A0A3Q0KTH3_SCHMA Loading...

RING-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KTH3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 321 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	43.3	Very low	36.1	Very low	215 Å²	215	133.5 Å²	133.5	100%	1.059	64%	0.639	S	S	*	*				0	-42.7	0	-121.5	165.2	76.9	0	0	114.3	K5	M1-K5 PolarHBondContact O-N 3.33Å
2	K	36.5	Very low	35.9	Very low	176 Å²	176	131.3 Å²	131.3	77%	0.765	63%	0.633	S	S	*	*	H	α-helix	trans	-63.6	-44.6	176.5	-93.9	-177.8	172.4	-178.1	0	114.7	V4 K5 E6	K2-V4 VanDerWaalsContact C-N 3.31Å; K2-V4 PolarHBondContact O-N 3.38Å; K2-K5 WeakPolarHBondContact O-CB 3.47Å; K2-K5 PolarHBondContact O-N 3.03Å; K2-K5 VanDerWaalsContact O-N 3.07Å; K2-E6 PolarHBondContact O-N 3.07Å
3	V	37.9	Very low	35.9	Very low	97 Å²	97	132.9 Å²	132.9	59%	0.588	63%	0.63	S	S	*	*	H	α-helix	trans	-65.9	-30.7	-178.5	-178.2	0	0	0	0	113	K7	V3-K7 WeakPolarHBondContact O-CB 3.43Å; V3-K7 PolarHBondContact O-N 3.02Å
4	V	34.1	Very low	35.4	Very low	107 Å²	107	126.6 Å²	126.6	65%	0.648	62%	0.618	S	S	*	*	H	α-helix	trans	-72.8	-33.3	174.9	179.4	0	0	0	0	110.8	K2 L8	K2-V4 VanDerWaalsContact C-N 3.31Å; K2-V4 PolarHBondContact O-N 3.38Å; V4-L8 VanDerWaalsContact O-CB 3.28Å; V4-L8 WeakPolarHBondContact O-CB 3.11Å; V4-L8 PolarHBondContact O-N 2.96Å
5	K	39	Very low	35.1	Very low	152 Å²	152	129.2 Å²	129.2	66%	0.661	63%	0.628	S	S	*	*	H	α-helix	trans	-70.3	-41.3	175.2	-129	-178.6	-178.2	-174.7	0	111.7	M1 K2 L8 I9	M1-K5 PolarHBondContact O-N 3.33Å; K2-K5 WeakPolarHBondContact O-CB 3.47Å; K2-K5 PolarHBondContact O-N 3.03Å; K2-K5 VanDerWaalsContact O-N 3.07Å; K5-L8 PolarHBondContact O-N 2.95Å; K5-I9 VanDerWaalsContact O-CB 3.28Å; K5-I9 WeakPolarHBondContact O-CB 3.22Å; K5-I9 VanDerWaalsContact O-CG1 3.22Å; K5-I9 WeakPolarHBondContact O-CG1 3.46Å; K5-I9 PolarHBondContact O-N 2.86Å
6	E	37.6	Very low	34.8	Very low	119 Å²	119	129.4 Å²	129.4	56%	0.556	63%	0.633	S	S	*	*	H	α-helix	trans	-67	-40	175.1	-79.7	171.4	167.2	0	0	112.5	K2 I9 L10	K2-E6 PolarHBondContact O-N 3.07Å; E6-I9 PolarHBondContact O-N 3.44Å; E6-L10 WeakPolarHBondContact O-CB 2.97Å; E6-L10 WeakPolarHBondContact O-CG 3.5Å; E6-L10 PolarHBondContact O-N 2.85Å
7	K	32.1	Very low	34.6	Very low	151 Å²	151	126.6 Å²	126.6	66%	0.657	64%	0.635	S	S	*	*	H	α-helix	trans	-68.8	-34.8	174	-79.2	-171.5	173.9	-173.5	0	113.1	V3 W11	V3-K7 WeakPolarHBondContact O-CB 3.43Å; V3-K7 PolarHBondContact O-N 3.02Å; K7-W11 WeakPolarHBondContact O-CB 3.39Å; K7-W11 PolarHBondContact O-N 3.42Å
8	L	33.2	Very low	34.3	Very low	95 Å²	95	128.9 Å²	128.9	50%	0.497	65%	0.65	S	S	.	*	H	α-helix	trans	-69.5	-37.7	174.8	-170.6	73.8	0	0	0	111.7	V4 K5 W11 L12	V4-L8 VanDerWaalsContact O-CB 3.28Å; V4-L8 WeakPolarHBondContact O-CB 3.11Å; V4-L8 PolarHBondContact O-N 2.96Å; K5-L8 PolarHBondContact O-N 2.95Å; L8-W11 HydrophobicContact CD1-CE3 4.21Å; L8-W11 PolarHBondContact O-N 2.82Å; L8-L12 HydrophobicContact CG-CD1 4.41Å; L8-L12 WeakPolarHBondContact O-CB 3.28Å; L8-L12 WeakPolarHBondContact O-CG 3.28Å; L8-L12 PolarHBondContact O-N 3.1Å
9	I	35.6	Very low	34	Very low	83 Å²	83	126 Å²	126	43%	0.426	64%	0.643	S	S	.	*	H	α-helix	trans	-63.8	-52.7	172.7	-78.5	171.5	0	0	0	109.4	K5 E6 W11 L12 Y13	K5-I9 VanDerWaalsContact O-CB 3.28Å; K5-I9 WeakPolarHBondContact O-CB 3.22Å; K5-I9 VanDerWaalsContact O-CG1 3.22Å; K5-I9 WeakPolarHBondContact O-CG1 3.46Å; K5-I9 PolarHBondContact O-N 2.86Å; E6-I9 PolarHBondContact O-N 3.44Å; I9-W11 VanDerWaalsContact C-N 3.27Å; I9-W11 PolarHBondContact O-N 3.31Å; I9-L12 CarbonylContact O-C 3.55Å; I9-L12 WeakPolarHBondContact O-CB 3.36Å; I9-L12 PolarHBondContact O-N 3.39Å; I9-L12 VanDerWaalsContact O-N 3.1Å; I9-Y13 HydrophobicContact CB-CD2 4.34Å; I9-Y13 HydrophobicContact CB-CE2 4.48Å; I9-Y13 HydrophobicContact CG2-CD2 3.52Å; I9-Y13 HydrophobicContact CG2-CE2 3.67Å; I9-Y13 WeakPolarHBondContact O-CB 3.35Å; I9-Y13 WeakPolarHBondContact O-CD2 3.42Å; I9-Y13 PolarHBondContact O-N 3.28Å
10	L	35.2	Very low	33.7	Very low	98 Å²	98	123.3 Å²	123.3	51%	0.513	65%	0.648	S	S	.	*	H	α-helix	trans	-63.1	-30.1	176.8	-77.4	159.8	0	0	0	113.5	E6 Y13 G14	E6-L10 WeakPolarHBondContact O-CB 2.97Å; E6-L10 WeakPolarHBondContact O-CG 3.5Å; E6-L10 PolarHBondContact O-N 2.85Å; L10-Y13 CarbonylContact O-C 3.55Å; L10-Y13 PolarHBondContact O-N 2.9Å; L10-G14 PolarHBondContact O-N 3.46Å
11	W	32.7	Very low	33.4	Very low	175 Å²	175	123.3 Å²	123.3	66%	0.663	65%	0.646	S	S	*	*	H	α-helix	trans	-70.3	-39.6	172.5	-176.7	81.3	0	0	0	112.2	K7 L8 I9 Y13	K7-W11 WeakPolarHBondContact O-CB 3.39Å; K7-W11 PolarHBondContact O-N 3.42Å; L8-W11 HydrophobicContact CD1-CE3 4.21Å; L8-W11 PolarHBondContact O-N 2.82Å; I9-W11 VanDerWaalsContact C-N 3.27Å; I9-W11 PolarHBondContact O-N 3.31Å; W11-Y13 VanDerWaalsContact C-N 3.31Å
12	L	33.6	Very low	32.8	Very low	107 Å²	107	116.1 Å²	116.1	56%	0.56	62%	0.617	S	S	*	*	H	α-helix	trans	-68.6	-28.5	170.1	-76	163.3	0	0	0	112.7	L8 I9	L8-L12 HydrophobicContact CG-CD1 4.41Å; L8-L12 WeakPolarHBondContact O-CB 3.28Å; L8-L12 WeakPolarHBondContact O-CG 3.28Å; L8-L12 PolarHBondContact O-N 3.1Å; I9-L12 CarbonylContact O-C 3.55Å; I9-L12 WeakPolarHBondContact O-CB 3.36Å; I9-L12 PolarHBondContact O-N 3.39Å; I9-L12 VanDerWaalsContact O-N 3.1Å
13	Y	35.7	Very low	32.5	Very low	153 Å²	153	110.5 Å²	110.5	60%	0.6	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	17.2	-177.5	-72.4	-65.2	0	0	0	114.8	I9 L10 W11	I9-Y13 HydrophobicContact CB-CD2 4.34Å; I9-Y13 HydrophobicContact CB-CE2 4.48Å; I9-Y13 HydrophobicContact CG2-CD2 3.52Å; I9-Y13 HydrophobicContact CG2-CE2 3.67Å; I9-Y13 WeakPolarHBondContact O-CB 3.35Å; I9-Y13 WeakPolarHBondContact O-CD2 3.42Å; I9-Y13 PolarHBondContact O-N 3.28Å; L10-Y13 CarbonylContact O-C 3.55Å; L10-Y13 PolarHBondContact O-N 2.9Å; W11-Y13 VanDerWaalsContact C-N 3.31Å
14	G	29.6	Very low	32	Very low	44 Å²	44	110.9 Å²	110.9	45%	0.454	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	86.4	53.5	154.2	0	0	0	0	0	116.1	L10	L10-G14 PolarHBondContact O-N 3.46Å
15	Q	30.6	Very low	31.8	Very low	166 Å²	166	109.1 Å²	109.1	78%	0.776	59%	0.585	S	S	*	*			trans	-105.6	15.3	167	-110.1	-168.8	1.5	0	0	115.8
16	N	29.7	Very low	31.3	Very low	133 Å²	133	112.3 Å²	112.3	71%	0.711	59%	0.593	S	S	*	*	S	Bend	trans	-119.2	129.2	161.5	-84.4	-19.3	0	0	0	111
17	A	32.6	Very low	30.8	Very low	81 Å²	81	108.5 Å²	108.5	67%	0.669	59%	0.586	S	S	*	*			trans	-56.3	166.2	175.7	0	0	0	0	0	113
18	D	28.5	Very low	30.5	Very low	168 Å²	168	110.1 Å²	110.1	90%	0.898	59%	0.589	S	S	*	*	S	Bend	trans	82.4	23.7	159.7	-51.7	-25.1	0	0	0	119.6
19	S	29.1	Very low	30.3	Very low	74 Å²	74	112 Å²	112	52%	0.517	60%	0.597	S	S	.	*			trans	-135.3	131.1	160.1	67	0	0	0	0	112.4	M21 S22	S19-M21 PolarHBondContact O-N 2.85Å; S19-S22 PolarHBondContact O-N 3.24Å
20	G	28.4	Very low	30.2	Very low	72 Å²	72	114.2 Å²	114.2	74%	0.742	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	8.5	177.9	0	0	0	0	0	115.4
21	M	27.3	Very low	30.2	Very low	124 Å²	124	111.4 Å²	111.4	61%	0.611	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-13.3	-179.9	-70.4	-65.1	-65.9	0	0	113.9	S19 V23 L24	S19-M21 PolarHBondContact O-N 2.85Å; M21-V23 PolarHBondContact O-N 2.91Å; M21-L24 HydrophobicContact CE-CD1 3.95Å; M21-L24 PolarHBondContact O-N 2.81Å; M21-L24 HydrophobicContact SD-CD1 3.77Å
22	S	30.1	Very low	30.1	Very low	64 Å²	64	111.1 Å²	111.1	45%	0.448	61%	0.608	S	S	.	*	H	α-helix	trans	-67.9	-16.7	175.8	66.3	0	0	0	0	113.8	S19	S19-S22 PolarHBondContact O-N 3.24Å
23	V	31	Very low	30.3	Very low	58 Å²	58	108.7 Å²	108.7	35%	0.352	60%	0.597	S	S	.	*	H	α-helix	trans	-77.2	-31.9	-179.8	177.2	0	0	0	0	111.8	M21 N284	M21-V23 PolarHBondContact O-N 2.91Å; V23-N284 HydrophobicContact CG1-CB 3.76Å; V23-N284 WeakPolarHBondContact CG1-ND2 3.08Å; V23-N284 WeakPolarHBondContact CG1-OD1 3.14Å
24	L	27.3	Very low	30.3	Very low	104 Å²	104	104.9 Å²	104.9	55%	0.545	59%	0.593	S	S	.	*	H	α-helix	trans	-74.9	-34.5	-179.2	-78.5	162.3	0	0	0	112.4	M21 R26 G27	M21-L24 HydrophobicContact CE-CD1 3.95Å; M21-L24 PolarHBondContact O-N 2.81Å; M21-L24 HydrophobicContact SD-CD1 3.77Å; L24-R26 VanDerWaalsContact C-N 3.3Å; L24-R26 PolarHBondContact O-N 3.13Å; L24-G27 PolarHBondContact O-N 2.67Å
25	T	28.3	Very low	30.9	Very low	71 Å²	71	109 Å²	109	44%	0.436	61%	0.61	S	S	.	*	H	α-helix	trans	-73.6	-21.9	-179.6	-27.3	0	0	0	0	112.8	G27	T25-G27 VanDerWaalsContact C-N 3.31Å
26	R	29.2	Very low	31.5	Very low	219 Å²	219	108.6 Å²	108.6	83%	0.826	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-73.9	-20.1	171.4	-80	-175.8	173	-178.3	-0.7	113.4	L24	L24-R26 VanDerWaalsContact C-N 3.3Å; L24-R26 PolarHBondContact O-N 3.13Å
27	G	27.2	Very low	32.5	Very low	39 Å²	39	113.8 Å²	113.8	40%	0.402	62%	0.615	S	S	.	*	G	3₁₀ helix	trans	-79.3	-15.6	179.4	0	0	0	0	0	114.8	L24 T25	L24-G27 PolarHBondContact O-N 2.67Å; T25-G27 VanDerWaalsContact C-N 3.31Å
28	Y	26	Very low	34.1	Very low	185 Å²	185	112.2 Å²	112.2	73%	0.725	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-123.2	24.1	-174.1	-72.7	-82.1	0	0	0	114.3	I30	Y28-I30 PolarHBondContact O-N 3.48Å
29	M	29.3	Very low	35.9	Very low	133 Å²	133	107 Å²	107	66%	0.655	57%	0.572	S	S	*	*			trans	-75.6	71.5	149.9	-82.5	-169	58	0	0	108.6	S31	M29-S31 PolarHBondContact O-N 2.94Å
30	I	33.6	Very low	37.9	Very low	131 Å²	131	105.2 Å²	105.2	67%	0.672	56%	0.556	S	S	*	*			trans	-54.7	103.1	142.5	-58.3	172.3	0	0	0	102.5	Y28 D32	Y28-I30 PolarHBondContact O-N 3.48Å; I30-D32 PolarHBondContact O-N 3.2Å
31	S	33.6	Very low	40.4	Very low	38 Å²	38	102 Å²	102	27%	0.266	52%	0.523	S	S	.	.			trans	-48.5	143.9	-168.7	62.7	0	0	0	0	110.7	M29 V33	M29-S31 PolarHBondContact O-N 2.94Å; S31-V33 CarbonylContact O-C 3.59Å; S31-V33 PolarHBondContact O-N 3.43Å; S31-V33 VanDerWaalsContact O-O 3.06Å; S31-V33 VanDerWaalsContact OG-CB 3.27Å; S31-V33 WeakPolarHBondContact OG-CB 3.44Å; S31-V33 PolarHBondContact OG-O 2.87Å
32	D	31.7	Very low	43.1	Very low	170 Å²	170	96.3 Å²	96.3	91%	0.909	50%	0.495	S	S	*	.	S	Bend	trans	-56.7	-6.5	167.8	-70.6	-35.7	0	0	0	112.8	I30 S34	I30-D32 PolarHBondContact O-N 3.2Å; D32-S34 PolarHBondContact O-N 3.09Å
33	V	38	Very low	45.6	Very low	55 Å²	55	95.2 Å²	95.2	33%	0.333	49%	0.486	S	S	.	.	S	Bend	trans	-70.7	111.7	167.8	-166.3	0	0	0	0	108.9	S31 T35 W180	S31-V33 CarbonylContact O-C 3.59Å; S31-V33 PolarHBondContact O-N 3.43Å; S31-V33 VanDerWaalsContact O-O 3.06Å; S31-V33 VanDerWaalsContact OG-CB 3.27Å; S31-V33 WeakPolarHBondContact OG-CB 3.44Å; S31-V33 PolarHBondContact OG-O 2.87Å; V33-T35 PolarHBondContact O-N 3.09Å; V33-W180 HydrophobicContact CB-CZ3 4.1Å; V33-W180 HydrophobicContact CG1-CE3 4.27Å; V33-W180 HydrophobicContact CG1-CH2 3.8Å; V33-W180 HydrophobicContact CG1-CZ3 3.31Å; V33-W180 HydrophobicContact CG2-CE3 4.4Å; V33-W180 HydrophobicContact CG2-CZ3 3.66Å
34	S	34.4	Very low	48.2	Very low	73 Å²	73	92.7 Å²	92.7	51%	0.51	47%	0.47	S	S	.	.			trans	-18.1	129.4	165.8	177.9	0	0	0	0	113.6	D32 K36	D32-S34 PolarHBondContact O-N 3.09Å; S34-K36 PolarHBondContact O-N 3.49Å; S34-K36 VanDerWaalsContact OG-CG 3.31Å; S34-K36 WeakPolarHBondContact OG-CG 3.47Å; S34-K36 PolarHBondContact OG-N 2.77Å
35	T	42.5	Very low	50.7	Low	132 Å²	132	91.5 Å²	91.5	81%	0.81	47%	0.467	S	S	*	.			trans	-63	29.4	167	49.8	0	0	0	0	113.2	V33 R37	V33-T35 PolarHBondContact O-N 3.09Å; T35-R37 PolarHBondContact O-N 3.31Å
36	K	44.5	Very low	53.3	Low	156 Å²	156	89.9 Å²	89.9	68%	0.678	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-55.7	125.7	170.5	-98	172	-178.9	-176	0	108.1	S34 L38	S34-K36 PolarHBondContact O-N 3.49Å; S34-K36 VanDerWaalsContact OG-CG 3.31Å; S34-K36 WeakPolarHBondContact OG-CG 3.47Å; S34-K36 PolarHBondContact OG-N 2.77Å; K36-L38 PolarHBondContact O-N 3.06Å; K36-L38 VanDerWaalsContact O-N 3.09Å
37	R	50.7	Low	55.9	Low	242 Å²	242	79.6 Å²	79.6	91%	0.913	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-52.6	116.6	176.7	-173.5	176.3	-178.3	176.8	0.5	108.9	T35 S39	T35-R37 PolarHBondContact O-N 3.31Å; R37-S39 PolarHBondContact O-N 3.29Å
38	L	65.4	Low	58.8	Low	49 Å²	49	81 Å²	81	26%	0.257	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-68.2	127.3	171.7	-68.9	170.7	0	0	0	108.6	K36 E148 I150 T178 L184	K36-L38 PolarHBondContact O-N 3.06Å; K36-L38 VanDerWaalsContact O-N 3.09Å; L38-E148 HydrophobicContact CD2-CB 3.9Å; L38-E148 HydrophobicContact CD2-CG 3.63Å; L38-I150 HydrophobicContact CB-CD1 4.07Å; L38-I150 HydrophobicContact CB-CG1 4.44Å; L38-T178 HydrophobicContact CD1-CG2 4.36Å; L38-L184 HydrophobicContact CD1-CD1 3.51Å
39	S	67.2	Low	61.6	Low	57 Å²	57	73.7 Å²	73.7	40%	0.399	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-88.2	127.5	172.6	48.2	0	0	0	0	109.6	R37 I150	R37-S39 PolarHBondContact O-N 3.29Å; S39-I150 PolarHBondContact O-N 2.77Å; S39-I150 VanDerWaalsContact O-N 3.14Å
40	N	71.4	Confident	64.3	Low	37 Å²	37	69 Å²	69	20%	0.198	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	-95.1	120.9	160	-168	-18.5	0	0	0	108.1	S42 V43 I150 T153 W176	N40-S42 VanDerWaalsContact C-N 3.33Å; N40-S42 PolarHBondContact OD1-N 3.3Å; N40-S42 PolarHBondContact OD1-O 2.79Å; N40-V43 HydrophobicContact CB-CG1 4.41Å; N40-I150 HydrophobicContact CB-CB 4.2Å; N40-I150 HydrophobicContact CB-CD1 3.96Å; N40-I150 HydrophobicContact CB-CG2 4.24Å; N40-T153 PolarHBondContact ND2-OG1 2.78Å; N40-W176 VanDerWaalsContact ND2-CE2 3.29Å; N40-W176 PolarHBondContact ND2-NE1 2.72Å; N40-W176 VanDerWaalsContact ND2-NE1 3.15Å
41	S	79	Confident	66.6	Low	5 Å²	5	68.4 Å²	68.4	4%	0.035	38%	0.379	C	S	.	.			trans	-82.1	-14.9	-175.3	-60.1	0	0	0	0	113	S65 I66	S41-S65 CarbonylContact O-C 3.59Å; S41-S65 VanDerWaalsContact O-CA 3.3Å; S41-S65 WeakPolarHBondContact O-CA 3.31Å; S41-S65 PolarHBondContact O-OG 2.84Å; S41-I66 VanDerWaalsContact O-CG1 3.25Å; S41-I66 WeakPolarHBondContact O-CG1 3.29Å; S41-I66 PolarHBondContact O-N 3.45Å
42	S	84.5	Confident	68.9	Low	5 Å²	5	71 Å²	71	4%	0.035	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	129.5	-173.3	-46.8	0	0	0	0	111.8	N40 S64 S65 V69	N40-S42 VanDerWaalsContact C-N 3.33Å; N40-S42 PolarHBondContact OD1-N 3.3Å; N40-S42 PolarHBondContact OD1-O 2.79Å; S42-S64 WeakPolarHBondContact CA-O 3.27Å; S42-S65 PolarHBondContact OG-OG 3.35Å; S42-V69 WeakPolarHBondContact OG-CG1 3.33Å
43	V	83.6	Confident	71.4	Confident	41 Å²	41	66 Å²	66	25%	0.248	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	145.4	-179.9	-67.9	0	0	0	0	110.9	N40 T45 V63 S64 Y155	N40-V43 HydrophobicContact CB-CG1 4.41Å; V43-T45 HydrophobicContact CG2-CG2 3.84Å; V43-T45 PolarHBondContact O-N 2.99Å; V43-V63 WeakPolarHBondContact O-CA 3.02Å; V43-S64 PolarHBondContact N-O 3.48Å; V43-S64 PolarHBondContact O-N 3.29Å; V43-Y155 WeakPolarHBondContact CA-OH 3.44Å
44	I	84.9	Confident	73.6	Confident	5 Å²	5	67.1 Å²	67.1	3%	0.026	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	118.1	162.2	-62	178.6	0	0	0	107.3	S46 F47 V61 T62 V63 I136 L138 Y155 I171	I44-S46 WeakPolarHBondContact CG2-O 3.38Å; I44-F47 HydrophobicContact CG2-CB 4.33Å; I44-V61 HydrophobicContact CD1-CG1 4.38Å; I44-V61 HydrophobicContact CG2-CB 4.18Å; I44-V61 HydrophobicContact CG2-CG1 4.41Å; I44-T62 CarbonylContact C-O 3.52Å; I44-T62 WeakPolarHBondContact CA-O 3.23Å; I44-V63 HydrophobicContact CG1-CG2 4.36Å; I44-I136 HydrophobicContact CD1-CB 4.45Å; I44-I136 HydrophobicContact CD1-CD1 4.12Å; I44-I136 HydrophobicContact CD1-CG2 4.13Å; I44-L138 HydrophobicContact CG1-CD1 4.46Å; I44-Y155 HydrophobicContact CB-CD1 4.4Å; I44-Y155 HydrophobicContact CB-CE1 3.84Å; I44-Y155 HydrophobicContact CB-CE2 4.09Å; I44-Y155 HydrophobicContact CD1-CD1 3.98Å; I44-Y155 HydrophobicContact CD1-CD2 3.51Å; I44-Y155 HydrophobicContact CD1-CE1 4.21Å; I44-Y155 HydrophobicContact CD1-CE2 3.75Å; I44-Y155 HydrophobicContact CD1-CG 3.65Å; I44-Y155 HydrophobicContact CG1-CD1 4.47Å; I44-Y155 HydrophobicContact CG1-CD2 3.95Å; I44-Y155 HydrophobicContact CG1-CE1 4.2Å; I44-Y155 HydrophobicContact CG1-CE2 3.62Å; I44-Y155 HydrophobicContact CG1-CG 4.38Å; I44-Y155 PolarHBondContact N-OH 2.82Å; I44-I171 HydrophobicContact CG2-CD1 4.26Å
45	T	80.5	Confident	75.9	Confident	78 Å²	78	65 Å²	65	48%	0.479	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-17.4	179.9	54	0	0	0	0	113.2	V43 T62	V43-T45 HydrophobicContact CG2-CG2 3.84Å; V43-T45 PolarHBondContact O-N 2.99Å; T45-T62 PolarHBondContact N-O 3.21Å; T45-T62 PolarHBondContact OG1-O 3.3Å
46	S	81.6	Confident	77.7	Confident	37 Å²	37	58.9 Å²	58.9	26%	0.259	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	142.4	171.6	-168	0	0	0	0	109.6	I44 V61 T62	I44-S46 WeakPolarHBondContact CG2-O 3.38Å; S46-V61 CarbonylContact O-C 3.57Å; S46-V61 VanDerWaalsContact O-CA 3.31Å; S46-V61 WeakPolarHBondContact O-CA 3.5Å; S46-T62 WeakPolarHBondContact CB-OG1 3.13Å; S46-T62 PolarHBondContact N-O 2.72Å; S46-T62 PolarHBondContact O-N 2.94Å
47	F	84.1	Confident	79.8	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.018	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	120.2	176	171.9	-78.1	0	0	0	107.3	I44 P49 I59 R60 V61 I157 T169 I171 A192	I44-F47 HydrophobicContact CG2-CB 4.33Å; F47-P49 HydrophobicContact CE1-CB 4.25Å; F47-P49 HydrophobicContact CE1-CG 4.04Å; F47-I59 HydrophobicContact CD2-CG2 3.71Å; F47-I59 HydrophobicContact CE1-CG2 4.3Å; F47-I59 HydrophobicContact CE2-CD1 4.2Å; F47-I59 HydrophobicContact CE2-CG2 3.27Å; F47-I59 HydrophobicContact CG-CG2 4.39Å; F47-I59 HydrophobicContact CZ-CD1 3.96Å; F47-I59 HydrophobicContact CZ-CG1 4.35Å; F47-I59 HydrophobicContact CZ-CG2 3.59Å; F47-R60 CarbonylContact C-O 3.51Å; F47-R60 WeakPolarHBondContact CA-O 3.15Å; F47-V61 HydrophobicContact CD2-CG1 3.73Å; F47-V61 HydrophobicContact CE2-CG1 4.42Å; F47-I157 HydrophobicContact CD2-CD1 4.13Å; F47-I157 HydrophobicContact CE2-CD1 3.55Å; F47-I157 HydrophobicContact CE2-CG1 4.09Å; F47-I157 HydrophobicContact CE2-CG2 3.85Å; F47-I157 HydrophobicContact CZ-CD1 4.27Å; F47-I157 HydrophobicContact CZ-CG2 3.63Å; F47-T169 HydrophobicContact CZ-CG2 4.21Å; F47-I171 HydrophobicContact CB-CD1 3.67Å; F47-I171 HydrophobicContact CB-CG1 4.18Å; F47-I171 HydrophobicContact CD1-CG1 4.32Å; F47-I171 HydrophobicContact CD2-CD1 3.92Å; F47-I171 HydrophobicContact CD2-CG1 3.66Å; F47-I171 HydrophobicContact CE2-CG1 4.07Å; F47-I171 HydrophobicContact CG-CD1 3.87Å; F47-I171 HydrophobicContact CG-CG1 3.81Å; F47-A192 HydrophobicContact CB-CB 3.68Å; F47-A192 HydrophobicContact CD1-CB 4.11Å; F47-A192 HydrophobicContact CG-CB 4.32Å; F47-A192 VanDerWaalsContact O-O 3.14Å
48	Q	87.2	Confident	81.8	Confident	69 Å²	69	43.2 Å²	43.2	32%	0.322	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	94	-171.4	-71.2	-179.2	-21	0	0	108.7	R60 E194	Q48-R60 HydrophobicContact CB-CB 4.18Å; Q48-R60 PolarHBondContact N-O 2.78Å; Q48-R60 PolarHBondContact O-N 2.98Å; Q48-E194 HydrophobicContact CG-CG 4.3Å
49	P	85.9	Confident	83	Confident	31 Å²	31	41 Å²	41	20%	0.201	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	144.9	171.5	30.6	-32.3	0	0	0	110	F47 S51 G56 T169	F47-P49 HydrophobicContact CE1-CB 4.25Å; F47-P49 HydrophobicContact CE1-CG 4.04Å; P49-S51 PolarHBondContact O-N 3.43Å; P49-G56 WeakPolarHBondContact CA-O 3.16Å; P49-T169 HydrophobicContact CB-CG2 3.92Å; P49-T169 WeakPolarHBondContact CG-O 3.42Å
50	S	86	Confident	84.2	Confident	33 Å²	33	45.9 Å²	45.9	23%	0.231	26%	0.263	C	S	.	.			trans	-63.6	134.1	176.4	-172.3	0	0	0	0	112.1	S52 G56 D57 P58	S50-S52 PolarHBondContact O-N 3.09Å; S50-S52 WeakPolarHBondContact OG-CB 3.19Å; S50-S52 PolarHBondContact OG-N 2.72Å; S50-S52 PolarHBondContact OG-OG 3.22Å; S50-G56 PolarHBondContact N-O 3.02Å; S50-G56 VanDerWaalsContact O-CA 3.29Å; S50-G56 WeakPolarHBondContact O-CA 3.17Å; S50-D57 VanDerWaalsContact CB-C 3.47Å; S50-D57 WeakPolarHBondContact CB-O 3.47Å; S50-P58 WeakPolarHBondContact CB-O 3.41Å; S50-P58 PolarHBondContact N-O 3.16Å; S50-P58 VanDerWaalsContact N-O 3.14Å
