A0A087XQJ2_POEFO Loading...

P2X purinoceptor

Receptor for ATP that acts as a ligand-gated ion channel.

AlphaFold DB , UniProt , Accession A0A087XQJ2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 577 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	41.8	Very low	66.8	Low	222 Å²	222	121.2 Å²	121.2	100%	1.094	71%	0.705	S	S	*	*				0	97.9	0	-75.8	170.8	165.6	0	0	107.7	C3	M1-C3 VanDerWaalsContact C-N 3.26Å; M1-C3 PolarHBondContact O-N 3.42Å
2	P	49.4	Very low	68.4	Low	130 Å²	130	127.2 Å²	127.2	84%	0.844	71%	0.709	S	S	*	*			trans	-89.4	72.1	172.2	35.2	-24.6	0	0	0	106.9
3	C	57.9	Low	69.9	Low	99 Å²	99	132.4 Å²	132.4	67%	0.669	72%	0.724	S	S	*	*			trans	-130.5	69.7	-164.7	-64.2	0	0	0	0	110.9	M1	M1-C3 VanDerWaalsContact C-N 3.26Å; M1-C3 PolarHBondContact O-N 3.42Å
4	C	62.3	Low	71.4	Confident	111 Å²	111	130.6 Å²	130.6	75%	0.75	72%	0.72	S	S	*	*			trans	171.5	88.6	142.8	-89.2	0	0	0	0	107.1
5	D	72.4	Confident	72.5	Confident	109 Å²	109	128 Å²	128	58%	0.583	72%	0.715	S	S	*	*			trans	-66.9	122.4	161.9	-163.2	-15.8	0	0	0	106.6	L7 G8	D5-L7 PolarHBondContact O-N 3.48Å; D5-L7 VanDerWaalsContact O-N 3.09Å; D5-G8 WeakPolarHBondContact O-CA 3.4Å; D5-G8 PolarHBondContact O-N 3.28Å
6	P	69.4	Low	73.4	Confident	94 Å²	94	132.9 Å²	132.9	61%	0.61	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-58.2	-23.9	-178.7	21.8	-33.5	0	0	0	112.7	G8 L9	P6-G8 VanDerWaalsContact C-N 3.28Å; P6-G8 PolarHBondContact O-N 2.7Å; P6-L9 WeakPolarHBondContact O-CB 3.02Å; P6-L9 PolarHBondContact O-N 2.79Å
7	L	71.8	Confident	74.2	Confident	127 Å²	127	133.7 Å²	133.7	67%	0.665	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-67.4	-27.7	170.8	-73.8	158.7	0	0	0	112.9	D5 L9 C10	D5-L7 PolarHBondContact O-N 3.48Å; D5-L7 VanDerWaalsContact O-N 3.09Å; L7-L9 VanDerWaalsContact C-N 3.26Å; L7-L9 PolarHBondContact O-N 2.84Å; L7-C10 PolarHBondContact O-N 2.93Å; L7-C10 VanDerWaalsContact O-N 3.13Å
8	G	71.1	Confident	74.8	Confident	32 Å²	32	129.9 Å²	129.9	33%	0.33	71%	0.71	S	S	.	*	G	3₁₀ helix	trans	-62.2	-31	172.9	0	0	0	0	0	113.2	D5 P6 C10 Q11	D5-G8 WeakPolarHBondContact O-CA 3.4Å; D5-G8 PolarHBondContact O-N 3.28Å; P6-G8 VanDerWaalsContact C-N 3.28Å; P6-G8 PolarHBondContact O-N 2.7Å; G8-C10 PolarHBondContact O-N 3.16Å; G8-Q11 WeakPolarHBondContact O-CB 3.31Å; G8-Q11 PolarHBondContact O-N 3.4Å
9	L	72.3	Confident	75.3	Confident	145 Å²	145	134.6 Å²	134.6	76%	0.759	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-70.1	-22.4	175.4	-68.3	164.1	0	0	0	112.6	P6 L7	P6-L9 WeakPolarHBondContact O-CB 3.02Å; P6-L9 PolarHBondContact O-N 2.79Å; L7-L9 VanDerWaalsContact C-N 3.26Å; L7-L9 PolarHBondContact O-N 2.84Å
10	C	81.9	Confident	75.8	Confident	102 Å²	102	131.8 Å²	131.8	69%	0.689	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-93.1	7.2	176.5	-62.2	0	0	0	0	113	L7 G8 Y12	L7-C10 PolarHBondContact O-N 2.93Å; L7-C10 VanDerWaalsContact O-N 3.13Å; G8-C10 PolarHBondContact O-N 3.16Å; C10-Y12 PolarHBondContact O-N 2.81Å
11	Q	84.8	Confident	76.2	Confident	162 Å²	162	133.8 Å²	133.8	76%	0.757	71%	0.706	S	S	*	*			trans	-72.7	122.1	175	-70.7	-178.7	-5.8	0	0	110	G8	G8-Q11 WeakPolarHBondContact O-CB 3.31Å; G8-Q11 PolarHBondContact O-N 3.4Å
12	Y	85.4	Confident	78.3	Confident	193 Å²	193	125.4 Å²	125.4	76%	0.757	67%	0.669	S	S	*	*			trans	-109.1	126.5	171.8	74.5	-86.1	0	0	0	109	C10 T14	C10-Y12 PolarHBondContact O-N 2.81Å; Y12-T14 HydrophobicContact CD2-CG2 3.76Å; Y12-T14 HydrophobicContact CE2-CG2 3.75Å
13	Q	88.3	Confident	80.1	Confident	195 Å²	195	125.6 Å²	125.6	91%	0.911	67%	0.668	S	S	*	*			trans	-96.5	128.5	177.3	-169.8	173.1	-10.1	0	0	109.2
14	T	90.7	Very high	81.5	Confident	107 Å²	107	129.4 Å²	129.4	66%	0.656	67%	0.668	S	S	*	*			trans	-116.2	146.1	172	52.2	0	0	0	0	109.8	Y12	Y12-T14 HydrophobicContact CD2-CG2 3.76Å; Y12-T14 HydrophobicContact CE2-CG2 3.75Å
15	S	88.1	Confident	82.6	Confident	92 Å²	92	124.9 Å²	124.9	64%	0.643	64%	0.636	S	S	*	*			trans	-73.5	131.2	171.6	48.3	0	0	0	0	109.5	L17	S15-L17 PolarHBondContact O-N 3.1Å
16	K	87.4	Confident	83.4	Confident	206 Å²	206	121 Å²	121	90%	0.896	62%	0.622	S	S	*	*			trans	-70.4	122.7	169.3	-172.4	179.8	178.6	-174.6	0	108
17	L	86.5	Confident	84.5	Confident	147 Å²	147	119.7 Å²	119.7	77%	0.77	62%	0.615	S	S	*	*			trans	-109.9	143.4	-177	-62.8	174.1	0	0	0	111.1	S15	S15-L17 PolarHBondContact O-N 3.1Å
18	V	85.7	Confident	85.4	Confident	66 Å²	66	116.8 Å²	116.8	40%	0.4	60%	0.6	S	S	.	*			trans	-97.9	119.3	171.3	-179.3	0	0	0	0	108.8	R366	V18-R366 HydrophobicContact CG1-CB 4.4Å
19	R	84.6	Confident	86.4	Confident	218 Å²	218	119.5 Å²	119.5	82%	0.823	60%	0.602	S	S	*	*			trans	-93.5	113	178.4	-172.8	174.9	-177.7	173.6	0.3	110.6
20	I	83.7	Confident	87.4	Confident	78 Å²	78	121.6 Å²	121.6	40%	0.4	60%	0.601	S	S	.	*			trans	-91.4	123.4	173.7	-50.2	173.4	0	0	0	108.9	L25 L350 Y363	I20-L25 HydrophobicContact CG2-CD1 4.15Å; I20-L350 HydrophobicContact CD1-CD1 3.94Å; I20-Y363 HydrophobicContact CD1-CD2 3.53Å; I20-Y363 HydrophobicContact CD1-CE2 3.53Å; I20-Y363 HydrophobicContact CD1-CG 4.5Å; I20-Y363 HydrophobicContact CG1-CD2 4.18Å; I20-Y363 HydrophobicContact CG1-CE2 4.26Å
21	Q	84.4	Confident	88	Confident	174 Å²	174	120.2 Å²	120.2	81%	0.813	59%	0.592	S	S	*	*			trans	-95.5	92.2	173.6	-68.9	-176.6	-10.1	0	0	109.5
22	S	85.6	Confident	88.5	Confident	46 Å²	46	114.9 Å²	114.9	32%	0.322	57%	0.568	S	S	.	*			trans	-142	128.5	176.6	178.5	0	0	0	0	110.6	G26	S22-G26 PolarHBondContact O-N 2.85Å
23	V	88.5	Confident	88.9	Confident	135 Å²	135	106.9 Å²	106.9	82%	0.818	54%	0.539	S	S	*	.	H	α-helix	trans	-65.7	-40.9	179.7	-179.4	0	0	0	0	111	G26 S27	V23-G26 PolarHBondContact O-N 3.22Å; V23-S27 WeakPolarHBondContact O-CB 3.4Å; V23-S27 PolarHBondContact O-N 3.01Å
24	R	86.1	Confident	89.2	Confident	178 Å²	178	99.4 Å²	99.4	67%	0.672	51%	0.514	S	S	*	.	H	α-helix	trans	-66.2	-47.9	-178.3	-175.8	171.6	175.4	-162.9	1.6	112.3	S27 L28 Y355	R24-S27 PolarHBondContact O-N 2.78Å; R24-L28 WeakPolarHBondContact O-CB 3.44Å; R24-L28 PolarHBondContact O-N 3.04Å; R24-Y355 WeakPolarHBondContact CD-OH 3.35Å
25	L	85.9	Confident	89.5	Confident	16 Å²	16	97 Å²	97	8%	0.084	51%	0.505	C	S	.	.	H	α-helix	trans	-69.1	-37.8	177.5	-66.6	169.5	0	0	0	111.8	I20 L28 K29 L350 Y355	I20-L25 HydrophobicContact CG2-CD1 4.15Å; L25-L28 PolarHBondContact O-N 3.38Å; L25-K29 WeakPolarHBondContact O-CB 3.06Å; L25-K29 PolarHBondContact O-N 3.17Å; L25-L350 HydrophobicContact CD1-CD2 3.92Å; L25-L350 HydrophobicContact CD2-CD2 4.17Å; L25-Y355 HydrophobicContact CD1-CE1 4.49Å; L25-Y355 HydrophobicContact CD2-CE2 4.13Å
26	G	89.8	Confident	89.8	Confident	27 Å²	27	94.1 Å²	94.1	28%	0.278	48%	0.482	S	S	.	.	H	α-helix	trans	-60.1	-49.2	173.3	0	0	0	0	0	111.9	S22 V23 L28 K29 W30	S22-G26 PolarHBondContact O-N 2.85Å; V23-G26 PolarHBondContact O-N 3.22Å; G26-L28 PolarHBondContact O-N 3.1Å; G26-K29 PolarHBondContact O-N 3.43Å; G26-W30 PolarHBondContact O-N 3.26Å
27	S	91.8	Very high	90.1	Very high	68 Å²	68	88.4 Å²	88.4	48%	0.476	46%	0.461	S	S	.	.	H	α-helix	trans	-60.7	-45.3	176.2	-176.2	0	0	0	0	111.6	V23 R24 K29 W30 S31	V23-S27 WeakPolarHBondContact O-CB 3.4Å; V23-S27 PolarHBondContact O-N 3.01Å; R24-S27 PolarHBondContact O-N 2.78Å; S27-K29 PolarHBondContact O-N 3.46Å; S27-W30 PolarHBondContact O-N 2.96Å; S27-S31 WeakPolarHBondContact O-CB 3.18Å; S27-S31 PolarHBondContact O-N 3.2Å; S27-S31 PolarHBondContact O-OG 3.16Å
28	L	90.5	Very high	90.6	Very high	65 Å²	65	86.6 Å²	86.6	34%	0.34	45%	0.451	S	S	.	.	H	α-helix	trans	-59.5	-45.9	177.9	-179.4	61.9	0	0	0	111.7	R24 L25 G26 S31 L32 L349	R24-L28 WeakPolarHBondContact O-CB 3.44Å; R24-L28 PolarHBondContact O-N 3.04Å; L25-L28 PolarHBondContact O-N 3.38Å; G26-L28 PolarHBondContact O-N 3.1Å; L28-S31 PolarHBondContact O-N 3.02Å; L28-L32 HydrophobicContact CD1-CD1 4.1Å; L28-L32 HydrophobicContact CD1-CG 4.29Å; L28-L32 HydrophobicContact CG-CD1 4.04Å; L28-L32 WeakPolarHBondContact O-CB 3.42Å; L28-L32 WeakPolarHBondContact O-CG 3.37Å; L28-L32 PolarHBondContact O-N 3.03Å; L28-L349 HydrophobicContact CD2-CD1 3.94Å
29	K	92.1	Very high	91	Very high	89 Å²	89	89.5 Å²	89.5	39%	0.387	46%	0.459	S	S	.	.	H	α-helix	trans	-57.5	-49.9	176.3	-178.6	-178.1	174	177.2	0	112	L25 G26 S27 L32 N33 T342 I346	L25-K29 WeakPolarHBondContact O-CB 3.06Å; L25-K29 PolarHBondContact O-N 3.17Å; G26-K29 PolarHBondContact O-N 3.43Å; S27-K29 PolarHBondContact O-N 3.46Å; K29-L32 PolarHBondContact O-N 3.16Å; K29-N33 WeakPolarHBondContact O-CB 3.2Å; K29-N33 VanDerWaalsContact O-CG 3.3Å; K29-N33 PolarHBondContact O-N 2.6Å; K29-T342 HydrophobicContact CB-CG2 4.48Å; K29-T342 HydrophobicContact CG-CG2 3.98Å; K29-I346 HydrophobicContact CB-CD1 3.61Å; K29-I346 HydrophobicContact CD-CD1 4.48Å; K29-I346 HydrophobicContact CG-CD1 3.92Å
30	W	94.3	Very high	91.4	Very high	190 Å²	190	79.6 Å²	79.6	72%	0.72	42%	0.422	S	S	*	.	H	α-helix	trans	-69	-37	-178	-73.7	116.2	0	0	0	112.3	G26 S27 N33 G34	G26-W30 PolarHBondContact O-N 3.26Å; S27-W30 PolarHBondContact O-N 2.96Å; W30-N33 PolarHBondContact O-N 3.23Å; W30-G34 PolarHBondContact O-N 3.28Å
31	S	94.5	Very high	91.9	Very high	73 Å²	73	78.5 Å²	78.5	51%	0.51	42%	0.42	S	S	.	.	H	α-helix	trans	-63.7	-45.3	173.9	-63.8	0	0	0	0	112.1	S27 L28 G34 A35	S27-S31 WeakPolarHBondContact O-CB 3.18Å; S27-S31 PolarHBondContact O-N 3.2Å; S27-S31 PolarHBondContact O-OG 3.16Å; L28-S31 PolarHBondContact O-N 3.02Å; S31-G34 PolarHBondContact O-N 3.09Å; S31-A35 WeakPolarHBondContact O-CB 3.29Å; S31-A35 PolarHBondContact O-N 3.11Å
32	L	93.9	Very high	92.4	Very high	50 Å²	50	74 Å²	74	26%	0.262	40%	0.401	S	S	.	.	H	α-helix	trans	-62.2	-46.4	176	-74.8	169.4	0	0	0	111.5	L28 K29 G34 A35 I36 T342	L28-L32 HydrophobicContact CD1-CD1 4.1Å; L28-L32 HydrophobicContact CD1-CG 4.29Å; L28-L32 HydrophobicContact CG-CD1 4.04Å; L28-L32 WeakPolarHBondContact O-CB 3.42Å; L28-L32 WeakPolarHBondContact O-CG 3.37Å; L28-L32 PolarHBondContact O-N 3.03Å; K29-L32 PolarHBondContact O-N 3.16Å; L32-G34 VanDerWaalsContact C-N 3.33Å; L32-G34 PolarHBondContact O-N 3.04Å; L32-A35 PolarHBondContact O-N 3.08Å; L32-I36 WeakPolarHBondContact O-CG1 3.44Å; L32-I36 PolarHBondContact O-N 2.9Å; L32-T342 HydrophobicContact CB-CG2 3.84Å; L32-T342 HydrophobicContact CD1-CG2 4.06Å
33	N	94.8	Very high	92.8	Very high	25 Å²	25	74.5 Å²	74.5	13%	0.134	40%	0.399	C	S	.	.	H	α-helix	trans	-62.4	-39.9	176.2	-75.4	-7.3	0	0	0	112.4	K29 W30 I36 L37 Y339 T342	K29-N33 WeakPolarHBondContact O-CB 3.2Å; K29-N33 VanDerWaalsContact O-CG 3.3Å; K29-N33 PolarHBondContact O-N 2.6Å; W30-N33 PolarHBondContact O-N 3.23Å; N33-I36 PolarHBondContact O-N 3.42Å; N33-L37 WeakPolarHBondContact O-CB 3.22Å; N33-L37 PolarHBondContact O-N 3.15Å; N33-Y339 HydrophobicContact CB-CD1 4.17Å; N33-Y339 HydrophobicContact CB-CE1 4.08Å; N33-T342 VanDerWaalsContact OD1-CB 3.29Å; N33-T342 WeakPolarHBondContact OD1-CB 3.12Å; N33-T342 WeakPolarHBondContact OD1-CG2 3.17Å; N33-T342 PolarHBondContact OD1-OG1 2.86Å
34	G	95.4	Very high	93	Very high	37 Å²	37	69.7 Å²	69.7	38%	0.381	37%	0.368	S	S	.	.	H	α-helix	trans	-63.5	-41.1	175.3	0	0	0	0	0	112.4	W30 S31 L32 L37 L38	W30-G34 PolarHBondContact O-N 3.28Å; S31-G34 PolarHBondContact O-N 3.09Å; L32-G34 VanDerWaalsContact C-N 3.33Å; L32-G34 PolarHBondContact O-N 3.04Å; G34-L37 PolarHBondContact O-N 3.2Å; G34-L38 WeakPolarHBondContact O-CB 3.4Å; G34-L38 PolarHBondContact O-N 3.12Å
35	A	95.1	Very high	93.2	Very high	57 Å²	57	66.7 Å²	66.7	47%	0.471	37%	0.365	S	S	.	.	H	α-helix	trans	-64.7	-43.4	175.2	0	0	0	0	0	112.1	S31 L32 L38 F39	S31-A35 WeakPolarHBondContact O-CB 3.29Å; S31-A35 PolarHBondContact O-N 3.11Å; L32-A35 PolarHBondContact O-N 3.08Å; A35-L38 PolarHBondContact O-N 3.25Å; A35-F39 WeakPolarHBondContact O-CB 3.35Å; A35-F39 PolarHBondContact O-N 2.96Å
36	I	95.3	Very high	93.5	Very high	31 Å²	31	75.7 Å²	75.7	16%	0.159	40%	0.398	C	S	.	.	H	α-helix	trans	-60.6	-48.1	174.6	-69.4	166.2	0	0	0	110.4	L32 N33 L38 F39 I40 Y339 T342	L32-I36 WeakPolarHBondContact O-CG1 3.44Å; L32-I36 PolarHBondContact O-N 2.9Å; N33-I36 PolarHBondContact O-N 3.42Å; I36-L38 PolarHBondContact O-N 3.39Å; I36-F39 PolarHBondContact O-N 3.43Å; I36-I40 HydrophobicContact CG2-CD1 3.58Å; I36-I40 HydrophobicContact CG2-CG1 4.37Å; I36-I40 WeakPolarHBondContact O-CD1 2.84Å; I36-I40 VanDerWaalsContact O-CG1 3.22Å; I36-I40 WeakPolarHBondContact O-CG1 3.19Å; I36-I40 PolarHBondContact O-N 2.06Å; I36-Y339 HydrophobicContact CG2-CD1 4.39Å; I36-Y339 HydrophobicContact CG2-CE1 4.21Å; I36-T342 VanDerWaalsContact CD1-OG1 3.31Å; I36-T342 WeakPolarHBondContact CD1-OG1 3.46Å
37	L	94.8	Very high	93.5	Very high	87 Å²	87	78.1 Å²	78.1	46%	0.455	40%	0.404	S	S	.	.	H	α-helix	trans	-58.8	-48.1	177.5	179.5	63	0	0	0	111.6	N33 G34 F39 I40 C41 Y339	N33-L37 WeakPolarHBondContact O-CB 3.22Å; N33-L37 PolarHBondContact O-N 3.15Å; G34-L37 PolarHBondContact O-N 3.2Å; L37-F39 VanDerWaalsContact C-N 3.33Å; L37-F39 PolarHBondContact O-N 3.36Å; L37-I40 PolarHBondContact O-N 3.39Å; L37-C41 PolarHBondContact O-N 2.89Å; L37-C41 PolarHBondContact O-SG 3.14Å; L37-C41 VanDerWaalsContact O-SG 3.32Å; L37-Y339 WeakPolarHBondContact CB-OH 3.37Å; L37-Y339 WeakPolarHBondContact CD1-OH 3.35Å
38	L	95.6	Very high	93.5	Very high	108 Å²	108	78.9 Å²	78.9	57%	0.565	40%	0.397	S	S	*	.	H	α-helix	trans	-58.8	-46	178.6	179.7	65.2	0	0	0	111.1	G34 A35 I36 C41 I42	G34-L38 WeakPolarHBondContact O-CB 3.4Å; G34-L38 PolarHBondContact O-N 3.12Å; A35-L38 PolarHBondContact O-N 3.25Å; I36-L38 PolarHBondContact O-N 3.39Å; L38-C41 PolarHBondContact O-N 2.89Å; L38-I42 HydrophobicContact CD1-CD1 4.03Å; L38-I42 HydrophobicContact CD1-CG1 4.36Å; L38-I42 HydrophobicContact CG-CD1 3.88Å; L38-I42 VanDerWaalsContact O-CG1 3.29Å; L38-I42 WeakPolarHBondContact O-CG1 3.32Å; L38-I42 PolarHBondContact O-N 2.86Å
39	F	94.1	Very high	93.6	Very high	128 Å²	128	81 Å²	81	56%	0.561	40%	0.403	S	S	*	.	H	α-helix	trans	-60.6	-46	177	178.3	-99.7	0	0	0	111.9	A35 I36 L37 C41 I42 M43	A35-F39 WeakPolarHBondContact O-CB 3.35Å; A35-F39 PolarHBondContact O-N 2.96Å; I36-F39 PolarHBondContact O-N 3.43Å; L37-F39 VanDerWaalsContact C-N 3.33Å; L37-F39 PolarHBondContact O-N 3.36Å; F39-C41 PolarHBondContact O-N 3.22Å; F39-I42 PolarHBondContact O-N 3.05Å; F39-M43 HydrophobicContact CD1-CG 4.19Å; F39-M43 HydrophobicContact CD2-CG 4.23Å; F39-M43 HydrophobicContact CE1-CG 3.77Å; F39-M43 HydrophobicContact CE2-CE 4.03Å; F39-M43 HydrophobicContact CE2-CG 3.81Å; F39-M43 HydrophobicContact CE2-SD 4.27Å; F39-M43 HydrophobicContact CG-CG 4.41Å; F39-M43 HydrophobicContact CZ-CG 3.56Å; F39-M43 HydrophobicContact CZ-SD 4.15Å; F39-M43 WeakPolarHBondContact O-CB 3.37Å; F39-M43 WeakPolarHBondContact O-CG 3.4Å; F39-M43 PolarHBondContact O-N 3.16Å
40	I	94.3	Very high	93.6	Very high	10 Å²	10	78.2 Å²	78.2	5%	0.051	39%	0.39	C	S	.	.	H	α-helix	trans	-58.6	-47.6	176	-68.1	162	0	0	0	110.2	I36 L37 I42 M43 M44 Y331 T335 Y339	I36-I40 HydrophobicContact CG2-CD1 3.58Å; I36-I40 HydrophobicContact CG2-CG1 4.37Å; I36-I40 WeakPolarHBondContact O-CD1 2.84Å; I36-I40 VanDerWaalsContact O-CG1 3.22Å; I36-I40 WeakPolarHBondContact O-CG1 3.19Å; I36-I40 PolarHBondContact O-N 2.06Å; L37-I40 PolarHBondContact O-N 3.39Å; I40-I42 PolarHBondContact O-N 3.18Å; I40-M43 PolarHBondContact O-N 3.42Å; I40-M44 VanDerWaalsContact O-CB 3.22Å; I40-M44 WeakPolarHBondContact O-CB 3.44Å; I40-M44 PolarHBondContact O-N 3.22Å; I40-Y331 HydrophobicContact CG2-CE1 3.62Å; I40-Y331 PolarHBondContact O-OH 2.78Å; I40-Y331 VanDerWaalsContact O-OH 3.07Å; I40-T335 HydrophobicContact CG1-CG2 4.2Å; I40-T335 HydrophobicContact CG2-CG2 3.86Å; I40-Y339 HydrophobicContact CD1-CE2 4.33Å
41	C	93.7	Very high	93.5	Very high	54 Å²	54	69.3 Å²	69.3	37%	0.365	36%	0.357	S	S	.	.	H	α-helix	trans	-61.4	-45	178.6	-70.3	0	0	0	0	112.5	L37 L38 F39 M44 L45	L37-C41 PolarHBondContact O-N 2.89Å; L37-C41 PolarHBondContact O-SG 3.14Å; L37-C41 VanDerWaalsContact O-SG 3.32Å; L38-C41 PolarHBondContact O-N 2.89Å; F39-C41 PolarHBondContact O-N 3.22Å; C41-M44 PolarHBondContact O-N 3.19Å; C41-L45 WeakPolarHBondContact O-CG 3.13Å; C41-L45 PolarHBondContact O-N 3.18Å
42	I	94.8	Very high	93.6	Very high	80 Å²	80	69.9 Å²	69.9	41%	0.41	35%	0.351	S	S	.	.	H	α-helix	trans	-62.9	-47.4	177.9	-67.3	168.3	0	0	0	110.3	L38 F39 I40 M44 L45 W46	L38-I42 HydrophobicContact CD1-CD1 4.03Å; L38-I42 HydrophobicContact CD1-CG1 4.36Å; L38-I42 HydrophobicContact CG-CD1 3.88Å; L38-I42 VanDerWaalsContact O-CG1 3.29Å; L38-I42 WeakPolarHBondContact O-CG1 3.32Å; L38-I42 PolarHBondContact O-N 2.86Å; F39-I42 PolarHBondContact O-N 3.05Å; I40-I42 PolarHBondContact O-N 3.18Å; I42-M44 VanDerWaalsContact C-N 3.33Å; I42-M44 PolarHBondContact O-N 2.89Å; I42-L45 PolarHBondContact O-N 2.76Å; I42-W46 VanDerWaalsContact O-CB 3.31Å; I42-W46 WeakPolarHBondContact O-CB 2.7Å; I42-W46 PolarHBondContact O-N 2.99Å
43	M	93.1	Very high	93.6	Very high	57 Å²	57	71.5 Å²	71.5	28%	0.281	36%	0.357	S	S	.	.	H	α-helix	trans	-64.6	-37.4	179.3	-73.2	-61.6	117.7	0	0	112.4	F39 I40 L45 N47	F39-M43 HydrophobicContact CD1-CG 4.19Å; F39-M43 HydrophobicContact CD2-CG 4.23Å; F39-M43 HydrophobicContact CE1-CG 3.77Å; F39-M43 HydrophobicContact CE2-CE 4.03Å; F39-M43 HydrophobicContact CE2-CG 3.81Å; F39-M43 HydrophobicContact CE2-SD 4.27Å; F39-M43 HydrophobicContact CG-CG 4.41Å; F39-M43 HydrophobicContact CZ-CG 3.56Å; F39-M43 HydrophobicContact CZ-SD 4.15Å; F39-M43 WeakPolarHBondContact O-CB 3.37Å; F39-M43 WeakPolarHBondContact O-CG 3.4Å; F39-M43 PolarHBondContact O-N 3.16Å; I40-M43 PolarHBondContact O-N 3.42Å; M43-L45 VanDerWaalsContact C-N 3.35Å; M43-N47 WeakPolarHBondContact O-CB 3.44Å; M43-N47 PolarHBondContact O-N 3.44Å; M43-N47 PolarHBondContact O-ND2 3.05Å
44	M	93.2	Very high	93.7	Very high	34 Å²	34	71.8 Å²	71.8	17%	0.167	36%	0.358	C	S	.	.	H	α-helix	trans	-60.4	-45.2	175.1	-170.2	-160.8	-78.8	0	0	111	I40 C41 I42 R48 K49 Y50 L328 Y331	I40-M44 VanDerWaalsContact O-CB 3.22Å; I40-M44 WeakPolarHBondContact O-CB 3.44Å; I40-M44 PolarHBondContact O-N 3.22Å; C41-M44 PolarHBondContact O-N 3.19Å; I42-M44 VanDerWaalsContact C-N 3.33Å; I42-M44 PolarHBondContact O-N 2.89Å; M44-R48 WeakPolarHBondContact O-CA 3.41Å; M44-R48 PolarHBondContact O-N 3.24Å; M44-K49 PolarHBondContact O-N 3.49Å; M44-Y50 HydrophobicContact CG-CD1 4.07Å; M44-L328 HydrophobicContact CE-CD1 3.88Å; M44-L328 HydrophobicContact SD-CD1 4.02Å; M44-Y331 HydrophobicContact CB-CD1 4.32Å; M44-Y331 HydrophobicContact CB-CE1 3.54Å; M44-Y331 HydrophobicContact CE-CD1 3.44Å; M44-Y331 VanDerWaalsContact CE-CD1 3.44Å; M44-Y331 HydrophobicContact CE-CE1 3.54Å; M44-Y331 HydrophobicContact CG-CD1 3.93Å; M44-Y331 HydrophobicContact CG-CE1 3.68Å; M44-Y331 PolarHBondContact N-OH 2.85Å; M44-Y331 HydrophobicContact SD-CD1 4.49Å; M44-Y331 HydrophobicContact SD-CE1 4.47Å
45	L	90.6	Very high	93.7	Very high	115 Å²	115	76 Å²	76	60%	0.602	37%	0.372	S	S	*	.	H	α-helix	trans	-73.6	-42.9	-179.7	-68.9	173	0	0	0	112.5	C41 I42 M43 R48 Y50	C41-L45 WeakPolarHBondContact O-CG 3.13Å; C41-L45 PolarHBondContact O-N 3.18Å; I42-L45 PolarHBondContact O-N 2.76Å; M43-L45 VanDerWaalsContact C-N 3.35Å; L45-R48 WeakPolarHBondContact O-CG 3.48Å; L45-R48 PolarHBondContact O-N 2.8Å; L45-Y50 HydrophobicContact CD2-CE1 4.28Å
46	W	91.3	Very high	93.7	Very high	205 Å²	205	74.5 Å²	74.5	78%	0.777	36%	0.356	S	S	*	.	H	α-helix	trans	-65.2	-48.2	-178.8	-169.6	-75.4	0	0	0	111.8	I42 R48	I42-W46 VanDerWaalsContact O-CB 3.31Å; I42-W46 WeakPolarHBondContact O-CB 2.7Å; I42-W46 PolarHBondContact O-N 2.99Å; W46-R48 VanDerWaalsContact C-N 3.34Å
47	N	90.8	Very high	93.7	Very high	78 Å²	78	77.1 Å²	77.1	42%	0.417	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-3.1	-178.6	-63.6	-45.9	0	0	0	113.2	M43 K49	M43-N47 WeakPolarHBondContact O-CB 3.44Å; M43-N47 PolarHBondContact O-N 3.44Å; M43-N47 PolarHBondContact O-ND2 3.05Å; N47-K49 HydrophobicContact CB-CD 4.32Å; N47-K49 HydrophobicContact CB-CG 3.9Å; N47-K49 PolarHBondContact O-N 3.48Å
48	R	91.9	Very high	93.7	Very high	84 Å²	84	74.9 Å²	74.9	32%	0.317	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	41.8	-177.6	-57.3	-177.6	-167.7	157.7	5.8	113.4	M44 L45 W46 Y50 Q51 F53	M44-R48 WeakPolarHBondContact O-CA 3.41Å; M44-R48 PolarHBondContact O-N 3.24Å; L45-R48 WeakPolarHBondContact O-CG 3.48Å; L45-R48 PolarHBondContact O-N 2.8Å; W46-R48 VanDerWaalsContact C-N 3.34Å; R48-Y50 HydrophobicContact CB-CE1 4.16Å; R48-Y50 HydrophobicContact CG-CE1 4.37Å; R48-Y50 PolarHBondContact O-N 3.23Å; R48-Y50 VanDerWaalsContact O-N 3.15Å; R48-Q51 HydrophobicContact CB-CG 4.19Å; R48-Q51 WeakPolarHBondContact O-CB 3.46Å; R48-Q51 PolarHBondContact O-N 2.66Å; R48-F53 HydrophobicContact CB-CZ 4.11Å
49	K	91.4	Very high	93.6	Very high	110 Å²	110	73 Å²	73	48%	0.478	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-14.3	-176.6	-67.5	-61.2	-171.1	-178.3	0	114.2	M44 N47 Q51 Y331	M44-K49 PolarHBondContact O-N 3.49Å; N47-K49 HydrophobicContact CB-CD 4.32Å; N47-K49 HydrophobicContact CB-CG 3.9Å; N47-K49 PolarHBondContact O-N 3.48Å; K49-Q51 PolarHBondContact O-N 3.13Å; K49-Y331 HydrophobicContact CB-CD2 3.52Å; K49-Y331 HydrophobicContact CB-CE2 3.82Å; K49-Y331 HydrophobicContact CB-CG 4.18Å; K49-Y331 HydrophobicContact CG-CD2 4.03Å; K49-Y331 HydrophobicContact CG-CE2 3.95Å
50	Y	92	Very high	93.6	Very high	29 Å²	29	67.6 Å²	67.6	11%	0.114	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-9.2	170.8	63.2	-94	0	0	0	113.2	M44 L45 R48 D258 F323 S324	M44-Y50 HydrophobicContact CG-CD1 4.07Å; L45-Y50 HydrophobicContact CD2-CE1 4.28Å; R48-Y50 HydrophobicContact CB-CE1 4.16Å; R48-Y50 HydrophobicContact CG-CE1 4.37Å; R48-Y50 PolarHBondContact O-N 3.23Å; R48-Y50 VanDerWaalsContact O-N 3.15Å; Y50-D258 WeakPolarHBondContact CE2-OD2 3.48Å; Y50-F323 AromaticContact CD2-CD2 3.9Å; Y50-F323 HydrophobicContact CD2-CD2 3.9Å; Y50-S324 PolarHBondContact O-N 3.36Å; Y50-S324 VanDerWaalsContact O-N 3.11Å
