A0A077ZDJ9_TRITR Loading...

LBP

AlphaFold DB , UniProt , Accession A0A077ZDJ9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 704 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	37.8	Very low	40.1	Very low	225 Å²	225	147.7 Å²	147.7	100%	1.108	74%	0.743	S	S	*	*				0	124.6	0	-161.6	171.3	-177.2	0	0	107.3
2	H	35.4	Very low	40.4	Very low	146 Å²	146	149.4 Å²	149.4	68%	0.676	74%	0.742	S	S	*	*			trans	42.4	118	171.7	-65.1	-49.8	0	0	0	120.5
3	I	38.6	Very low	40.9	Very low	179 Å²	179	148 Å²	148	92%	0.918	74%	0.737	S	S	*	*				-140	107.8	113.5	-82.2	142.5	0	0	0	106.1
4	K	34.8	Very low	41.2	Very low	160 Å²	160	145.2 Å²	145.2	70%	0.696	72%	0.724	S	S	*	*			trans	-98.3	153.1	164.5	-85.8	-175.2	170.4	-178.5	0	107.7
5	H	41.4	Very low	41	Very low	152 Å²	152	148.3 Å²	148.3	70%	0.704	72%	0.724	S	S	*	*			trans	80.7	86.6	163.9	-58.9	-68.4	0	0	0	117.9
6	F	41.1	Very low	41.1	Very low	205 Å²	205	142.8 Å²	142.8	90%	0.899	71%	0.71	S	S	*	*			trans	-138.4	91.1	137.3	-126	-94.6	0	0	0	107.8
7	V	39.8	Very low	40.9	Very low	121 Å²	121	137.1 Å²	137.1	73%	0.733	70%	0.696	S	S	*	*			trans	-88.8	113.3	167.3	174.6	0	0	0	0	105.7	F9	V7-F9 PolarHBondContact O-N 3.48Å
8	P	43.4	Very low	40.7	Very low	78 Å²	78	138.2 Å²	138.2	51%	0.506	70%	0.696	S	S	.	*			trans	-83	123.5	-177.7	31.3	-29.2	0	0	0	109.5	S10	P8-S10 PolarHBondContact O-N 3.32Å
9	F	40.9	Very low	40.5	Very low	189 Å²	189	137 Å²	137	83%	0.829	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	12.4	171.7	-107.6	-98.1	0	0	0	115.8	V7	V7-F9 PolarHBondContact O-N 3.48Å
10	S	41.6	Very low	40.2	Very low	70 Å²	70	141.2 Å²	141.2	49%	0.49	70%	0.697	S	S	.	*	H	α-helix	trans	-81.9	-24.4	-172.7	60.8	0	0	0	0	114.1	P8	P8-S10 PolarHBondContact O-N 3.32Å
11	T	46.5	Very low	40	Very low	100 Å²	100	137.6 Å²	137.6	61%	0.613	69%	0.69	S	S	*	*	H	α-helix	trans	-75.9	-24	-178.9	39.7	0	0	0	0	113.8
12	F	42.9	Very low	40	Very low	168 Å²	168	132.7 Å²	132.7	74%	0.737	68%	0.677	S	S	*	*	H	α-helix	trans	-76.8	-26.8	179.7	-115.6	-87.5	0	0	0	113.6	A16	F12-A16 PolarHBondContact O-N 2.96Å
13	I	47	Very low	40	Very low	131 Å²	131	133.3 Å²	133.3	67%	0.672	68%	0.68	S	S	*	*	H	α-helix	trans	-75.1	-32.2	179.9	-59.7	179	0	0	0	111	W15 A16 G17	I13-W15 VanDerWaalsContact C-N 3.33Å; I13-W15 PolarHBondContact O-N 3.49Å; I13-A16 PolarHBondContact O-N 3.39Å; I13-G17 PolarHBondContact O-N 2.9Å; I13-G17 VanDerWaalsContact O-N 3.14Å
14	I	45.5	Very low	40.2	Very low	109 Å²	109	132.2 Å²	132.2	56%	0.559	67%	0.669	S	S	*	*	H	α-helix	trans	-68.9	-34.2	177.8	-58.5	176.4	0	0	0	110.9	G17 F18	I14-G17 PolarHBondContact O-N 3.31Å; I14-F18 HydrophobicContact CG2-CD2 4.29Å; I14-F18 PolarHBondContact O-N 2.99Å
15	W	37.9	Very low	40.8	Very low	192 Å²	192	131.5 Å²	131.5	73%	0.727	67%	0.672	S	S	*	*	H	α-helix	trans	-71	-37.1	175.8	-99.4	65.5	0	0	0	113.4	I13 G17 F18 I19	I13-W15 VanDerWaalsContact C-N 3.33Å; I13-W15 PolarHBondContact O-N 3.49Å; W15-G17 VanDerWaalsContact C-N 3.29Å; W15-G17 PolarHBondContact O-N 3.22Å; W15-F18 PolarHBondContact O-N 3.4Å; W15-I19 HydrophobicContact CE3-CD1 4.13Å; W15-I19 WeakPolarHBondContact O-CG1 3.28Å; W15-I19 PolarHBondContact O-N 2.72Å
16	A	42.8	Very low	41.8	Very low	60 Å²	60	128.1 Å²	128.1	50%	0.496	67%	0.666	S	S	.	*	H	α-helix	trans	-68.8	-28.4	174.5	0	0	0	0	0	112.8	F12 I13	F12-A16 PolarHBondContact O-N 2.96Å; I13-A16 PolarHBondContact O-N 3.39Å
17	G	37.5	Very low	43.8	Very low	46 Å²	46	123.2 Å²	123.2	47%	0.474	65%	0.648	S	S	.	*	H	α-helix	trans	-71.1	-38.4	174.2	0	0	0	0	0	113.6	I13 I14 W15	I13-G17 PolarHBondContact O-N 2.9Å; I13-G17 VanDerWaalsContact O-N 3.14Å; I14-G17 PolarHBondContact O-N 3.31Å; W15-G17 VanDerWaalsContact C-N 3.29Å; W15-G17 PolarHBondContact O-N 3.22Å
18	F	36.8	Very low	46.3	Very low	157 Å²	157	119.7 Å²	119.7	69%	0.689	63%	0.625	S	S	*	*	H	α-helix	trans	-77.3	-32.4	-179.3	-97.4	-87.8	0	0	0	113.7	I14 W15 R20 A21	I14-F18 HydrophobicContact CG2-CD2 4.29Å; I14-F18 PolarHBondContact O-N 2.99Å; W15-F18 PolarHBondContact O-N 3.4Å; F18-R20 VanDerWaalsContact C-N 3.31Å; F18-R20 PolarHBondContact O-N 3.47Å; F18-A21 PolarHBondContact O-N 3.1Å
19	I	38.1	Very low	48.7	Very low	115 Å²	115	116.4 Å²	116.4	59%	0.59	60%	0.603	S	S	*	*	H	α-helix	trans	-70	-30.8	176.6	-63.8	170.2	0	0	0	111.1	W15 A21	W15-I19 HydrophobicContact CE3-CD1 4.13Å; W15-I19 WeakPolarHBondContact O-CG1 3.28Å; W15-I19 PolarHBondContact O-N 2.72Å; I19-A21 VanDerWaalsContact C-N 3.31Å; I19-A21 PolarHBondContact O-N 3.11Å
20	R	33.1	Very low	51.3	Low	220 Å²	220	107.4 Å²	107.4	83%	0.83	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-14.8	175.6	-81.7	-176.6	175.7	169.1	-0.2	114.7	F18	F18-R20 VanDerWaalsContact C-N 3.31Å; F18-R20 PolarHBondContact O-N 3.47Å
21	A	36.4	Very low	53.8	Low	67 Å²	67	104.3 Å²	104.3	55%	0.554	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-21.5	-179.3	0	0	0	0	0	113.7	F18 I19	F18-A21 PolarHBondContact O-N 3.1Å; I19-A21 VanDerWaalsContact C-N 3.31Å; I19-A21 PolarHBondContact O-N 3.11Å
22	C	37.9	Very low	56.1	Low	122 Å²	122	99.8 Å²	99.8	82%	0.824	51%	0.514	S	S	*	.	S	Bend	trans	-92.5	-2.7	-179.9	-84.1	0	0	0	0	114.7
23	E	36	Very low	58.5	Low	159 Å²	159	94.7 Å²	94.7	74%	0.743	50%	0.495	S	S	*	.			trans	-106.3	48.7	171.6	-150.7	161.6	-157.4	0	0	109.9	N25	E23-N25 VanDerWaalsContact C-N 3.26Å; E23-N25 PolarHBondContact O-N 3.03Å
24	K	43.3	Very low	60.6	Low	156 Å²	156	89.9 Å²	89.9	68%	0.678	47%	0.468	S	S	*	.			trans	-57.2	103.7	152.5	-93.5	-173.6	173.5	-176.7	0	104.6	S26 D146	K24-S26 VanDerWaalsContact C-N 3.34Å; K24-S26 PolarHBondContact O-N 3.35Å; K24-D146 IonicContact NZ-OD2 3.43Å; K24-D146 PolarHBondContact NZ-OD2 3.17Å
25	N	47.5	Very low	62.8	Low	144 Å²	144	86.7 Å²	86.7	77%	0.77	45%	0.452	S	S	*	.			trans	-34.5	97.8	172.9	-91.2	-19.1	0	0	0	109	E23 I27	E23-N25 VanDerWaalsContact C-N 3.26Å; E23-N25 PolarHBondContact O-N 3.03Å; N25-I27 VanDerWaalsContact C-N 3.34Å; N25-I27 PolarHBondContact O-N 2.93Å
26	S	60.9	Low	65.4	Low	81 Å²	81	77.6 Å²	77.6	57%	0.566	42%	0.417	S	S	*	.			trans	-73	102.2	-176.7	84.1	0	0	0	0	105.1	K24 N28	K24-S26 VanDerWaalsContact C-N 3.34Å; K24-S26 PolarHBondContact O-N 3.35Å; S26-N28 PolarHBondContact O-N 3.24Å; S26-N28 VanDerWaalsContact O-N 3.12Å
27	I	83.4	Confident	67.6	Low	103 Å²	103	80.1 Å²	80.1	53%	0.528	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-61.6	119.6	178.1	-59	173.1	0	0	0	106.1	N25 V258	N25-I27 VanDerWaalsContact C-N 3.34Å; N25-I27 PolarHBondContact O-N 2.93Å; I27-V258 HydrophobicContact CB-CB 4.36Å; I27-V258 HydrophobicContact CB-CG1 4.14Å; I27-V258 HydrophobicContact CG2-CB 4.45Å; I27-V258 HydrophobicContact CG2-CG1 3.77Å
28	N	92.5	Very high	70.2	Confident	47 Å²	47	79.9 Å²	79.9	25%	0.251	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-67.3	135.7	174.7	-70.9	-42.5	0	0	0	108.6	S26 A288 T289	S26-N28 PolarHBondContact O-N 3.24Å; S26-N28 VanDerWaalsContact O-N 3.12Å; N28-A288 HydrophobicContact CB-CB 4.12Å; N28-A288 WeakPolarHBondContact CB-O 3.33Å; N28-A288 PolarHBondContact ND2-O 3.01Å; N28-A288 WeakPolarHBondContact O-CB 3.31Å; N28-T289 WeakPolarHBondContact CB-O 3.47Å
29	P	94.1	Very high	72.8	Confident	8 Å²	8	72.4 Å²	72.4	5%	0.052	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-69.5	134.9	174.7	28.3	-32.6	0	0	0	110.3	V32 V258 M271 H272 L291	P29-V32 HydrophobicContact CB-CG2 4.04Å; P29-V32 HydrophobicContact CG-CG2 4.13Å; P29-V258 HydrophobicContact CB-CG2 3.84Å; P29-M271 HydrophobicContact CB-CB 3.88Å; P29-M271 HydrophobicContact CB-CG 4.45Å; P29-M271 HydrophobicContact CG-CB 4.29Å; P29-M271 HydrophobicContact CG-CG 4.42Å; P29-M271 HydrophobicContact CG-SD 4.21Å; P29-H272 WeakPolarHBondContact CA-O 3.44Å; P29-L291 WeakPolarHBondContact O-CB 3.16Å
30	A	95.1	Very high	75.3	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.348	C	S	.	.	S	Bend	trans	-96.7	-21.4	170.1	0	0	0	0	0	112.6	H272 A273 A288 S307 Y309 V310	A30-H272 PolarHBondContact N-O 3.02Å; A30-A273 WeakPolarHBondContact CB-O 3.36Å; A30-A288 HydrophobicContact CB-CB 4.1Å; A30-S307 VanDerWaalsContact CA-OG 3.28Å; A30-S307 WeakPolarHBondContact CA-OG 3.41Å; A30-S307 VanDerWaalsContact CB-OG 3.26Å; A30-S307 WeakPolarHBondContact CB-OG 3.47Å; A30-S307 PolarHBondContact O-N 3.44Å; A30-S307 PolarHBondContact O-OG 3.04Å; A30-Y309 HydrophobicContact CB-CD1 3.43Å; A30-Y309 VanDerWaalsContact CB-CD1 3.43Å; A30-Y309 HydrophobicContact CB-CE1 4.27Å; A30-Y309 HydrophobicContact CB-CG 4.18Å; A30-V310 HydrophobicContact CB-CG2 3.92Å
31	V	94.8	Very high	77.9	Confident	6 Å²	6	61.4 Å²	61.4	4%	0.036	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128	173.9	176.5	0	0	0	0	109.3	L33 L255 H272 I304 F305 L306 V310	V31-L33 HydrophobicContact CG1-CD2 3.98Å; V31-L33 HydrophobicContact CG1-CG 4.45Å; V31-L255 HydrophobicContact CB-CD2 4.42Å; V31-L255 HydrophobicContact CG1-CD2 4.39Å; V31-L255 HydrophobicContact CG2-CD2 4.28Å; V31-H272 HydrophobicContact CB-CB 4.1Å; V31-H272 PolarHBondContact N-O 2.81Å; V31-H272 PolarHBondContact O-N 3.44Å; V31-I304 HydrophobicContact CG1-CG2 4.44Å; V31-F305 VanDerWaalsContact CA-O 3.27Å; V31-F305 WeakPolarHBondContact CA-O 3.34Å; V31-L306 HydrophobicContact CB-CD2 4.39Å; V31-L306 HydrophobicContact CG1-CD2 4.04Å; V31-L306 HydrophobicContact CG2-CD2 3.66Å; V31-V310 HydrophobicContact CG2-CG2 3.71Å
32	V	94.2	Very high	80.5	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.024	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	121.4	171.5	170.6	0	0	0	0	108.9	P29 V269 T270 M271 L291 I304 F305	P29-V32 HydrophobicContact CB-CG2 4.04Å; P29-V32 HydrophobicContact CG-CG2 4.13Å; V32-V269 HydrophobicContact CG1-CG1 3.57Å; V32-T270 WeakPolarHBondContact CA-O 3.12Å; V32-M271 HydrophobicContact CG2-CG 4.13Å; V32-L291 HydrophobicContact CB-CD2 3.84Å; V32-L291 HydrophobicContact CG2-CD2 3.38Å; V32-I304 WeakPolarHBondContact O-CA 3.38Å; V32-F305 HydrophobicContact CB-CB 4.2Å; V32-F305 HydrophobicContact CB-CD2 4.26Å; V32-F305 HydrophobicContact CG1-CD2 4.2Å; V32-F305 PolarHBondContact N-O 3.49Å; V32-F305 PolarHBondContact O-N 2.76Å
33	L	92.8	Very high	82.9	Confident	62 Å²	62	57 Å²	57	33%	0.325	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	132.1	170.9	-45.4	174.3	0	0	0	107.6	V31 V269 T270 H272 I304	V31-L33 HydrophobicContact CG1-CD2 3.98Å; V31-L33 HydrophobicContact CG1-CG 4.45Å; L33-V269 CarbonylContact O-C 3.56Å; L33-V269 WeakPolarHBondContact O-CA 3.26Å; L33-T270 WeakPolarHBondContact CB-OG1 3.39Å; L33-T270 PolarHBondContact N-O 3.49Å; L33-T270 PolarHBondContact O-N 3.22Å; L33-H272 WeakPolarHBondContact CD1-NE2 3.43Å; L33-I304 HydrophobicContact CD2-CB 4.19Å; L33-I304 HydrophobicContact CD2-CD1 3.89Å; L33-I304 HydrophobicContact CD2-CG1 3.56Å; L33-I304 HydrophobicContact CD2-CG2 3.87Å
34	R	91.7	Very high	85.2	Confident	29 Å²	29	51.2 Å²	51.2	11%	0.109	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	119.9	178.6	175.1	176.6	-178.7	-170.4	-0.9	109.4	N36 A267 V268 V269 L295 A302 S303 F305	R34-N36 WeakPolarHBondContact CD-OD1 3.3Å; R34-N36 PolarHBondContact NE-OD1 3.19Å; R34-A267 HydrophobicContact CG-CB 4.36Å; R34-V268 CarbonylContact C-O 3.57Å; R34-V268 VanDerWaalsContact CA-O 3.32Å; R34-V268 WeakPolarHBondContact CA-O 3.42Å; R34-V269 HydrophobicContact CB-CG2 4.39Å; R34-V269 HydrophobicContact CG-CG2 4.07Å; R34-L295 VanDerWaalsContact NH1-C 3.26Å; R34-L295 PolarHBondContact NH1-O 2.88Å; R34-L295 PolarHBondContact NH2-O 2.81Å; R34-A302 CarbonylContact O-C 3.58Å; R34-A302 VanDerWaalsContact O-CA 3.26Å; R34-A302 WeakPolarHBondContact O-CA 3.48Å; R34-S303 PolarHBondContact N-O 3.28Å; R34-S303 PolarHBondContact O-N 3.41Å; R34-F305 HydrophobicContact CB-CE2 4.48Å
35	L	91.8	Very high	87.3	Confident	42 Å²	42	50.5 Å²	50.5	22%	0.22	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	122.9	159.7	-60.3	172.9	0	0	0	107.5	V40 L43 A267 V268 A302 F505	L35-V40 HydrophobicContact CB-CG2 4.25Å; L35-L43 HydrophobicContact CD1-CD1 3.51Å; L35-A267 WeakPolarHBondContact O-CA 3.26Å; L35-A267 WeakPolarHBondContact O-CB 3.4Å; L35-V268 HydrophobicContact CB-CB 4.1Å; L35-V268 HydrophobicContact CD1-CB 4.09Å; L35-V268 HydrophobicContact CD1-CG1 4.38Å; L35-V268 HydrophobicContact CG-CB 4.42Å; L35-V268 PolarHBondContact N-O 3.4Å; L35-V268 PolarHBondContact O-N 3.25Å; L35-V268 VanDerWaalsContact O-N 3.09Å; L35-A302 HydrophobicContact CD2-CB 4.07Å; L35-F505 HydrophobicContact CD2-CE1 3.81Å; L35-F505 HydrophobicContact CD2-CZ 4.05Å
36	N	92	Very high	89.1	Confident	1 Å²	1	44 Å²	44	1%	0.005	22%	0.218	C	C	.	.			trans	-82.7	173.5	175.6	-63.7	-47.8	0	0	0	110.1	R34 S38 G39 V40 K266 R300 M301 S303	R34-N36 WeakPolarHBondContact CD-OD1 3.3Å; R34-N36 PolarHBondContact NE-OD1 3.19Å; N36-S38 VanDerWaalsContact C-N 3.27Å; N36-S38 PolarHBondContact O-N 3.37Å; N36-G39 CarbonylContact O-C 3.58Å; N36-G39 WeakPolarHBondContact O-CA 3.38Å; N36-G39 PolarHBondContact O-N 3.29Å; N36-V40 PolarHBondContact O-N 2.7Å; N36-K266 CarbonylContact C-O 3.57Å; N36-R300 VanDerWaalsContact CB-O 3.25Å; N36-R300 WeakPolarHBondContact CB-O 3.45Å; N36-R300 PolarHBondContact ND2-O 2.93Å; N36-M301 PolarHBondContact N-O 2.71Å; N36-S303 PolarHBondContact ND2-OG 2.7Å
37	K	90.3	Very high	90.1	Very high	114 Å²	114	42.4 Å²	42.4	50%	0.496	20%	0.201	S	C	.	.	H	α-helix	trans	-52.3	-43.6	-177.5	-174.6	-179.1	179.1	-177	0	113	G39 V40 Q41 K266	K37-G39 VanDerWaalsContact C-N 3.34Å; K37-V40 PolarHBondContact O-N 2.86Å; K37-Q41 WeakPolarHBondContact O-CB 3.19Å; K37-Q41 VanDerWaalsContact O-CG 3.27Å; K37-Q41 WeakPolarHBondContact O-CG 3.29Å; K37-Q41 PolarHBondContact O-N 3.45Å; K37-K266 VanDerWaalsContact CA-O 3.24Å; K37-K266 WeakPolarHBondContact CA-O 3.29Å; K37-K266 PolarHBondContact N-O 3.27Å
38	S	91.3	Very high	89.9	Confident	40 Å²	40	40.5 Å²	40.5	28%	0.28	19%	0.187	S	C	.	.	H	α-helix	trans	-64.4	-38.1	177	48.4	0	0	0	0	112.4	N36 Y42 N299 R300 M301	N36-S38 VanDerWaalsContact C-N 3.27Å; N36-S38 PolarHBondContact O-N 3.37Å; S38-Y42 WeakPolarHBondContact O-CB 3.49Å; S38-Y42 PolarHBondContact O-N 3.22Å; S38-N299 PolarHBondContact OG-O 3.06Å; S38-R300 PolarHBondContact OG-O 2.77Å; S38-M301 WeakPolarHBondContact OG-CA 3.3Å
39	G	91.6	Very high	89.3	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-68.4	-41.8	174.6	0	0	0	0	0	112.8	N36 K37 Y42 L43 M301	N36-G39 CarbonylContact O-C 3.58Å; N36-G39 WeakPolarHBondContact O-CA 3.38Å; N36-G39 PolarHBondContact O-N 3.29Å; K37-G39 VanDerWaalsContact C-N 3.34Å; G39-Y42 PolarHBondContact O-N 3.24Å; G39-L43 WeakPolarHBondContact O-CG 3.34Å; G39-L43 PolarHBondContact O-N 2.83Å; G39-M301 WeakPolarHBondContact CA-O 3.44Å
40	V	89.6	Confident	88.4	Confident	2 Å²	2	43 Å²	43	1%	0.012	19%	0.194	C	C	.	.	H	α-helix	trans	-57.4	-56.8	173	172.5	0	0	0	0	109.4	L35 N36 K37 Y42 L43 E44 I92 V268	L35-V40 HydrophobicContact CB-CG2 4.25Å; N36-V40 PolarHBondContact O-N 2.7Å; K37-V40 PolarHBondContact O-N 2.86Å; V40-Y42 PolarHBondContact O-N 3.35Å; V40-L43 WeakPolarHBondContact O-CA 3.21Å; V40-L43 WeakPolarHBondContact O-CB 3.32Å; V40-L43 PolarHBondContact O-N 3.12Å; V40-E44 HydrophobicContact CG1-CG 4.25Å; V40-E44 VanDerWaalsContact O-CG 3.25Å; V40-E44 WeakPolarHBondContact O-CG 3.2Å; V40-E44 PolarHBondContact O-N 2.86Å; V40-I92 HydrophobicContact CG1-CD1 3.63Å; V40-I92 HydrophobicContact CG1-CG1 4.26Å; V40-I92 HydrophobicContact CG2-CD1 4.3Å; V40-V268 HydrophobicContact CG2-CG2 4.1Å
41	Q	89.5	Confident	87.3	Confident	102 Å²	102	43.7 Å²	43.7	48%	0.477	20%	0.198	S	C	.	.	H	α-helix	trans	-55	-38.2	179.7	-73.3	177.4	-27.9	0	0	113.3	K37 E44 W45	K37-Q41 WeakPolarHBondContact O-CB 3.19Å; K37-Q41 VanDerWaalsContact O-CG 3.27Å; K37-Q41 WeakPolarHBondContact O-CG 3.29Å; K37-Q41 PolarHBondContact O-N 3.45Å; Q41-E44 PolarHBondContact O-N 3.4Å; Q41-W45 PolarHBondContact O-N 3.22Å
42	Y	90.7	Very high	86.2	Confident	41 Å²	41	50.8 Å²	50.8	16%	0.161	23%	0.229	C	C	.	.	H	α-helix	trans	-65.1	-43.4	174.7	178.1	-95.7	0	0	0	112.4	S38 G39 V40 E44 W45 Q46 M301 F505 D506 I507	S38-Y42 WeakPolarHBondContact O-CB 3.49Å; S38-Y42 PolarHBondContact O-N 3.22Å; G39-Y42 PolarHBondContact O-N 3.24Å; V40-Y42 PolarHBondContact O-N 3.35Å; Y42-E44 VanDerWaalsContact C-N 3.34Å; Y42-W45 WeakPolarHBondContact O-CB 3.48Å; Y42-W45 PolarHBondContact O-N 2.73Å; Y42-Q46 HydrophobicContact CD1-CG 4.12Å; Y42-Q46 HydrophobicContact CE1-CG 3.7Å; Y42-Q46 HydrophobicContact CE2-CG 4.42Å; Y42-Q46 WeakPolarHBondContact O-CG 3.19Å; Y42-Q46 PolarHBondContact O-N 2.85Å; Y42-Q46 PolarHBondContact OH-NE2 3.06Å; Y42-M301 HydrophobicContact CD1-CE 3.3Å; Y42-M301 HydrophobicContact CD2-CE 3.8Å; Y42-M301 HydrophobicContact CE1-CE 3.94Å; Y42-M301 HydrophobicContact CE2-CE 4.35Å; Y42-M301 HydrophobicContact CG-CE 3.2Å; Y42-F505 HydrophobicContact CD1-CD2 4.48Å; Y42-F505 AromaticContact CD1-CE2 3.82Å; Y42-F505 HydrophobicContact CD1-CE2 3.82Å; Y42-F505 HydrophobicContact CD1-CZ 4.28Å; Y42-F505 HydrophobicContact CE1-CD2 4.23Å; Y42-F505 AromaticContact CE1-CE2 3.93Å; Y42-F505 HydrophobicContact CE1-CE2 3.93Å; Y42-D506 WeakPolarHBondContact OH-CA 3.28Å; Y42-I507 HydrophobicContact CE1-CD1 4.3Å; Y42-I507 HydrophobicContact CE1-CG1 4.14Å; Y42-I507 PolarHBondContact OH-N 3.42Å
43	L	86.9	Confident	85.1	Confident	55 Å²	55	55.8 Å²	55.8	29%	0.288	26%	0.255	S	S	.	.	H	α-helix	trans	-62.7	-41.1	174.1	-70.1	-178.1	0	0	0	111.7	L35 G39 V40 W45 Q46 F47 F505 I507	L35-L43 HydrophobicContact CD1-CD1 3.51Å; G39-L43 WeakPolarHBondContact O-CG 3.34Å; G39-L43 PolarHBondContact O-N 2.83Å; V40-L43 WeakPolarHBondContact O-CA 3.21Å; V40-L43 WeakPolarHBondContact O-CB 3.32Å; V40-L43 PolarHBondContact O-N 3.12Å; L43-W45 VanDerWaalsContact C-N 3.27Å; L43-W45 PolarHBondContact O-N 3.26Å; L43-Q46 PolarHBondContact O-N 2.77Å; L43-F47 VanDerWaalsContact O-CB 3.29Å; L43-F47 WeakPolarHBondContact O-CB 3.47Å; L43-F47 PolarHBondContact O-N 2.9Å; L43-F505 HydrophobicContact CD2-CE2 4.06Å; L43-F505 HydrophobicContact CD2-CZ 4.25Å; L43-F505 HydrophobicContact CG-CZ 4.31Å; L43-I507 HydrophobicContact CD2-CD1 3.71Å
44	E	85.6	Confident	83.9	Confident	38 Å²	38	56.3 Å²	56.3	18%	0.178	25%	0.253	C	S	.	.	H	α-helix	trans	-58.7	-44	174.8	-46	-170.5	151.7	0	0	110.3	V40 Q41 Y42 F47 R48 F90	V40-E44 HydrophobicContact CG1-CG 4.25Å; V40-E44 VanDerWaalsContact O-CG 3.25Å; V40-E44 WeakPolarHBondContact O-CG 3.2Å; V40-E44 PolarHBondContact O-N 2.86Å; Q41-E44 PolarHBondContact O-N 3.4Å; Y42-E44 VanDerWaalsContact C-N 3.34Å; E44-F47 PolarHBondContact O-N 2.93Å; E44-R48 WeakPolarHBondContact O-CB 3.4Å; E44-R48 WeakPolarHBondContact O-CG 3.43Å; E44-R48 PolarHBondContact O-N 2.69Å; E44-F90 HydrophobicContact CB-CD1 3.77Å; E44-F90 HydrophobicContact CB-CE1 4.46Å; E44-F90 HydrophobicContact CB-CG 4.48Å; E44-F90 HydrophobicContact CG-CD1 3.5Å; E44-F90 VanDerWaalsContact CG-CD1 3.5Å; E44-F90 HydrophobicContact CG-CE1 3.97Å
45	W	87	Confident	82.7	Confident	141 Å²	141	55.6 Å²	55.6	53%	0.534	25%	0.25	S	S	.	.	H	α-helix	trans	-63.6	-44.6	178.1	-178.5	80.1	0	0	0	112.6	Q41 Y42 L43 R48 R49	Q41-W45 PolarHBondContact O-N 3.22Å; Y42-W45 WeakPolarHBondContact O-CB 3.48Å; Y42-W45 PolarHBondContact O-N 2.73Å; L43-W45 VanDerWaalsContact C-N 3.27Å; L43-W45 PolarHBondContact O-N 3.26Å; W45-R48 PolarHBondContact O-N 2.79Å; W45-R49 PolarHBondContact O-N 2.85Å
46	Q	85.3	Confident	81.4	Confident	7 Å²	7	57.4 Å²	57.4	3%	0.033	27%	0.271	C	S	.	.	H	α-helix	trans	-64.4	-41.6	176.8	-71.7	-66.8	-1.7	0	0	111.9	Y42 L43 R48 R49 L50 I507	Y42-Q46 HydrophobicContact CD1-CG 4.12Å; Y42-Q46 HydrophobicContact CE1-CG 3.7Å; Y42-Q46 HydrophobicContact CE2-CG 4.42Å; Y42-Q46 WeakPolarHBondContact O-CG 3.19Å; Y42-Q46 PolarHBondContact O-N 2.85Å; Y42-Q46 PolarHBondContact OH-NE2 3.06Å; L43-Q46 PolarHBondContact O-N 2.77Å; Q46-R48 PolarHBondContact O-N 2.91Å; Q46-R49 WeakPolarHBondContact O-CB 3.47Å; Q46-R49 PolarHBondContact O-N 2.8Å; Q46-R49 VanDerWaalsContact OE1-CZ 3.29Å; Q46-L50 WeakPolarHBondContact O-CB 3.28Å; Q46-L50 WeakPolarHBondContact O-CG 3.36Å; Q46-L50 PolarHBondContact O-N 2.79Å; Q46-I507 HydrophobicContact CB-CD1 4.48Å; Q46-I507 HydrophobicContact CG-CD1 4.3Å
47	F	81.3	Confident	80.1	Confident	48 Å²	48	59.9 Å²	59.9	21%	0.211	29%	0.289	C	S	.	.	H	α-helix	trans	-61.9	-43.5	176.1	-173.8	-104.5	0	0	0	111.7	L43 E44 R49 L50 L51 F87 F90 F100	L43-F47 VanDerWaalsContact O-CB 3.29Å; L43-F47 WeakPolarHBondContact O-CB 3.47Å; L43-F47 PolarHBondContact O-N 2.9Å; E44-F47 PolarHBondContact O-N 2.93Å; F47-R49 VanDerWaalsContact C-N 3.35Å; F47-R49 PolarHBondContact O-N 2.74Å; F47-L50 WeakPolarHBondContact O-CB 3.29Å; F47-L50 PolarHBondContact O-N 2.77Å; F47-L51 HydrophobicContact CD1-CD1 3.73Å; F47-L51 HydrophobicContact CD1-CG 4.42Å; F47-L51 HydrophobicContact CE1-CD1 3.16Å; F47-L51 HydrophobicContact CE1-CG 4.11Å; F47-L51 HydrophobicContact CE2-CD1 4.19Å; F47-L51 HydrophobicContact CE2-CG 4.39Å; F47-L51 HydrophobicContact CG-CD1 4.46Å; F47-L51 HydrophobicContact CZ-CD1 3.43Å; F47-L51 VanDerWaalsContact CZ-CD1 3.43Å; F47-L51 HydrophobicContact CZ-CD2 4.49Å; F47-L51 HydrophobicContact CZ-CG 4.09Å; F47-L51 PolarHBondContact O-N 2.81Å; F47-F87 HydrophobicContact CD1-CE2 4.3Å; F47-F87 HydrophobicContact CD1-CZ 4.13Å; F47-F87 HydrophobicContact CE1-CE2 4.19Å; F47-F87 HydrophobicContact CE1-CZ 4.2Å; F47-F90 AromaticContact CD1-CD2 3.37Å; F47-F90 HydrophobicContact CD1-CD2 3.37Å; F47-F90 AromaticContact CD1-CE2 3.65Å; F47-F90 HydrophobicContact CD1-CE2 3.65Å; F47-F90 HydrophobicContact CD1-CG 4.11Å; F47-F90 AromaticContact CE1-CD2 3.45Å; F47-F90 HydrophobicContact CE1-CD2 3.45Å; F47-F90 VanDerWaalsContact CE1-CD2 3.45Å; F47-F90 AromaticContact CE1-CE2 3.64Å; F47-F90 HydrophobicContact CE1-CE2 3.64Å; F47-F90 HydrophobicContact CG-CD2 4.27Å; F47-F90 HydrophobicContact CG-CE2 4.19Å; F47-F90 HydrophobicContact CZ-CD2 4.42Å; F47-F90 HydrophobicContact CZ-CE2 4.2Å; F47-F100 HydrophobicContact CE1-CB 4.41Å; F47-F100 HydrophobicContact CE1-CG 4.42Å
48	R	80.3	Confident	79	Confident	64 Å²	64	56.9 Å²	56.9	24%	0.242	28%	0.278	C	S	.	.	H	α-helix	trans	-59	-44.5	173.3	-72.8	178.6	-166.9	-115.6	4.8	112	E44 W45 Q46 K52 F87 D88 D89	E44-R48 WeakPolarHBondContact O-CB 3.4Å; E44-R48 WeakPolarHBondContact O-CG 3.43Å; E44-R48 PolarHBondContact O-N 2.69Å; W45-R48 PolarHBondContact O-N 2.79Å; Q46-R48 PolarHBondContact O-N 2.91Å; R48-K52 VanDerWaalsContact O-CB 3.29Å; R48-K52 WeakPolarHBondContact O-CB 3.42Å; R48-K52 PolarHBondContact O-N 3Å; R48-F87 HydrophobicContact CB-CD1 4.44Å; R48-F87 HydrophobicContact CB-CG 4.46Å; R48-F87 HydrophobicContact CG-CD1 3.4Å; R48-F87 HydrophobicContact CG-CD2 4.31Å; R48-F87 HydrophobicContact CG-CE1 3.39Å; R48-F87 HydrophobicContact CG-CE2 4.43Å; R48-F87 HydrophobicContact CG-CG 3.84Å; R48-F87 HydrophobicContact CG-CZ 3.98Å; R48-F87 VanDerWaalsContact CZ-CE1 3.49Å; R48-F87 VanDerWaalsContact NH1-CD1 3.25Å; R48-D88 PolarHBondContact NH1-O 3.29Å; R48-D89 IonicContact NH2-OD1 2.79Å; R48-D89 PolarHBondContact NH2-OD1 2.74Å
49	R	79.3	Confident	78.1	Confident	70 Å²	70	59 Å²	59	26%	0.264	29%	0.286	S	S	.	.	H	α-helix	trans	-62.8	-47.1	177.8	-172.7	170.4	73.9	136.5	1.9	111.3	W45 Q46 F47 N53 E509	W45-R49 PolarHBondContact O-N 2.85Å; Q46-R49 WeakPolarHBondContact O-CB 3.47Å; Q46-R49 PolarHBondContact O-N 2.8Å; Q46-R49 VanDerWaalsContact OE1-CZ 3.29Å; F47-R49 VanDerWaalsContact C-N 3.35Å; F47-R49 PolarHBondContact O-N 2.74Å; R49-N53 WeakPolarHBondContact O-CB 3.23Å; R49-N53 VanDerWaalsContact O-CG 3.32Å; R49-N53 PolarHBondContact O-N 3.13Å; R49-N53 VanDerWaalsContact O-N 3.07Å; R49-E509 IonicContact CZ-OE1 4Å; R49-E509 IonicContact NH1-OE1 3.25Å; R49-E509 PolarHBondContact NH1-OE1 3.3Å; R49-E509 IonicContact NH2-OE1 3.21Å
50	L	75.1	Confident	77	Confident	36 Å²	36	60.6 Å²	60.6	19%	0.188	29%	0.292	C	S	.	.	H	α-helix	trans	-56.9	-53.5	176.2	-83.6	177.3	0	0	0	112.1	Q46 F47 N53 R54 L512 F515	Q46-L50 WeakPolarHBondContact O-CB 3.28Å; Q46-L50 WeakPolarHBondContact O-CG 3.36Å; Q46-L50 PolarHBondContact O-N 2.79Å; F47-L50 WeakPolarHBondContact O-CB 3.29Å; F47-L50 PolarHBondContact O-N 2.77Å; L50-N53 PolarHBondContact O-N 3.48Å; L50-R54 WeakPolarHBondContact O-CB 3.49Å; L50-R54 PolarHBondContact O-N 3.01Å; L50-L512 HydrophobicContact CD1-CD2 3.55Å; L50-L512 HydrophobicContact CD2-CB 3.64Å; L50-L512 HydrophobicContact CD2-CD2 3.89Å; L50-L512 HydrophobicContact CD2-CG 4.29Å; L50-L512 VanDerWaalsContact CD2-O 3.29Å; L50-L512 WeakPolarHBondContact CD2-O 3.48Å; L50-L512 HydrophobicContact CG-CB 4.47Å; L50-L512 HydrophobicContact CG-CD2 3.79Å; L50-F515 HydrophobicContact CD1-CD1 4.27Å
51	L	72.6	Confident	76.3	Confident	15 Å²	15	63.9 Å²	63.9	8%	0.079	31%	0.309	C	S	.	.	H	α-helix	trans	-64.5	-44.6	-178.3	-74.1	-180	0	0	0	111.5	F47 N53 R54 F55 F87 F519	F47-L51 HydrophobicContact CD1-CD1 3.73Å; F47-L51 HydrophobicContact CD1-CG 4.42Å; F47-L51 HydrophobicContact CE1-CD1 3.16Å; F47-L51 HydrophobicContact CE1-CG 4.11Å; F47-L51 HydrophobicContact CE2-CD1 4.19Å; F47-L51 HydrophobicContact CE2-CG 4.39Å; F47-L51 HydrophobicContact CG-CD1 4.46Å; F47-L51 HydrophobicContact CZ-CD1 3.43Å; F47-L51 VanDerWaalsContact CZ-CD1 3.43Å; F47-L51 HydrophobicContact CZ-CD2 4.49Å; F47-L51 HydrophobicContact CZ-CG 4.09Å; F47-L51 PolarHBondContact O-N 2.81Å; L51-N53 VanDerWaalsContact C-N 3.33Å; L51-N53 PolarHBondContact O-N 3.27Å; L51-R54 PolarHBondContact O-N 3Å; L51-R54 VanDerWaalsContact O-N 3.1Å; L51-F55 HydrophobicContact CB-CD2 4.3Å; L51-F55 HydrophobicContact CD2-CE2 4.26Å; L51-F55 WeakPolarHBondContact O-CB 3.44Å; L51-F55 WeakPolarHBondContact O-CD2 3.43Å; L51-F55 PolarHBondContact O-N 3.49Å; L51-F87 HydrophobicContact CB-CD2 4.44Å; L51-F87 HydrophobicContact CD1-CD2 4.02Å; L51-F87 HydrophobicContact CD1-CE2 3.43Å; L51-F87 VanDerWaalsContact CD1-CE2 3.43Å; L51-F87 HydrophobicContact CD1-CZ 4.44Å; L51-F519 HydrophobicContact CD2-CE2 4.45Å
52	K	72.1	Confident	75.5	Confident	156 Å²	156	62.9 Å²	62.9	68%	0.678	31%	0.307	S	S	*	.	H	α-helix	trans	-56.3	-47.8	177.5	-176.3	-178.7	177.9	-175.6	0	111.8	R48 R54	R48-K52 VanDerWaalsContact O-CB 3.29Å; R48-K52 WeakPolarHBondContact O-CB 3.42Å; R48-K52 PolarHBondContact O-N 3Å; K52-R54 VanDerWaalsContact C-N 3.29Å; K52-R54 PolarHBondContact O-N 2.8Å
53	N	69.8	Low	74.5	Confident	108 Å²	108	62.3 Å²	62.3	58%	0.578	31%	0.311	S	S	*	.	H	α-helix	trans	-66.4	-32.7	179.4	-70.7	-8.3	0	0	0	111.7	R49 L50 L51	R49-N53 WeakPolarHBondContact O-CB 3.23Å; R49-N53 VanDerWaalsContact O-CG 3.32Å; R49-N53 PolarHBondContact O-N 3.13Å; R49-N53 VanDerWaalsContact O-N 3.07Å; L50-N53 PolarHBondContact O-N 3.48Å; L51-N53 VanDerWaalsContact C-N 3.33Å; L51-N53 PolarHBondContact O-N 3.27Å
54	R	67.5	Low	73.9	Confident	73 Å²	73	59.8 Å²	59.8	28%	0.275	30%	0.298	S	S	.	.	H	α-helix	trans	-86	-36.3	-176.8	-156.2	72.6	-171.6	146	-8.6	114.3	L50 L51 K52 A56 S57 I58 G516 F519 S520	L50-R54 WeakPolarHBondContact O-CB 3.49Å; L50-R54 PolarHBondContact O-N 3.01Å; L51-R54 PolarHBondContact O-N 3Å; L51-R54 VanDerWaalsContact O-N 3.1Å; K52-R54 VanDerWaalsContact C-N 3.29Å; K52-R54 PolarHBondContact O-N 2.8Å; R54-A56 PolarHBondContact O-N 2.75Å; R54-S57 WeakPolarHBondContact CA-OG 3.33Å; R54-S57 WeakPolarHBondContact CD-OG 3.38Å; R54-S57 PolarHBondContact NE-OG 3.5Å; R54-S57 VanDerWaalsContact NH1-CB 3.34Å; R54-S57 PolarHBondContact NH1-OG 3.27Å; R54-S57 WeakPolarHBondContact O-CA 3.43Å; R54-S57 PolarHBondContact O-N 3.03Å; R54-S57 PolarHBondContact O-OG 3.34Å; R54-I58 PolarHBondContact O-N 3.06Å; R54-G516 WeakPolarHBondContact CD-O 3.39Å; R54-G516 PolarHBondContact NE-O 2.81Å; R54-F519 HydrophobicContact CG-CD1 4.24Å; R54-S520 PolarHBondContact NH2-OG 2.84Å
55	F	66.6	Low	73.3	Confident	14 Å²	14	61 Å²	61	6%	0.061	30%	0.303	C	S	.	.	H	α-helix	trans	-54.7	-32.9	170.3	-92.6	-89.4	0	0	0	111.5	L51 S57 I58 W60 P85 L102	L51-F55 HydrophobicContact CB-CD2 4.3Å; L51-F55 HydrophobicContact CD2-CE2 4.26Å; L51-F55 WeakPolarHBondContact O-CB 3.44Å; L51-F55 WeakPolarHBondContact O-CD2 3.43Å; L51-F55 PolarHBondContact O-N 3.49Å; F55-S57 VanDerWaalsContact C-N 3.26Å; F55-S57 PolarHBondContact O-N 3.49Å; F55-I58 HydrophobicContact CD1-CD1 4.17Å; F55-I58 HydrophobicContact CE1-CD1 4.48Å; F55-I58 HydrophobicContact CG-CD1 4.47Å; F55-W60 HydrophobicContact CD1-CH2 4.1Å; F55-W60 AromaticContact CD1-CZ2 3.77Å; F55-W60 HydrophobicContact CD1-CZ2 3.77Å; F55-W60 HydrophobicContact CE1-CH2 4.21Å; F55-W60 HydrophobicContact CE1-CZ2 4.33Å; F55-W60 PolarHBondContact O-NE1 2.8Å; F55-P85 HydrophobicContact CB-CG 4.04Å; F55-P85 HydrophobicContact CD1-CG 3.36Å; F55-P85 HydrophobicContact CD2-CG 4.29Å; F55-P85 HydrophobicContact CE1-CG 3.86Å; F55-P85 HydrophobicContact CG-CG 3.64Å; F55-L102 HydrophobicContact CD2-CD1 4.38Å; F55-L102 HydrophobicContact CE1-CD1 3.92Å; F55-L102 HydrophobicContact CE2-CD1 3.43Å; F55-L102 VanDerWaalsContact CE2-CD1 3.43Å; F55-L102 HydrophobicContact CZ-CD1 3.16Å
56	A	65.1	Low	72.5	Confident	80 Å²	80	56.4 Å²	56.4	66%	0.661	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-18	173.2	0	0	0	0	0	114.5	R54	R54-A56 PolarHBondContact O-N 2.75Å
57	S	65.3	Low	71.6	Confident	54 Å²	54	56.7 Å²	56.7	38%	0.378	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-4.1	-175.2	69.7	0	0	0	0	115	R54 F55 D59	R54-S57 WeakPolarHBondContact CA-OG 3.33Å; R54-S57 WeakPolarHBondContact CD-OG 3.38Å; R54-S57 PolarHBondContact NE-OG 3.5Å; R54-S57 VanDerWaalsContact NH1-CB 3.34Å; R54-S57 PolarHBondContact NH1-OG 3.27Å; R54-S57 WeakPolarHBondContact O-CA 3.43Å; R54-S57 PolarHBondContact O-N 3.03Å; R54-S57 PolarHBondContact O-OG 3.34Å; F55-S57 VanDerWaalsContact C-N 3.26Å; F55-S57 PolarHBondContact O-N 3.49Å; S57-D59 PolarHBondContact O-N 3.15Å
58	I	66.8	Low	71	Confident	50 Å²	50	54.5 Å²	54.5	26%	0.256	28%	0.282	S	S	.	.	S	Bend	trans	-64.3	134.4	175.3	-67.6	170.1	0	0	0	108.5	R54 F55 W60 A63 F519	R54-I58 PolarHBondContact O-N 3.06Å; F55-I58 HydrophobicContact CD1-CD1 4.17Å; F55-I58 HydrophobicContact CE1-CD1 4.48Å; F55-I58 HydrophobicContact CG-CD1 4.47Å; I58-W60 VanDerWaalsContact C-N 3.25Å; I58-W60 HydrophobicContact CB-CD2 4.4Å; I58-W60 HydrophobicContact CB-CG 4.5Å; I58-W60 HydrophobicContact CB-CZ2 4.25Å; I58-W60 HydrophobicContact CD1-CH2 4.43Å; I58-W60 HydrophobicContact CD1-CZ2 3.9Å; I58-W60 HydrophobicContact CG2-CD2 3.97Å; I58-W60 HydrophobicContact CG2-CE3 4.49Å; I58-W60 HydrophobicContact CG2-CG 4.16Å; I58-W60 HydrophobicContact CG2-CZ2 4.33Å; I58-W60 PolarHBondContact O-N 3.38Å; I58-A63 HydrophobicContact CG2-CB 4.49Å; I58-F519 HydrophobicContact CD1-CE1 4.28Å
59	D	71.2	Confident	70.2	Confident	84 Å²	84	55.2 Å²	55.2	45%	0.449	29%	0.291	S	S	.	.			trans	-75.1	85.1	168.7	-177.3	-8.4	0	0	0	109.4	S57 N61 N62 A63	S57-D59 PolarHBondContact O-N 3.15Å; D59-N61 PolarHBondContact O-N 3.01Å; D59-N61 WeakPolarHBondContact OD1-CB 3.09Å; D59-N61 PolarHBondContact OD1-N 3.36Å; D59-N62 HydrophobicContact CB-CB 4.33Å; D59-N62 PolarHBondContact O-N 2.88Å; D59-N62 PolarHBondContact OD1-N 3.46Å; D59-N62 VanDerWaalsContact OD1-N 3.16Å; D59-N62 VanDerWaalsContact OD2-CG 3.31Å; D59-N62 PolarHBondContact OD2-ND2 3.4Å; D59-A63 PolarHBondContact O-N 2.81Å
60	W	70.4	Confident	69.5	Low	35 Å²	35	57 Å²	57	13%	0.133	31%	0.311	C	S	.	.	H	α-helix	trans	-65.1	-25.2	-177.6	-69.6	96.5	0	0	0	113.2	F55 I58 A63 V64 L79 L82 M105 L107	F55-W60 HydrophobicContact CD1-CH2 4.1Å; F55-W60 AromaticContact CD1-CZ2 3.77Å; F55-W60 HydrophobicContact CD1-CZ2 3.77Å; F55-W60 HydrophobicContact CE1-CH2 4.21Å; F55-W60 HydrophobicContact CE1-CZ2 4.33Å; F55-W60 PolarHBondContact O-NE1 2.8Å; I58-W60 VanDerWaalsContact C-N 3.25Å; I58-W60 HydrophobicContact CB-CD2 4.4Å; I58-W60 HydrophobicContact CB-CG 4.5Å; I58-W60 HydrophobicContact CB-CZ2 4.25Å; I58-W60 HydrophobicContact CD1-CH2 4.43Å; I58-W60 HydrophobicContact CD1-CZ2 3.9Å; I58-W60 HydrophobicContact CG2-CD2 3.97Å; I58-W60 HydrophobicContact CG2-CE3 4.49Å; I58-W60 HydrophobicContact CG2-CG 4.16Å; I58-W60 HydrophobicContact CG2-CZ2 4.33Å; I58-W60 PolarHBondContact O-N 3.38Å; W60-A63 HydrophobicContact CE3-CB 4.47Å; W60-A63 PolarHBondContact O-N 3.04Å; W60-V64 VanDerWaalsContact O-CB 3.23Å; W60-V64 WeakPolarHBondContact O-CB 3.41Å; W60-V64 WeakPolarHBondContact O-CG2 3.23Å; W60-V64 PolarHBondContact O-N 3.5Å; W60-L79 HydrophobicContact CB-CD2 3.37Å; W60-L79 HydrophobicContact CB-CG 4.39Å; W60-L79 HydrophobicContact CG-CD2 4.2Å; W60-L82 HydrophobicContact CD2-CD1 4.24Å; W60-L82 HydrophobicContact CD2-CD2 3.74Å; W60-L82 VanDerWaalsContact CE2-CD2 3.45Å; W60-L82 HydrophobicContact CE3-CD1 4.44Å; W60-L82 HydrophobicContact CG-CD2 3.61Å; W60-L82 HydrophobicContact CZ2-CD1 4.47Å; W60-L82 HydrophobicContact CZ2-CD2 4.2Å; W60-M105 HydrophobicContact CH2-SD 3.68Å; W60-M105 HydrophobicContact CZ2-SD 4.39Å; W60-M105 HydrophobicContact CZ3-SD 4.16Å; W60-L107 HydrophobicContact CE3-CD2 4.18Å; W60-L107 HydrophobicContact CZ3-CD2 4.4Å
61	N	74.1	Confident	69.2	Low	70 Å²	70	57.1 Å²	57.1	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-63	-49.5	173.5	-80.3	-47.4	0	0	0	110.3	D59 V64 K65 L79	D59-N61 PolarHBondContact O-N 3.01Å; D59-N61 WeakPolarHBondContact OD1-CB 3.09Å; D59-N61 PolarHBondContact OD1-N 3.36Å; N61-V64 PolarHBondContact O-N 2.76Å; N61-K65 WeakPolarHBondContact O-CG 3.35Å; N61-K65 PolarHBondContact O-N 3.31Å; N61-L79 WeakPolarHBondContact OD1-CA 3.36Å; N61-L79 VanDerWaalsContact OD1-CB 3.23Å; N61-L79 WeakPolarHBondContact OD1-CB 3.25Å; N61-L79 PolarHBondContact OD1-N 3.49Å; N61-L79 PolarHBondContact OD1-O 2.72Å
62	N	72.4	Confident	69.1	Low	81 Å²	81	57.8 Å²	57.8	43%	0.433	32%	0.317	S	S	.	.	H	α-helix	trans	-67.5	-35.7	175.9	-82.5	-26.3	0	0	0	112.6	D59 T66	D59-N62 HydrophobicContact CB-CB 4.33Å; D59-N62 PolarHBondContact O-N 2.88Å; D59-N62 PolarHBondContact OD1-N 3.46Å; D59-N62 VanDerWaalsContact OD1-N 3.16Å; D59-N62 VanDerWaalsContact OD2-CG 3.31Å; D59-N62 PolarHBondContact OD2-ND2 3.4Å; N62-T66 WeakPolarHBondContact O-CG2 3.3Å; N62-T66 PolarHBondContact O-N 2.73Å; N62-T66 VanDerWaalsContact O-N 3.17Å; N62-T66 PolarHBondContact O-OG1 3.26Å; N62-T66 VanDerWaalsContact O-OG1 3.13Å
63	A	69.5	Low	68.9	Low	30 Å²	30	54.3 Å²	54.3	25%	0.248	31%	0.311	C	S	.	.	H	α-helix	trans	-60.4	-51.3	174.6	0	0	0	0	0	111	I58 D59 W60 T66 M67	I58-A63 HydrophobicContact CG2-CB 4.49Å; D59-A63 PolarHBondContact O-N 2.81Å; W60-A63 HydrophobicContact CE3-CB 4.47Å; W60-A63 PolarHBondContact O-N 3.04Å; A63-T66 PolarHBondContact O-N 2.85Å; A63-T66 PolarHBondContact O-OG1 2.78Å; A63-M67 VanDerWaalsContact O-CB 3.3Å; A63-M67 WeakPolarHBondContact O-CB 3.38Å; A63-M67 PolarHBondContact O-N 3.22Å
64	V	73.7	Confident	68.9	Low	2 Å²	2	52.7 Å²	52.7	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-62.7	-43.6	179.9	166.2	0	0	0	0	112.1	W60 N61 T66 M67 L68 A77 L79 I109	W60-V64 VanDerWaalsContact O-CB 3.23Å; W60-V64 WeakPolarHBondContact O-CB 3.41Å; W60-V64 WeakPolarHBondContact O-CG2 3.23Å; W60-V64 PolarHBondContact O-N 3.5Å; N61-V64 PolarHBondContact O-N 2.76Å; V64-T66 VanDerWaalsContact C-N 3.31Å; V64-T66 PolarHBondContact O-N 2.82Å; V64-M67 WeakPolarHBondContact O-CB 3.35Å; V64-M67 PolarHBondContact O-N 3.27Å; V64-L68 HydrophobicContact CG1-CD1 4.38Å; V64-L68 PolarHBondContact O-N 2.83Å; V64-A77 HydrophobicContact CG1-CB 3.66Å; V64-L79 HydrophobicContact CG2-CB 4.49Å; V64-L79 HydrophobicContact CG2-CD1 4.1Å; V64-I109 HydrophobicContact CG1-CB 4.29Å; V64-I109 HydrophobicContact CG1-CD1 3.92Å; V64-I109 HydrophobicContact CG1-CG1 3.88Å; V64-I109 HydrophobicContact CG1-CG2 3.48Å; V64-I109 VanDerWaalsContact CG1-CG2 3.48Å; V64-I109 HydrophobicContact CG2-CD1 4.16Å; V64-I109 HydrophobicContact CG2-CG1 4.19Å
65	K	74.5	Confident	69.1	Low	64 Å²	64	50.7 Å²	50.7	28%	0.278	30%	0.296	S	S	.	.	H	α-helix	trans	-53.7	-49.4	173.3	-76.6	-176.2	-172.4	-155	0	111.4	N61 L69 E76 A77	N61-K65 WeakPolarHBondContact O-CG 3.35Å; N61-K65 PolarHBondContact O-N 3.31Å; K65-L69 WeakPolarHBondContact O-CD1 3.08Å; K65-L69 PolarHBondContact O-N 2.87Å; K65-E76 IonicContact NZ-OE1 2.61Å; K65-E76 PolarHBondContact NZ-OE1 2.77Å; K65-A77 VanDerWaalsContact CE-O 3.28Å; K65-A77 WeakPolarHBondContact CE-O 3.5Å; K65-A77 WeakPolarHBondContact CG-O 3.22Å
66	T	69.3	Low	69.7	Low	43 Å²	43	52.8 Å²	52.8	26%	0.264	31%	0.306	S	S	.	.	H	α-helix	trans	-74.3	-25.5	-179.5	59.9	0	0	0	0	114.3	N62 A63 V64 L68 K523	N62-T66 WeakPolarHBondContact O-CG2 3.3Å; N62-T66 PolarHBondContact O-N 2.73Å; N62-T66 VanDerWaalsContact O-N 3.17Å; N62-T66 PolarHBondContact O-OG1 3.26Å; N62-T66 VanDerWaalsContact O-OG1 3.13Å; A63-T66 PolarHBondContact O-N 2.85Å; A63-T66 PolarHBondContact O-OG1 2.78Å; V64-T66 VanDerWaalsContact C-N 3.31Å; V64-T66 PolarHBondContact O-N 2.82Å; T66-L68 VanDerWaalsContact C-N 3.35Å; T66-K523 PolarHBondContact OG1-NZ 3.2Å
67	M	67.3	Low	70.5	Confident	13 Å²	13	49 Å²	49	6%	0.064	28%	0.275	C	S	.	.	H	α-helix	trans	-68.1	-35.1	177.6	174.8	-171.6	168.6	0	0	112.1	A63 V64 L131 A194 R197	A63-M67 VanDerWaalsContact O-CB 3.3Å; A63-M67 WeakPolarHBondContact O-CB 3.38Å; A63-M67 PolarHBondContact O-N 3.22Å; V64-M67 WeakPolarHBondContact O-CB 3.35Å; V64-M67 PolarHBondContact O-N 3.27Å; M67-L131 HydrophobicContact CE-CD1 4.14Å; M67-A194 HydrophobicContact CE-CB 3.12Å; M67-R197 HydrophobicContact CB-CB 4.34Å; M67-R197 HydrophobicContact CB-CG 4.05Å; M67-R197 HydrophobicContact CG-CB 4.11Å; M67-R197 HydrophobicContact CG-CG 4.35Å
68	L	67.9	Low	71.4	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-99.1	-20.2	-173.3	-63.1	-175.4	0	0	0	114.6	V64 T66 P70 S71 F72 A77 I109 L111 L190	V64-L68 HydrophobicContact CG1-CD1 4.38Å; V64-L68 PolarHBondContact O-N 2.83Å; T66-L68 VanDerWaalsContact C-N 3.35Å; L68-P70 VanDerWaalsContact C-CD 3.44Å; L68-P70 VanDerWaalsContact C-N 3.32Å; L68-S71 CarbonylContact O-C 3.54Å; L68-S71 PolarHBondContact O-N 2.86Å; L68-F72 HydrophobicContact CD2-CD2 4.39Å; L68-F72 PolarHBondContact O-N 2.87Å; L68-A77 HydrophobicContact CB-CB 4.39Å; L68-A77 HydrophobicContact CD1-CB 3.76Å; L68-A77 HydrophobicContact CG-CB 4.5Å; L68-I109 HydrophobicContact CD1-CD1 4.38Å; L68-I109 HydrophobicContact CD1-CG2 4Å; L68-L111 HydrophobicContact CD1-CD1 4.49Å; L68-L111 HydrophobicContact CD1-CD2 3.26Å; L68-L111 HydrophobicContact CD1-CG 4.47Å; L68-L190 HydrophobicContact CD1-CD2 4.15Å; L68-L190 HydrophobicContact CD2-CD2 3.32Å; L68-L190 HydrophobicContact CG-CD2 4.41Å
69	L	63.7	Low	72.2	Confident	80 Å²	80	51.3 Å²	51.3	42%	0.419	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-45.2	178	-119.6	84.3	0	0	0	114.1	K65 S71 F72 P73	K65-L69 WeakPolarHBondContact O-CD1 3.08Å; K65-L69 PolarHBondContact O-N 2.87Å; L69-S71 VanDerWaalsContact C-N 3.33Å; L69-S71 PolarHBondContact O-N 3.43Å; L69-F72 CarbonylContact O-C 3.51Å; L69-P73 WeakPolarHBondContact O-CA 3.32Å
70	P	65.3	Low	72.9	Confident	108 Å²	108	52 Å²	52	70%	0.701	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-31.2	179.5	-20.4	33	0	0	0	113.5	L68	L68-P70 VanDerWaalsContact C-CD 3.44Å; L68-P70 VanDerWaalsContact C-N 3.32Å
71	S	68	Low	73.7	Confident	38 Å²	38	54.8 Å²	54.8	27%	0.266	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-29	-178	-59.7	0	0	0	0	112.6	L68 L69	L68-S71 CarbonylContact O-C 3.54Å; L68-S71 PolarHBondContact O-N 2.86Å; L69-S71 VanDerWaalsContact C-N 3.33Å; L69-S71 PolarHBondContact O-N 3.43Å
72	F	71.4	Confident	74.2	Confident	28 Å²	28	53.2 Å²	53.2	12%	0.123	29%	0.286	C	S	.	.			trans	-145	71.3	-174.5	-55.7	-77.5	0	0	0	111	L68 L69 L74 L75 M186 L189 L190	L68-F72 HydrophobicContact CD2-CD2 4.39Å; L68-F72 PolarHBondContact O-N 2.87Å; L69-F72 CarbonylContact O-C 3.51Å; F72-L74 PolarHBondContact O-N 2.69Å; F72-L74 VanDerWaalsContact O-N 3.1Å; F72-L75 HydrophobicContact CB-CB 3.97Å; F72-L75 HydrophobicContact CB-CD1 3.79Å; F72-L75 HydrophobicContact CB-CG 4.03Å; F72-L75 HydrophobicContact CD1-CD1 3.97Å; F72-L75 HydrophobicContact CG-CD1 3.97Å; F72-L75 PolarHBondContact O-N 3.22Å; F72-M186 HydrophobicContact CE1-CG 3.72Å; F72-M186 HydrophobicContact CE1-SD 4.04Å; F72-M186 HydrophobicContact CZ-CG 3.56Å; F72-M186 HydrophobicContact CZ-SD 4.39Å; F72-L189 HydrophobicContact CZ-CB 4.14Å; F72-L190 HydrophobicContact CD2-CD2 4.26Å; F72-L190 HydrophobicContact CE2-CD2 3.58Å; F72-L190 HydrophobicContact CE2-CG 3.82Å; F72-L190 HydrophobicContact CZ-CD2 4.41Å; F72-L190 HydrophobicContact CZ-CG 4.21Å
73	P	67.4	Low	74.8	Confident	83 Å²	83	56 Å²	56	54%	0.539	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.9	-175.1	25.4	-35.1	0	0	0	113.8	L69	L69-P73 WeakPolarHBondContact O-CA 3.32Å
74	L	69.2	Low	75.3	Confident	74 Å²	74	58.4 Å²	58.4	39%	0.387	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-5.2	178.5	-60.1	176.5	0	0	0	113.3	F72 R114 L115 M552	F72-L74 PolarHBondContact O-N 2.69Å; F72-L74 VanDerWaalsContact O-N 3.1Å; L74-R114 WeakPolarHBondContact O-CB 3.27Å; L74-R114 PolarHBondContact O-N 3.01Å; L74-L115 HydrophobicContact CD2-CD1 3.94Å; L74-M552 HydrophobicContact CD1-CE 4.25Å
75	L	72.7	Confident	75.7	Confident	31 Å²	31	59.2 Å²	59.2	16%	0.162	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.5	-179.3	-61.4	177.8	0	0	0	110.5	F72 L111 E112	F72-L75 HydrophobicContact CB-CB 3.97Å; F72-L75 HydrophobicContact CB-CD1 3.79Å; F72-L75 HydrophobicContact CB-CG 4.03Å; F72-L75 HydrophobicContact CD1-CD1 3.97Å; F72-L75 HydrophobicContact CG-CD1 3.97Å; F72-L75 PolarHBondContact O-N 3.22Å; L75-L111 HydrophobicContact CB-CB 4.35Å; L75-L111 HydrophobicContact CD1-CB 4.04Å; L75-L111 HydrophobicContact CD1-CD1 4.04Å; L75-E112 CarbonylContact C-O 3.58Å; L75-E112 WeakPolarHBondContact CA-O 3.43Å
76	E	79	Confident	76.1	Confident	58 Å²	58	64.1 Å²	64.1	27%	0.271	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	133.9	161.7	177.8	164.5	-164.9	0	0	109	K65 L111 E112	K65-E76 IonicContact NZ-OE1 2.61Å; K65-E76 PolarHBondContact NZ-OE1 2.77Å; E76-L111 CarbonylContact O-C 3.5Å; E76-L111 VanDerWaalsContact O-CA 3.29Å; E76-L111 WeakPolarHBondContact O-CA 3.06Å; E76-E112 HydrophobicContact CB-CG 3.83Å; E76-E112 HydrophobicContact CG-CG 4.39Å; E76-E112 PolarHBondContact N-O 2.99Å; E76-E112 PolarHBondContact O-N 3.47Å
77	A	81.8	Confident	76.5	Confident	2 Å²	2	63.7 Å²	63.7	2%	0.017	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	141.5	-179.6	0	0	0	0	0	111.3	V64 K65 L68 I109 F110 L111	V64-A77 HydrophobicContact CG1-CB 3.66Å; K65-A77 VanDerWaalsContact CE-O 3.28Å; K65-A77 WeakPolarHBondContact CE-O 3.5Å; K65-A77 WeakPolarHBondContact CG-O 3.22Å; L68-A77 HydrophobicContact CB-CB 4.39Å; L68-A77 HydrophobicContact CD1-CB 3.76Å; L68-A77 HydrophobicContact CG-CB 4.5Å; A77-I109 HydrophobicContact CB-CG2 4.07Å; A77-F110 CarbonylContact C-O 3.54Å; A77-F110 VanDerWaalsContact CA-O 3.29Å; A77-F110 WeakPolarHBondContact CA-O 3.3Å; A77-L111 HydrophobicContact CB-CD2 3.55Å
78	R	83	Confident	77.3	Confident	119 Å²	119	66 Å²	66	45%	0.449	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	136	175.2	-57.1	-176.7	-175.1	-168.6	1.5	109	I109 F110 E112	R78-I109 CarbonylContact O-C 3.53Å; R78-I109 WeakPolarHBondContact O-CA 3.34Å; R78-F110 HydrophobicContact CB-CB 4.39Å; R78-F110 PolarHBondContact N-O 2.97Å; R78-F110 PolarHBondContact O-N 2.88Å; R78-E112 IonicContact CZ-OE1 3.81Å; R78-E112 IonicContact CZ-OE2 3.01Å; R78-E112 IonicContact NE-OE1 3.42Å; R78-E112 PolarHBondContact NE-OE1 2.8Å; R78-E112 IonicContact NH2-OE1 3.05Å; R78-E112 PolarHBondContact NH2-OE1 3.38Å; R78-E112 IonicContact NH2-OE2 2.69Å
79	L	84.3	Confident	78.1	Confident	33 Å²	33	67.8 Å²	67.8	17%	0.173	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	126.6	172.3	-175.1	78.4	0	0	0	108.4	W60 N61 V64 D81 L82 L107	W60-L79 HydrophobicContact CB-CD2 3.37Å; W60-L79 HydrophobicContact CB-CG 4.39Å; W60-L79 HydrophobicContact CG-CD2 4.2Å; N61-L79 WeakPolarHBondContact OD1-CA 3.36Å; N61-L79 VanDerWaalsContact OD1-CB 3.23Å; N61-L79 WeakPolarHBondContact OD1-CB 3.25Å; N61-L79 PolarHBondContact OD1-N 3.49Å; N61-L79 PolarHBondContact OD1-O 2.72Å; V64-L79 HydrophobicContact CG2-CB 4.49Å; V64-L79 HydrophobicContact CG2-CD1 4.1Å; L79-D81 WeakPolarHBondContact CD1-O 3Å; L79-L82 HydrophobicContact CD1-CB 4.37Å; L79-L82 HydrophobicContact CD2-CB 3.71Å; L79-L82 HydrophobicContact CG-CB 4.49Å; L79-L107 HydrophobicContact CD1-CD2 3.83Å
80	I	86.5	Confident	79.1	Confident	97 Å²	97	65 Å²	65	50%	0.497	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-48.2	172.1	-71.1	167	0	0	0	110.4	V108 F110 L128	I80-V108 HydrophobicContact CB-CB 4.34Å; I80-V108 HydrophobicContact CB-CG1 4.09Å; I80-V108 HydrophobicContact CD1-CG1 4.34Å; I80-V108 HydrophobicContact CG2-CG1 4.34Å; I80-V108 PolarHBondContact N-O 2.81Å; I80-F110 HydrophobicContact CD1-CB 3.56Å; I80-F110 HydrophobicContact CD1-CD2 4.15Å; I80-F110 HydrophobicContact CD1-CG 4.23Å; I80-F110 HydrophobicContact CG1-CB 3.91Å; I80-L128 HydrophobicContact CD1-CD1 3.18Å
81	D	87.1	Confident	80.1	Confident	94 Å²	94	63.7 Å²	63.7	50%	0.503	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	142.8	-174.8	-173.7	28.2	0	0	0	109.7	L79 V108	L79-D81 WeakPolarHBondContact CD1-O 3Å; D81-V108 HydrophobicContact CB-CB 3.92Å; D81-V108 HydrophobicContact CB-CG2 3.99Å; D81-V108 PolarHBondContact N-O 3.5Å; D81-V108 PolarHBondContact O-N 2.56Å