51	S	82.5	Confident	85.2	Confident	119 Å²	119	44.1 Å²	44.1	83%	0.832	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-4.5	170.1	55	0	0	0	0	113.8	P49 N53	P49-S51 PolarHBondContact O-N 3.43Å; S51-N53 VanDerWaalsContact C-N 3.33Å; S51-N53 PolarHBondContact O-N 3.03Å
52	S	81.3	Confident	85.6	Confident	93 Å²	93	45 Å²	45	65%	0.65	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-19.6	-174.6	68.7	0	0	0	0	114.3	S50	S50-S52 PolarHBondContact O-N 3.09Å; S50-S52 WeakPolarHBondContact OG-CB 3.19Å; S50-S52 PolarHBondContact OG-N 2.72Å; S50-S52 PolarHBondContact OG-OG 3.22Å
53	N	83.6	Confident	85.8	Confident	65 Å²	65	44.8 Å²	44.8	35%	0.348	26%	0.257	S	S	.	.	S	Bend	trans	-148.6	160.9	177.8	58.7	71.8	0	0	0	111.2	S51 C55 G56 D57	S51-N53 VanDerWaalsContact C-N 3.33Å; S51-N53 PolarHBondContact O-N 3.03Å; N53-C55 PolarHBondContact O-N 3.07Å; N53-C55 PolarHBondContact OD1-N 3.3Å; N53-G56 PolarHBondContact O-N 3.26Å; N53-G56 VanDerWaalsContact O-N 3.13Å; N53-G56 PolarHBondContact OD1-N 3.33Å; N53-D57 PolarHBondContact ND2-O 3.17Å; N53-D57 PolarHBondContact OD1-N 3.17Å
54	M	83.8	Confident	85.7	Confident	78 Å²	78	44.8 Å²	44.8	38%	0.384	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-35.7	-179	-177.9	178.4	62.2	0	0	113	G56 K160 I161 E163	M54-G56 PolarHBondContact O-N 2.63Å; M54-K160 HydrophobicContact CG-CB 4.38Å; M54-K160 HydrophobicContact CG-CD 3.94Å; M54-K160 HydrophobicContact CG-CG 3.74Å; M54-K160 HydrophobicContact SD-CG 4.25Å; M54-I161 WeakPolarHBondContact CE-O 3.4Å; M54-E163 HydrophobicContact SD-CG 3.94Å; M54-E163 PolarHBondContact SD-N 2.95Å
55	C	83.6	Confident	85.8	Confident	29 Å²	29	44.8 Å²	44.8	20%	0.196	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-13.1	-178	-62	0	0	0	0	113.5	N53 V159 K160 T169	N53-C55 PolarHBondContact O-N 3.07Å; N53-C55 PolarHBondContact OD1-N 3.3Å; C55-V159 HydrophobicContact CB-CG1 4.03Å; C55-V159 WeakPolarHBondContact O-CG1 3.48Å; C55-K160 VanDerWaalsContact CA-O 3.29Å; C55-K160 WeakPolarHBondContact CA-O 3.26Å; C55-T169 VanDerWaalsContact C-OG1 3.27Å; C55-T169 WeakPolarHBondContact O-CG2 3.21Å; C55-T169 PolarHBondContact O-OG1 3.01Å
56	G	80.7	Confident	85.9	Confident	3 Å²	3	46.7 Å²	46.7	3%	0.031	27%	0.266	C	S	.	.			trans	76.5	21.7	-175.6	0	0	0	0	0	114.3	P49 S50 N53 M54 P58 I59	P49-G56 WeakPolarHBondContact CA-O 3.16Å; S50-G56 PolarHBondContact N-O 3.02Å; S50-G56 VanDerWaalsContact O-CA 3.29Å; S50-G56 WeakPolarHBondContact O-CA 3.17Å; N53-G56 PolarHBondContact O-N 3.26Å; N53-G56 VanDerWaalsContact O-N 3.13Å; N53-G56 PolarHBondContact OD1-N 3.33Å; M54-G56 PolarHBondContact O-N 2.63Å; G56-P58 CarbonylContact O-C 3.59Å; G56-I59 VanDerWaalsContact O-CG1 3.31Å; G56-I59 WeakPolarHBondContact O-CG1 3.39Å; G56-I59 PolarHBondContact O-N 2.79Å
57	D	88.2	Confident	86.2	Confident	29 Å²	29	48.2 Å²	48.2	16%	0.155	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-92	130	-173.2	-163.5	-23.7	0	0	0	112.2	S50 N53 H117 V118 N119	S50-D57 VanDerWaalsContact CB-C 3.47Å; S50-D57 WeakPolarHBondContact CB-O 3.47Å; N53-D57 PolarHBondContact ND2-O 3.17Å; N53-D57 PolarHBondContact OD1-N 3.17Å; D57-H117 WeakPolarHBondContact OD1-CA 3.14Å; D57-H117 IonicContact OD1-CE1 2.7Å; D57-H117 IonicContact OD1-CG 3.42Å; D57-H117 IonicContact OD1-ND1 2.67Å; D57-H117 PolarHBondContact OD1-ND1 2.8Å; D57-V118 HydrophobicContact CB-CB 4.3Å; D57-V118 HydrophobicContact CB-CG2 3.81Å; D57-V118 VanDerWaalsContact CG-N 3.34Å; D57-V118 PolarHBondContact OD1-N 2.8Å; D57-V118 PolarHBondContact OD2-N 3.15Å; D57-N119 PolarHBondContact OD2-N 2.78Å
58	P	92.3	Very high	86.5	Confident	41 Å²	41	50.3 Å²	50.3	27%	0.266	29%	0.286	S	S	.	.	S	Bend	cis	-74.8	153.1	-6.3	30.8	-34.3	0	0	0	112.6	S50 G56 S115	S50-P58 WeakPolarHBondContact CB-O 3.41Å; S50-P58 PolarHBondContact N-O 3.16Å; S50-P58 VanDerWaalsContact N-O 3.14Å; G56-P58 CarbonylContact O-C 3.59Å; P58-S115 WeakPolarHBondContact CB-OG 3.19Å
59	I	91.5	Very high	86.8	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	125.4	168.1	-60.7	172.2	0	0	0	107.7	F47 G56 V61 I116 V118 I157 T169	F47-I59 HydrophobicContact CD2-CG2 3.71Å; F47-I59 HydrophobicContact CE1-CG2 4.3Å; F47-I59 HydrophobicContact CE2-CD1 4.2Å; F47-I59 HydrophobicContact CE2-CG2 3.27Å; F47-I59 HydrophobicContact CG-CG2 4.39Å; F47-I59 HydrophobicContact CZ-CD1 3.96Å; F47-I59 HydrophobicContact CZ-CG1 4.35Å; F47-I59 HydrophobicContact CZ-CG2 3.59Å; G56-I59 VanDerWaalsContact O-CG1 3.31Å; G56-I59 WeakPolarHBondContact O-CG1 3.39Å; G56-I59 PolarHBondContact O-N 2.79Å; I59-V61 HydrophobicContact CG2-CG1 3.94Å; I59-I116 PolarHBondContact N-O 3.05Å; I59-I116 PolarHBondContact O-N 2.85Å; I59-V118 HydrophobicContact CD1-CG2 3.56Å; I59-V118 HydrophobicContact CG1-CG2 3.7Å; I59-I157 HydrophobicContact CD1-CG2 4.03Å; I59-T169 HydrophobicContact CD1-CG2 3.91Å; I59-T169 HydrophobicContact CG1-CG2 4.32Å
60	R	92.8	Very high	87.3	Confident	160 Å²	160	48.6 Å²	48.6	60%	0.604	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	133.4	168.2	-72.7	-177.4	167.4	-168.3	-3.3	110.1	F47 Q48 I114	F47-R60 CarbonylContact C-O 3.51Å; F47-R60 WeakPolarHBondContact CA-O 3.15Å; Q48-R60 HydrophobicContact CB-CB 4.18Å; Q48-R60 PolarHBondContact N-O 2.78Å; Q48-R60 PolarHBondContact O-N 2.98Å; R60-I114 WeakPolarHBondContact CA-O 3.19Å
61	V	90.9	Very high	87.8	Confident	1 Å²	1	47 Å²	47	1%	0.006	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.5	174.1	-60.6	0	0	0	0	110.2	I44 S46 F47 I59 V63 L71 D113 I114 I116 I136	I44-V61 HydrophobicContact CD1-CG1 4.38Å; I44-V61 HydrophobicContact CG2-CB 4.18Å; I44-V61 HydrophobicContact CG2-CG1 4.41Å; S46-V61 CarbonylContact O-C 3.57Å; S46-V61 VanDerWaalsContact O-CA 3.31Å; S46-V61 WeakPolarHBondContact O-CA 3.5Å; F47-V61 HydrophobicContact CD2-CG1 3.73Å; F47-V61 HydrophobicContact CE2-CG1 4.42Å; I59-V61 HydrophobicContact CG2-CG1 3.94Å; V61-V63 HydrophobicContact CG2-CG2 4.36Å; V61-L71 HydrophobicContact CG2-CD1 4.28Å; V61-D113 WeakPolarHBondContact O-CA 3.18Å; V61-I114 HydrophobicContact CG2-CB 3.98Å; V61-I114 PolarHBondContact N-O 3Å; V61-I114 PolarHBondContact O-N 2.79Å; V61-I116 HydrophobicContact CG1-CD1 4.39Å; V61-I116 HydrophobicContact CG2-CD1 3.75Å; V61-I136 HydrophobicContact CG1-CD1 4.15Å
62	T	87.2	Confident	88.5	Confident	23 Å²	23	41.4 Å²	41.4	14%	0.141	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.7	169	-55.5	0	0	0	0	108	I44 T45 S46 I111 Q112 D113	I44-T62 CarbonylContact C-O 3.52Å; I44-T62 WeakPolarHBondContact CA-O 3.23Å; T45-T62 PolarHBondContact N-O 3.21Å; T45-T62 PolarHBondContact OG1-O 3.3Å; S46-T62 WeakPolarHBondContact CB-OG1 3.13Å; S46-T62 PolarHBondContact N-O 2.72Å; S46-T62 PolarHBondContact O-N 2.94Å; T62-I111 HydrophobicContact CG2-CG2 3.36Å; T62-Q112 CarbonylContact C-O 3.52Å; T62-Q112 WeakPolarHBondContact CA-O 3.36Å; T62-D113 VanDerWaalsContact CB-OD1 3.27Å; T62-D113 WeakPolarHBondContact CB-OD1 3.47Å; T62-D113 VanDerWaalsContact CG2-OD1 3.28Å; T62-D113 WeakPolarHBondContact CG2-OD1 3.25Å; T62-D113 PolarHBondContact OG1-OD1 2.94Å
63	V	89	Confident	89.3	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.1	177.2	-173.3	0	0	0	0	108.9	V43 I44 V61 L71 V107 I111 Q112 I114 L138	V43-V63 WeakPolarHBondContact O-CA 3.02Å; I44-V63 HydrophobicContact CG1-CG2 4.36Å; V61-V63 HydrophobicContact CG2-CG2 4.36Å; V63-L71 HydrophobicContact CG2-CD1 3.74Å; V63-V107 HydrophobicContact CB-CG1 4.26Å; V63-V107 HydrophobicContact CG1-CG1 3.97Å; V63-I111 CarbonylContact O-C 3.53Å; V63-I111 WeakPolarHBondContact O-CA 3.5Å; V63-Q112 PolarHBondContact N-O 2.89Å; V63-Q112 PolarHBondContact O-N 3.37Å; V63-I114 HydrophobicContact CG2-CD1 4.14Å; V63-L138 HydrophobicContact CG1-CD1 4.11Å; V63-L138 HydrophobicContact CG1-CD2 4.13Å; V63-L138 HydrophobicContact CG2-CD2 4.48Å
64	S	82.8	Confident	89.9	Confident	42 Å²	42	34 Å²	34	29%	0.294	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126	168.1	-176.1	0	0	0	0	109.1	S42 V43 G110	S42-S64 WeakPolarHBondContact CA-O 3.27Å; V43-S64 PolarHBondContact N-O 3.48Å; V43-S64 PolarHBondContact O-N 3.29Å; S64-G110 WeakPolarHBondContact CA-O 3.32Å
65	S	86.3	Confident	90.4	Very high	5 Å²	5	32.3 Å²	32.3	4%	0.035	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	139.1	-177.8	-165.5	0	0	0	0	112.1	S41 S42 K67 P109 G110	S41-S65 CarbonylContact O-C 3.59Å; S41-S65 VanDerWaalsContact O-CA 3.3Å; S41-S65 WeakPolarHBondContact O-CA 3.31Å; S41-S65 PolarHBondContact O-OG 2.84Å; S42-S65 PolarHBondContact OG-OG 3.35Å; S65-K67 WeakPolarHBondContact CB-O 3.49Å; S65-K67 PolarHBondContact OG-N 3.47Å; S65-K67 PolarHBondContact OG-O 2.96Å; S65-P109 CarbonylContact O-C 3.54Å; S65-P109 WeakPolarHBondContact O-CA 3.41Å; S65-G110 PolarHBondContact N-O 2.91Å; S65-G110 PolarHBondContact O-N 3.29Å
66	I	82.9	Confident	90.7	Very high	117 Å²	117	34.9 Å²	34.9	60%	0.6	18%	0.18	S	C	*	.	S	Bend	trans	-91.6	-16.4	171.8	53.2	160.7	0	0	0	112.8	S41	S41-I66 VanDerWaalsContact O-CG1 3.25Å; S41-I66 WeakPolarHBondContact O-CG1 3.29Å; S41-I66 PolarHBondContact O-N 3.45Å
67	K	87.2	Confident	91.2	Very high	69 Å²	69	35.1 Å²	35.1	30%	0.3	18%	0.18	S	C	.	.	S	Bend	trans	-127.2	165.5	179.6	-64	179.7	-173.1	177.8	0	110.1	S65 V69 T142 E149	S65-K67 WeakPolarHBondContact CB-O 3.49Å; S65-K67 PolarHBondContact OG-N 3.47Å; S65-K67 PolarHBondContact OG-O 2.96Å; K67-V69 PolarHBondContact O-N 2.94Å; K67-T142 HydrophobicContact CD-CG2 4.49Å; K67-E149 IonicContact NZ-OE1 3.99Å; K67-E149 IonicContact NZ-OE2 3.93Å; K67-E149 PolarHBondContact NZ-OE2 3.4Å
68	A	91.4	Very high	91.2	Very high	49 Å²	49	35.4 Å²	35.4	41%	0.405	18%	0.184	S	C	.	.			trans	-70.5	130.3	169.8	0	0	0	0	0	109.6	V107	A68-V107 VanDerWaalsContact CA-O 3.31Å; A68-V107 WeakPolarHBondContact CA-O 3.31Å
69	V	93.5	Very high	90.8	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.03	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	157.5	177.5	-58.8	0	0	0	0	111.1	S42 K67 V107 V139	S42-V69 WeakPolarHBondContact OG-CG1 3.33Å; K67-V69 PolarHBondContact O-N 2.94Å; V69-V107 HydrophobicContact CG2-CB 3.74Å; V69-V107 HydrophobicContact CG2-CG1 4.27Å; V69-V107 HydrophobicContact CG2-CG2 4.27Å; V69-V107 PolarHBondContact N-O 3.42Å; V69-V107 PolarHBondContact O-N 3.46Å; V69-V139 WeakPolarHBondContact CA-O 3.11Å; V69-V139 WeakPolarHBondContact CB-O 3.26Å
70	E	95.5	Very high	90.3	Very high	59 Å²	59	38.5 Å²	38.5	28%	0.276	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.4	170.6	-169.4	171.3	81.9	0	0	108.7	C72 K104 V139	E70-C72 PolarHBondContact OE1-SG 3.4Å; E70-K104 HydrophobicContact CG-CB 4.4Å; E70-K104 IonicContact OE1-NZ 2.79Å; E70-V139 PolarHBondContact N-O 3.36Å; E70-V139 PolarHBondContact O-N 3.23Å
71	L	97	Very high	90	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	119.1	166.5	-179.9	153.4	0	0	0	108.1	V61 V63 V73 K104 H105 V107 I114 I116 I136 G137 L138	V61-L71 HydrophobicContact CG2-CD1 4.28Å; V63-L71 HydrophobicContact CG2-CD1 3.74Å; L71-V73 HydrophobicContact CD2-CG2 3.64Å; L71-K104 CarbonylContact O-C 3.55Å; L71-K104 VanDerWaalsContact O-CA 3.26Å; L71-K104 WeakPolarHBondContact O-CA 3.45Å; L71-H105 HydrophobicContact CB-CB 4.26Å; L71-H105 HydrophobicContact CD2-CB 4.5Å; L71-H105 PolarHBondContact N-O 2.69Å; L71-H105 PolarHBondContact O-N 2.78Å; L71-V107 HydrophobicContact CB-CG2 3.91Å; L71-I114 HydrophobicContact CD1-CD1 3.87Å; L71-I116 HydrophobicContact CD2-CD1 4.18Å; L71-I136 HydrophobicContact CD1-CG2 3.86Å; L71-I136 HydrophobicContact CD2-CG2 4.12Å; L71-I136 HydrophobicContact CG-CG2 3.75Å; L71-G137 CarbonylContact C-O 3.6Å; L71-G137 WeakPolarHBondContact CA-O 3.3Å; L71-L138 HydrophobicContact CB-CD2 3.77Å; L71-L138 HydrophobicContact CD1-CD2 3.8Å; L71-L138 HydrophobicContact CG-CD2 3.88Å
72	C	97.5	Very high	90	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	126.6	179.6	-71.9	0	0	0	0	109.8	E70 L74 I97 A101 I136 G137	E70-C72 PolarHBondContact OE1-SG 3.4Å; C72-L74 HydrophobicContact CB-CD1 4.33Å; C72-I97 HydrophobicContact CB-CG2 3.56Å; C72-A101 HydrophobicContact CB-CB 3.75Å; C72-I136 CarbonylContact O-C 3.59Å; C72-I136 WeakPolarHBondContact O-CA 3.46Å; C72-G137 PolarHBondContact N-O 3.36Å; C72-G137 PolarHBondContact O-N 2.79Å
73	V	97.3	Very high	89.7	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.5	174	-171.7	0	0	0	0	109.4	L71 R75 A101 T102 E103 I116 V134	L71-V73 HydrophobicContact CD2-CG2 3.64Å; V73-R75 HydrophobicContact CG1-CG 4.46Å; V73-A101 CarbonylContact O-C 3.47Å; V73-A101 WeakPolarHBondContact O-CA 3.32Å; V73-T102 PolarHBondContact O-N 2.87Å; V73-T102 PolarHBondContact O-OG1 2.82Å; V73-E103 HydrophobicContact CB-CB 4.12Å; V73-E103 HydrophobicContact CG2-CB 4.33Å; V73-E103 HydrophobicContact CG2-CG 4.46Å; V73-E103 PolarHBondContact N-O 2.99Å; V73-E103 PolarHBondContact O-N 3.34Å; V73-I116 HydrophobicContact CB-CG2 4.45Å; V73-I116 HydrophobicContact CG1-CG2 3.74Å; V73-I116 HydrophobicContact CG2-CD1 3.9Å; V73-I116 HydrophobicContact CG2-CG1 4.13Å; V73-I116 HydrophobicContact CG2-CG2 3.91Å; V73-V134 HydrophobicContact CG1-CG1 4.13Å
74	L	96.4	Very high	89.3	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	139.8	173.1	-61.7	83.8	0	0	0	108.9	C72 V77 Y96 I97 N100 V134 V135	C72-L74 HydrophobicContact CB-CD1 4.33Å; L74-V77 HydrophobicContact CB-CG2 3.5Å; L74-V77 VanDerWaalsContact CB-CG2 3.5Å; L74-V77 HydrophobicContact CD2-CG2 4.41Å; L74-Y96 HydrophobicContact CD2-CD1 4.22Å; L74-Y96 HydrophobicContact CD2-CE1 3.81Å; L74-I97 HydrophobicContact CD1-CG2 4.06Å; L74-N100 HydrophobicContact CD2-CB 3.92Å; L74-V134 WeakPolarHBondContact O-CA 3.3Å; L74-V135 HydrophobicContact CB-CB 4.29Å; L74-V135 PolarHBondContact N-O 2.79Å; L74-V135 PolarHBondContact O-N 2.85Å
75	R	93.4	Very high	89.6	Confident	43 Å²	43	35.3 Å²	35.3	16%	0.162	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	148.9	-178.4	-64.7	177.2	177.4	87.8	-2.1	110	V73 V77 T102 E103 H117 V118 S133	V73-R75 HydrophobicContact CG1-CG 4.46Å; R75-V77 VanDerWaalsContact C-N 3.28Å; R75-V77 PolarHBondContact O-N 2.98Å; R75-T102 PolarHBondContact NH1-OG1 3.5Å; R75-E103 IonicContact CZ-OE2 3.92Å; R75-E103 IonicContact NH1-OE2 2.75Å; R75-E103 IonicContact NH2-OE2 3.56Å; R75-E103 PolarHBondContact NH2-OE2 2.89Å; R75-H117 VanDerWaalsContact CZ-O 3.31Å; R75-H117 PolarHBondContact NE-O 2.89Å; R75-H117 VanDerWaalsContact NE-O 3.15Å; R75-H117 PolarHBondContact NH2-O 2.84Å; R75-V118 WeakPolarHBondContact CD-O 3.4Å; R75-V118 PolarHBondContact NE-O 3.49Å; R75-S133 WeakPolarHBondContact CA-O 3.49Å
76	D	90.6	Very high	89.5	Confident	84 Å²	84	35 Å²	35	45%	0.449	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	49.6	45.8	177.7	-64.9	-38.7	0	0	0	114.1	S78 K131 Y132 S133	D76-S78 PolarHBondContact O-N 3.42Å; D76-K131 HydrophobicContact CB-CD 4.26Å; D76-Y132 CarbonylContact C-O 3.55Å; D76-Y132 WeakPolarHBondContact CA-O 3.3Å; D76-Y132 PolarHBondContact N-O 3.48Å; D76-S133 PolarHBondContact N-O 2.93Å
77	V	90.7	Very high	89.4	Confident	7 Å²	7	32.1 Å²	32.1	4%	0.042	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	118.5	-173.1	-165.5	0	0	0	0	110.3	L74 R75 L79 F82 Y96 K131 Y132 V135	L74-V77 HydrophobicContact CB-CG2 3.5Å; L74-V77 VanDerWaalsContact CB-CG2 3.5Å; L74-V77 HydrophobicContact CD2-CG2 4.41Å; R75-V77 VanDerWaalsContact C-N 3.28Å; R75-V77 PolarHBondContact O-N 2.98Å; V77-L79 PolarHBondContact O-N 3.2Å; V77-F82 HydrophobicContact CG1-CB 3.8Å; V77-F82 HydrophobicContact CG1-CD2 3.85Å; V77-F82 HydrophobicContact CG1-CG 4.06Å; V77-Y96 HydrophobicContact CG1-CE1 4.41Å; V77-Y96 WeakPolarHBondContact CG1-OH 3.44Å; V77-K131 CarbonylContact O-C 3.59Å; V77-K131 WeakPolarHBondContact O-CA 3.47Å; V77-Y132 PolarHBondContact N-O 3.36Å; V77-Y132 PolarHBondContact O-N 2.93Å; V77-V135 HydrophobicContact CB-CG2 4.33Å; V77-V135 HydrophobicContact CG2-CB 4.29Å; V77-V135 HydrophobicContact CG2-CG2 4.01Å
78	S	89.7	Confident	89.2	Confident	35 Å²	35	30.5 Å²	30.5	25%	0.245	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.8	125.8	173	166.1	0	0	0	0	111.7	D76 S80 S81 F82	D76-S78 PolarHBondContact O-N 3.42Å; S78-S80 VanDerWaalsContact C-N 3.33Å; S78-S80 PolarHBondContact O-N 3.04Å; S78-S80 PolarHBondContact OG-OG 3.19Å; S78-S81 PolarHBondContact O-N 3.42Å; S78-S81 PolarHBondContact OG-N 3.42Å; S78-S81 PolarHBondContact OG-OG 2.75Å; S78-F82 VanDerWaalsContact O-CB 3.31Å; S78-F82 WeakPolarHBondContact O-CB 2.85Å; S78-F82 PolarHBondContact O-N 2.98Å
79	L	83.2	Confident	89.1	Confident	26 Å²	26	31.2 Å²	31.2	14%	0.136	19%	0.187	C	C	.	.	H	α-helix	trans	-57.1	-48.2	177.6	-91	93	0	0	0	110.7	V77 S81 F82 H83 D130 K131 Y132	V77-L79 PolarHBondContact O-N 3.2Å; L79-S81 PolarHBondContact O-N 3.39Å; L79-F82 PolarHBondContact O-N 2.96Å; L79-H83 WeakPolarHBondContact O-CB 3.48Å; L79-H83 PolarHBondContact O-CD2 3.32Å; L79-H83 VanDerWaalsContact O-CD2 3.29Å; L79-H83 PolarHBondContact O-N 2.85Å; L79-D130 VanDerWaalsContact CD1-O 3.27Å; L79-D130 WeakPolarHBondContact CD1-O 3.33Å; L79-D130 PolarHBondContact N-O 3.38Å; L79-K131 VanDerWaalsContact CD1-CA 3.44Å; L79-Y132 HydrophobicContact CD1-CD1 4.34Å; L79-Y132 HydrophobicContact CD1-CE1 4.35Å; L79-Y132 HydrophobicContact CD1-CG 4.45Å; L79-Y132 HydrophobicContact CD2-CE1 4.04Å; L79-Y132 HydrophobicContact CD2-CE2 4.4Å; L79-Y132 HydrophobicContact CG-CD1 4.38Å; L79-Y132 HydrophobicContact CG-CD2 4.18Å; L79-Y132 HydrophobicContact CG-CE1 4.01Å; L79-Y132 HydrophobicContact CG-CE2 3.82Å; L79-Y132 HydrophobicContact CG-CG 4.45Å
80	S	80.6	Confident	88.9	Confident	82 Å²	82	32.1 Å²	32.1	57%	0.573	19%	0.191	S	C	*	.	H	α-helix	trans	-62	-45.3	-176.8	56.4	0	0	0	0	112.2	S78 A84	S78-S80 VanDerWaalsContact C-N 3.33Å; S78-S80 PolarHBondContact O-N 3.04Å; S78-S80 PolarHBondContact OG-OG 3.19Å; S80-A84 WeakPolarHBondContact O-CB 3.19Å; S80-A84 PolarHBondContact O-N 3.03Å
81	S	87.8	Confident	88.7	Confident	56 Å²	56	35.9 Å²	35.9	39%	0.392	21%	0.207	S	C	.	.	H	α-helix	trans	-67.3	-42.3	179.6	-55.3	0	0	0	0	111.3	S78 L79 A84 I85	S78-S81 PolarHBondContact O-N 3.42Å; S78-S81 PolarHBondContact OG-N 3.42Å; S78-S81 PolarHBondContact OG-OG 2.75Å; L79-S81 PolarHBondContact O-N 3.39Å; S81-A84 PolarHBondContact O-N 3.42Å; S81-I85 PolarHBondContact O-N 3.02Å
82	F	89.2	Confident	88.5	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-67.4	-39.6	179.8	-166.3	-108.3	0	0	0	112.4	V77 S78 L79 I85 L86 Y96 Y132 V135 C154 I156	V77-F82 HydrophobicContact CG1-CB 3.8Å; V77-F82 HydrophobicContact CG1-CD2 3.85Å; V77-F82 HydrophobicContact CG1-CG 4.06Å; S78-F82 VanDerWaalsContact O-CB 3.31Å; S78-F82 WeakPolarHBondContact O-CB 2.85Å; S78-F82 PolarHBondContact O-N 2.98Å; L79-F82 PolarHBondContact O-N 2.96Å; F82-I85 HydrophobicContact CD2-CG2 4.22Å; F82-I85 VanDerWaalsContact O-CG2 3.3Å; F82-I85 WeakPolarHBondContact O-CG2 3.23Å; F82-I85 PolarHBondContact O-N 3.38Å; F82-L86 HydrophobicContact CD1-CD1 3.62Å; F82-L86 HydrophobicContact CD1-CG 3.98Å; F82-L86 HydrophobicContact CE1-CD1 3.41Å; F82-L86 VanDerWaalsContact CE1-CD1 3.41Å; F82-L86 HydrophobicContact CE1-CD2 3.97Å; F82-L86 HydrophobicContact CE1-CG 3.63Å; F82-L86 HydrophobicContact CZ-CD1 4.3Å; F82-L86 HydrophobicContact CZ-CD2 4.06Å; F82-L86 HydrophobicContact CZ-CG 4.04Å; F82-L86 WeakPolarHBondContact O-CB 3.41Å; F82-L86 VanDerWaalsContact O-CG 3.32Å; F82-L86 WeakPolarHBondContact O-CG 3.4Å; F82-L86 PolarHBondContact O-N 2.64Å; F82-Y96 AromaticContact CD2-CE1 3.82Å; F82-Y96 HydrophobicContact CD2-CE1 3.82Å; F82-Y96 HydrophobicContact CE2-CE1 4.32Å; F82-Y132 HydrophobicContact CD1-CD2 4.24Å; F82-Y132 HydrophobicContact CD1-CE2 4.08Å; F82-V135 HydrophobicContact CE1-CG1 4.4Å; F82-V135 HydrophobicContact CE2-CG1 4.02Å; F82-V135 HydrophobicContact CZ-CG1 3.73Å; F82-C154 HydrophobicContact CZ-CB 4.12Å; F82-I156 HydrophobicContact CD1-CD1 4.16Å; F82-I156 HydrophobicContact CE1-CD1 3.41Å; F82-I156 VanDerWaalsContact CE1-CD1 3.41Å; F82-I156 HydrophobicContact CZ-CD1 4.03Å