51	Q	94.2	Very high	93.5	Very high	3 Å²	3	71 Å²	71	1%	0.014	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	143.6	177.7	-59.6	-174.1	-29.6	0	0	110.6	R48 K49 F53 N256 D258 K322	R48-Q51 HydrophobicContact CB-CG 4.19Å; R48-Q51 WeakPolarHBondContact O-CB 3.46Å; R48-Q51 PolarHBondContact O-N 2.66Å; K49-Q51 PolarHBondContact O-N 3.13Å; Q51-F53 HydrophobicContact CB-CE1 4.49Å; Q51-F53 HydrophobicContact CB-CE2 4.21Å; Q51-F53 HydrophobicContact CB-CZ 4.05Å; Q51-N256 PolarHBondContact NE2-OD1 2.89Å; Q51-D258 PolarHBondContact NE2-OD1 3.24Å; Q51-D258 PolarHBondContact NE2-OD2 3.27Å; Q51-K322 CarbonylContact C-O 3.37Å; Q51-K322 VanDerWaalsContact CA-O 3.31Å; Q51-K322 WeakPolarHBondContact CA-O 3.43Å
52	E	94.8	Very high	93.4	Very high	85 Å²	85	70.8 Å²	70.8	40%	0.397	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	142.1	160.5	-174.3	170	-176.5	0	0	108.7	F194 G321 K322 S324 Q327	E52-F194 HydrophobicContact CB-CE1 4.43Å; E52-F194 HydrophobicContact CB-CZ 4.39Å; E52-F194 HydrophobicContact CG-CE1 4.39Å; E52-F194 HydrophobicContact CG-CZ 4.38Å; E52-F194 VanDerWaalsContact O-CZ 3.24Å; E52-F194 WeakPolarHBondContact O-CZ 3.34Å; E52-G321 WeakPolarHBondContact O-CA 3.35Å; E52-K322 PolarHBondContact N-O 3.4Å; E52-K322 PolarHBondContact O-N 3.42Å; E52-S324 PolarHBondContact OE2-OG 2.9Å; E52-Q327 HydrophobicContact CB-CG 4.16Å
53	F	94.8	Very high	93.3	Very high	84 Å²	84	72.9 Å²	72.9	37%	0.368	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	137.8	-175.9	-67.5	-81.1	0	0	0	111.5	R48 Q51 Q319 A320	R48-F53 HydrophobicContact CB-CZ 4.11Å; Q51-F53 HydrophobicContact CB-CE1 4.49Å; Q51-F53 HydrophobicContact CB-CE2 4.21Å; Q51-F53 HydrophobicContact CB-CZ 4.05Å; F53-Q319 HydrophobicContact CD1-CG 4.37Å; F53-A320 VanDerWaalsContact CA-O 3.24Å; F53-A320 WeakPolarHBondContact CA-O 3.4Å
54	D	96.1	Very high	93.3	Very high	32 Å²	32	70.7 Å²	70.7	17%	0.171	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	145.4	173.2	-171.4	20.6	0	0	0	110.1	F191 P192 A193 F194 Q319 A320	D54-F191 HydrophobicContact CB-CB 4.41Å; D54-F191 HydrophobicContact CB-CD1 4.39Å; D54-F191 VanDerWaalsContact OD2-CA 3.32Å; D54-F191 WeakPolarHBondContact OD2-CA 3Å; D54-F191 WeakPolarHBondContact OD2-CB 3.46Å; D54-P192 VanDerWaalsContact OD2-CD 3.32Å; D54-P192 WeakPolarHBondContact OD2-CD 3.47Å; D54-P192 VanDerWaalsContact OD2-N 3.09Å; D54-A193 HydrophobicContact CB-CB 3.91Å; D54-A193 VanDerWaalsContact CG-CB 3.46Å; D54-A193 VanDerWaalsContact OD2-CB 3.28Å; D54-A193 WeakPolarHBondContact OD2-CB 3.36Å; D54-A193 PolarHBondContact OD2-N 3.36Å; D54-F194 HydrophobicContact CB-CD2 3.77Å; D54-F194 HydrophobicContact CB-CE2 3.3Å; D54-F194 HydrophobicContact CB-CZ 3.8Å; D54-Q319 CarbonylContact O-C 3.56Å; D54-Q319 VanDerWaalsContact O-CA 3.27Å; D54-Q319 WeakPolarHBondContact O-CA 3.32Å; D54-A320 PolarHBondContact N-O 3.49Å; D54-A320 PolarHBondContact O-N 2.95Å
55	L	95.9	Very high	93.3	Very high	126 Å²	126	75 Å²	75	66%	0.66	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.8	149.4	-179.9	-66	176.1	0	0	0	110.8
56	V	95.9	Very high	93.4	Very high	25 Å²	25	70.6 Å²	70.6	15%	0.152	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-76.7	132.7	-176	71	0	0	0	0	112.4	I189 F191 G318	V56-I189 HydrophobicContact CG2-CB 3.56Å; V56-I189 HydrophobicContact CG2-CD1 4.37Å; V56-I189 HydrophobicContact CG2-CG2 3.56Å; V56-F191 HydrophobicContact CB-CD1 4.36Å; V56-F191 HydrophobicContact CB-CE1 3.62Å; V56-F191 HydrophobicContact CB-CZ 4.06Å; V56-F191 HydrophobicContact CG2-CE1 4.03Å; V56-F191 HydrophobicContact CG2-CZ 4.06Å; V56-G318 VanDerWaalsContact CG1-N 3.33Å; V56-G318 PolarHBondContact N-O 3.38Å; V56-G318 VanDerWaalsContact N-O 3.14Å
57	V	95.1	Very high	93.5	Very high	85 Å²	85	65.5 Å²	65.5	52%	0.515	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.6	161.8	-179.2	0	0	0	0	107.8	I189 R190 P192	V57-I189 CarbonylContact O-C 3.59Å; V57-I189 WeakPolarHBondContact O-CA 3.26Å; V57-R190 PolarHBondContact N-O 3.1Å; V57-R190 PolarHBondContact O-N 3.04Å; V57-P192 HydrophobicContact CG2-CG 3.84Å
58	S	94.9	Very high	93.6	Very high	40 Å²	40	61.9 Å²	61.9	28%	0.28	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	153.1	-172.7	80	0	0	0	0	113.6	N188 V316	S58-N188 CarbonylContact C-O 3.58Å; S58-N188 WeakPolarHBondContact CA-O 3.47Å; S58-V316 WeakPolarHBondContact OG-CB 3.46Å
59	S	93.4	Very high	93.5	Very high	70 Å²	70	64.4 Å²	64.4	49%	0.49	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	132.6	168.7	177.2	0	0	0	0	108.4	N187 N188	S59-N187 WeakPolarHBondContact O-CA 3.29Å; S59-N187 PolarHBondContact O-ND2 2.8Å; S59-N188 PolarHBondContact N-O 2.78Å; S59-N188 PolarHBondContact O-N 3.04Å
60	V	94	Very high	93.2	Very high	14 Å²	14	59.7 Å²	59.7	9%	0.085	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.2	-177.1	-177.6	0	0	0	0	109.2	T62 I185 K186 N187 I314 V316	V60-T62 HydrophobicContact CG1-CG2 4.27Å; V60-I185 HydrophobicContact CG1-CG2 4.07Å; V60-K186 WeakPolarHBondContact CA-O 3.39Å; V60-N187 WeakPolarHBondContact CG2-ND2 3.47Å; V60-I314 HydrophobicContact CG1-CB 4.3Å; V60-I314 HydrophobicContact CG1-CD1 3.58Å; V60-I314 HydrophobicContact CG1-CG2 3.99Å; V60-I314 HydrophobicContact CG2-CG2 4.01Å; V60-V316 HydrophobicContact CG2-CG2 3.62Å
61	T	92.1	Very high	92.8	Very high	80 Å²	80	68 Å²	68	49%	0.491	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	136.5	167.6	53	0	0	0	0	109.1	K186	T61-K186 PolarHBondContact N-O 3.11Å; T61-K186 PolarHBondContact O-N 2.86Å; T61-K186 WeakPolarHBondContact OG1-CB 3Å
62	T	92.3	Very high	92	Very high	51 Å²	51	69 Å²	69	31%	0.313	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	149.9	-178.2	54.1	0	0	0	0	110.4	V60 F95 L184 I185 I314	V60-T62 HydrophobicContact CG1-CG2 4.27Å; T62-F95 HydrophobicContact CG2-CD1 3.81Å; T62-F95 HydrophobicContact CG2-CE1 4.15Å; T62-L184 WeakPolarHBondContact CA-O 3.45Å; T62-I185 HydrophobicContact CG2-CG1 4.4Å; T62-I314 HydrophobicContact CG2-CD1 3.21Å
63	K	92.1	Very high	90.8	Very high	123 Å²	123	71.9 Å²	71.9	54%	0.535	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	109.2	171.1	-174.2	168	-174.8	166.3	0	109.1	L184	K63-L184 HydrophobicContact CB-CB 4.48Å; K63-L184 PolarHBondContact N-O 2.91Å; K63-L184 PolarHBondContact O-N 2.99Å
64	V	92.7	Very high	89.4	Confident	11 Å²	11	72 Å²	72	7%	0.067	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	142.6	175.3	-169.1	0	0	0	0	109.2	V82 Y85 F95 V97 T182 V183	V64-V82 WeakPolarHBondContact O-CG2 3.46Å; V64-Y85 HydrophobicContact CB-CE2 4.4Å; V64-Y85 HydrophobicContact CG1-CE2 3.79Å; V64-F95 HydrophobicContact CG2-CD2 3.64Å; V64-F95 HydrophobicContact CG2-CE2 3.99Å; V64-F95 HydrophobicContact CG2-CG 4.28Å; V64-V97 HydrophobicContact CG1-CG2 4.43Å; V64-T182 CarbonylContact C-O 3.59Å; V64-T182 WeakPolarHBondContact CA-O 3.18Å; V64-V183 HydrophobicContact CG2-CB 4.47Å; V64-V183 HydrophobicContact CG2-CG2 4.13Å
65	K	92.9	Very high	88	Confident	126 Å²	126	73.2 Å²	73.2	55%	0.548	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	129.8	174.9	-70.6	-175	174.6	-174.8	0	109.8	T182	K65-T182 PolarHBondContact N-O 2.88Å; K65-T182 PolarHBondContact O-N 3.1Å; K65-T182 PolarHBondContact O-OG1 3Å
66	G	92.6	Very high	87.1	Confident	21 Å²	21	69 Å²	69	22%	0.216	40%	0.402	C	S	.	.			trans	171.7	155.6	-179.3	0	0	0	0	0	109.7	Y85 F181	G66-Y85 PolarHBondContact N-OH 2.89Å; G66-Y85 WeakPolarHBondContact O-CE1 3.19Å; G66-Y85 PolarHBondContact O-OH 2.69Å; G66-F181 VanDerWaalsContact CA-CD1 3.45Å
67	V	93.6	Very high	86.5	Confident	98 Å²	98	72.4 Å²	72.4	59%	0.594	42%	0.419	S	S	*	.			trans	-138	140.5	170	-68.3	0	0	0	0	108	L79 W80 D81 F181	V67-L79 HydrophobicContact CB-CD1 4.42Å; V67-W80 WeakPolarHBondContact CA-O 3.48Å; V67-D81 HydrophobicContact CG1-CB 4.45Å; V67-F181 WeakPolarHBondContact O-CE1 3.32Å
68	A	91.9	Very high	86	Confident	3 Å²	3	70.9 Å²	70.9	3%	0.025	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.9	175.5	0	0	0	0	0	109.5	W80 L175 A177 F181	A68-W80 PolarHBondContact N-O 3.01Å; A68-W80 PolarHBondContact O-N 3.2Å; A68-L175 HydrophobicContact CB-CD2 4.32Å; A68-L175 HydrophobicContact CB-CG 4.46Å; A68-A177 HydrophobicContact CB-CB 3.97Å; A68-F181 HydrophobicContact CB-CE1 4.31Å; A68-F181 HydrophobicContact CB-CZ 3.82Å
69	Q	90	Very high	85.8	Confident	137 Å²	137	73.9 Å²	73.9	64%	0.64	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.1	171.2	-171.2	177	43.2	0	0	108.5	N77 L78	Q69-N77 HydrophobicContact CG-CB 4.47Å; Q69-L78 WeakPolarHBondContact CA-O 3.41Å
70	T	86.9	Confident	85.6	Confident	10 Å²	10	70.9 Å²	70.9	6%	0.061	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.3	177.5	69.8	0	0	0	0	111.2	L72 N77 L78 W80 L174 L175	T70-L72 WeakPolarHBondContact OG1-CD1 3.39Å; T70-N77 CarbonylContact O-C 3.6Å; T70-N77 WeakPolarHBondContact O-CA 3.38Å; T70-L78 PolarHBondContact N-O 3.19Å; T70-L78 PolarHBondContact O-N 2.89Å; T70-W80 PolarHBondContact OG1-NE1 3.2Å; T70-L174 WeakPolarHBondContact CG2-O 3.46Å; T70-L175 HydrophobicContact CG2-CD1 4.15Å; T70-L175 HydrophobicContact CG2-CG 3.94Å
71	R	83.3	Confident	85.5	Confident	204 Å²	204	73.5 Å²	73.5	77%	0.77	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	106.2	174.7	-78.8	177.5	-175.5	-180	6.7	108.9	N77	R71-N77 WeakPolarHBondContact CG-OD1 3.21Å; R71-N77 PolarHBondContact NE-OD1 3.42Å; R71-N77 VanDerWaalsContact NE-OD1 3.16Å
72	L	76.5	Confident	85.3	Confident	24 Å²	24	72.2 Å²	72.2	13%	0.126	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.9	172.6	-82.9	103.9	0	0	0	110.7	T70 G74 V75 G76 L78 W80 V103	T70-L72 WeakPolarHBondContact OG1-CD1 3.39Å; L72-G74 PolarHBondContact O-N 2.95Å; L72-V75 HydrophobicContact CB-CB 4.04Å; L72-V75 HydrophobicContact CB-CG2 3.98Å; L72-V75 PolarHBondContact O-N 3.04Å; L72-V75 VanDerWaalsContact O-N 3.11Å; L72-G76 PolarHBondContact N-O 3.06Å; L72-G76 VanDerWaalsContact N-O 3.12Å; L72-G76 PolarHBondContact O-N 2.81Å; L72-G76 VanDerWaalsContact O-N 3.08Å; L72-L78 HydrophobicContact CD1-CB 4.36Å; L72-L78 HydrophobicContact CD1-CD2 4.22Å; L72-W80 HydrophobicContact CD1-CZ2 4.21Å; L72-V103 HydrophobicContact CD2-CB 4.23Å; L72-V103 HydrophobicContact CD2-CG2 3.74Å
73	T	69.1	Low	85.1	Confident	146 Å²	146	73.5 Å²	73.5	90%	0.896	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	120.2	171.8	47.4	0	0	0	0	109.8
74	G	65.1	Low	84.9	Confident	85 Å²	85	70 Å²	70	88%	0.876	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.8	-1.9	-178.7	0	0	0	0	0	116	L72	L72-G74 PolarHBondContact O-N 2.95Å
75	V	68.4	Low	84.6	Confident	58 Å²	58	69.5 Å²	69.5	35%	0.352	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-33.7	177.8	-170.9	0	0	0	0	112.6	L72 K105	L72-V75 HydrophobicContact CB-CB 4.04Å; L72-V75 HydrophobicContact CB-CG2 3.98Å; L72-V75 PolarHBondContact O-N 3.04Å; L72-V75 VanDerWaalsContact O-N 3.11Å; V75-K105 HydrophobicContact CG2-CD 4.12Å
76	G	76.9	Confident	83.8	Confident	39 Å²	39	64.9 Å²	64.9	40%	0.402	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	94	-156.4	-172.4	0	0	0	0	0	112.4	L72 L78	L72-G76 PolarHBondContact N-O 3.06Å; L72-G76 VanDerWaalsContact N-O 3.12Å; L72-G76 PolarHBondContact O-N 2.81Å; L72-G76 VanDerWaalsContact O-N 3.08Å; G76-L78 PolarHBondContact O-N 2.79Å
77	N	82.4	Confident	82.7	Confident	96 Å²	96	65 Å²	65	51%	0.513	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	118.6	177.9	-65.4	-38.8	0	0	0	109.7	Q69 T70 R71	Q69-N77 HydrophobicContact CG-CB 4.47Å; T70-N77 CarbonylContact O-C 3.6Å; T70-N77 WeakPolarHBondContact O-CA 3.38Å; R71-N77 WeakPolarHBondContact CG-OD1 3.21Å; R71-N77 PolarHBondContact NE-OD1 3.42Å; R71-N77 VanDerWaalsContact NE-OD1 3.16Å
78	L	84.8	Confident	81	Confident	53 Å²	53	66.4 Å²	66.4	28%	0.277	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130	175.3	-173.3	61.1	0	0	0	109.6	Q69 T70 L72 G76 W80	Q69-L78 WeakPolarHBondContact CA-O 3.41Å; T70-L78 PolarHBondContact N-O 3.19Å; T70-L78 PolarHBondContact O-N 2.89Å; L72-L78 HydrophobicContact CD1-CB 4.36Å; L72-L78 HydrophobicContact CD1-CD2 4.22Å; G76-L78 PolarHBondContact O-N 2.79Å; L78-W80 HydrophobicContact CD2-CD2 4.37Å; L78-W80 HydrophobicContact CD2-CH2 3.71Å; L78-W80 HydrophobicContact CD2-CZ2 3.24Å; L78-W80 HydrophobicContact CD2-CZ3 4.42Å; L78-W80 HydrophobicContact CG-CZ2 4.16Å
79	L	90.4	Very high	79.2	Confident	103 Å²	103	69.1 Å²	69.1	54%	0.539	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	131.8	171.9	-176.6	70.3	0	0	0	108.5	V67	V67-L79 HydrophobicContact CB-CD1 4.42Å
80	W	89.8	Confident	77.7	Confident	6 Å²	6	71.2 Å²	71.2	2%	0.023	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	118.7	175.3	-59.2	90	0	0	0	108.6	V67 A68 T70 L72 L78 D84 M98 V101 L175 Y305	V67-W80 WeakPolarHBondContact CA-O 3.48Å; A68-W80 PolarHBondContact N-O 3.01Å; A68-W80 PolarHBondContact O-N 3.2Å; T70-W80 PolarHBondContact OG1-NE1 3.2Å; L72-W80 HydrophobicContact CD1-CZ2 4.21Å; L78-W80 HydrophobicContact CD2-CD2 4.37Å; L78-W80 HydrophobicContact CD2-CH2 3.71Å; L78-W80 HydrophobicContact CD2-CZ2 3.24Å; L78-W80 HydrophobicContact CD2-CZ3 4.42Å; L78-W80 HydrophobicContact CG-CZ2 4.16Å; W80-D84 HydrophobicContact CE3-CB 3.65Å; W80-D84 HydrophobicContact CZ3-CB 4.16Å; W80-M98 HydrophobicContact CD2-CE 4.11Å; W80-M98 HydrophobicContact CE3-CE 3.34Å; W80-M98 HydrophobicContact CH2-CE 3.83Å; W80-M98 HydrophobicContact CZ2-CE 4.49Å; W80-M98 HydrophobicContact CZ3-CE 3.21Å; W80-V101 HydrophobicContact CH2-CG1 4.03Å; W80-V101 HydrophobicContact CZ2-CG1 3.85Å; W80-L175 HydrophobicContact CB-CD2 4Å; W80-L175 HydrophobicContact CD2-CD2 4.28Å; W80-L175 HydrophobicContact CG-CD2 3.85Å; W80-Y305 HydrophobicContact CH2-CE1 4.36Å
81	D	91.3	Very high	76.6	Confident	69 Å²	69	74.1 Å²	74.1	37%	0.369	45%	0.446	S	S	.	.			trans	-110.6	-178.2	173.1	83.4	-7	0	0	0	111.3	V67 A83 D84 Y85	V67-D81 HydrophobicContact CG1-CB 4.45Å; D81-A83 PolarHBondContact O-N 2.82Å; D81-A83 WeakPolarHBondContact OD1-CA 3.33Å; D81-A83 WeakPolarHBondContact OD1-CB 3.44Å; D81-A83 PolarHBondContact OD1-N 3.09Å; D81-D84 PolarHBondContact O-N 3.08Å; D81-D84 PolarHBondContact OD1-N 3.08Å; D81-Y85 WeakPolarHBondContact O-CD1 3.48Å; D81-Y85 WeakPolarHBondContact O-CE1 3.5Å; D81-Y85 PolarHBondContact O-N 3.01Å; D81-Y85 VanDerWaalsContact O-N 3.14Å
82	V	88.7	Confident	75.9	Confident	54 Å²	54	76 Å²	76	33%	0.327	45%	0.452	S	S	.	.	H	α-helix	trans	-52	-40.9	-179	-177	0	0	0	0	111.7	V64 D84 Y85 S86	V64-V82 WeakPolarHBondContact O-CG2 3.46Å; V82-D84 VanDerWaalsContact C-N 3.3Å; V82-D84 PolarHBondContact O-N 2.89Å; V82-Y85 VanDerWaalsContact CA-CZ 3.5Å; V82-Y85 VanDerWaalsContact CG2-OH 3.32Å; V82-Y85 WeakPolarHBondContact CG2-OH 3.37Å; V82-S86 WeakPolarHBondContact O-CB 3.47Å; V82-S86 PolarHBondContact O-N 3.02Å; V82-S86 VanDerWaalsContact O-N 3.08Å; V82-S86 PolarHBondContact O-OG 2.94Å
83	A	86.9	Confident	76.4	Confident	77 Å²	77	78 Å²	78	64%	0.636	46%	0.463	S	S	*	.	H	α-helix	trans	-69.1	-29.9	-176.4	0	0	0	0	0	112.3	D81	D81-A83 PolarHBondContact O-N 2.82Å; D81-A83 WeakPolarHBondContact OD1-CA 3.33Å; D81-A83 WeakPolarHBondContact OD1-CB 3.44Å; D81-A83 PolarHBondContact OD1-N 3.09Å
84	D	87.9	Confident	77.5	Confident	49 Å²	49	71.5 Å²	71.5	26%	0.262	42%	0.424	S	S	.	.	H	α-helix	trans	-82.9	-39.6	179.8	-68.1	-51.5	0	0	0	113.5	W80 D81 V82 K292	W80-D84 HydrophobicContact CE3-CB 3.65Å; W80-D84 HydrophobicContact CZ3-CB 4.16Å; D81-D84 PolarHBondContact O-N 3.08Å; D81-D84 PolarHBondContact OD1-N 3.08Å; V82-D84 VanDerWaalsContact C-N 3.3Å; V82-D84 PolarHBondContact O-N 2.89Å; D84-K292 IonicContact OD1-NZ 2.77Å; D84-K292 PolarHBondContact OD1-NZ 3.17Å
85	Y	86.4	Confident	78.8	Confident	1 Å²	1	68.1 Å²	68.1	0%	0.004	39%	0.385	C	S	.	.	H	α-helix	trans	-94.7	-17	-174.6	66.3	-113.8	0	0	0	115	V64 G66 D81 V82 G87 V97 M98 F181	V64-Y85 HydrophobicContact CB-CE2 4.4Å; V64-Y85 HydrophobicContact CG1-CE2 3.79Å; G66-Y85 PolarHBondContact N-OH 2.89Å; G66-Y85 WeakPolarHBondContact O-CE1 3.19Å; G66-Y85 PolarHBondContact O-OH 2.69Å; D81-Y85 WeakPolarHBondContact O-CD1 3.48Å; D81-Y85 WeakPolarHBondContact O-CE1 3.5Å; D81-Y85 PolarHBondContact O-N 3.01Å; D81-Y85 VanDerWaalsContact O-N 3.14Å; V82-Y85 VanDerWaalsContact CA-CZ 3.5Å; V82-Y85 VanDerWaalsContact CG2-OH 3.32Å; V82-Y85 WeakPolarHBondContact CG2-OH 3.37Å; Y85-G87 VanDerWaalsContact C-N 3.35Å; Y85-V97 HydrophobicContact CD2-CG1 4.09Å; Y85-V97 HydrophobicContact CE2-CG1 4.45Å; Y85-M98 PolarHBondContact O-N 2.85Å; Y85-M98 VanDerWaalsContact O-N 3.09Å; Y85-F181 AromaticContact CD1-CE2 3.73Å; Y85-F181 HydrophobicContact CD1-CE2 3.73Å; Y85-F181 HydrophobicContact CD1-CZ 4.31Å; Y85-F181 HydrophobicContact CD2-CE2 4.34Å; Y85-F181 HydrophobicContact CE1-CD2 4.1Å; Y85-F181 AromaticContact CE1-CE2 3.4Å; Y85-F181 HydrophobicContact CE1-CE2 3.4Å; Y85-F181 AromaticContact CE1-CZ 3.92Å; Y85-F181 HydrophobicContact CE1-CZ 3.92Å; Y85-F181 HydrophobicContact CE2-CD2 4.1Å; Y85-F181 HydrophobicContact CE2-CE2 4.08Å; Y85-F181 HydrophobicContact CG-CE2 4.22Å; Y85-F181 AromaticContact CZ-CD2 3.79Å; Y85-F181 AromaticContact CZ-CE2 3.59Å
86	S	77.3	Confident	79.9	Confident	29 Å²	29	66 Å²	66	20%	0.203	37%	0.371	C	S	.	.	S	Bend	trans	-83.9	-6.4	-174.5	77.5	0	0	0	0	114.8	V82 F96	V82-S86 WeakPolarHBondContact O-CB 3.47Å; V82-S86 PolarHBondContact O-N 3.02Å; V82-S86 VanDerWaalsContact O-N 3.08Å; V82-S86 PolarHBondContact O-OG 2.94Å; S86-F96 WeakPolarHBondContact CA-O 3.47Å
87	G	68.8	Low	80.7	Confident	23 Å²	23	64.1 Å²	64.1	24%	0.237	35%	0.352	C	S	.	.			trans	62.4	163.9	-172.4	0	0	0	0	0	113	Y85 S89	Y85-G87 VanDerWaalsContact C-N 3.35Å; G87-S89 VanDerWaalsContact C-N 3.3Å
88	S	58.2	Low	81.2	Confident	129 Å²	129	59.7 Å²	59.7	90%	0.902	33%	0.328	S	S	*	.	S	Bend	trans	-78.9	-13.7	176.6	74.3	0	0	0	0	113.3	Q90	S88-Q90 PolarHBondContact O-N 2.93Å; S88-Q90 VanDerWaalsContact O-N 3.12Å
89	S	53.8	Low	81.6	Confident	59 Å²	59	57.2 Å²	57.2	41%	0.413	32%	0.315	S	S	.	.			trans	-83.8	84.8	-177.5	58.4	0	0	0	0	111.3	G87 D91	G87-S89 VanDerWaalsContact C-N 3.3Å; S89-D91 PolarHBondContact O-N 3.17Å
90	Q	58.5	Low	81.7	Confident	182 Å²	182	52.3 Å²	52.3	85%	0.85	29%	0.29	S	S	*	.			trans	-74.9	71.7	159.1	-68.9	-176.4	13.1	0	0	108.9	S88 R92	S88-Q90 PolarHBondContact O-N 2.93Å; S88-Q90 VanDerWaalsContact O-N 3.12Å; Q90-R92 PolarHBondContact O-N 2.84Å
91	D	64.8	Low	81.8	Confident	71 Å²	71	52.1 Å²	52.1	38%	0.38	29%	0.289	S	S	.	.			trans	-53.4	136.6	170.4	-92	-1.4	0	0	0	109.3	S89 N93 S94 R311	S89-D91 PolarHBondContact O-N 3.17Å; D91-N93 PolarHBondContact O-N 2.9Å; D91-S94 WeakPolarHBondContact CB-OG 3.4Å; D91-S94 PolarHBondContact O-N 2.83Å; D91-S94 VanDerWaalsContact O-N 3.14Å; D91-R311 IonicContact OD2-CZ 2.78Å; D91-R311 IonicContact OD2-NH1 3.56Å; D91-R311 PolarHBondContact OD2-NH1 3.12Å; D91-R311 IonicContact OD2-NH2 3.61Å; D91-R311 PolarHBondContact OD2-NH2 2.75Å
92	R	68.8	Low	81.7	Confident	242 Å²	242	49.2 Å²	49.2	91%	0.913	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	105	177.3	-70	179.1	173.4	179.6	-1.5	108.1	Q90	Q90-R92 PolarHBondContact O-N 2.84Å
93	N	86.3	Confident	81.7	Confident	67 Å²	67	48.3 Å²	48.3	36%	0.358	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.8	16.5	-179.4	-45.6	-22.7	0	0	0	116.8	D91 I314	D91-N93 PolarHBondContact O-N 2.9Å; N93-I314 WeakPolarHBondContact O-CB 3.45Å; N93-I314 PolarHBondContact O-N 3.47Å
94	S	91.8	Very high	81.8	Confident	9 Å²	9	45.7 Å²	45.7	6%	0.063	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	164.1	166.9	70.7	0	0	0	0	112.1	D91 R311 F312 D313	D91-S94 WeakPolarHBondContact CB-OG 3.4Å; D91-S94 PolarHBondContact O-N 2.83Å; D91-S94 VanDerWaalsContact O-N 3.14Å; S94-R311 PolarHBondContact OG-NH2 3.47Å; S94-R311 VanDerWaalsContact OG-NH2 3.1Å; S94-F312 CarbonylContact C-O 3.55Å; S94-F312 WeakPolarHBondContact CA-O 3.22Å; S94-F312 VanDerWaalsContact CB-O 3.26Å; S94-F312 WeakPolarHBondContact CB-O 3.45Å; S94-D313 WeakPolarHBondContact CB-OD1 3.2Å
95	F	92.2	Very high	81.9	Confident	14 Å²	14	47.1 Å²	47.1	6%	0.061	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	146.9	172	64.1	-84.5	0	0	0	110.1	T62 V64 V97 V183 L226 I249 F312 I314	T62-F95 HydrophobicContact CG2-CD1 3.81Å; T62-F95 HydrophobicContact CG2-CE1 4.15Å; V64-F95 HydrophobicContact CG2-CD2 3.64Å; V64-F95 HydrophobicContact CG2-CE2 3.99Å; V64-F95 HydrophobicContact CG2-CG 4.28Å; F95-V97 HydrophobicContact CD2-CG2 3.85Å; F95-V97 HydrophobicContact CE2-CG2 3.93Å; F95-V183 HydrophobicContact CE1-CG2 3.99Å; F95-V183 HydrophobicContact CE2-CB 4.44Å; F95-V183 HydrophobicContact CE2-CG2 4.2Å; F95-V183 HydrophobicContact CZ-CB 4.12Å; F95-V183 HydrophobicContact CZ-CG1 4.03Å; F95-V183 HydrophobicContact CZ-CG2 3.76Å; F95-L226 HydrophobicContact CE2-CD2 4.21Å; F95-L226 HydrophobicContact CZ-CD2 4.46Å; F95-I249 HydrophobicContact CE1-CD1 3.81Å; F95-I249 HydrophobicContact CZ-CD1 4.17Å; F95-F312 HydrophobicContact CD1-CB 3.81Å; F95-F312 HydrophobicContact CD2-CB 4.15Å; F95-F312 AromaticContact CD2-CD2 3.95Å; F95-F312 HydrophobicContact CD2-CD2 3.95Å; F95-F312 HydrophobicContact CD2-CG 4.39Å; F95-F312 HydrophobicContact CE1-CB 3.34Å; F95-F312 HydrophobicContact CE1-CG 4.03Å; F95-F312 HydrophobicContact CE2-CB 3.71Å; F95-F312 AromaticContact CE2-CD2 3.29Å; F95-F312 HydrophobicContact CE2-CD2 3.29Å; F95-F312 HydrophobicContact CE2-CE2 4.03Å; F95-F312 AromaticContact CE2-CG 3.62Å; F95-F312 HydrophobicContact CE2-CG 3.62Å; F95-F312 HydrophobicContact CG-CB 4.2Å; F95-F312 HydrophobicContact CZ-CB 3.27Å; F95-F312 HydrophobicContact CZ-CD1 4.11Å; F95-F312 AromaticContact CZ-CD2 3.64Å; F95-F312 HydrophobicContact CZ-CD2 3.64Å; F95-F312 HydrophobicContact CZ-CE2 4.48Å; F95-F312 AromaticContact CZ-CG 3.41Å; F95-F312 HydrophobicContact CZ-CG 3.41Å; F95-F312 VanDerWaalsContact CZ-CG 3.41Å; F95-F312 PolarHBondContact N-O 2.97Å; F95-F312 PolarHBondContact O-N 2.89Å; F95-I314 HydrophobicContact CD1-CD1 4.31Å; F95-I314 HydrophobicContact CE1-CD1 4.19Å
