A0A096NJJ6_PAPAN Loading...

Serpin family A member 12

AlphaFold DB , UniProt , Accession A0A096NJJ6, Species PAPAN (Papio anubis, Olive baboon), Gene SERPINA12, Length 414 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	43.2	Very low	42.8	Very low	244 Å²	244	130.7 Å²	130.7	100%	1.202	74%	0.736	S	S	*	*				0	109.5	0	-93.5	154.9	61.7	0	0	107.5
2	N	35.8	Very low	42.8	Very low	138 Å²	138	125 Å²	125	74%	0.738	72%	0.717	S	S	*	*			trans	-80.1	141.4	-161	-85.8	-25.3	0	0	0	113.4	T4	N2-T4 PolarHBondContact O-N 2.83Å; N2-T4 VanDerWaalsContact O-N 3.13Å
3	P	43.1	Very low	42.4	Very low	125 Å²	125	123 Å²	123	81%	0.812	71%	0.708	S	S	*	*	S	Bend	trans	-87.4	46	179	38	-35.6	0	0	0	112
4	T	48.2	Very low	42	Very low	103 Å²	103	123.3 Å²	123.3	63%	0.632	71%	0.705	S	S	*	*			trans	-111.4	1.9	-175.9	49	0	0	0	0	114.6	N2	N2-T4 PolarHBondContact O-N 2.83Å; N2-T4 VanDerWaalsContact O-N 3.13Å
5	L	45.5	Very low	41.9	Very low	152 Å²	152	123.9 Å²	123.9	80%	0.796	70%	0.704	S	S	*	*	S	Bend	trans	-96.3	-12	-179.3	-127.9	79.4	0	0	0	115
6	G	42.8	Very low	41.7	Very low	64 Å²	64	123.1 Å²	123.1	66%	0.66	70%	0.703	S	S	*	*	S	Bend	trans	-86.9	-18	-178.5	0	0	0	0	0	115.4
7	L	41.7	Very low	41.5	Very low	135 Å²	135	123.4 Å²	123.4	71%	0.707	71%	0.707	S	S	*	*	S	Bend	trans	-89.7	-17.5	-175.2	-131.7	89.4	0	0	0	113.8
8	A	43.7	Very low	41.3	Very low	68 Å²	68	127.7 Å²	127.7	56%	0.562	72%	0.716	S	S	*	*	H	α-helix	trans	-80.6	-25.1	-176	0	0	0	0	0	113.6
9	I	44.9	Very low	41.1	Very low	129 Å²	129	123.8 Å²	123.8	66%	0.662	71%	0.707	S	S	*	*	H	α-helix	trans	-85.8	-25	-177.2	-59.9	177.1	0	0	0	111.7
10	F	41.4	Very low	40.9	Very low	169 Å²	169	126 Å²	126	74%	0.741	72%	0.716	S	S	*	*	H	α-helix	trans	-77.6	-24.5	176.5	-129.5	-91.2	0	0	0	113.5
11	L	41.1	Very low	40.8	Very low	111 Å²	111	128 Å²	128	58%	0.581	72%	0.724	S	S	*	*	H	α-helix	trans	-82.1	-22.3	178	-103.4	140.1	0	0	0	113.6
12	A	42.8	Very low	40.1	Very low	62 Å²	62	125.8 Å²	125.8	51%	0.512	71%	0.708	S	S	.	*	H	α-helix	trans	-79.9	-26.1	178.4	0	0	0	0	0	113.6
13	V	37.3	Very low	40	Very low	99 Å²	99	124 Å²	124	60%	0.6	70%	0.704	S	S	*	*	H	α-helix	trans	-82.9	-23	177.6	-179.1	0	0	0	0	112.1	L15	V13-L15 VanDerWaalsContact C-N 3.34Å
14	L	37	Very low	39.4	Very low	127 Å²	127	123.8 Å²	123.8	67%	0.665	71%	0.705	S	S	*	*	S	Bend	trans	-80.7	-10.9	176.4	-108.4	140.4	0	0	0	114.1
15	L	39.8	Very low	38.8	Very low	133 Å²	133	125.8 Å²	125.8	70%	0.696	71%	0.705	S	S	*	*	S	Bend	trans	-99.4	-6.8	179.8	-87	162	0	0	0	114.9	V13	V13-L15 VanDerWaalsContact C-N 3.34Å
16	T	39.7	Very low	38.3	Very low	110 Å²	110	121 Å²	121	68%	0.675	68%	0.684	S	S	*	*	S	Bend	trans	-105.4	-7.5	179.3	48.3	0	0	0	0	115
17	V	38.2	Very low	38	Very low	129 Å²	129	123.5 Å²	123.5	78%	0.782	69%	0.689	S	S	*	*	S	Bend	trans	-94.7	-6.4	174.6	-174.4	0	0	0	0	112.8	G19	V17-G19 VanDerWaalsContact C-N 3.3Å; V17-G19 PolarHBondContact O-N 2.8Å
18	K	36.7	Very low	37.6	Very low	201 Å²	201	127.3 Å²	127.3	87%	0.874	69%	0.694	S	S	*	*	S	Bend	trans	-90.6	13.3	178.2	-126.2	174.6	-171.4	175.6	0	114.5
19	G	37.6	Very low	37.1	Very low	53 Å²	53	127.5 Å²	127.5	55%	0.546	69%	0.685	S	S	.	*	S	Bend	trans	-136.3	57.7	-171.3	0	0	0	0	0	113.8	V17	V17-G19 VanDerWaalsContact C-N 3.3Å; V17-G19 PolarHBondContact O-N 2.8Å
20	L	38.7	Very low	36.5	Very low	167 Å²	167	130 Å²	130	87%	0.874	69%	0.688	S	S	*	*	S	Bend	trans	-169.7	136.3	151.6	-103.8	138.5	0	0	0	109.7
21	L	37.1	Very low	36.3	Very low	168 Å²	168	128.8 Å²	128.8	88%	0.88	68%	0.682	S	S	*	*			trans	79.8	51.7	-175.4	-57.1	163.2	0	0	0	116.8
22	K	30.4	Very low	36.1	Very low	199 Å²	199	125.9 Å²	125.9	87%	0.865	67%	0.674	S	S	*	*			trans	-87.8	117.8	137.7	-82.9	-174.9	178.7	179.3	0	107.6	S24	K22-S24 PolarHBondContact O-N 3.17Å; K22-S24 VanDerWaalsContact O-N 3.15Å
23	P	33	Very low	35.7	Very low	101 Å²	101	128 Å²	128	66%	0.656	68%	0.677	S	S	*	*			trans	-64.4	117.7	159.9	20.2	-15.6	0	0	0	106.4	F25	P23-F25 HydrophobicContact CB-CD2 3.95Å; P23-F25 HydrophobicContact CB-CE2 4.05Å; P23-F25 HydrophobicContact CG-CD2 4.46Å; P23-F25 PolarHBondContact O-N 3.02Å
24	S	29.5	Very low	36.3	Very low	119 Å²	119	126.8 Å²	126.8	83%	0.832	67%	0.672	S	S	*	*			trans	-69.1	71.1	176.8	47.9	0	0	0	0	110.4	K22 S26	K22-S24 PolarHBondContact O-N 3.17Å; K22-S24 VanDerWaalsContact O-N 3.15Å; S24-S26 PolarHBondContact O-N 3.18Å
25	F	37.2	Very low	37.1	Very low	146 Å²	146	126.7 Å²	126.7	64%	0.64	67%	0.668	S	S	*	*			trans	-78.4	105.3	164	-82.1	-81.9	0	0	0	108.7	P23 N29	P23-F25 HydrophobicContact CB-CD2 3.95Å; P23-F25 HydrophobicContact CB-CE2 4.05Å; P23-F25 HydrophobicContact CG-CD2 4.46Å; P23-F25 PolarHBondContact O-N 3.02Å; F25-N29 HydrophobicContact CD1-CB 4.47Å
26	S	33.4	Very low	37.9	Very low	50 Å²	50	122.6 Å²	122.6	35%	0.35	65%	0.654	S	S	.	*			trans	-57	146.6	176.9	69.9	0	0	0	0	111.8	S24 R28 N29	S24-S26 PolarHBondContact O-N 3.18Å; S26-R28 PolarHBondContact O-N 2.99Å; S26-N29 PolarHBondContact O-N 3.13Å
27	P	36.8	Very low	38.8	Very low	117 Å²	117	122.3 Å²	122.3	76%	0.76	65%	0.645	S	S	*	*	H	α-helix	trans	-59.4	-18.4	174.5	-22.5	31.9	0	0	0	114.1	N29 K31	P27-N29 VanDerWaalsContact C-N 3.34Å; P27-K31 PolarHBondContact O-N 3.07Å
28	R	33.2	Very low	40.1	Very low	215 Å²	215	116.9 Å²	116.9	81%	0.811	62%	0.615	S	S	*	*	H	α-helix	trans	-65.5	-35.9	170.9	-90.8	-175.3	-171.3	177.6	3.3	112.2	S26 K31 A32	S26-R28 PolarHBondContact O-N 2.99Å; R28-K31 PolarHBondContact O-N 3.09Å; R28-A32 VanDerWaalsContact O-CB 3.26Å; R28-A32 WeakPolarHBondContact O-CB 3.48Å; R28-A32 PolarHBondContact O-N 3.32Å
29	N	33.1	Very low	41.5	Very low	72 Å²	72	115 Å²	115	39%	0.385	60%	0.603	S	S	.	*	H	α-helix	trans	-72.6	-34.1	-177.7	-71.1	-9.5	0	0	0	112.1	F25 S26 P27 A32 L33	F25-N29 HydrophobicContact CD1-CB 4.47Å; S26-N29 PolarHBondContact O-N 3.13Å; P27-N29 VanDerWaalsContact C-N 3.34Å; N29-A32 PolarHBondContact O-N 3.2Å; N29-L33 WeakPolarHBondContact O-CB 3.27Å; N29-L33 WeakPolarHBondContact O-CD1 3.22Å; N29-L33 VanDerWaalsContact O-CG 3.32Å; N29-L33 WeakPolarHBondContact O-CG 3.17Å; N29-L33 PolarHBondContact O-N 3.29Å
30	Y	33.5	Very low	43.2	Very low	183 Å²	183	119 Å²	119	72%	0.718	61%	0.605	S	S	*	*	H	α-helix	trans	-66.6	-40	173.5	-112.6	-91.9	0	0	0	112.4	S34	Y30-S34 VanDerWaalsContact O-CB 3.28Å; Y30-S34 WeakPolarHBondContact O-CB 3.24Å; Y30-S34 PolarHBondContact O-N 3.17Å; Y30-S34 PolarHBondContact O-OG 3.45Å; Y30-S34 VanDerWaalsContact O-OG 3.07Å
31	K	37	Very low	44.9	Very low	142 Å²	142	112.8 Å²	112.8	62%	0.617	57%	0.571	S	S	*	*	H	α-helix	trans	-71.3	-36.4	176.7	-148.8	173.8	-173	177.6	0	111.7	P27 R28 S34 Q35	P27-K31 PolarHBondContact O-N 3.07Å; R28-K31 PolarHBondContact O-N 3.09Å; K31-S34 PolarHBondContact O-OG 3Å; K31-Q35 WeakPolarHBondContact O-CB 3.43Å; K31-Q35 WeakPolarHBondContact O-CG 3.49Å; K31-Q35 PolarHBondContact O-N 3.11Å
32	A	35.9	Very low	46.8	Very low	51 Å²	51	111.8 Å²	111.8	42%	0.421	56%	0.556	S	S	.	*	H	α-helix	trans	-72.3	-39	175.1	0	0	0	0	0	112.6	R28 N29 A36	R28-A32 VanDerWaalsContact O-CB 3.26Å; R28-A32 WeakPolarHBondContact O-CB 3.48Å; R28-A32 PolarHBondContact O-N 3.32Å; N29-A32 PolarHBondContact O-N 3.2Å; A32-A36 WeakPolarHBondContact O-CB 3.27Å; A32-A36 PolarHBondContact O-N 3.08Å
33	L	35.1	Very low	49.3	Very low	107 Å²	107	108.9 Å²	108.9	56%	0.56	54%	0.543	S	S	*	.	H	α-helix	trans	-68.4	-42.1	174.3	-81.9	156.8	0	0	0	111.5	N29 A36 Q37	N29-L33 WeakPolarHBondContact O-CB 3.27Å; N29-L33 WeakPolarHBondContact O-CD1 3.22Å; N29-L33 VanDerWaalsContact O-CG 3.32Å; N29-L33 WeakPolarHBondContact O-CG 3.17Å; N29-L33 PolarHBondContact O-N 3.29Å; L33-A36 PolarHBondContact O-N 2.93Å; L33-Q37 WeakPolarHBondContact O-CB 3.15Å; L33-Q37 PolarHBondContact O-N 3.11Å
34	S	50.5	Low	51.7	Low	72 Å²	72	104.6 Å²	104.6	50%	0.503	52%	0.516	S	S	.	.	H	α-helix	trans	-69.7	-34.6	175.3	71.2	0	0	0	0	112.8	Y30 K31 G38	Y30-S34 VanDerWaalsContact O-CB 3.28Å; Y30-S34 WeakPolarHBondContact O-CB 3.24Å; Y30-S34 PolarHBondContact O-N 3.17Å; Y30-S34 PolarHBondContact O-OG 3.45Å; Y30-S34 VanDerWaalsContact O-OG 3.07Å; K31-S34 PolarHBondContact O-OG 3Å; S34-G38 PolarHBondContact O-N 2.95Å
35	Q	52.7	Low	54.4	Low	125 Å²	125	99 Å²	99	58%	0.584	48%	0.478	S	S	*	.	H	α-helix	trans	-70.1	-39.2	171.7	-76.6	174.3	-4.9	0	0	112.4	K31 W39	K31-Q35 WeakPolarHBondContact O-CB 3.43Å; K31-Q35 WeakPolarHBondContact O-CG 3.49Å; K31-Q35 PolarHBondContact O-N 3.11Å; Q35-W39 VanDerWaalsContact O-CB 3.23Å; Q35-W39 WeakPolarHBondContact O-CB 3.04Å; Q35-W39 PolarHBondContact O-N 2.66Å
36	A	56.6	Low	56.8	Low	48 Å²	48	99 Å²	99	40%	0.397	48%	0.477	S	S	.	.	H	α-helix	trans	-69.3	-38.7	176.9	0	0	0	0	0	111.8	A32 L33 W39 K40	A32-A36 WeakPolarHBondContact O-CB 3.27Å; A32-A36 PolarHBondContact O-N 3.08Å; L33-A36 PolarHBondContact O-N 2.93Å; A36-W39 PolarHBondContact O-N 2.9Å; A36-K40 WeakPolarHBondContact O-CG 3.23Å; A36-K40 PolarHBondContact O-N 3.38Å
37	Q	59.3	Low	59.4	Low	103 Å²	103	100.4 Å²	100.4	48%	0.481	48%	0.478	S	S	.	.	H	α-helix	trans	-68.6	-47.2	175.3	-168.9	150.5	-24	0	0	111	L33 W39 K40 E41	L33-Q37 WeakPolarHBondContact O-CB 3.15Å; L33-Q37 PolarHBondContact O-N 3.11Å; Q37-W39 VanDerWaalsContact C-N 3.27Å; Q37-W39 PolarHBondContact O-N 3.3Å; Q37-K40 PolarHBondContact O-N 2.78Å; Q37-K40 VanDerWaalsContact O-N 3.14Å; Q37-E41 WeakPolarHBondContact O-CG 3.34Å; Q37-E41 PolarHBondContact O-N 3.02Å
38	G	64.2	Low	62	Low	16 Å²	16	94.9 Å²	94.9	17%	0.165	44%	0.442	C	S	.	.	H	α-helix	trans	-62.3	-30.3	172.9	0	0	0	0	0	113.8	S34 R42	S34-G38 PolarHBondContact O-N 2.95Å; G38-R42 WeakPolarHBondContact O-CB 3.46Å; G38-R42 VanDerWaalsContact O-CD 3.27Å; G38-R42 WeakPolarHBondContact O-CD 3.16Å; G38-R42 WeakPolarHBondContact O-CG 3.26Å; G38-R42 PolarHBondContact O-N 2.89Å; G38-R42 VanDerWaalsContact O-N 3.09Å
39	W	66.9	Low	64.7	Low	162 Å²	162	84.7 Å²	84.7	61%	0.614	40%	0.404	S	S	*	.	H	α-helix	trans	-71.1	-40.7	173.3	-179.2	86.7	0	0	0	112.5	Q35 A36 Q37 R42 K43	Q35-W39 VanDerWaalsContact O-CB 3.23Å; Q35-W39 WeakPolarHBondContact O-CB 3.04Å; Q35-W39 PolarHBondContact O-N 2.66Å; A36-W39 PolarHBondContact O-N 2.9Å; Q37-W39 VanDerWaalsContact C-N 3.27Å; Q37-W39 PolarHBondContact O-N 3.3Å; W39-R42 PolarHBondContact O-N 3.48Å; W39-K43 HydrophobicContact CH2-CD 4.11Å; W39-K43 HydrophobicContact CZ2-CD 4.48Å; W39-K43 HydrophobicContact CZ3-CD 4.43Å; W39-K43 PolarHBondContact O-N 3.14Å
40	K	72.7	Confident	67.5	Low	136 Å²	136	85.6 Å²	85.6	59%	0.591	40%	0.402	S	S	*	.	H	α-helix	trans	-64.1	-48.4	175.3	-76.8	-178.5	179.3	-176.3	0	111.5	A36 Q37 R42 K43 A44	A36-K40 WeakPolarHBondContact O-CG 3.23Å; A36-K40 PolarHBondContact O-N 3.38Å; Q37-K40 PolarHBondContact O-N 2.78Å; Q37-K40 VanDerWaalsContact O-N 3.14Å; K40-R42 VanDerWaalsContact C-N 3.31Å; K40-R42 PolarHBondContact O-N 3.49Å; K40-K43 PolarHBondContact O-N 3.26Å; K40-K43 VanDerWaalsContact O-N 3.09Å; K40-A44 PolarHBondContact O-N 3.29Å
41	E	73.9	Confident	70.3	Confident	36 Å²	36	78.2 Å²	78.2	17%	0.168	37%	0.374	C	S	.	.	H	α-helix	trans	-57.4	-43.8	176.1	-73.1	168.9	-169.3	0	0	111.5	Q37 K43 A44 A45 E114 Y118	Q37-E41 WeakPolarHBondContact O-CG 3.34Å; Q37-E41 PolarHBondContact O-N 3.02Å; E41-K43 PolarHBondContact O-N 3.01Å; E41-A44 PolarHBondContact O-N 3.29Å; E41-A45 VanDerWaalsContact O-CB 3.23Å; E41-A45 WeakPolarHBondContact O-CB 3.22Å; E41-A45 PolarHBondContact O-N 2.84Å; E41-E114 HydrophobicContact CG-CB 4.32Å; E41-Y118 HydrophobicContact CB-CD2 4.29Å; E41-Y118 HydrophobicContact CB-CG 4.35Å
42	R	76.9	Confident	72.9	Confident	148 Å²	148	71.5 Å²	71.5	56%	0.558	35%	0.345	S	S	*	.	H	α-helix	trans	-62.2	-39.6	175	-76.9	169.2	-171.7	-169.7	3.7	113.1	G38 W39 K40 K46 Y118	G38-R42 WeakPolarHBondContact O-CB 3.46Å; G38-R42 VanDerWaalsContact O-CD 3.27Å; G38-R42 WeakPolarHBondContact O-CD 3.16Å; G38-R42 WeakPolarHBondContact O-CG 3.26Å; G38-R42 PolarHBondContact O-N 2.89Å; G38-R42 VanDerWaalsContact O-N 3.09Å; W39-R42 PolarHBondContact O-N 3.48Å; K40-R42 VanDerWaalsContact C-N 3.31Å; K40-R42 PolarHBondContact O-N 3.49Å; R42-K46 WeakPolarHBondContact O-CB 3.42Å; R42-K46 PolarHBondContact O-N 2.98Å; R42-Y118 HydrophobicContact CG-CE1 3.75Å; R42-Y118 HydrophobicContact CG-CE2 3.97Å; R42-Y118 VanDerWaalsContact CG-CZ 3.45Å; R42-Y118 WeakPolarHBondContact CG-OH 3.43Å; R42-Y118 PolarHBondContact NE-OH 3.32Å
43	K	83.1	Confident	75.6	Confident	138 Å²	138	69.9 Å²	69.9	60%	0.6	33%	0.329	S	S	*	.	H	α-helix	trans	-68.4	-44.9	178.5	-171.9	-177.7	177	-173.8	0	110.9	W39 K40 E41 K46 E47	W39-K43 HydrophobicContact CH2-CD 4.11Å; W39-K43 HydrophobicContact CZ2-CD 4.48Å; W39-K43 HydrophobicContact CZ3-CD 4.43Å; W39-K43 PolarHBondContact O-N 3.14Å; K40-K43 PolarHBondContact O-N 3.26Å; K40-K43 VanDerWaalsContact O-N 3.09Å; E41-K43 PolarHBondContact O-N 3.01Å; K43-K46 PolarHBondContact O-N 3.23Å; K43-E47 PolarHBondContact O-N 3.44Å
44	A	84.4	Confident	78.4	Confident	10 Å²	10	66.2 Å²	66.2	8%	0.083	31%	0.31	C	S	.	.	H	α-helix	trans	-60.3	-46.7	174.5	0	0	0	0	0	111.2	K40 E41 K46 E47 L48 D111	K40-A44 PolarHBondContact O-N 3.29Å; E41-A44 PolarHBondContact O-N 3.29Å; A44-K46 VanDerWaalsContact C-N 3.32Å; A44-K46 PolarHBondContact O-N 2.77Å; A44-E47 PolarHBondContact O-N 3.44Å; A44-L48 WeakPolarHBondContact O-CB 3.45Å; A44-L48 WeakPolarHBondContact O-CG 3.28Å; A44-L48 PolarHBondContact O-N 2.87Å; A44-D111 HydrophobicContact CB-CB 3.88Å
45	A	86.3	Confident	80.4	Confident	3 Å²	3	62.8 Å²	62.8	3%	0.025	29%	0.286	C	S	.	.	H	α-helix	trans	-57	-42.9	175.3	0	0	0	0	0	112.1	E41 E47 L48 T49 Y118 I119	E41-A45 VanDerWaalsContact O-CB 3.23Å; E41-A45 WeakPolarHBondContact O-CB 3.22Å; E41-A45 PolarHBondContact O-N 2.84Å; A45-E47 PolarHBondContact O-N 3.05Å; A45-L48 PolarHBondContact O-N 3.36Å; A45-T49 VanDerWaalsContact O-CG2 3.25Å; A45-T49 WeakPolarHBondContact O-CG2 3.45Å; A45-T49 PolarHBondContact O-N 3.41Å; A45-T49 PolarHBondContact O-OG1 2.89Å; A45-Y118 HydrophobicContact CB-CD1 3.59Å; A45-Y118 HydrophobicContact CB-CE1 4.31Å; A45-Y118 HydrophobicContact CB-CG 4.45Å; A45-I119 HydrophobicContact CB-CD1 4.14Å; A45-I119 HydrophobicContact CB-CG1 3.84Å
46	K	86.6	Confident	82.4	Confident	146 Å²	146	56.9 Å²	56.9	64%	0.635	26%	0.258	S	S	*	.	H	α-helix	trans	-62.7	-41.5	178.2	-174.9	178.7	178.9	-180	0	112.9	R42 K43 A44 T49 R50	R42-K46 WeakPolarHBondContact O-CB 3.42Å; R42-K46 PolarHBondContact O-N 2.98Å; K43-K46 PolarHBondContact O-N 3.23Å; A44-K46 VanDerWaalsContact C-N 3.32Å; A44-K46 PolarHBondContact O-N 2.77Å; K46-T49 PolarHBondContact O-OG1 3.09Å; K46-R50 PolarHBondContact O-N 3.32Å
47	E	88.4	Confident	84.2	Confident	79 Å²	79	54.7 Å²	54.7	37%	0.369	24%	0.24	S	C	.	.	H	α-helix	trans	-68.3	-42.8	175.7	-177.7	56	-153.4	0	0	110.9	K43 A44 A45 T49 R50 Q51 I107	K43-E47 PolarHBondContact O-N 3.44Å; A44-E47 PolarHBondContact O-N 3.44Å; A45-E47 PolarHBondContact O-N 3.05Å; E47-T49 VanDerWaalsContact C-N 3.35Å; E47-T49 PolarHBondContact O-N 2.95Å; E47-R50 WeakPolarHBondContact O-CB 3.35Å; E47-R50 PolarHBondContact O-N 3.11Å; E47-Q51 WeakPolarHBondContact O-CG 3.37Å; E47-Q51 PolarHBondContact O-N 3.38Å; E47-Q51 PolarHBondContact OE1-NE2 3.01Å; E47-I107 HydrophobicContact CG-CD1 4.46Å
48	L	91.8	Very high	85.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.7	-44.5	176.3	-78.5	167	0	0	0	112.4	A44 A45 R50 Q51 N52 F104 I107 L112 F116 I119	A44-L48 WeakPolarHBondContact O-CB 3.45Å; A44-L48 WeakPolarHBondContact O-CG 3.28Å; A44-L48 PolarHBondContact O-N 2.87Å; A45-L48 PolarHBondContact O-N 3.36Å; L48-R50 VanDerWaalsContact C-N 3.27Å; L48-R50 PolarHBondContact O-N 3.37Å; L48-Q51 PolarHBondContact O-N 2.95Å; L48-N52 WeakPolarHBondContact O-CB 3.45Å; L48-N52 PolarHBondContact O-N 3.21Å; L48-F104 HydrophobicContact CD2-CD1 4.22Å; L48-F104 HydrophobicContact CD2-CE1 4.27Å; L48-I107 HydrophobicContact CD2-CD1 3.34Å; L48-I107 HydrophobicContact CD2-CG2 4.43Å; L48-I107 HydrophobicContact CG-CD1 3.94Å; L48-L112 WeakPolarHBondContact CD1-O 3.44Å; L48-L112 HydrophobicContact CD2-CD1 3.45Å; L48-L112 VanDerWaalsContact CD2-CD1 3.45Å; L48-F116 HydrophobicContact CD1-CD2 4.4Å; L48-F116 HydrophobicContact CD2-CD2 4.45Å; L48-F116 HydrophobicContact CD2-CE2 4.01Å; L48-F116 HydrophobicContact CD2-CZ 4.43Å; L48-I119 HydrophobicContact CB-CD1 4.14Å; L48-I119 HydrophobicContact CD1-CD1 4.47Å
49	T	90.4	Very high	87.2	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.012	23%	0.226	C	C	.	.	H	α-helix	trans	-67.9	-31.8	-179.7	65.5	0	0	0	0	112	A45 K46 E47 M53 I119 I399 P400	A45-T49 VanDerWaalsContact O-CG2 3.25Å; A45-T49 WeakPolarHBondContact O-CG2 3.45Å; A45-T49 PolarHBondContact O-N 3.41Å; A45-T49 PolarHBondContact O-OG1 2.89Å; K46-T49 PolarHBondContact O-OG1 3.09Å; E47-T49 VanDerWaalsContact C-N 3.35Å; E47-T49 PolarHBondContact O-N 2.95Å; T49-M53 WeakPolarHBondContact O-CB 3.3Å; T49-M53 PolarHBondContact O-N 3.17Å; T49-I119 HydrophobicContact CG2-CD1 3.74Å; T49-I119 HydrophobicContact CG2-CG1 4.21Å; T49-I399 HydrophobicContact CG2-CG2 3.91Å; T49-P400 WeakPolarHBondContact CB-O 3.44Å; T49-P400 PolarHBondContact OG1-O 3.39Å
50	R	90.6	Very high	88.5	Confident	91 Å²	91	45.3 Å²	45.3	34%	0.343	20%	0.198	S	C	.	.	H	α-helix	trans	-63.1	-47.7	171	-175.4	175.5	-175.2	-83.5	0.4	111.5	K46 E47 L48 M53 D54 V289 D290	K46-R50 PolarHBondContact O-N 3.32Å; E47-R50 WeakPolarHBondContact O-CB 3.35Å; E47-R50 PolarHBondContact O-N 3.11Å; L48-R50 VanDerWaalsContact C-N 3.27Å; L48-R50 PolarHBondContact O-N 3.37Å; R50-M53 PolarHBondContact O-N 3.03Å; R50-D54 PolarHBondContact O-N 3.02Å; R50-V289 HydrophobicContact CB-CG2 4.49Å; R50-V289 HydrophobicContact CG-CG2 3.27Å; R50-V289 WeakPolarHBondContact O-CG2 3.32Å; R50-D290 IonicContact CZ-OD1 3.52Å; R50-D290 IonicContact NH2-OD1 2.78Å; R50-D290 PolarHBondContact NH2-OD1 3.16Å; R50-D290 IonicContact NH2-OD2 3.74Å
51	Q	92.3	Very high	89.4	Confident	27 Å²	27	41.5 Å²	41.5	13%	0.126	18%	0.181	C	C	.	.	H	α-helix	trans	-66.7	-38.1	178.5	-65.2	-54.6	-23.6	0	0	112.9	E47 L48 D54 F55 N103 I107	E47-Q51 WeakPolarHBondContact O-CG 3.37Å; E47-Q51 PolarHBondContact O-N 3.38Å; E47-Q51 PolarHBondContact OE1-NE2 3.01Å; L48-Q51 PolarHBondContact O-N 2.95Å; Q51-D54 WeakPolarHBondContact O-CB 3.31Å; Q51-D54 PolarHBondContact O-N 3.35Å; Q51-F55 PolarHBondContact O-N 3.19Å; Q51-N103 HydrophobicContact CB-CB 4.03Å; Q51-N103 HydrophobicContact CG-CB 4.45Å; Q51-N103 PolarHBondContact O-ND2 3.32Å; Q51-I107 HydrophobicContact CG-CD1 4.15Å
52	N	93.3	Very high	90.3	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-67	-37.2	176.2	-178.6	-1	0	0	0	112	L48 F55 G56 P76 L77 S80	L48-N52 WeakPolarHBondContact O-CB 3.45Å; L48-N52 PolarHBondContact O-N 3.21Å; N52-F55 WeakPolarHBondContact O-CB 3.3Å; N52-F55 PolarHBondContact O-N 2.75Å; N52-G56 PolarHBondContact O-N 3.24Å; N52-P76 WeakPolarHBondContact OD1-CB 3.43Å; N52-P76 PolarHBondContact OD1-O 3.22Å; N52-L77 VanDerWaalsContact ND2-CA 3.29Å; N52-L77 WeakPolarHBondContact ND2-CA 3.4Å; N52-L77 VanDerWaalsContact ND2-CD1 3.28Å; N52-L77 WeakPolarHBondContact ND2-CD1 3.38Å; N52-L77 PolarHBondContact OD1-N 2.99Å; N52-S80 PolarHBondContact OD1-OG 2.73Å; N52-S80 VanDerWaalsContact OD1-OG 3.13Å
53	M	92.5	Very high	91	Very high	18 Å²	18	38.4 Å²	38.4	9%	0.089	17%	0.172	C	C	.	.	H	α-helix	trans	-62.1	-43.6	171.8	-179.3	164.5	63.3	0	0	111.8	T49 R50 G56 F57 V289 F292 V402	T49-M53 WeakPolarHBondContact O-CB 3.3Å; T49-M53 PolarHBondContact O-N 3.17Å; R50-M53 PolarHBondContact O-N 3.03Å; M53-G56 PolarHBondContact O-N 2.87Å; M53-F57 HydrophobicContact CG-CD2 4.21Å; M53-F57 HydrophobicContact CG-CE1 4.43Å; M53-F57 HydrophobicContact CG-CE2 3.53Å; M53-F57 HydrophobicContact CG-CZ 3.65Å; M53-F57 WeakPolarHBondContact O-CD2 3.27Å; M53-F57 WeakPolarHBondContact O-CG 3.15Å; M53-F57 PolarHBondContact O-N 3.31Å; M53-F57 HydrophobicContact SD-CE2 4.2Å; M53-F57 HydrophobicContact SD-CZ 4.1Å; M53-V289 HydrophobicContact CE-CG2 4.21Å; M53-F292 HydrophobicContact CE-CB 3.63Å; M53-F292 HydrophobicContact CE-CD1 4.32Å; M53-F292 HydrophobicContact CE-CG 4.06Å; M53-F292 HydrophobicContact SD-CB 3.67Å; M53-F292 HydrophobicContact SD-CD1 4.25Å; M53-F292 HydrophobicContact SD-CD2 3.99Å; M53-F292 HydrophobicContact SD-CG 3.71Å; M53-V402 HydrophobicContact CB-CG2 4.21Å; M53-V402 HydrophobicContact CG-CG2 3.88Å; M53-V402 HydrophobicContact SD-CG2 3.99Å
54	D	92.3	Very high	91.4	Very high	29 Å²	29	32.1 Å²	32.1	16%	0.155	15%	0.146	C	C	.	.	H	α-helix	trans	-61.6	-44	174	-174.1	56.7	0	0	0	112.1	R50 Q51 G56 F57 K58 N103 V289	R50-D54 PolarHBondContact O-N 3.02Å; Q51-D54 WeakPolarHBondContact O-CB 3.31Å; Q51-D54 PolarHBondContact O-N 3.35Å; D54-G56 PolarHBondContact O-N 3.44Å; D54-F57 PolarHBondContact O-N 2.66Å; D54-K58 WeakPolarHBondContact O-CG 3.28Å; D54-K58 PolarHBondContact O-N 3.28Å; D54-K58 WeakPolarHBondContact OD2-CE 3.32Å; D54-K58 IonicContact OD2-NZ 2.95Å; D54-K58 PolarHBondContact OD2-NZ 2.98Å; D54-N103 PolarHBondContact OD2-ND2 3.33Å; D54-V289 HydrophobicContact CB-CB 4.12Å; D54-V289 HydrophobicContact CB-CG2 4.46Å
55	F	93.7	Very high	91.6	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-56.6	-48	173.3	164.7	-101.3	0	0	0	111.4	Q51 N52 F57 K58 L59 P76 I79 S80 F102 L323 M326	Q51-F55 PolarHBondContact O-N 3.19Å; N52-F55 WeakPolarHBondContact O-CB 3.3Å; N52-F55 PolarHBondContact O-N 2.75Å; F55-F57 VanDerWaalsContact C-N 3.31Å; F55-F57 PolarHBondContact O-N 3.15Å; F55-K58 PolarHBondContact O-N 2.93Å; F55-K58 VanDerWaalsContact O-N 3.17Å; F55-L59 HydrophobicContact CE1-CD2 4.05Å; F55-L59 HydrophobicContact CZ-CB 4.49Å; F55-L59 HydrophobicContact CZ-CD2 3.88Å; F55-L59 WeakPolarHBondContact O-CB 3.42Å; F55-L59 PolarHBondContact O-N 2.86Å; F55-P76 HydrophobicContact CD1-CB 4.27Å; F55-I79 HydrophobicContact CE1-CB 4.32Å; F55-I79 HydrophobicContact CE1-CG2 4.25Å; F55-I79 HydrophobicContact CZ-CG2 4.04Å; F55-S80 WeakPolarHBondContact CD1-OG 3.45Å; F55-F102 HydrophobicContact CD1-CD1 4.09Å; F55-F102 HydrophobicContact CD1-CE1 4.26Å; F55-F102 AromaticContact CD2-CD1 3.82Å; F55-F102 HydrophobicContact CD2-CD1 3.82Å; F55-F102 HydrophobicContact CD2-CE1 4.2Å; F55-F102 HydrophobicContact CD2-CG 4.35Å; F55-F102 AromaticContact CE1-CD1 3.91Å; F55-F102 HydrophobicContact CE1-CD1 3.91Å; F55-F102 AromaticContact CE1-CE1 3.62Å; F55-F102 HydrophobicContact CE1-CE1 3.62Å; F55-F102 AromaticContact CE2-CD1 3.62Å; F55-F102 HydrophobicContact CE2-CD1 3.62Å; F55-F102 AromaticContact CE2-CE1 3.54Å; F55-F102 HydrophobicContact CE2-CE1 3.54Å; F55-F102 HydrophobicContact CE2-CG 4.26Å; F55-F102 HydrophobicContact CE2-CZ 4.11Å; F55-F102 HydrophobicContact CG-CD1 4.05Å; F55-F102 AromaticContact CZ-CD1 3.69Å; F55-F102 HydrophobicContact CZ-CD1 3.69Å; F55-F102 AromaticContact CZ-CE1 3.21Å; F55-F102 HydrophobicContact CZ-CE1 3.21Å; F55-F102 AromaticContact CZ-CZ 3.91Å; F55-F102 HydrophobicContact CZ-CZ 3.91Å; F55-L323 HydrophobicContact CE2-CD2 4.23Å; F55-L323 HydrophobicContact CZ-CD2 4.19Å; F55-M326 HydrophobicContact CD2-CE 3.5Å; F55-M326 VanDerWaalsContact CD2-CE 3.5Å; F55-M326 HydrophobicContact CD2-SD 4.3Å; F55-M326 HydrophobicContact CE2-CE 3.46Å; F55-M326 VanDerWaalsContact CE2-CE 3.46Å; F55-M326 HydrophobicContact CE2-SD 3.64Å; F55-M326 HydrophobicContact CZ-SD 4.4Å
56	G	94.4	Very high	91.6	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-56.7	-43.5	176.9	0	0	0	0	0	112.6	N52 M53 D54 L59 L60 L405	N52-G56 PolarHBondContact O-N 3.24Å; M53-G56 PolarHBondContact O-N 2.87Å; D54-G56 PolarHBondContact O-N 3.44Å; G56-L59 PolarHBondContact O-N 3.31Å; G56-L60 WeakPolarHBondContact O-CB 3.2Å; G56-L60 PolarHBondContact O-N 3.46Å; G56-L405 VanDerWaalsContact C-CD2 3.5Å; G56-L405 VanDerWaalsContact O-CD2 3.23Å; G56-L405 WeakPolarHBondContact O-CD2 3.3Å
57	F	93.7	Very high	91.5	Very high	2 Å²	2	35 Å²	35	1%	0.009	18%	0.177	C	C	.	.	H	α-helix	trans	-66.1	-42.7	175.6	-63.1	-30.5	0	0	0	112.7	M53 D54 F55 L59 L60 K61 L287 Q288 L393 L405	M53-F57 HydrophobicContact CG-CD2 4.21Å; M53-F57 HydrophobicContact CG-CE1 4.43Å; M53-F57 HydrophobicContact CG-CE2 3.53Å; M53-F57 HydrophobicContact CG-CZ 3.65Å; M53-F57 WeakPolarHBondContact O-CD2 3.27Å; M53-F57 WeakPolarHBondContact O-CG 3.15Å; M53-F57 PolarHBondContact O-N 3.31Å; M53-F57 HydrophobicContact SD-CE2 4.2Å; M53-F57 HydrophobicContact SD-CZ 4.1Å; D54-F57 PolarHBondContact O-N 2.66Å; F55-F57 VanDerWaalsContact C-N 3.31Å; F55-F57 PolarHBondContact O-N 3.15Å; F57-L59 VanDerWaalsContact C-N 3.33Å; F57-L59 PolarHBondContact O-N 2.93Å; F57-L60 PolarHBondContact O-N 3.37Å; F57-K61 VanDerWaalsContact O-CG 3.26Å; F57-K61 WeakPolarHBondContact O-CG 3.31Å; F57-K61 PolarHBondContact O-N 3.26Å; F57-L287 HydrophobicContact CB-CB 4.09Å; F57-L287 HydrophobicContact CD1-CB 4.11Å; F57-L287 HydrophobicContact CD1-CD1 3.93Å; F57-L287 HydrophobicContact CD1-CG 4.47Å; F57-L287 HydrophobicContact CD2-CB 4.27Å; F57-L287 HydrophobicContact CE1-CD1 4.37Å; F57-L287 HydrophobicContact CG-CB 3.91Å; F57-Q288 WeakPolarHBondContact CE2-O 3.39Å; F57-L393 HydrophobicContact CE1-CD2 4.11Å; F57-L393 HydrophobicContact CZ-CD2 4.34Å; F57-L405 HydrophobicContact CD1-CD2 4.1Å; F57-L405 HydrophobicContact CE1-CD1 4.39Å
58	K	92.9	Very high	91.2	Very high	80 Å²	80	35.6 Å²	35.6	35%	0.348	19%	0.188	S	C	.	.	H	α-helix	trans	-59.7	-45.6	175	-72.6	174.4	-175.6	168	0	111.2	D54 F55 K61 K62 N103 M326	D54-K58 WeakPolarHBondContact O-CG 3.28Å; D54-K58 PolarHBondContact O-N 3.28Å; D54-K58 WeakPolarHBondContact OD2-CE 3.32Å; D54-K58 IonicContact OD2-NZ 2.95Å; D54-K58 PolarHBondContact OD2-NZ 2.98Å; F55-K58 PolarHBondContact O-N 2.93Å; F55-K58 VanDerWaalsContact O-N 3.17Å; K58-K61 PolarHBondContact O-N 2.75Å; K58-K62 WeakPolarHBondContact O-CG 3.26Å; K58-K62 PolarHBondContact O-N 3.27Å; K58-N103 PolarHBondContact NZ-ND2 2.92Å; K58-N103 PolarHBondContact NZ-OD1 3.2Å; K58-M326 HydrophobicContact CB-CE 3.96Å
59	L	93.6	Very high	90.9	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-62.9	-47.7	179	178.1	57.8	0	0	0	111.4	F55 G56 F57 K61 K62 L63 L74 I79 T322 M326	F55-L59 HydrophobicContact CE1-CD2 4.05Å; F55-L59 HydrophobicContact CZ-CB 4.49Å; F55-L59 HydrophobicContact CZ-CD2 3.88Å; F55-L59 WeakPolarHBondContact O-CB 3.42Å; F55-L59 PolarHBondContact O-N 2.86Å; G56-L59 PolarHBondContact O-N 3.31Å; F57-L59 VanDerWaalsContact C-N 3.33Å; F57-L59 PolarHBondContact O-N 2.93Å; L59-K61 PolarHBondContact O-N 3.3Å; L59-K62 PolarHBondContact O-N 3Å; L59-L63 HydrophobicContact CD1-CD1 3.92Å; L59-L63 HydrophobicContact CD1-CG 4.12Å; L59-L63 HydrophobicContact CG-CD1 3.98Å; L59-L63 WeakPolarHBondContact O-CG 3.44Å; L59-L63 PolarHBondContact O-N 3.28Å; L59-L74 HydrophobicContact CD2-CD1 3.97Å; L59-L74 HydrophobicContact CD2-CD2 3.82Å; L59-L74 HydrophobicContact CD2-CG 4.48Å; L59-L74 HydrophobicContact CG-CD2 3.82Å; L59-I79 HydrophobicContact CD2-CD1 3.7Å; L59-T322 HydrophobicContact CD1-CG2 3.3Å; L59-M326 HydrophobicContact CB-SD 4.03Å; L59-M326 HydrophobicContact CD1-SD 3.81Å; L59-M326 HydrophobicContact CG-SD 4.47Å
60	L	94	Very high	90.9	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-57.9	-46.7	176	-179.7	68.4	0	0	0	111.5	G56 F57 K62 L63 A64 I72 L287 L391 L405 K407	G56-L60 WeakPolarHBondContact O-CB 3.2Å; G56-L60 PolarHBondContact O-N 3.46Å; F57-L60 PolarHBondContact O-N 3.37Å; L60-K62 VanDerWaalsContact C-N 3.32Å; L60-K62 PolarHBondContact O-N 2.95Å; L60-L63 PolarHBondContact O-N 2.72Å; L60-A64 VanDerWaalsContact O-CB 3.22Å; L60-A64 WeakPolarHBondContact O-CB 3.33Å; L60-A64 PolarHBondContact O-N 2.88Å; L60-I72 HydrophobicContact CD1-CB 4.2Å; L60-I72 HydrophobicContact CD1-CD1 4.14Å; L60-I72 HydrophobicContact CD1-CG2 3.87Å; L60-L287 HydrophobicContact CD2-CD1 3.89Å; L60-L391 HydrophobicContact CD2-CD1 4.35Å; L60-L391 HydrophobicContact CD2-CD2 4.41Å; L60-L405 HydrophobicContact CB-CD2 3.77Å; L60-L405 HydrophobicContact CB-CG 4.44Å; L60-L405 HydrophobicContact CD2-CD1 4.04Å; L60-L405 HydrophobicContact CD2-CD2 3.97Å; L60-L405 HydrophobicContact CD2-CG 3.98Å; L60-L405 HydrophobicContact CG-CD2 4.38Å; L60-K407 HydrophobicContact CD1-CB 4.2Å
61	K	92.6	Very high	91	Very high	56 Å²	56	42.9 Å²	42.9	24%	0.243	23%	0.23	C	C	.	.	H	α-helix	trans	-59.3	-42.4	178.1	-72.5	179.2	-155.7	-166.1	0	112.1	F57 K58 L59 S65 E284 K285 L287	F57-K61 VanDerWaalsContact O-CG 3.26Å; F57-K61 WeakPolarHBondContact O-CG 3.31Å; F57-K61 PolarHBondContact O-N 3.26Å; K58-K61 PolarHBondContact O-N 2.75Å; L59-K61 PolarHBondContact O-N 3.3Å; K61-S65 WeakPolarHBondContact O-CB 3.35Å; K61-S65 PolarHBondContact O-N 3.47Å; K61-S65 PolarHBondContact O-OG 3.4Å; K61-E284 WeakPolarHBondContact CD-O 3.39Å; K61-E284 WeakPolarHBondContact CE-O 3.29Å; K61-E284 VanDerWaalsContact CG-O 3.29Å; K61-E284 WeakPolarHBondContact CG-O 3.31Å; K61-K285 PolarHBondContact NZ-O 3.12Å; K61-L287 WeakPolarHBondContact CE-O 3.15Å; K61-L287 PolarHBondContact NZ-O 3.17Å
62	K	91.8	Very high	91.1	Very high	102 Å²	102	41.8 Å²	41.8	44%	0.443	23%	0.225	S	C	.	.	H	α-helix	trans	-64.9	-47.7	178	-74.4	-68.5	-173.9	175.4	0	111.4	K58 L59 L60 S65 N66	K58-K62 WeakPolarHBondContact O-CG 3.26Å; K58-K62 PolarHBondContact O-N 3.27Å; L59-K62 PolarHBondContact O-N 3Å; L60-K62 VanDerWaalsContact C-N 3.32Å; L60-K62 PolarHBondContact O-N 2.95Å; K62-S65 PolarHBondContact O-N 3.24Å; K62-N66 PolarHBondContact O-N 2.8Å
63	L	91.8	Very high	91.1	Very high	18 Å²	18	41.8 Å²	41.8	9%	0.094	23%	0.225	C	C	.	.	H	α-helix	trans	-63.2	-43.8	177.6	-69.8	171.1	0	0	0	112.2	L59 L60 S65 N66 S67 I72 L74 F317 T322	L59-L63 HydrophobicContact CD1-CD1 3.92Å; L59-L63 HydrophobicContact CD1-CG 4.12Å; L59-L63 HydrophobicContact CG-CD1 3.98Å; L59-L63 WeakPolarHBondContact O-CG 3.44Å; L59-L63 PolarHBondContact O-N 3.28Å; L60-L63 PolarHBondContact O-N 2.72Å; L63-S65 VanDerWaalsContact C-N 3.27Å; L63-S65 PolarHBondContact O-N 2.76Å; L63-N66 PolarHBondContact O-N 3.33Å; L63-S67 PolarHBondContact O-N 3.05Å; L63-I72 HydrophobicContact CB-CD1 3.86Å; L63-I72 HydrophobicContact CB-CG2 4.38Å; L63-I72 HydrophobicContact CD1-CG2 4.04Å; L63-L74 HydrophobicContact CD1-CD2 3.35Å; L63-F317 HydrophobicContact CD1-CD1 4.01Å; L63-F317 HydrophobicContact CD1-CE1 3.66Å; L63-F317 HydrophobicContact CD1-CZ 4.07Å; L63-F317 HydrophobicContact CD2-CD1 3.76Å; L63-F317 HydrophobicContact CD2-CE1 3.8Å; L63-F317 HydrophobicContact CG-CE1 4.29Å; L63-T322 HydrophobicContact CD2-CG2 3.82Å; L63-T322 HydrophobicContact CG-CG2 4.32Å
64	A	91.6	Very high	91.1	Very high	6 Å²	6	41 Å²	41	5%	0.05	22%	0.221	C	C	.	.	H	α-helix	trans	-63.1	-33.1	177	0	0	0	0	0	112.6	L60 I72 K407	L60-A64 VanDerWaalsContact O-CB 3.22Å; L60-A64 WeakPolarHBondContact O-CB 3.33Å; L60-A64 PolarHBondContact O-N 2.88Å; A64-I72 HydrophobicContact CB-CD1 3.95Å; A64-K407 HydrophobicContact CB-CD 4.41Å
65	S	88.9	Confident	91.2	Very high	90 Å²	90	39.6 Å²	39.6	63%	0.629	21%	0.214	S	C	*	.	H	α-helix	trans	-72.9	-37.7	176	-58	0	0	0	0	112.4	K61 K62 L63	K61-S65 WeakPolarHBondContact O-CB 3.35Å; K61-S65 PolarHBondContact O-N 3.47Å; K61-S65 PolarHBondContact O-OG 3.4Å; K62-S65 PolarHBondContact O-N 3.24Å; L63-S65 VanDerWaalsContact C-N 3.27Å; L63-S65 PolarHBondContact O-N 2.76Å
66	N	86.8	Confident	91.2	Very high	83 Å²	83	39.6 Å²	39.6	44%	0.444	21%	0.214	S	C	.	.	H	α-helix	trans	-80.8	-20.4	-178.2	-72.1	-8.3	0	0	0	113.7	K62 L63 Y325	K62-N66 PolarHBondContact O-N 2.8Å; L63-N66 PolarHBondContact O-N 3.33Å; N66-Y325 VanDerWaalsContact ND2-CD2 3.32Å; N66-Y325 WeakPolarHBondContact ND2-CD2 3.2Å; N66-Y325 VanDerWaalsContact ND2-CE2 3.27Å; N66-Y325 WeakPolarHBondContact ND2-CE2 3.37Å
67	S	84.3	Confident	91.1	Very high	46 Å²	46	39.6 Å²	39.6	32%	0.322	21%	0.213	S	C	.	.	S	Bend	trans	-140.3	69.1	-179.8	-73.4	0	0	0	0	110.3	L63 G69 R70	L63-S67 PolarHBondContact O-N 3.05Å; S67-G69 PolarHBondContact O-N 3.41Å; S67-R70 PolarHBondContact O-N 2.83Å
68	P	83	Confident	91	Very high	92 Å²	92	39.5 Å²	39.5	60%	0.597	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	138	179.2	27.6	-34.4	0	0	0	110	R70	P68-R70 VanDerWaalsContact C-N 3.31Å; P68-R70 PolarHBondContact O-N 3.34Å
69	G	84.3	Confident	91	Very high	42 Å²	42	35.7 Å²	35.7	43%	0.433	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	16.8	178.9	0	0	0	0	0	115	S67 V409	S67-G69 PolarHBondContact O-N 3.41Å; G69-V409 WeakPolarHBondContact O-CG2 3.25Å
70	R	90.6	Very high	91.1	Very high	175 Å²	175	35.6 Å²	35.6	66%	0.66	20%	0.196	S	C	*	.			trans	-106	150	167	-70.7	-168.5	168.8	-177.7	-4	111.9	S67 P68	S67-R70 PolarHBondContact O-N 2.83Å; P68-R70 VanDerWaalsContact C-N 3.31Å; P68-R70 PolarHBondContact O-N 3.34Å
71	N	93.7	Very high	91	Very high	28 Å²	28	35.5 Å²	35.5	15%	0.15	20%	0.196	C	C	.	.			trans	-62.2	141.8	167	-88.2	-0.5	0	0	0	110	M313 K407 V409 N410 G413	N71-M313 HydrophobicContact CB-CE 3.44Å; N71-M313 VanDerWaalsContact CB-CE 3.44Å; N71-K407 WeakPolarHBondContact CA-O 3.48Å; N71-V409 VanDerWaalsContact OD1-CG2 3.28Å; N71-V409 WeakPolarHBondContact OD1-CG2 3.36Å; N71-V409 PolarHBondContact OD1-N 3.09Å; N71-N410 PolarHBondContact ND2-O 2.94Å; N71-N410 PolarHBondContact OD1-N 2.66Å; N71-N410 VanDerWaalsContact OD1-N 3.16Å; N71-G413 PolarHBondContact ND2-O 2.93Å
72	I	94.3	Very high	91	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.026	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	132.1	176.8	-57.1	171.5	0	0	0	107.1	L60 L63 A64 L74 F317 G406 K407	L60-I72 HydrophobicContact CD1-CB 4.2Å; L60-I72 HydrophobicContact CD1-CD1 4.14Å; L60-I72 HydrophobicContact CD1-CG2 3.87Å; L63-I72 HydrophobicContact CB-CD1 3.86Å; L63-I72 HydrophobicContact CB-CG2 4.38Å; L63-I72 HydrophobicContact CD1-CG2 4.04Å; A64-I72 HydrophobicContact CB-CD1 3.95Å; I72-L74 HydrophobicContact CG2-CD2 4.05Å; I72-F317 HydrophobicContact CG2-CE1 4.47Å; I72-F317 HydrophobicContact CG2-CZ 3.89Å; I72-G406 CarbonylContact O-C 3.57Å; I72-G406 WeakPolarHBondContact O-CA 3.47Å; I72-K407 HydrophobicContact CB-CB 4.14Å; I72-K407 HydrophobicContact CD1-CB 4.45Å; I72-K407 HydrophobicContact CD1-CD 4.12Å; I72-K407 HydrophobicContact CG1-CB 4.48Å; I72-K407 PolarHBondContact N-O 3.41Å; I72-K407 PolarHBondContact O-N 2.96Å
