031	21%	0.209	C	C	.	.			trans	94.6	-173	-170.6	0	0	0	0	0	111.4	M105 L743 L753	M105-G745 PolarHBondContact O-N 3.11Å; L743-G745 PolarHBondContact O-N 3.46Å; G745-L753 WeakPolarHBondContact CA-O 3.12Å
746	T	80	Confident	82	Confident	27 Å²	27	32.4 Å²	32.4	17%	0.166	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	138.9	175.9	56.5	0	0	0	0	110.2	S752 L753	T746-S752 WeakPolarHBondContact O-CA 3.36Å; T746-L753 PolarHBondContact N-O 2.79Å; T746-L753 PolarHBondContact O-N 2.89Å
747	K	72.4	Confident	82.3	Confident	159 Å²	159	31.8 Å²	31.8	69%	0.691	18%	0.184	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	121.2	172.7	-164.3	173.9	-176.5	177.3	0	107.9
748	S	64.1	Low	82.5	Confident	49 Å²	49	31.8 Å²	31.8	34%	0.343	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	162.7	177.7	76.2	0	0	0	0	110.3	H750 G751	S748-H750 PolarHBondContact O-N 2.89Å; S748-H750 VanDerWaalsContact O-N 3.08Å; S748-H750 PolarHBondContact OG-N 3.28Å; S748-G751 PolarHBondContact N-O 2.97Å; S748-G751 PolarHBondContact O-N 2.77Å; S748-G751 VanDerWaalsContact O-N 3.14Å; S748-G751 VanDerWaalsContact O-O 3.13Å; S748-G751 PolarHBondContact OG-N 3.08Å; S748-G751 PolarHBondContact OG-O 2.93Å
749	T	53.9	Low	82.4	Confident	137 Å²	137	31.8 Å²	31.8	84%	0.84	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-20	171	47.6	0	0	0	0	113.2
750	H	52.3	Low	82.2	Confident	144 Å²	144	31.9 Å²	31.9	67%	0.667	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.4	0.4	-176.9	-60.4	-74.1	0	0	0	113.7	P487 S748	P487-H750 HydrophobicContact CB-CB 4.18Å; P487-H750 VanDerWaalsContact CB-CD2 3.48Å; P487-H750 WeakPolarHBondContact CB-CD2 3.39Å; S748-H750 PolarHBondContact O-N 2.89Å; S748-H750 VanDerWaalsContact O-N 3.08Å; S748-H750 PolarHBondContact OG-N 3.28Å
751	G	63.8	Low	81.9	Confident	41 Å²	41	32.2 Å²	32.2	42%	0.423	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	145.2	165.3	-179.9	0	0	0	0	0	113.3	S748	S748-G751 PolarHBondContact N-O 2.97Å; S748-G751 PolarHBondContact O-N 2.77Å; S748-G751 VanDerWaalsContact O-N 3.14Å; S748-G751 VanDerWaalsContact O-O 3.13Å; S748-G751 PolarHBondContact OG-N 3.08Å; S748-G751 PolarHBondContact OG-O 2.93Å
752	S	74.7	Confident	81.5	Confident	72 Å²	72	33.2 Å²	33.2	50%	0.503	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	134.6	176.8	65.2	0	0	0	0	110.8	T746	T746-S752 WeakPolarHBondContact O-CA 3.36Å
753	L	80.2	Confident	80.6	Confident	21 Å²	21	39.6 Å²	39.6	11%	0.11	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.6	173.3	-65.7	-176.9	0	0	0	109.4	L108 T490 G745 T746	L108-L753 HydrophobicContact CB-CD1 4.15Å; L108-L753 HydrophobicContact CD2-CD1 3.76Å; T490-L753 HydrophobicContact CG2-CD1 3.44Å; T490-L753 VanDerWaalsContact CG2-CD1 3.44Å; T490-L753 HydrophobicContact CG2-CG 4.38Å; G745-L753 WeakPolarHBondContact CA-O 3.12Å; T746-L753 PolarHBondContact N-O 2.79Å; T746-L753 PolarHBondContact O-N 2.89Å