96	F	92.4	Very high	82	Confident	13 Å²	13	51.8 Å²	51.8	6%	0.057	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	141.9	177.7	179.5	-98.4	0	0	0	110	S86 M98 L286 F288 G309 R311	S86-F96 WeakPolarHBondContact CA-O 3.47Å; F96-M98 HydrophobicContact CE1-CB 3.85Å; F96-L286 HydrophobicContact CD2-CD2 4.13Å; F96-L286 HydrophobicContact CE2-CD2 4.01Å; F96-F288 AromaticContact CD1-CE1 3.67Å; F96-F288 HydrophobicContact CD1-CE1 3.67Å; F96-F288 AromaticContact CD1-CZ 3.93Å; F96-F288 HydrophobicContact CD1-CZ 3.93Å; F96-F288 HydrophobicContact CD2-CE1 4.11Å; F96-F288 HydrophobicContact CE1-CD1 4.46Å; F96-F288 AromaticContact CE1-CE1 3.32Å; F96-F288 HydrophobicContact CE1-CE1 3.32Å; F96-F288 AromaticContact CE1-CZ 3.67Å; F96-F288 HydrophobicContact CE1-CZ 3.67Å; F96-F288 HydrophobicContact CE2-CD1 4.38Å; F96-F288 AromaticContact CE2-CE1 3.8Å; F96-F288 HydrophobicContact CE2-CE1 3.8Å; F96-F288 HydrophobicContact CG-CE1 4.04Å; F96-F288 HydrophobicContact CZ-CD1 4.16Å; F96-F288 AromaticContact CZ-CE1 3.38Å; F96-F288 HydrophobicContact CZ-CE1 3.38Å; F96-F288 HydrophobicContact CZ-CZ 4.18Å; F96-G309 VanDerWaalsContact CZ-CA 3.42Å; F96-R311 HydrophobicContact CD2-CB 4.34Å
97	V	93.6	Very high	82.7	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	113.8	171.7	-176.7	0	0	0	0	108.4	V64 Y85 F95 T99 A178 F181 L226 G309 I310 F312	V64-V97 HydrophobicContact CG1-CG2 4.43Å; Y85-V97 HydrophobicContact CD2-CG1 4.09Å; Y85-V97 HydrophobicContact CE2-CG1 4.45Å; F95-V97 HydrophobicContact CD2-CG2 3.85Å; F95-V97 HydrophobicContact CE2-CG2 3.93Å; V97-T99 PolarHBondContact O-N 3.43Å; V97-A178 HydrophobicContact CG1-CB 4.41Å; V97-F181 HydrophobicContact CG1-CD2 4.16Å; V97-L226 HydrophobicContact CB-CD1 4.17Å; V97-L226 HydrophobicContact CG1-CD1 3.86Å; V97-L226 HydrophobicContact CG2-CD1 3.85Å; V97-G309 CarbonylContact O-C 3.57Å; V97-G309 WeakPolarHBondContact O-CA 3.4Å; V97-I310 PolarHBondContact N-O 3.42Å; V97-I310 PolarHBondContact O-N 3.41Å; V97-F312 HydrophobicContact CG2-CD2 4.43Å; V97-F312 HydrophobicContact CG2-CE2 4.28Å
98	M	93.1	Very high	83.8	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	130.1	174.1	-174.6	172.1	65	0	0	110.9	W80 Y85 F96 N100 V101 A307	W80-M98 HydrophobicContact CD2-CE 4.11Å; W80-M98 HydrophobicContact CE3-CE 3.34Å; W80-M98 HydrophobicContact CH2-CE 3.83Å; W80-M98 HydrophobicContact CZ2-CE 4.49Å; W80-M98 HydrophobicContact CZ3-CE 3.21Å; Y85-M98 PolarHBondContact O-N 2.85Å; Y85-M98 VanDerWaalsContact O-N 3.09Å; F96-M98 HydrophobicContact CE1-CB 3.85Å; M98-N100 WeakPolarHBondContact CG-O 3.23Å; M98-V101 HydrophobicContact SD-CB 3.91Å; M98-V101 HydrophobicContact SD-CG2 4.04Å; M98-A307 HydrophobicContact CG-CB 3.98Å; M98-A307 HydrophobicContact SD-CB 3.63Å
99	T	93.4	Very high	85.5	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	-24	179.2	55.6	0	0	0	0	112.4	V97 L175 A178 F237 A241 F308 G309 I310	V97-T99 PolarHBondContact O-N 3.43Å; T99-L175 WeakPolarHBondContact O-CA 3.45Å; T99-L175 WeakPolarHBondContact O-CB 3.34Å; T99-L175 PolarHBondContact O-N 2.8Å; T99-A178 HydrophobicContact CG2-CB 4.35Å; T99-F237 HydrophobicContact CG2-CE1 4.43Å; T99-F237 HydrophobicContact CG2-CZ 4.02Å; T99-A241 WeakPolarHBondContact CB-O 3.28Å; T99-A241 HydrophobicContact CG2-CB 4.21Å; T99-A241 WeakPolarHBondContact OG1-CA 3.42Å; T99-A241 PolarHBondContact OG1-O 2.87Å; T99-F308 PolarHBondContact N-O 2.81Å; T99-F308 PolarHBondContact OG1-O 3.45Å; T99-G309 WeakPolarHBondContact OG1-CA 3.4Å; T99-I310 HydrophobicContact CG2-CD1 4.27Å; T99-I310 HydrophobicContact CG2-CG1 4.17Å
100	N	92.3	Very high	87.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	154.1	176.6	-141.5	0.2	0	0	0	110.8	M98 P170 L174 V242 F308	M98-N100 WeakPolarHBondContact CG-O 3.23Å; N100-P170 PolarHBondContact ND2-O 2.9Å; N100-P170 WeakPolarHBondContact OD1-CG 3.45Å; N100-L174 WeakPolarHBondContact OD1-CG 3.3Å; N100-L174 PolarHBondContact OD1-N 2.81Å; N100-V242 PolarHBondContact ND2-O 2.95Å; N100-F308 HydrophobicContact CB-CB 3.91Å; N100-F308 HydrophobicContact CB-CD2 4.23Å; N100-F308 HydrophobicContact CB-CG 4.42Å; N100-F308 PolarHBondContact N-O 3.33Å; N100-F308 PolarHBondContact O-N 2.9Å
101	V	90.4	Very high	88.9	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.012	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	140.5	-178.8	66.3	0	0	0	0	111.5	W80 M98 V103 L174 Y305 K306	W80-V101 HydrophobicContact CH2-CG1 4.03Å; W80-V101 HydrophobicContact CZ2-CG1 3.85Å; M98-V101 HydrophobicContact SD-CB 3.91Å; M98-V101 HydrophobicContact SD-CG2 4.04Å; V101-V103 HydrophobicContact CG1-CG2 4.22Å; V101-V103 HydrophobicContact CG2-CG2 3.91Å; V101-L174 HydrophobicContact CG1-CD1 3.95Å; V101-L174 WeakPolarHBondContact O-CD1 3.48Å; V101-Y305 HydrophobicContact CG2-CD1 4.02Å; V101-K306 WeakPolarHBondContact CA-O 3.35Å
102	I	90	Very high	90.2	Very high	9 Å²	9	48.1 Å²	48.1	5%	0.046	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	128.7	166.1	-59	173.5	0	0	0	106.9	Q166 K306 F308	I102-Q166 HydrophobicContact CD1-CG 4.43Å; I102-Q166 WeakPolarHBondContact CD1-O 3.37Å; I102-Q166 HydrophobicContact CG2-CB 4.41Å; I102-K306 HydrophobicContact CB-CB 4.29Å; I102-K306 HydrophobicContact CD1-CD 4.45Å; I102-K306 PolarHBondContact N-O 2.83Å; I102-K306 PolarHBondContact O-N 3.44Å; I102-F308 HydrophobicContact CD1-CE2 3.9Å; I102-F308 HydrophobicContact CD1-CZ 4.28Å; I102-F308 HydrophobicContact CG1-CE2 4.07Å
103	V	88.8	Confident	91.2	Very high	35 Å²	35	37.4 Å²	37.4	21%	0.212	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	119.7	-174.8	-173.3	0	0	0	0	109.3	L72 V101 K105 T303 L304 Y305	L72-V103 HydrophobicContact CD2-CB 4.23Å; L72-V103 HydrophobicContact CD2-CG2 3.74Å; V101-V103 HydrophobicContact CG1-CG2 4.22Å; V101-V103 HydrophobicContact CG2-CG2 3.91Å; V103-K105 HydrophobicContact CG1-CG 4.02Å; V103-T303 HydrophobicContact CG1-CG2 3.59Å; V103-L304 WeakPolarHBondContact CA-O 3.35Å; V103-Y305 HydrophobicContact CG1-CD1 4.2Å; V103-Y305 HydrophobicContact CG1-CE1 3.85Å; V103-Y305 HydrophobicContact CG2-CD1 3.77Å; V103-Y305 HydrophobicContact CG2-CE1 3.86Å
104	T	89.8	Confident	91.3	Very high	21 Å²	21	35.1 Å²	35.1	13%	0.129	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	107.5	173	-51.3	0	0	0	0	108.4	Q107 P162 T303 L304	T104-Q107 HydrophobicContact CG2-CG 3.93Å; T104-P162 WeakPolarHBondContact CG2-O 3.44Å; T104-T303 WeakPolarHBondContact O-CA 3.3Å; T104-L304 PolarHBondContact N-O 3Å; T104-L304 PolarHBondContact O-N 2.97Å
105	K	88.6	Confident	90.9	Very high	79 Å²	79	35.6 Å²	35.6	34%	0.343	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	162.2	-176.4	-71.1	-169.8	167.8	-170.4	0	112.8	V75 V103 Q107 T303	V75-K105 HydrophobicContact CG2-CD 4.12Å; V103-K105 HydrophobicContact CG1-CG 4.02Å; K105-Q107 PolarHBondContact O-N 3.43Å; K105-T303 HydrophobicContact CG-CG2 3.96Å
106	N	88.5	Confident	90.3	Very high	99 Å²	99	36.6 Å²	36.6	53%	0.529	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	54.6	36.2	167.9	-50.6	-13.6	0	0	0	112.9	K108	N106-K108 PolarHBondContact O-N 3.47Å
107	Q	92.5	Very high	89	Confident	4 Å²	4	38.5 Å²	38.5	2%	0.019	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	129.2	175	-69.4	-164.1	-36.3	0	0	109.3	T104 K105 W160 C161 P162 E301 R302	T104-Q107 HydrophobicContact CG2-CG 3.93Å; K105-Q107 PolarHBondContact O-N 3.43Å; Q107-W160 HydrophobicContact CB-CB 4.16Å; Q107-W160 HydrophobicContact CB-CE3 4.12Å; Q107-W160 PolarHBondContact NE2-O 3.3Å; Q107-C161 CarbonylContact C-O 3.47Å; Q107-C161 VanDerWaalsContact CA-O 3.28Å; Q107-C161 WeakPolarHBondContact CA-O 3.28Å; Q107-P162 PolarHBondContact NE2-O 3.04Å; Q107-E301 CarbonylContact O-C 3.5Å; Q107-E301 VanDerWaalsContact O-CA 3.3Å; Q107-E301 WeakPolarHBondContact O-CA 3.24Å; Q107-R302 HydrophobicContact CB-CG 3.77Å; Q107-R302 WeakPolarHBondContact CB-O 3.33Å; Q107-R302 PolarHBondContact N-O 3.38Å; Q107-R302 PolarHBondContact O-N 3.29Å; Q107-R302 VanDerWaalsContact OE1-NH2 3.14Å
108	K	93.1	Very high	87.4	Confident	84 Å²	84	47.5 Å²	47.5	37%	0.365	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	150.1	175	-69.5	177.2	-178.4	-173.4	0	109.7	N106 G110 W160 C161 V299 E301	N106-K108 PolarHBondContact O-N 3.47Å; K108-G110 PolarHBondContact O-N 3.35Å; K108-W160 CarbonylContact O-C 3.58Å; K108-W160 WeakPolarHBondContact O-CA 3.12Å; K108-C161 PolarHBondContact N-O 2.84Å; K108-C161 PolarHBondContact O-N 3.03Å; K108-V299 HydrophobicContact CD-CG1 4.22Å; K108-V299 HydrophobicContact CG-CG1 4.37Å; K108-E301 HydrophobicContact CD-CG 4.4Å; K108-E301 VanDerWaalsContact CE-CG 3.45Å; K108-E301 WeakPolarHBondContact CE-OE1 3.37Å; K108-E301 HydrophobicContact CG-CG 3.92Å; K108-E301 IonicContact NZ-OE1 3.03Å; K108-E301 PolarHBondContact NZ-OE1 3.07Å
109	Q	92	Very high	85.8	Confident	136 Å²	136	50.1 Å²	50.1	64%	0.636	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	125.6	168.2	-66.1	-177	13.8	0	0	109.2	W160	Q109-W160 HydrophobicContact CG-CD2 3.89Å; Q109-W160 HydrophobicContact CG-CE3 4Å; Q109-W160 HydrophobicContact CG-CH2 3.83Å; Q109-W160 HydrophobicContact CG-CZ2 3.7Å; Q109-W160 HydrophobicContact CG-CZ3 3.96Å
110	G	92.3	Very high	84.6	Confident	35 Å²	35	58 Å²	58	36%	0.361	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.1	-166.5	-177.4	0	0	0	0	0	111.9	K108 S158 A159	K108-G110 PolarHBondContact O-N 3.35Å; G110-S158 WeakPolarHBondContact O-CA 3.31Å; G110-A159 PolarHBondContact N-O 2.64Å; G110-A159 PolarHBondContact O-N 3.45Å; G110-A159 VanDerWaalsContact O-O 3.05Å
111	K	92.6	Very high	84.3	Confident	134 Å²	134	62.4 Å²	62.4	58%	0.583	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.3	130.1	177.2	-61.4	-177.6	176.7	-169.3	0	109.7	T142 E156 V157	K111-T142 HydrophobicContact CD-CG2 4.24Å; K111-T142 HydrophobicContact CG-CG2 4.48Å; K111-E156 HydrophobicContact CB-CG 3.99Å; K111-V157 WeakPolarHBondContact CA-O 3.36Å
112	C	91.1	Very high	84.2	Confident	24 Å²	24	62.7 Å²	62.7	16%	0.162	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	165.3	176.4	53.8	0	0	0	0	111.7	V157 C161	C112-V157 PolarHBondContact N-O 3.4Å; C112-V157 VanDerWaalsContact N-O 3.09Å; C112-V157 WeakPolarHBondContact O-CG2 3.36Å; C112-V157 PolarHBondContact O-N 3.3Å; C112-C161 HydrophobicContact CB-CB 3.67Å; C112-C161 WeakPolarHBondContact CB-SG 3.35Å; C112-C161 PolarHBondContact N-SG 3.03Å; C112-C161 VanDerWaalsContact N-SG 3.43Å; C112-C161 WeakPolarHBondContact SG-CB 3.49Å; C112-C161 CovalentContact SG-SG 2.03Å; C112-C161 PolarHBondContact SG-SG 3.45Å
113	A	90.1	Very high	84.1	Confident	16 Å²	16	72.8 Å²	72.8	13%	0.132	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	129.8	178.5	0	0	0	0	0	110.1	I146 F148	A113-I146 HydrophobicContact CB-CD1 3.62Å; A113-I146 HydrophobicContact CB-CG1 3.75Å; A113-F148 HydrophobicContact CB-CB 4.01Å; A113-F148 HydrophobicContact CB-CD2 3.86Å; A113-F148 HydrophobicContact CB-CG 4.45Å
114	E	87.9	Confident	84.1	Confident	20 Å²	20	73.5 Å²	73.5	9%	0.093	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-65.4	148.7	174.9	-175.9	55.1	-104.3	0	0	110.8	H138 T154 C155 V157	E114-H138 IonicContact OE1-CE1 3.45Å; E114-H138 IonicContact OE1-CG 3.4Å; E114-H138 IonicContact OE1-ND1 2.87Å; E114-H138 PolarHBondContact OE1-ND1 2.84Å; E114-H138 PolarHBondContact OE2-N 3.08Å; E114-H138 IonicContact OE2-ND1 3.1Å; E114-T154 VanDerWaalsContact O-CB 3.25Å; E114-T154 WeakPolarHBondContact O-CB 3.37Å; E114-T154 WeakPolarHBondContact O-CG2 3.44Å; E114-T154 PolarHBondContact O-OG1 2.84Å; E114-C155 WeakPolarHBondContact CB-O 3.44Å; E114-C155 PolarHBondContact N-O 2.85Å; E114-V157 HydrophobicContact CB-CG1 3.96Å; E114-V157 HydrophobicContact CB-CG2 4.04Å; E114-V157 HydrophobicContact CG-CG1 4.39Å
115	V	85.3	Confident	84.1	Confident	18 Å²	18	77 Å²	77	11%	0.109	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-77.1	131.8	178.3	178.3	0	0	0	0	108.3	S117 F148 I163 T165	V115-S117 VanDerWaalsContact C-N 3.3Å; V115-S117 PolarHBondContact O-N 3.1Å; V115-F148 HydrophobicContact CG2-CE2 4Å; V115-F148 HydrophobicContact CG2-CZ 4.31Å; V115-I163 HydrophobicContact CB-CG2 4.47Å; V115-I163 HydrophobicContact CG2-CB 4.05Å; V115-I163 HydrophobicContact CG2-CG2 3.63Å; V115-T165 HydrophobicContact CG2-CG2 4.14Å
116	P	78.6	Confident	84	Confident	36 Å²	36	82 Å²	82	23%	0.234	42%	0.415	C	S	.	.			trans	-67	85.1	-176.9	23.7	-31.4	0	0	0	111.8	K118 L121 F148 T154	P116-K118 PolarHBondContact O-N 2.93Å; P116-L121 HydrophobicContact CB-CD2 4.32Å; P116-F148 HydrophobicContact CG-CD1 4.39Å; P116-F148 HydrophobicContact CG-CE1 4.4Å; P116-T154 HydrophobicContact CB-CG2 3.95Å; P116-T154 HydrophobicContact CG-CG2 4.35Å
117	S	65.3	Low	83.9	Confident	53 Å²	53	81.3 Å²	81.3	37%	0.371	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-75.1	119.9	173.6	-175.4	0	0	0	0	109.2	V115 G119 R120 Q136	V115-S117 VanDerWaalsContact C-N 3.3Å; V115-S117 PolarHBondContact O-N 3.1Å; S117-G119 PolarHBondContact O-N 3.05Å; S117-R120 PolarHBondContact O-N 3.36Å; S117-Q136 PolarHBondContact OG-OE1 3.03Å
118	K	60.9	Low	83.7	Confident	190 Å²	190	81.6 Å²	81.6	83%	0.826	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	48	33.7	178.5	-64	-178.3	179.1	176.4	0	115.5	P116	P116-K118 PolarHBondContact O-N 2.93Å
119	G	58.3	Low	83.5	Confident	56 Å²	56	84.2 Å²	84.2	58%	0.577	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	86.4	15.7	167.8	0	0	0	0	0	116.7	S117 L121	S117-G119 PolarHBondContact O-N 3.05Å; G119-L121 VanDerWaalsContact C-N 3.33Å; G119-L121 PolarHBondContact O-N 3.28Å
120	R	69.1	Low	83.5	Confident	166 Å²	166	85.9 Å²	85.9	63%	0.626	44%	0.435	S	S	*	.			trans	-74.4	86.6	171.9	-149.2	173.3	-176.7	173.2	-1.8	110.1	S117 D134	S117-R120 PolarHBondContact O-N 3.36Å; R120-D134 IonicContact NH1-OD2 2.78Å; R120-D134 PolarHBondContact NH1-OD2 2.89Å
121	L	85.5	Confident	83.3	Confident	94 Å²	94	86.5 Å²	86.5	49%	0.492	44%	0.441	S	S	.	.			trans	-98.3	138.8	176.1	-66.2	163	0	0	0	108.8	P116 G119 K152 K153 T154	P116-L121 HydrophobicContact CB-CD2 4.32Å; G119-L121 VanDerWaalsContact C-N 3.33Å; G119-L121 PolarHBondContact O-N 3.28Å; L121-K152 HydrophobicContact CD2-CB 3.94Å; L121-K152 HydrophobicContact CD2-CG 4.13Å; L121-K153 WeakPolarHBondContact CD2-O 3.41Å; L121-T154 HydrophobicContact CD2-CG2 4.36Å
122	C	88.1	Confident	83	Confident	7 Å²	7	81.2 Å²	81.2	5%	0.047	42%	0.423	C	S	.	.			trans	-94.3	146.5	169.9	68.7	0	0	0	0	109.2	D127 C145 K153 T154	C122-D127 HydrophobicContact CB-CB 3.99Å; C122-C145 HydrophobicContact CB-CB 3.82Å; C122-C145 WeakPolarHBondContact CB-SG 3.5Å; C122-C145 WeakPolarHBondContact SG-CA 3.33Å; C122-C145 WeakPolarHBondContact SG-CB 3.47Å; C122-C145 CovalentContact SG-SG 2.03Å; C122-C145 PolarHBondContact SG-SG 2.86Å; C122-K153 PolarHBondContact N-O 3.45Å; C122-K153 VanDerWaalsContact N-O 3.08Å; C122-K153 VanDerWaalsContact O-CB 3.29Å; C122-K153 WeakPolarHBondContact O-CB 3.49Å; C122-K153 VanDerWaalsContact SG-C 3.54Å; C122-T154 WeakPolarHBondContact SG-CA 3.42Å; C122-T154 PolarHBondContact SG-N 3.34Å; C122-T154 VanDerWaalsContact SG-N 3.38Å; C122-T154 PolarHBondContact SG-O 2.8Å; C122-T154 VanDerWaalsContact SG-O 3.35Å
123	R	87.3	Confident	82.8	Confident	221 Å²	221	89.3 Å²	89.3	83%	0.834	45%	0.45	S	S	*	.	S	Bend	trans	-103.6	-38	169.8	-65.4	-177.9	178.1	-169.1	0.3	110.3	D127	R123-D127 WeakPolarHBondContact CA-OD2 3.35Å; R123-D127 PolarHBondContact N-OD2 2.71Å
124	S	88.9	Confident	82.4	Confident	50 Å²	50	91.5 Å²	91.5	35%	0.35	46%	0.459	S	S	.	.	S	Bend	trans	-136.6	163.9	-177.1	70.9	0	0	0	0	111.6	Q126 D127 C145	S124-Q126 PolarHBondContact O-N 3.28Å; S124-D127 PolarHBondContact N-OD2 3.34Å; S124-D127 WeakPolarHBondContact O-CB 3.36Å; S124-D127 PolarHBondContact O-N 2.96Å; S124-D127 VanDerWaalsContact O-N 3.09Å; S124-D127 PolarHBondContact OG-OD2 3.32Å; S124-C145 VanDerWaalsContact C-CB 3.44Å; S124-C145 WeakPolarHBondContact O-CB 3.33Å
125	D	89.6	Confident	81.9	Confident	95 Å²	95	99.1 Å²	99.1	51%	0.508	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-61.4	-26.4	179.1	-60.6	-20.6	0	0	0	112.2	D127 C128 G143 C145	D125-D127 PolarHBondContact O-N 2.96Å; D125-C128 PolarHBondContact O-N 3.49Å; D125-C128 VanDerWaalsContact O-N 3.08Å; D125-G143 VanDerWaalsContact O-O 3.14Å; D125-C145 WeakPolarHBondContact OD1-CA 3.49Å; D125-C145 VanDerWaalsContact OD1-CB 3.28Å; D125-C145 WeakPolarHBondContact OD1-CB 3.07Å; D125-C145 PolarHBondContact OD1-N 3.47Å
126	Q	86.2	Confident	81.5	Confident	183 Å²	183	102.8 Å²	102.8	86%	0.855	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-65.9	-19	176.5	-63.7	-179.7	-2.7	0	0	113.7	S124 C128	S124-Q126 PolarHBondContact O-N 3.28Å; Q126-C128 PolarHBondContact O-N 2.89Å
127	D	87.1	Confident	81.7	Confident	86 Å²	86	102.4 Å²	102.4	46%	0.46	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-77.6	-9.8	176.5	-56	-45.6	0	0	0	112.1	C122 R123 S124 D125	C122-D127 HydrophobicContact CB-CB 3.99Å; R123-D127 WeakPolarHBondContact CA-OD2 3.35Å; R123-D127 PolarHBondContact N-OD2 2.71Å; S124-D127 PolarHBondContact N-OD2 3.34Å; S124-D127 WeakPolarHBondContact O-CB 3.36Å; S124-D127 PolarHBondContact O-N 2.96Å; S124-D127 VanDerWaalsContact O-N 3.09Å; S124-D127 PolarHBondContact OG-OD2 3.32Å; D125-D127 PolarHBondContact O-N 2.96Å
128	C	88.4	Confident	82.7	Confident	9 Å²	9	104 Å²	104	6%	0.061	51%	0.51	C	S	.	.	S	Bend	trans	-113	122.4	-177.2	-56	0	0	0	0	109.3	D125 Q126 G143 C155	D125-C128 PolarHBondContact O-N 3.49Å; D125-C128 VanDerWaalsContact O-N 3.08Å; Q126-C128 PolarHBondContact O-N 2.89Å; C128-G143 WeakPolarHBondContact O-CA 3.44Å; C128-C155 VanDerWaalsContact CA-SG 3.55Å; C128-C155 HydrophobicContact CB-CB 3.81Å; C128-C155 WeakPolarHBondContact CB-SG 3.36Å; C128-C155 WeakPolarHBondContact SG-CA 3.37Å; C128-C155 WeakPolarHBondContact SG-CB 3.36Å; C128-C155 CovalentContact SG-SG 2.04Å; C128-C155 PolarHBondContact SG-SG 2.9Å
129	E	89.8	Confident	84.1	Confident	140 Å²	140	95.7 Å²	95.7	65%	0.654	48%	0.479	S	S	*	.			trans	-94	124.4	-179.6	-72.2	177.2	-177.1	0	0	109.6	G131 A132 Q141	E129-G131 PolarHBondContact O-N 3Å; E129-A132 HydrophobicContact CB-CB 3.64Å; E129-A132 WeakPolarHBondContact O-CB 3.22Å; E129-A132 PolarHBondContact O-N 2.84Å; E129-Q141 WeakPolarHBondContact O-CB 3.4Å; E129-Q141 PolarHBondContact O-OE1 2.84Å
130	E	91	Very high	85.7	Confident	171 Å²	171	97.6 Å²	97.6	80%	0.799	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	130.7	178	-172.1	177.3	-171.9	0	0	110.8	A132	E130-A132 PolarHBondContact O-N 2.91Å
131	G	88.7	Confident	86.7	Confident	47 Å²	47	90.7 Å²	90.7	49%	0.485	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	-2.9	-178.1	0	0	0	0	0	114.7	E129 Q141	E129-G131 PolarHBondContact O-N 3Å; G131-Q141 PolarHBondContact N-O 2.79Å
132	A	86.8	Confident	87	Confident	24 Å²	24	87.3 Å²	87.3	20%	0.198	43%	0.433	C	S	.	.			trans	-71.3	144.6	178.1	0	0	0	0	0	112.1	E129 E130 Q141	E129-A132 HydrophobicContact CB-CB 3.64Å; E129-A132 WeakPolarHBondContact O-CB 3.22Å; E129-A132 PolarHBondContact O-N 2.84Å; E130-A132 PolarHBondContact O-N 2.91Å; A132-Q141 HydrophobicContact CB-CB 4.47Å; A132-Q141 PolarHBondContact O-N 2.9Å
133	W	85.9	Confident	87.1	Confident	194 Å²	194	87.8 Å²	87.8	74%	0.735	44%	0.439	S	S	*	.			trans	-138.4	149	171.6	72.8	-85.2	0	0	0	109.8
134	D	81.1	Confident	87.3	Confident	61 Å²	61	79.5 Å²	79.5	33%	0.326	42%	0.415	S	S	.	.			trans	-129.7	156.2	177.8	-177.6	9.5	0	0	0	108.3	R120 Q136 S137	R120-D134 IonicContact NH1-OD2 2.78Å; R120-D134 PolarHBondContact NH1-OD2 2.89Å; D134-Q136 PolarHBondContact O-N 3.02Å; D134-Q136 VanDerWaalsContact O-N 3.09Å; D134-S137 WeakPolarHBondContact O-CB 3.36Å; D134-S137 PolarHBondContact O-N 2.97Å
135	Q	78.1	Confident	87.4	Confident	180 Å²	180	77.7 Å²	77.7	84%	0.841	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.8	176.8	-69.8	-179.5	-13.5	0	0	113
136	Q	76.4	Confident	87.5	Confident	95 Å²	95	75.7 Å²	75.7	44%	0.444	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-7.6	177.9	-61.3	178.9	21.1	0	0	113.6	S117 D134	S117-Q136 PolarHBondContact OG-OE1 3.03Å; D134-Q136 PolarHBondContact O-N 3.02Å; D134-Q136 VanDerWaalsContact O-N 3.09Å
137	S	82.4	Confident	87.7	Confident	29 Å²	29	76.5 Å²	76.5	20%	0.203	39%	0.386	C	S	.	.			trans	-77.7	141	178.7	-169.2	0	0	0	0	110.4	D134 G139	D134-S137 WeakPolarHBondContact O-CB 3.36Å; D134-S137 PolarHBondContact O-N 2.97Å; S137-G139 VanDerWaalsContact C-N 3.34Å; S137-G139 PolarHBondContact OG-O 2.88Å
138	H	87.3	Confident	87.6	Confident	86 Å²	86	75.8 Å²	75.8	40%	0.398	38%	0.379	S	S	.	.	S	Bend	trans	-86.5	-9.4	177	-63.5	91.2	0	0	0	112.7	E114 I163	E114-H138 IonicContact OE1-CE1 3.45Å; E114-H138 IonicContact OE1-CG 3.4Å; E114-H138 IonicContact OE1-ND1 2.87Å; E114-H138 PolarHBondContact OE1-ND1 2.84Å; E114-H138 PolarHBondContact OE2-N 3.08Å; E114-H138 IonicContact OE2-ND1 3.1Å; H138-I163 HydrophobicContact CB-CD1 4.28Å; H138-I163 HydrophobicContact CB-CG1 4.3Å; H138-I163 HydrophobicContact CB-CG2 3.9Å; H138-I163 WeakPolarHBondContact ND1-CG2 3.39Å