73	M	92.3	Very high	91	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	113.5	173.7	-178	60.7	65.7	0	0	110	M313 G315 F317 A356 L358 L392 F404	M73-M313 HydrophobicContact CB-CB 4.45Å; M73-M313 HydrophobicContact CB-CE 4.07Å; M73-M313 HydrophobicContact CE-CB 4.4Å; M73-M313 HydrophobicContact CE-CE 4.39Å; M73-M313 HydrophobicContact CE-SD 3.92Å; M73-G315 WeakPolarHBondContact O-CA 3.4Å; M73-F317 VanDerWaalsContact O-CE2 3.31Å; M73-F317 WeakPolarHBondContact O-CE2 3.24Å; M73-A356 HydrophobicContact CG-CB 4.32Å; M73-L358 HydrophobicContact CE-CB 4.17Å; M73-L358 HydrophobicContact CE-CD2 3.63Å; M73-L358 HydrophobicContact CG-CB 4.42Å; M73-L358 HydrophobicContact SD-CB 4.26Å; M73-L358 HydrophobicContact SD-CD2 4.17Å; M73-L392 HydrophobicContact CE-CD2 4.44Å; M73-F404 HydrophobicContact SD-CB 4.18Å; M73-F404 HydrophobicContact SD-CD1 4.16Å
74	L	92.3	Very high	91.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	167.3	-178.5	62.4	87.8	0	0	0	111.3	L59 L63 I72 P76 F317 F404 L405	L59-L74 HydrophobicContact CD2-CD1 3.97Å; L59-L74 HydrophobicContact CD2-CD2 3.82Å; L59-L74 HydrophobicContact CD2-CG 4.48Å; L59-L74 HydrophobicContact CG-CD2 3.82Å; L63-L74 HydrophobicContact CD1-CD2 3.35Å; I72-L74 HydrophobicContact CG2-CD2 4.05Å; L74-P76 HydrophobicContact CD1-CB 4.41Å; L74-P76 HydrophobicContact CD1-CG 3.59Å; L74-F317 HydrophobicContact CB-CD2 4.43Å; L74-F317 HydrophobicContact CB-CE2 3.97Å; L74-F404 WeakPolarHBondContact O-CA 3.4Å; L74-L405 HydrophobicContact CD1-CB 4.24Å; L74-L405 PolarHBondContact N-O 3.4Å; L74-L405 PolarHBondContact O-N 3.4Å
75	S	93.8	Very high	91.3	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.157	C	C	.	.			trans	-118	102.3	172.3	179.5	0	0	0	0	109.1	L77 S78 I79 H354 L403	S75-L77 PolarHBondContact O-N 3.22Å; S75-S78 PolarHBondContact O-N 3.17Å; S75-S78 VanDerWaalsContact OG-CB 3.31Å; S75-S78 WeakPolarHBondContact OG-CB 2.97Å; S75-S78 PolarHBondContact OG-N 3.06Å; S75-I79 WeakPolarHBondContact O-CG1 3.44Å; S75-I79 PolarHBondContact O-N 3.48Å; S75-I79 VanDerWaalsContact O-N 3.15Å; S75-H354 PolarHBondContact N-NE2 3.13Å; S75-H354 VanDerWaalsContact N-NE2 3.18Å; S75-L403 WeakPolarHBondContact CA-O 3.31Å; S75-L403 WeakPolarHBondContact CB-O 3.46Å; S75-L403 PolarHBondContact OG-O 3Å
76	P	94.1	Very high	91.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.1	-38.9	179.9	-21.3	33.5	0	0	0	111.5	N52 F55 L74 S80 V402 L405	N52-P76 WeakPolarHBondContact OD1-CB 3.43Å; N52-P76 PolarHBondContact OD1-O 3.22Å; F55-P76 HydrophobicContact CD1-CB 4.27Å; L74-P76 HydrophobicContact CD1-CB 4.41Å; L74-P76 HydrophobicContact CD1-CG 3.59Å; P76-S80 VanDerWaalsContact O-CB 3.24Å; P76-S80 WeakPolarHBondContact O-CB 3.37Å; P76-S80 PolarHBondContact O-N 3.44Å; P76-S80 PolarHBondContact O-OG 3.02Å; P76-V402 HydrophobicContact CG-CG1 4.19Å; P76-L405 HydrophobicContact CG-CB 4Å; P76-L405 HydrophobicContact CG-CD2 4.36Å
77	L	92.8	Very high	91.9	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-62.9	-47.6	177.2	178.4	64.7	0	0	0	113.2	N52 S75 I79 S80 T81 F116 I119 L123 I134 L403	N52-L77 VanDerWaalsContact ND2-CA 3.29Å; N52-L77 WeakPolarHBondContact ND2-CA 3.4Å; N52-L77 VanDerWaalsContact ND2-CD1 3.28Å; N52-L77 WeakPolarHBondContact ND2-CD1 3.38Å; N52-L77 PolarHBondContact OD1-N 2.99Å; S75-L77 PolarHBondContact O-N 3.22Å; L77-I79 VanDerWaalsContact C-N 3.34Å; L77-I79 PolarHBondContact O-N 2.98Å; L77-S80 PolarHBondContact O-N 3.23Å; L77-T81 HydrophobicContact CD1-CG2 4.05Å; L77-T81 HydrophobicContact CG-CG2 4.45Å; L77-T81 WeakPolarHBondContact O-CG2 3.43Å; L77-T81 PolarHBondContact O-N 3.04Å; L77-T81 PolarHBondContact O-OG1 3.23Å; L77-F116 HydrophobicContact CD1-CE1 4.06Å; L77-I119 HydrophobicContact CD1-CG2 3.81Å; L77-I119 HydrophobicContact CD2-CG2 4.07Å; L77-L123 HydrophobicContact CD2-CD1 3.21Å; L77-I134 HydrophobicContact CD2-CD1 3.63Å; L77-I134 HydrophobicContact CG-CD1 4.35Å; L77-L403 HydrophobicContact CD2-CD2 3.78Å
78	S	91.5	Very high	92.4	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.8	-44.2	-179.6	-146.5	0	0	0	0	111.1	S75 S80 T81 A82 N206	S75-S78 PolarHBondContact O-N 3.17Å; S75-S78 VanDerWaalsContact OG-CB 3.31Å; S75-S78 WeakPolarHBondContact OG-CB 2.97Å; S75-S78 PolarHBondContact OG-N 3.06Å; S78-S80 PolarHBondContact O-N 2.94Å; S78-T81 PolarHBondContact O-N 3.4Å; S78-T81 PolarHBondContact O-OG1 3.39Å; S78-A82 PolarHBondContact O-N 3.26Å; S78-N206 WeakPolarHBondContact CA-OD1 3.17Å; S78-N206 WeakPolarHBondContact CB-OD1 3.39Å; S78-N206 PolarHBondContact O-ND2 3.4Å; S78-N206 PolarHBondContact O-OD1 2.97Å; S78-N206 PolarHBondContact OG-ND2 2.88Å; S78-N206 PolarHBondContact OG-OD1 3.22Å
79	I	93.3	Very high	92.9	Very high	1 Å²	1	13 Å²	13	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-64.8	-43.1	176.6	-58.3	167.2	0	0	0	110.6	F55 L59 S75 L77 A82 F83 F102 L319 H354	F55-I79 HydrophobicContact CE1-CB 4.32Å; F55-I79 HydrophobicContact CE1-CG2 4.25Å; F55-I79 HydrophobicContact CZ-CG2 4.04Å; L59-I79 HydrophobicContact CD2-CD1 3.7Å; S75-I79 WeakPolarHBondContact O-CG1 3.44Å; S75-I79 PolarHBondContact O-N 3.48Å; S75-I79 VanDerWaalsContact O-N 3.15Å; L77-I79 VanDerWaalsContact C-N 3.34Å; L77-I79 PolarHBondContact O-N 2.98Å; I79-A82 PolarHBondContact O-N 3.49Å; I79-F83 HydrophobicContact CG2-CD2 4.25Å; I79-F83 WeakPolarHBondContact O-CD2 3.45Å; I79-F83 PolarHBondContact O-N 3.32Å; I79-F83 VanDerWaalsContact O-N 3.15Å; I79-F102 HydrophobicContact CG2-CE1 3.83Å; I79-F102 HydrophobicContact CG2-CZ 3.9Å; I79-L319 HydrophobicContact CD1-CD2 4Å; I79-L319 HydrophobicContact CG1-CD2 4.19Å; I79-L319 HydrophobicContact CG2-CD1 4.18Å; I79-L319 HydrophobicContact CG2-CD2 4.11Å; I79-H354 HydrophobicContact CD1-CB 4.26Å; I79-H354 HydrophobicContact CG1-CB 4.05Å
80	S	94.8	Very high	93.3	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-65.1	-39.9	-179.5	-61.1	0	0	0	0	112.9	N52 F55 P76 L77 S78 S84	N52-S80 PolarHBondContact OD1-OG 2.73Å; N52-S80 VanDerWaalsContact OD1-OG 3.13Å; F55-S80 WeakPolarHBondContact CD1-OG 3.45Å; P76-S80 VanDerWaalsContact O-CB 3.24Å; P76-S80 WeakPolarHBondContact O-CB 3.37Å; P76-S80 PolarHBondContact O-N 3.44Å; P76-S80 PolarHBondContact O-OG 3.02Å; L77-S80 PolarHBondContact O-N 3.23Å; S78-S80 PolarHBondContact O-N 2.94Å; S80-S84 WeakPolarHBondContact O-CB 3.44Å; S80-S84 PolarHBondContact O-N 3.25Å
81	T	93	Very high	93.4	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-64.2	-42.5	176.7	51	0	0	0	0	111.1	L77 S78 S84 L85 F116 I120 Y158 N206	L77-T81 HydrophobicContact CD1-CG2 4.05Å; L77-T81 HydrophobicContact CG-CG2 4.45Å; L77-T81 WeakPolarHBondContact O-CG2 3.43Å; L77-T81 PolarHBondContact O-N 3.04Å; L77-T81 PolarHBondContact O-OG1 3.23Å; S78-T81 PolarHBondContact O-N 3.4Å; S78-T81 PolarHBondContact O-OG1 3.39Å; T81-S84 PolarHBondContact O-N 3.36Å; T81-L85 WeakPolarHBondContact O-CB 3.32Å; T81-L85 PolarHBondContact O-N 3.26Å; T81-F116 HydrophobicContact CG2-CD1 3.51Å; T81-F116 HydrophobicContact CG2-CE1 3.76Å; T81-F116 HydrophobicContact CG2-CG 4.38Å; T81-I120 HydrophobicContact CG2-CD1 3.88Å; T81-I120 HydrophobicContact CG2-CG1 3.95Å; T81-Y158 WeakPolarHBondContact O-CE1 3.43Å; T81-N206 PolarHBondContact OG1-ND2 3.26Å
82	A	91.9	Very high	93.4	Very high	1 Å²	1	8.8 Å²	8.8	1%	0.008	5%	0.045	C	C	.	.	H	α-helix	trans	-61	-47.5	179.6	0	0	0	0	0	112.2	S78 I79 L85 L86 L204 N206	S78-A82 PolarHBondContact O-N 3.26Å; I79-A82 PolarHBondContact O-N 3.49Å; A82-L85 WeakPolarHBondContact O-CB 3.44Å; A82-L85 PolarHBondContact O-N 2.69Å; A82-L86 PolarHBondContact O-N 2.79Å; A82-L204 HydrophobicContact CB-CD2 3.88Å; A82-L204 HydrophobicContact CB-CG 4.4Å; A82-L204 WeakPolarHBondContact O-CD2 3.15Å; A82-N206 HydrophobicContact CB-CB 3.64Å
83	F	93.1	Very high	93.3	Very high	1 Å²	1	10.9 Å²	10.9	0%	0.004	6%	0.06	C	C	.	.	H	α-helix	trans	-78	-28.5	-179.8	-81.6	-97.4	0	0	0	113.1	I79 L85 L86 C87 I98 F102 L319 L323 I331 F332 A352	I79-F83 HydrophobicContact CG2-CD2 4.25Å; I79-F83 WeakPolarHBondContact O-CD2 3.45Å; I79-F83 PolarHBondContact O-N 3.32Å; I79-F83 VanDerWaalsContact O-N 3.15Å; F83-L85 VanDerWaalsContact C-N 3.27Å; F83-L85 PolarHBondContact O-N 3.24Å; F83-L86 HydrophobicContact CD1-CD1 4.13Å; F83-L86 HydrophobicContact CE1-CD1 4.13Å; F83-L86 PolarHBondContact O-N 3.05Å; F83-C87 PolarHBondContact O-N 3.38Å; F83-C87 VanDerWaalsContact O-N 3.13Å; F83-C87 PolarHBondContact O-SG 3.21Å; F83-C87 VanDerWaalsContact O-SG 3.41Å; F83-I98 HydrophobicContact CB-CG2 4.18Å; F83-F102 HydrophobicContact CB-CD2 4.01Å; F83-F102 HydrophobicContact CB-CE1 4.12Å; F83-F102 HydrophobicContact CB-CE2 3.34Å; F83-F102 HydrophobicContact CB-CZ 3.41Å; F83-F102 VanDerWaalsContact CB-CZ 3.41Å; F83-F102 AromaticContact CD1-CE2 3.76Å; F83-F102 HydrophobicContact CD1-CE2 3.76Å; F83-F102 HydrophobicContact CD1-CZ 4.12Å; F83-F102 HydrophobicContact CD2-CE2 4.16Å; F83-F102 AromaticContact CD2-CZ 3.66Å; F83-F102 HydrophobicContact CD2-CZ 3.66Å; F83-F102 HydrophobicContact CG-CE1 4.47Å; F83-F102 AromaticContact CG-CE2 3.45Å; F83-F102 HydrophobicContact CG-CE2 3.45Å; F83-F102 VanDerWaalsContact CG-CE2 3.45Å; F83-F102 AromaticContact CG-CZ 3.42Å; F83-F102 HydrophobicContact CG-CZ 3.42Å; F83-F102 VanDerWaalsContact CG-CZ 3.42Å; F83-L319 HydrophobicContact CE2-CD1 3.76Å; F83-L323 HydrophobicContact CD1-CD1 4.01Å; F83-L323 HydrophobicContact CD2-CD1 3.93Å; F83-L323 HydrophobicContact CE1-CD1 3.45Å; F83-L323 VanDerWaalsContact CE1-CD1 3.45Å; F83-L323 HydrophobicContact CE2-CD1 3.39Å; F83-L323 HydrophobicContact CG-CD1 4.24Å; F83-L323 HydrophobicContact CZ-CD1 3.12Å; F83-I331 HydrophobicContact CE1-CG2 4.39Å; F83-F332 HydrophobicContact CE1-CE1 4.41Å; F83-F332 AromaticContact CE1-CZ 3.8Å; F83-F332 HydrophobicContact CE1-CZ 3.8Å; F83-F332 HydrophobicContact CZ-CE1 4.25Å; F83-F332 AromaticContact CZ-CZ 3.77Å; F83-F332 HydrophobicContact CZ-CZ 3.77Å; F83-A352 HydrophobicContact CZ-CB 4.26Å
84	S	95.2	Very high	93.4	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-66.8	-31	170.3	-170.7	0	0	0	0	112.4	S80 T81 C87 L112 H113 F116 Y158	S80-S84 WeakPolarHBondContact O-CB 3.44Å; S80-S84 PolarHBondContact O-N 3.25Å; T81-S84 PolarHBondContact O-N 3.36Å; S84-C87 VanDerWaalsContact O-CB 3.32Å; S84-C87 WeakPolarHBondContact O-CB 3.48Å; S84-C87 PolarHBondContact O-N 3.02Å; S84-L112 WeakPolarHBondContact OG-CG 3.09Å; S84-H113 PolarHBondContact O-CE1 3.37Å; S84-F116 WeakPolarHBondContact OG-CD2 3.45Å; S84-F116 WeakPolarHBondContact OG-CE2 3.5Å; S84-Y158 WeakPolarHBondContact CB-OH 3.38Å; S84-Y158 PolarHBondContact O-OH 2.8Å; S84-Y158 PolarHBondContact OG-OH 3.14Å
85	L	94.4	Very high	93.5	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-63.5	-46.7	169.9	-174.9	171.5	0	0	0	109.9	T81 A82 F83 C87 L88 N136 L138 F150 A154 Y158 A160	T81-L85 WeakPolarHBondContact O-CB 3.32Å; T81-L85 PolarHBondContact O-N 3.26Å; A82-L85 WeakPolarHBondContact O-CB 3.44Å; A82-L85 PolarHBondContact O-N 2.69Å; F83-L85 VanDerWaalsContact C-N 3.27Å; F83-L85 PolarHBondContact O-N 3.24Å; L85-C87 PolarHBondContact O-N 3.03Å; L85-C87 VanDerWaalsContact O-N 3.17Å; L85-L88 VanDerWaalsContact O-CB 3.26Å; L85-L88 WeakPolarHBondContact O-CB 3.32Å; L85-L88 WeakPolarHBondContact O-CG 3.47Å; L85-L88 PolarHBondContact O-N 2.86Å; L85-N136 HydrophobicContact CD1-CB 3.81Å; L85-L138 HydrophobicContact CD2-CD1 3.97Å; L85-L138 HydrophobicContact CD2-CD2 4.23Å; L85-L138 HydrophobicContact CD2-CG 4.37Å; L85-F150 HydrophobicContact CD2-CE2 4.1Å; L85-F150 HydrophobicContact CD2-CZ 3.99Å; L85-A154 HydrophobicContact CD1-CB 4.44Å; L85-A154 HydrophobicContact CD2-CB 4.18Å; L85-A154 HydrophobicContact CG-CB 4.24Å; L85-Y158 HydrophobicContact CB-CD1 4.01Å; L85-Y158 HydrophobicContact CB-CD2 3.96Å; L85-Y158 HydrophobicContact CB-CE1 4.19Å; L85-Y158 HydrophobicContact CB-CE2 4.14Å; L85-Y158 HydrophobicContact CB-CG 3.9Å; L85-Y158 HydrophobicContact CD1-CD2 4.44Å; L85-Y158 HydrophobicContact CD1-CG 4.09Å; L85-Y158 HydrophobicContact CG-CD2 3.94Å; L85-Y158 HydrophobicContact CG-CE2 4.48Å; L85-Y158 HydrophobicContact CG-CG 4.02Å; L85-A160 HydrophobicContact CD1-CB 3.52Å
86	L	92.3	Very high	93.6	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.9	-26.5	177.3	-68	178.5	0	0	0	113.5	A82 F83 L88 G89 A90 M202 L204 I331 V349	A82-L86 PolarHBondContact O-N 2.79Å; F83-L86 HydrophobicContact CD1-CD1 4.13Å; F83-L86 HydrophobicContact CE1-CD1 4.13Å; F83-L86 PolarHBondContact O-N 3.05Å; L86-L88 PolarHBondContact O-N 3.01Å; L86-G89 CarbonylContact O-C 3.44Å; L86-G89 PolarHBondContact O-N 2.74Å; L86-A90 WeakPolarHBondContact O-CB 3.49Å; L86-A90 PolarHBondContact O-N 2.86Å; L86-M202 HydrophobicContact CD2-CE 4.09Å; L86-L204 HydrophobicContact CD1-CD2 3.57Å; L86-L204 HydrophobicContact CD2-CD2 4.08Å; L86-L204 HydrophobicContact CG-CD2 3.66Å; L86-I331 HydrophobicContact CD1-CG1 4.36Å; L86-V349 HydrophobicContact CD1-CG2 4Å
87	C	95.3	Very high	93.6	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.007	10%	0.098	C	C	.	.	H	α-helix	trans	-57.5	-29.6	172.4	-67.6	0	0	0	0	113.3	F83 S84 L85 G89 A90 L95 I98	F83-C87 PolarHBondContact O-N 3.38Å; F83-C87 VanDerWaalsContact O-N 3.13Å; F83-C87 PolarHBondContact O-SG 3.21Å; F83-C87 VanDerWaalsContact O-SG 3.41Å; S84-C87 VanDerWaalsContact O-CB 3.32Å; S84-C87 WeakPolarHBondContact O-CB 3.48Å; S84-C87 PolarHBondContact O-N 3.02Å; L85-C87 PolarHBondContact O-N 3.03Å; L85-C87 VanDerWaalsContact O-N 3.17Å; C87-G89 PolarHBondContact O-N 3.48Å; C87-A90 PolarHBondContact O-N 2.88Å; C87-L95 HydrophobicContact CB-CD1 3.59Å; C87-I98 WeakPolarHBondContact SG-CG2 3.14Å
88	L	94.9	Very high	93.8	Very high	18 Å²	18	18 Å²	18	9%	0.094	10%	0.097	C	C	.	.	H	α-helix	trans	-61.6	-35.5	175	-66.3	170.2	0	0	0	111.5	L85 L86 H113 F150 D153 A154 Y158	L85-L88 VanDerWaalsContact O-CB 3.26Å; L85-L88 WeakPolarHBondContact O-CB 3.32Å; L85-L88 WeakPolarHBondContact O-CG 3.47Å; L85-L88 PolarHBondContact O-N 2.86Å; L86-L88 PolarHBondContact O-N 3.01Å; L88-H113 VanDerWaalsContact CD2-CE1 3.45Å; L88-H113 WeakPolarHBondContact CD2-CE1 3.13Å; L88-F150 HydrophobicContact CB-CD2 3.82Å; L88-F150 HydrophobicContact CB-CE2 4.09Å; L88-D153 HydrophobicContact CD1-CB 3.76Å; L88-D153 HydrophobicContact CD2-CB 3.92Å; L88-D153 HydrophobicContact CG-CB 4.4Å; L88-A154 HydrophobicContact CD1-CB 4.43Å; L88-Y158 HydrophobicContact CD1-CD2 4.02Å; L88-Y158 HydrophobicContact CD1-CE2 3.77Å; L88-Y158 HydrophobicContact CG-CE2 4.35Å
89	G	92.6	Very high	93.9	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-93.1	-10.5	-177.7	0	0	0	0	0	114.4	L86 C87 L338 K340 I341	L86-G89 CarbonylContact O-C 3.44Å; L86-G89 PolarHBondContact O-N 2.74Å; C87-G89 PolarHBondContact O-N 3.48Å; G89-L338 CarbonylContact O-C 3.5Å; G89-L338 VanDerWaalsContact O-CA 3.3Å; G89-L338 WeakPolarHBondContact O-CA 3.49Å; G89-K340 WeakPolarHBondContact O-CB 3.48Å; G89-I341 VanDerWaalsContact CA-CG1 3.44Å
90	A	93.3	Very high	94	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.13	C	C	.	.			trans	-100.2	156.6	-175.4	0	0	0	0	0	112.8	L86 C87 T94 L95 I98 D337 L338 K340	L86-A90 WeakPolarHBondContact O-CB 3.49Å; L86-A90 PolarHBondContact O-N 2.86Å; C87-A90 PolarHBondContact O-N 2.88Å; A90-T94 HydrophobicContact CB-CG2 4.21Å; A90-L95 HydrophobicContact CB-CB 4.16Å; A90-L95 HydrophobicContact CB-CD1 4.25Å; A90-I98 HydrophobicContact CB-CD1 4.31Å; A90-D337 VanDerWaalsContact CA-O 3.28Å; A90-D337 WeakPolarHBondContact CA-O 3.26Å; A90-L338 HydrophobicContact CB-CD2 4.22Å; A90-K340 PolarHBondContact O-NZ 2.74Å; A90-K340 VanDerWaalsContact O-NZ 3.11Å
91	Q	92.6	Very high	93.9	Very high	51 Å²	51	25.6 Å²	25.6	24%	0.238	13%	0.134	C	C	.	.			trans	-147.6	176.3	171	65.4	-174.3	35.4	0	0	112.2	T94 L95 D337 T339	Q91-T94 PolarHBondContact O-N 3.48Å; Q91-L95 PolarHBondContact O-N 3.16Å; Q91-L95 VanDerWaalsContact O-N 3.13Å; Q91-D337 HydrophobicContact CG-CB 3.87Å; Q91-D337 VanDerWaalsContact CG-OD1 3.27Å; Q91-D337 WeakPolarHBondContact CG-OD1 3.31Å; Q91-D337 WeakPolarHBondContact CG-OD2 3.42Å; Q91-D337 PolarHBondContact N-O 3.14Å; Q91-D337 PolarHBondContact NE2-OD1 2.85Å; Q91-D337 PolarHBondContact NE2-OD2 2.92Å; Q91-T339 VanDerWaalsContact CD-OG1 3.26Å; Q91-T339 PolarHBondContact NE2-OG1 3.49Å; Q91-T339 VanDerWaalsContact NE2-OG1 3.08Å; Q91-T339 PolarHBondContact OE1-OG1 2.92Å
92	D	92.9	Very high	94	Very high	105 Å²	105	25.6 Å²	25.6	56%	0.561	13%	0.134	S	C	*	.	H	α-helix	trans	46.8	-137.2	179.2	-60.2	-39.8	0	0	0	112.9	T94 L95 D96	D92-T94 PolarHBondContact O-N 3.21Å; D92-L95 WeakPolarHBondContact O-CB 3.42Å; D92-L95 PolarHBondContact O-N 3.08Å; D92-L95 VanDerWaalsContact O-N 3.09Å; D92-D96 PolarHBondContact O-N 2.76Å
93	S	93.4	Very high	94	Very high	48 Å²	48	26.9 Å²	26.9	34%	0.336	14%	0.141	S	C	.	.	H	α-helix	trans	-64.7	-24.6	-173.8	67.8	0	0	0	0	114.2	E97 K330	S93-E97 PolarHBondContact O-N 3.23Å; S93-E97 VanDerWaalsContact O-N 3.07Å; S93-K330 VanDerWaalsContact OG-CD 3.27Å; S93-K330 WeakPolarHBondContact OG-CD 3.38Å; S93-K330 PolarHBondContact OG-NZ 3.24Å
94	T	93.8	Very high	94	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.006	14%	0.141	C	C	.	.	H	α-helix	trans	-68.1	-44	173.5	-58.4	0	0	0	0	110.8	A90 Q91 D92 I98 I331 G336 D337	A90-T94 HydrophobicContact CB-CG2 4.21Å; Q91-T94 PolarHBondContact O-N 3.48Å; D92-T94 PolarHBondContact O-N 3.21Å; T94-I98 HydrophobicContact CG2-CD1 4.45Å; T94-I98 WeakPolarHBondContact O-CG1 3.19Å; T94-I98 PolarHBondContact O-N 2.98Å; T94-I331 HydrophobicContact CG2-CB 3.9Å; T94-I331 HydrophobicContact CG2-CD1 3.64Å; T94-I331 HydrophobicContact CG2-CG1 4.34Å; T94-G336 WeakPolarHBondContact OG1-CA 3.47Å; T94-D337 PolarHBondContact OG1-N 2.82Å
95	L	95.2	Very high	93.7	Very high	15 Å²	15	35.4 Å²	35.4	8%	0.079	17%	0.173	C	C	.	.	H	α-helix	trans	-65.5	-40.4	174.9	-178	62.5	0	0	0	111.6	C87 A90 Q91 D92 I98 K99	C87-L95 HydrophobicContact CB-CD1 3.59Å; A90-L95 HydrophobicContact CB-CB 4.16Å; A90-L95 HydrophobicContact CB-CD1 4.25Å; Q91-L95 PolarHBondContact O-N 3.16Å; Q91-L95 VanDerWaalsContact O-N 3.13Å; D92-L95 WeakPolarHBondContact O-CB 3.42Å; D92-L95 PolarHBondContact O-N 3.08Å; D92-L95 VanDerWaalsContact O-N 3.09Å; L95-I98 PolarHBondContact O-N 3.24Å; L95-K99 HydrophobicContact CD1-CD 4.26Å; L95-K99 HydrophobicContact CD1-CG 4.24Å; L95-K99 HydrophobicContact CG-CD 4.1Å; L95-K99 HydrophobicContact CG-CG 4.4Å; L95-K99 WeakPolarHBondContact O-CB 3.45Å; L95-K99 WeakPolarHBondContact O-CG 3.29Å; L95-K99 PolarHBondContact O-N 3.41Å
96	D	94.8	Very high	93.5	Very high	97 Å²	97	44.6 Å²	44.6	52%	0.519	21%	0.213	S	C	.	.	H	α-helix	trans	-63.2	-42.7	179.7	-75.3	-26.3	0	0	0	112.5	D92 K99 Q100	D92-D96 PolarHBondContact O-N 2.76Å; D96-K99 PolarHBondContact O-N 3.3Å; D96-Q100 VanDerWaalsContact O-CB 3.22Å; D96-Q100 WeakPolarHBondContact O-CB 3.49Å; D96-Q100 PolarHBondContact O-N 3.39Å
97	E	95.4	Very high	93.4	Very high	40 Å²	40	45.3 Å²	45.3	19%	0.187	22%	0.217	C	C	.	.	H	α-helix	trans	-61	-46.7	175.9	-81.3	-178.1	-162.1	0	0	111.6	S93 Q100 G101 S329 K330	S93-E97 PolarHBondContact O-N 3.23Å; S93-E97 VanDerWaalsContact O-N 3.07Å; E97-Q100 PolarHBondContact O-N 2.9Å; E97-G101 PolarHBondContact O-N 3.15Å; E97-S329 PolarHBondContact OE2-N 3.44Å; E97-K330 WeakPolarHBondContact OE1-CD 3.26Å; E97-K330 VanDerWaalsContact OE1-CE 3.22Å; E97-K330 WeakPolarHBondContact OE1-CE 3.34Å; E97-K330 VanDerWaalsContact OE1-CG 3.24Å; E97-K330 WeakPolarHBondContact OE1-CG 2.97Å; E97-K330 IonicContact OE1-NZ 3.9Å; E97-K330 WeakPolarHBondContact OE2-CB 3.24Å; E97-K330 PolarHBondContact OE2-N 2.95Å
98	I	95.2	Very high	93.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62	-49.6	177.7	-60.8	166.7	0	0	0	109.9	F83 C87 A90 T94 L95 Q100 G101 F102 I328 I331	F83-I98 HydrophobicContact CB-CG2 4.18Å; C87-I98 WeakPolarHBondContact SG-CG2 3.14Å; A90-I98 HydrophobicContact CB-CD1 4.31Å; T94-I98 HydrophobicContact CG2-CD1 4.45Å; T94-I98 WeakPolarHBondContact O-CG1 3.19Å; T94-I98 PolarHBondContact O-N 2.98Å; L95-I98 PolarHBondContact O-N 3.24Å; I98-Q100 PolarHBondContact O-N 3.24Å; I98-G101 PolarHBondContact O-N 3.48Å; I98-F102 HydrophobicContact CG2-CD2 3.92Å; I98-F102 HydrophobicContact CG2-CE2 4.33Å; I98-F102 WeakPolarHBondContact O-CD2 3.4Å; I98-F102 PolarHBondContact O-N 3.19Å; I98-F102 VanDerWaalsContact O-N 3.09Å; I98-I328 HydrophobicContact CG1-CG2 4.09Å; I98-I331 HydrophobicContact CD1-CB 4.28Å; I98-I331 HydrophobicContact CD1-CD1 4.14Å; I98-I331 HydrophobicContact CD1-CG1 4.13Å
99	K	95.4	Very high	93	Very high	29 Å²	29	52 Å²	52	13%	0.126	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-32.6	179.5	-75.9	-174.8	175.7	172.2	0	112	L95 D96 N103 F104 R105 E109	L95-K99 HydrophobicContact CD1-CD 4.26Å; L95-K99 HydrophobicContact CD1-CG 4.24Å; L95-K99 HydrophobicContact CG-CD 4.1Å; L95-K99 HydrophobicContact CG-CG 4.4Å; L95-K99 WeakPolarHBondContact O-CB 3.45Å; L95-K99 WeakPolarHBondContact O-CG 3.29Å; L95-K99 PolarHBondContact O-N 3.41Å; D96-K99 PolarHBondContact O-N 3.3Å; K99-N103 CarbonylContact O-C 3.28Å; K99-N103 PolarHBondContact O-N 2.9Å; K99-F104 HydrophobicContact CB-CB 4.27Å; K99-F104 HydrophobicContact CG-CB 4.18Å; K99-F104 PolarHBondContact O-N 3.39Å; K99-R105 PolarHBondContact O-N 2.93Å; K99-E109 IonicContact NZ-OE2 3.02Å; K99-E109 PolarHBondContact NZ-OE2 2.99Å
100	Q	94.4	Very high	92.9	Very high	121 Å²	121	58.4 Å²	58.4	57%	0.565	28%	0.282	S	S	*	.	H	α-helix	trans	-73.7	-49.7	176.3	178.2	162.7	-29.9	0	0	112.1	D96 E97 I98 F102 N103	D96-Q100 VanDerWaalsContact O-CB 3.22Å; D96-Q100 WeakPolarHBondContact O-CB 3.49Å; D96-Q100 PolarHBondContact O-N 3.39Å; E97-Q100 PolarHBondContact O-N 2.9Å; I98-Q100 PolarHBondContact O-N 3.24Å; Q100-F102 PolarHBondContact O-N 3.4Å; Q100-N103 PolarHBondContact O-N 2.67Å
101	G	93.3	Very high	92.9	Very high	9 Å²	9	61.2 Å²	61.2	9%	0.093	30%	0.297	C	S	.	.	H	α-helix	trans	-66.2	-35.2	-175.5	0	0	0	0	0	113.6	E97 I98	E97-G101 PolarHBondContact O-N 3.15Å; I98-G101 PolarHBondContact O-N 3.48Å
102	F	93.9	Very high	92.9	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	7.1	177	-73.7	-88.8	0	0	0	114.3	F55 I79 F83 I98 Q100 F104 L323 I328	F55-F102 HydrophobicContact CD1-CD1 4.09Å; F55-F102 HydrophobicContact CD1-CE1 4.26Å; F55-F102 AromaticContact CD2-CD1 3.82Å; F55-F102 HydrophobicContact CD2-CD1 3.82Å; F55-F102 HydrophobicContact CD2-CE1 4.2Å; F55-F102 HydrophobicContact CD2-CG 4.35Å; F55-F102 AromaticContact CE1-CD1 3.91Å; F55-F102 HydrophobicContact CE1-CD1 3.91Å; F55-F102 AromaticContact CE1-CE1 3.62Å; F55-F102 HydrophobicContact CE1-CE1 3.62Å; F55-F102 AromaticContact CE2-CD1 3.62Å; F55-F102 HydrophobicContact CE2-CD1 3.62Å; F55-F102 AromaticContact CE2-CE1 3.54Å; F55-F102 HydrophobicContact CE2-CE1 3.54Å; F55-F102 HydrophobicContact CE2-CG 4.26Å; F55-F102 HydrophobicContact CE2-CZ 4.11Å; F55-F102 HydrophobicContact CG-CD1 4.05Å; F55-F102 AromaticContact CZ-CD1 3.69Å; F55-F102 HydrophobicContact CZ-CD1 3.69Å; F55-F102 AromaticContact CZ-CE1 3.21Å; F55-F102 HydrophobicContact CZ-CE1 3.21Å; F55-F102 AromaticContact CZ-CZ 3.91Å; F55-F102 HydrophobicContact CZ-CZ 3.91Å; I79-F102 HydrophobicContact CG2-CE1 3.83Å; I79-F102 HydrophobicContact CG2-CZ 3.9Å; F83-F102 HydrophobicContact CB-CD2 4.01Å; F83-F102 HydrophobicContact CB-CE1 4.12Å; F83-F102 HydrophobicContact CB-CE2 3.34Å; F83-F102 HydrophobicContact CB-CZ 3.41Å; F83-F102 VanDerWaalsContact CB-CZ 3.41Å; F83-F102 AromaticContact CD1-CE2 3.76Å; F83-F102 HydrophobicContact CD1-CE2 3.76Å; F83-F102 HydrophobicContact CD1-CZ 4.12Å; F83-F102 HydrophobicContact CD2-CE2 4.16Å; F83-F102 AromaticContact CD2-CZ 3.66Å; F83-F102 HydrophobicContact CD2-CZ 3.66Å; F83-F102 HydrophobicContact CG-CE1 4.47Å; F83-F102 AromaticContact CG-CE2 3.45Å; F83-F102 HydrophobicContact CG-CE2 3.45Å; F83-F102 VanDerWaalsContact CG-CE2 3.45Å; F83-F102 AromaticContact CG-CZ 3.42Å; F83-F102 HydrophobicContact CG-CZ 3.42Å; F83-F102 VanDerWaalsContact CG-CZ 3.42Å; I98-F102 HydrophobicContact CG2-CD2 3.92Å; I98-F102 HydrophobicContact CG2-CE2 4.33Å; I98-F102 WeakPolarHBondContact O-CD2 3.4Å; I98-F102 PolarHBondContact O-N 3.19Å; I98-F102 VanDerWaalsContact O-N 3.09Å; Q100-F102 PolarHBondContact O-N 3.4Å; F102-F104 VanDerWaalsContact C-N 3.28Å; F102-F104 HydrophobicContact CB-CD1 4.2Å; F102-F104 HydrophobicContact CB-CD2 3.64Å; F102-F104 HydrophobicContact CB-CE1 3.93Å; F102-F104 HydrophobicContact CB-CE2 3.34Å; F102-F104 HydrophobicContact CB-CG 4.07Å; F102-F104 HydrophobicContact CB-CZ 3.5Å; F102-F104 VanDerWaalsContact CB-CZ 3.5Å; F102-F104 HydrophobicContact CD1-CE2 4.42Å; F102-F104 HydrophobicContact CD1-CZ 4.23Å; F102-F104 AromaticContact CG-CE2 3.91Å; F102-F104 HydrophobicContact CG-CE2 3.91Å; F102-F104 HydrophobicContact CG-CZ 4.1Å; F102-F104 WeakPolarHBondContact O-CD1 3.31Å; F102-F104 WeakPolarHBondContact O-CE1 3.31Å; F102-F104 PolarHBondContact O-N 3.3Å; F102-L323 HydrophobicContact CE2-CD1 4.32Å; F102-L323 HydrophobicContact CE2-CD2 4.25Å; F102-L323 HydrophobicContact CZ-CD1 4.06Å; F102-L323 HydrophobicContact CZ-CD2 3.84Å; F102-I328 HydrophobicContact CD2-CD1 3.67Å; F102-I328 HydrophobicContact CE2-CD1 3.47Å; F102-I328 VanDerWaalsContact CE2-CD1 3.47Å; F102-I328 HydrophobicContact CZ-CD1 4.45Å
103	N	92.8	Very high	93	Very high	28 Å²	28	54.1 Å²	54.1	15%	0.15	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	27.1	-177.5	-57.4	-41.1	0	0	0	115.1	Q51 D54 K58 K99 Q100	Q51-N103 HydrophobicContact CB-CB 4.03Å; Q51-N103 HydrophobicContact CG-CB 4.45Å; Q51-N103 PolarHBondContact O-ND2 3.32Å; D54-N103 PolarHBondContact OD2-ND2 3.33Å; K58-N103 PolarHBondContact NZ-ND2 2.92Å; K58-N103 PolarHBondContact NZ-OD1 3.2Å; K99-N103 CarbonylContact O-C 3.28Å; K99-N103 PolarHBondContact O-N 2.9Å; Q100-N103 PolarHBondContact O-N 2.67Å
104	F	93.3	Very high	93	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.251	C	S	.	.			trans	-84.5	-10.5	177.5	-54.4	-33.5	0	0	0	114.2	L48 K99 F102 K106 I107 L112 F116	L48-F104 HydrophobicContact CD2-CD1 4.22Å; L48-F104 HydrophobicContact CD2-CE1 4.27Å; K99-F104 HydrophobicContact CB-CB 4.27Å; K99-F104 HydrophobicContact CG-CB 4.18Å; K99-F104 PolarHBondContact O-N 3.39Å; F102-F104 VanDerWaalsContact C-N 3.28Å; F102-F104 HydrophobicContact CB-CD1 4.2Å; F102-F104 HydrophobicContact CB-CD2 3.64Å; F102-F104 HydrophobicContact CB-CE1 3.93Å; F102-F104 HydrophobicContact CB-CE2 3.34Å; F102-F104 HydrophobicContact CB-CG 4.07Å; F102-F104 HydrophobicContact CB-CZ 3.5Å; F102-F104 VanDerWaalsContact CB-CZ 3.5Å; F102-F104 HydrophobicContact CD1-CE2 4.42Å; F102-F104 HydrophobicContact CD1-CZ 4.23Å; F102-F104 AromaticContact CG-CE2 3.91Å; F102-F104 HydrophobicContact CG-CE2 3.91Å; F102-F104 HydrophobicContact CG-CZ 4.1Å; F102-F104 WeakPolarHBondContact O-CD1 3.31Å; F102-F104 WeakPolarHBondContact O-CE1 3.31Å; F102-F104 PolarHBondContact O-N 3.3Å; F104-K106 PolarHBondContact O-N 3.04Å; F104-I107 WeakPolarHBondContact O-CB 3.24Å; F104-I107 PolarHBondContact O-N 3.29Å; F104-L112 HydrophobicContact CB-CD1 4.12Å; F104-L112 HydrophobicContact CB-CD2 4.27Å; F104-L112 HydrophobicContact CD1-CD1 3.71Å; F104-L112 HydrophobicContact CD2-CD1 3.94Å; F104-L112 HydrophobicContact CD2-CD2 4.19Å; F104-L112 HydrophobicContact CE1-CD1 4.03Å; F104-L112 HydrophobicContact CE2-CD1 4.23Å; F104-L112 HydrophobicContact CG-CD1 3.66Å; F104-L112 HydrophobicContact CG-CD2 4.32Å; F104-L112 HydrophobicContact CZ-CD1 4.27Å; F104-F116 AromaticContact CE1-CE2 3.85Å; F104-F116 HydrophobicContact CE1-CE2 3.85Å; F104-F116 AromaticContact CE1-CZ 3.91Å; F104-F116 HydrophobicContact CE1-CZ 3.91Å; F104-F116 HydrophobicContact CE2-CE2 4.36Å; F104-F116 AromaticContact CZ-CE2 3.62Å; F104-F116 HydrophobicContact CZ-CE2 3.62Å; F104-F116 AromaticContact CZ-CZ 3.73Å; F104-F116 HydrophobicContact CZ-CZ 3.73Å
105	R	89	Confident	93	Very high	180 Å²	180	53.2 Å²	53.2	68%	0.679	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-31	-171.7	-170	173.2	-179.5	178.7	0.5	115.1	K99	K99-R105 PolarHBondContact O-N 2.93Å
106	K	88.9	Confident	92.9	Very high	193 Å²	193	52.5 Å²	52.5	84%	0.839	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.5	0.4	-179.6	-64.3	-175.8	179.3	-179	0	113.7	F104	F104-K106 PolarHBondContact O-N 3.04Å
107	I	90.9	Very high	92.8	Very high	15 Å²	15	51.2 Å²	51.2	8%	0.077	24%	0.238	C	C	.	.	S	Bend	trans	-103.5	125.3	-175.9	-54	-179.2	0	0	0	108	E47 L48 Q51 F104 D111 L112	E47-I107 HydrophobicContact CG-CD1 4.46Å; L48-I107 HydrophobicContact CD2-CD1 3.34Å; L48-I107 HydrophobicContact CD2-CG2 4.43Å; L48-I107 HydrophobicContact CG-CD1 3.94Å; Q51-I107 HydrophobicContact CG-CD1 4.15Å; F104-I107 WeakPolarHBondContact O-CB 3.24Å; F104-I107 PolarHBondContact O-N 3.29Å; I107-D111 HydrophobicContact CG2-CB 3.99Å; I107-L112 HydrophobicContact CG2-CB 4.1Å
108	P	92.8	Very high	92.7	Very high	76 Å²	76	50.8 Å²	50.8	49%	0.494	24%	0.235	S	C	.	.			trans	-55.1	143.4	172	-25	35.1	0	0	0	111.2	K110 D111 L112	P108-K110 VanDerWaalsContact C-N 3.28Å; P108-K110 PolarHBondContact O-N 3.4Å; P108-D111 HydrophobicContact CB-CB 4.26Å; P108-D111 WeakPolarHBondContact CG-OD2 3.26Å; P108-D111 PolarHBondContact O-N 2.83Å; P108-L112 PolarHBondContact O-N 2.71Å
109	E	90.2	Very high	92.5	Very high	83 Å²	83	50.8 Å²	50.8	39%	0.388	24%	0.235	S	C	.	.	H	α-helix	trans	-57.4	-41.6	-174.8	-169.4	157.5	131.7	0	0	112.8	K99 D111 L112 H113	K99-E109 IonicContact NZ-OE2 3.02Å; K99-E109 PolarHBondContact NZ-OE2 2.99Å; E109-D111 PolarHBondContact O-N 3.16Å; E109-L112 WeakPolarHBondContact O-CB 3.29Å; E109-L112 PolarHBondContact O-N 2.77Å; E109-H113 PolarHBondContact O-CD2 3.47Å; E109-H113 PolarHBondContact O-N 3.11Å
110	K	89.7	Confident	92.3	Very high	136 Å²	136	50 Å²	50	59%	0.591	23%	0.232	S	C	*	.	H	α-helix	trans	-58.7	-48.7	175.2	-174.9	176	177.2	174.5	0	112	P108 L112 H113 E114	P108-K110 VanDerWaalsContact C-N 3.28Å; P108-K110 PolarHBondContact O-N 3.4Å; K110-L112 VanDerWaalsContact C-N 3.28Å; K110-L112 PolarHBondContact O-N 3.36Å; K110-H113 PolarHBondContact O-N 2.92Å; K110-E114 WeakPolarHBondContact CE-OE1 3.31Å; K110-E114 WeakPolarHBondContact CE-OE2 3.47Å; K110-E114 HydrophobicContact CG-CG 4.32Å; K110-E114 IonicContact NZ-OE1 2.83Å; K110-E114 WeakPolarHBondContact O-CB 3.44Å; K110-E114 WeakPolarHBondContact O-CG 3.27Å; K110-E114 PolarHBondContact O-N 3.14Å
111	D	92.3	Very high	92	Very high	59 Å²	59	50.2 Å²	50.2	32%	0.316	23%	0.233	S	C	.	.	H	α-helix	trans	-66	-32.2	-178.6	-65.9	-6.7	0	0	0	111.7	A44 I107 P108 E109 G115	A44-D111 HydrophobicContact CB-CB 3.88Å; I107-D111 HydrophobicContact CG2-CB 3.99Å; P108-D111 HydrophobicContact CB-CB 4.26Å; P108-D111 WeakPolarHBondContact CG-OD2 3.26Å; P108-D111 PolarHBondContact O-N 2.83Å; E109-D111 PolarHBondContact O-N 3.16Å; D111-G115 WeakPolarHBondContact O-CA 3.22Å; D111-G115 PolarHBondContact O-N 2.97Å
112	L	94.1	Very high	91.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.6	-54.1	175.6	174.7	64	0	0	0	111.1	L48 S84 F104 I107 P108 E109 K110 F116	L48-L112 WeakPolarHBondContact CD1-O 3.44Å; L48-L112 HydrophobicContact CD2-CD1 3.45Å; L48-L112 VanDerWaalsContact CD2-CD1 3.45Å; S84-L112 WeakPolarHBondContact OG-CG 3.09Å; F104-L112 HydrophobicContact CB-CD1 4.12Å; F104-L112 HydrophobicContact CB-CD2 4.27Å; F104-L112 HydrophobicContact CD1-CD1 3.71Å; F104-L112 HydrophobicContact CD2-CD1 3.94Å; F104-L112 HydrophobicContact CD2-CD2 4.19Å; F104-L112 HydrophobicContact CE1-CD1 4.03Å; F104-L112 HydrophobicContact CE2-CD1 4.23Å; F104-L112 HydrophobicContact CG-CD1 3.66Å; F104-L112 HydrophobicContact CG-CD2 4.32Å; F104-L112 HydrophobicContact CZ-CD1 4.27Å; I107-L112 HydrophobicContact CG2-CB 4.1Å; P108-L112 PolarHBondContact O-N 2.71Å; E109-L112 WeakPolarHBondContact O-CB 3.29Å; E109-L112 PolarHBondContact O-N 2.77Å; K110-L112 VanDerWaalsContact C-N 3.28Å; K110-L112 PolarHBondContact O-N 3.36Å; L112-F116 HydrophobicContact CD1-CD2 3.86Å; L112-F116 HydrophobicContact CD1-CE2 3.59Å; L112-F116 HydrophobicContact CG-CD2 4.47Å; L112-F116 WeakPolarHBondContact O-CD2 3.38Å; L112-F116 PolarHBondContact O-N 2.98Å; L112-F116 VanDerWaalsContact O-N 3.11Å
113	H	94.8	Very high	91.5	Very high	7 Å²	7	51.9 Å²	51.9	3%	0.032	24%	0.238	C	C	.	.	H	α-helix	trans	-74	-43.9	-175.8	-58.5	-60.3	0	0	0	112.1	S84 L88 E109 K110 G115 F116 H117 F157 Y158	S84-H113 PolarHBondContact O-CE1 3.37Å; L88-H113 VanDerWaalsContact CD2-CE1 3.45Å; L88-H113 WeakPolarHBondContact CD2-CE1 3.13Å; E109-H113 PolarHBondContact O-CD2 3.47Å; E109-H113 PolarHBondContact O-N 3.11Å; K110-H113 PolarHBondContact O-N 2.92Å; H113-G115 VanDerWaalsContact C-N 3.31Å; H113-G115 PolarHBondContact O-N 2.81Å; H113-F116 PolarHBondContact O-N 2.94Å; H113-H117 WeakPolarHBondContact O-CB 3.39Å; H113-H117 PolarHBondContact O-N 3.36Å; H113-F157 HydrophobicContact CB-CB 4.27Å; H113-F157 HydrophobicContact CB-CD1 3.94Å; H113-F157 HydrophobicContact CB-CD2 3.95Å; H113-F157 HydrophobicContact CB-CE1 4.25Å; H113-F157 HydrophobicContact CB-CE2 4.26Å; H113-F157 HydrophobicContact CB-CG 3.79Å; H113-F157 HydrophobicContact CB-CZ 4.4Å; H113-Y158 AromaticContact ND1-CE2 3.68Å; H113-Y158 AromaticContact ND1-CZ 3.66Å; H113-Y158 PolarHBondContact ND1-OH 3.02Å
114	E	92.9	Very high	91.2	Very high	29 Å²	29	53.7 Å²	53.7	14%	0.136	25%	0.248	C	C	.	.	H	α-helix	trans	-62.5	-38.8	175.6	-74	-176.8	170.7	0	0	111.9	E41 K110 H117 Y118 F157	E41-E114 HydrophobicContact CG-CB 4.32Å; K110-E114 WeakPolarHBondContact CE-OE1 3.31Å; K110-E114 WeakPolarHBondContact CE-OE2 3.47Å; K110-E114 HydrophobicContact CG-CG 4.32Å; K110-E114 IonicContact NZ-OE1 2.83Å; K110-E114 WeakPolarHBondContact O-CB 3.44Å; K110-E114 WeakPolarHBondContact O-CG 3.27Å; K110-E114 PolarHBondContact O-N 3.14Å; E114-H117 WeakPolarHBondContact O-CB 3.44Å; E114-H117 PolarHBondContact O-N 3.43Å; E114-Y118 PolarHBondContact O-N 3.13Å; E114-F157 HydrophobicContact CG-CE1 3.9Å
115	G	93.3	Very high	90.6	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-68.8	-39.5	177.7	0	0	0	0	0	112.8	D111 H113 Y118 I119	D111-G115 WeakPolarHBondContact O-CA 3.22Å; D111-G115 PolarHBondContact O-N 2.97Å; H113-G115 VanDerWaalsContact C-N 3.31Å; H113-G115 PolarHBondContact O-N 2.81Å; G115-Y118 PolarHBondContact O-N 3.38Å; G115-I119 WeakPolarHBondContact O-CD1 3.1Å; G115-I119 WeakPolarHBondContact O-CG1 3.35Å; G115-I119 PolarHBondContact O-N 3.17Å