82	L	83.2	Confident	80.8	Confident	37 Å²	37	62.4 Å²	62.4	19%	0.194	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	121	175.5	169.5	77.1	0	0	0	108.1	W60 L79 M105 D106 L107	W60-L82 HydrophobicContact CD2-CD1 4.24Å; W60-L82 HydrophobicContact CD2-CD2 3.74Å; W60-L82 VanDerWaalsContact CE2-CD2 3.45Å; W60-L82 HydrophobicContact CE3-CD1 4.44Å; W60-L82 HydrophobicContact CG-CD2 3.61Å; W60-L82 HydrophobicContact CZ2-CD1 4.47Å; W60-L82 HydrophobicContact CZ2-CD2 4.2Å; L79-L82 HydrophobicContact CD1-CB 4.37Å; L79-L82 HydrophobicContact CD2-CB 3.71Å; L79-L82 HydrophobicContact CG-CB 4.49Å; L82-M105 HydrophobicContact CD1-CG 4.13Å; L82-M105 HydrophobicContact CD1-SD 4.27Å; L82-D106 WeakPolarHBondContact CA-O 3.21Å; L82-L107 HydrophobicContact CD1-CD2 3.35Å; L82-L107 HydrophobicContact CD1-CG 4.24Å
83	R	85.8	Confident	81.4	Confident	140 Å²	140	63.6 Å²	63.6	53%	0.528	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	120.4	161	-173.3	175.1	-67.4	176	-8.7	108.5	D106	R83-D106 HydrophobicContact CB-CB 3.72Å; R83-D106 WeakPolarHBondContact CD-OD2 3.08Å; R83-D106 IonicContact CZ-OD2 2.97Å; R83-D106 PolarHBondContact N-O 3.21Å; R83-D106 IonicContact NE-OD2 3.72Å; R83-D106 PolarHBondContact NE-OD2 3.4Å; R83-D106 IonicContact NH1-OD2 2.64Å; R83-D106 PolarHBondContact NH1-OD2 3.33Å; R83-D106 IonicContact NH2-OD2 2.76Å; R83-D106 PolarHBondContact O-N 2.83Å
84	P	79.6	Confident	81.9	Confident	80 Å²	80	62.9 Å²	62.9	52%	0.519	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-62.5	147.1	-179.9	26.7	-34.3	0	0	0	110.5
85	P	82.8	Confident	82.2	Confident	19 Å²	19	68 Å²	68	12%	0.123	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-62.9	146.3	177.1	23.8	-30.8	0	0	0	111.3	F55 L102 S103 M105	F55-P85 HydrophobicContact CB-CG 4.04Å; F55-P85 HydrophobicContact CD1-CG 3.36Å; F55-P85 HydrophobicContact CD2-CG 4.29Å; F55-P85 HydrophobicContact CE1-CG 3.86Å; F55-P85 HydrophobicContact CG-CG 3.64Å; P85-L102 HydrophobicContact CB-CB 4.08Å; P85-L102 HydrophobicContact CB-CD1 4.47Å; P85-L102 HydrophobicContact CG-CD1 4.48Å; P85-S103 CarbonylContact C-O 3.48Å; P85-S103 WeakPolarHBondContact CA-O 3.23Å; P85-M105 HydrophobicContact CB-CB 4.11Å
86	R	81.9	Confident	82.8	Confident	168 Å²	168	67.7 Å²	67.7	63%	0.634	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	132.3	161	-177.3	177.8	177.7	160.9	-1	108.3	D88 L102 S103 H104	R86-D88 PolarHBondContact O-N 3.1Å; R86-L102 CarbonylContact O-C 3.57Å; R86-L102 WeakPolarHBondContact O-CA 3.48Å; R86-S103 PolarHBondContact N-O 3.4Å; R86-S103 PolarHBondContact O-N 3.34Å; R86-H104 HydrophobicContact CB-CB 4.32Å
87	F	79.6	Confident	83.3	Confident	33 Å²	33	69.1 Å²	69.1	15%	0.145	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	113.4	171	-162.6	-73.7	0	0	0	108.9	F47 R48 L51 D89 F90 F100 L102	F47-F87 HydrophobicContact CD1-CE2 4.3Å; F47-F87 HydrophobicContact CD1-CZ 4.13Å; F47-F87 HydrophobicContact CE1-CE2 4.19Å; F47-F87 HydrophobicContact CE1-CZ 4.2Å; R48-F87 HydrophobicContact CB-CD1 4.44Å; R48-F87 HydrophobicContact CB-CG 4.46Å; R48-F87 HydrophobicContact CG-CD1 3.4Å; R48-F87 HydrophobicContact CG-CD2 4.31Å; R48-F87 HydrophobicContact CG-CE1 3.39Å; R48-F87 HydrophobicContact CG-CE2 4.43Å; R48-F87 HydrophobicContact CG-CG 3.84Å; R48-F87 HydrophobicContact CG-CZ 3.98Å; R48-F87 VanDerWaalsContact CZ-CE1 3.49Å; R48-F87 VanDerWaalsContact NH1-CD1 3.25Å; L51-F87 HydrophobicContact CB-CD2 4.44Å; L51-F87 HydrophobicContact CD1-CD2 4.02Å; L51-F87 HydrophobicContact CD1-CE2 3.43Å; L51-F87 VanDerWaalsContact CD1-CE2 3.43Å; L51-F87 HydrophobicContact CD1-CZ 4.44Å; F87-D89 WeakPolarHBondContact CE1-O 3.25Å; F87-D89 VanDerWaalsContact CZ-O 3.23Å; F87-D89 WeakPolarHBondContact CZ-O 3.39Å; F87-F90 HydrophobicContact CE1-CB 3.65Å; F87-F90 HydrophobicContact CZ-CB 3.69Å; F87-F90 HydrophobicContact CZ-CD2 4.44Å; F87-F100 HydrophobicContact CE2-CB 4.38Å; F87-F100 HydrophobicContact CZ-CB 3.93Å; F87-L102 HydrophobicContact CB-CD2 4.11Å; F87-L102 HydrophobicContact CD2-CD2 3.18Å; F87-L102 HydrophobicContact CE2-CD2 3.68Å; F87-L102 HydrophobicContact CG-CD2 3.86Å
88	D	83.4	Confident	83.6	Confident	63 Å²	63	70.5 Å²	70.5	34%	0.337	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-54.7	-178.3	-64.9	-35.1	0	0	0	110.2	R48 R86 S101 S103	R48-D88 PolarHBondContact NH1-O 3.29Å; R86-D88 PolarHBondContact O-N 3.1Å; D88-S101 PolarHBondContact N-O 3.08Å; D88-S103 PolarHBondContact OD1-OG 3.46Å; D88-S103 WeakPolarHBondContact OD2-CB 3.27Å; D88-S103 PolarHBondContact OD2-N 2.97Å; D88-S103 PolarHBondContact OD2-OG 2.84Å
89	D	84	Confident	84	Confident	38 Å²	38	67.3 Å²	67.3	20%	0.203	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	146.9	-168.5	-145.8	0.5	0	0	0	114.6	R48 F87 K91 Y99 F100 S101	R48-D89 IonicContact NH2-OD1 2.79Å; R48-D89 PolarHBondContact NH2-OD1 2.74Å; F87-D89 WeakPolarHBondContact CE1-O 3.25Å; F87-D89 VanDerWaalsContact CZ-O 3.23Å; F87-D89 WeakPolarHBondContact CZ-O 3.39Å; D89-K91 VanDerWaalsContact OD2-CD 3.28Å; D89-K91 WeakPolarHBondContact OD2-CD 3.18Å; D89-K91 WeakPolarHBondContact OD2-CE 3.2Å; D89-K91 IonicContact OD2-NZ 3.89Å; D89-K91 PolarHBondContact OD2-NZ 2.99Å; D89-Y99 HydrophobicContact CB-CE1 4.4Å; D89-F100 CarbonylContact O-C 3.5Å; D89-F100 WeakPolarHBondContact O-CA 3.4Å; D89-S101 WeakPolarHBondContact CB-OG 3.46Å; D89-S101 PolarHBondContact N-O 3.23Å; D89-S101 PolarHBondContact N-OG 3.38Å; D89-S101 PolarHBondContact O-N 2.77Å
90	F	85.7	Confident	84.3	Confident	22 Å²	22	66.3 Å²	66.3	10%	0.096	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	121.1	170.8	179.8	-91.7	0	0	0	104.8	E44 F47 F87 I92 Y99 F100	E44-F90 HydrophobicContact CB-CD1 3.77Å; E44-F90 HydrophobicContact CB-CE1 4.46Å; E44-F90 HydrophobicContact CB-CG 4.48Å; E44-F90 HydrophobicContact CG-CD1 3.5Å; E44-F90 VanDerWaalsContact CG-CD1 3.5Å; E44-F90 HydrophobicContact CG-CE1 3.97Å; F47-F90 AromaticContact CD1-CD2 3.37Å; F47-F90 HydrophobicContact CD1-CD2 3.37Å; F47-F90 AromaticContact CD1-CE2 3.65Å; F47-F90 HydrophobicContact CD1-CE2 3.65Å; F47-F90 HydrophobicContact CD1-CG 4.11Å; F47-F90 AromaticContact CE1-CD2 3.45Å; F47-F90 HydrophobicContact CE1-CD2 3.45Å; F47-F90 VanDerWaalsContact CE1-CD2 3.45Å; F47-F90 AromaticContact CE1-CE2 3.64Å; F47-F90 HydrophobicContact CE1-CE2 3.64Å; F47-F90 HydrophobicContact CG-CD2 4.27Å; F47-F90 HydrophobicContact CG-CE2 4.19Å; F47-F90 HydrophobicContact CZ-CD2 4.42Å; F47-F90 HydrophobicContact CZ-CE2 4.2Å; F87-F90 HydrophobicContact CE1-CB 3.65Å; F87-F90 HydrophobicContact CZ-CB 3.69Å; F87-F90 HydrophobicContact CZ-CD2 4.44Å; F90-I92 HydrophobicContact CE1-CG1 4.12Å; F90-Y99 CarbonylContact C-O 3.59Å; F90-Y99 VanDerWaalsContact CA-O 3.29Å; F90-Y99 WeakPolarHBondContact CA-O 3.44Å; F90-F100 HydrophobicContact CD2-CB 3.95Å
91	K	85.4	Confident	84.5	Confident	80 Å²	80	62.1 Å²	62.1	35%	0.348	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	139	-176.8	-74.3	175.4	168.8	152.1	0	110.2	D89 L93 Y99	D89-K91 VanDerWaalsContact OD2-CD 3.28Å; D89-K91 WeakPolarHBondContact OD2-CD 3.18Å; D89-K91 WeakPolarHBondContact OD2-CE 3.2Å; D89-K91 IonicContact OD2-NZ 3.89Å; D89-K91 PolarHBondContact OD2-NZ 2.99Å; K91-L93 HydrophobicContact CB-CD2 4.09Å; K91-Y99 PolarHBondContact N-O 3.17Å; K91-Y99 PolarHBondContact O-N 3.19Å
92	I	83.9	Confident	84.6	Confident	12 Å²	12	58 Å²	58	6%	0.062	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	105.3	165.2	-54.9	-172.8	0	0	0	107.1	V40 F90 L98 L263 E265 V268	V40-I92 HydrophobicContact CG1-CD1 3.63Å; V40-I92 HydrophobicContact CG1-CG1 4.26Å; V40-I92 HydrophobicContact CG2-CD1 4.3Å; F90-I92 HydrophobicContact CE1-CG1 4.12Å; I92-L98 HydrophobicContact CB-CD2 4.39Å; I92-L98 HydrophobicContact CG1-CD2 3.94Å; I92-L98 HydrophobicContact CG2-CD2 4.18Å; I92-L263 HydrophobicContact CG2-CB 3.66Å; I92-L263 HydrophobicContact CG2-CD2 4.2Å; I92-L263 HydrophobicContact CG2-CG 4.41Å; I92-E265 WeakPolarHBondContact O-CG 3.31Å; I92-E265 PolarHBondContact O-N 2.69Å; I92-V268 HydrophobicContact CD1-CG2 3.48Å; I92-V268 VanDerWaalsContact CD1-CG2 3.48Å; I92-V268 HydrophobicContact CG2-CG2 4.48Å
93	L	83.4	Confident	84.9	Confident	52 Å²	52	56.8 Å²	56.8	27%	0.272	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	154.3	-179.8	-61	179.8	0	0	0	110.4	K91 R97 Y99	K91-L93 HydrophobicContact CB-CD2 4.09Å; L93-R97 HydrophobicContact CB-CB 3.98Å; L93-R97 PolarHBondContact N-O 3.22Å; L93-Y99 HydrophobicContact CD1-CG 4.45Å
94	P	77.5	Confident	85	Confident	68 Å²	68	55 Å²	55	44%	0.442	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	162.5	168.1	-22.9	33.7	0	0	0	112.2	S96	P94-S96 VanDerWaalsContact C-N 3.34Å
95	F	76.6	Confident	85.4	Confident	182 Å²	182	51.6 Å²	51.6	80%	0.798	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.4	36	-179.6	-46.1	-75	0	0	0	114.2	R97	F95-R97 PolarHBondContact O-N 3.16Å
96	S	84.8	Confident	85.6	Confident	24 Å²	24	51.2 Å²	51.2	17%	0.168	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	42.8	170.9	-55.4	0	0	0	0	113.2	P94 V142 P261	P94-S96 VanDerWaalsContact C-N 3.34Å; S96-V142 WeakPolarHBondContact CB-O 3.43Å; S96-V142 VanDerWaalsContact O-CB 3.26Å; S96-V142 WeakPolarHBondContact O-CB 3.32Å; S96-V142 WeakPolarHBondContact O-CG2 3.4Å; S96-V142 PolarHBondContact O-N 3.25Å; S96-P261 PolarHBondContact OG-O 3.26Å
97	R	88.4	Confident	85.9	Confident	88 Å²	88	43.3 Å²	43.3	33%	0.332	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	138.6	178.3	-70.9	178.9	179.6	-152	-12.3	111.5	L93 F95 I140 D156	L93-R97 HydrophobicContact CB-CB 3.98Å; L93-R97 PolarHBondContact N-O 3.22Å; F95-R97 PolarHBondContact O-N 3.16Å; R97-I140 CarbonylContact C-O 3.45Å; R97-I140 VanDerWaalsContact CA-O 3.27Å; R97-I140 WeakPolarHBondContact CA-O 3.3Å; R97-D156 IonicContact CZ-OD2 3.02Å; R97-D156 IonicContact NE-OD2 2.93Å; R97-D156 IonicContact NH1-OD2 3.66Å; R97-D156 PolarHBondContact NH1-OD2 3Å; R97-D156 IonicContact NH2-OD2 3.75Å; R97-D156 PolarHBondContact NH2-OD2 2.88Å
98	L	89.8	Confident	86.4	Confident	32 Å²	32	43 Å²	43	17%	0.168	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.7	169.5	-52.5	173.4	0	0	0	108	I92 S139 I140 V142	I92-L98 HydrophobicContact CB-CD2 4.39Å; I92-L98 HydrophobicContact CG1-CD2 3.94Å; I92-L98 HydrophobicContact CG2-CD2 4.18Å; L98-S139 CarbonylContact O-C 3.45Å; L98-S139 WeakPolarHBondContact O-CA 3.33Å; L98-I140 HydrophobicContact CB-CB 4.21Å; L98-I140 PolarHBondContact N-O 2.83Å; L98-I140 PolarHBondContact O-N 2.96Å; L98-V142 HydrophobicContact CD1-CG2 4.16Å; L98-V142 HydrophobicContact CG-CG2 3.98Å
99	Y	90.6	Very high	86.6	Confident	51 Å²	51	40 Å²	40	20%	0.2	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136.2	178.2	172.3	-94.2	0	0	0	109.5	D89 F90 K91 L93 E137 V138	D89-Y99 HydrophobicContact CB-CE1 4.4Å; F90-Y99 CarbonylContact C-O 3.59Å; F90-Y99 VanDerWaalsContact CA-O 3.29Å; F90-Y99 WeakPolarHBondContact CA-O 3.44Å; K91-Y99 PolarHBondContact N-O 3.17Å; K91-Y99 PolarHBondContact O-N 3.19Å; L93-Y99 HydrophobicContact CD1-CG 4.45Å; Y99-E137 HydrophobicContact CE2-CB 4.11Å; Y99-V138 WeakPolarHBondContact CA-O 2.92Å
100	F	90.3	Very high	86.7	Confident	12 Å²	12	40.5 Å²	40.5	5%	0.053	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	150.1	165.9	72	-92.6	0	0	0	112.1	F47 F87 D89 F90 L102 L136 V138 I140 M202	F47-F100 HydrophobicContact CE1-CB 4.41Å; F47-F100 HydrophobicContact CE1-CG 4.42Å; F87-F100 HydrophobicContact CE2-CB 4.38Å; F87-F100 HydrophobicContact CZ-CB 3.93Å; D89-F100 CarbonylContact O-C 3.5Å; D89-F100 WeakPolarHBondContact O-CA 3.4Å; F90-F100 HydrophobicContact CD2-CB 3.95Å; F100-L102 HydrophobicContact CD2-CG 4.41Å; F100-L136 HydrophobicContact CE2-CD2 4.4Å; F100-V138 HydrophobicContact CD1-CB 4.03Å; F100-V138 HydrophobicContact CD1-CG1 4.45Å; F100-V138 HydrophobicContact CE1-CB 3.52Å; F100-V138 HydrophobicContact CE1-CG1 3.69Å; F100-V138 HydrophobicContact CE1-CG2 4.1Å; F100-V138 HydrophobicContact CE2-CB 4.04Å; F100-V138 HydrophobicContact CE2-CG2 3.87Å; F100-V138 HydrophobicContact CZ-CB 3.53Å; F100-V138 HydrophobicContact CZ-CG1 3.95Å; F100-V138 HydrophobicContact CZ-CG2 3.55Å; F100-V138 PolarHBondContact N-O 3.48Å; F100-V138 PolarHBondContact O-N 3.04Å; F100-I140 HydrophobicContact CD1-CD1 4.46Å; F100-I140 HydrophobicContact CE1-CD1 4.08Å; F100-M202 HydrophobicContact CZ-SD 4.35Å
101	S	90.9	Very high	86.6	Confident	10 Å²	10	39.5 Å²	39.5	7%	0.07	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	139.2	177.8	62.9	0	0	0	0	112.9	D88 D89 L136	D88-S101 PolarHBondContact N-O 3.08Å; D89-S101 WeakPolarHBondContact CB-OG 3.46Å; D89-S101 PolarHBondContact N-O 3.23Å; D89-S101 PolarHBondContact N-OG 3.38Å; D89-S101 PolarHBondContact O-N 2.77Å; S101-L136 CarbonylContact C-O 3.55Å; S101-L136 VanDerWaalsContact CA-O 3.25Å; S101-L136 WeakPolarHBondContact CA-O 3.33Å
102	L	89.1	Confident	86.5	Confident	6 Å²	6	37.7 Å²	37.7	3%	0.031	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	143.2	175.7	-54.4	178.3	0	0	0	108.3	F55 P85 R86 F87 F100 S135 L136	F55-L102 HydrophobicContact CD2-CD1 4.38Å; F55-L102 HydrophobicContact CE1-CD1 3.92Å; F55-L102 HydrophobicContact CE2-CD1 3.43Å; F55-L102 VanDerWaalsContact CE2-CD1 3.43Å; F55-L102 HydrophobicContact CZ-CD1 3.16Å; P85-L102 HydrophobicContact CB-CB 4.08Å; P85-L102 HydrophobicContact CB-CD1 4.47Å; P85-L102 HydrophobicContact CG-CD1 4.48Å; R86-L102 CarbonylContact O-C 3.57Å; R86-L102 WeakPolarHBondContact O-CA 3.48Å; F87-L102 HydrophobicContact CB-CD2 4.11Å; F87-L102 HydrophobicContact CD2-CD2 3.18Å; F87-L102 HydrophobicContact CE2-CD2 3.68Å; F87-L102 HydrophobicContact CG-CD2 3.86Å; F100-L102 HydrophobicContact CD2-CG 4.41Å; L102-S135 CarbonylContact O-C 3.54Å; L102-S135 WeakPolarHBondContact O-CA 3.1Å; L102-S135 WeakPolarHBondContact O-CB 3.32Å; L102-L136 HydrophobicContact CB-CB 4.36Å; L102-L136 HydrophobicContact CD1-CD2 4.11Å; L102-L136 PolarHBondContact N-O 3.5Å; L102-L136 PolarHBondContact O-N 3.36Å
103	S	90.1	Very high	86	Confident	12 Å²	12	38.8 Å²	38.8	8%	0.084	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	-178.9	174.6	69.4	0	0	0	0	112.8	P85 R86 D88 M105 L134	P85-S103 CarbonylContact C-O 3.48Å; P85-S103 WeakPolarHBondContact CA-O 3.23Å; R86-S103 PolarHBondContact N-O 3.4Å; R86-S103 PolarHBondContact O-N 3.34Å; D88-S103 PolarHBondContact OD1-OG 3.46Å; D88-S103 WeakPolarHBondContact OD2-CB 3.27Å; D88-S103 PolarHBondContact OD2-N 2.97Å; D88-S103 PolarHBondContact OD2-OG 2.84Å; S103-M105 PolarHBondContact O-N 3.38Å; S103-M105 VanDerWaalsContact O-N 3.13Å; S103-L134 CarbonylContact C-O 3.54Å
104	H	88.2	Confident	85.3	Confident	104 Å²	104	43.5 Å²	43.5	48%	0.481	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	58.2	25.7	177.2	-57.6	87.3	0	0	0	114.1	R86 L134	R86-H104 HydrophobicContact CB-CB 4.32Å; H104-L134 PolarHBondContact N-O 2.94Å
105	M	86.2	Confident	84.7	Confident	7 Å²	7	45.4 Å²	45.4	3%	0.034	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	127.9	168.9	178	165	54.9	0	0	109.1	W60 L82 P85 S103 L107 S133 L134	W60-M105 HydrophobicContact CH2-SD 3.68Å; W60-M105 HydrophobicContact CZ2-SD 4.39Å; W60-M105 HydrophobicContact CZ3-SD 4.16Å; L82-M105 HydrophobicContact CD1-CG 4.13Å; L82-M105 HydrophobicContact CD1-SD 4.27Å; P85-M105 HydrophobicContact CB-CB 4.11Å; S103-M105 PolarHBondContact O-N 3.38Å; S103-M105 VanDerWaalsContact O-N 3.13Å; M105-L107 HydrophobicContact CG-CG 4.46Å; M105-S133 PolarHBondContact O-N 3.13Å; M105-L134 HydrophobicContact CB-CB 4.14Å; M105-L134 HydrophobicContact CE-CB 4.3Å; M105-L134 HydrophobicContact CE-CD1 3.87Å; M105-L134 HydrophobicContact CE-CD2 3.21Å; M105-L134 HydrophobicContact CE-CG 3.95Å; M105-L134 PolarHBondContact N-O 2.93Å; M105-L134 VanDerWaalsContact N-O 3.16Å; M105-L134 VanDerWaalsContact O-CB 3.27Å; M105-L134 WeakPolarHBondContact O-CB 3.49Å; M105-L134 PolarHBondContact O-N 3.2Å
106	D	88.8	Confident	84	Confident	11 Å²	11	43 Å²	43	6%	0.059	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133.4	174.1	-59.4	-31.8	0	0	0	108.6	L82 R83 L131 K132 S133	L82-D106 WeakPolarHBondContact CA-O 3.21Å; R83-D106 HydrophobicContact CB-CB 3.72Å; R83-D106 WeakPolarHBondContact CD-OD2 3.08Å; R83-D106 IonicContact CZ-OD2 2.97Å; R83-D106 PolarHBondContact N-O 3.21Å; R83-D106 IonicContact NE-OD2 3.72Å; R83-D106 PolarHBondContact NE-OD2 3.4Å; R83-D106 IonicContact NH1-OD2 2.64Å; R83-D106 PolarHBondContact NH1-OD2 3.33Å; R83-D106 IonicContact NH2-OD2 2.76Å; R83-D106 PolarHBondContact O-N 2.83Å; D106-L131 CarbonylContact C-O 3.59Å; D106-L131 WeakPolarHBondContact CA-O 3.46Å; D106-K132 HydrophobicContact CB-CG 4.49Å; D106-K132 WeakPolarHBondContact OD1-CA 3.34Å; D106-S133 PolarHBondContact OD1-N 2.9Å
107	L	87.3	Confident	82.6	Confident	3 Å²	3	47.6 Å²	47.6	2%	0.016	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	126.6	178.4	-68.3	163.5	0	0	0	109	W60 L79 L82 M105 I109 A130 L131 L134	W60-L107 HydrophobicContact CE3-CD2 4.18Å; W60-L107 HydrophobicContact CZ3-CD2 4.4Å; L79-L107 HydrophobicContact CD1-CD2 3.83Å; L82-L107 HydrophobicContact CD1-CD2 3.35Å; L82-L107 HydrophobicContact CD1-CG 4.24Å; M105-L107 HydrophobicContact CG-CG 4.46Å; L107-I109 HydrophobicContact CB-CG1 4.49Å; L107-A130 CarbonylContact O-C 3.57Å; L107-A130 WeakPolarHBondContact O-CA 3.47Å; L107-L131 HydrophobicContact CB-CB 4.27Å; L107-L131 HydrophobicContact CB-CD1 4.49Å; L107-L131 HydrophobicContact CD1-CD1 4.29Å; L107-L131 PolarHBondContact N-O 2.97Å; L107-L131 PolarHBondContact O-N 3.49Å; L107-L134 HydrophobicContact CD1-CD1 4.08Å
108	V	89.2	Confident	80.9	Confident	26 Å²	26	47.8 Å²	47.8	16%	0.158	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	119.1	167.9	-172.9	0	0	0	0	108.1	I80 D81 L128 A129 A130	I80-V108 HydrophobicContact CB-CB 4.34Å; I80-V108 HydrophobicContact CB-CG1 4.09Å; I80-V108 HydrophobicContact CD1-CG1 4.34Å; I80-V108 HydrophobicContact CG2-CG1 4.34Å; I80-V108 PolarHBondContact N-O 2.81Å; D81-V108 HydrophobicContact CB-CB 3.92Å; D81-V108 HydrophobicContact CB-CG2 3.99Å; D81-V108 PolarHBondContact N-O 3.5Å; D81-V108 PolarHBondContact O-N 2.56Å; V108-L128 HydrophobicContact CG1-CD1 3.69Å; V108-L128 HydrophobicContact CG1-CG 4.21Å; V108-A129 CarbonylContact C-O 3.53Å; V108-A129 WeakPolarHBondContact CA-O 3.43Å; V108-A130 HydrophobicContact CG2-CB 4.41Å
109	I	88.1	Confident	79.2	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	133.7	-172.7	-56.6	167.6	0	0	0	108.4	V64 L68 A77 R78 L107 L111 L128 A129 L131	V64-I109 HydrophobicContact CG1-CB 4.29Å; V64-I109 HydrophobicContact CG1-CD1 3.92Å; V64-I109 HydrophobicContact CG1-CG1 3.88Å; V64-I109 HydrophobicContact CG1-CG2 3.48Å; V64-I109 VanDerWaalsContact CG1-CG2 3.48Å; V64-I109 HydrophobicContact CG2-CD1 4.16Å; V64-I109 HydrophobicContact CG2-CG1 4.19Å; L68-I109 HydrophobicContact CD1-CD1 4.38Å; L68-I109 HydrophobicContact CD1-CG2 4Å; A77-I109 HydrophobicContact CB-CG2 4.07Å; R78-I109 CarbonylContact O-C 3.53Å; R78-I109 WeakPolarHBondContact O-CA 3.34Å; L107-I109 HydrophobicContact CB-CG1 4.49Å; I109-L111 HydrophobicContact CG2-CD2 3.58Å; I109-L111 HydrophobicContact CG2-CG 4.34Å; I109-L128 CarbonylContact O-C 3.48Å; I109-A129 HydrophobicContact CB-CB 4.37Å; I109-A129 PolarHBondContact N-O 3.31Å; I109-A129 PolarHBondContact O-N 2.92Å; I109-L131 HydrophobicContact CD1-CD1 4.39Å
110	F	86.7	Confident	77.6	Confident	48 Å²	48	54.7 Å²	54.7	21%	0.211	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	131.1	166.4	-166.9	-113.1	0	0	0	109.6	A77 R78 I80 E112 V127 I170	A77-F110 CarbonylContact C-O 3.54Å; A77-F110 VanDerWaalsContact CA-O 3.29Å; A77-F110 WeakPolarHBondContact CA-O 3.3Å; R78-F110 HydrophobicContact CB-CB 4.39Å; R78-F110 PolarHBondContact N-O 2.97Å; R78-F110 PolarHBondContact O-N 2.88Å; I80-F110 HydrophobicContact CD1-CB 3.56Å; I80-F110 HydrophobicContact CD1-CD2 4.15Å; I80-F110 HydrophobicContact CD1-CG 4.23Å; I80-F110 HydrophobicContact CG1-CB 3.91Å; F110-E112 HydrophobicContact CD1-CB 4.41Å; F110-E112 HydrophobicContact CE1-CB 3.96Å; F110-V127 CarbonylContact C-O 3.57Å; F110-I170 HydrophobicContact CE2-CD1 4.03Å
111	L	83	Confident	75.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.5	174.3	-47.6	175.3	0	0	0	108.5	L68 L75 E76 A77 I109 S126 V127	L68-L111 HydrophobicContact CD1-CD1 4.49Å; L68-L111 HydrophobicContact CD1-CD2 3.26Å; L68-L111 HydrophobicContact CD1-CG 4.47Å; L75-L111 HydrophobicContact CB-CB 4.35Å; L75-L111 HydrophobicContact CD1-CB 4.04Å; L75-L111 HydrophobicContact CD1-CD1 4.04Å; E76-L111 CarbonylContact O-C 3.5Å; E76-L111 VanDerWaalsContact O-CA 3.29Å; E76-L111 WeakPolarHBondContact O-CA 3.06Å; A77-L111 HydrophobicContact CB-CD2 3.55Å; I109-L111 HydrophobicContact CG2-CD2 3.58Å; I109-L111 HydrophobicContact CG2-CG 4.34Å; L111-S126 CarbonylContact O-C 3.42Å; L111-S126 VanDerWaalsContact O-CA 3.26Å; L111-S126 WeakPolarHBondContact O-CA 3.11Å; L111-V127 HydrophobicContact CB-CB 4.07Å; L111-V127 HydrophobicContact CD1-CB 4.2Å; L111-V127 HydrophobicContact CD1-CG1 4.47Å; L111-V127 HydrophobicContact CG-CB 4.4Å; L111-V127 PolarHBondContact N-O 3.28Å; L111-V127 PolarHBondContact O-N 3.34Å
112	E	83	Confident	74.2	Confident	43 Å²	43	67.9 Å²	67.9	20%	0.201	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	156	176.4	67.4	-169.8	165.2	0	0	109.9	L75 E76 R78 F110 R114	L75-E112 CarbonylContact C-O 3.58Å; L75-E112 WeakPolarHBondContact CA-O 3.43Å; E76-E112 HydrophobicContact CB-CG 3.83Å; E76-E112 HydrophobicContact CG-CG 4.39Å; E76-E112 PolarHBondContact N-O 2.99Å; E76-E112 PolarHBondContact O-N 3.47Å; R78-E112 IonicContact CZ-OE1 3.81Å; R78-E112 IonicContact CZ-OE2 3.01Å; R78-E112 IonicContact NE-OE1 3.42Å; R78-E112 PolarHBondContact NE-OE1 2.8Å; R78-E112 IonicContact NH2-OE1 3.05Å; R78-E112 PolarHBondContact NH2-OE1 3.38Å; R78-E112 IonicContact NH2-OE2 2.69Å; F110-E112 HydrophobicContact CD1-CB 4.41Å; F110-E112 HydrophobicContact CE1-CB 3.96Å; E112-R114 PolarHBondContact O-N 3.25Å
113	E	74.8	Confident	72.9	Confident	34 Å²	34	71.7 Å²	71.7	16%	0.159	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	123.4	179	-167.1	-174	165.4	0	0	111.7	L117	E113-L117 WeakPolarHBondContact OE1-CB 3.42Å; E113-L117 PolarHBondContact OE1-N 2.82Å
114	R	68.1	Low	71.8	Confident	151 Å²	151	72.3 Å²	72.3	57%	0.57	37%	0.365	S	S	*	.	S	Bend	trans	-70.1	-40.6	-175.5	-173.6	178.1	-178.6	-176.6	0.1	113.6	L74 E112	L74-R114 WeakPolarHBondContact O-CB 3.27Å; L74-R114 PolarHBondContact O-N 3.01Å; E112-R114 PolarHBondContact O-N 3.25Å
115	L	64.9	Low	71.1	Confident	109 Å²	109	69.9 Å²	69.9	57%	0.571	36%	0.355	S	S	*	.	S	Bend	trans	-97.5	-0.3	-171.9	-78.9	159.8	0	0	0	113.5	L74 L117	L74-L115 HydrophobicContact CD2-CD1 3.94Å; L115-L117 HydrophobicContact CB-CD1 3.91Å; L115-L117 HydrophobicContact CB-CD2 4.3Å; L115-L117 HydrophobicContact CB-CG 3.63Å; L115-L117 HydrophobicContact CD1-CD1 4.11Å; L115-L117 PolarHBondContact O-N 3.37Å
116	Q	61.8	Low	70.9	Confident	131 Å²	131	70.3 Å²	70.3	61%	0.612	36%	0.359	S	S	*	.			trans	44.3	34.4	-176.4	-69.4	-173	0.2	0	0	111.9	L118 S119	Q116-L118 PolarHBondContact O-N 3.5Å; Q116-S119 VanDerWaalsContact O-CB 3.26Å; Q116-S119 WeakPolarHBondContact O-CB 3.37Å; Q116-S119 PolarHBondContact O-N 3.16Å; Q116-S119 PolarHBondContact O-OG 3.13Å
117	L	55.6	Low	70.6	Confident	120 Å²	120	70 Å²	70	63%	0.628	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-26.4	-172.2	-72.8	158.6	0	0	0	110.3	E113 L115	E113-L117 WeakPolarHBondContact OE1-CB 3.42Å; E113-L117 PolarHBondContact OE1-N 2.82Å; L115-L117 HydrophobicContact CB-CD1 3.91Å; L115-L117 HydrophobicContact CB-CD2 4.3Å; L115-L117 HydrophobicContact CB-CG 3.63Å; L115-L117 HydrophobicContact CD1-CD1 4.11Å; L115-L117 PolarHBondContact O-N 3.37Å
118	L	53.3	Low	70.6	Confident	92 Å²	92	72.2 Å²	72.2	48%	0.482	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-8.1	177.9	-64.4	166.2	0	0	0	114.1	Q116 L120 L121 R122	Q116-L118 PolarHBondContact O-N 3.5Å; L118-L120 VanDerWaalsContact C-N 3.29Å; L118-L120 PolarHBondContact O-N 3.47Å; L118-L121 PolarHBondContact O-N 3.49Å; L118-R122 CarbonylContact C-O 3.55Å; L118-R122 PolarHBondContact O-N 3.22Å; L118-R122 VanDerWaalsContact O-O 3.08Å
119	S	54.1	Low	70.5	Confident	63 Å²	63	71 Å²	71	44%	0.441	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-30	-172	62.1	0	0	0	0	114.4	Q116 L121 R122	Q116-S119 VanDerWaalsContact O-CB 3.26Å; Q116-S119 WeakPolarHBondContact O-CB 3.37Å; Q116-S119 PolarHBondContact O-N 3.16Å; Q116-S119 PolarHBondContact O-OG 3.13Å; S119-L121 PolarHBondContact O-N 3.18Å; S119-L121 VanDerWaalsContact O-N 3.11Å; S119-R122 WeakPolarHBondContact CA-O 3.41Å
120	L	55.4	Low	70.6	Confident	166 Å²	166	71.7 Å²	71.7	87%	0.869	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-18.8	178	-143	95.2	0	0	0	112	L118	L118-L120 VanDerWaalsContact C-N 3.29Å; L118-L120 PolarHBondContact O-N 3.47Å
121	L	54.8	Low	70.6	Confident	151 Å²	151	69.4 Å²	69.4	79%	0.791	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	-20.5	-175.4	-73.9	158.7	0	0	0	114.5	L118 S119	L118-L121 PolarHBondContact O-N 3.49Å; S119-L121 PolarHBondContact O-N 3.18Å; S119-L121 VanDerWaalsContact O-N 3.11Å
122	R	56.4	Low	71	Confident	147 Å²	147	72.9 Å²	72.9	56%	0.555	37%	0.372	S	S	*	.	S	Bend	trans	-170.1	158.2	-178.6	-104.7	163	-120.1	-167.4	-2.6	113.7	L118 S119 G124	L118-R122 CarbonylContact C-O 3.55Å; L118-R122 PolarHBondContact O-N 3.22Å; L118-R122 VanDerWaalsContact O-O 3.08Å; S119-R122 WeakPolarHBondContact CA-O 3.41Å; R122-G124 PolarHBondContact O-N 3.14Å
123	P	60	Low	71.3	Confident	87 Å²	87	73.4 Å²	73.4	57%	0.565	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-59	130	171.4	25	-32.5	0	0	0	110.3
124	G	68.5	Low	72	Confident	25 Å²	25	71.9 Å²	71.9	26%	0.258	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-58	152.9	-177.1	0	0	0	0	0	113.2	R122 S126	R122-G124 PolarHBondContact O-N 3.14Å; G124-S126 PolarHBondContact O-N 3.46Å
125	I	73.5	Confident	73.1	Confident	52 Å²	52	65.6 Å²	65.6	27%	0.267	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-68.4	130.5	177.7	-60.9	170.9	0	0	0	108.5	V127 F169 L179	I125-V127 HydrophobicContact CG2-CG2 4.35Å; I125-F169 HydrophobicContact CG2-CD1 4.38Å; I125-L179 HydrophobicContact CD1-CD1 4.36Å; I125-L179 HydrophobicContact CG2-CD1 4.19Å
126	S	80.9	Confident	74.4	Confident	17 Å²	17	60.6 Å²	60.6	12%	0.119	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	147	171.4	-57.5	0	0	0	0	110.6	L111 G124 I170	L111-S126 CarbonylContact O-C 3.42Å; L111-S126 VanDerWaalsContact O-CA 3.26Å; L111-S126 WeakPolarHBondContact O-CA 3.11Å; G124-S126 PolarHBondContact O-N 3.46Å; S126-I170 PolarHBondContact N-O 2.77Å; S126-I170 PolarHBondContact O-N 3.41Å
127	V	83.7	Confident	75.9	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.024	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	125.6	-178.5	-171	0	0	0	0	110.1	F110 L111 I125 L167 F169 M186	F110-V127 CarbonylContact C-O 3.57Å; L111-V127 HydrophobicContact CB-CB 4.07Å; L111-V127 HydrophobicContact CD1-CB 4.2Å; L111-V127 HydrophobicContact CD1-CG1 4.47Å; L111-V127 HydrophobicContact CG-CB 4.4Å; L111-V127 PolarHBondContact N-O 3.28Å; L111-V127 PolarHBondContact O-N 3.34Å; I125-V127 HydrophobicContact CG2-CG2 4.35Å; V127-L167 HydrophobicContact CG1-CB 4.14Å; V127-F169 HydrophobicContact CG1-CD1 4.36Å; V127-F169 HydrophobicContact CG1-CE1 4.42Å; V127-F169 HydrophobicContact CG2-CD1 3.6Å; V127-F169 HydrophobicContact CG2-CE1 3.82Å; V127-M186 HydrophobicContact CB-CE 4.4Å; V127-M186 HydrophobicContact CG1-CE 3.55Å; V127-M186 HydrophobicContact CG2-CE 4.13Å
128	L	86.9	Confident	77.6	Confident	49 Å²	49	52.5 Å²	52.5	26%	0.257	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	115.8	166.2	-174.4	78.5	0	0	0	109.1	I80 V108 I109 L167 K168 I170	I80-L128 HydrophobicContact CD1-CD1 3.18Å; V108-L128 HydrophobicContact CG1-CD1 3.69Å; V108-L128 HydrophobicContact CG1-CG 4.21Å; I109-L128 CarbonylContact O-C 3.48Å; L128-L167 CarbonylContact O-C 3.55Å; L128-L167 WeakPolarHBondContact O-CA 3.42Å; L128-K168 HydrophobicContact CB-CB 4.23Å; L128-K168 PolarHBondContact N-O 3.28Å; L128-K168 PolarHBondContact O-N 3.44Å; L128-I170 HydrophobicContact CB-CD1 4.35Å
129	A	87.5	Confident	79.5	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.008	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	116.6	176.1	0	0	0	0	0	110.8	V108 I109 R166 L167 L190	V108-A129 CarbonylContact C-O 3.53Å; V108-A129 WeakPolarHBondContact CA-O 3.43Å; I109-A129 HydrophobicContact CB-CB 4.37Å; I109-A129 PolarHBondContact N-O 3.31Å; I109-A129 PolarHBondContact O-N 2.92Å; A129-R166 WeakPolarHBondContact CA-O 3.02Å; A129-L167 HydrophobicContact CB-CD2 3.44Å; A129-L167 VanDerWaalsContact CB-CD2 3.44Å; A129-L190 HydrophobicContact CB-CD1 4.11Å
130	A	89.2	Confident	81.3	Confident	15 Å²	15	46.1 Å²	46.1	12%	0.124	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	118.7	172.8	0	0	0	0	0	109.6	L107 V108 W164 S165 R166	L107-A130 CarbonylContact O-C 3.57Å; L107-A130 WeakPolarHBondContact O-CA 3.47Å; V108-A130 HydrophobicContact CG2-CB 4.41Å; A130-W164 HydrophobicContact CB-CZ3 4.46Å; A130-S165 CarbonylContact O-C 3.55Å; A130-S165 VanDerWaalsContact O-CA 3.23Å; A130-S165 WeakPolarHBondContact O-CA 3.43Å; A130-R166 PolarHBondContact N-O 3.27Å; A130-R166 PolarHBondContact O-N 3.46Å
131	L	87.8	Confident	83.1	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	119.4	170.2	-52.9	174.8	0	0	0	107.4	M67 D106 L107 I109 I162	M67-L131 HydrophobicContact CE-CD1 4.14Å; D106-L131 CarbonylContact C-O 3.59Å; D106-L131 WeakPolarHBondContact CA-O 3.46Å; L107-L131 HydrophobicContact CB-CB 4.27Å; L107-L131 HydrophobicContact CB-CD1 4.49Å; L107-L131 HydrophobicContact CD1-CD1 4.29Å; L107-L131 PolarHBondContact N-O 2.97Å; L107-L131 PolarHBondContact O-N 3.49Å; I109-L131 HydrophobicContact CD1-CD1 4.39Å; L131-I162 HydrophobicContact CB-CG2 4.35Å; L131-I162 HydrophobicContact CD2-CG2 4.4Å
132	K	91	Very high	84.8	Confident	72 Å²	72	35.2 Å²	35.2	31%	0.313	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	151.5	-178.9	-65.8	-140.4	-166.9	172.5	0	112.7	D106 L134 G163 W164	D106-K132 HydrophobicContact CB-CG 4.49Å; D106-K132 WeakPolarHBondContact OD1-CA 3.34Å; K132-L134 VanDerWaalsContact C-N 3.3Å; K132-L134 PolarHBondContact O-N 2.79Å; K132-G163 PolarHBondContact O-N 3.31Å; K132-G163 VanDerWaalsContact O-N 3.14Å; K132-W164 HydrophobicContact CB-CD2 3.84Å; K132-W164 HydrophobicContact CB-CE3 4.38Å; K132-W164 HydrophobicContact CB-CG 4.22Å; K132-W164 HydrophobicContact CB-CH2 4.49Å; K132-W164 HydrophobicContact CB-CZ2 3.95Å; K132-W164 HydrophobicContact CD-CH2 3.65Å; K132-W164 HydrophobicContact CD-CZ2 3.18Å; K132-W164 HydrophobicContact CD-CZ3 4.45Å; K132-W164 HydrophobicContact CG-CD2 4.11Å; K132-W164 HydrophobicContact CG-CE3 4.27Å; K132-W164 HydrophobicContact CG-CH2 3.73Å; K132-W164 HydrophobicContact CG-CZ2 3.52Å; K132-W164 HydrophobicContact CG-CZ3 4.04Å; K132-W164 PolarHBondContact N-O 3.32Å; K132-W164 PolarHBondContact O-N 2.93Å
133	S	90	Very high	86.4	Confident	55 Å²	55	31.3 Å²	31.3	39%	0.385	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	54.2	48.3	-179.6	-56.2	0	0	0	0	111.3	M105 D106 S135 G163	M105-S133 PolarHBondContact O-N 3.13Å; D106-S133 PolarHBondContact OD1-N 2.9Å; S133-S135 PolarHBondContact O-N 2.86Å; S133-G163 PolarHBondContact O-N 2.86Å
134	L	89.5	Confident	87.8	Confident	1 Å²	1	29 Å²	29	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	128	171.1	-168.5	161.1	0	0	0	108.3	S103 H104 M105 L107 K132 V160 T161 I162 I198	S103-L134 CarbonylContact C-O 3.54Å; H104-L134 PolarHBondContact N-O 2.94Å; M105-L134 HydrophobicContact CB-CB 4.14Å; M105-L134 HydrophobicContact CE-CB 4.3Å; M105-L134 HydrophobicContact CE-CD1 3.87Å; M105-L134 HydrophobicContact CE-CD2 3.21Å; M105-L134 HydrophobicContact CE-CG 3.95Å; M105-L134 PolarHBondContact N-O 2.93Å; M105-L134 VanDerWaalsContact N-O 3.16Å; M105-L134 VanDerWaalsContact O-CB 3.27Å; M105-L134 WeakPolarHBondContact O-CB 3.49Å; M105-L134 PolarHBondContact O-N 3.2Å; L107-L134 HydrophobicContact CD1-CD1 4.08Å; K132-L134 VanDerWaalsContact C-N 3.3Å; K132-L134 PolarHBondContact O-N 2.79Å; L134-V160 HydrophobicContact CD1-CG1 4.3Å; L134-V160 HydrophobicContact CD2-CG1 3.83Å; L134-V160 HydrophobicContact CG-CG1 3.98Å; L134-T161 CarbonylContact C-O 3.53Å; L134-T161 WeakPolarHBondContact CA-O 3.33Å; L134-I162 HydrophobicContact CD1-CG1 4.19Å; L134-I162 HydrophobicContact CG-CG1 4.06Å; L134-I198 HydrophobicContact CD1-CD1 3.89Å; L134-I198 HydrophobicContact CD2-CD1 4.4Å
135	S	91.3	Very high	88.7	Confident	20 Å²	20	29.4 Å²	29.4	14%	0.14	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	144.2	170.4	62.6	0	0	0	0	110.7	L102 S133 V160 T161	L102-S135 CarbonylContact O-C 3.54Å; L102-S135 WeakPolarHBondContact O-CA 3.1Å; L102-S135 WeakPolarHBondContact O-CB 3.32Å; S133-S135 PolarHBondContact O-N 2.86Å; S135-V160 CarbonylContact O-C 3.58Å; S135-V160 VanDerWaalsContact O-CA 3.27Å; S135-V160 WeakPolarHBondContact O-CA 3.23Å; S135-T161 PolarHBondContact N-O 3.06Å; S135-T161 PolarHBondContact O-N 3.49Å; S135-T161 PolarHBondContact OG-OG1 3.47Å
136	L	90.9	Very high	89.2	Confident	4 Å²	4	30.4 Å²	30.4	2%	0.021	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	124.4	-179.8	169.1	66.7	0	0	0	107	F100 S101 L102 V138 N159 V160 I198 M202	F100-L136 HydrophobicContact CE2-CD2 4.4Å; S101-L136 CarbonylContact C-O 3.55Å; S101-L136 VanDerWaalsContact CA-O 3.25Å; S101-L136 WeakPolarHBondContact CA-O 3.33Å; L102-L136 HydrophobicContact CB-CB 4.36Å; L102-L136 HydrophobicContact CD1-CD2 4.11Å; L102-L136 PolarHBondContact N-O 3.5Å; L102-L136 PolarHBondContact O-N 3.36Å; L136-V138 HydrophobicContact CD1-CG2 3.63Å; L136-V138 HydrophobicContact CD2-CG2 4.12Å; L136-V138 HydrophobicContact CG-CG2 3.78Å; L136-N159 CarbonylContact C-O 3.51Å; L136-N159 WeakPolarHBondContact CA-O 3.29Å; L136-V160 HydrophobicContact CD1-CG2 3.61Å; L136-I198 HydrophobicContact CD1-CG2 3.91Å; L136-I198 HydrophobicContact CD2-CG2 4.08Å; L136-M202 HydrophobicContact CD2-CG 4.22Å; L136-M202 HydrophobicContact CD2-SD 4.28Å
137	E	93.1	Very high	89.4	Confident	80 Å²	80	37 Å²	37	37%	0.374	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.9	173	-60.4	-178.8	174.1	0	0	107.8	Y99 C158 N159	Y99-E137 HydrophobicContact CE2-CB 4.11Å; E137-C158 WeakPolarHBondContact O-CA 3.49Å; E137-N159 HydrophobicContact CB-CB 4.39Å; E137-N159 PolarHBondContact N-O 2.98Å; E137-N159 PolarHBondContact O-N 3.31Å
138	V	92.4	Very high	89.4	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	126.7	-177.9	-177.5	0	0	0	0	109.4	Y99 F100 L136 I140 M155 E157 M202 I206	Y99-V138 WeakPolarHBondContact CA-O 2.92Å; F100-V138 HydrophobicContact CD1-CB 4.03Å; F100-V138 HydrophobicContact CD1-CG1 4.45Å; F100-V138 HydrophobicContact CE1-CB 3.52Å; F100-V138 HydrophobicContact CE1-CG1 3.69Å; F100-V138 HydrophobicContact CE1-CG2 4.1Å; F100-V138 HydrophobicContact CE2-CB 4.04Å; F100-V138 HydrophobicContact CE2-CG2 3.87Å; F100-V138 HydrophobicContact CZ-CB 3.53Å; F100-V138 HydrophobicContact CZ-CG1 3.95Å; F100-V138 HydrophobicContact CZ-CG2 3.55Å; F100-V138 PolarHBondContact N-O 3.48Å; F100-V138 PolarHBondContact O-N 3.04Å; L136-V138 HydrophobicContact CD1-CG2 3.63Å; L136-V138 HydrophobicContact CD2-CG2 4.12Å; L136-V138 HydrophobicContact CG-CG2 3.78Å; V138-I140 HydrophobicContact CG1-CG1 4.03Å; V138-M155 HydrophobicContact CG1-CG 4.03Å; V138-M155 HydrophobicContact CG1-SD 4.4Å; V138-E157 CarbonylContact C-O 3.59Å; V138-E157 WeakPolarHBondContact CA-O 3.44Å; V138-M202 HydrophobicContact CG2-CG 4.39Å; V138-I206 HydrophobicContact CG1-CD1 3.88Å
139	S	93.2	Very high	89.5	Confident	11 Å²	11	41.3 Å²	41.3	8%	0.077	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	130.4	168.6	-175.6	0	0	0	0	108.7	L98 D156 E157	L98-S139 CarbonylContact O-C 3.45Å; L98-S139 WeakPolarHBondContact O-CA 3.33Å; S139-D156 PolarHBondContact O-N 3.05Å; S139-D156 PolarHBondContact OG-OD2 2.97Å; S139-E157 PolarHBondContact N-O 3Å; S139-E157 PolarHBondContact O-N 2.5Å
140	I	92.2	Very high	89.4	Confident	10 Å²	10	42.2 Å²	42.2	5%	0.051	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.3	177.7	-55.7	175.5	0	0	0	107.6	R97 L98 F100 V138 L153 V154 I206	R97-I140 CarbonylContact C-O 3.45Å; R97-I140 VanDerWaalsContact CA-O 3.27Å; R97-I140 WeakPolarHBondContact CA-O 3.3Å; L98-I140 HydrophobicContact CB-CB 4.21Å; L98-I140 PolarHBondContact N-O 2.83Å; L98-I140 PolarHBondContact O-N 2.96Å; F100-I140 HydrophobicContact CD1-CD1 4.46Å; F100-I140 HydrophobicContact CE1-CD1 4.08Å; V138-I140 HydrophobicContact CG1-CG1 4.03Å; I140-L153 HydrophobicContact CG2-CB 3.94Å; I140-L153 HydrophobicContact CG2-CD2 4.05Å; I140-L153 HydrophobicContact CG2-CG 4.44Å; I140-V154 CarbonylContact C-O 3.6Å; I140-V154 WeakPolarHBondContact CA-O 3.42Å; I140-I206 HydrophobicContact CD1-CD1 3.73Å; I140-I206 HydrophobicContact CD1-CG1 3.97Å; I140-I206 HydrophobicContact CD1-CG2 4.29Å; I140-I206 HydrophobicContact CG1-CD1 3.85Å; I140-I206 HydrophobicContact CG1-CG1 4.46Å; I140-I206 HydrophobicContact CG1-CG2 4.35Å; I140-I206 HydrophobicContact CG2-CG2 3.91Å
141	E	91.9	Very high	89.4	Confident	72 Å²	72	42.6 Å²	42.6	34%	0.336	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	134.5	170.4	-171.6	171.3	-161.5	0	0	110.5	I143 V154 D156	E141-I143 HydrophobicContact CG-CG1 3.98Å; E141-V154 PolarHBondContact N-O 2.9Å; E141-V154 PolarHBondContact O-N 2.84Å; E141-D156 HydrophobicContact CB-CB 4.22Å
142	V	91.2	Very high	89.5	Confident	17 Å²	17	43.5 Å²	43.5	10%	0.103	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	101.9	177.9	-175.6	0	0	0	0	107.8	S96 L98 V151 L153 L263	S96-V142 WeakPolarHBondContact CB-O 3.43Å; S96-V142 VanDerWaalsContact O-CB 3.26Å; S96-V142 WeakPolarHBondContact O-CB 3.32Å; S96-V142 WeakPolarHBondContact O-CG2 3.4Å; S96-V142 PolarHBondContact O-N 3.25Å; L98-V142 HydrophobicContact CD1-CG2 4.16Å; L98-V142 HydrophobicContact CG-CG2 3.98Å; V142-V151 HydrophobicContact CG1-CG1 3.23Å; V142-L153 HydrophobicContact CB-CD2 4.17Å; V142-L153 HydrophobicContact CG1-CD2 4.14Å; V142-L153 HydrophobicContact CG2-CD2 3.63Å; V142-L263 HydrophobicContact CB-CD1 3.9Å; V142-L263 HydrophobicContact CG1-CD1 4.1Å; V142-L263 HydrophobicContact CG2-CD1 3.62Å
143	I	90.2	Very high	89.5	Confident	64 Å²	64	41 Å²	41	33%	0.328	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	131.4	-174.5	-58.5	178.3	0	0	0	109.1	E141 V151 S152 V154	E141-I143 HydrophobicContact CG-CG1 3.98Å; I143-V151 CarbonylContact O-C 3.56Å; I143-V151 WeakPolarHBondContact O-CA 3.25Å; I143-S152 PolarHBondContact N-O 2.62Å; I143-S152 PolarHBondContact O-N 3.3Å; I143-S152 PolarHBondContact O-OG 2.7Å; I143-V154 HydrophobicContact CD1-CB 4.03Å; I143-V154 HydrophobicContact CD1-CG2 3.57Å; I143-V154 HydrophobicContact CG1-CG2 4.46Å
144	F	89.7	Confident	89.6	Confident	40 Å²	40	40.7 Å²	40.7	18%	0.175	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123.1	172.6	170.1	-112.8	0	0	0	109.9	D146 K149 T150 L257 A260	F144-D146 VanDerWaalsContact CE1-OD1 3.3Å; F144-D146 WeakPolarHBondContact CE1-OD1 3.46Å; F144-K149 HydrophobicContact CZ-CD 4.13Å; F144-T150 WeakPolarHBondContact CD2-O 3.48Å; F144-L257 HydrophobicContact CD2-CB 4.24Å; F144-L257 HydrophobicContact CD2-CD1 4.12Å; F144-L257 HydrophobicContact CE2-CB 3.56Å; F144-L257 HydrophobicContact CE2-CD1 4.23Å; F144-L257 HydrophobicContact CZ-CB 4.34Å; F144-A260 HydrophobicContact CB-CB 3.73Å; F144-A260 HydrophobicContact CD1-CB 4.04Å; F144-A260 HydrophobicContact CG-CB 4.03Å
145	S	87.6	Confident	89.8	Confident	32 Å²	32	42 Å²	42	22%	0.224	23%	0.226	C	C	.	.			trans	-91.1	114.9	176.1	171.2	0	0	0	0	110.2	D147 T148 K149 T150	S145-D147 PolarHBondContact O-N 2.94Å; S145-T148 WeakPolarHBondContact CB-OG1 3.05Å; S145-T148 PolarHBondContact OG-N 3.44Å; S145-T148 PolarHBondContact OG-OG1 2.98Å; S145-K149 VanDerWaalsContact O-CA 3.28Å; S145-K149 WeakPolarHBondContact O-CA 3.27Å; S145-K149 PolarHBondContact O-N 3.1Å; S145-T150 PolarHBondContact N-O 2.97Å
146	D	83.3	Confident	89.8	Confident	73 Å²	73	43.8 Å²	43.8	39%	0.39	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-25	178.1	-121.4	-2.6	0	0	0	112	K24 F144 K149	K24-D146 IonicContact NZ-OD2 3.43Å; K24-D146 PolarHBondContact NZ-OD2 3.17Å; F144-D146 VanDerWaalsContact CE1-OD1 3.3Å; F144-D146 WeakPolarHBondContact CE1-OD1 3.46Å; D146-K149 VanDerWaalsContact O-CD 3.27Å; D146-K149 WeakPolarHBondContact O-CD 3.29Å; D146-K149 WeakPolarHBondContact O-CE 3.42Å; D146-K149 PolarHBondContact O-NZ 3.07Å; D146-K149 IonicContact OD1-NZ 2.69Å; D146-K149 PolarHBondContact OD1-NZ 3.37Å
147	D	84.7	Confident	90	Very high	155 Å²	155	49.7 Å²	49.7	83%	0.829	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-47.3	-177.7	-65.6	-33.8	0	0	0	111.9	S145	S145-D147 PolarHBondContact O-N 2.94Å
148	T	84.4	Confident	90	Very high	76 Å²	76	47 Å²	47	47%	0.466	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-13.9	-178.2	58.9	0	0	0	0	112.8	S145 T150	S145-T148 WeakPolarHBondContact CB-OG1 3.05Å; S145-T148 PolarHBondContact OG-N 3.44Å; S145-T148 PolarHBondContact OG-OG1 2.98Å; T148-T150 WeakPolarHBondContact CB-OG1 3.3Å; T148-T150 PolarHBondContact O-N 2.82Å; T148-T150 PolarHBondContact OG1-OG1 2.81Å
149	K	87.6	Confident	90.1	Very high	68 Å²	68	50.3 Å²	50.3	30%	0.296	27%	0.27	S	S	.	.			trans	55.7	27.3	-172.6	-53.9	-52.2	-168.7	-167.6	0	113.3	F144 S145 D146 L257	F144-K149 HydrophobicContact CZ-CD 4.13Å; S145-K149 VanDerWaalsContact O-CA 3.28Å; S145-K149 WeakPolarHBondContact O-CA 3.27Å; S145-K149 PolarHBondContact O-N 3.1Å; D146-K149 VanDerWaalsContact O-CD 3.27Å; D146-K149 WeakPolarHBondContact O-CD 3.29Å; D146-K149 WeakPolarHBondContact O-CE 3.42Å; D146-K149 PolarHBondContact O-NZ 3.07Å; D146-K149 IonicContact OD1-NZ 2.69Å; D146-K149 PolarHBondContact OD1-NZ 3.37Å; K149-L257 WeakPolarHBondContact CD-O 3.42Å; K149-L257 WeakPolarHBondContact O-CB 3.35Å; K149-L257 PolarHBondContact O-N 3.41Å
150	T	86.7	Confident	89.9	Confident	20 Å²	20	50.1 Å²	50.1	12%	0.123	27%	0.268	C	S	.	.			trans	-114.1	172.9	177.5	60.5	0	0	0	0	111.1	F144 S145 T148	F144-T150 WeakPolarHBondContact CD2-O 3.48Å; S145-T150 PolarHBondContact N-O 2.97Å; T148-T150 WeakPolarHBondContact CB-OG1 3.3Å; T148-T150 PolarHBondContact O-N 2.82Å; T148-T150 PolarHBondContact OG1-OG1 2.81Å
151	V	89.1	Confident	89.8	Confident	24 Å²	24	52.6 Å²	52.6	15%	0.145	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	134.2	173.5	174	0	0	0	0	108.6	V142 I143 L214 L257 P261	V142-V151 HydrophobicContact CG1-CG1 3.23Å; I143-V151 CarbonylContact O-C 3.56Å; I143-V151 WeakPolarHBondContact O-CA 3.25Å; V151-L214 HydrophobicContact CG1-CD1 4.49Å; V151-L214 VanDerWaalsContact O-CB 3.31Å; V151-L214 WeakPolarHBondContact O-CB 3.34Å; V151-L257 HydrophobicContact CG2-CD1 3.45Å; V151-L257 VanDerWaalsContact CG2-CD1 3.45Å; V151-P261 HydrophobicContact CG2-CG 3.67Å
152	S	90.4	Very high	89.6	Confident	20 Å²	20	50.2 Å²	50.2	14%	0.14	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	157	166.7	49.4	0	0	0	0	110.2	I143 S211	I143-S152 PolarHBondContact N-O 2.62Å; I143-S152 PolarHBondContact O-N 3.3Å; I143-S152 PolarHBondContact O-OG 2.7Å; S152-S211 VanDerWaalsContact CA-OG 3.25Å; S152-S211 WeakPolarHBondContact CA-OG 3.38Å; S152-S211 WeakPolarHBondContact CB-OG 3.24Å
153	L	90.9	Very high	89.4	Confident	18 Å²	18	52.1 Å²	52.1	9%	0.094	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	131.4	173.7	-63.3	177.2	0	0	0	108.2	I140 V142 I206 L210 S211 L214	I140-L153 HydrophobicContact CG2-CB 3.94Å; I140-L153 HydrophobicContact CG2-CD2 4.05Å; I140-L153 HydrophobicContact CG2-CG 4.44Å; V142-L153 HydrophobicContact CB-CD2 4.17Å; V142-L153 HydrophobicContact CG1-CD2 4.14Å; V142-L153 HydrophobicContact CG2-CD2 3.63Å; L153-I206 HydrophobicContact CB-CG2 3.98Å; L153-L210 HydrophobicContact CD1-CB 4Å; L153-L210 HydrophobicContact CD1-CD1 4.3Å; L153-S211 PolarHBondContact N-OG 3.42Å; L153-L214 HydrophobicContact CD1-CD1 3.66Å; L153-L214 HydrophobicContact CD2-CD1 4.29Å; L153-L214 HydrophobicContact CG-CD1 3.57Å
154	V	92.1	Very high	89.2	Confident	50 Å²	50	53.2 Å²	53.2	30%	0.303	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.1	175.8	178.8	0	0	0	0	108.5	I140 E141 I143 D156 D207	I140-V154 CarbonylContact C-O 3.6Å; I140-V154 WeakPolarHBondContact CA-O 3.42Å; E141-V154 PolarHBondContact N-O 2.9Å; E141-V154 PolarHBondContact O-N 2.84Å; I143-V154 HydrophobicContact CD1-CB 4.03Å; I143-V154 HydrophobicContact CD1-CG2 3.57Å; I143-V154 HydrophobicContact CG1-CG2 4.46Å; V154-D156 PolarHBondContact O-N 3.45Å; V154-D207 WeakPolarHBondContact CA-OD1 3.36Å
155	M	92.6	Very high	89	Confident	28 Å²	28	52.5 Å²	52.5	14%	0.138	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	114.5	172.1	-167.6	-176	74.2	0	0	109.7	V138 C158 M202 E203 I206 D207	V138-M155 HydrophobicContact CG1-CG 4.03Å; V138-M155 HydrophobicContact CG1-SD 4.4Å; M155-C158 HydrophobicContact CE-CB 3.79Å; M155-C158 HydrophobicContact SD-CB 3.69Å; M155-M202 HydrophobicContact SD-CB 3.86Å; M155-E203 HydrophobicContact CE-CB 3.57Å; M155-E203 HydrophobicContact CE-CG 3.95Å; M155-E203 HydrophobicContact SD-CB 4.03Å; M155-I206 HydrophobicContact CB-CD1 4.07Å; M155-I206 HydrophobicContact CB-CG2 4.42Å; M155-I206 HydrophobicContact CG-CD1 4Å; M155-I206 HydrophobicContact SD-CD1 4.28Å; M155-D207 PolarHBondContact N-OD1 3.11Å