139	G	89.8	Confident	87.4	Confident	16 Å²	16	79.5 Å²	79.5	17%	0.165	40%	0.398	C	S	.	.	S	Bend	trans	-161.9	-164.7	177.2	0	0	0	0	0	113.6	S137	S137-G139 VanDerWaalsContact C-N 3.34Å; S137-G139 PolarHBondContact OG-O 2.88Å
140	I	92.1	Very high	87.1	Confident	95 Å²	95	79 Å²	79	49%	0.487	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	130.7	-177.8	-58.3	171.4	0	0	0	109.2	V157 S158	I140-V157 CarbonylContact O-C 3.59Å; I140-V157 VanDerWaalsContact O-CA 3.26Å; I140-V157 WeakPolarHBondContact O-CA 3.35Å; I140-S158 PolarHBondContact N-O 3.48Å; I140-S158 PolarHBondContact O-N 3.28Å
141	Q	91.1	Very high	86.7	Confident	22 Å²	22	79 Å²	79	10%	0.103	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	139.4	179.2	-68.6	-172.9	3.2	0	0	112	E129 G131 A132 C155 V157	E129-Q141 WeakPolarHBondContact O-CB 3.4Å; E129-Q141 PolarHBondContact O-OE1 2.84Å; G131-Q141 PolarHBondContact N-O 2.79Å; A132-Q141 HydrophobicContact CB-CB 4.47Å; A132-Q141 PolarHBondContact O-N 2.9Å; Q141-C155 HydrophobicContact CG-CB 4.46Å; Q141-V157 HydrophobicContact CG-CG1 4.04Å
142	T	91.6	Very high	86.6	Confident	22 Å²	22	81.5 Å²	81.5	14%	0.135	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-6.2	177.4	60	0	0	0	0	113.5	K111 E156 S158	K111-T142 HydrophobicContact CD-CG2 4.24Å; K111-T142 HydrophobicContact CG-CG2 4.48Å; T142-E156 WeakPolarHBondContact CB-OE2 3.15Å; T142-E156 HydrophobicContact CG2-CG 4.34Å; T142-E156 PolarHBondContact N-O 3.12Å; T142-E156 VanDerWaalsContact OG1-CB 3.29Å; T142-E156 WeakPolarHBondContact OG1-CB 3.46Å; T142-E156 WeakPolarHBondContact OG1-CG 3.4Å; T142-E156 PolarHBondContact OG1-O 3.33Å; T142-E156 PolarHBondContact OG1-OE2 3.06Å; T142-S158 VanDerWaalsContact CG2-OG 3.31Å; T142-S158 WeakPolarHBondContact CG2-OG 3.46Å
143	G	89.7	Confident	86.8	Confident	17 Å²	17	84.3 Å²	84.3	18%	0.175	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	84.6	3.5	-176.5	0	0	0	0	0	115.3	D125 C128	D125-G143 VanDerWaalsContact O-O 3.14Å; C128-G143 WeakPolarHBondContact O-CA 3.44Å
144	S	91.6	Very high	87	Confident	47 Å²	47	75.1 Å²	75.1	33%	0.329	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	139.5	178.4	-62.3	0	0	0	0	112.3	C155 E156	S144-C155 CarbonylContact O-C 3.59Å; S144-C155 WeakPolarHBondContact O-CA 3.26Å; S144-E156 PolarHBondContact O-N 3.46Å
145	C	91.5	Very high	87.4	Confident	13 Å²	13	73 Å²	73	9%	0.088	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	103	177.5	177.6	0	0	0	0	111.2	C122 S124 D125	C122-C145 HydrophobicContact CB-CB 3.82Å; C122-C145 WeakPolarHBondContact CB-SG 3.5Å; C122-C145 WeakPolarHBondContact SG-CA 3.33Å; C122-C145 WeakPolarHBondContact SG-CB 3.47Å; C122-C145 CovalentContact SG-SG 2.03Å; C122-C145 PolarHBondContact SG-SG 2.86Å; S124-C145 VanDerWaalsContact C-CB 3.44Å; S124-C145 WeakPolarHBondContact O-CB 3.33Å; D125-C145 WeakPolarHBondContact OD1-CA 3.49Å; D125-C145 VanDerWaalsContact OD1-CB 3.28Å; D125-C145 WeakPolarHBondContact OD1-CB 3.07Å; D125-C145 PolarHBondContact OD1-N 3.47Å
146	I	91.6	Very high	88	Confident	52 Å²	52	66.1 Å²	66.1	27%	0.267	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	161.3	-174	62.7	169.8	0	0	0	112.3	A113 F148 K153 T154 E156	A113-I146 HydrophobicContact CB-CD1 3.62Å; A113-I146 HydrophobicContact CB-CG1 3.75Å; I146-F148 PolarHBondContact O-N 3.22Å; I146-K153 CarbonylContact O-C 3.27Å; I146-K153 WeakPolarHBondContact O-CA 3.48Å; I146-K153 WeakPolarHBondContact O-CB 3.42Å; I146-T154 PolarHBondContact N-O 3.17Å; I146-T154 PolarHBondContact O-N 2.93Å; I146-T154 VanDerWaalsContact O-O 3.05Å; I146-E156 HydrophobicContact CD1-CB 3.75Å; I146-E156 HydrophobicContact CD1-CG 3.93Å; I146-E156 HydrophobicContact CG1-CB 3.93Å; I146-E156 HydrophobicContact CG2-CB 4.25Å
147	R	88.9	Confident	88.8	Confident	201 Å²	201	61.6 Å²	61.6	76%	0.758	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	120.9	177.6	-66.1	179.2	-177.2	169.8	1	109.6	K153	R147-K153 HydrophobicContact CG-CG 4.02Å
148	F	85.9	Confident	89.3	Confident	71 Å²	71	62.8 Å²	62.8	31%	0.311	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-44	172.2	175.9	-95.8	0	0	0	111.3	A113 V115 P116 I146 K152 T154 T165	A113-F148 HydrophobicContact CB-CB 4.01Å; A113-F148 HydrophobicContact CB-CD2 3.86Å; A113-F148 HydrophobicContact CB-CG 4.45Å; V115-F148 HydrophobicContact CG2-CE2 4Å; V115-F148 HydrophobicContact CG2-CZ 4.31Å; P116-F148 HydrophobicContact CG-CD1 4.39Å; P116-F148 HydrophobicContact CG-CE1 4.4Å; I146-F148 PolarHBondContact O-N 3.22Å; F148-K152 PolarHBondContact N-O 2.77Å; F148-T154 HydrophobicContact CB-CG2 4.28Å; F148-T165 HydrophobicContact CE2-CG2 4.43Å; F148-T165 HydrophobicContact CZ-CG2 4.06Å
149	D	84.1	Confident	89.6	Confident	86 Å²	86	59.3 Å²	59.3	46%	0.46	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	172.7	178.8	-168.1	6.1	0	0	0	108.8	M151 K152	D149-M151 PolarHBondContact O-N 2.84Å; D149-K152 HydrophobicContact CB-CB 4.35Å; D149-K152 PolarHBondContact N-O 2.89Å; D149-K152 VanDerWaalsContact N-O 3.15Å; D149-K152 PolarHBondContact O-N 2.97Å; D149-K152 VanDerWaalsContact O-N 3.16Å
150	V	83.5	Confident	89.7	Confident	131 Å²	131	60.5 Å²	60.5	79%	0.794	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-36.8	-175.5	-174.3	0	0	0	0	112.2
151	M	82.9	Confident	89.7	Confident	171 Å²	171	56.9 Å²	56.9	84%	0.842	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	-7.1	-176.6	-62	-60.6	-68.4	0	0	114.8	D149	D149-M151 PolarHBondContact O-N 2.84Å
152	K	87.2	Confident	89.7	Confident	98 Å²	98	59.4 Å²	59.4	43%	0.426	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129.1	-168.8	-64.8	176.7	-175.3	168.2	0	111.1	L121 F148 D149	L121-K152 HydrophobicContact CD2-CB 3.94Å; L121-K152 HydrophobicContact CD2-CG 4.13Å; F148-K152 PolarHBondContact N-O 2.77Å; D149-K152 HydrophobicContact CB-CB 4.35Å; D149-K152 PolarHBondContact N-O 2.89Å; D149-K152 VanDerWaalsContact N-O 3.15Å; D149-K152 PolarHBondContact O-N 2.97Å; D149-K152 VanDerWaalsContact O-N 3.16Å
153	K	89.5	Confident	89.6	Confident	83 Å²	83	58.9 Å²	58.9	36%	0.361	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	139.9	170.5	-67.4	-175.2	-176.9	-174.4	0	110.5	L121 C122 I146 R147	L121-K153 WeakPolarHBondContact CD2-O 3.41Å; C122-K153 PolarHBondContact N-O 3.45Å; C122-K153 VanDerWaalsContact N-O 3.08Å; C122-K153 VanDerWaalsContact O-CB 3.29Å; C122-K153 WeakPolarHBondContact O-CB 3.49Å; C122-K153 VanDerWaalsContact SG-C 3.54Å; I146-K153 CarbonylContact O-C 3.27Å; I146-K153 WeakPolarHBondContact O-CA 3.48Å; I146-K153 WeakPolarHBondContact O-CB 3.42Å; R147-K153 HydrophobicContact CG-CG 4.02Å
154	T	90.4	Very high	89.4	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.012	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	160.6	176.5	56.9	0	0	0	0	109.9	E114 P116 L121 C122 I146 F148	E114-T154 VanDerWaalsContact O-CB 3.25Å; E114-T154 WeakPolarHBondContact O-CB 3.37Å; E114-T154 WeakPolarHBondContact O-CG2 3.44Å; E114-T154 PolarHBondContact O-OG1 2.84Å; P116-T154 HydrophobicContact CB-CG2 3.95Å; P116-T154 HydrophobicContact CG-CG2 4.35Å; L121-T154 HydrophobicContact CD2-CG2 4.36Å; C122-T154 WeakPolarHBondContact SG-CA 3.42Å; C122-T154 PolarHBondContact SG-N 3.34Å; C122-T154 VanDerWaalsContact SG-N 3.38Å; C122-T154 PolarHBondContact SG-O 2.8Å; C122-T154 VanDerWaalsContact SG-O 3.35Å; I146-T154 PolarHBondContact N-O 3.17Å; I146-T154 PolarHBondContact O-N 2.93Å; I146-T154 VanDerWaalsContact O-O 3.05Å; F148-T154 HydrophobicContact CB-CG2 4.28Å
155	C	89.9	Confident	88.7	Confident	17 Å²	17	60.5 Å²	60.5	12%	0.115	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	140.5	178.2	-62	0	0	0	0	110.7	E114 C128 Q141 S144	E114-C155 WeakPolarHBondContact CB-O 3.44Å; E114-C155 PolarHBondContact N-O 2.85Å; C128-C155 VanDerWaalsContact CA-SG 3.55Å; C128-C155 HydrophobicContact CB-CB 3.81Å; C128-C155 WeakPolarHBondContact CB-SG 3.36Å; C128-C155 WeakPolarHBondContact SG-CA 3.37Å; C128-C155 WeakPolarHBondContact SG-CB 3.36Å; C128-C155 CovalentContact SG-SG 2.04Å; C128-C155 PolarHBondContact SG-SG 2.9Å; Q141-C155 HydrophobicContact CG-CB 4.46Å; S144-C155 CarbonylContact O-C 3.59Å; S144-C155 WeakPolarHBondContact O-CA 3.26Å
156	E	91.6	Very high	87.8	Confident	35 Å²	35	65 Å²	65	16%	0.164	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	134.2	169.4	-178	-172.5	-114.4	0	0	109.4	K111 T142 S144 I146	K111-E156 HydrophobicContact CB-CG 3.99Å; T142-E156 WeakPolarHBondContact CB-OE2 3.15Å; T142-E156 HydrophobicContact CG2-CG 4.34Å; T142-E156 PolarHBondContact N-O 3.12Å; T142-E156 VanDerWaalsContact OG1-CB 3.29Å; T142-E156 WeakPolarHBondContact OG1-CB 3.46Å; T142-E156 WeakPolarHBondContact OG1-CG 3.4Å; T142-E156 PolarHBondContact OG1-O 3.33Å; T142-E156 PolarHBondContact OG1-OE2 3.06Å; S144-E156 PolarHBondContact O-N 3.46Å; I146-E156 HydrophobicContact CD1-CB 3.75Å; I146-E156 HydrophobicContact CD1-CG 3.93Å; I146-E156 HydrophobicContact CG1-CB 3.93Å; I146-E156 HydrophobicContact CG2-CB 4.25Å
157	V	92.3	Very high	86.8	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	143.4	177.7	-67.7	0	0	0	0	110.7	K111 C112 E114 I140 Q141 A159 I163	K111-V157 WeakPolarHBondContact CA-O 3.36Å; C112-V157 PolarHBondContact N-O 3.4Å; C112-V157 VanDerWaalsContact N-O 3.09Å; C112-V157 WeakPolarHBondContact O-CG2 3.36Å; C112-V157 PolarHBondContact O-N 3.3Å; E114-V157 HydrophobicContact CB-CG1 3.96Å; E114-V157 HydrophobicContact CB-CG2 4.04Å; E114-V157 HydrophobicContact CG-CG1 4.39Å; I140-V157 CarbonylContact O-C 3.59Å; I140-V157 VanDerWaalsContact O-CA 3.26Å; I140-V157 WeakPolarHBondContact O-CA 3.35Å; Q141-V157 HydrophobicContact CG-CG1 4.04Å; V157-A159 HydrophobicContact CG2-CB 4.11Å; V157-A159 PolarHBondContact O-N 3.37Å; V157-I163 HydrophobicContact CG2-CD1 3.46Å; V157-I163 VanDerWaalsContact CG2-CD1 3.46Å
158	S	93.3	Very high	86.5	Confident	54 Å²	54	62.6 Å²	62.6	38%	0.378	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	104.8	167.7	-62.4	0	0	0	0	108.4	G110 I140 T142	G110-S158 WeakPolarHBondContact O-CA 3.31Å; I140-S158 PolarHBondContact N-O 3.48Å; I140-S158 PolarHBondContact O-N 3.28Å; T142-S158 VanDerWaalsContact CG2-OG 3.31Å; T142-S158 WeakPolarHBondContact CG2-OG 3.46Å
159	A	92.7	Very high	86.5	Confident	13 Å²	13	60.1 Å²	60.1	11%	0.107	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	-172.6	-170	0	0	0	0	0	111.8	G110 V157 C161 I163	G110-A159 PolarHBondContact N-O 2.64Å; G110-A159 PolarHBondContact O-N 3.45Å; G110-A159 VanDerWaalsContact O-O 3.05Å; V157-A159 HydrophobicContact CG2-CB 4.11Å; V157-A159 PolarHBondContact O-N 3.37Å; A159-C161 PolarHBondContact O-N 3Å; A159-I163 HydrophobicContact CB-CD1 4.32Å; A159-I163 HydrophobicContact CB-CG1 4.43Å
160	W	92.8	Very high	86.6	Confident	41 Å²	41	57.6 Å²	57.6	16%	0.155	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	107.3	167.7	-74	91.4	0	0	0	110	Q107 K108 Q109 P162 Y293 E300 R302	Q107-W160 HydrophobicContact CB-CB 4.16Å; Q107-W160 HydrophobicContact CB-CE3 4.12Å; Q107-W160 PolarHBondContact NE2-O 3.3Å; K108-W160 CarbonylContact O-C 3.58Å; K108-W160 WeakPolarHBondContact O-CA 3.12Å; Q109-W160 HydrophobicContact CG-CD2 3.89Å; Q109-W160 HydrophobicContact CG-CE3 4Å; Q109-W160 HydrophobicContact CG-CH2 3.83Å; Q109-W160 HydrophobicContact CG-CZ2 3.7Å; Q109-W160 HydrophobicContact CG-CZ3 3.96Å; W160-P162 CarbonylContact O-C 3.6Å; W160-Y293 HydrophobicContact CH2-CD1 4.3Å; W160-Y293 AromaticContact CH2-CE1 3.91Å; W160-Y293 HydrophobicContact CH2-CE1 3.91Å; W160-Y293 AromaticContact CZ2-CE1 3.89Å; W160-Y293 HydrophobicContact CZ2-CE1 3.89Å; W160-E300 HydrophobicContact CH2-CG 4.35Å; W160-R302 VanDerWaalsContact CB-NH2 3.25Å; W160-R302 VanDerWaalsContact CD1-NH1 3.33Å; W160-R302 VanDerWaalsContact CD1-NH2 3.3Å; W160-R302 VanDerWaalsContact CD2-CD 3.49Å; W160-R302 HydrophobicContact CD2-CG 4.02Å; W160-R302 VanDerWaalsContact CD2-NE 3.31Å; W160-R302 HydrophobicContact CE3-CB 4.44Å; W160-R302 HydrophobicContact CE3-CG 3.57Å; W160-R302 VanDerWaalsContact CG-NE 3.28Å; W160-R302 VanDerWaalsContact CG-NH2 3.25Å; W160-R302 HydrophobicContact CH2-CG 4.34Å; W160-R302 HydrophobicContact CZ3-CB 4.13Å; W160-R302 HydrophobicContact CZ3-CG 3.75Å
161	C	91.5	Very high	86.8	Confident	19 Å²	19	59.1 Å²	59.1	13%	0.128	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.6	-171.4	-62.6	0	0	0	0	111.4	Q107 K108 C112 A159	Q107-C161 CarbonylContact C-O 3.47Å; Q107-C161 VanDerWaalsContact CA-O 3.28Å; Q107-C161 WeakPolarHBondContact CA-O 3.28Å; K108-C161 PolarHBondContact N-O 2.84Å; K108-C161 PolarHBondContact O-N 3.03Å; C112-C161 HydrophobicContact CB-CB 3.67Å; C112-C161 WeakPolarHBondContact CB-SG 3.35Å; C112-C161 PolarHBondContact N-SG 3.03Å; C112-C161 VanDerWaalsContact N-SG 3.43Å; C112-C161 WeakPolarHBondContact SG-CB 3.49Å; C112-C161 CovalentContact SG-SG 2.03Å; C112-C161 PolarHBondContact SG-SG 3.45Å; A159-C161 PolarHBondContact O-N 3Å
162	P	91.1	Very high	87.1	Confident	75 Å²	75	56.5 Å²	56.5	49%	0.487	30%	0.302	S	S	.	.	S	Bend	cis	-76.1	145.6	1.7	31.2	-34.9	0	0	0	113.2	T104 Q107 W160	T104-P162 WeakPolarHBondContact CG2-O 3.44Å; Q107-P162 PolarHBondContact NE2-O 3.04Å; W160-P162 CarbonylContact O-C 3.6Å
163	I	88.6	Confident	87.3	Confident	10 Å²	10	52.4 Å²	52.4	5%	0.051	29%	0.286	C	S	.	.			trans	-71.5	152.7	177.4	-65.4	162.5	0	0	0	110.2	V115 H138 V157 A159 T165	V115-I163 HydrophobicContact CB-CG2 4.47Å; V115-I163 HydrophobicContact CG2-CB 4.05Å; V115-I163 HydrophobicContact CG2-CG2 3.63Å; H138-I163 HydrophobicContact CB-CD1 4.28Å; H138-I163 HydrophobicContact CB-CG1 4.3Å; H138-I163 HydrophobicContact CB-CG2 3.9Å; H138-I163 WeakPolarHBondContact ND1-CG2 3.39Å; V157-I163 HydrophobicContact CG2-CD1 3.46Å; V157-I163 VanDerWaalsContact CG2-CD1 3.46Å; A159-I163 HydrophobicContact CB-CD1 4.32Å; A159-I163 HydrophobicContact CB-CG1 4.43Å; I163-T165 PolarHBondContact O-N 3.15Å
164	E	86.2	Confident	87.3	Confident	5 Å²	5	51 Å²	51	2%	0.023	28%	0.282	C	S	.	.			trans	-59.7	103.7	175.2	-176.2	-165	148.3	0	0	110.6	Q166 R289 K306	E164-Q166 VanDerWaalsContact OE1-O 3.09Å; E164-R289 IonicContact OE1-NH2 3.8Å; E164-R289 IonicContact OE2-CZ 3.89Å; E164-R289 IonicContact OE2-NE 3.59Å; E164-R289 PolarHBondContact OE2-NE 3.21Å; E164-R289 IonicContact OE2-NH2 2.77Å; E164-R289 PolarHBondContact OE2-NH2 2.91Å; E164-R289 VanDerWaalsContact OE2-NH2 3.1Å; E164-K306 WeakPolarHBondContact OE1-CD 3.35Å; E164-K306 WeakPolarHBondContact OE1-CE 3.47Å; E164-K306 IonicContact OE1-NZ 3.67Å; E164-K306 PolarHBondContact OE1-NZ 2.92Å
165	T	77.8	Confident	87.3	Confident	93 Å²	93	50.9 Å²	50.9	57%	0.571	28%	0.282	S	S	*	.			trans	-80.2	-29.4	178.9	54.4	0	0	0	0	113	V115 F148 I163	V115-T165 HydrophobicContact CG2-CG2 4.14Å; F148-T165 HydrophobicContact CE2-CG2 4.43Å; F148-T165 HydrophobicContact CZ-CG2 4.06Å; I163-T165 PolarHBondContact O-N 3.15Å
166	Q	72.4	Confident	87.3	Confident	107 Å²	107	53 Å²	53	50%	0.5	30%	0.3	S	S	.	.			trans	-96	103.7	-175.3	-165.5	171.6	35.4	0	0	110.6	I102 E164	I102-Q166 HydrophobicContact CD1-CG 4.43Å; I102-Q166 WeakPolarHBondContact CD1-O 3.37Å; I102-Q166 HydrophobicContact CG2-CB 4.41Å; E164-Q166 VanDerWaalsContact OE1-O 3.09Å
167	T	70.6	Confident	87.3	Confident	83 Å²	83	53.5 Å²	53.5	51%	0.509	31%	0.31	S	S	.	.			trans	-85.7	-34.8	179.5	49.2	0	0	0	0	112.8	K306	T167-K306 PolarHBondContact O-NZ 3.16Å
168	N	81.3	Confident	87.3	Confident	121 Å²	121	53.5 Å²	53.5	65%	0.647	31%	0.31	S	S	*	.	S	Bend	trans	-82.8	135.7	-177	-68.5	-31	0	0	0	111.9
169	P	85.7	Confident	87.4	Confident	19 Å²	19	54.7 Å²	54.7	12%	0.123	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-65.4	144.2	176.5	27.2	-33.5	0	0	0	111.3	V242 E243 F308	P169-V242 HydrophobicContact CB-CG1 4.08Å; P169-V242 WeakPolarHBondContact CB-O 3.32Å; P169-V242 HydrophobicContact CG-CG1 3.81Å; P169-E243 HydrophobicContact CG-CG 4.34Å; P169-F308 HydrophobicContact CB-CD1 4.44Å; P169-F308 HydrophobicContact CB-CD2 4.26Å; P169-F308 HydrophobicContact CB-CE1 4.21Å; P169-F308 HydrophobicContact CB-CE2 4.01Å; P169-F308 HydrophobicContact CB-CG 4.48Å; P169-F308 HydrophobicContact CB-CZ 3.97Å; P169-F308 HydrophobicContact CG-CE1 4.38Å; P169-F308 HydrophobicContact CG-CZ 4.46Å
170	P	87.3	Confident	87.5	Confident	32 Å²	32	58.6 Å²	58.6	21%	0.208	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-65.7	141.5	176.1	27	-32.9	0	0	0	110.8	N100 P172 L174	N100-P170 PolarHBondContact ND2-O 2.9Å; N100-P170 WeakPolarHBondContact OD1-CG 3.45Å; P170-P172 CarbonylContact C-O 3.53Å; P170-L174 HydrophobicContact CG-CD1 4.14Å; P170-L174 HydrophobicContact CG-CG 4.01Å
171	R	88.1	Confident	87.6	Confident	164 Å²	164	56.9 Å²	56.9	62%	0.619	32%	0.323	S	S	*	.	S	Bend	trans	-122.9	123	176.2	-63.9	-174.2	-168.3	-110.5	-0.4	108.5	V242 E243	R171-V242 HydrophobicContact CG-CG1 3.63Å; R171-V242 HydrophobicContact CG-CG2 4.2Å; R171-E243 IonicContact CZ-OE1 2.66Å; R171-E243 IonicContact NH1-OE1 3.48Å; R171-E243 IonicContact NH2-OE1 3.94Å; R171-E243 PolarHBondContact NH2-OE1 3.28Å
172	P	89.1	Confident	87.8	Confident	115 Å²	115	58.4 Å²	58.4	75%	0.747	33%	0.331	S	S	*	.	S	Bend	cis	-71.1	165.7	1.4	31.7	-36.6	0	0	0	113.5	P170	P170-P172 CarbonylContact C-O 3.53Å
173	A	90.3	Very high	87.9	Confident	12 Å²	12	54.8 Å²	54.8	10%	0.099	31%	0.308	C	S	.	.			trans	-62.1	139.1	178.5	0	0	0	0	0	111.9	L175 A241 V242	A173-L175 PolarHBondContact O-N 2.93Å; A173-A241 HydrophobicContact CB-CB 3.68Å; A173-V242 HydrophobicContact CB-CG2 4.19Å
174	L	90.2	Very high	88.2	Confident	53 Å²	53	56 Å²	56	28%	0.277	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-40	-174.9	-68.8	174.5	0	0	0	113.2	T70 N100 V101 P170	T70-L174 WeakPolarHBondContact CG2-O 3.46Å; N100-L174 WeakPolarHBondContact OD1-CG 3.3Å; N100-L174 PolarHBondContact OD1-N 2.81Å; V101-L174 HydrophobicContact CG1-CD1 3.95Å; V101-L174 WeakPolarHBondContact O-CD1 3.48Å; P170-L174 HydrophobicContact CG-CD1 4.14Å; P170-L174 HydrophobicContact CG-CG 4.01Å
175	L	90.9	Very high	88.6	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	55.3	-178.9	-68.2	80.7	0	0	0	111.3	A68 T70 W80 T99 A173 A177 A178	A68-L175 HydrophobicContact CB-CD2 4.32Å; A68-L175 HydrophobicContact CB-CG 4.46Å; T70-L175 HydrophobicContact CG2-CD1 4.15Å; T70-L175 HydrophobicContact CG2-CG 3.94Å; W80-L175 HydrophobicContact CB-CD2 4Å; W80-L175 HydrophobicContact CD2-CD2 4.28Å; W80-L175 HydrophobicContact CG-CD2 3.85Å; T99-L175 WeakPolarHBondContact O-CA 3.45Å; T99-L175 WeakPolarHBondContact O-CB 3.34Å; T99-L175 PolarHBondContact O-N 2.8Å; A173-L175 PolarHBondContact O-N 2.93Å; L175-A177 PolarHBondContact O-N 2.77Å; L175-A178 WeakPolarHBondContact O-CB 3.25Å; L175-A178 PolarHBondContact O-N 2.87Å
176	A	88.8	Confident	89.4	Confident	60 Å²	60	56.2 Å²	56.2	50%	0.496	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-58.5	-28.9	173.6	0	0	0	0	0	112.8	A178 E179	A176-A178 PolarHBondContact O-N 2.84Å; A176-A178 VanDerWaalsContact O-N 3.09Å; A176-E179 WeakPolarHBondContact O-CB 3.02Å; A176-E179 PolarHBondContact O-N 3.1Å
177	A	91.6	Very high	90.5	Very high	46 Å²	46	51.2 Å²	51.2	38%	0.38	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-60.6	-17.3	175.4	0	0	0	0	0	114	A68 L175 E179 N180	A68-A177 HydrophobicContact CB-CB 3.97Å; L175-A177 PolarHBondContact O-N 2.77Å; A177-E179 PolarHBondContact O-N 2.72Å; A177-E179 VanDerWaalsContact O-N 3.15Å; A177-N180 PolarHBondContact O-N 2.77Å
178	A	93.7	Very high	91.7	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-60	-21.5	175.6	0	0	0	0	0	113	V97 T99 L175 A176 N180 F181 F237	V97-A178 HydrophobicContact CG1-CB 4.41Å; T99-A178 HydrophobicContact CG2-CB 4.35Å; L175-A178 WeakPolarHBondContact O-CB 3.25Å; L175-A178 PolarHBondContact O-N 2.87Å; A176-A178 PolarHBondContact O-N 2.84Å; A176-A178 VanDerWaalsContact O-N 3.09Å; A178-N180 PolarHBondContact O-N 3.45Å; A178-N180 VanDerWaalsContact O-N 3.16Å; A178-F181 HydrophobicContact CB-CD2 3.99Å; A178-F181 HydrophobicContact CB-CE2 3.95Å; A178-F181 HydrophobicContact CB-CG 4.45Å; A178-F181 HydrophobicContact CB-CZ 4.38Å; A178-F181 WeakPolarHBondContact O-CB 3.37Å; A178-F181 PolarHBondContact O-N 2.94Å; A178-F237 HydrophobicContact CB-CE1 4.31Å; A178-F237 HydrophobicContact CB-CZ 3.96Å
179	E	94.8	Very high	92.4	Very high	79 Å²	79	45.3 Å²	45.3	37%	0.369	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-56.3	-30.3	172.7	-168.1	-179.9	167.6	0	0	112.4	A176 A177 R225 G227 F237	A176-E179 WeakPolarHBondContact O-CB 3.02Å; A176-E179 PolarHBondContact O-N 3.1Å; A177-E179 PolarHBondContact O-N 2.72Å; A177-E179 VanDerWaalsContact O-N 3.15Å; E179-R225 WeakPolarHBondContact O-CG 3.46Å; E179-R225 PolarHBondContact O-NE 2.99Å; E179-G227 PolarHBondContact O-N 2.8Å; E179-F237 HydrophobicContact CB-CD1 3.66Å; E179-F237 HydrophobicContact CB-CD2 4.43Å; E179-F237 HydrophobicContact CB-CE1 3.79Å; E179-F237 HydrophobicContact CB-CG 4.02Å; E179-F237 HydrophobicContact CB-CZ 4.26Å; E179-F237 HydrophobicContact CG-CB 4.14Å; E179-F237 HydrophobicContact CG-CD1 4Å; E179-F237 HydrophobicContact CG-CD2 4.29Å; E179-F237 HydrophobicContact CG-CG 3.87Å
180	N	94.9	Very high	92.9	Very high	96 Å²	96	50.1 Å²	50.1	51%	0.513	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-92.2	0	-178.2	-63.1	-18.2	0	0	0	113.6	A177 A178 R225	A177-N180 PolarHBondContact O-N 2.77Å; A178-N180 PolarHBondContact O-N 3.45Å; A178-N180 VanDerWaalsContact O-N 3.16Å; N180-R225 PolarHBondContact OD1-NE 2.94Å; N180-R225 PolarHBondContact OD1-NH2 3.14Å