83	H	81.3	Confident	88.4	Confident	15 Å²	15	39 Å²	39	7%	0.069	22%	0.223	C	C	.	.	H	α-helix	trans	-67.9	-42.2	176.7	-64.1	172	0	0	0	111.3	L79 I85 L86 T87 Y132 F228	L79-H83 WeakPolarHBondContact O-CB 3.48Å; L79-H83 PolarHBondContact O-CD2 3.32Å; L79-H83 VanDerWaalsContact O-CD2 3.29Å; L79-H83 PolarHBondContact O-N 2.85Å; H83-I85 VanDerWaalsContact C-N 3.3Å; H83-I85 PolarHBondContact O-N 3.29Å; H83-L86 PolarHBondContact O-N 3.32Å; H83-T87 WeakPolarHBondContact O-CG2 3.44Å; H83-T87 PolarHBondContact O-N 3.33Å; H83-Y132 AromaticContact NE2-CE2 3.46Å; H83-Y132 WeakPolarHBondContact NE2-CE2 3.45Å; H83-Y132 AromaticContact NE2-CZ 3.56Å; H83-Y132 PolarHBondContact NE2-OH 3.29Å; H83-F228 AromaticContact CE1-CE1 3.14Å; H83-F228 WeakPolarHBondContact CE1-CE1 3.27Å; H83-F228 AromaticContact CE1-CZ 3.19Å; H83-F228 WeakPolarHBondContact CE1-CZ 3.45Å; H83-F228 AromaticContact ND1-CE1 3.84Å; H83-F228 AromaticContact NE2-CE1 3.7Å; H83-F228 AromaticContact NE2-CZ 3.19Å; H83-F228 WeakPolarHBondContact NE2-CZ 3.18Å
84	A	80.7	Confident	88.3	Confident	57 Å²	57	42.5 Å²	42.5	47%	0.471	24%	0.237	S	C	.	.	H	α-helix	trans	-55.8	-47.9	174.8	0	0	0	0	0	110.9	S80 S81 T87 S88	S80-A84 WeakPolarHBondContact O-CB 3.19Å; S80-A84 PolarHBondContact O-N 3.03Å; S81-A84 PolarHBondContact O-N 3.42Å; A84-T87 PolarHBondContact O-N 2.91Å; A84-T87 PolarHBondContact O-OG1 3.34Å; A84-S88 PolarHBondContact O-N 3.21Å
85	I	90.3	Very high	88.2	Confident	30 Å²	30	45.9 Å²	45.9	15%	0.154	26%	0.255	C	S	.	.	H	α-helix	trans	-72.7	-32.8	-178.4	-157.2	76.3	0	0	0	113.7	S81 F82 H83 T87 S88 N92 L93 Y96	S81-I85 PolarHBondContact O-N 3.02Å; F82-I85 HydrophobicContact CD2-CG2 4.22Å; F82-I85 VanDerWaalsContact O-CG2 3.3Å; F82-I85 WeakPolarHBondContact O-CG2 3.23Å; F82-I85 PolarHBondContact O-N 3.38Å; H83-I85 VanDerWaalsContact C-N 3.3Å; H83-I85 PolarHBondContact O-N 3.29Å; I85-T87 PolarHBondContact O-N 3.35Å; I85-S88 WeakPolarHBondContact O-CB 3.41Å; I85-S88 PolarHBondContact O-N 2.75Å; I85-N92 HydrophobicContact CD1-CB 3.9Å; I85-L93 HydrophobicContact CG1-CD1 4.38Å; I85-L93 HydrophobicContact CG2-CD1 3.9Å; I85-Y96 HydrophobicContact CB-CD2 4.24Å; I85-Y96 HydrophobicContact CB-CG 4.22Å; I85-Y96 HydrophobicContact CD1-CD2 4.44Å; I85-Y96 HydrophobicContact CG1-CD2 4.07Å; I85-Y96 HydrophobicContact CG1-CG 3.83Å; I85-Y96 HydrophobicContact CG2-CD1 3.76Å; I85-Y96 HydrophobicContact CG2-CD2 4.11Å; I85-Y96 HydrophobicContact CG2-CE1 4.02Å; I85-Y96 HydrophobicContact CG2-CE2 4.32Å; I85-Y96 HydrophobicContact CG2-CG 3.82Å
86	L	83.8	Confident	88.4	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-56	-35	173.1	-85.5	172.5	0	0	0	112.4	F82 H83 L93 Y175 K177 L183 I278	F82-L86 HydrophobicContact CD1-CD1 3.62Å; F82-L86 HydrophobicContact CD1-CG 3.98Å; F82-L86 HydrophobicContact CE1-CD1 3.41Å; F82-L86 VanDerWaalsContact CE1-CD1 3.41Å; F82-L86 HydrophobicContact CE1-CD2 3.97Å; F82-L86 HydrophobicContact CE1-CG 3.63Å; F82-L86 HydrophobicContact CZ-CD1 4.3Å; F82-L86 HydrophobicContact CZ-CD2 4.06Å; F82-L86 HydrophobicContact CZ-CG 4.04Å; F82-L86 WeakPolarHBondContact O-CB 3.41Å; F82-L86 VanDerWaalsContact O-CG 3.32Å; F82-L86 WeakPolarHBondContact O-CG 3.4Å; F82-L86 PolarHBondContact O-N 2.64Å; H83-L86 PolarHBondContact O-N 3.32Å; L86-L93 HydrophobicContact CD2-CD1 4.31Å; L86-L93 HydrophobicContact CD2-CD2 4.22Å; L86-Y175 HydrophobicContact CD1-CD2 4Å; L86-Y175 HydrophobicContact CD1-CE2 4.06Å; L86-Y175 HydrophobicContact CD1-CG 4.31Å; L86-Y175 HydrophobicContact CD2-CD2 4.31Å; L86-Y175 HydrophobicContact CD2-CG 4.16Å; L86-K177 PolarHBondContact O-NZ 2.82Å; L86-L183 HydrophobicContact CB-CD2 4.42Å; L86-L183 HydrophobicContact CD2-CD1 4.14Å; L86-I278 HydrophobicContact CD1-CG2 4.49Å
87	T	80	Confident	88.7	Confident	56 Å²	56	42 Å²	42	34%	0.344	23%	0.234	S	C	.	.	H	α-helix	trans	-84.3	-16	177.8	63.5	0	0	0	0	114.9	H83 A84 I85 I278 C279	H83-T87 WeakPolarHBondContact O-CG2 3.44Å; H83-T87 PolarHBondContact O-N 3.33Å; A84-T87 PolarHBondContact O-N 2.91Å; A84-T87 PolarHBondContact O-OG1 3.34Å; I85-T87 PolarHBondContact O-N 3.35Å; T87-I278 WeakPolarHBondContact CG2-O 3.34Å; T87-C279 VanDerWaalsContact CG2-CA 3.43Å; T87-C279 HydrophobicContact CG2-CB 4.34Å
88	S	83	Confident	88.9	Confident	35 Å²	35	43.5 Å²	43.5	25%	0.245	24%	0.243	C	C	.	.	S	Bend	trans	-64.5	175.3	175.5	-160.9	0	0	0	0	110.8	A84 I85 N92 K177	A84-S88 PolarHBondContact O-N 3.21Å; I85-S88 WeakPolarHBondContact O-CB 3.41Å; I85-S88 PolarHBondContact O-N 2.75Å; S88-N92 VanDerWaalsContact OG-CB 3.26Å; S88-N92 WeakPolarHBondContact OG-CB 3.43Å; S88-N92 PolarHBondContact OG-ND2 3.49Å; S88-K177 WeakPolarHBondContact O-CE 3.4Å; S88-K177 PolarHBondContact O-NZ 2.87Å
89	D	89.1	Confident	89.2	Confident	63 Å²	63	47.1 Å²	47.1	34%	0.337	26%	0.264	S	S	.	.			trans	-61.4	160.3	171.5	68	51.1	0	0	0	111.6	K91 N92 L93 N181	D89-K91 PolarHBondContact O-N 2.93Å; D89-K91 WeakPolarHBondContact OD1-CB 3.41Å; D89-K91 PolarHBondContact OD1-N 2.6Å; D89-N92 PolarHBondContact O-N 3.42Å; D89-N92 WeakPolarHBondContact OD1-CB 3.03Å; D89-N92 PolarHBondContact OD1-N 3.04Å; D89-N92 PolarHBondContact OD1-ND2 3.44Å; D89-N92 PolarHBondContact OD2-ND2 3.19Å; D89-L93 PolarHBondContact O-N 3.18Å; D89-L93 VanDerWaalsContact O-N 3.09Å; D89-N181 WeakPolarHBondContact CA-OD1 3.28Å
90	H	89	Confident	89.8	Confident	25 Å²	25	49.7 Å²	49.7	12%	0.116	28%	0.278	C	S	.	.	H	α-helix	trans	-55.5	-38.6	-179	161	-88.2	0	0	0	111.8	L93 R94 N151 I152 K177 N181	H90-L93 PolarHBondContact O-N 3.35Å; H90-R94 WeakPolarHBondContact O-CB 3.49Å; H90-R94 PolarHBondContact O-N 3.38Å; H90-N151 PolarHBondContact CD2-OD1 3.14Å; H90-N151 PolarHBondContact CE1-ND2 2.83Å; H90-N151 VanDerWaalsContact CE1-ND2 3.3Å; H90-N151 PolarHBondContact NE2-ND2 3.48Å; H90-N151 PolarHBondContact NE2-OD1 2.88Å; H90-I152 VanDerWaalsContact CD2-CD1 3.41Å; H90-I152 WeakPolarHBondContact CD2-CD1 3.44Å; H90-I152 WeakPolarHBondContact NE2-CD1 3.27Å; H90-K177 HydrophobicContact CB-CG 4.3Å; H90-N181 WeakPolarHBondContact CB-OD1 3.24Å; H90-N181 PolarHBondContact N-OD1 3.18Å
91	K	91.7	Very high	90.6	Very high	137 Å²	137	46.7 Å²	46.7	60%	0.596	26%	0.258	S	S	*	.	H	α-helix	trans	-67.8	-46.4	-178.1	-175.9	-178	175.9	-175.6	0	110.7	D89 L93 R94 D95	D89-K91 PolarHBondContact O-N 2.93Å; D89-K91 WeakPolarHBondContact OD1-CB 3.41Å; D89-K91 PolarHBondContact OD1-N 2.6Å; K91-L93 VanDerWaalsContact C-N 3.33Å; K91-L93 PolarHBondContact O-N 3.08Å; K91-R94 WeakPolarHBondContact O-CB 3.09Å; K91-R94 PolarHBondContact O-N 3.5Å; K91-D95 WeakPolarHBondContact O-CB 3.26Å; K91-D95 VanDerWaalsContact O-CG 3.28Å; K91-D95 PolarHBondContact O-N 2.77Å
92	N	94	Very high	90.9	Very high	64 Å²	64	48.3 Å²	48.3	34%	0.342	27%	0.266	S	S	.	.	H	α-helix	trans	-62.8	-40.7	178.2	-65.8	-24.2	0	0	0	111.4	I85 S88 D89 D95 Y96	I85-N92 HydrophobicContact CD1-CB 3.9Å; S88-N92 VanDerWaalsContact OG-CB 3.26Å; S88-N92 WeakPolarHBondContact OG-CB 3.43Å; S88-N92 PolarHBondContact OG-ND2 3.49Å; D89-N92 PolarHBondContact O-N 3.42Å; D89-N92 WeakPolarHBondContact OD1-CB 3.03Å; D89-N92 PolarHBondContact OD1-N 3.04Å; D89-N92 PolarHBondContact OD1-ND2 3.44Å; D89-N92 PolarHBondContact OD2-ND2 3.19Å; N92-D95 PolarHBondContact O-N 2.87Å; N92-Y96 VanDerWaalsContact O-CB 3.29Å; N92-Y96 WeakPolarHBondContact O-CB 3.35Å; N92-Y96 PolarHBondContact O-N 3.48Å
93	L	93.9	Very high	91.2	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-63.3	-44.8	174.3	179.6	61	0	0	0	111.7	I85 L86 D89 H90 K91 Y96 I97 I152 K177	I85-L93 HydrophobicContact CG1-CD1 4.38Å; I85-L93 HydrophobicContact CG2-CD1 3.9Å; L86-L93 HydrophobicContact CD2-CD1 4.31Å; L86-L93 HydrophobicContact CD2-CD2 4.22Å; D89-L93 PolarHBondContact O-N 3.18Å; D89-L93 VanDerWaalsContact O-N 3.09Å; H90-L93 PolarHBondContact O-N 3.35Å; K91-L93 VanDerWaalsContact C-N 3.33Å; K91-L93 PolarHBondContact O-N 3.08Å; L93-Y96 PolarHBondContact O-N 2.88Å; L93-I97 HydrophobicContact CD1-CD1 3.88Å; L93-I97 HydrophobicContact CD1-CG1 4.19Å; L93-I97 HydrophobicContact CG-CD1 3.88Å; L93-I97 VanDerWaalsContact O-CG1 3.3Å; L93-I97 WeakPolarHBondContact O-CG1 3.01Å; L93-I97 PolarHBondContact O-N 3.24Å; L93-I152 HydrophobicContact CB-CD1 4.28Å; L93-I152 HydrophobicContact CD2-CD1 4.17Å; L93-I152 HydrophobicContact CD2-CG2 4.17Å; L93-I152 HydrophobicContact CG-CD1 4.12Å; L93-I152 HydrophobicContact CG-CG2 4.46Å; L93-K177 HydrophobicContact CD2-CB 3.77Å; L93-K177 HydrophobicContact CD2-CD 4.06Å; L93-K177 HydrophobicContact CD2-CG 3.84Å
94	R	95	Very high	92	Very high	75 Å²	75	54.5 Å²	54.5	28%	0.283	29%	0.293	S	S	.	.	H	α-helix	trans	-56.6	-53.5	175.3	-179.7	-179.4	177.9	159.2	-2.1	111	H90 K91 Y96 I97 V98 V139 I152	H90-R94 WeakPolarHBondContact O-CB 3.49Å; H90-R94 PolarHBondContact O-N 3.38Å; K91-R94 WeakPolarHBondContact O-CB 3.09Å; K91-R94 PolarHBondContact O-N 3.5Å; R94-Y96 VanDerWaalsContact C-N 3.28Å; R94-Y96 PolarHBondContact O-N 3.26Å; R94-I97 PolarHBondContact O-N 3.36Å; R94-V98 HydrophobicContact CG-CG2 4.29Å; R94-V98 WeakPolarHBondContact O-CB 3.31Å; R94-V98 VanDerWaalsContact O-CG2 3.3Å; R94-V98 WeakPolarHBondContact O-CG2 3.46Å; R94-V98 PolarHBondContact O-N 3.18Å; R94-V139 HydrophobicContact CG-CG1 3.79Å; R94-I152 HydrophobicContact CB-CD1 3.87Å
95	D	95.1	Very high	92.7	Very high	72 Å²	72	54.4 Å²	54.4	39%	0.385	28%	0.283	S	S	.	.	H	α-helix	trans	-62.4	-39.6	-175.9	-68.9	-13.5	0	0	0	110.6	K91 N92 T99	K91-D95 WeakPolarHBondContact O-CB 3.26Å; K91-D95 VanDerWaalsContact O-CG 3.28Å; K91-D95 PolarHBondContact O-N 2.77Å; N92-D95 PolarHBondContact O-N 2.87Å; D95-T99 WeakPolarHBondContact O-CB 3.39Å; D95-T99 PolarHBondContact O-N 2.84Å; D95-T99 PolarHBondContact O-OG1 2.77Å
96	Y	97.1	Very high	92.9	Very high	47 Å²	47	58 Å²	58	18%	0.184	31%	0.306	C	S	.	.	H	α-helix	trans	-61.2	-49.1	173.6	179.8	-83.4	0	0	0	112.6	L74 V77 F82 I85 N92 L93 R94 T99 N100	L74-Y96 HydrophobicContact CD2-CD1 4.22Å; L74-Y96 HydrophobicContact CD2-CE1 3.81Å; V77-Y96 HydrophobicContact CG1-CE1 4.41Å; V77-Y96 WeakPolarHBondContact CG1-OH 3.44Å; F82-Y96 AromaticContact CD2-CE1 3.82Å; F82-Y96 HydrophobicContact CD2-CE1 3.82Å; F82-Y96 HydrophobicContact CE2-CE1 4.32Å; I85-Y96 HydrophobicContact CB-CD2 4.24Å; I85-Y96 HydrophobicContact CB-CG 4.22Å; I85-Y96 HydrophobicContact CD1-CD2 4.44Å; I85-Y96 HydrophobicContact CG1-CD2 4.07Å; I85-Y96 HydrophobicContact CG1-CG 3.83Å; I85-Y96 HydrophobicContact CG2-CD1 3.76Å; I85-Y96 HydrophobicContact CG2-CD2 4.11Å; I85-Y96 HydrophobicContact CG2-CE1 4.02Å; I85-Y96 HydrophobicContact CG2-CE2 4.32Å; I85-Y96 HydrophobicContact CG2-CG 3.82Å; N92-Y96 VanDerWaalsContact O-CB 3.29Å; N92-Y96 WeakPolarHBondContact O-CB 3.35Å; N92-Y96 PolarHBondContact O-N 3.48Å; L93-Y96 PolarHBondContact O-N 2.88Å; R94-Y96 VanDerWaalsContact C-N 3.28Å; R94-Y96 PolarHBondContact O-N 3.26Å; Y96-T99 PolarHBondContact O-N 3.36Å; Y96-N100 WeakPolarHBondContact CD2-ND2 3.37Å; Y96-N100 WeakPolarHBondContact O-CB 3.35Å; Y96-N100 PolarHBondContact O-N 2.84Å; Y96-N100 PolarHBondContact O-ND2 3.38Å
97	I	97.1	Very high	93.4	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.6	-50.2	-179.7	-71.5	168.1	0	0	0	110	C72 L74 L93 R94 T99 A101 V139 I152	C72-I97 HydrophobicContact CB-CG2 3.56Å; L74-I97 HydrophobicContact CD1-CG2 4.06Å; L93-I97 HydrophobicContact CD1-CD1 3.88Å; L93-I97 HydrophobicContact CD1-CG1 4.19Å; L93-I97 HydrophobicContact CG-CD1 3.88Å; L93-I97 VanDerWaalsContact O-CG1 3.3Å; L93-I97 WeakPolarHBondContact O-CG1 3.01Å; L93-I97 PolarHBondContact O-N 3.24Å; R94-I97 PolarHBondContact O-N 3.36Å; I97-T99 PolarHBondContact O-N 3.07Å; I97-A101 WeakPolarHBondContact O-CB 3Å; I97-A101 PolarHBondContact O-N 2.86Å; I97-A101 VanDerWaalsContact O-N 3.07Å; I97-V139 HydrophobicContact CB-CG2 4.35Å; I97-V139 HydrophobicContact CD1-CG2 4.5Å; I97-V139 HydrophobicContact CG2-CG2 3.64Å; I97-I152 HydrophobicContact CD1-CG2 3.49Å; I97-I152 VanDerWaalsContact CD1-CG2 3.49Å
98	V	95.2	Very high	94	Very high	38 Å²	38	62 Å²	62	23%	0.23	32%	0.319	C	S	.	.	H	α-helix	trans	-68	-36.2	-176	174.8	0	0	0	0	111.7	R94 K104 V139	R94-V98 HydrophobicContact CG-CG2 4.29Å; R94-V98 WeakPolarHBondContact O-CB 3.31Å; R94-V98 VanDerWaalsContact O-CG2 3.3Å; R94-V98 WeakPolarHBondContact O-CG2 3.46Å; R94-V98 PolarHBondContact O-N 3.18Å; V98-K104 VanDerWaalsContact CG1-NZ 3.3Å; V98-K104 WeakPolarHBondContact O-CE 3.44Å; V98-K104 PolarHBondContact O-NZ 2.96Å; V98-V139 HydrophobicContact CG2-CG1 4.4Å; V98-V139 HydrophobicContact CG2-CG2 4.5Å
99	T	96.1	Very high	94.5	Very high	111 Å²	111	64.1 Å²	64.1	68%	0.681	33%	0.332	S	S	*	.	H	α-helix	trans	-77.8	-38.2	-178.4	-56.3	0	0	0	0	112.3	D95 Y96 I97	D95-T99 WeakPolarHBondContact O-CB 3.39Å; D95-T99 PolarHBondContact O-N 2.84Å; D95-T99 PolarHBondContact O-OG1 2.77Å; Y96-T99 PolarHBondContact O-N 3.36Å; I97-T99 PolarHBondContact O-N 3.07Å
100	N	96.3	Very high	94.5	Very high	80 Å²	80	62.9 Å²	62.9	43%	0.428	33%	0.334	S	S	.	.	H	α-helix	trans	-93.3	1.7	-176.9	-63.4	-80.6	0	0	0	113.5	L74 Y96 T102	L74-N100 HydrophobicContact CD2-CB 3.92Å; Y96-N100 WeakPolarHBondContact CD2-ND2 3.37Å; Y96-N100 WeakPolarHBondContact O-CB 3.35Å; Y96-N100 PolarHBondContact O-N 2.84Å; Y96-N100 PolarHBondContact O-ND2 3.38Å; N100-T102 PolarHBondContact O-N 2.96Å
101	A	96.5	Very high	94.5	Very high	18 Å²	18	67.4 Å²	67.4	15%	0.149	36%	0.358	C	S	.	.			trans	-64.5	126.4	173.4	0	0	0	0	0	110.4	C72 V73 I97 K104	C72-A101 HydrophobicContact CB-CB 3.75Å; V73-A101 CarbonylContact O-C 3.47Å; V73-A101 WeakPolarHBondContact O-CA 3.32Å; I97-A101 WeakPolarHBondContact O-CB 3Å; I97-A101 PolarHBondContact O-N 2.86Å; I97-A101 VanDerWaalsContact O-N 3.07Å; A101-K104 HydrophobicContact CB-CD 4.46Å; A101-K104 HydrophobicContact CB-CG 3.92Å
102	T	95.3	Very high	94.6	Very high	91 Å²	91	63.6 Å²	63.6	56%	0.558	34%	0.342	S	S	*	.	S	Bend	trans	-88.1	-17.6	174.8	47	0	0	0	0	111.8	V73 R75 N100	V73-T102 PolarHBondContact O-N 2.87Å; V73-T102 PolarHBondContact O-OG1 2.82Å; R75-T102 PolarHBondContact NH1-OG1 3.5Å; N100-T102 PolarHBondContact O-N 2.96Å
103	E	95.5	Very high	94.6	Very high	50 Å²	50	66.6 Å²	66.6	23%	0.234	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	143.7	176.8	175.9	-177.3	177.4	0	0	109.3	V73 R75 H105	V73-E103 HydrophobicContact CB-CB 4.12Å; V73-E103 HydrophobicContact CG2-CB 4.33Å; V73-E103 HydrophobicContact CG2-CG 4.46Å; V73-E103 PolarHBondContact N-O 2.99Å; V73-E103 PolarHBondContact O-N 3.34Å; R75-E103 IonicContact CZ-OE2 3.92Å; R75-E103 IonicContact NH1-OE2 2.75Å; R75-E103 IonicContact NH2-OE2 3.56Å; R75-E103 PolarHBondContact NH2-OE2 2.89Å; E103-H105 IonicContact OE1-CD2 3.74Å; E103-H105 IonicContact OE1-CE1 3.48Å; E103-H105 PolarHBondContact OE1-CE1 2.58Å; E103-H105 IonicContact OE1-NE2 3.88Å; E103-H105 PolarHBondContact OE1-NE2 3.45Å
104	K	96.3	Very high	94.7	Very high	95 Å²	95	67.1 Å²	67.1	41%	0.413	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	138.4	-177.4	-63.8	-178.6	178.3	-170.8	0	111.1	E70 L71 V98 A101	E70-K104 HydrophobicContact CG-CB 4.4Å; E70-K104 IonicContact OE1-NZ 2.79Å; L71-K104 CarbonylContact O-C 3.55Å; L71-K104 VanDerWaalsContact O-CA 3.26Å; L71-K104 WeakPolarHBondContact O-CA 3.45Å; V98-K104 VanDerWaalsContact CG1-NZ 3.3Å; V98-K104 WeakPolarHBondContact O-CE 3.44Å; V98-K104 PolarHBondContact O-NZ 2.96Å; A101-K104 HydrophobicContact CB-CD 4.46Å; A101-K104 HydrophobicContact CB-CG 3.92Å
105	H	96.1	Very high	94.7	Very high	54 Å²	54	66 Å²	66	25%	0.25	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	130.8	175.7	-63.6	-88.7	0	0	0	110.7	L71 E103 V107 I114	L71-H105 HydrophobicContact CB-CB 4.26Å; L71-H105 HydrophobicContact CD2-CB 4.5Å; L71-H105 PolarHBondContact N-O 2.69Å; L71-H105 PolarHBondContact O-N 2.78Å; E103-H105 IonicContact OE1-CD2 3.74Å; E103-H105 IonicContact OE1-CE1 3.48Å; E103-H105 PolarHBondContact OE1-CE1 2.58Å; E103-H105 IonicContact OE1-NE2 3.88Å; E103-H105 PolarHBondContact OE1-NE2 3.45Å; H105-V107 PolarHBondContact O-N 3.23Å; H105-I114 HydrophobicContact CB-CD1 4.08Å
106	T	95.2	Very high	94.7	Very high	106 Å²	106	62.6 Å²	62.6	65%	0.65	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	110.8	172.2	-56.6	0	0	0	0	109.7
107	V	93.9	Very high	94.4	Very high	0 Å²	0	65 Å²	65	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	117.1	177.4	-173.8	0	0	0	0	109.3	V63 A68 V69 L71 H105 Q112 I114	V63-V107 HydrophobicContact CB-CG1 4.26Å; V63-V107 HydrophobicContact CG1-CG1 3.97Å; A68-V107 VanDerWaalsContact CA-O 3.31Å; A68-V107 WeakPolarHBondContact CA-O 3.31Å; V69-V107 HydrophobicContact CG2-CB 3.74Å; V69-V107 HydrophobicContact CG2-CG1 4.27Å; V69-V107 HydrophobicContact CG2-CG2 4.27Å; V69-V107 PolarHBondContact N-O 3.42Å; V69-V107 PolarHBondContact O-N 3.46Å; L71-V107 HydrophobicContact CB-CG2 3.91Å; H105-V107 PolarHBondContact O-N 3.23Å; V107-Q112 HydrophobicContact CG1-CB 4.46Å; V107-Q112 HydrophobicContact CG1-CG 4.44Å; V107-I114 HydrophobicContact CG2-CD1 3.84Å
108	K	92.9	Very high	93.9	Very high	139 Å²	139	65 Å²	65	60%	0.604	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-81.8	158.9	174.3	-59.9	-179.8	-178.6	175.6	0	109.9	G110	K108-G110 PolarHBondContact O-N 3.42Å
109	P	92.5	Very high	93.3	Very high	80 Å²	80	67.7 Å²	67.7	52%	0.519	37%	0.372	S	S	.	.	S	Bend	trans	-51.1	136.4	169.5	-24.9	33.2	0	0	0	111.7	S65	S65-P109 CarbonylContact O-C 3.54Å; S65-P109 WeakPolarHBondContact O-CA 3.41Å
110	G	89	Confident	92.2	Very high	37 Å²	37	63.5 Å²	63.5	38%	0.381	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	120.1	-154.8	-173.1	0	0	0	0	0	112.3	S64 S65 K108	S64-G110 WeakPolarHBondContact CA-O 3.32Å; S65-G110 PolarHBondContact N-O 2.91Å; S65-G110 PolarHBondContact O-N 3.29Å; K108-G110 PolarHBondContact O-N 3.42Å
111	I	89.4	Confident	90.7	Very high	120 Å²	120	67.3 Å²	67.3	62%	0.615	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	133	177.9	-61.7	173.8	0	0	0	107.9	T62 V63	T62-I111 HydrophobicContact CG2-CG2 3.36Å; V63-I111 CarbonylContact O-C 3.53Å; V63-I111 WeakPolarHBondContact O-CA 3.5Å
112	Q	93.9	Very high	89	Confident	58 Å²	58	71.2 Å²	71.2	27%	0.271	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	134.9	175.9	-66.5	-169.8	3	0	0	111.4	T62 V63 V107	T62-Q112 CarbonylContact C-O 3.52Å; T62-Q112 WeakPolarHBondContact CA-O 3.36Å; V63-Q112 PolarHBondContact N-O 2.89Å; V63-Q112 PolarHBondContact O-N 3.37Å; V107-Q112 HydrophobicContact CG1-CB 4.46Å; V107-Q112 HydrophobicContact CG1-CG 4.44Å
113	D	94.7	Very high	87.3	Confident	127 Å²	127	69.3 Å²	69.3	68%	0.679	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	130.6	172.4	-65.1	-33.5	0	0	0	110	V61 T62	V61-D113 WeakPolarHBondContact O-CA 3.18Å; T62-D113 VanDerWaalsContact CB-OD1 3.27Å; T62-D113 WeakPolarHBondContact CB-OD1 3.47Å; T62-D113 VanDerWaalsContact CG2-OD1 3.28Å; T62-D113 WeakPolarHBondContact CG2-OD1 3.25Å; T62-D113 PolarHBondContact OG1-OD1 2.94Å
114	I	95.9	Very high	85.4	Confident	11 Å²	11	72.2 Å²	72.2	6%	0.056	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	131.3	-175.8	-59.2	169.2	0	0	0	108.1	R60 V61 V63 L71 H105 V107 I116	R60-I114 WeakPolarHBondContact CA-O 3.19Å; V61-I114 HydrophobicContact CG2-CB 3.98Å; V61-I114 PolarHBondContact N-O 3Å; V61-I114 PolarHBondContact O-N 2.79Å; V63-I114 HydrophobicContact CG2-CD1 4.14Å; L71-I114 HydrophobicContact CD1-CD1 3.87Å; H105-I114 HydrophobicContact CB-CD1 4.08Å; V107-I114 HydrophobicContact CG2-CD1 3.84Å; I114-I116 HydrophobicContact CG2-CG1 4.07Å
115	S	95.3	Very high	83.8	Confident	52 Å²	52	72.7 Å²	72.7	36%	0.364	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126.1	175.1	-169.9	0	0	0	0	109	P58	P58-S115 WeakPolarHBondContact CB-OG 3.19Å