156	D	92.6	Very high	88.9	Confident	58 Å²	58	59 Å²	59	31%	0.31	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-54.9	-179.2	179.1	35.8	0	0	0	110.3	R97 S139 E141 V154	R97-D156 IonicContact CZ-OD2 3.02Å; R97-D156 IonicContact NE-OD2 2.93Å; R97-D156 IonicContact NH1-OD2 3.66Å; R97-D156 PolarHBondContact NH1-OD2 3Å; R97-D156 IonicContact NH2-OD2 3.75Å; R97-D156 PolarHBondContact NH2-OD2 2.88Å; S139-D156 PolarHBondContact O-N 3.05Å; S139-D156 PolarHBondContact OG-OD2 2.97Å; E141-D156 HydrophobicContact CB-CB 4.22Å; V154-D156 PolarHBondContact O-N 3.45Å
157	E	93.3	Very high	89	Confident	127 Å²	127	56.1 Å²	56.1	59%	0.593	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.8	139.8	-179.8	-62.5	-177.3	175.5	0	0	110.8	V138 S139	V138-E157 CarbonylContact C-O 3.59Å; V138-E157 WeakPolarHBondContact CA-O 3.44Å; S139-E157 PolarHBondContact N-O 3Å; S139-E157 PolarHBondContact O-N 2.5Å
158	C	94	Very high	88.9	Confident	24 Å²	24	55.4 Å²	55.4	16%	0.162	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	115	169.5	174.2	0	0	0	0	109.8	E137 M155 C199	E137-C158 WeakPolarHBondContact O-CA 3.49Å; M155-C158 HydrophobicContact CE-CB 3.79Å; M155-C158 HydrophobicContact SD-CB 3.69Å; C158-C199 HydrophobicContact CB-CB 3.68Å; C158-C199 WeakPolarHBondContact CB-SG 3.28Å; C158-C199 PolarHBondContact O-SG 3.42Å; C158-C199 VanDerWaalsContact O-SG 3.38Å; C158-C199 WeakPolarHBondContact SG-CA 3.27Å; C158-C199 WeakPolarHBondContact SG-CB 3.45Å; C158-C199 CovalentContact SG-SG 2.04Å; C158-C199 PolarHBondContact SG-SG 3.36Å
159	N	93.3	Very high	88.8	Confident	70 Å²	70	52.9 Å²	52.9	37%	0.374	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125.6	178.4	-170.5	16.7	0	0	0	109.8	L136 E137	L136-N159 CarbonylContact C-O 3.51Å; L136-N159 WeakPolarHBondContact CA-O 3.29Å; E137-N159 HydrophobicContact CB-CB 4.39Å; E137-N159 PolarHBondContact N-O 2.98Å; E137-N159 PolarHBondContact O-N 3.31Å
160	V	90.5	Very high	88.3	Confident	6 Å²	6	52.5 Å²	52.5	4%	0.036	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	115.4	174.9	178.7	0	0	0	0	107.5	L134 S135 L136 I162 Q195 I198	L134-V160 HydrophobicContact CD1-CG1 4.3Å; L134-V160 HydrophobicContact CD2-CG1 3.83Å; L134-V160 HydrophobicContact CG-CG1 3.98Å; S135-V160 CarbonylContact O-C 3.58Å; S135-V160 VanDerWaalsContact O-CA 3.27Å; S135-V160 WeakPolarHBondContact O-CA 3.23Å; L136-V160 HydrophobicContact CD1-CG2 3.61Å; V160-I162 HydrophobicContact CG1-CG1 4.47Å; V160-Q195 HydrophobicContact CB-CB 3.94Å; V160-Q195 HydrophobicContact CB-CG 3.91Å; V160-Q195 HydrophobicContact CG1-CB 4.49Å; V160-Q195 HydrophobicContact CG2-CG 4.33Å; V160-I198 HydrophobicContact CG1-CD1 4.21Å; V160-I198 HydrophobicContact CG2-CB 4.13Å; V160-I198 HydrophobicContact CG2-CG2 3.91Å
161	T	89.9	Confident	87.7	Confident	62 Å²	62	55.5 Å²	55.5	38%	0.38	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	138.7	174.6	82.4	0	0	0	0	110	L134 S135	L134-T161 CarbonylContact C-O 3.53Å; L134-T161 WeakPolarHBondContact CA-O 3.33Å; S135-T161 PolarHBondContact N-O 3.06Å; S135-T161 PolarHBondContact O-N 3.49Å; S135-T161 PolarHBondContact OG-OG1 3.47Å
162	I	87.6	Confident	86.6	Confident	23 Å²	23	56 Å²	56	12%	0.118	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	111.9	-179.3	-64.8	164.2	0	0	0	106.9	L131 L134 V160 W164 Q191 A194	L131-I162 HydrophobicContact CB-CG2 4.35Å; L131-I162 HydrophobicContact CD2-CG2 4.4Å; L134-I162 HydrophobicContact CD1-CG1 4.19Å; L134-I162 HydrophobicContact CG-CG1 4.06Å; V160-I162 HydrophobicContact CG1-CG1 4.47Å; I162-W164 PolarHBondContact O-N 3.44Å; I162-Q191 HydrophobicContact CB-CG 4.18Å; I162-Q191 HydrophobicContact CD1-CB 3.91Å; I162-Q191 HydrophobicContact CD1-CG 3.7Å; I162-Q191 HydrophobicContact CG2-CG 4.24Å; I162-A194 HydrophobicContact CD1-CB 3.84Å
163	G	87.4	Confident	85.5	Confident	57 Å²	57	60.9 Å²	60.9	59%	0.588	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.7	-48.8	-175.6	0	0	0	0	0	113.2	K132 S133	K132-G163 PolarHBondContact O-N 3.31Å; K132-G163 VanDerWaalsContact O-N 3.14Å; S133-G163 PolarHBondContact O-N 2.86Å
164	W	86.1	Confident	84.3	Confident	87 Å²	87	67.9 Å²	67.9	33%	0.33	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	155.2	170.1	61.2	-90.8	0	0	0	112.8	A130 K132 I162 R166	A130-W164 HydrophobicContact CB-CZ3 4.46Å; K132-W164 HydrophobicContact CB-CD2 3.84Å; K132-W164 HydrophobicContact CB-CE3 4.38Å; K132-W164 HydrophobicContact CB-CG 4.22Å; K132-W164 HydrophobicContact CB-CH2 4.49Å; K132-W164 HydrophobicContact CB-CZ2 3.95Å; K132-W164 HydrophobicContact CD-CH2 3.65Å; K132-W164 HydrophobicContact CD-CZ2 3.18Å; K132-W164 HydrophobicContact CD-CZ3 4.45Å; K132-W164 HydrophobicContact CG-CD2 4.11Å; K132-W164 HydrophobicContact CG-CE3 4.27Å; K132-W164 HydrophobicContact CG-CH2 3.73Å; K132-W164 HydrophobicContact CG-CZ2 3.52Å; K132-W164 HydrophobicContact CG-CZ3 4.04Å; K132-W164 PolarHBondContact N-O 3.32Å; K132-W164 PolarHBondContact O-N 2.93Å; I162-W164 PolarHBondContact O-N 3.44Å; W164-R166 HydrophobicContact CE3-CB 4.24Å; W164-R166 HydrophobicContact CE3-CG 3.63Å; W164-R166 HydrophobicContact CH2-CG 4.37Å; W164-R166 HydrophobicContact CZ3-CB 3.77Å; W164-R166 HydrophobicContact CZ3-CG 3.35Å
165	S	85.6	Confident	83.1	Confident	24 Å²	24	70.5 Å²	70.5	17%	0.168	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	139.7	174.6	51.5	0	0	0	0	110.4	A130 S187 Q191	A130-S165 CarbonylContact O-C 3.55Å; A130-S165 VanDerWaalsContact O-CA 3.23Å; A130-S165 WeakPolarHBondContact O-CA 3.43Å; S165-S187 WeakPolarHBondContact OG-CB 3.37Å; S165-Q191 PolarHBondContact OG-NE2 2.76Å
166	R	84.3	Confident	81.9	Confident	170 Å²	170	70 Å²	70	64%	0.642	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	131.1	171.4	-75.6	-179.4	-169.8	179.1	-0.8	110	A129 A130 W164	A129-R166 WeakPolarHBondContact CA-O 3.02Å; A130-R166 PolarHBondContact N-O 3.27Å; A130-R166 PolarHBondContact O-N 3.46Å; W164-R166 HydrophobicContact CE3-CB 4.24Å; W164-R166 HydrophobicContact CE3-CG 3.63Å; W164-R166 HydrophobicContact CH2-CG 4.37Å; W164-R166 HydrophobicContact CZ3-CB 3.77Å; W164-R166 HydrophobicContact CZ3-CG 3.35Å
167	L	85.4	Confident	80.9	Confident	11 Å²	11	73.8 Å²	73.8	6%	0.058	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.3	172.8	-44.5	174	0	0	0	108	V127 L128 A129 F169 N183 M186 S187 L190	V127-L167 HydrophobicContact CG1-CB 4.14Å; L128-L167 CarbonylContact O-C 3.55Å; L128-L167 WeakPolarHBondContact O-CA 3.42Å; A129-L167 HydrophobicContact CB-CD2 3.44Å; A129-L167 VanDerWaalsContact CB-CD2 3.44Å; L167-F169 HydrophobicContact CB-CE2 4.4Å; L167-N183 WeakPolarHBondContact CB-OD1 3.2Å; L167-N183 WeakPolarHBondContact CD1-OD1 3.49Å; L167-N183 VanDerWaalsContact CG-OD1 3.25Å; L167-N183 WeakPolarHBondContact CG-OD1 3.33Å; L167-M186 HydrophobicContact CB-CE 4.04Å; L167-M186 HydrophobicContact CD1-CB 3.54Å; L167-M186 HydrophobicContact CD1-CE 3.39Å; L167-M186 HydrophobicContact CD1-CG 3.69Å; L167-M186 HydrophobicContact CD1-SD 4.39Å; L167-M186 HydrophobicContact CG-CE 4.15Å; L167-S187 WeakPolarHBondContact CD1-OG 3.38Å; L167-L190 HydrophobicContact CD1-CD1 3.88Å; L167-L190 HydrophobicContact CD2-CD1 3.25Å; L167-L190 HydrophobicContact CG-CD1 4.22Å
168	K	83.9	Confident	79.9	Confident	141 Å²	141	71.9 Å²	71.9	61%	0.613	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117	109.1	173.2	179.5	179.7	-178.9	-178.2	0	107.5	L128	L128-K168 HydrophobicContact CB-CB 4.23Å; L128-K168 PolarHBondContact N-O 3.28Å; L128-K168 PolarHBondContact O-N 3.44Å
169	F	81.9	Confident	78.8	Confident	22 Å²	22	71.8 Å²	71.8	10%	0.096	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	139.2	172.9	-61	-92.7	0	0	0	109.2	I125 V127 L167 V172 L179 N183 M186	I125-F169 HydrophobicContact CG2-CD1 4.38Å; V127-F169 HydrophobicContact CG1-CD1 4.36Å; V127-F169 HydrophobicContact CG1-CE1 4.42Å; V127-F169 HydrophobicContact CG2-CD1 3.6Å; V127-F169 HydrophobicContact CG2-CE1 3.82Å; L167-F169 HydrophobicContact CB-CE2 4.4Å; F169-V172 HydrophobicContact CB-CB 4.32Å; F169-V172 HydrophobicContact CB-CG1 3.95Å; F169-V172 HydrophobicContact CB-CG2 3.35Å; F169-V172 VanDerWaalsContact O-CG2 3.3Å; F169-V172 WeakPolarHBondContact O-CG2 3.46Å; F169-L179 HydrophobicContact CB-CD1 4.28Å; F169-L179 HydrophobicContact CD1-CB 3.88Å; F169-L179 HydrophobicContact CD1-CD1 3.44Å; F169-L179 VanDerWaalsContact CD1-CD1 3.44Å; F169-L179 HydrophobicContact CD1-CD2 4.3Å; F169-L179 HydrophobicContact CD1-CG 4.07Å; F169-L179 HydrophobicContact CD2-CB 3.89Å; F169-L179 HydrophobicContact CE1-CB 3.83Å; F169-L179 HydrophobicContact CE1-CD1 3.87Å; F169-L179 HydrophobicContact CE1-CD2 3.85Å; F169-L179 HydrophobicContact CE1-CG 4.05Å; F169-L179 HydrophobicContact CE2-CB 3.85Å; F169-L179 WeakPolarHBondContact CE2-O 3.46Å; F169-L179 HydrophobicContact CG-CB 3.9Å; F169-L179 HydrophobicContact CG-CD1 3.94Å; F169-L179 HydrophobicContact CG-CG 4.5Å; F169-L179 HydrophobicContact CZ-CB 3.8Å; F169-L179 HydrophobicContact CZ-CD2 4.3Å; F169-L179 HydrophobicContact CZ-CG 4.46Å; F169-L179 WeakPolarHBondContact CZ-O 3.19Å; F169-N183 HydrophobicContact CE2-CB 4.48Å; F169-M186 HydrophobicContact CD1-CE 4.42Å; F169-M186 HydrophobicContact CE1-CE 3.39Å; F169-M186 HydrophobicContact CE1-SD 4.21Å; F169-M186 HydrophobicContact CE2-CE 4.13Å; F169-M186 HydrophobicContact CZ-CE 3.2Å; F169-M186 HydrophobicContact CZ-SD 4.16Å
170	I	77.6	Confident	77.7	Confident	61 Å²	61	73.3 Å²	73.3	31%	0.313	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	139.5	179.5	-58.7	165	0	0	0	106.3	F110 S126 L128	F110-I170 HydrophobicContact CE2-CD1 4.03Å; S126-I170 PolarHBondContact N-O 2.77Å; S126-I170 PolarHBondContact O-N 3.41Å; L128-I170 HydrophobicContact CB-CD1 4.35Å
171	N	72.7	Confident	76.9	Confident	82 Å²	82	77.3 Å²	77.3	44%	0.439	40%	0.402	S	S	.	.	S	Bend	trans	61.6	60.8	-172.6	-53.9	-28.9	0	0	0	113.1
172	V	65.6	Low	76.2	Confident	35 Å²	35	77.6 Å²	77.6	21%	0.212	40%	0.4	C	S	.	.			trans	-112.8	42.6	-168.1	-140.4	0	0	0	0	112.4	F169 F174 G176 L179	F169-V172 HydrophobicContact CB-CB 4.32Å; F169-V172 HydrophobicContact CB-CG1 3.95Å; F169-V172 HydrophobicContact CB-CG2 3.35Å; F169-V172 VanDerWaalsContact O-CG2 3.3Å; F169-V172 WeakPolarHBondContact O-CG2 3.46Å; V172-F174 PolarHBondContact O-N 3.02Å; V172-G176 PolarHBondContact O-N 3.38Å; V172-L179 HydrophobicContact CG1-CB 4.19Å; V172-L179 HydrophobicContact CG1-CD1 3.22Å; V172-L179 HydrophobicContact CG1-CG 4.09Å
173	D	68.1	Low	75.7	Confident	122 Å²	122	78.6 Å²	78.6	65%	0.652	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.1	-71.5	-167.1	-59.9	-24.8	0	0	0	114.1
174	F	66.6	Low	75.3	Confident	166 Å²	166	84.7 Å²	84.7	73%	0.728	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-18.2	-174.4	-172.2	-101	0	0	0	112.9	V172	V172-F174 PolarHBondContact O-N 3.02Å
175	F	65.3	Low	74.8	Confident	105 Å²	105	84.8 Å²	84.8	46%	0.461	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	3.7	-175.8	-64.2	-76.6	0	0	0	113.2	D177 I178 L179	F175-D177 VanDerWaalsContact C-N 3.33Å; F175-D177 PolarHBondContact O-N 2.68Å; F175-I178 HydrophobicContact CD1-CD1 3.98Å; F175-I178 PolarHBondContact O-N 3.21Å; F175-I178 VanDerWaalsContact O-N 3.12Å; F175-L179 HydrophobicContact CB-CD1 4.32Å; F175-L179 HydrophobicContact CB-CG 4.21Å; F175-L179 WeakPolarHBondContact O-CB 3.36Å; F175-L179 WeakPolarHBondContact O-CG 3.19Å; F175-L179 PolarHBondContact O-N 3.27Å
176	G	68.2	Low	74.4	Confident	17 Å²	17	84.6 Å²	84.6	18%	0.175	42%	0.423	C	S	.	.	H	α-helix	trans	-49.5	-49.6	-176.6	0	0	0	0	0	113.6	V172 L179 N180	V172-G176 PolarHBondContact O-N 3.38Å; G176-L179 PolarHBondContact O-N 3.42Å; G176-N180 VanDerWaalsContact O-CB 3.29Å; G176-N180 WeakPolarHBondContact O-CB 3.14Å; G176-N180 PolarHBondContact O-N 3.4Å; G176-N180 PolarHBondContact O-ND2 3.4Å
177	D	71.9	Confident	74.2	Confident	138 Å²	138	77 Å²	77	74%	0.738	40%	0.396	S	S	*	.	H	α-helix	trans	-67	-40.1	-179	-66.3	-25.1	0	0	0	112.6	F175 S181	F175-D177 VanDerWaalsContact C-N 3.33Å; F175-D177 PolarHBondContact O-N 2.68Å; D177-S181 WeakPolarHBondContact O-CB 3.48Å; D177-S181 PolarHBondContact O-N 2.97Å
178	I	72.3	Confident	74.1	Confident	87 Å²	87	77.9 Å²	77.9	45%	0.446	41%	0.407	S	S	.	.	H	α-helix	trans	-65.9	-44.9	177.4	-65.7	167.5	0	0	0	109.9	F175 S181 M182	F175-I178 HydrophobicContact CD1-CD1 3.98Å; F175-I178 PolarHBondContact O-N 3.21Å; F175-I178 VanDerWaalsContact O-N 3.12Å; I178-S181 VanDerWaalsContact O-CB 3.32Å; I178-S181 WeakPolarHBondContact O-CB 3.46Å; I178-S181 PolarHBondContact O-N 3.37Å; I178-M182 HydrophobicContact CG2-SD 4.34Å; I178-M182 WeakPolarHBondContact O-CG 3.32Å; I178-M182 PolarHBondContact O-N 3.29Å
179	L	70.1	Confident	73.9	Confident	22 Å²	22	75.1 Å²	75.1	12%	0.115	40%	0.399	C	S	.	.	H	α-helix	trans	-69.8	-36	179.6	-68.6	-174.3	0	0	0	112.4	I125 F169 V172 F175 G176 S181 M182 N183	I125-L179 HydrophobicContact CD1-CD1 4.36Å; I125-L179 HydrophobicContact CG2-CD1 4.19Å; F169-L179 HydrophobicContact CB-CD1 4.28Å; F169-L179 HydrophobicContact CD1-CB 3.88Å; F169-L179 HydrophobicContact CD1-CD1 3.44Å; F169-L179 VanDerWaalsContact CD1-CD1 3.44Å; F169-L179 HydrophobicContact CD1-CD2 4.3Å; F169-L179 HydrophobicContact CD1-CG 4.07Å; F169-L179 HydrophobicContact CD2-CB 3.89Å; F169-L179 HydrophobicContact CE1-CB 3.83Å; F169-L179 HydrophobicContact CE1-CD1 3.87Å; F169-L179 HydrophobicContact CE1-CD2 3.85Å; F169-L179 HydrophobicContact CE1-CG 4.05Å; F169-L179 HydrophobicContact CE2-CB 3.85Å; F169-L179 WeakPolarHBondContact CE2-O 3.46Å; F169-L179 HydrophobicContact CG-CB 3.9Å; F169-L179 HydrophobicContact CG-CD1 3.94Å; F169-L179 HydrophobicContact CG-CG 4.5Å; F169-L179 HydrophobicContact CZ-CB 3.8Å; F169-L179 HydrophobicContact CZ-CD2 4.3Å; F169-L179 HydrophobicContact CZ-CG 4.46Å; F169-L179 WeakPolarHBondContact CZ-O 3.19Å; V172-L179 HydrophobicContact CG1-CB 4.19Å; V172-L179 HydrophobicContact CG1-CD1 3.22Å; V172-L179 HydrophobicContact CG1-CG 4.09Å; F175-L179 HydrophobicContact CB-CD1 4.32Å; F175-L179 HydrophobicContact CB-CG 4.21Å; F175-L179 WeakPolarHBondContact O-CB 3.36Å; F175-L179 WeakPolarHBondContact O-CG 3.19Å; F175-L179 PolarHBondContact O-N 3.27Å; G176-L179 PolarHBondContact O-N 3.42Å; L179-S181 VanDerWaalsContact C-N 3.32Å; L179-S181 PolarHBondContact O-N 3.26Å; L179-M182 HydrophobicContact CD2-SD 4.36Å; L179-M182 CarbonylContact O-C 3.48Å; L179-M182 PolarHBondContact O-N 2.96Å; L179-M182 VanDerWaalsContact O-N 3.13Å; L179-N183 PolarHBondContact O-N 2.97Å
180	N	71.1	Confident	73.9	Confident	101 Å²	101	74.1 Å²	74.1	54%	0.54	40%	0.395	S	S	.	.	H	α-helix	trans	-62.6	-39.6	171.7	-76.1	-24.7	0	0	0	111.7	G176 M182 N183	G176-N180 VanDerWaalsContact O-CB 3.29Å; G176-N180 WeakPolarHBondContact O-CB 3.14Å; G176-N180 PolarHBondContact O-N 3.4Å; G176-N180 PolarHBondContact O-ND2 3.4Å; N180-M182 VanDerWaalsContact C-N 3.32Å; N180-M182 PolarHBondContact O-N 3.41Å; N180-N183 WeakPolarHBondContact O-CB 3.38Å; N180-N183 PolarHBondContact O-N 2.94Å
181	S	73.7	Confident	74.2	Confident	91 Å²	91	74.3 Å²	74.3	64%	0.636	39%	0.394	S	S	*	.	H	α-helix	trans	-60.6	-40.8	171.1	151.1	0	0	0	0	111.9	D177 I178 L179 N183	D177-S181 WeakPolarHBondContact O-CB 3.48Å; D177-S181 PolarHBondContact O-N 2.97Å; I178-S181 VanDerWaalsContact O-CB 3.32Å; I178-S181 WeakPolarHBondContact O-CB 3.46Å; I178-S181 PolarHBondContact O-N 3.37Å; L179-S181 VanDerWaalsContact C-N 3.32Å; L179-S181 PolarHBondContact O-N 3.26Å; S181-N183 VanDerWaalsContact C-N 3.27Å; S181-N183 PolarHBondContact O-N 3.37Å
182	M	74	Confident	74.7	Confident	68 Å²	68	75 Å²	75	34%	0.335	40%	0.401	S	S	.	.	H	α-helix	trans	-75.5	-11.7	179	-67.9	-178	74.6	0	0	113.8	I178 L179 N180 K184 T185 M186	I178-M182 HydrophobicContact CG2-SD 4.34Å; I178-M182 WeakPolarHBondContact O-CG 3.32Å; I178-M182 PolarHBondContact O-N 3.29Å; L179-M182 HydrophobicContact CD2-SD 4.36Å; L179-M182 CarbonylContact O-C 3.48Å; L179-M182 PolarHBondContact O-N 2.96Å; L179-M182 VanDerWaalsContact O-N 3.13Å; N180-M182 VanDerWaalsContact C-N 3.32Å; N180-M182 PolarHBondContact O-N 3.41Å; M182-K184 VanDerWaalsContact C-N 3.27Å; M182-K184 PolarHBondContact O-N 3.29Å; M182-T185 PolarHBondContact O-N 3.02Å; M182-M186 WeakPolarHBondContact O-CB 3.01Å; M182-M186 PolarHBondContact O-N 3.42Å
183	N	78.3	Confident	75.5	Confident	43 Å²	43	73.8 Å²	73.8	23%	0.23	40%	0.396	C	S	.	.	H	α-helix	trans	-54.4	-42.3	-176.6	-168.3	2.5	0	0	0	112.2	L167 F169 L179 N180 S181 S187	L167-N183 WeakPolarHBondContact CB-OD1 3.2Å; L167-N183 WeakPolarHBondContact CD1-OD1 3.49Å; L167-N183 VanDerWaalsContact CG-OD1 3.25Å; L167-N183 WeakPolarHBondContact CG-OD1 3.33Å; F169-N183 HydrophobicContact CE2-CB 4.48Å; L179-N183 PolarHBondContact O-N 2.97Å; N180-N183 WeakPolarHBondContact O-CB 3.38Å; N180-N183 PolarHBondContact O-N 2.94Å; S181-N183 VanDerWaalsContact C-N 3.27Å; S181-N183 PolarHBondContact O-N 3.37Å; N183-S187 WeakPolarHBondContact O-CB 3.44Å; N183-S187 PolarHBondContact O-N 2.89Å; N183-S187 PolarHBondContact O-OG 3.38Å; N183-S187 PolarHBondContact OD1-OG 2.04Å
184	K	78	Confident	76.2	Confident	185 Å²	185	68 Å²	68	80%	0.804	36%	0.364	S	S	*	.	H	α-helix	trans	-63.6	-46	176.2	-72.1	-175.6	179.2	179.9	0	112.2	M182 S187 G188	M182-K184 VanDerWaalsContact C-N 3.27Å; M182-K184 PolarHBondContact O-N 3.29Å; K184-S187 PolarHBondContact O-N 2.96Å; K184-G188 PolarHBondContact O-N 3.23Å
185	T	76.7	Confident	77.2	Confident	89 Å²	89	63.6 Å²	63.6	55%	0.546	35%	0.346	S	S	.	.	H	α-helix	trans	-64.4	-47.3	179.4	-53.8	0	0	0	0	111.2	M182 S187 G188 L189	M182-T185 PolarHBondContact O-N 3.02Å; T185-S187 VanDerWaalsContact C-N 3.33Å; T185-S187 PolarHBondContact O-N 3.23Å; T185-G188 PolarHBondContact O-N 3.38Å; T185-L189 HydrophobicContact CG2-CD1 4.36Å; T185-L189 WeakPolarHBondContact O-CG 3.38Å; T185-L189 PolarHBondContact O-N 3.25Å
186	M	77.5	Confident	78.1	Confident	20 Å²	20	66.3 Å²	66.3	10%	0.099	36%	0.358	C	S	.	.	H	α-helix	trans	-67.5	-36.4	-179.8	-165.3	163.9	81.5	0	0	111.3	F72 V127 L167 F169 M182 L189 L190	F72-M186 HydrophobicContact CE1-CG 3.72Å; F72-M186 HydrophobicContact CE1-SD 4.04Å; F72-M186 HydrophobicContact CZ-CG 3.56Å; F72-M186 HydrophobicContact CZ-SD 4.39Å; V127-M186 HydrophobicContact CB-CE 4.4Å; V127-M186 HydrophobicContact CG1-CE 3.55Å; V127-M186 HydrophobicContact CG2-CE 4.13Å; L167-M186 HydrophobicContact CB-CE 4.04Å; L167-M186 HydrophobicContact CD1-CB 3.54Å; L167-M186 HydrophobicContact CD1-CE 3.39Å; L167-M186 HydrophobicContact CD1-CG 3.69Å; L167-M186 HydrophobicContact CD1-SD 4.39Å; L167-M186 HydrophobicContact CG-CE 4.15Å; F169-M186 HydrophobicContact CD1-CE 4.42Å; F169-M186 HydrophobicContact CE1-CE 3.39Å; F169-M186 HydrophobicContact CE1-SD 4.21Å; F169-M186 HydrophobicContact CE2-CE 4.13Å; F169-M186 HydrophobicContact CZ-CE 3.2Å; F169-M186 HydrophobicContact CZ-SD 4.16Å; M182-M186 WeakPolarHBondContact O-CB 3.01Å; M182-M186 PolarHBondContact O-N 3.42Å; M186-L189 PolarHBondContact O-N 3.03Å; M186-L190 HydrophobicContact CG-CD1 4.37Å; M186-L190 WeakPolarHBondContact O-CB 3.35Å; M186-L190 VanDerWaalsContact O-CG 3.25Å; M186-L190 WeakPolarHBondContact O-CG 3.29Å; M186-L190 PolarHBondContact O-N 3.42Å
187	S	80.1	Confident	78.8	Confident	12 Å²	12	68.3 Å²	68.3	8%	0.084	36%	0.36	C	S	.	.	H	α-helix	trans	-63.7	-45	174.4	-69.3	0	0	0	0	111.5	S165 L167 N183 K184 T185 L190 Q191	S165-S187 WeakPolarHBondContact OG-CB 3.37Å; L167-S187 WeakPolarHBondContact CD1-OG 3.38Å; N183-S187 WeakPolarHBondContact O-CB 3.44Å; N183-S187 PolarHBondContact O-N 2.89Å; N183-S187 PolarHBondContact O-OG 3.38Å; N183-S187 PolarHBondContact OD1-OG 2.04Å; K184-S187 PolarHBondContact O-N 2.96Å; T185-S187 VanDerWaalsContact C-N 3.33Å; T185-S187 PolarHBondContact O-N 3.23Å; S187-L190 PolarHBondContact O-N 2.84Å; S187-Q191 VanDerWaalsContact O-CG 3.31Å; S187-Q191 WeakPolarHBondContact O-CG 3.38Å; S187-Q191 PolarHBondContact O-N 3.4Å
188	G	83	Confident	79.3	Confident	28 Å²	28	63 Å²	63	29%	0.289	33%	0.332	S	S	.	.	H	α-helix	trans	-62.8	-42.5	175.5	0	0	0	0	0	112.6	K184 T185 Q191 V192	K184-G188 PolarHBondContact O-N 3.23Å; T185-G188 PolarHBondContact O-N 3.38Å; G188-Q191 PolarHBondContact O-N 2.93Å; G188-V192 WeakPolarHBondContact O-CG2 3.4Å; G188-V192 PolarHBondContact O-N 2.84Å
189	L	80.3	Confident	80.1	Confident	84 Å²	84	59.7 Å²	59.7	44%	0.44	32%	0.316	S	S	.	.	H	α-helix	trans	-63.5	-40.8	175.4	-72.7	172.6	0	0	0	112.4	F72 T185 M186 Q191 G193	F72-L189 HydrophobicContact CZ-CB 4.14Å; T185-L189 HydrophobicContact CG2-CD1 4.36Å; T185-L189 WeakPolarHBondContact O-CG 3.38Å; T185-L189 PolarHBondContact O-N 3.25Å; M186-L189 PolarHBondContact O-N 3.03Å; L189-Q191 VanDerWaalsContact C-N 3.34Å; L189-G193 PolarHBondContact O-N 3.46Å
190	L	81	Confident	80.8	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-63	-40.8	175	-76.5	166.4	0	0	0	111.7	L68 F72 A129 L167 M186 S187 A194	L68-L190 HydrophobicContact CD1-CD2 4.15Å; L68-L190 HydrophobicContact CD2-CD2 3.32Å; L68-L190 HydrophobicContact CG-CD2 4.41Å; F72-L190 HydrophobicContact CD2-CD2 4.26Å; F72-L190 HydrophobicContact CE2-CD2 3.58Å; F72-L190 HydrophobicContact CE2-CG 3.82Å; F72-L190 HydrophobicContact CZ-CD2 4.41Å; F72-L190 HydrophobicContact CZ-CG 4.21Å; A129-L190 HydrophobicContact CB-CD1 4.11Å; L167-L190 HydrophobicContact CD1-CD1 3.88Å; L167-L190 HydrophobicContact CD2-CD1 3.25Å; L167-L190 HydrophobicContact CG-CD1 4.22Å; M186-L190 HydrophobicContact CG-CD1 4.37Å; M186-L190 WeakPolarHBondContact O-CB 3.35Å; M186-L190 VanDerWaalsContact O-CG 3.25Å; M186-L190 WeakPolarHBondContact O-CG 3.29Å; M186-L190 PolarHBondContact O-N 3.42Å; S187-L190 PolarHBondContact O-N 2.84Å; L190-A194 WeakPolarHBondContact O-CB 3.29Å; L190-A194 PolarHBondContact O-N 3.47Å
191	Q	83.5	Confident	81.3	Confident	65 Å²	65	58.3 Å²	58.3	30%	0.304	31%	0.311	S	S	.	.	H	α-helix	trans	-65.7	-48.4	177.3	-72.8	177.8	-23.3	0	0	112.1	I162 S165 S187 G188 L189 G193 A194 Q195	I162-Q191 HydrophobicContact CB-CG 4.18Å; I162-Q191 HydrophobicContact CD1-CB 3.91Å; I162-Q191 HydrophobicContact CD1-CG 3.7Å; I162-Q191 HydrophobicContact CG2-CG 4.24Å; S165-Q191 PolarHBondContact OG-NE2 2.76Å; S187-Q191 VanDerWaalsContact O-CG 3.31Å; S187-Q191 WeakPolarHBondContact O-CG 3.38Å; S187-Q191 PolarHBondContact O-N 3.4Å; G188-Q191 PolarHBondContact O-N 2.93Å; L189-Q191 VanDerWaalsContact C-N 3.34Å; Q191-G193 VanDerWaalsContact C-N 3.34Å; Q191-G193 PolarHBondContact O-N 2.86Å; Q191-A194 WeakPolarHBondContact O-CB 3.38Å; Q191-A194 PolarHBondContact O-N 3.23Å; Q191-Q195 PolarHBondContact O-N 3.49Å
192	V	84.4	Confident	81.7	Confident	95 Å²	95	55 Å²	55	58%	0.576	29%	0.285	S	S	*	.	H	α-helix	trans	-63.8	-41.5	177.8	173.9	0	0	0	0	111	G188 Q195 K196	G188-V192 WeakPolarHBondContact O-CG2 3.4Å; G188-V192 PolarHBondContact O-N 2.84Å; V192-Q195 PolarHBondContact O-N 2.95Å; V192-K196 WeakPolarHBondContact O-CB 3.25Å; V192-K196 PolarHBondContact O-N 2.83Å
193	G	82	Confident	82.4	Confident	10 Å²	10	56.3 Å²	56.3	10%	0.103	29%	0.29	C	S	.	.	H	α-helix	trans	-62.7	-42.6	175.7	0	0	0	0	0	112.5	L189 Q191 R197	L189-G193 PolarHBondContact O-N 3.46Å; Q191-G193 VanDerWaalsContact C-N 3.34Å; Q191-G193 PolarHBondContact O-N 2.86Å; G193-R197 WeakPolarHBondContact O-CB 2.86Å; G193-R197 PolarHBondContact O-N 3.35Å
194	A	81.8	Confident	82.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-58.5	-53.9	174.7	0	0	0	0	0	112.2	M67 I162 L190 Q191 R197 I198	M67-A194 HydrophobicContact CE-CB 3.12Å; I162-A194 HydrophobicContact CD1-CB 3.84Å; L190-A194 WeakPolarHBondContact O-CB 3.29Å; L190-A194 PolarHBondContact O-N 3.47Å; Q191-A194 WeakPolarHBondContact O-CB 3.38Å; Q191-A194 PolarHBondContact O-N 3.23Å; A194-R197 PolarHBondContact O-N 2.98Å; A194-I198 WeakPolarHBondContact O-CB 3.43Å; A194-I198 VanDerWaalsContact O-CG1 3.27Å; A194-I198 WeakPolarHBondContact O-CG1 3.38Å; A194-I198 PolarHBondContact O-N 3.45Å
195	Q	87.6	Confident	82.8	Confident	74 Å²	74	48.5 Å²	48.5	35%	0.346	26%	0.255	S	S	.	.	H	α-helix	trans	-58	-52.8	179.9	175.3	171.4	7.6	0	0	111	V160 Q191 V192 R197 I198 C199	V160-Q195 HydrophobicContact CB-CB 3.94Å; V160-Q195 HydrophobicContact CB-CG 3.91Å; V160-Q195 HydrophobicContact CG1-CB 4.49Å; V160-Q195 HydrophobicContact CG2-CG 4.33Å; Q191-Q195 PolarHBondContact O-N 3.49Å; V192-Q195 PolarHBondContact O-N 2.95Å; Q195-R197 VanDerWaalsContact C-N 3.3Å; Q195-R197 PolarHBondContact O-N 2.85Å; Q195-I198 PolarHBondContact O-N 3Å; Q195-C199 WeakPolarHBondContact O-CB 3.44Å; Q195-C199 PolarHBondContact O-N 2.85Å; Q195-C199 PolarHBondContact O-SG 3.36Å; Q195-C199 VanDerWaalsContact O-SG 3.42Å
196	K	85.7	Confident	83.3	Confident	162 Å²	162	44.3 Å²	44.3	70%	0.704	23%	0.23	S	C	*	.	H	α-helix	trans	-57.5	-42.4	-178.7	-172.9	176.5	-178.5	178.7	0	111.9	V192 S200	V192-K196 WeakPolarHBondContact O-CB 3.25Å; V192-K196 PolarHBondContact O-N 2.83Å; K196-S200 WeakPolarHBondContact O-CB 3.46Å; K196-S200 PolarHBondContact O-N 3.33Å
197	R	81.3	Confident	83.8	Confident	60 Å²	60	45.4 Å²	45.4	23%	0.226	24%	0.236	C	C	.	.	H	α-helix	trans	-73.2	-44.9	-178.7	-172.6	63.1	170.7	164.1	-3.6	112.7	M67 G193 A194 Q195 C199 S200 Q201	M67-R197 HydrophobicContact CB-CB 4.34Å; M67-R197 HydrophobicContact CB-CG 4.05Å; M67-R197 HydrophobicContact CG-CB 4.11Å; M67-R197 HydrophobicContact CG-CG 4.35Å; G193-R197 WeakPolarHBondContact O-CB 2.86Å; G193-R197 PolarHBondContact O-N 3.35Å; A194-R197 PolarHBondContact O-N 2.98Å; Q195-R197 VanDerWaalsContact C-N 3.3Å; Q195-R197 PolarHBondContact O-N 2.85Å; R197-C199 VanDerWaalsContact C-N 3.34Å; R197-S200 PolarHBondContact O-N 3.37Å; R197-Q201 HydrophobicContact CG-CG 4.48Å; R197-Q201 VanDerWaalsContact O-CG 3.3Å; R197-Q201 WeakPolarHBondContact O-CG 3.37Å; R197-Q201 PolarHBondContact O-N 2.76Å
198	I	82.9	Confident	84	Confident	27 Å²	27	50.1 Å²	50.1	14%	0.138	26%	0.26	C	S	.	.	H	α-helix	trans	-60.9	-47.3	179.4	-69	167.5	0	0	0	109.5	L134 L136 V160 A194 Q195 Q201 M202	L134-I198 HydrophobicContact CD1-CD1 3.89Å; L134-I198 HydrophobicContact CD2-CD1 4.4Å; L136-I198 HydrophobicContact CD1-CG2 3.91Å; L136-I198 HydrophobicContact CD2-CG2 4.08Å; V160-I198 HydrophobicContact CG1-CD1 4.21Å; V160-I198 HydrophobicContact CG2-CB 4.13Å; V160-I198 HydrophobicContact CG2-CG2 3.91Å; A194-I198 WeakPolarHBondContact O-CB 3.43Å; A194-I198 VanDerWaalsContact O-CG1 3.27Å; A194-I198 WeakPolarHBondContact O-CG1 3.38Å; A194-I198 PolarHBondContact O-N 3.45Å; Q195-I198 PolarHBondContact O-N 3Å; I198-Q201 PolarHBondContact O-N 3.18Å; I198-M202 WeakPolarHBondContact O-CG 3.28Å; I198-M202 PolarHBondContact O-N 2.91Å
199	C	89.3	Confident	83.8	Confident	16 Å²	16	50.4 Å²	50.4	11%	0.108	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-44.1	178.1	-67.1	0	0	0	0	112.6	C158 Q195 R197 Q201 M202 E203	C158-C199 HydrophobicContact CB-CB 3.68Å; C158-C199 WeakPolarHBondContact CB-SG 3.28Å; C158-C199 PolarHBondContact O-SG 3.42Å; C158-C199 VanDerWaalsContact O-SG 3.38Å; C158-C199 WeakPolarHBondContact SG-CA 3.27Å; C158-C199 WeakPolarHBondContact SG-CB 3.45Å; C158-C199 CovalentContact SG-SG 2.04Å; C158-C199 PolarHBondContact SG-SG 3.36Å; Q195-C199 WeakPolarHBondContact O-CB 3.44Å; Q195-C199 PolarHBondContact O-N 2.85Å; Q195-C199 PolarHBondContact O-SG 3.36Å; Q195-C199 VanDerWaalsContact O-SG 3.42Å; R197-C199 VanDerWaalsContact C-N 3.34Å; C199-Q201 VanDerWaalsContact C-N 3.27Å; C199-Q201 PolarHBondContact O-N 2.91Å; C199-M202 PolarHBondContact O-N 3.02Å; C199-M202 VanDerWaalsContact O-N 3.11Å; C199-E203 WeakPolarHBondContact O-CB 3.49Å; C199-E203 PolarHBondContact O-N 3.24Å
200	S	85.4	Confident	83.9	Confident	45 Å²	45	47.5 Å²	47.5	32%	0.315	24%	0.241	S	C	.	.	H	α-helix	trans	-60.4	-34.3	175.3	169.8	0	0	0	0	113	K196 R197 Q204	K196-S200 WeakPolarHBondContact O-CB 3.46Å; K196-S200 PolarHBondContact O-N 3.33Å; R197-S200 PolarHBondContact O-N 3.37Å; S200-Q204 WeakPolarHBondContact O-CB 3.39Å; S200-Q204 PolarHBondContact O-N 3.3Å
201	Q	79.9	Confident	84.1	Confident	50 Å²	50	47.7 Å²	47.7	23%	0.234	24%	0.243	C	C	.	.	H	α-helix	trans	-72.1	-38.1	174.4	-71.7	-70.3	-75.7	0	0	112.3	R197 I198 C199 F205	R197-Q201 HydrophobicContact CG-CG 4.48Å; R197-Q201 VanDerWaalsContact O-CG 3.3Å; R197-Q201 WeakPolarHBondContact O-CG 3.37Å; R197-Q201 PolarHBondContact O-N 2.76Å; I198-Q201 PolarHBondContact O-N 3.18Å; C199-Q201 VanDerWaalsContact C-N 3.27Å; C199-Q201 PolarHBondContact O-N 2.91Å; Q201-F205 WeakPolarHBondContact O-CB 3.05Å; Q201-F205 PolarHBondContact O-N 3.15Å; Q201-F205 VanDerWaalsContact O-N 3.1Å
202	M	83.6	Confident	84.1	Confident	20 Å²	20	45.9 Å²	45.9	10%	0.099	24%	0.241	C	C	.	.	H	α-helix	trans	-65.4	-46.3	174.6	-70	-59.1	105.8	0	0	111.3	F100 L136 V138 M155 I198 C199 Q204 F205 I206 F519	F100-M202 HydrophobicContact CZ-SD 4.35Å; L136-M202 HydrophobicContact CD2-CG 4.22Å; L136-M202 HydrophobicContact CD2-SD 4.28Å; V138-M202 HydrophobicContact CG2-CG 4.39Å; M155-M202 HydrophobicContact SD-CB 3.86Å; I198-M202 WeakPolarHBondContact O-CG 3.28Å; I198-M202 PolarHBondContact O-N 2.91Å; C199-M202 PolarHBondContact O-N 3.02Å; C199-M202 VanDerWaalsContact O-N 3.11Å; M202-Q204 PolarHBondContact O-N 2.84Å; M202-F205 PolarHBondContact O-N 3.1Å; M202-F205 VanDerWaalsContact O-N 3.15Å; M202-I206 HydrophobicContact CB-CD1 4.36Å; M202-I206 WeakPolarHBondContact O-CB 3.4Å; M202-I206 WeakPolarHBondContact O-CD1 3.49Å; M202-I206 WeakPolarHBondContact O-CG1 3.27Å; M202-I206 PolarHBondContact O-N 3.48Å; M202-F519 HydrophobicContact CE-CZ 4Å
203	E	88.4	Confident	84	Confident	96 Å²	96	45.8 Å²	45.8	45%	0.449	23%	0.231	S	C	.	.	H	α-helix	trans	-55.5	-51.1	175.3	-168.2	-178.9	169.6	0	0	110.7	M155 C199 F205 I206 D207	M155-E203 HydrophobicContact CE-CB 3.57Å; M155-E203 HydrophobicContact CE-CG 3.95Å; M155-E203 HydrophobicContact SD-CB 4.03Å; C199-E203 WeakPolarHBondContact O-CB 3.49Å; C199-E203 PolarHBondContact O-N 3.24Å; E203-F205 VanDerWaalsContact C-N 3.25Å; E203-F205 PolarHBondContact O-N 3.24Å; E203-I206 PolarHBondContact O-N 3.07Å; E203-D207 VanDerWaalsContact O-CB 3.27Å; E203-D207 WeakPolarHBondContact O-CB 3.5Å; E203-D207 PolarHBondContact O-N 2.83Å
204	Q	83.8	Confident	84.1	Confident	48 Å²	48	48.1 Å²	48.1	22%	0.224	24%	0.241	C	C	.	.	I	π-helix	trans	-59.1	-37.9	178.3	-176.5	173.1	24.5	0	0	112.5	S200 M202 N208 A522	S200-Q204 WeakPolarHBondContact O-CB 3.39Å; S200-Q204 PolarHBondContact O-N 3.3Å; M202-Q204 PolarHBondContact O-N 2.84Å; Q204-N208 VanDerWaalsContact O-CB 3.28Å; Q204-N208 WeakPolarHBondContact O-CB 3.35Å; Q204-N208 PolarHBondContact O-N 3.26Å; Q204-N208 PolarHBondContact O-ND2 2.96Å; Q204-A522 PolarHBondContact NE2-O 3.14Å; Q204-A522 PolarHBondContact OE1-O 3.45Å
205	F	81.2	Confident	84	Confident	16 Å²	16	53.1 Å²	53.1	7%	0.07	26%	0.264	C	S	.	.	I	π-helix	trans	-71.1	-48.2	177.6	173.4	-108.3	0	0	0	112	Q201 M202 E203 T209 L210 F519 A522	Q201-F205 WeakPolarHBondContact O-CB 3.05Å; Q201-F205 PolarHBondContact O-N 3.15Å; Q201-F205 VanDerWaalsContact O-N 3.1Å; M202-F205 PolarHBondContact O-N 3.1Å; M202-F205 VanDerWaalsContact O-N 3.15Å; E203-F205 VanDerWaalsContact C-N 3.25Å; E203-F205 PolarHBondContact O-N 3.24Å; F205-T209 HydrophobicContact CD2-CG2 4.2Å; F205-T209 HydrophobicContact CE2-CG2 4.11Å; F205-T209 WeakPolarHBondContact O-CA 3.28Å; F205-T209 WeakPolarHBondContact O-CB 3.16Å; F205-T209 PolarHBondContact O-N 3.2Å; F205-L210 HydrophobicContact CD1-CD1 4.14Å; F205-L210 HydrophobicContact CD1-CG 4.3Å; F205-L210 HydrophobicContact CE1-CD1 3.44Å; F205-L210 VanDerWaalsContact CE1-CD1 3.44Å; F205-L210 HydrophobicContact CE1-CD2 4.1Å; F205-L210 HydrophobicContact CE1-CG 3.68Å; F205-L210 HydrophobicContact CE2-CD2 4.1Å; F205-L210 HydrophobicContact CE2-CG 4.14Å; F205-L210 HydrophobicContact CZ-CD1 3.78Å; F205-L210 HydrophobicContact CZ-CD2 3.51Å; F205-L210 HydrophobicContact CZ-CG 3.55Å; F205-L210 PolarHBondContact O-N 2.82Å; F205-F519 AromaticContact CD1-CD2 3.74Å; F205-F519 HydrophobicContact CD1-CD2 3.74Å; F205-F519 AromaticContact CD1-CE2 3.51Å; F205-F519 HydrophobicContact CD1-CE2 3.51Å; F205-F519 HydrophobicContact CD2-CB 4.38Å; F205-F519 AromaticContact CD2-CD2 3.65Å; F205-F519 HydrophobicContact CD2-CD2 3.65Å; F205-F519 HydrophobicContact CD2-CE2 4.14Å; F205-F519 HydrophobicContact CD2-CG 4.18Å; F205-F519 AromaticContact CE1-CD2 3.4Å; F205-F519 HydrophobicContact CE1-CD2 3.4Å; F205-F519 VanDerWaalsContact CE1-CD2 3.4Å; F205-F519 AromaticContact CE1-CE2 3.48Å; F205-F519 HydrophobicContact CE1-CE2 3.48Å; F205-F519 VanDerWaalsContact CE1-CE2 3.48Å; F205-F519 HydrophobicContact CE2-CB 3.87Å; F205-F519 AromaticContact CE2-CD2 3.34Å; F205-F519 HydrophobicContact CE2-CD2 3.34Å; F205-F519 HydrophobicContact CE2-CE2 4.15Å; F205-F519 AromaticContact CE2-CG 3.94Å; F205-F519 HydrophobicContact CE2-CG 3.94Å; F205-F519 AromaticContact CG-CD2 3.85Å; F205-F519 HydrophobicContact CG-CD2 3.85Å; F205-F519 AromaticContact CG-CE2 3.85Å; F205-F519 HydrophobicContact CG-CE2 3.85Å; F205-F519 HydrophobicContact CZ-CB 4.36Å; F205-F519 AromaticContact CZ-CD2 3.23Å; F205-F519 HydrophobicContact CZ-CD2 3.23Å; F205-F519 AromaticContact CZ-CE2 3.85Å; F205-F519 HydrophobicContact CZ-CE2 3.85Å; F205-F519 HydrophobicContact CZ-CG 4.21Å; F205-A522 HydrophobicContact CB-CB 4.46Å; F205-A522 HydrophobicContact CD2-CB 4.43Å
206	I	86.7	Confident	83.7	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.01	28%	0.277	C	S	.	.	I	π-helix	trans	-68.2	-56.6	-177.2	-66.6	158.2	0	0	0	110	V138 I140 L153 M155 M202 E203 L210 S211	V138-I206 HydrophobicContact CG1-CD1 3.88Å; I140-I206 HydrophobicContact CD1-CD1 3.73Å; I140-I206 HydrophobicContact CD1-CG1 3.97Å; I140-I206 HydrophobicContact CD1-CG2 4.29Å; I140-I206 HydrophobicContact CG1-CD1 3.85Å; I140-I206 HydrophobicContact CG1-CG1 4.46Å; I140-I206 HydrophobicContact CG1-CG2 4.35Å; I140-I206 HydrophobicContact CG2-CG2 3.91Å; L153-I206 HydrophobicContact CB-CG2 3.98Å; M155-I206 HydrophobicContact CB-CD1 4.07Å; M155-I206 HydrophobicContact CB-CG2 4.42Å; M155-I206 HydrophobicContact CG-CD1 4Å; M155-I206 HydrophobicContact SD-CD1 4.28Å; M202-I206 HydrophobicContact CB-CD1 4.36Å; M202-I206 WeakPolarHBondContact O-CB 3.4Å; M202-I206 WeakPolarHBondContact O-CD1 3.49Å; M202-I206 WeakPolarHBondContact O-CG1 3.27Å; M202-I206 PolarHBondContact O-N 3.48Å; E203-I206 PolarHBondContact O-N 3.07Å; I206-L210 HydrophobicContact CG1-CD1 4.49Å; I206-L210 WeakPolarHBondContact O-CB 3.39Å; I206-L210 PolarHBondContact O-N 3Å; I206-S211 PolarHBondContact O-N 2.85Å
207	D	87.6	Confident	83.5	Confident	42 Å²	42	49.8 Å²	49.8	23%	0.225	26%	0.262	C	S	.	.	I	π-helix	trans	-74.6	-35.4	-168.5	-62.8	11.7	0	0	0	111.7	V154 M155 E203 S211	V154-D207 WeakPolarHBondContact CA-OD1 3.36Å; M155-D207 PolarHBondContact N-OD1 3.11Å; E203-D207 VanDerWaalsContact O-CB 3.27Å; E203-D207 WeakPolarHBondContact O-CB 3.5Å; E203-D207 PolarHBondContact O-N 2.83Å; D207-S211 WeakPolarHBondContact O-CB 3.48Å
208	N	84.2	Confident	83.5	Confident	111 Å²	111	50.6 Å²	50.6	59%	0.594	28%	0.276	S	S	*	.	I	π-helix	trans	-99.8	-41.7	-177.9	-55	-59.7	0	0	0	113.3	Q204 G212	Q204-N208 VanDerWaalsContact O-CB 3.28Å; Q204-N208 WeakPolarHBondContact O-CB 3.35Å; Q204-N208 PolarHBondContact O-N 3.26Å; Q204-N208 PolarHBondContact O-ND2 2.96Å; N208-G212 PolarHBondContact O-N 3.12Å
209	T	78.9	Confident	83.7	Confident	35 Å²	35	52.8 Å²	52.8	22%	0.215	29%	0.285	C	S	.	.	I	π-helix	trans	-86.5	-48.8	-173.4	-49.5	0	0	0	0	111.2	F205 Y213 R518	F205-T209 HydrophobicContact CD2-CG2 4.2Å; F205-T209 HydrophobicContact CE2-CG2 4.11Å; F205-T209 WeakPolarHBondContact O-CA 3.28Å; F205-T209 WeakPolarHBondContact O-CB 3.16Å; F205-T209 PolarHBondContact O-N 3.2Å; T209-Y213 WeakPolarHBondContact O-CB 3.46Å; T209-Y213 PolarHBondContact O-N 3.21Å; T209-R518 HydrophobicContact CG2-CB 4.13Å
210	L	81.9	Confident	83.7	Confident	23 Å²	23	55.3 Å²	55.3	12%	0.12	29%	0.294	C	S	.	.	I	π-helix	trans	-77.3	-47.8	-179.1	-64.7	-176.3	0	0	0	112.4	L153 F205 I206 G212 Y213 L214 F515	L153-L210 HydrophobicContact CD1-CB 4Å; L153-L210 HydrophobicContact CD1-CD1 4.3Å; F205-L210 HydrophobicContact CD1-CD1 4.14Å; F205-L210 HydrophobicContact CD1-CG 4.3Å; F205-L210 HydrophobicContact CE1-CD1 3.44Å; F205-L210 VanDerWaalsContact CE1-CD1 3.44Å; F205-L210 HydrophobicContact CE1-CD2 4.1Å; F205-L210 HydrophobicContact CE1-CG 3.68Å; F205-L210 HydrophobicContact CE2-CD2 4.1Å; F205-L210 HydrophobicContact CE2-CG 4.14Å; F205-L210 HydrophobicContact CZ-CD1 3.78Å; F205-L210 HydrophobicContact CZ-CD2 3.51Å; F205-L210 HydrophobicContact CZ-CG 3.55Å; F205-L210 PolarHBondContact O-N 2.82Å; I206-L210 HydrophobicContact CG1-CD1 4.49Å; I206-L210 WeakPolarHBondContact O-CB 3.39Å; I206-L210 PolarHBondContact O-N 3Å; L210-G212 VanDerWaalsContact C-N 3.33Å; L210-G212 PolarHBondContact O-N 3.29Å; L210-Y213 WeakPolarHBondContact O-CB 3.41Å; L210-Y213 PolarHBondContact O-N 2.81Å; L210-L214 WeakPolarHBondContact O-CG 3.44Å; L210-L214 PolarHBondContact O-N 2.93Å; L210-F515 HydrophobicContact CD2-CE1 4.35Å; L210-F515 HydrophobicContact CD2-CE2 3.49Å; L210-F515 VanDerWaalsContact CD2-CE2 3.49Å; L210-F515 HydrophobicContact CD2-CZ 3.28Å
211	S	85.6	Confident	83.8	Confident	5 Å²	5	56.4 Å²	56.4	4%	0.035	29%	0.293	C	S	.	.	H	α-helix	trans	-59.3	-47.8	176.7	-160	0	0	0	0	111	S152 L153 I206 D207 Y213 L214 E215	S152-S211 VanDerWaalsContact CA-OG 3.25Å; S152-S211 WeakPolarHBondContact CA-OG 3.38Å; S152-S211 WeakPolarHBondContact CB-OG 3.24Å; L153-S211 PolarHBondContact N-OG 3.42Å; I206-S211 PolarHBondContact O-N 2.85Å; D207-S211 WeakPolarHBondContact O-CB 3.48Å; S211-Y213 PolarHBondContact O-N 3.36Å; S211-L214 PolarHBondContact O-N 2.84Å; S211-E215 WeakPolarHBondContact O-CG 3.4Å; S211-E215 PolarHBondContact O-N 2.85Å; S211-E215 PolarHBondContact OG-OE1 3.39Å
212	G	84.5	Confident	84.2	Confident	26 Å²	26	55.7 Å²	55.7	27%	0.268	29%	0.293	S	S	.	.	H	α-helix	trans	-57.4	-37.5	177	0	0	0	0	0	112.8	N208 L210 T216	N208-G212 PolarHBondContact O-N 3.12Å; L210-G212 VanDerWaalsContact C-N 3.33Å; L210-G212 PolarHBondContact O-N 3.29Å; G212-T216 WeakPolarHBondContact O-CG2 3.4Å; G212-T216 PolarHBondContact O-N 3.23Å; G212-T216 PolarHBondContact O-OG1 3.41Å
213	Y	81.3	Confident	84.1	Confident	94 Å²	94	56.1 Å²	56.1	37%	0.369	30%	0.296	S	S	.	.	H	α-helix	trans	-64.8	-47	174.1	179.8	-109.8	0	0	0	112.5	T209 L210 S211 E215 T216 V217	T209-Y213 WeakPolarHBondContact O-CB 3.46Å; T209-Y213 PolarHBondContact O-N 3.21Å; L210-Y213 WeakPolarHBondContact O-CB 3.41Å; L210-Y213 PolarHBondContact O-N 2.81Å; S211-Y213 PolarHBondContact O-N 3.36Å; Y213-E215 VanDerWaalsContact C-N 3.29Å; Y213-E215 PolarHBondContact O-N 2.97Å; Y213-T216 PolarHBondContact O-N 2.99Å; Y213-T216 VanDerWaalsContact O-N 3.14Å; Y213-T216 PolarHBondContact O-OG1 2.94Å; Y213-V217 PolarHBondContact O-N 2.61Å
214	L	83.7	Confident	83.2	Confident	59 Å²	59	53 Å²	53	31%	0.309	29%	0.286	S	S	.	.	H	α-helix	trans	-64.1	-35	-179.9	-67.1	175.3	0	0	0	112.5	V151 L153 L210 S211 T216 V217	V151-L214 HydrophobicContact CG1-CD1 4.49Å; V151-L214 VanDerWaalsContact O-CB 3.31Å; V151-L214 WeakPolarHBondContact O-CB 3.34Å; L153-L214 HydrophobicContact CD1-CD1 3.66Å; L153-L214 HydrophobicContact CD2-CD1 4.29Å; L153-L214 HydrophobicContact CG-CD1 3.57Å; L210-L214 WeakPolarHBondContact O-CG 3.44Å; L210-L214 PolarHBondContact O-N 2.93Å; S211-L214 PolarHBondContact O-N 2.84Å; L214-T216 VanDerWaalsContact C-N 3.3Å; L214-T216 PolarHBondContact O-N 2.92Å; L214-V217 PolarHBondContact O-N 3.01Å
215	E	80.9	Confident	82.3	Confident	104 Å²	104	57.8 Å²	57.8	49%	0.486	31%	0.308	S	S	.	.	H	α-helix	trans	-69.4	-26.8	175.5	-71.7	168.6	-153.9	0	0	112.9	S211 Y213 V217	S211-E215 WeakPolarHBondContact O-CG 3.4Å; S211-E215 PolarHBondContact O-N 2.85Å; S211-E215 PolarHBondContact OG-OE1 3.39Å; Y213-E215 VanDerWaalsContact C-N 3.29Å; Y213-E215 PolarHBondContact O-N 2.97Å; E215-V217 VanDerWaalsContact C-N 3.34Å
216	T	81.2	Confident	81.1	Confident	101 Å²	101	58.5 Å²	58.5	62%	0.62	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-8.9	177.3	61.8	0	0	0	0	114.4	G212 Y213 L214 P218	G212-T216 WeakPolarHBondContact O-CG2 3.4Å; G212-T216 PolarHBondContact O-N 3.23Å; G212-T216 PolarHBondContact O-OG1 3.41Å; Y213-T216 PolarHBondContact O-N 2.99Å; Y213-T216 VanDerWaalsContact O-N 3.14Å; Y213-T216 PolarHBondContact O-OG1 2.94Å; L214-T216 VanDerWaalsContact C-N 3.3Å; L214-T216 PolarHBondContact O-N 2.92Å; T216-P218 WeakPolarHBondContact O-CD 3.18Å
217	V	80.6	Confident	79.6	Confident	65 Å²	65	59.6 Å²	59.6	39%	0.394	32%	0.323	S	S	.	.	S	Bend	trans	-67.6	118.8	179.9	-179.8	0	0	0	0	108.9	Y213 L214 E215 H219	Y213-V217 PolarHBondContact O-N 2.61Å; L214-V217 PolarHBondContact O-N 3.01Å; E215-V217 VanDerWaalsContact C-N 3.34Å; V217-H219 PolarHBondContact O-N 2.64Å
218	P	82.5	Confident	77.9	Confident	78 Å²	78	59.5 Å²	59.5	51%	0.506	33%	0.325	S	S	.	.			trans	-63.3	136.8	177.3	26.5	-33.1	0	0	0	109.5	T216 F221	T216-P218 WeakPolarHBondContact O-CD 3.18Å; P218-F221 HydrophobicContact CG-CE1 3.96Å; P218-F221 HydrophobicContact CG-CZ 4.13Å; P218-F221 WeakPolarHBondContact O-CE2 3.01Å; P218-F221 WeakPolarHBondContact O-CZ 3.25Å
219	H	87.5	Confident	76.4	Confident	72 Å²	72	60.5 Å²	60.5	33%	0.333	33%	0.33	S	S	.	.	S	Bend	trans	-94.5	-12.6	175.6	55.8	-89.1	0	0	0	112.3	V217 D254 L255 S256	V217-H219 PolarHBondContact O-N 2.64Å; H219-D254 IonicContact CD2-OD1 3.03Å; H219-L255 WeakPolarHBondContact O-CA 3.33Å; H219-L255 PolarHBondContact O-N 3.14Å; H219-S256 PolarHBondContact CD2-OG 3.02Å
220	K	89.5	Confident	74.9	Confident	70 Å²	70	66.6 Å²	66.6	30%	0.304	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.8	176.3	-61.8	-176	179.6	-176.8	0	110.6	M252 V253 D254 G280	K220-M252 HydrophobicContact CB-CE 3.66Å; K220-V253 VanDerWaalsContact CA-O 3.3Å; K220-V253 WeakPolarHBondContact CA-O 3.1Å; K220-D254 VanDerWaalsContact CE-OD2 3.22Å; K220-D254 WeakPolarHBondContact CE-OD2 3.34Å; K220-D254 HydrophobicContact CG-CB 4.45Å; K220-D254 IonicContact NZ-OD2 3.48Å; K220-G280 PolarHBondContact NZ-O 3.42Å
221	F	87	Confident	73.4	Confident	67 Å²	67	66.3 Å²	66.3	29%	0.294	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	136.1	-176.9	-62.1	-91.1	0	0	0	110.9	P218 M252 V253 L255	P218-F221 HydrophobicContact CG-CE1 3.96Å; P218-F221 HydrophobicContact CG-CZ 4.13Å; P218-F221 WeakPolarHBondContact O-CE2 3.01Å; P218-F221 WeakPolarHBondContact O-CZ 3.25Å; F221-M252 CarbonylContact O-C 3.53Å; F221-M252 WeakPolarHBondContact O-CA 3.31Å; F221-V253 HydrophobicContact CB-CG1 3.93Å; F221-V253 PolarHBondContact N-O 3.23Å; F221-V253 PolarHBondContact O-N 3.41Å; F221-L255 HydrophobicContact CD2-CD1 3.77Å; F221-L255 HydrophobicContact CD2-CG 4.27Å; F221-L255 HydrophobicContact CE2-CB 4.39Å; F221-L255 HydrophobicContact CE2-CD1 3.9Å
222	P	87	Confident	71.5	Confident	35 Å²	35	68.8 Å²	68.8	23%	0.227	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	132.4	171.6	29.8	-33.8	0	0	0	110.1	A224 Q225 L251	P222-A224 PolarHBondContact O-N 3.35Å; P222-Q225 HydrophobicContact CG-CB 4.3Å; P222-Q225 HydrophobicContact CG-CG 3.7Å; P222-Q225 PolarHBondContact O-N 3.49Å; P222-L251 WeakPolarHBondContact CA-O 3.41Å
223	I	81.6	Confident	69.7	Low	30 Å²	30	69.6 Å²	69.6	15%	0.154	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-64.7	-31.6	-178.9	-64.3	-179.8	0	0	0	111.1	Q225 A226 I227 L251 V253 V276 L314	I223-Q225 PolarHBondContact O-N 2.85Å; I223-A226 WeakPolarHBondContact O-CA 3.38Å; I223-A226 WeakPolarHBondContact O-CB 3.26Å; I223-A226 PolarHBondContact O-N 2.81Å; I223-I227 HydrophobicContact CG2-CD1 3.83Å; I223-I227 HydrophobicContact CG2-CG1 4.36Å; I223-I227 PolarHBondContact O-N 2.95Å; I223-L251 HydrophobicContact CB-CB 4.47Å; I223-L251 HydrophobicContact CD1-CB 3.93Å; I223-L251 HydrophobicContact CG1-CB 4.33Å; I223-L251 PolarHBondContact N-O 3.19Å; I223-V253 HydrophobicContact CG1-CB 4.47Å; I223-V276 HydrophobicContact CD1-CB 4.19Å; I223-V276 HydrophobicContact CD1-CG1 3.38Å; I223-V276 HydrophobicContact CD1-CG2 3.74Å; I223-L314 HydrophobicContact CD1-CD1 4.09Å
224	A	70.9	Confident	67.9	Low	29 Å²	29	69.1 Å²	69.1	24%	0.24	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-61	-24.9	178.6	0	0	0	0	0	113.8	P222 A226 I227 R249	P222-A224 PolarHBondContact O-N 3.35Å; A224-A226 PolarHBondContact O-N 3.05Å; A224-I227 PolarHBondContact O-N 3.06Å; A224-R249 HydrophobicContact CB-CB 4.36Å; A224-R249 HydrophobicContact CB-CG 4.03Å
225	Q	65.1	Low	65.9	Low	150 Å²	150	71.4 Å²	71.4	70%	0.701	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-66.1	-23.5	172.5	-78.1	175.7	1.2	0	0	112.5	P222 I223	P222-Q225 HydrophobicContact CG-CB 4.3Å; P222-Q225 HydrophobicContact CG-CG 3.7Å; P222-Q225 PolarHBondContact O-N 3.49Å; I223-Q225 PolarHBondContact O-N 2.85Å
226	A	56.2	Low	64.1	Low	31 Å²	31	67.8 Å²	67.8	26%	0.256	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-87.7	-10.8	176.3	0	0	0	0	0	113.6	I223 A224 V478 P480	I223-A226 WeakPolarHBondContact O-CA 3.38Å; I223-A226 WeakPolarHBondContact O-CB 3.26Å; I223-A226 PolarHBondContact O-N 2.81Å; A224-A226 PolarHBondContact O-N 3.05Å; A226-V478 VanDerWaalsContact O-O 3.14Å; A226-P480 HydrophobicContact CB-CB 4.04Å; A226-P480 HydrophobicContact CB-CG 3.71Å