116	F	93.4	Very high	90.4	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-67.4	-38.2	172.2	-86.2	-59.2	0	0	0	112.8	L48 L77 T81 S84 F104 L112 H113 Y118 I119 I120 Y158	L48-F116 HydrophobicContact CD1-CD2 4.4Å; L48-F116 HydrophobicContact CD2-CD2 4.45Å; L48-F116 HydrophobicContact CD2-CE2 4.01Å; L48-F116 HydrophobicContact CD2-CZ 4.43Å; L77-F116 HydrophobicContact CD1-CE1 4.06Å; T81-F116 HydrophobicContact CG2-CD1 3.51Å; T81-F116 HydrophobicContact CG2-CE1 3.76Å; T81-F116 HydrophobicContact CG2-CG 4.38Å; S84-F116 WeakPolarHBondContact OG-CD2 3.45Å; S84-F116 WeakPolarHBondContact OG-CE2 3.5Å; F104-F116 AromaticContact CE1-CE2 3.85Å; F104-F116 HydrophobicContact CE1-CE2 3.85Å; F104-F116 AromaticContact CE1-CZ 3.91Å; F104-F116 HydrophobicContact CE1-CZ 3.91Å; F104-F116 HydrophobicContact CE2-CE2 4.36Å; F104-F116 AromaticContact CZ-CE2 3.62Å; F104-F116 HydrophobicContact CZ-CE2 3.62Å; F104-F116 AromaticContact CZ-CZ 3.73Å; F104-F116 HydrophobicContact CZ-CZ 3.73Å; L112-F116 HydrophobicContact CD1-CD2 3.86Å; L112-F116 HydrophobicContact CD1-CE2 3.59Å; L112-F116 HydrophobicContact CG-CD2 4.47Å; L112-F116 WeakPolarHBondContact O-CD2 3.38Å; L112-F116 PolarHBondContact O-N 2.98Å; L112-F116 VanDerWaalsContact O-N 3.11Å; H113-F116 PolarHBondContact O-N 2.94Å; F116-Y118 VanDerWaalsContact C-N 3.33Å; F116-Y118 PolarHBondContact O-N 2.98Å; F116-I119 HydrophobicContact CD1-CD1 4.27Å; F116-I119 PolarHBondContact O-N 3.44Å; F116-I120 WeakPolarHBondContact O-CB 2.76Å; F116-I120 VanDerWaalsContact O-CG1 3.25Å; F116-I120 WeakPolarHBondContact O-CG1 3.49Å; F116-I120 PolarHBondContact O-N 3.48Å; F116-Y158 HydrophobicContact CB-CD1 4.49Å; F116-Y158 HydrophobicContact CB-CE1 3.75Å; F116-Y158 HydrophobicContact CD2-CE1 4.33Å; F116-Y158 HydrophobicContact CG-CE1 4.16Å
117	H	93	Very high	90.1	Very high	70 Å²	70	48.1 Å²	48.1	32%	0.324	23%	0.233	S	C	.	.	H	α-helix	trans	-54.7	-50.8	171.7	175	81.7	0	0	0	111.3	H113 E114 I119 I120 H121 N156 F157	H113-H117 WeakPolarHBondContact O-CB 3.39Å; H113-H117 PolarHBondContact O-N 3.36Å; E114-H117 WeakPolarHBondContact O-CB 3.44Å; E114-H117 PolarHBondContact O-N 3.43Å; H117-I119 PolarHBondContact O-N 2.89Å; H117-I120 PolarHBondContact O-N 2.85Å; H117-H121 VanDerWaalsContact O-CB 3.29Å; H117-H121 WeakPolarHBondContact O-CB 3.47Å; H117-H121 PolarHBondContact O-N 2.73Å; H117-N156 PolarHBondContact CE1-O 2.93Å; H117-N156 PolarHBondContact ND1-O 3.25Å; H117-F157 WeakPolarHBondContact CA-O 3.39Å; H117-F157 HydrophobicContact CB-CB 4.43Å; H117-F157 HydrophobicContact CB-CD1 4.1Å; H117-F157 VanDerWaalsContact CB-O 3.28Å; H117-F157 WeakPolarHBondContact CB-O 3.37Å
118	Y	92.3	Very high	89.4	Confident	31 Å²	31	55 Å²	55	12%	0.122	27%	0.265	C	S	.	.	H	α-helix	trans	-58.2	-46.4	176.9	-177.4	-98.6	0	0	0	112.2	E41 R42 A45 E114 G115 F116 E122	E41-Y118 HydrophobicContact CB-CD2 4.29Å; E41-Y118 HydrophobicContact CB-CG 4.35Å; R42-Y118 HydrophobicContact CG-CE1 3.75Å; R42-Y118 HydrophobicContact CG-CE2 3.97Å; R42-Y118 VanDerWaalsContact CG-CZ 3.45Å; R42-Y118 WeakPolarHBondContact CG-OH 3.43Å; R42-Y118 PolarHBondContact NE-OH 3.32Å; A45-Y118 HydrophobicContact CB-CD1 3.59Å; A45-Y118 HydrophobicContact CB-CE1 4.31Å; A45-Y118 HydrophobicContact CB-CG 4.45Å; E114-Y118 PolarHBondContact O-N 3.13Å; G115-Y118 PolarHBondContact O-N 3.38Å; F116-Y118 VanDerWaalsContact C-N 3.33Å; F116-Y118 PolarHBondContact O-N 2.98Å; Y118-E122 HydrophobicContact CD1-CG 4.48Å; Y118-E122 HydrophobicContact CD2-CG 4.24Å; Y118-E122 HydrophobicContact CE1-CG 4.09Å; Y118-E122 HydrophobicContact CE2-CG 3.77Å; Y118-E122 WeakPolarHBondContact O-CB 3.45Å; Y118-E122 WeakPolarHBondContact O-CG 3.48Å; Y118-E122 PolarHBondContact O-N 3.44Å; Y118-E122 VanDerWaalsContact O-N 3.07Å
119	I	92	Very high	88.8	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62.1	-48.7	179.7	-67.3	161.6	0	0	0	111.2	A45 L48 T49 L77 G115 F116 H117 L123 I399	A45-I119 HydrophobicContact CB-CD1 4.14Å; A45-I119 HydrophobicContact CB-CG1 3.84Å; L48-I119 HydrophobicContact CB-CD1 4.14Å; L48-I119 HydrophobicContact CD1-CD1 4.47Å; T49-I119 HydrophobicContact CG2-CD1 3.74Å; T49-I119 HydrophobicContact CG2-CG1 4.21Å; L77-I119 HydrophobicContact CD1-CG2 3.81Å; L77-I119 HydrophobicContact CD2-CG2 4.07Å; G115-I119 WeakPolarHBondContact O-CD1 3.1Å; G115-I119 WeakPolarHBondContact O-CG1 3.35Å; G115-I119 PolarHBondContact O-N 3.17Å; F116-I119 HydrophobicContact CD1-CD1 4.27Å; F116-I119 PolarHBondContact O-N 3.44Å; H117-I119 PolarHBondContact O-N 2.89Å; I119-L123 HydrophobicContact CG2-CD1 3.56Å; I119-L123 HydrophobicContact CG2-CG 4.33Å; I119-L123 VanDerWaalsContact O-CB 3.28Å; I119-L123 WeakPolarHBondContact O-CB 3.42Å; I119-L123 VanDerWaalsContact O-CG 3.27Å; I119-L123 WeakPolarHBondContact O-CG 3.16Å; I119-L123 PolarHBondContact O-N 3.47Å; I119-I399 HydrophobicContact CG1-CG2 4.09Å; I119-I399 HydrophobicContact CG2-CG2 4.47Å
120	I	90.6	Very high	88.5	Confident	12 Å²	12	49.7 Å²	49.7	6%	0.062	24%	0.235	C	C	.	.	H	α-helix	trans	-63.1	-48.9	-178.2	-68.6	164.9	0	0	0	110.1	T81 F116 H117 E122 L123 N124 Y158	T81-I120 HydrophobicContact CG2-CD1 3.88Å; T81-I120 HydrophobicContact CG2-CG1 3.95Å; F116-I120 WeakPolarHBondContact O-CB 2.76Å; F116-I120 VanDerWaalsContact O-CG1 3.25Å; F116-I120 WeakPolarHBondContact O-CG1 3.49Å; F116-I120 PolarHBondContact O-N 3.48Å; H117-I120 PolarHBondContact O-N 2.85Å; I120-E122 PolarHBondContact O-N 3.13Å; I120-L123 PolarHBondContact O-N 2.91Å; I120-N124 WeakPolarHBondContact CG2-ND2 3.32Å; I120-N124 VanDerWaalsContact O-CB 3.3Å; I120-N124 WeakPolarHBondContact O-CB 3.43Å; I120-N124 PolarHBondContact O-N 2.86Å; I120-Y158 HydrophobicContact CD1-CD1 3.79Å; I120-Y158 HydrophobicContact CD1-CG 4.49Å
121	H	89.1	Confident	88.4	Confident	126 Å²	126	46.2 Å²	46.2	58%	0.583	22%	0.22	S	C	*	.	H	α-helix	trans	-59.8	-45.4	-178.8	178.4	-89.9	0	0	0	112.1	H117	H117-H121 VanDerWaalsContact O-CB 3.29Å; H117-H121 WeakPolarHBondContact O-CB 3.47Å; H117-H121 PolarHBondContact O-N 2.73Å
122	E	88.4	Confident	88	Confident	40 Å²	40	43.8 Å²	43.8	19%	0.187	21%	0.207	C	C	.	.	H	α-helix	trans	-77.3	-27.3	-177.6	-73.1	-76.4	150.2	0	0	113.5	Y118 I120 Q125 K398 I399	Y118-E122 HydrophobicContact CD1-CG 4.48Å; Y118-E122 HydrophobicContact CD2-CG 4.24Å; Y118-E122 HydrophobicContact CE1-CG 4.09Å; Y118-E122 HydrophobicContact CE2-CG 3.77Å; Y118-E122 WeakPolarHBondContact O-CB 3.45Å; Y118-E122 WeakPolarHBondContact O-CG 3.48Å; Y118-E122 PolarHBondContact O-N 3.44Å; Y118-E122 VanDerWaalsContact O-N 3.07Å; I120-E122 PolarHBondContact O-N 3.13Å; E122-Q125 PolarHBondContact O-NE2 2.88Å; E122-K398 WeakPolarHBondContact OE2-CE 3.4Å; E122-K398 IonicContact OE2-NZ 3.69Å; E122-K398 PolarHBondContact OE2-NZ 3.49Å; E122-I399 HydrophobicContact CB-CD1 3.17Å; E122-I399 HydrophobicContact CB-CG1 4.19Å; E122-I399 HydrophobicContact CG-CD1 4.12Å
123	L	87.5	Confident	87.5	Confident	5 Å²	5	45.3 Å²	45.3	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-81	-34.4	175.9	-73.9	175.2	0	0	0	112.8	L77 I119 I120 Q125 V132 I134 I399 L403	L77-L123 HydrophobicContact CD2-CD1 3.21Å; I119-L123 HydrophobicContact CG2-CD1 3.56Å; I119-L123 HydrophobicContact CG2-CG 4.33Å; I119-L123 VanDerWaalsContact O-CB 3.28Å; I119-L123 WeakPolarHBondContact O-CB 3.42Å; I119-L123 VanDerWaalsContact O-CG 3.27Å; I119-L123 WeakPolarHBondContact O-CG 3.16Å; I119-L123 PolarHBondContact O-N 3.47Å; I120-L123 PolarHBondContact O-N 2.91Å; L123-Q125 VanDerWaalsContact C-N 3.3Å; L123-Q125 PolarHBondContact O-N 3.24Å; L123-V132 WeakPolarHBondContact O-CB 3.34Å; L123-I134 HydrophobicContact CB-CD1 4.26Å; L123-I134 HydrophobicContact CD1-CD1 3.94Å; L123-I399 HydrophobicContact CD2-CD1 4.16Å; L123-I399 HydrophobicContact CG-CD1 3.88Å; L123-L403 HydrophobicContact CD1-CD2 3.67Å; L123-L403 HydrophobicContact CD2-CD2 3.97Å; L123-L403 HydrophobicContact CG-CD2 4.46Å
124	N	86.9	Confident	87	Confident	66 Å²	66	45.2 Å²	45.2	35%	0.353	22%	0.218	S	C	.	.			trans	-66.2	89.9	177.3	-82.6	-18.6	0	0	0	110.5	I120 S133 I134	I120-N124 WeakPolarHBondContact CG2-ND2 3.32Å; I120-N124 VanDerWaalsContact O-CB 3.3Å; I120-N124 WeakPolarHBondContact O-CB 3.43Å; I120-N124 PolarHBondContact O-N 2.86Å; N124-S133 WeakPolarHBondContact OD1-CA 3.39Å; N124-I134 PolarHBondContact ND2-O 3.48Å; N124-I134 PolarHBondContact OD1-N 2.91Å; N124-I134 PolarHBondContact OD1-O 2.97Å
125	Q	81.5	Confident	86.5	Confident	49 Å²	49	44.1 Å²	44.1	23%	0.229	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130.6	-176.5	-66.8	-177.9	22.1	0	0	109.3	E122 L123 K131 V132	E122-Q125 PolarHBondContact O-NE2 2.88Å; L123-Q125 VanDerWaalsContact C-N 3.3Å; L123-Q125 PolarHBondContact O-N 3.24Å; Q125-K131 CarbonylContact O-C 3.57Å; Q125-K131 VanDerWaalsContact O-CA 3.28Å; Q125-K131 WeakPolarHBondContact O-CA 3.32Å; Q125-V132 PolarHBondContact N-O 3.37Å; Q125-V132 PolarHBondContact O-N 3.43Å
126	K	84.4	Confident	86.1	Confident	157 Å²	157	44.2 Å²	44.2	68%	0.683	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-123.9	85.3	174.9	-168.5	179.1	-178	-176.9	0	109.3	K131	K126-K131 HydrophobicContact CG-CG 4.44Å
127	T	82.2	Confident	85.8	Confident	49 Å²	49	44.2 Å²	44.2	30%	0.301	22%	0.215	S	C	.	.			trans	-116.8	174.6	176.2	64.9	0	0	0	0	110.9	D129 L130 K266	T127-D129 VanDerWaalsContact C-N 3.34Å; T127-D129 PolarHBondContact O-N 3.36Å; T127-L130 CarbonylContact C-O 3.57Å; T127-L130 WeakPolarHBondContact CA-O 3.43Å; T127-L130 PolarHBondContact N-O 3.41Å; T127-L130 PolarHBondContact OG1-N 2.88Å; T127-L130 PolarHBondContact OG1-O 2.98Å; T127-K266 VanDerWaalsContact CB-NZ 3.32Å; T127-K266 PolarHBondContact OG1-NZ 3.44Å
128	Q	75.8	Confident	85.5	Confident	159 Å²	159	40.9 Å²	40.9	74%	0.743	20%	0.199	S	C	*	.	S	Bend	trans	-62.2	-41.3	-177	-174.5	171	-0.9	0	0	112.4
129	D	80.9	Confident	85.4	Confident	45 Å²	45	39.6 Å²	39.6	24%	0.241	19%	0.194	C	C	.	.	S	Bend	trans	-102.9	-9.9	-173.4	-49.8	-48.9	0	0	0	114.2	T127 A212 R213 H265	T127-D129 VanDerWaalsContact C-N 3.34Å; T127-D129 PolarHBondContact O-N 3.36Å; D129-A212 VanDerWaalsContact O-CA 3.31Å; D129-A212 WeakPolarHBondContact O-CA 3.19Å; D129-R213 PolarHBondContact O-N 2.89Å; D129-R213 IonicContact OD1-CZ 3.72Å; D129-R213 IonicContact OD1-NE 3.73Å; D129-H265 HydrophobicContact CB-CB 3.85Å
130	L	83.9	Confident	85.2	Confident	3 Å²	3	39.6 Å²	39.6	2%	0.016	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	123.2	178.1	178.1	65.5	0	0	0	110.1	T127 V132 F210 R211 A212 K266 I268	T127-L130 CarbonylContact C-O 3.57Å; T127-L130 WeakPolarHBondContact CA-O 3.43Å; T127-L130 PolarHBondContact N-O 3.41Å; T127-L130 PolarHBondContact OG1-N 2.88Å; T127-L130 PolarHBondContact OG1-O 2.98Å; L130-V132 HydrophobicContact CD1-CG2 3.57Å; L130-V132 HydrophobicContact CD2-CG2 4.42Å; L130-V132 HydrophobicContact CG-CG2 3.96Å; L130-F210 HydrophobicContact CD1-CD2 4.46Å; L130-F210 HydrophobicContact CD1-CE2 3.84Å; L130-R211 CarbonylContact C-O 3.6Å; L130-R211 WeakPolarHBondContact CA-O 3.33Å; L130-A212 HydrophobicContact CD1-CB 3.57Å; L130-K266 HydrophobicContact CB-CD 4.29Å; L130-K266 HydrophobicContact CD2-CB 4.4Å; L130-K266 HydrophobicContact CD2-CD 4.21Å; L130-I268 HydrophobicContact CD1-CG1 3.99Å; L130-I268 HydrophobicContact CD2-CG1 3.91Å
131	K	86.4	Confident	85.1	Confident	64 Å²	64	39.8 Å²	39.8	28%	0.278	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	111.9	171	-63.4	-179.5	-176.3	176.1	0	108.6	Q125 K126 F209 R211	Q125-K131 CarbonylContact O-C 3.57Å; Q125-K131 VanDerWaalsContact O-CA 3.28Å; Q125-K131 WeakPolarHBondContact O-CA 3.32Å; K126-K131 HydrophobicContact CG-CG 4.44Å; K131-F209 HydrophobicContact CB-CE1 4.24Å; K131-R211 HydrophobicContact CB-CB 4.21Å; K131-R211 PolarHBondContact N-O 3.36Å; K131-R211 PolarHBondContact O-N 2.83Å
132	V	84.6	Confident	84.9	Confident	7 Å²	7	41.4 Å²	41.4	4%	0.042	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.8	170.7	-170.9	0	0	0	0	107	L123 Q125 L130 I134 F209 F210	L123-V132 WeakPolarHBondContact O-CB 3.34Å; Q125-V132 PolarHBondContact N-O 3.37Å; Q125-V132 PolarHBondContact O-N 3.43Å; L130-V132 HydrophobicContact CD1-CG2 3.57Å; L130-V132 HydrophobicContact CD2-CG2 4.42Å; L130-V132 HydrophobicContact CG-CG2 3.96Å; V132-I134 HydrophobicContact CG1-CG1 4.37Å; V132-F209 WeakPolarHBondContact CA-O 3.44Å; V132-F210 HydrophobicContact CG2-CD2 3.76Å; V132-F210 HydrophobicContact CG2-CE2 4.2Å
133	S	82.8	Confident	84.8	Confident	33 Å²	33	41.8 Å²	41.8	23%	0.231	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	112.9	177.8	-177.9	0	0	0	0	108.3	N124 I208 F209	N124-S133 WeakPolarHBondContact OD1-CA 3.39Å; S133-I208 CarbonylContact O-C 3.56Å; S133-I208 WeakPolarHBondContact O-CA 3.36Å; S133-F209 PolarHBondContact N-O 3.24Å; S133-F209 PolarHBondContact O-N 2.95Å
134	I	84.9	Confident	84.6	Confident	5 Å²	5	42 Å²	42	3%	0.026	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	127.3	172.8	-58.9	170.5	0	0	0	106.1	L77 L123 N124 V132 Y207 I208	L77-I134 HydrophobicContact CD2-CD1 3.63Å; L77-I134 HydrophobicContact CG-CD1 4.35Å; L123-I134 HydrophobicContact CB-CD1 4.26Å; L123-I134 HydrophobicContact CD1-CD1 3.94Å; N124-I134 PolarHBondContact ND2-O 3.48Å; N124-I134 PolarHBondContact OD1-N 2.91Å; N124-I134 PolarHBondContact OD1-O 2.97Å; V132-I134 HydrophobicContact CG1-CG1 4.37Å; I134-Y207 WeakPolarHBondContact CA-O 3.07Å; I134-I208 HydrophobicContact CD1-CD1 4.01Å; I134-I208 HydrophobicContact CG1-CB 4.31Å; I134-I208 HydrophobicContact CG1-CD1 3.81Å; I134-I208 HydrophobicContact CG1-CG1 3.78Å
135	G	81.7	Confident	84.6	Confident	6 Å²	6	47.1 Å²	47.1	6%	0.062	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	151.2	-179.9	0	0	0	0	0	112.4	N206 Y207	G135-N206 PolarHBondContact O-ND2 3.18Å; G135-Y207 PolarHBondContact N-O 2.98Å; G135-Y207 VanDerWaalsContact N-O 3.12Å; G135-Y207 PolarHBondContact O-N 2.71Å
136	N	85.1	Confident	84.9	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	140	173.9	-55.2	-70.6	0	0	0	108.1	L85 A160 E161 N206	L85-N136 HydrophobicContact CD1-CB 3.81Å; N136-A160 HydrophobicContact CB-CB 4.12Å; N136-A160 WeakPolarHBondContact O-CA 3.2Å; N136-E161 PolarHBondContact O-N 3.42Å; N136-E161 VanDerWaalsContact O-N 3.15Å; N136-N206 PolarHBondContact OD1-ND2 2.5Å
137	T	87.7	Confident	85.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	130.9	175.8	-54.2	0	0	0	0	109.6	F139 E161 I163 F180 T205	T137-F139 HydrophobicContact CG2-CD2 4.17Å; T137-F139 HydrophobicContact CG2-CE1 4.28Å; T137-F139 HydrophobicContact CG2-CE2 3.62Å; T137-F139 HydrophobicContact CG2-CZ 3.69Å; T137-E161 CarbonylContact C-O 3.58Å; T137-E161 VanDerWaalsContact CA-O 3.3Å; T137-E161 WeakPolarHBondContact CA-O 3.48Å; T137-E161 HydrophobicContact CG2-CB 4.21Å; T137-E161 WeakPolarHBondContact CG2-O 3.46Å; T137-I163 HydrophobicContact CG2-CD1 3.7Å; T137-I163 HydrophobicContact CG2-CG1 4.07Å; T137-F180 HydrophobicContact CG2-CD1 4.42Å; T137-F180 HydrophobicContact CG2-CE1 3.7Å; T137-F180 HydrophobicContact CG2-CZ 3.88Å; T137-F180 VanDerWaalsContact OG1-CE1 3.23Å; T137-F180 WeakPolarHBondContact OG1-CE1 3.1Å; T137-T205 WeakPolarHBondContact CB-OG1 3.2Å; T137-T205 PolarHBondContact N-O 3.27Å; T137-T205 PolarHBondContact O-N 3.15Å; T137-T205 PolarHBondContact O-OG1 2.82Å
138	L	87.3	Confident	85.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	111.9	176.3	-69.7	174	0	0	0	108.9	L85 I140 F150 A154 E161 T162 I163 M202 L204	L85-L138 HydrophobicContact CD2-CD1 3.97Å; L85-L138 HydrophobicContact CD2-CD2 4.23Å; L85-L138 HydrophobicContact CD2-CG 4.37Å; L138-I140 HydrophobicContact CB-CD1 4.44Å; L138-I140 HydrophobicContact CB-CG1 4.26Å; L138-F150 HydrophobicContact CD1-CE1 3.58Å; L138-F150 HydrophobicContact CD1-CZ 3.61Å; L138-A154 HydrophobicContact CD1-CB 4.36Å; L138-E161 PolarHBondContact N-O 3.33Å; L138-T162 CarbonylContact O-C 3.39Å; L138-T162 WeakPolarHBondContact O-CA 3.2Å; L138-I163 PolarHBondContact O-N 3.4Å; L138-M202 HydrophobicContact CD2-SD 4.48Å; L138-L204 HydrophobicContact CD2-CB 4.33Å; L138-L204 HydrophobicContact CD2-CD1 3.71Å
139	F	89.8	Confident	86.7	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.018	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	109.9	168.9	-62.5	-87.4	0	0	0	108.2	T137 I163 T165 F167 I177 F180 M202 L203 T205	T137-F139 HydrophobicContact CG2-CD2 4.17Å; T137-F139 HydrophobicContact CG2-CE1 4.28Å; T137-F139 HydrophobicContact CG2-CE2 3.62Å; T137-F139 HydrophobicContact CG2-CZ 3.69Å; F139-I163 WeakPolarHBondContact CA-O 3.48Å; F139-I163 HydrophobicContact CD1-CB 3.83Å; F139-I163 HydrophobicContact CD1-CD1 4.44Å; F139-I163 HydrophobicContact CD1-CG2 3.99Å; F139-I163 HydrophobicContact CE1-CB 4.01Å; F139-I163 HydrophobicContact CE1-CD1 3.75Å; F139-I163 HydrophobicContact CE1-CG1 4.41Å; F139-I163 HydrophobicContact CE1-CG2 4.08Å; F139-I163 HydrophobicContact CZ-CD1 4.18Å; F139-T165 WeakPolarHBondContact CD1-OG1 3.41Å; F139-F167 HydrophobicContact CB-CZ 3.94Å; F139-I177 HydrophobicContact CB-CD1 4.45Å; F139-I177 HydrophobicContact CD1-CD1 4.37Å; F139-I177 HydrophobicContact CD1-CG1 3.74Å; F139-I177 HydrophobicContact CD2-CD1 4.27Å; F139-I177 HydrophobicContact CD2-CG1 4.03Å; F139-I177 HydrophobicContact CD2-CG2 4.24Å; F139-I177 HydrophobicContact CE1-CB 4.43Å; F139-I177 HydrophobicContact CE1-CG1 3.72Å; F139-I177 HydrophobicContact CE2-CB 4.34Å; F139-I177 HydrophobicContact CE2-CG1 4.02Å; F139-I177 HydrophobicContact CE2-CG2 3.69Å; F139-I177 HydrophobicContact CG-CD1 4.11Å; F139-I177 HydrophobicContact CG-CG1 3.9Å; F139-I177 HydrophobicContact CZ-CB 4.16Å; F139-I177 HydrophobicContact CZ-CG1 3.86Å; F139-I177 HydrophobicContact CZ-CG2 3.89Å; F139-F180 HydrophobicContact CZ-CB 4.39Å; F139-F180 AromaticContact CZ-CD1 3.89Å; F139-F180 HydrophobicContact CZ-CD1 3.89Å; F139-F180 HydrophobicContact CZ-CE1 4.42Å; F139-F180 HydrophobicContact CZ-CG 4.18Å; F139-M202 CarbonylContact O-C 3.59Å; F139-M202 VanDerWaalsContact O-CA 3.29Å; F139-M202 WeakPolarHBondContact O-CA 3.32Å; F139-L203 HydrophobicContact CB-CB 4.24Å; F139-L203 HydrophobicContact CD2-CD2 4.42Å; F139-L203 PolarHBondContact N-O 2.88Å; F139-L203 PolarHBondContact O-N 2.96Å; F139-T205 HydrophobicContact CD2-CG2 4.09Å; F139-T205 HydrophobicContact CE2-CG2 3.78Å; F139-T205 WeakPolarHBondContact CE2-OG1 3.39Å
140	I	87.3	Confident	87.3	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	136.1	-176.4	-58.3	-177.2	0	0	0	108.8	L138 R142 L144 P146 T162 I163 L164 T165 M202	L138-I140 HydrophobicContact CB-CD1 4.44Å; L138-I140 HydrophobicContact CB-CG1 4.26Å; I140-R142 PolarHBondContact O-N 2.94Å; I140-L144 HydrophobicContact CG2-CB 3.75Å; I140-L144 HydrophobicContact CG2-CD1 4.06Å; I140-P146 HydrophobicContact CD1-CB 4.06Å; I140-P146 HydrophobicContact CD1-CG 4.07Å; I140-T162 HydrophobicContact CD1-CG2 3.62Å; I140-T162 HydrophobicContact CG1-CG2 4.11Å; I140-I163 PolarHBondContact N-O 2.91Å; I140-L164 CarbonylContact O-C 3.54Å; I140-L164 WeakPolarHBondContact O-CA 3.29Å; I140-T165 PolarHBondContact O-N 3.2Å; I140-M202 HydrophobicContact CG1-CG 4.35Å
141	D	87.9	Confident	87.7	Confident	16 Å²	16	47.9 Å²	47.9	9%	0.086	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	138.5	176.6	-169.4	-102.5	0	0	0	111.3	G143 L144 T165 F167 V201	D141-G143 PolarHBondContact O-N 3.37Å; D141-G143 VanDerWaalsContact O-N 3.14Å; D141-G143 WeakPolarHBondContact OD1-CA 3.23Å; D141-G143 PolarHBondContact OD1-N 3.22Å; D141-L144 HydrophobicContact CB-CD1 4.17Å; D141-L144 WeakPolarHBondContact O-CB 3.38Å; D141-L144 PolarHBondContact O-N 3.01Å; D141-T165 CarbonylContact C-O 3.6Å; D141-T165 VanDerWaalsContact CA-O 3.31Å; D141-T165 WeakPolarHBondContact CA-O 3.26Å; D141-F167 HydrophobicContact CB-CD2 3.78Å; D141-F167 HydrophobicContact CB-CE2 4.36Å; D141-F167 PolarHBondContact OD2-N 3.01Å; D141-V201 HydrophobicContact CB-CB 4.29Å; D141-V201 WeakPolarHBondContact CB-O 3.48Å; D141-V201 PolarHBondContact N-O 2.66Å
142	R	86.6	Confident	88.1	Confident	160 Å²	160	48.6 Å²	48.6	60%	0.604	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-24.4	178.6	-72.9	167.7	-174	-163.2	2.3	113.6	I140 L144 L164 T165	I140-R142 PolarHBondContact O-N 2.94Å; R142-L144 VanDerWaalsContact C-N 3.26Å; R142-L164 HydrophobicContact CG-CB 3.89Å; R142-L164 PolarHBondContact NE-O 3.29Å; R142-T165 PolarHBondContact N-O 3.15Å
143	G	85	Confident	88.6	Confident	47 Å²	47	50 Å²	50	49%	0.485	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-3.8	175.3	0	0	0	0	0	114.1	D141	D141-G143 PolarHBondContact O-N 3.37Å; D141-G143 VanDerWaalsContact O-N 3.14Å; D141-G143 WeakPolarHBondContact OD1-CA 3.23Å; D141-G143 PolarHBondContact OD1-N 3.22Å
144	L	84.8	Confident	89.1	Confident	11 Å²	11	48.4 Å²	48.4	6%	0.058	23%	0.23	C	C	.	.			trans	-96.4	138.2	173.3	-82.3	163.4	0	0	0	111.2	I140 D141 R142 P146 V201 A342 R345 L347	I140-L144 HydrophobicContact CG2-CB 3.75Å; I140-L144 HydrophobicContact CG2-CD1 4.06Å; D141-L144 HydrophobicContact CB-CD1 4.17Å; D141-L144 WeakPolarHBondContact O-CB 3.38Å; D141-L144 PolarHBondContact O-N 3.01Å; R142-L144 VanDerWaalsContact C-N 3.26Å; L144-P146 VanDerWaalsContact O-CD 3.31Å; L144-P146 WeakPolarHBondContact O-CD 3.47Å; L144-V201 HydrophobicContact CD1-CB 3.66Å; L144-V201 HydrophobicContact CD1-CG2 4.03Å; L144-V201 VanDerWaalsContact CD1-O 3.26Å; L144-V201 WeakPolarHBondContact CD1-O 3.35Å; L144-A342 HydrophobicContact CD2-CB 3.67Å; L144-R345 HydrophobicContact CD2-CB 4.47Å; L144-L347 HydrophobicContact CD1-CD2 3.84Å; L144-L347 HydrophobicContact CD2-CD1 4.41Å; L144-L347 HydrophobicContact CD2-CD2 3.84Å; L144-L347 HydrophobicContact CG-CD2 4.49Å
145	Q	85.6	Confident	89.5	Confident	172 Å²	172	54.1 Å²	54.1	80%	0.804	26%	0.257	S	S	*	.			trans	-107	93.5	168.9	-67.4	-175.7	-0.2	0	0	108
146	P	88.5	Confident	90.1	Very high	34 Å²	34	58.7 Å²	58.7	22%	0.221	28%	0.28	C	S	.	.			trans	-66.3	148.2	178.5	28.4	-34.4	0	0	0	110.4	I140 L144 R148 V151 I341	I140-P146 HydrophobicContact CD1-CB 4.06Å; I140-P146 HydrophobicContact CD1-CG 4.07Å; L144-P146 VanDerWaalsContact O-CD 3.31Å; L144-P146 WeakPolarHBondContact O-CD 3.47Å; P146-R148 PolarHBondContact O-N 2.95Å; P146-V151 HydrophobicContact CB-CG2 3.86Å; P146-V151 HydrophobicContact CG-CG2 3.76Å; P146-I341 CarbonylContact C-O 3.57Å; P146-I341 WeakPolarHBondContact CA-O 3.46Å; P146-I341 HydrophobicContact CB-CG2 4.42Å
147	Q	92.1	Very high	90.5	Very high	71 Å²	71	61 Å²	61	33%	0.332	29%	0.29	S	S	.	.			trans	-60.3	131.9	174.2	-64	-159.7	25.4	0	0	109.6	K149 F150 V151 T339 K340 I341 P343	Q147-K149 PolarHBondContact O-N 2.8Å; Q147-F150 HydrophobicContact CB-CB 4.44Å; Q147-F150 WeakPolarHBondContact O-CB 3.24Å; Q147-F150 PolarHBondContact O-N 2.84Å; Q147-V151 PolarHBondContact O-N 3.05Å; Q147-T339 PolarHBondContact NE2-O 2.97Å; Q147-K340 VanDerWaalsContact CB-O 3.3Å; Q147-K340 WeakPolarHBondContact CB-O 3.46Å; Q147-K340 VanDerWaalsContact CD-O 3.27Å; Q147-K340 WeakPolarHBondContact CG-O 3.28Å; Q147-I341 PolarHBondContact N-O 2.74Å; Q147-P343 HydrophobicContact CG-CG 3.91Å
148	R	92.6	Very high	90.7	Very high	193 Å²	193	61.1 Å²	61.1	73%	0.728	29%	0.291	S	S	*	.	H	α-helix	trans	-53.4	-43.4	-180	-179.1	175.5	172.2	161.2	4.2	112.4	P146 F150 V151 E152	P146-R148 PolarHBondContact O-N 2.95Å; R148-F150 VanDerWaalsContact C-N 3.34Å; R148-F150 PolarHBondContact O-N 2.88Å; R148-V151 PolarHBondContact O-N 2.84Å; R148-E152 HydrophobicContact CG-CG 4.27Å; R148-E152 IonicContact CZ-OE1 2.57Å; R148-E152 VanDerWaalsContact CZ-OE1 3.29Å; R148-E152 IonicContact NE-OE1 3.14Å; R148-E152 PolarHBondContact NE-OE1 3.46Å; R148-E152 IonicContact NE-OE2 2.66Å; R148-E152 IonicContact NH2-OE1 2.95Å; R148-E152 PolarHBondContact NH2-OE1 2.68Å; R148-E152 WeakPolarHBondContact O-CG 3.43Å; R148-E152 PolarHBondContact O-N 3.45Å
149	K	94.4	Very high	90.9	Very high	141 Å²	141	63.6 Å²	63.6	61%	0.613	32%	0.316	S	S	*	.	H	α-helix	trans	-58.4	-44.1	178.6	-176.2	177.6	178.2	-174.3	0	112.3	Q147 V151 E152 D153	Q147-K149 PolarHBondContact O-N 2.8Å; K149-V151 PolarHBondContact O-N 3.46Å; K149-E152 PolarHBondContact O-N 3.43Å; K149-D153 WeakPolarHBondContact CE-OD2 3.38Å; K149-D153 WeakPolarHBondContact CG-OD2 3.49Å; K149-D153 VanDerWaalsContact O-CB 3.31Å; K149-D153 WeakPolarHBondContact O-CB 3.16Å; K149-D153 VanDerWaalsContact O-CG 3.27Å; K149-D153 PolarHBondContact O-N 3.32Å
150	F	93.6	Very high	91	Very high	5 Å²	5	63.6 Å²	63.6	2%	0.022	32%	0.317	C	S	.	.	H	α-helix	trans	-62.1	-44.6	178.6	168.9	-102.4	0	0	0	111.8	L85 L88 L138 Q147 R148 A154 I341	L85-F150 HydrophobicContact CD2-CE2 4.1Å; L85-F150 HydrophobicContact CD2-CZ 3.99Å; L88-F150 HydrophobicContact CB-CD2 3.82Å; L88-F150 HydrophobicContact CB-CE2 4.09Å; L138-F150 HydrophobicContact CD1-CE1 3.58Å; L138-F150 HydrophobicContact CD1-CZ 3.61Å; Q147-F150 HydrophobicContact CB-CB 4.44Å; Q147-F150 WeakPolarHBondContact O-CB 3.24Å; Q147-F150 PolarHBondContact O-N 2.84Å; R148-F150 VanDerWaalsContact C-N 3.34Å; R148-F150 PolarHBondContact O-N 2.88Å; F150-A154 WeakPolarHBondContact O-CB 3.47Å; F150-A154 PolarHBondContact O-N 2.83Å; F150-I341 HydrophobicContact CD1-CB 4.47Å; F150-I341 HydrophobicContact CD1-CG1 4.2Å; F150-I341 HydrophobicContact CD1-CG2 4.07Å; F150-I341 HydrophobicContact CD2-CG1 4.05Å; F150-I341 HydrophobicContact CE1-CD1 4.15Å; F150-I341 HydrophobicContact CE1-CG1 4.05Å; F150-I341 HydrophobicContact CE1-CG2 3.96Å; F150-I341 HydrophobicContact CE2-CD1 4.01Å; F150-I341 HydrophobicContact CE2-CG1 3.91Å; F150-I341 HydrophobicContact CG-CG1 4.19Å; F150-I341 HydrophobicContact CZ-CD1 3.73Å; F150-I341 HydrophobicContact CZ-CG1 3.9Å
151	V	92.6	Very high	91.1	Very high	35 Å²	35	67.3 Å²	67.3	21%	0.212	33%	0.334	C	S	.	.	H	α-helix	trans	-64.8	-46.2	179	-179.6	0	0	0	0	111	P146 Q147 R148 K149 A154 E155	P146-V151 HydrophobicContact CB-CG2 3.86Å; P146-V151 HydrophobicContact CG-CG2 3.76Å; Q147-V151 PolarHBondContact O-N 3.05Å; R148-V151 PolarHBondContact O-N 2.84Å; K149-V151 PolarHBondContact O-N 3.46Å; V151-A154 PolarHBondContact O-N 3.47Å; V151-E155 PolarHBondContact O-N 3.36Å
152	E	94.9	Very high	91.1	Very high	78 Å²	78	68.8 Å²	68.8	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-62.2	-45.4	177.8	-72.7	176.6	167.7	0	0	111.6	R148 K149 E155 N156	R148-E152 HydrophobicContact CG-CG 4.27Å; R148-E152 IonicContact CZ-OE1 2.57Å; R148-E152 VanDerWaalsContact CZ-OE1 3.29Å; R148-E152 IonicContact NE-OE1 3.14Å; R148-E152 PolarHBondContact NE-OE1 3.46Å; R148-E152 IonicContact NE-OE2 2.66Å; R148-E152 IonicContact NH2-OE1 2.95Å; R148-E152 PolarHBondContact NH2-OE1 2.68Å; R148-E152 WeakPolarHBondContact O-CG 3.43Å; R148-E152 PolarHBondContact O-N 3.45Å; K149-E152 PolarHBondContact O-N 3.43Å; E152-E155 PolarHBondContact O-N 2.8Å; E152-N156 VanDerWaalsContact O-CB 3.24Å; E152-N156 WeakPolarHBondContact O-CB 3.3Å; E152-N156 PolarHBondContact O-N 2.99Å; E152-N156 PolarHBondContact O-ND2 3.11Å
153	D	95.3	Very high	91.3	Very high	36 Å²	36	63.5 Å²	63.5	19%	0.193	33%	0.327	C	S	.	.	H	α-helix	trans	-67	-37.5	178.3	-71.6	-20.7	0	0	0	111.7	L88 K149 F157	L88-D153 HydrophobicContact CD1-CB 3.76Å; L88-D153 HydrophobicContact CD2-CB 3.92Å; L88-D153 HydrophobicContact CG-CB 4.4Å; K149-D153 WeakPolarHBondContact CE-OD2 3.38Å; K149-D153 WeakPolarHBondContact CG-OD2 3.49Å; K149-D153 VanDerWaalsContact O-CB 3.31Å; K149-D153 WeakPolarHBondContact O-CB 3.16Å; K149-D153 VanDerWaalsContact O-CG 3.27Å; K149-D153 PolarHBondContact O-N 3.32Å; D153-F157 HydrophobicContact CB-CD2 4.07Å; D153-F157 HydrophobicContact CB-CE2 4.26Å; D153-F157 WeakPolarHBondContact O-CB 3.22Å; D153-F157 WeakPolarHBondContact O-CD2 3.47Å; D153-F157 PolarHBondContact O-N 3.35Å
154	A	94.1	Very high	91.5	Very high	0 Å²	0	66 Å²	66	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-64.9	-41.9	176.2	0	0	0	0	0	111.8	L85 L88 L138 F150 V151 Y158 A160	L85-A154 HydrophobicContact CD1-CB 4.44Å; L85-A154 HydrophobicContact CD2-CB 4.18Å; L85-A154 HydrophobicContact CG-CB 4.24Å; L88-A154 HydrophobicContact CD1-CB 4.43Å; L138-A154 HydrophobicContact CD1-CB 4.36Å; F150-A154 WeakPolarHBondContact O-CB 3.47Å; F150-A154 PolarHBondContact O-N 2.83Å; V151-A154 PolarHBondContact O-N 3.47Å; A154-Y158 WeakPolarHBondContact O-CA 3.4Å; A154-Y158 VanDerWaalsContact O-CB 3.31Å; A154-Y158 WeakPolarHBondContact O-CB 3.35Å; A154-Y158 PolarHBondContact O-N 3.15Å; A154-Y158 VanDerWaalsContact O-N 3.15Å; A154-A160 HydrophobicContact CB-CB 4.17Å; A154-A160 VanDerWaalsContact O-CB 3.32Å; A154-A160 WeakPolarHBondContact O-CB 3.19Å; A154-A160 PolarHBondContact O-N 3.46Å
155	E	93.6	Very high	91.7	Very high	126 Å²	126	65.6 Å²	65.6	59%	0.589	33%	0.327	S	S	*	.	H	α-helix	trans	-67.2	-49.5	175	-172.9	173.6	-177.6	0	0	111.1	V151 E152 G159	V151-E155 PolarHBondContact O-N 3.36Å; E152-E155 PolarHBondContact O-N 2.8Å; E155-G159 WeakPolarHBondContact O-CA 3.2Å; E155-G159 PolarHBondContact O-N 3.44Å
156	N	93.2	Very high	91.9	Very high	101 Å²	101	60.5 Å²	60.5	54%	0.54	31%	0.305	S	S	.	.	H	α-helix	trans	-66	-50.1	-174.7	-72	-32.6	0	0	0	112.9	H117 E152	H117-N156 PolarHBondContact CE1-O 2.93Å; H117-N156 PolarHBondContact ND1-O 3.25Å; E152-N156 VanDerWaalsContact O-CB 3.24Å; E152-N156 WeakPolarHBondContact O-CB 3.3Å; E152-N156 PolarHBondContact O-N 2.99Å; E152-N156 PolarHBondContact O-ND2 3.11Å
157	F	93.1	Very high	91.9	Very high	51 Å²	51	59.3 Å²	59.3	22%	0.224	30%	0.296	C	S	.	.	H	α-helix	trans	-83.6	-32.1	-175.4	-67.1	-64.2	0	0	0	113	H113 E114 H117 D153	H113-F157 HydrophobicContact CB-CB 4.27Å; H113-F157 HydrophobicContact CB-CD1 3.94Å; H113-F157 HydrophobicContact CB-CD2 3.95Å; H113-F157 HydrophobicContact CB-CE1 4.25Å; H113-F157 HydrophobicContact CB-CE2 4.26Å; H113-F157 HydrophobicContact CB-CG 3.79Å; H113-F157 HydrophobicContact CB-CZ 4.4Å; E114-F157 HydrophobicContact CG-CE1 3.9Å; H117-F157 WeakPolarHBondContact CA-O 3.39Å; H117-F157 HydrophobicContact CB-CB 4.43Å; H117-F157 HydrophobicContact CB-CD1 4.1Å; H117-F157 VanDerWaalsContact CB-O 3.28Å; H117-F157 WeakPolarHBondContact CB-O 3.37Å; D153-F157 HydrophobicContact CB-CD2 4.07Å; D153-F157 HydrophobicContact CB-CE2 4.26Å; D153-F157 WeakPolarHBondContact O-CB 3.22Å; D153-F157 WeakPolarHBondContact O-CD2 3.47Å; D153-F157 PolarHBondContact O-N 3.35Å
158	Y	93.4	Very high	91.7	Very high	2 Å²	2	63.7 Å²	63.7	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-115.3	-3.6	-170	-63.1	-87.2	0	0	0	114.3	T81 S84 L85 L88 H113 F116 I120 A154 A160	T81-Y158 WeakPolarHBondContact O-CE1 3.43Å; S84-Y158 WeakPolarHBondContact CB-OH 3.38Å; S84-Y158 PolarHBondContact O-OH 2.8Å; S84-Y158 PolarHBondContact OG-OH 3.14Å; L85-Y158 HydrophobicContact CB-CD1 4.01Å; L85-Y158 HydrophobicContact CB-CD2 3.96Å; L85-Y158 HydrophobicContact CB-CE1 4.19Å; L85-Y158 HydrophobicContact CB-CE2 4.14Å; L85-Y158 HydrophobicContact CB-CG 3.9Å; L85-Y158 HydrophobicContact CD1-CD2 4.44Å; L85-Y158 HydrophobicContact CD1-CG 4.09Å; L85-Y158 HydrophobicContact CG-CD2 3.94Å; L85-Y158 HydrophobicContact CG-CE2 4.48Å; L85-Y158 HydrophobicContact CG-CG 4.02Å; L88-Y158 HydrophobicContact CD1-CD2 4.02Å; L88-Y158 HydrophobicContact CD1-CE2 3.77Å; L88-Y158 HydrophobicContact CG-CE2 4.35Å; H113-Y158 AromaticContact ND1-CE2 3.68Å; H113-Y158 AromaticContact ND1-CZ 3.66Å; H113-Y158 PolarHBondContact ND1-OH 3.02Å; F116-Y158 HydrophobicContact CB-CD1 4.49Å; F116-Y158 HydrophobicContact CB-CE1 3.75Å; F116-Y158 HydrophobicContact CD2-CE1 4.33Å; F116-Y158 HydrophobicContact CG-CE1 4.16Å; I120-Y158 HydrophobicContact CD1-CD1 3.79Å; I120-Y158 HydrophobicContact CD1-CG 4.49Å; A154-Y158 WeakPolarHBondContact O-CA 3.4Å; A154-Y158 VanDerWaalsContact O-CB 3.31Å; A154-Y158 WeakPolarHBondContact O-CB 3.35Å; A154-Y158 PolarHBondContact O-N 3.15Å; A154-Y158 VanDerWaalsContact O-N 3.15Å; Y158-A160 PolarHBondContact O-N 3.22Å
159	G	91.1	Very high	91.5	Very high	52 Å²	52	57.8 Å²	57.8	54%	0.536	30%	0.3	S	S	.	.			trans	57	30.3	-171.1	0	0	0	0	0	111.6	E155	E155-G159 WeakPolarHBondContact O-CA 3.2Å; E155-G159 PolarHBondContact O-N 3.44Å
160	A	91.3	Very high	91.3	Very high	4 Å²	4	53.6 Å²	53.6	3%	0.033	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-78.1	130.8	-171.2	0	0	0	0	0	111.3	L85 N136 A154 Y158	L85-A160 HydrophobicContact CD1-CB 3.52Å; N136-A160 HydrophobicContact CB-CB 4.12Å; N136-A160 WeakPolarHBondContact O-CA 3.2Å; A154-A160 HydrophobicContact CB-CB 4.17Å; A154-A160 VanDerWaalsContact O-CB 3.32Å; A154-A160 WeakPolarHBondContact O-CB 3.19Å; A154-A160 PolarHBondContact O-N 3.46Å; Y158-A160 PolarHBondContact O-N 3.22Å
161	E	89.6	Confident	91.1	Very high	78 Å²	78	61.7 Å²	61.7	36%	0.364	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	126.3	173.1	-74.6	168.8	-130	0	0	109.4	N136 T137 L138 F180 K184	N136-E161 PolarHBondContact O-N 3.42Å; N136-E161 VanDerWaalsContact O-N 3.15Å; T137-E161 CarbonylContact C-O 3.58Å; T137-E161 VanDerWaalsContact CA-O 3.3Å; T137-E161 WeakPolarHBondContact CA-O 3.48Å; T137-E161 HydrophobicContact CG2-CB 4.21Å; T137-E161 WeakPolarHBondContact CG2-O 3.46Å; L138-E161 PolarHBondContact N-O 3.33Å; E161-F180 WeakPolarHBondContact OE2-CE2 3.37Å; E161-F180 WeakPolarHBondContact OE2-CZ 3.43Å; E161-K184 IonicContact OE1-NZ 3.66Å; E161-K184 PolarHBondContact OE1-NZ 3.46Å; E161-K184 IonicContact OE2-NZ 3.99Å; E161-K184 PolarHBondContact OE2-NZ 3.33Å
162	T	88	Confident	91.1	Very high	47 Å²	47	64.2 Å²	64.2	29%	0.288	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	118.7	174	-60.4	0	0	0	0	109.8	L138 I140	L138-T162 CarbonylContact O-C 3.39Å; L138-T162 WeakPolarHBondContact O-CA 3.2Å; I140-T162 HydrophobicContact CD1-CG2 3.62Å; I140-T162 HydrophobicContact CG1-CG2 4.11Å
163	I	90.3	Very high	91	Very high	50 Å²	50	60.6 Å²	60.6	26%	0.256	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	118.9	-174.6	-58.2	179.7	0	0	0	110.2	T137 L138 F139 I140 T165 F180	T137-I163 HydrophobicContact CG2-CD1 3.7Å; T137-I163 HydrophobicContact CG2-CG1 4.07Å; L138-I163 PolarHBondContact O-N 3.4Å; F139-I163 WeakPolarHBondContact CA-O 3.48Å; F139-I163 HydrophobicContact CD1-CB 3.83Å; F139-I163 HydrophobicContact CD1-CD1 4.44Å; F139-I163 HydrophobicContact CD1-CG2 3.99Å; F139-I163 HydrophobicContact CE1-CB 4.01Å; F139-I163 HydrophobicContact CE1-CD1 3.75Å; F139-I163 HydrophobicContact CE1-CG1 4.41Å; F139-I163 HydrophobicContact CE1-CG2 4.08Å; F139-I163 HydrophobicContact CZ-CD1 4.18Å; I140-I163 PolarHBondContact N-O 2.91Å; I163-T165 PolarHBondContact O-N 3.44Å; I163-T165 PolarHBondContact O-OG1 3.09Å; I163-T165 VanDerWaalsContact O-OG1 3.05Å; I163-F180 HydrophobicContact CD1-CD2 3.74Å; I163-F180 HydrophobicContact CD1-CE1 4.42Å; I163-F180 HydrophobicContact CD1-CE2 3.43Å; I163-F180 VanDerWaalsContact CD1-CE2 3.43Å; I163-F180 HydrophobicContact CD1-CG 4.33Å; I163-F180 HydrophobicContact CD1-CZ 3.8Å