116	I	94.2	Very high	82.2	Confident	1 Å²	1	77 Å²	77	1%	0.005	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	122.2	-176.1	-59.7	170.1	0	0	0	108.3	I59 V61 L71 V73 I114 I136	I59-I116 PolarHBondContact N-O 3.05Å; I59-I116 PolarHBondContact O-N 2.85Å; V61-I116 HydrophobicContact CG1-CD1 4.39Å; V61-I116 HydrophobicContact CG2-CD1 3.75Å; L71-I116 HydrophobicContact CD2-CD1 4.18Å; V73-I116 HydrophobicContact CB-CG2 4.45Å; V73-I116 HydrophobicContact CG1-CG2 3.74Å; V73-I116 HydrophobicContact CG2-CD1 3.9Å; V73-I116 HydrophobicContact CG2-CG1 4.13Å; V73-I116 HydrophobicContact CG2-CG2 3.91Å; I114-I116 HydrophobicContact CG2-CG1 4.07Å; I116-I136 HydrophobicContact CD1-CD1 3.54Å; I116-I136 HydrophobicContact CD1-CG1 4.14Å
117	H	92.3	Very high	80.8	Confident	97 Å²	97	76.2 Å²	76.2	45%	0.449	42%	0.423	S	S	.	.			trans	-80.5	133.2	172.2	-75.5	-65.4	0	0	0	110.7	D57 R75	D57-H117 WeakPolarHBondContact OD1-CA 3.14Å; D57-H117 IonicContact OD1-CE1 2.7Å; D57-H117 IonicContact OD1-CG 3.42Å; D57-H117 IonicContact OD1-ND1 2.67Å; D57-H117 PolarHBondContact OD1-ND1 2.8Å; R75-H117 VanDerWaalsContact CZ-O 3.31Å; R75-H117 PolarHBondContact NE-O 2.89Å; R75-H117 VanDerWaalsContact NE-O 3.15Å; R75-H117 PolarHBondContact NH2-O 2.84Å
118	V	85.6	Confident	79.6	Confident	0 Å²	0	83 Å²	83	0%	0	45%	0.452	C	S	.	.			trans	-77	-40.7	-174.4	-162.7	0	0	0	0	109.8	D57 I59 R75 V120 V134 V159	D57-V118 HydrophobicContact CB-CB 4.3Å; D57-V118 HydrophobicContact CB-CG2 3.81Å; D57-V118 VanDerWaalsContact CG-N 3.34Å; D57-V118 PolarHBondContact OD1-N 2.8Å; D57-V118 PolarHBondContact OD2-N 3.15Å; I59-V118 HydrophobicContact CD1-CG2 3.56Å; I59-V118 HydrophobicContact CG1-CG2 3.7Å; R75-V118 WeakPolarHBondContact CD-O 3.4Å; R75-V118 PolarHBondContact NE-O 3.49Å; V118-V120 HydrophobicContact CB-CG2 4.34Å; V118-V120 HydrophobicContact CG1-CB 4.24Å; V118-V120 HydrophobicContact CG1-CG2 3.36Å; V118-V120 PolarHBondContact O-N 3.45Å; V118-V134 HydrophobicContact CG1-CG2 3.48Å; V118-V134 VanDerWaalsContact CG1-CG2 3.48Å; V118-V159 HydrophobicContact CG1-CB 4.17Å; V118-V159 HydrophobicContact CG1-CG1 3.68Å; V118-V159 HydrophobicContact CG1-CG2 3.44Å; V118-V159 VanDerWaalsContact CG1-CG2 3.44Å
119	N	82.8	Confident	78.7	Confident	95 Å²	95	78.4 Å²	78.4	51%	0.508	43%	0.431	S	S	.	.			trans	57.4	25.5	180	-63.2	-24.6	0	0	0	114.6	D57 H121	D57-N119 PolarHBondContact OD2-N 2.78Å; N119-H121 PolarHBondContact O-ND1 3.18Å
120	V	72.6	Confident	78.1	Confident	22 Å²	22	80 Å²	80	13%	0.133	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-83.3	131.2	-177	-178.3	0	0	0	0	110	V118 V159 I161	V118-V120 HydrophobicContact CB-CG2 4.34Å; V118-V120 HydrophobicContact CG1-CB 4.24Å; V118-V120 HydrophobicContact CG1-CG2 3.36Å; V118-V120 PolarHBondContact O-N 3.45Å; V120-V159 HydrophobicContact CG2-CG1 4.35Å; V120-I161 HydrophobicContact CB-CG2 4.37Å; V120-I161 HydrophobicContact CG1-CG2 3.61Å
121	H	65	Low	77.9	Confident	160 Å²	160	82.9 Å²	82.9	74%	0.741	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-84.8	137.6	174.4	-63.9	10.2	0	0	0	109.3	N119 C123	N119-H121 PolarHBondContact O-ND1 3.18Å; H121-C123 PolarHBondContact O-N 3.47Å
122	S	61.8	Low	77.8	Confident	100 Å²	100	77.6 Å²	77.6	70%	0.699	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-53.5	124.3	176.3	54	0	0	0	0	110	P124	S122-P124 WeakPolarHBondContact O-CD 3.34Å
123	C	58.6	Low	77.5	Confident	52 Å²	52	75.1 Å²	75.1	35%	0.351	40%	0.399	S	S	.	.			trans	-94.6	109.4	177.3	-175.7	0	0	0	0	109	H121 D125 I161 R162	H121-C123 PolarHBondContact O-N 3.47Å; C123-D125 VanDerWaalsContact C-N 3.34Å; C123-D125 PolarHBondContact O-N 3.42Å; C123-I161 HydrophobicContact CB-CD1 3.8Å; C123-R162 PolarHBondContact O-NE 3.47Å; C123-R162 PolarHBondContact O-NH2 3.24Å; C123-R162 PolarHBondContact SG-NH2 3.45Å
124	P	55.8	Low	77.4	Confident	111 Å²	111	69 Å²	69	72%	0.721	37%	0.366	S	S	*	.			trans	-71.4	-23.4	-169	26.1	-33	0	0	0	114.2	S122	S122-P124 WeakPolarHBondContact O-CD 3.34Å
125	D	62.2	Low	77.3	Confident	105 Å²	105	68.5 Å²	68.5	56%	0.561	36%	0.364	S	S	*	.	S	Bend	trans	-93.3	127.4	-172.9	-73	-28.6	0	0	0	112.5	C123 T127 R162	C123-D125 VanDerWaalsContact C-N 3.34Å; C123-D125 PolarHBondContact O-N 3.42Å; D125-T127 HydrophobicContact CB-CG2 4.21Å; D125-T127 PolarHBondContact O-N 3.09Å; D125-T127 PolarHBondContact O-OG1 3.28Å; D125-R162 PolarHBondContact O-NH1 3.35Å; D125-R162 PolarHBondContact O-NH2 3.26Å
126	H	63.3	Low	77.4	Confident	145 Å²	145	66.1 Å²	66.1	67%	0.671	35%	0.346	S	S	*	.			trans	-63.8	16.2	175.6	-56.7	-71.3	0	0	0	115.1	E164	H126-E164 VanDerWaalsContact CE1-CD 3.48Å; H126-E164 IonicContact CE1-OE1 2.8Å; H126-E164 IonicContact CE1-OE2 2.69Å; H126-E164 PolarHBondContact CE1-OE2 3.42Å; H126-E164 IonicContact ND1-OE2 3.64Å; H126-E164 PolarHBondContact ND1-OE2 2.98Å; H126-E164 VanDerWaalsContact ND1-OE2 3.13Å
127	T	65.7	Low	77.5	Confident	89 Å²	89	66 Å²	66	55%	0.546	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-63.9	150.4	173.7	53.1	0	0	0	0	111.1	D125 R129 R162	D125-T127 HydrophobicContact CB-CG2 4.21Å; D125-T127 PolarHBondContact O-N 3.09Å; D125-T127 PolarHBondContact O-OG1 3.28Å; T127-R129 PolarHBondContact O-N 3.48Å; T127-R162 PolarHBondContact O-NH1 3.02Å
128	K	68.3	Low	77.6	Confident	141 Å²	141	61.6 Å²	61.6	61%	0.613	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-53.3	138.7	174.7	-70.8	-177	179.6	179.8	0	110.1	D130	K128-D130 PolarHBondContact O-N 2.74Å
129	R	74.3	Confident	78.1	Confident	43 Å²	43	61.8 Å²	61.8	16%	0.162	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-65.1	124.4	174.9	-68.8	-179	174.5	-132.1	11.3	110	T127 S133 V159 I161 E165	T127-R129 PolarHBondContact O-N 3.48Å; R129-S133 PolarHBondContact NH1-OG 3.04Å; R129-V159 PolarHBondContact NH1-O 2.92Å; R129-V159 PolarHBondContact NH2-O 2.86Å; R129-I161 VanDerWaalsContact NH2-CG1 3.29Å; R129-E165 IonicContact CZ-OE1 3.77Å; R129-E165 IonicContact CZ-OE2 2.87Å; R129-E165 IonicContact NE-OE1 3.96Å; R129-E165 PolarHBondContact NE-OE1 3.13Å; R129-E165 IonicContact NH2-OE1 3.61Å; R129-E165 PolarHBondContact NH2-OE1 3.37Å; R129-E165 IonicContact NH2-OE2 3.14Å; R129-E165 PolarHBondContact NH2-OE2 3.22Å
130	D	78.9	Confident	78.4	Confident	113 Å²	113	57.4 Å²	57.4	60%	0.604	30%	0.304	S	S	*	.			trans	-103.9	-1.2	172.3	70.1	-24.6	0	0	0	112.2	L79 K128	L79-D130 VanDerWaalsContact CD1-O 3.27Å; L79-D130 WeakPolarHBondContact CD1-O 3.33Å; L79-D130 PolarHBondContact N-O 3.38Å; K128-D130 PolarHBondContact O-N 2.74Å
131	K	85.7	Confident	78.4	Confident	99 Å²	99	60 Å²	60	43%	0.43	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	144.1	176.3	-63.9	173.7	-174.4	-177.4	0	112.7	D76 V77 L79	D76-K131 HydrophobicContact CB-CD 4.26Å; V77-K131 CarbonylContact O-C 3.59Å; V77-K131 WeakPolarHBondContact O-CA 3.47Å; L79-K131 VanDerWaalsContact CD1-CA 3.44Å
132	Y	86.5	Confident	78.4	Confident	8 Å²	8	53.9 Å²	53.9	3%	0.031	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	124.9	159.3	-64.3	-54.8	0	0	0	109	D76 V77 L79 F82 H83 V134 V135 I156 M172 F228	D76-Y132 CarbonylContact C-O 3.55Å; D76-Y132 WeakPolarHBondContact CA-O 3.3Å; D76-Y132 PolarHBondContact N-O 3.48Å; V77-Y132 PolarHBondContact N-O 3.36Å; V77-Y132 PolarHBondContact O-N 2.93Å; L79-Y132 HydrophobicContact CD1-CD1 4.34Å; L79-Y132 HydrophobicContact CD1-CE1 4.35Å; L79-Y132 HydrophobicContact CD1-CG 4.45Å; L79-Y132 HydrophobicContact CD2-CE1 4.04Å; L79-Y132 HydrophobicContact CD2-CE2 4.4Å; L79-Y132 HydrophobicContact CG-CD1 4.38Å; L79-Y132 HydrophobicContact CG-CD2 4.18Å; L79-Y132 HydrophobicContact CG-CE1 4.01Å; L79-Y132 HydrophobicContact CG-CE2 3.82Å; L79-Y132 HydrophobicContact CG-CG 4.45Å; F82-Y132 HydrophobicContact CD1-CD2 4.24Å; F82-Y132 HydrophobicContact CD1-CE2 4.08Å; H83-Y132 AromaticContact NE2-CE2 3.46Å; H83-Y132 WeakPolarHBondContact NE2-CE2 3.45Å; H83-Y132 AromaticContact NE2-CZ 3.56Å; H83-Y132 PolarHBondContact NE2-OH 3.29Å; Y132-V134 PolarHBondContact O-N 2.99Å; Y132-V135 HydrophobicContact CD2-CG2 4.28Å; Y132-V135 HydrophobicContact CG-CG2 4.39Å; Y132-I156 HydrophobicContact CD1-CG2 3.36Å; Y132-I156 HydrophobicContact CD2-CG2 4.1Å; Y132-I156 HydrophobicContact CE1-CG2 3.51Å; Y132-I156 HydrophobicContact CE2-CG2 4.2Å; Y132-I156 HydrophobicContact CG-CG2 3.69Å; Y132-M172 HydrophobicContact CD1-CE 4.23Å; Y132-M172 HydrophobicContact CE1-CE 3.74Å; Y132-F228 WeakPolarHBondContact OH-CE2 3.43Å; Y132-F228 WeakPolarHBondContact OH-CZ 3.48Å
133	S	88.4	Confident	78.1	Confident	6 Å²	6	54.4 Å²	54.4	4%	0.042	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	-45.6	179.8	-63.2	0	0	0	0	111.8	R75 D76 R129	R75-S133 WeakPolarHBondContact CA-O 3.49Å; D76-S133 PolarHBondContact N-O 2.93Å; R129-S133 PolarHBondContact NH1-OG 3.04Å
134	V	92.7	Very high	78	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	136.5	178.3	173.7	0	0	0	0	110.6	V73 L74 V118 Y132 I136 I157 V159	V73-V134 HydrophobicContact CG1-CG1 4.13Å; L74-V134 WeakPolarHBondContact O-CA 3.3Å; V118-V134 HydrophobicContact CG1-CG2 3.48Å; V118-V134 VanDerWaalsContact CG1-CG2 3.48Å; Y132-V134 PolarHBondContact O-N 2.99Å; V134-I136 HydrophobicContact CG1-CG1 4.16Å; V134-I157 HydrophobicContact CB-CB 4Å; V134-I157 HydrophobicContact CB-CG1 4.44Å; V134-I157 HydrophobicContact CG1-CB 4.15Å; V134-I157 HydrophobicContact CG1-CG1 4.03Å; V134-I157 PolarHBondContact O-N 3.48Å; V134-V159 HydrophobicContact CB-CG2 4.33Å; V134-V159 HydrophobicContact CG2-CG2 4.09Å
135	V	94.4	Very high	78.3	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	128.5	166.7	176.2	0	0	0	0	108.4	L74 V77 F82 Y132 Y155 I156	L74-V135 HydrophobicContact CB-CB 4.29Å; L74-V135 PolarHBondContact N-O 2.79Å; L74-V135 PolarHBondContact O-N 2.85Å; V77-V135 HydrophobicContact CB-CG2 4.33Å; V77-V135 HydrophobicContact CG2-CB 4.29Å; V77-V135 HydrophobicContact CG2-CG2 4.01Å; F82-V135 HydrophobicContact CE1-CG1 4.4Å; F82-V135 HydrophobicContact CE2-CG1 4.02Å; F82-V135 HydrophobicContact CZ-CG1 3.73Å; Y132-V135 HydrophobicContact CD2-CG2 4.28Å; Y132-V135 HydrophobicContact CG-CG2 4.39Å; V135-Y155 CarbonylContact C-O 3.58Å; V135-Y155 WeakPolarHBondContact CA-O 3.15Å; V135-I156 HydrophobicContact CB-CD1 4.44Å; V135-I156 HydrophobicContact CG1-CD1 3.91Å; V135-I156 HydrophobicContact CG2-CD1 3.78Å
136	I	96	Very high	78.8	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	117.7	173.3	-58.5	171.3	0	0	0	108.4	I44 V61 L71 C72 I116 V134 C154 Y155 I157	I44-I136 HydrophobicContact CD1-CB 4.45Å; I44-I136 HydrophobicContact CD1-CD1 4.12Å; I44-I136 HydrophobicContact CD1-CG2 4.13Å; V61-I136 HydrophobicContact CG1-CD1 4.15Å; L71-I136 HydrophobicContact CD1-CG2 3.86Å; L71-I136 HydrophobicContact CD2-CG2 4.12Å; L71-I136 HydrophobicContact CG-CG2 3.75Å; C72-I136 CarbonylContact O-C 3.59Å; C72-I136 WeakPolarHBondContact O-CA 3.46Å; I116-I136 HydrophobicContact CD1-CD1 3.54Å; I116-I136 HydrophobicContact CD1-CG1 4.14Å; V134-I136 HydrophobicContact CG1-CG1 4.16Å; I136-C154 CarbonylContact O-C 3.59Å; I136-C154 WeakPolarHBondContact O-CA 3.35Å; I136-Y155 PolarHBondContact N-O 3.48Å; I136-Y155 PolarHBondContact O-N 2.72Å; I136-I157 HydrophobicContact CD1-CD1 4.41Å; I136-I157 HydrophobicContact CD1-CG1 4.16Å; I136-I157 HydrophobicContact CG1-CG1 4.31Å
137	G	96.2	Very high	79.5	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	123.8	172.4	0	0	0	0	0	111.1	L71 C72 T153	L71-G137 CarbonylContact C-O 3.6Å; L71-G137 WeakPolarHBondContact CA-O 3.3Å; C72-G137 PolarHBondContact N-O 3.36Å; C72-G137 PolarHBondContact O-N 2.79Å; G137-T153 CarbonylContact C-O 3.54Å; G137-T153 WeakPolarHBondContact CA-O 3.11Å
138	L	95.5	Very high	80.2	Confident	3 Å²	3	53.9 Å²	53.9	2%	0.016	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	116.4	164.4	-60.8	178.3	0	0	0	108.1	I44 V63 L71 I152 T153 Y155	I44-L138 HydrophobicContact CG1-CD1 4.46Å; V63-L138 HydrophobicContact CG1-CD1 4.11Å; V63-L138 HydrophobicContact CG1-CD2 4.13Å; V63-L138 HydrophobicContact CG2-CD2 4.48Å; L71-L138 HydrophobicContact CB-CD2 3.77Å; L71-L138 HydrophobicContact CD1-CD2 3.8Å; L71-L138 HydrophobicContact CG-CD2 3.88Å; L138-I152 WeakPolarHBondContact O-CA 3.47Å; L138-T153 PolarHBondContact N-O 3.03Å; L138-T153 PolarHBondContact O-N 2.86Å; L138-Y155 HydrophobicContact CD1-CE2 3.91Å; L138-Y155 HydrophobicContact CG-CE2 4.37Å
139	V	95.2	Very high	80.8	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.024	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	113.4	-176.3	-178.6	0	0	0	0	109.4	V69 E70 R94 I97 V98	V69-V139 WeakPolarHBondContact CA-O 3.11Å; V69-V139 WeakPolarHBondContact CB-O 3.26Å; E70-V139 PolarHBondContact N-O 3.36Å; E70-V139 PolarHBondContact O-N 3.23Å; R94-V139 HydrophobicContact CG-CG1 3.79Å; I97-V139 HydrophobicContact CB-CG2 4.35Å; I97-V139 HydrophobicContact CD1-CG2 4.5Å; I97-V139 HydrophobicContact CG2-CG2 3.64Å; V98-V139 HydrophobicContact CG2-CG1 4.4Å; V98-V139 HydrophobicContact CG2-CG2 4.5Å
140	S	88.8	Confident	81.3	Confident	4 Å²	4	45.9 Å²	45.9	3%	0.028	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	131	172.2	173.4	0	0	0	0	110.6	T142 N151	S140-T142 VanDerWaalsContact C-N 3.35Å; S140-T142 PolarHBondContact O-N 2.84Å; S140-T142 VanDerWaalsContact O-N 3.09Å; S140-T142 PolarHBondContact OG-OG1 3.42Å; S140-N151 PolarHBondContact N-O 2.67Å
141	S	72.9	Confident	81.7	Confident	77 Å²	77	40.8 Å²	40.8	54%	0.538	23%	0.231	S	C	.	.			trans	-77.3	87.2	165.6	44.2	0	0	0	0	108.8
142	T	65.7	Low	82.1	Confident	31 Å²	31	36 Å²	36	19%	0.19	21%	0.211	C	C	.	.			trans	-125.3	134.2	167.2	29.6	0	0	0	0	112.7	K67 S140 E149	K67-T142 HydrophobicContact CD-CG2 4.49Å; S140-T142 VanDerWaalsContact C-N 3.35Å; S140-T142 PolarHBondContact O-N 2.84Å; S140-T142 VanDerWaalsContact O-N 3.09Å; S140-T142 PolarHBondContact OG-OG1 3.42Å; T142-E149 WeakPolarHBondContact CB-OE1 3.26Å; T142-E149 PolarHBondContact OG1-OE1 2.82Å
143	P	56	Low	82.3	Confident	111 Å²	111	35.8 Å²	35.8	72%	0.721	21%	0.21	S	C	*	.			trans	-77.7	163.6	175	34.2	-33.4	0	0	0	110.4	S145	P143-S145 PolarHBondContact O-N 3.42Å
144	D	55.2	Low	82.5	Confident	175 Å²	175	35.5 Å²	35.5	94%	0.936	21%	0.208	S	C	*	.			trans	-35.5	93.8	-177.9	-63.8	-40.5	0	0	0	113.6
145	S	62.3	Low	82.4	Confident	39 Å²	39	35.6 Å²	35.6	27%	0.273	21%	0.208	S	C	.	.			trans	-84.5	128.6	177.5	167.3	0	0	0	0	108.8	P143 V147	P143-S145 PolarHBondContact O-N 3.42Å; S145-V147 WeakPolarHBondContact CB-O 3.3Å; S145-V147 PolarHBondContact O-N 3.02Å; S145-V147 VanDerWaalsContact O-N 3.13Å; S145-V147 PolarHBondContact OG-N 3.45Å; S145-V147 PolarHBondContact OG-O 3.24Å
146	L	73.4	Confident	82.1	Confident	174 Å²	174	35.6 Å²	35.6	91%	0.911	21%	0.208	S	C	*	.	S	Bend	trans	-62.4	-12.7	169.1	-71.7	166	0	0	0	112.5
147	V	77.1	Confident	81.6	Confident	88 Å²	88	35.6 Å²	35.6	53%	0.533	21%	0.208	S	C	.	.	S	Bend	trans	-111.3	132.7	179.4	-175.1	0	0	0	0	109.5	S145 E149	S145-V147 WeakPolarHBondContact CB-O 3.3Å; S145-V147 PolarHBondContact O-N 3.02Å; S145-V147 VanDerWaalsContact O-N 3.13Å; S145-V147 PolarHBondContact OG-N 3.45Å; S145-V147 PolarHBondContact OG-O 3.24Å; V147-E149 PolarHBondContact O-N 2.9Å
148	E	80.1	Confident	80.9	Confident	15 Å²	15	36 Å²	36	7%	0.07	21%	0.21	C	C	.	.			trans	-62.3	125.7	173.2	-168.1	177.7	-169.5	0	0	110.5	L38 T178 W180 R182	L38-E148 HydrophobicContact CD2-CB 3.9Å; L38-E148 HydrophobicContact CD2-CG 3.63Å; E148-T178 HydrophobicContact CG-CG2 4.14Å; E148-T178 WeakPolarHBondContact OE1-CB 3.35Å; E148-T178 VanDerWaalsContact OE1-CG2 3.27Å; E148-T178 WeakPolarHBondContact OE1-CG2 3.21Å; E148-T178 PolarHBondContact OE1-OG1 2.91Å; E148-W180 HydrophobicContact CB-CD2 3.61Å; E148-W180 HydrophobicContact CB-CE3 3.99Å; E148-W180 HydrophobicContact CB-CG 3.92Å; E148-W180 HydrophobicContact CB-CZ2 4.22Å; E148-W180 HydrophobicContact CB-CZ3 4.47Å; E148-W180 HydrophobicContact CG-CB 3.97Å; E148-W180 HydrophobicContact CG-CD2 3.91Å; E148-W180 HydrophobicContact CG-CE3 4.29Å; E148-W180 HydrophobicContact CG-CG 3.77Å; E148-R182 WeakPolarHBondContact OE1-CD 3.35Å; E148-R182 IonicContact OE1-CZ 3.19Å; E148-R182 IonicContact OE1-NE 3.78Å; E148-R182 IonicContact OE1-NH1 3.86Å; E148-R182 PolarHBondContact OE1-NH1 2.8Å; E148-R182 IonicContact OE2-CZ 2.73Å; E148-R182 IonicContact OE2-NH1 3.85Å; E148-R182 PolarHBondContact OE2-NH1 2.84Å
149	E	81.6	Confident	80.5	Confident	14 Å²	14	35.9 Å²	35.9	7%	0.065	21%	0.209	C	C	.	.			trans	-137	153.7	174.7	61.8	172.1	-166	0	0	111	K67 T142 V147 T178 T179	K67-E149 IonicContact NZ-OE1 3.99Å; K67-E149 IonicContact NZ-OE2 3.93Å; K67-E149 PolarHBondContact NZ-OE2 3.4Å; T142-E149 WeakPolarHBondContact CB-OE1 3.26Å; T142-E149 PolarHBondContact OG1-OE1 2.82Å; V147-E149 PolarHBondContact O-N 2.9Å; E149-T178 CarbonylContact O-C 3.53Å; E149-T178 WeakPolarHBondContact O-CA 3.36Å; E149-T178 WeakPolarHBondContact O-CB 3.11Å; E149-T179 HydrophobicContact CG-CG2 3.78Å; E149-T179 PolarHBondContact N-OG1 3Å; E149-T179 PolarHBondContact O-N 3.32Å
150	I	83.8	Confident	80	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	115	171	-61.3	156.3	0	0	0	107.3	L38 S39 N40 W176 T178	L38-I150 HydrophobicContact CB-CD1 4.07Å; L38-I150 HydrophobicContact CB-CG1 4.44Å; S39-I150 PolarHBondContact O-N 2.77Å; S39-I150 VanDerWaalsContact O-N 3.14Å; N40-I150 HydrophobicContact CB-CB 4.2Å; N40-I150 HydrophobicContact CB-CD1 3.96Å; N40-I150 HydrophobicContact CB-CG2 4.24Å; I150-W176 HydrophobicContact CD1-CB 4.31Å; I150-W176 HydrophobicContact CD1-CD2 3.84Å; I150-W176 HydrophobicContact CD1-CE3 3.36Å; I150-W176 HydrophobicContact CD1-CG 4.26Å; I150-W176 HydrophobicContact CD1-CZ3 3.89Å; I150-W176 HydrophobicContact CG1-CB 4.22Å; I150-W176 HydrophobicContact CG1-CE3 4.45Å; I150-W176 HydrophobicContact CG2-CB 3.72Å; I150-W176 HydrophobicContact CG2-CD2 4.44Å; I150-W176 HydrophobicContact CG2-CG 3.88Å; I150-T178 HydrophobicContact CG1-CG2 4.04Å
151	N	88.9	Confident	79.7	Confident	5 Å²	5	37.7 Å²	37.7	3%	0.027	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	-8	-176.2	67.2	-13.4	0	0	0	113.3	H90 S140 K177 T179	H90-N151 PolarHBondContact CD2-OD1 3.14Å; H90-N151 PolarHBondContact CE1-ND2 2.83Å; H90-N151 VanDerWaalsContact CE1-ND2 3.3Å; H90-N151 PolarHBondContact NE2-ND2 3.48Å; H90-N151 PolarHBondContact NE2-OD1 2.88Å; S140-N151 PolarHBondContact N-O 2.67Å; N151-K177 PolarHBondContact N-O 3.28Å; N151-K177 PolarHBondContact OD1-O 2.89Å; N151-T179 HydrophobicContact CB-CG2 4.42Å; N151-T179 WeakPolarHBondContact ND2-CG2 3.23Å
152	I	93	Very high	80.1	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.6	165.5	-52.8	173.8	0	0	0	108.4	H90 L93 R94 I97 L138 W176 K177	H90-I152 VanDerWaalsContact CD2-CD1 3.41Å; H90-I152 WeakPolarHBondContact CD2-CD1 3.44Å; H90-I152 WeakPolarHBondContact NE2-CD1 3.27Å; L93-I152 HydrophobicContact CB-CD1 4.28Å; L93-I152 HydrophobicContact CD2-CD1 4.17Å; L93-I152 HydrophobicContact CD2-CG2 4.17Å; L93-I152 HydrophobicContact CG-CD1 4.12Å; L93-I152 HydrophobicContact CG-CG2 4.46Å; R94-I152 HydrophobicContact CB-CD1 3.87Å; I97-I152 HydrophobicContact CD1-CG2 3.49Å; I97-I152 VanDerWaalsContact CD1-CG2 3.49Å; L138-I152 WeakPolarHBondContact O-CA 3.47Å; I152-W176 WeakPolarHBondContact O-CA 3.28Å; I152-K177 HydrophobicContact CB-CB 3.97Å; I152-K177 HydrophobicContact CD1-CB 4.44Å; I152-K177 PolarHBondContact N-O 2.78Å; I152-K177 PolarHBondContact O-N 2.88Å
153	T	91.7	Very high	80.8	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.012	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125.5	168.8	-61.5	0	0	0	0	108.8	N40 G137 L138 Y155 I174 Y175	N40-T153 PolarHBondContact ND2-OG1 2.78Å; G137-T153 CarbonylContact C-O 3.54Å; G137-T153 WeakPolarHBondContact CA-O 3.11Å; L138-T153 PolarHBondContact N-O 3.03Å; L138-T153 PolarHBondContact O-N 2.86Å; T153-Y155 HydrophobicContact CG2-CD2 3.82Å; T153-Y155 HydrophobicContact CG2-CE2 3.21Å; T153-I174 HydrophobicContact CG2-CG2 3.88Å; T153-Y175 CarbonylContact C-O 3.52Å; T153-Y175 WeakPolarHBondContact CA-O 3.38Å