227	I	55	Low	62.5	Low	25 Å²	25	63.8 Å²	63.8	13%	0.128	36%	0.359	C	S	.	.	S	Bend	trans	-114.4	108	-178	-49.8	171	0	0	0	107.5	I223 A224 D229 T231 F232 I477	I223-I227 HydrophobicContact CG2-CD1 3.83Å; I223-I227 HydrophobicContact CG2-CG1 4.36Å; I223-I227 PolarHBondContact O-N 2.95Å; A224-I227 PolarHBondContact O-N 3.06Å; I227-D229 PolarHBondContact O-N 2.94Å; I227-T231 HydrophobicContact CG2-CG2 3.99Å; I227-F232 HydrophobicContact CB-CE2 3.8Å; I227-F232 HydrophobicContact CB-CZ 4.43Å; I227-F232 HydrophobicContact CD1-CE2 3.99Å; I227-F232 HydrophobicContact CD1-CZ 3.93Å; I227-F232 HydrophobicContact CG1-CE2 4.5Å; I227-F232 HydrophobicContact CG2-CD2 3.95Å; I227-F232 HydrophobicContact CG2-CE2 3.19Å; I227-F232 HydrophobicContact CG2-CZ 3.67Å; I227-I477 HydrophobicContact CG1-CG2 4.36Å; I227-I477 HydrophobicContact CG2-CG2 4.47Å
228	S	51.6	Low	60.9	Low	39 Å²	39	64.9 Å²	64.9	27%	0.273	37%	0.368	S	S	.	.			trans	-47.5	138.2	176.9	179.9	0	0	0	0	111.1	Q230 T231	S228-Q230 PolarHBondContact O-N 3.25Å; S228-Q230 PolarHBondContact OG-N 2.87Å; S228-T231 WeakPolarHBondContact O-CB 3.27Å; S228-T231 PolarHBondContact O-N 3.3Å; S228-T231 PolarHBondContact O-OG1 2.78Å
229	D	51.8	Low	59.3	Low	132 Å²	132	63.2 Å²	63.2	71%	0.706	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-54.4	-23.2	174.7	-79.3	-38.8	0	0	0	112.2	I227	I227-D229 PolarHBondContact O-N 2.94Å
230	Q	48.6	Very low	57.9	Low	163 Å²	163	61.8 Å²	61.8	76%	0.762	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-68.2	-30.8	176.1	-62.4	-178.6	13.5	0	0	113.4	S228 F232 S233	S228-Q230 PolarHBondContact O-N 3.25Å; S228-Q230 PolarHBondContact OG-N 2.87Å; Q230-F232 PolarHBondContact O-N 3.25Å; Q230-S233 PolarHBondContact O-N 3.16Å
231	T	48.6	Very low	56.4	Low	17 Å²	17	61.3 Å²	61.3	10%	0.104	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-66.3	-22.1	-178.9	-47.6	0	0	0	0	112	I227 S228 I477	I227-T231 HydrophobicContact CG2-CG2 3.99Å; S228-T231 WeakPolarHBondContact O-CB 3.27Å; S228-T231 PolarHBondContact O-N 3.3Å; S228-T231 PolarHBondContact O-OG1 2.78Å; T231-I477 HydrophobicContact CG2-CG1 4.4Å
232	F	47.5	Very low	55.2	Low	58 Å²	58	67.4 Å²	67.4	25%	0.254	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-108.9	22.1	179.8	-63.3	-63.4	0	0	0	114.1	I227 Q230 L237 L248	I227-F232 HydrophobicContact CB-CE2 3.8Å; I227-F232 HydrophobicContact CB-CZ 4.43Å; I227-F232 HydrophobicContact CD1-CE2 3.99Å; I227-F232 HydrophobicContact CD1-CZ 3.93Å; I227-F232 HydrophobicContact CG1-CE2 4.5Å; I227-F232 HydrophobicContact CG2-CD2 3.95Å; I227-F232 HydrophobicContact CG2-CE2 3.19Å; I227-F232 HydrophobicContact CG2-CZ 3.67Å; Q230-F232 PolarHBondContact O-N 3.25Å; F232-L237 HydrophobicContact CD1-CD1 4.14Å; F232-L248 HydrophobicContact CD1-CD1 4.26Å; F232-L248 HydrophobicContact CE1-CD1 3.39Å; F232-L248 HydrophobicContact CE2-CD1 3.98Å; F232-L248 HydrophobicContact CZ-CD1 3.24Å
233	S	46	Very low	54.4	Low	43 Å²	43	71.8 Å²	71.8	30%	0.301	40%	0.396	S	S	.	.			trans	-58.8	133.3	171.1	-175	0	0	0	0	109.8	Q230 S235 A236 L237	Q230-S233 PolarHBondContact O-N 3.16Å; S233-S235 PolarHBondContact O-N 2.86Å; S233-S235 VanDerWaalsContact O-N 3.12Å; S233-S235 PolarHBondContact OG-OG 2.89Å; S233-A236 WeakPolarHBondContact O-CA 3.31Å; S233-A236 VanDerWaalsContact O-CB 3.27Å; S233-A236 WeakPolarHBondContact O-CB 3.36Å; S233-A236 PolarHBondContact O-N 3.43Å; S233-L237 PolarHBondContact O-N 2.93Å
234	P	43	Very low	54.1	Low	83 Å²	83	71.2 Å²	71.2	54%	0.539	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-22.1	177.8	21.7	-31.6	0	0	0	113.2	A236	P234-A236 VanDerWaalsContact C-N 3.27Å; P234-A236 PolarHBondContact O-N 2.96Å
235	S	42	Very low	54.3	Low	107 Å²	107	70.8 Å²	70.8	75%	0.748	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-22.1	170.1	49.1	0	0	0	0	113.6	S233	S233-S235 PolarHBondContact O-N 2.86Å; S233-S235 VanDerWaalsContact O-N 3.12Å; S233-S235 PolarHBondContact OG-OG 2.89Å
236	A	42.1	Very low	54.8	Low	28 Å²	28	67.6 Å²	67.6	23%	0.231	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-29.1	-178.8	0	0	0	0	0	112.3	S233 P234 Q475	S233-A236 WeakPolarHBondContact O-CA 3.31Å; S233-A236 VanDerWaalsContact O-CB 3.27Å; S233-A236 WeakPolarHBondContact O-CB 3.36Å; S233-A236 PolarHBondContact O-N 3.43Å; P234-A236 VanDerWaalsContact C-N 3.27Å; P234-A236 PolarHBondContact O-N 2.96Å; A236-Q475 PolarHBondContact O-NE2 3.19Å
237	L	48.2	Very low	56.1	Low	17 Å²	17	68 Å²	68	9%	0.089	37%	0.374	C	S	.	.			trans	-133.3	76.5	-176.1	-82.2	157	0	0	0	110.7	F232 S233 L239 L240 L472	F232-L237 HydrophobicContact CD1-CD1 4.14Å; S233-L237 PolarHBondContact O-N 2.93Å; L237-L239 PolarHBondContact O-N 3.36Å; L237-L240 HydrophobicContact CB-CB 4.15Å; L237-L240 HydrophobicContact CB-CD1 4.11Å; L237-L240 HydrophobicContact CD1-CD1 3.6Å; L237-L240 HydrophobicContact CD2-CD1 3.65Å; L237-L240 HydrophobicContact CG-CD1 3.97Å; L237-L240 PolarHBondContact O-N 3.33Å; L237-L240 VanDerWaalsContact O-N 3.15Å; L237-L472 HydrophobicContact CD1-CD1 3.82Å; L237-L472 HydrophobicContact CD2-CB 4.42Å; L237-L472 HydrophobicContact CD2-CD1 3.48Å; L237-L472 VanDerWaalsContact CD2-CD1 3.48Å; L237-L472 HydrophobicContact CD2-CD2 4.35Å; L237-L472 HydrophobicContact CD2-CG 4.28Å; L237-L472 HydrophobicContact CG-CD1 4.02Å
238	P	47.9	Very low	57.4	Low	89 Å²	89	67.5 Å²	67.5	58%	0.578	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-19.3	177.9	20.4	-30.6	0	0	0	113.1
239	L	49.1	Very low	58.9	Low	43 Å²	43	71.5 Å²	71.5	23%	0.225	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-5.9	-177.2	-62.4	174.4	0	0	0	115.6	L237 P241 F326 L328 V468	L237-L239 PolarHBondContact O-N 3.36Å; L239-P241 WeakPolarHBondContact O-CD 3.25Å; L239-F326 WeakPolarHBondContact O-CE1 3.49Å; L239-L328 HydrophobicContact CD2-CD2 4.35Å; L239-V468 HydrophobicContact CD1-CB 4.35Å; L239-V468 HydrophobicContact CD1-CG1 3.52Å; L239-V468 HydrophobicContact CD1-CG2 3.84Å
240	L	58.2	Low	60.7	Low	41 Å²	41	68.8 Å²	68.8	22%	0.215	36%	0.364	C	S	.	.	S	Bend	trans	-103.7	102.3	178.1	-86.6	150.6	0	0	0	110.3	L237 K244 F323	L237-L240 HydrophobicContact CB-CB 4.15Å; L237-L240 HydrophobicContact CB-CD1 4.11Å; L237-L240 HydrophobicContact CD1-CD1 3.6Å; L237-L240 HydrophobicContact CD2-CD1 3.65Å; L237-L240 HydrophobicContact CG-CD1 3.97Å; L237-L240 PolarHBondContact O-N 3.33Å; L237-L240 VanDerWaalsContact O-N 3.15Å; L240-K244 HydrophobicContact CD2-CB 3.92Å; L240-K244 HydrophobicContact CD2-CD 3.99Å; L240-F323 HydrophobicContact CD2-CE1 4.11Å; L240-F323 HydrophobicContact CD2-CE2 3.95Å; L240-F323 HydrophobicContact CD2-CZ 3.44Å; L240-F323 VanDerWaalsContact CD2-CZ 3.44Å
241	P	58	Low	62.8	Low	60 Å²	60	61 Å²	61	39%	0.39	33%	0.328	S	S	.	.			trans	-51	141.7	169.2	-26.9	32.1	0	0	0	111.6	L239 D243 K244	L239-P241 WeakPolarHBondContact O-CD 3.25Å; P241-D243 PolarHBondContact O-N 2.86Å; P241-K244 WeakPolarHBondContact O-CB 3.46Å; P241-K244 PolarHBondContact O-N 2.91Å
242	R	60.9	Low	64.9	Low	195 Å²	195	62.5 Å²	62.5	74%	0.736	33%	0.334	S	S	*	.	H	α-helix	trans	-50.8	-33.7	178.2	-74.8	-174.3	178	-173.3	-0	113	K244 A245 N246	R242-K244 PolarHBondContact O-N 3.44Å; R242-A245 PolarHBondContact O-N 3.21Å; R242-N246 PolarHBondContact O-N 3.11Å
243	D	70.2	Confident	67	Low	127 Å²	127	61 Å²	61	68%	0.679	33%	0.329	S	S	*	.	H	α-helix	trans	-59.6	-32.9	178.5	-57.4	-28	0	0	0	112.4	P241	P241-D243 PolarHBondContact O-N 2.86Å
244	K	76.1	Confident	69.3	Low	19 Å²	19	60 Å²	60	8%	0.083	32%	0.321	C	S	.	.	H	α-helix	trans	-75.7	-34.3	178.6	-64.3	-168.5	-178.9	-174.3	0	112.6	L240 P241 R242 N246 L247 F323 N325 F326	L240-K244 HydrophobicContact CD2-CB 3.92Å; L240-K244 HydrophobicContact CD2-CD 3.99Å; P241-K244 WeakPolarHBondContact O-CB 3.46Å; P241-K244 PolarHBondContact O-N 2.91Å; R242-K244 PolarHBondContact O-N 3.44Å; K244-N246 PolarHBondContact O-N 2.95Å; K244-L247 WeakPolarHBondContact O-CB 3.42Å; K244-L247 PolarHBondContact O-N 2.91Å; K244-L247 VanDerWaalsContact O-N 3.07Å; K244-F323 HydrophobicContact CB-CD2 3.92Å; K244-F323 HydrophobicContact CB-CE2 3.72Å; K244-F323 HydrophobicContact CD-CD2 4.33Å; K244-F323 HydrophobicContact CD-CE2 4.49Å; K244-F323 WeakPolarHBondContact CD-O 3.39Å; K244-F323 WeakPolarHBondContact CE-O 3.23Å; K244-F323 HydrophobicContact CG-CD2 4.35Å; K244-F323 PolarHBondContact NZ-O 3.29Å; K244-N325 WeakPolarHBondContact CE-O 3.33Å; K244-N325 PolarHBondContact NZ-O 2.78Å; K244-F326 HydrophobicContact CD-CE1 4.24Å; K244-F326 VanDerWaalsContact NZ-CZ 3.27Å
245	A	73.6	Confident	71.7	Confident	20 Å²	20	58.5 Å²	58.5	17%	0.165	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-34.7	175.2	0	0	0	0	0	111.6	R242 L247 L248	R242-A245 PolarHBondContact O-N 3.21Å; A245-L247 VanDerWaalsContact C-N 3.28Å; A245-L247 PolarHBondContact O-N 3.19Å; A245-L248 PolarHBondContact O-N 2.92Å
246	N	77.2	Confident	74.1	Confident	83 Å²	83	54 Å²	54	44%	0.444	28%	0.276	S	S	.	.	H	α-helix	trans	-64.5	-31	174.7	-69.7	-28.1	0	0	0	113	R242 K244 L248 R249	R242-N246 PolarHBondContact O-N 3.11Å; K244-N246 PolarHBondContact O-N 2.95Å; N246-L248 VanDerWaalsContact C-N 3.3Å; N246-L248 PolarHBondContact O-N 3.39Å; N246-R249 PolarHBondContact O-N 2.84Å; N246-R249 PolarHBondContact OD1-NH1 3.41Å
247	L	81.9	Confident	76.5	Confident	38 Å²	38	53.4 Å²	53.4	20%	0.199	27%	0.269	C	S	.	.	H	α-helix	trans	-63.8	-36.8	175.9	-62.8	174.7	0	0	0	111.7	K244 A245 R249 E250 W278 R321 F323	K244-L247 WeakPolarHBondContact O-CB 3.42Å; K244-L247 PolarHBondContact O-N 2.91Å; K244-L247 VanDerWaalsContact O-N 3.07Å; A245-L247 VanDerWaalsContact C-N 3.28Å; A245-L247 PolarHBondContact O-N 3.19Å; L247-R249 VanDerWaalsContact C-N 3.25Å; L247-R249 PolarHBondContact O-N 2.76Å; L247-E250 PolarHBondContact O-N 3.25Å; L247-W278 HydrophobicContact CB-CZ3 4.17Å; L247-W278 HydrophobicContact CD2-CH2 3.68Å; L247-W278 HydrophobicContact CD2-CZ3 3.89Å; L247-W278 VanDerWaalsContact O-CZ3 3.28Å; L247-W278 WeakPolarHBondContact O-CZ3 3.26Å; L247-R321 HydrophobicContact CD1-CB 4.2Å; L247-R321 HydrophobicContact CD2-CB 4.31Å; L247-F323 HydrophobicContact CD1-CB 4.45Å; L247-F323 HydrophobicContact CD1-CD2 4.14Å
248	L	82.2	Confident	78.6	Confident	15 Å²	15	53.8 Å²	53.8	8%	0.079	27%	0.272	C	S	.	.	H	α-helix	trans	-65.9	-28.9	-179.7	-64.8	171.4	0	0	0	112.8	F232 A245 N246 E250 L251 L318 F323	F232-L248 HydrophobicContact CD1-CD1 4.26Å; F232-L248 HydrophobicContact CE1-CD1 3.39Å; F232-L248 HydrophobicContact CE2-CD1 3.98Å; F232-L248 HydrophobicContact CZ-CD1 3.24Å; A245-L248 PolarHBondContact O-N 2.92Å; N246-L248 VanDerWaalsContact C-N 3.3Å; N246-L248 PolarHBondContact O-N 3.39Å; L248-E250 PolarHBondContact O-N 3.22Å; L248-L251 HydrophobicContact CD2-CD1 3.97Å; L248-L251 PolarHBondContact O-N 3.45Å; L248-L318 HydrophobicContact CD2-CD2 3.68Å; L248-F323 HydrophobicContact CD1-CE2 4.3Å; L248-F323 HydrophobicContact CD1-CZ 4.45Å; L248-F323 HydrophobicContact CD2-CE2 4.27Å; L248-F323 HydrophobicContact CG-CE2 4.13Å
249	R	83.6	Confident	80.6	Confident	124 Å²	124	53.9 Å²	53.9	47%	0.468	26%	0.261	S	S	.	.	H	α-helix	trans	-68.7	-23.6	178.5	-64.8	-175.3	173	113.3	2.9	113.7	A224 N246 L247	A224-R249 HydrophobicContact CB-CB 4.36Å; A224-R249 HydrophobicContact CB-CG 4.03Å; N246-R249 PolarHBondContact O-N 2.84Å; N246-R249 PolarHBondContact OD1-NH1 3.41Å; L247-R249 VanDerWaalsContact C-N 3.25Å; L247-R249 PolarHBondContact O-N 2.76Å
250	E	89.5	Confident	82.5	Confident	74 Å²	74	54 Å²	54	35%	0.346	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-4.6	-176.9	-66.7	-81.7	-137.7	0	0	112.4	L247 L248 W278 K279	L247-E250 PolarHBondContact O-N 3.25Å; L248-E250 PolarHBondContact O-N 3.22Å; E250-W278 HydrophobicContact CB-CD2 4.17Å; E250-W278 HydrophobicContact CB-CE3 3.87Å; E250-W278 HydrophobicContact CB-CH2 3.18Å; E250-W278 HydrophobicContact CB-CZ2 3.51Å; E250-W278 HydrophobicContact CB-CZ3 3.39Å; E250-W278 HydrophobicContact CG-CH2 3.56Å; E250-W278 HydrophobicContact CG-CZ2 3.76Å; E250-W278 HydrophobicContact CG-CZ3 4.24Å; E250-K279 WeakPolarHBondContact O-CA 3.26Å; E250-K279 PolarHBondContact O-N 3.44Å; E250-K279 WeakPolarHBondContact OE1-CE 3.38Å; E250-K279 IonicContact OE1-NZ 3.55Å; E250-K279 PolarHBondContact OE1-NZ 2.71Å; E250-K279 WeakPolarHBondContact OE2-CE 3.25Å; E250-K279 IonicContact OE2-NZ 2.94Å
251	L	92.3	Very high	84	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	134.4	175.3	-66.5	173.2	0	0	0	110.8	P222 I223 L248 V276 W278 L314 A317 L318	P222-L251 WeakPolarHBondContact CA-O 3.41Å; I223-L251 HydrophobicContact CB-CB 4.47Å; I223-L251 HydrophobicContact CD1-CB 3.93Å; I223-L251 HydrophobicContact CG1-CB 4.33Å; I223-L251 PolarHBondContact N-O 3.19Å; L248-L251 HydrophobicContact CD2-CD1 3.97Å; L248-L251 PolarHBondContact O-N 3.45Å; L251-V276 HydrophobicContact CB-CG1 4.47Å; L251-V276 HydrophobicContact CD2-CG1 4.46Å; L251-W278 HydrophobicContact CD2-CE3 4.11Å; L251-L314 HydrophobicContact CD1-CD1 3.64Å; L251-A317 HydrophobicContact CD2-CB 3.64Å; L251-L318 HydrophobicContact CD1-CD2 3.75Å; L251-L318 HydrophobicContact CD1-CG 4.17Å
252	M	92.9	Very high	85.4	Confident	48 Å²	48	54 Å²	54	24%	0.236	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	142.8	175.7	-56.1	-175.9	80.5	0	0	110.8	K220 F221 V276 S277 K279	K220-M252 HydrophobicContact CB-CE 3.66Å; F221-M252 CarbonylContact O-C 3.53Å; F221-M252 WeakPolarHBondContact O-CA 3.31Å; M252-V276 WeakPolarHBondContact O-CA 3.32Å; M252-S277 PolarHBondContact N-O 2.68Å; M252-S277 PolarHBondContact O-N 3.19Å; M252-K279 VanDerWaalsContact SD-C 3.57Å
253	V	92.9	Very high	86.7	Confident	25 Å²	25	45.6 Å²	45.6	15%	0.152	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	131.2	168.6	62.4	0	0	0	0	109.7	K220 F221 I223 L255 E275 V276	K220-V253 VanDerWaalsContact CA-O 3.3Å; K220-V253 WeakPolarHBondContact CA-O 3.1Å; F221-V253 HydrophobicContact CB-CG1 3.93Å; F221-V253 PolarHBondContact N-O 3.23Å; F221-V253 PolarHBondContact O-N 3.41Å; I223-V253 HydrophobicContact CG1-CB 4.47Å; V253-L255 HydrophobicContact CG1-CG 4.34Å; V253-L255 HydrophobicContact CG2-CD2 3.93Å; V253-L255 HydrophobicContact CG2-CG 4.23Å; V253-E275 CarbonylContact C-O 3.59Å; V253-E275 WeakPolarHBondContact CA-O 3.21Å; V253-V276 HydrophobicContact CB-CG2 4.18Å; V253-V276 HydrophobicContact CG2-CG2 4.2Å
254	D	93.8	Very high	87.2	Confident	24 Å²	24	42.4 Å²	42.4	13%	0.128	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	107.4	174.3	-166.2	-20.4	0	0	0	110.4	H219 K220 S256 G274 E275	H219-D254 IonicContact CD2-OD1 3.03Å; K220-D254 VanDerWaalsContact CE-OD2 3.22Å; K220-D254 WeakPolarHBondContact CE-OD2 3.34Å; K220-D254 HydrophobicContact CG-CB 4.45Å; K220-D254 IonicContact NZ-OD2 3.48Å; D254-S256 WeakPolarHBondContact OD1-CB 3.28Å; D254-S256 PolarHBondContact OD1-N 3.18Å; D254-S256 PolarHBondContact OD1-OG 3.06Å; D254-G274 VanDerWaalsContact O-CA 3.3Å; D254-G274 WeakPolarHBondContact O-CA 3.1Å; D254-G274 PolarHBondContact O-N 3.48Å; D254-E275 HydrophobicContact CB-CB 4.49Å; D254-E275 PolarHBondContact N-O 3.47Å
255	L	92.6	Very high	87.4	Confident	51 Å²	51	47 Å²	47	27%	0.267	24%	0.239	S	C	.	.			trans	-102.4	25	175.9	-60.1	-179.8	0	0	0	112	V31 H219 F221 V253 H272	V31-L255 HydrophobicContact CB-CD2 4.42Å; V31-L255 HydrophobicContact CG1-CD2 4.39Å; V31-L255 HydrophobicContact CG2-CD2 4.28Å; H219-L255 WeakPolarHBondContact O-CA 3.33Å; H219-L255 PolarHBondContact O-N 3.14Å; F221-L255 HydrophobicContact CD2-CD1 3.77Å; F221-L255 HydrophobicContact CD2-CG 4.27Å; F221-L255 HydrophobicContact CE2-CB 4.39Å; F221-L255 HydrophobicContact CE2-CD1 3.9Å; V253-L255 HydrophobicContact CG1-CG 4.34Å; V253-L255 HydrophobicContact CG2-CD2 3.93Å; V253-L255 HydrophobicContact CG2-CG 4.23Å; L255-H272 PolarHBondContact O-ND1 3.23Å
256	S	92.4	Very high	87.8	Confident	12 Å²	12	53.3 Å²	53.3	8%	0.084	26%	0.262	C	S	.	.			trans	-57.2	141.3	170.4	-60.4	0	0	0	0	111.1	H219 D254 V258 H272 A273	H219-S256 PolarHBondContact CD2-OG 3.02Å; D254-S256 WeakPolarHBondContact OD1-CB 3.28Å; D254-S256 PolarHBondContact OD1-N 3.18Å; D254-S256 PolarHBondContact OD1-OG 3.06Å; S256-V258 PolarHBondContact O-N 3.47Å; S256-H272 CarbonylContact O-C 3.57Å; S256-H272 VanDerWaalsContact O-CA 3.23Å; S256-H272 WeakPolarHBondContact O-CA 3.37Å; S256-A273 PolarHBondContact O-N 2.92Å
257	L	92.4	Very high	88.3	Confident	16 Å²	16	49.5 Å²	49.5	8%	0.084	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	130.3	175.2	-71.4	170.2	0	0	0	110.4	F144 K149 V151 P261 T270 M271 H272	F144-L257 HydrophobicContact CD2-CB 4.24Å; F144-L257 HydrophobicContact CD2-CD1 4.12Å; F144-L257 HydrophobicContact CE2-CB 3.56Å; F144-L257 HydrophobicContact CE2-CD1 4.23Å; F144-L257 HydrophobicContact CZ-CB 4.34Å; K149-L257 WeakPolarHBondContact CD-O 3.42Å; K149-L257 WeakPolarHBondContact O-CB 3.35Å; K149-L257 PolarHBondContact O-N 3.41Å; V151-L257 HydrophobicContact CG2-CD1 3.45Å; V151-L257 VanDerWaalsContact CG2-CD1 3.45Å; L257-P261 HydrophobicContact CD1-CG 4.41Å; L257-T270 HydrophobicContact CD2-CG2 4.41Å; L257-M271 CarbonylContact C-O 3.57Å; L257-M271 WeakPolarHBondContact CA-O 2.92Å; L257-M271 WeakPolarHBondContact CD2-O 3.28Å; L257-H272 VanDerWaalsContact CD2-CE1 3.47Å; L257-H272 WeakPolarHBondContact CD2-CE1 3.32Å
258	V	92.3	Very high	88.7	Confident	24 Å²	24	48.8 Å²	48.8	15%	0.145	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	-16.3	174.9	-66	0	0	0	0	112.4	I27 P29 S256 M271 A273	I27-V258 HydrophobicContact CB-CB 4.36Å; I27-V258 HydrophobicContact CB-CG1 4.14Å; I27-V258 HydrophobicContact CG2-CB 4.45Å; I27-V258 HydrophobicContact CG2-CG1 3.77Å; P29-V258 HydrophobicContact CB-CG2 3.84Å; S256-V258 PolarHBondContact O-N 3.47Å; V258-M271 HydrophobicContact CG2-CB 4.03Å; V258-M271 WeakPolarHBondContact CG2-O 3.33Å; V258-M271 PolarHBondContact N-O 2.93Å; V258-A273 HydrophobicContact CG1-CB 3.89Å
259	R	89.9	Confident	89.1	Confident	92 Å²	92	49.1 Å²	49.1	35%	0.347	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	160	-179.7	-64	-177.4	-170.3	148.6	-0.5	110.1	M271	R259-M271 HydrophobicContact CB-CB 4.41Å; R259-M271 HydrophobicContact CB-SD 4.35Å
260	A	89.3	Confident	89.5	Confident	44 Å²	44	44.6 Å²	44.6	36%	0.364	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	140.9	170.7	0	0	0	0	0	111	F144	F144-A260 HydrophobicContact CB-CB 3.73Å; F144-A260 HydrophobicContact CD1-CB 4.04Å; F144-A260 HydrophobicContact CG-CB 4.03Å
261	P	90.3	Very high	89.7	Confident	7 Å²	7	42.3 Å²	42.3	5%	0.045	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	143.5	172.7	-23.8	33.5	0	0	0	111.9	S96 V151 L257 V269 T270	S96-P261 PolarHBondContact OG-O 3.26Å; V151-P261 HydrophobicContact CG2-CG 3.67Å; L257-P261 HydrophobicContact CD1-CG 4.41Å; P261-V269 CarbonylContact C-O 3.59Å; P261-V269 WeakPolarHBondContact CA-O 3.07Å; P261-T270 HydrophobicContact CB-CG2 4.11Å; P261-T270 HydrophobicContact CG-CG2 4.26Å
262	L	88	Confident	89.8	Confident	94 Å²	94	43.2 Å²	43.2	49%	0.492	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	114	170.9	-55.4	176.9	0	0	0	108.8	V268 V269 M271	L262-V268 WeakPolarHBondContact O-CA 3.49Å; L262-V269 HydrophobicContact CB-CB 4.21Å; L262-V269 PolarHBondContact N-O 3.41Å; L262-V269 PolarHBondContact O-N 3.26Å; L262-M271 HydrophobicContact CD1-CE 3.57Å; L262-M271 HydrophobicContact CG-CE 4.23Å
263	L	86.9	Confident	89.9	Confident	19 Å²	19	41.8 Å²	41.8	10%	0.099	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.3	-178	-64.6	178.4	0	0	0	110.2	I92 V142 V268	I92-L263 HydrophobicContact CG2-CB 3.66Å; I92-L263 HydrophobicContact CG2-CD2 4.2Å; I92-L263 HydrophobicContact CG2-CG 4.41Å; V142-L263 HydrophobicContact CB-CD1 3.9Å; V142-L263 HydrophobicContact CG1-CD1 4.1Å; V142-L263 HydrophobicContact CG2-CD1 3.62Å; L263-V268 HydrophobicContact CD2-CB 3.89Å; L263-V268 HydrophobicContact CD2-CG1 3.43Å; L263-V268 VanDerWaalsContact CD2-CG1 3.43Å; L263-V268 HydrophobicContact CD2-CG2 3.53Å
264	N	81.8	Confident	90	Very high	60 Å²	60	40.6 Å²	40.6	32%	0.321	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	169.7	167.5	64.4	69.7	0	0	0	110.9	K266 A267	N264-K266 PolarHBondContact O-N 3.48Å; N264-K266 WeakPolarHBondContact OD1-CA 3.33Å; N264-K266 WeakPolarHBondContact OD1-CB 3.49Å; N264-K266 PolarHBondContact OD1-N 2.78Å; N264-A267 PolarHBondContact N-O 2.79Å; N264-A267 CarbonylContact O-C 3.59Å; N264-A267 PolarHBondContact O-N 2.9Å; N264-A267 VanDerWaalsContact O-O 3.06Å; N264-A267 PolarHBondContact OD1-N 2.96Å; N264-A267 PolarHBondContact OD1-O 2.82Å
265	E	79.1	Confident	90.1	Very high	117 Å²	117	40.9 Å²	40.9	55%	0.547	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-19.3	-178.8	-59.8	-177.8	169.4	0	0	114.8	I92	I92-E265 WeakPolarHBondContact O-CG 3.31Å; I92-E265 PolarHBondContact O-N 2.69Å
266	K	83.1	Confident	90.2	Very high	151 Å²	151	38.7 Å²	38.7	66%	0.657	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-24.4	-177.7	-59.5	-179.5	-177.7	176.6	0	112.9	N36 K37 N264	N36-K266 CarbonylContact C-O 3.57Å; K37-K266 VanDerWaalsContact CA-O 3.24Å; K37-K266 WeakPolarHBondContact CA-O 3.29Å; K37-K266 PolarHBondContact N-O 3.27Å; N264-K266 PolarHBondContact O-N 3.48Å; N264-K266 WeakPolarHBondContact OD1-CA 3.33Å; N264-K266 WeakPolarHBondContact OD1-CB 3.49Å; N264-K266 PolarHBondContact OD1-N 2.78Å
267	A	87.2	Confident	90.4	Very high	4 Å²	4	38.3 Å²	38.3	3%	0.033	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	147.2	-176.8	0	0	0	0	0	113	R34 L35 N264 V269	R34-A267 HydrophobicContact CG-CB 4.36Å; L35-A267 WeakPolarHBondContact O-CA 3.26Å; L35-A267 WeakPolarHBondContact O-CB 3.4Å; N264-A267 PolarHBondContact N-O 2.79Å; N264-A267 CarbonylContact O-C 3.59Å; N264-A267 PolarHBondContact O-N 2.9Å; N264-A267 VanDerWaalsContact O-O 3.06Å; N264-A267 PolarHBondContact OD1-N 2.96Å; N264-A267 PolarHBondContact OD1-O 2.82Å; A267-V269 HydrophobicContact CB-CG2 4.27Å
268	V	89.9	Confident	90.4	Very high	23 Å²	23	39.6 Å²	39.6	14%	0.139	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123.4	163.5	171.6	0	0	0	0	107.3	R34 L35 V40 I92 L262 L263	R34-V268 CarbonylContact C-O 3.57Å; R34-V268 VanDerWaalsContact CA-O 3.32Å; R34-V268 WeakPolarHBondContact CA-O 3.42Å; L35-V268 HydrophobicContact CB-CB 4.1Å; L35-V268 HydrophobicContact CD1-CB 4.09Å; L35-V268 HydrophobicContact CD1-CG1 4.38Å; L35-V268 HydrophobicContact CG-CB 4.42Å; L35-V268 PolarHBondContact N-O 3.4Å; L35-V268 PolarHBondContact O-N 3.25Å; L35-V268 VanDerWaalsContact O-N 3.09Å; V40-V268 HydrophobicContact CG2-CG2 4.1Å; I92-V268 HydrophobicContact CD1-CG2 3.48Å; I92-V268 VanDerWaalsContact CD1-CG2 3.48Å; I92-V268 HydrophobicContact CG2-CG2 4.48Å; L262-V268 WeakPolarHBondContact O-CA 3.49Å; L263-V268 HydrophobicContact CD2-CB 3.89Å; L263-V268 HydrophobicContact CD2-CG1 3.43Å; L263-V268 VanDerWaalsContact CD2-CG1 3.43Å; L263-V268 HydrophobicContact CD2-CG2 3.53Å
269	V	91.7	Very high	90.4	Very high	22 Å²	22	43.1 Å²	43.1	13%	0.133	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	126	-177.8	-174.3	0	0	0	0	109.7	V32 L33 R34 P261 L262 A267 M271	V32-V269 HydrophobicContact CG1-CG1 3.57Å; L33-V269 CarbonylContact O-C 3.56Å; L33-V269 WeakPolarHBondContact O-CA 3.26Å; R34-V269 HydrophobicContact CB-CG2 4.39Å; R34-V269 HydrophobicContact CG-CG2 4.07Å; P261-V269 CarbonylContact C-O 3.59Å; P261-V269 WeakPolarHBondContact CA-O 3.07Å; L262-V269 HydrophobicContact CB-CB 4.21Å; L262-V269 PolarHBondContact N-O 3.41Å; L262-V269 PolarHBondContact O-N 3.26Å; A267-V269 HydrophobicContact CB-CG2 4.27Å; V269-M271 HydrophobicContact CG1-CE 4.32Å
270	T	92.1	Very high	90.5	Very high	29 Å²	29	39 Å²	39	18%	0.178	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.3	173.2	59.2	0	0	0	0	110.1	V32 L33 L257 P261 H272	V32-T270 WeakPolarHBondContact CA-O 3.12Å; L33-T270 WeakPolarHBondContact CB-OG1 3.39Å; L33-T270 PolarHBondContact N-O 3.49Å; L33-T270 PolarHBondContact O-N 3.22Å; L257-T270 HydrophobicContact CD2-CG2 4.41Å; P261-T270 HydrophobicContact CB-CG2 4.11Å; P261-T270 HydrophobicContact CG-CG2 4.26Å; T270-H272 VanDerWaalsContact CB-NE2 3.28Å; T270-H272 WeakPolarHBondContact CB-NE2 3.45Å; T270-H272 PolarHBondContact OG1-NE2 2.82Å
271	M	93.8	Very high	90.6	Very high	26 Å²	26	42.6 Å²	42.6	13%	0.128	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	119.7	-170.9	-65	-170.4	-169	0	0	109.3	P29 V32 L257 V258 R259 L262 V269	P29-M271 HydrophobicContact CB-CB 3.88Å; P29-M271 HydrophobicContact CB-CG 4.45Å; P29-M271 HydrophobicContact CG-CB 4.29Å; P29-M271 HydrophobicContact CG-CG 4.42Å; P29-M271 HydrophobicContact CG-SD 4.21Å; V32-M271 HydrophobicContact CG2-CG 4.13Å; L257-M271 CarbonylContact C-O 3.57Å; L257-M271 WeakPolarHBondContact CA-O 2.92Å; L257-M271 WeakPolarHBondContact CD2-O 3.28Å; V258-M271 HydrophobicContact CG2-CB 4.03Å; V258-M271 WeakPolarHBondContact CG2-O 3.33Å; V258-M271 PolarHBondContact N-O 2.93Å; R259-M271 HydrophobicContact CB-CB 4.41Å; R259-M271 HydrophobicContact CB-SD 4.35Å; L262-M271 HydrophobicContact CD1-CE 3.57Å; L262-M271 HydrophobicContact CG-CE 4.23Å; V269-M271 HydrophobicContact CG1-CE 4.32Å
272	H	94.2	Very high	90.6	Very high	19 Å²	19	43.3 Å²	43.3	9%	0.088	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	155.9	-168.4	-52.4	-97.7	0	0	0	112.6	P29 A30 V31 L33 L255 S256 L257 T270	P29-H272 WeakPolarHBondContact CA-O 3.44Å; A30-H272 PolarHBondContact N-O 3.02Å; V31-H272 HydrophobicContact CB-CB 4.1Å; V31-H272 PolarHBondContact N-O 2.81Å; V31-H272 PolarHBondContact O-N 3.44Å; L33-H272 WeakPolarHBondContact CD1-NE2 3.43Å; L255-H272 PolarHBondContact O-ND1 3.23Å; S256-H272 CarbonylContact O-C 3.57Å; S256-H272 VanDerWaalsContact O-CA 3.23Å; S256-H272 WeakPolarHBondContact O-CA 3.37Å; L257-H272 VanDerWaalsContact CD2-CE1 3.47Å; L257-H272 WeakPolarHBondContact CD2-CE1 3.32Å; T270-H272 VanDerWaalsContact CB-NE2 3.28Å; T270-H272 WeakPolarHBondContact CB-NE2 3.45Å; T270-H272 PolarHBondContact OG1-NE2 2.82Å
273	A	94.1	Very high	90.5	Very high	19 Å²	19	47.1 Å²	47.1	16%	0.157	23%	0.232	C	C	.	.			trans	-63.1	-44.8	-177.1	0	0	0	0	0	113.1	A30 S256 V258 E275	A30-A273 WeakPolarHBondContact CB-O 3.36Å; S256-A273 PolarHBondContact O-N 2.92Å; V258-A273 HydrophobicContact CG1-CB 3.89Å; A273-E275 PolarHBondContact O-N 3.09Å
274	G	94.4	Very high	90.8	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.			trans	65.8	15.2	176.9	0	0	0	0	0	115.5	D254 V276	D254-G274 VanDerWaalsContact O-CA 3.3Å; D254-G274 WeakPolarHBondContact O-CA 3.1Å; D254-G274 PolarHBondContact O-N 3.48Å; G274-V276 PolarHBondContact O-N 3.23Å
275	E	96	Very high	91.3	Very high	30 Å²	30	48.5 Å²	48.5	14%	0.14	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	128.2	178.6	-177	177.3	-165.8	0	0	110.2	V253 D254 A273 G282 K283 T284 Y309	V253-E275 CarbonylContact C-O 3.59Å; V253-E275 WeakPolarHBondContact CA-O 3.21Å; D254-E275 HydrophobicContact CB-CB 4.49Å; D254-E275 PolarHBondContact N-O 3.47Å; A273-E275 PolarHBondContact O-N 3.09Å; E275-G282 VanDerWaalsContact OE1-C 3.25Å; E275-G282 VanDerWaalsContact OE1-CA 3.27Å; E275-G282 WeakPolarHBondContact OE1-CA 3.08Å; E275-G282 WeakPolarHBondContact OE2-CA 3.05Å; E275-K283 PolarHBondContact OE1-N 2.89Å; E275-T284 VanDerWaalsContact CD-OG1 3.31Å; E275-T284 HydrophobicContact CG-CG2 4.06Å; E275-T284 WeakPolarHBondContact OE1-CB 3.11Å; E275-T284 VanDerWaalsContact OE1-CG2 3.28Å; E275-T284 WeakPolarHBondContact OE1-CG2 3.49Å; E275-T284 PolarHBondContact OE1-N 3.05Å; E275-T284 PolarHBondContact OE1-OG1 3.04Å; E275-Y309 HydrophobicContact CB-CE1 3.91Å; E275-Y309 HydrophobicContact CG-CE1 4.41Å; E275-Y309 WeakPolarHBondContact CG-OH 3.07Å
276	V	95.7	Very high	92.1	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.024	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	125.1	166	172.7	0	0	0	0	109.5	I223 L251 M252 V253 G274 V310 S313 L314	I223-V276 HydrophobicContact CD1-CB 4.19Å; I223-V276 HydrophobicContact CD1-CG1 3.38Å; I223-V276 HydrophobicContact CD1-CG2 3.74Å; L251-V276 HydrophobicContact CB-CG1 4.47Å; L251-V276 HydrophobicContact CD2-CG1 4.46Å; M252-V276 WeakPolarHBondContact O-CA 3.32Å; V253-V276 HydrophobicContact CB-CG2 4.18Å; V253-V276 HydrophobicContact CG2-CG2 4.2Å; G274-V276 PolarHBondContact O-N 3.23Å; V276-V310 HydrophobicContact CG2-CG1 4.33Å; V276-S313 PolarHBondContact N-OG 3.38Å; V276-S313 CarbonylContact O-C 3.5Å; V276-S313 WeakPolarHBondContact O-CB 3.31Å; V276-L314 HydrophobicContact CB-CB 3.98Å; V276-L314 HydrophobicContact CG1-CB 3.87Å; V276-L314 HydrophobicContact CG1-CD1 3.87Å; V276-L314 HydrophobicContact CG1-CG 4.49Å; V276-L314 HydrophobicContact CG2-CB 4.21Å
277	S	95.9	Very high	92.5	Very high	4 Å²	4	44.2 Å²	44.2	3%	0.028	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	159.1	179.2	61	0	0	0	0	112.6	M252 K279 G280 Q281 G282	M252-S277 PolarHBondContact N-O 2.68Å; M252-S277 PolarHBondContact O-N 3.19Å; S277-K279 PolarHBondContact O-N 3.09Å; S277-G280 PolarHBondContact O-N 3.01Å; S277-G280 VanDerWaalsContact OG-C 3.28Å; S277-G280 VanDerWaalsContact OG-CA 3.24Å; S277-G280 WeakPolarHBondContact OG-CA 3.42Å; S277-Q281 PolarHBondContact OG-N 2.95Å; S277-G282 WeakPolarHBondContact OG-CA 3.28Å; S277-G282 PolarHBondContact OG-N 2.95Å
278	W	93.5	Very high	92.8	Very high	43 Å²	43	44.3 Å²	44.3	16%	0.163	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	121.1	175.1	-175.7	-99.4	0	0	0	110.6	L247 E250 L251 G280 Q281 R321	L247-W278 HydrophobicContact CB-CZ3 4.17Å; L247-W278 HydrophobicContact CD2-CH2 3.68Å; L247-W278 HydrophobicContact CD2-CZ3 3.89Å; L247-W278 VanDerWaalsContact O-CZ3 3.28Å; L247-W278 WeakPolarHBondContact O-CZ3 3.26Å; E250-W278 HydrophobicContact CB-CD2 4.17Å; E250-W278 HydrophobicContact CB-CE3 3.87Å; E250-W278 HydrophobicContact CB-CH2 3.18Å; E250-W278 HydrophobicContact CB-CZ2 3.51Å; E250-W278 HydrophobicContact CB-CZ3 3.39Å; E250-W278 HydrophobicContact CG-CH2 3.56Å; E250-W278 HydrophobicContact CG-CZ2 3.76Å; E250-W278 HydrophobicContact CG-CZ3 4.24Å; L251-W278 HydrophobicContact CD2-CE3 4.11Å; W278-G280 PolarHBondContact O-N 3.24Å; W278-Q281 WeakPolarHBondContact O-CB 3.35Å; W278-Q281 WeakPolarHBondContact O-CG 3.31Å; W278-Q281 PolarHBondContact O-N 3.44Å; W278-R321 HydrophobicContact CD2-CG 4.43Å; W278-R321 HydrophobicContact CE3-CG 3.99Å; W278-R321 HydrophobicContact CZ3-CG 4.19Å
279	K	91.8	Very high	92.8	Very high	98 Å²	98	46.6 Å²	46.6	43%	0.426	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	23.9	-177.7	-62.2	-176.2	172.4	-165.2	0	113.8	E250 M252 S277 Q281	E250-K279 WeakPolarHBondContact O-CA 3.26Å; E250-K279 PolarHBondContact O-N 3.44Å; E250-K279 WeakPolarHBondContact OE1-CE 3.38Å; E250-K279 IonicContact OE1-NZ 3.55Å; E250-K279 PolarHBondContact OE1-NZ 2.71Å; E250-K279 WeakPolarHBondContact OE2-CE 3.25Å; E250-K279 IonicContact OE2-NZ 2.94Å; M252-K279 VanDerWaalsContact SD-C 3.57Å; S277-K279 PolarHBondContact O-N 3.09Å; K279-Q281 HydrophobicContact CB-CG 4.3Å; K279-Q281 PolarHBondContact O-N 3.31Å
280	G	91.2	Very high	92.6	Very high	6 Å²	6	48.5 Å²	48.5	6%	0.062	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	22	-177.2	0	0	0	0	0	114.4	K220 S277 W278 G282	K220-G280 PolarHBondContact NZ-O 3.42Å; S277-G280 PolarHBondContact O-N 3.01Å; S277-G280 VanDerWaalsContact OG-C 3.28Å; S277-G280 VanDerWaalsContact OG-CA 3.24Å; S277-G280 WeakPolarHBondContact OG-CA 3.42Å; W278-G280 PolarHBondContact O-N 3.24Å; G280-G282 PolarHBondContact O-N 3.47Å
281	Q	92.2	Very high	92.2	Very high	119 Å²	119	48.3 Å²	48.3	56%	0.556	27%	0.268	S	S	*	.			trans	-74.7	-8.8	-178.3	-67.6	-178.7	-8.2	0	0	113.9	S277 W278 K279	S277-Q281 PolarHBondContact OG-N 2.95Å; W278-Q281 WeakPolarHBondContact O-CB 3.35Å; W278-Q281 WeakPolarHBondContact O-CG 3.31Å; W278-Q281 PolarHBondContact O-N 3.44Å; K279-Q281 HydrophobicContact CB-CG 4.3Å; K279-Q281 PolarHBondContact O-N 3.31Å
282	G	90.1	Very high	91.2	Very high	22 Å²	22	54.6 Å²	54.6	23%	0.227	29%	0.291	C	S	.	.			trans	64.4	-142.1	-174	0	0	0	0	0	112.3	E275 S277 G280	E275-G282 VanDerWaalsContact OE1-C 3.25Å; E275-G282 VanDerWaalsContact OE1-CA 3.27Å; E275-G282 WeakPolarHBondContact OE1-CA 3.08Å; E275-G282 WeakPolarHBondContact OE2-CA 3.05Å; S277-G282 WeakPolarHBondContact OG-CA 3.28Å; S277-G282 PolarHBondContact OG-N 2.95Å; G280-G282 PolarHBondContact O-N 3.47Å
283	K	85.8	Confident	90	Very high	175 Å²	175	56 Å²	56	76%	0.761	30%	0.303	S	S	*	.			trans	71.8	24.5	175.8	-52.4	174.4	-179.8	176.8	0	115	E275	E275-K283 PolarHBondContact OE1-N 2.89Å
284	T	92.5	Very high	88.7	Confident	16 Å²	16	57.2 Å²	57.2	10%	0.098	31%	0.311	C	S	.	.			trans	-57.5	131.7	162.6	50.1	0	0	0	0	109.7	E275 F286 Y309 Y316	E275-T284 VanDerWaalsContact CD-OG1 3.31Å; E275-T284 HydrophobicContact CG-CG2 4.06Å; E275-T284 WeakPolarHBondContact OE1-CB 3.11Å; E275-T284 VanDerWaalsContact OE1-CG2 3.28Å; E275-T284 WeakPolarHBondContact OE1-CG2 3.49Å; E275-T284 PolarHBondContact OE1-N 3.05Å; E275-T284 PolarHBondContact OE1-OG1 3.04Å; T284-F286 PolarHBondContact O-N 2.89Å; T284-Y309 PolarHBondContact OG1-OH 3.04Å; T284-Y316 HydrophobicContact CG2-CD1 4Å
285	P	94	Very high	86.9	Confident	92 Å²	92	64 Å²	64	60%	0.597	35%	0.346	S	S	*	.	S	Bend	trans	-77.6	10.5	-170.1	30.1	-35.2	0	0	0	113.6	Y316	P285-Y316 VanDerWaalsContact CD-CE1 3.48Å; P285-Y316 HydrophobicContact CG-CD2 4.2Å; P285-Y316 HydrophobicContact CG-CE1 4.34Å; P285-Y316 HydrophobicContact CG-CE2 3.64Å
286	F	94.4	Very high	85.2	Confident	77 Å²	77	69.7 Å²	69.7	34%	0.338	37%	0.373	S	S	.	.	S	Bend	trans	-140.3	159	-178.5	50	-95.3	0	0	0	108.8	T284 Y309 N312 Y316	T284-F286 PolarHBondContact O-N 2.89Å; F286-Y309 AromaticContact CD2-CD2 3.69Å; F286-Y309 HydrophobicContact CD2-CD2 3.69Å; F286-Y309 AromaticContact CD2-CE2 3.58Å; F286-Y309 HydrophobicContact CD2-CE2 3.58Å; F286-Y309 AromaticContact CE2-CD2 3.73Å; F286-Y309 HydrophobicContact CE2-CD2 3.73Å; F286-Y309 AromaticContact CE2-CE2 3.68Å; F286-Y309 HydrophobicContact CE2-CE2 3.68Å; F286-Y309 WeakPolarHBondContact O-CE2 3.32Å; F286-N312 HydrophobicContact CE2-CB 3.9Å; F286-N312 HydrophobicContact CZ-CB 4.01Å; F286-Y316 HydrophobicContact CE1-CD2 4.31Å; F286-Y316 HydrophobicContact CE1-CG 4.19Å
287	S	92.2	Very high	83.3	Confident	100 Å²	100	72.7 Å²	72.7	70%	0.699	39%	0.394	S	S	*	.			trans	-109.1	161.6	178.5	54.7	0	0	0	0	111.4
288	A	93.2	Very high	81.8	Confident	7 Å²	7	76.6 Å²	76.6	6%	0.058	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-62.8	138.9	173.2	0	0	0	0	0	111.1	N28 A30 Y309	N28-A288 HydrophobicContact CB-CB 4.12Å; N28-A288 WeakPolarHBondContact CB-O 3.33Å; N28-A288 PolarHBondContact ND2-O 3.01Å; N28-A288 WeakPolarHBondContact O-CB 3.31Å; A30-A288 HydrophobicContact CB-CB 4.1Å; A288-Y309 HydrophobicContact CB-CD1 3.88Å; A288-Y309 HydrophobicContact CB-CD2 4.05Å; A288-Y309 HydrophobicContact CB-CE1 4.35Å; A288-Y309 HydrophobicContact CB-CG 3.67Å
289	T	91	Very high	81.2	Confident	71 Å²	71	82.1 Å²	82.1	44%	0.436	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-79.9	165.9	169.1	57.9	0	0	0	0	110.2	N28 L291 N497	N28-T289 WeakPolarHBondContact CB-O 3.47Å; T289-L291 PolarHBondContact O-N 2.89Å; T289-N497 PolarHBondContact OG1-ND2 3.5Å
290	A	86.9	Confident	81.1	Confident	62 Å²	62	81.2 Å²	81.2	51%	0.512	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-59.3	126.8	177.2	0	0	0	0	0	110.1	N497	A290-N497 PolarHBondContact O-ND2 2.86Å
291	L	84.3	Confident	81.2	Confident	24 Å²	24	81.9 Å²	81.9	13%	0.126	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-83.5	125.1	-179.4	175.9	70.8	0	0	0	110.5	P29 V32 T289 S293 F305	P29-L291 WeakPolarHBondContact O-CB 3.16Å; V32-L291 HydrophobicContact CB-CD2 3.84Å; V32-L291 HydrophobicContact CG2-CD2 3.38Å; T289-L291 PolarHBondContact O-N 2.89Å; L291-S293 PolarHBondContact O-N 2.85Å; L291-S293 VanDerWaalsContact O-N 3.13Å; L291-F305 HydrophobicContact CD1-CB 4.41Å; L291-F305 HydrophobicContact CD2-CB 3.96Å
292	Y	72.7	Confident	81.3	Confident	158 Å²	158	76.5 Å²	76.5	62%	0.62	42%	0.416	S	S	*	.			trans	-79.7	88.3	170.9	-71.8	-84.4	0	0	0	110.9	N497	Y292-N497 WeakPolarHBondContact CD2-OD1 3.39Å; Y292-N497 PolarHBondContact N-OD1 2.79Å
293	S	67.8	Low	81.4	Confident	49 Å²	49	75.5 Å²	75.5	34%	0.343	41%	0.406	S	S	.	.			trans	-92.3	101.3	165.9	63.4	0	0	0	0	109.3	L291 L295	L291-S293 PolarHBondContact O-N 2.85Å; L291-S293 VanDerWaalsContact O-N 3.13Å; S293-L295 PolarHBondContact O-N 2.84Å
294	S	67.8	Low	81.7	Confident	44 Å²	44	69.4 Å²	69.4	31%	0.308	38%	0.381	S	S	.	.			trans	-63.1	136	168.9	67.9	0	0	0	0	109.3	E296	S294-E296 PolarHBondContact O-N 3.38Å
295	L	55	Low	81.7	Confident	143 Å²	143	68.7 Å²	68.7	75%	0.749	38%	0.376	S	S	*	.			trans	-74.8	-6.9	176.6	-89.5	87.5	0	0	0	112.8	R34 S293 S297	R34-L295 VanDerWaalsContact NH1-C 3.26Å; R34-L295 PolarHBondContact NH1-O 2.88Å; R34-L295 PolarHBondContact NH2-O 2.81Å; S293-L295 PolarHBondContact O-N 2.84Å; L295-S297 PolarHBondContact O-N 2.84Å
296	E	61.1	Low	81.7	Confident	149 Å²	149	66.5 Å²	66.5	70%	0.696	36%	0.359	S	S	*	.			trans	-63.1	104	179.1	-65.6	-171.1	167.3	0	0	110.9	S294	S294-E296 PolarHBondContact O-N 3.38Å
297	S	55.7	Low	81.7	Confident	67 Å²	67	62.8 Å²	62.8	47%	0.469	34%	0.343	S	S	.	.			trans	-77.6	125.6	178.7	66	0	0	0	0	109.6	L295	L295-S297 PolarHBondContact O-N 2.84Å
298	H	64.1	Low	81.9	Confident	87 Å²	87	59.3 Å²	59.3	40%	0.403	32%	0.316	S	S	.	.			trans	-79.3	160.1	159.1	-67.3	58.9	0	0	0	108.3	R300 K500	H298-R300 PolarHBondContact O-N 3.42Å; H298-K500 PolarHBondContact ND1-NZ 3.35Å
299	N	80.4	Confident	82	Confident	158 Å²	158	59.9 Å²	59.9	85%	0.845	32%	0.317	S	S	*	.	S	Bend	trans	-63.5	5	-174.4	-77.7	-15.8	0	0	0	115.6	S38	S38-N299 PolarHBondContact OG-O 3.06Å
300	R	90.8	Very high	82.2	Confident	80 Å²	80	57.4 Å²	57.4	30%	0.302	30%	0.302	S	S	.	.	S	Bend	trans	-79.5	151.2	-178.7	-64.9	-61.5	-172.8	-159.5	-4.8	112	N36 S38 H298 A302 N489 D502 D504	N36-R300 VanDerWaalsContact CB-O 3.25Å; N36-R300 WeakPolarHBondContact CB-O 3.45Å; N36-R300 PolarHBondContact ND2-O 2.93Å; S38-R300 PolarHBondContact OG-O 2.77Å; H298-R300 PolarHBondContact O-N 3.42Å; R300-A302 PolarHBondContact O-N 2.86Å; R300-N489 VanDerWaalsContact CZ-CB 3.47Å; R300-N489 PolarHBondContact NE-O 3.48Å; R300-D502 HydrophobicContact CB-CB 3.99Å; R300-D502 HydrophobicContact CG-CB 3.83Å; R300-D504 WeakPolarHBondContact CA-OD1 3.33Å; R300-D504 WeakPolarHBondContact CD-OD1 3.31Å; R300-D504 IonicContact CZ-OD2 3.92Å; R300-D504 IonicContact NE-OD2 2.71Å; R300-D504 IonicContact NH1-OD2 3.71Å; R300-D504 PolarHBondContact NH1-OD2 3.26Å
301	M	93.7	Very high	82.6	Confident	19 Å²	19	56.4 Å²	56.4	9%	0.094	29%	0.286	C	S	.	.	S	Bend	trans	-68	-34.4	-175.2	-64.9	171.2	59.1	0	0	113.6	N36 S38 G39 Y42 F503 D504 F505	N36-M301 PolarHBondContact N-O 2.71Å; S38-M301 WeakPolarHBondContact OG-CA 3.3Å; G39-M301 WeakPolarHBondContact CA-O 3.44Å; Y42-M301 HydrophobicContact CD1-CE 3.3Å; Y42-M301 HydrophobicContact CD2-CE 3.8Å; Y42-M301 HydrophobicContact CE1-CE 3.94Å; Y42-M301 HydrophobicContact CE2-CE 4.35Å; Y42-M301 HydrophobicContact CG-CE 3.2Å; M301-F503 PolarHBondContact N-O 3.41Å; M301-D504 HydrophobicContact CG-CB 4.36Å; M301-D504 PolarHBondContact N-OD1 3.39Å; M301-D504 VanDerWaalsContact N-OD1 3.11Å; M301-D504 HydrophobicContact SD-CB 3.96Å; M301-F505 HydrophobicContact CB-CD1 3.9Å; M301-F505 HydrophobicContact CB-CE1 3.74Å; M301-F505 HydrophobicContact CE-CD1 4Å; M301-F505 HydrophobicContact CE-CD2 4.18Å; M301-F505 HydrophobicContact CE-CE1 3.8Å; M301-F505 HydrophobicContact CE-CE2 3.98Å; M301-F505 HydrophobicContact CE-CG 4.18Å; M301-F505 HydrophobicContact CE-CZ 3.79Å; M301-F505 VanDerWaalsContact CE-O 3.28Å; M301-F505 WeakPolarHBondContact CE-O 3.44Å
302	A	92.8	Very high	83.2	Confident	7 Å²	7	56 Å²	56	6%	0.058	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	156.4	-179.8	0	0	0	0	0	112.3	R34 L35 R300 D502 F503 F505	R34-A302 CarbonylContact O-C 3.58Å; R34-A302 VanDerWaalsContact O-CA 3.26Å; R34-A302 WeakPolarHBondContact O-CA 3.48Å; L35-A302 HydrophobicContact CD2-CB 4.07Å; R300-A302 PolarHBondContact O-N 2.86Å; A302-D502 WeakPolarHBondContact O-CA 3.28Å; A302-F503 HydrophobicContact CB-CD2 4.01Å; A302-F503 HydrophobicContact CB-CE2 3.55Å; A302-F503 HydrophobicContact CB-CZ 3.84Å; A302-F503 PolarHBondContact N-O 2.03Å; A302-F503 PolarHBondContact O-N 3.11Å; A302-F505 HydrophobicContact CB-CD1 4.11Å; A302-F505 HydrophobicContact CB-CE1 4.1Å
303	S	92.6	Very high	84.4	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.007	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	134.3	176.2	-52.6	0	0	0	0	109.8	R34 N36 A501 D502	R34-S303 PolarHBondContact N-O 3.28Å; R34-S303 PolarHBondContact O-N 3.41Å; N36-S303 PolarHBondContact ND2-OG 2.7Å; S303-A501 CarbonylContact C-O 3.58Å; S303-A501 VanDerWaalsContact CA-O 3.31Å; S303-A501 WeakPolarHBondContact CA-O 3.38Å; S303-D502 VanDerWaalsContact CB-OD1 3.26Å; S303-D502 WeakPolarHBondContact CB-OD1 3.07Å; S303-D502 PolarHBondContact OG-OD1 3.03Å
304	I	92.6	Very high	85.7	Confident	46 Å²	46	47.9 Å²	47.9	24%	0.236	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125.8	171.8	-60.7	-179.2	0	0	0	108.1	V31 V32 L33 L306 K500 A501 F503	V31-I304 HydrophobicContact CG1-CG2 4.44Å; V32-I304 WeakPolarHBondContact O-CA 3.38Å; L33-I304 HydrophobicContact CD2-CB 4.19Å; L33-I304 HydrophobicContact CD2-CD1 3.89Å; L33-I304 HydrophobicContact CD2-CG1 3.56Å; L33-I304 HydrophobicContact CD2-CG2 3.87Å; I304-L306 HydrophobicContact CG2-CD2 3.66Å; I304-L306 HydrophobicContact CG2-CG 4.05Å; I304-K500 CarbonylContact O-C 3.51Å; I304-K500 VanDerWaalsContact O-CA 3.29Å; I304-K500 WeakPolarHBondContact O-CA 3.42Å; I304-A501 PolarHBondContact N-O 3.45Å; I304-A501 PolarHBondContact O-N 2.87Å; I304-F503 HydrophobicContact CB-CE1 4.48Å; I304-F503 HydrophobicContact CD1-CE1 3.55Å; I304-F503 HydrophobicContact CD1-CZ 3.7Å; I304-F503 HydrophobicContact CG1-CE1 3.61Å; I304-F503 HydrophobicContact CG1-CZ 3.89Å
305	F	93.3	Very high	87	Confident	1 Å²	1	47.6 Å²	47.6	0%	0.004	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127.5	172.2	-59.4	-101.1	0	0	0	108.7	V31 V32 R34 L291 M499 K500	V31-F305 VanDerWaalsContact CA-O 3.27Å; V31-F305 WeakPolarHBondContact CA-O 3.34Å; V32-F305 HydrophobicContact CB-CB 4.2Å; V32-F305 HydrophobicContact CB-CD2 4.26Å; V32-F305 HydrophobicContact CG1-CD2 4.2Å; V32-F305 PolarHBondContact N-O 3.49Å; V32-F305 PolarHBondContact O-N 2.76Å; R34-F305 HydrophobicContact CB-CE2 4.48Å; L291-F305 HydrophobicContact CD1-CB 4.41Å; L291-F305 HydrophobicContact CD2-CB 3.96Å; F305-M499 CarbonylContact C-O 3.53Å; F305-M499 WeakPolarHBondContact CA-O 3.05Å; F305-K500 HydrophobicContact CD1-CB 4.02Å; F305-K500 HydrophobicContact CD1-CD 4.36Å; F305-K500 HydrophobicContact CD1-CG 3.92Å; F305-K500 HydrophobicContact CE1-CB 4.11Å; F305-K500 HydrophobicContact CE1-CD 3.62Å; F305-K500 HydrophobicContact CE1-CG 3.64Å; F305-K500 HydrophobicContact CG-CG 4.48Å; F305-K500 HydrophobicContact CZ-CD 3.88Å; F305-K500 HydrophobicContact CZ-CG 3.98Å
306	L	93.6	Very high	89	Confident	46 Å²	46	43.2 Å²	43.2	24%	0.241	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	115.4	176.2	-53.3	177.5	0	0	0	108.1	V31 I304 V310 F311 S498 M499	V31-L306 HydrophobicContact CB-CD2 4.39Å; V31-L306 HydrophobicContact CG1-CD2 4.04Å; V31-L306 HydrophobicContact CG2-CD2 3.66Å; I304-L306 HydrophobicContact CG2-CD2 3.66Å; I304-L306 HydrophobicContact CG2-CG 4.05Å; L306-V310 HydrophobicContact CB-CG2 4.48Å; L306-F311 HydrophobicContact CB-CE2 4.05Å; L306-F311 HydrophobicContact CD1-CE2 4.47Å; L306-F311 HydrophobicContact CD1-CZ 4.23Å; L306-S498 CarbonylContact O-C 3.52Å; L306-S498 VanDerWaalsContact O-CA 3.28Å; L306-S498 WeakPolarHBondContact O-CA 3.13Å; L306-S498 WeakPolarHBondContact O-CB 3.47Å; L306-M499 PolarHBondContact N-O 2.89Å; L306-M499 PolarHBondContact O-N 3Å
307	S	94.5	Very high	90.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	162.4	172.7	67.4	0	0	0	0	111.4	A30 Y309 V310 F311 N497	A30-S307 VanDerWaalsContact CA-OG 3.28Å; A30-S307 WeakPolarHBondContact CA-OG 3.41Å; A30-S307 VanDerWaalsContact CB-OG 3.26Å; A30-S307 WeakPolarHBondContact CB-OG 3.47Å; A30-S307 PolarHBondContact O-N 3.44Å; A30-S307 PolarHBondContact O-OG 3.04Å; S307-Y309 PolarHBondContact O-N 3.3Å; S307-Y309 VanDerWaalsContact O-N 3.15Å; S307-Y309 WeakPolarHBondContact OG-CB 3.42Å; S307-Y309 PolarHBondContact OG-N 3.19Å; S307-V310 PolarHBondContact O-N 2.89Å; S307-V310 VanDerWaalsContact O-N 3.15Å; S307-F311 WeakPolarHBondContact O-CD2 3.27Å; S307-N497 WeakPolarHBondContact CA-O 3.37Å
308	D	95	Very high	92.4	Very high	26 Å²	26	33.8 Å²	33.8	14%	0.139	17%	0.165	C	C	.	.	H	α-helix	trans	-52.3	-28.4	168.9	57.8	5.9	0	0	0	113.6	V310 F311 N312 F381 N497	D308-V310 VanDerWaalsContact C-N 3.28Å; D308-V310 PolarHBondContact O-N 3.32Å; D308-F311 PolarHBondContact O-N 3.4Å; D308-N312 WeakPolarHBondContact O-CB 3.17Å; D308-N312 PolarHBondContact O-N 2.98Å; D308-N312 PolarHBondContact O-ND2 3.22Å; D308-F381 HydrophobicContact CB-CD2 3.92Å; D308-F381 HydrophobicContact CB-CE2 4.08Å; D308-N497 PolarHBondContact N-O 3.18Å