181	F	95.3	Very high	93.3	Very high	5 Å²	5	48.6 Å²	48.6	2%	0.022	26%	0.255	C	S	.	.			trans	-69.7	150.8	178.1	-67	-0.1	0	0	0	110.2	G66 V67 A68 Y85 V97 A178 R225 L226	G66-F181 VanDerWaalsContact CA-CD1 3.45Å; V67-F181 WeakPolarHBondContact O-CE1 3.32Å; A68-F181 HydrophobicContact CB-CE1 4.31Å; A68-F181 HydrophobicContact CB-CZ 3.82Å; Y85-F181 AromaticContact CD1-CE2 3.73Å; Y85-F181 HydrophobicContact CD1-CE2 3.73Å; Y85-F181 HydrophobicContact CD1-CZ 4.31Å; Y85-F181 HydrophobicContact CD2-CE2 4.34Å; Y85-F181 HydrophobicContact CE1-CD2 4.1Å; Y85-F181 AromaticContact CE1-CE2 3.4Å; Y85-F181 HydrophobicContact CE1-CE2 3.4Å; Y85-F181 AromaticContact CE1-CZ 3.92Å; Y85-F181 HydrophobicContact CE1-CZ 3.92Å; Y85-F181 HydrophobicContact CE2-CD2 4.1Å; Y85-F181 HydrophobicContact CE2-CE2 4.08Å; Y85-F181 HydrophobicContact CG-CE2 4.22Å; Y85-F181 AromaticContact CZ-CD2 3.79Å; Y85-F181 AromaticContact CZ-CE2 3.59Å; V97-F181 HydrophobicContact CG1-CD2 4.16Å; A178-F181 HydrophobicContact CB-CD2 3.99Å; A178-F181 HydrophobicContact CB-CE2 3.95Å; A178-F181 HydrophobicContact CB-CG 4.45Å; A178-F181 HydrophobicContact CB-CZ 4.38Å; A178-F181 WeakPolarHBondContact O-CB 3.37Å; A178-F181 PolarHBondContact O-N 2.94Å; F181-R225 WeakPolarHBondContact O-CA 3.39Å; F181-L226 HydrophobicContact CB-CD1 3.81Å; F181-L226 HydrophobicContact CB-CG 4.13Å; F181-L226 PolarHBondContact O-N 3.29Å
182	T	94.9	Very high	93.7	Very high	50 Å²	50	44.1 Å²	44.1	31%	0.307	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	144	-179.6	57.3	0	0	0	0	110.2	V64 K65 I223 F224	V64-T182 CarbonylContact C-O 3.59Å; V64-T182 WeakPolarHBondContact CA-O 3.18Å; K65-T182 PolarHBondContact N-O 2.88Å; K65-T182 PolarHBondContact O-N 3.1Å; K65-T182 PolarHBondContact O-OG1 3Å; T182-I223 HydrophobicContact CG2-CG2 4.37Å; T182-F224 CarbonylContact C-O 3.58Å; T182-F224 VanDerWaalsContact CA-O 3.22Å; T182-F224 WeakPolarHBondContact CA-O 3.39Å
183	V	94.4	Very high	93.9	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.8	172.8	62	0	0	0	0	109.3	V64 F95 I185 I223 F224 L226 M229	V64-V183 HydrophobicContact CG2-CB 4.47Å; V64-V183 HydrophobicContact CG2-CG2 4.13Å; F95-V183 HydrophobicContact CE1-CG2 3.99Å; F95-V183 HydrophobicContact CE2-CB 4.44Å; F95-V183 HydrophobicContact CE2-CG2 4.2Å; F95-V183 HydrophobicContact CZ-CB 4.12Å; F95-V183 HydrophobicContact CZ-CG1 4.03Å; F95-V183 HydrophobicContact CZ-CG2 3.76Å; V183-I185 HydrophobicContact CG1-CG1 4.43Å; V183-I185 HydrophobicContact CG2-CG1 4.12Å; V183-I223 WeakPolarHBondContact O-CA 3.46Å; V183-F224 HydrophobicContact CG1-CB 3.91Å; V183-F224 PolarHBondContact N-O 2.98Å; V183-F224 PolarHBondContact O-N 2.9Å; V183-L226 HydrophobicContact CB-CD2 4.43Å; V183-L226 HydrophobicContact CG1-CD2 4.07Å; V183-M229 HydrophobicContact CG1-SD 3.93Å
184	L	94.1	Very high	94	Very high	35 Å²	35	42.9 Å²	42.9	18%	0.183	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	119.5	167.6	174	66.5	0	0	0	108.4	T62 K63 K186 P222 I223	T62-L184 WeakPolarHBondContact CA-O 3.45Å; K63-L184 HydrophobicContact CB-CB 4.48Å; K63-L184 PolarHBondContact N-O 2.91Å; K63-L184 PolarHBondContact O-N 2.99Å; L184-K186 HydrophobicContact CD2-CG 4.42Å; L184-K186 HydrophobicContact CG-CG 4.31Å; L184-P222 HydrophobicContact CD1-CB 4.06Å; L184-P222 HydrophobicContact CD1-CG 3.87Å; L184-I223 HydrophobicContact CB-CG1 4.37Å; L184-I223 HydrophobicContact CD1-CD1 4.46Å; L184-I223 HydrophobicContact CD1-CG1 3.67Å
185	I	95.1	Very high	94.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	116.9	176.3	-55.8	178.5	0	0	0	108.6	V60 T62 V183 N200 P222 F224 I249 I251 I314	V60-I185 HydrophobicContact CG1-CG2 4.07Å; T62-I185 HydrophobicContact CG2-CG1 4.4Å; V183-I185 HydrophobicContact CG1-CG1 4.43Å; V183-I185 HydrophobicContact CG2-CG1 4.12Å; I185-N200 PolarHBondContact O-ND2 3.48Å; I185-P222 PolarHBondContact N-O 2.69Å; I185-F224 HydrophobicContact CB-CE2 4.33Å; I185-F224 HydrophobicContact CD1-CD2 3.74Å; I185-F224 HydrophobicContact CD1-CE2 3.83Å; I185-F224 HydrophobicContact CG1-CD2 4.05Å; I185-F224 HydrophobicContact CG1-CE2 4.19Å; I185-I249 HydrophobicContact CD1-CD1 3.98Å; I185-I249 HydrophobicContact CD1-CG2 4.11Å; I185-I251 HydrophobicContact CG2-CD1 4.1Å; I185-I314 HydrophobicContact CD1-CD1 4.29Å; I185-I314 HydrophobicContact CG1-CD1 4.48Å; I185-I314 HydrophobicContact CG2-CD1 4.21Å
186	K	94.3	Very high	94.3	Very high	103 Å²	103	47.4 Å²	47.4	45%	0.448	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	114.9	172	-59.4	178.6	-178.5	-178.8	0	108.1	V60 T61 L184 I201	V60-K186 WeakPolarHBondContact CA-O 3.39Å; T61-K186 PolarHBondContact N-O 3.11Å; T61-K186 PolarHBondContact O-N 2.86Å; T61-K186 WeakPolarHBondContact OG1-CB 3Å; L184-K186 HydrophobicContact CD2-CG 4.42Å; L184-K186 HydrophobicContact CG-CG 4.31Å; K186-I201 HydrophobicContact CG-CD1 4.03Å
187	N	95.9	Very high	94.6	Very high	2 Å²	2	49 Å²	49	1%	0.011	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125.6	178.9	175.9	-128.1	0	0	0	110	S59 V60 I189 R199 N200 I251 W253	S59-N187 WeakPolarHBondContact O-CA 3.29Å; S59-N187 PolarHBondContact O-ND2 2.8Å; V60-N187 WeakPolarHBondContact CG2-ND2 3.47Å; N187-I189 WeakPolarHBondContact OD1-CG2 3.44Å; N187-R199 WeakPolarHBondContact O-CA 3.31Å; N187-N200 HydrophobicContact CB-CB 4.44Å; N187-N200 PolarHBondContact N-OD1 3.09Å; N187-N200 PolarHBondContact O-N 3.43Å; N187-N200 PolarHBondContact O-OD1 2.89Å; N187-I251 HydrophobicContact CB-CD1 4.34Å; N187-W253 PolarHBondContact OD1-NE1 2.83Å
188	N	95.1	Very high	94.7	Very high	78 Å²	78	50.4 Å²	50.4	42%	0.417	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.9	172.4	-169.6	13.6	0	0	0	108.7	S58 S59 I197 R198	S58-N188 CarbonylContact C-O 3.58Å; S58-N188 WeakPolarHBondContact CA-O 3.47Å; S59-N188 PolarHBondContact N-O 2.78Å; S59-N188 PolarHBondContact O-N 3.04Å; N188-I197 WeakPolarHBondContact OD1-CG2 2.99Å; N188-R198 PolarHBondContact OD1-O 2.85Å
189	I	96.1	Very high	94.8	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	145.3	179.1	58.2	152.3	0	0	0	110.8	V56 V57 N187 F191 I197 R198 W253 V316	V56-I189 HydrophobicContact CG2-CB 3.56Å; V56-I189 HydrophobicContact CG2-CD1 4.37Å; V56-I189 HydrophobicContact CG2-CG2 3.56Å; V57-I189 CarbonylContact O-C 3.59Å; V57-I189 WeakPolarHBondContact O-CA 3.26Å; N187-I189 WeakPolarHBondContact OD1-CG2 3.44Å; I189-F191 HydrophobicContact CD1-CE2 3.67Å; I189-F191 HydrophobicContact CD1-CZ 4.08Å; I189-I197 WeakPolarHBondContact O-CA 3.43Å; I189-R198 HydrophobicContact CD1-CB 4.08Å; I189-R198 HydrophobicContact CG1-CB 3.87Å; I189-R198 WeakPolarHBondContact CG1-O 3.17Å; I189-R198 PolarHBondContact N-O 3.25Å; I189-R198 PolarHBondContact O-N 3.1Å; I189-W253 HydrophobicContact CD1-CB 4.19Å; I189-W253 HydrophobicContact CD1-CD2 3.38Å; I189-W253 HydrophobicContact CD1-CE3 3.43Å; I189-W253 VanDerWaalsContact CD1-CE3 3.43Å; I189-W253 HydrophobicContact CD1-CG 3.75Å; I189-W253 HydrophobicContact CD1-CH2 4.22Å; I189-W253 HydrophobicContact CD1-CZ2 4.19Å; I189-W253 HydrophobicContact CD1-CZ3 3.87Å; I189-W253 HydrophobicContact CG1-CD2 4.14Å; I189-W253 HydrophobicContact CG1-CE3 4.35Å; I189-W253 HydrophobicContact CG1-CH2 4.31Å; I189-W253 HydrophobicContact CG1-CZ2 4.11Å; I189-W253 HydrophobicContact CG1-CZ3 4.43Å; I189-W253 HydrophobicContact CG2-CD2 4.34Å; I189-W253 HydrophobicContact CG2-CG 4.27Å; I189-W253 HydrophobicContact CG2-CZ2 4.34Å; I189-V316 HydrophobicContact CG2-CG1 4.15Å
190	R	96	Very high	94.8	Very high	121 Å²	121	53 Å²	53	46%	0.457	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	136.4	175.1	-174.5	172.1	-170.6	-175.8	3.1	109.4	V57 P192 N195 F196 I197	V57-R190 PolarHBondContact N-O 3.1Å; V57-R190 PolarHBondContact O-N 3.04Å; R190-P192 WeakPolarHBondContact O-CD 3.48Å; R190-N195 PolarHBondContact NH2-OD1 2.03Å; R190-F196 CarbonylContact C-O 3.57Å; R190-F196 WeakPolarHBondContact CA-O 3.02Å; R190-I197 HydrophobicContact CB-CG1 4.27Å; R190-I197 HydrophobicContact CG-CG1 3.88Å
191	F	96.6	Very high	94.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	97.4	165.8	-62.2	-75.9	0	0	0	107.3	D54 V56 I189 A193 F194 N195 F196 C255 A320	D54-F191 HydrophobicContact CB-CB 4.41Å; D54-F191 HydrophobicContact CB-CD1 4.39Å; D54-F191 VanDerWaalsContact OD2-CA 3.32Å; D54-F191 WeakPolarHBondContact OD2-CA 3Å; D54-F191 WeakPolarHBondContact OD2-CB 3.46Å; V56-F191 HydrophobicContact CB-CD1 4.36Å; V56-F191 HydrophobicContact CB-CE1 3.62Å; V56-F191 HydrophobicContact CB-CZ 4.06Å; V56-F191 HydrophobicContact CG2-CE1 4.03Å; V56-F191 HydrophobicContact CG2-CZ 4.06Å; I189-F191 HydrophobicContact CD1-CE2 3.67Å; I189-F191 HydrophobicContact CD1-CZ 4.08Å; F191-A193 VanDerWaalsContact C-N 3.32Å; F191-A193 PolarHBondContact O-N 2.87Å; F191-F194 HydrophobicContact CB-CD2 4.14Å; F191-F194 PolarHBondContact O-N 2.03Å; F191-N195 PolarHBondContact O-N 3Å; F191-F196 HydrophobicContact CB-CB 4.49Å; F191-F196 HydrophobicContact CD2-CB 4.48Å; F191-F196 AromaticContact CD2-CD1 3.95Å; F191-F196 HydrophobicContact CD2-CD1 3.95Å; F191-F196 HydrophobicContact CE2-CD1 4.39Å; F191-F196 PolarHBondContact N-O 2.91Å; F191-F196 PolarHBondContact O-N 3.14Å; F191-C255 HydrophobicContact CE2-CB 4.23Å; F191-C255 HydrophobicContact CZ-CB 4.37Å; F191-A320 HydrophobicContact CB-CB 4.35Å; F191-A320 HydrophobicContact CD1-CB 3.53Å; F191-A320 HydrophobicContact CD2-CB 3.61Å; F191-A320 HydrophobicContact CE1-CB 3.55Å; F191-A320 VanDerWaalsContact CE1-N 3.3Å; F191-A320 HydrophobicContact CE2-CB 3.63Å; F191-A320 HydrophobicContact CG-CB 3.55Å; F191-A320 HydrophobicContact CZ-CB 3.6Å
192	P	95.1	Very high	94.5	Very high	69 Å²	69	49.5 Å²	49.5	45%	0.448	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-40.4	-173.6	-24.9	35.3	0	0	0	113.5	D54 V57 R190 F194 N195	D54-P192 VanDerWaalsContact OD2-CD 3.32Å; D54-P192 WeakPolarHBondContact OD2-CD 3.47Å; D54-P192 VanDerWaalsContact OD2-N 3.09Å; V57-P192 HydrophobicContact CG2-CG 3.84Å; R190-P192 WeakPolarHBondContact O-CD 3.48Å; P192-F194 VanDerWaalsContact C-N 3.26Å; P192-F194 PolarHBondContact O-N 2.9Å; P192-N195 PolarHBondContact O-N 2.85Å
193	A	93.7	Very high	94.1	Very high	71 Å²	71	51.2 Å²	51.2	59%	0.587	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-33.3	-177.2	0	0	0	0	0	112	D54 F191	D54-A193 HydrophobicContact CB-CB 3.91Å; D54-A193 VanDerWaalsContact CG-CB 3.46Å; D54-A193 VanDerWaalsContact OD2-CB 3.28Å; D54-A193 WeakPolarHBondContact OD2-CB 3.36Å; D54-A193 PolarHBondContact OD2-N 3.36Å; F191-A193 VanDerWaalsContact C-N 3.32Å; F191-A193 PolarHBondContact O-N 2.87Å
194	F	92.9	Very high	93.8	Very high	30 Å²	30	57.3 Å²	57.3	13%	0.132	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-0.9	179	-51.7	-44.2	0	0	0	114.1	E52 D54 F191 P192 F196 L257 A320 K322	E52-F194 HydrophobicContact CB-CE1 4.43Å; E52-F194 HydrophobicContact CB-CZ 4.39Å; E52-F194 HydrophobicContact CG-CE1 4.39Å; E52-F194 HydrophobicContact CG-CZ 4.38Å; E52-F194 VanDerWaalsContact O-CZ 3.24Å; E52-F194 WeakPolarHBondContact O-CZ 3.34Å; D54-F194 HydrophobicContact CB-CD2 3.77Å; D54-F194 HydrophobicContact CB-CE2 3.3Å; D54-F194 HydrophobicContact CB-CZ 3.8Å; F191-F194 HydrophobicContact CB-CD2 4.14Å; F191-F194 PolarHBondContact O-N 2.03Å; P192-F194 VanDerWaalsContact C-N 3.26Å; P192-F194 PolarHBondContact O-N 2.9Å; F194-F196 HydrophobicContact CB-CB 4.37Å; F194-F196 PolarHBondContact O-N 3.1Å; F194-F196 VanDerWaalsContact O-N 3.17Å; F194-L257 HydrophobicContact CB-CD1 4.05Å; F194-L257 HydrophobicContact CD2-CD1 3.72Å; F194-L257 HydrophobicContact CG-CD1 4.18Å; F194-A320 HydrophobicContact CD2-CB 4Å; F194-A320 HydrophobicContact CE2-CB 4.03Å; F194-A320 WeakPolarHBondContact CE2-O 3.39Å; F194-K322 HydrophobicContact CB-CD 4.33Å; F194-K322 HydrophobicContact CD1-CB 3.99Å; F194-K322 HydrophobicContact CD1-CD 3.8Å; F194-K322 HydrophobicContact CD2-CB 4.34Å; F194-K322 HydrophobicContact CE1-CB 3.88Å; F194-K322 HydrophobicContact CE1-CD 4.4Å; F194-K322 HydrophobicContact CE2-CB 4.22Å; F194-K322 HydrophobicContact CG-CB 4.24Å; F194-K322 HydrophobicContact CG-CD 4.1Å; F194-K322 HydrophobicContact CZ-CB 4Å
195	N	93.9	Very high	93.5	Very high	111 Å²	111	56.6 Å²	56.6	59%	0.594	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.4	38.1	-170	-163.8	33.6	0	0	0	113.2	R190 F191 P192	R190-N195 PolarHBondContact NH2-OD1 2.03Å; F191-N195 PolarHBondContact O-N 3Å; P192-N195 PolarHBondContact O-N 2.85Å
196	F	94.1	Very high	93.3	Very high	38 Å²	38	61.9 Å²	61.9	17%	0.167	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	129	-178.8	-174.4	-99.2	0	0	0	110.3	R190 F191 F194 R198 L257 C264	R190-F196 CarbonylContact C-O 3.57Å; R190-F196 WeakPolarHBondContact CA-O 3.02Å; F191-F196 HydrophobicContact CB-CB 4.49Å; F191-F196 HydrophobicContact CD2-CB 4.48Å; F191-F196 AromaticContact CD2-CD1 3.95Å; F191-F196 HydrophobicContact CD2-CD1 3.95Å; F191-F196 HydrophobicContact CE2-CD1 4.39Å; F191-F196 PolarHBondContact N-O 2.91Å; F191-F196 PolarHBondContact O-N 3.14Å; F194-F196 HydrophobicContact CB-CB 4.37Å; F194-F196 PolarHBondContact O-N 3.1Å; F194-F196 VanDerWaalsContact O-N 3.17Å; F196-R198 HydrophobicContact CD1-CB 4.39Å; F196-R198 HydrophobicContact CE1-CB 3.69Å; F196-R198 HydrophobicContact CE1-CG 4.32Å; F196-R198 HydrophobicContact CZ-CB 4.3Å; F196-L257 HydrophobicContact CB-CD1 3.87Å; F196-L257 HydrophobicContact CD1-CD1 4.2Å; F196-L257 HydrophobicContact CD1-CD2 3.69Å; F196-L257 HydrophobicContact CD2-CD1 4.48Å; F196-L257 HydrophobicContact CD2-CD2 4.04Å; F196-L257 HydrophobicContact CE1-CD2 3.59Å; F196-L257 HydrophobicContact CE2-CD2 3.99Å; F196-L257 HydrophobicContact CG-CD1 3.94Å; F196-L257 HydrophobicContact CG-CD2 3.89Å; F196-L257 HydrophobicContact CZ-CD2 3.76Å; F196-C264 HydrophobicContact CE1-CB 4.45Å
197	I	93.9	Very high	93.1	Very high	93 Å²	93	61.4 Å²	61.4	48%	0.477	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134.9	177.7	-60.6	170.3	0	0	0	108.8	N188 I189 R190	N188-I197 WeakPolarHBondContact OD1-CG2 2.99Å; I189-I197 WeakPolarHBondContact O-CA 3.43Å; R190-I197 HydrophobicContact CB-CG1 4.27Å; R190-I197 HydrophobicContact CG-CG1 3.88Å
198	R	94.5	Very high	92.8	Very high	76 Å²	76	64.7 Å²	64.7	29%	0.287	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	147.3	176.8	-167.3	65	171.9	-172.3	-3.4	110.3	N188 I189 F196 W253	N188-R198 PolarHBondContact OD1-O 2.85Å; I189-R198 HydrophobicContact CD1-CB 4.08Å; I189-R198 HydrophobicContact CG1-CB 3.87Å; I189-R198 WeakPolarHBondContact CG1-O 3.17Å; I189-R198 PolarHBondContact N-O 3.25Å; I189-R198 PolarHBondContact O-N 3.1Å; F196-R198 HydrophobicContact CD1-CB 4.39Å; F196-R198 HydrophobicContact CE1-CB 3.69Å; F196-R198 HydrophobicContact CE1-CG 4.32Å; F196-R198 HydrophobicContact CZ-CB 4.3Å; R198-W253 HydrophobicContact CG-CH2 4.2Å; R198-W253 HydrophobicContact CG-CZ3 4.01Å
199	R	94.6	Very high	92.7	Very high	130 Å²	130	63.4 Å²	63.4	49%	0.491	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	153.2	173.6	57.2	176.2	-160.2	-167.3	9	110.1	N187 I201	N187-R199 WeakPolarHBondContact O-CA 3.31Å; R199-I201 VanDerWaalsContact CD-O 3.28Å; R199-I201 WeakPolarHBondContact CD-O 3.1Å; R199-I201 VanDerWaalsContact CG-O 3.23Å; R199-I201 WeakPolarHBondContact CG-O 3.07Å; R199-I201 PolarHBondContact NE-O 2.9Å
200	N	94.5	Very high	92.4	Very high	3 Å²	3	65.1 Å²	65.1	2%	0.016	34%	0.34	C	S	.	.	S	Bend	trans	-66.9	-35.9	176	68	-38.6	0	0	0	112.8	I185 N187 L202 W253 P266 Y268	I185-N200 PolarHBondContact O-ND2 3.48Å; N187-N200 HydrophobicContact CB-CB 4.44Å; N187-N200 PolarHBondContact N-OD1 3.09Å; N187-N200 PolarHBondContact O-N 3.43Å; N187-N200 PolarHBondContact O-OD1 2.89Å; N200-L202 PolarHBondContact O-N 3.02Å; N200-W253 HydrophobicContact CB-CH2 4.4Å; N200-W253 HydrophobicContact CB-CZ2 4.08Å; N200-P266 HydrophobicContact CB-CG 4.1Å; N200-Y268 WeakPolarHBondContact CB-OH 3.47Å; N200-Y268 PolarHBondContact ND2-OH 2.99Å; N200-Y268 VanDerWaalsContact ND2-OH 3.08Å
201	I	93.6	Very high	92	Very high	25 Å²	25	69.1 Å²	69.1	13%	0.128	36%	0.355	C	S	.	.	S	Bend	trans	-77.1	102	175	-58.9	174.1	0	0	0	108.8	K186 R199 M205 P222	K186-I201 HydrophobicContact CG-CD1 4.03Å; R199-I201 VanDerWaalsContact CD-O 3.28Å; R199-I201 WeakPolarHBondContact CD-O 3.1Å; R199-I201 VanDerWaalsContact CG-O 3.23Å; R199-I201 WeakPolarHBondContact CG-O 3.07Å; R199-I201 PolarHBondContact NE-O 2.9Å; I201-M205 HydrophobicContact CG2-CB 4.13Å; I201-M205 HydrophobicContact CG2-SD 4.49Å; I201-P222 HydrophobicContact CG1-CB 4.2Å; I201-P222 HydrophobicContact CG1-CG 4.04Å
202	L	90.8	Very high	91.6	Very high	4 Å²	4	73.5 Å²	73.5	2%	0.021	39%	0.386	C	S	.	.			trans	-70	153.5	-174.3	-54.1	179.6	0	0	0	111.5	N200 Q204 M205 L220 L265	N200-L202 PolarHBondContact O-N 3.02Å; L202-Q204 HydrophobicContact CB-CG 4.3Å; L202-Q204 VanDerWaalsContact CB-NE2 3.32Å; L202-Q204 PolarHBondContact O-N 2.81Å; L202-Q204 VanDerWaalsContact O-N 3.16Å; L202-M205 HydrophobicContact CB-CE 4.24Å; L202-M205 HydrophobicContact CB-CG 4.22Å; L202-M205 HydrophobicContact CB-SD 4.12Å; L202-M205 HydrophobicContact CD1-CE 3.98Å; L202-M205 HydrophobicContact CG-CE 3.96Å; L202-M205 HydrophobicContact CG-SD 4.28Å; L202-M205 PolarHBondContact N-SD 3.19Å; L202-M205 VanDerWaalsContact N-SD 3.36Å; L202-M205 WeakPolarHBondContact O-CB 3.36Å; L202-M205 PolarHBondContact O-N 3.2Å; L202-L220 HydrophobicContact CD1-CD1 4.21Å; L202-L265 HydrophobicContact CD1-CD2 3.82Å; L202-L265 HydrophobicContact CD2-CD2 4.37Å
203	P	86.9	Confident	91.5	Very high	85 Å²	85	71.2 Å²	71.2	55%	0.552	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-30.5	-179.7	-26.6	35.6	0	0	0	114.7	M205	P203-M205 VanDerWaalsContact C-N 3.26Å; P203-M205 PolarHBondContact O-N 3.01Å
204	Q	87.3	Confident	91.2	Very high	128 Å²	128	72.4 Å²	72.4	60%	0.598	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-11.3	176.3	66.9	-88.1	24	0	0	114.4	L202 N206	L202-Q204 HydrophobicContact CB-CG 4.3Å; L202-Q204 VanDerWaalsContact CB-NE2 3.32Å; L202-Q204 PolarHBondContact O-N 2.81Å; L202-Q204 VanDerWaalsContact O-N 3.16Å; Q204-N206 PolarHBondContact O-N 3.17Å
205	M	89.6	Confident	90.8	Very high	20 Å²	20	73.9 Å²	73.9	10%	0.099	37%	0.369	C	S	.	.			trans	-84.7	96.9	179.8	-66.7	174.8	176.1	0	0	109.8	I201 L202 P203 Y209 L220	I201-M205 HydrophobicContact CG2-CB 4.13Å; I201-M205 HydrophobicContact CG2-SD 4.49Å; L202-M205 HydrophobicContact CB-CE 4.24Å; L202-M205 HydrophobicContact CB-CG 4.22Å; L202-M205 HydrophobicContact CB-SD 4.12Å; L202-M205 HydrophobicContact CD1-CE 3.98Å; L202-M205 HydrophobicContact CG-CE 3.96Å; L202-M205 HydrophobicContact CG-SD 4.28Å; L202-M205 PolarHBondContact N-SD 3.19Å; L202-M205 VanDerWaalsContact N-SD 3.36Å; L202-M205 WeakPolarHBondContact O-CB 3.36Å; L202-M205 PolarHBondContact O-N 3.2Å; P203-M205 VanDerWaalsContact C-N 3.26Å; P203-M205 PolarHBondContact O-N 3.01Å; M205-Y209 HydrophobicContact CB-CD1 3.62Å; M205-Y209 HydrophobicContact CB-CE1 3.97Å; M205-Y209 HydrophobicContact CB-CG 4.36Å; M205-Y209 HydrophobicContact CE-CE1 4.03Å; M205-Y209 HydrophobicContact CG-CD1 3.67Å; M205-Y209 HydrophobicContact CG-CE1 3.55Å; M205-Y209 HydrophobicContact CG-CG 4.36Å; M205-Y209 HydrophobicContact SD-CD1 4.27Å; M205-Y209 HydrophobicContact SD-CE1 3.61Å; M205-L220 HydrophobicContact CE-CB 3.67Å; M205-L220 HydrophobicContact CE-CD1 4.34Å
206	N	90.8	Very high	90.4	Very high	112 Å²	112	72.4 Å²	72.4	60%	0.599	37%	0.372	S	S	*	.			trans	-81.3	171.7	177.4	-67.1	-18.4	0	0	0	112.1	Q204 A208 Y209 L210	Q204-N206 PolarHBondContact O-N 3.17Å; N206-A208 PolarHBondContact O-N 3.31Å; N206-Y209 WeakPolarHBondContact O-CB 3Å; N206-Y209 PolarHBondContact O-N 2.77Å; N206-L210 PolarHBondContact O-N 3.4Å; N206-L210 VanDerWaalsContact O-N 3.1Å
207	D	89.3	Confident	90.1	Very high	92 Å²	92	78 Å²	78	49%	0.492	40%	0.404	S	S	.	.	H	α-helix	trans	-58.3	-36.5	177.1	-169.5	64.1	0	0	0	112.5	Y209 L210 R211	D207-Y209 VanDerWaalsContact C-N 3.31Å; D207-Y209 PolarHBondContact O-N 3.03Å; D207-L210 PolarHBondContact O-N 3.48Å; D207-L210 VanDerWaalsContact O-N 3.17Å; D207-R211 WeakPolarHBondContact O-CG 3.46Å; D207-R211 PolarHBondContact O-N 2.88Å; D207-R211 IonicContact OD2-CZ 3.11Å; D207-R211 IonicContact OD2-NE 2.79Å; D207-R211 PolarHBondContact OD2-NE 2.86Å; D207-R211 IonicContact OD2-NH2 2.7Å; D207-R211 PolarHBondContact OD2-NH2 2.71Å
208	A	90.4	Very high	89.9	Confident	72 Å²	72	76 Å²	76	60%	0.595	39%	0.394	S	S	*	.	H	α-helix	trans	-60.7	-38.1	174.7	0	0	0	0	0	113	N206 R211 S212	N206-A208 PolarHBondContact O-N 3.31Å; A208-R211 PolarHBondContact O-N 3.18Å; A208-S212 PolarHBondContact O-N 2.94Å; A208-S212 PolarHBondContact O-OG 3.03Å
209	Y	91.3	Very high	89.6	Confident	50 Å²	50	75.6 Å²	75.6	20%	0.196	40%	0.403	C	S	.	.	H	α-helix	trans	-66.4	-46	173.8	166.6	-91.6	0	0	0	110.5	M205 N206 D207 R211 S212 C213 D218 C221	M205-Y209 HydrophobicContact CB-CD1 3.62Å; M205-Y209 HydrophobicContact CB-CE1 3.97Å; M205-Y209 HydrophobicContact CB-CG 4.36Å; M205-Y209 HydrophobicContact CE-CE1 4.03Å; M205-Y209 HydrophobicContact CG-CD1 3.67Å; M205-Y209 HydrophobicContact CG-CE1 3.55Å; M205-Y209 HydrophobicContact CG-CG 4.36Å; M205-Y209 HydrophobicContact SD-CD1 4.27Å; M205-Y209 HydrophobicContact SD-CE1 3.61Å; N206-Y209 WeakPolarHBondContact O-CB 3Å; N206-Y209 PolarHBondContact O-N 2.77Å; D207-Y209 VanDerWaalsContact C-N 3.31Å; D207-Y209 PolarHBondContact O-N 3.03Å; Y209-R211 PolarHBondContact O-N 2.93Å; Y209-S212 PolarHBondContact O-N 2.68Å; Y209-S212 VanDerWaalsContact O-N 3.1Å; Y209-S212 PolarHBondContact O-OG 3.35Å; Y209-C213 HydrophobicContact CD1-CB 4.34Å; Y209-C213 HydrophobicContact CD2-CB 4.21Å; Y209-C213 HydrophobicContact CE1-CB 3.92Å; Y209-C213 HydrophobicContact CE2-CB 3.77Å; Y209-C213 HydrophobicContact CG-CB 4.48Å; Y209-C213 VanDerWaalsContact O-CB 3.31Å; Y209-C213 WeakPolarHBondContact O-CB 3.41Å; Y209-C213 PolarHBondContact O-N 2.97Å; Y209-D218 VanDerWaalsContact CE2-OD2 3.29Å; Y209-D218 WeakPolarHBondContact CE2-OD2 3.1Å; Y209-D218 PolarHBondContact OH-OD2 2.8Å; Y209-C221 WeakPolarHBondContact OH-CA 3.46Å; Y209-C221 PolarHBondContact OH-N 3.34Å