754	S	84.8	Confident	79.4	Confident	12 Å²	12	41.4 Å²	41.4	8%	0.084	23%	0.229	C	C	.	.			trans	-63	145.7	175.2	54.5	0	0	0	0	111.7	Q107 R129 L130	Q107-S754 WeakPolarHBondContact CB-O 3.34Å; Q107-S754 PolarHBondContact N-O 2.85Å; Q107-S754 VanDerWaalsContact N-O 3.1Å; Q107-S754 PolarHBondContact OE1-OG 2.84Å; Q107-S754 VanDerWaalsContact OE1-OG 3.09Å; R129-S754 PolarHBondContact NH2-OG 2.83Å; L130-S754 WeakPolarHBondContact O-CB 3.36Å
755	G	90.1	Very high	77.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	175.6	172.1	0	0	0	0	0	112.5	L130 L743	L130-G755 PolarHBondContact N-O 3.26Å; L130-G755 PolarHBondContact O-N 2.84Å; L743-G755 CarbonylContact O-C 3.54Å; L743-G755 WeakPolarHBondContact O-CA 3.36Å
756	L	92.5	Very high	75.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	130.6	177	-175	75.7	0	0	0	109.5	Q107 F110 F128 L743 L758	Q107-L756 HydrophobicContact CB-CB 4.1Å; Q107-L756 HydrophobicContact CG-CB 4.41Å; Q107-L756 HydrophobicContact CG-CD1 4.29Å; F110-L756 HydrophobicContact CB-CD2 3.71Å; F110-L756 HydrophobicContact CD1-CD2 3.41Å; F110-L756 VanDerWaalsContact CD1-CD2 3.41Å; F110-L756 HydrophobicContact CD2-CD2 3.97Å; F110-L756 HydrophobicContact CE1-CD2 3.96Å; F110-L756 HydrophobicContact CE2-CD2 4.46Å; F110-L756 HydrophobicContact CG-CD2 3.4Å; F110-L756 VanDerWaalsContact CG-CD2 3.4Å; F110-L756 HydrophobicContact CZ-CD2 4.46Å; F128-L756 WeakPolarHBondContact O-CD1 3.31Å; L743-L756 HydrophobicContact CB-CB 4.36Å; L743-L756 WeakPolarHBondContact CB-O 3.48Å; L743-L756 PolarHBondContact N-O 3.17Å; L743-L756 PolarHBondContact O-N 2.89Å; L756-L758 HydrophobicContact CD2-CD1 4.19Å; L756-L758 HydrophobicContact CG-CD1 4.37Å
757	G	92.6	Very high	73.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	138.8	170.4	0	0	0	0	0	111.3	K127 F128 I741	K127-G757 CarbonylContact C-O 3.56Å; K127-G757 VanDerWaalsContact CA-O 3.32Å; K127-G757 WeakPolarHBondContact CA-O 3.48Å; F128-G757 PolarHBondContact N-O 3.28Å; F128-G757 PolarHBondContact O-N 2.89Å; I741-G757 CarbonylContact O-C 3.57Å; I741-G757 WeakPolarHBondContact O-CA 3.41Å
758	L	92.4	Very high	71.5	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	136.2	169.2	-55.8	81.2	0	0	0	108.2	F110 L120 F124 K127 L740 I741 L743 L756	F110-L758 HydrophobicContact CE2-CD2 3.92Å; F110-L758 HydrophobicContact CZ-CD2 4.24Å; L120-L758 HydrophobicContact CB-CD2 4.28Å; F124-L758 HydrophobicContact CB-CB 3.83Å; F124-L758 HydrophobicContact CB-CD2 4.27Å; F124-L758 HydrophobicContact CD1-CB 4.15Å; F124-L758 HydrophobicContact CG-CB 3.98Å; K127-L758 HydrophobicContact CG-CG 4.38Å; L740-L758 CarbonylContact C-O 3.52Å; L740-L758 WeakPolarHBondContact CA-O 3.46Å; I741-L758 HydrophobicContact CB-CB 4.19Å; I741-L758 HydrophobicContact CB-CD1 4.2Å; I741-L758 HydrophobicContact CG2-CD1 4.28Å; I741-L758 PolarHBondContact N-O 3.01Å; I741-L758 PolarHBondContact O-N 3.32Å; L743-L758 HydrophobicContact CD1-CD1 3.81Å; L756-L758 HydrophobicContact CD2-CD1 4.19Å; L756-L758 HydrophobicContact CG-CD1 4.37Å