309	Y	96.1	Very high	93.9	Very high	20 Å²	20	32.8 Å²	32.8	8%	0.078	16%	0.158	C	C	.	.	H	α-helix	trans	-55.4	-38	175.5	178.1	-99.1	0	0	0	113.6	A30 E275 T284 F286 A288 S307 F311 N312 S313	A30-Y309 HydrophobicContact CB-CD1 3.43Å; A30-Y309 VanDerWaalsContact CB-CD1 3.43Å; A30-Y309 HydrophobicContact CB-CE1 4.27Å; A30-Y309 HydrophobicContact CB-CG 4.18Å; E275-Y309 HydrophobicContact CB-CE1 3.91Å; E275-Y309 HydrophobicContact CG-CE1 4.41Å; E275-Y309 WeakPolarHBondContact CG-OH 3.07Å; T284-Y309 PolarHBondContact OG1-OH 3.04Å; F286-Y309 AromaticContact CD2-CD2 3.69Å; F286-Y309 HydrophobicContact CD2-CD2 3.69Å; F286-Y309 AromaticContact CD2-CE2 3.58Å; F286-Y309 HydrophobicContact CD2-CE2 3.58Å; F286-Y309 AromaticContact CE2-CD2 3.73Å; F286-Y309 HydrophobicContact CE2-CD2 3.73Å; F286-Y309 AromaticContact CE2-CE2 3.68Å; F286-Y309 HydrophobicContact CE2-CE2 3.68Å; F286-Y309 WeakPolarHBondContact O-CE2 3.32Å; A288-Y309 HydrophobicContact CB-CD1 3.88Å; A288-Y309 HydrophobicContact CB-CD2 4.05Å; A288-Y309 HydrophobicContact CB-CE1 4.35Å; A288-Y309 HydrophobicContact CB-CG 3.67Å; S307-Y309 PolarHBondContact O-N 3.3Å; S307-Y309 VanDerWaalsContact O-N 3.15Å; S307-Y309 WeakPolarHBondContact OG-CB 3.42Å; S307-Y309 PolarHBondContact OG-N 3.19Å; Y309-F311 VanDerWaalsContact C-N 3.27Å; Y309-F311 PolarHBondContact O-N 2.77Å; Y309-N312 PolarHBondContact O-N 2.92Å; Y309-S313 VanDerWaalsContact O-CB 3.3Å; Y309-S313 WeakPolarHBondContact O-CB 3.47Å; Y309-S313 PolarHBondContact O-N 3.33Å; Y309-S313 PolarHBondContact O-OG 3.19Å
310	V	95.5	Very high	94.6	Very high	18 Å²	18	29.3 Å²	29.3	11%	0.109	14%	0.14	C	C	.	.	H	α-helix	trans	-60.6	-42.2	177.7	-176.6	0	0	0	0	110.3	A30 V31 V276 L306 S307 D308 S313 L314	A30-V310 HydrophobicContact CB-CG2 3.92Å; V31-V310 HydrophobicContact CG2-CG2 3.71Å; V276-V310 HydrophobicContact CG2-CG1 4.33Å; L306-V310 HydrophobicContact CB-CG2 4.48Å; S307-V310 PolarHBondContact O-N 2.89Å; S307-V310 VanDerWaalsContact O-N 3.15Å; D308-V310 VanDerWaalsContact C-N 3.28Å; D308-V310 PolarHBondContact O-N 3.32Å; V310-S313 PolarHBondContact O-OG 3.24Å; V310-L314 WeakPolarHBondContact O-CB 3.5Å; V310-L314 PolarHBondContact O-N 2.77Å
311	F	94.9	Very high	94.7	Very high	41 Å²	41	30.3 Å²	30.3	18%	0.18	14%	0.143	C	C	.	.	H	α-helix	trans	-75.6	-40.6	179.5	-60.9	-88.9	0	0	0	111.5	L306 S307 D308 Y309 L314 M315 V379 F381 M499	L306-F311 HydrophobicContact CB-CE2 4.05Å; L306-F311 HydrophobicContact CD1-CE2 4.47Å; L306-F311 HydrophobicContact CD1-CZ 4.23Å; S307-F311 WeakPolarHBondContact O-CD2 3.27Å; D308-F311 PolarHBondContact O-N 3.4Å; Y309-F311 VanDerWaalsContact C-N 3.27Å; Y309-F311 PolarHBondContact O-N 2.77Å; F311-L314 WeakPolarHBondContact O-CB 3.44Å; F311-L314 PolarHBondContact O-N 2.87Å; F311-M315 WeakPolarHBondContact O-CB 3.3Å; F311-M315 VanDerWaalsContact O-CG 3.24Å; F311-M315 WeakPolarHBondContact O-CG 3.46Å; F311-M315 PolarHBondContact O-N 2.86Å; F311-V379 HydrophobicContact CB-CB 3.87Å; F311-V379 HydrophobicContact CB-CG1 3.93Å; F311-V379 HydrophobicContact CB-CG2 3.93Å; F311-V379 HydrophobicContact CG-CG1 4.36Å; F311-F381 AromaticContact CD2-CE2 3.69Å; F311-F381 HydrophobicContact CD2-CE2 3.69Å; F311-F381 AromaticContact CD2-CZ 3.52Å; F311-F381 HydrophobicContact CD2-CZ 3.52Å; F311-F381 AromaticContact CE2-CE2 3.81Å; F311-F381 HydrophobicContact CE2-CE2 3.81Å; F311-F381 AromaticContact CE2-CZ 3.52Å; F311-F381 HydrophobicContact CE2-CZ 3.52Å; F311-F381 HydrophobicContact CG-CZ 4.17Å; F311-F381 HydrophobicContact CZ-CZ 4.17Å; F311-M499 HydrophobicContact CE1-CE 3.86Å; F311-M499 HydrophobicContact CE2-CE 3.65Å; F311-M499 HydrophobicContact CZ-CE 3.14Å; F311-M499 HydrophobicContact CZ-SD 4.34Å
312	N	97.1	Very high	94.6	Very high	16 Å²	16	38.1 Å²	38.1	9%	0.086	17%	0.172	C	C	.	.	H	α-helix	trans	-66.8	-40.3	179.1	-72.9	-35.4	0	0	0	112.5	F286 D308 Y309 L314 M315 Y316 V379	F286-N312 HydrophobicContact CE2-CB 3.9Å; F286-N312 HydrophobicContact CZ-CB 4.01Å; D308-N312 WeakPolarHBondContact O-CB 3.17Å; D308-N312 PolarHBondContact O-N 2.98Å; D308-N312 PolarHBondContact O-ND2 3.22Å; Y309-N312 PolarHBondContact O-N 2.92Å; N312-L314 VanDerWaalsContact C-N 3.34Å; N312-M315 PolarHBondContact O-N 2.75Å; N312-Y316 VanDerWaalsContact O-CB 3.27Å; N312-Y316 WeakPolarHBondContact O-CB 3.36Å; N312-Y316 PolarHBondContact O-N 3.37Å; N312-V379 PolarHBondContact ND2-O 3.31Å; N312-V379 WeakPolarHBondContact OD1-CA 3.44Å; N312-V379 PolarHBondContact OD1-N 2.76Å; N312-V379 PolarHBondContact OD1-O 2.83Å
313	S	97.5	Very high	94.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63	-41.1	173.3	55.2	0	0	0	0	111.6	V276 Y309 V310 Y316 A317	V276-S313 PolarHBondContact N-OG 3.38Å; V276-S313 CarbonylContact O-C 3.5Å; V276-S313 WeakPolarHBondContact O-CB 3.31Å; Y309-S313 VanDerWaalsContact O-CB 3.3Å; Y309-S313 WeakPolarHBondContact O-CB 3.47Å; Y309-S313 PolarHBondContact O-N 3.33Å; Y309-S313 PolarHBondContact O-OG 3.19Å; V310-S313 PolarHBondContact O-OG 3.24Å; S313-Y316 PolarHBondContact O-N 2.88Å; S313-A317 WeakPolarHBondContact O-CB 3.36Å; S313-A317 PolarHBondContact O-N 2.85Å
314	L	95.3	Very high	94.2	Very high	36 Å²	36	40.5 Å²	40.5	19%	0.188	18%	0.181	C	C	.	.	H	α-helix	trans	-60	-51.9	171.8	169.9	63.6	0	0	0	112	I223 L251 V276 V310 F311 N312 Y316 A317 L318	I223-L314 HydrophobicContact CD1-CD1 4.09Å; L251-L314 HydrophobicContact CD1-CD1 3.64Å; V276-L314 HydrophobicContact CB-CB 3.98Å; V276-L314 HydrophobicContact CG1-CB 3.87Å; V276-L314 HydrophobicContact CG1-CD1 3.87Å; V276-L314 HydrophobicContact CG1-CG 4.49Å; V276-L314 HydrophobicContact CG2-CB 4.21Å; V310-L314 WeakPolarHBondContact O-CB 3.5Å; V310-L314 PolarHBondContact O-N 2.77Å; F311-L314 WeakPolarHBondContact O-CB 3.44Å; F311-L314 PolarHBondContact O-N 2.87Å; N312-L314 VanDerWaalsContact C-N 3.34Å; L314-Y316 VanDerWaalsContact C-N 3.28Å; L314-Y316 PolarHBondContact O-N 2.81Å; L314-A317 PolarHBondContact O-N 2.83Å; L314-L318 HydrophobicContact CD1-CD1 3.87Å; L314-L318 HydrophobicContact CD1-CG 4.12Å; L314-L318 HydrophobicContact CG-CD1 4.07Å; L314-L318 WeakPolarHBondContact O-CG 3.29Å; L314-L318 PolarHBondContact O-N 2.81Å
315	M	95.4	Very high	94.1	Very high	39 Å²	39	40.9 Å²	40.9	19%	0.192	18%	0.183	C	C	.	.	H	α-helix	trans	-62.1	-37.4	-179.8	-68.7	-56.1	134.6	0	0	111.7	F311 N312 L318 W319 F324 P377 V379	F311-M315 WeakPolarHBondContact O-CB 3.3Å; F311-M315 VanDerWaalsContact O-CG 3.24Å; F311-M315 WeakPolarHBondContact O-CG 3.46Å; F311-M315 PolarHBondContact O-N 2.86Å; N312-M315 PolarHBondContact O-N 2.75Å; M315-L318 HydrophobicContact CE-CD1 4.49Å; M315-L318 HydrophobicContact SD-CD1 4.49Å; M315-W319 VanDerWaalsContact O-CB 3.24Å; M315-W319 WeakPolarHBondContact O-CB 3.37Å; M315-W319 PolarHBondContact O-N 2.55Å; M315-F324 HydrophobicContact SD-CE1 4.49Å; M315-F324 HydrophobicContact SD-CZ 3.7Å; M315-P377 HydrophobicContact CB-CB 4.19Å; M315-P377 HydrophobicContact CB-CG 4.39Å; M315-P377 WeakPolarHBondContact CB-O 3.27Å; M315-P377 HydrophobicContact CG-CB 4.18Å; M315-P377 HydrophobicContact SD-CB 4.4Å; M315-P377 HydrophobicContact SD-CG 4.41Å; M315-V379 HydrophobicContact CG-CG2 4Å
316	Y	97	Very high	93.7	Very high	50 Å²	50	42.8 Å²	42.8	20%	0.196	19%	0.192	C	C	.	.	H	α-helix	trans	-63.2	-50.1	173.4	177.7	-98.6	0	0	0	112	T284 P285 F286 N312 S313 L314 L318 W319 D320 P376	T284-Y316 HydrophobicContact CG2-CD1 4Å; P285-Y316 VanDerWaalsContact CD-CE1 3.48Å; P285-Y316 HydrophobicContact CG-CD2 4.2Å; P285-Y316 HydrophobicContact CG-CE1 4.34Å; P285-Y316 HydrophobicContact CG-CE2 3.64Å; F286-Y316 HydrophobicContact CE1-CD2 4.31Å; F286-Y316 HydrophobicContact CE1-CG 4.19Å; N312-Y316 VanDerWaalsContact O-CB 3.27Å; N312-Y316 WeakPolarHBondContact O-CB 3.36Å; N312-Y316 PolarHBondContact O-N 3.37Å; S313-Y316 PolarHBondContact O-N 2.88Å; L314-Y316 VanDerWaalsContact C-N 3.28Å; L314-Y316 PolarHBondContact O-N 2.81Å; Y316-L318 VanDerWaalsContact C-N 3.28Å; Y316-L318 PolarHBondContact O-N 2.81Å; Y316-W319 HydrophobicContact CD2-CE3 4.12Å; Y316-W319 HydrophobicContact CD2-CZ3 4.36Å; Y316-W319 HydrophobicContact CE2-CE3 4.09Å; Y316-W319 AromaticContact CE2-CZ3 3.92Å; Y316-W319 HydrophobicContact CE2-CZ3 3.92Å; Y316-W319 PolarHBondContact O-N 2.88Å; Y316-W319 VanDerWaalsContact O-N 3.16Å; Y316-D320 WeakPolarHBondContact O-CB 3.3Å; Y316-D320 PolarHBondContact O-N 2.71Å; Y316-P376 HydrophobicContact CD2-CB 4.23Å; Y316-P376 HydrophobicContact CD2-CG 4.12Å
317	A	95.6	Very high	93.4	Very high	7 Å²	7	44.1 Å²	44.1	6%	0.058	20%	0.202	C	C	.	.	H	α-helix	trans	-61.5	-36.9	-179.9	0	0	0	0	0	112.3	L251 S313 L314 R321	L251-A317 HydrophobicContact CD2-CB 3.64Å; S313-A317 WeakPolarHBondContact O-CB 3.36Å; S313-A317 PolarHBondContact O-N 2.85Å; L314-A317 PolarHBondContact O-N 2.83Å; A317-R321 WeakPolarHBondContact O-CG 2.97Å; A317-R321 PolarHBondContact O-N 3.02Å
318	L	93.6	Very high	92.8	Very high	11 Å²	11	44.5 Å²	44.5	6%	0.058	20%	0.204	C	C	.	.	H	α-helix	trans	-67.3	-45.8	173.2	-72.2	173.5	0	0	0	112.1	L248 L251 L314 M315 Y316 R321 R322 F323 F324	L248-L318 HydrophobicContact CD2-CD2 3.68Å; L251-L318 HydrophobicContact CD1-CD2 3.75Å; L251-L318 HydrophobicContact CD1-CG 4.17Å; L314-L318 HydrophobicContact CD1-CD1 3.87Å; L314-L318 HydrophobicContact CD1-CG 4.12Å; L314-L318 HydrophobicContact CG-CD1 4.07Å; L314-L318 WeakPolarHBondContact O-CG 3.29Å; L314-L318 PolarHBondContact O-N 2.81Å; M315-L318 HydrophobicContact CE-CD1 4.49Å; M315-L318 HydrophobicContact SD-CD1 4.49Å; Y316-L318 VanDerWaalsContact C-N 3.28Å; Y316-L318 PolarHBondContact O-N 2.81Å; L318-R321 CarbonylContact O-C 3.58Å; L318-R321 PolarHBondContact O-N 3.29Å; L318-R322 PolarHBondContact O-N 3.33Å; L318-F323 HydrophobicContact CB-CB 3.85Å; L318-F323 HydrophobicContact CB-CD1 4.3Å; L318-F323 HydrophobicContact CB-CG 4.16Å; L318-F323 HydrophobicContact CD1-CD1 4.38Å; L318-F323 HydrophobicContact CD2-CB 4.02Å; L318-F323 HydrophobicContact CD2-CD1 4.12Å; L318-F323 HydrophobicContact CD2-CD2 3.68Å; L318-F323 HydrophobicContact CD2-CE2 4.09Å; L318-F323 HydrophobicContact CD2-CG 3.69Å; L318-F323 HydrophobicContact CD2-CZ 4.49Å; L318-F323 HydrophobicContact CG-CG 4.41Å; L318-F323 WeakPolarHBondContact O-CB 3.26Å; L318-F323 PolarHBondContact O-N 3.09Å; L318-F324 HydrophobicContact CB-CE2 3.62Å; L318-F324 HydrophobicContact CB-CZ 3.88Å; L318-F324 HydrophobicContact CD1-CZ 4.05Å
319	W	94.8	Very high	92.1	Very high	66 Å²	66	44.5 Å²	44.5	25%	0.25	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-44.3	-179.9	171.3	77.8	0	0	0	112.6	M315 Y316 R321 R322 F324 L373 P376	M315-W319 VanDerWaalsContact O-CB 3.24Å; M315-W319 WeakPolarHBondContact O-CB 3.37Å; M315-W319 PolarHBondContact O-N 2.55Å; Y316-W319 HydrophobicContact CD2-CE3 4.12Å; Y316-W319 HydrophobicContact CD2-CZ3 4.36Å; Y316-W319 HydrophobicContact CE2-CE3 4.09Å; Y316-W319 AromaticContact CE2-CZ3 3.92Å; Y316-W319 HydrophobicContact CE2-CZ3 3.92Å; Y316-W319 PolarHBondContact O-N 2.88Å; Y316-W319 VanDerWaalsContact O-N 3.16Å; W319-R321 PolarHBondContact O-N 2.97Å; W319-R322 WeakPolarHBondContact O-CA 3.25Å; W319-R322 PolarHBondContact O-N 2.89Å; W319-F324 HydrophobicContact CB-CD2 3.97Å; W319-F324 HydrophobicContact CB-CE2 4.1Å; W319-L373 PolarHBondContact NE1-O 3.01Å; W319-L373 VanDerWaalsContact NE1-O 3.12Å; W319-P376 HydrophobicContact CB-CB 4.02Å; W319-P376 HydrophobicContact CD2-CB 4.06Å; W319-P376 HydrophobicContact CD2-CG 4.47Å; W319-P376 HydrophobicContact CE3-CB 4.12Å; W319-P376 HydrophobicContact CE3-CG 4.29Å; W319-P376 HydrophobicContact CG-CB 4.03Å
320	D	94.5	Very high	91.1	Very high	85 Å²	85	46.5 Å²	46.5	46%	0.455	22%	0.215	S	C	.	.	H	α-helix	trans	-57.8	-31.1	176.7	-175.1	64.7	0	0	0	111.8	Y316 R322	Y316-D320 WeakPolarHBondContact O-CB 3.3Å; Y316-D320 PolarHBondContact O-N 2.71Å; D320-R322 VanDerWaalsContact C-N 3.31Å; D320-R322 PolarHBondContact O-N 2.91Å
321	R	92.6	Very high	90	Very high	101 Å²	101	52.3 Å²	52.3	38%	0.381	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	14	174.6	-60.5	-60.9	-178.5	-172.5	-7.5	114.4	L247 W278 A317 L318 W319 F323	L247-R321 HydrophobicContact CD1-CB 4.2Å; L247-R321 HydrophobicContact CD2-CB 4.31Å; W278-R321 HydrophobicContact CD2-CG 4.43Å; W278-R321 HydrophobicContact CE3-CG 3.99Å; W278-R321 HydrophobicContact CZ3-CG 4.19Å; A317-R321 WeakPolarHBondContact O-CG 2.97Å; A317-R321 PolarHBondContact O-N 3.02Å; L318-R321 CarbonylContact O-C 3.58Å; L318-R321 PolarHBondContact O-N 3.29Å; W319-R321 PolarHBondContact O-N 2.97Å; R321-F323 PolarHBondContact O-N 3.13Å; R321-F323 VanDerWaalsContact O-N 3.16Å
322	R	91.7	Very high	88.8	Confident	183 Å²	183	54 Å²	54	69%	0.691	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	26.4	179.5	-56.4	-180	-179.3	178.4	-0	113.3	L318 W319 D320 F324 N325	L318-R322 PolarHBondContact O-N 3.33Å; W319-R322 WeakPolarHBondContact O-CA 3.25Å; W319-R322 PolarHBondContact O-N 2.89Å; D320-R322 VanDerWaalsContact C-N 3.31Å; D320-R322 PolarHBondContact O-N 2.91Å; R322-F324 PolarHBondContact O-N 3.1Å; R322-F324 VanDerWaalsContact O-N 3.16Å; R322-N325 HydrophobicContact CB-CB 4.26Å; R322-N325 WeakPolarHBondContact O-CB 3.01Å; R322-N325 PolarHBondContact O-N 3.01Å
323	F	89.2	Confident	87.3	Confident	22 Å²	22	53.4 Å²	53.4	10%	0.096	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-32.1	179.6	-177.1	-91.7	0	0	0	112	L240 K244 L247 L248 L318 R321 N325	L240-F323 HydrophobicContact CD2-CE1 4.11Å; L240-F323 HydrophobicContact CD2-CE2 3.95Å; L240-F323 HydrophobicContact CD2-CZ 3.44Å; L240-F323 VanDerWaalsContact CD2-CZ 3.44Å; K244-F323 HydrophobicContact CB-CD2 3.92Å; K244-F323 HydrophobicContact CB-CE2 3.72Å; K244-F323 HydrophobicContact CD-CD2 4.33Å; K244-F323 HydrophobicContact CD-CE2 4.49Å; K244-F323 WeakPolarHBondContact CD-O 3.39Å; K244-F323 WeakPolarHBondContact CE-O 3.23Å; K244-F323 HydrophobicContact CG-CD2 4.35Å; K244-F323 PolarHBondContact NZ-O 3.29Å; L247-F323 HydrophobicContact CD1-CB 4.45Å; L247-F323 HydrophobicContact CD1-CD2 4.14Å; L248-F323 HydrophobicContact CD1-CE2 4.3Å; L248-F323 HydrophobicContact CD1-CZ 4.45Å; L248-F323 HydrophobicContact CD2-CE2 4.27Å; L248-F323 HydrophobicContact CG-CE2 4.13Å; L318-F323 HydrophobicContact CB-CB 3.85Å; L318-F323 HydrophobicContact CB-CD1 4.3Å; L318-F323 HydrophobicContact CB-CG 4.16Å; L318-F323 HydrophobicContact CD1-CD1 4.38Å; L318-F323 HydrophobicContact CD2-CB 4.02Å; L318-F323 HydrophobicContact CD2-CD1 4.12Å; L318-F323 HydrophobicContact CD2-CD2 3.68Å; L318-F323 HydrophobicContact CD2-CE2 4.09Å; L318-F323 HydrophobicContact CD2-CG 3.69Å; L318-F323 HydrophobicContact CD2-CZ 4.49Å; L318-F323 HydrophobicContact CG-CG 4.41Å; L318-F323 WeakPolarHBondContact O-CB 3.26Å; L318-F323 PolarHBondContact O-N 3.09Å; R321-F323 PolarHBondContact O-N 3.13Å; R321-F323 VanDerWaalsContact O-N 3.16Å; F323-N325 VanDerWaalsContact C-N 3.33Å; F323-N325 PolarHBondContact O-N 3.22Å
324	F	89.4	Confident	85.7	Confident	36 Å²	36	56.3 Å²	56.3	16%	0.158	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	11.5	179.4	-53.5	-72.8	0	0	0	114.5	M315 L318 W319 R322 F326 L373 P377	M315-F324 HydrophobicContact SD-CE1 4.49Å; M315-F324 HydrophobicContact SD-CZ 3.7Å; L318-F324 HydrophobicContact CB-CE2 3.62Å; L318-F324 HydrophobicContact CB-CZ 3.88Å; L318-F324 HydrophobicContact CD1-CZ 4.05Å; W319-F324 HydrophobicContact CB-CD2 3.97Å; W319-F324 HydrophobicContact CB-CE2 4.1Å; R322-F324 PolarHBondContact O-N 3.1Å; R322-F324 VanDerWaalsContact O-N 3.16Å; F324-F326 HydrophobicContact CB-CE2 4.46Å; F324-F326 VanDerWaalsContact O-CD2 3.27Å; F324-F326 WeakPolarHBondContact O-CD2 3.04Å; F324-F326 WeakPolarHBondContact O-CE2 3.4Å; F324-L373 HydrophobicContact CB-CB 4.19Å; F324-L373 HydrophobicContact CB-CD1 3.42Å; F324-L373 VanDerWaalsContact CB-CD1 3.42Å; F324-L373 HydrophobicContact CB-CG 3.59Å; F324-L373 HydrophobicContact CD1-CD1 4.18Å; F324-L373 HydrophobicContact CD2-CD1 3.7Å; F324-L373 HydrophobicContact CG-CD1 3.5Å; F324-L373 HydrophobicContact CG-CG 4.25Å; F324-P377 HydrophobicContact CD2-CG 4.28Å; F324-P377 HydrophobicContact CE1-CG 4.48Å; F324-P377 HydrophobicContact CE2-CG 3.9Å; F324-P377 HydrophobicContact CZ-CG 4.03Å
325	N	89.5	Confident	84.1	Confident	54 Å²	54	56.2 Å²	56.2	29%	0.289	27%	0.272	S	S	.	.			trans	-92.4	118.8	172.9	-68.1	3.2	0	0	0	109.3	K244 R322 F323 M371 T372	K244-N325 WeakPolarHBondContact CE-O 3.33Å; K244-N325 PolarHBondContact NZ-O 2.78Å; R322-N325 HydrophobicContact CB-CB 4.26Å; R322-N325 WeakPolarHBondContact O-CB 3.01Å; R322-N325 PolarHBondContact O-N 3.01Å; F323-N325 VanDerWaalsContact C-N 3.33Å; F323-N325 PolarHBondContact O-N 3.22Å; N325-M371 CarbonylContact C-O 3.56Å; N325-M371 WeakPolarHBondContact CA-O 3.42Å; N325-T372 HydrophobicContact CB-CG2 4.2Å
326	F	85.7	Confident	82.7	Confident	41 Å²	41	54.4 Å²	54.4	18%	0.18	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	139.2	-179.1	-59.1	-94.2	0	0	0	109.5	L239 K244 F324 L328 V370 M371	L239-F326 WeakPolarHBondContact O-CE1 3.49Å; K244-F326 HydrophobicContact CD-CE1 4.24Å; K244-F326 VanDerWaalsContact NZ-CZ 3.27Å; F324-F326 HydrophobicContact CB-CE2 4.46Å; F324-F326 VanDerWaalsContact O-CD2 3.27Å; F324-F326 WeakPolarHBondContact O-CD2 3.04Å; F324-F326 WeakPolarHBondContact O-CE2 3.4Å; F326-L328 HydrophobicContact CB-CD2 4.33Å; F326-V370 CarbonylContact O-C 3.59Å; F326-V370 WeakPolarHBondContact O-CA 3.36Å; F326-M371 HydrophobicContact CB-CB 4.45Å; F326-M371 HydrophobicContact CB-CE 4.02Å; F326-M371 HydrophobicContact CG-CE 4.42Å; F326-M371 PolarHBondContact N-O 3Å; F326-M371 PolarHBondContact O-N 2.96Å
327	V	86	Confident	81.2	Confident	74 Å²	74	58.4 Å²	58.4	45%	0.448	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	107.8	168	179.3	0	0	0	0	105.3	T329 N332 V370	V327-T329 HydrophobicContact CG1-CG2 4.41Å; V327-N332 PolarHBondContact O-ND2 3.49Å; V327-V370 HydrophobicContact CG1-CG2 4.21Å; V327-V370 HydrophobicContact CG2-CG1 4.28Å; V327-V370 HydrophobicContact CG2-CG2 4.17Å
328	L	82.1	Confident	79.4	Confident	8 Å²	8	60.6 Å²	60.6	4%	0.042	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.4	-179.9	-52.7	-177.6	0	0	0	108.9	L239 F326 N332 L335 M336 E368 L369 M371	L239-L328 HydrophobicContact CD2-CD2 4.35Å; F326-L328 HydrophobicContact CB-CD2 4.33Å; L328-N332 WeakPolarHBondContact CA-OD1 3.39Å; L328-L335 HydrophobicContact CD1-CD2 4.2Å; L328-M336 HydrophobicContact CB-CG 3.68Å; L328-M336 HydrophobicContact CB-SD 4.22Å; L328-E368 WeakPolarHBondContact O-CA 3.27Å; L328-L369 HydrophobicContact CB-CB 4.3Å; L328-L369 HydrophobicContact CD1-CD2 4.38Å; L328-L369 PolarHBondContact N-O 2.91Å; L328-L369 PolarHBondContact O-N 3.21Å; L328-M371 HydrophobicContact CD1-CE 3.59Å; L328-M371 HydrophobicContact CG-CE 4.17Å
329	T	80.7	Confident	77.9	Confident	27 Å²	27	61.9 Å²	61.9	17%	0.166	30%	0.301	C	S	.	.			trans	-127.6	168.1	175.7	66.9	0	0	0	0	108.9	V327 H331 N332 S333 M336 E368	V327-T329 HydrophobicContact CG1-CG2 4.41Å; T329-H331 PolarHBondContact O-N 2.9Å; T329-H331 VanDerWaalsContact O-N 3.16Å; T329-H331 PolarHBondContact OG1-N 2.84Å; T329-N332 PolarHBondContact N-OD1 2.93Å; T329-N332 PolarHBondContact O-N 3.3Å; T329-N332 PolarHBondContact O-OD1 3.35Å; T329-N332 VanDerWaalsContact O-OD1 3.09Å; T329-S333 PolarHBondContact O-N 2.83Å; T329-M336 WeakPolarHBondContact O-CB 3.24Å; T329-E368 HydrophobicContact CG2-CG 3.8Å
330	E	74.9	Confident	76.4	Confident	62 Å²	62	61.6 Å²	61.6	29%	0.29	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-33.8	173.8	67.1	-168.8	168.4	0	0	113.3	R366	E330-R366 VanDerWaalsContact OE1-CD 3.28Å; E330-R366 WeakPolarHBondContact OE1-CD 3.22Å; E330-R366 IonicContact OE1-CZ 3.22Å; E330-R366 IonicContact OE1-NE 3.87Å; E330-R366 PolarHBondContact OE1-NE 2.77Å; E330-R366 IonicContact OE1-NH1 3.88Å; E330-R366 PolarHBondContact OE1-NH1 3.47Å
331	H	73.3	Confident	74.9	Confident	139 Å²	139	59.4 Å²	59.4	64%	0.644	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-20.1	-173.9	-63.6	-66.6	0	0	0	113.9	T329 R366	T329-H331 PolarHBondContact O-N 2.9Å; T329-H331 VanDerWaalsContact O-N 3.16Å; T329-H331 PolarHBondContact OG1-N 2.84Å; H331-R366 PolarHBondContact NE2-NH1 3.32Å
332	N	69	Low	73.2	Confident	76 Å²	76	60.5 Å²	60.5	41%	0.406	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-0.1	-170	76.6	8.1	0	0	0	114.1	V327 L328 T329	V327-N332 PolarHBondContact O-ND2 3.49Å; L328-N332 WeakPolarHBondContact CA-OD1 3.39Å; T329-N332 PolarHBondContact N-OD1 2.93Å; T329-N332 PolarHBondContact O-N 3.3Å; T329-N332 PolarHBondContact O-OD1 3.35Å; T329-N332 VanDerWaalsContact O-OD1 3.09Å
333	S	66.6	Low	71.5	Confident	4 Å²	4	59.8 Å²	59.8	3%	0.028	32%	0.316	C	S	.	.			trans	-149.8	115.7	-172.9	-176.6	0	0	0	0	111.8	T329 L335 M336 E337	T329-S333 PolarHBondContact O-N 2.83Å; S333-L335 PolarHBondContact O-N 2.87Å; S333-L335 VanDerWaalsContact O-N 3.12Å; S333-L335 WeakPolarHBondContact OG-CB 3.12Å; S333-L335 PolarHBondContact OG-N 3.5Å; S333-M336 WeakPolarHBondContact O-CB 3.27Å; S333-M336 PolarHBondContact O-N 2.75Å; S333-E337 PolarHBondContact O-N 2.74Å; S333-E337 VanDerWaalsContact O-N 3.1Å
334	A	63.8	Low	70	Confident	62 Å²	62	60.1 Å²	60.1	51%	0.512	32%	0.321	S	S	.	.	H	α-helix	trans	-57.1	-24.4	168.8	0	0	0	0	0	112	E337 L338	A334-E337 PolarHBondContact O-N 2.73Å; A334-L338 VanDerWaalsContact O-CB 3.29Å; A334-L338 WeakPolarHBondContact O-CB 3.46Å; A334-L338 PolarHBondContact O-N 3.12Å
335	L	61.8	Low	68.2	Low	34 Å²	34	62.2 Å²	62.2	18%	0.178	35%	0.345	C	S	.	.	H	α-helix	trans	-65.8	-40.2	172.3	-178.1	69	0	0	0	111.6	L328 S333 L338 L339 I464	L328-L335 HydrophobicContact CD1-CD2 4.2Å; S333-L335 PolarHBondContact O-N 2.87Å; S333-L335 VanDerWaalsContact O-N 3.12Å; S333-L335 WeakPolarHBondContact OG-CB 3.12Å; S333-L335 PolarHBondContact OG-N 3.5Å; L335-L338 PolarHBondContact O-N 2.97Å; L335-L339 HydrophobicContact CG-CD1 4.05Å; L335-L339 HydrophobicContact CG-CG 4.46Å; L335-L339 VanDerWaalsContact O-CB 3.32Å; L335-L339 WeakPolarHBondContact O-CB 3.14Å; L335-L339 WeakPolarHBondContact O-CG 3.3Å; L335-L339 PolarHBondContact O-N 3.01Å; L335-I464 HydrophobicContact CD1-CB 4.49Å; L335-I464 HydrophobicContact CD1-CD1 3.66Å; L335-I464 HydrophobicContact CD1-CG1 3.91Å; L335-I464 HydrophobicContact CD1-CG2 3.73Å; L335-I464 HydrophobicContact CD2-CG2 3.96Å; L335-I464 HydrophobicContact CG-CG2 4.49Å
336	M	65.1	Low	66.5	Low	1 Å²	1	65.6 Å²	65.6	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-72.1	-35.4	176.8	-70.8	-61.9	-63	0	0	111.6	L328 T329 S333 L339 Q340 L367 L369	L328-M336 HydrophobicContact CB-CG 3.68Å; L328-M336 HydrophobicContact CB-SD 4.22Å; T329-M336 WeakPolarHBondContact O-CB 3.24Å; S333-M336 WeakPolarHBondContact O-CB 3.27Å; S333-M336 PolarHBondContact O-N 2.75Å; M336-L339 PolarHBondContact O-N 3.34Å; M336-L339 HydrophobicContact SD-CD1 4.25Å; M336-Q340 VanDerWaalsContact O-CB 3.31Å; M336-Q340 WeakPolarHBondContact O-CB 3.23Å; M336-Q340 VanDerWaalsContact O-CG 3.27Å; M336-Q340 WeakPolarHBondContact O-CG 3.4Å; M336-Q340 PolarHBondContact O-N 2.81Å; M336-Q340 PolarHBondContact O-NE2 2.79Å; M336-L367 HydrophobicContact CE-CB 4.06Å; M336-L367 WeakPolarHBondContact CE-O 3.5Å; M336-L369 HydrophobicContact SD-CB 3.82Å
337	E	65.2	Low	65.1	Low	133 Å²	133	72.7 Å²	72.7	62%	0.621	39%	0.391	S	S	*	.	H	α-helix	trans	-61	-46.2	170.9	-171.3	179.4	-177.4	0	0	110.9	S333 A334 Q340 S341	S333-E337 PolarHBondContact O-N 2.74Å; S333-E337 VanDerWaalsContact O-N 3.1Å; A334-E337 PolarHBondContact O-N 2.73Å; E337-Q340 PolarHBondContact O-N 3.15Å; E337-S341 WeakPolarHBondContact O-CB 3.07Å; E337-S341 PolarHBondContact O-N 3.38Å
338	L	58.4	Low	63.6	Low	54 Å²	54	72.3 Å²	72.3	28%	0.283	39%	0.386	S	S	.	.	H	α-helix	trans	-65.8	-41.1	177	-177.8	65.4	0	0	0	112.7	A334 L335 Q340 S341 A345 F346	A334-L338 VanDerWaalsContact O-CB 3.29Å; A334-L338 WeakPolarHBondContact O-CB 3.46Å; A334-L338 PolarHBondContact O-N 3.12Å; L335-L338 PolarHBondContact O-N 2.97Å; L338-Q340 VanDerWaalsContact C-N 3.32Å; L338-S341 WeakPolarHBondContact O-CB 3.36Å; L338-S341 PolarHBondContact O-N 2.78Å; L338-A345 HydrophobicContact CD1-CB 4.01Å; L338-F346 HydrophobicContact CD2-CD2 3.91Å; L338-F346 HydrophobicContact CD2-CE2 3.55Å
339	L	60.7	Low	62.7	Low	38 Å²	38	72.3 Å²	72.3	20%	0.199	39%	0.387	C	S	.	.	H	α-helix	trans	-65.3	-37.8	177.1	-75.8	171.1	0	0	0	111.1	L335 M336 L350	L335-L339 HydrophobicContact CG-CD1 4.05Å; L335-L339 HydrophobicContact CG-CG 4.46Å; L335-L339 VanDerWaalsContact O-CB 3.32Å; L335-L339 WeakPolarHBondContact O-CB 3.14Å; L335-L339 WeakPolarHBondContact O-CG 3.3Å; L335-L339 PolarHBondContact O-N 3.01Å; M336-L339 PolarHBondContact O-N 3.34Å; M336-L339 HydrophobicContact SD-CD1 4.25Å; L339-L350 HydrophobicContact CB-CB 4.11Å; L339-L350 HydrophobicContact CB-CD2 4.19Å; L339-L350 WeakPolarHBondContact O-CA 3.28Å; L339-L350 WeakPolarHBondContact O-CB 3.28Å; L339-L350 PolarHBondContact O-N 2.84Å
340	Q	63.4	Low	61.9	Low	59 Å²	59	71.6 Å²	71.6	28%	0.276	38%	0.382	S	S	.	.	H	α-helix	trans	-84.4	-18.3	179.6	-70.1	176.3	60	0	0	114.1	M336 E337 L338	M336-Q340 VanDerWaalsContact O-CB 3.31Å; M336-Q340 WeakPolarHBondContact O-CB 3.23Å; M336-Q340 VanDerWaalsContact O-CG 3.27Å; M336-Q340 WeakPolarHBondContact O-CG 3.4Å; M336-Q340 PolarHBondContact O-N 2.81Å; M336-Q340 PolarHBondContact O-NE2 2.79Å; E337-Q340 PolarHBondContact O-N 3.15Å; L338-Q340 VanDerWaalsContact C-N 3.32Å
341	S	63.4	Low	61.5	Low	40 Å²	40	71.4 Å²	71.4	28%	0.28	39%	0.386	S	S	.	.			trans	-56.2	142.2	174	-178.1	0	0	0	0	110.5	E337 L338 E343 C344 C349	E337-S341 WeakPolarHBondContact O-CB 3.07Å; E337-S341 PolarHBondContact O-N 3.38Å; L338-S341 WeakPolarHBondContact O-CB 3.36Å; L338-S341 PolarHBondContact O-N 2.78Å; S341-E343 PolarHBondContact OG-N 3.47Å; S341-E343 PolarHBondContact OG-O 2.95Å; S341-C344 PolarHBondContact O-SG 2.8Å; S341-C349 WeakPolarHBondContact O-CB 3.49Å; S341-C349 PolarHBondContact O-SG 2.93Å
342	T	57.8	Low	61.1	Low	124 Å²	124	68.6 Å²	68.6	76%	0.761	38%	0.376	S	S	*	.	S	Bend	trans	-82.7	-17.2	166.7	48.5	0	0	0	0	112	C349	T342-C349 PolarHBondContact O-SG 3.31Å; T342-C349 VanDerWaalsContact O-SG 3.36Å
343	E	56.7	Low	61	Low	167 Å²	167	65.3 Å²	65.3	78%	0.78	36%	0.358	S	S	*	.	S	Bend	trans	-97.3	91.8	172.3	-67.2	-175.9	-177.1	0	0	108.6	S341	S341-E343 PolarHBondContact OG-N 3.47Å; S341-E343 PolarHBondContact OG-O 2.95Å
344	C	56.5	Low	61.2	Low	29 Å²	29	66 Å²	66	20%	0.196	36%	0.361	C	S	.	.			trans	-93.3	122	-173.2	-68	0	0	0	0	112.2	S341 F346 E347 L348 C349	S341-C344 PolarHBondContact O-SG 2.8Å; C344-F346 PolarHBondContact O-N 3.44Å; C344-F346 VanDerWaalsContact O-N 3.12Å; C344-E347 PolarHBondContact O-N 2.75Å; C344-L348 WeakPolarHBondContact CB-O 3.48Å; C344-L348 VanDerWaalsContact SG-C 3.54Å; C344-L348 PolarHBondContact SG-O 2.83Å; C344-L348 VanDerWaalsContact SG-O 3.35Å; C344-C349 HydrophobicContact CB-CB 4.34Å; C344-C349 WeakPolarHBondContact CB-SG 3.3Å; C344-C349 WeakPolarHBondContact SG-CA 3.26Å; C344-C349 WeakPolarHBondContact SG-CB 3.28Å; C344-C349 PolarHBondContact SG-N 2.83Å; C344-C349 CovalentContact SG-SG 2.03Å; C344-C349 PolarHBondContact SG-SG 3.42Å
345	A	52.2	Low	61.6	Low	80 Å²	80	70.5 Å²	70.5	66%	0.661	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.4	175.7	0	0	0	0	0	113.6	L338	L338-A345 HydrophobicContact CD1-CB 4.01Å
346	F	53.9	Low	61.8	Low	126 Å²	126	75.1 Å²	75.1	55%	0.553	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.1	25.2	-175.7	-58.8	-69	0	0	0	113.4	L338 C344 L348	L338-F346 HydrophobicContact CD2-CD2 3.91Å; L338-F346 HydrophobicContact CD2-CE2 3.55Å; C344-F346 PolarHBondContact O-N 3.44Å; C344-F346 VanDerWaalsContact O-N 3.12Å; F346-L348 PolarHBondContact O-N 3.06Å; F346-L348 VanDerWaalsContact O-N 3.1Å
347	E	54.9	Low	61.8	Low	189 Å²	189	76.2 Å²	76.2	88%	0.883	40%	0.402	S	S	*	.	S	Bend	trans	59.3	15	-179.6	-60.4	-175.5	165.4	0	0	115.5	C344	C344-E347 PolarHBondContact O-N 2.75Å
348	L	54.8	Low	61.9	Low	66 Å²	66	77.3 Å²	77.3	35%	0.346	41%	0.412	S	S	.	.			trans	-153.9	128.5	-178.5	-130.1	131.5	0	0	0	113.1	C344 F346 L353 F456	C344-L348 WeakPolarHBondContact CB-O 3.48Å; C344-L348 VanDerWaalsContact SG-C 3.54Å; C344-L348 PolarHBondContact SG-O 2.83Å; C344-L348 VanDerWaalsContact SG-O 3.35Å; F346-L348 PolarHBondContact O-N 3.06Å; F346-L348 VanDerWaalsContact O-N 3.1Å; L348-L353 HydrophobicContact CD2-CB 4.46Å; L348-F456 HydrophobicContact CD1-CE2 3.84Å; L348-F456 HydrophobicContact CD1-CZ 3.48Å; L348-F456 VanDerWaalsContact CD1-CZ 3.48Å; L348-F456 HydrophobicContact CD2-CE1 3.82Å; L348-F456 HydrophobicContact CD2-CZ 3.4Å; L348-F456 VanDerWaalsContact CD2-CZ 3.4Å; L348-F456 HydrophobicContact CG-CZ 3.94Å
349	C	63.2	Low	62.5	Low	9 Å²	9	76.2 Å²	76.2	6%	0.061	41%	0.406	C	S	.	.			trans	-105.3	149.9	-177.6	-54.6	0	0	0	0	112.2	S341 T342 C344 P351 D352 L353	S341-C349 WeakPolarHBondContact O-CB 3.49Å; S341-C349 PolarHBondContact O-SG 2.93Å; T342-C349 PolarHBondContact O-SG 3.31Å; T342-C349 VanDerWaalsContact O-SG 3.36Å; C344-C349 HydrophobicContact CB-CB 4.34Å; C344-C349 WeakPolarHBondContact CB-SG 3.3Å; C344-C349 WeakPolarHBondContact SG-CA 3.26Å; C344-C349 WeakPolarHBondContact SG-CB 3.28Å; C344-C349 PolarHBondContact SG-N 2.83Å; C344-C349 CovalentContact SG-SG 2.03Å; C344-C349 PolarHBondContact SG-SG 3.42Å; C349-P351 VanDerWaalsContact C-CD 3.5Å; C349-P351 VanDerWaalsContact C-N 3.31Å; C349-D352 VanDerWaalsContact CB-OD2 3.32Å; C349-D352 WeakPolarHBondContact CB-OD2 3.45Å; C349-D352 PolarHBondContact N-OD2 2.98Å; C349-D352 WeakPolarHBondContact O-CB 3.4Å; C349-D352 PolarHBondContact O-N 3.11Å; C349-D352 VanDerWaalsContact O-N 3.11Å; C349-L353 PolarHBondContact O-N 3.39Å
350	L	65	Low	62.8	Low	12 Å²	12	81.7 Å²	81.7	6%	0.063	44%	0.436	C	S	.	.	H	α-helix	trans	-59.6	-37	175.9	-173.1	62.9	0	0	0	112.2	L339 L353 L354 L367	L339-L350 HydrophobicContact CB-CB 4.11Å; L339-L350 HydrophobicContact CB-CD2 4.19Å; L339-L350 WeakPolarHBondContact O-CA 3.28Å; L339-L350 WeakPolarHBondContact O-CB 3.28Å; L339-L350 PolarHBondContact O-N 2.84Å; L350-L353 HydrophobicContact CD1-CD2 4.19Å; L350-L353 WeakPolarHBondContact O-CB 3.47Å; L350-L353 PolarHBondContact O-N 3.34Å; L350-L354 HydrophobicContact CG-CD1 4.24Å; L350-L354 HydrophobicContact CG-CG 4.4Å; L350-L354 VanDerWaalsContact O-CG 3.29Å; L350-L354 WeakPolarHBondContact O-CG 3.35Å; L350-L354 PolarHBondContact O-N 3.07Å; L350-L367 HydrophobicContact CD2-CD1 3.5Å; L350-L367 HydrophobicContact CG-CD1 4.25Å
351	P	65.3	Low	63	Low	57 Å²	57	80.2 Å²	80.2	37%	0.37	43%	0.43	S	S	.	.	H	α-helix	trans	-56	-48.3	168.7	-27.5	36.5	0	0	0	113.2	C349 L353 L354 E355	C349-P351 VanDerWaalsContact C-CD 3.5Å; C349-P351 VanDerWaalsContact C-N 3.31Å; P351-L353 PolarHBondContact O-N 3.39Å; P351-L354 PolarHBondContact O-N 3.32Å; P351-L354 VanDerWaalsContact O-N 3.13Å; P351-E355 WeakPolarHBondContact O-CB 3.49Å; P351-E355 PolarHBondContact O-N 3.44Å
352	D	66.5	Low	63.3	Low	80 Å²	80	81.8 Å²	81.8	43%	0.428	44%	0.436	S	S	.	.	H	α-helix	trans	-58.2	-37.3	177.3	-51.9	-29	0	0	0	111.3	C349 L356	C349-D352 VanDerWaalsContact CB-OD2 3.32Å; C349-D352 WeakPolarHBondContact CB-OD2 3.45Å; C349-D352 PolarHBondContact N-OD2 2.98Å; C349-D352 WeakPolarHBondContact O-CB 3.4Å; C349-D352 PolarHBondContact O-N 3.11Å; C349-D352 VanDerWaalsContact O-N 3.11Å; D352-L356 WeakPolarHBondContact O-CB 3.18Å; D352-L356 PolarHBondContact O-N 3.41Å
353	L	65.7	Low	63.6	Low	8 Å²	8	85.6 Å²	85.6	4%	0.042	44%	0.442	C	S	.	.	H	α-helix	trans	-71.2	-41.3	178.2	-176	54.9	0	0	0	112.4	L348 C349 L350 P351 E355 L356 L357 F456 F457	L348-L353 HydrophobicContact CD2-CB 4.46Å; C349-L353 PolarHBondContact O-N 3.39Å; L350-L353 HydrophobicContact CD1-CD2 4.19Å; L350-L353 WeakPolarHBondContact O-CB 3.47Å; L350-L353 PolarHBondContact O-N 3.34Å; P351-L353 PolarHBondContact O-N 3.39Å; L353-E355 VanDerWaalsContact C-N 3.35Å; L353-L356 PolarHBondContact O-N 2.78Å; L353-L357 HydrophobicContact CD1-CD1 4.01Å; L353-L357 HydrophobicContact CD1-CG 4.35Å; L353-L357 HydrophobicContact CG-CD1 4.11Å; L353-L357 WeakPolarHBondContact O-CB 3.24Å; L353-L357 WeakPolarHBondContact O-CD1 3.42Å; L353-L357 WeakPolarHBondContact O-CG 3.49Å; L353-L357 PolarHBondContact O-N 3.38Å; L353-L357 VanDerWaalsContact O-N 3.13Å; L353-F456 HydrophobicContact CD1-CD1 3.82Å; L353-F456 HydrophobicContact CD1-CE1 3.65Å; L353-F456 HydrophobicContact CD2-CE1 4.17Å; L353-F456 HydrophobicContact CG-CE1 4.49Å; L353-F457 HydrophobicContact CD1-CE2 4.31Å; L353-F457 HydrophobicContact CD1-CZ 4.02Å; L353-F457 HydrophobicContact CD2-CD1 3.94Å; L353-F457 HydrophobicContact CD2-CE1 3.18Å; L353-F457 HydrophobicContact CD2-CE2 4.35Å; L353-F457 HydrophobicContact CD2-CZ 3.41Å; L353-F457 VanDerWaalsContact CD2-CZ 3.41Å; L353-F457 HydrophobicContact CG-CE1 4.05Å; L353-F457 HydrophobicContact CG-CZ 3.74Å
354	L	71.2	Confident	64.3	Low	17 Å²	17	84.6 Å²	84.6	9%	0.089	44%	0.437	C	S	.	.	H	α-helix	trans	-66.5	-39.8	175.6	-69.6	170.3	0	0	0	111.1	L350 P351 L357 D358 I359 V361 L367 L396 V407	L350-L354 HydrophobicContact CG-CD1 4.24Å; L350-L354 HydrophobicContact CG-CG 4.4Å; L350-L354 VanDerWaalsContact O-CG 3.29Å; L350-L354 WeakPolarHBondContact O-CG 3.35Å; L350-L354 PolarHBondContact O-N 3.07Å; P351-L354 PolarHBondContact O-N 3.32Å; P351-L354 VanDerWaalsContact O-N 3.13Å; L354-L357 PolarHBondContact O-N 3.32Å; L354-D358 PolarHBondContact O-N 2.58Å; L354-I359 HydrophobicContact CD2-CB 4.14Å; L354-I359 HydrophobicContact CD2-CD1 4.36Å; L354-I359 HydrophobicContact CD2-CG2 4Å; L354-I359 PolarHBondContact O-N 2.83Å; L354-V361 HydrophobicContact CD1-CG2 3.94Å; L354-V361 HydrophobicContact CD2-CG2 4.13Å; L354-L367 HydrophobicContact CD1-CD1 3.88Å; L354-L396 HydrophobicContact CD2-CD2 4.26Å; L354-V407 HydrophobicContact CD2-CG1 4.37Å
355	E	71	Confident	65.4	Low	158 Å²	158	84 Å²	84	74%	0.738	43%	0.434	S	S	*	.	H	α-helix	trans	-65.2	-44.7	174.5	-172.2	175.1	-178.5	0	0	111.5	P351 L353 L357 D358	P351-E355 WeakPolarHBondContact O-CB 3.49Å; P351-E355 PolarHBondContact O-N 3.44Å; L353-E355 VanDerWaalsContact C-N 3.35Å; E355-L357 PolarHBondContact O-N 3.26Å; E355-D358 PolarHBondContact O-N 3.01Å; E355-D358 VanDerWaalsContact O-N 3.15Å
356	L	66.7	Low	66.8	Low	131 Å²	131	87 Å²	87	69%	0.686	43%	0.428	S	S	*	.	H	α-helix	trans	-58.8	-31	175.1	-177.5	66	0	0	0	112.5	D352 L353	D352-L356 WeakPolarHBondContact O-CB 3.18Å; D352-L356 PolarHBondContact O-N 3.41Å; L353-L356 PolarHBondContact O-N 2.78Å
357	L	66.3	Low	68.2	Low	23 Å²	23	81.8 Å²	81.8	12%	0.12	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	1.4	-177.9	-66.5	171.2	0	0	0	113.9	L353 L354 E355 I359 L449 E453 F457	L353-L357 HydrophobicContact CD1-CD1 4.01Å; L353-L357 HydrophobicContact CD1-CG 4.35Å; L353-L357 HydrophobicContact CG-CD1 4.11Å; L353-L357 WeakPolarHBondContact O-CB 3.24Å; L353-L357 WeakPolarHBondContact O-CD1 3.42Å; L353-L357 WeakPolarHBondContact O-CG 3.49Å; L353-L357 PolarHBondContact O-N 3.38Å; L353-L357 VanDerWaalsContact O-N 3.13Å; L354-L357 PolarHBondContact O-N 3.32Å; E355-L357 PolarHBondContact O-N 3.26Å; L357-I359 HydrophobicContact CB-CD1 3.7Å; L357-I359 HydrophobicContact CB-CG1 3.72Å; L357-I359 HydrophobicContact CD1-CD1 3.95Å; L357-I359 HydrophobicContact CG-CD1 4.46Å; L357-I359 PolarHBondContact O-N 2.75Å; L357-L449 HydrophobicContact CD1-CD2 3.98Å; L357-L449 HydrophobicContact CD2-CD2 3.85Å; L357-E453 HydrophobicContact CD2-CB 4.02Å; L357-E453 HydrophobicContact CD2-CG 3.39Å; L357-E453 WeakPolarHBondContact CD2-OE1 3.3Å; L357-F457 HydrophobicContact CD1-CE2 3.73Å; L357-F457 HydrophobicContact CD1-CZ 3.72Å
358	D	67.3	Low	69.7	Low	156 Å²	156	75.3 Å²	75.3	83%	0.834	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	35.7	-174.5	-161.8	34	0	0	0	112.4	L354 E355	L354-D358 PolarHBondContact O-N 2.58Å; E355-D358 PolarHBondContact O-N 3.01Å; E355-D358 VanDerWaalsContact O-N 3.15Å
359	I	69.3	Low	71.2	Confident	32 Å²	32	73.4 Å²	73.4	16%	0.164	37%	0.365	C	S	.	.			trans	-97.4	99.7	178.9	-61.4	177.3	0	0	0	108.2	L354 L357 V361 V407 A447	L354-I359 HydrophobicContact CD2-CB 4.14Å; L354-I359 HydrophobicContact CD2-CD1 4.36Å; L354-I359 HydrophobicContact CD2-CG2 4Å; L354-I359 PolarHBondContact O-N 2.83Å; L357-I359 HydrophobicContact CB-CD1 3.7Å; L357-I359 HydrophobicContact CB-CG1 3.72Å; L357-I359 HydrophobicContact CD1-CD1 3.95Å; L357-I359 HydrophobicContact CG-CD1 4.46Å; L357-I359 PolarHBondContact O-N 2.75Å; I359-V361 HydrophobicContact CG2-CG2 3.81Å; I359-V361 PolarHBondContact O-N 3.39Å; I359-V407 HydrophobicContact CD1-CG1 3.88Å; I359-V407 HydrophobicContact CG2-CG1 3.48Å; I359-V407 VanDerWaalsContact CG2-CG1 3.48Å; I359-A447 HydrophobicContact CD1-CB 4.49Å
360	D	67.8	Low	72.5	Confident	153 Å²	153	74 Å²	74	82%	0.818	37%	0.369	S	S	*	.			trans	-73.7	112	173	-163.2	7.4	0	0	0	110
361	V	68.6	Low	73.6	Confident	27 Å²	27	75.8 Å²	75.8	16%	0.164	38%	0.378	C	S	.	.			trans	-108.8	123.9	176.6	-175.8	0	0	0	0	107.5	L354 I359 F363 S365 L367	L354-V361 HydrophobicContact CD1-CG2 3.94Å; L354-V361 HydrophobicContact CD2-CG2 4.13Å; I359-V361 HydrophobicContact CG2-CG2 3.81Å; I359-V361 PolarHBondContact O-N 3.39Å; V361-F363 PolarHBondContact O-N 2.94Å; V361-S365 WeakPolarHBondContact CG1-OG 3.35Å; V361-L367 HydrophobicContact CG1-CD2 4.07Å
362	D	68.9	Low	75	Confident	73 Å²	73	74.5 Å²	74.5	39%	0.39	37%	0.369	S	S	.	.			trans	-53.7	130.5	178	-175.9	-2.6	0	0	0	110.9	E364 S365	D362-E364 PolarHBondContact O-N 3.18Å; D362-E364 PolarHBondContact OD1-N 3.26Å; D362-E364 VanDerWaalsContact OD1-N 3.14Å; D362-S365 WeakPolarHBondContact O-CB 3.34Å; D362-S365 PolarHBondContact O-N 3.33Å; D362-S365 PolarHBondContact O-OG 3.24Å
363	F	63.7	Low	76.3	Confident	204 Å²	204	72.3 Å²	72.3	90%	0.895	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-25.4	179.6	-67.8	-80.2	0	0	0	113.2	V361 S365	V361-F363 PolarHBondContact O-N 2.94Å; F363-S365 VanDerWaalsContact C-N 3.3Å
364	E	71.8	Confident	77.8	Confident	146 Å²	146	76.3 Å²	76.3	68%	0.682	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-5.3	175.3	-64.9	-168.2	170.8	0	0	113.5	D362	D362-E364 PolarHBondContact O-N 3.18Å; D362-E364 PolarHBondContact OD1-N 3.26Å; D362-E364 VanDerWaalsContact OD1-N 3.14Å
365	S	79.1	Confident	79	Confident	18 Å²	18	77.2 Å²	77.2	13%	0.126	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-92.6	148.1	-177	77.7	0	0	0	0	112.8	V361 D362 F363 S398 V399	V361-S365 WeakPolarHBondContact CG1-OG 3.35Å; D362-S365 WeakPolarHBondContact O-CB 3.34Å; D362-S365 PolarHBondContact O-N 3.33Å; D362-S365 PolarHBondContact O-OG 3.24Å; F363-S365 VanDerWaalsContact C-N 3.3Å; S365-S398 WeakPolarHBondContact CB-OG 3.28Å; S365-S398 PolarHBondContact OG-OG 2.95Å; S365-V399 WeakPolarHBondContact CA-O 3.23Å
366	R	81.5	Confident	80.2	Confident	142 Å²	142	71.7 Å²	71.7	54%	0.536	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	143.6	175.9	-62.6	178.2	-174.4	-167.5	0.5	110.4	E330 H331 S398 V399	E330-R366 VanDerWaalsContact OE1-CD 3.28Å; E330-R366 WeakPolarHBondContact OE1-CD 3.22Å; E330-R366 IonicContact OE1-CZ 3.22Å; E330-R366 IonicContact OE1-NE 3.87Å; E330-R366 PolarHBondContact OE1-NE 2.77Å; E330-R366 IonicContact OE1-NH1 3.88Å; E330-R366 PolarHBondContact OE1-NH1 3.47Å; H331-R366 PolarHBondContact NE2-NH1 3.32Å; R366-S398 CarbonylContact O-C 3.54Å; R366-S398 WeakPolarHBondContact O-CA 3.29Å; R366-V399 PolarHBondContact N-O 2.82Å; R366-V399 PolarHBondContact O-N 2.9Å
367	L	82.9	Confident	81.6	Confident	17 Å²	17	65.9 Å²	65.9	9%	0.089	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	131.7	177.3	-65.5	173.8	0	0	0	111.1	M336 L350 L354 V361 L396 N397	M336-L367 HydrophobicContact CE-CB 4.06Å; M336-L367 WeakPolarHBondContact CE-O 3.5Å; L350-L367 HydrophobicContact CD2-CD1 3.5Å; L350-L367 HydrophobicContact CG-CD1 4.25Å; L354-L367 HydrophobicContact CD1-CD1 3.88Å; V361-L367 HydrophobicContact CG1-CD2 4.07Å; L367-L396 HydrophobicContact CB-CD1 4.28Å; L367-L396 HydrophobicContact CD2-CD1 4.35Å; L367-L396 HydrophobicContact CD2-CD2 4.49Å; L367-L396 HydrophobicContact CD2-CG 4.37Å; L367-N397 CarbonylContact C-O 3.54Å; L367-N397 WeakPolarHBondContact CA-O 3.37Å
368	E	87	Confident	83.1	Confident	53 Å²	53	68.5 Å²	68.5	25%	0.248	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.5	172.6	-63.7	-169.9	164.1	0	0	110.2	L328 T329 N397 V399	L328-E368 WeakPolarHBondContact O-CA 3.27Å; T329-E368 HydrophobicContact CG2-CG 3.8Å; E368-N397 HydrophobicContact CB-CB 4.38Å; E368-N397 PolarHBondContact N-O 2.9Å; E368-N397 PolarHBondContact O-N 2.96Å; E368-V399 HydrophobicContact CB-CG2 4.37Å; E368-V399 VanDerWaalsContact CD-CG2 3.42Å; E368-V399 HydrophobicContact CG-CG2 3.68Å
369	L	86.5	Confident	84.4	Confident	25 Å²	25	61.3 Å²	61.3	13%	0.131	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	111.1	172.5	-172.1	71.6	0	0	0	109.4	L328 M336 M371 I394 Y395 L396	L328-L369 HydrophobicContact CB-CB 4.3Å; L328-L369 HydrophobicContact CD1-CD2 4.38Å; L328-L369 PolarHBondContact N-O 2.91Å; L328-L369 PolarHBondContact O-N 3.21Å; M336-L369 HydrophobicContact SD-CB 3.82Å; L369-M371 HydrophobicContact CD2-SD 4.44Å; L369-M371 HydrophobicContact CG-CG 4.38Å; L369-I394 HydrophobicContact CD1-CG2 3.43Å; L369-I394 VanDerWaalsContact CD1-CG2 3.43Å; L369-I394 HydrophobicContact CG-CG2 4.16Å; L369-Y395 CarbonylContact C-O 3.59Å; L369-Y395 WeakPolarHBondContact CA-O 3.5Å; L369-L396 HydrophobicContact CD1-CD1 4.31Å
370	V	89.6	Confident	85.6	Confident	23 Å²	23	61.9 Å²	61.9	14%	0.139	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	118.9	179.9	-177.8	0	0	0	0	109.3	F326 V327 T372 I394 Y395	F326-V370 CarbonylContact O-C 3.59Å; F326-V370 WeakPolarHBondContact O-CA 3.36Å; V327-V370 HydrophobicContact CG1-CG2 4.21Å; V327-V370 HydrophobicContact CG2-CG1 4.28Å; V327-V370 HydrophobicContact CG2-CG2 4.17Å; V370-T372 HydrophobicContact CG1-CG2 4.13Å; V370-I394 CarbonylContact O-C 3.57Å; V370-I394 WeakPolarHBondContact O-CA 3.41Å; V370-Y395 HydrophobicContact CB-CD2 3.86Å; V370-Y395 HydrophobicContact CG1-CD2 3.84Å; V370-Y395 HydrophobicContact CG1-CE2 4.44Å; V370-Y395 PolarHBondContact N-O 3.15Å; V370-Y395 WeakPolarHBondContact O-CD2 3.47Å; V370-Y395 PolarHBondContact O-N 3.39Å
371	M	90	Very high	86.7	Confident	49 Å²	49	55.4 Å²	55.4	24%	0.241	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129.5	177.2	-57.6	-174.1	-72.1	0	0	109.5	N325 F326 L328 L369 K393 I394	N325-M371 CarbonylContact C-O 3.56Å; N325-M371 WeakPolarHBondContact CA-O 3.42Å; F326-M371 HydrophobicContact CB-CB 4.45Å; F326-M371 HydrophobicContact CB-CE 4.02Å; F326-M371 HydrophobicContact CG-CE 4.42Å; F326-M371 PolarHBondContact N-O 3Å; F326-M371 PolarHBondContact O-N 2.96Å; L328-M371 HydrophobicContact CD1-CE 3.59Å; L328-M371 HydrophobicContact CG-CE 4.17Å; L369-M371 HydrophobicContact CD2-SD 4.44Å; L369-M371 HydrophobicContact CG-CG 4.38Å; M371-K393 WeakPolarHBondContact CA-O 3.34Å; M371-I394 HydrophobicContact CG-CD1 4.37Å; M371-I394 HydrophobicContact CG-CG1 4.02Å; M371-I394 HydrophobicContact CG-CG2 4.28Å; M371-I394 HydrophobicContact SD-CD1 4.38Å
372	T	92.8	Very high	87.3	Confident	29 Å²	29	55.9 Å²	55.9	18%	0.178	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	143.6	-179.5	57.6	0	0	0	0	110.7	N325 V370 G392 K393	N325-T372 HydrophobicContact CB-CG2 4.2Å; V370-T372 HydrophobicContact CG1-CG2 4.13Å; T372-G392 CarbonylContact O-C 3.58Å; T372-G392 WeakPolarHBondContact O-CA 3.45Å; T372-K393 PolarHBondContact N-O 3.26Å; T372-K393 PolarHBondContact O-N 3.21Å
373	L	95.3	Very high	87.6	Confident	35 Å²	35	57.6 Å²	57.6	18%	0.183	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	132	171.5	-67.8	-170.7	0	0	0	110.7	W319 F324 P377 K391	W319-L373 PolarHBondContact NE1-O 3.01Å; W319-L373 VanDerWaalsContact NE1-O 3.12Å; F324-L373 HydrophobicContact CB-CB 4.19Å; F324-L373 HydrophobicContact CB-CD1 3.42Å; F324-L373 VanDerWaalsContact CB-CD1 3.42Å; F324-L373 HydrophobicContact CB-CG 3.59Å; F324-L373 HydrophobicContact CD1-CD1 4.18Å; F324-L373 HydrophobicContact CD2-CD1 3.7Å; F324-L373 HydrophobicContact CG-CD1 3.5Å; F324-L373 HydrophobicContact CG-CG 4.25Å; L373-P377 HydrophobicContact CD1-CG 3.52Å; L373-K391 WeakPolarHBondContact CA-O 3.46Å; L373-K391 WeakPolarHBondContact CD2-O 3.49Å
374	I	95.7	Very high	88.3	Confident	92 Å²	92	53.4 Å²	53.4	47%	0.472	28%	0.283	S	S	.	.	S	Bend	trans	-88.7	-16.2	178.6	60.2	170.3	0	0	0	112.5	K391 K393	I374-K391 HydrophobicContact CD1-CB 4.05Å; I374-K391 HydrophobicContact CG1-CB 3.81Å; I374-K391 WeakPolarHBondContact CG1-O 3.24Å; I374-K391 PolarHBondContact N-O 2.82Å; I374-K393 HydrophobicContact CG2-CD 4.13Å; I374-K393 HydrophobicContact CG2-CG 3.89Å
375	A	96.5	Very high	89.1	Confident	35 Å²	35	49.6 Å²	49.6	29%	0.289	26%	0.264	S	S	.	.	S	Bend	trans	-145.7	154.7	177.8	0	0	0	0	0	109.3
376	P	96.5	Very high	89.7	Confident	43 Å²	43	48.7 Å²	48.7	28%	0.279	26%	0.258	S	S	.	.			trans	-60.8	141.4	176	27.8	-36.8	0	0	0	110.7	Y316 W319	Y316-P376 HydrophobicContact CD2-CB 4.23Å; Y316-P376 HydrophobicContact CD2-CG 4.12Å; W319-P376 HydrophobicContact CB-CB 4.02Å; W319-P376 HydrophobicContact CD2-CB 4.06Å; W319-P376 HydrophobicContact CD2-CG 4.47Å; W319-P376 HydrophobicContact CE3-CB 4.12Å; W319-P376 HydrophobicContact CE3-CG 4.29Å; W319-P376 HydrophobicContact CG-CB 4.03Å