164	L	88.7	Confident	90.8	Very high	98 Å²	98	61.1 Å²	61.1	51%	0.513	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	119	176.4	-65.8	-179	0	0	0	111.8	I140 R142	I140-L164 CarbonylContact O-C 3.54Å; I140-L164 WeakPolarHBondContact O-CA 3.29Å; R142-L164 HydrophobicContact CG-CB 3.89Å; R142-L164 PolarHBondContact NE-O 3.29Å
165	T	90.6	Very high	90.8	Very high	3 Å²	3	67.7 Å²	67.7	2%	0.018	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	149.5	-166.9	-55.4	0	0	0	0	110.5	F139 I140 D141 R142 I163 F167 T173	F139-T165 WeakPolarHBondContact CD1-OG1 3.41Å; I140-T165 PolarHBondContact O-N 3.2Å; D141-T165 CarbonylContact C-O 3.6Å; D141-T165 VanDerWaalsContact CA-O 3.31Å; D141-T165 WeakPolarHBondContact CA-O 3.26Å; R142-T165 PolarHBondContact N-O 3.15Å; I163-T165 PolarHBondContact O-N 3.44Å; I163-T165 PolarHBondContact O-OG1 3.09Å; I163-T165 VanDerWaalsContact O-OG1 3.05Å; T165-F167 HydrophobicContact CG2-CD2 4.33Å; T165-F167 HydrophobicContact CG2-CE1 4.25Å; T165-F167 HydrophobicContact CG2-CE2 4.09Å; T165-F167 HydrophobicContact CG2-CZ 4.04Å; T165-T173 HydrophobicContact CG2-CG2 3.26Å
166	N	89.4	Confident	90.7	Very high	65 Å²	65	66.2 Å²	66.2	35%	0.348	34%	0.337	S	S	.	.			trans	-103.7	90	175.6	178.9	11.4	0	0	0	110.6	Q168 N169 T173	N166-Q168 PolarHBondContact O-N 2.94Å; N166-Q168 VanDerWaalsContact O-N 3.08Å; N166-Q168 VanDerWaalsContact OD1-CB 3.27Å; N166-Q168 WeakPolarHBondContact OD1-CB 3.49Å; N166-Q168 WeakPolarHBondContact OD1-CG 3.42Å; N166-Q168 PolarHBondContact OD1-N 3.38Å; N166-Q168 VanDerWaalsContact OD1-N 3.16Å; N166-N169 PolarHBondContact O-N 3.48Å; N166-T173 PolarHBondContact O-OG1 3.45Å
167	F	88.4	Confident	90.6	Very high	9 Å²	9	61.4 Å²	61.4	4%	0.039	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-1.2	-177.6	-70.2	-79.1	0	0	0	114.2	F139 D141 T165 N169 L170 T173 I177 I196 T200 L203	F139-F167 HydrophobicContact CB-CZ 3.94Å; D141-F167 HydrophobicContact CB-CD2 3.78Å; D141-F167 HydrophobicContact CB-CE2 4.36Å; D141-F167 PolarHBondContact OD2-N 3.01Å; T165-F167 HydrophobicContact CG2-CD2 4.33Å; T165-F167 HydrophobicContact CG2-CE1 4.25Å; T165-F167 HydrophobicContact CG2-CE2 4.09Å; T165-F167 HydrophobicContact CG2-CZ 4.04Å; F167-N169 VanDerWaalsContact C-N 3.27Å; F167-N169 PolarHBondContact O-N 3Å; F167-L170 WeakPolarHBondContact O-CD2 3.23Å; F167-T173 HydrophobicContact CD1-CG2 3.78Å; F167-T173 HydrophobicContact CE1-CG2 3.8Å; F167-I177 HydrophobicContact CE1-CD1 4.44Å; F167-I196 HydrophobicContact CD1-CG2 4.04Å; F167-I196 HydrophobicContact CE1-CG2 4.32Å; F167-T200 WeakPolarHBondContact CB-O 3.18Å; F167-T200 HydrophobicContact CD1-CG2 3.85Å; F167-T200 HydrophobicContact CE1-CG2 3.68Å; F167-T200 HydrophobicContact CG-CG2 4.43Å; F167-T200 VanDerWaalsContact CG-O 3.22Å; F167-T200 WeakPolarHBondContact CG-O 3.31Å; F167-T200 HydrophobicContact CZ-CG2 4.11Å; F167-L203 HydrophobicContact CE1-CB 4.19Å; F167-L203 HydrophobicContact CE1-CD1 4.49Å; F167-L203 HydrophobicContact CZ-CB 3.94Å
168	Q	87.3	Confident	90.6	Very high	163 Å²	163	59.4 Å²	59.4	76%	0.762	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-22.7	170.9	-55	-59.7	-37.7	0	0	112.4	N166	N166-Q168 PolarHBondContact O-N 2.94Å; N166-Q168 VanDerWaalsContact O-N 3.08Å; N166-Q168 VanDerWaalsContact OD1-CB 3.27Å; N166-Q168 WeakPolarHBondContact OD1-CB 3.49Å; N166-Q168 WeakPolarHBondContact OD1-CG 3.42Å; N166-Q168 PolarHBondContact OD1-N 3.38Å; N166-Q168 VanDerWaalsContact OD1-N 3.16Å
169	N	88.9	Confident	90.6	Very high	70 Å²	70	63.6 Å²	63.6	37%	0.374	33%	0.325	S	S	.	.	S	Bend	trans	-112.2	73.2	176.2	-164.4	-32.1	0	0	0	111.1	N166 F167 K171 I172 T173	N166-N169 PolarHBondContact O-N 3.48Å; F167-N169 VanDerWaalsContact C-N 3.27Å; F167-N169 PolarHBondContact O-N 3Å; N169-K171 VanDerWaalsContact C-N 3.27Å; N169-K171 PolarHBondContact O-N 3.31Å; N169-K171 VanDerWaalsContact O-N 3.15Å; N169-I172 HydrophobicContact CB-CB 4.38Å; N169-I172 WeakPolarHBondContact ND2-CD1 3.37Å; N169-I172 PolarHBondContact O-N 3.2Å; N169-I172 VanDerWaalsContact O-N 3.11Å; N169-I172 WeakPolarHBondContact OD1-CG1 3.25Å; N169-I172 PolarHBondContact OD1-N 3.41Å; N169-T173 PolarHBondContact O-N 3.49Å; N169-T173 PolarHBondContact O-OG1 3.14Å
170	L	90	Very high	90.5	Very high	53 Å²	53	63 Å²	63	28%	0.277	31%	0.308	S	S	.	.	H	α-helix	trans	-51.8	-41.1	-172.2	-60.9	174.5	0	0	0	113.5	F167 T173 Q174 I196 P198	F167-L170 WeakPolarHBondContact O-CD2 3.23Å; L170-T173 PolarHBondContact O-N 2.78Å; L170-Q174 WeakPolarHBondContact O-CB 3.45Å; L170-Q174 PolarHBondContact O-N 3.33Å; L170-I196 HydrophobicContact CD2-CB 4Å; L170-I196 HydrophobicContact CD2-CG2 3.72Å; L170-P198 HydrophobicContact CD1-CG 4.14Å
171	K	90.3	Very high	90.3	Very high	174 Å²	174	62.8 Å²	62.8	76%	0.757	31%	0.306	S	S	*	.	H	α-helix	trans	-67.6	-42.3	-178.6	-169.6	175.2	-177.6	177.3	0	112.5	N169 K175	N169-K171 VanDerWaalsContact C-N 3.27Å; N169-K171 PolarHBondContact O-N 3.31Å; N169-K171 VanDerWaalsContact O-N 3.15Å; K171-K175 PolarHBondContact O-N 3.09Å
172	I	91.8	Very high	90.4	Very high	89 Å²	89	60.4 Å²	60.4	46%	0.456	30%	0.298	S	S	.	.	H	α-helix	trans	-68.7	-45.2	176.1	-66.1	-176.5	0	0	0	109.9	N169 Q174 K175 Q176	N169-I172 HydrophobicContact CB-CB 4.38Å; N169-I172 WeakPolarHBondContact ND2-CD1 3.37Å; N169-I172 PolarHBondContact O-N 3.2Å; N169-I172 VanDerWaalsContact O-N 3.11Å; N169-I172 WeakPolarHBondContact OD1-CG1 3.25Å; N169-I172 PolarHBondContact OD1-N 3.41Å; I172-Q174 PolarHBondContact O-N 3.46Å; I172-K175 PolarHBondContact O-N 3.26Å; I172-Q176 HydrophobicContact CG2-CG 4.34Å; I172-Q176 WeakPolarHBondContact O-CG 3.48Å; I172-Q176 PolarHBondContact O-N 3.15Å
173	T	91.8	Very high	90.5	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.006	32%	0.317	C	S	.	.	H	α-helix	trans	-59.7	-46.6	179	-67.5	0	0	0	0	112.3	T165 N166 F167 N169 L170 K175 Q176 I177 I196	T165-T173 HydrophobicContact CG2-CG2 3.26Å; N166-T173 PolarHBondContact O-OG1 3.45Å; F167-T173 HydrophobicContact CD1-CG2 3.78Å; F167-T173 HydrophobicContact CE1-CG2 3.8Å; N169-T173 PolarHBondContact O-N 3.49Å; N169-T173 PolarHBondContact O-OG1 3.14Å; L170-T173 PolarHBondContact O-N 2.78Å; T173-K175 VanDerWaalsContact C-N 3.3Å; T173-K175 PolarHBondContact O-N 3.02Å; T173-Q176 PolarHBondContact O-N 3.24Å; T173-I177 HydrophobicContact CG2-CD1 3.72Å; T173-I177 HydrophobicContact CG2-CG1 4.36Å; T173-I177 WeakPolarHBondContact O-CG1 3.43Å; T173-I177 PolarHBondContact O-N 3.43Å; T173-I196 HydrophobicContact CG2-CD1 3.77Å
174	Q	92.6	Very high	90.1	Very high	48 Å²	48	64.8 Å²	64.8	22%	0.224	32%	0.317	C	S	.	.	H	α-helix	trans	-56	-47.5	176.4	-178.9	-172.6	15.8	0	0	111.2	L170 I172 Q176 I177 N178 I193 E194 I196	L170-Q174 WeakPolarHBondContact O-CB 3.45Å; L170-Q174 PolarHBondContact O-N 3.33Å; I172-Q174 PolarHBondContact O-N 3.46Å; Q174-Q176 PolarHBondContact O-N 3.42Å; Q174-I177 PolarHBondContact O-N 2.99Å; Q174-N178 WeakPolarHBondContact O-CB 3.4Å; Q174-N178 PolarHBondContact O-N 3.22Å; Q174-I193 PolarHBondContact NE2-O 2.92Å; Q174-E194 PolarHBondContact NE2-O 3.15Å; Q174-I196 HydrophobicContact CB-CD1 3.95Å
175	K	93.1	Very high	89.8	Confident	137 Å²	137	60.2 Å²	60.2	60%	0.596	29%	0.293	S	S	*	.	H	α-helix	trans	-60.9	-45.8	177.5	-173.8	-178.8	176	-171.4	0	111.4	K171 I172 T173 I177 N178 D179	K171-K175 PolarHBondContact O-N 3.09Å; I172-K175 PolarHBondContact O-N 3.26Å; T173-K175 VanDerWaalsContact C-N 3.3Å; T173-K175 PolarHBondContact O-N 3.02Å; K175-I177 PolarHBondContact O-N 2.87Å; K175-N178 PolarHBondContact O-N 3.35Å; K175-D179 WeakPolarHBondContact CE-OD2 3.37Å; K175-D179 WeakPolarHBondContact CG-OD2 3.38Å; K175-D179 WeakPolarHBondContact O-CB 3.39Å; K175-D179 PolarHBondContact O-N 3.4Å
176	Q	92.6	Very high	89.6	Confident	96 Å²	96	65.8 Å²	65.8	45%	0.449	32%	0.315	S	S	.	.	H	α-helix	trans	-59.7	-43.6	178.5	-73.6	176.5	-32	0	0	112.7	I172 T173 Q174 F180	I172-Q176 HydrophobicContact CG2-CG 4.34Å; I172-Q176 WeakPolarHBondContact O-CG 3.48Å; I172-Q176 PolarHBondContact O-N 3.15Å; T173-Q176 PolarHBondContact O-N 3.24Å; Q174-Q176 PolarHBondContact O-N 3.42Å; Q176-F180 VanDerWaalsContact O-CB 3.29Å; Q176-F180 WeakPolarHBondContact O-CB 3.18Å; Q176-F180 PolarHBondContact O-N 2.82Å
177	I	91.3	Very high	89.4	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-65.8	-46	178.5	-63.9	167.8	0	0	0	110.3	F139 F167 T173 Q174 K175 F180 I181 I193 I196 L203 T205	F139-I177 HydrophobicContact CB-CD1 4.45Å; F139-I177 HydrophobicContact CD1-CD1 4.37Å; F139-I177 HydrophobicContact CD1-CG1 3.74Å; F139-I177 HydrophobicContact CD2-CD1 4.27Å; F139-I177 HydrophobicContact CD2-CG1 4.03Å; F139-I177 HydrophobicContact CD2-CG2 4.24Å; F139-I177 HydrophobicContact CE1-CB 4.43Å; F139-I177 HydrophobicContact CE1-CG1 3.72Å; F139-I177 HydrophobicContact CE2-CB 4.34Å; F139-I177 HydrophobicContact CE2-CG1 4.02Å; F139-I177 HydrophobicContact CE2-CG2 3.69Å; F139-I177 HydrophobicContact CG-CD1 4.11Å; F139-I177 HydrophobicContact CG-CG1 3.9Å; F139-I177 HydrophobicContact CZ-CB 4.16Å; F139-I177 HydrophobicContact CZ-CG1 3.86Å; F139-I177 HydrophobicContact CZ-CG2 3.89Å; F167-I177 HydrophobicContact CE1-CD1 4.44Å; T173-I177 HydrophobicContact CG2-CD1 3.72Å; T173-I177 HydrophobicContact CG2-CG1 4.36Å; T173-I177 WeakPolarHBondContact O-CG1 3.43Å; T173-I177 PolarHBondContact O-N 3.43Å; Q174-I177 PolarHBondContact O-N 2.99Å; K175-I177 PolarHBondContact O-N 2.87Å; I177-F180 PolarHBondContact O-N 3.46Å; I177-I181 HydrophobicContact CG2-CG1 4.44Å; I177-I181 VanDerWaalsContact O-CG1 3.3Å; I177-I181 WeakPolarHBondContact O-CG1 3.28Å; I177-I181 PolarHBondContact O-N 3.41Å; I177-I193 HydrophobicContact CB-CD1 4.25Å; I177-I193 HydrophobicContact CD1-CD1 4.16Å; I177-I193 HydrophobicContact CG2-CD1 3.43Å; I177-I193 VanDerWaalsContact CG2-CD1 3.43Å; I177-I193 HydrophobicContact CG2-CG1 4.23Å; I177-I196 HydrophobicContact CD1-CD1 4.01Å; I177-L203 HydrophobicContact CD1-CD1 4.15Å; I177-T205 HydrophobicContact CG2-CG2 3.89Å
178	N	92.5	Very high	89.2	Confident	9 Å²	9	67.1 Å²	67.1	5%	0.048	33%	0.327	C	S	.	.	H	α-helix	trans	-64.1	-43.4	178.7	-80.6	-22.6	0	0	0	112.4	Q174 K175 F180 I181 S182 N190 L192 I193	Q174-N178 WeakPolarHBondContact O-CB 3.4Å; Q174-N178 PolarHBondContact O-N 3.22Å; K175-N178 PolarHBondContact O-N 3.35Å; N178-F180 VanDerWaalsContact C-N 3.33Å; N178-F180 PolarHBondContact O-N 2.83Å; N178-I181 PolarHBondContact O-N 2.8Å; N178-S182 VanDerWaalsContact O-CB 3.27Å; N178-S182 WeakPolarHBondContact O-CB 3.36Å; N178-S182 PolarHBondContact O-N 2.94Å; N178-N190 VanDerWaalsContact CB-O 3.26Å; N178-N190 WeakPolarHBondContact CB-O 3.14Å; N178-L192 PolarHBondContact OD1-N 3.5Å; N178-I193 PolarHBondContact ND2-O 3.25Å; N178-I193 PolarHBondContact OD1-N 3.47Å
179	D	92.7	Very high	88.9	Confident	90 Å²	90	59.6 Å²	59.6	48%	0.481	29%	0.292	S	S	.	.	H	α-helix	trans	-62.3	-40.8	176	-71.6	-14.2	0	0	0	111.1	K175 S182 N183	K175-D179 WeakPolarHBondContact CE-OD2 3.37Å; K175-D179 WeakPolarHBondContact CG-OD2 3.38Å; K175-D179 WeakPolarHBondContact O-CB 3.39Å; K175-D179 PolarHBondContact O-N 3.4Å; D179-S182 PolarHBondContact O-N 2.91Å; D179-N183 WeakPolarHBondContact O-CB 3.11Å; D179-N183 PolarHBondContact O-N 3.24Å
180	F	90.1	Very high	88.7	Confident	39 Å²	39	59.7 Å²	59.7	17%	0.171	29%	0.292	C	S	.	.	H	α-helix	trans	-61.5	-49.5	175.9	177.4	-88.4	0	0	0	111.6	T137 F139 E161 I163 Q176 I177 N178 N183 K184	T137-F180 HydrophobicContact CG2-CD1 4.42Å; T137-F180 HydrophobicContact CG2-CE1 3.7Å; T137-F180 HydrophobicContact CG2-CZ 3.88Å; T137-F180 VanDerWaalsContact OG1-CE1 3.23Å; T137-F180 WeakPolarHBondContact OG1-CE1 3.1Å; F139-F180 HydrophobicContact CZ-CB 4.39Å; F139-F180 AromaticContact CZ-CD1 3.89Å; F139-F180 HydrophobicContact CZ-CD1 3.89Å; F139-F180 HydrophobicContact CZ-CE1 4.42Å; F139-F180 HydrophobicContact CZ-CG 4.18Å; E161-F180 WeakPolarHBondContact OE2-CE2 3.37Å; E161-F180 WeakPolarHBondContact OE2-CZ 3.43Å; I163-F180 HydrophobicContact CD1-CD2 3.74Å; I163-F180 HydrophobicContact CD1-CE1 4.42Å; I163-F180 HydrophobicContact CD1-CE2 3.43Å; I163-F180 VanDerWaalsContact CD1-CE2 3.43Å; I163-F180 HydrophobicContact CD1-CG 4.33Å; I163-F180 HydrophobicContact CD1-CZ 3.8Å; Q176-F180 VanDerWaalsContact O-CB 3.29Å; Q176-F180 WeakPolarHBondContact O-CB 3.18Å; Q176-F180 PolarHBondContact O-N 2.82Å; I177-F180 PolarHBondContact O-N 3.46Å; N178-F180 VanDerWaalsContact C-N 3.33Å; N178-F180 PolarHBondContact O-N 2.83Å; F180-N183 PolarHBondContact O-N 3.42Å; F180-K184 HydrophobicContact CD1-CG 4.24Å; F180-K184 HydrophobicContact CE1-CG 3.84Å; F180-K184 HydrophobicContact CZ-CD 4.33Å; F180-K184 HydrophobicContact CZ-CG 4.09Å; F180-K184 WeakPolarHBondContact O-CG 3.45Å; F180-K184 PolarHBondContact O-N 2.98Å
181	I	87.6	Confident	88.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-66.7	-39.9	179.7	-63.3	-66.8	0	0	0	111.3	I177 N178 N183 K184 T185 I189 L192 T205 Y207	I177-I181 HydrophobicContact CG2-CG1 4.44Å; I177-I181 VanDerWaalsContact O-CG1 3.3Å; I177-I181 WeakPolarHBondContact O-CG1 3.28Å; I177-I181 PolarHBondContact O-N 3.41Å; N178-I181 PolarHBondContact O-N 2.8Å; I181-N183 VanDerWaalsContact C-N 3.31Å; I181-N183 PolarHBondContact O-N 3.4Å; I181-K184 PolarHBondContact O-N 3.45Å; I181-T185 HydrophobicContact CG2-CG2 4.25Å; I181-T185 WeakPolarHBondContact O-CB 3.25Å; I181-T185 VanDerWaalsContact O-CG2 3.32Å; I181-T185 WeakPolarHBondContact O-CG2 3.24Å; I181-T185 PolarHBondContact O-N 3.09Å; I181-T185 PolarHBondContact O-OG1 2.89Å; I181-I189 HydrophobicContact CG2-CB 3.97Å; I181-I189 HydrophobicContact CG2-CG2 3.7Å; I181-L192 HydrophobicContact CD1-CD2 4.17Å; I181-L192 HydrophobicContact CG1-CD2 3.88Å; I181-L192 HydrophobicContact CG2-CB 4.24Å; I181-L192 HydrophobicContact CG2-CD2 4.17Å; I181-T205 HydrophobicContact CD1-CG2 4.43Å; I181-Y207 HydrophobicContact CD1-CD1 3.66Å; I181-Y207 HydrophobicContact CD1-CE1 4.21Å
182	S	90.4	Very high	88.1	Confident	28 Å²	28	54.3 Å²	54.3	20%	0.196	27%	0.272	C	S	.	.	H	α-helix	trans	-56.8	-46.9	174.6	-178.1	0	0	0	0	110.8	N178 D179 T185 Y186 G187 I189 N190	N178-S182 VanDerWaalsContact O-CB 3.27Å; N178-S182 WeakPolarHBondContact O-CB 3.36Å; N178-S182 PolarHBondContact O-N 2.94Å; D179-S182 PolarHBondContact O-N 2.91Å; S182-T185 CarbonylContact O-C 3.6Å; S182-T185 PolarHBondContact O-N 3Å; S182-T185 PolarHBondContact O-OG1 2.93Å; S182-Y186 PolarHBondContact O-N 3.34Å; S182-G187 PolarHBondContact O-N 2.91Å; S182-I189 WeakPolarHBondContact CA-O 3.29Å; S182-I189 PolarHBondContact N-O 2.86Å; S182-N190 PolarHBondContact OG-OD1 3.22Å
183	N	89.7	Confident	87.8	Confident	128 Å²	128	50.2 Å²	50.2	68%	0.684	25%	0.251	S	S	*	.	H	α-helix	trans	-62.4	-48.1	177.3	-172	9.4	0	0	0	112.2	D179 F180 I181 T185 Y186	D179-N183 WeakPolarHBondContact O-CB 3.11Å; D179-N183 PolarHBondContact O-N 3.24Å; F180-N183 PolarHBondContact O-N 3.42Å; I181-N183 VanDerWaalsContact C-N 3.31Å; I181-N183 PolarHBondContact O-N 3.4Å; N183-T185 PolarHBondContact O-N 3.42Å; N183-T185 VanDerWaalsContact O-N 3.17Å; N183-Y186 PolarHBondContact O-N 3Å
184	K	83.3	Confident	87.5	Confident	61 Å²	61	57.2 Å²	57.2	27%	0.265	28%	0.284	S	S	.	.	H	α-helix	trans	-61.5	-25.8	178.3	-67.1	-64.3	-170.9	175.7	0	113.3	E161 F180 I181 Y207	E161-K184 IonicContact OE1-NZ 3.66Å; E161-K184 PolarHBondContact OE1-NZ 3.46Å; E161-K184 IonicContact OE2-NZ 3.99Å; E161-K184 PolarHBondContact OE2-NZ 3.33Å; F180-K184 HydrophobicContact CD1-CG 4.24Å; F180-K184 HydrophobicContact CE1-CG 3.84Å; F180-K184 HydrophobicContact CZ-CD 4.33Å; F180-K184 HydrophobicContact CZ-CG 4.09Å; F180-K184 WeakPolarHBondContact O-CG 3.45Å; F180-K184 PolarHBondContact O-N 2.98Å; I181-K184 PolarHBondContact O-N 3.45Å; K184-Y207 HydrophobicContact CB-CD2 4.42Å; K184-Y207 HydrophobicContact CB-CE1 3.9Å; K184-Y207 HydrophobicContact CB-CE2 3.8Å; K184-Y207 WeakPolarHBondContact CD-OH 3.31Å; K184-Y207 HydrophobicContact CG-CE1 4Å; K184-Y207 WeakPolarHBondContact CG-OH 3.46Å
185	T	82	Confident	87.1	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.006	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	15	-178.1	64	0	0	0	0	113.4	I181 S182 N183 G187 K188 I189 Y207	I181-T185 HydrophobicContact CG2-CG2 4.25Å; I181-T185 WeakPolarHBondContact O-CB 3.25Å; I181-T185 VanDerWaalsContact O-CG2 3.32Å; I181-T185 WeakPolarHBondContact O-CG2 3.24Å; I181-T185 PolarHBondContact O-N 3.09Å; I181-T185 PolarHBondContact O-OG1 2.89Å; S182-T185 CarbonylContact O-C 3.6Å; S182-T185 PolarHBondContact O-N 3Å; S182-T185 PolarHBondContact O-OG1 2.93Å; N183-T185 PolarHBondContact O-N 3.42Å; N183-T185 VanDerWaalsContact O-N 3.17Å; T185-G187 VanDerWaalsContact C-N 3.27Å; T185-G187 PolarHBondContact O-N 2.86Å; T185-K188 WeakPolarHBondContact O-CB 3.38Å; T185-K188 VanDerWaalsContact O-CG 3.26Å; T185-K188 WeakPolarHBondContact O-CG 3.47Å; T185-K188 PolarHBondContact O-N 3.31Å; T185-K188 VanDerWaalsContact O-N 3.16Å; T185-I189 HydrophobicContact CG2-CB 4.01Å; T185-I189 HydrophobicContact CG2-CD1 3.97Å; T185-I189 HydrophobicContact CG2-CG1 4Å; T185-I189 WeakPolarHBondContact OG1-CB 3.43Å; T185-I189 PolarHBondContact OG1-N 3.42Å; T185-Y207 HydrophobicContact CG2-CD2 3.93Å; T185-Y207 HydrophobicContact CG2-CG 4.09Å
186	Y	85.3	Confident	86.7	Confident	121 Å²	121	54.6 Å²	54.6	48%	0.475	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	38.1	178.4	-53.5	-76.5	0	0	0	113.9	S182 N183 K188 F209	S182-Y186 PolarHBondContact O-N 3.34Å; N183-Y186 PolarHBondContact O-N 3Å; Y186-K188 VanDerWaalsContact C-N 3.31Å; Y186-K188 PolarHBondContact O-N 3.28Å; Y186-F209 HydrophobicContact CD2-CD1 4.07Å; Y186-F209 HydrophobicContact CD2-CD2 4.44Å; Y186-F209 AromaticContact CD2-CE1 3.92Å; Y186-F209 HydrophobicContact CD2-CE1 3.92Å; Y186-F209 HydrophobicContact CD2-CE2 4.31Å; Y186-F209 HydrophobicContact CD2-CG 4.33Å; Y186-F209 HydrophobicContact CD2-CZ 4.05Å; Y186-F209 HydrophobicContact CE2-CD1 4.09Å; Y186-F209 HydrophobicContact CE2-CE1 4.08Å
187	G	86.6	Confident	86.2	Confident	33 Å²	33	53.6 Å²	53.6	34%	0.34	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	11.6	178.5	0	0	0	0	0	114.9	S182 T185 N190	S182-G187 PolarHBondContact O-N 2.91Å; T185-G187 VanDerWaalsContact C-N 3.27Å; T185-G187 PolarHBondContact O-N 2.86Å; G187-N190 VanDerWaalsContact C-OD1 3.31Å; G187-N190 WeakPolarHBondContact CA-OD1 3.33Å; G187-N190 PolarHBondContact O-ND2 3.31Å; G187-N190 PolarHBondContact O-OD1 3.21Å; G187-N190 VanDerWaalsContact O-OD1 3.09Å
188	K	83.9	Confident	85.7	Confident	69 Å²	69	59 Å²	59	30%	0.3	31%	0.311	S	S	.	.	S	Bend	trans	-81.9	-46.5	177.7	-60.3	-55.2	-173.6	172.5	0	111.6	T185 Y186 F209 E357 E366	T185-K188 WeakPolarHBondContact O-CB 3.38Å; T185-K188 VanDerWaalsContact O-CG 3.26Å; T185-K188 WeakPolarHBondContact O-CG 3.47Å; T185-K188 PolarHBondContact O-N 3.31Å; T185-K188 VanDerWaalsContact O-N 3.16Å; Y186-K188 VanDerWaalsContact C-N 3.31Å; Y186-K188 PolarHBondContact O-N 3.28Å; K188-F209 HydrophobicContact CG-CD2 4.33Å; K188-F209 HydrophobicContact CG-CE2 3.98Å; K188-E357 VanDerWaalsContact O-OE2 3.07Å; K188-E366 VanDerWaalsContact CE-OE1 3.25Å; K188-E366 WeakPolarHBondContact CE-OE1 3.38Å; K188-E366 IonicContact NZ-OE1 2.65Å; K188-E366 PolarHBondContact NZ-OE1 2.89Å; K188-E366 IonicContact NZ-OE2 2.79Å
189	I	81.3	Confident	85.1	Confident	4 Å²	4	61.9 Å²	61.9	2%	0.021	34%	0.343	C	S	.	.			trans	-102.6	89.7	178.7	-53.5	-172.3	0	0	0	109.5	I181 S182 T185 L192 K355	I181-I189 HydrophobicContact CG2-CB 3.97Å; I181-I189 HydrophobicContact CG2-CG2 3.7Å; S182-I189 WeakPolarHBondContact CA-O 3.29Å; S182-I189 PolarHBondContact N-O 2.86Å; T185-I189 HydrophobicContact CG2-CB 4.01Å; T185-I189 HydrophobicContact CG2-CD1 3.97Å; T185-I189 HydrophobicContact CG2-CG1 4Å; T185-I189 WeakPolarHBondContact OG1-CB 3.43Å; T185-I189 PolarHBondContact OG1-N 3.42Å; I189-L192 HydrophobicContact CG2-CB 4.1Å; I189-L192 HydrophobicContact CG2-CD1 4.22Å; I189-K355 HydrophobicContact CD1-CB 4.32Å; I189-K355 HydrophobicContact CD1-CG 4.28Å; I189-K355 HydrophobicContact CG2-CB 4.27Å; I189-K355 HydrophobicContact CG2-CD 3.78Å; I189-K355 HydrophobicContact CG2-CG 4.08Å
190	N	84.7	Confident	84.5	Confident	72 Å²	72	58 Å²	58	39%	0.385	32%	0.322	S	S	.	.			trans	-89.2	-48.3	-174.3	-61.7	-41.4	0	0	0	113.9	N178 S182 G187	N178-N190 VanDerWaalsContact CB-O 3.26Å; N178-N190 WeakPolarHBondContact CB-O 3.14Å; S182-N190 PolarHBondContact OG-OD1 3.22Å; G187-N190 VanDerWaalsContact C-OD1 3.31Å; G187-N190 WeakPolarHBondContact CA-OD1 3.33Å; G187-N190 PolarHBondContact O-ND2 3.31Å; G187-N190 PolarHBondContact O-OD1 3.21Å; G187-N190 VanDerWaalsContact O-OD1 3.09Å
191	N	83.7	Confident	84	Confident	108 Å²	108	57.8 Å²	57.8	58%	0.578	32%	0.324	S	S	*	.			trans	-113	87.6	177.5	-59	-36.5	0	0	0	107.3	K355	N191-K355 PolarHBondContact O-NZ 2.85Å
192	L	83.8	Confident	83.9	Confident	6 Å²	6	57.9 Å²	57.9	3%	0.031	32%	0.324	C	S	.	.	S	Bend	trans	-77.5	-41.7	173.8	179	65.7	0	0	0	109.7	N178 I181 I189 T205 V353 K355	N178-L192 PolarHBondContact OD1-N 3.5Å; I181-L192 HydrophobicContact CD1-CD2 4.17Å; I181-L192 HydrophobicContact CG1-CD2 3.88Å; I181-L192 HydrophobicContact CG2-CB 4.24Å; I181-L192 HydrophobicContact CG2-CD2 4.17Å; I189-L192 HydrophobicContact CG2-CB 4.1Å; I189-L192 HydrophobicContact CG2-CD1 4.22Å; L192-T205 HydrophobicContact CD2-CG2 3.82Å; L192-V353 HydrophobicContact CD1-CB 4.4Å; L192-V353 HydrophobicContact CD1-CG1 3.88Å; L192-V353 HydrophobicContact CG-CG1 4.38Å; L192-K355 HydrophobicContact CD1-CB 3.39Å; L192-K355 HydrophobicContact CD1-CD 4.24Å; L192-K355 HydrophobicContact CD1-CG 4.45Å
193	I	85	Confident	83.7	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.015	32%	0.316	C	S	.	.			trans	-114.4	121.9	-174.4	-51	-173.6	0	0	0	109.2	Q174 I177 N178 N195 I196 L203 T205	Q174-I193 PolarHBondContact NE2-O 2.92Å; I177-I193 HydrophobicContact CB-CD1 4.25Å; I177-I193 HydrophobicContact CD1-CD1 4.16Å; I177-I193 HydrophobicContact CG2-CD1 3.43Å; I177-I193 VanDerWaalsContact CG2-CD1 3.43Å; I177-I193 HydrophobicContact CG2-CG1 4.23Å; N178-I193 PolarHBondContact ND2-O 3.25Å; N178-I193 PolarHBondContact OD1-N 3.47Å; I193-N195 WeakPolarHBondContact CG2-O 3.28Å; I193-I196 HydrophobicContact CG2-CG1 3.76Å; I193-L203 HydrophobicContact CD1-CD1 3.52Å; I193-L203 HydrophobicContact CD1-CD2 3.4Å; I193-L203 VanDerWaalsContact CD1-CD2 3.4Å; I193-L203 HydrophobicContact CD1-CG 4.1Å; I193-T205 HydrophobicContact CD1-CG2 4.15Å
194	E	85.1	Confident	83.4	Confident	148 Å²	148	50.9 Å²	50.9	69%	0.692	29%	0.285	S	S	*	.	S	Bend	trans	-91.5	-34.9	179.9	-66.8	-175.2	178.2	0	0	112.8	Q174	Q174-E194 PolarHBondContact NE2-O 3.15Å
195	N	83.8	Confident	83.4	Confident	119 Å²	119	48 Å²	48	64%	0.636	27%	0.272	S	S	*	.			trans	-145.7	153.2	176.8	-65.2	-62.3	0	0	0	109.3	I193	I193-N195 WeakPolarHBondContact CG2-O 3.28Å
196	I	85.1	Confident	83.4	Confident	12 Å²	12	48.3 Å²	48.3	6%	0.062	27%	0.274	C	S	.	.			trans	-123.2	125.9	172.9	-60	175.7	0	0	0	107	F167 L170 T173 Q174 I177 I193 T200 L203	F167-I196 HydrophobicContact CD1-CG2 4.04Å; F167-I196 HydrophobicContact CE1-CG2 4.32Å; L170-I196 HydrophobicContact CD2-CB 4Å; L170-I196 HydrophobicContact CD2-CG2 3.72Å; T173-I196 HydrophobicContact CG2-CD1 3.77Å; Q174-I196 HydrophobicContact CB-CD1 3.95Å; I177-I196 HydrophobicContact CD1-CD1 4.01Å; I193-I196 HydrophobicContact CG2-CG1 3.76Å; I196-T200 HydrophobicContact CG2-CG2 4.01Å; I196-L203 HydrophobicContact CD1-CD1 4.48Å; I196-L203 HydrophobicContact CG1-CD1 4.35Å
197	D	82.7	Confident	83.2	Confident	74 Å²	74	43.1 Å²	43.1	40%	0.396	25%	0.254	S	S	.	.			trans	-64.9	135.1	-179.3	-80.4	-8.3	0	0	0	111.3	G199 T200	D197-G199 PolarHBondContact O-N 3.18Å; D197-T200 VanDerWaalsContact O-CB 3.31Å; D197-T200 WeakPolarHBondContact O-CB 3.39Å; D197-T200 PolarHBondContact O-N 3.17Å; D197-T200 PolarHBondContact O-OG1 2.96Å
198	P	81.2	Confident	83	Confident	114 Å²	114	41.7 Å²	41.7	74%	0.74	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	126.8	167.8	-22.5	33	0	0	0	110.4	L170	L170-P198 HydrophobicContact CD1-CG 4.14Å
199	G	79.1	Confident	83	Confident	70 Å²	70	39.2 Å²	39.2	72%	0.722	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	93.6	2.3	-173.5	0	0	0	0	0	114.5	D197 V201	D197-G199 PolarHBondContact O-N 3.18Å; G199-V201 PolarHBondContact O-N 3.3Å
200	T	79.8	Confident	83.2	Confident	8 Å²	8	39.3 Å²	39.3	5%	0.049	23%	0.228	C	C	.	.			trans	-59.2	124.9	164.7	-61.7	0	0	0	0	109.3	F167 I196 D197 L203	F167-T200 WeakPolarHBondContact CB-O 3.18Å; F167-T200 HydrophobicContact CD1-CG2 3.85Å; F167-T200 HydrophobicContact CE1-CG2 3.68Å; F167-T200 HydrophobicContact CG-CG2 4.43Å; F167-T200 VanDerWaalsContact CG-O 3.22Å; F167-T200 WeakPolarHBondContact CG-O 3.31Å; F167-T200 HydrophobicContact CZ-CG2 4.11Å; I196-T200 HydrophobicContact CG2-CG2 4.01Å; D197-T200 VanDerWaalsContact O-CB 3.31Å; D197-T200 WeakPolarHBondContact O-CB 3.39Å; D197-T200 PolarHBondContact O-N 3.17Å; D197-T200 PolarHBondContact O-OG1 2.96Å; T200-L203 HydrophobicContact CG2-CB 4.38Å
201	V	80.9	Confident	83.1	Confident	35 Å²	35	39.6 Å²	39.6	21%	0.212	22%	0.223	C	C	.	.			trans	-120.6	-12	177.9	-66.1	0	0	0	0	112.5	D141 L144 G199 L347	D141-V201 HydrophobicContact CB-CB 4.29Å; D141-V201 WeakPolarHBondContact CB-O 3.48Å; D141-V201 PolarHBondContact N-O 2.66Å; L144-V201 HydrophobicContact CD1-CB 3.66Å; L144-V201 HydrophobicContact CD1-CG2 4.03Å; L144-V201 VanDerWaalsContact CD1-O 3.26Å; L144-V201 WeakPolarHBondContact CD1-O 3.35Å; G199-V201 PolarHBondContact O-N 3.3Å; V201-L347 HydrophobicContact CB-CD2 4.43Å; V201-L347 HydrophobicContact CG2-CD2 3.38Å
202	M	84	Confident	83.4	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	137.7	173.1	-175.3	178.1	71	0	0	109.2	L86 L138 F139 I140 L338 I341 V349	L86-M202 HydrophobicContact CD2-CE 4.09Å; L138-M202 HydrophobicContact CD2-SD 4.48Å; F139-M202 CarbonylContact O-C 3.59Å; F139-M202 VanDerWaalsContact O-CA 3.29Å; F139-M202 WeakPolarHBondContact O-CA 3.32Å; I140-M202 HydrophobicContact CG1-CG 4.35Å; M202-L338 HydrophobicContact CE-CD1 3.98Å; M202-I341 HydrophobicContact CE-CD1 3.8Å; M202-I341 HydrophobicContact SD-CD1 3.77Å; M202-I341 HydrophobicContact SD-CG2 4.28Å; M202-V349 HydrophobicContact CE-CG2 3.89Å
203	L	85.8	Confident	83.7	Confident	3 Å²	3	35.6 Å²	35.6	2%	0.016	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	122.2	175.1	-161.7	152.7	0	0	0	109.5	F139 F167 I177 I193 I196 T200 T205 E351	F139-L203 HydrophobicContact CB-CB 4.24Å; F139-L203 HydrophobicContact CD2-CD2 4.42Å; F139-L203 PolarHBondContact N-O 2.88Å; F139-L203 PolarHBondContact O-N 2.96Å; F167-L203 HydrophobicContact CE1-CB 4.19Å; F167-L203 HydrophobicContact CE1-CD1 4.49Å; F167-L203 HydrophobicContact CZ-CB 3.94Å; I177-L203 HydrophobicContact CD1-CD1 4.15Å; I193-L203 HydrophobicContact CD1-CD1 3.52Å; I193-L203 HydrophobicContact CD1-CD2 3.4Å; I193-L203 VanDerWaalsContact CD1-CD2 3.4Å; I193-L203 HydrophobicContact CD1-CG 4.1Å; I196-L203 HydrophobicContact CD1-CD1 4.48Å; I196-L203 HydrophobicContact CG1-CD1 4.35Å; T200-L203 HydrophobicContact CG2-CB 4.38Å; L203-T205 HydrophobicContact CD2-CG2 3.31Å; L203-E351 HydrophobicContact CD1-CB 4.16Å; L203-E351 HydrophobicContact CG-CB 4.4Å
204	L	84.5	Confident	84.1	Confident	6 Å²	6	35.4 Å²	35.4	3%	0.031	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	119.8	174.3	173.2	65.3	0	0	0	109	A82 L86 L138	A82-L204 HydrophobicContact CB-CD2 3.88Å; A82-L204 HydrophobicContact CB-CG 4.4Å; A82-L204 WeakPolarHBondContact O-CD2 3.15Å; L86-L204 HydrophobicContact CD1-CD2 3.57Å; L86-L204 HydrophobicContact CD2-CD2 4.08Å; L86-L204 HydrophobicContact CG-CD2 3.66Å; L138-L204 HydrophobicContact CD2-CB 4.33Å; L138-L204 HydrophobicContact CD2-CD1 3.71Å
205	T	83.1	Confident	84.4	Confident	1 Å²	1	33 Å²	33	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	144.6	167.5	63.7	0	0	0	0	110.1	T137 F139 I177 I181 L192 I193 L203	T137-T205 WeakPolarHBondContact CB-OG1 3.2Å; T137-T205 PolarHBondContact N-O 3.27Å; T137-T205 PolarHBondContact O-N 3.15Å; T137-T205 PolarHBondContact O-OG1 2.82Å; F139-T205 HydrophobicContact CD2-CG2 4.09Å; F139-T205 HydrophobicContact CE2-CG2 3.78Å; F139-T205 WeakPolarHBondContact CE2-OG1 3.39Å; I177-T205 HydrophobicContact CG2-CG2 3.89Å; I181-T205 HydrophobicContact CD1-CG2 4.43Å; L192-T205 HydrophobicContact CD2-CG2 3.82Å; I193-T205 HydrophobicContact CD1-CG2 4.15Å; L203-T205 HydrophobicContact CD2-CG2 3.31Å
206	N	82.6	Confident	84.7	Confident	7 Å²	7	30 Å²	30	4%	0.037	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	138.3	175.5	167.4	-93.8	0	0	0	107.9	S78 T81 A82 G135 N136	S78-N206 WeakPolarHBondContact CA-OD1 3.17Å; S78-N206 WeakPolarHBondContact CB-OD1 3.39Å; S78-N206 PolarHBondContact O-ND2 3.4Å; S78-N206 PolarHBondContact O-OD1 2.97Å; S78-N206 PolarHBondContact OG-ND2 2.88Å; S78-N206 PolarHBondContact OG-OD1 3.22Å; T81-N206 PolarHBondContact OG1-ND2 3.26Å; A82-N206 HydrophobicContact CB-CB 3.64Å; G135-N206 PolarHBondContact O-ND2 3.18Å; N136-N206 PolarHBondContact OD1-ND2 2.5Å
207	Y	79.9	Confident	85.1	Confident	12 Å²	12	31.2 Å²	31.2	5%	0.047	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	149.7	-179.5	62.3	-93.5	0	0	0	110.2	I134 G135 I181 K184 T185	I134-Y207 WeakPolarHBondContact CA-O 3.07Å; G135-Y207 PolarHBondContact N-O 2.98Å; G135-Y207 VanDerWaalsContact N-O 3.12Å; G135-Y207 PolarHBondContact O-N 2.71Å; I181-Y207 HydrophobicContact CD1-CD1 3.66Å; I181-Y207 HydrophobicContact CD1-CE1 4.21Å; K184-Y207 HydrophobicContact CB-CD2 4.42Å; K184-Y207 HydrophobicContact CB-CE1 3.9Å; K184-Y207 HydrophobicContact CB-CE2 3.8Å; K184-Y207 WeakPolarHBondContact CD-OH 3.31Å; K184-Y207 HydrophobicContact CG-CE1 4Å; K184-Y207 WeakPolarHBondContact CG-OH 3.46Å; T185-Y207 HydrophobicContact CG2-CD2 3.93Å; T185-Y207 HydrophobicContact CG2-CG 4.09Å
208	I	83.9	Confident	85.6	Confident	3 Å²	3	27.9 Å²	27.9	2%	0.015	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	129.5	168.7	-177.3	167.9	0	0	0	108.9	S133 I134 L403 F404	S133-I208 CarbonylContact O-C 3.56Å; S133-I208 WeakPolarHBondContact O-CA 3.36Å; I134-I208 HydrophobicContact CD1-CD1 4.01Å; I134-I208 HydrophobicContact CG1-CB 4.31Å; I134-I208 HydrophobicContact CG1-CD1 3.81Å; I134-I208 HydrophobicContact CG1-CG1 3.78Å; I208-L403 HydrophobicContact CD1-CB 4.47Å; I208-F404 HydrophobicContact CB-CZ 4.32Å; I208-F404 HydrophobicContact CD1-CD2 4.46Å; I208-F404 HydrophobicContact CD1-CE2 3.66Å; I208-F404 HydrophobicContact CD1-CZ 3.89Å; I208-F404 HydrophobicContact CG1-CE2 3.97Å; I208-F404 HydrophobicContact CG1-CZ 3.77Å; I208-F404 HydrophobicContact CG2-CE1 3.91Å; I208-F404 HydrophobicContact CG2-CZ 3.69Å
209	F	82.8	Confident	86.2	Confident	16 Å²	16	26 Å²	26	7%	0.07	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.3	170	174.8	-95.8	0	0	0	108.5	K131 V132 S133 Y186 K188 R211	K131-F209 HydrophobicContact CB-CE1 4.24Å; V132-F209 WeakPolarHBondContact CA-O 3.44Å; S133-F209 PolarHBondContact N-O 3.24Å; S133-F209 PolarHBondContact O-N 2.95Å; Y186-F209 HydrophobicContact CD2-CD1 4.07Å; Y186-F209 HydrophobicContact CD2-CD2 4.44Å; Y186-F209 AromaticContact CD2-CE1 3.92Å; Y186-F209 HydrophobicContact CD2-CE1 3.92Å; Y186-F209 HydrophobicContact CD2-CE2 4.31Å; Y186-F209 HydrophobicContact CD2-CG 4.33Å; Y186-F209 HydrophobicContact CD2-CZ 4.05Å; Y186-F209 HydrophobicContact CE2-CD1 4.09Å; Y186-F209 HydrophobicContact CE2-CE1 4.08Å; K188-F209 HydrophobicContact CG-CD2 4.33Å; K188-F209 HydrophobicContact CG-CE2 3.98Å; F209-R211 HydrophobicContact CE1-CB 3.69Å; F209-R211 HydrophobicContact CZ-CB 3.75Å
210	F	84.8	Confident	86.9	Confident	7 Å²	7	26 Å²	26	3%	0.031	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	127.9	179.3	171.9	-103.6	0	0	0	110.4	L130 V132 A212 Y264 I268 L358 T365 I394 L403 F404	L130-F210 HydrophobicContact CD1-CD2 4.46Å; L130-F210 HydrophobicContact CD1-CE2 3.84Å; V132-F210 HydrophobicContact CG2-CD2 3.76Å; V132-F210 HydrophobicContact CG2-CE2 4.2Å; F210-A212 HydrophobicContact CE1-CB 4.18Å; F210-A212 HydrophobicContact CE2-CB 3.75Å; F210-A212 HydrophobicContact CZ-CB 3.4Å; F210-A212 VanDerWaalsContact CZ-CB 3.4Å; F210-Y264 HydrophobicContact CE1-CE1 4.47Å; F210-Y264 HydrophobicContact CE1-CE2 4.23Å; F210-Y264 HydrophobicContact CZ-CD2 4.19Å; F210-Y264 HydrophobicContact CZ-CE1 4.47Å; F210-Y264 HydrophobicContact CZ-CE2 4.01Å; F210-Y264 HydrophobicContact CZ-CG 4.48Å; F210-I268 HydrophobicContact CE2-CG1 4.45Å; F210-I268 HydrophobicContact CE2-CG2 3.81Å; F210-I268 HydrophobicContact CZ-CG2 3.8Å; F210-L358 HydrophobicContact CD1-CD1 4.03Å; F210-T365 HydrophobicContact CD1-CG2 3.68Å; F210-T365 HydrophobicContact CE1-CG2 3.89Å; F210-T365 WeakPolarHBondContact O-CG2 3.32Å; F210-I394 HydrophobicContact CD1-CG2 4.37Å; F210-I394 HydrophobicContact CE1-CG2 3.89Å; F210-I394 HydrophobicContact CE2-CG2 4.22Å; F210-I394 HydrophobicContact CZ-CG2 3.81Å; F210-L403 HydrophobicContact CD2-CD1 4.41Å; F210-F404 HydrophobicContact CB-CD2 4.33Å; F210-F404 HydrophobicContact CB-CE2 3.34Å; F210-F404 HydrophobicContact CB-CZ 3.76Å; F210-F404 HydrophobicContact CD1-CE2 4.33Å; F210-F404 AromaticContact CG-CE2 3.93Å; F210-F404 HydrophobicContact CG-CE2 3.93Å
211	R	84.5	Confident	87.6	Confident	78 Å²	78	32.5 Å²	32.5	29%	0.294	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	121.8	176.2	167.1	167.9	-175.5	175.8	3.6	108.8	L130 K131 F209 T365 E366 G367	L130-R211 CarbonylContact C-O 3.6Å; L130-R211 WeakPolarHBondContact CA-O 3.33Å; K131-R211 HydrophobicContact CB-CB 4.21Å; K131-R211 PolarHBondContact N-O 3.36Å; K131-R211 PolarHBondContact O-N 2.83Å; F209-R211 HydrophobicContact CE1-CB 3.69Å; F209-R211 HydrophobicContact CZ-CB 3.75Å; R211-T365 CarbonylContact C-O 3.58Å; R211-T365 WeakPolarHBondContact CA-O 3.38Å; R211-T365 WeakPolarHBondContact CG-O 3.25Å; R211-E366 HydrophobicContact CB-CB 4.4Å; R211-E366 WeakPolarHBondContact CD-O 3.18Å; R211-E366 HydrophobicContact CG-CB 3.76Å; R211-E366 WeakPolarHBondContact CG-O 3.31Å; R211-E366 PolarHBondContact NE-O 2.78Å; R211-G367 PolarHBondContact NH2-O 3.17Å