759	M	90.4	Very high	70.2	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	139.7	-173.2	-175.3	178.1	44.2	0	0	111.7	L50 T52 L69 W85 C86 H126 F128 L738 C739 L740	L50-M759 HydrophobicContact CD1-CE 4.29Å; L50-M759 HydrophobicContact CD1-SD 4.22Å; L50-M759 HydrophobicContact CD2-CB 4.44Å; L50-M759 HydrophobicContact CD2-CE 3.73Å; L50-M759 HydrophobicContact CD2-CG 3.49Å; L50-M759 VanDerWaalsContact CD2-CG 3.49Å; L50-M759 HydrophobicContact CD2-SD 3.61Å; L50-M759 HydrophobicContact CG-CE 4.36Å; T52-M759 HydrophobicContact CG2-CE 4.13Å; L69-M759 HydrophobicContact CD2-SD 3.48Å; L69-M759 WeakPolarHBondContact CD2-SD 3.37Å; W85-M759 HydrophobicContact CH2-CE 3.48Å; W85-M759 VanDerWaalsContact CH2-CE 3.48Å; W85-M759 HydrophobicContact CH2-SD 4.03Å; W85-M759 HydrophobicContact CZ3-CE 3.46Å; W85-M759 VanDerWaalsContact CZ3-CE 3.46Å; C86-M759 HydrophobicContact CB-CE 4.45Å; H126-M759 HydrophobicContact CB-CB 4.4Å; H126-M759 HydrophobicContact CB-CE 4.32Å; H126-M759 PolarHBondContact N-O 3.2Å; H126-M759 PolarHBondContact O-N 3.42Å; F128-M759 HydrophobicContact CE1-CB 4.13Å; F128-M759 HydrophobicContact CE1-CE 4.48Å; L738-M759 HydrophobicContact CD1-CG 4.23Å; C739-M759 WeakPolarHBondContact O-CA 3.45Å; L740-M759 HydrophobicContact CD2-CB 3.74Å; L740-M759 HydrophobicContact CD2-CG 3.58Å; L740-M759 HydrophobicContact CD2-SD 3.89Å; L740-M759 HydrophobicContact CG-CG 4.4Å
760	G	89.1	Confident	68.9	Low	2 Å²	2	55 Å²	55	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.2	162.8	176.8	0	0	0	0	0	112.3	C739	C739-G760 PolarHBondContact N-O 3.35Å; C739-G760 PolarHBondContact O-N 2.94Å; C739-G760 VanDerWaalsContact O-N 3.13Å
761	I	87.6	Confident	67.8	Low	7 Å²	7	51.3 Å²	51.3	4%	0.036	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	131.9	171.8	-59.6	172.2	0	0	0	107.6	A48 L50 L88 L94 T737 L738 E763 E764	A48-I761 HydrophobicContact CB-CD1 4.18Å; L50-I761 HydrophobicContact CB-CD1 3.92Å; L50-I761 HydrophobicContact CB-CG1 4.3Å; L88-I761 HydrophobicContact CD1-CD1 3.56Å; L94-I761 HydrophobicContact CD2-CD1 4.12Å; L94-I761 HydrophobicContact CD2-CG1 4.36Å; L94-I761 HydrophobicContact CD2-CG2 4.33Å; T737-I761 WeakPolarHBondContact O-CA 3.41Å; L738-I761 HydrophobicContact CD1-CG1 4Å; I761-E763 PolarHBondContact O-N 3.45Å; I761-E764 HydrophobicContact CB-CB 4.37Å; I761-E764 PolarHBondContact O-N 2.98Å
762	K	86.8	Confident	66	Low	21 Å²	21	57.8 Å²	57.8	9%	0.091	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	127.7	178	-178.6	169.8	-178.5	171.1	0	110.9	Y730 N731 L733 G736 T737 E764	Y730-K762 HydrophobicContact CE2-CB 4.31Å; Y730-K762 PolarHBondContact O-NZ 3.13Å; N731-K762 PolarHBondContact O-NZ 3.15Å; L733-K762 HydrophobicContact CB-CD 4.07Å; L733-K762 WeakPolarHBondContact O-CD 3.2Å; L733-K762 VanDerWaalsContact O-CE 3.28Å; L733-K762 WeakPolarHBondContact O-CE 3.5Å; L733-K762 PolarHBondContact O-NZ 2.93Å; G736-K762 PolarHBondContact N-O 2.77Å; T737-K762 PolarHBondContact O-N 3.35Å; K762-E764 VanDerWaalsContact C-N 3.3Å