377	P	97	Very high	90.4	Very high	9 Å²	9	43.5 Å²	43.5	6%	0.058	24%	0.24	C	C	.	.			trans	-56.8	139.2	169.3	-21.9	31	0	0	0	111.1	M315 F324 L373 V388 T389	M315-P377 HydrophobicContact CB-CB 4.19Å; M315-P377 HydrophobicContact CB-CG 4.39Å; M315-P377 WeakPolarHBondContact CB-O 3.27Å; M315-P377 HydrophobicContact CG-CB 4.18Å; M315-P377 HydrophobicContact SD-CB 4.4Å; M315-P377 HydrophobicContact SD-CG 4.41Å; F324-P377 HydrophobicContact CD2-CG 4.28Å; F324-P377 HydrophobicContact CE1-CG 4.48Å; F324-P377 HydrophobicContact CE2-CG 3.9Å; F324-P377 HydrophobicContact CZ-CG 4.03Å; L373-P377 HydrophobicContact CD1-CG 3.52Å; P377-V388 HydrophobicContact CB-CG1 3.98Å; P377-T389 CarbonylContact C-O 3.59Å; P377-T389 WeakPolarHBondContact CA-O 3.28Å
378	N	97	Very high	91	Very high	78 Å²	78	44.6 Å²	44.6	42%	0.417	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	115.3	175	180	83.6	0	0	0	109.8	V388 T389	N378-V388 WeakPolarHBondContact O-CA 3.4Å; N378-T389 PolarHBondContact N-O 3.15Å; N378-T389 PolarHBondContact O-N 3.16Å; N378-T389 PolarHBondContact O-OG1 3.15Å
379	V	96.1	Very high	91.5	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.03	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	133.8	171.5	-174.2	0	0	0	0	109	F311 N312 M315 F381 M387 V388 F418	F311-V379 HydrophobicContact CB-CB 3.87Å; F311-V379 HydrophobicContact CB-CG1 3.93Å; F311-V379 HydrophobicContact CB-CG2 3.93Å; F311-V379 HydrophobicContact CG-CG1 4.36Å; N312-V379 PolarHBondContact ND2-O 3.31Å; N312-V379 WeakPolarHBondContact OD1-CA 3.44Å; N312-V379 PolarHBondContact OD1-N 2.76Å; N312-V379 PolarHBondContact OD1-O 2.83Å; M315-V379 HydrophobicContact CG-CG2 4Å; V379-F381 HydrophobicContact CG1-CE1 4.28Å; V379-F381 HydrophobicContact CG1-CZ 4.2Å; V379-M387 CarbonylContact C-O 3.54Å; V379-M387 VanDerWaalsContact CA-O 3.24Å; V379-M387 WeakPolarHBondContact CA-O 3.3Å; V379-V388 HydrophobicContact CG2-CG1 4.48Å; V379-V388 HydrophobicContact CG2-CG2 4.15Å; V379-F418 HydrophobicContact CG1-CE1 4.06Å; V379-F418 HydrophobicContact CG1-CZ 3.93Å
380	S	94.4	Very high	91.9	Very high	43 Å²	43	44.4 Å²	44.4	30%	0.301	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	153.8	169.1	59.5	0	0	0	0	109.9	G386 M387	S380-G386 CarbonylContact O-C 3.57Å; S380-G386 WeakPolarHBondContact O-CA 3.44Å; S380-M387 PolarHBondContact N-O 3.11Å; S380-M387 PolarHBondContact O-N 2.86Å
381	F	91	Very high	92.3	Very high	18 Å²	18	48.7 Å²	48.7	8%	0.079	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	141.2	174.9	-61.3	-59.9	0	0	0	110.3	D308 F311 V379 F418 F494 G496 M499	D308-F381 HydrophobicContact CB-CD2 3.92Å; D308-F381 HydrophobicContact CB-CE2 4.08Å; F311-F381 AromaticContact CD2-CE2 3.69Å; F311-F381 HydrophobicContact CD2-CE2 3.69Å; F311-F381 AromaticContact CD2-CZ 3.52Å; F311-F381 HydrophobicContact CD2-CZ 3.52Å; F311-F381 AromaticContact CE2-CE2 3.81Å; F311-F381 HydrophobicContact CE2-CE2 3.81Å; F311-F381 AromaticContact CE2-CZ 3.52Å; F311-F381 HydrophobicContact CE2-CZ 3.52Å; F311-F381 HydrophobicContact CG-CZ 4.17Å; F311-F381 HydrophobicContact CZ-CZ 4.17Å; V379-F381 HydrophobicContact CG1-CE1 4.28Å; V379-F381 HydrophobicContact CG1-CZ 4.2Å; F381-F418 HydrophobicContact CE1-CE2 4.2Å; F381-F418 AromaticContact CE1-CZ 3.79Å; F381-F418 HydrophobicContact CE1-CZ 3.79Å; F381-F494 HydrophobicContact CB-CD1 4.37Å; F381-F494 AromaticContact CD1-CD1 3.46Å; F381-F494 HydrophobicContact CD1-CD1 3.46Å; F381-F494 VanDerWaalsContact CD1-CD1 3.46Å; F381-F494 AromaticContact CD1-CE1 3.5Å; F381-F494 HydrophobicContact CD1-CE1 3.5Å; F381-F494 AromaticContact CE1-CD1 3.98Å; F381-F494 HydrophobicContact CE1-CD1 3.98Å; F381-F494 AromaticContact CE1-CE1 3.59Å; F381-F494 HydrophobicContact CE1-CE1 3.59Å; F381-F494 HydrophobicContact CG-CD1 4.07Å; F381-F494 HydrophobicContact CG-CE1 4.49Å; F381-G496 CarbonylContact C-O 3.57Å; F381-M499 HydrophobicContact CE1-CE 3.89Å; F381-M499 HydrophobicContact CE2-CB 4.33Å; F381-M499 HydrophobicContact CZ-CB 4.23Å; F381-M499 HydrophobicContact CZ-CE 3.61Å
382	S	81	Confident	92.6	Very high	36 Å²	36	46.6 Å²	46.6	25%	0.252	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	165.8	167	67.7	0	0	0	0	108.7	N384 F385 F494	S382-N384 PolarHBondContact O-N 2.84Å; S382-F385 PolarHBondContact N-O 3.03Å; S382-F385 PolarHBondContact O-N 3.37Å; S382-F385 VanDerWaalsContact O-O 3.09Å; S382-F385 WeakPolarHBondContact OG-CD2 3.33Å; S382-F385 WeakPolarHBondContact OG-CE1 3.47Å; S382-F385 VanDerWaalsContact OG-CE2 3.23Å; S382-F385 WeakPolarHBondContact OG-CE2 3.19Å; S382-F385 VanDerWaalsContact OG-CZ 3.26Å; S382-F385 WeakPolarHBondContact OG-CZ 3.33Å; S382-F385 PolarHBondContact OG-O 3.4Å; S382-F494 WeakPolarHBondContact O-CB 3.19Å
383	D	74.7	Confident	92.6	Very high	109 Å²	109	47.6 Å²	47.6	58%	0.583	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	110.2	173.5	-59.5	-30.5	0	0	0	108.2
384	N	78.9	Confident	92.5	Very high	117 Å²	117	47.3 Å²	47.3	63%	0.626	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	96	-14.9	177.6	-47.9	-60	0	0	0	119.2	S382	S382-N384 PolarHBondContact O-N 2.84Å
385	F	87.8	Confident	92.2	Very high	65 Å²	65	45.4 Å²	45.4	29%	0.285	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	158.6	179	56.4	-86.1	0	0	0	112.5	S382 M387 A417 F418 R419	S382-F385 PolarHBondContact N-O 3.03Å; S382-F385 PolarHBondContact O-N 3.37Å; S382-F385 VanDerWaalsContact O-O 3.09Å; S382-F385 WeakPolarHBondContact OG-CD2 3.33Å; S382-F385 WeakPolarHBondContact OG-CE1 3.47Å; S382-F385 VanDerWaalsContact OG-CE2 3.23Å; S382-F385 WeakPolarHBondContact OG-CE2 3.19Å; S382-F385 VanDerWaalsContact OG-CZ 3.26Å; S382-F385 WeakPolarHBondContact OG-CZ 3.33Å; S382-F385 PolarHBondContact OG-O 3.4Å; F385-M387 HydrophobicContact CD2-CG 3.76Å; F385-M387 HydrophobicContact CD2-SD 3.59Å; F385-M387 VanDerWaalsContact CD2-SD 3.59Å; F385-M387 HydrophobicContact CE2-CG 3.57Å; F385-M387 HydrophobicContact CE2-SD 3.41Å; F385-M387 WeakPolarHBondContact CE2-SD 3.5Å; F385-A417 HydrophobicContact CD2-CB 4.19Å; F385-F418 WeakPolarHBondContact CB-O 3.48Å; F385-R419 HydrophobicContact CB-CG 4.09Å
386	G	92.6	Very high	91.8	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	151.4	165.9	0	0	0	0	0	110.7	S380 A417 F418	S380-G386 CarbonylContact O-C 3.57Å; S380-G386 WeakPolarHBondContact O-CA 3.44Å; G386-A417 CarbonylContact O-C 3.49Å; G386-A417 WeakPolarHBondContact O-CA 3.11Å; G386-F418 VanDerWaalsContact C-CD1 3.42Å; G386-F418 VanDerWaalsContact CA-CE1 3.45Å; G386-F418 PolarHBondContact N-O 2.99Å; G386-F418 VanDerWaalsContact O-CD1 3.29Å; G386-F418 WeakPolarHBondContact O-CD1 3.45Å; G386-F418 PolarHBondContact O-N 2.62Å
387	M	94.8	Very high	91.4	Very high	33 Å²	33	43.1 Å²	43.1	16%	0.163	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.8	173.5	-67.9	-64.5	-83.1	0	0	109	V379 S380 F385 T415 A416 A417 D435	V379-M387 CarbonylContact C-O 3.54Å; V379-M387 VanDerWaalsContact CA-O 3.24Å; V379-M387 WeakPolarHBondContact CA-O 3.3Å; S380-M387 PolarHBondContact N-O 3.11Å; S380-M387 PolarHBondContact O-N 2.86Å; F385-M387 HydrophobicContact CD2-CG 3.76Å; F385-M387 HydrophobicContact CD2-SD 3.59Å; F385-M387 VanDerWaalsContact CD2-SD 3.59Å; F385-M387 HydrophobicContact CE2-CG 3.57Å; F385-M387 HydrophobicContact CE2-SD 3.41Å; F385-M387 WeakPolarHBondContact CE2-SD 3.5Å; M387-T415 HydrophobicContact CE-CG2 3.28Å; M387-A416 CarbonylContact C-O 3.52Å; M387-A416 VanDerWaalsContact CA-O 3.3Å; M387-A416 WeakPolarHBondContact CA-O 3.41Å; M387-A417 VanDerWaalsContact SD-CA 3.5Å; M387-A417 HydrophobicContact SD-CB 3.5Å; M387-A417 WeakPolarHBondContact SD-CB 3.36Å; M387-D435 HydrophobicContact CE-CB 4.42Å
388	V	95.7	Very high	90.9	Very high	39 Å²	39	43.2 Å²	43.2	24%	0.236	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.8	170.1	-171.1	0	0	0	0	108.1	P377 N378 V379 T415 A416 F418	P377-V388 HydrophobicContact CB-CG1 3.98Å; N378-V388 WeakPolarHBondContact O-CA 3.4Å; V379-V388 HydrophobicContact CG2-CG1 4.48Å; V379-V388 HydrophobicContact CG2-CG2 4.15Å; V388-T415 CarbonylContact O-C 3.55Å; V388-T415 WeakPolarHBondContact O-CA 3.41Å; V388-A416 PolarHBondContact N-O 3.02Å; V388-A416 PolarHBondContact O-N 3.04Å; V388-F418 HydrophobicContact CG2-CD1 3.64Å; V388-F418 HydrophobicContact CG2-CE1 3.46Å; V388-F418 VanDerWaalsContact CG2-CE1 3.46Å
389	T	97	Very high	90.4	Very high	45 Å²	45	41.5 Å²	41.5	28%	0.276	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	134.4	172.5	54.5	0	0	0	0	109.4	P377 N378 A414 T415	P377-T389 CarbonylContact C-O 3.59Å; P377-T389 WeakPolarHBondContact CA-O 3.28Å; N378-T389 PolarHBondContact N-O 3.15Å; N378-T389 PolarHBondContact O-N 3.16Å; N378-T389 PolarHBondContact O-OG1 3.15Å; T389-A414 CarbonylContact C-O 3.49Å; T389-A414 WeakPolarHBondContact CA-O 3.41Å; T389-T415 HydrophobicContact CG2-CG2 3.98Å
390	S	96.3	Very high	90	Very high	30 Å²	30	42.2 Å²	42.2	21%	0.21	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	148.2	-180	64.3	0	0	0	0	111	A414	S390-A414 PolarHBondContact N-O 2.96Å; S390-A414 PolarHBondContact O-N 3.38Å
391	K	97.1	Very high	89.4	Confident	112 Å²	112	44.8 Å²	44.8	49%	0.487	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	129.8	176.4	-69	178.7	-171.4	-178	0	108.6	L373 I374 V412 H413	L373-K391 WeakPolarHBondContact CA-O 3.46Å; L373-K391 WeakPolarHBondContact CD2-O 3.49Å; I374-K391 HydrophobicContact CD1-CB 4.05Å; I374-K391 HydrophobicContact CG1-CB 3.81Å; I374-K391 WeakPolarHBondContact CG1-O 3.24Å; I374-K391 PolarHBondContact N-O 2.82Å; K391-V412 WeakPolarHBondContact CA-O 3.26Å; K391-H413 VanDerWaalsContact CG-CD2 3.48Å; K391-H413 WeakPolarHBondContact CG-CD2 3.23Å
392	G	95.9	Very high	88.8	Confident	5 Å²	5	52.7 Å²	52.7	5%	0.052	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	-175	-175.9	0	0	0	0	0	113.5	T372 V412	T372-G392 CarbonylContact O-C 3.58Å; T372-G392 WeakPolarHBondContact O-CA 3.45Å; G392-V412 PolarHBondContact N-O 2.78Å; G392-V412 PolarHBondContact O-N 3.03Å
393	K	94.4	Very high	89	Confident	51 Å²	51	52.6 Å²	52.6	22%	0.222	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	138.7	174.1	-64.2	-173.9	176.3	-147.3	0	109.1	M371 T372 I374 Y395 V410 N411 D442	M371-K393 WeakPolarHBondContact CA-O 3.34Å; T372-K393 PolarHBondContact N-O 3.26Å; T372-K393 PolarHBondContact O-N 3.21Å; I374-K393 HydrophobicContact CG2-CD 4.13Å; I374-K393 HydrophobicContact CG2-CG 3.89Å; K393-Y395 HydrophobicContact CB-CE1 4.06Å; K393-Y395 HydrophobicContact CB-CE2 3.96Å; K393-Y395 HydrophobicContact CD-CE1 4.26Å; K393-Y395 WeakPolarHBondContact CD-OH 3.34Å; K393-V410 CarbonylContact C-O 3.52Å; K393-V410 VanDerWaalsContact CA-O 3.31Å; K393-V410 WeakPolarHBondContact CA-O 3.49Å; K393-N411 VanDerWaalsContact CE-OD1 3.22Å; K393-N411 WeakPolarHBondContact CE-OD1 3.19Å; K393-D442 IonicContact NZ-OD2 2.76Å; K393-D442 PolarHBondContact NZ-OD2 2.83Å
394	I	91.5	Very high	89.6	Confident	28 Å²	28	52 Å²	52	14%	0.144	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.6	172	-57.3	-177.7	0	0	0	107.6	L369 V370 M371 V410 V412 M439	L369-I394 HydrophobicContact CD1-CG2 3.43Å; L369-I394 VanDerWaalsContact CD1-CG2 3.43Å; L369-I394 HydrophobicContact CG-CG2 4.16Å; V370-I394 CarbonylContact O-C 3.57Å; V370-I394 WeakPolarHBondContact O-CA 3.41Å; M371-I394 HydrophobicContact CG-CD1 4.37Å; M371-I394 HydrophobicContact CG-CG1 4.02Å; M371-I394 HydrophobicContact CG-CG2 4.28Å; M371-I394 HydrophobicContact SD-CD1 4.38Å; I394-V410 HydrophobicContact CB-CG2 3.74Å; I394-V410 HydrophobicContact CG2-CG2 4.48Å; I394-V410 PolarHBondContact N-O 3.31Å; I394-V410 PolarHBondContact O-N 3.13Å; I394-V412 HydrophobicContact CB-CG2 4.42Å; I394-V412 HydrophobicContact CD1-CG2 3.67Å; I394-V412 HydrophobicContact CG1-CG2 3.7Å; I394-M439 HydrophobicContact CD1-CE 4.28Å
395	Y	90.2	Very high	89.9	Confident	53 Å²	53	49.5 Å²	49.5	21%	0.208	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.9	177.3	-43.9	-76.8	0	0	0	108.3	L369 V370 K393 K409	L369-Y395 CarbonylContact C-O 3.59Å; L369-Y395 WeakPolarHBondContact CA-O 3.5Å; V370-Y395 HydrophobicContact CB-CD2 3.86Å; V370-Y395 HydrophobicContact CG1-CD2 3.84Å; V370-Y395 HydrophobicContact CG1-CE2 4.44Å; V370-Y395 PolarHBondContact N-O 3.15Å; V370-Y395 WeakPolarHBondContact O-CD2 3.47Å; V370-Y395 PolarHBondContact O-N 3.39Å; K393-Y395 HydrophobicContact CB-CE1 4.06Å; K393-Y395 HydrophobicContact CB-CE2 3.96Å; K393-Y395 HydrophobicContact CD-CE1 4.26Å; K393-Y395 WeakPolarHBondContact CD-OH 3.34Å; Y395-K409 HydrophobicContact CD1-CB 3.91Å; Y395-K409 HydrophobicContact CD1-CD 3.85Å; Y395-K409 HydrophobicContact CD1-CG 3.7Å; Y395-K409 HydrophobicContact CE1-CB 4.29Å; Y395-K409 HydrophobicContact CE1-CD 3.97Å; Y395-K409 HydrophobicContact CE1-CG 4.24Å
396	L	87.4	Confident	89.8	Confident	4 Å²	4	47.3 Å²	47.3	2%	0.021	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122.3	161.7	-173.4	66.3	0	0	0	107.5	L354 L367 L369 N406 V407 F408	L354-L396 HydrophobicContact CD2-CD2 4.26Å; L367-L396 HydrophobicContact CB-CD1 4.28Å; L367-L396 HydrophobicContact CD2-CD1 4.35Å; L367-L396 HydrophobicContact CD2-CD2 4.49Å; L367-L396 HydrophobicContact CD2-CG 4.37Å; L369-L396 HydrophobicContact CD1-CD1 4.31Å; L396-N406 PolarHBondContact O-ND2 3.3Å; L396-V407 HydrophobicContact CB-CB 4.25Å; L396-V407 HydrophobicContact CD2-CB 4.25Å; L396-V407 HydrophobicContact CD2-CG1 4.08Å; L396-V407 HydrophobicContact CG-CB 4.19Å; L396-V407 HydrophobicContact CG-CG2 4.44Å; L396-V407 WeakPolarHBondContact O-CB 3.4Å; L396-V407 PolarHBondContact O-N 3.34Å; L396-F408 HydrophobicContact CB-CD1 3.89Å; L396-F408 HydrophobicContact CB-CD2 4.43Å; L396-F408 HydrophobicContact CB-CE1 3.55Å; L396-F408 HydrophobicContact CB-CE2 4.14Å; L396-F408 HydrophobicContact CB-CG 4.31Å; L396-F408 HydrophobicContact CB-CZ 3.69Å; L396-F408 HydrophobicContact CD2-CD1 4.01Å; L396-F408 HydrophobicContact CD2-CE1 3.4Å; L396-F408 VanDerWaalsContact CD2-CE1 3.4Å; L396-F408 HydrophobicContact CD2-CZ 4.12Å; L396-F408 HydrophobicContact CG-CE1 4.12Å; L396-F408 PolarHBondContact N-O 2.8Å; L396-F408 VanDerWaalsContact N-O 3.09Å; L396-F408 PolarHBondContact O-N 3.33Å
397	N	88.5	Confident	89.4	Confident	25 Å²	25	47.9 Å²	47.9	13%	0.134	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	143.4	176.4	-62.2	-33.7	0	0	0	109.4	L367 E368 V404 V405 N406	L367-N397 CarbonylContact C-O 3.54Å; L367-N397 WeakPolarHBondContact CA-O 3.37Å; E368-N397 HydrophobicContact CB-CB 4.38Å; E368-N397 PolarHBondContact N-O 2.9Å; E368-N397 PolarHBondContact O-N 2.96Å; N397-V404 HydrophobicContact CB-CG1 3.82Å; N397-V405 CarbonylContact C-O 3.59Å; N397-V405 WeakPolarHBondContact CA-O 3.48Å; N397-N406 PolarHBondContact OD1-ND2 3.18Å
398	S	86.7	Confident	89	Confident	12 Å²	12	46.7 Å²	46.7	8%	0.084	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	123.4	164.4	159.7	0	0	0	0	107.3	S365 R366 V404 V405	S365-S398 WeakPolarHBondContact CB-OG 3.28Å; S365-S398 PolarHBondContact OG-OG 2.95Å; R366-S398 CarbonylContact O-C 3.54Å; R366-S398 WeakPolarHBondContact O-CA 3.29Å; S398-V404 WeakPolarHBondContact O-CA 3.3Å; S398-V405 PolarHBondContact N-O 2.92Å; S398-V405 PolarHBondContact O-N 3.28Å
399	V	87.3	Confident	88.8	Confident	42 Å²	42	47 Å²	47	26%	0.255	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	100.7	-179	-176.9	0	0	0	0	107.8	S365 R366 E368 V404	S365-V399 WeakPolarHBondContact CA-O 3.23Å; R366-V399 PolarHBondContact N-O 2.82Å; R366-V399 PolarHBondContact O-N 2.9Å; E368-V399 HydrophobicContact CB-CG2 4.37Å; E368-V399 VanDerWaalsContact CD-CG2 3.42Å; E368-V399 HydrophobicContact CG-CG2 3.68Å; V399-V404 HydrophobicContact CG1-CG2 4.41Å; V399-V404 HydrophobicContact CG2-CG1 4.28Å; V399-V404 HydrophobicContact CG2-CG2 4.14Å
400	G	86.2	Confident	88.6	Confident	20 Å²	20	45 Å²	45	21%	0.206	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	-175.3	179	0	0	0	0	0	112.6	Q402 G403	G400-Q402 PolarHBondContact O-N 3.29Å; G400-G403 PolarHBondContact N-O 2.9Å; G400-G403 PolarHBondContact O-N 2.89Å
401	P	82.8	Confident	88.6	Confident	96 Å²	96	45.5 Å²	45.5	62%	0.623	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-30.4	178.7	-21.9	31.5	0	0	0	113.5	G403	P401-G403 VanDerWaalsContact C-N 3.26Å; P401-G403 PolarHBondContact O-N 2.84Å
402	Q	78.8	Confident	88.5	Confident	185 Å²	185	41.1 Å²	41.1	86%	0.864	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-4.9	-178.6	-56.9	-175.2	11.5	0	0	113.4	G400	G400-Q402 PolarHBondContact O-N 3.29Å
403	G	85.6	Confident	88.5	Confident	34 Å²	34	43.9 Å²	43.9	35%	0.351	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	113.9	-163.7	-177.9	0	0	0	0	0	113.2	G400 P401	G400-G403 PolarHBondContact N-O 2.9Å; G400-G403 PolarHBondContact O-N 2.89Å; P401-G403 VanDerWaalsContact C-N 3.26Å; P401-G403 PolarHBondContact O-N 2.84Å
404	V	86	Confident	88.6	Confident	95 Å²	95	41.9 Å²	41.9	58%	0.576	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	114.8	-176.6	-175.4	0	0	0	0	109.9	N397 S398 V399	N397-V404 HydrophobicContact CB-CG1 3.82Å; S398-V404 WeakPolarHBondContact O-CA 3.3Å; V399-V404 HydrophobicContact CG1-CG2 4.41Å; V399-V404 HydrophobicContact CG2-CG1 4.28Å; V399-V404 HydrophobicContact CG2-CG2 4.14Å
405	V	85.3	Confident	88.8	Confident	66 Å²	66	41.3 Å²	41.3	40%	0.4	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	121.5	172	-179.9	0	0	0	0	108.6	N397 S398 V407	N397-V405 CarbonylContact C-O 3.59Å; N397-V405 WeakPolarHBondContact CA-O 3.48Å; S398-V405 PolarHBondContact N-O 2.92Å; S398-V405 PolarHBondContact O-N 3.28Å; V405-V407 PolarHBondContact O-N 2.91Å
406	N	85.1	Confident	89	Confident	19 Å²	19	39.5 Å²	39.5	10%	0.102	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	121.7	170.8	179.3	-102.1	0	0	0	110	L396 N397 F408 K409	L396-N406 PolarHBondContact O-ND2 3.3Å; N397-N406 PolarHBondContact OD1-ND2 3.18Å; N406-F408 PolarHBondContact ND2-O 2.94Å; N406-F408 VanDerWaalsContact ND2-O 3.11Å; N406-K409 WeakPolarHBondContact ND2-CG 3.38Å; N406-K409 VanDerWaalsContact OD1-CE 3.26Å; N406-K409 WeakPolarHBondContact OD1-CE 3.36Å; N406-K409 WeakPolarHBondContact OD1-CG 3.36Å
407	V	85	Confident	89.3	Confident	11 Å²	11	40.6 Å²	40.6	7%	0.067	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-59.2	179.3	179	0	0	0	0	109.1	L354 I359 L396 V405 A447	L354-V407 HydrophobicContact CD2-CG1 4.37Å; I359-V407 HydrophobicContact CD1-CG1 3.88Å; I359-V407 HydrophobicContact CG2-CG1 3.48Å; I359-V407 VanDerWaalsContact CG2-CG1 3.48Å; L396-V407 HydrophobicContact CB-CB 4.25Å; L396-V407 HydrophobicContact CD2-CB 4.25Å; L396-V407 HydrophobicContact CD2-CG1 4.08Å; L396-V407 HydrophobicContact CG-CB 4.19Å; L396-V407 HydrophobicContact CG-CG2 4.44Å; L396-V407 WeakPolarHBondContact O-CB 3.4Å; L396-V407 PolarHBondContact O-N 3.34Å; V405-V407 PolarHBondContact O-N 2.91Å; V407-A447 WeakPolarHBondContact O-CB 3.49Å
408	F	86.7	Confident	89.6	Confident	9 Å²	9	40.3 Å²	40.3	4%	0.039	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	163.4	170	67	-103.1	0	0	0	112.4	L396 N406 V410 S445 A447 L449 F457	L396-F408 HydrophobicContact CB-CD1 3.89Å; L396-F408 HydrophobicContact CB-CD2 4.43Å; L396-F408 HydrophobicContact CB-CE1 3.55Å; L396-F408 HydrophobicContact CB-CE2 4.14Å; L396-F408 HydrophobicContact CB-CG 4.31Å; L396-F408 HydrophobicContact CB-CZ 3.69Å; L396-F408 HydrophobicContact CD2-CD1 4.01Å; L396-F408 HydrophobicContact CD2-CE1 3.4Å; L396-F408 VanDerWaalsContact CD2-CE1 3.4Å; L396-F408 HydrophobicContact CD2-CZ 4.12Å; L396-F408 HydrophobicContact CG-CE1 4.12Å; L396-F408 PolarHBondContact N-O 2.8Å; L396-F408 VanDerWaalsContact N-O 3.09Å; L396-F408 PolarHBondContact O-N 3.33Å; N406-F408 PolarHBondContact ND2-O 2.94Å; N406-F408 VanDerWaalsContact ND2-O 3.11Å; F408-V410 HydrophobicContact CD2-CG1 4.02Å; F408-V410 HydrophobicContact CE2-CG1 4.34Å; F408-V410 HydrophobicContact CE2-CG2 4.39Å; F408-S445 WeakPolarHBondContact CA-OG 3.45Å; F408-A447 HydrophobicContact CB-CB 4.48Å; F408-L449 HydrophobicContact CB-CD1 4.37Å; F408-L449 HydrophobicContact CD2-CD1 4.08Å; F408-L449 HydrophobicContact CE2-CD1 4.5Å; F408-L449 HydrophobicContact CG-CD1 4.09Å; F408-F457 HydrophobicContact CE1-CE1 4.07Å; F408-F457 AromaticContact CE1-CZ 3.83Å; F408-F457 HydrophobicContact CE1-CZ 3.83Å; F408-F457 HydrophobicContact CZ-CD1 4.44Å; F408-F457 AromaticContact CZ-CE1 3.84Å; F408-F457 HydrophobicContact CZ-CE1 3.84Å; F408-F457 AromaticContact CZ-CZ 3.98Å; F408-F457 HydrophobicContact CZ-CZ 3.98Å
409	K	91.5	Very high	89.8	Confident	44 Å²	44	47 Å²	47	19%	0.191	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	128	174.2	-49.4	-171	-179.7	151.7	0	110.4	Y395 N406 D442 S444 S445	Y395-K409 HydrophobicContact CD1-CB 3.91Å; Y395-K409 HydrophobicContact CD1-CD 3.85Å; Y395-K409 HydrophobicContact CD1-CG 3.7Å; Y395-K409 HydrophobicContact CE1-CB 4.29Å; Y395-K409 HydrophobicContact CE1-CD 3.97Å; Y395-K409 HydrophobicContact CE1-CG 4.24Å; N406-K409 WeakPolarHBondContact ND2-CG 3.38Å; N406-K409 VanDerWaalsContact OD1-CE 3.26Å; N406-K409 WeakPolarHBondContact OD1-CE 3.36Å; N406-K409 WeakPolarHBondContact OD1-CG 3.36Å; K409-D442 HydrophobicContact CB-CB 3.71Å; K409-D442 PolarHBondContact O-N 3.29Å; K409-S444 WeakPolarHBondContact CD-OG 3.29Å; K409-S444 PolarHBondContact NZ-O 3.27Å; K409-S444 PolarHBondContact NZ-OG 2.84Å; K409-S444 VanDerWaalsContact NZ-OG 3.09Å; K409-S445 PolarHBondContact N-OG 3.32Å
410	V	93.2	Very high	90	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	139.3	176.1	-62.6	0	0	0	0	111	K393 I394 F408 V412 M439 T440 L449 L454	K393-V410 CarbonylContact C-O 3.52Å; K393-V410 VanDerWaalsContact CA-O 3.31Å; K393-V410 WeakPolarHBondContact CA-O 3.49Å; I394-V410 HydrophobicContact CB-CG2 3.74Å; I394-V410 HydrophobicContact CG2-CG2 4.48Å; I394-V410 PolarHBondContact N-O 3.31Å; I394-V410 PolarHBondContact O-N 3.13Å; F408-V410 HydrophobicContact CD2-CG1 4.02Å; F408-V410 HydrophobicContact CE2-CG1 4.34Å; F408-V410 HydrophobicContact CE2-CG2 4.39Å; V410-V412 HydrophobicContact CG2-CG2 4.19Å; V410-M439 HydrophobicContact CB-CB 4.5Å; V410-M439 HydrophobicContact CG2-SD 4.07Å; V410-T440 CarbonylContact C-O 3.58Å; V410-T440 WeakPolarHBondContact CA-O 3.24Å; V410-L449 HydrophobicContact CG1-CD1 3.99Å; V410-L454 HydrophobicContact CG1-CD2 3.63Å
411	N	95	Very high	90.1	Very high	42 Å²	42	49 Å²	49	23%	0.225	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	137.7	165.2	-59.8	-71.5	0	0	0	108.5	K393 M439 T440 D442	K393-N411 VanDerWaalsContact CE-OD1 3.22Å; K393-N411 WeakPolarHBondContact CE-OD1 3.19Å; N411-M439 CarbonylContact O-C 3.5Å; N411-M439 VanDerWaalsContact O-CA 3.28Å; N411-M439 WeakPolarHBondContact O-CA 3.3Å; N411-T440 PolarHBondContact N-O 3.12Å; N411-T440 PolarHBondContact O-N 3.26Å; N411-D442 WeakPolarHBondContact ND2-CA 3.4Å; N411-D442 PolarHBondContact OD1-OD2 3.07Å
412	V	95.3	Very high	90.5	Very high	20 Å²	20	45.6 Å²	45.6	12%	0.121	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132.4	-176.9	-176.5	0	0	0	0	109.7	K391 G392 I394 V410 A414 L437 I438 M439	K391-V412 WeakPolarHBondContact CA-O 3.26Å; G392-V412 PolarHBondContact N-O 2.78Å; G392-V412 PolarHBondContact O-N 3.03Å; I394-V412 HydrophobicContact CB-CG2 4.42Å; I394-V412 HydrophobicContact CD1-CG2 3.67Å; I394-V412 HydrophobicContact CG1-CG2 3.7Å; V410-V412 HydrophobicContact CG2-CG2 4.19Å; V412-A414 HydrophobicContact CG1-CB 4.34Å; V412-L437 HydrophobicContact CG1-CD1 4.13Å; V412-L437 HydrophobicContact CG1-CG 4.28Å; V412-I438 WeakPolarHBondContact CA-O 3.5Å; V412-M439 HydrophobicContact CG2-CE 4.34Å; V412-M439 HydrophobicContact CG2-CG 4.21Å
413	H	96.6	Very high	90.9	Very high	63 Å²	63	40.2 Å²	40.2	29%	0.292	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	109.5	166	-175.6	-133.7	0	0	0	108.6	K391 I438	K391-H413 VanDerWaalsContact CG-CD2 3.48Å; K391-H413 WeakPolarHBondContact CG-CD2 3.23Å; H413-I438 HydrophobicContact CB-CB 4.49Å; H413-I438 PolarHBondContact N-O 3Å; H413-I438 PolarHBondContact O-N 2.98Å
414	A	95.7	Very high	90.8	Very high	9 Å²	9	48.9 Å²	48.9	7%	0.074	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.4	-174.8	0	0	0	0	0	110.7	T389 S390 V412 R436 L437	T389-A414 CarbonylContact C-O 3.49Å; T389-A414 WeakPolarHBondContact CA-O 3.41Å; S390-A414 PolarHBondContact N-O 2.96Å; S390-A414 PolarHBondContact O-N 3.38Å; V412-A414 HydrophobicContact CG1-CB 4.34Å; A414-R436 CarbonylContact C-O 3.45Å; A414-R436 WeakPolarHBondContact CA-O 3.27Å; A414-L437 HydrophobicContact CB-CD1 3.57Å
415	T	95.5	Very high	90.7	Very high	16 Å²	16	48.9 Å²	48.9	10%	0.098	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	122.1	174.5	-58.7	0	0	0	0	108.3	M387 V388 T389 D435 R436	M387-T415 HydrophobicContact CE-CG2 3.28Å; V388-T415 CarbonylContact O-C 3.55Å; V388-T415 WeakPolarHBondContact O-CA 3.41Å; T389-T415 HydrophobicContact CG2-CG2 3.98Å; T415-D435 HydrophobicContact CG2-CB 4.29Å; T415-D435 PolarHBondContact O-N 3.34Å; T415-R436 PolarHBondContact N-O 2.9Å; T415-R436 PolarHBondContact O-N 2.88Å
416	A	95	Very high	90.7	Very high	14 Å²	14	46.9 Å²	46.9	12%	0.116	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	132.5	-179.3	0	0	0	0	0	110.4	M387 V388 V432 A433 I434	M387-A416 CarbonylContact C-O 3.52Å; M387-A416 VanDerWaalsContact CA-O 3.3Å; M387-A416 WeakPolarHBondContact CA-O 3.41Å; V388-A416 PolarHBondContact N-O 3.02Å; V388-A416 PolarHBondContact O-N 3.04Å; A416-V432 HydrophobicContact CB-CG2 3.81Å; A416-A433 CarbonylContact C-O 3.39Å; A416-A433 WeakPolarHBondContact CA-O 3.39Å; A416-I434 HydrophobicContact CB-CD1 3.61Å
417	A	94.5	Very high	90.8	Very high	27 Å²	27	46.6 Å²	46.6	22%	0.223	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	133.6	167.7	0	0	0	0	0	109.2	F385 G386 M387 V432 A433	F385-A417 HydrophobicContact CD2-CB 4.19Å; G386-A417 CarbonylContact O-C 3.49Å; G386-A417 WeakPolarHBondContact O-CA 3.11Å; M387-A417 VanDerWaalsContact SD-CA 3.5Å; M387-A417 HydrophobicContact SD-CB 3.5Å; M387-A417 WeakPolarHBondContact SD-CB 3.36Å; A417-V432 CarbonylContact O-C 3.49Å; A417-V432 WeakPolarHBondContact O-CA 3.49Å; A417-A433 PolarHBondContact N-O 3.5Å; A417-A433 PolarHBondContact O-N 3.12Å
418	F	93.6	Very high	90.9	Very high	20 Å²	20	47.6 Å²	47.6	9%	0.088	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	149.9	175.6	68.9	-86.1	0	0	0	111.5	V379 F381 F385 G386 V388 L420 K431 V432	V379-F418 HydrophobicContact CG1-CE1 4.06Å; V379-F418 HydrophobicContact CG1-CZ 3.93Å; F381-F418 HydrophobicContact CE1-CE2 4.2Å; F381-F418 AromaticContact CE1-CZ 3.79Å; F381-F418 HydrophobicContact CE1-CZ 3.79Å; F385-F418 WeakPolarHBondContact CB-O 3.48Å; G386-F418 VanDerWaalsContact C-CD1 3.42Å; G386-F418 VanDerWaalsContact CA-CE1 3.45Å; G386-F418 PolarHBondContact N-O 2.99Å; G386-F418 VanDerWaalsContact O-CD1 3.29Å; G386-F418 WeakPolarHBondContact O-CD1 3.45Å; G386-F418 PolarHBondContact O-N 2.62Å; V388-F418 HydrophobicContact CG2-CD1 3.64Å; V388-F418 HydrophobicContact CG2-CE1 3.46Å; V388-F418 VanDerWaalsContact CG2-CE1 3.46Å; F418-L420 HydrophobicContact CD2-CD1 4.3Å; F418-L420 HydrophobicContact CD2-CD2 4.17Å; F418-L420 HydrophobicContact CD2-CG 3.86Å; F418-L420 HydrophobicContact CE2-CD1 3.93Å; F418-L420 HydrophobicContact CE2-CG 3.99Å; F418-K431 CarbonylContact C-O 3.52Å; F418-K431 VanDerWaalsContact CA-O 3.24Å; F418-K431 WeakPolarHBondContact CA-O 3.35Å; F418-V432 HydrophobicContact CB-CB 4.38Å; F418-V432 HydrophobicContact CB-CG2 4.31Å
419	R	90.9	Very high	91.1	Very high	152 Å²	152	48.9 Å²	48.9	57%	0.574	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-124	136.7	170.7	-70.1	-172.3	176.4	119.6	-0.2	108.8	F385 G430 K431	F385-R419 HydrophobicContact CB-CG 4.09Å; R419-G430 CarbonylContact O-C 3.53Å; R419-G430 WeakPolarHBondContact O-CA 3.35Å; R419-K431 PolarHBondContact N-O 3.39Å; R419-K431 PolarHBondContact O-N 3.36Å
420	L	91.1	Very high	91.1	Very high	26 Å²	26	46.8 Å²	46.8	14%	0.136	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	150.4	175.2	-59.6	177.9	0	0	0	109.2	F418 L428 K429 L473 L492 F494 M499	F418-L420 HydrophobicContact CD2-CD1 4.3Å; F418-L420 HydrophobicContact CD2-CD2 4.17Å; F418-L420 HydrophobicContact CD2-CG 3.86Å; F418-L420 HydrophobicContact CE2-CD1 3.93Å; F418-L420 HydrophobicContact CE2-CG 3.99Å; L420-L428 HydrophobicContact CB-CD1 4.04Å; L420-L428 HydrophobicContact CD1-CD2 4.46Å; L420-K429 CarbonylContact C-O 3.59Å; L420-K429 VanDerWaalsContact CA-O 3.25Å; L420-K429 WeakPolarHBondContact CA-O 3.28Å; L420-L473 HydrophobicContact CD2-CD2 4.17Å; L420-L492 HydrophobicContact CB-CD2 3.42Å; L420-L492 VanDerWaalsContact CB-CD2 3.42Å; L420-F494 HydrophobicContact CB-CZ 4.46Å; L420-M499 HydrophobicContact CD1-CE 3.72Å; L420-M499 HydrophobicContact CD1-SD 4.12Å
421	F	89.9	Confident	91.1	Very high	77 Å²	77	52.9 Å²	52.9	34%	0.338	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	148.4	176.1	53.1	-88.1	0	0	0	110.1	Q423 K429 K431	F421-Q423 HydrophobicContact CD2-CG 4.28Å; F421-Q423 HydrophobicContact CE2-CG 4.16Å; F421-K429 HydrophobicContact CD2-CB 4.14Å; F421-K429 HydrophobicContact CE1-CB 4.35Å; F421-K429 HydrophobicContact CE2-CB 3.54Å; F421-K429 HydrophobicContact CE2-CD 4.46Å; F421-K429 HydrophobicContact CZ-CB 3.66Å; F421-K429 PolarHBondContact N-O 2.77Å; F421-K429 PolarHBondContact O-N 2.97Å; F421-K431 HydrophobicContact CE1-CG 4.5Å
422	I	90.1	Very high	90.9	Very high	26 Å²	26	52.1 Å²	52.1	13%	0.133	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	126.6	177.6	-60.5	169.1	0	0	0	108.2	M426 T427 L428 L479 L492 A501	I422-M426 HydrophobicContact CG2-CE 4.1Å; I422-M426 HydrophobicContact CG2-SD 4.2Å; I422-T427 WeakPolarHBondContact CA-O 3.44Å; I422-L428 HydrophobicContact CG1-CD1 4.06Å; I422-L479 HydrophobicContact CD1-CD1 4.02Å; I422-L479 HydrophobicContact CG1-CD1 4.18Å; I422-L479 HydrophobicContact CG2-CD1 4.2Å; I422-L492 HydrophobicContact CD1-CB 4.32Å; I422-L492 HydrophobicContact CD1-CD1 4.21Å; I422-L492 HydrophobicContact CG1-CB 4.34Å; I422-A501 HydrophobicContact CD1-CB 4.43Å
423	Q	87.8	Confident	90.8	Very high	71 Å²	71	53.5 Å²	53.5	33%	0.332	26%	0.262	S	S	.	.			trans	-83.5	170.6	173.3	-68.3	-160.1	-29.3	0	0	111.9	F421 D425 M426 T427 K429	F421-Q423 HydrophobicContact CD2-CG 4.28Å; F421-Q423 HydrophobicContact CE2-CG 4.16Å; Q423-D425 VanDerWaalsContact CB-OD1 3.23Å; Q423-D425 WeakPolarHBondContact CB-OD1 3.38Å; Q423-D425 PolarHBondContact O-N 3.25Å; Q423-M426 PolarHBondContact O-N 3.38Å; Q423-T427 PolarHBondContact N-O 3.25Å; Q423-T427 PolarHBondContact OE1-OG1 3.31Å; Q423-K429 HydrophobicContact CG-CD 4.15Å; Q423-K429 HydrophobicContact CG-CG 4.3Å
424	K	83.6	Confident	90.6	Very high	216 Å²	216	51.1 Å²	51.1	94%	0.939	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-26.9	-176.7	-68.9	-175.7	179.2	179.1	0	113.8	M426	K424-M426 PolarHBondContact O-N 2.87Å
425	D	84.5	Confident	90.4	Very high	96 Å²	96	55.8 Å²	55.8	51%	0.513	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	11.2	175.9	65.1	-12.6	0	0	0	113	Q423 T427	Q423-D425 VanDerWaalsContact CB-OD1 3.23Å; Q423-D425 WeakPolarHBondContact CB-OD1 3.38Å; Q423-D425 PolarHBondContact O-N 3.25Å; D425-T427 VanDerWaalsContact CG-CG2 3.48Å; D425-T427 PolarHBondContact O-N 2.83Å; D425-T427 WeakPolarHBondContact OD1-CB 3.38Å; D425-T427 WeakPolarHBondContact OD1-CG2 3.47Å; D425-T427 PolarHBondContact OD1-N 3.31Å; D425-T427 VanDerWaalsContact OD1-N 3.09Å; D425-T427 PolarHBondContact OD1-OG1 3.44Å; D425-T427 VanDerWaalsContact OD2-CG2 3.25Å; D425-T427 WeakPolarHBondContact OD2-CG2 3.08Å; D425-T427 PolarHBondContact OD2-OG1 2.84Å
426	M	84.3	Confident	90.3	Very high	24 Å²	24	62 Å²	62	12%	0.118	30%	0.297	C	S	.	.	S	Bend	trans	62	24.3	-176.2	-57	-60.5	-55.9	0	0	113.8	I422 Q423 K424 L479 V487	I422-M426 HydrophobicContact CG2-CE 4.1Å; I422-M426 HydrophobicContact CG2-SD 4.2Å; Q423-M426 PolarHBondContact O-N 3.38Å; K424-M426 PolarHBondContact O-N 2.87Å; M426-L479 HydrophobicContact CE-CD1 3.84Å; M426-L479 WeakPolarHBondContact O-CB 3.22Å; M426-L479 VanDerWaalsContact O-CG 3.31Å; M426-L479 WeakPolarHBondContact O-CG 3.43Å; M426-L479 PolarHBondContact O-N 3.37Å; M426-V487 HydrophobicContact CE-CB 4.01Å; M426-V487 HydrophobicContact CE-CG1 3.4Å; M426-V487 VanDerWaalsContact CE-CG1 3.4Å; M426-V487 WeakPolarHBondContact CG-O 3.35Å; M426-V487 HydrophobicContact SD-CG1 4.41Å
427	T	86.5	Confident	90.3	Very high	12 Å²	12	62.4 Å²	62.4	7%	0.074	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	129.5	167.5	62.9	0	0	0	0	110.9	I422 Q423 D425 I477 V478	I422-T427 WeakPolarHBondContact CA-O 3.44Å; Q423-T427 PolarHBondContact N-O 3.25Å; Q423-T427 PolarHBondContact OE1-OG1 3.31Å; D425-T427 VanDerWaalsContact CG-CG2 3.48Å; D425-T427 PolarHBondContact O-N 2.83Å; D425-T427 WeakPolarHBondContact OD1-CB 3.38Å; D425-T427 WeakPolarHBondContact OD1-CG2 3.47Å; D425-T427 PolarHBondContact OD1-N 3.31Å; D425-T427 VanDerWaalsContact OD1-N 3.09Å; D425-T427 PolarHBondContact OD1-OG1 3.44Å; D425-T427 VanDerWaalsContact OD2-CG2 3.25Å; D425-T427 WeakPolarHBondContact OD2-CG2 3.08Å; D425-T427 PolarHBondContact OD2-OG1 2.84Å; T427-I477 CarbonylContact C-O 3.49Å; T427-I477 WeakPolarHBondContact CA-O 2.99Å; T427-V478 HydrophobicContact CG2-CG2 3.95Å
428	L	88.5	Confident	90.2	Very high	33 Å²	33	63.9 Å²	63.9	17%	0.173	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	112.5	171.4	-178.9	68.2	0	0	0	108.6	L420 I422 G476 I477 L479 L492	L420-L428 HydrophobicContact CB-CD1 4.04Å; L420-L428 HydrophobicContact CD1-CD2 4.46Å; I422-L428 HydrophobicContact CG1-CD1 4.06Å; L428-G476 CarbonylContact O-C 3.53Å; L428-G476 WeakPolarHBondContact O-CA 3.35Å; L428-I477 PolarHBondContact N-O 2.84Å; L428-I477 PolarHBondContact O-N 2.8Å; L428-L479 HydrophobicContact CB-CD2 4.12Å; L428-L479 HydrophobicContact CB-CG 4.37Å; L428-L492 HydrophobicContact CD1-CD2 4.1Å
429	K	90.8	Very high	90.3	Very high	36 Å²	36	63.8 Å²	63.8	16%	0.157	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	169.7	176	-67.8	-161.7	179.7	-155.5	0	111.3	L420 F421 Q423 L473 D474	L420-K429 CarbonylContact C-O 3.59Å; L420-K429 VanDerWaalsContact CA-O 3.25Å; L420-K429 WeakPolarHBondContact CA-O 3.28Å; F421-K429 HydrophobicContact CD2-CB 4.14Å; F421-K429 HydrophobicContact CE1-CB 4.35Å; F421-K429 HydrophobicContact CE2-CB 3.54Å; F421-K429 HydrophobicContact CE2-CD 4.46Å; F421-K429 HydrophobicContact CZ-CB 3.66Å; F421-K429 PolarHBondContact N-O 2.77Å; F421-K429 PolarHBondContact O-N 2.97Å; Q423-K429 HydrophobicContact CG-CD 4.15Å; Q423-K429 HydrophobicContact CG-CG 4.3Å; K429-L473 CarbonylContact C-O 3.55Å; K429-L473 VanDerWaalsContact CA-O 3.26Å; K429-L473 WeakPolarHBondContact CA-O 3.33Å; K429-D474 WeakPolarHBondContact CD-O 3.49Å; K429-D474 WeakPolarHBondContact CE-O 3.48Å; K429-D474 PolarHBondContact NZ-O 3.47Å; K429-D474 IonicContact NZ-OD1 3.73Å
430	G	91.5	Very high	90.4	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	178.1	176	0	0	0	0	0	115.2	R419 L473	R419-G430 CarbonylContact O-C 3.53Å; R419-G430 WeakPolarHBondContact O-CA 3.35Å; G430-L473 VanDerWaalsContact C-CB 3.47Å; G430-L473 PolarHBondContact N-O 2.91Å; G430-L473 VanDerWaalsContact O-CB 3.28Å; G430-L473 WeakPolarHBondContact O-CB 3.36Å
431	K	91.7	Very high	90.4	Very high	131 Å²	131	60.8 Å²	60.8	57%	0.57	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.6	148.7	171.4	-65.8	-172.9	173.9	-172.6	0	108.9	F418 R419 F421 T470	F418-K431 CarbonylContact C-O 3.52Å; F418-K431 VanDerWaalsContact CA-O 3.24Å; F418-K431 WeakPolarHBondContact CA-O 3.35Å; R419-K431 PolarHBondContact N-O 3.39Å; R419-K431 PolarHBondContact O-N 3.36Å; F421-K431 HydrophobicContact CE1-CG 4.5Å; K431-T470 HydrophobicContact CG-CG2 4.29Å
432	V	92.4	Very high	90.4	Very high	25 Å²	25	58 Å²	58	15%	0.152	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	143.4	175.9	67.2	0	0	0	0	109.9	A416 A417 F418 G469 T470 L473	A416-V432 HydrophobicContact CB-CG2 3.81Å; A417-V432 CarbonylContact O-C 3.49Å; A417-V432 WeakPolarHBondContact O-CA 3.49Å; F418-V432 HydrophobicContact CB-CB 4.38Å; F418-V432 HydrophobicContact CB-CG2 4.31Å; V432-G469 VanDerWaalsContact CG1-C 3.42Å; V432-T470 PolarHBondContact O-OG1 2.97Å; V432-L473 HydrophobicContact CB-CD1 4.02Å; V432-L473 HydrophobicContact CG1-CD1 4.49Å
433	A	93	Very high	90.2	Very high	50 Å²	50	69.1 Å²	69.1	41%	0.413	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	134.2	170.8	0	0	0	0	0	107.6	A416 A417 D435	A416-A433 CarbonylContact C-O 3.39Å; A416-A433 WeakPolarHBondContact CA-O 3.39Å; A417-A433 PolarHBondContact N-O 3.5Å; A417-A433 PolarHBondContact O-N 3.12Å; A433-D435 PolarHBondContact O-N 3.1Å
434	I	92.7	Very high	90	Very high	12 Å²	12	68.9 Å²	68.9	6%	0.062	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	104.8	177.3	-60.8	-62.9	0	0	0	107.2	A416 L437 K462 L465 E466	A416-I434 HydrophobicContact CB-CD1 3.61Å; I434-L437 HydrophobicContact CG2-CB 4.14Å; I434-L437 HydrophobicContact CG2-CD1 4.35Å; I434-K462 HydrophobicContact CB-CD 4.42Å; I434-K462 HydrophobicContact CB-CG 3.7Å; I434-K462 HydrophobicContact CG1-CG 4.41Å; I434-K462 HydrophobicContact CG2-CB 4.5Å; I434-K462 HydrophobicContact CG2-CD 4.37Å; I434-K462 HydrophobicContact CG2-CG 3.78Å; I434-K462 WeakPolarHBondContact O-CE 3.14Å; I434-K462 PolarHBondContact O-NZ 3.11Å; I434-L465 HydrophobicContact CD1-CB 4.21Å; I434-L465 HydrophobicContact CG1-CB 4.15Å; I434-E466 HydrophobicContact CB-CG 3.89Å; I434-E466 HydrophobicContact CG1-CG 3.51Å; I434-E466 PolarHBondContact N-OE1 2.84Å
435	D	91.4	Very high	90	Very high	108 Å²	108	59.6 Å²	59.6	58%	0.578	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.2	-48.6	178	177.9	61.9	0	0	0	110.5	M387 T415 A433	M387-D435 HydrophobicContact CE-CB 4.42Å; T415-D435 HydrophobicContact CG2-CB 4.29Å; T415-D435 PolarHBondContact O-N 3.34Å; A433-D435 PolarHBondContact O-N 3.1Å
436	R	92.9	Very high	89.5	Confident	147 Å²	147	62.6 Å²	62.6	56%	0.555	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.1	133.6	-175.2	-162.3	176.1	-169.3	-173.6	-1.3	111.9	A414 T415 I438	A414-R436 CarbonylContact C-O 3.45Å; A414-R436 WeakPolarHBondContact CA-O 3.27Å; T415-R436 PolarHBondContact N-O 2.9Å; T415-R436 PolarHBondContact O-N 2.88Å; R436-I438 HydrophobicContact CG-CD1 4.33Å; R436-I438 HydrophobicContact CG-CG1 3.95Å
437	L	94.4	Very high	89.1	Confident	22 Å²	22	62.7 Å²	62.7	12%	0.115	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	107.8	170.8	-162.2	99.7	0	0	0	108.6	V412 A414 I434 M439 A458 A461 L465	V412-L437 HydrophobicContact CG1-CD1 4.13Å; V412-L437 HydrophobicContact CG1-CG 4.28Å; A414-L437 HydrophobicContact CB-CD1 3.57Å; I434-L437 HydrophobicContact CG2-CB 4.14Å; I434-L437 HydrophobicContact CG2-CD1 4.35Å; L437-M439 HydrophobicContact CD2-CE 3.58Å; L437-M439 HydrophobicContact CD2-CG 4.49Å; L437-A458 HydrophobicContact CD2-CB 3.87Å; L437-A458 VanDerWaalsContact CD2-O 3.27Å; L437-A458 WeakPolarHBondContact CD2-O 3.15Å; L437-A461 HydrophobicContact CD2-CB 3.72Å; L437-L465 HydrophobicContact CD1-CD1 3.97Å
438	I	93.7	Very high	88.7	Confident	57 Å²	57	66.4 Å²	66.4	29%	0.292	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	126.3	178.9	-52.6	171.9	0	0	0	108.3	V412 H413 R436 T440	V412-I438 WeakPolarHBondContact CA-O 3.5Å; H413-I438 HydrophobicContact CB-CB 4.49Å; H413-I438 PolarHBondContact N-O 3Å; H413-I438 PolarHBondContact O-N 2.98Å; R436-I438 HydrophobicContact CG-CD1 4.33Å; R436-I438 HydrophobicContact CG-CG1 3.95Å; I438-T440 HydrophobicContact CG2-CG2 4.44Å
439	M	93.9	Very high	88.4	Confident	19 Å²	19	65.4 Å²	65.4	9%	0.094	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	139.6	171.3	-61.3	-164	178	0	0	110.4	I394 V410 N411 V412 L437 L454 F457 A458 A461	I394-M439 HydrophobicContact CD1-CE 4.28Å; V410-M439 HydrophobicContact CB-CB 4.5Å; V410-M439 HydrophobicContact CG2-SD 4.07Å; N411-M439 CarbonylContact O-C 3.5Å; N411-M439 VanDerWaalsContact O-CA 3.28Å; N411-M439 WeakPolarHBondContact O-CA 3.3Å; V412-M439 HydrophobicContact CG2-CE 4.34Å; V412-M439 HydrophobicContact CG2-CG 4.21Å; L437-M439 HydrophobicContact CD2-CE 3.58Å; L437-M439 HydrophobicContact CD2-CG 4.49Å; M439-L454 HydrophobicContact CB-CB 4.42Å; M439-L454 HydrophobicContact CB-CD2 3.92Å; M439-F457 HydrophobicContact SD-CB 3.94Å; M439-A458 HydrophobicContact CG-CB 4.16Å; M439-A458 HydrophobicContact SD-CB 4.49Å; M439-A461 HydrophobicContact CE-CB 3.67Å
440	T	93.1	Very high	88.1	Confident	75 Å²	75	67.4 Å²	67.4	46%	0.46	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	138	169.7	58.9	0	0	0	0	110	V410 N411 I438 D442	V410-T440 CarbonylContact C-O 3.58Å; V410-T440 WeakPolarHBondContact CA-O 3.24Å; N411-T440 PolarHBondContact N-O 3.12Å; N411-T440 PolarHBondContact O-N 3.26Å; I438-T440 HydrophobicContact CG2-CG2 4.44Å; T440-D442 PolarHBondContact O-N 3.28Å
441	T	91.7	Very high	87.8	Confident	40 Å²	40	75.2 Å²	75.2	25%	0.245	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	127.5	175.7	-55.7	0	0	0	0	110.2	L449	T441-L449 PolarHBondContact OG1-N 2.95Å; T441-L449 PolarHBondContact OG1-O 2.9Å
442	D	90.4	Very high	87.4	Confident	18 Å²	18	77 Å²	77	10%	0.096	39%	0.394	C	S	.	.			trans	-71.9	139.9	173.4	-175.5	-73.8	0	0	0	109.6	K393 K409 N411 T440 S444 S445	K393-D442 IonicContact NZ-OD2 2.76Å; K393-D442 PolarHBondContact NZ-OD2 2.83Å; K409-D442 HydrophobicContact CB-CB 3.71Å; K409-D442 PolarHBondContact O-N 3.29Å; N411-D442 WeakPolarHBondContact ND2-CA 3.4Å; N411-D442 PolarHBondContact OD1-OD2 3.07Å; T440-D442 PolarHBondContact O-N 3.28Å; D442-S444 PolarHBondContact O-N 3.28Å; D442-S444 WeakPolarHBondContact OD1-CB 3.27Å; D442-S444 PolarHBondContact OD1-N 3.41Å; D442-S444 PolarHBondContact OD1-OG 3.2Å; D442-S445 WeakPolarHBondContact O-CB 3.31Å; D442-S445 PolarHBondContact O-N 3.24Å
443	R	85.5	Confident	86.9	Confident	260 Å²	260	78 Å²	78	98%	0.981	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-22.2	-177.9	-63.6	-178.3	-178.9	174	-0.4	113.8
444	S	83.7	Confident	86.7	Confident	65 Å²	65	76.6 Å²	76.6	46%	0.455	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	9.4	178.4	72.6	0	0	0	0	114	K409 D442	K409-S444 WeakPolarHBondContact CD-OG 3.29Å; K409-S444 PolarHBondContact NZ-O 3.27Å; K409-S444 PolarHBondContact NZ-OG 2.84Å; K409-S444 VanDerWaalsContact NZ-OG 3.09Å; D442-S444 PolarHBondContact O-N 3.28Å; D442-S444 WeakPolarHBondContact OD1-CB 3.27Å; D442-S444 PolarHBondContact OD1-N 3.41Å; D442-S444 PolarHBondContact OD1-OG 3.2Å
445	S	83.7	Confident	86.4	Confident	21 Å²	21	81.6 Å²	81.6	15%	0.147	41%	0.406	C	S	.	.			trans	-73.4	140	173.9	-166.4	0	0	0	0	110.7	F408 K409 D442 A447	F408-S445 WeakPolarHBondContact CA-OG 3.45Å; K409-S445 PolarHBondContact N-OG 3.32Å; D442-S445 WeakPolarHBondContact O-CB 3.31Å; D442-S445 PolarHBondContact O-N 3.24Å; S445-A447 WeakPolarHBondContact CB-O 3.27Å; S445-A447 PolarHBondContact OG-O 2.85Å
446	K	73.3	Confident	85.9	Confident	159 Å²	159	79.4 Å²	79.4	69%	0.691	39%	0.391	S	S	*	.	S	Bend	trans	-75.5	-41.8	174	-72.2	-171	178.5	-175.9	0	111.5
447	A	76.3	Confident	85.3	Confident	27 Å²	27	73.6 Å²	73.6	22%	0.223	37%	0.37	C	S	.	.	S	Bend	trans	-93.8	129.8	172.1	0	0	0	0	0	110.2	I359 V407 F408 S445	I359-A447 HydrophobicContact CD1-CB 4.49Å; V407-A447 WeakPolarHBondContact O-CB 3.49Å; F408-A447 HydrophobicContact CB-CB 4.48Å; S445-A447 WeakPolarHBondContact CB-O 3.27Å; S445-A447 PolarHBondContact OG-O 2.85Å
448	A	77.9	Confident	85	Confident	89 Å²	89	72.9 Å²	72.9	74%	0.736	37%	0.367	S	S	*	.			trans	-95.8	100.1	173	0	0	0	0	0	109.5
449	L	82.1	Confident	84.5	Confident	13 Å²	13	74.3 Å²	74.3	7%	0.068	38%	0.375	C	S	.	.			trans	-68.2	134.4	175.2	-60.2	175.2	0	0	0	109.9	L357 F408 V410 T441 E453 L454 F457	L357-L449 HydrophobicContact CD1-CD2 3.98Å; L357-L449 HydrophobicContact CD2-CD2 3.85Å; F408-L449 HydrophobicContact CB-CD1 4.37Å; F408-L449 HydrophobicContact CD2-CD1 4.08Å; F408-L449 HydrophobicContact CE2-CD1 4.5Å; F408-L449 HydrophobicContact CG-CD1 4.09Å; V410-L449 HydrophobicContact CG1-CD1 3.99Å; T441-L449 PolarHBondContact OG1-N 2.95Å; T441-L449 PolarHBondContact OG1-O 2.9Å; L449-E453 WeakPolarHBondContact CA-OE2 3.34Å; L449-E453 HydrophobicContact CB-CB 4.23Å; L449-E453 HydrophobicContact CD2-CB 4.37Å; L449-L454 HydrophobicContact CB-CD2 3.91Å; L449-L454 HydrophobicContact CB-CG 3.87Å; L449-L454 HydrophobicContact CD1-CD2 3.98Å; L449-F457 HydrophobicContact CD1-CD2 3.9Å; L449-F457 HydrophobicContact CD1-CE2 3.76Å; L449-F457 HydrophobicContact CD2-CE2 4.14Å
450	N	84.5	Confident	83.7	Confident	77 Å²	77	75.9 Å²	75.9	41%	0.412	38%	0.383	S	S	.	.			trans	-77.5	171.9	173.9	71.2	46.7	0	0	0	111.3	K452 E453 L454	N450-K452 VanDerWaalsContact C-N 3.32Å; N450-K452 PolarHBondContact O-N 3.35Å; N450-K452 PolarHBondContact OD1-N 3.07Å; N450-E453 PolarHBondContact N-OE2 3.36Å; N450-E453 PolarHBondContact ND2-OE1 3.41Å; N450-E453 PolarHBondContact O-N 2.96Å; N450-E453 WeakPolarHBondContact OD1-CG 3.35Å; N450-E453 PolarHBondContact OD1-N 2.91Å; N450-L454 WeakPolarHBondContact O-CG 3.49Å; N450-L454 PolarHBondContact O-N 3.17Å
451	E	86.4	Confident	83.2	Confident	164 Å²	164	73.2 Å²	73.2	77%	0.766	37%	0.369	S	S	*	.	H	α-helix	trans	-61.5	-37.5	-175	-172.7	172	-165.4	0	0	113.3	L454 E455	E451-L454 PolarHBondContact O-N 3.34Å; E451-E455 VanDerWaalsContact O-CB 3.31Å; E451-E455 WeakPolarHBondContact O-CB 3.5Å; E451-E455 PolarHBondContact O-N 3.42Å