212	A	88.8	Confident	88.3	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	145.4	-178.8	0	0	0	0	0	110.7	D129 L130 F210 Y264 G364 T365	D129-A212 VanDerWaalsContact O-CA 3.31Å; D129-A212 WeakPolarHBondContact O-CA 3.19Å; L130-A212 HydrophobicContact CD1-CB 3.57Å; F210-A212 HydrophobicContact CE1-CB 4.18Å; F210-A212 HydrophobicContact CE2-CB 3.75Å; F210-A212 HydrophobicContact CZ-CB 3.4Å; F210-A212 VanDerWaalsContact CZ-CB 3.4Å; A212-Y264 HydrophobicContact CB-CD1 3.51Å; A212-Y264 HydrophobicContact CB-CE1 4.14Å; A212-Y264 HydrophobicContact CB-CG 3.79Å; A212-Y264 WeakPolarHBondContact O-CD1 3.27Å; A212-G364 CarbonylContact O-C 3.59Å; A212-G364 WeakPolarHBondContact O-CA 3.43Å; A212-T365 PolarHBondContact N-O 2.92Å; A212-T365 CarbonylContact O-C 3.34Å; A212-T365 WeakPolarHBondContact O-CA 3.43Å; A212-T365 PolarHBondContact O-N 3.41Å; A212-T365 VanDerWaalsContact O-O 3.09Å
213	R	90.2	Very high	88.9	Confident	29 Å²	29	35 Å²	35	11%	0.109	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	145	172.6	-65.7	-173.2	-166	-176.9	12.1	111.9	D129 Y264 H265 R363 A368 A369	D129-R213 PolarHBondContact O-N 2.89Å; D129-R213 IonicContact OD1-CZ 3.72Å; D129-R213 IonicContact OD1-NE 3.73Å; R213-Y264 CarbonylContact O-C 3.44Å; R213-Y264 VanDerWaalsContact O-CA 3.24Å; R213-Y264 WeakPolarHBondContact O-CA 3.46Å; R213-Y264 WeakPolarHBondContact O-CB 3.14Å; R213-Y264 WeakPolarHBondContact O-CD1 3.28Å; R213-H265 PolarHBondContact O-N 2.96Å; R213-H265 PolarHBondContact O-ND1 3.15Å; R213-R363 CarbonylContact C-O 3.56Å; R213-R363 VanDerWaalsContact CA-O 3.23Å; R213-R363 WeakPolarHBondContact CA-O 3.25Å; R213-R363 WeakPolarHBondContact CB-O 3.43Å; R213-A368 WeakPolarHBondContact CD-O 3.31Å; R213-A368 VanDerWaalsContact CZ-CA 3.5Å; R213-A368 VanDerWaalsContact CZ-CB 3.48Å; R213-A368 VanDerWaalsContact NE-N 3.16Å; R213-A368 PolarHBondContact NE-O 2.77Å; R213-A368 PolarHBondContact NH1-O 3.32Å; R213-A369 PolarHBondContact NH1-O 2.91Å
214	W	93.2	Very high	89.5	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-58.1	145.1	169.6	-65.7	128.5	0	0	0	110.1	H216 F218 I262 Y264 H265 A270 M360 D361 R363 G364	W214-H216 VanDerWaalsContact CB-O 3.25Å; W214-H216 WeakPolarHBondContact CB-O 3.33Å; W214-H216 PolarHBondContact O-N 2.96Å; W214-F218 AromaticContact CD1-CD2 3.63Å; W214-F218 AromaticContact CD1-CE2 3.78Å; W214-F218 HydrophobicContact CD2-CE2 4.45Å; W214-F218 AromaticContact CE2-CE2 3.99Å; W214-F218 HydrophobicContact CG-CD2 4.48Å; W214-F218 HydrophobicContact CG-CE2 4.34Å; W214-F218 AromaticContact NE1-CD2 3.7Å; W214-F218 AromaticContact NE1-CE2 3.58Å; W214-I262 HydrophobicContact CD2-CG2 4.1Å; W214-I262 HydrophobicContact CE3-CB 4.39Å; W214-I262 HydrophobicContact CE3-CG2 3.51Å; W214-I262 HydrophobicContact CH2-CB 4.42Å; W214-I262 HydrophobicContact CH2-CG2 4.14Å; W214-I262 HydrophobicContact CZ3-CB 3.94Å; W214-I262 HydrophobicContact CZ3-CG2 3.53Å; W214-Y264 HydrophobicContact CD2-CD1 4.13Å; W214-Y264 AromaticContact CD2-CE1 3.85Å; W214-Y264 HydrophobicContact CD2-CE1 3.85Å; W214-Y264 AromaticContact CE3-CD1 3.56Å; W214-Y264 HydrophobicContact CE3-CD1 3.56Å; W214-Y264 HydrophobicContact CE3-CD2 4.27Å; W214-Y264 AromaticContact CE3-CE1 3.42Å; W214-Y264 HydrophobicContact CE3-CE1 3.42Å; W214-Y264 VanDerWaalsContact CE3-CE1 3.42Å; W214-Y264 HydrophobicContact CE3-CE2 4.18Å; W214-Y264 AromaticContact CE3-CG 3.99Å; W214-Y264 HydrophobicContact CE3-CG 3.99Å; W214-Y264 AromaticContact CE3-CZ 3.76Å; W214-Y264 AromaticContact CH2-CE1 3.74Å; W214-Y264 HydrophobicContact CH2-CE1 3.74Å; W214-Y264 HydrophobicContact CH2-CE2 4.01Å; W214-Y264 AromaticContact CH2-CZ 3.37Å; W214-Y264 WeakPolarHBondContact CH2-OH 3.5Å; W214-Y264 HydrophobicContact CZ2-CE1 4.12Å; W214-Y264 AromaticContact CZ3-CD1 3.85Å; W214-Y264 HydrophobicContact CZ3-CD1 3.85Å; W214-Y264 AromaticContact CZ3-CD2 3.93Å; W214-Y264 HydrophobicContact CZ3-CD2 3.93Å; W214-Y264 AromaticContact CZ3-CE1 3.36Å; W214-Y264 HydrophobicContact CZ3-CE1 3.36Å; W214-Y264 AromaticContact CZ3-CE2 3.47Å; W214-Y264 HydrophobicContact CZ3-CE2 3.47Å; W214-Y264 VanDerWaalsContact CZ3-CE2 3.47Å; W214-Y264 HydrophobicContact CZ3-CG 4.11Å; W214-Y264 AromaticContact CZ3-CZ 3.15Å; W214-Y264 WeakPolarHBondContact CZ3-OH 3.48Å; W214-H265 PolarHBondContact O-CE1 2.94Å; W214-H265 PolarHBondContact O-ND1 2.94Å; W214-A270 HydrophobicContact CH2-CB 3.67Å; W214-A270 HydrophobicContact CZ3-CB 3.72Å; W214-M360 HydrophobicContact CH2-CE 3.87Å; W214-M360 HydrophobicContact CH2-CG 4.39Å; W214-M360 HydrophobicContact CH2-SD 4.09Å; W214-M360 HydrophobicContact CZ2-CE 4.01Å; W214-M360 HydrophobicContact CZ2-CG 3.58Å; W214-M360 HydrophobicContact CZ2-SD 3.7Å; W214-D361 PolarHBondContact NE1-O 2.89Å; W214-R363 PolarHBondContact N-O 3.48Å; W214-G364 VanDerWaalsContact NE1-CA 3.28Å
215	Q	91.4	Very high	90.2	Very high	97 Å²	97	46 Å²	46	45%	0.453	23%	0.227	S	C	.	.	S	Bend	trans	-60.9	-34.2	172.1	-175	179	-8.4	0	0	110.8	P263	Q215-P263 HydrophobicContact CB-CB 4.21Å; Q215-P263 HydrophobicContact CB-CG 4.01Å; Q215-P263 WeakPolarHBondContact CB-O 3.23Å; Q215-P263 PolarHBondContact N-O 3.46Å; Q215-P263 VanDerWaalsContact OE1-CB 3.32Å
216	H	90.7	Very high	90.9	Very high	56 Å²	56	47.1 Å²	47.1	26%	0.259	23%	0.232	S	C	.	.	S	Bend	trans	-129.3	110.5	171.8	-59.3	-69.4	0	0	0	107.8	W214 Q374	W214-H216 VanDerWaalsContact CB-O 3.25Å; W214-H216 WeakPolarHBondContact CB-O 3.33Å; W214-H216 PolarHBondContact O-N 2.96Å; H216-Q374 PolarHBondContact CD2-NE2 3.02Å; H216-Q374 PolarHBondContact CE1-NE2 3.47Å; H216-Q374 PolarHBondContact ND1-NE2 3.47Å; H216-Q374 PolarHBondContact NE2-NE2 3.07Å; H216-Q374 VanDerWaalsContact NE2-NE2 3.15Å
217	E	93	Very high	91.6	Very high	37 Å²	37	49.4 Å²	49.4	17%	0.173	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-70	147.8	-179.2	-62.2	-177	-166.9	0	0	110.7	E362 A369 G370	E217-E362 CarbonylContact C-O 3.57Å; E217-E362 WeakPolarHBondContact CA-O 3.08Å; E217-E362 WeakPolarHBondContact CB-O 3.34Å; E217-A369 WeakPolarHBondContact OE2-CA 3.3Å; E217-G370 PolarHBondContact OE1-N 2.97Å
218	F	94.1	Very high	92.4	Very high	5 Å²	5	48.8 Å²	48.8	2%	0.022	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-75.5	152.5	168.9	-61.8	-99.4	0	0	0	109	W214 P220 M241 H243 I262 V306 V308 E362	W214-F218 AromaticContact CD1-CD2 3.63Å; W214-F218 AromaticContact CD1-CE2 3.78Å; W214-F218 HydrophobicContact CD2-CE2 4.45Å; W214-F218 AromaticContact CE2-CE2 3.99Å; W214-F218 HydrophobicContact CG-CD2 4.48Å; W214-F218 HydrophobicContact CG-CE2 4.34Å; W214-F218 AromaticContact NE1-CD2 3.7Å; W214-F218 AromaticContact NE1-CE2 3.58Å; F218-P220 WeakPolarHBondContact O-CD 3.45Å; F218-M241 HydrophobicContact CB-CB 4.21Å; F218-M241 HydrophobicContact CD1-CB 3.68Å; F218-M241 HydrophobicContact CD2-CE 4.35Å; F218-M241 HydrophobicContact CD2-SD 4.3Å; F218-M241 HydrophobicContact CE1-CB 4.14Å; F218-M241 HydrophobicContact CE2-CE 4.26Å; F218-M241 HydrophobicContact CG-CB 3.9Å; F218-M241 HydrophobicContact CG-SD 4.44Å; F218-H243 HydrophobicContact CD1-CB 3.54Å; F218-H243 HydrophobicContact CE1-CB 3.69Å; F218-H243 HydrophobicContact CG-CB 4.38Å; F218-I262 HydrophobicContact CZ-CD1 4.23Å; F218-V306 HydrophobicContact CE1-CG2 4.05Å; F218-V306 HydrophobicContact CZ-CG2 4.39Å; F218-V308 HydrophobicContact CZ-CG2 4.29Å; F218-E362 HydrophobicContact CB-CB 3.84Å; F218-E362 HydrophobicContact CB-CG 3.77Å; F218-E362 PolarHBondContact N-O 3.42Å; F218-E362 WeakPolarHBondContact O-CB 3.28Å
219	D	92.3	Very high	92.9	Very high	73 Å²	73	53.3 Å²	53.3	39%	0.39	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-86.6	117.5	173.2	-177.3	-4.7	0	0	0	109.7	N221 V222 T223	D219-N221 PolarHBondContact O-N 2.9Å; D219-N221 VanDerWaalsContact O-N 3.09Å; D219-N221 WeakPolarHBondContact OD1-CB 3.49Å; D219-N221 PolarHBondContact OD1-N 2.98Å; D219-N221 PolarHBondContact OD1-ND2 3.31Å; D219-V222 HydrophobicContact CB-CB 4.43Å; D219-V222 HydrophobicContact CB-CG2 3.84Å; D219-V222 PolarHBondContact O-N 2.89Å; D219-T223 PolarHBondContact O-N 3.39Å
220	P	94.4	Very high	93.3	Very high	71 Å²	71	54.4 Å²	54.4	46%	0.461	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.9	176.9	-23.8	34.3	0	0	0	114.3	F218 V222 E362	F218-P220 WeakPolarHBondContact O-CD 3.45Å; P220-V222 VanDerWaalsContact C-N 3.26Å; P220-V222 PolarHBondContact O-N 3.35Å; P220-E362 HydrophobicContact CB-CG 4.38Å; P220-E362 HydrophobicContact CG-CB 4.06Å; P220-E362 HydrophobicContact CG-CG 4.13Å
221	N	94.9	Very high	92.9	Very high	144 Å²	144	59.2 Å²	59.2	77%	0.77	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-19	177.8	-57.2	-53	0	0	0	112.8	D219	D219-N221 PolarHBondContact O-N 2.9Å; D219-N221 VanDerWaalsContact O-N 3.09Å; D219-N221 WeakPolarHBondContact OD1-CB 3.49Å; D219-N221 PolarHBondContact OD1-N 2.98Å; D219-N221 PolarHBondContact OD1-ND2 3.31Å
222	V	95.8	Very high	92.2	Very high	63 Å²	63	64.6 Å²	64.6	38%	0.382	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-20.7	178.9	-170.6	0	0	0	0	111.1	D219 P220 K224 F242	D219-V222 HydrophobicContact CB-CB 4.43Å; D219-V222 HydrophobicContact CB-CG2 3.84Å; D219-V222 PolarHBondContact O-N 2.89Å; P220-V222 VanDerWaalsContact C-N 3.26Å; P220-V222 PolarHBondContact O-N 3.35Å; V222-K224 PolarHBondContact O-N 3.5Å; V222-F242 HydrophobicContact CG1-CB 4Å; V222-F242 HydrophobicContact CG1-CD1 3.81Å; V222-F242 HydrophobicContact CG1-CG 4.29Å
223	T	97.3	Very high	91.4	Very high	27 Å²	27	72 Å²	72	17%	0.166	36%	0.356	C	S	.	.			trans	-61.4	129	174.4	-60.7	0	0	0	0	111.1	D219 P239 M240 M241 E362	D219-T223 PolarHBondContact O-N 3.39Å; T223-P239 HydrophobicContact CG2-CB 4.11Å; T223-M240 WeakPolarHBondContact CA-O 3.37Å; T223-M241 HydrophobicContact CG2-CG 4.36Å; T223-E362 VanDerWaalsContact CB-OE1 3.25Å; T223-E362 WeakPolarHBondContact CB-OE1 3.46Å; T223-E362 WeakPolarHBondContact CG2-OE1 3.12Å; T223-E362 PolarHBondContact OG1-OE1 3.42Å
224	K	97.6	Very high	91.4	Very high	129 Å²	129	73.3 Å²	73.3	56%	0.561	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.3	159.6	-179.4	65.1	-167.4	-178.7	-172.4	0	111.7	V222 E226 M240	V222-K224 PolarHBondContact O-N 3.5Å; K224-E226 WeakPolarHBondContact CE-OE1 3.4Å; K224-E226 HydrophobicContact CG-CG 4.02Å; K224-E226 IonicContact NZ-OE1 3.69Å; K224-E226 PolarHBondContact O-N 2.99Å; K224-M240 PolarHBondContact N-O 3.28Å; K224-M240 WeakPolarHBondContact O-CB 3.32Å; K224-M240 PolarHBondContact O-N 2.94Å
225	E	98.1	Very high	91.4	Very high	112 Å²	112	76 Å²	76	52%	0.523	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	120.1	175.7	-69.4	-62.3	144	0	0	110.5	V238	E225-V238 WeakPolarHBondContact CA-O 3.17Å; E225-V238 WeakPolarHBondContact OE2-CA 3.26Å; E225-V238 PolarHBondContact OE2-N 3.47Å
226	E	98.1	Very high	91.6	Very high	24 Å²	24	72.8 Å²	72.8	11%	0.112	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	164.3	175.7	-61	-165.5	176.5	0	0	111.2	K224 K237 V238 M240 K385	K224-E226 WeakPolarHBondContact CE-OE1 3.4Å; K224-E226 HydrophobicContact CG-CG 4.02Å; K224-E226 IonicContact NZ-OE1 3.69Å; K224-E226 PolarHBondContact O-N 2.99Å; E226-K237 WeakPolarHBondContact O-CA 3.29Å; E226-V238 PolarHBondContact N-O 2.8Å; E226-V238 PolarHBondContact O-N 2.79Å; E226-M240 HydrophobicContact CB-CB 3.81Å; E226-M240 HydrophobicContact CB-CE 4.47Å; E226-M240 HydrophobicContact CB-CG 4.3Å; E226-M240 HydrophobicContact CG-CB 3.79Å; E226-M240 HydrophobicContact CG-CG 4.3Å; E226-K385 WeakPolarHBondContact OE2-CE 3.2Å; E226-K385 IonicContact OE2-NZ 3.2Å; E226-K385 PolarHBondContact OE2-NZ 2.72Å
227	D	97.3	Very high	91.9	Very high	54 Å²	54	75.5 Å²	75.5	29%	0.289	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	134.5	177.1	-67.3	-56.9	0	0	0	111.3	F229 S235 K237	D227-F229 HydrophobicContact CB-CE1 4.47Å; D227-F229 HydrophobicContact CB-CE2 4.26Å; D227-F229 HydrophobicContact CB-CZ 4.05Å; D227-S235 PolarHBondContact OD1-OG 2.82Å; D227-K237 WeakPolarHBondContact OD1-CD 3.3Å; D227-K237 VanDerWaalsContact OD1-CE 3.25Å; D227-K237 WeakPolarHBondContact OD1-CE 3.37Å; D227-K237 IonicContact OD1-NZ 2.66Å; D227-K237 PolarHBondContact OD1-NZ 3.19Å; D227-K237 IonicContact OD2-NZ 2.82Å; D227-K237 PolarHBondContact OD2-NZ 3.38Å
228	F	97.4	Very high	92.1	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	118	163.3	-171.5	-79.5	0	0	0	108.8	L230 S235 V236 V238 P309 D387 R388 Y390 V409 P411	F228-L230 HydrophobicContact CD1-CD2 3.97Å; F228-L230 HydrophobicContact CE1-CD2 4.21Å; F228-S235 CarbonylContact O-C 3.58Å; F228-S235 VanDerWaalsContact O-CA 3.24Å; F228-S235 WeakPolarHBondContact O-CA 3.12Å; F228-V236 HydrophobicContact CB-CG2 4.1Å; F228-V236 PolarHBondContact N-O 2.81Å; F228-V236 PolarHBondContact O-N 2.94Å; F228-V238 HydrophobicContact CB-CG1 3.86Å; F228-V238 HydrophobicContact CB-CG2 3.88Å; F228-P309 HydrophobicContact CE2-CG 4.41Å; F228-D387 CarbonylContact C-O 3.56Å; F228-D387 WeakPolarHBondContact CA-O 3.26Å; F228-R388 VanDerWaalsContact CZ-O 3.29Å; F228-R388 WeakPolarHBondContact CZ-O 3.4Å; F228-Y390 HydrophobicContact CE2-CD1 4.15Å; F228-Y390 AromaticContact CE2-CE1 3.94Å; F228-Y390 HydrophobicContact CE2-CE1 3.94Å; F228-Y390 HydrophobicContact CZ-CD1 4.17Å; F228-Y390 HydrophobicContact CZ-CE1 4.18Å; F228-V409 WeakPolarHBondContact CE1-O 3.26Å; F228-P411 HydrophobicContact CD1-CG 4.26Å; F228-P411 HydrophobicContact CD2-CG 3.55Å; F228-P411 HydrophobicContact CE1-CG 4.3Å; F228-P411 HydrophobicContact CE2-CG 3.58Å; F228-P411 HydrophobicContact CG-CG 3.9Å; F228-P411 HydrophobicContact CZ-CG 3.95Å
229	F	95.1	Very high	92.2	Very high	97 Å²	97	75 Å²	75	43%	0.425	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	118.7	-175.6	-58.8	-82.7	0	0	0	111.3	D227 D387 R388 P389	D227-F229 HydrophobicContact CB-CE1 4.47Å; D227-F229 HydrophobicContact CB-CE2 4.26Å; D227-F229 HydrophobicContact CB-CZ 4.05Å; F229-D387 HydrophobicContact CD2-CB 4.27Å; F229-D387 WeakPolarHBondContact CD2-O 3.37Å; F229-D387 PolarHBondContact N-O 3.35Å; F229-R388 WeakPolarHBondContact O-CA 3.34Å; F229-P389 WeakPolarHBondContact O-CD 3.33Å
230	L	91.3	Very high	92.5	Very high	39 Å²	39	71.6 Å²	71.6	20%	0.204	37%	0.368	C	S	.	.			trans	-84.7	162.7	175.9	-52	177.2	0	0	0	110.6	F228 K232 N233 S234 V236 V409 N410	F228-L230 HydrophobicContact CD1-CD2 3.97Å; F228-L230 HydrophobicContact CE1-CD2 4.21Å; L230-K232 PolarHBondContact O-N 3.23Å; L230-N233 PolarHBondContact O-N 3.25Å; L230-S234 WeakPolarHBondContact CB-O 3.39Å; L230-S234 PolarHBondContact N-O 3.15Å; L230-V236 HydrophobicContact CD1-CG1 3.97Å; L230-V236 HydrophobicContact CD2-CG2 4.33Å; L230-V409 WeakPolarHBondContact CD2-O 3.16Å; L230-N410 HydrophobicContact CD2-CB 3.93Å
231	E	74.9	Confident	92.7	Very high	109 Å²	109	68.2 Å²	68.2	51%	0.509	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-16.6	-177.1	-71.3	-169.9	163	0	0	115.4	L280 P389	E231-L280 WeakPolarHBondContact OE1-CD2 3.3Å; E231-P389 HydrophobicContact CG-CG 4.13Å
232	K	69.9	Low	92.8	Very high	191 Å²	191	64.3 Å²	64.3	83%	0.83	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	27	-175.8	-65.1	-174.5	179.5	-179.3	0	113.9	L230 S234	L230-K232 PolarHBondContact O-N 3.23Å; K232-S234 PolarHBondContact O-N 3.28Å
233	N	72.3	Confident	92.8	Very high	156 Å²	156	63.2 Å²	63.2	83%	0.834	31%	0.313	S	S	*	.	S	Bend	trans	62.5	20	179.6	-129.4	26.6	0	0	0	114.3	L230	L230-N233 PolarHBondContact O-N 3.25Å
234	S	89.4	Confident	92.5	Very high	55 Å²	55	64 Å²	64	39%	0.385	32%	0.319	S	S	.	.			trans	-99.2	148.3	168.5	54.4	0	0	0	0	109.4	L230 K232	L230-S234 WeakPolarHBondContact CB-O 3.39Å; L230-S234 PolarHBondContact N-O 3.15Å; K232-S234 PolarHBondContact O-N 3.28Å
235	S	93.4	Very high	92.2	Very high	58 Å²	58	57.8 Å²	57.8	41%	0.406	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	156.6	170.7	67.7	0	0	0	0	111.2	D227 F228	D227-S235 PolarHBondContact OD1-OG 2.82Å; F228-S235 CarbonylContact O-C 3.58Å; F228-S235 VanDerWaalsContact O-CA 3.24Å; F228-S235 WeakPolarHBondContact O-CA 3.12Å
236	V	95.4	Very high	91.9	Very high	29 Å²	29	54.8 Å²	54.8	18%	0.176	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	145.4	167	-66.4	0	0	0	0	108.5	F228 L230 V238 I412	F228-V236 HydrophobicContact CB-CG2 4.1Å; F228-V236 PolarHBondContact N-O 2.81Å; F228-V236 PolarHBondContact O-N 2.94Å; L230-V236 HydrophobicContact CD1-CG1 3.97Å; L230-V236 HydrophobicContact CD2-CG2 4.33Å; V236-V238 HydrophobicContact CG2-CG1 3.98Å; V236-I412 HydrophobicContact CB-CD1 4.07Å; V236-I412 HydrophobicContact CG1-CD1 4.12Å; V236-I412 HydrophobicContact CG2-CD1 4.39Å; V236-I412 HydrophobicContact CG2-CG1 4.33Å
237	K	97	Very high	91.8	Very high	113 Å²	113	53.9 Å²	53.9	49%	0.491	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	130.1	171.9	-67.7	-60	-171.9	-169.3	0	109.6	E226 D227	E226-K237 WeakPolarHBondContact O-CA 3.29Å; D227-K237 WeakPolarHBondContact OD1-CD 3.3Å; D227-K237 VanDerWaalsContact OD1-CE 3.25Å; D227-K237 WeakPolarHBondContact OD1-CE 3.37Å; D227-K237 IonicContact OD1-NZ 2.66Å; D227-K237 PolarHBondContact OD1-NZ 3.19Å; D227-K237 IonicContact OD2-NZ 2.82Å; D227-K237 PolarHBondContact OD2-NZ 3.38Å
238	V	97.4	Very high	91.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	146.2	177	-53.9	0	0	0	0	110.3	E225 E226 F228 V236 M240 P309 P411 I412	E225-V238 WeakPolarHBondContact CA-O 3.17Å; E225-V238 WeakPolarHBondContact OE2-CA 3.26Å; E225-V238 PolarHBondContact OE2-N 3.47Å; E226-V238 PolarHBondContact N-O 2.8Å; E226-V238 PolarHBondContact O-N 2.79Å; F228-V238 HydrophobicContact CB-CG1 3.86Å; F228-V238 HydrophobicContact CB-CG2 3.88Å; V236-V238 HydrophobicContact CG2-CG1 3.98Å; V238-M240 HydrophobicContact CG2-CE 3.85Å; V238-M240 PolarHBondContact O-N 3.43Å; V238-P309 HydrophobicContact CG2-CB 3.93Å; V238-P411 HydrophobicContact CG1-CB 4.12Å; V238-P411 HydrophobicContact CG1-CG 4.14Å; V238-I412 HydrophobicContact CG1-CG2 4.09Å
239	P	97.9	Very high	91.8	Very high	31 Å²	31	55 Å²	55	20%	0.201	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	105.3	170.8	26.3	-34.5	0	0	0	109.5	T223 R310	T223-P239 HydrophobicContact CG2-CB 4.11Å; P239-R310 HydrophobicContact CB-CG 4.28Å; P239-R310 HydrophobicContact CG-CB 3.98Å; P239-R310 HydrophobicContact CG-CG 4.2Å; P239-R310 PolarHBondContact O-N 2.79Å
240	M	98.4	Very high	91.9	Very high	1 Å²	1	51 Å²	51	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	113.9	-177.5	-168.2	66.8	68.8	0	0	109.5	T223 K224 E226 V238 P309 D387	T223-M240 WeakPolarHBondContact CA-O 3.37Å; K224-M240 PolarHBondContact N-O 3.28Å; K224-M240 WeakPolarHBondContact O-CB 3.32Å; K224-M240 PolarHBondContact O-N 2.94Å; E226-M240 HydrophobicContact CB-CB 3.81Å; E226-M240 HydrophobicContact CB-CE 4.47Å; E226-M240 HydrophobicContact CB-CG 4.3Å; E226-M240 HydrophobicContact CG-CB 3.79Å; E226-M240 HydrophobicContact CG-CG 4.3Å; V238-M240 HydrophobicContact CG2-CE 3.85Å; V238-M240 PolarHBondContact O-N 3.43Å; M240-P309 HydrophobicContact CE-CB 4.4Å; M240-P309 HydrophobicContact SD-CB 4.31Å; M240-P309 VanDerWaalsContact SD-N 3.41Å; M240-D387 HydrophobicContact CE-CB 4.32Å
241	M	98.1	Very high	92.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	145.4	173.8	-51	178.8	-63	0	0	109	F218 T223 S307 V308 R310 M360 E362	F218-M241 HydrophobicContact CB-CB 4.21Å; F218-M241 HydrophobicContact CD1-CB 3.68Å; F218-M241 HydrophobicContact CD2-CE 4.35Å; F218-M241 HydrophobicContact CD2-SD 4.3Å; F218-M241 HydrophobicContact CE1-CB 4.14Å; F218-M241 HydrophobicContact CE2-CE 4.26Å; F218-M241 HydrophobicContact CG-CB 3.9Å; F218-M241 HydrophobicContact CG-SD 4.44Å; T223-M241 HydrophobicContact CG2-CG 4.36Å; M241-S307 CarbonylContact O-C 3.48Å; M241-S307 VanDerWaalsContact O-CA 3.26Å; M241-S307 WeakPolarHBondContact O-CA 3.49Å; M241-V308 WeakPolarHBondContact CA-O 3.06Å; M241-V308 VanDerWaalsContact CB-O 3.31Å; M241-V308 WeakPolarHBondContact CB-O 3.14Å; M241-V308 HydrophobicContact CE-CB 4.13Å; M241-V308 HydrophobicContact CE-CG1 4.16Å; M241-V308 PolarHBondContact N-O 2.87Å; M241-V308 PolarHBondContact O-N 2.78Å; M241-R310 HydrophobicContact CG-CG 3.86Å; M241-R310 HydrophobicContact SD-CG 3.89Å; M241-M360 HydrophobicContact CE-CG 4.45Å; M241-E362 HydrophobicContact CG-CG 4.03Å; M241-E362 HydrophobicContact SD-CB 4.39Å; M241-E362 HydrophobicContact SD-CG 3.89Å; M241-E362 PolarHBondContact SD-N 3.13Å
242	F	97.2	Very high	93.3	Very high	63 Å²	63	48.2 Å²	48.2	28%	0.276	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	138.1	-179.5	175.9	-86.9	0	0	0	111.4	V222 D305 V306	V222-F242 HydrophobicContact CG1-CB 4Å; V222-F242 HydrophobicContact CG1-CD1 3.81Å; V222-F242 HydrophobicContact CG1-CG 4.29Å; F242-D305 HydrophobicContact CE2-CB 3.88Å; F242-D305 HydrophobicContact CZ-CB 4.01Å; F242-V306 WeakPolarHBondContact CA-O 3.27Å
243	H	94.6	Very high	94.6	Very high	40 Å²	40	45.1 Å²	45.1	19%	0.185	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	138.8	171.7	179.3	-88	0	0	0	110	F218 Y247 V306	F218-H243 HydrophobicContact CD1-CB 3.54Å; F218-H243 HydrophobicContact CE1-CB 3.69Å; F218-H243 HydrophobicContact CG-CB 4.38Å; H243-Y247 AromaticContact ND1-CE2 3.75Å; H243-Y247 AromaticContact ND1-CZ 3.64Å; H243-Y247 PolarHBondContact ND1-OH 2.84Å; H243-V306 HydrophobicContact CB-CG2 4.23Å; H243-V306 PolarHBondContact N-O 2.83Å; H243-V306 WeakPolarHBondContact O-CG2 3.41Å; H243-V306 PolarHBondContact O-N 3.43Å
244	S	92.6	Very high	95.7	Very high	42 Å²	42	44 Å²	44	29%	0.294	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	124.5	171.2	-170.3	0	0	0	0	109.2	V304 D305	S244-V304 WeakPolarHBondContact CA-O 3.38Å; S244-D305 WeakPolarHBondContact CB-OD1 3.29Å; S244-D305 PolarHBondContact OG-OD1 2.8Å
245	G	91.2	Very high	96.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.2	-178.1	-176	0	0	0	0	0	114.7	Y247 V303 V304	G245-Y247 VanDerWaalsContact O-CD2 3.31Å; G245-Y247 WeakPolarHBondContact O-CD2 3.23Å; G245-Y247 PolarHBondContact O-N 2.87Å; G245-V303 CarbonylContact O-C 3.51Å; G245-V303 WeakPolarHBondContact O-CA 3.29Å; G245-V304 PolarHBondContact N-O 3.39Å; G245-V304 VanDerWaalsContact N-O 3.08Å; G245-V304 PolarHBondContact O-N 2.89Å
246	M	91.8	Very high	96.3	Very high	48 Å²	48	39.7 Å²	39.7	24%	0.236	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	111.8	177.1	-73.5	-66.7	-81.2	0	0	111.7	R301 R302 V303 L376	M246-R301 HydrophobicContact CB-CG 4.46Å; M246-R301 HydrophobicContact CE-CB 4.4Å; M246-R301 HydrophobicContact CE-CG 3.76Å; M246-R302 WeakPolarHBondContact CA-O 3.14Å; M246-V303 HydrophobicContact SD-CB 4.29Å; M246-V303 HydrophobicContact SD-CG2 3.49Å; M246-V303 WeakPolarHBondContact SD-CG2 3.43Å; M246-V303 PolarHBondContact SD-N 2.96Å; M246-V303 VanDerWaalsContact SD-N 3.42Å; M246-L376 HydrophobicContact CG-CD2 3.93Å
247	Y	95.3	Very high	96.4	Very high	6 Å²	6	38.3 Å²	38.3	2%	0.024	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	157.7	-180	-67.2	-79.5	0	0	0	112.3	H243 G245 L260 I262 R301 R302 V304 V306	H243-Y247 AromaticContact ND1-CE2 3.75Å; H243-Y247 AromaticContact ND1-CZ 3.64Å; H243-Y247 PolarHBondContact ND1-OH 2.84Å; G245-Y247 VanDerWaalsContact O-CD2 3.31Å; G245-Y247 WeakPolarHBondContact O-CD2 3.23Å; G245-Y247 PolarHBondContact O-N 2.87Å; Y247-L260 HydrophobicContact CG-CD1 4.23Å; Y247-I262 HydrophobicContact CD1-CG1 4.28Å; Y247-I262 HydrophobicContact CE1-CB 4.48Å; Y247-I262 HydrophobicContact CE1-CG1 4.17Å; Y247-I262 HydrophobicContact CE1-CG2 4.1Å; Y247-R301 CarbonylContact O-C 3.53Å; Y247-R301 WeakPolarHBondContact O-CA 3.41Å; Y247-R302 PolarHBondContact N-O 3.02Å; Y247-R302 PolarHBondContact O-N 2.82Å; Y247-V304 HydrophobicContact CD2-CB 4.02Å; Y247-V306 HydrophobicContact CD2-CG1 3.72Å; Y247-V306 HydrophobicContact CD2-CG2 4.32Å; Y247-V306 HydrophobicContact CE1-CG2 4.48Å; Y247-V306 HydrophobicContact CE2-CB 4.35Å; Y247-V306 HydrophobicContact CE2-CG1 3.8Å; Y247-V306 HydrophobicContact CE2-CG2 3.54Å; Y247-V306 HydrophobicContact CG-CG1 4.23Å
248	Q	97	Very high	96.5	Very high	74 Å²	74	34.3 Å²	34.3	35%	0.346	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	119.3	165.2	-63.7	-68.8	-3.4	0	0	108.1	E261 L299 S300	Q248-E261 HydrophobicContact CB-CB 4.04Å; Q248-E261 HydrophobicContact CB-CG 4.18Å; Q248-E261 PolarHBondContact O-N 2.55Å; Q248-L299 HydrophobicContact CB-CB 4.42Å; Q248-L299 HydrophobicContact CB-CD2 4.3Å; Q248-S300 PolarHBondContact OE1-O 3.14Å
249	V	97.9	Very high	96.5	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.018	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	147.5	-177.1	66.3	0	0	0	0	110.3	T258 I259 L260 S300 R302 V304 L382 V384	V249-T258 HydrophobicContact CG2-CG2 4.23Å; V249-I259 VanDerWaalsContact CA-O 3.32Å; V249-I259 WeakPolarHBondContact CA-O 3.2Å; V249-I259 WeakPolarHBondContact CG2-O 3.18Å; V249-L260 HydrophobicContact CB-CD1 4.45Å; V249-S300 PolarHBondContact N-O 2.63Å; V249-S300 PolarHBondContact O-N 3.4Å; V249-S300 PolarHBondContact O-OG 2.62Å; V249-R302 HydrophobicContact CG1-CB 3.94Å; V249-R302 HydrophobicContact CG1-CG 4.14Å; V249-V304 HydrophobicContact CB-CG2 4.18Å; V249-V304 HydrophobicContact CG1-CG2 3.75Å; V249-L382 HydrophobicContact CG1-CD2 3.89Å; V249-L382 HydrophobicContact CG2-CD2 3.89Å; V249-V384 HydrophobicContact CG2-CG2 4.08Å
250	G	97.6	Very high	96.5	Very high	13 Å²	13	33 Å²	33	13%	0.134	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162	171.7	177.2	0	0	0	0	0	111.3	I259	G250-I259 PolarHBondContact N-O 2.94Å; G250-I259 PolarHBondContact O-N 3.33Å
251	Y	98.1	Very high	96.5	Very high	84 Å²	84	33.6 Å²	33.6	33%	0.329	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.1	175.8	-178.2	-98.5	0	0	0	109	D253 C257 D276	Y251-D253 HydrophobicContact CE1-CB 4.37Å; Y251-D253 VanDerWaalsContact CE1-OD1 3.27Å; Y251-D253 WeakPolarHBondContact CE1-OD1 3.28Å; Y251-C257 WeakPolarHBondContact CD2-O 3.32Å; Y251-D276 PolarHBondContact OH-OD2 2.91Å
252	D	97.6	Very high	96.4	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.027	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	97.4	176.7	-176.5	11.7	0	0	0	109.8	K254 L255 S256 C257 I259 R294 W295 L298	D252-K254 PolarHBondContact O-N 3.13Å; D252-K254 VanDerWaalsContact O-N 3.14Å; D252-K254 WeakPolarHBondContact OD1-CB 3.2Å; D252-K254 PolarHBondContact OD1-N 2.9Å; D252-L255 CarbonylContact O-C 3.46Å; D252-L255 PolarHBondContact O-N 3.49Å; D252-L255 VanDerWaalsContact O-N 3.09Å; D252-L255 WeakPolarHBondContact OD2-CD1 3.27Å; D252-L255 WeakPolarHBondContact OD2-CG 3.47Å; D252-S256 WeakPolarHBondContact O-CA 3.09Å; D252-S256 PolarHBondContact O-N 2.91Å; D252-C257 PolarHBondContact N-O 3.27Å; D252-C257 PolarHBondContact O-N 3.25Å; D252-I259 HydrophobicContact CB-CD1 4.08Å; D252-R294 IonicContact OD1-CZ 2.62Å; D252-R294 IonicContact OD1-NE 2.74Å; D252-R294 PolarHBondContact OD1-NE 3.34Å; D252-R294 IonicContact OD1-NH2 2.78Å; D252-R294 IonicContact OD2-CZ 3.82Å; D252-R294 IonicContact OD2-NE 3.85Å; D252-R294 PolarHBondContact OD2-NE 3Å; D252-R294 IonicContact OD2-NH2 2.76Å; D252-R294 PolarHBondContact OD2-NH2 3.04Å; D252-W295 PolarHBondContact OD2-NE1 3.07Å; D252-L298 HydrophobicContact CB-CD1 3.82Å
253	D	96.8	Very high	96.4	Very high	126 Å²	126	32.1 Å²	32.1	67%	0.674	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-33.5	179	-62.8	-74.6	0	0	0	112.5	Y251 L255	Y251-D253 HydrophobicContact CE1-CB 4.37Å; Y251-D253 VanDerWaalsContact CE1-OD1 3.27Å; Y251-D253 WeakPolarHBondContact CE1-OD1 3.28Å; D253-L255 VanDerWaalsContact C-N 3.31Å; D253-L255 PolarHBondContact O-N 2.65Å
254	K	95.9	Very high	96.3	Very high	132 Å²	132	30.2 Å²	30.2	57%	0.574	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-36.8	-178.6	-174.9	176.9	179.6	177	0	112	D252 H282	D252-K254 PolarHBondContact O-N 3.13Å; D252-K254 VanDerWaalsContact O-N 3.14Å; D252-K254 WeakPolarHBondContact OD1-CB 3.2Å; D252-K254 PolarHBondContact OD1-N 2.9Å; K254-H282 PolarHBondContact O-NE2 3.31Å
255	L	96.5	Very high	96	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.021	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-2.1	-177	-61.9	-176.3	0	0	0	113.2	D252 D253 H282 L283 T291 W295	D252-L255 CarbonylContact O-C 3.46Å; D252-L255 PolarHBondContact O-N 3.49Å; D252-L255 VanDerWaalsContact O-N 3.09Å; D252-L255 WeakPolarHBondContact OD2-CD1 3.27Å; D252-L255 WeakPolarHBondContact OD2-CG 3.47Å; D253-L255 VanDerWaalsContact C-N 3.31Å; D253-L255 PolarHBondContact O-N 2.65Å; L255-H282 PolarHBondContact O-CD2 3.09Å; L255-L283 HydrophobicContact CB-CD1 4.05Å; L255-L283 HydrophobicContact CD1-CD1 3.99Å; L255-T291 HydrophobicContact CD1-CG2 3.54Å; L255-W295 HydrophobicContact CD1-CZ2 4.03Å
256	S	97.4	Very high	95.6	Very high	20 Å²	20	36 Å²	36	14%	0.14	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	56.9	-179.8	-50.8	0	0	0	0	110.9	D252 D276	D252-S256 WeakPolarHBondContact O-CA 3.09Å; D252-S256 PolarHBondContact O-N 2.91Å; S256-D276 WeakPolarHBondContact CB-OD2 3.49Å; S256-D276 PolarHBondContact O-N 2.87Å
257	C	98	Very high	95.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	144.3	-178.9	68.8	0	0	0	0	113.3	Y251 D252 L274 L283	Y251-C257 WeakPolarHBondContact CD2-O 3.32Å; D252-C257 PolarHBondContact N-O 3.27Å; D252-C257 PolarHBondContact O-N 3.25Å; C257-L274 CarbonylContact C-O 3.42Å; C257-L274 WeakPolarHBondContact CA-O 3.44Å; C257-L283 HydrophobicContact CB-CD1 4.35Å; C257-L283 HydrophobicContact CB-CD2 4.25Å
258	T	98.4	Very high	95.3	Very high	29 Å²	29	37.4 Å²	37.4	18%	0.178	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	134.1	167.6	-57	0	0	0	0	109.8	V249 L274 V384	V249-T258 HydrophobicContact CG2-CG2 4.23Å; T258-L274 PolarHBondContact N-O 3.07Å; T258-L274 PolarHBondContact O-N 3.42Å; T258-V384 HydrophobicContact CG2-CG1 4.3Å; T258-V384 HydrophobicContact CG2-CG2 4.2Å
259	I	98.4	Very high	95.2	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126.2	177.3	-51.6	150	0	0	0	107.4	V249 G250 D252 I271 F272 L273 W295 L298 L299	V249-I259 VanDerWaalsContact CA-O 3.32Å; V249-I259 WeakPolarHBondContact CA-O 3.2Å; V249-I259 WeakPolarHBondContact CG2-O 3.18Å; G250-I259 PolarHBondContact N-O 2.94Å; G250-I259 PolarHBondContact O-N 3.33Å; D252-I259 HydrophobicContact CB-CD1 4.08Å; I259-I271 HydrophobicContact CG2-CG2 3.97Å; I259-F272 WeakPolarHBondContact CA-O 3.27Å; I259-L273 HydrophobicContact CB-CD2 4.37Å; I259-L273 HydrophobicContact CG1-CD2 3.95Å; I259-L273 HydrophobicContact CG2-CD2 4.01Å; I259-W295 HydrophobicContact CD1-CB 3.82Å; I259-W295 HydrophobicContact CD1-CD2 4.2Å; I259-W295 HydrophobicContact CD1-CG 3.49Å; I259-W295 VanDerWaalsContact CD1-CG 3.49Å; I259-W295 HydrophobicContact CG1-CD2 4.46Å; I259-W295 HydrophobicContact CG1-CG 4.22Å; I259-L298 HydrophobicContact CD1-CD1 4.44Å; I259-L299 HydrophobicContact CB-CD2 4.18Å; I259-L299 HydrophobicContact CG2-CD2 3.89Å
260	L	98.4	Very high	95.1	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127.2	176.2	174.5	68	0	0	0	109.7	Y247 V249 I262 I271 F272 V306 V384 I386	Y247-L260 HydrophobicContact CG-CD1 4.23Å; V249-L260 HydrophobicContact CB-CD1 4.45Å; L260-I262 HydrophobicContact CD2-CD1 4Å; L260-I262 HydrophobicContact CD2-CG1 4.1Å; L260-I262 HydrophobicContact CG-CG1 4.07Å; L260-I271 CarbonylContact O-C 3.54Å; L260-I271 WeakPolarHBondContact O-CA 3Å; L260-F272 HydrophobicContact CB-CB 4.37Å; L260-F272 PolarHBondContact N-O 3.45Å; L260-F272 PolarHBondContact O-N 2.95Å; L260-V306 HydrophobicContact CD1-CG1 3.89Å; L260-V306 HydrophobicContact CD2-CB 4.21Å; L260-V306 HydrophobicContact CD2-CG1 3.72Å; L260-V306 HydrophobicContact CG-CG1 4.46Å; L260-V384 HydrophobicContact CB-CG1 4.47Å; L260-V384 HydrophobicContact CD2-CG1 4.03Å; L260-I386 HydrophobicContact CD2-CD1 4.35Å
261	E	97.6	Very high	95.1	Very high	14 Å²	14	33.2 Å²	33.2	7%	0.065	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.2	171.5	-46.4	-158.4	146.6	0	0	111.6	Q248 T269 A270 I271 K296 L299	Q248-E261 HydrophobicContact CB-CB 4.04Å; Q248-E261 HydrophobicContact CB-CG 4.18Å; Q248-E261 PolarHBondContact O-N 2.55Å; E261-T269 HydrophobicContact CB-CG2 3.66Å; E261-T269 HydrophobicContact CG-CG2 4.46Å; E261-A270 WeakPolarHBondContact CA-O 3.42Å; E261-I271 HydrophobicContact CG-CG1 4.1Å; E261-K296 VanDerWaalsContact CD-NZ 3.3Å; E261-K296 IonicContact OE1-NZ 2.95Å; E261-K296 PolarHBondContact OE1-NZ 2.92Å; E261-K296 IonicContact OE2-NZ 3.29Å; E261-K296 PolarHBondContact OE2-NZ 3.07Å; E261-K296 VanDerWaalsContact OE2-NZ 3.14Å; E261-L299 HydrophobicContact CG-CD1 3.71Å; E261-L299 HydrophobicContact CG-CD2 4.21Å; E261-L299 VanDerWaalsContact OE1-CD1 3.24Å; E261-L299 WeakPolarHBondContact OE1-CD1 3.48Å
262	I	97.1	Very high	95.2	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	110	173.9	-53.1	-171.7	0	0	0	108	W214 F218 Y247 L260 A270 F272 V308	W214-I262 HydrophobicContact CD2-CG2 4.1Å; W214-I262 HydrophobicContact CE3-CB 4.39Å; W214-I262 HydrophobicContact CE3-CG2 3.51Å; W214-I262 HydrophobicContact CH2-CB 4.42Å; W214-I262 HydrophobicContact CH2-CG2 4.14Å; W214-I262 HydrophobicContact CZ3-CB 3.94Å; W214-I262 HydrophobicContact CZ3-CG2 3.53Å; F218-I262 HydrophobicContact CZ-CD1 4.23Å; Y247-I262 HydrophobicContact CD1-CG1 4.28Å; Y247-I262 HydrophobicContact CE1-CB 4.48Å; Y247-I262 HydrophobicContact CE1-CG1 4.17Å; Y247-I262 HydrophobicContact CE1-CG2 4.1Å; L260-I262 HydrophobicContact CD2-CD1 4Å; L260-I262 HydrophobicContact CD2-CG1 4.1Å; L260-I262 HydrophobicContact CG-CG1 4.07Å; I262-A270 PolarHBondContact N-O 3.2Å; I262-A270 PolarHBondContact O-N 2.93Å; I262-F272 HydrophobicContact CB-CE2 4.24Å; I262-F272 HydrophobicContact CD1-CD2 4.19Å; I262-F272 HydrophobicContact CD1-CE2 3.69Å; I262-F272 HydrophobicContact CD1-CZ 4.42Å; I262-F272 HydrophobicContact CG1-CD2 4.19Å; I262-F272 HydrophobicContact CG1-CE2 3.92Å; I262-V308 HydrophobicContact CD1-CG2 3.8Å
263	P	95.3	Very high	95.2	Very high	31 Å²	31	29 Å²	29	20%	0.201	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	141.2	-177.4	28.9	-32.9	0	0	0	112	Q215	Q215-P263 HydrophobicContact CB-CB 4.21Å; Q215-P263 HydrophobicContact CB-CG 4.01Å; Q215-P263 WeakPolarHBondContact CB-O 3.23Å; Q215-P263 PolarHBondContact N-O 3.46Å; Q215-P263 VanDerWaalsContact OE1-CB 3.32Å