154	C	93	Very high	81.9	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.007	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.5	174.5	-56.1	0	0	0	0	109.5	F82 I136 I174 Y175	F82-C154 HydrophobicContact CZ-CB 4.12Å; I136-C154 CarbonylContact O-C 3.59Å; I136-C154 WeakPolarHBondContact O-CA 3.35Å; C154-I174 CarbonylContact O-C 3.58Å; C154-I174 VanDerWaalsContact O-CA 3.31Å; C154-I174 WeakPolarHBondContact O-CA 3.37Å; C154-Y175 PolarHBondContact N-O 2.87Å; C154-Y175 PolarHBondContact O-N 3.33Å
155	Y	89.9	Confident	82.7	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.008	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118.7	170.7	-66	-96.3	0	0	0	108.5	V43 I44 V135 I136 L138 T153 I171 I174	V43-Y155 WeakPolarHBondContact CA-OH 3.44Å; I44-Y155 HydrophobicContact CB-CD1 4.4Å; I44-Y155 HydrophobicContact CB-CE1 3.84Å; I44-Y155 HydrophobicContact CB-CE2 4.09Å; I44-Y155 HydrophobicContact CD1-CD1 3.98Å; I44-Y155 HydrophobicContact CD1-CD2 3.51Å; I44-Y155 HydrophobicContact CD1-CE1 4.21Å; I44-Y155 HydrophobicContact CD1-CE2 3.75Å; I44-Y155 HydrophobicContact CD1-CG 3.65Å; I44-Y155 HydrophobicContact CG1-CD1 4.47Å; I44-Y155 HydrophobicContact CG1-CD2 3.95Å; I44-Y155 HydrophobicContact CG1-CE1 4.2Å; I44-Y155 HydrophobicContact CG1-CE2 3.62Å; I44-Y155 HydrophobicContact CG1-CG 4.38Å; I44-Y155 PolarHBondContact N-OH 2.82Å; V135-Y155 CarbonylContact C-O 3.58Å; V135-Y155 WeakPolarHBondContact CA-O 3.15Å; I136-Y155 PolarHBondContact N-O 3.48Å; I136-Y155 PolarHBondContact O-N 2.72Å; L138-Y155 HydrophobicContact CD1-CE2 3.91Å; L138-Y155 HydrophobicContact CG-CE2 4.37Å; T153-Y155 HydrophobicContact CG2-CD2 3.82Å; T153-Y155 HydrophobicContact CG2-CE2 3.21Å; Y155-I171 HydrophobicContact CD1-CD1 3.94Å; Y155-I171 HydrophobicContact CD1-CG1 4.41Å; Y155-I171 HydrophobicContact CD1-CG2 3.9Å; Y155-I171 HydrophobicContact CE1-CD1 4.35Å; Y155-I174 HydrophobicContact CD1-CD1 3.91Å; Y155-I174 HydrophobicContact CD1-CG1 3.68Å; Y155-I174 HydrophobicContact CD1-CG2 4.44Å; Y155-I174 HydrophobicContact CE1-CD1 3.51Å; Y155-I174 HydrophobicContact CE1-CG1 3.77Å; Y155-I174 HydrophobicContact CE1-CG2 4.19Å
156	I	87.3	Confident	83.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	115.4	174.5	-47.7	-51.8	0	0	0	107.5	F82 Y132 V135 M172 Y173 Y175	F82-I156 HydrophobicContact CD1-CD1 4.16Å; F82-I156 HydrophobicContact CE1-CD1 3.41Å; F82-I156 VanDerWaalsContact CE1-CD1 3.41Å; F82-I156 HydrophobicContact CZ-CD1 4.03Å; Y132-I156 HydrophobicContact CD1-CG2 3.36Å; Y132-I156 HydrophobicContact CD2-CG2 4.1Å; Y132-I156 HydrophobicContact CE1-CG2 3.51Å; Y132-I156 HydrophobicContact CE2-CG2 4.2Å; Y132-I156 HydrophobicContact CG-CG2 3.69Å; V135-I156 HydrophobicContact CB-CD1 4.44Å; V135-I156 HydrophobicContact CG1-CD1 3.91Å; V135-I156 HydrophobicContact CG2-CD1 3.78Å; I156-M172 HydrophobicContact CG2-CE 3.84Å; I156-M172 PolarHBondContact O-N 3.15Å; I156-Y173 PolarHBondContact N-O 3.37Å; I156-Y173 PolarHBondContact O-N 2.85Å; I156-Y175 HydrophobicContact CD1-CD2 4.21Å; I156-Y175 HydrophobicContact CD1-CE2 4.24Å; I156-Y175 HydrophobicContact CG1-CD2 3.98Å; I156-Y175 HydrophobicContact CG1-CE2 3.71Å
157	I	85.4	Confident	83.1	Confident	1 Å²	1	32 Å²	32	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	117.7	-177.9	-51	-52.7	0	0	0	108	F47 I59 V134 I136 V159 T169 S170 I171	F47-I157 HydrophobicContact CD2-CD1 4.13Å; F47-I157 HydrophobicContact CE2-CD1 3.55Å; F47-I157 HydrophobicContact CE2-CG1 4.09Å; F47-I157 HydrophobicContact CE2-CG2 3.85Å; F47-I157 HydrophobicContact CZ-CD1 4.27Å; F47-I157 HydrophobicContact CZ-CG2 3.63Å; I59-I157 HydrophobicContact CD1-CG2 4.03Å; V134-I157 HydrophobicContact CB-CB 4Å; V134-I157 HydrophobicContact CB-CG1 4.44Å; V134-I157 HydrophobicContact CG1-CB 4.15Å; V134-I157 HydrophobicContact CG1-CG1 4.03Å; V134-I157 PolarHBondContact O-N 3.48Å; I136-I157 HydrophobicContact CD1-CD1 4.41Å; I136-I157 HydrophobicContact CD1-CG1 4.16Å; I136-I157 HydrophobicContact CG1-CG1 4.31Å; I157-V159 HydrophobicContact CG2-CG2 4.2Å; I157-T169 HydrophobicContact CG2-CG2 4.36Å; I157-S170 WeakPolarHBondContact CA-O 3.42Å; I157-I171 HydrophobicContact CD1-CB 4.2Å; I157-I171 HydrophobicContact CD1-CG1 3.51Å
158	H	81.4	Confident	83.1	Confident	8 Å²	8	33.1 Å²	33.1	4%	0.037	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	131.5	162.1	179.5	74.3	0	0	0	107.6	E165 V167 T169 S170 M172	H158-E165 IonicContact CE1-OE2 3.13Å; H158-E165 IonicContact NE2-OE2 3.66Å; H158-V167 PolarHBondContact CD2-O 2.8Å; H158-V167 PolarHBondContact NE2-O 3.33Å; H158-T169 CarbonylContact O-C 3.59Å; H158-T169 WeakPolarHBondContact O-CA 3.21Å; H158-T169 WeakPolarHBondContact O-CG2 3.37Å; H158-S170 PolarHBondContact N-O 2.89Å; H158-S170 PolarHBondContact O-N 2.93Å; H158-M172 HydrophobicContact CB-CB 4.19Å; H158-M172 HydrophobicContact CB-SD 4.26Å
159	V	86.9	Confident	83.3	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.158	C	C	.	.			trans	-116.6	122.3	173.8	176.7	0	0	0	0	105.9	C55 V118 V120 R129 V134 I157 I161 T169	C55-V159 HydrophobicContact CB-CG1 4.03Å; C55-V159 WeakPolarHBondContact O-CG1 3.48Å; V118-V159 HydrophobicContact CG1-CB 4.17Å; V118-V159 HydrophobicContact CG1-CG1 3.68Å; V118-V159 HydrophobicContact CG1-CG2 3.44Å; V118-V159 VanDerWaalsContact CG1-CG2 3.44Å; V120-V159 HydrophobicContact CG2-CG1 4.35Å; R129-V159 PolarHBondContact NH1-O 2.92Å; R129-V159 PolarHBondContact NH2-O 2.86Å; V134-V159 HydrophobicContact CB-CG2 4.33Å; V134-V159 HydrophobicContact CG2-CG2 4.09Å; I157-V159 HydrophobicContact CG2-CG2 4.2Å; V159-I161 HydrophobicContact CB-CG2 4.4Å; V159-I161 HydrophobicContact CG1-CG2 3.91Å; V159-I161 PolarHBondContact O-N 3.23Å; V159-T169 WeakPolarHBondContact CA-OG1 3.44Å; V159-T169 HydrophobicContact CG2-CG2 4.45Å
160	K	84.8	Confident	83.3	Confident	33 Å²	33	33.2 Å²	33.2	14%	0.143	16%	0.162	C	C	.	.			trans	-71.4	115.5	176.2	-177.9	171.6	175.2	157.9	0	109.3	M54 C55 R162 E163 E165 T169	M54-K160 HydrophobicContact CG-CB 4.38Å; M54-K160 HydrophobicContact CG-CD 3.94Å; M54-K160 HydrophobicContact CG-CG 3.74Å; M54-K160 HydrophobicContact SD-CG 4.25Å; C55-K160 VanDerWaalsContact CA-O 3.29Å; C55-K160 WeakPolarHBondContact CA-O 3.26Å; K160-R162 WeakPolarHBondContact CE-O 3.44Å; K160-E163 PolarHBondContact NZ-O 3.42Å; K160-E163 VanDerWaalsContact NZ-O 3.16Å; K160-E165 WeakPolarHBondContact CA-OE2 3.46Å; K160-E165 WeakPolarHBondContact CE-O 3.33Å; K160-E165 HydrophobicContact CG-CB 4.09Å; K160-E165 PolarHBondContact NZ-O 3.34Å; K160-T169 PolarHBondContact N-OG1 2.98Å
161	I	83.7	Confident	83	Confident	14 Å²	14	33.8 Å²	33.8	7%	0.072	17%	0.165	C	C	.	.			trans	-117.9	-5.3	-178.1	75.7	-166.7	0	0	0	113.3	M54 V120 C123 R129 V159 E165	M54-I161 WeakPolarHBondContact CE-O 3.4Å; V120-I161 HydrophobicContact CB-CG2 4.37Å; V120-I161 HydrophobicContact CG1-CG2 3.61Å; C123-I161 HydrophobicContact CB-CD1 3.8Å; R129-I161 VanDerWaalsContact NH2-CG1 3.29Å; V159-I161 HydrophobicContact CB-CG2 4.4Å; V159-I161 HydrophobicContact CG1-CG2 3.91Å; V159-I161 PolarHBondContact O-N 3.23Å; I161-E165 PolarHBondContact N-OE2 2.9Å
162	R	80.9	Confident	82.4	Confident	29 Å²	29	34 Å²	34	11%	0.109	17%	0.166	C	C	.	.	S	Bend	trans	-132	147.7	176.1	-53.2	-178.7	-177.2	142.6	9	109.9	C123 D125 T127 K160 E164 E165	C123-R162 PolarHBondContact O-NE 3.47Å; C123-R162 PolarHBondContact O-NH2 3.24Å; C123-R162 PolarHBondContact SG-NH2 3.45Å; D125-R162 PolarHBondContact O-NH1 3.35Å; D125-R162 PolarHBondContact O-NH2 3.26Å; T127-R162 PolarHBondContact O-NH1 3.02Å; K160-R162 WeakPolarHBondContact CE-O 3.44Å; R162-E164 VanDerWaalsContact C-N 3.25Å; R162-E164 WeakPolarHBondContact CB-OE2 3.38Å; R162-E164 PolarHBondContact O-N 2.93Å; R162-E165 HydrophobicContact CB-CG 4.15Å; R162-E165 PolarHBondContact N-OE2 3Å; R162-E165 PolarHBondContact O-N 3.46Å
163	E	79.8	Confident	81.5	Confident	164 Å²	164	35.3 Å²	35.3	77%	0.766	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-36.4	178.8	-76.2	-172.7	163.8	0	0	111.6	M54 K160 E165	M54-E163 HydrophobicContact SD-CG 3.94Å; M54-E163 PolarHBondContact SD-N 2.95Å; K160-E163 PolarHBondContact NZ-O 3.42Å; K160-E163 VanDerWaalsContact NZ-O 3.16Å; E163-E165 PolarHBondContact O-N 2.8Å
164	E	78.8	Confident	80.9	Confident	105 Å²	105	35.7 Å²	35.7	49%	0.491	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.1	-179.6	-39.8	92.2	-139.6	0	0	113.7	H126 R162 H166	H126-E164 VanDerWaalsContact CE1-CD 3.48Å; H126-E164 IonicContact CE1-OE1 2.8Å; H126-E164 IonicContact CE1-OE2 2.69Å; H126-E164 PolarHBondContact CE1-OE2 3.42Å; H126-E164 IonicContact ND1-OE2 3.64Å; H126-E164 PolarHBondContact ND1-OE2 2.98Å; H126-E164 VanDerWaalsContact ND1-OE2 3.13Å; R162-E164 VanDerWaalsContact C-N 3.25Å; R162-E164 WeakPolarHBondContact CB-OE2 3.38Å; R162-E164 PolarHBondContact O-N 2.93Å; E164-H166 PolarHBondContact O-N 2.97Å; E164-H166 VanDerWaalsContact O-N 3.16Å
165	E	73.3	Confident	80.5	Confident	32 Å²	32	35.7 Å²	35.7	15%	0.15	17%	0.173	C	C	.	.			trans	-69.6	115.5	179.7	-74.1	176	157.7	0	0	110.4	R129 H158 K160 I161 R162 E163 V167	R129-E165 IonicContact CZ-OE1 3.77Å; R129-E165 IonicContact CZ-OE2 2.87Å; R129-E165 IonicContact NE-OE1 3.96Å; R129-E165 PolarHBondContact NE-OE1 3.13Å; R129-E165 IonicContact NH2-OE1 3.61Å; R129-E165 PolarHBondContact NH2-OE1 3.37Å; R129-E165 IonicContact NH2-OE2 3.14Å; R129-E165 PolarHBondContact NH2-OE2 3.22Å; H158-E165 IonicContact CE1-OE2 3.13Å; H158-E165 IonicContact NE2-OE2 3.66Å; K160-E165 WeakPolarHBondContact CA-OE2 3.46Å; K160-E165 WeakPolarHBondContact CE-O 3.33Å; K160-E165 HydrophobicContact CG-CB 4.09Å; K160-E165 PolarHBondContact NZ-O 3.34Å; I161-E165 PolarHBondContact N-OE2 2.9Å; R162-E165 HydrophobicContact CB-CG 4.15Å; R162-E165 PolarHBondContact N-OE2 3Å; R162-E165 PolarHBondContact O-N 3.46Å; E163-E165 PolarHBondContact O-N 2.8Å; E165-V167 PolarHBondContact O-N 2.87Å
166	H	72.8	Confident	80.2	Confident	135 Å²	135	38 Å²	38	63%	0.625	18%	0.181	S	C	*	.	S	Bend	trans	-73	-9.9	179.8	-62	-61.5	0	0	0	114	E164 E234	E164-H166 PolarHBondContact O-N 2.97Å; E164-H166 VanDerWaalsContact O-N 3.16Å; H166-E234 IonicContact NE2-OE1 3.83Å
167	V	70.1	Confident	80.1	Confident	22 Å²	22	38.2 Å²	38.2	13%	0.133	18%	0.183	C	C	.	.	S	Bend	trans	-101.5	120.8	179.6	-174.7	0	0	0	0	108.2	H158 E165	H158-V167 PolarHBondContact CD2-O 2.8Å; H158-V167 PolarHBondContact NE2-O 3.33Å; E165-V167 PolarHBondContact O-N 2.87Å
168	N	78.7	Confident	80.1	Confident	111 Å²	111	38.2 Å²	38.2	59%	0.594	18%	0.182	S	C	*	.	P	Polyproline II helix	trans	-71.9	160.8	172.9	-70.9	-29.4	0	0	0	110.8	S170	N168-S170 WeakPolarHBondContact O-CB 3.41Å; N168-S170 PolarHBondContact O-N 3.42Å; N168-S170 VanDerWaalsContact O-N 3.07Å; N168-S170 PolarHBondContact O-OG 2.66Å
169	T	84.5	Confident	80.2	Confident	10 Å²	10	39.3 Å²	39.3	6%	0.061	19%	0.19	C	C	.	.	S	Bend	trans	-52.1	118.4	173.7	-64.2	0	0	0	0	110.3	F47 P49 C55 I59 I157 H158 V159 K160	F47-T169 HydrophobicContact CZ-CG2 4.21Å; P49-T169 HydrophobicContact CB-CG2 3.92Å; P49-T169 WeakPolarHBondContact CG-O 3.42Å; C55-T169 VanDerWaalsContact C-OG1 3.27Å; C55-T169 WeakPolarHBondContact O-CG2 3.21Å; C55-T169 PolarHBondContact O-OG1 3.01Å; I59-T169 HydrophobicContact CD1-CG2 3.91Å; I59-T169 HydrophobicContact CG1-CG2 4.32Å; I157-T169 HydrophobicContact CG2-CG2 4.36Å; H158-T169 CarbonylContact O-C 3.59Å; H158-T169 WeakPolarHBondContact O-CA 3.21Å; H158-T169 WeakPolarHBondContact O-CG2 3.37Å; V159-T169 WeakPolarHBondContact CA-OG1 3.44Å; V159-T169 HydrophobicContact CG2-CG2 4.45Å; K160-T169 PolarHBondContact N-OG1 2.98Å
170	S	80.8	Confident	80.1	Confident	22 Å²	22	44.6 Å²	44.6	15%	0.154	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	160.8	-170.4	53.9	0	0	0	0	112	I157 H158 N168 M172	I157-S170 WeakPolarHBondContact CA-O 3.42Å; H158-S170 PolarHBondContact N-O 2.89Å; H158-S170 PolarHBondContact O-N 2.93Å; N168-S170 WeakPolarHBondContact O-CB 3.41Å; N168-S170 PolarHBondContact O-N 3.42Å; N168-S170 VanDerWaalsContact O-N 3.07Å; N168-S170 PolarHBondContact O-OG 2.66Å; S170-M172 PolarHBondContact O-N 2.69Å
171	I	77.8	Confident	80	Confident	14 Å²	14	47 Å²	47	7%	0.072	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	119.9	167.1	-61.3	169.3	0	0	0	107.8	I44 F47 Y155 I157 I174	I44-I171 HydrophobicContact CG2-CD1 4.26Å; F47-I171 HydrophobicContact CB-CD1 3.67Å; F47-I171 HydrophobicContact CB-CG1 4.18Å; F47-I171 HydrophobicContact CD1-CG1 4.32Å; F47-I171 HydrophobicContact CD2-CD1 3.92Å; F47-I171 HydrophobicContact CD2-CG1 3.66Å; F47-I171 HydrophobicContact CE2-CG1 4.07Å; F47-I171 HydrophobicContact CG-CD1 3.87Å; F47-I171 HydrophobicContact CG-CG1 3.81Å; Y155-I171 HydrophobicContact CD1-CD1 3.94Å; Y155-I171 HydrophobicContact CD1-CG1 4.41Å; Y155-I171 HydrophobicContact CD1-CG2 3.9Å; Y155-I171 HydrophobicContact CE1-CD1 4.35Å; I157-I171 HydrophobicContact CD1-CB 4.2Å; I157-I171 HydrophobicContact CD1-CG1 3.51Å; I171-I174 HydrophobicContact CG2-CD1 4.32Å; I171-I174 HydrophobicContact CG2-CG1 3.91Å
172	M	76.1	Confident	79.6	Confident	10 Å²	10	51.1 Å²	51.1	5%	0.049	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-45.7	-177.1	-170.8	177.6	58.7	0	0	112	Y132 I156 H158 S170 L231	Y132-M172 HydrophobicContact CD1-CE 4.23Å; Y132-M172 HydrophobicContact CE1-CE 3.74Å; I156-M172 HydrophobicContact CG2-CE 3.84Å; I156-M172 PolarHBondContact O-N 3.15Å; H158-M172 HydrophobicContact CB-CB 4.19Å; H158-M172 HydrophobicContact CB-SD 4.26Å; S170-M172 PolarHBondContact O-N 2.69Å; M172-L231 HydrophobicContact CE-CD2 3.89Å; M172-L231 HydrophobicContact SD-CD1 4.36Å; M172-L231 HydrophobicContact SD-CD2 3.53Å; M172-L231 VanDerWaalsContact SD-CD2 3.53Å; M172-L231 HydrophobicContact SD-CG 4.49Å
173	Y	74.2	Confident	79.4	Confident	27 Å²	27	51 Å²	51	11%	0.106	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	152.3	178.6	-58.9	-66.4	0	0	0	111.4	I156 C226 F228	I156-Y173 PolarHBondContact N-O 3.37Å; I156-Y173 PolarHBondContact O-N 2.85Å; Y173-C226 PolarHBondContact OH-O 3.26Å; Y173-F228 AromaticContact CD2-CD2 3.81Å; Y173-F228 HydrophobicContact CD2-CD2 3.81Å; Y173-F228 AromaticContact CD2-CE2 3.86Å; Y173-F228 HydrophobicContact CD2-CE2 3.86Å; Y173-F228 HydrophobicContact CE1-CD2 4.33Å; Y173-F228 AromaticContact CE2-CD2 3.3Å; Y173-F228 HydrophobicContact CE2-CD2 3.3Å; Y173-F228 AromaticContact CE2-CE2 3.82Å; Y173-F228 HydrophobicContact CE2-CE2 3.82Å; Y173-F228 HydrophobicContact CE2-CG 4.37Å; Y173-F228 AromaticContact CZ-CD2 3.62Å; Y173-F228 WeakPolarHBondContact OH-CA 3.45Å; Y173-F228 PolarHBondContact OH-N 2.78Å
174	I	78	Confident	79	Confident	10 Å²	10	45.1 Å²	45.1	5%	0.051	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131.9	173.1	-54.1	174.4	0	0	0	107.9	T153 C154 Y155 I171 P186 F190	T153-I174 HydrophobicContact CG2-CG2 3.88Å; C154-I174 CarbonylContact O-C 3.58Å; C154-I174 VanDerWaalsContact O-CA 3.31Å; C154-I174 WeakPolarHBondContact O-CA 3.37Å; Y155-I174 HydrophobicContact CD1-CD1 3.91Å; Y155-I174 HydrophobicContact CD1-CG1 3.68Å; Y155-I174 HydrophobicContact CD1-CG2 4.44Å; Y155-I174 HydrophobicContact CE1-CD1 3.51Å; Y155-I174 HydrophobicContact CE1-CG1 3.77Å; Y155-I174 HydrophobicContact CE1-CG2 4.19Å; I171-I174 HydrophobicContact CG2-CD1 4.32Å; I171-I174 HydrophobicContact CG2-CG1 3.91Å; I174-P186 HydrophobicContact CB-CG 3.98Å; I174-P186 HydrophobicContact CG2-CG 3.89Å; I174-P186 WeakPolarHBondContact O-CD 3.34Å; I174-F190 HydrophobicContact CD1-CD2 3.28Å; I174-F190 HydrophobicContact CD1-CE2 3.6Å; I174-F190 HydrophobicContact CD1-CG 4.26Å
175	Y	84.6	Confident	78.6	Confident	1 Å²	1	42.1 Å²	42.1	0%	0.004	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	135.3	172.8	-62.6	-74.9	0	0	0	109.8	L86 T153 C154 I156 L183 T185 F228 I278	L86-Y175 HydrophobicContact CD1-CD2 4Å; L86-Y175 HydrophobicContact CD1-CE2 4.06Å; L86-Y175 HydrophobicContact CD1-CG 4.31Å; L86-Y175 HydrophobicContact CD2-CD2 4.31Å; L86-Y175 HydrophobicContact CD2-CG 4.16Å; T153-Y175 CarbonylContact C-O 3.52Å; T153-Y175 WeakPolarHBondContact CA-O 3.38Å; C154-Y175 PolarHBondContact N-O 2.87Å; C154-Y175 PolarHBondContact O-N 3.33Å; I156-Y175 HydrophobicContact CD1-CD2 4.21Å; I156-Y175 HydrophobicContact CD1-CE2 4.24Å; I156-Y175 HydrophobicContact CG1-CD2 3.98Å; I156-Y175 HydrophobicContact CG1-CE2 3.71Å; Y175-L183 HydrophobicContact CD1-CD1 4.19Å; Y175-L183 HydrophobicContact CG-CD1 4.45Å; Y175-T185 WeakPolarHBondContact CD1-OG1 3.3Å; Y175-T185 WeakPolarHBondContact CE1-OG1 3.27Å; Y175-F228 WeakPolarHBondContact OH-CE2 3.34Å; Y175-I278 HydrophobicContact CE1-CD1 4.21Å; Y175-I278 HydrophobicContact CE1-CG2 4.45Å; Y175-I278 VanDerWaalsContact OH-CD1 3.23Å; Y175-I278 WeakPolarHBondContact OH-CD1 3.46Å
176	W	83.4	Confident	78	Confident	49 Å²	49	41.6 Å²	41.6	19%	0.186	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	126.4	172.1	-64.1	-16.4	0	0	0	108.5	N40 I150 I152 L183 L184 P186	N40-W176 VanDerWaalsContact ND2-CE2 3.29Å; N40-W176 PolarHBondContact ND2-NE1 2.72Å; N40-W176 VanDerWaalsContact ND2-NE1 3.15Å; I150-W176 HydrophobicContact CD1-CB 4.31Å; I150-W176 HydrophobicContact CD1-CD2 3.84Å; I150-W176 HydrophobicContact CD1-CE3 3.36Å; I150-W176 HydrophobicContact CD1-CG 4.26Å; I150-W176 HydrophobicContact CD1-CZ3 3.89Å; I150-W176 HydrophobicContact CG1-CB 4.22Å; I150-W176 HydrophobicContact CG1-CE3 4.45Å; I150-W176 HydrophobicContact CG2-CB 3.72Å; I150-W176 HydrophobicContact CG2-CD2 4.44Å; I150-W176 HydrophobicContact CG2-CG 3.88Å; I152-W176 WeakPolarHBondContact O-CA 3.28Å; W176-L183 CarbonylContact O-C 3.55Å; W176-L183 WeakPolarHBondContact O-CA 3.31Å; W176-L184 HydrophobicContact CB-CB 4.17Å; W176-L184 PolarHBondContact N-O 3.32Å; W176-L184 PolarHBondContact O-N 2.83Å; W176-P186 HydrophobicContact CD2-CB 4.22Å; W176-P186 HydrophobicContact CD2-CG 3.8Å; W176-P186 HydrophobicContact CE3-CB 4.09Å; W176-P186 HydrophobicContact CE3-CG 4.17Å; W176-P186 HydrophobicContact CG-CG 4.38Å; W176-P186 HydrophobicContact CH2-CB 3.65Å; W176-P186 HydrophobicContact CH2-CG 4.08Å; W176-P186 HydrophobicContact CZ2-CB 3.76Å; W176-P186 HydrophobicContact CZ2-CG 3.67Å; W176-P186 HydrophobicContact CZ3-CB 3.82Å; W176-P186 HydrophobicContact CZ3-CG 4.31Å
177	K	86.4	Confident	76.7	Confident	6 Å²	6	42.4 Å²	42.4	3%	0.026	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.2	168.1	-159.4	74.3	167.2	-179.2	0	108.3	L86 S88 H90 L93 N151 I152 N181 R182 L183	L86-K177 PolarHBondContact O-NZ 2.82Å; S88-K177 WeakPolarHBondContact O-CE 3.4Å; S88-K177 PolarHBondContact O-NZ 2.87Å; H90-K177 HydrophobicContact CB-CG 4.3Å; L93-K177 HydrophobicContact CD2-CB 3.77Å; L93-K177 HydrophobicContact CD2-CD 4.06Å; L93-K177 HydrophobicContact CD2-CG 3.84Å; N151-K177 PolarHBondContact N-O 3.28Å; N151-K177 PolarHBondContact OD1-O 2.89Å; I152-K177 HydrophobicContact CB-CB 3.97Å; I152-K177 HydrophobicContact CD1-CB 4.44Å; I152-K177 PolarHBondContact N-O 2.78Å; I152-K177 PolarHBondContact O-N 2.88Å; K177-N181 WeakPolarHBondContact CE-O 3.46Å; K177-N181 PolarHBondContact NZ-O 3.3Å; K177-R182 WeakPolarHBondContact CA-O 3.39Å; K177-L183 HydrophobicContact CD-CB 4.32Å; K177-L183 HydrophobicContact CD-CD1 4.21Å