210	L	90.2	Very high	89.5	Confident	38 Å²	38	71 Å²	71	20%	0.199	39%	0.388	C	S	.	.	H	α-helix	trans	-63.1	-26.8	179.7	-65.8	176.8	0	0	0	113.2	N206 D207 P222 I223	N206-L210 PolarHBondContact O-N 3.4Å; N206-L210 VanDerWaalsContact O-N 3.1Å; D207-L210 PolarHBondContact O-N 3.48Å; D207-L210 VanDerWaalsContact O-N 3.17Å; L210-P222 HydrophobicContact CD2-CG 3.66Å; L210-I223 HydrophobicContact CB-CD1 4.5Å; L210-I223 WeakPolarHBondContact O-CD1 3.32Å
211	R	88.3	Confident	89.5	Confident	204 Å²	204	70.9 Å²	70.9	77%	0.77	39%	0.387	S	S	*	.	H	α-helix	trans	-76.5	-26.4	175.5	-68.7	178.7	-165.1	-163.5	4	113.8	D207 A208 Y209	D207-R211 WeakPolarHBondContact O-CG 3.46Å; D207-R211 PolarHBondContact O-N 2.88Å; D207-R211 IonicContact OD2-CZ 3.11Å; D207-R211 IonicContact OD2-NE 2.79Å; D207-R211 PolarHBondContact OD2-NE 2.86Å; D207-R211 IonicContact OD2-NH2 2.7Å; D207-R211 PolarHBondContact OD2-NH2 2.71Å; A208-R211 PolarHBondContact O-N 3.18Å; Y209-R211 PolarHBondContact O-N 2.93Å
212	S	88.8	Confident	89.5	Confident	93 Å²	93	69.7 Å²	69.7	65%	0.65	38%	0.381	S	S	*	.	H	α-helix	trans	-113.6	-14	-170.7	55.6	0	0	0	0	114.1	A208 Y209	A208-S212 PolarHBondContact O-N 2.94Å; A208-S212 PolarHBondContact O-OG 3.03Å; Y209-S212 PolarHBondContact O-N 2.68Å; Y209-S212 VanDerWaalsContact O-N 3.1Å; Y209-S212 PolarHBondContact O-OG 3.35Å
213	C	91.5	Very high	89.7	Confident	21 Å²	21	71.6 Å²	71.6	14%	0.142	39%	0.391	C	S	.	.			trans	-67.4	138.7	-177.5	80.8	0	0	0	0	111.2	Y209 C221	Y209-C213 HydrophobicContact CD1-CB 4.34Å; Y209-C213 HydrophobicContact CD2-CB 4.21Å; Y209-C213 HydrophobicContact CE1-CB 3.92Å; Y209-C213 HydrophobicContact CE2-CB 3.77Å; Y209-C213 HydrophobicContact CG-CB 4.48Å; Y209-C213 VanDerWaalsContact O-CB 3.31Å; Y209-C213 WeakPolarHBondContact O-CB 3.41Å; Y209-C213 PolarHBondContact O-N 2.97Å; C213-C221 HydrophobicContact CB-CB 3.72Å; C213-C221 WeakPolarHBondContact CB-SG 3.42Å; C213-C221 PolarHBondContact O-SG 2.83Å; C213-C221 VanDerWaalsContact O-SG 3.39Å; C213-C221 WeakPolarHBondContact SG-CB 3.25Å; C213-C221 CovalentContact SG-SG 2.06Å; C213-C221 PolarHBondContact SG-SG 3.26Å
214	H	88.2	Confident	90.1	Very high	95 Å²	95	67.8 Å²	67.8	44%	0.44	37%	0.366	S	S	.	.			trans	-137.1	139.7	174.9	-172.2	66.4	0	0	0	109.8	A216 N217 D218 D228	H214-A216 VanDerWaalsContact C-N 3.27Å; H214-A216 PolarHBondContact O-N 3.38Å; H214-N217 PolarHBondContact O-N 2.93Å; H214-N217 VanDerWaalsContact O-N 3.16Å; H214-D218 PolarHBondContact O-N 2.95Å; H214-D228 IonicContact CE1-OD2 3.84Å
215	R	85.4	Confident	90.5	Very high	61 Å²	61	65.9 Å²	65.9	23%	0.23	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-28.3	-168.6	-175.2	58.8	-174.7	79.5	1.3	114.1	N217 D218 F224	R215-N217 VanDerWaalsContact C-N 3.29Å; R215-N217 PolarHBondContact O-N 3.08Å; R215-D218 WeakPolarHBondContact CA-O 3.43Å; R215-F224 HydrophobicContact CG-CE1 4.49Å
216	A	83.9	Confident	90.8	Very high	80 Å²	80	65 Å²	65	66%	0.661	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-34.7	178	0	0	0	0	0	112.4	H214	H214-A216 VanDerWaalsContact C-N 3.27Å; H214-A216 PolarHBondContact O-N 3.38Å
217	N	87.9	Confident	91	Very high	157 Å²	157	59.8 Å²	59.8	84%	0.84	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-35.5	-179.1	-66.7	3.5	0	0	0	111.9	H214 R215	H214-N217 PolarHBondContact O-N 2.93Å; H214-N217 VanDerWaalsContact O-N 3.16Å; R215-N217 VanDerWaalsContact C-N 3.29Å; R215-N217 PolarHBondContact O-N 3.08Å
218	D	89.4	Confident	91.2	Very high	49 Å²	49	56.8 Å²	56.8	26%	0.262	31%	0.305	S	S	.	.			trans	-124.5	118.4	-178.4	-166.5	-23.6	0	0	0	112.1	Y209 H214 R215 L220 C221	Y209-D218 VanDerWaalsContact CE2-OD2 3.29Å; Y209-D218 WeakPolarHBondContact CE2-OD2 3.1Å; Y209-D218 PolarHBondContact OH-OD2 2.8Å; H214-D218 PolarHBondContact O-N 2.95Å; R215-D218 WeakPolarHBondContact CA-O 3.43Å; D218-L220 VanDerWaalsContact C-N 3.27Å; D218-L220 PolarHBondContact O-N 2.75Å; D218-L220 WeakPolarHBondContact OD1-CB 3.04Å; D218-L220 PolarHBondContact OD1-N 2.99Å; D218-C221 HydrophobicContact CB-CB 4.49Å; D218-C221 PolarHBondContact O-N 2.99Å
219	S	90.1	Very high	91.5	Very high	68 Å²	68	53.4 Å²	53.4	48%	0.476	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-16.6	178.4	68	0	0	0	0	116.5
220	L	91.6	Very high	91.7	Very high	34 Å²	34	51 Å²	51	18%	0.178	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-2.7	-178.2	-60.4	173.1	0	0	0	112.9	L202 M205 D218 P222 L265 P266	L202-L220 HydrophobicContact CD1-CD1 4.21Å; M205-L220 HydrophobicContact CE-CB 3.67Å; M205-L220 HydrophobicContact CE-CD1 4.34Å; D218-L220 VanDerWaalsContact C-N 3.27Å; D218-L220 PolarHBondContact O-N 2.75Å; D218-L220 WeakPolarHBondContact OD1-CB 3.04Å; D218-L220 PolarHBondContact OD1-N 2.99Å; L220-P222 WeakPolarHBondContact O-CD 3.43Å; L220-L265 HydrophobicContact CD1-CD2 4.41Å; L220-L265 HydrophobicContact CD2-CB 4.22Å; L220-L265 HydrophobicContact CD2-CD1 4.49Å; L220-L265 HydrophobicContact CD2-CD2 4.26Å; L220-P266 HydrophobicContact CD2-CG 4.42Å
221	C	94.1	Very high	91.9	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.289	C	S	.	.			trans	-60.3	122.7	178.1	-177.3	0	0	0	0	110.2	Y209 C213 D218 I223 F224	Y209-C221 WeakPolarHBondContact OH-CA 3.46Å; Y209-C221 PolarHBondContact OH-N 3.34Å; C213-C221 HydrophobicContact CB-CB 3.72Å; C213-C221 WeakPolarHBondContact CB-SG 3.42Å; C213-C221 PolarHBondContact O-SG 2.83Å; C213-C221 VanDerWaalsContact O-SG 3.39Å; C213-C221 WeakPolarHBondContact SG-CB 3.25Å; C213-C221 CovalentContact SG-SG 2.06Å; C213-C221 PolarHBondContact SG-SG 3.26Å; D218-C221 HydrophobicContact CB-CB 4.49Å; D218-C221 PolarHBondContact O-N 2.99Å; C221-I223 VanDerWaalsContact C-N 3.26Å; C221-I223 PolarHBondContact O-N 3.32Å; C221-F224 WeakPolarHBondContact O-CZ 2.88Å
222	P	94.2	Very high	92.1	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.275	C	S	.	.			trans	-84.7	1.6	-176.3	36.4	-39.3	0	0	0	113.3	L184 I185 I201 L210 L220 F224	L184-P222 HydrophobicContact CD1-CB 4.06Å; L184-P222 HydrophobicContact CD1-CG 3.87Å; I185-P222 PolarHBondContact N-O 2.69Å; I201-P222 HydrophobicContact CG1-CB 4.2Å; I201-P222 HydrophobicContact CG1-CG 4.04Å; L210-P222 HydrophobicContact CD2-CG 3.66Å; L220-P222 WeakPolarHBondContact O-CD 3.43Å; P222-F224 WeakPolarHBondContact O-CD2 3.29Å; P222-F224 WeakPolarHBondContact O-CE2 3.21Å
223	I	95	Very high	92.4	Very high	44 Å²	44	49 Å²	49	23%	0.226	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	125.2	180	-59.3	174.5	0	0	0	108.3	T182 V183 L184 L210 C221	T182-I223 HydrophobicContact CG2-CG2 4.37Å; V183-I223 WeakPolarHBondContact O-CA 3.46Å; L184-I223 HydrophobicContact CB-CG1 4.37Å; L184-I223 HydrophobicContact CD1-CD1 4.46Å; L184-I223 HydrophobicContact CD1-CG1 3.67Å; L210-I223 HydrophobicContact CB-CD1 4.5Å; L210-I223 WeakPolarHBondContact O-CD1 3.32Å; C221-I223 VanDerWaalsContact C-N 3.26Å; C221-I223 PolarHBondContact O-N 3.32Å
224	F	95.5	Very high	92.5	Very high	6 Å²	6	51 Å²	51	3%	0.026	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	141.6	-176.9	-55.8	-86.8	0	0	0	110.3	T182 V183 I185 R215 C221 P222 M229 Y268 F270	T182-F224 CarbonylContact C-O 3.58Å; T182-F224 VanDerWaalsContact CA-O 3.22Å; T182-F224 WeakPolarHBondContact CA-O 3.39Å; V183-F224 HydrophobicContact CG1-CB 3.91Å; V183-F224 PolarHBondContact N-O 2.98Å; V183-F224 PolarHBondContact O-N 2.9Å; I185-F224 HydrophobicContact CB-CE2 4.33Å; I185-F224 HydrophobicContact CD1-CD2 3.74Å; I185-F224 HydrophobicContact CD1-CE2 3.83Å; I185-F224 HydrophobicContact CG1-CD2 4.05Å; I185-F224 HydrophobicContact CG1-CE2 4.19Å; R215-F224 HydrophobicContact CG-CE1 4.49Å; C221-F224 WeakPolarHBondContact O-CZ 2.88Å; P222-F224 WeakPolarHBondContact O-CD2 3.29Å; P222-F224 WeakPolarHBondContact O-CE2 3.21Å; F224-M229 HydrophobicContact CB-CG 3.93Å; F224-M229 HydrophobicContact CB-SD 3.54Å; F224-M229 VanDerWaalsContact CB-SD 3.54Å; F224-M229 HydrophobicContact CG-SD 4.41Å; F224-Y268 HydrophobicContact CE1-CD1 4.41Å; F224-Y268 HydrophobicContact CE1-CD2 4.35Å; F224-Y268 HydrophobicContact CE1-CG 4.13Å; F224-Y268 HydrophobicContact CE2-CD1 4.38Å; F224-Y268 HydrophobicContact CE2-CE1 4.24Å; F224-Y268 AromaticContact CZ-CD1 3.68Å; F224-Y268 HydrophobicContact CZ-CD1 3.68Å; F224-Y268 AromaticContact CZ-CD2 3.9Å; F224-Y268 HydrophobicContact CZ-CD2 3.9Å; F224-Y268 AromaticContact CZ-CE1 3.82Å; F224-Y268 HydrophobicContact CZ-CE1 3.82Å; F224-Y268 HydrophobicContact CZ-CE2 4.03Å; F224-Y268 AromaticContact CZ-CG 3.73Å; F224-Y268 HydrophobicContact CZ-CG 3.73Å; F224-Y268 AromaticContact CZ-CZ 3.99Å; F224-F270 HydrophobicContact CD1-CE2 4.47Å; F224-F270 AromaticContact CD1-CZ 3.69Å; F224-F270 HydrophobicContact CD1-CZ 3.69Å; F224-F270 AromaticContact CE1-CZ 3.85Å; F224-F270 HydrophobicContact CE1-CZ 3.85Å; F224-F270 HydrophobicContact CG-CZ 4.38Å
225	R	95.4	Very high	92.7	Very high	88 Å²	88	48.2 Å²	48.2	33%	0.332	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	135.6	169	178.4	178.6	170.2	-157.3	-1.9	109	E179 N180 F181 G227 D228 M229	E179-R225 WeakPolarHBondContact O-CG 3.46Å; E179-R225 PolarHBondContact O-NE 2.99Å; N180-R225 PolarHBondContact OD1-NE 2.94Å; N180-R225 PolarHBondContact OD1-NH2 3.14Å; F181-R225 WeakPolarHBondContact O-CA 3.39Å; R225-G227 VanDerWaalsContact C-N 3.34Å; R225-G227 PolarHBondContact O-N 2.99Å; R225-D228 HydrophobicContact CB-CB 4.35Å; R225-D228 WeakPolarHBondContact CB-OD2 3.44Å; R225-D228 PolarHBondContact O-N 2.67Å; R225-D228 VanDerWaalsContact O-N 3.13Å; R225-M229 WeakPolarHBondContact O-CG 3.29Å; R225-M229 PolarHBondContact O-N 2.88Å
226	L	95.5	Very high	93.1	Very high	1 Å²	1	52 Å²	52	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-61.9	-40.6	-173.8	-58.8	-173.3	0	0	0	112.5	F95 V97 F181 V183 D228 M229 V230 F237 F312	F95-L226 HydrophobicContact CE2-CD2 4.21Å; F95-L226 HydrophobicContact CZ-CD2 4.46Å; V97-L226 HydrophobicContact CB-CD1 4.17Å; V97-L226 HydrophobicContact CG1-CD1 3.86Å; V97-L226 HydrophobicContact CG2-CD1 3.85Å; F181-L226 HydrophobicContact CB-CD1 3.81Å; F181-L226 HydrophobicContact CB-CG 4.13Å; F181-L226 PolarHBondContact O-N 3.29Å; V183-L226 HydrophobicContact CB-CD2 4.43Å; V183-L226 HydrophobicContact CG1-CD2 4.07Å; L226-D228 VanDerWaalsContact C-N 3.32Å; L226-D228 PolarHBondContact O-N 3.26Å; L226-M229 HydrophobicContact CD2-SD 4.04Å; L226-M229 PolarHBondContact O-N 2.84Å; L226-V230 WeakPolarHBondContact O-CG2 3.46Å; L226-V230 PolarHBondContact O-N 3.29Å; L226-V230 VanDerWaalsContact O-N 3.1Å; L226-F237 HydrophobicContact CB-CE2 4.13Å; L226-F312 HydrophobicContact CB-CZ 4.33Å; L226-F312 HydrophobicContact CD1-CE2 4.33Å; L226-F312 HydrophobicContact CD2-CE1 4.38Å; L226-F312 HydrophobicContact CD2-CE2 3.99Å; L226-F312 HydrophobicContact CD2-CZ 3.84Å; L226-F312 HydrophobicContact CG-CZ 4.45Å
227	G	95	Very high	93.6	Very high	3 Å²	3	48.7 Å²	48.7	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-59.5	-39.5	175.1	0	0	0	0	0	113.6	E179 R225 V230 R231	E179-G227 PolarHBondContact O-N 2.8Å; R225-G227 VanDerWaalsContact C-N 3.34Å; R225-G227 PolarHBondContact O-N 2.99Å; G227-V230 PolarHBondContact O-N 3.2Å; G227-R231 VanDerWaalsContact O-CB 3.24Å; G227-R231 WeakPolarHBondContact O-CB 3.38Å; G227-R231 PolarHBondContact O-N 3.45Å
228	D	94.5	Very high	93.8	Very high	29 Å²	29	44.8 Å²	44.8	16%	0.155	24%	0.237	C	C	.	.	H	α-helix	trans	-67.2	-39	179	-65.9	-26.6	0	0	0	111.4	H214 R225 L226 R231 E232	H214-D228 IonicContact CE1-OD2 3.84Å; R225-D228 HydrophobicContact CB-CB 4.35Å; R225-D228 WeakPolarHBondContact CB-OD2 3.44Å; R225-D228 PolarHBondContact O-N 2.67Å; R225-D228 VanDerWaalsContact O-N 3.13Å; L226-D228 VanDerWaalsContact C-N 3.32Å; L226-D228 PolarHBondContact O-N 3.26Å; D228-R231 PolarHBondContact O-N 2.94Å; D228-R231 IonicContact OD1-CZ 3.18Å; D228-R231 IonicContact OD1-NE 3.64Å; D228-R231 IonicContact OD1-NH2 2.76Å; D228-R231 PolarHBondContact OD1-NH2 3.27Å; D228-E232 WeakPolarHBondContact O-CB 3.3Å; D228-E232 PolarHBondContact O-N 3.4Å
229	M	95.1	Very high	93.8	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-65.2	-44.5	177.6	-62.7	164.7	63.5	0	0	112.1	V183 F224 R225 L226 R231 E232 A233 I249 F270 F312	V183-M229 HydrophobicContact CG1-SD 3.93Å; F224-M229 HydrophobicContact CB-CG 3.93Å; F224-M229 HydrophobicContact CB-SD 3.54Å; F224-M229 VanDerWaalsContact CB-SD 3.54Å; F224-M229 HydrophobicContact CG-SD 4.41Å; R225-M229 WeakPolarHBondContact O-CG 3.29Å; R225-M229 PolarHBondContact O-N 2.88Å; L226-M229 HydrophobicContact CD2-SD 4.04Å; L226-M229 PolarHBondContact O-N 2.84Å; M229-R231 VanDerWaalsContact C-N 3.34Å; M229-E232 PolarHBondContact O-N 3.02Å; M229-A233 PolarHBondContact O-N 3.32Å; M229-I249 HydrophobicContact CE-CD1 3.3Å; M229-I249 HydrophobicContact CE-CG1 3.52Å; M229-F270 HydrophobicContact CB-CD1 3.96Å; M229-F270 HydrophobicContact CB-CE1 4.14Å; M229-F270 HydrophobicContact CB-CG 4.18Å; M229-F270 HydrophobicContact CE-CD1 3.93Å; M229-F270 HydrophobicContact CE-CE1 3.64Å; M229-F270 HydrophobicContact CG-CD1 4Å; M229-F270 HydrophobicContact CG-CE1 3.65Å; M229-F270 HydrophobicContact CG-CE2 4.32Å; M229-F270 HydrophobicContact CG-CG 4.48Å; M229-F270 HydrophobicContact CG-CZ 3.83Å; M229-F270 WeakPolarHBondContact O-CB 3.38Å; M229-F270 HydrophobicContact SD-CE1 4.29Å; M229-F312 HydrophobicContact CB-CE1 4.47Å; M229-F312 HydrophobicContact CE-CD1 3.48Å; M229-F312 VanDerWaalsContact CE-CD1 3.48Å; M229-F312 HydrophobicContact CE-CE1 3.62Å; M229-F312 HydrophobicContact CE-CG 4.45Å; M229-F312 HydrophobicContact SD-CE1 4.35Å
230	V	95.3	Very high	93.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.6	-39.6	178.3	176.6	0	0	0	0	110.6	L226 G227 A233 G234 E235 F237 M240 I247 I310 F312	L226-V230 WeakPolarHBondContact O-CG2 3.46Å; L226-V230 PolarHBondContact O-N 3.29Å; L226-V230 VanDerWaalsContact O-N 3.1Å; G227-V230 PolarHBondContact O-N 3.2Å; V230-A233 WeakPolarHBondContact O-CB 3.24Å; V230-A233 PolarHBondContact O-N 2.61Å; V230-G234 PolarHBondContact O-N 3.47Å; V230-E235 HydrophobicContact CG1-CB 3.76Å; V230-E235 PolarHBondContact O-N 3.31Å; V230-F237 HydrophobicContact CB-CD2 4.18Å; V230-F237 HydrophobicContact CG1-CB 4.4Å; V230-F237 HydrophobicContact CG2-CD2 3.82Å; V230-F237 HydrophobicContact CG2-CE2 4.36Å; V230-M240 HydrophobicContact CG1-CE 4.27Å; V230-M240 HydrophobicContact CG1-SD 4.29Å; V230-I247 HydrophobicContact CG2-CG1 4.24Å; V230-I310 HydrophobicContact CG2-CD1 4.29Å; V230-F312 HydrophobicContact CG2-CZ 4.49Å
231	R	95	Very high	93.9	Very high	172 Å²	172	42.9 Å²	42.9	65%	0.649	22%	0.222	S	C	*	.	H	α-helix	trans	-65.9	-41.3	175.9	-178.6	170.7	55.5	158.5	-1.6	112.7	G227 D228 M229 A233 G234	G227-R231 VanDerWaalsContact O-CB 3.24Å; G227-R231 WeakPolarHBondContact O-CB 3.38Å; G227-R231 PolarHBondContact O-N 3.45Å; D228-R231 PolarHBondContact O-N 2.94Å; D228-R231 IonicContact OD1-CZ 3.18Å; D228-R231 IonicContact OD1-NE 3.64Å; D228-R231 IonicContact OD1-NH2 2.76Å; D228-R231 PolarHBondContact OD1-NH2 3.27Å; M229-R231 VanDerWaalsContact C-N 3.34Å; R231-A233 VanDerWaalsContact C-N 3.26Å; R231-A233 PolarHBondContact O-N 3.02Å; R231-G234 PolarHBondContact O-N 3.06Å
232	E	93.9	Very high	93.8	Very high	99 Å²	99	43.3 Å²	43.3	46%	0.463	22%	0.224	S	C	.	.	H	α-helix	trans	-67.7	-27.5	175.7	-169.1	174.6	161.5	0	0	112	D228 M229 G234 F270	D228-E232 WeakPolarHBondContact O-CB 3.3Å; D228-E232 PolarHBondContact O-N 3.4Å; M229-E232 PolarHBondContact O-N 3.02Å; E232-G234 PolarHBondContact O-N 2.84Å; E232-F270 HydrophobicContact CB-CD2 3.94Å; E232-F270 VanDerWaalsContact CD-CD2 3.47Å; E232-F270 HydrophobicContact CG-CD2 3.96Å; E232-F270 WeakPolarHBondContact OE2-CD2 3.27Å; E232-F270 VanDerWaalsContact OE2-CE2 3.31Å; E232-F270 WeakPolarHBondContact OE2-CE2 3.26Å
233	A	94.2	Very high	93.5	Very high	22 Å²	22	46.3 Å²	46.3	18%	0.182	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-3.8	169.4	0	0	0	0	0	113.9	M229 V230 R231 I247 F270	M229-A233 PolarHBondContact O-N 3.32Å; V230-A233 WeakPolarHBondContact O-CB 3.24Å; V230-A233 PolarHBondContact O-N 2.61Å; R231-A233 VanDerWaalsContact C-N 3.26Å; R231-A233 PolarHBondContact O-N 3.02Å; A233-I247 HydrophobicContact CB-CD1 4.18Å; A233-F270 HydrophobicContact CB-CB 4.16Å
234	G	93.3	Very high	93.2	Very high	62 Å²	62	44.3 Å²	44.3	64%	0.639	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.1	16.2	178.7	0	0	0	0	0	114.8	V230 R231 E232	V230-G234 PolarHBondContact O-N 3.47Å; R231-G234 PolarHBondContact O-N 3.06Å; E232-G234 PolarHBondContact O-N 2.84Å
235	E	91.9	Very high	93	Very high	37 Å²	37	44.1 Å²	44.1	17%	0.173	23%	0.228	C	C	.	.			trans	-117.4	160.7	-172.6	-66	-71.4	-172.4	0	0	112.6	V230 M240 R272	V230-E235 HydrophobicContact CG1-CB 3.76Å; V230-E235 PolarHBondContact O-N 3.31Å; E235-M240 HydrophobicContact CB-CE 3.72Å; E235-M240 HydrophobicContact CG-CE 3.81Å; E235-R272 VanDerWaalsContact CD-NH1 3.35Å; E235-R272 HydrophobicContact CG-CB 4.4Å; E235-R272 WeakPolarHBondContact OE1-CD 3.43Å; E235-R272 IonicContact OE1-CZ 3.28Å; E235-R272 IonicContact OE1-NE 2.71Å; E235-R272 IonicContact OE1-NH1 3.64Å; E235-R272 PolarHBondContact OE1-NH1 3.35Å; E235-R272 IonicContact OE2-NH1 3.69Å; E235-R272 PolarHBondContact OE2-NH1 2.03Å
236	K	93.6	Very high	92.9	Very high	139 Å²	139	41.1 Å²	41.1	60%	0.604	22%	0.22	S	C	*	.			trans	-96.3	124.6	174.5	-67.6	-177	-177.6	176.4	0	110.6	S238 D239 M240	K236-S238 VanDerWaalsContact C-N 3.3Å; K236-S238 PolarHBondContact O-N 3.09Å; K236-D239 HydrophobicContact CB-CB 4.44Å; K236-D239 PolarHBondContact O-N 3.22Å; K236-M240 PolarHBondContact O-N 2.89Å
237	F	94.5	Very high	92.8	Very high	12 Å²	12	41.1 Å²	41.1	5%	0.053	22%	0.22	C	C	.	.	H	α-helix	trans	-59.9	-39.8	179.9	-168.5	-85.9	0	0	0	112.4	T99 A178 E179 L226 V230 D239 M240 A241 I310	T99-F237 HydrophobicContact CG2-CE1 4.43Å; T99-F237 HydrophobicContact CG2-CZ 4.02Å; A178-F237 HydrophobicContact CB-CE1 4.31Å; A178-F237 HydrophobicContact CB-CZ 3.96Å; E179-F237 HydrophobicContact CB-CD1 3.66Å; E179-F237 HydrophobicContact CB-CD2 4.43Å; E179-F237 HydrophobicContact CB-CE1 3.79Å; E179-F237 HydrophobicContact CB-CG 4.02Å; E179-F237 HydrophobicContact CB-CZ 4.26Å; E179-F237 HydrophobicContact CG-CB 4.14Å; E179-F237 HydrophobicContact CG-CD1 4Å; E179-F237 HydrophobicContact CG-CD2 4.29Å; E179-F237 HydrophobicContact CG-CG 3.87Å; L226-F237 HydrophobicContact CB-CE2 4.13Å; V230-F237 HydrophobicContact CB-CD2 4.18Å; V230-F237 HydrophobicContact CG1-CB 4.4Å; V230-F237 HydrophobicContact CG2-CD2 3.82Å; V230-F237 HydrophobicContact CG2-CE2 4.36Å; F237-D239 VanDerWaalsContact C-N 3.29Å; F237-D239 PolarHBondContact O-N 3.18Å; F237-M240 PolarHBondContact O-N 2.76Å; F237-A241 HydrophobicContact CD1-CB 4.2Å; F237-A241 HydrophobicContact CE1-CB 4.05Å; F237-A241 WeakPolarHBondContact O-CB 3.31Å; F237-A241 PolarHBondContact O-N 3.27Å; F237-I310 HydrophobicContact CD2-CD1 4.17Å; F237-I310 HydrophobicContact CE2-CD1 3.76Å; F237-I310 HydrophobicContact CZ-CD1 4.23Å
238	S	92.8	Very high	92.9	Very high	74 Å²	74	41 Å²	41	52%	0.517	22%	0.218	S	C	.	.	H	α-helix	trans	-56.6	-40.8	179.8	55.5	0	0	0	0	113.5	K236	K236-S238 VanDerWaalsContact C-N 3.3Å; K236-S238 PolarHBondContact O-N 3.09Å
239	D	89.9	Confident	93	Very high	101 Å²	101	39.6 Å²	39.6	54%	0.54	21%	0.211	S	C	.	.	H	α-helix	trans	-79.4	-43	-172.8	-58.3	-12.3	0	0	0	109.4	K236 F237 A241 V242	K236-D239 HydrophobicContact CB-CB 4.44Å; K236-D239 PolarHBondContact O-N 3.22Å; F237-D239 VanDerWaalsContact C-N 3.29Å; F237-D239 PolarHBondContact O-N 3.18Å; D239-A241 VanDerWaalsContact C-N 3.3Å; D239-A241 PolarHBondContact O-N 2.96Å; D239-V242 PolarHBondContact O-N 3.15Å
240	M	90.6	Very high	93	Very high	9 Å²	9	41 Å²	41	4%	0.044	22%	0.217	C	C	.	.	H	α-helix	trans	-67.1	-30.9	175.5	-163.9	175.7	-68.6	0	0	112.4	V230 E235 K236 F237 V242 G244 I247 R272 I310	V230-M240 HydrophobicContact CG1-CE 4.27Å; V230-M240 HydrophobicContact CG1-SD 4.29Å; E235-M240 HydrophobicContact CB-CE 3.72Å; E235-M240 HydrophobicContact CG-CE 3.81Å; K236-M240 PolarHBondContact O-N 2.89Å; F237-M240 PolarHBondContact O-N 2.76Å; M240-V242 PolarHBondContact O-N 3.01Å; M240-G244 CarbonylContact O-C 3.58Å; M240-G244 WeakPolarHBondContact O-CA 3.42Å; M240-G244 PolarHBondContact O-N 2.04Å; M240-I247 HydrophobicContact CE-CD1 3.89Å; M240-I247 HydrophobicContact SD-CD1 3.9Å; M240-I247 HydrophobicContact SD-CG1 3.99Å; M240-R272 HydrophobicContact CE-CG 4.44Å; M240-I310 HydrophobicContact CB-CD1 4.25Å; M240-I310 HydrophobicContact CG-CD1 3.87Å; M240-I310 HydrophobicContact CG-CG1 3.95Å; M240-I310 HydrophobicContact SD-CD1 3.82Å; M240-I310 HydrophobicContact SD-CG1 4.11Å; M240-I310 HydrophobicContact SD-CG2 4.17Å
241	A	92.8	Very high	93.1	Very high	1 Å²	1	41 Å²	41	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-66	-22.8	179	0	0	0	0	0	113.5	T99 A173 F237 D239	T99-A241 WeakPolarHBondContact CB-O 3.28Å; T99-A241 HydrophobicContact CG2-CB 4.21Å; T99-A241 WeakPolarHBondContact OG1-CA 3.42Å; T99-A241 PolarHBondContact OG1-O 2.87Å; A173-A241 HydrophobicContact CB-CB 3.68Å; F237-A241 HydrophobicContact CD1-CB 4.2Å; F237-A241 HydrophobicContact CE1-CB 4.05Å; F237-A241 WeakPolarHBondContact O-CB 3.31Å; F237-A241 PolarHBondContact O-N 3.27Å; D239-A241 VanDerWaalsContact C-N 3.3Å; D239-A241 PolarHBondContact O-N 2.96Å