452	K	82.9	Confident	83	Confident	170 Å²	170	74.5 Å²	74.5	74%	0.739	37%	0.371	S	S	*	.	H	α-helix	trans	-68.7	-40.9	179.1	-66	-176.7	179.1	-179.4	0	111.6	N450 E455 F456	N450-K452 VanDerWaalsContact C-N 3.32Å; N450-K452 PolarHBondContact O-N 3.35Å; N450-K452 PolarHBondContact OD1-N 3.07Å; K452-E455 PolarHBondContact O-N 3.12Å; K452-F456 VanDerWaalsContact O-CB 3.23Å; K452-F456 WeakPolarHBondContact O-CB 3.39Å; K452-F456 PolarHBondContact O-N 2.79Å
453	E	81.6	Confident	82.5	Confident	44 Å²	44	76.7 Å²	76.7	21%	0.206	39%	0.386	C	S	.	.	H	α-helix	trans	-64.4	-46.2	176	-66.1	160.8	-173.3	0	0	110.3	L357 L449 N450 E455 F456 F457	L357-E453 HydrophobicContact CD2-CB 4.02Å; L357-E453 HydrophobicContact CD2-CG 3.39Å; L357-E453 WeakPolarHBondContact CD2-OE1 3.3Å; L449-E453 WeakPolarHBondContact CA-OE2 3.34Å; L449-E453 HydrophobicContact CB-CB 4.23Å; L449-E453 HydrophobicContact CD2-CB 4.37Å; N450-E453 PolarHBondContact N-OE2 3.36Å; N450-E453 PolarHBondContact ND2-OE1 3.41Å; N450-E453 PolarHBondContact O-N 2.96Å; N450-E453 WeakPolarHBondContact OD1-CG 3.35Å; N450-E453 PolarHBondContact OD1-N 2.91Å; E453-E455 PolarHBondContact O-N 3.41Å; E453-F456 WeakPolarHBondContact O-CB 3.32Å; E453-F456 PolarHBondContact O-N 2.79Å; E453-F457 WeakPolarHBondContact O-CD2 3.18Å; E453-F457 PolarHBondContact O-N 2.76Å
454	L	88.1	Confident	82.2	Confident	21 Å²	21	65.7 Å²	65.7	11%	0.11	35%	0.346	C	S	.	.	H	α-helix	trans	-61.4	-42.3	176.1	-71.6	169.6	0	0	0	112.4	V410 M439 L449 N450 E451 F456 A458	V410-L454 HydrophobicContact CG1-CD2 3.63Å; M439-L454 HydrophobicContact CB-CB 4.42Å; M439-L454 HydrophobicContact CB-CD2 3.92Å; L449-L454 HydrophobicContact CB-CD2 3.91Å; L449-L454 HydrophobicContact CB-CG 3.87Å; L449-L454 HydrophobicContact CD1-CD2 3.98Å; N450-L454 WeakPolarHBondContact O-CG 3.49Å; N450-L454 PolarHBondContact O-N 3.17Å; E451-L454 PolarHBondContact O-N 3.34Å; L454-F456 VanDerWaalsContact C-N 3.33Å; L454-A458 WeakPolarHBondContact O-CB 3.44Å; L454-A458 PolarHBondContact O-N 3.15Å
455	E	86.2	Confident	82.2	Confident	118 Å²	118	66.2 Å²	66.2	55%	0.551	34%	0.343	S	S	*	.	H	α-helix	trans	-63.8	-41.1	175.5	-176.9	176.6	-170	0	0	111.3	E451 K452 E453 A458 N459	E451-E455 VanDerWaalsContact O-CB 3.31Å; E451-E455 WeakPolarHBondContact O-CB 3.5Å; E451-E455 PolarHBondContact O-N 3.42Å; K452-E455 PolarHBondContact O-N 3.12Å; E453-E455 PolarHBondContact O-N 3.41Å; E455-A458 WeakPolarHBondContact O-CB 3.48Å; E455-A458 PolarHBondContact O-N 2.95Å; E455-N459 VanDerWaalsContact O-CG 3.31Å; E455-N459 PolarHBondContact O-N 3.38Å; E455-N459 PolarHBondContact O-ND2 2.97Å
456	F	80.8	Confident	82.3	Confident	62 Å²	62	67.8 Å²	67.8	27%	0.272	35%	0.348	S	S	.	.	H	α-helix	trans	-61.4	-51.9	175.7	179.9	-99.3	0	0	0	112.1	L348 L353 K452 E453 L454 A458 N459 I460	L348-F456 HydrophobicContact CD1-CE2 3.84Å; L348-F456 HydrophobicContact CD1-CZ 3.48Å; L348-F456 VanDerWaalsContact CD1-CZ 3.48Å; L348-F456 HydrophobicContact CD2-CE1 3.82Å; L348-F456 HydrophobicContact CD2-CZ 3.4Å; L348-F456 VanDerWaalsContact CD2-CZ 3.4Å; L348-F456 HydrophobicContact CG-CZ 3.94Å; L353-F456 HydrophobicContact CD1-CD1 3.82Å; L353-F456 HydrophobicContact CD1-CE1 3.65Å; L353-F456 HydrophobicContact CD2-CE1 4.17Å; L353-F456 HydrophobicContact CG-CE1 4.49Å; K452-F456 VanDerWaalsContact O-CB 3.23Å; K452-F456 WeakPolarHBondContact O-CB 3.39Å; K452-F456 PolarHBondContact O-N 2.79Å; E453-F456 WeakPolarHBondContact O-CB 3.32Å; E453-F456 PolarHBondContact O-N 2.79Å; L454-F456 VanDerWaalsContact C-N 3.33Å; F456-A458 PolarHBondContact O-N 3.12Å; F456-N459 PolarHBondContact O-N 2.79Å; F456-I460 HydrophobicContact CD1-CD1 3.97Å; F456-I460 HydrophobicContact CE1-CD1 3.26Å; F456-I460 HydrophobicContact CE1-CG1 4.37Å; F456-I460 HydrophobicContact CE2-CD1 4.25Å; F456-I460 HydrophobicContact CZ-CD1 3.42Å; F456-I460 VanDerWaalsContact CZ-CD1 3.42Å; F456-I460 HydrophobicContact CZ-CG1 4.29Å; F456-I460 PolarHBondContact O-N 3.3Å; F456-I460 VanDerWaalsContact O-N 3.13Å
457	F	81.2	Confident	82.6	Confident	25 Å²	25	63.7 Å²	63.7	11%	0.11	34%	0.337	C	S	.	.	H	α-helix	trans	-57.6	-38.7	173.2	-82.1	-71.4	0	0	0	112	L353 L357 F408 M439 L449 E453 I460 A461	L353-F457 HydrophobicContact CD1-CE2 4.31Å; L353-F457 HydrophobicContact CD1-CZ 4.02Å; L353-F457 HydrophobicContact CD2-CD1 3.94Å; L353-F457 HydrophobicContact CD2-CE1 3.18Å; L353-F457 HydrophobicContact CD2-CE2 4.35Å; L353-F457 HydrophobicContact CD2-CZ 3.41Å; L353-F457 VanDerWaalsContact CD2-CZ 3.41Å; L353-F457 HydrophobicContact CG-CE1 4.05Å; L353-F457 HydrophobicContact CG-CZ 3.74Å; L357-F457 HydrophobicContact CD1-CE2 3.73Å; L357-F457 HydrophobicContact CD1-CZ 3.72Å; F408-F457 HydrophobicContact CE1-CE1 4.07Å; F408-F457 AromaticContact CE1-CZ 3.83Å; F408-F457 HydrophobicContact CE1-CZ 3.83Å; F408-F457 HydrophobicContact CZ-CD1 4.44Å; F408-F457 AromaticContact CZ-CE1 3.84Å; F408-F457 HydrophobicContact CZ-CE1 3.84Å; F408-F457 AromaticContact CZ-CZ 3.98Å; F408-F457 HydrophobicContact CZ-CZ 3.98Å; M439-F457 HydrophobicContact SD-CB 3.94Å; L449-F457 HydrophobicContact CD1-CD2 3.9Å; L449-F457 HydrophobicContact CD1-CE2 3.76Å; L449-F457 HydrophobicContact CD2-CE2 4.14Å; E453-F457 WeakPolarHBondContact O-CD2 3.18Å; E453-F457 PolarHBondContact O-N 2.76Å; F457-I460 PolarHBondContact O-N 2.77Å; F457-A461 VanDerWaalsContact O-CB 3.31Å; F457-A461 WeakPolarHBondContact O-CB 3.09Å; F457-A461 PolarHBondContact O-N 3.07Å
458	A	87.7	Confident	82.8	Confident	7 Å²	7	64.9 Å²	64.9	6%	0.058	34%	0.341	C	S	.	.	H	α-helix	trans	-64.8	-41.2	178.7	0	0	0	0	0	112.3	L437 M439 L454 E455 F456 A461 K462	L437-A458 HydrophobicContact CD2-CB 3.87Å; L437-A458 VanDerWaalsContact CD2-O 3.27Å; L437-A458 WeakPolarHBondContact CD2-O 3.15Å; M439-A458 HydrophobicContact CG-CB 4.16Å; M439-A458 HydrophobicContact SD-CB 4.49Å; L454-A458 WeakPolarHBondContact O-CB 3.44Å; L454-A458 PolarHBondContact O-N 3.15Å; E455-A458 WeakPolarHBondContact O-CB 3.48Å; E455-A458 PolarHBondContact O-N 2.95Å; F456-A458 PolarHBondContact O-N 3.12Å; A458-A461 PolarHBondContact O-N 3.5Å; A458-K462 WeakPolarHBondContact O-CB 3.42Å; A458-K462 PolarHBondContact O-N 2.97Å
459	N	83.9	Confident	83	Confident	86 Å²	86	61.5 Å²	61.5	46%	0.46	32%	0.315	S	S	.	.	H	α-helix	trans	-66.1	-42.2	177.7	-71.7	-29.6	0	0	0	112.1	E455 F456 K462 T463	E455-N459 VanDerWaalsContact O-CG 3.31Å; E455-N459 PolarHBondContact O-N 3.38Å; E455-N459 PolarHBondContact O-ND2 2.97Å; F456-N459 PolarHBondContact O-N 2.79Å; N459-K462 WeakPolarHBondContact O-CB 3.24Å; N459-K462 PolarHBondContact O-N 3.19Å; N459-T463 PolarHBondContact O-N 3.31Å; N459-T463 VanDerWaalsContact O-N 3.1Å; N459-T463 PolarHBondContact O-OG1 3.2Å
460	I	77.1	Confident	83.2	Confident	52 Å²	52	62.6 Å²	62.6	27%	0.267	32%	0.322	S	S	.	.	H	α-helix	trans	-61.1	-52.2	174.4	-69.5	172.1	0	0	0	110.6	F456 F457 K462 T463 I464	F456-I460 HydrophobicContact CD1-CD1 3.97Å; F456-I460 HydrophobicContact CE1-CD1 3.26Å; F456-I460 HydrophobicContact CE1-CG1 4.37Å; F456-I460 HydrophobicContact CE2-CD1 4.25Å; F456-I460 HydrophobicContact CZ-CD1 3.42Å; F456-I460 VanDerWaalsContact CZ-CD1 3.42Å; F456-I460 HydrophobicContact CZ-CG1 4.29Å; F456-I460 PolarHBondContact O-N 3.3Å; F456-I460 VanDerWaalsContact O-N 3.13Å; F457-I460 PolarHBondContact O-N 2.77Å; I460-K462 PolarHBondContact O-N 3.46Å; I460-T463 PolarHBondContact O-N 3.5Å; I460-I464 HydrophobicContact CG2-CD1 3.53Å; I460-I464 WeakPolarHBondContact O-CD1 3.37Å; I460-I464 WeakPolarHBondContact O-CG1 3.42Å; I460-I464 PolarHBondContact O-N 3.25Å
461	A	82.9	Confident	83	Confident	20 Å²	20	63.2 Å²	63.2	17%	0.165	33%	0.325	C	S	.	.	H	α-helix	trans	-60.1	-37.3	179.9	0	0	0	0	0	111.7	L437 M439 F457 A458 L465	L437-A461 HydrophobicContact CD2-CB 3.72Å; M439-A461 HydrophobicContact CE-CB 3.67Å; F457-A461 VanDerWaalsContact O-CB 3.31Å; F457-A461 WeakPolarHBondContact O-CB 3.09Å; F457-A461 PolarHBondContact O-N 3.07Å; A458-A461 PolarHBondContact O-N 3.5Å; A461-L465 VanDerWaalsContact O-CB 3.27Å; A461-L465 WeakPolarHBondContact O-CB 3.46Å; A461-L465 WeakPolarHBondContact O-CD1 3.27Å; A461-L465 WeakPolarHBondContact O-CG 3.42Å; A461-L465 PolarHBondContact O-N 3.16Å
462	K	86.3	Confident	82.6	Confident	66 Å²	66	58.8 Å²	58.8	29%	0.287	31%	0.306	S	S	.	.	H	α-helix	trans	-57.2	-55.3	174.3	-175.6	-179.2	168.7	157.7	0	111.1	I434 A458 N459 I460 I464 L465 E466	I434-K462 HydrophobicContact CB-CD 4.42Å; I434-K462 HydrophobicContact CB-CG 3.7Å; I434-K462 HydrophobicContact CG1-CG 4.41Å; I434-K462 HydrophobicContact CG2-CB 4.5Å; I434-K462 HydrophobicContact CG2-CD 4.37Å; I434-K462 HydrophobicContact CG2-CG 3.78Å; I434-K462 WeakPolarHBondContact O-CE 3.14Å; I434-K462 PolarHBondContact O-NZ 3.11Å; A458-K462 WeakPolarHBondContact O-CB 3.42Å; A458-K462 PolarHBondContact O-N 2.97Å; N459-K462 WeakPolarHBondContact O-CB 3.24Å; N459-K462 PolarHBondContact O-N 3.19Å; I460-K462 PolarHBondContact O-N 3.46Å; K462-I464 PolarHBondContact O-N 3.26Å; K462-L465 PolarHBondContact O-N 3Å; K462-E466 WeakPolarHBondContact CE-OE1 3.35Å; K462-E466 WeakPolarHBondContact O-CG 2.96Å; K462-E466 PolarHBondContact O-N 3.48Å
463	T	80.7	Confident	82.7	Confident	64 Å²	64	53 Å²	53	39%	0.393	28%	0.283	S	S	.	.	H	α-helix	trans	-59.1	-45.1	-179.2	-59.9	0	0	0	0	111.9	N459 I460 E466 V467	N459-T463 PolarHBondContact O-N 3.31Å; N459-T463 VanDerWaalsContact O-N 3.1Å; N459-T463 PolarHBondContact O-OG1 3.2Å; I460-T463 PolarHBondContact O-N 3.5Å; T463-E466 PolarHBondContact O-N 3.48Å; T463-V467 WeakPolarHBondContact O-CG2 3.35Å; T463-V467 PolarHBondContact O-N 2.95Å; T463-V467 VanDerWaalsContact O-N 3.12Å
464	I	78.4	Confident	82.9	Confident	30 Å²	30	54.5 Å²	54.5	15%	0.154	29%	0.293	C	S	.	.	H	α-helix	trans	-62.1	-48.4	178.6	-66.5	156.6	0	0	0	111	L335 I460 K462 E466 V467 V468	L335-I464 HydrophobicContact CD1-CB 4.49Å; L335-I464 HydrophobicContact CD1-CD1 3.66Å; L335-I464 HydrophobicContact CD1-CG1 3.91Å; L335-I464 HydrophobicContact CD1-CG2 3.73Å; L335-I464 HydrophobicContact CD2-CG2 3.96Å; L335-I464 HydrophobicContact CG-CG2 4.49Å; I460-I464 HydrophobicContact CG2-CD1 3.53Å; I460-I464 WeakPolarHBondContact O-CD1 3.37Å; I460-I464 WeakPolarHBondContact O-CG1 3.42Å; I460-I464 PolarHBondContact O-N 3.25Å; K462-I464 PolarHBondContact O-N 3.26Å; I464-E466 VanDerWaalsContact C-N 3.31Å; I464-E466 PolarHBondContact O-N 3.16Å; I464-V467 PolarHBondContact O-N 2.95Å; I464-V468 HydrophobicContact CG2-CG2 4.22Å; I464-V468 WeakPolarHBondContact O-CB 3.36Å; I464-V468 VanDerWaalsContact O-CG2 3.3Å; I464-V468 WeakPolarHBondContact O-CG2 3.38Å; I464-V468 PolarHBondContact O-N 3.36Å
465	L	84.5	Confident	82.5	Confident	76 Å²	76	56.9 Å²	56.9	40%	0.398	30%	0.303	S	S	.	.	H	α-helix	trans	-65.1	-34.6	-178.3	-71.9	171.4	0	0	0	112.3	I434 L437 A461 K462 G469	I434-L465 HydrophobicContact CD1-CB 4.21Å; I434-L465 HydrophobicContact CG1-CB 4.15Å; L437-L465 HydrophobicContact CD1-CD1 3.97Å; A461-L465 VanDerWaalsContact O-CB 3.27Å; A461-L465 WeakPolarHBondContact O-CB 3.46Å; A461-L465 WeakPolarHBondContact O-CD1 3.27Å; A461-L465 WeakPolarHBondContact O-CG 3.42Å; A461-L465 PolarHBondContact O-N 3.16Å; K462-L465 PolarHBondContact O-N 3Å; L465-G469 WeakPolarHBondContact O-CA 2.96Å; L465-G469 PolarHBondContact O-N 3.24Å
466	E	85.6	Confident	82	Confident	53 Å²	53	51.6 Å²	51.6	25%	0.248	28%	0.28	C	S	.	.	H	α-helix	trans	-65.6	-46	174.8	-74.3	-178.2	167.2	0	0	112.2	I434 K462 T463 I464 T470	I434-E466 HydrophobicContact CB-CG 3.89Å; I434-E466 HydrophobicContact CG1-CG 3.51Å; I434-E466 PolarHBondContact N-OE1 2.84Å; K462-E466 WeakPolarHBondContact CE-OE1 3.35Å; K462-E466 WeakPolarHBondContact O-CG 2.96Å; K462-E466 PolarHBondContact O-N 3.48Å; T463-E466 PolarHBondContact O-N 3.48Å; I464-E466 VanDerWaalsContact C-N 3.31Å; I464-E466 PolarHBondContact O-N 3.16Å; E466-T470 WeakPolarHBondContact O-CB 3.42Å; E466-T470 PolarHBondContact O-N 2.88Å; E466-T470 PolarHBondContact O-OG1 3.16Å
467	V	80.5	Confident	81.9	Confident	74 Å²	74	51.7 Å²	51.7	45%	0.448	28%	0.283	S	S	.	.	H	α-helix	trans	-63.4	-55.4	178	173.2	0	0	0	0	110	T463 I464 G469 T470 D471	T463-V467 WeakPolarHBondContact O-CG2 3.35Å; T463-V467 PolarHBondContact O-N 2.95Å; T463-V467 VanDerWaalsContact O-N 3.12Å; I464-V467 PolarHBondContact O-N 2.95Å; V467-G469 VanDerWaalsContact C-N 3.34Å; V467-G469 PolarHBondContact O-N 3.48Å; V467-T470 PolarHBondContact O-N 3.34Å; V467-D471 WeakPolarHBondContact O-CB 3.38Å; V467-D471 VanDerWaalsContact O-CG 3.25Å; V467-D471 PolarHBondContact O-N 2.93Å
468	V	78.7	Confident	81.6	Confident	52 Å²	52	53.9 Å²	53.9	32%	0.315	30%	0.298	S	S	.	.	H	α-helix	trans	-58.6	-45.9	-179.1	168.5	0	0	0	0	111.7	L239 I464 T470 L472	L239-V468 HydrophobicContact CD1-CB 4.35Å; L239-V468 HydrophobicContact CD1-CG1 3.52Å; L239-V468 HydrophobicContact CD1-CG2 3.84Å; I464-V468 HydrophobicContact CG2-CG2 4.22Å; I464-V468 WeakPolarHBondContact O-CB 3.36Å; I464-V468 VanDerWaalsContact O-CG2 3.3Å; I464-V468 WeakPolarHBondContact O-CG2 3.38Å; I464-V468 PolarHBondContact O-N 3.36Å; V468-T470 VanDerWaalsContact C-N 3.35Å; V468-L472 WeakPolarHBondContact O-CB 3.45Å; V468-L472 PolarHBondContact O-N 3.23Å
469	G	84	Confident	80.9	Confident	18 Å²	18	56.1 Å²	56.1	19%	0.186	31%	0.309	C	S	.	.	H	α-helix	trans	-69.1	-34.4	-178.9	0	0	0	0	0	112.5	V432 L465 V467 L473	V432-G469 VanDerWaalsContact CG1-C 3.42Å; L465-G469 WeakPolarHBondContact O-CA 2.96Å; L465-G469 PolarHBondContact O-N 3.24Å; V467-G469 VanDerWaalsContact C-N 3.34Å; V467-G469 PolarHBondContact O-N 3.48Å; G469-L473 VanDerWaalsContact O-CG 3.3Å; G469-L473 WeakPolarHBondContact O-CG 3.41Å; G469-L473 PolarHBondContact O-N 3.17Å; G469-L473 VanDerWaalsContact O-N 3.11Å
470	T	84.6	Confident	80.1	Confident	35 Å²	35	55.6 Å²	55.6	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-72.1	-42.7	176.2	-62.9	0	0	0	0	111	K431 V432 E466 V467 V468 L472 L473 D474	K431-T470 HydrophobicContact CG-CG2 4.29Å; V432-T470 PolarHBondContact O-OG1 2.97Å; E466-T470 WeakPolarHBondContact O-CB 3.42Å; E466-T470 PolarHBondContact O-N 2.88Å; E466-T470 PolarHBondContact O-OG1 3.16Å; V467-T470 PolarHBondContact O-N 3.34Å; V468-T470 VanDerWaalsContact C-N 3.35Å; T470-L472 VanDerWaalsContact C-N 3.29Å; T470-L472 PolarHBondContact O-N 2.87Å; T470-L473 CarbonylContact O-C 3.55Å; T470-L473 PolarHBondContact O-N 3.04Å; T470-L473 VanDerWaalsContact O-N 3.16Å; T470-D474 VanDerWaalsContact O-CB 3.3Å; T470-D474 WeakPolarHBondContact O-CB 3.45Å; T470-D474 PolarHBondContact O-N 3.43Å
471	D	80.9	Confident	79.6	Confident	91 Å²	91	57.6 Å²	57.6	49%	0.487	33%	0.329	S	S	.	.	H	α-helix	trans	-60.4	-41.5	176.6	-70.3	-13.7	0	0	0	111.2	V467 D474 Q475	V467-D471 WeakPolarHBondContact O-CB 3.38Å; V467-D471 VanDerWaalsContact O-CG 3.25Å; V467-D471 PolarHBondContact O-N 2.93Å; D471-D474 PolarHBondContact O-N 3.32Å; D471-Q475 WeakPolarHBondContact O-CG 3.48Å; D471-Q475 PolarHBondContact O-N 3.16Å; D471-Q475 VanDerWaalsContact O-N 3.15Å
472	L	78.6	Confident	78.8	Confident	70 Å²	70	62.4 Å²	62.4	37%	0.366	35%	0.35	S	S	.	.	H	α-helix	trans	-61.4	-45.6	174.3	175.7	54.8	0	0	0	112.1	L237 V468 T470	L237-L472 HydrophobicContact CD1-CD1 3.82Å; L237-L472 HydrophobicContact CD2-CB 4.42Å; L237-L472 HydrophobicContact CD2-CD1 3.48Å; L237-L472 VanDerWaalsContact CD2-CD1 3.48Å; L237-L472 HydrophobicContact CD2-CD2 4.35Å; L237-L472 HydrophobicContact CD2-CG 4.28Å; L237-L472 HydrophobicContact CG-CD1 4.02Å; V468-L472 WeakPolarHBondContact O-CB 3.45Å; V468-L472 PolarHBondContact O-N 3.23Å; T470-L472 VanDerWaalsContact C-N 3.29Å; T470-L472 PolarHBondContact O-N 2.87Å
473	L	85.1	Confident	78	Confident	49 Å²	49	65.9 Å²	65.9	26%	0.257	38%	0.376	S	S	.	.	H	α-helix	trans	-74.3	-25.1	180	-69.2	175.7	0	0	0	113	L420 K429 G430 V432 G469 T470 G476	L420-L473 HydrophobicContact CD2-CD2 4.17Å; K429-L473 CarbonylContact C-O 3.55Å; K429-L473 VanDerWaalsContact CA-O 3.26Å; K429-L473 WeakPolarHBondContact CA-O 3.33Å; G430-L473 VanDerWaalsContact C-CB 3.47Å; G430-L473 PolarHBondContact N-O 2.91Å; G430-L473 VanDerWaalsContact O-CB 3.28Å; G430-L473 WeakPolarHBondContact O-CB 3.36Å; V432-L473 HydrophobicContact CB-CD1 4.02Å; V432-L473 HydrophobicContact CG1-CD1 4.49Å; G469-L473 VanDerWaalsContact O-CG 3.3Å; G469-L473 WeakPolarHBondContact O-CG 3.41Å; G469-L473 PolarHBondContact O-N 3.17Å; G469-L473 VanDerWaalsContact O-N 3.11Å; T470-L473 CarbonylContact O-C 3.55Å; T470-L473 PolarHBondContact O-N 3.04Å; T470-L473 VanDerWaalsContact O-N 3.16Å; L473-G476 PolarHBondContact O-N 3.09Å
474	D	85.2	Confident	77.7	Confident	75 Å²	75	63 Å²	63	40%	0.401	36%	0.36	S	S	.	.	H	α-helix	trans	-81.2	-22.7	179.3	-166	53.6	0	0	0	112.9	K429 T470 D471 G476	K429-D474 WeakPolarHBondContact CD-O 3.49Å; K429-D474 WeakPolarHBondContact CE-O 3.48Å; K429-D474 PolarHBondContact NZ-O 3.47Å; K429-D474 IonicContact NZ-OD1 3.73Å; T470-D474 VanDerWaalsContact O-CB 3.3Å; T470-D474 WeakPolarHBondContact O-CB 3.45Å; T470-D474 PolarHBondContact O-N 3.43Å; D471-D474 PolarHBondContact O-N 3.32Å; D474-G476 PolarHBondContact O-N 3.49Å
475	Q	79.6	Confident	77.8	Confident	71 Å²	71	64.3 Å²	64.3	33%	0.332	36%	0.364	S	S	.	.	H	α-helix	trans	-58.4	-38.9	167.4	-73.9	167	25.1	0	0	111.4	A236 D471	A236-Q475 PolarHBondContact O-NE2 3.19Å; D471-Q475 WeakPolarHBondContact O-CG 3.48Å; D471-Q475 PolarHBondContact O-N 3.16Å; D471-Q475 VanDerWaalsContact O-N 3.15Å
476	G	77	Confident	77.8	Confident	7 Å²	7	63.7 Å²	63.7	7%	0.072	36%	0.364	C	S	.	.			trans	77.4	161.5	176.1	0	0	0	0	0	114.7	L428 L473 D474	L428-G476 CarbonylContact O-C 3.53Å; L428-G476 WeakPolarHBondContact O-CA 3.35Å; L473-G476 PolarHBondContact O-N 3.09Å; D474-G476 PolarHBondContact O-N 3.49Å
477	I	77.7	Confident	77.8	Confident	64 Å²	64	63.3 Å²	63.3	33%	0.328	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	120.6	175.1	-58.2	170.8	0	0	0	107	I227 T231 T427 L428 L479	I227-I477 HydrophobicContact CG1-CG2 4.36Å; I227-I477 HydrophobicContact CG2-CG2 4.47Å; T231-I477 HydrophobicContact CG2-CG1 4.4Å; T427-I477 CarbonylContact C-O 3.49Å; T427-I477 WeakPolarHBondContact CA-O 2.99Å; L428-I477 PolarHBondContact N-O 2.84Å; L428-I477 PolarHBondContact O-N 2.8Å; I477-L479 PolarHBondContact O-N 2.82Å
478	V	75.5	Confident	78.2	Confident	71 Å²	71	63.7 Å²	63.7	43%	0.43	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	120.3	170.2	-177.9	0	0	0	0	107.4	A226 T427	A226-V478 VanDerWaalsContact O-O 3.14Å; T427-V478 HydrophobicContact CG2-CG2 3.95Å
479	L	73	Confident	78.7	Confident	55 Å²	55	65.3 Å²	65.3	29%	0.288	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-62	136.2	176.5	-69.6	171.8	0	0	0	109.3	I422 M426 L428 I477 S481	I422-L479 HydrophobicContact CD1-CD1 4.02Å; I422-L479 HydrophobicContact CG1-CD1 4.18Å; I422-L479 HydrophobicContact CG2-CD1 4.2Å; M426-L479 HydrophobicContact CE-CD1 3.84Å; M426-L479 WeakPolarHBondContact O-CB 3.22Å; M426-L479 VanDerWaalsContact O-CG 3.31Å; M426-L479 WeakPolarHBondContact O-CG 3.43Å; M426-L479 PolarHBondContact O-N 3.37Å; L428-L479 HydrophobicContact CB-CD2 4.12Å; L428-L479 HydrophobicContact CB-CG 4.37Å; I477-L479 PolarHBondContact O-N 2.82Å; L479-S481 PolarHBondContact O-N 2.82Å
480	P	65.5	Low	79	Confident	74 Å²	74	65.3 Å²	65.3	48%	0.481	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-57.6	126.6	-178.9	19.3	-29.9	0	0	0	110.8	A226	A226-P480 HydrophobicContact CB-CB 4.04Å; A226-P480 HydrophobicContact CB-CG 3.71Å
481	S	67.1	Low	79.2	Confident	95 Å²	95	67.1 Å²	67.1	66%	0.664	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-81.5	127	162.3	57	0	0	0	0	108.5	L479	L479-S481 PolarHBondContact O-N 2.82Å
482	M	67.4	Low	79.6	Confident	121 Å²	121	64 Å²	64	60%	0.596	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-74.7	138.3	164.3	-60.8	-163.6	-26	0	0	108.6	G484 F485	M482-G484 PolarHBondContact O-N 3.48Å; M482-G484 VanDerWaalsContact O-N 3.16Å; M482-F485 HydrophobicContact CB-CB 4.29Å; M482-F485 HydrophobicContact CB-CD2 4.12Å; M482-F485 HydrophobicContact CE-CD2 3.38Å; M482-F485 HydrophobicContact CE-CE2 3.56Å; M482-F485 HydrophobicContact CE-CG 4.01Å; M482-F485 HydrophobicContact CE-CZ 4.31Å; M482-F485 PolarHBondContact O-N 2.74Å; M482-F485 VanDerWaalsContact O-O 3.04Å
483	T	68.9	Low	80.1	Confident	138 Å²	138	63.6 Å²	63.6	85%	0.847	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	125.9	173.1	-50.7	0	0	0	0	109.8
484	G	73.6	Confident	80.2	Confident	4 Å²	4	62.5 Å²	62.5	4%	0.041	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	-1.9	-178.3	0	0	0	0	0	115.4	M482 I507 D508	M482-G484 PolarHBondContact O-N 3.48Å; M482-G484 VanDerWaalsContact O-N 3.16Å; G484-I507 CarbonylContact O-C 3.58Å; G484-I507 WeakPolarHBondContact O-CA 3.41Å; G484-D508 VanDerWaalsContact C-OD2 3.27Å; G484-D508 WeakPolarHBondContact CA-OD2 2.9Å; G484-D508 PolarHBondContact N-OD2 2.72Å; G484-D508 PolarHBondContact O-N 3.21Å
485	F	80.1	Confident	80.2	Confident	57 Å²	57	60.7 Å²	60.7	25%	0.25	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	127.3	177.2	-65.4	-95.8	0	0	0	111.1	M482 F505 D506 I507 L511	M482-F485 HydrophobicContact CB-CB 4.29Å; M482-F485 HydrophobicContact CB-CD2 4.12Å; M482-F485 HydrophobicContact CE-CD2 3.38Å; M482-F485 HydrophobicContact CE-CE2 3.56Å; M482-F485 HydrophobicContact CE-CG 4.01Å; M482-F485 HydrophobicContact CE-CZ 4.31Å; M482-F485 PolarHBondContact O-N 2.74Å; M482-F485 VanDerWaalsContact O-O 3.04Å; F485-F505 HydrophobicContact CD1-CD2 4.21Å; F485-D506 WeakPolarHBondContact CA-O 3.44Å; F485-I507 HydrophobicContact CD1-CG1 3.96Å; F485-I507 HydrophobicContact CE1-CD1 4.08Å; F485-I507 HydrophobicContact CE1-CG1 3.69Å; F485-L511 HydrophobicContact CD2-CD2 3.99Å; F485-L511 HydrophobicContact CE2-CD2 3.46Å; F485-L511 VanDerWaalsContact CE2-CD2 3.46Å; F485-L511 HydrophobicContact CZ-CD2 4.02Å
486	T	85	Confident	80.5	Confident	63 Å²	63	58.5 Å²	58.5	39%	0.387	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.7	170.9	51.7	0	0	0	0	109.6	F505 D506	T486-F505 CarbonylContact O-C 3.5Å; T486-F505 WeakPolarHBondContact O-CA 3.29Å; T486-D506 PolarHBondContact N-O 2.93Å; T486-D506 PolarHBondContact O-N 3.47Å
487	V	86.9	Confident	81.1	Confident	46 Å²	46	59.1 Å²	59.1	28%	0.279	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	138	178.4	-174	0	0	0	0	109	M426 F503	M426-V487 HydrophobicContact CE-CB 4.01Å; M426-V487 HydrophobicContact CE-CG1 3.4Å; M426-V487 VanDerWaalsContact CE-CG1 3.4Å; M426-V487 WeakPolarHBondContact CG-O 3.35Å; M426-V487 HydrophobicContact SD-CG1 4.41Å; V487-F503 HydrophobicContact CG1-CB 3.47Å; V487-F503 VanDerWaalsContact CG1-CB 3.47Å; V487-F503 HydrophobicContact CG1-CD1 4.26Å; V487-F503 HydrophobicContact CG1-CD2 3.43Å; V487-F503 VanDerWaalsContact CG1-CD2 3.43Å; V487-F503 HydrophobicContact CG1-CE2 4.19Å; V487-F503 HydrophobicContact CG1-CG 3.47Å; V487-F503 VanDerWaalsContact CG1-CG 3.47Å; V487-F503 HydrophobicContact CG2-CD2 4.38Å; V487-F503 HydrophobicContact CG2-CE2 4.43Å
488	K	88.6	Confident	81.7	Confident	81 Å²	81	56.1 Å²	56.1	35%	0.352	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	163.5	178.4	66.3	-170	174.5	-167.1	0	111.8	G490 D504 D506	K488-G490 VanDerWaalsContact C-N 3.28Å; K488-G490 PolarHBondContact O-N 2.73Å; K488-D504 HydrophobicContact CG-CB 3.89Å; K488-D504 PolarHBondContact N-O 2.85Å; K488-D504 PolarHBondContact O-N 3.36Å; K488-D504 VanDerWaalsContact O-O 3.14Å; K488-D506 WeakPolarHBondContact CE-OD2 3.36Å; K488-D506 IonicContact NZ-OD1 3.8Å; K488-D506 PolarHBondContact NZ-OD1 3.35Å; K488-D506 IonicContact NZ-OD2 3.26Å; K488-D506 PolarHBondContact NZ-OD2 3.06Å
489	N	88.8	Confident	82.5	Confident	87 Å²	87	53.1 Å²	53.1	47%	0.465	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.2	39	176.7	-53.3	-39.1	0	0	0	114.3	R300 D504	R300-N489 VanDerWaalsContact CZ-CB 3.47Å; R300-N489 PolarHBondContact NE-O 3.48Å; N489-D504 PolarHBondContact ND2-OD2 3.14Å
490	G	89.3	Confident	83.3	Confident	17 Å²	17	50.7 Å²	50.7	18%	0.175	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	136.1	178.6	0	0	0	0	0	112.8	K488 D502	K488-G490 VanDerWaalsContact C-N 3.28Å; K488-G490 PolarHBondContact O-N 2.73Å; G490-D502 CarbonylContact C-O 3.55Å; G490-D502 WeakPolarHBondContact CA-O 3.32Å
491	L	89.6	Confident	84.5	Confident	74 Å²	74	48 Å²	48	39%	0.387	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	138.9	175.1	-176.7	62.9	0	0	0	109.4	H493 A501 D502	L491-H493 WeakPolarHBondContact CD2-NE2 3.27Å; L491-H493 VanDerWaalsContact CG-NE2 3.28Å; L491-H493 WeakPolarHBondContact CG-NE2 3.31Å; L491-A501 CarbonylContact O-C 3.54Å; L491-A501 WeakPolarHBondContact O-CA 3.48Å; L491-D502 PolarHBondContact N-O 3.41Å; L491-D502 PolarHBondContact O-N 2.86Å
492	L	89.6	Confident	85.7	Confident	24 Å²	24	43.5 Å²	43.5	13%	0.126	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	134.7	-176.9	-158.8	76.7	0	0	0	111.3	L420 I422 L428 M499 K500 A501	L420-L492 HydrophobicContact CB-CD2 3.42Å; L420-L492 VanDerWaalsContact CB-CD2 3.42Å; I422-L492 HydrophobicContact CD1-CB 4.32Å; I422-L492 HydrophobicContact CD1-CD1 4.21Å; I422-L492 HydrophobicContact CG1-CB 4.34Å; L428-L492 HydrophobicContact CD1-CD2 4.1Å; L492-M499 HydrophobicContact CD1-CG 3.69Å; L492-M499 HydrophobicContact CD1-SD 3.72Å; L492-M499 HydrophobicContact CD2-CG 4.09Å; L492-M499 HydrophobicContact CD2-SD 3.86Å; L492-M499 HydrophobicContact CG-CG 3.92Å; L492-M499 HydrophobicContact CG-SD 4.17Å; L492-K500 CarbonylContact C-O 3.51Å; L492-K500 WeakPolarHBondContact CA-O 3.4Å; L492-A501 HydrophobicContact CD1-CB 3.82Å
493	H	87.8	Confident	86.9	Confident	62 Å²	62	39.3 Å²	39.3	29%	0.287	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	153	175.9	-61.6	-73.9	0	0	0	110.7	L491 V495 M499 K500 D502	L491-H493 WeakPolarHBondContact CD2-NE2 3.27Å; L491-H493 VanDerWaalsContact CG-NE2 3.28Å; L491-H493 WeakPolarHBondContact CG-NE2 3.31Å; H493-V495 HydrophobicContact CB-CG2 4.49Å; H493-M499 CarbonylContact O-C 3.5Å; H493-K500 HydrophobicContact CB-CB 4.44Å; H493-K500 PolarHBondContact N-O 2.83Å; H493-K500 PolarHBondContact O-N 3.5Å; H493-D502 IonicContact CD2-OD2 2.72Å
494	F	87.7	Confident	88	Confident	26 Å²	26	33.6 Å²	33.6	11%	0.114	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.4	166.5	-60.8	-77.5	0	0	0	108.2	F381 S382 L420 S498 M499	F381-F494 HydrophobicContact CB-CD1 4.37Å; F381-F494 AromaticContact CD1-CD1 3.46Å; F381-F494 HydrophobicContact CD1-CD1 3.46Å; F381-F494 VanDerWaalsContact CD1-CD1 3.46Å; F381-F494 AromaticContact CD1-CE1 3.5Å; F381-F494 HydrophobicContact CD1-CE1 3.5Å; F381-F494 AromaticContact CE1-CD1 3.98Å; F381-F494 HydrophobicContact CE1-CD1 3.98Å; F381-F494 AromaticContact CE1-CE1 3.59Å; F381-F494 HydrophobicContact CE1-CE1 3.59Å; F381-F494 HydrophobicContact CG-CD1 4.07Å; F381-F494 HydrophobicContact CG-CE1 4.49Å; S382-F494 WeakPolarHBondContact O-CB 3.19Å; L420-F494 HydrophobicContact CB-CZ 4.46Å; F494-S498 CarbonylContact C-O 3.59Å; F494-S498 WeakPolarHBondContact CA-O 3.33Å; F494-M499 HydrophobicContact CD1-CB 4.28Å; F494-M499 HydrophobicContact CD1-CG 4.29Å; F494-M499 HydrophobicContact CE1-CB 4.3Å; F494-M499 HydrophobicContact CE1-CE 4.28Å; F494-M499 HydrophobicContact CE1-CG 4.03Å
495	V	85.9	Confident	88.8	Confident	38 Å²	38	34 Å²	34	23%	0.23	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	109.1	-178.6	-178.3	0	0	0	0	108.2	H493 N497 S498 K500	H493-V495 HydrophobicContact CB-CG2 4.49Å; V495-N497 PolarHBondContact O-N 2.96Å; V495-S498 PolarHBondContact N-O 2.89Å; V495-S498 PolarHBondContact O-N 3.24Å; V495-S498 PolarHBondContact O-OG 2.95Å; V495-K500 HydrophobicContact CG2-CB 4.42Å; V495-K500 HydrophobicContact CG2-CD 4.48Å
496	G	85.9	Confident	89.3	Confident	25 Å²	25	33.7 Å²	33.7	26%	0.258	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	-126.6	-176.6	0	0	0	0	0	111.7	F381 S498	F381-G496 CarbonylContact C-O 3.57Å; G496-S498 PolarHBondContact O-N 2.72Å
497	N	89.7	Confident	89.4	Confident	20 Å²	20	31.6 Å²	31.6	11%	0.107	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	23.5	177.2	68.9	-22	0	0	0	113.8	T289 A290 Y292 S307 D308 V495	T289-N497 PolarHBondContact OG1-ND2 3.5Å; A290-N497 PolarHBondContact O-ND2 2.86Å; Y292-N497 WeakPolarHBondContact CD2-OD1 3.39Å; Y292-N497 PolarHBondContact N-OD1 2.79Å; S307-N497 WeakPolarHBondContact CA-O 3.37Å; D308-N497 PolarHBondContact N-O 3.18Å; V495-N497 PolarHBondContact O-N 2.96Å
498	S	90.8	Very high	89.3	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	155	-172.5	76.7	0	0	0	0	114.3	L306 F494 V495 G496	L306-S498 CarbonylContact O-C 3.52Å; L306-S498 VanDerWaalsContact O-CA 3.28Å; L306-S498 WeakPolarHBondContact O-CA 3.13Å; L306-S498 WeakPolarHBondContact O-CB 3.47Å; F494-S498 CarbonylContact C-O 3.59Å; F494-S498 WeakPolarHBondContact CA-O 3.33Å; V495-S498 PolarHBondContact N-O 2.89Å; V495-S498 PolarHBondContact O-N 3.24Å; V495-S498 PolarHBondContact O-OG 2.95Å; G496-S498 PolarHBondContact O-N 2.72Å
499	M	91	Very high	88.9	Confident	8 Å²	8	34.6 Å²	34.6	4%	0.039	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	128.6	167.6	-171.8	-167	-42.4	0	0	108.7	F305 L306 F311 F381 L420 L492 H493 F494	F305-M499 CarbonylContact C-O 3.53Å; F305-M499 WeakPolarHBondContact CA-O 3.05Å; L306-M499 PolarHBondContact N-O 2.89Å; L306-M499 PolarHBondContact O-N 3Å; F311-M499 HydrophobicContact CE1-CE 3.86Å; F311-M499 HydrophobicContact CE2-CE 3.65Å; F311-M499 HydrophobicContact CZ-CE 3.14Å; F311-M499 HydrophobicContact CZ-SD 4.34Å; F381-M499 HydrophobicContact CE1-CE 3.89Å; F381-M499 HydrophobicContact CE2-CB 4.33Å; F381-M499 HydrophobicContact CZ-CB 4.23Å; F381-M499 HydrophobicContact CZ-CE 3.61Å; L420-M499 HydrophobicContact CD1-CE 3.72Å; L420-M499 HydrophobicContact CD1-SD 4.12Å; L492-M499 HydrophobicContact CD1-CG 3.69Å; L492-M499 HydrophobicContact CD1-SD 3.72Å; L492-M499 HydrophobicContact CD2-CG 4.09Å; L492-M499 HydrophobicContact CD2-SD 3.86Å; L492-M499 HydrophobicContact CG-CG 3.92Å; L492-M499 HydrophobicContact CG-SD 4.17Å; H493-M499 CarbonylContact O-C 3.5Å; F494-M499 HydrophobicContact CD1-CB 4.28Å; F494-M499 HydrophobicContact CD1-CG 4.29Å; F494-M499 HydrophobicContact CE1-CB 4.3Å; F494-M499 HydrophobicContact CE1-CE 4.28Å; F494-M499 HydrophobicContact CE1-CG 4.03Å
500	K	90.7	Very high	88.4	Confident	4 Å²	4	36.2 Å²	36.2	2%	0.017	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	120.2	178.9	-176.5	-168.4	-176.8	-135.6	0	109.6	H298 I304 F305 L492 H493 V495 D502	H298-K500 PolarHBondContact ND1-NZ 3.35Å; I304-K500 CarbonylContact O-C 3.51Å; I304-K500 VanDerWaalsContact O-CA 3.29Å; I304-K500 WeakPolarHBondContact O-CA 3.42Å; F305-K500 HydrophobicContact CD1-CB 4.02Å; F305-K500 HydrophobicContact CD1-CD 4.36Å; F305-K500 HydrophobicContact CD1-CG 3.92Å; F305-K500 HydrophobicContact CE1-CB 4.11Å; F305-K500 HydrophobicContact CE1-CD 3.62Å; F305-K500 HydrophobicContact CE1-CG 3.64Å; F305-K500 HydrophobicContact CG-CG 4.48Å; F305-K500 HydrophobicContact CZ-CD 3.88Å; F305-K500 HydrophobicContact CZ-CG 3.98Å; L492-K500 CarbonylContact C-O 3.51Å; L492-K500 WeakPolarHBondContact CA-O 3.4Å; H493-K500 HydrophobicContact CB-CB 4.44Å; H493-K500 PolarHBondContact N-O 2.83Å; H493-K500 PolarHBondContact O-N 3.5Å; V495-K500 HydrophobicContact CG2-CB 4.42Å; V495-K500 HydrophobicContact CG2-CD 4.48Å; K500-D502 WeakPolarHBondContact CE-OD1 3.43Å; K500-D502 VanDerWaalsContact CE-OD2 3.31Å; K500-D502 WeakPolarHBondContact CE-OD2 3.45Å; K500-D502 VanDerWaalsContact NZ-CG 3.27Å; K500-D502 IonicContact NZ-OD1 3.39Å; K500-D502 PolarHBondContact NZ-OD1 2.87Å; K500-D502 IonicContact NZ-OD2 3.87Å; K500-D502 PolarHBondContact NZ-OD2 3.27Å
501	A	90.9	Very high	87.7	Confident	19 Å²	19	37.7 Å²	37.7	16%	0.157	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	116.6	170.9	0	0	0	0	0	109.8	S303 I304 I422 L491 L492	S303-A501 CarbonylContact C-O 3.58Å; S303-A501 VanDerWaalsContact CA-O 3.31Å; S303-A501 WeakPolarHBondContact CA-O 3.38Å; I304-A501 PolarHBondContact N-O 3.45Å; I304-A501 PolarHBondContact O-N 2.87Å; I422-A501 HydrophobicContact CD1-CB 4.43Å; L491-A501 CarbonylContact O-C 3.54Å; L491-A501 WeakPolarHBondContact O-CA 3.48Å; L492-A501 HydrophobicContact CD1-CB 3.82Å
502	D	91.7	Very high	86.8	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	138.6	174.2	-66.5	-58.7	0	0	0	110.3	R300 A302 S303 G490 L491 H493 K500	R300-D502 HydrophobicContact CB-CB 3.99Å; R300-D502 HydrophobicContact CG-CB 3.83Å; A302-D502 WeakPolarHBondContact O-CA 3.28Å; S303-D502 VanDerWaalsContact CB-OD1 3.26Å; S303-D502 WeakPolarHBondContact CB-OD1 3.07Å; S303-D502 PolarHBondContact OG-OD1 3.03Å; G490-D502 CarbonylContact C-O 3.55Å; G490-D502 WeakPolarHBondContact CA-O 3.32Å; L491-D502 PolarHBondContact N-O 3.41Å; L491-D502 PolarHBondContact O-N 2.86Å; H493-D502 IonicContact CD2-OD2 2.72Å; K500-D502 WeakPolarHBondContact CE-OD1 3.43Å; K500-D502 VanDerWaalsContact CE-OD2 3.31Å; K500-D502 WeakPolarHBondContact CE-OD2 3.45Å; K500-D502 VanDerWaalsContact NZ-CG 3.27Å; K500-D502 IonicContact NZ-OD1 3.39Å; K500-D502 PolarHBondContact NZ-OD1 2.87Å; K500-D502 IonicContact NZ-OD2 3.87Å; K500-D502 PolarHBondContact NZ-OD2 3.27Å
503	F	91.6	Very high	85.9	Confident	32 Å²	32	37 Å²	37	14%	0.14	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	162.7	179.5	53	-93.9	0	0	0	113.1	M301 A302 I304 V487	M301-F503 PolarHBondContact N-O 3.41Å; A302-F503 HydrophobicContact CB-CD2 4.01Å; A302-F503 HydrophobicContact CB-CE2 3.55Å; A302-F503 HydrophobicContact CB-CZ 3.84Å; A302-F503 PolarHBondContact N-O 2.03Å; A302-F503 PolarHBondContact O-N 3.11Å; I304-F503 HydrophobicContact CB-CE1 4.48Å; I304-F503 HydrophobicContact CD1-CE1 3.55Å; I304-F503 HydrophobicContact CD1-CZ 3.7Å; I304-F503 HydrophobicContact CG1-CE1 3.61Å; I304-F503 HydrophobicContact CG1-CZ 3.89Å; V487-F503 HydrophobicContact CG1-CB 3.47Å; V487-F503 VanDerWaalsContact CG1-CB 3.47Å; V487-F503 HydrophobicContact CG1-CD1 4.26Å; V487-F503 HydrophobicContact CG1-CD2 3.43Å; V487-F503 VanDerWaalsContact CG1-CD2 3.43Å; V487-F503 HydrophobicContact CG1-CE2 4.19Å; V487-F503 HydrophobicContact CG1-CG 3.47Å; V487-F503 VanDerWaalsContact CG1-CG 3.47Å; V487-F503 HydrophobicContact CG2-CD2 4.38Å; V487-F503 HydrophobicContact CG2-CE2 4.43Å
504	D	92.3	Very high	85.2	Confident	19 Å²	19	39 Å²	39	10%	0.102	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	156.3	166	-56.7	-42.1	0	0	0	109.2	R300 M301 K488 N489	R300-D504 WeakPolarHBondContact CA-OD1 3.33Å; R300-D504 WeakPolarHBondContact CD-OD1 3.31Å; R300-D504 IonicContact CZ-OD2 3.92Å; R300-D504 IonicContact NE-OD2 2.71Å; R300-D504 IonicContact NH1-OD2 3.71Å; R300-D504 PolarHBondContact NH1-OD2 3.26Å; M301-D504 HydrophobicContact CG-CB 4.36Å; M301-D504 PolarHBondContact N-OD1 3.39Å; M301-D504 VanDerWaalsContact N-OD1 3.11Å; M301-D504 HydrophobicContact SD-CB 3.96Å; K488-D504 HydrophobicContact CG-CB 3.89Å; K488-D504 PolarHBondContact N-O 2.85Å; K488-D504 PolarHBondContact O-N 3.36Å; K488-D504 VanDerWaalsContact O-O 3.14Å; N489-D504 PolarHBondContact ND2-OD2 3.14Å
505	F	91	Very high	84.2	Confident	12 Å²	12	41.2 Å²	41.2	5%	0.053	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	150.5	178	64.5	-92.1	0	0	0	111.7	L35 Y42 L43 M301 A302 F485 T486 I507	L35-F505 HydrophobicContact CD2-CE1 3.81Å; L35-F505 HydrophobicContact CD2-CZ 4.05Å; Y42-F505 HydrophobicContact CD1-CD2 4.48Å; Y42-F505 AromaticContact CD1-CE2 3.82Å; Y42-F505 HydrophobicContact CD1-CE2 3.82Å; Y42-F505 HydrophobicContact CD1-CZ 4.28Å; Y42-F505 HydrophobicContact CE1-CD2 4.23Å; Y42-F505 AromaticContact CE1-CE2 3.93Å; Y42-F505 HydrophobicContact CE1-CE2 3.93Å; L43-F505 HydrophobicContact CD2-CE2 4.06Å; L43-F505 HydrophobicContact CD2-CZ 4.25Å; L43-F505 HydrophobicContact CG-CZ 4.31Å; M301-F505 HydrophobicContact CB-CD1 3.9Å; M301-F505 HydrophobicContact CB-CE1 3.74Å; M301-F505 HydrophobicContact CE-CD1 4Å; M301-F505 HydrophobicContact CE-CD2 4.18Å; M301-F505 HydrophobicContact CE-CE1 3.8Å; M301-F505 HydrophobicContact CE-CE2 3.98Å; M301-F505 HydrophobicContact CE-CG 4.18Å; M301-F505 HydrophobicContact CE-CZ 3.79Å; M301-F505 VanDerWaalsContact CE-O 3.28Å; M301-F505 WeakPolarHBondContact CE-O 3.44Å; A302-F505 HydrophobicContact CB-CD1 4.11Å; A302-F505 HydrophobicContact CB-CE1 4.1Å; F485-F505 HydrophobicContact CD1-CD2 4.21Å; T486-F505 CarbonylContact O-C 3.5Å; T486-F505 WeakPolarHBondContact O-CA 3.29Å; F505-I507 HydrophobicContact CD2-CG1 4.42Å; F505-I507 HydrophobicContact CE2-CG1 4.4Å
506	D	90.3	Very high	83.2	Confident	51 Å²	51	39.9 Å²	39.9	27%	0.273	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	152.2	165.1	-57.3	-53.1	0	0	0	110.2	Y42 F485 T486 K488	Y42-D506 WeakPolarHBondContact OH-CA 3.28Å; F485-D506 WeakPolarHBondContact CA-O 3.44Å; T486-D506 PolarHBondContact N-O 2.93Å; T486-D506 PolarHBondContact O-N 3.47Å; K488-D506 WeakPolarHBondContact CE-OD2 3.36Å; K488-D506 IonicContact NZ-OD1 3.8Å; K488-D506 PolarHBondContact NZ-OD1 3.35Å; K488-D506 IonicContact NZ-OD2 3.26Å; K488-D506 PolarHBondContact NZ-OD2 3.06Å
507	I	87	Confident	82.3	Confident	19 Å²	19	40.3 Å²	40.3	10%	0.097	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.9	174.5	-53.5	174.6	0	0	0	108.7	Y42 L43 Q46 G484 F485 F505 L511 L512	Y42-I507 HydrophobicContact CE1-CD1 4.3Å; Y42-I507 HydrophobicContact CE1-CG1 4.14Å; Y42-I507 PolarHBondContact OH-N 3.42Å; L43-I507 HydrophobicContact CD2-CD1 3.71Å; Q46-I507 HydrophobicContact CB-CD1 4.48Å; Q46-I507 HydrophobicContact CG-CD1 4.3Å; G484-I507 CarbonylContact O-C 3.58Å; G484-I507 WeakPolarHBondContact O-CA 3.41Å; F485-I507 HydrophobicContact CD1-CG1 3.96Å; F485-I507 HydrophobicContact CE1-CD1 4.08Å; F485-I507 HydrophobicContact CE1-CG1 3.69Å; F505-I507 HydrophobicContact CD2-CG1 4.42Å; F505-I507 HydrophobicContact CE2-CG1 4.4Å; I507-L511 HydrophobicContact CG2-CB 4.47Å; I507-L511 HydrophobicContact CG2-CD2 4.03Å; I507-L512 HydrophobicContact CB-CD1 4.41Å; I507-L512 HydrophobicContact CB-CD2 4.35Å; I507-L512 HydrophobicContact CB-CG 4.37Å; I507-L512 HydrophobicContact CG2-CD1 4.26Å; I507-L512 HydrophobicContact CG2-CD2 3.71Å; I507-L512 HydrophobicContact CG2-CG 3.71Å
508	D	84.7	Confident	81	Confident	61 Å²	61	45.3 Å²	45.3	33%	0.326	24%	0.238	S	C	.	.			trans	-65.6	142	179.6	-58	-25.5	0	0	0	111	G484 D510 L511 L512	G484-D508 VanDerWaalsContact C-OD2 3.27Å; G484-D508 WeakPolarHBondContact CA-OD2 2.9Å; G484-D508 PolarHBondContact N-OD2 2.72Å; G484-D508 PolarHBondContact O-N 3.21Å; D508-D510 PolarHBondContact O-N 2.94Å; D508-L511 PolarHBondContact O-N 2.84Å; D508-L512 WeakPolarHBondContact O-CG 3.39Å; D508-L512 PolarHBondContact O-N 3.36Å
509	E	80.4	Confident	79.3	Confident	129 Å²	129	46.9 Å²	46.9	60%	0.603	25%	0.245	S	C	*	.	H	α-helix	trans	-65.2	-25.3	-178.4	-60.4	-158.6	145.5	0	0	113	R49 L512 S513	R49-E509 IonicContact CZ-OE1 4Å; R49-E509 IonicContact NH1-OE1 3.25Å; R49-E509 PolarHBondContact NH1-OE1 3.3Å; R49-E509 IonicContact NH2-OE1 3.21Å; E509-L512 PolarHBondContact O-N 3.1Å; E509-S513 WeakPolarHBondContact O-CB 3.39Å; E509-S513 PolarHBondContact O-N 3.3Å; E509-S513 PolarHBondContact O-OG 2.79Å
510	D	78.5	Confident	77.3	Confident	121 Å²	121	49.5 Å²	49.5	65%	0.647	26%	0.264	S	S	*	.	H	α-helix	trans	-69.7	-39.8	175.4	-68.8	-25.5	0	0	0	112.6	D508 L512 S513 N514	D508-D510 PolarHBondContact O-N 2.94Å; D510-L512 VanDerWaalsContact C-N 3.33Å; D510-S513 WeakPolarHBondContact CA-OG 3.35Å; D510-S513 PolarHBondContact O-N 3.06Å; D510-S513 PolarHBondContact O-OG 2.84Å; D510-N514 WeakPolarHBondContact O-CB 3.1Å; D510-N514 VanDerWaalsContact O-CG 3.3Å; D510-N514 PolarHBondContact O-N 3.1Å; D510-N514 PolarHBondContact O-ND2 2.86Å; D510-N514 VanDerWaalsContact O-ND2 3.12Å
511	L	74.8	Confident	75.4	Confident	48 Å²	48	55.6 Å²	55.6	25%	0.251	29%	0.292	S	S	.	.	H	α-helix	trans	-65.6	-43.4	174.6	179.9	65.1	0	0	0	110.1	F485 I507 D508 S513 N514 F515	F485-L511 HydrophobicContact CD2-CD2 3.99Å; F485-L511 HydrophobicContact CE2-CD2 3.46Å; F485-L511 VanDerWaalsContact CE2-CD2 3.46Å; F485-L511 HydrophobicContact CZ-CD2 4.02Å; I507-L511 HydrophobicContact CG2-CB 4.47Å; I507-L511 HydrophobicContact CG2-CD2 4.03Å; D508-L511 PolarHBondContact O-N 2.84Å; L511-S513 VanDerWaalsContact C-N 3.34Å; L511-S513 PolarHBondContact O-N 2.89Å; L511-N514 PolarHBondContact O-N 3.27Å; L511-F515 WeakPolarHBondContact O-CB 3.19Å; L511-F515 PolarHBondContact O-N 3.05Å
512	L	71.2	Confident	73.1	Confident	16 Å²	16	55.3 Å²	55.3	8%	0.084	29%	0.29	C	S	.	.	H	α-helix	trans	-59.4	-43.5	175.9	-68.6	176.7	0	0	0	111.5	L50 I507 D508 E509 D510 G516	L50-L512 HydrophobicContact CD1-CD2 3.55Å; L50-L512 HydrophobicContact CD2-CB 3.64Å; L50-L512 HydrophobicContact CD2-CD2 3.89Å; L50-L512 HydrophobicContact CD2-CG 4.29Å; L50-L512 VanDerWaalsContact CD2-O 3.29Å; L50-L512 WeakPolarHBondContact CD2-O 3.48Å; L50-L512 HydrophobicContact CG-CB 4.47Å; L50-L512 HydrophobicContact CG-CD2 3.79Å; I507-L512 HydrophobicContact CB-CD1 4.41Å; I507-L512 HydrophobicContact CB-CD2 4.35Å; I507-L512 HydrophobicContact CB-CG 4.37Å; I507-L512 HydrophobicContact CG2-CD1 4.26Å; I507-L512 HydrophobicContact CG2-CD2 3.71Å; I507-L512 HydrophobicContact CG2-CG 3.71Å; D508-L512 WeakPolarHBondContact O-CG 3.39Å; D508-L512 PolarHBondContact O-N 3.36Å; E509-L512 PolarHBondContact O-N 3.1Å; D510-L512 VanDerWaalsContact C-N 3.33Å; L512-G516 PolarHBondContact O-N 3.41Å
513	S	70.9	Confident	70.7	Confident	66 Å²	66	58.8 Å²	58.8	46%	0.462	31%	0.305	S	S	.	.	H	α-helix	trans	-69.4	-41.4	179.4	72.3	0	0	0	0	112.5	E509 D510 L511 G516 A517	E509-S513 WeakPolarHBondContact O-CB 3.39Å; E509-S513 PolarHBondContact O-N 3.3Å; E509-S513 PolarHBondContact O-OG 2.79Å; D510-S513 WeakPolarHBondContact CA-OG 3.35Å; D510-S513 PolarHBondContact O-N 3.06Å; D510-S513 PolarHBondContact O-OG 2.84Å; L511-S513 VanDerWaalsContact C-N 3.34Å; L511-S513 PolarHBondContact O-N 2.89Å; S513-G516 CarbonylContact O-C 3.55Å; S513-G516 PolarHBondContact O-N 2.95Å; S513-A517 PolarHBondContact O-N 3.41Å
514	N	71.5	Confident	68	Low	105 Å²	105	68.1 Å²	68.1	56%	0.561	34%	0.339	S	S	*	.	H	α-helix	trans	-63.7	-43.3	176.2	-78.4	-35.1	0	0	0	112.5	D510 L511 G516 A517 R518	D510-N514 WeakPolarHBondContact O-CB 3.1Å; D510-N514 VanDerWaalsContact O-CG 3.3Å; D510-N514 PolarHBondContact O-N 3.1Å; D510-N514 PolarHBondContact O-ND2 2.86Å; D510-N514 VanDerWaalsContact O-ND2 3.12Å; L511-N514 PolarHBondContact O-N 3.27Å; N514-G516 VanDerWaalsContact C-N 3.33Å; N514-A517 PolarHBondContact O-N 3.37Å; N514-R518 PolarHBondContact O-N 3.47Å
515	F	67	Low	65	Low	72 Å²	72	74.2 Å²	74.2	32%	0.316	37%	0.37	S	S	.	.	H	α-helix	trans	-61.2	-44.1	173.8	-174.5	-96.4	0	0	0	111	L50 L210 L511 A517 R518 F519	L50-F515 HydrophobicContact CD1-CD1 4.27Å; L210-F515 HydrophobicContact CD2-CE1 4.35Å; L210-F515 HydrophobicContact CD2-CE2 3.49Å; L210-F515 VanDerWaalsContact CD2-CE2 3.49Å; L210-F515 HydrophobicContact CD2-CZ 3.28Å; L511-F515 WeakPolarHBondContact O-CB 3.19Å; L511-F515 PolarHBondContact O-N 3.05Å; F515-A517 VanDerWaalsContact C-N 3.32Å; F515-A517 PolarHBondContact O-N 2.93Å; F515-R518 PolarHBondContact O-N 3.15Å; F515-F519 PolarHBondContact O-N 2.92Å
516	G	65.1	Low	62.3	Low	11 Å²	11	79.6 Å²	79.6	11%	0.113	40%	0.4	C	S	.	.	H	α-helix	trans	-62.2	-32.6	174.2	0	0	0	0	0	114.3	R54 L512 S513 N514 F519	R54-G516 WeakPolarHBondContact CD-O 3.39Å; R54-G516 PolarHBondContact NE-O 2.81Å; L512-G516 PolarHBondContact O-N 3.41Å; S513-G516 CarbonylContact O-C 3.55Å; S513-G516 PolarHBondContact O-N 2.95Å; N514-G516 VanDerWaalsContact C-N 3.33Å; G516-F519 VanDerWaalsContact O-CB 3.3Å; G516-F519 WeakPolarHBondContact O-CB 3.12Å; G516-F519 PolarHBondContact O-N 3.25Å
517	A	66.6	Low	59.5	Low	34 Å²	34	81.3 Å²	81.3	28%	0.281	42%	0.415	S	S	.	.	H	α-helix	trans	-68	-37.6	176.5	0	0	0	0	0	112.3	S513 N514 F515 F519 S520 Q521	S513-A517 PolarHBondContact O-N 3.41Å; N514-A517 PolarHBondContact O-N 3.37Å; F515-A517 VanDerWaalsContact C-N 3.32Å; F515-A517 PolarHBondContact O-N 2.93Å; A517-F519 VanDerWaalsContact C-N 3.3Å; A517-F519 PolarHBondContact O-N 3.27Å; A517-S520 PolarHBondContact O-N 3.05Å; A517-S520 PolarHBondContact O-OG 3.23Å; A517-Q521 PolarHBondContact O-N 3.47Å
518	R	64	Low	56.7	Low	125 Å²	125	85 Å²	85	47%	0.472	44%	0.443	S	S	.	.	H	α-helix	trans	-64.1	-34.2	175.1	-69.8	-174.9	176.8	-172.3	-0.6	112.4	T209 N514 F515 S520 Q521 A522	T209-R518 HydrophobicContact CG2-CB 4.13Å; N514-R518 PolarHBondContact O-N 3.47Å; F515-R518 PolarHBondContact O-N 3.15Å; R518-S520 VanDerWaalsContact C-N 3.26Å; R518-S520 PolarHBondContact O-N 3.46Å; R518-Q521 PolarHBondContact O-N 2.98Å; R518-A522 PolarHBondContact O-N 3.41Å