178	T	84.5	Confident	75.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	160.3	173.9	75.1	0	0	0	0	111.3	L38 E148 E149 I150 W180 N181 R182 L184	L38-T178 HydrophobicContact CD1-CG2 4.36Å; E148-T178 HydrophobicContact CG-CG2 4.14Å; E148-T178 WeakPolarHBondContact OE1-CB 3.35Å; E148-T178 VanDerWaalsContact OE1-CG2 3.27Å; E148-T178 WeakPolarHBondContact OE1-CG2 3.21Å; E148-T178 PolarHBondContact OE1-OG1 2.91Å; E149-T178 CarbonylContact O-C 3.53Å; E149-T178 WeakPolarHBondContact O-CA 3.36Å; E149-T178 WeakPolarHBondContact O-CB 3.11Å; I150-T178 HydrophobicContact CG1-CG2 4.04Å; T178-W180 PolarHBondContact O-N 2.96Å; T178-W180 PolarHBondContact OG1-N 2.87Å; T178-N181 PolarHBondContact O-N 3.42Å; T178-R182 HydrophobicContact CG2-CB 4.19Å; T178-R182 PolarHBondContact N-O 3.42Å; T178-R182 WeakPolarHBondContact OG1-CB 3.2Å; T178-R182 PolarHBondContact OG1-N 3.42Å; T178-L184 HydrophobicContact CG2-CD1 3.88Å; T178-L184 HydrophobicContact CG2-CG 4.49Å
179	T	83.9	Confident	73.2	Confident	31 Å²	31	46.6 Å²	46.6	19%	0.19	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-21.6	170.6	47.5	0	0	0	0	113.2	E149 N151 N181	E149-T179 HydrophobicContact CG-CG2 3.78Å; E149-T179 PolarHBondContact N-OG1 3Å; E149-T179 PolarHBondContact O-N 3.32Å; N151-T179 HydrophobicContact CB-CG2 4.42Å; N151-T179 WeakPolarHBondContact ND2-CG2 3.23Å; T179-N181 VanDerWaalsContact C-N 3.33Å
180	W	84.8	Confident	70.7	Confident	112 Å²	112	49.9 Å²	49.9	42%	0.424	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	22.1	179.4	-65.6	10.7	0	0	0	112.9	V33 E148 T178 R182	V33-W180 HydrophobicContact CB-CZ3 4.1Å; V33-W180 HydrophobicContact CG1-CE3 4.27Å; V33-W180 HydrophobicContact CG1-CH2 3.8Å; V33-W180 HydrophobicContact CG1-CZ3 3.31Å; V33-W180 HydrophobicContact CG2-CE3 4.4Å; V33-W180 HydrophobicContact CG2-CZ3 3.66Å; E148-W180 HydrophobicContact CB-CD2 3.61Å; E148-W180 HydrophobicContact CB-CE3 3.99Å; E148-W180 HydrophobicContact CB-CG 3.92Å; E148-W180 HydrophobicContact CB-CZ2 4.22Å; E148-W180 HydrophobicContact CB-CZ3 4.47Å; E148-W180 HydrophobicContact CG-CB 3.97Å; E148-W180 HydrophobicContact CG-CD2 3.91Å; E148-W180 HydrophobicContact CG-CE3 4.29Å; E148-W180 HydrophobicContact CG-CG 3.77Å; T178-W180 PolarHBondContact O-N 2.96Å; T178-W180 PolarHBondContact OG1-N 2.87Å; W180-R182 PolarHBondContact O-N 3.48Å; W180-R182 VanDerWaalsContact O-N 3.16Å
181	N	82.2	Confident	68.1	Low	82 Å²	82	52 Å²	52	44%	0.439	25%	0.249	S	C	.	.	S	Bend	trans	65.9	8.7	178.3	-55.7	-42	0	0	0	115.4	D89 H90 K177 T178 T179 L183	D89-N181 WeakPolarHBondContact CA-OD1 3.28Å; H90-N181 WeakPolarHBondContact CB-OD1 3.24Å; H90-N181 PolarHBondContact N-OD1 3.18Å; K177-N181 WeakPolarHBondContact CE-O 3.46Å; K177-N181 PolarHBondContact NZ-O 3.3Å; T178-N181 PolarHBondContact O-N 3.42Å; T179-N181 VanDerWaalsContact C-N 3.33Å; N181-L183 PolarHBondContact O-N 2.81Å
182	R	75.4	Confident	65.7	Low	102 Å²	102	52.9 Å²	52.9	39%	0.385	26%	0.258	S	S	.	.			trans	-73.6	128	175.3	-68.9	176.8	47.7	-158	9.7	109.4	E148 K177 T178 W180	E148-R182 WeakPolarHBondContact OE1-CD 3.35Å; E148-R182 IonicContact OE1-CZ 3.19Å; E148-R182 IonicContact OE1-NE 3.78Å; E148-R182 IonicContact OE1-NH1 3.86Å; E148-R182 PolarHBondContact OE1-NH1 2.8Å; E148-R182 IonicContact OE2-CZ 2.73Å; E148-R182 IonicContact OE2-NH1 3.85Å; E148-R182 PolarHBondContact OE2-NH1 2.84Å; K177-R182 WeakPolarHBondContact CA-O 3.39Å; T178-R182 HydrophobicContact CG2-CB 4.19Å; T178-R182 PolarHBondContact N-O 3.42Å; T178-R182 WeakPolarHBondContact OG1-CB 3.2Å; T178-R182 PolarHBondContact OG1-N 3.42Å; W180-R182 PolarHBondContact O-N 3.48Å; W180-R182 VanDerWaalsContact O-N 3.16Å
183	L	77.8	Confident	63.4	Low	26 Å²	26	54.6 Å²	54.6	14%	0.136	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	126.1	169.2	-177.1	66.6	0	0	0	107.7	L86 Y175 W176 K177 N181 I278	L86-L183 HydrophobicContact CB-CD2 4.42Å; L86-L183 HydrophobicContact CD2-CD1 4.14Å; Y175-L183 HydrophobicContact CD1-CD1 4.19Å; Y175-L183 HydrophobicContact CG-CD1 4.45Å; W176-L183 CarbonylContact O-C 3.55Å; W176-L183 WeakPolarHBondContact O-CA 3.31Å; K177-L183 HydrophobicContact CD-CB 4.32Å; K177-L183 HydrophobicContact CD-CD1 4.21Å; N181-L183 PolarHBondContact O-N 2.81Å; L183-I278 HydrophobicContact CD2-CG2 4.06Å
184	L	71.1	Confident	61.4	Low	40 Å²	40	58.6 Å²	58.6	21%	0.209	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	142.5	178.8	-50.7	169.4	0	0	0	108.3	L38 W176 T178	L38-L184 HydrophobicContact CD1-CD1 3.51Å; W176-L184 HydrophobicContact CB-CB 4.17Å; W176-L184 PolarHBondContact N-O 3.32Å; W176-L184 PolarHBondContact O-N 2.83Å; T178-L184 HydrophobicContact CG2-CD1 3.88Å; T178-L184 HydrophobicContact CG2-CG 4.49Å
185	T	70.6	Confident	59.1	Low	42 Å²	42	65 Å²	65	26%	0.258	33%	0.333	S	S	.	.			trans	-116.2	99.7	171	-62.3	0	0	0	0	106.7	Y175 Q187 H247	Y175-T185 WeakPolarHBondContact CD1-OG1 3.3Å; Y175-T185 WeakPolarHBondContact CE1-OG1 3.27Å; T185-Q187 PolarHBondContact O-N 3.44Å; T185-H247 PolarHBondContact OG1-CD2 3Å
186	P	61.1	Low	56.4	Low	21 Å²	21	69.3 Å²	69.3	14%	0.136	37%	0.368	C	S	.	.			trans	-59.3	127.1	174.9	27.9	-37.4	0	0	0	108.8	I174 W176 I188	I174-P186 HydrophobicContact CB-CG 3.98Å; I174-P186 HydrophobicContact CG2-CG 3.89Å; I174-P186 WeakPolarHBondContact O-CD 3.34Å; W176-P186 HydrophobicContact CD2-CB 4.22Å; W176-P186 HydrophobicContact CD2-CG 3.8Å; W176-P186 HydrophobicContact CE3-CB 4.09Å; W176-P186 HydrophobicContact CE3-CG 4.17Å; W176-P186 HydrophobicContact CG-CG 4.38Å; W176-P186 HydrophobicContact CH2-CB 3.65Å; W176-P186 HydrophobicContact CH2-CG 4.08Å; W176-P186 HydrophobicContact CZ2-CB 3.76Å; W176-P186 HydrophobicContact CZ2-CG 3.67Å; W176-P186 HydrophobicContact CZ3-CB 3.82Å; W176-P186 HydrophobicContact CZ3-CG 4.31Å; P186-I188 PolarHBondContact O-N 2.85Å
187	Q	45.4	Very low	53.8	Low	152 Å²	152	73 Å²	73	71%	0.71	39%	0.392	S	S	*	.			trans	-78.7	24.7	-178.8	-141.1	177.7	10	0	0	112.6	T185 L189	T185-Q187 PolarHBondContact O-N 3.44Å; Q187-L189 PolarHBondContact O-N 3.44Å
188	I	42	Very low	51	Low	102 Å²	102	78 Å²	78	52%	0.523	43%	0.427	S	S	.	.			trans	-89.5	103.7	-177.6	-56.6	178	0	0	0	107.8	P186 F190	P186-I188 PolarHBondContact O-N 2.85Å; I188-F190 VanDerWaalsContact C-N 3.33Å; I188-F190 HydrophobicContact CB-CD2 4.16Å; I188-F190 HydrophobicContact CB-CE2 3.74Å; I188-F190 HydrophobicContact CB-CZ 4.31Å; I188-F190 HydrophobicContact CG2-CD2 3.9Å; I188-F190 HydrophobicContact CG2-CE1 4.26Å; I188-F190 HydrophobicContact CG2-CE2 3.6Å; I188-F190 HydrophobicContact CG2-CG 4.38Å; I188-F190 HydrophobicContact CG2-CZ 3.8Å; I188-F190 WeakPolarHBondContact O-CD2 3.41Å; I188-F190 PolarHBondContact O-N 2.76Å
189	L	33.1	Very low	48.4	Very low	120 Å²	120	85 Å²	85	63%	0.628	46%	0.463	S	S	*	.			trans	-49.3	92.3	158.7	-75	138	0	0	0	109.2	Q187 D191 W223	Q187-L189 PolarHBondContact O-N 3.44Å; L189-D191 PolarHBondContact O-N 3.07Å; L189-W223 HydrophobicContact CD2-CD2 4.43Å; L189-W223 HydrophobicContact CD2-CE3 3.32Å; L189-W223 HydrophobicContact CD2-CH2 4.22Å; L189-W223 HydrophobicContact CD2-CZ3 3.2Å; L189-W223 HydrophobicContact CG-CZ3 4.4Å
190	F	30.8	Very low	45.7	Very low	79 Å²	79	90.8 Å²	90.8	35%	0.346	49%	0.493	S	S	.	.			trans	-82.6	96	167.8	-75.7	-83.9	0	0	0	108.1	I174 I188 A192	I174-F190 HydrophobicContact CD1-CD2 3.28Å; I174-F190 HydrophobicContact CD1-CE2 3.6Å; I174-F190 HydrophobicContact CD1-CG 4.26Å; I188-F190 VanDerWaalsContact C-N 3.33Å; I188-F190 HydrophobicContact CB-CD2 4.16Å; I188-F190 HydrophobicContact CB-CE2 3.74Å; I188-F190 HydrophobicContact CB-CZ 4.31Å; I188-F190 HydrophobicContact CG2-CD2 3.9Å; I188-F190 HydrophobicContact CG2-CE1 4.26Å; I188-F190 HydrophobicContact CG2-CE2 3.6Å; I188-F190 HydrophobicContact CG2-CG 4.38Å; I188-F190 HydrophobicContact CG2-CZ 3.8Å; I188-F190 WeakPolarHBondContact O-CD2 3.41Å; I188-F190 PolarHBondContact O-N 2.76Å; F190-A192 VanDerWaalsContact C-N 3.35Å; F190-A192 PolarHBondContact O-N 3.37Å; F190-A192 VanDerWaalsContact O-N 3.13Å
191	D	27.6	Very low	42.9	Very low	66 Å²	66	93.4 Å²	93.4	35%	0.353	51%	0.51	S	S	.	.			trans	-65.3	97.8	156.9	-168.6	5.1	0	0	0	107.2	L189 G193	L189-D191 PolarHBondContact O-N 3.07Å; D191-G193 VanDerWaalsContact C-N 3.26Å; D191-G193 PolarHBondContact OD1-N 3.48Å
192	A	27.6	Very low	40.3	Very low	32 Å²	32	95.8 Å²	95.8	26%	0.264	53%	0.528	S	S	.	.			trans	-97.9	42.9	168.4	0	0	0	0	0	110.4	F47 F190	F47-A192 HydrophobicContact CB-CB 3.68Å; F47-A192 HydrophobicContact CD1-CB 4.11Å; F47-A192 HydrophobicContact CG-CB 4.32Å; F47-A192 VanDerWaalsContact O-O 3.14Å; F190-A192 VanDerWaalsContact C-N 3.35Å; F190-A192 PolarHBondContact O-N 3.37Å; F190-A192 VanDerWaalsContact O-N 3.13Å
193	G	27.5	Very low	38.1	Very low	47 Å²	47	97.7 Å²	97.7	49%	0.485	55%	0.551	S	S	.	*			trans	-80.8	136.7	163.9	0	0	0	0	0	110.8	D191	D191-G193 VanDerWaalsContact C-N 3.26Å; D191-G193 PolarHBondContact OD1-N 3.48Å
194	E	32	Very low	35.6	Very low	111 Å²	111	103.5 Å²	103.5	52%	0.519	58%	0.581	S	S	.	*			trans	-59.1	136.1	-175	-69.4	179.1	141.1	0	0	114.1	Q48 A196	Q48-E194 HydrophobicContact CG-CG 4.3Å; E194-A196 PolarHBondContact O-N 3.47Å
195	N	29.5	Very low	33.3	Very low	145 Å²	145	109.1 Å²	109.1	78%	0.775	61%	0.61	S	S	*	*			trans	-72.9	98	151.2	-75.7	-38.9	0	0	0	108	N197	N195-N197 PolarHBondContact O-N 3.28Å
196	A	27.2	Very low	31.2	Very low	90 Å²	90	112 Å²	112	74%	0.744	63%	0.629	S	S	*	*			trans	-69.5	79	162.7	0	0	0	0	0	109.1	E194 S198	E194-A196 PolarHBondContact O-N 3.47Å; A196-S198 PolarHBondContact O-N 2.78Å
197	N	29	Very low	29.5	Very low	128 Å²	128	119.9 Å²	119.9	68%	0.684	67%	0.667	S	S	*	*			trans	-77.1	100.6	163.1	-80.6	-18.1	0	0	0	107.5	N195 I199	N195-N197 PolarHBondContact O-N 3.28Å; N197-I199 VanDerWaalsContact C-N 3.29Å; N197-I199 PolarHBondContact O-N 3.25Å
198	S	27.3	Very low	28.3	Very low	109 Å²	109	121.6 Å²	121.6	76%	0.762	67%	0.672	S	S	*	*			trans	-56.2	100.3	151	56.7	0	0	0	0	107.4	A196 N200	A196-S198 PolarHBondContact O-N 2.78Å; S198-N200 VanDerWaalsContact C-N 3.33Å; S198-N200 PolarHBondContact O-N 3.4Å
199	I	31	Very low	27.4	Very low	147 Å²	147	122.9 Å²	122.9	75%	0.754	69%	0.685	S	S	*	*			trans	-70.7	96	170	-57.3	170.3	0	0	0	105.8	N197	N197-I199 VanDerWaalsContact C-N 3.29Å; N197-I199 PolarHBondContact O-N 3.25Å
200	N	26.7	Very low	27	Very low	153 Å²	153	124.2 Å²	124.2	82%	0.818	69%	0.691	S	S	*	*			trans	-82.7	125.1	149.1	-88.8	-11.5	0	0	0	107.1	S198	S198-N200 VanDerWaalsContact C-N 3.33Å; S198-N200 PolarHBondContact O-N 3.4Å
201	E	27	Very low	26.6	Very low	167 Å²	167	126.4 Å²	126.4	78%	0.78	71%	0.711	S	S	*	*			trans	-56.7	160.3	-177.9	-66.1	176.4	146.4	0	0	112.5
202	T	26.4	Very low	26.4	Very low	132 Å²	132	127.9 Å²	127.9	81%	0.81	73%	0.726	S	S	*	*			trans	81.6	92.7	175.1	69.9	0	0	0	0	116.1
203	T	28.5	Very low	26.5	Very low	142 Å²	142	135.5 Å²	135.5	87%	0.871	75%	0.75	S	S	*	*				-177.9	140	112.1	-57.5	0	0	0	0	109.4
204	I	25.8	Very low	26.4	Very low	148 Å²	148	139.7 Å²	139.7	76%	0.759	77%	0.766	S	S	*	*			trans	-92.4	142.8	-170.3	-68.7	164.9	0	0	0	111.2
205	L	23	Very low	26	Very low	158 Å²	158	141.2 Å²	141.2	83%	0.827	78%	0.777	S	S	*	*			trans	88.6	154.8	166	-67.5	147.5	0	0	0	119.2
206	P	27.7	Very low	25.9	Very low	102 Å²	102	141.5 Å²	141.5	66%	0.662	78%	0.779	S	S	*	*				-134.7	163.8	-52.2	34.3	-16.4	0	0	0	113.5
207	M	23.6	Very low	25.9	Very low	187 Å²	187	144 Å²	144	92%	0.921	78%	0.78	S	S	*	*			trans	36.1	85.4	149.4	-157	170.3	174.6	0	0	117.2
208	K	21.8	Very low	26	Very low	188 Å²	188	145.6 Å²	145.6	82%	0.817	78%	0.783	S	S	*	*			trans	-113	119.2	160.7	-97.8	-177.4	178	177.5	0	110.4	I210	K208-I210 HydrophobicContact CB-CG1 4.27Å; K208-I210 PolarHBondContact O-N 3.32Å
209	T	23.2	Very low	26.3	Very low	130 Å²	130	146.6 Å²	146.6	80%	0.798	78%	0.779	S	S	*	*			trans	-58.6	97.6	160.2	-39.2	0	0	0	0	107.8	T211	T209-T211 PolarHBondContact O-N 3.24Å
210	I	24.2	Very low	26.5	Very low	147 Å²	147	143 Å²	143	75%	0.754	77%	0.767	S	S	*	*			trans	-89.6	96.3	-177.9	-63.5	167.9	0	0	0	109.2	K208	K208-I210 HydrophobicContact CB-CG1 4.27Å; K208-I210 PolarHBondContact O-N 3.32Å
211	T	22.6	Very low	27	Very low	125 Å²	125	142.4 Å²	142.4	77%	0.767	75%	0.753	S	S	*	*			trans	-117.7	82	151.9	49.1	0	0	0	0	107.5	T209	T209-T211 PolarHBondContact O-N 3.24Å
212	S	23	Very low	27.7	Very low	97 Å²	97	139.7 Å²	139.7	68%	0.678	75%	0.748	S	S	*	*	S	Bend	trans	161.8	139.6	153.9	55.2	0	0	0	0	113.1
213	Y	30.1	Very low	28.6	Very low	193 Å²	193	136.9 Å²	136.9	76%	0.757	72%	0.723	S	S	*	*			trans	-32.6	132.7	158.7	-75.6	-99.5	0	0	0	115.5
214	T	25.1	Very low	29.9	Very low	135 Å²	135	135.2 Å²	135.2	83%	0.828	70%	0.7	S	S	*	*			trans	-151.8	119.4	144.8	41.1	0	0	0	0	110.2
215	N	24.6	Very low	31.6	Very low	142 Å²	142	129.8 Å²	129.8	76%	0.759	68%	0.675	S	S	*	*			trans	41.9	103.4	155.4	-85.2	-12.3	0	0	0	119.3
216	N	26.6	Very low	33.7	Very low	151 Å²	151	122.4 Å²	122.4	81%	0.807	64%	0.637	S	S	*	*				-151.6	135	106.3	-91.4	-21.7	0	0	0	110.7
217	N	27.1	Very low	35.9	Very low	142 Å²	142	117.6 Å²	117.6	76%	0.759	61%	0.605	S	S	*	*	S	Bend	trans	-59.7	146.4	179.6	-78.5	-31.2	0	0	0	111.3
218	E	31.5	Very low	38.2	Very low	162 Å²	162	108.8 Å²	108.8	76%	0.757	56%	0.562	S	S	*	*	S	Bend	trans	97.8	-30.4	166.7	-59.4	-170.7	151.3	0	0	120.1
219	I	33.9	Very low	40.5	Very low	131 Å²	131	102.3 Å²	102.3	67%	0.672	54%	0.536	S	S	*	.	S	Bend	trans	-99.8	-19.6	-169.1	-60.7	174.1	0	0	0	114.8	R221	I219-R221 PolarHBondContact O-N 3.21Å
220	S	35	Very low	42.8	Very low	72 Å²	72	98.2 Å²	98.2	50%	0.503	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	22.3	178.3	38.6	0	0	0	0	114.8
221	R	36.6	Very low	44.8	Very low	139 Å²	139	92.5 Å²	92.5	53%	0.525	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	2.5	-170.2	-74.9	-174.3	175.2	-173.8	-1.3	115.6	I219	I219-R221 PolarHBondContact O-N 3.21Å
222	T	42.1	Very low	47	Very low	110 Å²	110	88 Å²	88	68%	0.675	46%	0.456	S	S	*	.			trans	-97.2	-21.9	-165.2	59.5	0	0	0	0	115.4	R224	T222-R224 PolarHBondContact O-N 3.4Å
223	W	45.8	Very low	49	Very low	73 Å²	73	84.2 Å²	84.2	28%	0.277	43%	0.43	S	S	.	.			trans	-79.5	116	179.2	-164.7	91.2	0	0	0	111.5	L189 P225	L189-W223 HydrophobicContact CD2-CD2 4.43Å; L189-W223 HydrophobicContact CD2-CE3 3.32Å; L189-W223 HydrophobicContact CD2-CH2 4.22Å; L189-W223 HydrophobicContact CD2-CZ3 3.2Å; L189-W223 HydrophobicContact CG-CZ3 4.4Å; W223-P225 HydrophobicContact CH2-CB 4.21Å; W223-P225 HydrophobicContact CZ3-CB 3.88Å
224	R	55.7	Low	50.5	Low	107 Å²	107	82.1 Å²	82.1	40%	0.404	43%	0.427	S	S	.	.			trans	-109.2	130.2	178.1	-78.7	166.8	169.4	-141.1	5.9	108.5	T222 C226 I236	T222-R224 PolarHBondContact O-N 3.4Å; R224-C226 PolarHBondContact O-N 2.78Å; R224-I236 HydrophobicContact CB-CD1 3.49Å; R224-I236 VanDerWaalsContact CB-CD1 3.49Å; R224-I236 HydrophobicContact CB-CG1 3.99Å; R224-I236 VanDerWaalsContact CD-CD1 3.46Å; R224-I236 HydrophobicContact CG-CD1 3.5Å; R224-I236 VanDerWaalsContact CG-CD1 3.5Å; R224-I236 HydrophobicContact CG-CG1 4.45Å
225	P	59.8	Low	52.3	Low	35 Å²	35	76.5 Å²	76.5	23%	0.227	39%	0.393	C	S	.	.			trans	-56.4	135.8	174.1	24.4	-32	0	0	0	108.8	W223 I236 L239 L289	W223-P225 HydrophobicContact CH2-CB 4.21Å; W223-P225 HydrophobicContact CZ3-CB 3.88Å; P225-I236 HydrophobicContact CG-CG2 4.08Å; P225-I236 WeakPolarHBondContact O-CG1 3.43Å; P225-L239 HydrophobicContact CB-CD1 3.69Å; P225-L239 HydrophobicContact CG-CD1 4.12Å; P225-L239 WeakPolarHBondContact O-CD1 3.37Å; P225-L289 HydrophobicContact CB-CD1 4.19Å; P225-L289 HydrophobicContact CG-CD1 4.32Å
226	C	68	Low	54.1	Low	3 Å²	3	70.6 Å²	70.6	2%	0.02	36%	0.361	C	S	.	.			trans	-121.5	160.1	-177.6	57.1	0	0	0	0	110.9	Y173 R224 F228 S232	Y173-C226 PolarHBondContact OH-O 3.26Å; R224-C226 PolarHBondContact O-N 2.78Å; C226-F228 PolarHBondContact O-N 2.78Å; C226-S232 WeakPolarHBondContact CA-O 3.44Å; C226-S232 WeakPolarHBondContact CB-O 3.14Å
227	C	73.2	Confident	56	Low	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.342	C	S	.	.			trans	-68.2	128.5	177.7	171.3	0	0	0	0	110.4	I229 C230 L231 S232 L239 A249 I250 C251 C254	C227-I229 PolarHBondContact O-N 3.46Å; C227-I229 VanDerWaalsContact O-N 3.07Å; C227-I229 PolarHBondContact SG-N 3.5Å; C227-I229 VanDerWaalsContact SG-N 3.37Å; C227-C230 WeakPolarHBondContact CB-SG 3.45Å; C227-C230 VanDerWaalsContact SG-SG 3.64Å; C227-L231 WeakPolarHBondContact O-CA 3.36Å; C227-L231 WeakPolarHBondContact O-CD2 3.45Å; C227-L231 PolarHBondContact O-N 3.43Å; C227-S232 PolarHBondContact N-O 3.24Å; C227-L239 HydrophobicContact CB-CD2 3.84Å; C227-A249 CarbonylContact C-O 3.51Å; C227-I250 VanDerWaalsContact SG-CA 3.6Å; C227-C251 HydrophobicContact CB-CB 3.89Å; C227-C251 PolarHBondContact SG-N 2.84Å; C227-C254 VanDerWaalsContact SG-SG 3.7Å
228	F	73.5	Confident	58.3	Low	2 Å²	2	61.3 Å²	61.3	1%	0.009	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-27.1	178.4	-177.3	-102.1	0	0	0	114.8	H83 Y132 Y173 Y175 C226 A248 A249 I250 P277 I278	H83-F228 AromaticContact CE1-CE1 3.14Å; H83-F228 WeakPolarHBondContact CE1-CE1 3.27Å; H83-F228 AromaticContact CE1-CZ 3.19Å; H83-F228 WeakPolarHBondContact CE1-CZ 3.45Å; H83-F228 AromaticContact ND1-CE1 3.84Å; H83-F228 AromaticContact NE2-CE1 3.7Å; H83-F228 AromaticContact NE2-CZ 3.19Å; H83-F228 WeakPolarHBondContact NE2-CZ 3.18Å; Y132-F228 WeakPolarHBondContact OH-CE2 3.43Å; Y132-F228 WeakPolarHBondContact OH-CZ 3.48Å; Y173-F228 AromaticContact CD2-CD2 3.81Å; Y173-F228 HydrophobicContact CD2-CD2 3.81Å; Y173-F228 AromaticContact CD2-CE2 3.86Å; Y173-F228 HydrophobicContact CD2-CE2 3.86Å; Y173-F228 HydrophobicContact CE1-CD2 4.33Å; Y173-F228 AromaticContact CE2-CD2 3.3Å; Y173-F228 HydrophobicContact CE2-CD2 3.3Å; Y173-F228 AromaticContact CE2-CE2 3.82Å; Y173-F228 HydrophobicContact CE2-CE2 3.82Å; Y173-F228 HydrophobicContact CE2-CG 4.37Å; Y173-F228 AromaticContact CZ-CD2 3.62Å; Y173-F228 WeakPolarHBondContact OH-CA 3.45Å; Y173-F228 PolarHBondContact OH-N 2.78Å; Y175-F228 WeakPolarHBondContact OH-CE2 3.34Å; C226-F228 PolarHBondContact O-N 2.78Å; F228-A248 HydrophobicContact CB-CB 3.86Å; F228-A248 HydrophobicContact CD1-CB 4.06Å; F228-A248 HydrophobicContact CD2-CB 4.41Å; F228-A248 HydrophobicContact CG-CB 3.86Å; F228-A249 WeakPolarHBondContact CB-O 3.44Å; F228-A249 PolarHBondContact N-O 2.86Å; F228-I250 HydrophobicContact CB-CG2 3.94Å; F228-P277 HydrophobicContact CD1-CG 4.37Å; F228-P277 HydrophobicContact CE1-CG 4.48Å; F228-I278 HydrophobicContact CD1-CD1 4.34Å; F228-I278 HydrophobicContact CD1-CG1 4.37Å; F228-I278 HydrophobicContact CD2-CD1 4.25Å; F228-I278 HydrophobicContact CE1-CD1 3.77Å; F228-I278 HydrophobicContact CE1-CG1 3.48Å; F228-I278 VanDerWaalsContact CE1-CG1 3.48Å; F228-I278 HydrophobicContact CE2-CD1 3.75Å; F228-I278 HydrophobicContact CE2-CG1 4.21Å; F228-I278 HydrophobicContact CZ-CD1 3.44Å; F228-I278 VanDerWaalsContact CZ-CD1 3.44Å; F228-I278 HydrophobicContact CZ-CG1 3.39Å
229	I	69.3	Low	60.4	Low	53 Å²	53	53.6 Å²	53.6	27%	0.272	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-54.3	-175.6	-65	175.7	0	0	0	111.3	C227 I250 C254	C227-I229 PolarHBondContact O-N 3.46Å; C227-I229 VanDerWaalsContact O-N 3.07Å; C227-I229 PolarHBondContact SG-N 3.5Å; C227-I229 VanDerWaalsContact SG-N 3.37Å; I229-I250 HydrophobicContact CD1-CG2 3.94Å; I229-I250 HydrophobicContact CG1-CG2 3.92Å; I229-C254 HydrophobicContact CB-CB 3.97Å; I229-C254 HydrophobicContact CD1-CB 4.06Å; I229-C254 HydrophobicContact CG2-CB 4.23Å
230	C	72	Confident	62.5	Low	43 Å²	43	49.9 Å²	49.9	29%	0.291	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-8.7	-176.3	66.6	0	0	0	0	114.2	C227 S232	C227-C230 WeakPolarHBondContact CB-SG 3.45Å; C227-C230 VanDerWaalsContact SG-SG 3.64Å; C230-S232 PolarHBondContact O-N 3.17Å
231	L	66.4	Low	64.3	Low	27 Å²	27	46.9 Å²	46.9	14%	0.141	24%	0.236	C	C	.	.			trans	59.2	9.2	-176.4	-48	-173.6	0	0	0	115	M172 C227 S233	M172-L231 HydrophobicContact CE-CD2 3.89Å; M172-L231 HydrophobicContact SD-CD1 4.36Å; M172-L231 HydrophobicContact SD-CD2 3.53Å; M172-L231 VanDerWaalsContact SD-CD2 3.53Å; M172-L231 HydrophobicContact SD-CG 4.49Å; C227-L231 WeakPolarHBondContact O-CA 3.36Å; C227-L231 WeakPolarHBondContact O-CD2 3.45Å; C227-L231 PolarHBondContact O-N 3.43Å; L231-S233 PolarHBondContact O-N 2.88Å