242	V	91.4	Very high	93.2	Very high	9 Å²	9	37.2 Å²	37.2	6%	0.055	21%	0.206	C	C	.	.	H	α-helix	trans	-75.2	-52.5	-178.4	173.9	0	0	0	0	111.7	N100 P169 R171 A173 D239 M240	N100-V242 PolarHBondContact ND2-O 2.95Å; P169-V242 HydrophobicContact CB-CG1 4.08Å; P169-V242 WeakPolarHBondContact CB-O 3.32Å; P169-V242 HydrophobicContact CG-CG1 3.81Å; R171-V242 HydrophobicContact CG-CG1 3.63Å; R171-V242 HydrophobicContact CG-CG2 4.2Å; A173-V242 HydrophobicContact CB-CG2 4.19Å; D239-V242 PolarHBondContact O-N 3.15Å; M240-V242 PolarHBondContact O-N 3.01Å
243	E	87.6	Confident	93.3	Very high	63 Å²	63	32.5 Å²	32.5	29%	0.294	18%	0.184	S	C	.	.	H	α-helix	trans	-101	-16.6	-173	-64.2	177.7	-178.7	0	0	112.5	P169 R171 G285 L286	P169-E243 HydrophobicContact CG-CG 4.34Å; R171-E243 IonicContact CZ-OE1 2.66Å; R171-E243 IonicContact NH1-OE1 3.48Å; R171-E243 IonicContact NH2-OE1 3.94Å; R171-E243 PolarHBondContact NH2-OE1 3.28Å; E243-G285 CarbonylContact O-C 3.58Å; E243-G285 WeakPolarHBondContact O-CA 3.28Å; E243-L286 PolarHBondContact O-N 3.09Å
244	G	89.9	Confident	93.3	Very high	3 Å²	3	34.7 Å²	34.7	3%	0.031	19%	0.192	C	C	.	.			trans	85.4	177.8	-170.8	0	0	0	0	0	112.6	M240 G309	M240-G244 CarbonylContact O-C 3.58Å; M240-G244 WeakPolarHBondContact O-CA 3.42Å; M240-G244 PolarHBondContact O-N 2.04Å; G244-G309 CarbonylContact C-O 3.54Å; G244-G309 WeakPolarHBondContact CA-O 3.39Å
245	G	90.8	Very high	93.4	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.01	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.4	-178.6	-179.5	0	0	0	0	0	112.6	G309 I310 R311	G245-G309 PolarHBondContact N-O 2.94Å; G245-G309 VanDerWaalsContact N-O 3.1Å; G245-I310 WeakPolarHBondContact O-CA 3.41Å; G245-R311 PolarHBondContact O-N 2.89Å
246	V	92.4	Very high	93.5	Very high	26 Å²	26	30.6 Å²	30.6	16%	0.158	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	119	-179.8	-170.6	0	0	0	0	110.3	L273 D274 L286 R311	V246-L273 HydrophobicContact CB-CB 4.26Å; V246-L273 HydrophobicContact CG1-CB 4.01Å; V246-L273 HydrophobicContact CG1-CD1 4.11Å; V246-L273 PolarHBondContact O-N 3.38Å; V246-D274 HydrophobicContact CB-CB 4.3Å; V246-D274 HydrophobicContact CG2-CB 4.37Å; V246-D274 PolarHBondContact N-OD1 3.48Å; V246-D274 VanDerWaalsContact O-OD1 3.05Å; V246-L286 HydrophobicContact CG2-CD2 4.37Å; V246-R311 CarbonylContact C-O 3.57Å; V246-R311 WeakPolarHBondContact CA-O 3.45Å; V246-R311 HydrophobicContact CG2-CB 4.49Å
247	I	94.9	Very high	93.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	124.8	176.6	-63.5	-64.5	0	0	0	109.9	V230 A233 M240 R272 I310 R311 F312 D313	V230-I247 HydrophobicContact CG2-CG1 4.24Å; A233-I247 HydrophobicContact CB-CD1 4.18Å; M240-I247 HydrophobicContact CE-CD1 3.89Å; M240-I247 HydrophobicContact SD-CD1 3.9Å; M240-I247 HydrophobicContact SD-CG1 3.99Å; I247-R272 HydrophobicContact CD1-CB 4.29Å; I247-R272 HydrophobicContact CD1-CG 4.45Å; I247-I310 HydrophobicContact CB-CG2 4.37Å; I247-I310 HydrophobicContact CG1-CG2 3.8Å; I247-R311 PolarHBondContact N-O 2.92Å; I247-F312 HydrophobicContact CB-CD1 3.71Å; I247-F312 HydrophobicContact CB-CE1 3.82Å; I247-F312 HydrophobicContact CG1-CE1 4.15Å; I247-F312 HydrophobicContact CG2-CD1 3.79Å; I247-F312 HydrophobicContact CG2-CE1 3.88Å; I247-F312 CarbonylContact O-C 3.53Å; I247-F312 VanDerWaalsContact O-CA 3.25Å; I247-F312 WeakPolarHBondContact O-CA 3.32Å; I247-D313 PolarHBondContact O-N 3.43Å
248	G	95.8	Very high	93.4	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.7	171.3	0	0	0	0	0	111.8	F270 R271 D313 M315	G248-F270 WeakPolarHBondContact O-CA 3.19Å; G248-R271 WeakPolarHBondContact CA-O 3.49Å; G248-R271 PolarHBondContact N-O 2.75Å; G248-R271 PolarHBondContact O-N 2.83Å; G248-D313 CarbonylContact C-O 3.55Å; G248-D313 WeakPolarHBondContact CA-O 3.35Å; G248-M315 VanDerWaalsContact CA-CE 3.42Å
249	I	96.9	Very high	93	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	108.3	171.1	-55.6	166.2	0	0	0	107.7	F95 I185 M229 I251 F270 F312 D313 I314 M315	F95-I249 HydrophobicContact CE1-CD1 3.81Å; F95-I249 HydrophobicContact CZ-CD1 4.17Å; I185-I249 HydrophobicContact CD1-CD1 3.98Å; I185-I249 HydrophobicContact CD1-CG2 4.11Å; M229-I249 HydrophobicContact CE-CD1 3.3Å; M229-I249 HydrophobicContact CE-CG1 3.52Å; I249-I251 HydrophobicContact CG2-CG1 4.29Å; I249-F270 HydrophobicContact CB-CD1 4.33Å; I249-F270 HydrophobicContact CB-CE1 4.31Å; I249-F270 HydrophobicContact CG1-CD1 3.95Å; I249-F270 HydrophobicContact CG1-CE1 4.01Å; I249-F270 HydrophobicContact CG2-CD1 4.21Å; I249-F270 HydrophobicContact CG2-CE1 3.76Å; I249-F312 HydrophobicContact CD1-CB 3.89Å; I249-F312 HydrophobicContact CD1-CD1 4.12Å; I249-F312 HydrophobicContact CD1-CG 4.41Å; I249-F312 HydrophobicContact CG1-CD1 4.36Å; I249-D313 PolarHBondContact N-O 2.88Å; I249-I314 HydrophobicContact CB-CG1 4.08Å; I249-I314 HydrophobicContact CD1-CD1 4.34Å; I249-I314 HydrophobicContact CD1-CG1 3.72Å; I249-I314 HydrophobicContact CG1-CG1 4.44Å; I249-I314 WeakPolarHBondContact O-CA 3.32Å; I249-M315 PolarHBondContact O-N 2.79Å
250	Q	96.4	Very high	92.6	Very high	31 Å²	31	36.8 Å²	36.8	15%	0.145	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	121.8	-179.5	-66.1	-179.5	-13.7	0	0	109.9	Y268 S269 M315 F317	Q250-Y268 CarbonylContact O-C 3.4Å; Q250-Y268 WeakPolarHBondContact O-CA 3.46Å; Q250-S269 WeakPolarHBondContact CB-O 3.31Å; Q250-S269 WeakPolarHBondContact CB-OG 3.24Å; Q250-S269 PolarHBondContact N-O 3.25Å; Q250-S269 PolarHBondContact O-N 3.47Å; Q250-S269 PolarHBondContact OE1-OG 3.45Å; Q250-M315 CarbonylContact C-O 3.6Å; Q250-M315 WeakPolarHBondContact CA-O 3.31Å; Q250-M315 HydrophobicContact CG-CE 3.74Å; Q250-F317 HydrophobicContact CB-CE1 3.74Å; Q250-F317 HydrophobicContact CB-CZ 4.04Å; Q250-F317 HydrophobicContact CG-CE1 3.93Å; Q250-F317 HydrophobicContact CG-CZ 4.43Å
251	I	96.8	Very high	92.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	100.9	176.5	-49.1	-179.5	0	0	0	108	I185 N187 I249 P266 R267 Y268 I314 M315 V316 F317	I185-I251 HydrophobicContact CG2-CD1 4.1Å; N187-I251 HydrophobicContact CB-CD1 4.34Å; I249-I251 HydrophobicContact CG2-CG1 4.29Å; I251-P266 HydrophobicContact CG2-CB 3.96Å; I251-R267 CarbonylContact C-O 3.52Å; I251-R267 WeakPolarHBondContact CA-O 3.4Å; I251-Y268 HydrophobicContact CB-CE1 4.43Å; I251-Y268 HydrophobicContact CD1-CD1 4.28Å; I251-Y268 HydrophobicContact CD1-CE1 3.79Å; I251-Y268 HydrophobicContact CG1-CD1 3.81Å; I251-Y268 HydrophobicContact CG1-CE1 3.78Å; I251-Y268 HydrophobicContact CG2-CD1 4.31Å; I251-Y268 HydrophobicContact CG2-CE1 3.92Å; I251-I314 HydrophobicContact CD1-CG2 3.7Å; I251-I314 HydrophobicContact CG1-CG2 4.24Å; I251-M315 PolarHBondContact N-O 3.25Å; I251-V316 HydrophobicContact CB-CG1 4.39Å; I251-V316 HydrophobicContact CB-CG2 4.24Å; I251-V316 HydrophobicContact CD1-CG2 4.22Å; I251-V316 WeakPolarHBondContact O-CA 3.47Å; I251-F317 PolarHBondContact O-N 3.43Å; I251-F317 VanDerWaalsContact O-N 3.11Å
252	K	96.9	Very high	92	Very high	93 Å²	93	48.1 Å²	48.1	40%	0.404	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	126.1	178.9	-174.3	177.1	-179.5	175.8	0	111.2	R267 F317	K252-R267 HydrophobicContact CB-CB 4.35Å; K252-R267 PolarHBondContact N-O 3.47Å; K252-R267 PolarHBondContact O-N 2.89Å; K252-F317 CarbonylContact C-O 3.51Å; K252-F317 VanDerWaalsContact CA-O 3.29Å; K252-F317 WeakPolarHBondContact CA-O 3.02Å; K252-F317 HydrophobicContact CB-CD2 4.3Å; K252-F317 HydrophobicContact CB-CE2 3.77Å; K252-F317 HydrophobicContact CB-CZ 4.26Å; K252-F317 HydrophobicContact CD-CE2 4.06Å; K252-F317 HydrophobicContact CG-CD2 4.13Å; K252-F317 HydrophobicContact CG-CE2 3.8Å
253	W	96.3	Very high	92	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	105.5	171.4	-70	93.3	0	0	0	110.5	N187 I189 R198 N200 P266 F317 G318 Q319	N187-W253 PolarHBondContact OD1-NE1 2.83Å; I189-W253 HydrophobicContact CD1-CB 4.19Å; I189-W253 HydrophobicContact CD1-CD2 3.38Å; I189-W253 HydrophobicContact CD1-CE3 3.43Å; I189-W253 VanDerWaalsContact CD1-CE3 3.43Å; I189-W253 HydrophobicContact CD1-CG 3.75Å; I189-W253 HydrophobicContact CD1-CH2 4.22Å; I189-W253 HydrophobicContact CD1-CZ2 4.19Å; I189-W253 HydrophobicContact CD1-CZ3 3.87Å; I189-W253 HydrophobicContact CG1-CD2 4.14Å; I189-W253 HydrophobicContact CG1-CE3 4.35Å; I189-W253 HydrophobicContact CG1-CH2 4.31Å; I189-W253 HydrophobicContact CG1-CZ2 4.11Å; I189-W253 HydrophobicContact CG1-CZ3 4.43Å; I189-W253 HydrophobicContact CG2-CD2 4.34Å; I189-W253 HydrophobicContact CG2-CG 4.27Å; I189-W253 HydrophobicContact CG2-CZ2 4.34Å; R198-W253 HydrophobicContact CG-CH2 4.2Å; R198-W253 HydrophobicContact CG-CZ3 4.01Å; N200-W253 HydrophobicContact CB-CH2 4.4Å; N200-W253 HydrophobicContact CB-CZ2 4.08Å; W253-P266 HydrophobicContact CD2-CB 4.27Å; W253-P266 HydrophobicContact CH2-CB 4.05Å; W253-P266 HydrophobicContact CH2-CG 4.07Å; W253-P266 HydrophobicContact CZ2-CB 3.75Å; W253-P266 HydrophobicContact CZ2-CG 4.16Å; W253-P266 HydrophobicContact CZ3-CB 4.41Å; W253-F317 PolarHBondContact N-O 3.11Å; W253-G318 CarbonylContact O-C 3.55Å; W253-G318 WeakPolarHBondContact O-CA 3.37Å; W253-Q319 PolarHBondContact O-N 2.93Å
254	D	94.8	Very high	92.3	Very high	68 Å²	68	53 Å²	53	36%	0.364	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	97.1	172.3	-176.1	6.4	0	0	0	107.8
255	C	94.7	Very high	92.5	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.007	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	124.4	-166.9	-65.7	0	0	0	0	111.2	F191 L257 R263 C264 Q319 A320 G321	F191-C255 HydrophobicContact CE2-CB 4.23Å; F191-C255 HydrophobicContact CZ-CB 4.37Å; C255-L257 HydrophobicContact CB-CD2 4.33Å; C255-R263 WeakPolarHBondContact CA-O 3.21Å; C255-C264 HydrophobicContact CB-CB 3.55Å; C255-C264 WeakPolarHBondContact CB-SG 3Å; C255-C264 WeakPolarHBondContact SG-CA 3.34Å; C255-C264 WeakPolarHBondContact SG-CB 3.07Å; C255-C264 CovalentContact SG-SG 2.03Å; C255-C264 PolarHBondContact SG-SG 3.32Å; C255-Q319 PolarHBondContact N-O 2.7Å; C255-A320 HydrophobicContact CB-CB 4.11Å; C255-A320 CarbonylContact O-C 3.59Å; C255-A320 VanDerWaalsContact O-CA 3.3Å; C255-A320 WeakPolarHBondContact O-CA 3.02Å; C255-G321 PolarHBondContact O-N 2.85Å
256	N	94.4	Very high	92.7	Very high	11 Å²	11	56 Å²	56	6%	0.059	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	119.3	163.1	-169.5	-5.5	0	0	0	108.6	Q51 D258 Q262 R263	Q51-N256 PolarHBondContact NE2-OD1 2.89Å; N256-D258 VanDerWaalsContact OD1-CB 3.31Å; N256-D258 WeakPolarHBondContact OD1-CB 3.4Å; N256-D258 PolarHBondContact OD1-N 3.29Å; N256-D258 PolarHBondContact OD1-OD2 2.95Å; N256-Q262 WeakPolarHBondContact O-CA 3.45Å; N256-R263 PolarHBondContact N-O 3.18Å; N256-R263 PolarHBondContact O-N 2.93Å
257	L	93.6	Very high	92.8	Very high	19 Å²	19	62.6 Å²	62.6	10%	0.099	28%	0.279	C	S	.	.			trans	-101.4	10.4	179.7	-56.7	-175.4	0	0	0	112.8	F194 F196 C255 A320 G321 K322	F194-L257 HydrophobicContact CB-CD1 4.05Å; F194-L257 HydrophobicContact CD2-CD1 3.72Å; F194-L257 HydrophobicContact CG-CD1 4.18Å; F196-L257 HydrophobicContact CB-CD1 3.87Å; F196-L257 HydrophobicContact CD1-CD1 4.2Å; F196-L257 HydrophobicContact CD1-CD2 3.69Å; F196-L257 HydrophobicContact CD2-CD1 4.48Å; F196-L257 HydrophobicContact CD2-CD2 4.04Å; F196-L257 HydrophobicContact CE1-CD2 3.59Å; F196-L257 HydrophobicContact CE2-CD2 3.99Å; F196-L257 HydrophobicContact CG-CD1 3.94Å; F196-L257 HydrophobicContact CG-CD2 3.89Å; F196-L257 HydrophobicContact CZ-CD2 3.76Å; C255-L257 HydrophobicContact CB-CD2 4.33Å; L257-A320 HydrophobicContact CD1-CB 3.7Å; L257-A320 HydrophobicContact CG-CB 4.01Å; L257-G321 WeakPolarHBondContact CB-O 3.28Å; L257-G321 PolarHBondContact N-O 3.17Å; L257-K322 HydrophobicContact CB-CB 4.21Å; L257-K322 HydrophobicContact CB-CG 4.37Å
258	D	91.2	Very high	92.9	Very high	20 Å²	20	63.2 Å²	63.2	11%	0.107	28%	0.282	C	S	.	.			trans	-65.3	138.1	174.2	-67.4	-15.7	0	0	0	111.4	Y50 Q51 N256 L260 M261 Q262 F323	Y50-D258 WeakPolarHBondContact CE2-OD2 3.48Å; Q51-D258 PolarHBondContact NE2-OD1 3.24Å; Q51-D258 PolarHBondContact NE2-OD2 3.27Å; N256-D258 VanDerWaalsContact OD1-CB 3.31Å; N256-D258 WeakPolarHBondContact OD1-CB 3.4Å; N256-D258 PolarHBondContact OD1-N 3.29Å; N256-D258 PolarHBondContact OD1-OD2 2.95Å; D258-L260 PolarHBondContact O-N 3.3Å; D258-L260 VanDerWaalsContact O-N 3.1Å; D258-M261 CarbonylContact O-C 3.6Å; D258-M261 PolarHBondContact O-N 3.43Å; D258-M261 VanDerWaalsContact O-N 3.1Å; D258-Q262 WeakPolarHBondContact O-CA 3.37Å; D258-Q262 PolarHBondContact O-N 3.3Å; D258-F323 WeakPolarHBondContact OD1-CB 3.45Å; D258-F323 PolarHBondContact OD1-N 3.5Å
259	R	84.4	Confident	92.8	Very high	245 Å²	245	65.1 Å²	65.1	93%	0.925	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-33.3	-172.5	-165.2	175.4	-178.7	174.4	-0.2	113.9
260	L	82.9	Confident	92.8	Very high	172 Å²	172	65.7 Å²	65.7	90%	0.901	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-20	-177.2	-67	167.5	0	0	0	113.5	D258	D258-L260 PolarHBondContact O-N 3.3Å; D258-L260 VanDerWaalsContact O-N 3.1Å
261	M	83.2	Confident	92.7	Very high	131 Å²	131	71.5 Å²	71.5	65%	0.645	32%	0.318	S	S	*	.	S	Bend	trans	-133.2	37.3	-172.1	-61.8	-174.2	82.8	0	0	111.4	D258 R263	D258-M261 CarbonylContact O-C 3.6Å; D258-M261 PolarHBondContact O-N 3.43Å; D258-M261 VanDerWaalsContact O-N 3.1Å; M261-R263 PolarHBondContact O-N 2.66Å; M261-R263 VanDerWaalsContact O-N 3.08Å
262	Q	86.6	Confident	92.6	Very high	118 Å²	118	74.7 Å²	74.7	55%	0.551	33%	0.33	S	S	*	.			trans	-66.3	112.4	-175.5	-168.5	178.5	4.8	0	0	110.4	N256 D258	N256-Q262 WeakPolarHBondContact O-CA 3.45Å; D258-Q262 WeakPolarHBondContact O-CA 3.37Å; D258-Q262 PolarHBondContact O-N 3.3Å
263	R	91.6	Very high	92.3	Very high	166 Å²	166	74.1 Å²	74.1	63%	0.626	33%	0.331	S	S	*	.	B	Isolated β-bridge	trans	-144.3	115.8	178.2	-172.4	176.4	-177.4	176.1	2.7	109.3	C255 N256 M261	C255-R263 WeakPolarHBondContact CA-O 3.21Å; N256-R263 PolarHBondContact N-O 3.18Å; N256-R263 PolarHBondContact O-N 2.93Å; M261-R263 PolarHBondContact O-N 2.66Å; M261-R263 VanDerWaalsContact O-N 3.08Å
264	C	93.5	Very high	91.7	Very high	8 Å²	8	75.9 Å²	75.9	5%	0.054	34%	0.341	C	S	.	.			trans	-147.2	91.5	-178.2	-173.8	0	0	0	0	108.5	F196 C255	F196-C264 HydrophobicContact CE1-CB 4.45Å; C255-C264 HydrophobicContact CB-CB 3.55Å; C255-C264 WeakPolarHBondContact CB-SG 3Å; C255-C264 WeakPolarHBondContact SG-CA 3.34Å; C255-C264 WeakPolarHBondContact SG-CB 3.07Å; C255-C264 CovalentContact SG-SG 2.03Å; C255-C264 PolarHBondContact SG-SG 3.32Å
265	L	94.4	Very high	90.7	Very high	59 Å²	59	79.4 Å²	79.4	31%	0.309	36%	0.355	S	S	.	.			trans	-128.5	142.8	-177.7	-65	174.7	0	0	0	109.2	L202 L220	L202-L265 HydrophobicContact CD1-CD2 3.82Å; L202-L265 HydrophobicContact CD2-CD2 4.37Å; L220-L265 HydrophobicContact CD1-CD2 4.41Å; L220-L265 HydrophobicContact CD2-CB 4.22Å; L220-L265 HydrophobicContact CD2-CD1 4.49Å; L220-L265 HydrophobicContact CD2-CD2 4.26Å
266	P	95.8	Very high	89.5	Confident	7 Å²	7	87.6 Å²	87.6	5%	0.045	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	147.4	178.7	30.4	-33.6	0	0	0	110.7	N200 L220 I251 W253 Y268	N200-P266 HydrophobicContact CB-CG 4.1Å; L220-P266 HydrophobicContact CD2-CG 4.42Å; I251-P266 HydrophobicContact CG2-CB 3.96Å; W253-P266 HydrophobicContact CD2-CB 4.27Å; W253-P266 HydrophobicContact CH2-CB 4.05Å; W253-P266 HydrophobicContact CH2-CG 4.07Å; W253-P266 HydrophobicContact CZ2-CB 3.75Å; W253-P266 HydrophobicContact CZ2-CG 4.16Å; W253-P266 HydrophobicContact CZ3-CB 4.41Å; P266-Y268 HydrophobicContact CB-CE2 4.02Å; P266-Y268 HydrophobicContact CG-CE2 3.9Å
267	R	94.8	Very high	88.1	Confident	165 Å²	165	95.1 Å²	95.1	62%	0.623	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120	125.2	166.1	-66.6	-175.1	177.4	-178.4	0.5	109.2	I251 K252	I251-R267 CarbonylContact C-O 3.52Å; I251-R267 WeakPolarHBondContact CA-O 3.4Å; K252-R267 HydrophobicContact CB-CB 4.35Å; K252-R267 PolarHBondContact N-O 3.47Å; K252-R267 PolarHBondContact O-N 2.89Å
268	Y	95.3	Very high	85.8	Confident	14 Å²	14	97.4 Å²	97.4	6%	0.055	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	136.7	-179.4	-59.3	-80.3	0	0	0	110.1	N200 F224 Q250 I251 P266	N200-Y268 WeakPolarHBondContact CB-OH 3.47Å; N200-Y268 PolarHBondContact ND2-OH 2.99Å; N200-Y268 VanDerWaalsContact ND2-OH 3.08Å; F224-Y268 HydrophobicContact CE1-CD1 4.41Å; F224-Y268 HydrophobicContact CE1-CD2 4.35Å; F224-Y268 HydrophobicContact CE1-CG 4.13Å; F224-Y268 HydrophobicContact CE2-CD1 4.38Å; F224-Y268 HydrophobicContact CE2-CE1 4.24Å; F224-Y268 AromaticContact CZ-CD1 3.68Å; F224-Y268 HydrophobicContact CZ-CD1 3.68Å; F224-Y268 AromaticContact CZ-CD2 3.9Å; F224-Y268 HydrophobicContact CZ-CD2 3.9Å; F224-Y268 AromaticContact CZ-CE1 3.82Å; F224-Y268 HydrophobicContact CZ-CE1 3.82Å; F224-Y268 HydrophobicContact CZ-CE2 4.03Å; F224-Y268 AromaticContact CZ-CG 3.73Å; F224-Y268 HydrophobicContact CZ-CG 3.73Å; F224-Y268 AromaticContact CZ-CZ 3.99Å; Q250-Y268 CarbonylContact O-C 3.4Å; Q250-Y268 WeakPolarHBondContact O-CA 3.46Å; I251-Y268 HydrophobicContact CB-CE1 4.43Å; I251-Y268 HydrophobicContact CD1-CD1 4.28Å; I251-Y268 HydrophobicContact CD1-CE1 3.79Å; I251-Y268 HydrophobicContact CG1-CD1 3.81Å; I251-Y268 HydrophobicContact CG1-CE1 3.78Å; I251-Y268 HydrophobicContact CG2-CD1 4.31Å; I251-Y268 HydrophobicContact CG2-CE1 3.92Å; P266-Y268 HydrophobicContact CB-CE2 4.02Å; P266-Y268 HydrophobicContact CG-CE2 3.9Å
269	S	95.6	Very high	83.8	Confident	40 Å²	40	102.7 Å²	102.7	28%	0.28	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	148.6	168.4	50.6	0	0	0	0	110.3	Q250	Q250-S269 WeakPolarHBondContact CB-O 3.31Å; Q250-S269 WeakPolarHBondContact CB-OG 3.24Å; Q250-S269 PolarHBondContact N-O 3.25Å; Q250-S269 PolarHBondContact O-N 3.47Å; Q250-S269 PolarHBondContact OE1-OG 3.45Å
270	F	96	Very high	82.3	Confident	11 Å²	11	100.9 Å²	100.9	5%	0.048	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.5	-177.3	-52.3	-79.3	0	0	0	110.1	F224 M229 E232 A233 G248 I249	F224-F270 HydrophobicContact CD1-CE2 4.47Å; F224-F270 AromaticContact CD1-CZ 3.69Å; F224-F270 HydrophobicContact CD1-CZ 3.69Å; F224-F270 AromaticContact CE1-CZ 3.85Å; F224-F270 HydrophobicContact CE1-CZ 3.85Å; F224-F270 HydrophobicContact CG-CZ 4.38Å; M229-F270 HydrophobicContact CB-CD1 3.96Å; M229-F270 HydrophobicContact CB-CE1 4.14Å; M229-F270 HydrophobicContact CB-CG 4.18Å; M229-F270 HydrophobicContact CE-CD1 3.93Å; M229-F270 HydrophobicContact CE-CE1 3.64Å; M229-F270 HydrophobicContact CG-CD1 4Å; M229-F270 HydrophobicContact CG-CE1 3.65Å; M229-F270 HydrophobicContact CG-CE2 4.32Å; M229-F270 HydrophobicContact CG-CG 4.48Å; M229-F270 HydrophobicContact CG-CZ 3.83Å; M229-F270 WeakPolarHBondContact O-CB 3.38Å; M229-F270 HydrophobicContact SD-CE1 4.29Å; E232-F270 HydrophobicContact CB-CD2 3.94Å; E232-F270 VanDerWaalsContact CD-CD2 3.47Å; E232-F270 HydrophobicContact CG-CD2 3.96Å; E232-F270 WeakPolarHBondContact OE2-CD2 3.27Å; E232-F270 VanDerWaalsContact OE2-CE2 3.31Å; E232-F270 WeakPolarHBondContact OE2-CE2 3.26Å; A233-F270 HydrophobicContact CB-CB 4.16Å; G248-F270 WeakPolarHBondContact O-CA 3.19Å; I249-F270 HydrophobicContact CB-CD1 4.33Å; I249-F270 HydrophobicContact CB-CE1 4.31Å; I249-F270 HydrophobicContact CG1-CD1 3.95Å; I249-F270 HydrophobicContact CG1-CE1 4.01Å; I249-F270 HydrophobicContact CG2-CD1 4.21Å; I249-F270 HydrophobicContact CG2-CE1 3.76Å
271	R	95.1	Very high	80.8	Confident	154 Å²	154	98.4 Å²	98.4	58%	0.581	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.4	146.9	177.5	-67.9	-169.6	176.8	-176.6	-1.3	110.1	G248	G248-R271 WeakPolarHBondContact CA-O 3.49Å; G248-R271 PolarHBondContact N-O 2.75Å; G248-R271 PolarHBondContact O-N 2.83Å
272	R	92.8	Very high	79.5	Confident	67 Å²	67	98.7 Å²	98.7	25%	0.253	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	135.3	166.9	-168.9	176.4	-177.5	172.2	-2.9	109.9	E235 M240 I247 D274	E235-R272 VanDerWaalsContact CD-NH1 3.35Å; E235-R272 HydrophobicContact CG-CB 4.4Å; E235-R272 WeakPolarHBondContact OE1-CD 3.43Å; E235-R272 IonicContact OE1-CZ 3.28Å; E235-R272 IonicContact OE1-NE 2.71Å; E235-R272 IonicContact OE1-NH1 3.64Å; E235-R272 PolarHBondContact OE1-NH1 3.35Å; E235-R272 IonicContact OE2-NH1 3.69Å; E235-R272 PolarHBondContact OE2-NH1 2.03Å; M240-R272 HydrophobicContact CE-CG 4.44Å; I247-R272 HydrophobicContact CD1-CB 4.29Å; I247-R272 HydrophobicContact CD1-CG 4.45Å; R272-D274 WeakPolarHBondContact CG-OD1 3.46Å; R272-D274 IonicContact CZ-OD2 2.99Å; R272-D274 VanDerWaalsContact NE-CG 3.27Å; R272-D274 IonicContact NE-OD1 2.77Å; R272-D274 PolarHBondContact NE-OD1 3.34Å; R272-D274 IonicContact NE-OD2 3.4Å; R272-D274 PolarHBondContact NE-OD2 3.07Å; R272-D274 IonicContact NH2-OD2 2.96Å; R272-D274 PolarHBondContact NH2-OD2 3.37Å
273	L	90.7	Very high	78.2	Confident	81 Å²	81	102.8 Å²	102.8	42%	0.424	47%	0.473	S	S	.	.			trans	-105	-29.8	-179.3	-66.6	-179.1	0	0	0	112.7	V246 D313 M315	V246-L273 HydrophobicContact CB-CB 4.26Å; V246-L273 HydrophobicContact CG1-CB 4.01Å; V246-L273 HydrophobicContact CG1-CD1 4.11Å; V246-L273 PolarHBondContact O-N 3.38Å; L273-D313 HydrophobicContact CD1-CB 4.1Å; L273-M315 HydrophobicContact CD1-CE 3.97Å; L273-M315 HydrophobicContact CD2-CE 4.12Å; L273-M315 HydrophobicContact CG-CE 4.5Å