264	Y	93.1	Very high	95.2	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.116	C	C	.	.	B	Isolated β-bridge	trans	-85.2	171.5	161	-66.3	-84.1	0	0	0	109.9	F210 A212 R213 W214 K266 I268 A270 T365 I394	F210-Y264 HydrophobicContact CE1-CE1 4.47Å; F210-Y264 HydrophobicContact CE1-CE2 4.23Å; F210-Y264 HydrophobicContact CZ-CD2 4.19Å; F210-Y264 HydrophobicContact CZ-CE1 4.47Å; F210-Y264 HydrophobicContact CZ-CE2 4.01Å; F210-Y264 HydrophobicContact CZ-CG 4.48Å; A212-Y264 HydrophobicContact CB-CD1 3.51Å; A212-Y264 HydrophobicContact CB-CE1 4.14Å; A212-Y264 HydrophobicContact CB-CG 3.79Å; A212-Y264 WeakPolarHBondContact O-CD1 3.27Å; R213-Y264 CarbonylContact O-C 3.44Å; R213-Y264 VanDerWaalsContact O-CA 3.24Å; R213-Y264 WeakPolarHBondContact O-CA 3.46Å; R213-Y264 WeakPolarHBondContact O-CB 3.14Å; R213-Y264 WeakPolarHBondContact O-CD1 3.28Å; W214-Y264 HydrophobicContact CD2-CD1 4.13Å; W214-Y264 AromaticContact CD2-CE1 3.85Å; W214-Y264 HydrophobicContact CD2-CE1 3.85Å; W214-Y264 AromaticContact CE3-CD1 3.56Å; W214-Y264 HydrophobicContact CE3-CD1 3.56Å; W214-Y264 HydrophobicContact CE3-CD2 4.27Å; W214-Y264 AromaticContact CE3-CE1 3.42Å; W214-Y264 HydrophobicContact CE3-CE1 3.42Å; W214-Y264 VanDerWaalsContact CE3-CE1 3.42Å; W214-Y264 HydrophobicContact CE3-CE2 4.18Å; W214-Y264 AromaticContact CE3-CG 3.99Å; W214-Y264 HydrophobicContact CE3-CG 3.99Å; W214-Y264 AromaticContact CE3-CZ 3.76Å; W214-Y264 AromaticContact CH2-CE1 3.74Å; W214-Y264 HydrophobicContact CH2-CE1 3.74Å; W214-Y264 HydrophobicContact CH2-CE2 4.01Å; W214-Y264 AromaticContact CH2-CZ 3.37Å; W214-Y264 WeakPolarHBondContact CH2-OH 3.5Å; W214-Y264 HydrophobicContact CZ2-CE1 4.12Å; W214-Y264 AromaticContact CZ3-CD1 3.85Å; W214-Y264 HydrophobicContact CZ3-CD1 3.85Å; W214-Y264 AromaticContact CZ3-CD2 3.93Å; W214-Y264 HydrophobicContact CZ3-CD2 3.93Å; W214-Y264 AromaticContact CZ3-CE1 3.36Å; W214-Y264 HydrophobicContact CZ3-CE1 3.36Å; W214-Y264 AromaticContact CZ3-CE2 3.47Å; W214-Y264 HydrophobicContact CZ3-CE2 3.47Å; W214-Y264 VanDerWaalsContact CZ3-CE2 3.47Å; W214-Y264 HydrophobicContact CZ3-CG 4.11Å; W214-Y264 AromaticContact CZ3-CZ 3.15Å; W214-Y264 WeakPolarHBondContact CZ3-OH 3.48Å; Y264-K266 PolarHBondContact O-N 3.15Å; Y264-I268 WeakPolarHBondContact CB-O 3.33Å; Y264-I268 HydrophobicContact CD2-CB 4.24Å; Y264-I268 HydrophobicContact CD2-CG2 3.87Å; Y264-I268 HydrophobicContact CE2-CG2 4.44Å; Y264-I268 PolarHBondContact N-O 3.47Å; Y264-A270 HydrophobicContact CE2-CB 3.81Å; Y264-T365 PolarHBondContact OH-OG1 3.08Å; Y264-I394 HydrophobicContact CE2-CD1 4.14Å
265	H	86.3	Confident	95.3	Very high	61 Å²	61	17.3 Å²	17.3	28%	0.282	9%	0.089	S	C	.	.	S	Bend	trans	-55.2	139.7	162.8	-78.5	80.3	0	0	0	110	D129 R213 W214	D129-H265 HydrophobicContact CB-CB 3.85Å; R213-H265 PolarHBondContact O-N 2.96Å; R213-H265 PolarHBondContact O-ND1 3.15Å; W214-H265 PolarHBondContact O-CE1 2.94Å; W214-H265 PolarHBondContact O-ND1 2.94Å
266	K	84.3	Confident	95.3	Very high	103 Å²	103	19.3 Å²	19.3	45%	0.448	10%	0.1	S	C	.	.	S	Bend	trans	67.5	-148.2	-175.3	-51.3	-174.2	170	-176.5	0	112.8	T127 L130 Y264 I268	T127-K266 VanDerWaalsContact CB-NZ 3.32Å; T127-K266 PolarHBondContact OG1-NZ 3.44Å; L130-K266 HydrophobicContact CB-CD 4.29Å; L130-K266 HydrophobicContact CD2-CB 4.4Å; L130-K266 HydrophobicContact CD2-CD 4.21Å; Y264-K266 PolarHBondContact O-N 3.15Å; K266-I268 VanDerWaalsContact C-N 3.34Å; K266-I268 PolarHBondContact O-N 2.62Å
267	N	86.4	Confident	95.1	Very high	76 Å²	76	26.6 Å²	26.6	41%	0.406	13%	0.132	S	C	.	.	S	Bend	trans	-95.1	32.3	-165.1	-58.4	-52.3	0	0	0	113.1	S396 Q397 K398	N267-S396 CarbonylContact O-C 3.32Å; N267-Q397 HydrophobicContact CB-CB 4.34Å; N267-Q397 PolarHBondContact O-N 3.23Å; N267-K398 HydrophobicContact CB-CB 3.64Å
268	I	92.5	Very high	94.7	Very high	6 Å²	6	30.4 Å²	30.4	3%	0.031	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	144.2	179.2	-49.9	-62.9	0	0	0	109.4	L130 F210 Y264 K266 I394 Y395 L403	L130-I268 HydrophobicContact CD1-CG1 3.99Å; L130-I268 HydrophobicContact CD2-CG1 3.91Å; F210-I268 HydrophobicContact CE2-CG1 4.45Å; F210-I268 HydrophobicContact CE2-CG2 3.81Å; F210-I268 HydrophobicContact CZ-CG2 3.8Å; Y264-I268 WeakPolarHBondContact CB-O 3.33Å; Y264-I268 HydrophobicContact CD2-CB 4.24Å; Y264-I268 HydrophobicContact CD2-CG2 3.87Å; Y264-I268 HydrophobicContact CE2-CG2 4.44Å; Y264-I268 PolarHBondContact N-O 3.47Å; K266-I268 VanDerWaalsContact C-N 3.34Å; K266-I268 PolarHBondContact O-N 2.62Å; I268-I394 HydrophobicContact CG2-CG2 3.75Å; I268-Y395 WeakPolarHBondContact CA-O 3.45Å; I268-L403 HydrophobicContact CD1-CD1 3.97Å; I268-L403 HydrophobicContact CG2-CD1 4.47Å
269	T	95.2	Very high	94.5	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	136.9	-177	-54	0	0	0	0	110.4	E261 I271 Y395 Q397	E261-T269 HydrophobicContact CB-CG2 3.66Å; E261-T269 HydrophobicContact CG-CG2 4.46Å; T269-I271 HydrophobicContact CG2-CG1 4.25Å; T269-Y395 PolarHBondContact N-O 3.23Å; T269-Y395 PolarHBondContact O-N 3.15Å; T269-Q397 PolarHBondContact OG1-NE2 3.1Å
270	A	97.1	Very high	94.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	127	164.9	0	0	0	0	0	108.9	W214 E261 I262 Y264 F272 L392 L393 I394	W214-A270 HydrophobicContact CH2-CB 3.67Å; W214-A270 HydrophobicContact CZ3-CB 3.72Å; E261-A270 WeakPolarHBondContact CA-O 3.42Å; I262-A270 PolarHBondContact N-O 3.2Å; I262-A270 PolarHBondContact O-N 2.93Å; Y264-A270 HydrophobicContact CE2-CB 3.81Å; A270-F272 HydrophobicContact CB-CD2 4.39Å; A270-F272 HydrophobicContact CB-CE2 3.64Å; A270-F272 HydrophobicContact CB-CZ 4.19Å; A270-L392 HydrophobicContact CB-CD1 4.15Å; A270-L393 CarbonylContact C-O 3.53Å; A270-L393 WeakPolarHBondContact CA-O 3.49Å; A270-I394 HydrophobicContact CB-CD1 3.82Å
271	I	97.6	Very high	94.1	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	117.5	177.5	-55.2	169.7	0	0	0	107	I259 L260 E261 T269 L273 F292 L393 Y395	I259-I271 HydrophobicContact CG2-CG2 3.97Å; L260-I271 CarbonylContact O-C 3.54Å; L260-I271 WeakPolarHBondContact O-CA 3Å; E261-I271 HydrophobicContact CG-CG1 4.1Å; T269-I271 HydrophobicContact CG2-CG1 4.25Å; I271-L273 HydrophobicContact CG2-CD2 4.2Å; I271-F292 HydrophobicContact CD1-CE2 3.47Å; I271-F292 VanDerWaalsContact CD1-CE2 3.47Å; I271-F292 HydrophobicContact CD1-CZ 3.62Å; I271-L393 HydrophobicContact CB-CB 4.23Å; I271-L393 PolarHBondContact N-O 2.79Å; I271-L393 PolarHBondContact O-N 2.74Å; I271-Y395 HydrophobicContact CD1-CD1 4.5Å; I271-Y395 HydrophobicContact CD1-CG 4.27Å
272	F	98.4	Very high	94	Very high	1 Å²	1	43.2 Å²	43.2	0%	0.004	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.7	177.4	-61.5	-98.9	0	0	0	108.9	I259 L260 I262 A270 V308 M360 I386 Y390 L392	I259-F272 WeakPolarHBondContact CA-O 3.27Å; L260-F272 HydrophobicContact CB-CB 4.37Å; L260-F272 PolarHBondContact N-O 3.45Å; L260-F272 PolarHBondContact O-N 2.95Å; I262-F272 HydrophobicContact CB-CE2 4.24Å; I262-F272 HydrophobicContact CD1-CD2 4.19Å; I262-F272 HydrophobicContact CD1-CE2 3.69Å; I262-F272 HydrophobicContact CD1-CZ 4.42Å; I262-F272 HydrophobicContact CG1-CD2 4.19Å; I262-F272 HydrophobicContact CG1-CE2 3.92Å; A270-F272 HydrophobicContact CB-CD2 4.39Å; A270-F272 HydrophobicContact CB-CE2 3.64Å; A270-F272 HydrophobicContact CB-CZ 4.19Å; F272-V308 HydrophobicContact CE1-CG1 3.7Å; F272-V308 HydrophobicContact CZ-CG1 3.76Å; F272-M360 HydrophobicContact CE1-CE 4.41Å; F272-M360 HydrophobicContact CE1-SD 4.27Å; F272-M360 HydrophobicContact CZ-CE 3.87Å; F272-M360 HydrophobicContact CZ-SD 3.81Å; F272-I386 HydrophobicContact CB-CD1 3.63Å; F272-I386 HydrophobicContact CD1-CD1 3.35Å; F272-I386 HydrophobicContact CD2-CD1 4.29Å; F272-I386 HydrophobicContact CE1-CD1 4.02Å; F272-I386 HydrophobicContact CG-CD1 3.5Å; F272-Y390 AromaticContact CD1-CD2 3.91Å; F272-Y390 HydrophobicContact CD1-CD2 3.91Å; F272-Y390 AromaticContact CD1-CE2 3.67Å; F272-Y390 HydrophobicContact CD1-CE2 3.67Å; F272-Y390 AromaticContact CE1-CE2 3.95Å; F272-Y390 HydrophobicContact CE1-CE2 3.95Å; F272-L392 HydrophobicContact CD1-CD1 3.96Å; F272-L392 HydrophobicContact CD2-CD1 4.44Å; F272-L392 HydrophobicContact CE1-CD1 3.75Å; F272-L392 HydrophobicContact CE2-CD1 4.23Å; F272-L392 HydrophobicContact CG-CD1 4.31Å; F272-L392 HydrophobicContact CZ-CD1 3.89Å
273	L	98.1	Very high	93.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	103.4	175.6	-52	169.3	0	0	0	107.4	I259 I271 P275 L283 L287 W295 Y390 L391 L393	I259-L273 HydrophobicContact CB-CD2 4.37Å; I259-L273 HydrophobicContact CG1-CD2 3.95Å; I259-L273 HydrophobicContact CG2-CD2 4.01Å; I271-L273 HydrophobicContact CG2-CD2 4.2Å; L273-P275 VanDerWaalsContact O-CD 3.28Å; L273-P275 WeakPolarHBondContact O-CD 3.29Å; L273-L283 HydrophobicContact CB-CD2 3.98Å; L273-L287 HydrophobicContact CD1-CD2 4.43Å; L273-W295 HydrophobicContact CD1-CH2 3.15Å; L273-W295 HydrophobicContact CD1-CZ2 3.87Å; L273-W295 HydrophobicContact CD1-CZ3 3.63Å; L273-W295 HydrophobicContact CD2-CD2 4.23Å; L273-W295 HydrophobicContact CD2-CE3 4Å; L273-W295 HydrophobicContact CD2-CH2 3.62Å; L273-W295 HydrophobicContact CD2-CZ2 3.79Å; L273-W295 HydrophobicContact CD2-CZ3 3.71Å; L273-W295 HydrophobicContact CG-CH2 4.02Å; L273-W295 HydrophobicContact CG-CZ2 4.47Å; L273-W295 HydrophobicContact CG-CZ3 4.27Å; L273-Y390 WeakPolarHBondContact O-CA 3.32Å; L273-Y390 WeakPolarHBondContact O-CB 3.41Å; L273-L391 HydrophobicContact CB-CB 4.12Å; L273-L391 HydrophobicContact CD1-CB 4.09Å; L273-L391 HydrophobicContact CD1-CD1 4.3Å; L273-L391 PolarHBondContact N-O 3.38Å; L273-L391 PolarHBondContact O-N 2.98Å; L273-L393 HydrophobicContact CD1-CD1 3.59Å; L273-L393 HydrophobicContact CG-CD1 4.23Å
274	L	98.1	Very high	93.8	Very high	7 Å²	7	42.4 Å²	42.4	4%	0.037	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	100.1	-178	-177.5	67	0	0	0	108.3	C257 T258 K385 I386 R388	C257-L274 CarbonylContact C-O 3.42Å; C257-L274 WeakPolarHBondContact CA-O 3.44Å; T258-L274 PolarHBondContact N-O 3.07Å; T258-L274 PolarHBondContact O-N 3.42Å; L274-K385 WeakPolarHBondContact CD2-O 3.28Å; L274-I386 HydrophobicContact CD1-CG2 4.39Å; L274-R388 HydrophobicContact CD1-CG 3.64Å
275	P	97.3	Very high	93.8	Very high	4 Å²	4	50 Å²	50	3%	0.026	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	155.5	177.7	30.3	-35.8	0	0	0	111	L273 K279 L280 L283 R388 P389	L273-P275 VanDerWaalsContact O-CD 3.28Å; L273-P275 WeakPolarHBondContact O-CD 3.29Å; P275-K279 HydrophobicContact CB-CB 4.25Å; P275-L280 HydrophobicContact CG-CB 4.05Å; P275-L280 HydrophobicContact CG-CD1 3.89Å; P275-L283 HydrophobicContact CB-CB 4.43Å; P275-L283 HydrophobicContact CB-CD2 4.02Å; P275-L283 HydrophobicContact CG-CD2 4.27Å; P275-R388 PolarHBondContact O-NE 2.85Å; P275-R388 PolarHBondContact O-NH2 2.84Å; P275-P389 VanDerWaalsContact CD-O 3.31Å; P275-P389 WeakPolarHBondContact CD-O 3.48Å; P275-P389 WeakPolarHBondContact CG-O 3.23Å
276	D	96.5	Very high	94	Very high	47 Å²	47	48 Å²	48	25%	0.251	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-63.6	164.1	164.1	-61.7	-23.1	0	0	0	110.3	Y251 S256 G278 K279	Y251-D276 PolarHBondContact OH-OD2 2.91Å; S256-D276 WeakPolarHBondContact CB-OD2 3.49Å; S256-D276 PolarHBondContact O-N 2.87Å; D276-G278 PolarHBondContact O-N 2.87Å; D276-K279 HydrophobicContact CB-CB 4.32Å; D276-K279 HydrophobicContact CB-CG 3.89Å; D276-K279 WeakPolarHBondContact O-CB 3.4Å; D276-K279 PolarHBondContact O-N 2.9Å
277	E	92	Very high	94.4	Very high	173 Å²	173	43.2 Å²	43.2	81%	0.808	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	130.4	-178.6	-164.2	178.6	169.7	0	0	111.6	K279	E277-K279 PolarHBondContact O-N 2.98Å
278	G	90.5	Very high	94.4	Very high	80 Å²	80	44.5 Å²	44.5	83%	0.825	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.1	3.2	-177.1	0	0	0	0	0	115.7	D276	D276-G278 PolarHBondContact O-N 2.87Å
279	K	95.4	Very high	93.8	Very high	91 Å²	91	45.1 Å²	45.1	40%	0.396	24%	0.236	S	C	.	.			trans	-99.2	1.8	-176.2	-59.4	-61.8	-174.5	174	0	115.3	P275 D276 E277 K281 H282 L283	P275-K279 HydrophobicContact CB-CB 4.25Å; D276-K279 HydrophobicContact CB-CB 4.32Å; D276-K279 HydrophobicContact CB-CG 3.89Å; D276-K279 WeakPolarHBondContact O-CB 3.4Å; D276-K279 PolarHBondContact O-N 2.9Å; E277-K279 PolarHBondContact O-N 2.98Å; K279-K281 VanDerWaalsContact C-N 3.34Å; K279-K281 PolarHBondContact O-N 3.37Å; K279-H282 HydrophobicContact CB-CB 4.5Å; K279-H282 HydrophobicContact CD-CB 4.49Å; K279-H282 WeakPolarHBondContact O-CA 3.49Å; K279-H282 WeakPolarHBondContact O-CB 3.5Å; K279-H282 PolarHBondContact O-N 3.03Å; K279-L283 PolarHBondContact O-N 3Å
280	L	93.9	Very high	93.3	Very high	10 Å²	10	49.2 Å²	49.2	5%	0.052	26%	0.257	C	S	.	.	H	α-helix	trans	-54.3	-46.8	179.6	-177.7	66.3	0	0	0	112.8	E231 P275 H282 L283 E284 P389 L391	E231-L280 WeakPolarHBondContact OE1-CD2 3.3Å; P275-L280 HydrophobicContact CG-CB 4.05Å; P275-L280 HydrophobicContact CG-CD1 3.89Å; L280-H282 VanDerWaalsContact C-N 3.28Å; L280-H282 PolarHBondContact O-N 2.93Å; L280-L283 WeakPolarHBondContact O-CB 3.3Å; L280-L283 PolarHBondContact O-N 2.9Å; L280-E284 VanDerWaalsContact O-CG 3.3Å; L280-E284 WeakPolarHBondContact O-CG 3.03Å; L280-E284 PolarHBondContact O-N 2.84Å; L280-P389 HydrophobicContact CD2-CB 3.7Å; L280-L391 HydrophobicContact CD1-CD2 4.19Å; L280-L391 HydrophobicContact CD1-CG 4.43Å
281	K	93.3	Very high	92.8	Very high	127 Å²	127	49.3 Å²	49.3	55%	0.552	26%	0.258	S	S	*	.	H	α-helix	trans	-65.3	-31.3	177.6	-68.3	-177	-178.9	174.5	0	113	K279 K285	K279-K281 VanDerWaalsContact C-N 3.34Å; K279-K281 PolarHBondContact O-N 3.37Å; K281-K285 WeakPolarHBondContact O-CB 3.49Å; K281-K285 VanDerWaalsContact O-CG 3.32Å; K281-K285 WeakPolarHBondContact O-CG 3.47Å; K281-K285 PolarHBondContact O-N 2.77Å; K281-K285 VanDerWaalsContact O-N 3.14Å
282	H	95	Very high	92.2	Very high	85 Å²	85	49.8 Å²	49.8	39%	0.394	26%	0.26	S	S	.	.	H	α-helix	trans	-68.5	-48	175.5	177.1	65.3	0	0	0	110.4	K254 L255 K279 L280 E284 K285 G286	K254-H282 PolarHBondContact O-NE2 3.31Å; L255-H282 PolarHBondContact O-CD2 3.09Å; K279-H282 HydrophobicContact CB-CB 4.5Å; K279-H282 HydrophobicContact CD-CB 4.49Å; K279-H282 WeakPolarHBondContact O-CA 3.49Å; K279-H282 WeakPolarHBondContact O-CB 3.5Å; K279-H282 PolarHBondContact O-N 3.03Å; L280-H282 VanDerWaalsContact C-N 3.28Å; L280-H282 PolarHBondContact O-N 2.93Å; H282-E284 PolarHBondContact O-N 2.87Å; H282-K285 PolarHBondContact O-N 3.05Å; H282-G286 PolarHBondContact O-N 2.86Å
283	L	95.4	Very high	91.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-54.3	-53.2	173.2	173.1	59.6	0	0	0	111	L255 C257 L273 P275 K279 L280 K285 G286 L287 W295 L391	L255-L283 HydrophobicContact CB-CD1 4.05Å; L255-L283 HydrophobicContact CD1-CD1 3.99Å; C257-L283 HydrophobicContact CB-CD1 4.35Å; C257-L283 HydrophobicContact CB-CD2 4.25Å; L273-L283 HydrophobicContact CB-CD2 3.98Å; P275-L283 HydrophobicContact CB-CB 4.43Å; P275-L283 HydrophobicContact CB-CD2 4.02Å; P275-L283 HydrophobicContact CG-CD2 4.27Å; K279-L283 PolarHBondContact O-N 3Å; L280-L283 WeakPolarHBondContact O-CB 3.3Å; L280-L283 PolarHBondContact O-N 2.9Å; L283-K285 PolarHBondContact O-N 2.6Å; L283-G286 PolarHBondContact O-N 2.83Å; L283-G286 VanDerWaalsContact O-N 3.13Å; L283-L287 HydrophobicContact CD1-CD2 4.16Å; L283-L287 WeakPolarHBondContact O-CG 3.18Å; L283-L287 PolarHBondContact O-N 2.95Å; L283-L287 VanDerWaalsContact O-N 3.15Å; L283-W295 HydrophobicContact CD1-CZ2 4.41Å; L283-L391 HydrophobicContact CD2-CD1 3.86Å; L283-L391 HydrophobicContact CD2-CG 4.08Å; L283-L391 HydrophobicContact CG-CD1 3.93Å
284	E	93.7	Very high	91.3	Very high	16 Å²	16	56.3 Å²	56.3	8%	0.075	30%	0.297	C	S	.	.	H	α-helix	trans	-55.2	-48.7	179.7	-73.4	170.9	164	0	0	112.5	K61 L280 H282 G286 L287 K407	K61-E284 WeakPolarHBondContact CD-O 3.39Å; K61-E284 WeakPolarHBondContact CE-O 3.29Å; K61-E284 VanDerWaalsContact CG-O 3.29Å; K61-E284 WeakPolarHBondContact CG-O 3.31Å; L280-E284 VanDerWaalsContact O-CG 3.3Å; L280-E284 WeakPolarHBondContact O-CG 3.03Å; L280-E284 PolarHBondContact O-N 2.84Å; H282-E284 PolarHBondContact O-N 2.87Å; E284-G286 VanDerWaalsContact C-N 3.31Å; E284-G286 PolarHBondContact O-N 2.89Å; E284-L287 PolarHBondContact O-N 3.3Å; E284-K407 WeakPolarHBondContact OE1-CD 3.47Å; E284-K407 WeakPolarHBondContact OE1-CE 3.33Å; E284-K407 IonicContact OE1-NZ 3.78Å; E284-K407 PolarHBondContact OE1-NZ 2.81Å; E284-K407 IonicContact OE2-NZ 2.63Å
285	K	92.6	Very high	91	Very high	160 Å²	160	56.1 Å²	56.1	70%	0.696	30%	0.296	S	S	*	.	H	α-helix	trans	-65.5	-35.6	179.7	-73.9	178	-179.8	-177	0	112	K61 K281 H282 L283	K61-K285 PolarHBondContact NZ-O 3.12Å; K281-K285 WeakPolarHBondContact O-CB 3.49Å; K281-K285 VanDerWaalsContact O-CG 3.32Å; K281-K285 WeakPolarHBondContact O-CG 3.47Å; K281-K285 PolarHBondContact O-N 2.77Å; K281-K285 VanDerWaalsContact O-N 3.14Å; H282-K285 PolarHBondContact O-N 3.05Å; L283-K285 PolarHBondContact O-N 2.6Å
286	G	91.6	Very high	90.6	Very high	20 Å²	20	59.8 Å²	59.8	21%	0.206	31%	0.311	C	S	.	.	H	α-helix	trans	-80.7	-6.7	-177.6	0	0	0	0	0	116	H282 L283 E284 Q288 T291	H282-G286 PolarHBondContact O-N 2.86Å; L283-G286 PolarHBondContact O-N 2.83Å; L283-G286 VanDerWaalsContact O-N 3.13Å; E284-G286 VanDerWaalsContact C-N 3.31Å; E284-G286 PolarHBondContact O-N 2.89Å; G286-Q288 PolarHBondContact O-N 2.81Å; G286-T291 PolarHBondContact O-OG1 2.57Å
287	L	91.4	Very high	90.5	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.005	33%	0.332	C	S	.	.			trans	-62.4	120.7	175.6	-67.3	178.3	0	0	0	111.3	F57 L60 K61 L273 L283 E284 W295 L391	F57-L287 HydrophobicContact CB-CB 4.09Å; F57-L287 HydrophobicContact CD1-CB 4.11Å; F57-L287 HydrophobicContact CD1-CD1 3.93Å; F57-L287 HydrophobicContact CD1-CG 4.47Å; F57-L287 HydrophobicContact CD2-CB 4.27Å; F57-L287 HydrophobicContact CE1-CD1 4.37Å; F57-L287 HydrophobicContact CG-CB 3.91Å; L60-L287 HydrophobicContact CD2-CD1 3.89Å; K61-L287 WeakPolarHBondContact CE-O 3.15Å; K61-L287 PolarHBondContact NZ-O 3.17Å; L273-L287 HydrophobicContact CD1-CD2 4.43Å; L283-L287 HydrophobicContact CD1-CD2 4.16Å; L283-L287 WeakPolarHBondContact O-CG 3.18Å; L283-L287 PolarHBondContact O-N 2.95Å; L283-L287 VanDerWaalsContact O-N 3.15Å; E284-L287 PolarHBondContact O-N 3.3Å; L287-W295 HydrophobicContact CD2-CH2 3.6Å; L287-W295 HydrophobicContact CD2-CZ2 4.05Å; L287-L391 HydrophobicContact CD1-CD1 3.78Å
288	Q	87.6	Confident	90.7	Very high	103 Å²	103	57.4 Å²	57.4	48%	0.481	31%	0.308	S	S	.	.			trans	-142.5	162.9	178.5	-68.5	-175.6	-15.1	0	0	108.8	F57 G286 D290 T291	F57-Q288 WeakPolarHBondContact CE2-O 3.39Å; G286-Q288 PolarHBondContact O-N 2.81Å; Q288-D290 PolarHBondContact O-N 3.11Å; Q288-T291 PolarHBondContact N-OG1 3.24Å; Q288-T291 WeakPolarHBondContact O-CB 3.4Å; Q288-T291 PolarHBondContact O-N 2.83Å
289	V	79.6	Confident	90.9	Very high	20 Å²	20	54.8 Å²	54.8	12%	0.121	28%	0.275	C	S	.	.	H	α-helix	trans	-55.1	-39.2	179.3	66.9	0	0	0	0	113.4	R50 M53 D54 T291	R50-V289 HydrophobicContact CB-CG2 4.49Å; R50-V289 HydrophobicContact CG-CG2 3.27Å; R50-V289 WeakPolarHBondContact O-CG2 3.32Å; M53-V289 HydrophobicContact CE-CG2 4.21Å; D54-V289 HydrophobicContact CB-CB 4.12Å; D54-V289 HydrophobicContact CB-CG2 4.46Å; V289-T291 VanDerWaalsContact C-N 3.28Å; V289-T291 PolarHBondContact O-N 2.81Å
290	D	85.3	Confident	90.9	Very high	88 Å²	88	53.2 Å²	53.2	47%	0.471	28%	0.276	S	S	.	.	H	α-helix	trans	-79.8	-12	-179.3	-57.3	-40.2	0	0	0	112.8	R50 Q288 F292 S293 R294	R50-D290 IonicContact CZ-OD1 3.52Å; R50-D290 IonicContact NH2-OD1 2.78Å; R50-D290 PolarHBondContact NH2-OD1 3.16Å; R50-D290 IonicContact NH2-OD2 3.74Å; Q288-D290 PolarHBondContact O-N 3.11Å; D290-F292 VanDerWaalsContact C-N 3.31Å; D290-F292 PolarHBondContact O-N 2.96Å; D290-S293 PolarHBondContact O-N 3.29Å; D290-R294 PolarHBondContact O-N 2.78Å; D290-R294 VanDerWaalsContact O-N 3.09Å
291	T	85.8	Confident	90.9	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-61.7	-41.2	174.6	-68.6	0	0	0	0	111.2	L255 G286 Q288 V289 S293 R294 W295	L255-T291 HydrophobicContact CD1-CG2 3.54Å; G286-T291 PolarHBondContact O-OG1 2.57Å; Q288-T291 PolarHBondContact N-OG1 3.24Å; Q288-T291 WeakPolarHBondContact O-CB 3.4Å; Q288-T291 PolarHBondContact O-N 2.83Å; V289-T291 VanDerWaalsContact C-N 3.28Å; V289-T291 PolarHBondContact O-N 2.81Å; T291-S293 PolarHBondContact O-N 2.83Å; T291-R294 PolarHBondContact O-N 3.25Å; T291-R294 PolarHBondContact OG1-NH2 3.32Å; T291-W295 HydrophobicContact CG2-CD2 3.92Å; T291-W295 HydrophobicContact CG2-CE3 4.41Å; T291-W295 HydrophobicContact CG2-CH2 3.66Å; T291-W295 HydrophobicContact CG2-CZ2 3.13Å; T291-W295 HydrophobicContact CG2-CZ3 4.29Å; T291-W295 VanDerWaalsContact O-CG 3.31Å; T291-W295 PolarHBondContact O-N 3.49Å
292	F	84.9	Confident	90.9	Very high	11 Å²	11	59.7 Å²	59.7	5%	0.048	30%	0.296	C	S	.	.	H	α-helix	trans	-65	-40.3	178.3	-164.4	-94.4	0	0	0	112.4	M53 I271 D290 R294 W295 K296 L393 Y395	M53-F292 HydrophobicContact CE-CB 3.63Å; M53-F292 HydrophobicContact CE-CD1 4.32Å; M53-F292 HydrophobicContact CE-CG 4.06Å; M53-F292 HydrophobicContact SD-CB 3.67Å; M53-F292 HydrophobicContact SD-CD1 4.25Å; M53-F292 HydrophobicContact SD-CD2 3.99Å; M53-F292 HydrophobicContact SD-CG 3.71Å; I271-F292 HydrophobicContact CD1-CE2 3.47Å; I271-F292 VanDerWaalsContact CD1-CE2 3.47Å; I271-F292 HydrophobicContact CD1-CZ 3.62Å; D290-F292 VanDerWaalsContact C-N 3.31Å; D290-F292 PolarHBondContact O-N 2.96Å; F292-R294 VanDerWaalsContact C-N 3.31Å; F292-R294 PolarHBondContact O-N 2.75Å; F292-W295 AromaticContact CD2-CE3 3.94Å; F292-W295 HydrophobicContact CD2-CE3 3.94Å; F292-W295 HydrophobicContact CD2-CZ3 4.16Å; F292-W295 PolarHBondContact O-N 3.45Å; F292-K296 HydrophobicContact CE1-CG 4.35Å; F292-K296 PolarHBondContact O-N 2.9Å; F292-L393 HydrophobicContact CD2-CD2 4.49Å; F292-L393 HydrophobicContact CE2-CD2 4.43Å; F292-Y395 HydrophobicContact CD1-CE2 4.47Å; F292-Y395 HydrophobicContact CE1-CD1 4.44Å; F292-Y395 HydrophobicContact CE1-CD2 4.15Å; F292-Y395 AromaticContact CE1-CE1 3.93Å; F292-Y395 HydrophobicContact CE1-CE1 3.93Å; F292-Y395 AromaticContact CE1-CE2 3.6Å; F292-Y395 HydrophobicContact CE1-CE2 3.6Å; F292-Y395 AromaticContact CE1-CZ 3.46Å; F292-Y395 VanDerWaalsContact CE1-CZ 3.46Å; F292-Y395 HydrophobicContact CE2-CD2 4.15Å; F292-Y395 HydrophobicContact CE2-CE2 4.37Å; F292-Y395 HydrophobicContact CE2-CG 4.4Å; F292-Y395 AromaticContact CZ-CD1 3.86Å; F292-Y395 HydrophobicContact CZ-CD1 3.86Å; F292-Y395 AromaticContact CZ-CD2 3.58Å; F292-Y395 HydrophobicContact CZ-CD2 3.58Å; F292-Y395 AromaticContact CZ-CE1 3.81Å; F292-Y395 HydrophobicContact CZ-CE1 3.81Å; F292-Y395 AromaticContact CZ-CE2 3.53Å; F292-Y395 HydrophobicContact CZ-CE2 3.53Å; F292-Y395 AromaticContact CZ-CG 3.73Å; F292-Y395 HydrophobicContact CZ-CG 3.73Å; F292-Y395 AromaticContact CZ-CZ 3.64Å
293	S	85.8	Confident	90.8	Very high	81 Å²	81	56.3 Å²	56.3	57%	0.566	28%	0.281	S	S	*	.	H	α-helix	trans	-63.1	-39.2	176.4	-168.2	0	0	0	0	111.7	D290 T291 K296	D290-S293 PolarHBondContact O-N 3.29Å; T291-S293 PolarHBondContact O-N 2.83Å; S293-K296 PolarHBondContact O-N 3.41Å
294	R	91.1	Very high	90.8	Very high	57 Å²	57	56.3 Å²	56.3	22%	0.215	28%	0.281	C	S	.	.	H	α-helix	trans	-63.8	-45.8	175.6	-177.5	175.7	65.7	-94.8	-2.5	111.4	D252 D290 T291 F292 K296 T297 L298	D252-R294 IonicContact OD1-CZ 2.62Å; D252-R294 IonicContact OD1-NE 2.74Å; D252-R294 PolarHBondContact OD1-NE 3.34Å; D252-R294 IonicContact OD1-NH2 2.78Å; D252-R294 IonicContact OD2-CZ 3.82Å; D252-R294 IonicContact OD2-NE 3.85Å; D252-R294 PolarHBondContact OD2-NE 3Å; D252-R294 IonicContact OD2-NH2 2.76Å; D252-R294 PolarHBondContact OD2-NH2 3.04Å; D290-R294 PolarHBondContact O-N 2.78Å; D290-R294 VanDerWaalsContact O-N 3.09Å; T291-R294 PolarHBondContact O-N 3.25Å; T291-R294 PolarHBondContact OG1-NH2 3.32Å; F292-R294 VanDerWaalsContact C-N 3.31Å; F292-R294 PolarHBondContact O-N 2.75Å; R294-K296 PolarHBondContact O-N 3.43Å; R294-T297 WeakPolarHBondContact O-CA 3.49Å; R294-T297 WeakPolarHBondContact O-CB 3.41Å; R294-T297 PolarHBondContact O-N 3.44Å; R294-T297 PolarHBondContact O-OG1 2.98Å; R294-L298 HydrophobicContact CG-CD1 4.1Å; R294-L298 HydrophobicContact CG-CG 4.46Å; R294-L298 PolarHBondContact O-N 3.32Å
295	W	92.5	Very high	90.9	Very high	3 Å²	3	57.3 Å²	57.3	1%	0.011	29%	0.287	C	S	.	.	H	α-helix	trans	-56	-40.2	179.2	-66.5	-17.5	0	0	0	112.7	D252 L255 I259 L273 L283 L287 T291 F292 T297 L298 L299	D252-W295 PolarHBondContact OD2-NE1 3.07Å; L255-W295 HydrophobicContact CD1-CZ2 4.03Å; I259-W295 HydrophobicContact CD1-CB 3.82Å; I259-W295 HydrophobicContact CD1-CD2 4.2Å; I259-W295 HydrophobicContact CD1-CG 3.49Å; I259-W295 VanDerWaalsContact CD1-CG 3.49Å; I259-W295 HydrophobicContact CG1-CD2 4.46Å; I259-W295 HydrophobicContact CG1-CG 4.22Å; L273-W295 HydrophobicContact CD1-CH2 3.15Å; L273-W295 HydrophobicContact CD1-CZ2 3.87Å; L273-W295 HydrophobicContact CD1-CZ3 3.63Å; L273-W295 HydrophobicContact CD2-CD2 4.23Å; L273-W295 HydrophobicContact CD2-CE3 4Å; L273-W295 HydrophobicContact CD2-CH2 3.62Å; L273-W295 HydrophobicContact CD2-CZ2 3.79Å; L273-W295 HydrophobicContact CD2-CZ3 3.71Å; L273-W295 HydrophobicContact CG-CH2 4.02Å; L273-W295 HydrophobicContact CG-CZ2 4.47Å; L273-W295 HydrophobicContact CG-CZ3 4.27Å; L283-W295 HydrophobicContact CD1-CZ2 4.41Å; L287-W295 HydrophobicContact CD2-CH2 3.6Å; L287-W295 HydrophobicContact CD2-CZ2 4.05Å; T291-W295 HydrophobicContact CG2-CD2 3.92Å; T291-W295 HydrophobicContact CG2-CE3 4.41Å; T291-W295 HydrophobicContact CG2-CH2 3.66Å; T291-W295 HydrophobicContact CG2-CZ2 3.13Å; T291-W295 HydrophobicContact CG2-CZ3 4.29Å; T291-W295 VanDerWaalsContact O-CG 3.31Å; T291-W295 PolarHBondContact O-N 3.49Å; F292-W295 AromaticContact CD2-CE3 3.94Å; F292-W295 HydrophobicContact CD2-CE3 3.94Å; F292-W295 HydrophobicContact CD2-CZ3 4.16Å; F292-W295 PolarHBondContact O-N 3.45Å; W295-T297 PolarHBondContact O-N 3.2Å; W295-T297 VanDerWaalsContact O-N 3.13Å; W295-L298 PolarHBondContact O-N 3.33Å; W295-L299 WeakPolarHBondContact O-CG 3.34Å; W295-L299 PolarHBondContact O-N 3.18Å
296	K	89.3	Confident	91.2	Very high	80 Å²	80	49.7 Å²	49.7	35%	0.348	25%	0.254	S	S	.	.	H	α-helix	trans	-58.7	-26.1	175.2	-66.9	-55.8	-171.5	-176.7	0	114.1	E261 F292 S293 R294 L299	E261-K296 VanDerWaalsContact CD-NZ 3.3Å; E261-K296 IonicContact OE1-NZ 2.95Å; E261-K296 PolarHBondContact OE1-NZ 2.92Å; E261-K296 IonicContact OE2-NZ 3.29Å; E261-K296 PolarHBondContact OE2-NZ 3.07Å; E261-K296 VanDerWaalsContact OE2-NZ 3.14Å; F292-K296 HydrophobicContact CE1-CG 4.35Å; F292-K296 PolarHBondContact O-N 2.9Å; S293-K296 PolarHBondContact O-N 3.41Å; R294-K296 PolarHBondContact O-N 3.43Å; K296-L299 HydrophobicContact CD-CD1 4.18Å
297	T	93.5	Very high	91.5	Very high	111 Å²	111	49 Å²	49	68%	0.681	25%	0.246	S	C	*	.	H	α-helix	trans	-85	-19.3	175.8	69.7	0	0	0	0	113.8	R294 W295	R294-T297 WeakPolarHBondContact O-CA 3.49Å; R294-T297 WeakPolarHBondContact O-CB 3.41Å; R294-T297 PolarHBondContact O-N 3.44Å; R294-T297 PolarHBondContact O-OG1 2.98Å; W295-T297 PolarHBondContact O-N 3.2Å; W295-T297 VanDerWaalsContact O-N 3.13Å
298	L	95.6	Very high	91.8	Very high	60 Å²	60	49 Å²	49	31%	0.314	25%	0.246	S	C	.	.	H	α-helix	trans	-91.4	-17.7	-178.8	-63	172.7	0	0	0	112.8	D252 I259 R294 W295	D252-L298 HydrophobicContact CB-CD1 3.82Å; I259-L298 HydrophobicContact CD1-CD1 4.44Å; R294-L298 HydrophobicContact CG-CD1 4.1Å; R294-L298 HydrophobicContact CG-CG 4.46Å; R294-L298 PolarHBondContact O-N 3.32Å; W295-L298 PolarHBondContact O-N 3.33Å
299	L	95.9	Very high	92.3	Very high	25 Å²	25	44.1 Å²	44.1	13%	0.131	22%	0.223	C	C	.	.			trans	-74.7	133.3	-178.4	-70.8	169.5	0	0	0	111.1	Q248 I259 E261 W295 K296	Q248-L299 HydrophobicContact CB-CB 4.42Å; Q248-L299 HydrophobicContact CB-CD2 4.3Å; I259-L299 HydrophobicContact CB-CD2 4.18Å; I259-L299 HydrophobicContact CG2-CD2 3.89Å; E261-L299 HydrophobicContact CG-CD1 3.71Å; E261-L299 HydrophobicContact CG-CD2 4.21Å; E261-L299 VanDerWaalsContact OE1-CD1 3.24Å; E261-L299 WeakPolarHBondContact OE1-CD1 3.48Å; W295-L299 WeakPolarHBondContact O-CG 3.34Å; W295-L299 PolarHBondContact O-N 3.18Å; K296-L299 HydrophobicContact CD-CD1 4.18Å
300	S	95.6	Very high	93.1	Very high	58 Å²	58	47.9 Å²	47.9	41%	0.406	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	149.7	171.5	63.4	0	0	0	0	109.7	Q248 V249 R302	Q248-S300 PolarHBondContact OE1-O 3.14Å; V249-S300 PolarHBondContact N-O 2.63Å; V249-S300 PolarHBondContact O-N 3.4Å; V249-S300 PolarHBondContact O-OG 2.62Å; S300-R302 PolarHBondContact O-N 3.39Å
301	R	94.4	Very high	93.5	Very high	162 Å²	162	43.9 Å²	43.9	61%	0.611	21%	0.214	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	116.4	-179.9	-160.5	-174.7	-179.6	-179.9	-3	109.5	M246 Y247	M246-R301 HydrophobicContact CB-CG 4.46Å; M246-R301 HydrophobicContact CE-CB 4.4Å; M246-R301 HydrophobicContact CE-CG 3.76Å; Y247-R301 CarbonylContact O-C 3.53Å; Y247-R301 WeakPolarHBondContact O-CA 3.41Å
302	R	92.8	Very high	93.7	Very high	110 Å²	110	48.1 Å²	48.1	42%	0.415	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	160.8	-178	-58.2	-168.6	69.1	-167.2	-2.2	111.6	M246 Y247 V249 S300 V304	M246-R302 WeakPolarHBondContact CA-O 3.14Å; Y247-R302 PolarHBondContact N-O 3.02Å; Y247-R302 PolarHBondContact O-N 2.82Å; V249-R302 HydrophobicContact CG1-CB 3.94Å; V249-R302 HydrophobicContact CG1-CG 4.14Å; S300-R302 PolarHBondContact O-N 3.39Å; R302-V304 HydrophobicContact CB-CG2 4.35Å; R302-V304 PolarHBondContact O-N 2.75Å
303	V	92.3	Very high	93.8	Very high	14 Å²	14	47.7 Å²	47.7	9%	0.085	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	122.6	167.6	-173.3	0	0	0	0	107.9	G245 M246 L376 P377 P381 L382	G245-V303 CarbonylContact O-C 3.51Å; G245-V303 WeakPolarHBondContact O-CA 3.29Å; M246-V303 HydrophobicContact SD-CB 4.29Å; M246-V303 HydrophobicContact SD-CG2 3.49Å; M246-V303 WeakPolarHBondContact SD-CG2 3.43Å; M246-V303 PolarHBondContact SD-N 2.96Å; M246-V303 VanDerWaalsContact SD-N 3.42Å; V303-L376 HydrophobicContact CG1-CB 4.5Å; V303-L376 HydrophobicContact CG1-CD1 4.12Å; V303-L376 HydrophobicContact CG1-CD2 4.3Å; V303-L376 HydrophobicContact CG2-CB 4.38Å; V303-L376 HydrophobicContact CG2-CD2 4.31Å; V303-P377 HydrophobicContact CG2-CB 4.43Å; V303-P377 HydrophobicContact CG2-CG 4.05Å; V303-P381 HydrophobicContact CG1-CB 3.99Å; V303-P381 HydrophobicContact CG1-CG 4.01Å; V303-L382 PolarHBondContact O-N 3.25Å
304	V	95.6	Very high	93.7	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	131.7	-177.5	-167.6	0	0	0	0	110	S244 G245 Y247 V249 R302 V306 L382 V384	S244-V304 WeakPolarHBondContact CA-O 3.38Å; G245-V304 PolarHBondContact N-O 3.39Å; G245-V304 VanDerWaalsContact N-O 3.08Å; G245-V304 PolarHBondContact O-N 2.89Å; Y247-V304 HydrophobicContact CD2-CB 4.02Å; V249-V304 HydrophobicContact CB-CG2 4.18Å; V249-V304 HydrophobicContact CG1-CG2 3.75Å; R302-V304 HydrophobicContact CB-CG2 4.35Å; R302-V304 PolarHBondContact O-N 2.75Å; V304-V306 HydrophobicContact CB-CG1 3.91Å; V304-V306 HydrophobicContact CG1-CG1 3.53Å; V304-V306 PolarHBondContact O-N 2.87Å; V304-L382 CarbonylContact C-O 3.31Å; V304-L382 WeakPolarHBondContact CA-O 3.32Å; V304-L382 HydrophobicContact CG1-CB 4.46Å; V304-L382 WeakPolarHBondContact CG1-O 3.42Å; V304-L382 HydrophobicContact CG2-CB 4.36Å; V304-V384 HydrophobicContact CG1-CB 3.84Å; V304-V384 HydrophobicContact CG1-CG2 3.56Å
305	D	96.7	Very high	93.4	Very high	37 Å²	37	43.5 Å²	43.5	20%	0.198	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	98.4	163.7	-76.4	0.3	0	0	0	107.7	F242 S244 P381 L382 V383 V384	F242-D305 HydrophobicContact CE2-CB 3.88Å; F242-D305 HydrophobicContact CZ-CB 4.01Å; S244-D305 WeakPolarHBondContact CB-OD1 3.29Å; S244-D305 PolarHBondContact OG-OD1 2.8Å; D305-P381 HydrophobicContact CB-CB 4.41Å; D305-P381 WeakPolarHBondContact OD1-CB 3.44Å; D305-L382 PolarHBondContact N-O 3.15Å; D305-V383 HydrophobicContact CB-CG2 4.41Å; D305-V384 PolarHBondContact O-N 2.9Å
306	V	97.6	Very high	93	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130	-177.1	-61	0	0	0	0	110.5	F218 F242 H243 Y247 L260 V304 V384	F218-V306 HydrophobicContact CE1-CG2 4.05Å; F218-V306 HydrophobicContact CZ-CG2 4.39Å; F242-V306 WeakPolarHBondContact CA-O 3.27Å; H243-V306 HydrophobicContact CB-CG2 4.23Å; H243-V306 PolarHBondContact N-O 2.83Å; H243-V306 WeakPolarHBondContact O-CG2 3.41Å; H243-V306 PolarHBondContact O-N 3.43Å; Y247-V306 HydrophobicContact CD2-CG1 3.72Å; Y247-V306 HydrophobicContact CD2-CG2 4.32Å; Y247-V306 HydrophobicContact CE1-CG2 4.48Å; Y247-V306 HydrophobicContact CE2-CB 4.35Å; Y247-V306 HydrophobicContact CE2-CG1 3.8Å; Y247-V306 HydrophobicContact CE2-CG2 3.54Å; Y247-V306 HydrophobicContact CG-CG1 4.23Å; L260-V306 HydrophobicContact CD1-CG1 3.89Å; L260-V306 HydrophobicContact CD2-CB 4.21Å; L260-V306 HydrophobicContact CD2-CG1 3.72Å; L260-V306 HydrophobicContact CG-CG1 4.46Å; V304-V306 HydrophobicContact CB-CG1 3.91Å; V304-V306 HydrophobicContact CG1-CG1 3.53Å; V304-V306 PolarHBondContact O-N 2.87Å; V306-V384 WeakPolarHBondContact CA-O 3.22Å
307	S	98.5	Very high	92.8	Very high	7 Å²	7	44.5 Å²	44.5	5%	0.049	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	121.2	170	-50.5	0	0	0	0	109.6	M241 V384 I386	M241-S307 CarbonylContact O-C 3.48Å; M241-S307 VanDerWaalsContact O-CA 3.26Å; M241-S307 WeakPolarHBondContact O-CA 3.49Å; S307-V384 PolarHBondContact N-O 2.65Å; S307-I386 WeakPolarHBondContact O-CB 3.24Å; S307-I386 WeakPolarHBondContact O-CG1 3.47Å; S307-I386 PolarHBondContact O-N 2.86Å
308	V	98.3	Very high	92.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	128.4	-175	-174	0	0	0	0	109.6	F218 M241 I262 F272 M360 I386	F218-V308 HydrophobicContact CZ-CG2 4.29Å; M241-V308 WeakPolarHBondContact CA-O 3.06Å; M241-V308 VanDerWaalsContact CB-O 3.31Å; M241-V308 WeakPolarHBondContact CB-O 3.14Å; M241-V308 HydrophobicContact CE-CB 4.13Å; M241-V308 HydrophobicContact CE-CG1 4.16Å; M241-V308 PolarHBondContact N-O 2.87Å; M241-V308 PolarHBondContact O-N 2.78Å; I262-V308 HydrophobicContact CD1-CG2 3.8Å; F272-V308 HydrophobicContact CE1-CG1 3.7Å; F272-V308 HydrophobicContact CZ-CG1 3.76Å; V308-M360 HydrophobicContact CG1-SD 4.27Å; V308-I386 HydrophobicContact CG1-CD1 4.39Å; V308-I386 HydrophobicContact CG2-CD1 3.94Å