232	S	68.9	Low	66	Low	32 Å²	32	40.3 Å²	40.3	22%	0.224	21%	0.211	C	C	.	.			trans	-68.2	132.7	177.3	178.3	0	0	0	0	111.3	C226 C227 C230 E234 T235	C226-S232 WeakPolarHBondContact CA-O 3.44Å; C226-S232 WeakPolarHBondContact CB-O 3.14Å; C227-S232 PolarHBondContact N-O 3.24Å; C230-S232 PolarHBondContact O-N 3.17Å; S232-E234 PolarHBondContact OG-N 2.88Å; S232-T235 PolarHBondContact O-OG1 2.76Å
233	S	63.9	Low	66.9	Low	17 Å²	17	35.3 Å²	35.3	12%	0.119	18%	0.18	C	C	.	.	S	Bend	trans	-93.2	-7.9	171.4	58.3	0	0	0	0	112.9	L231 T235 I236	L231-S233 PolarHBondContact O-N 2.88Å; S233-T235 PolarHBondContact O-N 3.49Å; S233-I236 WeakPolarHBondContact O-CD1 3.46Å; S233-I236 VanDerWaalsContact O-CG1 3.24Å; S233-I236 WeakPolarHBondContact O-CG1 3.35Å
234	E	61.8	Low	67.8	Low	148 Å²	148	34.3 Å²	34.3	69%	0.692	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-19.3	176.5	-60.9	-179.8	154.8	0	0	111.9	H166 S232	H166-E234 IonicContact NE2-OE1 3.83Å; S232-E234 PolarHBondContact OG-N 2.88Å
235	T	61.9	Low	68	Low	18 Å²	18	30.4 Å²	30.4	11%	0.11	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	21.2	-171.8	50.3	0	0	0	0	114.5	S232 S233 S237 N238 L239 C251	S232-T235 PolarHBondContact O-OG1 2.76Å; S233-T235 PolarHBondContact O-N 3.49Å; T235-S237 VanDerWaalsContact C-N 3.25Å; T235-S237 PolarHBondContact O-N 2.8Å; T235-N238 VanDerWaalsContact C-OD1 3.26Å; T235-N238 VanDerWaalsContact CA-OD1 3.25Å; T235-N238 WeakPolarHBondContact CA-OD1 3.5Å; T235-N238 WeakPolarHBondContact CB-OD1 3.09Å; T235-N238 CarbonylContact O-C 3.53Å; T235-N238 PolarHBondContact O-N 3.22Å; T235-N238 VanDerWaalsContact O-N 3.1Å; T235-N238 PolarHBondContact O-OD1 2.83Å; T235-L239 WeakPolarHBondContact O-CG 3.49Å; T235-L239 PolarHBondContact O-N 3.39Å; T235-L239 VanDerWaalsContact O-N 3.14Å; T235-C251 VanDerWaalsContact CB-CB 3.45Å; T235-C251 HydrophobicContact CG2-CB 3.76Å; T235-C251 WeakPolarHBondContact OG1-CB 3.38Å
236	I	63.1	Low	68.4	Low	17 Å²	17	34.4 Å²	34.4	9%	0.087	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-55.9	-43.6	-176.7	-64.3	143.4	0	0	0	111.6	R224 P225 S233 N238 L239	R224-I236 HydrophobicContact CB-CD1 3.49Å; R224-I236 VanDerWaalsContact CB-CD1 3.49Å; R224-I236 HydrophobicContact CB-CG1 3.99Å; R224-I236 VanDerWaalsContact CD-CD1 3.46Å; R224-I236 HydrophobicContact CG-CD1 3.5Å; R224-I236 VanDerWaalsContact CG-CD1 3.5Å; R224-I236 HydrophobicContact CG-CG1 4.45Å; P225-I236 HydrophobicContact CG-CG2 4.08Å; P225-I236 WeakPolarHBondContact O-CG1 3.43Å; S233-I236 WeakPolarHBondContact O-CD1 3.46Å; S233-I236 VanDerWaalsContact O-CG1 3.24Å; S233-I236 WeakPolarHBondContact O-CG1 3.35Å; I236-N238 PolarHBondContact O-N 2.87Å; I236-N238 VanDerWaalsContact O-N 3.14Å; I236-L239 PolarHBondContact O-N 2.84Å
237	S	65.8	Low	68.1	Low	60 Å²	60	35.2 Å²	35.2	42%	0.42	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-67.3	-13.1	-176.2	62.7	0	0	0	0	113.8	T235	T235-S237 VanDerWaalsContact C-N 3.25Å; T235-S237 PolarHBondContact O-N 2.8Å
238	N	77	Confident	67.8	Low	39 Å²	39	35.3 Å²	35.3	21%	0.209	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-125.8	20.3	177.4	72.5	-11.2	0	0	0	113.4	T235 I236 R240 S252	T235-N238 VanDerWaalsContact C-OD1 3.26Å; T235-N238 VanDerWaalsContact CA-OD1 3.25Å; T235-N238 WeakPolarHBondContact CA-OD1 3.5Å; T235-N238 WeakPolarHBondContact CB-OD1 3.09Å; T235-N238 CarbonylContact O-C 3.53Å; T235-N238 PolarHBondContact O-N 3.22Å; T235-N238 VanDerWaalsContact O-N 3.1Å; T235-N238 PolarHBondContact O-OD1 2.83Å; I236-N238 PolarHBondContact O-N 2.87Å; I236-N238 VanDerWaalsContact O-N 3.14Å; N238-R240 PolarHBondContact O-N 2.59Å; N238-S252 PolarHBondContact O-N 2.96Å
239	L	74.2	Confident	67.8	Low	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.			trans	-70.2	128.3	171.7	-78.5	-177.8	0	0	0	111.5	P225 C227 T235 I236 A249 C251 L289	P225-L239 HydrophobicContact CB-CD1 3.69Å; P225-L239 HydrophobicContact CG-CD1 4.12Å; P225-L239 WeakPolarHBondContact O-CD1 3.37Å; C227-L239 HydrophobicContact CB-CD2 3.84Å; T235-L239 WeakPolarHBondContact O-CG 3.49Å; T235-L239 PolarHBondContact O-N 3.39Å; T235-L239 VanDerWaalsContact O-N 3.14Å; I236-L239 PolarHBondContact O-N 2.84Å; L239-A249 HydrophobicContact CB-CB 4.46Å; L239-A249 HydrophobicContact CD1-CB 4.4Å; L239-A249 HydrophobicContact CD2-CB 4.44Å; L239-C251 HydrophobicContact CD2-CB 4.32Å; L239-L289 HydrophobicContact CB-CB 4.38Å; L239-L289 HydrophobicContact CB-CD1 3.73Å; L239-L289 HydrophobicContact CB-CG 4.3Å; L239-L289 HydrophobicContact CD1-CD1 3.98Å; L239-L289 PolarHBondContact O-N 3.34Å
240	R	77.6	Confident	68.1	Low	53 Å²	53	33.4 Å²	33.4	20%	0.2	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.5	-179.5	-68.7	173	-175.7	-101.2	2	109.6	N238 A249 I250 S252 T286 L287 L288	N238-R240 PolarHBondContact O-N 2.59Å; R240-A249 CarbonylContact O-C 3.11Å; R240-A249 WeakPolarHBondContact O-CA 3.33Å; R240-I250 WeakPolarHBondContact CB-O 3.4Å; R240-I250 PolarHBondContact N-O 2.7Å; R240-I250 PolarHBondContact O-N 2.7Å; R240-S252 PolarHBondContact NE-OG 3.3Å; R240-T286 HydrophobicContact CB-CG2 4.23Å; R240-T286 PolarHBondContact NH1-OG1 3.18Å; R240-L287 CarbonylContact C-O 3.47Å; R240-L287 WeakPolarHBondContact CA-O 3.32Å; R240-L288 HydrophobicContact CG-CD1 4.25Å
241	V	74.5	Confident	68.5	Low	9 Å²	9	31.5 Å²	31.5	6%	0.055	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	127.8	169	178.3	0	0	0	0	108.7	L243 R246 A248 A249 T286 L287 L289	V241-L243 PolarHBondContact O-N 2.6Å; V241-R246 HydrophobicContact CG1-CB 3.86Å; V241-R246 HydrophobicContact CG1-CG 3.91Å; V241-A248 WeakPolarHBondContact CA-O 3.33Å; V241-A249 HydrophobicContact CG2-CB 4.13Å; V241-T286 WeakPolarHBondContact O-CA 3.06Å; V241-L287 HydrophobicContact CB-CB 4.21Å; V241-L287 PolarHBondContact N-O 2.75Å; V241-L287 PolarHBondContact O-N 3.35Å; V241-L289 HydrophobicContact CG2-CD1 4.33Å; V241-L289 HydrophobicContact CG2-CD2 3.76Å; V241-L289 HydrophobicContact CG2-CG 3.93Å
242	L	71.9	Confident	69.3	Low	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	119.8	-177.8	-59.6	179.6	0	0	0	111.2	R246 A248 I250 F255 C276 V283 T286	L242-R246 VanDerWaalsContact O-CA 3.26Å; L242-R246 WeakPolarHBondContact O-CA 3.21Å; L242-R246 PolarHBondContact O-N 3.23Å; L242-A248 HydrophobicContact CD1-CB 4.45Å; L242-A248 PolarHBondContact N-O 3.4Å; L242-A248 VanDerWaalsContact N-O 3.13Å; L242-I250 HydrophobicContact CD1-CD1 3.95Å; L242-I250 HydrophobicContact CD1-CG1 4.5Å; L242-I250 HydrophobicContact CD2-CD1 3.7Å; L242-I250 HydrophobicContact CD2-CG1 3.99Å; L242-I250 HydrophobicContact CG-CD1 4.1Å; L242-I250 HydrophobicContact CG-CG1 4.25Å; L242-F255 HydrophobicContact CD2-CD2 3.98Å; L242-F255 HydrophobicContact CD2-CE2 4.05Å; L242-C276 HydrophobicContact CD1-CB 4.38Å; L242-V283 HydrophobicContact CB-CG1 4.2Å; L242-V283 HydrophobicContact CB-CG2 4.09Å; L242-V283 HydrophobicContact CD1-CG2 4.15Å; L242-V283 HydrophobicContact CD2-CG1 3.93Å; L242-V283 HydrophobicContact CD2-CG2 4.19Å; L242-V283 HydrophobicContact CG-CG2 4.37Å; L242-T286 HydrophobicContact CD2-CG2 3.93Å
243	L	61.6	Low	70	Confident	5 Å²	5	34.9 Å²	34.9	3%	0.026	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	147.9	178.8	-60.6	-177.7	0	0	0	111.6	V241 R246 V283 N284 S285 L287 E318	V241-L243 PolarHBondContact O-N 2.6Å; L243-R246 HydrophobicContact CD2-CG 3.49Å; L243-R246 VanDerWaalsContact CD2-CG 3.49Å; L243-V283 VanDerWaalsContact O-CA 3.28Å; L243-V283 WeakPolarHBondContact O-CA 3.29Å; L243-N284 PolarHBondContact O-N 3.2Å; L243-S285 WeakPolarHBondContact CB-O 3.24Å; L243-S285 WeakPolarHBondContact CB-OG 3.48Å; L243-S285 WeakPolarHBondContact CD1-OG 3.35Å; L243-S285 PolarHBondContact N-O 3.29Å; L243-L287 HydrophobicContact CD1-CB 4.12Å; L243-L287 HydrophobicContact CD2-CB 4.48Å; L243-L287 HydrophobicContact CG-CB 4.31Å; L243-E318 HydrophobicContact CD1-CG 4.13Å
244	P	64.4	Low	70.8	Confident	53 Å²	53	34.3 Å²	34.3	34%	0.344	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	cis	-85.1	-12.1	6.2	33.6	-35.4	0	0	0	113.9	R246 T281 P282	P244-R246 PolarHBondContact O-N 3.39Å; P244-T281 HydrophobicContact CG-CG2 4.1Å; P244-P282 WeakPolarHBondContact CD-O 3.47Å
245	C	58.7	Low	71.7	Confident	25 Å²	25	28.2 Å²	28.2	17%	0.169	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-23.5	-162.7	75	0	0	0	0	115.3	H247 C276 C279 T281	C245-H247 WeakPolarHBondContact CB-ND1 3.45Å; C245-H247 PolarHBondContact O-N 3.3Å; C245-C276 WeakPolarHBondContact SG-CB 3.46Å; C245-C276 PolarHBondContact SG-SG 3.14Å; C245-C279 WeakPolarHBondContact CB-SG 3.18Å; C245-T281 HydrophobicContact CB-CG2 4.45Å
246	R	67.7	Low	72.7	Confident	119 Å²	119	32.5 Å²	32.5	45%	0.449	17%	0.17	S	C	.	.			trans	54.8	12.4	177.5	-60.1	170.4	-169.2	-93.9	-2	115.8	V241 L242 L243 P244 A248	V241-R246 HydrophobicContact CG1-CB 3.86Å; V241-R246 HydrophobicContact CG1-CG 3.91Å; L242-R246 VanDerWaalsContact O-CA 3.26Å; L242-R246 WeakPolarHBondContact O-CA 3.21Å; L242-R246 PolarHBondContact O-N 3.23Å; L243-R246 HydrophobicContact CD2-CG 3.49Å; L243-R246 VanDerWaalsContact CD2-CG 3.49Å; P244-R246 PolarHBondContact O-N 3.39Å; R246-A248 VanDerWaalsContact C-N 3.31Å; R246-A248 PolarHBondContact O-N 2.73Å
247	H	62.3	Low	73.5	Confident	20 Å²	20	34.4 Å²	34.4	9%	0.093	19%	0.186	C	C	.	.			trans	-70.6	-22.5	-174.4	-62.3	124.5	0	0	0	114.7	T185 C245 I278 C279	T185-H247 PolarHBondContact OG1-CD2 3Å; C245-H247 WeakPolarHBondContact CB-ND1 3.45Å; C245-H247 PolarHBondContact O-N 3.3Å; H247-I278 HydrophobicContact CB-CB 4.12Å; H247-I278 HydrophobicContact CB-CD1 3.56Å; H247-I278 HydrophobicContact CB-CG1 4.45Å; H247-I278 HydrophobicContact CB-CG2 4.31Å; H247-I278 WeakPolarHBondContact O-CD1 3.48Å; H247-C279 WeakPolarHBondContact CE1-CB 3.32Å; H247-C279 PolarHBondContact CE1-SG 3.38Å; H247-C279 WeakPolarHBondContact ND1-CB 3.46Å; H247-C279 PolarHBondContact ND1-SG 3.5Å
248	A	66.6	Low	73.9	Confident	2 Å²	2	33.2 Å²	33.2	2%	0.017	17%	0.174	C	C	.	.			trans	-139.3	139.9	-176.8	0	0	0	0	0	111	F228 V241 L242 R246 I250 I278	F228-A248 HydrophobicContact CB-CB 3.86Å; F228-A248 HydrophobicContact CD1-CB 4.06Å; F228-A248 HydrophobicContact CD2-CB 4.41Å; F228-A248 HydrophobicContact CG-CB 3.86Å; V241-A248 WeakPolarHBondContact CA-O 3.33Å; L242-A248 HydrophobicContact CD1-CB 4.45Å; L242-A248 PolarHBondContact N-O 3.4Å; L242-A248 VanDerWaalsContact N-O 3.13Å; R246-A248 VanDerWaalsContact C-N 3.31Å; R246-A248 PolarHBondContact O-N 2.73Å; A248-I250 HydrophobicContact CB-CG2 4.45Å; A248-I278 HydrophobicContact CB-CD1 3.79Å
249	A	74.3	Confident	73.8	Confident	15 Å²	15	34 Å²	34	12%	0.124	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	129.5	159.8	0	0	0	0	0	108.3	C227 F228 L239 R240 V241 L289	C227-A249 CarbonylContact C-O 3.51Å; F228-A249 WeakPolarHBondContact CB-O 3.44Å; F228-A249 PolarHBondContact N-O 2.86Å; L239-A249 HydrophobicContact CB-CB 4.46Å; L239-A249 HydrophobicContact CD1-CB 4.4Å; L239-A249 HydrophobicContact CD2-CB 4.44Å; R240-A249 CarbonylContact O-C 3.11Å; R240-A249 WeakPolarHBondContact O-CA 3.33Å; V241-A249 HydrophobicContact CG2-CB 4.13Å; A249-L289 HydrophobicContact CB-CD1 4.25Å
250	I	76.4	Confident	73.8	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	141.2	179.2	53.1	176.6	0	0	0	111.6	C227 F228 I229 R240 L242 A248 C254 F255 L258	C227-I250 VanDerWaalsContact SG-CA 3.6Å; F228-I250 HydrophobicContact CB-CG2 3.94Å; I229-I250 HydrophobicContact CD1-CG2 3.94Å; I229-I250 HydrophobicContact CG1-CG2 3.92Å; R240-I250 WeakPolarHBondContact CB-O 3.4Å; R240-I250 PolarHBondContact N-O 2.7Å; R240-I250 PolarHBondContact O-N 2.7Å; L242-I250 HydrophobicContact CD1-CD1 3.95Å; L242-I250 HydrophobicContact CD1-CG1 4.5Å; L242-I250 HydrophobicContact CD2-CD1 3.7Å; L242-I250 HydrophobicContact CD2-CG1 3.99Å; L242-I250 HydrophobicContact CG-CD1 4.1Å; L242-I250 HydrophobicContact CG-CG1 4.25Å; A248-I250 HydrophobicContact CB-CG2 4.45Å; I250-C254 HydrophobicContact CB-CB 4.47Å; I250-F255 HydrophobicContact CD1-CB 3.9Å; I250-F255 HydrophobicContact CD1-CD2 3.75Å; I250-F255 HydrophobicContact CD1-CG 4.34Å; I250-F255 HydrophobicContact CG1-CB 4.13Å; I250-F255 HydrophobicContact CG1-CD2 4.32Å; I250-L258 HydrophobicContact CD1-CD2 4.1Å
251	C	80.6	Confident	73.3	Confident	2 Å²	2	41 Å²	41	1%	0.014	22%	0.219	C	C	.	.			trans	-67.8	161	176.5	69.1	0	0	0	0	110.7	C227 T235 L239 D253 C254 F255	C227-C251 HydrophobicContact CB-CB 3.89Å; C227-C251 PolarHBondContact SG-N 2.84Å; T235-C251 VanDerWaalsContact CB-CB 3.45Å; T235-C251 HydrophobicContact CG2-CB 3.76Å; T235-C251 WeakPolarHBondContact OG1-CB 3.38Å; L239-C251 HydrophobicContact CD2-CB 4.32Å; C251-D253 PolarHBondContact O-N 2.91Å; C251-C254 PolarHBondContact O-N 2.89Å; C251-C254 PolarHBondContact SG-N 3.27Å; C251-F255 WeakPolarHBondContact O-CB 3.48Å; C251-F255 PolarHBondContact O-N 2.78Å
252	S	82.7	Confident	72.8	Confident	31 Å²	31	41.6 Å²	41.6	22%	0.217	22%	0.224	C	C	.	.	H	α-helix	trans	-53.4	-39.4	179.2	-71	0	0	0	0	113.3	N238 R240 F255 Q256	N238-S252 PolarHBondContact O-N 2.96Å; R240-S252 PolarHBondContact NE-OG 3.3Å; S252-F255 PolarHBondContact O-N 2.87Å; S252-Q256 WeakPolarHBondContact O-CB 3.31Å; S252-Q256 PolarHBondContact O-N 3.17Å
253	D	83.4	Confident	72.3	Confident	99 Å²	99	46.9 Å²	46.9	53%	0.529	25%	0.25	S	S	.	.	H	α-helix	trans	-69.6	-42.5	-176.9	-56.7	-22.2	0	0	0	111.9	C251 F255 Q256 S257	C251-D253 PolarHBondContact O-N 2.91Å; D253-F255 VanDerWaalsContact C-N 3.33Å; D253-Q256 PolarHBondContact O-N 3.43Å; D253-S257 WeakPolarHBondContact O-CB 3.44Å; D253-S257 PolarHBondContact O-N 2.84Å; D253-S257 PolarHBondContact O-OG 3.03Å
254	C	80.2	Confident	72	Confident	6 Å²	6	54.3 Å²	54.3	4%	0.041	28%	0.283	C	S	.	.	H	α-helix	trans	-68.2	-37.1	175.3	-72.3	0	0	0	0	111.1	C227 I229 I250 C251 S257 L258	C227-C254 VanDerWaalsContact SG-SG 3.7Å; I229-C254 HydrophobicContact CB-CB 3.97Å; I229-C254 HydrophobicContact CD1-CB 4.06Å; I229-C254 HydrophobicContact CG2-CB 4.23Å; I250-C254 HydrophobicContact CB-CB 4.47Å; C251-C254 PolarHBondContact O-N 2.89Å; C251-C254 PolarHBondContact SG-N 3.27Å; C254-S257 PolarHBondContact O-N 3.07Å; C254-L258 WeakPolarHBondContact O-CB 3.48Å; C254-L258 PolarHBondContact O-N 3.48Å
255	F	81.9	Confident	71.4	Confident	20 Å²	20	54.2 Å²	54.2	9%	0.088	28%	0.284	C	S	.	.	H	α-helix	trans	-63.1	-45.7	173	-179.5	-97.7	0	0	0	112	L242 I250 C251 S252 D253 S257 L258 H259 I274 T286 L321	L242-F255 HydrophobicContact CD2-CD2 3.98Å; L242-F255 HydrophobicContact CD2-CE2 4.05Å; I250-F255 HydrophobicContact CD1-CB 3.9Å; I250-F255 HydrophobicContact CD1-CD2 3.75Å; I250-F255 HydrophobicContact CD1-CG 4.34Å; I250-F255 HydrophobicContact CG1-CB 4.13Å; I250-F255 HydrophobicContact CG1-CD2 4.32Å; C251-F255 WeakPolarHBondContact O-CB 3.48Å; C251-F255 PolarHBondContact O-N 2.78Å; S252-F255 PolarHBondContact O-N 2.87Å; D253-F255 VanDerWaalsContact C-N 3.33Å; F255-S257 VanDerWaalsContact C-N 3.34Å; F255-S257 PolarHBondContact O-N 3.07Å; F255-L258 WeakPolarHBondContact O-CB 3.46Å; F255-L258 PolarHBondContact O-N 3.13Å; F255-H259 WeakPolarHBondContact O-CB 3.37Å; F255-H259 PolarHBondContact O-N 2.95Å; F255-I274 HydrophobicContact CE2-CD1 4.27Å; F255-I274 HydrophobicContact CE2-CG2 4.45Å; F255-I274 HydrophobicContact CZ-CD1 3.83Å; F255-T286 HydrophobicContact CD2-CG2 4.13Å; F255-T286 HydrophobicContact CE2-CG2 3.62Å; F255-T286 HydrophobicContact CZ-CG2 4.03Å; F255-L321 HydrophobicContact CE1-CD2 4.25Å; F255-L321 HydrophobicContact CE2-CD2 4.12Å; F255-L321 HydrophobicContact CZ-CD2 3.37Å
256	Q	82.6	Confident	70.7	Confident	107 Å²	107	60.1 Å²	60.1	50%	0.5	31%	0.312	S	S	.	.	H	α-helix	trans	-65.5	-38.3	178.1	-167.4	-179	21.2	0	0	111.8	S252 D253 H259 K260	S252-Q256 WeakPolarHBondContact O-CB 3.31Å; S252-Q256 PolarHBondContact O-N 3.17Å; D253-Q256 PolarHBondContact O-N 3.43Å; Q256-H259 PolarHBondContact O-N 3.24Å; Q256-K260 WeakPolarHBondContact O-CG 3.28Å; Q256-K260 PolarHBondContact O-N 3.3Å
257	S	78.4	Confident	69.5	Low	58 Å²	58	61.6 Å²	61.6	41%	0.406	33%	0.329	S	S	.	.	H	α-helix	trans	-63.2	-42.9	174.1	-59.6	0	0	0	0	111.6	D253 C254 F255 K260 S261	D253-S257 WeakPolarHBondContact O-CB 3.44Å; D253-S257 PolarHBondContact O-N 2.84Å; D253-S257 PolarHBondContact O-OG 3.03Å; C254-S257 PolarHBondContact O-N 3.07Å; F255-S257 VanDerWaalsContact C-N 3.34Å; F255-S257 PolarHBondContact O-N 3.07Å; S257-K260 PolarHBondContact O-N 3.2Å; S257-S261 WeakPolarHBondContact O-CB 3.27Å; S257-S261 PolarHBondContact O-N 3.22Å; S257-S261 PolarHBondContact O-OG 3.24Å
258	L	74.4	Confident	68.5	Low	35 Å²	35	65 Å²	65	18%	0.183	35%	0.345	C	S	.	.	H	α-helix	trans	-61.7	-46.1	174.7	-176.4	69.2	0	0	0	111.1	I250 C254 F255 S261 A262 I274	I250-L258 HydrophobicContact CD1-CD2 4.1Å; C254-L258 WeakPolarHBondContact O-CB 3.48Å; C254-L258 PolarHBondContact O-N 3.48Å; F255-L258 WeakPolarHBondContact O-CB 3.46Å; F255-L258 PolarHBondContact O-N 3.13Å; L258-S261 PolarHBondContact O-N 3.31Å; L258-A262 PolarHBondContact O-N 2.65Å; L258-I274 HydrophobicContact CD2-CG2 3.85Å; L258-I274 HydrophobicContact CG-CG2 4.22Å
259	H	75.9	Confident	67.4	Low	56 Å²	56	73.5 Å²	73.5	26%	0.259	38%	0.384	S	S	.	.	H	α-helix	trans	-58.9	-49.2	177.3	-174.9	-65.4	0	0	0	112	F255 Q256 S261 A262 M263 I274	F255-H259 WeakPolarHBondContact O-CB 3.37Å; F255-H259 PolarHBondContact O-N 2.95Å; Q256-H259 PolarHBondContact O-N 3.24Å; H259-S261 VanDerWaalsContact C-N 3.32Å; H259-S261 PolarHBondContact O-N 3.14Å; H259-A262 PolarHBondContact O-N 3.1Å; H259-M263 VanDerWaalsContact CE1-SD 3.56Å; H259-M263 PolarHBondContact O-N 3.48Å; H259-I274 HydrophobicContact CB-CD1 4.06Å; H259-I274 WeakPolarHBondContact CD2-CD1 3.44Å
260	K	74.2	Confident	65.9	Low	117 Å²	117	75.6 Å²	75.6	51%	0.509	39%	0.392	S	S	.	.	H	α-helix	trans	-58.1	-46.4	176.5	-75	177.3	180	177.7	0	110.9	Q256 S257 A262 M263 F264	Q256-K260 WeakPolarHBondContact O-CG 3.28Å; Q256-K260 PolarHBondContact O-N 3.3Å; S257-K260 PolarHBondContact O-N 3.2Å; K260-A262 VanDerWaalsContact C-N 3.29Å; K260-A262 PolarHBondContact O-N 3.23Å; K260-M263 PolarHBondContact O-N 3Å; K260-F264 WeakPolarHBondContact O-CD2 3.42Å; K260-F264 PolarHBondContact O-N 3.19Å
261	S	67.8	Low	64.6	Low	82 Å²	82	80.5 Å²	80.5	57%	0.573	42%	0.418	S	S	*	.	H	α-helix	trans	-61.8	-37.3	-179.8	-54.7	0	0	0	0	112.6	S257 L258 H259 S265	S257-S261 WeakPolarHBondContact O-CB 3.27Å; S257-S261 PolarHBondContact O-N 3.22Å; S257-S261 PolarHBondContact O-OG 3.24Å; L258-S261 PolarHBondContact O-N 3.31Å; H259-S261 VanDerWaalsContact C-N 3.32Å; H259-S261 PolarHBondContact O-N 3.14Å; S261-S265 PolarHBondContact O-N 3.23Å
262	A	63.7	Low	63.2	Low	21 Å²	21	82.6 Å²	82.6	17%	0.174	44%	0.439	C	S	.	.	H	α-helix	trans	-68.7	-31.6	177.9	0	0	0	0	0	113.2	L258 H259 K260 G272 I274	L258-A262 PolarHBondContact O-N 2.65Å; H259-A262 PolarHBondContact O-N 3.1Å; K260-A262 VanDerWaalsContact C-N 3.29Å; K260-A262 PolarHBondContact O-N 3.23Å; A262-G272 PolarHBondContact O-N 3.14Å; A262-I274 HydrophobicContact CB-CG1 4.42Å
263	M	60.7	Low	62.2	Low	111 Å²	111	85.2 Å²	85.2	55%	0.547	45%	0.45	S	S	.	.	H	α-helix	trans	-75.2	-23.3	179.4	-74	-155.3	144.1	0	0	114.2	H259 K260	H259-M263 VanDerWaalsContact CE1-SD 3.56Å; H259-M263 PolarHBondContact O-N 3.48Å; K260-M263 PolarHBondContact O-N 3Å
264	F	55.5	Low	61.6	Low	161 Å²	161	81.1 Å²	81.1	71%	0.706	43%	0.428	S	S	*	.	S	Bend	trans	-111.7	6.5	-173.4	-62.8	-67.4	0	0	0	114.8	K260 I266	K260-F264 WeakPolarHBondContact O-CD2 3.42Å; K260-F264 PolarHBondContact O-N 3.19Å; F264-I266 PolarHBondContact O-N 2.92Å