519	F	53.3	Low	54.4	Low	33 Å²	33	90.4 Å²	90.4	15%	0.145	47%	0.466	C	S	.	.	H	α-helix	trans	-53.7	-41.3	173	-168.6	-84.9	0	0	0	112.6	L51 R54 I58 M202 F205 F515 G516 A517	L51-F519 HydrophobicContact CD2-CE2 4.45Å; R54-F519 HydrophobicContact CG-CD1 4.24Å; I58-F519 HydrophobicContact CD1-CE1 4.28Å; M202-F519 HydrophobicContact CE-CZ 4Å; F205-F519 AromaticContact CD1-CD2 3.74Å; F205-F519 HydrophobicContact CD1-CD2 3.74Å; F205-F519 AromaticContact CD1-CE2 3.51Å; F205-F519 HydrophobicContact CD1-CE2 3.51Å; F205-F519 HydrophobicContact CD2-CB 4.38Å; F205-F519 AromaticContact CD2-CD2 3.65Å; F205-F519 HydrophobicContact CD2-CD2 3.65Å; F205-F519 HydrophobicContact CD2-CE2 4.14Å; F205-F519 HydrophobicContact CD2-CG 4.18Å; F205-F519 AromaticContact CE1-CD2 3.4Å; F205-F519 HydrophobicContact CE1-CD2 3.4Å; F205-F519 VanDerWaalsContact CE1-CD2 3.4Å; F205-F519 AromaticContact CE1-CE2 3.48Å; F205-F519 HydrophobicContact CE1-CE2 3.48Å; F205-F519 VanDerWaalsContact CE1-CE2 3.48Å; F205-F519 HydrophobicContact CE2-CB 3.87Å; F205-F519 AromaticContact CE2-CD2 3.34Å; F205-F519 HydrophobicContact CE2-CD2 3.34Å; F205-F519 HydrophobicContact CE2-CE2 4.15Å; F205-F519 AromaticContact CE2-CG 3.94Å; F205-F519 HydrophobicContact CE2-CG 3.94Å; F205-F519 AromaticContact CG-CD2 3.85Å; F205-F519 HydrophobicContact CG-CD2 3.85Å; F205-F519 AromaticContact CG-CE2 3.85Å; F205-F519 HydrophobicContact CG-CE2 3.85Å; F205-F519 HydrophobicContact CZ-CB 4.36Å; F205-F519 AromaticContact CZ-CD2 3.23Å; F205-F519 HydrophobicContact CZ-CD2 3.23Å; F205-F519 AromaticContact CZ-CE2 3.85Å; F205-F519 HydrophobicContact CZ-CE2 3.85Å; F205-F519 HydrophobicContact CZ-CG 4.21Å; F515-F519 PolarHBondContact O-N 2.92Å; G516-F519 VanDerWaalsContact O-CB 3.3Å; G516-F519 WeakPolarHBondContact O-CB 3.12Å; G516-F519 PolarHBondContact O-N 3.25Å; A517-F519 VanDerWaalsContact C-N 3.3Å; A517-F519 PolarHBondContact O-N 3.27Å
520	S	50.3	Low	52.1	Low	63 Å²	63	91 Å²	91	44%	0.441	47%	0.474	S	S	.	.	H	α-helix	trans	-77.3	-20.6	177.8	49.2	0	0	0	0	114.6	R54 A517 R518	R54-S520 PolarHBondContact NH2-OG 2.84Å; A517-S520 PolarHBondContact O-N 3.05Å; A517-S520 PolarHBondContact O-OG 3.23Å; R518-S520 VanDerWaalsContact C-N 3.26Å; R518-S520 PolarHBondContact O-N 3.46Å
521	Q	50.3	Low	49.7	Very low	131 Å²	131	89.1 Å²	89.1	61%	0.612	47%	0.47	S	S	*	.	H	α-helix	trans	-87.6	-6.4	-178.6	-69.2	-178.8	11	0	0	113.5	A517 R518 K523	A517-Q521 PolarHBondContact O-N 3.47Å; R518-Q521 PolarHBondContact O-N 2.98Å; Q521-K523 PolarHBondContact O-N 3Å
522	A	43.7	Very low	47.5	Very low	13 Å²	13	94 Å²	94	11%	0.107	50%	0.495	C	S	.	.	S	Bend	trans	-57.1	1.2	172.8	0	0	0	0	0	113.9	Q204 F205 R518	Q204-A522 PolarHBondContact NE2-O 3.14Å; Q204-A522 PolarHBondContact OE1-O 3.45Å; F205-A522 HydrophobicContact CB-CB 4.46Å; F205-A522 HydrophobicContact CD2-CB 4.43Å; R518-A522 PolarHBondContact O-N 3.41Å
523	K	40.2	Very low	45.5	Very low	73 Å²	73	100.6 Å²	100.6	32%	0.317	53%	0.531	S	S	.	.			trans	-118.9	71	173.1	-165.9	-178.9	-176	179	0	112	T66 Q521	T66-K523 PolarHBondContact OG1-NZ 3.2Å; Q521-K523 PolarHBondContact O-N 3Å
524	R	35.4	Very low	43.6	Very low	229 Å²	229	101.4 Å²	101.4	86%	0.864	54%	0.542	S	S	*	.			trans	-143.8	-2	164.1	-84.1	-159.8	-175.1	171.6	2.1	117.1
525	I	29.3	Very low	41.5	Very low	146 Å²	146	105.6 Å²	105.6	75%	0.749	56%	0.555	S	S	*	*			trans	-105.5	64.6	168.2	-46.8	176.4	0	0	0	107.6
526	D	34.7	Very low	39.7	Very low	126 Å²	126	113.4 Å²	113.4	67%	0.674	58%	0.584	S	S	*	*			trans	-81.2	108.7	144.7	-81.5	-33.6	0	0	0	103.7	S528	D526-S528 VanDerWaalsContact C-N 3.33Å; D526-S528 PolarHBondContact O-N 3.48Å
527	S	30.1	Very low	37.8	Very low	86 Å²	86	115.5 Å²	115.5	60%	0.601	61%	0.605	S	S	*	*			trans	-49.4	106.7	160.7	36	0	0	0	0	107.5	E529	S527-E529 PolarHBondContact O-N 3.22Å
528	S	28.4	Very low	36	Very low	97 Å²	97	121.3 Å²	121.3	68%	0.678	63%	0.632	S	S	*	*			trans	-43.9	116.6	162.5	38.2	0	0	0	0	109.9	D526 D530	D526-S528 VanDerWaalsContact C-N 3.33Å; D526-S528 PolarHBondContact O-N 3.48Å; S528-D530 VanDerWaalsContact C-N 3.26Å; S528-D530 PolarHBondContact O-N 3.43Å
529	E	36.2	Very low	34.3	Very low	174 Å²	174	123.4 Å²	123.4	81%	0.813	65%	0.652	S	S	*	*	S	Bend	trans	47.9	-5.7	151.6	-79.6	177.8	145.2	0	0	122.7	S527	S527-E529 PolarHBondContact O-N 3.22Å
530	D	32.1	Very low	33.1	Very low	143 Å²	143	126.4 Å²	126.4	77%	0.765	68%	0.683	S	S	*	*	S	Bend	trans	-98.3	-3	-174.2	-78	-24.4	0	0	0	116.1	S528	S528-D530 VanDerWaalsContact C-N 3.26Å; S528-D530 PolarHBondContact O-N 3.43Å
531	S	28.8	Very low	31.9	Very low	80 Å²	80	131.5 Å²	131.5	56%	0.559	71%	0.705	S	S	*	*	S	Bend	trans	-100.5	-8.5	176.3	67.8	0	0	0	0	115.2
532	L	28.5	Very low	30.6	Very low	150 Å²	150	129 Å²	129	79%	0.785	72%	0.715	S	S	*	*	S	Bend	trans	-82.1	-13.4	177	-97.6	150.5	0	0	0	113.9
533	N	29.1	Very low	29.6	Very low	156 Å²	156	132.7 Å²	132.7	83%	0.834	76%	0.755	S	S	*	*	S	Bend	trans	-101.3	-6.8	174.4	-76.5	-21	0	0	0	114.5
534	A	30.7	Very low	28.9	Very low	83 Å²	83	133.4 Å²	133.4	69%	0.686	78%	0.782	S	S	*	*	S	Bend	trans	-106	1	-170.8	0	0	0	0	0	115.7
535	K	27.6	Very low	28.4	Very low	192 Å²	192	125.4 Å²	125.4	84%	0.835	77%	0.771	S	S	*	*	S	Bend	trans	-131.9	16.1	-178.7	-130.5	179.1	-175.2	-179.9	0	116.4
536	Y	28.9	Very low	28.4	Very low	236 Å²	236	122.8 Å²	122.8	93%	0.925	77%	0.766	S	S	*	*	S	Bend	trans	-123.1	45.9	170.1	-101.6	-83.8	0	0	0	110.9
537	G	26.3	Very low	28.2	Very low	55 Å²	55	123 Å²	123	57%	0.567	77%	0.766	S	S	*	*	S	Bend	trans	-123.6	126.5	157.6	0	0	0	0	0	106.4
538	D	29.1	Very low	28.4	Very low	157 Å²	157	124.3 Å²	124.3	84%	0.84	77%	0.77	S	S	*	*	S	Bend	trans	70.9	81.8	174.1	-53.7	-26	0	0	0	116.5
539	D	27.4	Very low	28.5	Very low	168 Å²	168	128.5 Å²	128.5	90%	0.898	77%	0.772	S	S	*	*			trans	-174.6	73.7	130.2	-90.2	-23.8	0	0	0	109.9	N541	D539-N541 PolarHBondContact O-N 3.42Å
540	A	27.7	Very low	28.3	Very low	96 Å²	96	122.2 Å²	122.2	79%	0.793	75%	0.748	S	S	*	*			trans	-80.6	84	164	0	0	0	0	0	108.8
541	N	25.6	Very low	28.5	Very low	170 Å²	170	120.3 Å²	120.3	91%	0.909	74%	0.737	S	S	*	*			trans	174.5	92.6	151.3	-92.9	-24.3	0	0	0	110.7	D539	D539-N541 PolarHBondContact O-N 3.42Å
542	G	23	Very low	28.6	Very low	79 Å²	79	122.2 Å²	122.2	81%	0.814	74%	0.739	S	S	*	*			trans	179.3	100.1	171.1	0	0	0	0	0	110.9
543	G	22.9	Very low	28.9	Very low	91 Å²	91	118.9 Å²	118.9	94%	0.938	72%	0.724	S	S	*	*			trans	-59.4	140.9	-172.7	0	0	0	0	0	114.1
544	G	25.2	Very low	29.1	Very low	87 Å²	87	119.8 Å²	119.8	90%	0.897	72%	0.716	S	S	*	*	S	Bend	trans	145.1	22.9	171.5	0	0	0	0	0	117.1
545	G	25.1	Very low	29.5	Very low	61 Å²	61	120.8 Å²	120.8	63%	0.629	71%	0.708	S	S	*	*			trans	-139.6	2.8	-179.5	0	0	0	0	0	116.6	I547	G545-I547 PolarHBondContact O-N 2.83Å
546	S	29.6	Very low	30	Very low	92 Å²	92	117.8 Å²	117.8	64%	0.643	70%	0.7	S	S	*	*			trans	-97.8	32.7	-171	-175.1	0	0	0	0	114.7	S550	S546-S550 WeakPolarHBondContact O-CB 3.22Å
547	I	29.6	Very low	30.3	Very low	131 Å²	131	110 Å²	110	67%	0.672	68%	0.68	S	S	*	*	S	Bend	trans	-97.7	-34.1	175	-60.7	-180	0	0	0	111.9	G545 S550 L551	G545-I547 PolarHBondContact O-N 2.83Å; I547-S550 PolarHBondContact O-N 2.81Å; I547-L551 HydrophobicContact CG2-CD1 4Å; I547-L551 PolarHBondContact O-N 2.9Å; I547-L551 VanDerWaalsContact O-N 3.08Å
548	T	35.4	Very low	30.9	Very low	113 Å²	113	110.1 Å²	110.1	69%	0.693	67%	0.673	S	S	*	*	H	α-helix	trans	-72.7	-43.2	-179.6	40.8	0	0	0	0	112.8
549	Y	30.1	Very low	31.2	Very low	184 Å²	184	113.5 Å²	113.5	72%	0.722	67%	0.674	S	S	*	*	H	α-helix	trans	-69	-36.7	170.9	-86.4	-83.3	0	0	0	111.8	L551 M552 T553	Y549-L551 VanDerWaalsContact C-N 3.33Å; Y549-L551 PolarHBondContact O-N 2.9Å; Y549-M552 PolarHBondContact O-N 2.84Å; Y549-T553 VanDerWaalsContact O-CB 3.3Å; Y549-T553 WeakPolarHBondContact O-CB 3.41Å; Y549-T553 PolarHBondContact O-N 3.12Å; Y549-T553 PolarHBondContact O-OG1 2.96Å
550	S	31.5	Very low	31.8	Very low	42 Å²	42	108.5 Å²	108.5	29%	0.294	66%	0.655	S	S	.	*	H	α-helix	trans	-63.5	-35	179.1	-177.5	0	0	0	0	112.8	S546 I547 R554	S546-S550 WeakPolarHBondContact O-CB 3.22Å; I547-S550 PolarHBondContact O-N 2.81Å; S550-R554 WeakPolarHBondContact O-CA 3.23Å; S550-R554 WeakPolarHBondContact O-CB 3.47Å; S550-R554 WeakPolarHBondContact O-CG 3.31Å; S550-R554 PolarHBondContact O-N 2.79Å
551	L	35.5	Very low	32.5	Very low	103 Å²	103	106.3 Å²	106.3	54%	0.539	63%	0.632	S	S	.	*	H	α-helix	trans	-71.7	-42.7	177.4	-107.4	119	0	0	0	113.2	I547 Y549 R554 M555	I547-L551 HydrophobicContact CG2-CD1 4Å; I547-L551 PolarHBondContact O-N 2.9Å; I547-L551 VanDerWaalsContact O-N 3.08Å; Y549-L551 VanDerWaalsContact C-N 3.33Å; Y549-L551 PolarHBondContact O-N 2.9Å; L551-R554 PolarHBondContact O-N 2.87Å; L551-M555 WeakPolarHBondContact O-CG 3.26Å; L551-M555 PolarHBondContact O-N 2.96Å
552	M	31.2	Very low	32.8	Very low	121 Å²	121	106.9 Å²	106.9	60%	0.596	62%	0.621	S	S	*	*	H	α-helix	trans	-70.8	-35.2	174.7	-96.6	-171.3	172.9	0	0	112.5	L74 Y549 M555 L556	L74-M552 HydrophobicContact CD1-CE 4.25Å; Y549-M552 PolarHBondContact O-N 2.84Å; M552-M555 WeakPolarHBondContact O-CB 3.5Å; M552-M555 PolarHBondContact O-N 2.83Å; M552-L556 PolarHBondContact O-N 3.11Å
553	T	35.6	Very low	33.6	Very low	79 Å²	79	106.9 Å²	106.9	49%	0.485	61%	0.606	S	S	.	*	H	α-helix	trans	-74.1	-31.6	176.2	-33.8	0	0	0	0	111.3	Y549 M555 L556 S557	Y549-T553 VanDerWaalsContact O-CB 3.3Å; Y549-T553 WeakPolarHBondContact O-CB 3.41Å; Y549-T553 PolarHBondContact O-N 3.12Å; Y549-T553 PolarHBondContact O-OG1 2.96Å; T553-M555 VanDerWaalsContact C-N 3.31Å; T553-M555 PolarHBondContact O-N 3.02Å; T553-L556 PolarHBondContact O-N 3.02Å; T553-L556 VanDerWaalsContact O-N 3.15Å; T553-S557 PolarHBondContact O-N 2.96Å
554	R	32.1	Very low	34.2	Very low	175 Å²	175	109.6 Å²	109.6	66%	0.66	59%	0.592	S	S	*	*	H	α-helix	trans	-67.5	-28.6	169.6	-80.4	175	173.2	-161.3	-1	112.6	S550 L551 L556 S557 S558	S550-R554 WeakPolarHBondContact O-CA 3.23Å; S550-R554 WeakPolarHBondContact O-CB 3.47Å; S550-R554 WeakPolarHBondContact O-CG 3.31Å; S550-R554 PolarHBondContact O-N 2.79Å; L551-R554 PolarHBondContact O-N 2.87Å; R554-L556 VanDerWaalsContact C-N 3.31Å; R554-S557 PolarHBondContact O-N 3.48Å; R554-S558 PolarHBondContact O-N 2.76Å
555	M	39.7	Very low	34.8	Very low	105 Å²	105	109.3 Å²	109.3	52%	0.517	57%	0.573	S	S	.	*	H	α-helix	trans	-63.8	-37.3	169.3	-74.7	-170.3	-178.9	0	0	111.5	L551 M552 T553 V561	L551-M555 WeakPolarHBondContact O-CG 3.26Å; L551-M555 PolarHBondContact O-N 2.96Å; M552-M555 WeakPolarHBondContact O-CB 3.5Å; M552-M555 PolarHBondContact O-N 2.83Å; T553-M555 VanDerWaalsContact C-N 3.31Å; T553-M555 PolarHBondContact O-N 3.02Å; M555-V561 WeakPolarHBondContact O-CG2 3.11Å
556	L	37.9	Very low	35.2	Very low	128 Å²	128	110.9 Å²	110.9	67%	0.67	57%	0.571	S	S	*	*	H	α-helix	trans	-80.9	-19.9	178.9	-70.6	167	0	0	0	114.2	M552 T553 R554	M552-L556 PolarHBondContact O-N 3.11Å; T553-L556 PolarHBondContact O-N 3.02Å; T553-L556 VanDerWaalsContact O-N 3.15Å; R554-L556 VanDerWaalsContact C-N 3.31Å
557	S	35.9	Very low	35.5	Very low	72 Å²	72	111 Å²	111	50%	0.503	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.5	0.8	178.9	75.2	0	0	0	0	114.9	T553 R554 R559	T553-S557 PolarHBondContact O-N 2.96Å; R554-S557 PolarHBondContact O-N 3.48Å; S557-R559 PolarHBondContact O-N 3.48Å
558	S	39.3	Very low	35.6	Very low	59 Å²	59	106.8 Å²	106.8	41%	0.413	55%	0.548	S	S	.	.	S	Bend	trans	-62.5	135	176.5	174.2	0	0	0	0	110.6	R554 A560 V561	R554-S558 PolarHBondContact O-N 2.76Å; S558-A560 PolarHBondContact O-N 2.9Å; S558-V561 PolarHBondContact O-N 3.46Å
559	R	35.5	Very low	35.5	Very low	228 Å²	228	107.6 Å²	107.6	86%	0.86	55%	0.547	S	S	*	.	H	α-helix	trans	-48.5	-29	178.8	-89.9	-179.4	172.9	177.8	-2.4	113.1	S557 T563	S557-R559 PolarHBondContact O-N 3.48Å; R559-T563 PolarHBondContact O-N 3.13Å; R559-T563 PolarHBondContact O-OG1 3.19Å
560	A	38.3	Very low	35.5	Very low	62 Å²	62	103.2 Å²	103.2	51%	0.512	54%	0.54	S	S	.	.	H	α-helix	trans	-66.3	-33	176.7	0	0	0	0	0	113.9	S558 T563 F564	S558-A560 PolarHBondContact O-N 2.9Å; A560-T563 PolarHBondContact O-OG1 2.91Å; A560-F564 PolarHBondContact O-N 3.33Å
561	V	42.4	Very low	35.4	Very low	51 Å²	51	103.9 Å²	103.9	31%	0.309	55%	0.548	S	S	.	.	H	α-helix	trans	-79.7	-32.6	-179.9	-179.5	0	0	0	0	111.5	M555 S558 F564 T565	M555-V561 WeakPolarHBondContact O-CG2 3.11Å; S558-V561 PolarHBondContact O-N 3.46Å; V561-F564 PolarHBondContact O-N 3.41Å; V561-T565 PolarHBondContact O-N 3.18Å; V561-T565 PolarHBondContact O-OG1 3.33Å
562	R	32.5	Very low	35.3	Very low	181 Å²	181	103.9 Å²	103.9	68%	0.683	55%	0.552	S	S	*	*	H	α-helix	trans	-67.1	-35.7	172.5	-76.1	-172.4	-178.6	-175.6	0.2	112.3	F564 T566	R562-F564 VanDerWaalsContact C-N 3.34Å; R562-T566 PolarHBondContact O-N 3.14Å; R562-T566 PolarHBondContact O-OG1 2.67Å
563	T	40.2	Very low	35.3	Very low	79 Å²	79	103.4 Å²	103.4	49%	0.485	56%	0.556	S	S	.	*	H	α-helix	trans	-66.6	-41	172.9	-0.8	0	0	0	0	110.2	R559 A560 T566 I567	R559-T563 PolarHBondContact O-N 3.13Å; R559-T563 PolarHBondContact O-OG1 3.19Å; A560-T563 PolarHBondContact O-OG1 2.91Å; T563-T566 PolarHBondContact O-N 3.18Å; T563-I567 HydrophobicContact CG2-CD1 4.42Å; T563-I567 WeakPolarHBondContact O-CB 3.44Å; T563-I567 WeakPolarHBondContact O-CD1 3.39Å; T563-I567 WeakPolarHBondContact O-CG1 3.35Å; T563-I567 PolarHBondContact O-N 2.77Å
564	F	35.4	Very low	35.1	Very low	149 Å²	149	103.2 Å²	103.2	65%	0.654	56%	0.563	S	S	*	*	H	α-helix	trans	-72.1	-36.6	-179.2	-119.2	-87.9	0	0	0	114.7	A560 V561 R562 T566 I567 A568	A560-F564 PolarHBondContact O-N 3.33Å; V561-F564 PolarHBondContact O-N 3.41Å; R562-F564 VanDerWaalsContact C-N 3.34Å; F564-T566 VanDerWaalsContact C-N 3.3Å; F564-T566 PolarHBondContact O-N 2.87Å; F564-I567 PolarHBondContact O-N 3.48Å; F564-A568 WeakPolarHBondContact O-CB 3.36Å; F564-A568 PolarHBondContact O-N 2.9Å
565	T	37.2	Very low	35	Very low	81 Å²	81	98.9 Å²	98.9	50%	0.497	56%	0.564	S	S	.	*	H	α-helix	trans	-67.8	-33	174.1	26.2	0	0	0	0	111.8	V561 L569	V561-T565 PolarHBondContact O-N 3.18Å; V561-T565 PolarHBondContact O-OG1 3.33Å; T565-L569 WeakPolarHBondContact O-CD1 3.01Å; T565-L569 PolarHBondContact O-N 2.77Å
566	T	34.5	Very low	34.4	Very low	94 Å²	94	102.3 Å²	102.3	58%	0.577	58%	0.579	S	S	*	*	H	α-helix	trans	-73	-38.5	175	-43	0	0	0	0	111.7	R562 T563 F564 T570	R562-T566 PolarHBondContact O-N 3.14Å; R562-T566 PolarHBondContact O-OG1 2.67Å; T563-T566 PolarHBondContact O-N 3.18Å; F564-T566 VanDerWaalsContact C-N 3.3Å; F564-T566 PolarHBondContact O-N 2.87Å; T566-T570 PolarHBondContact O-N 2.8Å; T566-T570 PolarHBondContact O-OG1 2.82Å
567	I	36.4	Very low	33.9	Very low	94 Å²	94	102.3 Å²	102.3	48%	0.482	58%	0.578	S	S	.	*	H	α-helix	trans	-71.8	-36.6	175.7	-66.6	164.4	0	0	0	111.2	T563 F564 T570 A571	T563-I567 HydrophobicContact CG2-CD1 4.42Å; T563-I567 WeakPolarHBondContact O-CB 3.44Å; T563-I567 WeakPolarHBondContact O-CD1 3.39Å; T563-I567 WeakPolarHBondContact O-CG1 3.35Å; T563-I567 PolarHBondContact O-N 2.77Å; F564-I567 PolarHBondContact O-N 3.48Å; I567-T570 WeakPolarHBondContact CA-OG1 3.43Å; I567-T570 PolarHBondContact O-N 2.85Å; I567-T570 PolarHBondContact O-OG1 2.91Å; I567-T570 VanDerWaalsContact O-OG1 3.1Å; I567-A571 VanDerWaalsContact O-CB 3.31Å; I567-A571 WeakPolarHBondContact O-CB 3.22Å; I567-A571 PolarHBondContact O-N 2.88Å
568	A	32	Very low	33.5	Very low	43 Å²	43	106.9 Å²	106.9	36%	0.355	59%	0.591	S	S	.	*	H	α-helix	trans	-70.4	-38.5	177.2	0	0	0	0	0	112	F564 T570 A571 V572	F564-A568 WeakPolarHBondContact O-CB 3.36Å; F564-A568 PolarHBondContact O-N 2.9Å; A568-T570 VanDerWaalsContact C-N 3.32Å; A568-T570 PolarHBondContact O-N 3.09Å; A568-A571 PolarHBondContact O-N 2.84Å; A568-V572 VanDerWaalsContact O-CG2 3.28Å; A568-V572 WeakPolarHBondContact O-CG2 3.33Å; A568-V572 PolarHBondContact O-N 2.86Å
569	L	32.1	Very low	33	Very low	130 Å²	130	113.1 Å²	113.1	68%	0.681	61%	0.614	S	S	*	*	H	α-helix	trans	-68.3	-30	173.6	-104.2	88.6	0	0	0	113.1	T565 T573	T565-L569 WeakPolarHBondContact O-CD1 3.01Å; T565-L569 PolarHBondContact O-N 2.77Å; L569-T573 PolarHBondContact O-OG1 3.24Å
570	T	30.2	Very low	32.4	Very low	92 Å²	92	107.4 Å²	107.4	56%	0.564	61%	0.609	S	S	*	*	H	α-helix	trans	-79	-26.5	173.7	34.7	0	0	0	0	112.7	T566 I567 A568 T573	T566-T570 PolarHBondContact O-N 2.8Å; T566-T570 PolarHBondContact O-OG1 2.82Å; I567-T570 WeakPolarHBondContact CA-OG1 3.43Å; I567-T570 PolarHBondContact O-N 2.85Å; I567-T570 PolarHBondContact O-OG1 2.91Å; I567-T570 VanDerWaalsContact O-OG1 3.1Å; A568-T570 VanDerWaalsContact C-N 3.32Å; A568-T570 PolarHBondContact O-N 3.09Å; T570-T573 PolarHBondContact O-OG1 2.94Å
571	A	29.9	Very low	31.8	Very low	56 Å²	56	109.2 Å²	109.2	46%	0.463	62%	0.618	S	S	.	*	H	α-helix	trans	-78.6	-35.3	174.9	0	0	0	0	0	113.1	I567 A568 T573 A574 A575	I567-A571 VanDerWaalsContact O-CB 3.31Å; I567-A571 WeakPolarHBondContact O-CB 3.22Å; I567-A571 PolarHBondContact O-N 2.88Å; A568-A571 PolarHBondContact O-N 2.84Å; A571-T573 VanDerWaalsContact C-N 3.34Å; A571-T573 PolarHBondContact O-N 2.93Å; A571-A574 PolarHBondContact O-N 2.9Å; A571-A575 PolarHBondContact O-N 2.86Å
572	V	33	Very low	31.1	Very low	103 Å²	103	113.3 Å²	113.3	62%	0.624	64%	0.643	S	S	*	*	H	α-helix	trans	-71.6	-28.2	179.5	172.5	0	0	0	0	112.1	A568 A574	A568-V572 VanDerWaalsContact O-CG2 3.28Å; A568-V572 WeakPolarHBondContact O-CG2 3.33Å; A568-V572 PolarHBondContact O-N 2.86Å; V572-A574 VanDerWaalsContact C-N 3.35Å
573	T	32.1	Very low	30.7	Very low	110 Å²	110	108.2 Å²	108.2	68%	0.675	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-11.6	175.2	43.7	0	0	0	0	114.1	L569 T570 A571	L569-T573 PolarHBondContact O-OG1 3.24Å; T570-T573 PolarHBondContact O-OG1 2.94Å; A571-T573 VanDerWaalsContact C-N 3.34Å; A571-T573 PolarHBondContact O-N 2.93Å
574	A	30	Very low	29.9	Very low	76 Å²	76	114 Å²	114	63%	0.628	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-13.8	-178.9	0	0	0	0	0	114.5	A571 V572	A571-A574 PolarHBondContact O-N 2.9Å; V572-A574 VanDerWaalsContact C-N 3.35Å
575	A	30.6	Very low	29.3	Very low	84 Å²	84	115.1 Å²	115.1	69%	0.694	67%	0.673	S	S	*	*	S	Bend	trans	-101.9	2.7	-174.5	0	0	0	0	0	115.1	A571	A571-A575 PolarHBondContact O-N 2.86Å
576	E	27.4	Very low	28.5	Very low	176 Å²	176	121.4 Å²	121.4	82%	0.822	69%	0.688	S	S	*	*	S	Bend	trans	-90.5	10.7	177.4	-101.7	178.9	167.8	0	0	114.7
577	I	27.6	Very low	28.1	Very low	129 Å²	129	125.3 Å²	125.3	66%	0.662	70%	0.7	S	S	*	*	S	Bend	trans	-118.9	118.2	175.4	-56.7	178	0	0	0	108.6
578	Q	27	Very low	27.4	Very low	167 Å²	167	128.2 Å²	128.2	78%	0.78	72%	0.716	S	S	*	*	S	Bend	trans	74.3	90.1	173.3	-69.2	159.6	-75.5	0	0	117
579	Q	28.1	Very low	26.8	Very low	190 Å²	190	131.4 Å²	131.4	89%	0.888	74%	0.735	S	S	*	*				174.1	107.9	86.2	-105.9	169.4	-10.5	0	0	110.1
580	S	24.1	Very low	26.4	Very low	109 Å²	109	130 Å²	130	76%	0.762	74%	0.742	S	S	*	*			trans	-77.1	158.8	155.3	56.1	0	0	0	0	110.1
581	S	26.3	Very low	26.2	Very low	100 Å²	100	130.5 Å²	130.5	70%	0.699	76%	0.756	S	S	*	*			trans	101.9	103.5	161	79.8	0	0	0	0	118.3
582	T	27	Very low	25.8	Very low	136 Å²	136	136.8 Å²	136.8	83%	0.834	78%	0.775	S	S	*	*				77.1	100.7	128.6	56.3	0	0	0	0	119.4
583	G	24.1	Very low	26.3	Very low	75 Å²	75	137 Å²	137	77%	0.773	78%	0.778	S	S	*	*				79.9	97.9	97.7	0	0	0	0	0	116.5
584	F	23.5	Very low	25.9	Very low	199 Å²	199	139.3 Å²	139.3	87%	0.873	79%	0.787	S	S	*	*			trans	-137.5	86.3	158.7	-142.9	-97.3	0	0	0	109.6
585	E	21.5	Very low	25.5	Very low	173 Å²	173	139.9 Å²	139.9	81%	0.808	79%	0.786	S	S	*	*			trans	-75.9	148.3	156.4	-82.1	-169.6	147	0	0	109.6
586	R	22.1	Very low	25	Very low	214 Å²	214	146.8 Å²	146.8	81%	0.808	79%	0.794	S	S	*	*			trans	88.6	105.7	169.6	-57.3	-177.8	-175.3	-180	1.4	117.4
587	Q	24.8	Very low	24.7	Very low	176 Å²	176	145.9 Å²	145.9	82%	0.822	79%	0.793	S	S	*	*				-171.2	108.5	117.3	-98.2	171.5	9.9	0	0	107.9
588	L	21.4	Very low	24.5	Very low	155 Å²	155	145.5 Å²	145.5	81%	0.812	80%	0.797	S	S	*	*				52.3	109	109	-85.2	110.9	0	0	0	113.7
589	S	19.9	Very low	24.1	Very low	110 Å²	110	146.3 Å²	146.3	77%	0.769	80%	0.8	S	S	*	*				58.6	103.3	85	-179.9	0	0	0	0	113.4
590	A	23	Very low	23.8	Very low	100 Å²	100	144.7 Å²	144.7	83%	0.826	80%	0.796	S	S	*	*			trans	163.6	117.8	131.2	0	0	0	0	0	110.8
591	A	25.9	Very low	23.7	Very low	102 Å²	102	142.5 Å²	142.5	84%	0.843	79%	0.791	S	S	*	*			trans	173.9	89.2	138	0	0	0	0	0	110.8
592	H	22.2	Very low	23.8	Very low	188 Å²	188	143.8 Å²	143.8	87%	0.87	80%	0.797	S	S	*	*			trans	-72.4	178.8	141.6	-107.6	-1.7	0	0	0	108.7
593	P	42.8	Very low	23.6	Very low	107 Å²	107	146.5 Å²	146.5	70%	0.695	80%	0.803	S	S	*	*				-125.9	162.3	-50.9	34.3	-18.5	0	0	0	109.7
594	D	25.4	Very low	23.5	Very low	160 Å²	160	147.3 Å²	147.3	86%	0.856	80%	0.796	S	S	*	*			trans	-141.9	126.8	153.3	-124.4	-23	0	0	0	113.5
595	S	20.4	Very low	23.4	Very low	87 Å²	87	145.8 Å²	145.8	61%	0.608	79%	0.792	S	S	*	*			trans	-64	147.2	175.5	57.5	0	0	0	0	112.8
596	R	21.6	Very low	23.5	Very low	230 Å²	230	145 Å²	145	87%	0.868	79%	0.788	S	S	*	*				-179.9	115.3	119.2	-96.3	169	-162.3	-160.4	5.2	111.5
597	I	19.4	Very low	23.5	Very low	157 Å²	157	139.6 Å²	139.6	81%	0.805	78%	0.775	S	S	*	*			trans	-60.4	128.6	155.2	-66	162.3	0	0	0	107.6	Q599	I597-Q599 HydrophobicContact CG2-CG 4.4Å
598	V	23.3	Very low	23.6	Very low	121 Å²	121	138.9 Å²	138.9	73%	0.733	77%	0.77	S	S	*	*			trans	-117.2	102.6	159.8	176.5	0	0	0	0	106.9	I600	V598-I600 HydrophobicContact CG1-CD1 4.2Å; V598-I600 HydrophobicContact CG1-CG1 4.06Å
599	Q	18.6	Very low	23.9	Very low	183 Å²	183	137.6 Å²	137.6	86%	0.855	76%	0.763	S	S	*	*			trans	-91.3	124.7	156.8	-86	-173.6	-33.2	0	0	108.1	I597	I597-Q599 HydrophobicContact CG2-CG 4.4Å
600	I	23.2	Very low	24.9	Very low	156 Å²	156	140.7 Å²	140.7	80%	0.8	77%	0.771	S	S	*	*			trans	-140.1	117.5	155.9	-56.4	177.5	0	0	0	102	V598	V598-I600 HydrophobicContact CG1-CD1 4.2Å; V598-I600 HydrophobicContact CG1-CG1 4.06Å
601	G	20.6	Very low	25.2	Very low	63 Å²	63	144 Å²	144	65%	0.649	77%	0.767	S	S	*	*			cis	99.7	121.8	49.5	0	0	0	0	0	107.8
602	P	28.5	Very low	25.5	Very low	128 Å²	128	145.2 Å²	145.2	83%	0.831	76%	0.759	S	S	*	*			trans	-88.4	153.1	-160.9	35.5	-34.1	0	0	0	113.3
603	M	24.3	Very low	26	Very low	193 Å²	193	146.5 Å²	146.5	95%	0.951	76%	0.762	S	S	*	*			trans	-111.5	104.9	162.3	-77	-167.1	85.4	0	0	110.1
604	S	20.6	Very low	25.4	Very low	91 Å²	91	149.2 Å²	149.2	64%	0.636	77%	0.765	S	S	*	*			trans	-78.3	166.7	151.7	49.6	0	0	0	0	110.6
605	E	22.5	Very low	25.7	Very low	168 Å²	168	150.6 Å²	150.6	79%	0.785	77%	0.767	S	S	*	*			trans	76.9	111.9	162.4	-70.8	179.5	163.2	0	0	117.8
606	E	22.5	Very low	26.2	Very low	155 Å²	155	154.1 Å²	154.1	72%	0.724	77%	0.773	S	S	*	*				143	137.3	88.2	-119.7	-168.3	151.4	0	0	113.1
607	N	23.7	Very low	26.5	Very low	101 Å²	101	152.8 Å²	152.8	54%	0.54	77%	0.774	S	S	.	*			trans	76.4	113.5	140.4	-76.8	-30.8	0	0	0	122.7
608	K	25.4	Very low	26.8	Very low	162 Å²	162	156.3 Å²	156.3	70%	0.704	78%	0.777	S	S	*	*				93	121.9	114.7	-79.7	179.5	-178.8	174.6	0	120.1
609	D	27.5	Very low	27	Very low	127 Å²	127	157.7 Å²	157.7	68%	0.679	78%	0.779	S	S	*	*			trans	62.2	101.8	133.3	-60.1	-31.8	0	0	0	117.4
610	D	41	Very low	27.3	Very low	175 Å²	175	154.3 Å²	154.3	94%	0.936	77%	0.77	S	S	*	*				-145.9	133.5	121.2	-112.6	-27.1	0	0	0	112.6
611	K	29.2	Very low	27.5	Very low	169 Å²	169	153.9 Å²	153.9	74%	0.735	77%	0.768	S	S	*	*			trans	-90.4	159.6	-169.4	-87.7	177.9	172.3	176.4	0	112.1
612	D	32	Very low	27.8	Very low	128 Å²	128	157.5 Å²	157.5	68%	0.684	77%	0.772	S	S	*	*			trans	70.6	104.5	148.2	-61.3	-27.4	0	0	0	119.5
613	K	34	Very low	27.7	Very low	215 Å²	215	156.7 Å²	156.7	94%	0.935	77%	0.766	S	S	*	*				-159.2	99.4	118.2	-104.7	169.7	-170.6	-177.5	0	111
614	H	29.3	Very low	28	Very low	164 Å²	164	154.3 Å²	154.3	76%	0.759	76%	0.762	S	S	*	*			trans	-67.6	123.8	162.2	-83.3	-74.3	0	0	0	109.9
615	E	32.9	Very low	28.3	Very low	190 Å²	190	158.6 Å²	158.6	89%	0.888	77%	0.772	S	S	*	*			trans	-124.3	113.2	158.9	-143.9	170.8	-160.5	0	0	108.9	K617	E615-K617 PolarHBondContact O-N 3.13Å
616	H	30.1	Very low	28.5	Very low	160 Å²	160	160 Å²	160	74%	0.741	78%	0.776	S	S	*	*			trans	-68.4	120.8	-173.1	-77.5	24.4	0	0	0	111.2	R618	H616-R618 PolarHBondContact O-N 3.13Å
617	K	28.5	Very low	28.6	Very low	203 Å²	203	157 Å²	157	88%	0.883	78%	0.778	S	S	*	*			trans	-63.6	101.6	163.9	-71	178.8	178.3	177.6	0	109.3	E615 I619	E615-K617 PolarHBondContact O-N 3.13Å; K617-I619 PolarHBondContact O-N 3.23Å
618	R	25.6	Very low	28.7	Very low	231 Å²	231	157.6 Å²	157.6	87%	0.872	79%	0.785	S	S	*	*			trans	-79.4	112	164.6	-78.2	-173.5	-172.7	-174.7	3	109.1	H616 V620	H616-R618 PolarHBondContact O-N 3.13Å; R618-V620 PolarHBondContact O-N 3.48Å
619	I	27.6	Very low	28.8	Very low	150 Å²	150	156.7 Å²	156.7	77%	0.769	79%	0.786	S	S	*	*			trans	-75.7	108	165.2	-61.4	173.1	0	0	0	106.6	K617 I621	K617-I619 PolarHBondContact O-N 3.23Å; I619-I621 HydrophobicContact CG2-CG1 3.99Å
620	V	24.8	Very low	28.6	Very low	111 Å²	111	160.9 Å²	160.9	67%	0.673	79%	0.794	S	S	*	*			trans	-90.7	103.4	171.9	-179.1	0	0	0	0	107.4	R618 L622	R618-V620 PolarHBondContact O-N 3.48Å; V620-L622 HydrophobicContact CG1-CD2 4.01Å; V620-L622 HydrophobicContact CG1-CG 4.15Å; V620-L622 PolarHBondContact O-N 2.86Å
621	I	26.8	Very low	27.9	Very low	147 Å²	147	160.3 Å²	160.3	75%	0.754	79%	0.786	S	S	*	*			trans	-82.4	103.8	168.9	-57.7	176.3	0	0	0	106.4	I619	I619-I621 HydrophobicContact CG2-CG1 3.99Å
622	L	27.2	Very low	27.9	Very low	139 Å²	139	157.8 Å²	157.8	73%	0.728	79%	0.787	S	S	*	*			trans	-78.4	131.7	171	-68.3	171.4	0	0	0	109.1	V620	V620-L622 HydrophobicContact CG1-CD2 4.01Å; V620-L622 HydrophobicContact CG1-CG 4.15Å; V620-L622 PolarHBondContact O-N 2.86Å
623	P	26.4	Very low	27.9	Very low	111 Å²	111	161 Å²	161	72%	0.721	80%	0.798	S	S	*	*			trans	-71.1	129.9	-179.9	28.3	-32	0	0	0	110.6	E625	P623-E625 PolarHBondContact O-N 3.25Å
624	V	29.7	Very low	28.2	Very low	143 Å²	143	155.9 Å²	155.9	87%	0.867	78%	0.779	S	S	*	*			trans	-69.3	100.4	172.4	-178.8	0	0	0	0	107.8	K626	V624-K626 PolarHBondContact O-N 2.88Å
625	E	27.5	Very low	28.9	Very low	181 Å²	181	150.7 Å²	150.7	85%	0.846	76%	0.762	S	S	*	*			trans	-62.9	130	167.9	-82.5	-175.2	154.9	0	0	109.8	P623 A627	P623-E625 PolarHBondContact O-N 3.25Å; E625-A627 PolarHBondContact O-N 2.89Å
626	K	26.7	Very low	29.8	Very low	198 Å²	198	147.1 Å²	147.1	86%	0.861	76%	0.755	S	S	*	*			trans	-44.2	99.9	-178.7	-64	168.7	177.6	177.9	0	112.6	V624 V628	V624-K626 PolarHBondContact O-N 2.88Å; K626-V628 VanDerWaalsContact C-N 3.33Å; K626-V628 PolarHBondContact O-N 3.31Å; K626-V628 VanDerWaalsContact O-N 3.09Å
627	A	25.5	Very low	30.7	Very low	93 Å²	93	146.6 Å²	146.6	77%	0.769	75%	0.753	S	S	*	*			trans	-73.7	95	154.7	0	0	0	0	0	107.4	E625 I629	E625-A627 PolarHBondContact O-N 2.89Å; A627-I629 PolarHBondContact O-N 3.24Å; A627-I629 VanDerWaalsContact O-N 3.1Å
628	V	25.5	Very low	31.5	Very low	112 Å²	112	142.4 Å²	142.4	68%	0.679	74%	0.738	S	S	*	*			trans	-59.7	110.4	171.7	175.3	0	0	0	0	107.6	K626 Y630	K626-V628 VanDerWaalsContact C-N 3.33Å; K626-V628 PolarHBondContact O-N 3.31Å; K626-V628 VanDerWaalsContact O-N 3.09Å; V628-Y630 PolarHBondContact O-N 3.27Å
629	I	27.2	Very low	32.9	Very low	143 Å²	143	134.1 Å²	134.1	73%	0.733	71%	0.713	S	S	*	*			trans	-64.6	105	171.7	-60.5	171.5	0	0	0	106.6	A627 Q631	A627-I629 PolarHBondContact O-N 3.24Å; A627-I629 VanDerWaalsContact O-N 3.1Å; I629-Q631 VanDerWaalsContact C-N 3.32Å; I629-Q631 HydrophobicContact CG2-CG 4.22Å; I629-Q631 PolarHBondContact O-N 2.89Å
630	Y	22.5	Very low	34.6	Very low	215 Å²	215	134.8 Å²	134.8	84%	0.843	71%	0.71	S	S	*	*			trans	-66.2	95.5	164	-97.3	-91	0	0	0	107.6	V628	V628-Y630 PolarHBondContact O-N 3.27Å
631	Q	27.2	Very low	36.1	Very low	164 Å²	164	137.1 Å²	137.1	77%	0.766	71%	0.711	S	S	*	*			trans	-71.7	123.1	160.5	-75.7	-174.1	-18.5	0	0	107.3	I629 E633	I629-Q631 VanDerWaalsContact C-N 3.32Å; I629-Q631 HydrophobicContact CG2-CG 4.22Å; I629-Q631 PolarHBondContact O-N 2.89Å; Q631-E633 PolarHBondContact O-N 3.47Å
632	P	30	Very low	37.2	Very low	116 Å²	116	134.4 Å²	134.4	75%	0.753	70%	0.698	S	S	*	*			trans	-62.4	127.3	178.5	23.4	-30.8	0	0	0	109.7	I634	P632-I634 PolarHBondContact O-N 2.88Å
633	E	30.1	Very low	38.4	Very low	195 Å²	195	135.3 Å²	135.3	91%	0.911	70%	0.696	S	S	*	*			trans	-57.3	104.2	174.1	-71.5	-179.5	162.2	0	0	109.4	Q631 S635	Q631-E633 PolarHBondContact O-N 3.47Å; E633-S635 PolarHBondContact O-N 3.46Å
634	I	40.7	Very low	39.6	Very low	107 Å²	107	134.6 Å²	134.6	55%	0.549	69%	0.693	S	S	.	*			trans	-62.3	119.5	167.7	-60.2	174.3	0	0	0	106.3	P632 M638 V639	P632-I634 PolarHBondContact O-N 2.88Å; I634-M638 HydrophobicContact CG2-CB 3.88Å; I634-M638 HydrophobicContact CG2-CG 4.12Å; I634-M638 HydrophobicContact CG2-SD 4.06Å; I634-V639 HydrophobicContact CB-CG2 4.39Å; I634-V639 HydrophobicContact CG2-CG2 3.76Å
635	S	43.5	Very low	40.5	Very low	56 Å²	56	129.8 Å²	129.8	39%	0.392	67%	0.666	S	S	.	*			trans	-58.1	145.1	-175.9	90.2	0	0	0	0	110.7	E633 E637 M638 V639	E633-S635 PolarHBondContact O-N 3.46Å; S635-E637 PolarHBondContact O-N 3.42Å; S635-E637 PolarHBondContact OG-N 3.43Å; S635-M638 PolarHBondContact O-N 3.49Å; S635-M638 PolarHBondContact OG-N 3.18Å; S635-V639 PolarHBondContact O-N 2.82Å; S635-V639 VanDerWaalsContact O-N 3.15Å
636	P	51.8	Low	41.3	Very low	115 Å²	115	124.8 Å²	124.8	75%	0.747	66%	0.655	S	S	*	*	H	α-helix	trans	-53.5	-29.9	176.6	-26.4	33.5	0	0	0	113.2	K640	P636-K640 WeakPolarHBondContact O-CB 3.46Å; P636-K640 PolarHBondContact O-N 3.35Å
637	E	50.9	Low	42	Very low	149 Å²	149	120.9 Å²	120.9	70%	0.696	64%	0.644	S	S	*	*	H	α-helix	trans	-68.9	-37.9	175.3	-70.6	-163.8	153.3	0	0	113.1	S635 K640 K641	S635-E637 PolarHBondContact O-N 3.42Å; S635-E637 PolarHBondContact OG-N 3.43Å; E637-K640 PolarHBondContact O-N 2.79Å; E637-K641 PolarHBondContact O-N 2.92Å
638	M	43.8	Very low	42.8	Very low	114 Å²	114	121.7 Å²	121.7	56%	0.562	63%	0.628	S	S	*	*	H	α-helix	trans	-70.6	-37.5	177.9	-166.5	179.6	-88.5	0	0	110.8	I634 S635 K640 K641 L642	I634-M638 HydrophobicContact CG2-CB 3.88Å; I634-M638 HydrophobicContact CG2-CG 4.12Å; I634-M638 HydrophobicContact CG2-SD 4.06Å; S635-M638 PolarHBondContact O-N 3.49Å; S635-M638 PolarHBondContact OG-N 3.18Å; M638-K640 VanDerWaalsContact C-N 3.32Å; M638-K640 PolarHBondContact O-N 3.06Å; M638-K641 PolarHBondContact O-N 3.34Å; M638-L642 HydrophobicContact CG-CD1 4.46Å; M638-L642 WeakPolarHBondContact O-CB 3.19Å; M638-L642 WeakPolarHBondContact O-CG 3.43Å; M638-L642 PolarHBondContact O-N 2.85Å
639	V	55.9	Low	43.5	Very low	57 Å²	57	119.8 Å²	119.8	35%	0.345	62%	0.624	S	S	.	*	H	α-helix	trans	-62.6	-39.4	170.2	179.7	0	0	0	0	111.2	I634 S635 L642 K643	I634-V639 HydrophobicContact CB-CG2 4.39Å; I634-V639 HydrophobicContact CG2-CG2 3.76Å; S635-V639 PolarHBondContact O-N 2.82Å; S635-V639 VanDerWaalsContact O-N 3.15Å; V639-L642 PolarHBondContact O-N 3.29Å; V639-K643 HydrophobicContact CG1-CD 4.37Å; V639-K643 WeakPolarHBondContact O-CG 3.34Å; V639-K643 PolarHBondContact O-N 3.11Å
640	K	62.5	Low	44.1	Very low	165 Å²	165	119.9 Å²	119.9	72%	0.717	62%	0.621	S	S	*	*	H	α-helix	trans	-66.4	-40.6	177.9	-157.3	177.5	-176	-177.4	0	111.9	P636 E637 M638 K643 S644	P636-K640 WeakPolarHBondContact O-CB 3.46Å; P636-K640 PolarHBondContact O-N 3.35Å; E637-K640 PolarHBondContact O-N 2.79Å; M638-K640 VanDerWaalsContact C-N 3.32Å; M638-K640 PolarHBondContact O-N 3.06Å; K640-K643 PolarHBondContact O-N 3.46Å; K640-S644 PolarHBondContact O-N 2.76Å; K640-S644 PolarHBondContact O-OG 3.27Å
641	K	57.7	Low	44.7	Very low	160 Å²	160	119.2 Å²	119.2	70%	0.696	62%	0.617	S	S	*	*	H	α-helix	trans	-65.5	-39.3	173.8	-81.1	-176.3	175.4	178.7	0	112.9	E637 M638 S644	E637-K641 PolarHBondContact O-N 2.92Å; M638-K641 PolarHBondContact O-N 3.34Å; K641-S644 PolarHBondContact O-N 3.27Å; K641-S644 PolarHBondContact O-OG 3.41Å; K641-S644 VanDerWaalsContact O-OG 3.05Å
642	L	48.2	Very low	45.3	Very low	90 Å²	90	113.7 Å²	113.7	47%	0.471	60%	0.6	S	S	.	*	H	α-helix	trans	-68.5	-36.8	177	-75.5	165.5	0	0	0	112.1	M638 V639 S644 S645 Y648	M638-L642 HydrophobicContact CG-CD1 4.46Å; M638-L642 WeakPolarHBondContact O-CB 3.19Å; M638-L642 WeakPolarHBondContact O-CG 3.43Å; M638-L642 PolarHBondContact O-N 2.85Å; V639-L642 PolarHBondContact O-N 3.29Å; L642-S644 VanDerWaalsContact C-N 3.33Å; L642-S644 PolarHBondContact O-N 2.98Å; L642-S645 PolarHBondContact O-OG 3.01Å; L642-Y648 WeakPolarHBondContact O-CB 3.32Å
643	K	53.5	Low	45.4	Very low	158 Å²	158	111 Å²	111	69%	0.687	59%	0.593	S	S	*	*	H	α-helix	trans	-71.7	-23	176	-75.7	-175.9	177.8	-175.9	0	114	V639 K640	V639-K643 HydrophobicContact CG1-CD 4.37Å; V639-K643 WeakPolarHBondContact O-CG 3.34Å; V639-K643 PolarHBondContact O-N 3.11Å; K640-K643 PolarHBondContact O-N 3.46Å
644	S	52.2	Low	45.5	Very low	96 Å²	96	112.3 Å²	112.3	67%	0.671	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-7.8	-178.5	62.8	0	0	0	0	114.6	K640 K641 L642	K640-S644 PolarHBondContact O-N 2.76Å; K640-S644 PolarHBondContact O-OG 3.27Å; K641-S644 PolarHBondContact O-N 3.27Å; K641-S644 PolarHBondContact O-OG 3.41Å; K641-S644 VanDerWaalsContact O-OG 3.05Å; L642-S644 VanDerWaalsContact C-N 3.33Å; L642-S644 PolarHBondContact O-N 2.98Å
645	S	47.9	Very low	44.9	Very low	41 Å²	41	112.8 Å²	112.8	29%	0.287	60%	0.598	S	S	.	*			trans	-77.2	129.4	175.5	75.3	0	0	0	0	109.9	L642 D647 Y648	L642-S645 PolarHBondContact O-OG 3.01Å; S645-D647 PolarHBondContact O-N 3.29Å; S645-D647 VanDerWaalsContact O-N 3.11Å; S645-Y648 PolarHBondContact O-N 2.77Å; S645-Y648 PolarHBondContact OG-N 3.15Å
646	A	43	Very low	44.1	Very low	76 Å²	76	121.2 Å²	121.2	63%	0.628	62%	0.621	S	S	*	*	H	α-helix	trans	-54	-27.5	170.8	0	0	0	0	0	111.5	Y648 A649 Q650	A646-Y648 PolarHBondContact O-N 3.21Å; A646-A649 PolarHBondContact O-N 2.87Å; A646-Q650 PolarHBondContact O-N 3.26Å
647	D	41.3	Very low	43	Very low	117 Å²	117	125.6 Å²	125.6	63%	0.626	62%	0.624	S	S	*	*	H	α-helix	trans	-64	-36	174.9	-59.6	-29.3	0	0	0	112.9	S645 Q650 W651	S645-D647 PolarHBondContact O-N 3.29Å; S645-D647 VanDerWaalsContact O-N 3.11Å; D647-Q650 PolarHBondContact O-N 3.3Å; D647-W651 VanDerWaalsContact O-CB 3.3Å; D647-W651 WeakPolarHBondContact O-CB 3.17Å; D647-W651 PolarHBondContact O-N 2.8Å
648	Y	43	Very low	41.9	Very low	110 Å²	110	124.5 Å²	124.5	43%	0.431	63%	0.627	S	S	.	*	H	α-helix	trans	-71.9	-34.8	176.3	-168.2	-94.2	0	0	0	111.8	L642 S645 A646 W651 A652	L642-Y648 WeakPolarHBondContact O-CB 3.32Å; S645-Y648 PolarHBondContact O-N 2.77Å; S645-Y648 PolarHBondContact OG-N 3.15Å; A646-Y648 PolarHBondContact O-N 3.21Å; Y648-W651 PolarHBondContact O-N 2.75Å; Y648-A652 HydrophobicContact CD1-CB 4.37Å; Y648-A652 HydrophobicContact CE1-CB 4.12Å; Y648-A652 VanDerWaalsContact O-CB 3.23Å; Y648-A652 WeakPolarHBondContact O-CB 3.34Å; Y648-A652 PolarHBondContact O-N 2.97Å
649	A	40.1	Very low	41.1	Very low	72 Å²	72	123.6 Å²	123.6	60%	0.595	63%	0.63	S	S	*	*	H	α-helix	trans	-66.7	-38	174.3	0	0	0	0	0	112	A646 G653	A646-A649 PolarHBondContact O-N 2.87Å; A649-G653 PolarHBondContact O-N 3.3Å
650	Q	40.5	Very low	39.6	Very low	145 Å²	145	128.3 Å²	128.3	68%	0.678	65%	0.653	S	S	*	*	H	α-helix	trans	-69	-35.1	172.4	-81.8	-169.4	-6	0	0	112.9	A646 D647	A646-Q650 PolarHBondContact O-N 3.26Å; D647-Q650 PolarHBondContact O-N 3.3Å
651	W	35.3	Very low	38	Very low	200 Å²	200	125.7 Å²	125.7	76%	0.758	66%	0.656	S	S	*	*	H	α-helix	trans	-77.3	-44.9	-178.7	-157.3	80.5	0	0	0	112.6	D647 Y648 G653 R654	D647-W651 VanDerWaalsContact O-CB 3.3Å; D647-W651 WeakPolarHBondContact O-CB 3.17Å; D647-W651 PolarHBondContact O-N 2.8Å; Y648-W651 PolarHBondContact O-N 2.75Å; W651-G653 VanDerWaalsContact C-N 3.26Å; W651-G653 PolarHBondContact O-N 3.45Å; W651-R654 PolarHBondContact O-N 2.96Å
652	A	39.8	Very low	36.5	Very low	49 Å²	49	126.8 Å²	126.8	41%	0.405	66%	0.66	S	S	.	*	H	α-helix	trans	-67.3	-24.6	177.1	0	0	0	0	0	113.1	Y648 R654	Y648-A652 HydrophobicContact CD1-CB 4.37Å; Y648-A652 HydrophobicContact CE1-CB 4.12Å; Y648-A652 VanDerWaalsContact O-CB 3.23Å; Y648-A652 WeakPolarHBondContact O-CB 3.34Å; Y648-A652 PolarHBondContact O-N 2.97Å; A652-R654 VanDerWaalsContact C-N 3.29Å; A652-R654 PolarHBondContact O-N 3.05Å
653	G	31.4	Very low	35.5	Very low	59 Å²	59	127.3 Å²	127.3	61%	0.608	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-13	177.2	0	0	0	0	0	115.3	A649 W651	A649-G653 PolarHBondContact O-N 3.3Å; W651-G653 VanDerWaalsContact C-N 3.26Å; W651-G653 PolarHBondContact O-N 3.45Å
654	R	31.7	Very low	34.3	Very low	223 Å²	223	126.3 Å²	126.3	84%	0.842	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	-0.9	-173.8	-78.2	-169.8	-176	-179	3.6	116.1	W651 A652	W651-R654 PolarHBondContact O-N 2.96Å; A652-R654 VanDerWaalsContact C-N 3.29Å; A652-R654 PolarHBondContact O-N 3.05Å
655	T	28.4	Very low	33.1	Very low	116 Å²	116	130.4 Å²	130.4	71%	0.712	68%	0.682	S	S	*	*			trans	-102.4	70.5	170.4	52.1	0	0	0	0	111	Y657	T655-Y657 VanDerWaalsContact C-N 3.31Å; T655-Y657 PolarHBondContact O-N 3.35Å; T655-Y657 VanDerWaalsContact O-N 3.11Å
656	R	27.5	Very low	32.2	Very low	234 Å²	234	133.5 Å²	133.5	88%	0.883	71%	0.71	S	S	*	*			trans	-72.7	95.4	154.2	-93.9	-172.4	-168.1	173.5	4.8	107.4	V658	R656-V658 PolarHBondContact O-N 2.95Å; R656-V658 VanDerWaalsContact O-N 3.13Å
657	Y	28.6	Very low	31.6	Very low	207 Å²	207	138.1 Å²	138.1	81%	0.812	72%	0.719	S	S	*	*			trans	-65.4	104.9	163.4	-164.2	-97.8	0	0	0	107.3	T655 P659	T655-Y657 VanDerWaalsContact C-N 3.31Å; T655-Y657 PolarHBondContact O-N 3.35Å; T655-Y657 VanDerWaalsContact O-N 3.11Å; Y657-P659 HydrophobicContact CD1-CG 4.43Å; Y657-P659 VanDerWaalsContact O-CD 3.28Å; Y657-P659 WeakPolarHBondContact O-CD 3.33Å
658	V	27.1	Very low	30.9	Very low	125 Å²	125	140.1 Å²	140.1	76%	0.758	72%	0.724	S	S	*	*			trans	-82.9	106.8	170.6	-179.7	0	0	0	0	106.1	R656 N660	R656-V658 PolarHBondContact O-N 2.95Å; R656-V658 VanDerWaalsContact O-N 3.13Å; V658-N660 PolarHBondContact O-N 2.91Å
659	P	28.3	Very low	30.2	Very low	96 Å²	96	140.6 Å²	140.6	62%	0.623	74%	0.739	S	S	*	*			trans	-73.3	116.7	-179.1	-2.8	20.3	0	0	0	108.3	Y657 S661	Y657-P659 HydrophobicContact CD1-CG 4.43Å; Y657-P659 VanDerWaalsContact O-CD 3.28Å; Y657-P659 WeakPolarHBondContact O-CD 3.33Å; P659-S661 PolarHBondContact O-N 3.09Å
660	N	24.4	Very low	29.4	Very low	156 Å²	156	144.7 Å²	144.7	83%	0.834	75%	0.751	S	S	*	*			trans	-91.8	87.1	171.1	-163.6	20.7	0	0	0	107.8	V658	V658-N660 PolarHBondContact O-N 2.91Å
661	S	28.6	Very low	29	Very low	109 Å²	109	146.6 Å²	146.6	76%	0.762	76%	0.76	S	S	*	*			trans	-119.8	99	168.1	59.2	0	0	0	0	109.5	P659	P659-S661 PolarHBondContact O-N 3.09Å
662	K	24.9	Very low	28.7	Very low	184 Å²	184	145 Å²	145	80%	0.8	77%	0.766	S	S	*	*			trans	-77.1	153	155.8	-83.9	-178.8	172.9	179.8	0	109.4
663	S	28.2	Very low	28.1	Very low	101 Å²	101	152.3 Å²	152.3	71%	0.706	79%	0.789	S	S	*	*			trans	77.2	102.5	161.9	63.4	0	0	0	0	119.4
664	N	28.3	Very low	27.9	Very low	137 Å²	137	157.7 Å²	157.7	73%	0.733	80%	0.798	S	S	*	*				105.6	108.1	126.2	-64.6	5.7	0	0	0	118.1
665	E	26.3	Very low	27.7	Very low	182 Å²	182	155.3 Å²	155.3	85%	0.85	80%	0.799	S	S	*	*			trans	54.6	102.4	131.5	-63.4	176	171.4	0	0	117.7
666	A	30.3	Very low	27.8	Very low	105 Å²	105	155.9 Å²	155.9	87%	0.868	80%	0.804	S	S	*	*				175.1	146.8	105.6	0	0	0	0	0	110.5
667	E	28.9	Very low	27.9	Very low	173 Å²	173	155.6 Å²	155.6	81%	0.808	80%	0.803	S	S	*	*			trans	-59.1	150.1	-179.1	-92.7	159.9	144.5	0	0	116.3
668	E	27.7	Very low	28.1	Very low	159 Å²	159	151.8 Å²	151.8	74%	0.743	80%	0.804	S	S	*	*			trans	76.7	126.2	134.6	-82.4	-176.9	159.4	0	0	124.1
669	T	27.6	Very low	28.2	Very low	121 Å²	121	157.7 Å²	157.7	74%	0.742	81%	0.813	S	S	*	*			trans	86.2	103.8	139.7	55.5	0	0	0	0	120.5
670	D	24.2	Very low	28.2	Very low	158 Å²	158	163 Å²	163	85%	0.845	83%	0.826	S	S	*	*				1.7	122.4	129.8	-61.6	-34.9	0	0	0	116.7
671	E	31.9	Very low	28.6	Very low	184 Å²	184	165.2 Å²	165.2	86%	0.86	83%	0.831	S	S	*	*			trans	-163.1	129.3	134.7	-110	179.3	-160.1	0	0	111.1
672	D	28.4	Very low	28.7	Very low	166 Å²	166	169.7 Å²	169.7	89%	0.888	84%	0.837	S	S	*	*			trans	-60	124.7	179	-65.6	-59.5	0	0	0	112.4
673	F	28	Very low	29	Very low	203 Å²	203	168.1 Å²	168.1	89%	0.89	84%	0.837	S	S	*	*			trans	-111	101.8	166.8	-112.4	-89.4	0	0	0	111
674	E	27.3	Very low	29	Very low	173 Å²	173	172.1 Å²	172.1	81%	0.808	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-66.7	128	176.7	-158.3	179	-179.7	0	0	111.4
675	M	27.1	Very low	29	Very low	172 Å²	172	171.1 Å²	171.1	85%	0.847	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-75.5	134.3	-179.2	-77.5	-170.6	-81.6	0	0	112.7
676	P	31.1	Very low	29	Very low	128 Å²	128	171.5 Å²	171.5	83%	0.831	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-72.7	137.1	179.7	-13.6	27.6	0	0	0	113.7
677	R	28.7	Very low	29	Very low	228 Å²	228	172.6 Å²	172.6	86%	0.86	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-68.2	143.1	177.4	-62.5	179.5	-164.4	178.3	5	112.8
678	P	32.2	Very low	29	Very low	127 Å²	127	173.9 Å²	173.9	83%	0.825	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-75.4	139.6	178.8	-6.2	21.8	0	0	0	113.1
679	R	29.5	Very low	28.9	Very low	249 Å²	249	175.9 Å²	175.9	94%	0.94	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-73.1	132.5	173.5	-80.5	179.6	173.9	172.4	-1.3	111.4
680	K	28	Very low	29	Very low	209 Å²	209	176.7 Å²	176.7	91%	0.909	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-59	128.5	171.9	-68.1	176	174.1	-178.8	0	111.4
681	Q	32.9	Very low	29.3	Very low	201 Å²	201	176.6 Å²	176.6	94%	0.939	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-102.3	136.7	165.8	-133	170.5	3.6	0	0	109.2
682	K	31.2	Very low	29	Very low	204 Å²	204	172.1 Å²	172.1	89%	0.887	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-75.9	154.2	-167.7	-87.3	174.7	168.2	178.2	0	113.8
683	D	31.3	Very low	29.1	Very low	150 Å²	150	170 Å²	170	80%	0.802	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-50.3	160.1	172.9	-57.1	-69	0	0	0	118.2
684	Q	27.7	Very low	28.9	Very low	186 Å²	186	167.8 Å²	167.8	87%	0.869	85%	0.847	S	S	*	*			trans	103.6	144.4	149.7	-65.1	-169.7	-8.8	0	0	119
685	P	29.8	Very low	29.1	Very low	116 Å²	116	166.7 Å²	166.7	75%	0.753	85%	0.846	S	S	*	*			cis	-135.1	163.8	-39.5	35.4	-18.3	0	0	0	113.9
686	E	24.5	Very low	29.2	Very low	189 Å²	189	165.1 Å²	165.1	88%	0.883	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-56.7	142.7	177	-65.8	174.8	130.2	0	0	115.1
687	P	30.4	Very low	29.2	Very low	128 Å²	128	168.6 Å²	168.6	83%	0.831	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-92	135.8	152.9	29.1	-18.8	0	0	0	111.4
688	K	29.4	Very low	29.3	Very low	200 Å²	200	165.4 Å²	165.4	87%	0.87	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-61	145.7	-174.2	-70.9	172.2	173.6	176.9	0	114.3
689	K	25.5	Very low	29.1	Very low	201 Å²	201	165.7 Å²	165.7	87%	0.874	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-57	135.2	160.7	-67.7	173.2	176	176.5	0	111.3
690	T	30.2	Very low	29.5	Very low	139 Å²	139	161.9 Å²	161.9	85%	0.853	84%	0.839	S	S	*	*			trans	-136.2	143.7	152.6	22.7	0	0	0	0	109.4
691	D	31.4	Very low	30	Very low	156 Å²	156	160.7 Å²	160.7	83%	0.834	84%	0.837	S	S	*	*			trans	-69.9	160.3	-160.8	-58.8	-66.9	0	0	0	116.3
692	A	24	Very low	30.1	Very low	90 Å²	90	161 Å²	161	74%	0.744	84%	0.835	S	S	*	*			trans	-37.3	160.3	160.4	0	0	0	0	0	114.3
693	P	30.4	Very low	30	Very low	120 Å²	120	159.5 Å²	159.5	78%	0.779	83%	0.831	S	S	*	*			cis	-144.8	167.2	40.3	37.4	-15.4	0	0	0	118.6	N695	P693-N695 PolarHBondContact O-N 2.61Å
694	N	25.5	Very low	30.5	Very low	158 Å²	158	163.8 Å²	163.8	85%	0.845	85%	0.854	S	S	*	*			trans	-28.1	121	161.6	-71.6	-25.5	0	0	0	114.1
695	N	30.4	Very low	30.6	Very low	149 Å²	149	162.7 Å²	162.7	80%	0.797	85%	0.853	S	S	*	*			trans	-152.8	115.3	143.4	-99.9	-25.3	0	0	0	110	P693 K697	P693-N695 PolarHBondContact O-N 2.61Å; N695-K697 PolarHBondContact O-N 2.84Å
696	V	29	Very low	30.6	Very low	140 Å²	140	165.1 Å²	165.1	85%	0.848	86%	0.859	S	S	*	*			trans	-3.1	111.8	153.3	-174.4	0	0	0	0	113.9
697	K	31.1	Very low	31	Very low	200 Å²	200	163.8 Å²	163.8	87%	0.87	86%	0.857	S	S	*	*			trans	-110.8	116.6	165.9	-86.1	-172	177.7	-179.6	0	110.6	N695	N695-K697 PolarHBondContact O-N 2.84Å
698	E	30.6	Very low	31	Very low	161 Å²	161	165.9 Å²	165.9	75%	0.752	86%	0.859	S	S	*	*			trans	-40.8	132.7	170.6	-66.6	160	142	0	0	113.7	H700	E698-H700 PolarHBondContact O-N 3Å; E698-H700 VanDerWaalsContact O-N 3.11Å
699	C	28.9	Very low	31.1	Very low	133 Å²	133	163.8 Å²	163.8	90%	0.899	86%	0.858	S	S	*	*			trans	-66.8	101.2	162	-92.5	0	0	0	0	109.1	Q701	C699-Q701 PolarHBondContact O-N 2.67Å; C699-Q701 VanDerWaalsContact O-N 3.17Å
700	H	37.1	Very low	31.5	Very low	169 Å²	169	161.3 Å²	161.3	78%	0.782	86%	0.857	S	S	*	*			trans	-67.7	108.8	163.7	-89.5	-66	0	0	0	110.1	E698 K702	E698-H700 PolarHBondContact O-N 3Å; E698-H700 VanDerWaalsContact O-N 3.11Å; H700-K702 PolarHBondContact O-N 3.15Å
701	Q	38.5	Very low	31.6	Very low	185 Å²	185	162.9 Å²	162.9	86%	0.864	86%	0.857	S	S	*	*			trans	-70.3	110.4	165	-157.2	170.8	7.7	0	0	108.1	C699 Q703	C699-Q701 PolarHBondContact O-N 2.67Å; C699-Q701 VanDerWaalsContact O-N 3.17Å; Q701-Q703 PolarHBondContact O-N 3.48Å
702	K	34.6	Very low	31.6	Very low	206 Å²	206	163.4 Å²	163.4	90%	0.896	86%	0.859	S	S	*	*			trans	-84.3	101.8	165.9	-85.4	-175.1	175	-179.2	0	108.1	H700	H700-K702 PolarHBondContact O-N 3.15Å
703	Q	29.2	Very low	32.2	Very low	173 Å²	173	169.5 Å²	169.5	81%	0.808	87%	0.869	S	S	*	*			trans	-63.5	132.4	157.3	-81.5	174.6	-36	0	0	109.3	Q701	Q701-Q703 PolarHBondContact O-N 3.48Å
704	N	41.5	Very low	32.4	Very low	240 Å²	240	174 Å²	174	100%	1.283	88%	0.877	S	S	*	*			trans	-133.4	0	132.3	-95	-9.5	0	0	0	106.8

Retrieved 704 of 704 residues in 875.7 ms (Link to these results)

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