309	P	97.4	Very high	92.1	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	144.4	178.6	28.6	-34.2	0	0	0	110.2	F228 V238 M240 I386 Y390 P411	F228-P309 HydrophobicContact CE2-CG 4.41Å; V238-P309 HydrophobicContact CG2-CB 3.93Å; M240-P309 HydrophobicContact CE-CB 4.4Å; M240-P309 HydrophobicContact SD-CB 4.31Å; M240-P309 VanDerWaalsContact SD-N 3.41Å; P309-I386 WeakPolarHBondContact CD-O 3.31Å; P309-Y390 HydrophobicContact CG-CE1 4.21Å; P309-P411 HydrophobicContact CB-CB 4.07Å; P309-P411 HydrophobicContact CB-CG 3.96Å; P309-P411 HydrophobicContact CG-CB 4.38Å; P309-P411 HydrophobicContact CG-CG 3.94Å
310	R	96.2	Very high	91.6	Very high	100 Å²	100	40.6 Å²	40.6	38%	0.377	19%	0.194	S	C	.	.			trans	-58.1	145.8	161.6	-65.4	-177.7	168.4	165.2	-6	108.4	P239 M241 E362	P239-R310 HydrophobicContact CB-CG 4.28Å; P239-R310 HydrophobicContact CG-CB 3.98Å; P239-R310 HydrophobicContact CG-CG 4.2Å; P239-R310 PolarHBondContact O-N 2.79Å; M241-R310 HydrophobicContact CG-CG 3.86Å; M241-R310 HydrophobicContact SD-CG 3.89Å; R310-E362 IonicContact CZ-OE1 3.1Å; R310-E362 IonicContact CZ-OE2 3.18Å; R310-E362 VanDerWaalsContact NE-CD 3.26Å; R310-E362 IonicContact NE-OE1 2.94Å; R310-E362 PolarHBondContact NE-OE1 2.94Å; R310-E362 IonicContact NE-OE2 2.86Å; R310-E362 PolarHBondContact NE-OE2 3.49Å; R310-E362 IonicContact NH2-OE1 2.66Å; R310-E362 PolarHBondContact NH2-OE1 3.01Å; R310-E362 IonicContact NH2-OE2 2.72Å; R310-E362 PolarHBondContact NH2-OE2 2.84Å
311	L	93.5	Very high	91.3	Very high	3 Å²	3	44 Å²	44	2%	0.016	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	131.4	-174.5	-168	66.4	0	0	0	110.1	M313 L358 K359 M360 L392 I408 P411	L311-M313 HydrophobicContact CD1-CG 3.71Å; L311-M313 HydrophobicContact CD1-SD 3.66Å; L311-M313 HydrophobicContact CD2-CG 4.32Å; L311-M313 HydrophobicContact CD2-SD 3.89Å; L311-M313 HydrophobicContact CG-CG 3.82Å; L311-M313 HydrophobicContact CG-SD 3.94Å; L311-L358 HydrophobicContact CD2-CD2 4.35Å; L311-K359 CarbonylContact O-C 3.45Å; L311-K359 WeakPolarHBondContact O-CA 3.5Å; L311-M360 HydrophobicContact CB-CB 3.94Å; L311-M360 PolarHBondContact N-O 2.83Å; L311-M360 PolarHBondContact O-N 3.21Å; L311-L392 HydrophobicContact CD2-CD2 3.93Å; L311-I408 HydrophobicContact CD1-CG1 4.11Å; L311-I408 HydrophobicContact CD1-CG2 4Å; L311-I408 HydrophobicContact CD2-CD1 4.42Å; L311-I408 HydrophobicContact CD2-CG1 4Å; L311-P411 HydrophobicContact CD1-CB 4.27Å
312	H	90.7	Very high	91.1	Very high	91 Å²	91	36.9 Å²	36.9	42%	0.421	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	115	164.1	-178.1	-148.9	0	0	0	108.6	E357 L358	H312-E357 IonicContact CD2-OE1 3.84Å; H312-E357 IonicContact CE1-OE1 3.79Å; H312-E357 IonicContact NE2-OE1 2.71Å; H312-E357 PolarHBondContact NE2-OE1 3.2Å; H312-L358 WeakPolarHBondContact CA-O 3.31Å
313	M	86.8	Confident	91	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	140.1	-174.2	-71.8	-172.9	67.6	0	0	111.2	N71 M73 L311 E357 L358 I408	N71-M313 HydrophobicContact CB-CE 3.44Å; N71-M313 VanDerWaalsContact CB-CE 3.44Å; M73-M313 HydrophobicContact CB-CB 4.45Å; M73-M313 HydrophobicContact CB-CE 4.07Å; M73-M313 HydrophobicContact CE-CB 4.4Å; M73-M313 HydrophobicContact CE-CE 4.39Å; M73-M313 HydrophobicContact CE-SD 3.92Å; L311-M313 HydrophobicContact CD1-CG 3.71Å; L311-M313 HydrophobicContact CD1-SD 3.66Å; L311-M313 HydrophobicContact CD2-CG 4.32Å; L311-M313 HydrophobicContact CD2-SD 3.89Å; L311-M313 HydrophobicContact CG-CG 3.82Å; L311-M313 HydrophobicContact CG-SD 3.94Å; M313-E357 CarbonylContact O-C 3.5Å; M313-E357 VanDerWaalsContact O-CA 3.32Å; M313-E357 WeakPolarHBondContact O-CA 3.35Å; M313-L358 PolarHBondContact N-O 2.92Å; M313-L358 PolarHBondContact O-N 3.01Å; M313-I408 HydrophobicContact SD-CD1 4.42Å; M313-I408 HydrophobicContact SD-CG1 3.57Å; M313-I408 VanDerWaalsContact SD-CG1 3.57Å
314	T	83.8	Confident	90.9	Very high	44 Å²	44	33.4 Å²	33.4	27%	0.27	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	118.1	170	-53.1	0	0	0	0	108.4	K355 A356	T314-K355 HydrophobicContact CG2-CD 4.37Å; T314-K355 HydrophobicContact CG2-CG 4.08Å; T314-A356 CarbonylContact C-O 3.56Å; T314-A356 VanDerWaalsContact CA-O 3.29Å; T314-A356 WeakPolarHBondContact CA-O 3.49Å
315	G	83.9	Confident	90.4	Very high	7 Å²	7	39.8 Å²	39.8	7%	0.072	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	125.3	169.4	0	0	0	0	0	110.2	M73 K355 A356	M73-G315 WeakPolarHBondContact O-CA 3.4Å; G315-K355 CarbonylContact O-C 3.58Å; G315-K355 VanDerWaalsContact O-CA 3.29Å; G315-K355 WeakPolarHBondContact O-CA 3.37Å; G315-A356 PolarHBondContact N-O 3.34Å; G315-A356 PolarHBondContact O-N 2.96Å
316	T	84.9	Confident	90	Very high	74 Å²	74	39.6 Å²	39.6	45%	0.454	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.7	171.9	-52.2	0	0	0	0	108.7	V353 H354 K355	T316-V353 HydrophobicContact CG2-CG1 4.08Å; T316-H354 CarbonylContact C-O 3.4Å; T316-H354 WeakPolarHBondContact CA-O 3.13Å; T316-K355 HydrophobicContact CG2-CD 4.4Å; T316-K355 WeakPolarHBondContact OG1-CD 2.83Å
317	F	85.2	Confident	89.7	Confident	30 Å²	30	41.8 Å²	41.8	13%	0.132	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	130.7	179.8	-57.2	-85	0	0	0	110.9	L63 I72 M73 L74 L319 H354	L63-F317 HydrophobicContact CD1-CD1 4.01Å; L63-F317 HydrophobicContact CD1-CE1 3.66Å; L63-F317 HydrophobicContact CD1-CZ 4.07Å; L63-F317 HydrophobicContact CD2-CD1 3.76Å; L63-F317 HydrophobicContact CD2-CE1 3.8Å; L63-F317 HydrophobicContact CG-CE1 4.29Å; I72-F317 HydrophobicContact CG2-CE1 4.47Å; I72-F317 HydrophobicContact CG2-CZ 3.89Å; M73-F317 VanDerWaalsContact O-CE2 3.31Å; M73-F317 WeakPolarHBondContact O-CE2 3.24Å; L74-F317 HydrophobicContact CB-CD2 4.43Å; L74-F317 HydrophobicContact CB-CE2 3.97Å; F317-L319 HydrophobicContact CB-CD2 4.48Å; F317-L319 PolarHBondContact O-N 2.8Å; F317-H354 PolarHBondContact N-O 2.78Å; F317-H354 PolarHBondContact O-N 3.25Å
318	D	86.3	Confident	89.5	Confident	46 Å²	46	41.5 Å²	41.5	25%	0.246	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	103.5	159.7	175.5	-19.8	0	0	0	107.6	K320 K321 T322	D318-K320 VanDerWaalsContact C-N 3.28Å; D318-K320 PolarHBondContact O-N 2.88Å; D318-K320 WeakPolarHBondContact OD1-CA 3.32Å; D318-K320 VanDerWaalsContact OD1-CB 3.31Å; D318-K320 WeakPolarHBondContact OD1-CB 3.32Å; D318-K320 PolarHBondContact OD1-N 2.87Å; D318-K321 HydrophobicContact CB-CB 4.47Å; D318-K321 HydrophobicContact CB-CD 4.49Å; D318-K321 PolarHBondContact OD1-N 2.97Å; D318-K321 VanDerWaalsContact OD2-CD 3.24Å; D318-K321 WeakPolarHBondContact OD2-CD 3.45Å; D318-K321 VanDerWaalsContact OD2-CE 3.26Å; D318-K321 WeakPolarHBondContact OD2-CE 3.35Å; D318-K321 WeakPolarHBondContact OD2-CG 3.49Å; D318-K321 IonicContact OD2-NZ 3.92Å; D318-K321 PolarHBondContact OD2-NZ 2.9Å; D318-T322 VanDerWaalsContact O-CB 3.29Å; D318-T322 WeakPolarHBondContact O-CB 3.43Å; D318-T322 PolarHBondContact O-N 2.78Å; D318-T322 PolarHBondContact O-OG1 3.16Å
319	L	86.9	Confident	89.3	Confident	8 Å²	8	43.3 Å²	43.3	4%	0.042	23%	0.225	C	C	.	.	H	α-helix	trans	-70.7	-26.7	-177.5	-66	-178.5	0	0	0	111.8	I79 F83 F317 T322 L323 A352 H354	I79-L319 HydrophobicContact CD1-CD2 4Å; I79-L319 HydrophobicContact CG1-CD2 4.19Å; I79-L319 HydrophobicContact CG2-CD1 4.18Å; I79-L319 HydrophobicContact CG2-CD2 4.11Å; F83-L319 HydrophobicContact CE2-CD1 3.76Å; F317-L319 HydrophobicContact CB-CD2 4.48Å; F317-L319 PolarHBondContact O-N 2.8Å; L319-T322 PolarHBondContact O-N 3.04Å; L319-L323 HydrophobicContact CB-CD1 4.03Å; L319-L323 HydrophobicContact CB-CG 4.35Å; L319-L323 WeakPolarHBondContact O-CB 3.4Å; L319-L323 WeakPolarHBondContact O-CG 3.46Å; L319-L323 PolarHBondContact O-N 3.45Å; L319-A352 HydrophobicContact CB-CB 3.91Å; L319-A352 VanDerWaalsContact CB-O 3.31Å; L319-A352 WeakPolarHBondContact CB-O 3.17Å; L319-A352 HydrophobicContact CD1-CB 4.43Å; L319-A352 PolarHBondContact N-O 2.71Å; L319-H354 HydrophobicContact CD1-CB 3.92Å; L319-H354 HydrophobicContact CD2-CB 3.66Å; L319-H354 HydrophobicContact CG-CB 3.82Å
320	K	86.8	Confident	89	Confident	60 Å²	60	46.3 Å²	46.3	26%	0.261	24%	0.238	S	C	.	.	H	α-helix	trans	-60.8	-51.9	175.4	173.4	175.1	180	178.7	0	110.3	D318 S324 F332 G350	D318-K320 VanDerWaalsContact C-N 3.28Å; D318-K320 PolarHBondContact O-N 2.88Å; D318-K320 WeakPolarHBondContact OD1-CA 3.32Å; D318-K320 VanDerWaalsContact OD1-CB 3.31Å; D318-K320 WeakPolarHBondContact OD1-CB 3.32Å; D318-K320 PolarHBondContact OD1-N 2.87Å; K320-S324 WeakPolarHBondContact O-CB 3.38Å; K320-S324 PolarHBondContact O-N 3.28Å; K320-S324 VanDerWaalsContact O-N 3.15Å; K320-S324 PolarHBondContact O-OG 2.8Å; K320-F332 HydrophobicContact CB-CD1 3.89Å; K320-F332 HydrophobicContact CB-CD2 4.35Å; K320-F332 HydrophobicContact CB-CE1 3.94Å; K320-F332 HydrophobicContact CB-CE2 4.4Å; K320-F332 HydrophobicContact CB-CG 4.11Å; K320-F332 HydrophobicContact CB-CZ 4.2Å; K320-F332 HydrophobicContact CD-CB 4.1Å; K320-F332 HydrophobicContact CD-CD1 4.21Å; K320-F332 HydrophobicContact CD-CG 4.23Å; K320-F332 HydrophobicContact CG-CB 3.92Å; K320-F332 HydrophobicContact CG-CD1 3.89Å; K320-F332 HydrophobicContact CG-CD2 4.04Å; K320-F332 HydrophobicContact CG-CE1 4.41Å; K320-F332 HydrophobicContact CG-CG 3.68Å; K320-G350 PolarHBondContact NZ-O 2.82Å
321	K	88.5	Confident	88.7	Confident	128 Å²	128	41.6 Å²	41.6	56%	0.557	22%	0.221	S	C	*	.	H	α-helix	trans	-63.6	-45.1	174.4	-70.1	179.5	-171.8	119.7	0	112	D318 S324 Y325	D318-K321 HydrophobicContact CB-CB 4.47Å; D318-K321 HydrophobicContact CB-CD 4.49Å; D318-K321 PolarHBondContact OD1-N 2.97Å; D318-K321 VanDerWaalsContact OD2-CD 3.24Å; D318-K321 WeakPolarHBondContact OD2-CD 3.45Å; D318-K321 VanDerWaalsContact OD2-CE 3.26Å; D318-K321 WeakPolarHBondContact OD2-CE 3.35Å; D318-K321 WeakPolarHBondContact OD2-CG 3.49Å; D318-K321 IonicContact OD2-NZ 3.92Å; D318-K321 PolarHBondContact OD2-NZ 2.9Å; K321-S324 PolarHBondContact O-N 3.14Å; K321-Y325 VanDerWaalsContact O-CD2 3.28Å; K321-Y325 WeakPolarHBondContact O-CD2 3.35Å; K321-Y325 PolarHBondContact O-N 3.19Å
322	T	89.5	Confident	88.4	Confident	14 Å²	14	42 Å²	42	9%	0.086	22%	0.222	C	C	.	.	H	α-helix	trans	-67.3	-45	-172.7	-56.7	0	0	0	0	112.5	L59 L63 D318 L319 Y325	L59-T322 HydrophobicContact CD1-CG2 3.3Å; L63-T322 HydrophobicContact CD2-CG2 3.82Å; L63-T322 HydrophobicContact CG-CG2 4.32Å; D318-T322 VanDerWaalsContact O-CB 3.29Å; D318-T322 WeakPolarHBondContact O-CB 3.43Å; D318-T322 PolarHBondContact O-N 2.78Å; D318-T322 PolarHBondContact O-OG1 3.16Å; L319-T322 PolarHBondContact O-N 3.04Å; T322-Y325 WeakPolarHBondContact O-CB 3.46Å; T322-Y325 PolarHBondContact O-N 3.02Å
323	L	91.6	Very high	88.2	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-76.6	-24.9	-179.8	-62.4	174.6	0	0	0	112.2	F55 F83 F102 L319 Y325 M326 G327 I328 F332	F55-L323 HydrophobicContact CE2-CD2 4.23Å; F55-L323 HydrophobicContact CZ-CD2 4.19Å; F83-L323 HydrophobicContact CD1-CD1 4.01Å; F83-L323 HydrophobicContact CD2-CD1 3.93Å; F83-L323 HydrophobicContact CE1-CD1 3.45Å; F83-L323 VanDerWaalsContact CE1-CD1 3.45Å; F83-L323 HydrophobicContact CE2-CD1 3.39Å; F83-L323 HydrophobicContact CG-CD1 4.24Å; F83-L323 HydrophobicContact CZ-CD1 3.12Å; F102-L323 HydrophobicContact CE2-CD1 4.32Å; F102-L323 HydrophobicContact CE2-CD2 4.25Å; F102-L323 HydrophobicContact CZ-CD1 4.06Å; F102-L323 HydrophobicContact CZ-CD2 3.84Å; L319-L323 HydrophobicContact CB-CD1 4.03Å; L319-L323 HydrophobicContact CB-CG 4.35Å; L319-L323 WeakPolarHBondContact O-CB 3.4Å; L319-L323 WeakPolarHBondContact O-CG 3.46Å; L319-L323 PolarHBondContact O-N 3.45Å; L323-Y325 PolarHBondContact O-N 3.31Å; L323-M326 HydrophobicContact CD2-SD 4.21Å; L323-M326 CarbonylContact O-C 3.6Å; L323-M326 VanDerWaalsContact O-CA 3.3Å; L323-M326 WeakPolarHBondContact O-CA 3.44Å; L323-M326 WeakPolarHBondContact O-CB 3.36Å; L323-M326 PolarHBondContact O-N 3.17Å; L323-G327 PolarHBondContact O-N 3Å; L323-I328 CarbonylContact C-O 3.54Å; L323-I328 HydrophobicContact CB-CB 4.11Å; L323-I328 HydrophobicContact CB-CD1 4.16Å; L323-I328 HydrophobicContact CD2-CD1 4.13Å; L323-I328 PolarHBondContact O-N 2.69Å; L323-F332 HydrophobicContact CB-CE2 4.31Å; L323-F332 HydrophobicContact CD1-CZ 4.26Å
324	S	89.9	Confident	87.7	Confident	50 Å²	50	47.5 Å²	47.5	35%	0.35	25%	0.248	S	C	.	.	H	α-helix	trans	-58.1	-38.7	168.3	-64.3	0	0	0	0	111.3	K320 K321 M326 G327 I328	K320-S324 WeakPolarHBondContact O-CB 3.38Å; K320-S324 PolarHBondContact O-N 3.28Å; K320-S324 VanDerWaalsContact O-N 3.15Å; K320-S324 PolarHBondContact O-OG 2.8Å; K321-S324 PolarHBondContact O-N 3.14Å; S324-M326 PolarHBondContact O-N 3.24Å; S324-G327 PolarHBondContact O-N 3.09Å; S324-I328 WeakPolarHBondContact CA-O 3.29Å; S324-I328 PolarHBondContact N-O 2.9Å
325	Y	85.7	Confident	87.1	Confident	134 Å²	134	52.9 Å²	52.9	53%	0.525	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-13.6	172.8	-58.5	-47.1	0	0	0	114.4	N66 K321 T322 L323	N66-Y325 VanDerWaalsContact ND2-CD2 3.32Å; N66-Y325 WeakPolarHBondContact ND2-CD2 3.2Å; N66-Y325 VanDerWaalsContact ND2-CE2 3.27Å; N66-Y325 WeakPolarHBondContact ND2-CE2 3.37Å; K321-Y325 VanDerWaalsContact O-CD2 3.28Å; K321-Y325 WeakPolarHBondContact O-CD2 3.35Å; K321-Y325 PolarHBondContact O-N 3.19Å; T322-Y325 WeakPolarHBondContact O-CB 3.46Å; T322-Y325 PolarHBondContact O-N 3.02Å; L323-Y325 PolarHBondContact O-N 3.31Å
326	M	88.5	Confident	86.8	Confident	33 Å²	33	52.8 Å²	52.8	16%	0.163	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	5.5	174.5	-58	-167.7	64.1	0	0	112.6	F55 K58 L59 L323 S324	F55-M326 HydrophobicContact CD2-CE 3.5Å; F55-M326 VanDerWaalsContact CD2-CE 3.5Å; F55-M326 HydrophobicContact CD2-SD 4.3Å; F55-M326 HydrophobicContact CE2-CE 3.46Å; F55-M326 VanDerWaalsContact CE2-CE 3.46Å; F55-M326 HydrophobicContact CE2-SD 3.64Å; F55-M326 HydrophobicContact CZ-SD 4.4Å; K58-M326 HydrophobicContact CB-CE 3.96Å; L59-M326 HydrophobicContact CB-SD 4.03Å; L59-M326 HydrophobicContact CD1-SD 3.81Å; L59-M326 HydrophobicContact CG-SD 4.47Å; L323-M326 HydrophobicContact CD2-SD 4.21Å; L323-M326 CarbonylContact O-C 3.6Å; L323-M326 VanDerWaalsContact O-CA 3.3Å; L323-M326 WeakPolarHBondContact O-CA 3.44Å; L323-M326 WeakPolarHBondContact O-CB 3.36Å; L323-M326 PolarHBondContact O-N 3.17Å; S324-M326 PolarHBondContact O-N 3.24Å
327	G	91.3	Very high	86.8	Confident	47 Å²	47	51 Å²	51	49%	0.485	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	20.4	178.5	0	0	0	0	0	114.3	L323 S324	L323-G327 PolarHBondContact O-N 3Å; S324-G327 PolarHBondContact O-N 3.09Å
328	I	94.1	Very high	87	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	25%	0.251	C	S	.	.			trans	-109.9	99.7	174.3	-56.2	156.2	0	0	0	107.5	I98 F102 L323 S324 I331 F332	I98-I328 HydrophobicContact CG1-CG2 4.09Å; F102-I328 HydrophobicContact CD2-CD1 3.67Å; F102-I328 HydrophobicContact CE2-CD1 3.47Å; F102-I328 VanDerWaalsContact CE2-CD1 3.47Å; F102-I328 HydrophobicContact CZ-CD1 4.45Å; L323-I328 CarbonylContact C-O 3.54Å; L323-I328 HydrophobicContact CB-CB 4.11Å; L323-I328 HydrophobicContact CB-CD1 4.16Å; L323-I328 HydrophobicContact CD2-CD1 4.13Å; L323-I328 PolarHBondContact O-N 2.69Å; S324-I328 WeakPolarHBondContact CA-O 3.29Å; S324-I328 PolarHBondContact N-O 2.9Å; I328-I331 HydrophobicContact CG2-CG2 3.81Å; I328-F332 HydrophobicContact CG2-CE2 4.39Å
329	S	93.1	Very high	87.2	Confident	37 Å²	37	49.5 Å²	49.5	26%	0.259	25%	0.252	S	S	.	.			trans	-125.9	-36	-179.4	72.3	0	0	0	0	112.8	E97 I331 F332 E333	E97-S329 PolarHBondContact OE2-N 3.44Å; S329-I331 VanDerWaalsContact C-N 3.25Å; S329-I331 PolarHBondContact O-N 2.81Å; S329-I331 VanDerWaalsContact O-N 3.11Å; S329-F332 WeakPolarHBondContact O-CB 3.46Å; S329-F332 PolarHBondContact O-N 2.93Å; S329-E333 VanDerWaalsContact CB-OE1 3.26Å; S329-E333 WeakPolarHBondContact CB-OE1 3.45Å; S329-E333 PolarHBondContact O-N 2.92Å; S329-E333 PolarHBondContact OG-OE1 3.47Å
330	K	92.4	Very high	87.4	Confident	64 Å²	64	52.1 Å²	52.1	28%	0.278	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-57.4	-35.8	-172.1	-77.1	-177.2	-179.7	177.9	0	114.3	S93 E97 F332 E333 G336	S93-K330 VanDerWaalsContact OG-CD 3.27Å; S93-K330 WeakPolarHBondContact OG-CD 3.38Å; S93-K330 PolarHBondContact OG-NZ 3.24Å; E97-K330 WeakPolarHBondContact OE1-CD 3.26Å; E97-K330 VanDerWaalsContact OE1-CE 3.22Å; E97-K330 WeakPolarHBondContact OE1-CE 3.34Å; E97-K330 VanDerWaalsContact OE1-CG 3.24Å; E97-K330 WeakPolarHBondContact OE1-CG 2.97Å; E97-K330 IonicContact OE1-NZ 3.9Å; E97-K330 WeakPolarHBondContact OE2-CB 3.24Å; E97-K330 PolarHBondContact OE2-N 2.95Å; K330-F332 PolarHBondContact O-N 3.47Å; K330-F332 VanDerWaalsContact O-N 3.14Å; K330-E333 PolarHBondContact O-N 2.9Å; K330-G336 WeakPolarHBondContact O-CA 3.42Å; K330-G336 PolarHBondContact O-N 2.9Å
331	I	89.7	Confident	87.5	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-60.5	-22.9	178.1	-169.3	62.1	0	0	0	113.1	F83 L86 T94 I98 I328 S329 L338 V349	F83-I331 HydrophobicContact CE1-CG2 4.39Å; L86-I331 HydrophobicContact CD1-CG1 4.36Å; T94-I331 HydrophobicContact CG2-CB 3.9Å; T94-I331 HydrophobicContact CG2-CD1 3.64Å; T94-I331 HydrophobicContact CG2-CG1 4.34Å; I98-I331 HydrophobicContact CD1-CB 4.28Å; I98-I331 HydrophobicContact CD1-CD1 4.14Å; I98-I331 HydrophobicContact CD1-CG1 4.13Å; I328-I331 HydrophobicContact CG2-CG2 3.81Å; S329-I331 VanDerWaalsContact C-N 3.25Å; S329-I331 PolarHBondContact O-N 2.81Å; S329-I331 VanDerWaalsContact O-N 3.11Å; I331-L338 HydrophobicContact CD1-CD1 3.85Å; I331-L338 HydrophobicContact CD1-CD2 3.45Å; I331-L338 VanDerWaalsContact CD1-CD2 3.45Å; I331-L338 HydrophobicContact CD1-CG 3.76Å; I331-V349 HydrophobicContact CD1-CG2 4.09Å; I331-V349 HydrophobicContact CG1-CB 4.41Å; I331-V349 HydrophobicContact CG1-CG2 3.74Å; I331-V349 PolarHBondContact O-N 2.75Å
332	F	87.4	Confident	87.3	Confident	11 Å²	11	43.6 Å²	43.6	5%	0.048	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-98.8	-3.6	178.6	-51.5	-67.6	0	0	0	113.3	F83 K320 L323 I328 S329 K330 V349 A352	F83-F332 HydrophobicContact CE1-CE1 4.41Å; F83-F332 AromaticContact CE1-CZ 3.8Å; F83-F332 HydrophobicContact CE1-CZ 3.8Å; F83-F332 HydrophobicContact CZ-CE1 4.25Å; F83-F332 AromaticContact CZ-CZ 3.77Å; F83-F332 HydrophobicContact CZ-CZ 3.77Å; K320-F332 HydrophobicContact CB-CD1 3.89Å; K320-F332 HydrophobicContact CB-CD2 4.35Å; K320-F332 HydrophobicContact CB-CE1 3.94Å; K320-F332 HydrophobicContact CB-CE2 4.4Å; K320-F332 HydrophobicContact CB-CG 4.11Å; K320-F332 HydrophobicContact CB-CZ 4.2Å; K320-F332 HydrophobicContact CD-CB 4.1Å; K320-F332 HydrophobicContact CD-CD1 4.21Å; K320-F332 HydrophobicContact CD-CG 4.23Å; K320-F332 HydrophobicContact CG-CB 3.92Å; K320-F332 HydrophobicContact CG-CD1 3.89Å; K320-F332 HydrophobicContact CG-CD2 4.04Å; K320-F332 HydrophobicContact CG-CE1 4.41Å; K320-F332 HydrophobicContact CG-CG 3.68Å; L323-F332 HydrophobicContact CB-CE2 4.31Å; L323-F332 HydrophobicContact CD1-CZ 4.26Å; I328-F332 HydrophobicContact CG2-CE2 4.39Å; S329-F332 WeakPolarHBondContact O-CB 3.46Å; S329-F332 PolarHBondContact O-N 2.93Å; K330-F332 PolarHBondContact O-N 3.47Å; K330-F332 VanDerWaalsContact O-N 3.14Å; F332-V349 HydrophobicContact CD1-CB 3.92Å; F332-V349 HydrophobicContact CD1-CG1 3.99Å; F332-V349 HydrophobicContact CE1-CB 4.21Å; F332-V349 HydrophobicContact CE1-CG1 3.92Å; F332-A352 HydrophobicContact CE1-CB 3.89Å
333	E	85.3	Confident	87	Confident	83 Å²	83	46.7 Å²	46.7	39%	0.388	25%	0.247	S	C	.	.	S	Bend	trans	-100.2	161.6	-178.7	-66.3	169	-154.4	0	0	110.7	S329 K330 H335 G336 K348	S329-E333 VanDerWaalsContact CB-OE1 3.26Å; S329-E333 WeakPolarHBondContact CB-OE1 3.45Å; S329-E333 PolarHBondContact O-N 2.92Å; S329-E333 PolarHBondContact OG-OE1 3.47Å; K330-E333 PolarHBondContact O-N 2.9Å; E333-H335 PolarHBondContact O-N 2.96Å; E333-G336 PolarHBondContact O-N 2.92Å; E333-K348 WeakPolarHBondContact O-CB 3.13Å
334	E	76.2	Confident	86	Confident	125 Å²	125	52.6 Å²	52.6	58%	0.584	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.4	-178.7	-69.1	-178.4	179.4	0	0	114	K348	E334-K348 HydrophobicContact CG-CD 3.86Å; E334-K348 IonicContact OE1-NZ 3.41Å; E334-K348 PolarHBondContact OE1-NZ 3.34Å
335	H	71.6	Confident	85.2	Confident	158 Å²	158	56.4 Å²	56.4	73%	0.731	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	13.5	173.8	-55.8	-55.4	0	0	0	112.9	E333 D337	E333-H335 PolarHBondContact O-N 2.96Å; H335-D337 PolarHBondContact O-N 2.84Å
336	G	77.9	Confident	84.7	Confident	5 Å²	5	56.8 Å²	56.8	5%	0.052	31%	0.305	C	S	.	.			trans	-60.4	115.3	168.7	0	0	0	0	0	110	T94 K330 E333 L338	T94-G336 WeakPolarHBondContact OG1-CA 3.47Å; K330-G336 WeakPolarHBondContact O-CA 3.42Å; K330-G336 PolarHBondContact O-N 2.9Å; E333-G336 PolarHBondContact O-N 2.92Å; G336-L338 PolarHBondContact O-N 3.21Å
337	D	86.1	Confident	84.3	Confident	35 Å²	35	55.3 Å²	55.3	19%	0.187	30%	0.298	C	S	.	.			trans	-79.6	92.3	-178.9	-163.4	-25.3	0	0	0	110.1	A90 Q91 T94 H335 T339	A90-D337 VanDerWaalsContact CA-O 3.28Å; A90-D337 WeakPolarHBondContact CA-O 3.26Å; Q91-D337 HydrophobicContact CG-CB 3.87Å; Q91-D337 VanDerWaalsContact CG-OD1 3.27Å; Q91-D337 WeakPolarHBondContact CG-OD1 3.31Å; Q91-D337 WeakPolarHBondContact CG-OD2 3.42Å; Q91-D337 PolarHBondContact N-O 3.14Å; Q91-D337 PolarHBondContact NE2-OD1 2.85Å; Q91-D337 PolarHBondContact NE2-OD2 2.92Å; T94-D337 PolarHBondContact OG1-N 2.82Å; H335-D337 PolarHBondContact O-N 2.84Å; D337-T339 WeakPolarHBondContact OD1-CB 3.41Å; D337-T339 VanDerWaalsContact OD1-CG2 3.23Å; D337-T339 WeakPolarHBondContact OD1-CG2 3.49Å; D337-T339 PolarHBondContact OD1-N 2.94Å; D337-T339 VanDerWaalsContact OD1-N 3.11Å; D337-T339 PolarHBondContact OD1-OG1 2.9Å
338	L	88.6	Confident	83.8	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.01	29%	0.29	C	S	.	.			trans	-110.8	26.1	175.6	-73.8	-179.4	0	0	0	111.8	G89 A90 M202 I331 G336 K340 I341 A342 L347 V349	G89-L338 CarbonylContact O-C 3.5Å; G89-L338 VanDerWaalsContact O-CA 3.3Å; G89-L338 WeakPolarHBondContact O-CA 3.49Å; A90-L338 HydrophobicContact CB-CD2 4.22Å; M202-L338 HydrophobicContact CE-CD1 3.98Å; I331-L338 HydrophobicContact CD1-CD1 3.85Å; I331-L338 HydrophobicContact CD1-CD2 3.45Å; I331-L338 VanDerWaalsContact CD1-CD2 3.45Å; I331-L338 HydrophobicContact CD1-CG 3.76Å; G336-L338 PolarHBondContact O-N 3.21Å; L338-K340 PolarHBondContact O-N 2.71Å; L338-I341 HydrophobicContact CB-CD1 4.32Å; L338-I341 HydrophobicContact CB-CG1 4.47Å; L338-I341 HydrophobicContact CD1-CD1 4.35Å; L338-I341 HydrophobicContact CD2-CD1 3.7Å; L338-I341 HydrophobicContact CD2-CG1 4.3Å; L338-I341 HydrophobicContact CG-CD1 4.35Å; L338-I341 WeakPolarHBondContact O-CA 3.38Å; L338-I341 VanDerWaalsContact O-CB 3.31Å; L338-I341 WeakPolarHBondContact O-CB 3.49Å; L338-I341 PolarHBondContact O-N 2.82Å; L338-A342 PolarHBondContact O-N 2.9Å; L338-L347 HydrophobicContact CB-CB 3.75Å; L338-L347 HydrophobicContact CB-CD1 4.46Å; L338-L347 HydrophobicContact CD1-CB 4.09Å; L338-V349 HydrophobicContact CD1-CG2 4.25Å
339	T	89.5	Confident	83.2	Confident	44 Å²	44	56.6 Å²	56.6	27%	0.27	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-23.1	-176.6	55.6	0	0	0	0	113.2	Q91 Q147 D337 I341 A342 P343	Q91-T339 VanDerWaalsContact CD-OG1 3.26Å; Q91-T339 PolarHBondContact NE2-OG1 3.49Å; Q91-T339 VanDerWaalsContact NE2-OG1 3.08Å; Q91-T339 PolarHBondContact OE1-OG1 2.92Å; Q147-T339 PolarHBondContact NE2-O 2.97Å; D337-T339 WeakPolarHBondContact OD1-CB 3.41Å; D337-T339 VanDerWaalsContact OD1-CG2 3.23Å; D337-T339 WeakPolarHBondContact OD1-CG2 3.49Å; D337-T339 PolarHBondContact OD1-N 2.94Å; D337-T339 VanDerWaalsContact OD1-N 3.11Å; D337-T339 PolarHBondContact OD1-OG1 2.9Å; T339-I341 PolarHBondContact O-N 2.91Å; T339-A342 CarbonylContact O-C 3.56Å; T339-A342 VanDerWaalsContact O-C 3.28Å; T339-A342 PolarHBondContact O-N 2.8Å; T339-P343 WeakPolarHBondContact O-CA 3.34Å
340	K	91.4	Very high	82.5	Confident	63 Å²	63	55.2 Å²	55.2	27%	0.274	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-17.8	169.3	-63.4	178.4	-176.9	161.9	0	113.1	G89 A90 Q147 L338	G89-K340 WeakPolarHBondContact O-CB 3.48Å; A90-K340 PolarHBondContact O-NZ 2.74Å; A90-K340 VanDerWaalsContact O-NZ 3.11Å; Q147-K340 VanDerWaalsContact CB-O 3.3Å; Q147-K340 WeakPolarHBondContact CB-O 3.46Å; Q147-K340 VanDerWaalsContact CD-O 3.27Å; Q147-K340 WeakPolarHBondContact CG-O 3.28Å; L338-K340 PolarHBondContact O-N 2.71Å
341	I	88.6	Confident	81.8	Confident	3 Å²	3	53.6 Å²	53.6	2%	0.015	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-57.3	168.1	-53.7	-174.8	0	0	0	109.3	G89 P146 Q147 F150 M202 L338 T339 L347	G89-I341 VanDerWaalsContact CA-CG1 3.44Å; P146-I341 CarbonylContact C-O 3.57Å; P146-I341 WeakPolarHBondContact CA-O 3.46Å; P146-I341 HydrophobicContact CB-CG2 4.42Å; Q147-I341 PolarHBondContact N-O 2.74Å; F150-I341 HydrophobicContact CD1-CB 4.47Å; F150-I341 HydrophobicContact CD1-CG1 4.2Å; F150-I341 HydrophobicContact CD1-CG2 4.07Å; F150-I341 HydrophobicContact CD2-CG1 4.05Å; F150-I341 HydrophobicContact CE1-CD1 4.15Å; F150-I341 HydrophobicContact CE1-CG1 4.05Å; F150-I341 HydrophobicContact CE1-CG2 3.96Å; F150-I341 HydrophobicContact CE2-CD1 4.01Å; F150-I341 HydrophobicContact CE2-CG1 3.91Å; F150-I341 HydrophobicContact CG-CG1 4.19Å; F150-I341 HydrophobicContact CZ-CD1 3.73Å; F150-I341 HydrophobicContact CZ-CG1 3.9Å; M202-I341 HydrophobicContact CE-CD1 3.8Å; M202-I341 HydrophobicContact SD-CD1 3.77Å; M202-I341 HydrophobicContact SD-CG2 4.28Å; L338-I341 HydrophobicContact CB-CD1 4.32Å; L338-I341 HydrophobicContact CB-CG1 4.47Å; L338-I341 HydrophobicContact CD1-CD1 4.35Å; L338-I341 HydrophobicContact CD2-CD1 3.7Å; L338-I341 HydrophobicContact CD2-CG1 4.3Å; L338-I341 HydrophobicContact CG-CD1 4.35Å; L338-I341 WeakPolarHBondContact O-CA 3.38Å; L338-I341 VanDerWaalsContact O-CB 3.31Å; L338-I341 WeakPolarHBondContact O-CB 3.49Å; L338-I341 PolarHBondContact O-N 2.82Å; T339-I341 PolarHBondContact O-N 2.91Å; I341-L347 HydrophobicContact CB-CD1 3.95Å; I341-L347 HydrophobicContact CG2-CD1 3.92Å
342	A	86.1	Confident	81.6	Confident	5 Å²	5	53.6 Å²	53.6	4%	0.041	28%	0.275	C	S	.	.			trans	-134.9	112.2	177.7	0	0	0	0	0	111.1	L144 L338 T339 C344 L347	L144-A342 HydrophobicContact CD2-CB 3.67Å; L338-A342 PolarHBondContact O-N 2.9Å; T339-A342 CarbonylContact O-C 3.56Å; T339-A342 VanDerWaalsContact O-C 3.28Å; T339-A342 PolarHBondContact O-N 2.8Å; A342-C344 VanDerWaalsContact C-N 3.32Å; A342-C344 PolarHBondContact O-N 2.83Å; A342-L347 HydrophobicContact CB-CD1 3.42Å; A342-L347 VanDerWaalsContact CB-CD1 3.42Å; A342-L347 HydrophobicContact CB-CG 4.11Å
343	P	81.2	Confident	81.4	Confident	80 Å²	80	54.3 Å²	54.3	52%	0.519	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-33.9	-174	-19.7	27	0	0	0	114.6	Q147 T339	Q147-P343 HydrophobicContact CG-CG 3.91Å; T339-P343 WeakPolarHBondContact O-CA 3.34Å
344	C	72	Confident	81.4	Confident	123 Å²	123	50.3 Å²	50.3	83%	0.831	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	14	-166.7	-56.6	0	0	0	0	113.9	A342	A342-C344 VanDerWaalsContact C-N 3.32Å; A342-C344 PolarHBondContact O-N 2.83Å
345	R	72.6	Confident	81.8	Confident	131 Å²	131	45.9 Å²	45.9	49%	0.494	24%	0.24	S	C	.	.	S	Bend	trans	-143.4	140.6	179	-73.4	-166	174.1	-175.7	1.2	111.1	L144 L347	L144-R345 HydrophobicContact CD2-CB 4.47Å; R345-L347 PolarHBondContact O-N 3.04Å
346	N	74.9	Confident	82.3	Confident	141 Å²	141	38.3 Å²	38.3	75%	0.754	21%	0.205	S	C	*	.			trans	-69.3	117.5	164.5	-67.4	-9.1	0	0	0	107.9
347	L	79.4	Confident	82.6	Confident	3 Å²	3	39.8 Å²	39.8	2%	0.016	21%	0.211	C	C	.	.			trans	-113.1	142.7	-179.6	-74.6	-175.6	0	0	0	109.5	L144 V201 L338 I341 A342 R345	L144-L347 HydrophobicContact CD1-CD2 3.84Å; L144-L347 HydrophobicContact CD2-CD1 4.41Å; L144-L347 HydrophobicContact CD2-CD2 3.84Å; L144-L347 HydrophobicContact CG-CD2 4.49Å; V201-L347 HydrophobicContact CB-CD2 4.43Å; V201-L347 HydrophobicContact CG2-CD2 3.38Å; L338-L347 HydrophobicContact CB-CB 3.75Å; L338-L347 HydrophobicContact CB-CD1 4.46Å; L338-L347 HydrophobicContact CD1-CB 4.09Å; I341-L347 HydrophobicContact CB-CD1 3.95Å; I341-L347 HydrophobicContact CG2-CD1 3.92Å; A342-L347 HydrophobicContact CB-CD1 3.42Å; A342-L347 VanDerWaalsContact CB-CD1 3.42Å; A342-L347 HydrophobicContact CB-CG 4.11Å; R345-L347 PolarHBondContact O-N 3.04Å
348	K	81.8	Confident	82.7	Confident	74 Å²	74	38.2 Å²	38.2	32%	0.322	20%	0.202	S	C	.	.			trans	-133.7	153.9	167.5	70.4	-174.3	175.1	-167	0	109.7	E333 E334 G350	E333-K348 WeakPolarHBondContact O-CB 3.13Å; E334-K348 HydrophobicContact CG-CD 3.86Å; E334-K348 IonicContact OE1-NZ 3.41Å; E334-K348 PolarHBondContact OE1-NZ 3.34Å; K348-G350 PolarHBondContact O-N 2.79Å
349	V	80.8	Confident	82.7	Confident	1 Å²	1	42 Å²	42	1%	0.006	22%	0.219	C	C	.	.			trans	-74.3	110.6	165.7	178.1	0	0	0	0	107.3	L86 M202 I331 F332 L338 A352	L86-V349 HydrophobicContact CD1-CG2 4Å; M202-V349 HydrophobicContact CE-CG2 3.89Å; I331-V349 HydrophobicContact CD1-CG2 4.09Å; I331-V349 HydrophobicContact CG1-CB 4.41Å; I331-V349 HydrophobicContact CG1-CG2 3.74Å; I331-V349 PolarHBondContact O-N 2.75Å; F332-V349 HydrophobicContact CD1-CB 3.92Å; F332-V349 HydrophobicContact CD1-CG1 3.99Å; F332-V349 HydrophobicContact CE1-CB 4.21Å; F332-V349 HydrophobicContact CE1-CG1 3.92Å; L338-V349 HydrophobicContact CD1-CG2 4.25Å; V349-A352 HydrophobicContact CG1-CB 4.14Å
350	G	78.8	Confident	82.9	Confident	7 Å²	7	40.1 Å²	40.1	7%	0.072	21%	0.207	C	C	.	.			trans	-67.8	-61.7	177.9	0	0	0	0	0	110.6	K320 K348	K320-G350 PolarHBondContact NZ-O 2.82Å; K348-G350 PolarHBondContact O-N 2.79Å
351	E	78.9	Confident	83	Confident	30 Å²	30	38.5 Å²	38.5	14%	0.14	20%	0.201	C	C	.	.			trans	-122.4	138.2	-176.7	-69.5	-57.4	130.5	0	0	111.5	L203	L203-E351 HydrophobicContact CD1-CB 4.16Å; L203-E351 HydrophobicContact CG-CB 4.4Å
352	A	83.7	Confident	83.2	Confident	2 Å²	2	38.7 Å²	38.7	2%	0.017	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	114.3	172	0	0	0	0	0	108.8	F83 L319 F332 V349	F83-A352 HydrophobicContact CZ-CB 4.26Å; L319-A352 HydrophobicContact CB-CB 3.91Å; L319-A352 VanDerWaalsContact CB-O 3.31Å; L319-A352 WeakPolarHBondContact CB-O 3.17Å; L319-A352 HydrophobicContact CD1-CB 4.43Å; L319-A352 PolarHBondContact N-O 2.71Å; F332-A352 HydrophobicContact CE1-CB 3.89Å; V349-A352 HydrophobicContact CG1-CB 4.14Å
353	V	83.6	Confident	83.3	Confident	25 Å²	25	43.9 Å²	43.9	15%	0.152	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132.1	-175.4	-177	0	0	0	0	109.7	L192 T316	L192-V353 HydrophobicContact CD1-CB 4.4Å; L192-V353 HydrophobicContact CD1-CG1 3.88Å; L192-V353 HydrophobicContact CG-CG1 4.38Å; T316-V353 HydrophobicContact CG2-CG1 4.08Å
354	H	86	Confident	83.3	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	130.2	168.6	-179.1	65.3	0	0	0	109.8	S75 I79 T316 F317 L319	S75-H354 PolarHBondContact N-NE2 3.13Å; S75-H354 VanDerWaalsContact N-NE2 3.18Å; I79-H354 HydrophobicContact CD1-CB 4.26Å; I79-H354 HydrophobicContact CG1-CB 4.05Å; T316-H354 CarbonylContact C-O 3.4Å; T316-H354 WeakPolarHBondContact CA-O 3.13Å; F317-H354 PolarHBondContact N-O 2.78Å; F317-H354 PolarHBondContact O-N 3.25Å; L319-H354 HydrophobicContact CD1-CB 3.92Å; L319-H354 HydrophobicContact CD2-CB 3.66Å; L319-H354 HydrophobicContact CG-CB 3.82Å
355	K	83.9	Confident	83.1	Confident	31 Å²	31	34.2 Å²	34.2	14%	0.135	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	126.3	171	-170.5	156	169.8	178.2	0	110	I189 N191 L192 T314 G315 T316	I189-K355 HydrophobicContact CD1-CB 4.32Å; I189-K355 HydrophobicContact CD1-CG 4.28Å; I189-K355 HydrophobicContact CG2-CB 4.27Å; I189-K355 HydrophobicContact CG2-CD 3.78Å; I189-K355 HydrophobicContact CG2-CG 4.08Å; N191-K355 PolarHBondContact O-NZ 2.85Å; L192-K355 HydrophobicContact CD1-CB 3.39Å; L192-K355 HydrophobicContact CD1-CD 4.24Å; L192-K355 HydrophobicContact CD1-CG 4.45Å; T314-K355 HydrophobicContact CG2-CD 4.37Å; T314-K355 HydrophobicContact CG2-CG 4.08Å; G315-K355 CarbonylContact O-C 3.58Å; G315-K355 VanDerWaalsContact O-CA 3.29Å; G315-K355 WeakPolarHBondContact O-CA 3.37Å; T316-K355 HydrophobicContact CG2-CD 4.4Å; T316-K355 WeakPolarHBondContact OG1-CD 2.83Å
356	A	83.6	Confident	82.1	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	134.1	175.4	0	0	0	0	0	109	M73 T314 G315 F404	M73-A356 HydrophobicContact CG-CB 4.32Å; T314-A356 CarbonylContact C-O 3.56Å; T314-A356 VanDerWaalsContact CA-O 3.29Å; T314-A356 WeakPolarHBondContact CA-O 3.49Å; G315-A356 PolarHBondContact N-O 3.34Å; G315-A356 PolarHBondContact O-N 2.96Å; A356-F404 HydrophobicContact CB-CD1 4.24Å; A356-F404 HydrophobicContact CB-CE1 3.97Å
357	E	84.1	Confident	80.1	Confident	36 Å²	36	23.4 Å²	23.4	17%	0.168	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132.4	172.4	-175.4	173.1	171.4	0	0	109.2	K188 H312 M313	K188-E357 VanDerWaalsContact O-OE2 3.07Å; H312-E357 IonicContact CD2-OE1 3.84Å; H312-E357 IonicContact CE1-OE1 3.79Å; H312-E357 IonicContact NE2-OE1 2.71Å; H312-E357 PolarHBondContact NE2-OE1 3.2Å; M313-E357 CarbonylContact O-C 3.5Å; M313-E357 VanDerWaalsContact O-CA 3.32Å; M313-E357 WeakPolarHBondContact O-CA 3.35Å
358	L	86.7	Confident	77.7	Confident	1 Å²	1	25 Å²	25	1%	0.005	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	126.5	176.3	-173.7	73.9	0	0	0	108.8	M73 F210 L311 H312 M313 T365 L392 I394	M73-L358 HydrophobicContact CE-CB 4.17Å; M73-L358 HydrophobicContact CE-CD2 3.63Å; M73-L358 HydrophobicContact CG-CB 4.42Å; M73-L358 HydrophobicContact SD-CB 4.26Å; M73-L358 HydrophobicContact SD-CD2 4.17Å; F210-L358 HydrophobicContact CD1-CD1 4.03Å; L311-L358 HydrophobicContact CD2-CD2 4.35Å; H312-L358 WeakPolarHBondContact CA-O 3.31Å; M313-L358 PolarHBondContact N-O 2.92Å; M313-L358 PolarHBondContact O-N 3.01Å; L358-T365 HydrophobicContact CD1-CG2 3.81Å; L358-L392 HydrophobicContact CD2-CD2 3.53Å; L358-I394 HydrophobicContact CD1-CG1 4.44Å