265	S	50.8	Low	61.2	Low	52 Å²	52	81.7 Å²	81.7	36%	0.364	43%	0.432	S	S	.	.			trans	-81.6	95.8	178.4	-176.2	0	0	0	0	111.3	S261 N267 I271	S261-S265 PolarHBondContact O-N 3.23Å; S265-N267 PolarHBondContact O-N 2.7Å; S265-N267 VanDerWaalsContact O-N 3.17Å; S265-I271 WeakPolarHBondContact O-CG1 3.47Å
266	I	44.7	Very low	60.5	Low	148 Å²	148	80.8 Å²	80.8	76%	0.759	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-11.8	-174.6	-50	170.5	0	0	0	112.8	F264	F264-I266 PolarHBondContact O-N 2.92Å
267	N	42.7	Very low	59.5	Low	151 Å²	151	76.5 Å²	76.5	81%	0.807	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.7	21.6	-167.4	-71.6	-25.4	0	0	0	115.5	S265	S265-N267 PolarHBondContact O-N 2.7Å; S265-N267 VanDerWaalsContact O-N 3.17Å
268	H	41	Very low	58.6	Low	92 Å²	92	73.8 Å²	73.8	43%	0.426	39%	0.39	S	S	.	.			trans	-123.7	136.8	-179.9	-149.6	-82.4	0	0	0	111.8	L270 I271	H268-L270 PolarHBondContact O-N 3.25Å; H268-I271 VanDerWaalsContact O-CD1 3.23Å; H268-I271 WeakPolarHBondContact O-CD1 3.31Å; H268-I271 WeakPolarHBondContact O-CG1 3.17Å; H268-I271 PolarHBondContact O-N 3.2Å
269	H	42.8	Very low	57.9	Low	180 Å²	180	73.1 Å²	73.1	83%	0.833	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	7.5	177.9	-3.8	-73.6	0	0	0	114
270	L	42.7	Very low	57.4	Low	58 Å²	58	77.4 Å²	77.4	30%	0.304	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	24.2	178.1	-59.7	171.6	0	0	0	110.9	H268 G272 L273 T275	H268-L270 PolarHBondContact O-N 3.25Å; L270-G272 PolarHBondContact O-N 2.93Å; L270-L273 HydrophobicContact CB-CB 4.41Å; L270-L273 HydrophobicContact CD2-CD1 4.03Å; L270-L273 WeakPolarHBondContact O-CB 3.45Å; L270-L273 PolarHBondContact O-N 2.92Å; L270-T275 HydrophobicContact CD1-CG2 3.98Å
271	I	49.1	Very low	56.9	Low	104 Å²	104	74.4 Å²	74.4	53%	0.533	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.4	125.4	173.6	-76.3	143.6	0	0	0	109.4	S265 H268 L273	S265-I271 WeakPolarHBondContact O-CG1 3.47Å; H268-I271 VanDerWaalsContact O-CD1 3.23Å; H268-I271 WeakPolarHBondContact O-CD1 3.31Å; H268-I271 WeakPolarHBondContact O-CG1 3.17Å; H268-I271 PolarHBondContact O-N 3.2Å; I271-L273 VanDerWaalsContact C-N 3.32Å; I271-L273 PolarHBondContact O-N 2.97Å
272	G	52.8	Low	57	Low	45 Å²	45	72.4 Å²	72.4	46%	0.464	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	-2.2	178.6	0	0	0	0	0	115.6	A262 L270	A262-G272 PolarHBondContact O-N 3.14Å; L270-G272 PolarHBondContact O-N 2.93Å
273	L	61.8	Low	57.4	Low	86 Å²	86	71.8 Å²	71.8	45%	0.45	37%	0.373	S	S	.	.			trans	-104.1	118.4	176.1	-68.5	167.7	0	0	0	110.8	L270 I271 T275	L270-L273 HydrophobicContact CB-CB 4.41Å; L270-L273 HydrophobicContact CD2-CD1 4.03Å; L270-L273 WeakPolarHBondContact O-CB 3.45Å; L270-L273 PolarHBondContact O-N 2.92Å; I271-L273 VanDerWaalsContact C-N 3.32Å; I271-L273 PolarHBondContact O-N 2.97Å; L273-T275 PolarHBondContact O-N 3.13Å
274	I	71.1	Confident	57.9	Low	13 Å²	13	69 Å²	69	7%	0.067	36%	0.36	C	S	.	.			trans	-65.6	128.9	167.5	-54.4	177.6	0	0	0	107.2	F255 L258 H259 A262 P282 V283 L321	F255-I274 HydrophobicContact CE2-CD1 4.27Å; F255-I274 HydrophobicContact CE2-CG2 4.45Å; F255-I274 HydrophobicContact CZ-CD1 3.83Å; L258-I274 HydrophobicContact CD2-CG2 3.85Å; L258-I274 HydrophobicContact CG-CG2 4.22Å; H259-I274 HydrophobicContact CB-CD1 4.06Å; H259-I274 WeakPolarHBondContact CD2-CD1 3.44Å; A262-I274 HydrophobicContact CB-CG1 4.42Å; I274-P282 CarbonylContact O-C 3.57Å; I274-P282 WeakPolarHBondContact O-CA 3.29Å; I274-V283 HydrophobicContact CB-CB 4.23Å; I274-V283 HydrophobicContact CG2-CB 3.99Å; I274-V283 HydrophobicContact CG2-CG2 3.91Å; I274-V283 PolarHBondContact O-N 3.32Å; I274-L321 HydrophobicContact CB-CD1 4.39Å; I274-L321 HydrophobicContact CD1-CD1 3.95Å; I274-L321 HydrophobicContact CD1-CD2 4.12Å
275	T	69.9	Low	58.9	Low	19 Å²	19	62.3 Å²	62.3	12%	0.117	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-121	147.2	176.5	53.4	0	0	0	0	110.2	L270 L273 R280 T281	L270-T275 HydrophobicContact CD1-CG2 3.98Å; L273-T275 PolarHBondContact O-N 3.13Å; T275-R280 WeakPolarHBondContact CB-O 3.2Å; T275-R280 VanDerWaalsContact CG2-O 3.27Å; T275-R280 WeakPolarHBondContact CG2-O 3.22Å; T275-T281 WeakPolarHBondContact CA-O 3.49Å
276	C	67.7	Low	60.1	Low	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.316	C	S	.	.			trans	-56.6	129	172.7	178.7	0	0	0	0	109.2	L242 C245 I278 C279 R280 T281	L242-C276 HydrophobicContact CD1-CB 4.38Å; C245-C276 WeakPolarHBondContact SG-CB 3.46Å; C245-C276 PolarHBondContact SG-SG 3.14Å; C276-I278 PolarHBondContact O-N 3.38Å; C276-I278 PolarHBondContact SG-N 3.19Å; C276-C279 WeakPolarHBondContact CB-SG 3.01Å; C276-C279 VanDerWaalsContact SG-SG 3.7Å; C276-R280 VanDerWaalsContact O-CA 3.23Å; C276-R280 WeakPolarHBondContact O-CA 3.41Å; C276-R280 PolarHBondContact O-N 3.16Å; C276-T281 PolarHBondContact N-O 2.78Å
277	P	61	Low	61.2	Low	17 Å²	17	53.7 Å²	53.7	11%	0.11	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-24.9	-179.9	25.2	-33.8	0	0	0	112.4	F228	F228-P277 HydrophobicContact CD1-CG 4.37Å; F228-P277 HydrophobicContact CE1-CG 4.48Å
278	I	59.8	Low	62.5	Low	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-73	175.4	-57.6	163.1	0	0	0	108.7	L86 T87 Y175 L183 F228 H247 A248 C276	L86-I278 HydrophobicContact CD1-CG2 4.49Å; T87-I278 WeakPolarHBondContact CG2-O 3.34Å; Y175-I278 HydrophobicContact CE1-CD1 4.21Å; Y175-I278 HydrophobicContact CE1-CG2 4.45Å; Y175-I278 VanDerWaalsContact OH-CD1 3.23Å; Y175-I278 WeakPolarHBondContact OH-CD1 3.46Å; L183-I278 HydrophobicContact CD2-CG2 4.06Å; F228-I278 HydrophobicContact CD1-CD1 4.34Å; F228-I278 HydrophobicContact CD1-CG1 4.37Å; F228-I278 HydrophobicContact CD2-CD1 4.25Å; F228-I278 HydrophobicContact CE1-CD1 3.77Å; F228-I278 HydrophobicContact CE1-CG1 3.48Å; F228-I278 VanDerWaalsContact CE1-CG1 3.48Å; F228-I278 HydrophobicContact CE2-CD1 3.75Å; F228-I278 HydrophobicContact CE2-CG1 4.21Å; F228-I278 HydrophobicContact CZ-CD1 3.44Å; F228-I278 VanDerWaalsContact CZ-CD1 3.44Å; F228-I278 HydrophobicContact CZ-CG1 3.39Å; H247-I278 HydrophobicContact CB-CB 4.12Å; H247-I278 HydrophobicContact CB-CD1 3.56Å; H247-I278 HydrophobicContact CB-CG1 4.45Å; H247-I278 HydrophobicContact CB-CG2 4.31Å; H247-I278 WeakPolarHBondContact O-CD1 3.48Å; A248-I278 HydrophobicContact CB-CD1 3.79Å; C276-I278 PolarHBondContact O-N 3.38Å; C276-I278 PolarHBondContact SG-N 3.19Å
279	C	61.2	Low	63.4	Low	22 Å²	22	46.8 Å²	46.8	15%	0.149	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-2.6	-165.4	71.2	0	0	0	0	116.3	T87 C245 H247 C276 T281	T87-C279 VanDerWaalsContact CG2-CA 3.43Å; T87-C279 HydrophobicContact CG2-CB 4.34Å; C245-C279 WeakPolarHBondContact CB-SG 3.18Å; H247-C279 WeakPolarHBondContact CE1-CB 3.32Å; H247-C279 PolarHBondContact CE1-SG 3.38Å; H247-C279 WeakPolarHBondContact ND1-CB 3.46Å; H247-C279 PolarHBondContact ND1-SG 3.5Å; C276-C279 WeakPolarHBondContact CB-SG 3.01Å; C276-C279 VanDerWaalsContact SG-SG 3.7Å; C279-T281 PolarHBondContact O-N 3.14Å; C279-T281 WeakPolarHBondContact SG-CB 3.25Å; C279-T281 PolarHBondContact SG-N 3.24Å; C279-T281 PolarHBondContact SG-OG1 3.13Å
280	R	64.2	Low	63.8	Low	146 Å²	146	41.2 Å²	41.2	55%	0.551	23%	0.23	S	C	*	.			trans	56.1	4.2	-173.3	-53.5	-59.7	-178	175.5	-0.9	115.5	T275 C276	T275-R280 WeakPolarHBondContact CB-O 3.2Å; T275-R280 VanDerWaalsContact CG2-O 3.27Å; T275-R280 WeakPolarHBondContact CG2-O 3.22Å; C276-R280 VanDerWaalsContact O-CA 3.23Å; C276-R280 WeakPolarHBondContact O-CA 3.41Å; C276-R280 PolarHBondContact O-N 3.16Å
281	T	64	Low	64.2	Low	53 Å²	53	46.9 Å²	46.9	33%	0.325	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-58	131.9	170.6	-56.4	0	0	0	0	108.7	P244 C245 T275 C276 C279 V283	P244-T281 HydrophobicContact CG-CG2 4.1Å; C245-T281 HydrophobicContact CB-CG2 4.45Å; T275-T281 WeakPolarHBondContact CA-O 3.49Å; C276-T281 PolarHBondContact N-O 2.78Å; C279-T281 PolarHBondContact O-N 3.14Å; C279-T281 WeakPolarHBondContact SG-CB 3.25Å; C279-T281 PolarHBondContact SG-N 3.24Å; C279-T281 PolarHBondContact SG-OG1 3.13Å; T281-V283 PolarHBondContact O-N 3.29Å
282	P	70.2	Confident	64.1	Low	41 Å²	41	45.1 Å²	45.1	27%	0.266	24%	0.242	S	C	.	.	B	Isolated β-bridge	trans	-51.2	128.4	171.2	-27.6	35.9	0	0	0	110.4	P244 I274 N284	P244-P282 WeakPolarHBondContact CD-O 3.47Å; I274-P282 CarbonylContact O-C 3.57Å; I274-P282 WeakPolarHBondContact O-CA 3.29Å; P282-N284 PolarHBondContact O-OD1 3.21Å
283	V	71.2	Confident	63.5	Low	7 Å²	7	47.1 Å²	47.1	4%	0.042	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-80.4	128.1	171.3	-173.3	0	0	0	0	106	L242 L243 I274 T281 S285 T286 L321	L242-V283 HydrophobicContact CB-CG1 4.2Å; L242-V283 HydrophobicContact CB-CG2 4.09Å; L242-V283 HydrophobicContact CD1-CG2 4.15Å; L242-V283 HydrophobicContact CD2-CG1 3.93Å; L242-V283 HydrophobicContact CD2-CG2 4.19Å; L242-V283 HydrophobicContact CG-CG2 4.37Å; L243-V283 VanDerWaalsContact O-CA 3.28Å; L243-V283 WeakPolarHBondContact O-CA 3.29Å; I274-V283 HydrophobicContact CB-CB 4.23Å; I274-V283 HydrophobicContact CG2-CB 3.99Å; I274-V283 HydrophobicContact CG2-CG2 3.91Å; I274-V283 PolarHBondContact O-N 3.32Å; T281-V283 PolarHBondContact O-N 3.29Å; V283-S285 VanDerWaalsContact CG1-O 3.3Å; V283-S285 WeakPolarHBondContact CG1-O 3.48Å; V283-T286 HydrophobicContact CG1-CG2 4.32Å; V283-L321 HydrophobicContact CB-CD1 4Å; V283-L321 HydrophobicContact CG1-CD1 3.85Å; V283-L321 WeakPolarHBondContact O-CD1 3.44Å
284	N	72.2	Confident	62.6	Low	54 Å²	54	47.4 Å²	47.4	29%	0.289	24%	0.237	S	C	.	.			trans	-111.1	-25.6	-178	-52.6	-26.2	0	0	0	111.6	V23 L243 P282	V23-N284 HydrophobicContact CG1-CB 3.76Å; V23-N284 WeakPolarHBondContact CG1-ND2 3.08Å; V23-N284 WeakPolarHBondContact CG1-OD1 3.14Å; L243-N284 PolarHBondContact O-N 3.2Å; P282-N284 PolarHBondContact O-OD1 3.21Å
285	S	76	Confident	61.1	Low	20 Å²	20	53.1 Å²	53.1	14%	0.14	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	165.3	177.5	53.6	0	0	0	0	109.1	L243 V283 I319	L243-S285 WeakPolarHBondContact CB-O 3.24Å; L243-S285 WeakPolarHBondContact CB-OG 3.48Å; L243-S285 WeakPolarHBondContact CD1-OG 3.35Å; L243-S285 PolarHBondContact N-O 3.29Å; V283-S285 VanDerWaalsContact CG1-O 3.3Å; V283-S285 WeakPolarHBondContact CG1-O 3.48Å; S285-I319 WeakPolarHBondContact CA-O 3.49Å; S285-I319 WeakPolarHBondContact CB-O 3.09Å
286	T	76.1	Confident	59.5	Low	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	141.4	169.9	57.4	0	0	0	0	110.1	R240 V241 L242 F255 V283 I319 L321	R240-T286 HydrophobicContact CB-CG2 4.23Å; R240-T286 PolarHBondContact NH1-OG1 3.18Å; V241-T286 WeakPolarHBondContact O-CA 3.06Å; L242-T286 HydrophobicContact CD2-CG2 3.93Å; F255-T286 HydrophobicContact CD2-CG2 4.13Å; F255-T286 HydrophobicContact CE2-CG2 3.62Å; F255-T286 HydrophobicContact CZ-CG2 4.03Å; V283-T286 HydrophobicContact CG1-CG2 4.32Å; T286-I319 PolarHBondContact N-O 3.23Å; T286-I319 PolarHBondContact O-N 3.17Å; T286-L321 HydrophobicContact CG2-CD2 4.24Å
287	L	68	Low	58	Low	19 Å²	19	66.2 Å²	66.2	10%	0.099	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	117.8	170.3	-173.2	73.4	0	0	0	108.6	R240 V241 L243 L289 I316 E318	R240-L287 CarbonylContact C-O 3.47Å; R240-L287 WeakPolarHBondContact CA-O 3.32Å; V241-L287 HydrophobicContact CB-CB 4.21Å; V241-L287 PolarHBondContact N-O 2.75Å; V241-L287 PolarHBondContact O-N 3.35Å; L243-L287 HydrophobicContact CD1-CB 4.12Å; L243-L287 HydrophobicContact CD2-CB 4.48Å; L243-L287 HydrophobicContact CG-CB 4.31Å; L287-L289 PolarHBondContact O-N 2.74Å; L287-I316 HydrophobicContact CD1-CG2 3.23Å; L287-I316 HydrophobicContact CD2-CG2 4.39Å; L287-I316 HydrophobicContact CG-CG2 4.25Å; L287-E318 HydrophobicContact CD1-CG 4Å
288	L	68.6	Low	56.6	Low	61 Å²	61	72.2 Å²	72.2	32%	0.319	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	125.2	170.1	-167.2	69.4	0	0	0	108.6	R240	R240-L288 HydrophobicContact CG-CD1 4.25Å
289	L	60.7	Low	55	Low	37 Å²	37	78.3 Å²	78.3	19%	0.194	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-63.4	133.6	172.9	-74.1	176	0	0	0	108.8	P225 L239 V241 A249 L287 R291	P225-L289 HydrophobicContact CB-CD1 4.19Å; P225-L289 HydrophobicContact CG-CD1 4.32Å; L239-L289 HydrophobicContact CB-CB 4.38Å; L239-L289 HydrophobicContact CB-CD1 3.73Å; L239-L289 HydrophobicContact CB-CG 4.3Å; L239-L289 HydrophobicContact CD1-CD1 3.98Å; L239-L289 PolarHBondContact O-N 3.34Å; V241-L289 HydrophobicContact CG2-CD1 4.33Å; V241-L289 HydrophobicContact CG2-CD2 3.76Å; V241-L289 HydrophobicContact CG2-CG 3.93Å; A249-L289 HydrophobicContact CB-CD1 4.25Å; L287-L289 PolarHBondContact O-N 2.74Å; L289-R291 PolarHBondContact O-N 3.44Å
290	P	50.6	Low	53.5	Low	63 Å²	63	85.5 Å²	85.5	41%	0.409	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-59.4	141	179.9	22.1	-30.5	0	0	0	110	T292	P290-T292 PolarHBondContact O-N 3.47Å
291	R	51.4	Low	51.8	Low	177 Å²	177	85.4 Å²	85.4	67%	0.668	44%	0.436	S	S	*	.			trans	-61	110.7	170.6	-71.2	-176.8	-179.4	-179.7	-1	107.4	L289 N293	L289-R291 PolarHBondContact O-N 3.44Å; R291-N293 PolarHBondContact O-N 2.87Å
292	T	48.3	Very low	49.9	Very low	67 Å²	67	89.2 Å²	89.2	41%	0.411	46%	0.455	S	S	.	.			trans	-69	117.3	162.2	45.2	0	0	0	0	106.7	P290 Y294	P290-T292 PolarHBondContact O-N 3.47Å; T292-Y294 HydrophobicContact CG2-CD2 4.43Å; T292-Y294 HydrophobicContact CG2-CE2 3.8Å; T292-Y294 PolarHBondContact O-N 3.22Å; T292-Y294 WeakPolarHBondContact OG1-CD2 2.99Å; T292-Y294 WeakPolarHBondContact OG1-CE2 3.38Å
293	N	38.9	Very low	47.8	Very low	86 Å²	86	96.1 Å²	96.1	46%	0.46	48%	0.483	S	S	.	.			trans	-64.2	71.7	174.6	-80.5	3	0	0	0	110.4	R291 E296	R291-N293 PolarHBondContact O-N 2.87Å; N293-E296 PolarHBondContact ND2-OE2 3.16Å
294	Y	43.7	Very low	45.6	Very low	93 Å²	93	102.1 Å²	102.1	37%	0.365	52%	0.52	S	S	.	.			trans	-87.5	-15.3	170.6	-73.4	-66.1	0	0	0	111.8	T292	T292-Y294 HydrophobicContact CG2-CD2 4.43Å; T292-Y294 HydrophobicContact CG2-CE2 3.8Å; T292-Y294 PolarHBondContact O-N 3.22Å; T292-Y294 WeakPolarHBondContact OG1-CD2 2.99Å; T292-Y294 WeakPolarHBondContact OG1-CE2 3.38Å
295	D	38.7	Very low	43.5	Very low	133 Å²	133	105.4 Å²	105.4	71%	0.711	54%	0.542	S	S	*	.	S	Bend	trans	-88.2	-13.1	-178.7	-64.9	-28.4	0	0	0	113.5
296	E	37.8	Very low	41.2	Very low	134 Å²	134	112.1 Å²	112.1	63%	0.626	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-7.6	178.7	-82.3	177.6	175.8	0	0	114.4	N293	N293-E296 PolarHBondContact ND2-OE2 3.16Å
297	F	34.6	Very low	38.9	Very low	159 Å²	159	120.7 Å²	120.7	70%	0.697	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-4.7	179.4	-95.8	-81.8	0	0	0	114.7
298	N	32.4	Very low	36.9	Very low	144 Å²	144	129.4 Å²	129.4	77%	0.77	66%	0.656	S	S	*	*	S	Bend	trans	-103.4	-0.4	178.3	-79.5	-18.5	0	0	0	113.9
299	N	26.5	Very low	34.9	Very low	128 Å²	128	130 Å²	130	68%	0.684	68%	0.678	S	S	*	*	S	Bend	trans	-125.4	130.6	171.6	-71.4	-34.8	0	0	0	108.2
300	E	28.9	Very low	33.1	Very low	173 Å²	173	134.5 Å²	134.5	81%	0.808	71%	0.706	S	S	*	*			trans	86.9	65.5	173.1	-54.7	-176.3	167.3	0	0	117.7	N302	E300-N302 PolarHBondContact O-N 2.98Å
301	V	28.1	Very low	31.8	Very low	144 Å²	144	138.1 Å²	138.1	87%	0.873	73%	0.727	S	S	*	*				-78.2	79	126.5	-178.9	0	0	0	0	106.7
302	N	25.4	Very low	30.6	Very low	134 Å²	134	135.3 Å²	135.3	72%	0.717	73%	0.73	S	S	*	*			trans	-139.4	103.6	158.6	-89.7	-27.1	0	0	0	106.5	E300 T304	E300-N302 PolarHBondContact O-N 2.98Å; N302-T304 PolarHBondContact O-N 2.72Å; N302-T304 VanDerWaalsContact O-N 3.17Å
303	H	25.3	Very low	29.6	Very low	186 Å²	186	137.4 Å²	137.4	86%	0.861	74%	0.743	S	S	*	*			trans	-60.2	112.5	172.5	-97.1	-72.1	0	0	0	110.2
304	T	25.9	Very low	29.3	Very low	133 Å²	133	138.4 Å²	138.4	82%	0.816	75%	0.748	S	S	*	*			trans	-148.5	110.8	144.8	37.8	0	0	0	0	108.4	N302	N302-T304 PolarHBondContact O-N 2.72Å; N302-T304 VanDerWaalsContact O-N 3.17Å
305	T	27	Very low	28.6	Very low	122 Å²	122	140.2 Å²	140.2	75%	0.748	76%	0.764	S	S	*	*			trans	-61.7	129.2	162.5	40.9	0	0	0	0	109.1
306	D	27.9	Very low	28.7	Very low	162 Å²	162	139.8 Å²	139.8	87%	0.866	76%	0.761	S	S	*	*			trans	-158.4	154.5	143.8	-89.3	-26.4	0	0	0	110
307	E	27.4	Very low	28.9	Very low	179 Å²	179	137.5 Å²	137.5	84%	0.836	76%	0.756	S	S	*	*			trans	-77.4	158.9	-156.6	-59.5	174.4	141.9	0	0	114.7
308	E	27.3	Very low	29	Very low	202 Å²	202	135.3 Å²	135.3	94%	0.944	75%	0.748	S	S	*	*			trans	69.7	113.3	171.1	-59.5	-168.8	158.7	0	0	118.3
309	G	25.4	Very low	30.2	Very low	74 Å²	74	131.3 Å²	131.3	76%	0.763	73%	0.726	S	S	*	*			trans	173.1	88.1	166.2	0	0	0	0	0	118.4
310	V	24.4	Very low	31.3	Very low	131 Å²	131	130.1 Å²	130.1	79%	0.794	73%	0.725	S	S	*	*			trans	49.1	108.4	141.9	-168	0	0	0	0	119.5	T312	V310-T312 PolarHBondContact O-N 2.74Å
311	T	23.7	Very low	32.6	Very low	139 Å²	139	127.2 Å²	127.2	85%	0.853	72%	0.715	S	S	*	*			trans	-70.9	104.4	157.6	21.7	0	0	0	0	110.9	T313	T311-T313 PolarHBondContact O-N 3.27Å
312	T	24.9	Very low	32.8	Very low	118 Å²	118	126.4 Å²	126.4	72%	0.724	71%	0.707	S	S	*	*			trans	-71.5	113.7	167.1	20	0	0	0	0	110.1	V310	V310-T312 PolarHBondContact O-N 2.74Å
313	T	26.6	Very low	33.2	Very low	112 Å²	112	126 Å²	126	69%	0.687	71%	0.706	S	S	*	*			trans	-78.5	118.3	167.8	30.3	0	0	0	0	108.9	T311 N315	T311-T313 PolarHBondContact O-N 3.27Å; T313-N315 PolarHBondContact O-N 3.22Å
314	N	33	Very low	33.6	Very low	107 Å²	107	122.7 Å²	122.7	57%	0.572	70%	0.698	S	S	*	*			trans	-66.8	93.3	174.8	-82.3	-23.3	0	0	0	110.1	I316	N314-I316 PolarHBondContact O-N 3Å
315	N	28.6	Very low	34.1	Very low	131 Å²	131	122.1 Å²	122.1	70%	0.701	69%	0.691	S	S	*	*			trans	-69.8	110.7	178.4	-76.2	-23.7	0	0	0	111	T313 T317	T313-N315 PolarHBondContact O-N 3.22Å; N315-T317 PolarHBondContact O-N 3.36Å; N315-T317 VanDerWaalsContact O-N 3.17Å; N315-T317 PolarHBondContact O-OG1 2.95Å
316	I	41.7	Very low	34.5	Very low	124 Å²	124	122.1 Å²	122.1	64%	0.636	69%	0.687	S	S	*	*			trans	-61.8	111.3	166.5	-61.7	175.5	0	0	0	107.4	L287 N314	L287-I316 HydrophobicContact CD1-CG2 3.23Å; L287-I316 HydrophobicContact CD2-CG2 4.39Å; L287-I316 HydrophobicContact CG-CG2 4.25Å; N314-I316 PolarHBondContact O-N 3Å
317	T	41.4	Very low	34.9	Very low	85 Å²	85	119.4 Å²	119.4	52%	0.521	68%	0.675	S	S	.	*			trans	-108.6	111.7	-178.9	-45.7	0	0	0	0	109.3	N315	N315-T317 PolarHBondContact O-N 3.36Å; N315-T317 VanDerWaalsContact O-N 3.17Å; N315-T317 PolarHBondContact O-OG1 2.95Å
318	E	38.4	Very low	35.5	Very low	113 Å²	113	115.1 Å²	115.1	53%	0.528	66%	0.664	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.8	128.2	166.1	-69.5	-170.3	170.8	0	0	108.8	L243 L287	L243-E318 HydrophobicContact CD1-CG 4.13Å; L287-E318 HydrophobicContact CD1-CG 4Å
319	I	56	Low	36.1	Very low	60 Å²	60	108.5 Å²	108.5	31%	0.308	64%	0.642	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.5	111.1	177.6	-55.8	172.9	0	0	0	107.1	S285 T286	S285-I319 WeakPolarHBondContact CA-O 3.49Å; S285-I319 WeakPolarHBondContact CB-O 3.09Å; T286-I319 PolarHBondContact N-O 3.23Å; T286-I319 PolarHBondContact O-N 3.17Å
320	P	50.7	Low	37	Very low	104 Å²	104	111.3 Å²	111.3	68%	0.675	63%	0.632	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-57.4	144.7	170	-17.7	29.3	0	0	0	110.3
321	L	54.6	Low	38.1	Very low	112 Å²	112	109.5 Å²	109.5	59%	0.586	62%	0.617	S	S	*	*			trans	-73.6	0	174.2	-69.3	-179.5	0	0	0	112.7	F255 I274 V283 T286	F255-L321 HydrophobicContact CE1-CD2 4.25Å; F255-L321 HydrophobicContact CE2-CD2 4.12Å; F255-L321 HydrophobicContact CZ-CD2 3.37Å; I274-L321 HydrophobicContact CB-CD1 4.39Å; I274-L321 HydrophobicContact CD1-CD1 3.95Å; I274-L321 HydrophobicContact CD1-CD2 4.12Å; V283-L321 HydrophobicContact CB-CD1 4Å; V283-L321 HydrophobicContact CG1-CD1 3.85Å; V283-L321 WeakPolarHBondContact O-CD1 3.44Å; T286-L321 HydrophobicContact CG2-CD2 4.24Å

Retrieved 321 of 321 residues in 319.4 ms (Link to these results)

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