763	E	75.1	Confident	63.7	Low	133 Å²	133	63.3 Å²	63.3	62%	0.621	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	38	-176.5	-64.4	176.2	-162.9	0	0	113.4	P735 I761 E765	P735-E763 HydrophobicContact CB-CB 4.36Å; P735-E763 WeakPolarHBondContact CB-OE2 3.23Å; P735-E763 VanDerWaalsContact CG-OE2 3.28Å; P735-E763 WeakPolarHBondContact CG-OE2 3.26Å; I761-E763 PolarHBondContact O-N 3.45Å; E763-E765 PolarHBondContact O-N 3.14Å
764	E	67.5	Low	62.9	Low	40 Å²	40	65.4 Å²	65.4	19%	0.187	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-56.6	117.2	161.4	-171.1	172.2	-158.9	0	0	108.6	R49 L50 I761 K762 E766	R49-E764 HydrophobicContact CG-CG 4.07Å; R49-E764 WeakPolarHBondContact CG-OE1 3.19Å; L50-E764 PolarHBondContact N-OE1 3Å; I761-E764 HydrophobicContact CB-CB 4.37Å; I761-E764 PolarHBondContact O-N 2.98Å; K762-E764 VanDerWaalsContact C-N 3.3Å; E764-E766 PolarHBondContact O-N 2.6Å
765	E	51.3	Low	61.7	Low	93 Å²	93	68.2 Å²	68.2	44%	0.435	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-56.1	127.2	-176.4	-104.2	173.8	-176.1	0	0	111.3	K47 E763 S767	K47-E765 HydrophobicContact CD-CG 4.07Å; K47-E765 WeakPolarHBondContact CE-OE1 3.39Å; K47-E765 IonicContact NZ-OE1 2.77Å; K47-E765 PolarHBondContact NZ-OE1 3.49Å; E763-E765 PolarHBondContact O-N 3.14Å; E765-S767 PolarHBondContact O-N 3Å
766	E	45.1	Very low	60.1	Low	138 Å²	138	72 Å²	72	65%	0.645	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-63.4	119.2	164.3	-79.2	179.7	165.4	0	0	108.1	E764 T768	E764-E766 PolarHBondContact O-N 2.6Å; E766-T768 PolarHBondContact O-N 3.35Å
767	S	36.8	Very low	58.2	Low	79 Å²	79	76.2 Å²	76.2	55%	0.552	45%	0.45	S	S	*	.	S	Bend	trans	-63.9	91.6	154.3	58	0	0	0	0	107.1	E765	E765-S767 PolarHBondContact O-N 3Å
768	T	29.9	Very low	56.1	Low	113 Å²	113	81 Å²	81	69%	0.693	48%	0.478	S	S	*	.			trans	46.6	89.5	166.8	52.9	0	0	0	0	115.9	E766	E766-T768 PolarHBondContact O-N 3.35Å
769	I	37.2	Very low	53.7	Low	127 Å²	127	86.3 Å²	86.3	65%	0.651	51%	0.509	S	S	*	.			trans	-108.9	78.6	146	-56.6	178.1	0	0	0	106.9
770	S	27.7	Very low	51.1	Low	110 Å²	110	92.5 Å²	92.5	77%	0.769	55%	0.546	S	S	*	.			trans	-140.7	97.4	161.6	53.8	0	0	0	0	108.3
771	G	28.1	Very low	48.1	Very low	68 Å²	68	99.5 Å²	99.5	70%	0.701	59%	0.586	S	S	*	*			trans	161.4	66.2	178.1	0	0	0	0	0	111.8
772	L	26.6	Very low	44.8	Very low	176 Å²	176	107.2 Å²	107.2	92%	0.921	63%	0.632	S	S	*	*			trans	175.5	82.7	143.9	-91.1	154.2	0	0	0	107.6
773	S	26.2	Very low	41	Very low	188 Å²	188	115 Å²	115	100%	1.315	68%	0.681	S	S	*	*			trans	-65.3	0	146.2	55.3	0	0	0	0	110.2

Retrieved 773 of 773 residues in 1206 ms (Link to these results)

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