359	K	89.4	Confident	75.3	Confident	83 Å²	83	24.8 Å²	24.8	36%	0.361	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	116.7	174.4	-177.6	-177.6	173.5	-173.9	0	109.5	L311 T365 E366	L311-K359 CarbonylContact O-C 3.45Å; L311-K359 WeakPolarHBondContact O-CA 3.5Å; K359-T365 WeakPolarHBondContact O-CA 3.44Å; K359-T365 WeakPolarHBondContact O-CG2 3.18Å; K359-E366 HydrophobicContact CB-CG 4.47Å; K359-E366 HydrophobicContact CD-CG 4.13Å
360	M	93.1	Very high	73.2	Confident	3 Å²	3	27.2 Å²	27.2	2%	0.015	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	125.9	-178.3	-171.8	-178.9	-73.2	0	0	110.2	W214 M241 F272 V308 L311 G364 L392	W214-M360 HydrophobicContact CH2-CE 3.87Å; W214-M360 HydrophobicContact CH2-CG 4.39Å; W214-M360 HydrophobicContact CH2-SD 4.09Å; W214-M360 HydrophobicContact CZ2-CE 4.01Å; W214-M360 HydrophobicContact CZ2-CG 3.58Å; W214-M360 HydrophobicContact CZ2-SD 3.7Å; M241-M360 HydrophobicContact CE-CG 4.45Å; F272-M360 HydrophobicContact CE1-CE 4.41Å; F272-M360 HydrophobicContact CE1-SD 4.27Å; F272-M360 HydrophobicContact CZ-CE 3.87Å; F272-M360 HydrophobicContact CZ-SD 3.81Å; V308-M360 HydrophobicContact CG1-SD 4.27Å; L311-M360 HydrophobicContact CB-CB 3.94Å; L311-M360 PolarHBondContact N-O 2.83Å; L311-M360 PolarHBondContact O-N 3.21Å; M360-G364 WeakPolarHBondContact CA-O 3.46Å; M360-L392 HydrophobicContact CE-CD1 4.27Å; M360-L392 HydrophobicContact CE-CD2 3.84Å
361	D	93.3	Very high	71.2	Confident	29 Å²	29	34.3 Å²	34.3	16%	0.155	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-139	-173.6	179.1	66.3	28.7	0	0	0	111.2	W214 R363 G364	W214-D361 PolarHBondContact NE1-O 2.89Å; D361-R363 PolarHBondContact O-N 2.66Å; D361-R363 PolarHBondContact OD1-N 2.92Å; D361-G364 PolarHBondContact N-O 2.82Å; D361-G364 PolarHBondContact O-N 3.49Å; D361-G364 VanDerWaalsContact O-N 3.15Å; D361-G364 VanDerWaalsContact O-O 3.08Å; D361-G364 PolarHBondContact OD1-N 2.9Å
362	E	93.6	Very high	69.6	Low	8 Å²	8	36.2 Å²	36.2	4%	0.037	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-27.8	-175.1	-71.9	88.2	165.6	0	0	113.7	E217 F218 P220 T223 M241 R310	E217-E362 CarbonylContact C-O 3.57Å; E217-E362 WeakPolarHBondContact CA-O 3.08Å; E217-E362 WeakPolarHBondContact CB-O 3.34Å; F218-E362 HydrophobicContact CB-CB 3.84Å; F218-E362 HydrophobicContact CB-CG 3.77Å; F218-E362 PolarHBondContact N-O 3.42Å; F218-E362 WeakPolarHBondContact O-CB 3.28Å; P220-E362 HydrophobicContact CB-CG 4.38Å; P220-E362 HydrophobicContact CG-CB 4.06Å; P220-E362 HydrophobicContact CG-CG 4.13Å; T223-E362 VanDerWaalsContact CB-OE1 3.25Å; T223-E362 WeakPolarHBondContact CB-OE1 3.46Å; T223-E362 WeakPolarHBondContact CG2-OE1 3.12Å; T223-E362 PolarHBondContact OG1-OE1 3.42Å; M241-E362 HydrophobicContact CG-CG 4.03Å; M241-E362 HydrophobicContact SD-CB 4.39Å; M241-E362 HydrophobicContact SD-CG 3.89Å; M241-E362 PolarHBondContact SD-N 3.13Å; R310-E362 IonicContact CZ-OE1 3.1Å; R310-E362 IonicContact CZ-OE2 3.18Å; R310-E362 VanDerWaalsContact NE-CD 3.26Å; R310-E362 IonicContact NE-OE1 2.94Å; R310-E362 PolarHBondContact NE-OE1 2.94Å; R310-E362 IonicContact NE-OE2 2.86Å; R310-E362 PolarHBondContact NE-OE2 3.49Å; R310-E362 IonicContact NH2-OE1 2.66Å; R310-E362 PolarHBondContact NH2-OE1 3.01Å; R310-E362 IonicContact NH2-OE2 2.72Å; R310-E362 PolarHBondContact NH2-OE2 2.84Å
363	R	87.6	Confident	67.7	Low	113 Å²	113	41.2 Å²	41.2	43%	0.426	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-20.8	-179.9	-62.7	-176.3	173.3	175.3	-1.8	111.9	R213 W214 D361	R213-R363 CarbonylContact C-O 3.56Å; R213-R363 VanDerWaalsContact CA-O 3.23Å; R213-R363 WeakPolarHBondContact CA-O 3.25Å; R213-R363 WeakPolarHBondContact CB-O 3.43Å; W214-R363 PolarHBondContact N-O 3.48Å; D361-R363 PolarHBondContact O-N 2.66Å; D361-R363 PolarHBondContact OD1-N 2.92Å
364	G	81.2	Confident	66.5	Low	0 Å²	0	43 Å²	43	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	145.6	-143.6	-172.6	0	0	0	0	0	112.5	A212 W214 M360 D361	A212-G364 CarbonylContact O-C 3.59Å; A212-G364 WeakPolarHBondContact O-CA 3.43Å; W214-G364 VanDerWaalsContact NE1-CA 3.28Å; M360-G364 WeakPolarHBondContact CA-O 3.46Å; D361-G364 PolarHBondContact N-O 2.82Å; D361-G364 PolarHBondContact O-N 3.49Å; D361-G364 VanDerWaalsContact O-N 3.15Å; D361-G364 VanDerWaalsContact O-O 3.08Å; D361-G364 PolarHBondContact OD1-N 2.9Å
365	T	69.4	Low	65.2	Low	1 Å²	1	49.7 Å²	49.7	1%	0.006	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	91.8	158.7	-59	0	0	0	0	107.4	F210 R211 A212 Y264 L358 K359	F210-T365 HydrophobicContact CD1-CG2 3.68Å; F210-T365 HydrophobicContact CE1-CG2 3.89Å; F210-T365 WeakPolarHBondContact O-CG2 3.32Å; R211-T365 CarbonylContact C-O 3.58Å; R211-T365 WeakPolarHBondContact CA-O 3.38Å; R211-T365 WeakPolarHBondContact CG-O 3.25Å; A212-T365 PolarHBondContact N-O 2.92Å; A212-T365 CarbonylContact O-C 3.34Å; A212-T365 WeakPolarHBondContact O-CA 3.43Å; A212-T365 PolarHBondContact O-N 3.41Å; A212-T365 VanDerWaalsContact O-O 3.09Å; Y264-T365 PolarHBondContact OH-OG1 3.08Å; L358-T365 HydrophobicContact CD1-CG2 3.81Å; K359-T365 WeakPolarHBondContact O-CA 3.44Å; K359-T365 WeakPolarHBondContact O-CG2 3.18Å
366	E	49.8	Very low	64.7	Low	29 Å²	29	51.5 Å²	51.5	14%	0.136	33%	0.331	C	S	.	.	S	Bend	trans	60.3	113.8	-175.4	-69	-161.5	148.8	0	0	118.5	K188 R211 K359	K188-E366 VanDerWaalsContact CE-OE1 3.25Å; K188-E366 WeakPolarHBondContact CE-OE1 3.38Å; K188-E366 IonicContact NZ-OE1 2.65Å; K188-E366 PolarHBondContact NZ-OE1 2.89Å; K188-E366 IonicContact NZ-OE2 2.79Å; R211-E366 HydrophobicContact CB-CB 4.4Å; R211-E366 WeakPolarHBondContact CD-O 3.18Å; R211-E366 HydrophobicContact CG-CB 3.76Å; R211-E366 WeakPolarHBondContact CG-O 3.31Å; R211-E366 PolarHBondContact NE-O 2.78Å; K359-E366 HydrophobicContact CB-CG 4.47Å; K359-E366 HydrophobicContact CD-CG 4.13Å
367	G	33.8	Very low	63.9	Low	15 Å²	15	54.7 Å²	54.7	16%	0.155	35%	0.352	C	S	.	.			trans	-120.3	-172.4	-155	0	0	0	0	0	121.5	R211	R211-G367 PolarHBondContact NH2-O 3.17Å
368	A	28.3	Very low	63.1	Low	37 Å²	37	62.7 Å²	62.7	31%	0.306	39%	0.392	S	S	.	.			trans	-153.9	172.4	141.9	0	0	0	0	0	106	R213	R213-A368 WeakPolarHBondContact CD-O 3.31Å; R213-A368 VanDerWaalsContact CZ-CA 3.5Å; R213-A368 VanDerWaalsContact CZ-CB 3.48Å; R213-A368 VanDerWaalsContact NE-N 3.16Å; R213-A368 PolarHBondContact NE-O 2.77Å; R213-A368 PolarHBondContact NH1-O 3.32Å
369	A	32.3	Very low	62.5	Low	70 Å²	70	69.1 Å²	69.1	58%	0.579	42%	0.422	S	S	*	.			trans	-95.8	156.6	-162.8	0	0	0	0	0	115.8	R213 E217	R213-A369 PolarHBondContact NH1-O 2.91Å; E217-A369 WeakPolarHBondContact OE2-CA 3.3Å
370	G	36.7	Very low	62.3	Low	52 Å²	52	71.6 Å²	71.6	54%	0.536	44%	0.444	S	S	.	.			trans	-159.2	141.9	163.1	0	0	0	0	0	111.6	E217	E217-G370 PolarHBondContact OE1-N 2.97Å
371	T	36.2	Very low	62	Low	156 Å²	156	73.3 Å²	73.3	96%	0.957	46%	0.456	S	S	*	.			trans	-101.9	142.3	-178.3	50.2	0	0	0	0	111.8
372	G	46	Very low	62.1	Low	69 Å²	69	74.9 Å²	74.9	71%	0.711	46%	0.464	S	S	*	.			trans	-146.9	145.3	173.7	0	0	0	0	0	111.5
373	A	44.3	Very low	62.3	Low	107 Å²	107	79.3 Å²	79.3	88%	0.884	49%	0.491	S	S	*	.			trans	-103.4	137.6	178.1	0	0	0	0	0	111
374	Q	57	Low	62.8	Low	62 Å²	62	74.2 Å²	74.2	29%	0.29	47%	0.473	S	S	.	.			trans	-116.8	137.9	172.5	-64.2	-172.9	21.2	0	0	110.2	H216 L376	H216-Q374 PolarHBondContact CD2-NE2 3.02Å; H216-Q374 PolarHBondContact CE1-NE2 3.47Å; H216-Q374 PolarHBondContact ND1-NE2 3.47Å; H216-Q374 PolarHBondContact NE2-NE2 3.07Å; H216-Q374 VanDerWaalsContact NE2-NE2 3.15Å; Q374-L376 HydrophobicContact CB-CD2 4.4Å
375	T	60.3	Low	63.6	Low	142 Å²	142	77.7 Å²	77.7	87%	0.871	49%	0.488	S	S	*	.			trans	-87.5	128.6	166.2	49.3	0	0	0	0	109
376	L	72.3	Confident	65	Low	68 Å²	68	77.7 Å²	77.7	36%	0.356	49%	0.488	S	S	.	.			trans	-112.6	137	-177.9	-59.2	177.8	0	0	0	110.5	M246 V303 Q374	M246-L376 HydrophobicContact CG-CD2 3.93Å; V303-L376 HydrophobicContact CG1-CB 4.5Å; V303-L376 HydrophobicContact CG1-CD1 4.12Å; V303-L376 HydrophobicContact CG1-CD2 4.3Å; V303-L376 HydrophobicContact CG2-CB 4.38Å; V303-L376 HydrophobicContact CG2-CD2 4.31Å; Q374-L376 HydrophobicContact CB-CD2 4.4Å
377	P	67.8	Low	67.3	Low	68 Å²	68	77.4 Å²	77.4	44%	0.442	49%	0.487	S	S	.	.			trans	-52.2	146.1	167.7	-25.3	30.9	0	0	0	112.7	V303 E379	V303-P377 HydrophobicContact CG2-CB 4.43Å; V303-P377 HydrophobicContact CG2-CG 4.05Å; P377-E379 PolarHBondContact O-N 2.93Å
378	M	65.6	Low	70.2	Confident	204 Å²	204	79.9 Å²	79.9	100%	1.005	49%	0.491	S	S	*	.	S	Bend	trans	-78.6	64.2	173.4	-75.6	-174	163.2	0	0	111.4
379	E	74.2	Confident	73.5	Confident	136 Å²	136	78.7 Å²	78.7	64%	0.636	48%	0.481	S	S	*	.	S	Bend	trans	-123	154.6	170.7	-67.4	-177.6	179.7	0	0	109.2	P377 P381	P377-E379 PolarHBondContact O-N 2.93Å; E379-P381 VanDerWaalsContact O-CD 3.24Å; E379-P381 WeakPolarHBondContact O-CD 3.19Å
380	T	85	Confident	76.6	Confident	134 Å²	134	75.3 Å²	75.3	82%	0.822	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-61.7	119.9	171.7	-51.1	0	0	0	0	109
381	P	88.6	Confident	79.4	Confident	40 Å²	40	72.9 Å²	72.9	26%	0.26	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-58.7	144.5	179.9	-26.4	36.3	0	0	0	112	V303 D305 E379	V303-P381 HydrophobicContact CG1-CB 3.99Å; V303-P381 HydrophobicContact CG1-CG 4.01Å; D305-P381 HydrophobicContact CB-CB 4.41Å; D305-P381 WeakPolarHBondContact OD1-CB 3.44Å; E379-P381 VanDerWaalsContact O-CD 3.24Å; E379-P381 WeakPolarHBondContact O-CD 3.19Å
382	L	94.9	Very high	82.4	Confident	62 Å²	62	65.5 Å²	65.5	33%	0.325	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	135.4	166.4	180	68	0	0	0	108.6	V249 V303 V304 D305 V384	V249-L382 HydrophobicContact CG1-CD2 3.89Å; V249-L382 HydrophobicContact CG2-CD2 3.89Å; V303-L382 PolarHBondContact O-N 3.25Å; V304-L382 CarbonylContact C-O 3.31Å; V304-L382 WeakPolarHBondContact CA-O 3.32Å; V304-L382 HydrophobicContact CG1-CB 4.46Å; V304-L382 WeakPolarHBondContact CG1-O 3.42Å; V304-L382 HydrophobicContact CG2-CB 4.36Å; D305-L382 PolarHBondContact N-O 3.15Å; L382-V384 HydrophobicContact CD2-CG2 4.26Å; L382-V384 HydrophobicContact CG-CG2 4.35Å
383	V	97.3	Very high	84.7	Confident	100 Å²	100	62.2 Å²	62.2	61%	0.606	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.6	177	-178.1	0	0	0	0	109.6	D305	D305-V383 HydrophobicContact CB-CG2 4.41Å
384	V	98.3	Very high	87.2	Confident	7 Å²	7	57.1 Å²	57.1	4%	0.042	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	107	171.9	179.2	0	0	0	0	109.1	V249 T258 L260 V304 D305 V306 S307 L382	V249-V384 HydrophobicContact CG2-CG2 4.08Å; T258-V384 HydrophobicContact CG2-CG1 4.3Å; T258-V384 HydrophobicContact CG2-CG2 4.2Å; L260-V384 HydrophobicContact CB-CG1 4.47Å; L260-V384 HydrophobicContact CD2-CG1 4.03Å; V304-V384 HydrophobicContact CG1-CB 3.84Å; V304-V384 HydrophobicContact CG1-CG2 3.56Å; D305-V384 PolarHBondContact O-N 2.9Å; V306-V384 WeakPolarHBondContact CA-O 3.22Å; S307-V384 PolarHBondContact N-O 2.65Å; L382-V384 HydrophobicContact CD2-CG2 4.26Å; L382-V384 HydrophobicContact CG-CG2 4.35Å
385	K	98.4	Very high	88.9	Confident	73 Å²	73	55.2 Å²	55.2	32%	0.317	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	116.1	-177.1	-167.7	168.8	-163	173.9	0	110.7	E226 L274 D387	E226-K385 WeakPolarHBondContact OE2-CE 3.2Å; E226-K385 IonicContact OE2-NZ 3.2Å; E226-K385 PolarHBondContact OE2-NZ 2.72Å; L274-K385 WeakPolarHBondContact CD2-O 3.28Å; K385-D387 VanDerWaalsContact C-N 3.3Å; K385-D387 HydrophobicContact CD-CB 4.35Å; K385-D387 WeakPolarHBondContact CD-OD2 3.49Å; K385-D387 HydrophobicContact CG-CB 3.93Å; K385-D387 PolarHBondContact O-N 3.19Å
386	I	98.3	Very high	90.4	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	26%	0.256	C	S	.	.			trans	-91.8	68.7	179.7	-50.2	-174.8	0	0	0	109	L260 F272 L274 S307 V308 P309 Y390	L260-I386 HydrophobicContact CD2-CD1 4.35Å; F272-I386 HydrophobicContact CB-CD1 3.63Å; F272-I386 HydrophobicContact CD1-CD1 3.35Å; F272-I386 HydrophobicContact CD2-CD1 4.29Å; F272-I386 HydrophobicContact CE1-CD1 4.02Å; F272-I386 HydrophobicContact CG-CD1 3.5Å; L274-I386 HydrophobicContact CD1-CG2 4.39Å; S307-I386 WeakPolarHBondContact O-CB 3.24Å; S307-I386 WeakPolarHBondContact O-CG1 3.47Å; S307-I386 PolarHBondContact O-N 2.86Å; V308-I386 HydrophobicContact CG1-CD1 4.39Å; V308-I386 HydrophobicContact CG2-CD1 3.94Å; P309-I386 WeakPolarHBondContact CD-O 3.31Å; I386-Y390 HydrophobicContact CG2-CD1 3.3Å; I386-Y390 HydrophobicContact CG2-CD2 3.97Å; I386-Y390 HydrophobicContact CG2-CE1 3.55Å; I386-Y390 HydrophobicContact CG2-CE2 4.18Å; I386-Y390 HydrophobicContact CG2-CG 3.53Å
387	D	97.1	Very high	91.2	Very high	22 Å²	22	49.7 Å²	49.7	12%	0.118	26%	0.259	C	S	.	.			trans	-109.8	18.3	-175.8	60.2	-2.1	0	0	0	113.2	F228 F229 M240 K385	F228-D387 CarbonylContact C-O 3.56Å; F228-D387 WeakPolarHBondContact CA-O 3.26Å; F229-D387 HydrophobicContact CD2-CB 4.27Å; F229-D387 WeakPolarHBondContact CD2-O 3.37Å; F229-D387 PolarHBondContact N-O 3.35Å; M240-D387 HydrophobicContact CE-CB 4.32Å; K385-D387 VanDerWaalsContact C-N 3.3Å; K385-D387 HydrophobicContact CD-CB 4.35Å; K385-D387 WeakPolarHBondContact CD-OD2 3.49Å; K385-D387 HydrophobicContact CG-CB 3.93Å; K385-D387 PolarHBondContact O-N 3.19Å
388	R	95.9	Very high	92	Very high	67 Å²	67	51.5 Å²	51.5	25%	0.253	26%	0.261	S	S	.	.	S	Bend	trans	-152.5	167.3	179.6	64.8	177.5	177.4	-83.7	6.9	110.7	F228 F229 L274 P275 Y390	F228-R388 VanDerWaalsContact CZ-O 3.29Å; F228-R388 WeakPolarHBondContact CZ-O 3.4Å; F229-R388 WeakPolarHBondContact O-CA 3.34Å; L274-R388 HydrophobicContact CD1-CG 3.64Å; P275-R388 PolarHBondContact O-NE 2.85Å; P275-R388 PolarHBondContact O-NH2 2.84Å; R388-Y390 WeakPolarHBondContact O-CD1 3.48Å; R388-Y390 PolarHBondContact O-N 3.25Å
389	P	96.4	Very high	92.9	Very high	12 Å²	12	42.1 Å²	42.1	8%	0.078	21%	0.214	C	C	.	.			trans	-48.2	129.6	-177.3	-33.2	34.8	0	0	0	114.4	F229 E231 P275 L280 I408 V409	F229-P389 WeakPolarHBondContact O-CD 3.33Å; E231-P389 HydrophobicContact CG-CG 4.13Å; P275-P389 VanDerWaalsContact CD-O 3.31Å; P275-P389 WeakPolarHBondContact CD-O 3.48Å; P275-P389 WeakPolarHBondContact CG-O 3.23Å; L280-P389 HydrophobicContact CD2-CB 3.7Å; P389-I408 CarbonylContact C-O 3.56Å; P389-I408 WeakPolarHBondContact CA-O 3.5Å; P389-V409 HydrophobicContact CB-CG1 4.36Å; P389-V409 HydrophobicContact CG-CB 4.48Å
390	Y	97.3	Very high	93.5	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	165.5	-173.6	65.8	-83.3	0	0	0	111.1	F228 F272 L273 P309 I386 R388 L392 I408	F228-Y390 HydrophobicContact CE2-CD1 4.15Å; F228-Y390 AromaticContact CE2-CE1 3.94Å; F228-Y390 HydrophobicContact CE2-CE1 3.94Å; F228-Y390 HydrophobicContact CZ-CD1 4.17Å; F228-Y390 HydrophobicContact CZ-CE1 4.18Å; F272-Y390 AromaticContact CD1-CD2 3.91Å; F272-Y390 HydrophobicContact CD1-CD2 3.91Å; F272-Y390 AromaticContact CD1-CE2 3.67Å; F272-Y390 HydrophobicContact CD1-CE2 3.67Å; F272-Y390 AromaticContact CE1-CE2 3.95Å; F272-Y390 HydrophobicContact CE1-CE2 3.95Å; L273-Y390 WeakPolarHBondContact O-CA 3.32Å; L273-Y390 WeakPolarHBondContact O-CB 3.41Å; P309-Y390 HydrophobicContact CG-CE1 4.21Å; I386-Y390 HydrophobicContact CG2-CD1 3.3Å; I386-Y390 HydrophobicContact CG2-CD2 3.97Å; I386-Y390 HydrophobicContact CG2-CE1 3.55Å; I386-Y390 HydrophobicContact CG2-CE2 4.18Å; I386-Y390 HydrophobicContact CG2-CG 3.53Å; R388-Y390 WeakPolarHBondContact O-CD1 3.48Å; R388-Y390 PolarHBondContact O-N 3.25Å; Y390-L392 HydrophobicContact CE2-CB 4.2Å; Y390-I408 HydrophobicContact CD1-CB 3.98Å; Y390-I408 HydrophobicContact CD1-CG2 4.32Å; Y390-I408 HydrophobicContact CD2-CB 4.47Å; Y390-I408 HydrophobicContact CD2-CD1 4.03Å; Y390-I408 HydrophobicContact CE1-CB 3.55Å; Y390-I408 HydrophobicContact CE1-CG1 4.18Å; Y390-I408 HydrophobicContact CE1-CG2 3.57Å; Y390-I408 HydrophobicContact CE2-CB 4.08Å; Y390-I408 HydrophobicContact CE2-CD1 3.56Å; Y390-I408 HydrophobicContact CE2-CG1 3.91Å; Y390-I408 HydrophobicContact CG-CB 4.43Å; Y390-I408 PolarHBondContact N-O 2.81Å; Y390-I408 PolarHBondContact O-N 2.99Å
391	L	97.4	Very high	93.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	145.9	168.5	-50.2	-179.1	0	0	0	110.2	L60 L273 L280 L283 L287 G406 K407	L60-L391 HydrophobicContact CD2-CD1 4.35Å; L60-L391 HydrophobicContact CD2-CD2 4.41Å; L273-L391 HydrophobicContact CB-CB 4.12Å; L273-L391 HydrophobicContact CD1-CB 4.09Å; L273-L391 HydrophobicContact CD1-CD1 4.3Å; L273-L391 PolarHBondContact N-O 3.38Å; L273-L391 PolarHBondContact O-N 2.98Å; L280-L391 HydrophobicContact CD1-CD2 4.19Å; L280-L391 HydrophobicContact CD1-CG 4.43Å; L283-L391 HydrophobicContact CD2-CD1 3.86Å; L283-L391 HydrophobicContact CD2-CG 4.08Å; L283-L391 HydrophobicContact CG-CD1 3.93Å; L287-L391 HydrophobicContact CD1-CD1 3.78Å; L391-G406 CarbonylContact C-O 3.57Å; L391-G406 VanDerWaalsContact CA-O 3.29Å; L391-G406 WeakPolarHBondContact CA-O 2.79Å; L391-K407 HydrophobicContact CD2-CB 3.65Å; L391-K407 HydrophobicContact CD2-CG 3.86Å
392	L	97.2	Very high	93.9	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.7	178.6	175.8	60.8	0	0	0	109.8	M73 A270 F272 L311 L358 M360 Y390 I394 L405 G406 I408	M73-L392 HydrophobicContact CE-CD2 4.44Å; A270-L392 HydrophobicContact CB-CD1 4.15Å; F272-L392 HydrophobicContact CD1-CD1 3.96Å; F272-L392 HydrophobicContact CD2-CD1 4.44Å; F272-L392 HydrophobicContact CE1-CD1 3.75Å; F272-L392 HydrophobicContact CE2-CD1 4.23Å; F272-L392 HydrophobicContact CG-CD1 4.31Å; F272-L392 HydrophobicContact CZ-CD1 3.89Å; L311-L392 HydrophobicContact CD2-CD2 3.93Å; L358-L392 HydrophobicContact CD2-CD2 3.53Å; M360-L392 HydrophobicContact CE-CD1 4.27Å; M360-L392 HydrophobicContact CE-CD2 3.84Å; Y390-L392 HydrophobicContact CE2-CB 4.2Å; L392-I394 HydrophobicContact CD1-CD1 4.11Å; L392-I394 HydrophobicContact CD2-CD1 4.47Å; L392-I394 HydrophobicContact CG-CD1 4.32Å; L392-L405 CarbonylContact O-C 3.39Å; L392-L405 WeakPolarHBondContact O-CA 3.35Å; L392-G406 PolarHBondContact N-O 3.44Å; L392-G406 PolarHBondContact O-N 2.62Å; L392-I408 HydrophobicContact CB-CD1 3.59Å; L392-I408 HydrophobicContact CD2-CD1 4.44Å
393	L	96.1	Very high	93.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.2	170.8	-70.2	74.8	0	0	0	109.1	F57 A270 I271 L273 F292 V402 F404 L405	F57-L393 HydrophobicContact CE1-CD2 4.11Å; F57-L393 HydrophobicContact CZ-CD2 4.34Å; A270-L393 CarbonylContact C-O 3.53Å; A270-L393 WeakPolarHBondContact CA-O 3.49Å; I271-L393 HydrophobicContact CB-CB 4.23Å; I271-L393 PolarHBondContact N-O 2.79Å; I271-L393 PolarHBondContact O-N 2.74Å; L273-L393 HydrophobicContact CD1-CD1 3.59Å; L273-L393 HydrophobicContact CG-CD1 4.23Å; F292-L393 HydrophobicContact CD2-CD2 4.49Å; F292-L393 HydrophobicContact CE2-CD2 4.43Å; L393-V402 HydrophobicContact CD2-CG2 4.44Å; L393-F404 WeakPolarHBondContact CA-O 3.42Å; L393-L405 HydrophobicContact CD1-CD1 3.76Å; L393-L405 HydrophobicContact CD2-CD1 4.3Å; L393-L405 HydrophobicContact CG-CD1 3.6Å
394	I	95.3	Very high	93.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	114.6	165.6	-53.2	-59.3	0	0	0	107.1	F210 Y264 I268 A270 L358 L392 L403 F404	F210-I394 HydrophobicContact CD1-CG2 4.37Å; F210-I394 HydrophobicContact CE1-CG2 3.89Å; F210-I394 HydrophobicContact CE2-CG2 4.22Å; F210-I394 HydrophobicContact CZ-CG2 3.81Å; Y264-I394 HydrophobicContact CE2-CD1 4.14Å; I268-I394 HydrophobicContact CG2-CG2 3.75Å; A270-I394 HydrophobicContact CB-CD1 3.82Å; L358-I394 HydrophobicContact CD1-CG1 4.44Å; L392-I394 HydrophobicContact CD1-CD1 4.11Å; L392-I394 HydrophobicContact CD2-CD1 4.47Å; L392-I394 HydrophobicContact CG-CD1 4.32Å; I394-L403 HydrophobicContact CB-CB 4.43Å; I394-L403 HydrophobicContact CG2-CB 4.28Å; I394-L403 HydrophobicContact CG2-CD1 4.37Å; I394-L403 WeakPolarHBondContact O-CB 3.24Å; I394-L403 PolarHBondContact O-N 3.35Å; I394-F404 HydrophobicContact CB-CB 3.96Å; I394-F404 HydrophobicContact CB-CD2 4.12Å; I394-F404 HydrophobicContact CG1-CB 3.82Å; I394-F404 HydrophobicContact CG1-CD2 4.29Å; I394-F404 HydrophobicContact CG1-CG 4.39Å; I394-F404 HydrophobicContact CG2-CD2 4.47Å; I394-F404 PolarHBondContact N-O 3.36Å; I394-F404 PolarHBondContact O-N 2.83Å
395	Y	93.5	Very high	93.5	Very high	22 Å²	22	21.9 Å²	21.9	9%	0.086	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	133.2	-169.4	179.8	-99.3	0	0	0	111.3	I268 T269 I271 F292 Q397 P400 V402	I268-Y395 WeakPolarHBondContact CA-O 3.45Å; T269-Y395 PolarHBondContact N-O 3.23Å; T269-Y395 PolarHBondContact O-N 3.15Å; I271-Y395 HydrophobicContact CD1-CD1 4.5Å; I271-Y395 HydrophobicContact CD1-CG 4.27Å; F292-Y395 HydrophobicContact CD1-CE2 4.47Å; F292-Y395 HydrophobicContact CE1-CD1 4.44Å; F292-Y395 HydrophobicContact CE1-CD2 4.15Å; F292-Y395 AromaticContact CE1-CE1 3.93Å; F292-Y395 HydrophobicContact CE1-CE1 3.93Å; F292-Y395 AromaticContact CE1-CE2 3.6Å; F292-Y395 HydrophobicContact CE1-CE2 3.6Å; F292-Y395 AromaticContact CE1-CZ 3.46Å; F292-Y395 VanDerWaalsContact CE1-CZ 3.46Å; F292-Y395 HydrophobicContact CE2-CD2 4.15Å; F292-Y395 HydrophobicContact CE2-CE2 4.37Å; F292-Y395 HydrophobicContact CE2-CG 4.4Å; F292-Y395 AromaticContact CZ-CD1 3.86Å; F292-Y395 HydrophobicContact CZ-CD1 3.86Å; F292-Y395 AromaticContact CZ-CD2 3.58Å; F292-Y395 HydrophobicContact CZ-CD2 3.58Å; F292-Y395 AromaticContact CZ-CE1 3.81Å; F292-Y395 HydrophobicContact CZ-CE1 3.81Å; F292-Y395 AromaticContact CZ-CE2 3.53Å; F292-Y395 HydrophobicContact CZ-CE2 3.53Å; F292-Y395 AromaticContact CZ-CG 3.73Å; F292-Y395 HydrophobicContact CZ-CG 3.73Å; F292-Y395 AromaticContact CZ-CZ 3.64Å; Y395-Q397 HydrophobicContact CD1-CG 4.26Å; Y395-Q397 HydrophobicContact CE1-CG 4.35Å; Y395-P400 WeakPolarHBondContact OH-CA 3.41Å; Y395-P400 WeakPolarHBondContact OH-CB 3.11Å; Y395-V402 HydrophobicContact CD2-CG2 4.28Å
396	S	92	Very high	93.3	Very high	4 Å²	4	18.4 Å²	18.4	3%	0.028	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	125.5	169.8	177.5	0	0	0	0	109.7	N267 I399 P400 S401	N267-S396 CarbonylContact O-C 3.32Å; S396-I399 CarbonylContact C-O 3.49Å; S396-I399 WeakPolarHBondContact CB-O 3.25Å; S396-I399 CarbonylContact O-C 3.58Å; S396-I399 VanDerWaalsContact O-C 3.31Å; S396-I399 PolarHBondContact OG-N 2.57Å; S396-I399 PolarHBondContact OG-O 3.36Å; S396-P400 WeakPolarHBondContact O-CA 3.4Å; S396-S401 PolarHBondContact N-O 2.86Å; S396-S401 PolarHBondContact O-N 2.93Å
397	Q	88	Confident	93.2	Very high	90 Å²	90	18.5 Å²	18.5	42%	0.421	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-37.6	178	-59.6	-172.3	-6.6	0	0	111.7	N267 T269 Y395	N267-Q397 HydrophobicContact CB-CB 4.34Å; N267-Q397 PolarHBondContact O-N 3.23Å; T269-Q397 PolarHBondContact OG1-NE2 3.1Å; Y395-Q397 HydrophobicContact CD1-CG 4.26Å; Y395-Q397 HydrophobicContact CE1-CG 4.35Å
398	K	85.3	Confident	93.2	Very high	107 Å²	107	17.5 Å²	17.5	47%	0.465	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-42.3	-179.7	-178.3	-179.6	173	-163.6	0	111	E122 N267	E122-K398 WeakPolarHBondContact OE2-CE 3.4Å; E122-K398 IonicContact OE2-NZ 3.69Å; E122-K398 PolarHBondContact OE2-NZ 3.49Å; N267-K398 HydrophobicContact CB-CB 3.64Å
399	I	83.9	Confident	93.1	Very high	7 Å²	7	15 Å²	15	4%	0.036	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	107.8	170.2	-57.8	175.4	0	0	0	105.9	T49 I119 E122 L123 S396 S401	T49-I399 HydrophobicContact CG2-CG2 3.91Å; I119-I399 HydrophobicContact CG1-CG2 4.09Å; I119-I399 HydrophobicContact CG2-CG2 4.47Å; E122-I399 HydrophobicContact CB-CD1 3.17Å; E122-I399 HydrophobicContact CB-CG1 4.19Å; E122-I399 HydrophobicContact CG-CD1 4.12Å; L123-I399 HydrophobicContact CD2-CD1 4.16Å; L123-I399 HydrophobicContact CG-CD1 3.88Å; S396-I399 CarbonylContact C-O 3.49Å; S396-I399 WeakPolarHBondContact CB-O 3.25Å; S396-I399 CarbonylContact O-C 3.58Å; S396-I399 VanDerWaalsContact O-C 3.31Å; S396-I399 PolarHBondContact OG-N 2.57Å; S396-I399 PolarHBondContact OG-O 3.36Å; I399-S401 PolarHBondContact O-N 2.78Å; I399-S401 PolarHBondContact O-OG 2.74Å
400	P	87.3	Confident	93	Very high	48 Å²	48	16 Å²	16	31%	0.312	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	62.1	-174.6	-31.8	39.1	0	0	0	116.5	T49 Y395 S396	T49-P400 WeakPolarHBondContact CB-O 3.44Å; T49-P400 PolarHBondContact OG1-O 3.39Å; Y395-P400 WeakPolarHBondContact OH-CA 3.41Å; Y395-P400 WeakPolarHBondContact OH-CB 3.11Å; S396-P400 WeakPolarHBondContact O-CA 3.4Å
401	S	89	Confident	92.7	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.007	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	138.5	-166.6	68.8	0	0	0	0	112	S396 I399 L403	S396-S401 PolarHBondContact N-O 2.86Å; S396-S401 PolarHBondContact O-N 2.93Å; I399-S401 PolarHBondContact O-N 2.78Å; I399-S401 PolarHBondContact O-OG 2.74Å; S401-L403 PolarHBondContact O-N 3.49Å
402	V	92.6	Very high	92.3	Very high	3 Å²	3	21.4 Å²	21.4	2%	0.018	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	111	172	-177.9	0	0	0	0	109.3	M53 P76 L393 Y395 F404 L405	M53-V402 HydrophobicContact CB-CG2 4.21Å; M53-V402 HydrophobicContact CG-CG2 3.88Å; M53-V402 HydrophobicContact SD-CG2 3.99Å; P76-V402 HydrophobicContact CG-CG1 4.19Å; L393-V402 HydrophobicContact CD2-CG2 4.44Å; Y395-V402 HydrophobicContact CD2-CG2 4.28Å; V402-F404 VanDerWaalsContact CG1-O 3.3Å; V402-F404 WeakPolarHBondContact CG1-O 3.38Å; V402-L405 HydrophobicContact CG1-CB 4.12Å
403	L	93	Very high	91.1	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	-44.9	178.2	-56.7	-174.7	0	0	0	111.2	S75 L77 L123 I208 F210 I268 I394 S401	S75-L403 WeakPolarHBondContact CA-O 3.31Å; S75-L403 WeakPolarHBondContact CB-O 3.46Å; S75-L403 PolarHBondContact OG-O 3Å; L77-L403 HydrophobicContact CD2-CD2 3.78Å; L123-L403 HydrophobicContact CD1-CD2 3.67Å; L123-L403 HydrophobicContact CD2-CD2 3.97Å; L123-L403 HydrophobicContact CG-CD2 4.46Å; I208-L403 HydrophobicContact CD1-CB 4.47Å; F210-L403 HydrophobicContact CD2-CD1 4.41Å; I268-L403 HydrophobicContact CD1-CD1 3.97Å; I268-L403 HydrophobicContact CG2-CD1 4.47Å; I394-L403 HydrophobicContact CB-CB 4.43Å; I394-L403 HydrophobicContact CG2-CB 4.28Å; I394-L403 HydrophobicContact CG2-CD1 4.37Å; I394-L403 WeakPolarHBondContact O-CB 3.24Å; I394-L403 PolarHBondContact O-N 3.35Å; S401-L403 PolarHBondContact O-N 3.49Å
404	F	94.2	Very high	89	Confident	1 Å²	1	32.7 Å²	32.7	0%	0.004	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	145.5	175.5	-66.2	-100.2	0	0	0	109.8	M73 L74 I208 F210 A356 L393 I394 V402	M73-F404 HydrophobicContact SD-CB 4.18Å; M73-F404 HydrophobicContact SD-CD1 4.16Å; L74-F404 WeakPolarHBondContact O-CA 3.4Å; I208-F404 HydrophobicContact CB-CZ 4.32Å; I208-F404 HydrophobicContact CD1-CD2 4.46Å; I208-F404 HydrophobicContact CD1-CE2 3.66Å; I208-F404 HydrophobicContact CD1-CZ 3.89Å; I208-F404 HydrophobicContact CG1-CE2 3.97Å; I208-F404 HydrophobicContact CG1-CZ 3.77Å; I208-F404 HydrophobicContact CG2-CE1 3.91Å; I208-F404 HydrophobicContact CG2-CZ 3.69Å; F210-F404 HydrophobicContact CB-CD2 4.33Å; F210-F404 HydrophobicContact CB-CE2 3.34Å; F210-F404 HydrophobicContact CB-CZ 3.76Å; F210-F404 HydrophobicContact CD1-CE2 4.33Å; F210-F404 AromaticContact CG-CE2 3.93Å; F210-F404 HydrophobicContact CG-CE2 3.93Å; A356-F404 HydrophobicContact CB-CD1 4.24Å; A356-F404 HydrophobicContact CB-CE1 3.97Å; L393-F404 WeakPolarHBondContact CA-O 3.42Å; I394-F404 HydrophobicContact CB-CB 3.96Å; I394-F404 HydrophobicContact CB-CD2 4.12Å; I394-F404 HydrophobicContact CG1-CB 3.82Å; I394-F404 HydrophobicContact CG1-CD2 4.29Å; I394-F404 HydrophobicContact CG1-CG 4.39Å; I394-F404 HydrophobicContact CG2-CD2 4.47Å; I394-F404 PolarHBondContact N-O 3.36Å; I394-F404 PolarHBondContact O-N 2.83Å; V402-F404 VanDerWaalsContact CG1-O 3.3Å; V402-F404 WeakPolarHBondContact CG1-O 3.38Å
405	L	95.5	Very high	88.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	125.1	174.5	179.2	64	0	0	0	107.9	G56 F57 L60 L74 P76 L392 L393 V402	G56-L405 VanDerWaalsContact C-CD2 3.5Å; G56-L405 VanDerWaalsContact O-CD2 3.23Å; G56-L405 WeakPolarHBondContact O-CD2 3.3Å; F57-L405 HydrophobicContact CD1-CD2 4.1Å; F57-L405 HydrophobicContact CE1-CD1 4.39Å; L60-L405 HydrophobicContact CB-CD2 3.77Å; L60-L405 HydrophobicContact CB-CG 4.44Å; L60-L405 HydrophobicContact CD2-CD1 4.04Å; L60-L405 HydrophobicContact CD2-CD2 3.97Å; L60-L405 HydrophobicContact CD2-CG 3.98Å; L60-L405 HydrophobicContact CG-CD2 4.38Å; L74-L405 HydrophobicContact CD1-CB 4.24Å; L74-L405 PolarHBondContact N-O 3.4Å; L74-L405 PolarHBondContact O-N 3.4Å; P76-L405 HydrophobicContact CG-CB 4Å; P76-L405 HydrophobicContact CG-CD2 4.36Å; L392-L405 CarbonylContact O-C 3.39Å; L392-L405 WeakPolarHBondContact O-CA 3.35Å; L393-L405 HydrophobicContact CD1-CD1 3.76Å; L393-L405 HydrophobicContact CD2-CD1 4.3Å; L393-L405 HydrophobicContact CG-CD1 3.6Å; V402-L405 HydrophobicContact CG1-CB 4.12Å
406	G	94.9	Very high	88.5	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	152.6	-177.5	0	0	0	0	0	113.9	I72 L391 L392	I72-G406 CarbonylContact O-C 3.57Å; I72-G406 WeakPolarHBondContact O-CA 3.47Å; L391-G406 CarbonylContact C-O 3.57Å; L391-G406 VanDerWaalsContact CA-O 3.29Å; L391-G406 WeakPolarHBondContact CA-O 2.79Å; L392-G406 PolarHBondContact N-O 3.44Å; L392-G406 PolarHBondContact O-N 2.62Å
407	K	95.9	Very high	88.3	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.017	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	121.2	166.5	171.9	-171.6	176.3	156.7	0	107	L60 A64 N71 I72 E284 L391 V409	L60-K407 HydrophobicContact CD1-CB 4.2Å; A64-K407 HydrophobicContact CB-CD 4.41Å; N71-K407 WeakPolarHBondContact CA-O 3.48Å; I72-K407 HydrophobicContact CB-CB 4.14Å; I72-K407 HydrophobicContact CD1-CB 4.45Å; I72-K407 HydrophobicContact CD1-CD 4.12Å; I72-K407 HydrophobicContact CG1-CB 4.48Å; I72-K407 PolarHBondContact N-O 3.41Å; I72-K407 PolarHBondContact O-N 2.96Å; E284-K407 WeakPolarHBondContact OE1-CD 3.47Å; E284-K407 WeakPolarHBondContact OE1-CE 3.33Å; E284-K407 IonicContact OE1-NZ 3.78Å; E284-K407 PolarHBondContact OE1-NZ 2.81Å; E284-K407 IonicContact OE2-NZ 2.63Å; L391-K407 HydrophobicContact CD2-CB 3.65Å; L391-K407 HydrophobicContact CD2-CG 3.86Å; K407-V409 HydrophobicContact CD-CG1 4.28Å; K407-V409 HydrophobicContact CG-CG1 4.16Å
408	I	95.8	Very high	88.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	112.2	-180	-58.1	78.3	0	0	0	106.7	L311 M313 P389 Y390 L392 P411	L311-I408 HydrophobicContact CD1-CG1 4.11Å; L311-I408 HydrophobicContact CD1-CG2 4Å; L311-I408 HydrophobicContact CD2-CD1 4.42Å; L311-I408 HydrophobicContact CD2-CG1 4Å; M313-I408 HydrophobicContact SD-CD1 4.42Å; M313-I408 HydrophobicContact SD-CG1 3.57Å; M313-I408 VanDerWaalsContact SD-CG1 3.57Å; P389-I408 CarbonylContact C-O 3.56Å; P389-I408 WeakPolarHBondContact CA-O 3.5Å; Y390-I408 HydrophobicContact CD1-CB 3.98Å; Y390-I408 HydrophobicContact CD1-CG2 4.32Å; Y390-I408 HydrophobicContact CD2-CB 4.47Å; Y390-I408 HydrophobicContact CD2-CD1 4.03Å; Y390-I408 HydrophobicContact CE1-CB 3.55Å; Y390-I408 HydrophobicContact CE1-CG1 4.18Å; Y390-I408 HydrophobicContact CE1-CG2 3.57Å; Y390-I408 HydrophobicContact CE2-CB 4.08Å; Y390-I408 HydrophobicContact CE2-CD1 3.56Å; Y390-I408 HydrophobicContact CE2-CG1 3.91Å; Y390-I408 HydrophobicContact CG-CB 4.43Å; Y390-I408 PolarHBondContact N-O 2.81Å; Y390-I408 PolarHBondContact O-N 2.99Å; L392-I408 HydrophobicContact CB-CD1 3.59Å; L392-I408 HydrophobicContact CD2-CD1 4.44Å; I408-P411 HydrophobicContact CG2-CG 4.22Å
409	V	94.8	Very high	88.5	Confident	14 Å²	14	29 Å²	29	9%	0.085	15%	0.151	C	C	.	.	S	Bend	trans	-103	-20.7	172.4	-62.9	0	0	0	0	111.8	G69 N71 F228 L230 P389 K407	G69-V409 WeakPolarHBondContact O-CG2 3.25Å; N71-V409 VanDerWaalsContact OD1-CG2 3.28Å; N71-V409 WeakPolarHBondContact OD1-CG2 3.36Å; N71-V409 PolarHBondContact OD1-N 3.09Å; F228-V409 WeakPolarHBondContact CE1-O 3.26Å; L230-V409 WeakPolarHBondContact CD2-O 3.16Å; P389-V409 HydrophobicContact CB-CG1 4.36Å; P389-V409 HydrophobicContact CG-CB 4.48Å; K407-V409 HydrophobicContact CD-CG1 4.28Å; K407-V409 HydrophobicContact CG-CG1 4.16Å
410	N	93.6	Very high	88.8	Confident	35 Å²	35	30.5 Å²	30.5	19%	0.187	16%	0.159	C	C	.	.			trans	-153.2	112.2	177.1	-176.3	-7.2	0	0	0	110.5	N71 L230 I412 G413	N71-N410 PolarHBondContact ND2-O 2.94Å; N71-N410 PolarHBondContact OD1-N 2.66Å; N71-N410 VanDerWaalsContact OD1-N 3.16Å; L230-N410 HydrophobicContact CD2-CB 3.93Å; N410-I412 VanDerWaalsContact C-N 3.25Å; N410-I412 PolarHBondContact O-N 2.95Å; N410-I412 WeakPolarHBondContact OD1-CG1 3.38Å; N410-I412 PolarHBondContact OD1-N 2.91Å; N410-I412 VanDerWaalsContact OD1-N 3.14Å; N410-G413 PolarHBondContact O-N 3.47Å; N410-G413 VanDerWaalsContact O-N 3.11Å
411	P	91.9	Very high	88.9	Confident	8 Å²	8	29.2 Å²	29.2	5%	0.052	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-22	-178	-23.2	34	0	0	0	115.4	F228 V238 P309 L311 I408	F228-P411 HydrophobicContact CD1-CG 4.26Å; F228-P411 HydrophobicContact CD2-CG 3.55Å; F228-P411 HydrophobicContact CE1-CG 4.3Å; F228-P411 HydrophobicContact CE2-CG 3.58Å; F228-P411 HydrophobicContact CG-CG 3.9Å; F228-P411 HydrophobicContact CZ-CG 3.95Å; V238-P411 HydrophobicContact CG1-CB 4.12Å; V238-P411 HydrophobicContact CG1-CG 4.14Å; P309-P411 HydrophobicContact CB-CB 4.07Å; P309-P411 HydrophobicContact CB-CG 3.96Å; P309-P411 HydrophobicContact CG-CB 4.38Å; P309-P411 HydrophobicContact CG-CG 3.94Å; L311-P411 HydrophobicContact CD1-CB 4.27Å; I408-P411 HydrophobicContact CG2-CG 4.22Å
412	I	88.1	Confident	88.9	Confident	104 Å²	104	31.4 Å²	31.4	53%	0.533	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-10.4	176.3	59.2	161.4	0	0	0	113	V236 V238 N410	V236-I412 HydrophobicContact CB-CD1 4.07Å; V236-I412 HydrophobicContact CG1-CD1 4.12Å; V236-I412 HydrophobicContact CG2-CD1 4.39Å; V236-I412 HydrophobicContact CG2-CG1 4.33Å; V238-I412 HydrophobicContact CG1-CG2 4.09Å; N410-I412 VanDerWaalsContact C-N 3.25Å; N410-I412 PolarHBondContact O-N 2.95Å; N410-I412 WeakPolarHBondContact OD1-CG1 3.38Å; N410-I412 PolarHBondContact OD1-N 2.91Å; N410-I412 VanDerWaalsContact OD1-N 3.14Å
413	G	72.1	Confident	88.6	Confident	21 Å²	21	33.8 Å²	33.8	22%	0.216	17%	0.17	C	C	.	.			trans	-79.1	128.8	179.6	0	0	0	0	0	111.6	N71 N410	N71-G413 PolarHBondContact ND2-O 2.93Å; N410-G413 PolarHBondContact O-N 3.47Å; N410-G413 VanDerWaalsContact O-N 3.11Å
414	K	53.1	Low	88.2	Confident	218 Å²	218	36.8 Å²	36.8	95%	0.948	19%	0.186	S	C	*	.			trans	-71.8	0	171	-72.4	-174.3	179	178.7	0	111.8

Retrieved 414 of 414 residues in 129.3 ms (Link to these results)

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