274	D	84.3	Confident	77.1	Confident	37 Å²	37	98.3 Å²	98.3	20%	0.198	47%	0.465	C	S	.	.	S	Bend	trans	-74.9	143.6	172.4	61.9	-55.9	0	0	0	110.8	V246 R272 R276	V246-D274 HydrophobicContact CB-CB 4.3Å; V246-D274 HydrophobicContact CG2-CB 4.37Å; V246-D274 PolarHBondContact N-OD1 3.48Å; V246-D274 VanDerWaalsContact O-OD1 3.05Å; R272-D274 WeakPolarHBondContact CG-OD1 3.46Å; R272-D274 IonicContact CZ-OD2 2.99Å; R272-D274 VanDerWaalsContact NE-CG 3.27Å; R272-D274 IonicContact NE-OD1 2.77Å; R272-D274 PolarHBondContact NE-OD1 3.34Å; R272-D274 IonicContact NE-OD2 3.4Å; R272-D274 PolarHBondContact NE-OD2 3.07Å; R272-D274 IonicContact NH2-OD2 2.96Å; R272-D274 PolarHBondContact NH2-OD2 3.37Å; D274-R276 PolarHBondContact O-N 2.89Å
275	E	74.8	Confident	76.2	Confident	141 Å²	141	99.4 Å²	99.4	66%	0.659	48%	0.478	S	S	*	.			trans	-69.6	124.9	179.7	-167.5	162.4	-150.7	0	0	109.9	E277 S278	E275-E277 PolarHBondContact O-N 3.25Å; E275-S278 VanDerWaalsContact CD-OG 3.32Å; E275-S278 WeakPolarHBondContact OE2-CB 3.29Å; E275-S278 PolarHBondContact OE2-OG 3.47Å
276	R	69.6	Low	75.8	Confident	173 Å²	173	99 Å²	99	65%	0.653	48%	0.475	S	S	*	.	S	Bend	trans	-62.8	-31	-178.5	-177.2	174.6	177.9	174.3	1.8	112.2	D274	D274-R276 PolarHBondContact O-N 2.89Å
277	E	65	Low	75.5	Confident	170 Å²	170	101.5 Å²	101.5	79%	0.794	49%	0.489	S	S	*	.			trans	-156.4	62.7	-158.6	-146	152.1	-144.2	0	0	112.3	E275	E275-E277 PolarHBondContact O-N 3.25Å
278	S	44.4	Very low	75.2	Confident	67 Å²	67	97.1 Å²	97.1	47%	0.469	47%	0.474	S	S	.	.	S	Bend	trans	-117.2	107.3	159.9	50.2	0	0	0	0	109.1	E275	E275-S278 VanDerWaalsContact CD-OG 3.32Å; E275-S278 WeakPolarHBondContact OE2-CB 3.29Å; E275-S278 PolarHBondContact OE2-OG 3.47Å
279	N	49.3	Very low	74.9	Confident	131 Å²	131	102.3 Å²	102.3	70%	0.701	49%	0.494	S	S	*	.			trans	33.5	102	171.8	-66.2	-36.3	0	0	0	115.1	T281 L282	N279-T281 PolarHBondContact O-N 3.44Å; N279-L282 PolarHBondContact O-N 3.08Å
280	K	52.3	Low	74.7	Confident	207 Å²	207	103.4 Å²	103.4	90%	0.9	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.3	-6.2	172.8	-74.5	-179.4	176.6	175.1	0	116.4
281	T	52.6	Low	74.5	Confident	120 Å²	120	104.3 Å²	104.3	74%	0.736	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-20.3	-177.9	48.9	0	0	0	0	114.7	N279	N279-T281 PolarHBondContact O-N 3.44Å
282	L	54.2	Low	74.2	Confident	137 Å²	137	101.1 Å²	101.1	72%	0.717	49%	0.493	S	S	*	.	S	Bend	trans	-122.1	78.9	-175	-136.4	78.7	0	0	0	112.2	N279	N279-L282 PolarHBondContact O-N 3.08Å
283	Y	59.9	Low	74.1	Confident	204 Å²	204	103.8 Å²	103.8	80%	0.8	50%	0.504	S	S	*	.			trans	59.1	77.5	171	-52.1	-81.9	0	0	0	116.4
284	P	68.3	Low	74.1	Confident	71 Å²	71	104.2 Å²	104.2	46%	0.461	51%	0.507	S	S	.	.			trans	-68.9	133.3	171.7	29.4	-33.6	0	0	0	111.6
285	G	75.4	Confident	74.5	Confident	32 Å²	32	107.7 Å²	107.7	33%	0.33	53%	0.53	S	S	.	.	S	Bend	trans	79	-172.4	172.2	0	0	0	0	0	115.4	E243	E243-G285 CarbonylContact O-C 3.58Å; E243-G285 WeakPolarHBondContact O-CA 3.28Å
286	L	86.5	Confident	75.1	Confident	49 Å²	49	103.7 Å²	103.7	26%	0.257	52%	0.515	S	S	.	.			trans	-118.8	116.4	-178	-178.8	70.2	0	0	0	109.9	F96 E243 V246 G309 R311	F96-L286 HydrophobicContact CD2-CD2 4.13Å; F96-L286 HydrophobicContact CE2-CD2 4.01Å; E243-L286 PolarHBondContact O-N 3.09Å; V246-L286 HydrophobicContact CG2-CD2 4.37Å; L286-G309 PolarHBondContact O-N 3.45Å; L286-R311 HydrophobicContact CD2-CB 3.35Å; L286-R311 HydrophobicContact CD2-CG 4.46Å
287	N	88.2	Confident	76	Confident	61 Å²	61	103.2 Å²	103.2	33%	0.326	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	153.5	175.9	66.8	78.2	0	0	0	112.4	A307 F308	N287-A307 WeakPolarHBondContact CA-O 3.34Å; N287-A307 WeakPolarHBondContact CB-O 3.16Å; N287-F308 HydrophobicContact CB-CD1 3.5Å; N287-F308 VanDerWaalsContact CB-CD1 3.5Å; N287-F308 HydrophobicContact CB-CE1 3.66Å; N287-F308 HydrophobicContact CB-CG 4.13Å; N287-F308 HydrophobicContact CB-CZ 4.42Å
288	F	88.8	Confident	77	Confident	72 Å²	72	98.6 Å²	98.6	32%	0.316	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	161.3	169.5	64.8	-91.4	0	0	0	110.6	F96 F290 A307	F96-F288 AromaticContact CD1-CE1 3.67Å; F96-F288 HydrophobicContact CD1-CE1 3.67Å; F96-F288 AromaticContact CD1-CZ 3.93Å; F96-F288 HydrophobicContact CD1-CZ 3.93Å; F96-F288 HydrophobicContact CD2-CE1 4.11Å; F96-F288 HydrophobicContact CE1-CD1 4.46Å; F96-F288 AromaticContact CE1-CE1 3.32Å; F96-F288 HydrophobicContact CE1-CE1 3.32Å; F96-F288 AromaticContact CE1-CZ 3.67Å; F96-F288 HydrophobicContact CE1-CZ 3.67Å; F96-F288 HydrophobicContact CE2-CD1 4.38Å; F96-F288 AromaticContact CE2-CE1 3.8Å; F96-F288 HydrophobicContact CE2-CE1 3.8Å; F96-F288 HydrophobicContact CG-CE1 4.04Å; F96-F288 HydrophobicContact CZ-CD1 4.16Å; F96-F288 AromaticContact CZ-CE1 3.38Å; F96-F288 HydrophobicContact CZ-CE1 3.38Å; F96-F288 HydrophobicContact CZ-CZ 4.18Å; F288-F290 HydrophobicContact CD2-CD1 4.06Å; F288-F290 AromaticContact CE2-CD1 3.57Å; F288-F290 HydrophobicContact CE2-CD1 3.57Å; F288-F290 HydrophobicContact CE2-CE1 4.12Å; F288-F290 HydrophobicContact CE2-CG 4.47Å; F288-A307 HydrophobicContact CE1-CB 4.42Å; F288-A307 HydrophobicContact CE2-CB 4.39Å; F288-A307 HydrophobicContact CZ-CB 4.2Å; F288-A307 PolarHBondContact N-O 3.42Å; F288-A307 PolarHBondContact O-N 3.27Å
289	R	89.1	Confident	79.1	Confident	123 Å²	123	98.8 Å²	98.8	46%	0.464	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	138.5	178.2	-66	-177.8	178.2	93.6	-8.8	110.5	E164 L304 Y305 K306	E164-R289 IonicContact OE1-NH2 3.8Å; E164-R289 IonicContact OE2-CZ 3.89Å; E164-R289 IonicContact OE2-NE 3.59Å; E164-R289 PolarHBondContact OE2-NE 3.21Å; E164-R289 IonicContact OE2-NH2 2.77Å; E164-R289 PolarHBondContact OE2-NH2 2.91Å; E164-R289 VanDerWaalsContact OE2-NH2 3.1Å; R289-L304 HydrophobicContact CB-CD1 4.25Å; R289-Y305 CarbonylContact C-O 3.56Å; R289-Y305 VanDerWaalsContact CA-O 3.26Å; R289-Y305 WeakPolarHBondContact CA-O 3.31Å; R289-K306 HydrophobicContact CG-CB 4.02Å; R289-K306 HydrophobicContact CG-CG 3.99Å
290	F	90.9	Very high	81.2	Confident	64 Å²	64	97.1 Å²	97.1	28%	0.281	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	156.4	169.9	68	-86.3	0	0	0	109.8	F288 Y305 A307	F288-F290 HydrophobicContact CD2-CD1 4.06Å; F288-F290 AromaticContact CE2-CD1 3.57Å; F288-F290 HydrophobicContact CE2-CD1 3.57Å; F288-F290 HydrophobicContact CE2-CE1 4.12Å; F288-F290 HydrophobicContact CE2-CG 4.47Å; F290-Y305 HydrophobicContact CD2-CD2 4.07Å; F290-Y305 HydrophobicContact CD2-CG 4.39Å; F290-Y305 HydrophobicContact CE1-CG 4.31Å; F290-Y305 AromaticContact CE2-CD2 3.6Å; F290-Y305 HydrophobicContact CE2-CD2 3.6Å; F290-Y305 HydrophobicContact CE2-CE2 4.38Å; F290-Y305 AromaticContact CE2-CG 3.73Å; F290-Y305 HydrophobicContact CE2-CG 3.73Å; F290-Y305 VanDerWaalsContact CZ-CB 3.44Å; F290-Y305 HydrophobicContact CZ-CD1 4.31Å; F290-Y305 HydrophobicContact CZ-CD2 4.08Å; F290-Y305 AromaticContact CZ-CG 3.7Å; F290-Y305 HydrophobicContact CZ-CG 3.7Å; F290-Y305 PolarHBondContact N-O 3.48Å; F290-Y305 PolarHBondContact O-N 3.02Å; F290-A307 HydrophobicContact CE1-CB 4.02Å
291	A	91.7	Very high	83.1	Confident	29 Å²	29	88.2 Å²	88.2	24%	0.24	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	144.1	-179.4	0	0	0	0	0	111.1	Y293 R302 T303 L304	A291-Y293 HydrophobicContact CB-CD2 4.47Å; A291-Y293 HydrophobicContact CB-CE2 3.9Å; A291-R302 HydrophobicContact CB-CB 4.39Å; A291-T303 CarbonylContact C-O 3.52Å; A291-T303 VanDerWaalsContact CA-O 3.3Å; A291-T303 WeakPolarHBondContact CA-O 3.33Å; A291-L304 HydrophobicContact CB-CD1 4.46Å
292	K	89.9	Confident	85	Confident	88 Å²	88	84.6 Å²	84.6	38%	0.383	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.3	166.1	-65.9	-173.7	179.1	-178.9	0	107.8	D84 R302 T303 Y305	D84-K292 IonicContact OD1-NZ 2.77Å; D84-K292 PolarHBondContact OD1-NZ 3.17Å; K292-R302 CarbonylContact O-C 3.58Å; K292-R302 WeakPolarHBondContact O-CA 3.22Å; K292-T303 PolarHBondContact N-O 2.98Å; K292-T303 PolarHBondContact O-N 3.39Å; K292-Y305 HydrophobicContact CB-CE2 4.09Å; K292-Y305 HydrophobicContact CD-CE2 3.86Å; K292-Y305 HydrophobicContact CG-CD2 4.34Å; K292-Y305 HydrophobicContact CG-CE2 3.79Å
293	Y	90.8	Very high	86.8	Confident	122 Å²	122	78.7 Å²	78.7	48%	0.478	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	133.3	-177.8	-66.6	-95.6	0	0	0	110.2	W160 A291 E300 R302	W160-Y293 HydrophobicContact CH2-CD1 4.3Å; W160-Y293 AromaticContact CH2-CE1 3.91Å; W160-Y293 HydrophobicContact CH2-CE1 3.91Å; W160-Y293 AromaticContact CZ2-CE1 3.89Å; W160-Y293 HydrophobicContact CZ2-CE1 3.89Å; A291-Y293 HydrophobicContact CB-CD2 4.47Å; A291-Y293 HydrophobicContact CB-CE2 3.9Å; Y293-E300 HydrophobicContact CD1-CG 4.42Å; Y293-R302 HydrophobicContact CD1-CB 3.79Å; Y293-R302 HydrophobicContact CE1-CB 3.99Å; Y293-R302 HydrophobicContact CG-CB 4.27Å
294	N	90.8	Very high	88.3	Confident	90 Å²	90	69.8 Å²	69.8	48%	0.481	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	145	179.3	-66.8	-16.6	0	0	0	109	E301	N294-E301 PolarHBondContact N-O 3.31Å; N294-E301 CarbonylContact O-C 3.47Å; N294-E301 WeakPolarHBondContact O-CA 3.38Å; N294-E301 PolarHBondContact O-N 2.95Å
295	T	91.5	Very high	89.3	Confident	110 Å²	110	67.8 Å²	67.8	68%	0.675	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.2	173.3	-48	0	0	0	0	109.4
296	V	88.8	Confident	90	Very high	57 Å²	57	67 Å²	67	35%	0.345	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	123.6	179	-175.7	0	0	0	0	108.3	G298 V299 E301	V296-G298 VanDerWaalsContact C-N 3.25Å; V296-G298 PolarHBondContact O-N 3.44Å; V296-V299 PolarHBondContact N-O 3.4Å; V296-V299 PolarHBondContact O-N 3.23Å; V296-E301 HydrophobicContact CB-CG 4.43Å
297	N	87.1	Confident	90.2	Very high	163 Å²	163	64.6 Å²	64.6	87%	0.872	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	38	-178.9	-58.5	-29.7	0	0	0	114.1	V299	N297-V299 PolarHBondContact O-N 3.35Å
298	G	86.6	Confident	90.4	Very high	73 Å²	73	62.1 Å²	62.1	75%	0.753	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	-1.4	-179.5	0	0	0	0	0	115.2	V296	V296-G298 VanDerWaalsContact C-N 3.25Å; V296-G298 PolarHBondContact O-N 3.44Å
299	V	88.6	Confident	90.5	Very high	71 Å²	71	58.7 Å²	58.7	43%	0.43	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	134.8	174.6	-177.8	0	0	0	0	109.2	K108 V296 N297 E301	K108-V299 HydrophobicContact CD-CG1 4.22Å; K108-V299 HydrophobicContact CG-CG1 4.37Å; V296-V299 PolarHBondContact N-O 3.4Å; V296-V299 PolarHBondContact O-N 3.23Å; N297-V299 PolarHBondContact O-N 3.35Å; V299-E301 PolarHBondContact O-N 3.19Å
300	E	92.2	Very high	90.7	Very high	97 Å²	97	52.8 Å²	52.8	45%	0.453	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	121.2	173.4	-169.9	-179.5	-149.4	0	0	110.1	W160 Y293	W160-E300 HydrophobicContact CH2-CG 4.35Å; Y293-E300 HydrophobicContact CD1-CG 4.42Å
301	E	92.9	Very high	90.8	Very high	20 Å²	20	53.7 Å²	53.7	9%	0.093	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	151.9	173.6	-59.9	-170	-176.2	0	0	109.7	Q107 K108 N294 V296 V299	Q107-E301 CarbonylContact O-C 3.5Å; Q107-E301 VanDerWaalsContact O-CA 3.3Å; Q107-E301 WeakPolarHBondContact O-CA 3.24Å; K108-E301 HydrophobicContact CD-CG 4.4Å; K108-E301 VanDerWaalsContact CE-CG 3.45Å; K108-E301 WeakPolarHBondContact CE-OE1 3.37Å; K108-E301 HydrophobicContact CG-CG 3.92Å; K108-E301 IonicContact NZ-OE1 3.03Å; K108-E301 PolarHBondContact NZ-OE1 3.07Å; N294-E301 PolarHBondContact N-O 3.31Å; N294-E301 CarbonylContact O-C 3.47Å; N294-E301 WeakPolarHBondContact O-CA 3.38Å; N294-E301 PolarHBondContact O-N 2.95Å; V296-E301 HydrophobicContact CB-CG 4.43Å; V299-E301 PolarHBondContact O-N 3.19Å
302	R	93.3	Very high	91	Very high	43 Å²	43	52.3 Å²	52.3	16%	0.162	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.8	168.4	76.2	-179.1	-167.3	-179.4	-1	111.7	Q107 W160 A291 K292 Y293	Q107-R302 HydrophobicContact CB-CG 3.77Å; Q107-R302 WeakPolarHBondContact CB-O 3.33Å; Q107-R302 PolarHBondContact N-O 3.38Å; Q107-R302 PolarHBondContact O-N 3.29Å; Q107-R302 VanDerWaalsContact OE1-NH2 3.14Å; W160-R302 VanDerWaalsContact CB-NH2 3.25Å; W160-R302 VanDerWaalsContact CD1-NH1 3.33Å; W160-R302 VanDerWaalsContact CD1-NH2 3.3Å; W160-R302 VanDerWaalsContact CD2-CD 3.49Å; W160-R302 HydrophobicContact CD2-CG 4.02Å; W160-R302 VanDerWaalsContact CD2-NE 3.31Å; W160-R302 HydrophobicContact CE3-CB 4.44Å; W160-R302 HydrophobicContact CE3-CG 3.57Å; W160-R302 VanDerWaalsContact CG-NE 3.28Å; W160-R302 VanDerWaalsContact CG-NH2 3.25Å; W160-R302 HydrophobicContact CH2-CG 4.34Å; W160-R302 HydrophobicContact CZ3-CB 4.13Å; W160-R302 HydrophobicContact CZ3-CG 3.75Å; A291-R302 HydrophobicContact CB-CB 4.39Å; K292-R302 CarbonylContact O-C 3.58Å; K292-R302 WeakPolarHBondContact O-CA 3.22Å; Y293-R302 HydrophobicContact CD1-CB 3.79Å; Y293-R302 HydrophobicContact CE1-CB 3.99Å; Y293-R302 HydrophobicContact CG-CB 4.27Å
303	T	90.8	Very high	91.2	Very high	13 Å²	13	49.9 Å²	49.9	8%	0.08	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	117.1	164.6	-58.1	0	0	0	0	108.3	V103 T104 K105 A291 K292 Y305	V103-T303 HydrophobicContact CG1-CG2 3.59Å; T104-T303 WeakPolarHBondContact O-CA 3.3Å; K105-T303 HydrophobicContact CG-CG2 3.96Å; A291-T303 CarbonylContact C-O 3.52Å; A291-T303 VanDerWaalsContact CA-O 3.3Å; A291-T303 WeakPolarHBondContact CA-O 3.33Å; K292-T303 PolarHBondContact N-O 2.98Å; K292-T303 PolarHBondContact O-N 3.39Å; T303-Y305 HydrophobicContact CG2-CD2 4.23Å; T303-Y305 HydrophobicContact CG2-CE1 4.31Å; T303-Y305 HydrophobicContact CG2-CE2 3.51Å; T303-Y305 WeakPolarHBondContact O-CD2 3.35Å
304	L	91.6	Very high	91.4	Very high	18 Å²	18	44.5 Å²	44.5	9%	0.094	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	129.9	176.9	-178.1	69.7	0	0	0	109.5	V103 T104 R289 A291	V103-L304 WeakPolarHBondContact CA-O 3.35Å; T104-L304 PolarHBondContact N-O 3Å; T104-L304 PolarHBondContact O-N 2.97Å; R289-L304 HydrophobicContact CB-CD1 4.25Å; A291-L304 HydrophobicContact CB-CD1 4.46Å
305	Y	89.4	Confident	91.6	Very high	29 Å²	29	43.2 Å²	43.2	11%	0.114	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	123	173.5	-63.1	-92.8	0	0	0	108.4	W80 V101 V103 R289 F290 K292 T303	W80-Y305 HydrophobicContact CH2-CE1 4.36Å; V101-Y305 HydrophobicContact CG2-CD1 4.02Å; V103-Y305 HydrophobicContact CG1-CD1 4.2Å; V103-Y305 HydrophobicContact CG1-CE1 3.85Å; V103-Y305 HydrophobicContact CG2-CD1 3.77Å; V103-Y305 HydrophobicContact CG2-CE1 3.86Å; R289-Y305 CarbonylContact C-O 3.56Å; R289-Y305 VanDerWaalsContact CA-O 3.26Å; R289-Y305 WeakPolarHBondContact CA-O 3.31Å; F290-Y305 HydrophobicContact CD2-CD2 4.07Å; F290-Y305 HydrophobicContact CD2-CG 4.39Å; F290-Y305 HydrophobicContact CE1-CG 4.31Å; F290-Y305 AromaticContact CE2-CD2 3.6Å; F290-Y305 HydrophobicContact CE2-CD2 3.6Å; F290-Y305 HydrophobicContact CE2-CE2 4.38Å; F290-Y305 AromaticContact CE2-CG 3.73Å; F290-Y305 HydrophobicContact CE2-CG 3.73Å; F290-Y305 VanDerWaalsContact CZ-CB 3.44Å; F290-Y305 HydrophobicContact CZ-CD1 4.31Å; F290-Y305 HydrophobicContact CZ-CD2 4.08Å; F290-Y305 AromaticContact CZ-CG 3.7Å; F290-Y305 HydrophobicContact CZ-CG 3.7Å; F290-Y305 PolarHBondContact N-O 3.48Å; F290-Y305 PolarHBondContact O-N 3.02Å; K292-Y305 HydrophobicContact CB-CE2 4.09Å; K292-Y305 HydrophobicContact CD-CE2 3.86Å; K292-Y305 HydrophobicContact CG-CD2 4.34Å; K292-Y305 HydrophobicContact CG-CE2 3.79Å; T303-Y305 HydrophobicContact CG2-CD2 4.23Å; T303-Y305 HydrophobicContact CG2-CE1 4.31Å; T303-Y305 HydrophobicContact CG2-CE2 3.51Å; T303-Y305 WeakPolarHBondContact O-CD2 3.35Å
306	K	90.9	Very high	91.8	Very high	14 Å²	14	39.1 Å²	39.1	6%	0.061	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	103.3	165.5	-178.5	179.2	-178.3	-170.6	0	107.5	V101 I102 E164 T167 R289 F308	V101-K306 WeakPolarHBondContact CA-O 3.35Å; I102-K306 HydrophobicContact CB-CB 4.29Å; I102-K306 HydrophobicContact CD1-CD 4.45Å; I102-K306 PolarHBondContact N-O 2.83Å; I102-K306 PolarHBondContact O-N 3.44Å; E164-K306 WeakPolarHBondContact OE1-CD 3.35Å; E164-K306 WeakPolarHBondContact OE1-CE 3.47Å; E164-K306 IonicContact OE1-NZ 3.67Å; E164-K306 PolarHBondContact OE1-NZ 2.92Å; T167-K306 PolarHBondContact O-NZ 3.16Å; R289-K306 HydrophobicContact CG-CB 4.02Å; R289-K306 HydrophobicContact CG-CG 3.99Å; K306-F308 HydrophobicContact CD-CE2 4.22Å; K306-F308 HydrophobicContact CD-CZ 4.03Å; K306-F308 HydrophobicContact CG-CE2 3.99Å; K306-F308 HydrophobicContact CG-CZ 4.12Å
307	A	90.9	Very high	92.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	134.6	-177.1	0	0	0	0	0	110.4	M98 N287 F288 F290	M98-A307 HydrophobicContact CG-CB 3.98Å; M98-A307 HydrophobicContact SD-CB 3.63Å; N287-A307 WeakPolarHBondContact CA-O 3.34Å; N287-A307 WeakPolarHBondContact CB-O 3.16Å; F288-A307 HydrophobicContact CE1-CB 4.42Å; F288-A307 HydrophobicContact CE2-CB 4.39Å; F288-A307 HydrophobicContact CZ-CB 4.2Å; F288-A307 PolarHBondContact N-O 3.42Å; F288-A307 PolarHBondContact O-N 3.27Å; F290-A307 HydrophobicContact CE1-CB 4.02Å
308	F	91.7	Very high	92.5	Very high	8 Å²	8	33.4 Å²	33.4	4%	0.035	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	141.4	166.4	-53.6	-100.2	0	0	0	107.5	T99 N100 I102 P169 N287 K306	T99-F308 PolarHBondContact N-O 2.81Å; T99-F308 PolarHBondContact OG1-O 3.45Å; N100-F308 HydrophobicContact CB-CB 3.91Å; N100-F308 HydrophobicContact CB-CD2 4.23Å; N100-F308 HydrophobicContact CB-CG 4.42Å; N100-F308 PolarHBondContact N-O 3.33Å; N100-F308 PolarHBondContact O-N 2.9Å; I102-F308 HydrophobicContact CD1-CE2 3.9Å; I102-F308 HydrophobicContact CD1-CZ 4.28Å; I102-F308 HydrophobicContact CG1-CE2 4.07Å; P169-F308 HydrophobicContact CB-CD1 4.44Å; P169-F308 HydrophobicContact CB-CD2 4.26Å; P169-F308 HydrophobicContact CB-CE1 4.21Å; P169-F308 HydrophobicContact CB-CE2 4.01Å; P169-F308 HydrophobicContact CB-CG 4.48Å; P169-F308 HydrophobicContact CB-CZ 3.97Å; P169-F308 HydrophobicContact CG-CE1 4.38Å; P169-F308 HydrophobicContact CG-CZ 4.46Å; N287-F308 HydrophobicContact CB-CD1 3.5Å; N287-F308 VanDerWaalsContact CB-CD1 3.5Å; N287-F308 HydrophobicContact CB-CE1 3.66Å; N287-F308 HydrophobicContact CB-CG 4.13Å; N287-F308 HydrophobicContact CB-CZ 4.42Å; K306-F308 HydrophobicContact CD-CE2 4.22Å; K306-F308 HydrophobicContact CD-CZ 4.03Å; K306-F308 HydrophobicContact CG-CE2 3.99Å; K306-F308 HydrophobicContact CG-CZ 4.12Å
309	G	92.1	Very high	92.9	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174	178.4	-176.3	0	0	0	0	0	113.8	F96 V97 T99 G244 G245 L286	F96-G309 VanDerWaalsContact CZ-CA 3.42Å; V97-G309 CarbonylContact O-C 3.57Å; V97-G309 WeakPolarHBondContact O-CA 3.4Å; T99-G309 WeakPolarHBondContact OG1-CA 3.4Å; G244-G309 CarbonylContact C-O 3.54Å; G244-G309 WeakPolarHBondContact CA-O 3.39Å; G245-G309 PolarHBondContact N-O 2.94Å; G245-G309 VanDerWaalsContact N-O 3.1Å; L286-G309 PolarHBondContact O-N 3.45Å
310	I	93.2	Very high	93.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	123	-178.2	-53.5	175	0	0	0	107.7	V97 T99 V230 F237 M240 G245 I247 F312	V97-I310 PolarHBondContact N-O 3.42Å; V97-I310 PolarHBondContact O-N 3.41Å; T99-I310 HydrophobicContact CG2-CD1 4.27Å; T99-I310 HydrophobicContact CG2-CG1 4.17Å; V230-I310 HydrophobicContact CG2-CD1 4.29Å; F237-I310 HydrophobicContact CD2-CD1 4.17Å; F237-I310 HydrophobicContact CE2-CD1 3.76Å; F237-I310 HydrophobicContact CZ-CD1 4.23Å; M240-I310 HydrophobicContact CB-CD1 4.25Å; M240-I310 HydrophobicContact CG-CD1 3.87Å; M240-I310 HydrophobicContact CG-CG1 3.95Å; M240-I310 HydrophobicContact SD-CD1 3.82Å; M240-I310 HydrophobicContact SD-CG1 4.11Å; M240-I310 HydrophobicContact SD-CG2 4.17Å; G245-I310 WeakPolarHBondContact O-CA 3.41Å; I247-I310 HydrophobicContact CB-CG2 4.37Å; I247-I310 HydrophobicContact CG1-CG2 3.8Å; I310-F312 HydrophobicContact CB-CE2 3.85Å; I310-F312 HydrophobicContact CB-CZ 4.22Å; I310-F312 HydrophobicContact CG2-CD2 4.1Å; I310-F312 HydrophobicContact CG2-CE1 4.21Å; I310-F312 HydrophobicContact CG2-CE2 3.59Å; I310-F312 HydrophobicContact CG2-CZ 3.65Å
311	R	93.1	Very high	93.4	Very high	82 Å²	82	26.1 Å²	26.1	31%	0.309	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	130.5	169.2	176.7	-179.7	172.8	132.3	12	108.9	D91 S94 F96 G245 V246 I247 L286 D313	D91-R311 IonicContact OD2-CZ 2.78Å; D91-R311 IonicContact OD2-NH1 3.56Å; D91-R311 PolarHBondContact OD2-NH1 3.12Å; D91-R311 IonicContact OD2-NH2 3.61Å; D91-R311 PolarHBondContact OD2-NH2 2.75Å; S94-R311 PolarHBondContact OG-NH2 3.47Å; S94-R311 VanDerWaalsContact OG-NH2 3.1Å; F96-R311 HydrophobicContact CD2-CB 4.34Å; G245-R311 PolarHBondContact O-N 2.89Å; V246-R311 CarbonylContact C-O 3.57Å; V246-R311 WeakPolarHBondContact CA-O 3.45Å; V246-R311 HydrophobicContact CG2-CB 4.49Å; I247-R311 PolarHBondContact N-O 2.92Å; L286-R311 HydrophobicContact CD2-CB 3.35Å; L286-R311 HydrophobicContact CD2-CG 4.46Å; R311-D313 WeakPolarHBondContact CG-OD1 3.36Å; R311-D313 IonicContact CZ-OD1 3.71Å; R311-D313 IonicContact NE-OD1 2.75Å; R311-D313 PolarHBondContact NE-OD1 2.88Å; R311-D313 IonicContact NE-OD2 2.64Å; R311-D313 IonicContact NH2-OD1 3.25Å
312	F	94.2	Very high	93.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	113.1	177.2	-68.9	-90.5	0	0	0	109.7	S94 F95 V97 L226 M229 V230 I247 I249 I310	S94-F312 CarbonylContact C-O 3.55Å; S94-F312 WeakPolarHBondContact CA-O 3.22Å; S94-F312 VanDerWaalsContact CB-O 3.26Å; S94-F312 WeakPolarHBondContact CB-O 3.45Å; F95-F312 HydrophobicContact CD1-CB 3.81Å; F95-F312 HydrophobicContact CD2-CB 4.15Å; F95-F312 AromaticContact CD2-CD2 3.95Å; F95-F312 HydrophobicContact CD2-CD2 3.95Å; F95-F312 HydrophobicContact CD2-CG 4.39Å; F95-F312 HydrophobicContact CE1-CB 3.34Å; F95-F312 HydrophobicContact CE1-CG 4.03Å; F95-F312 HydrophobicContact CE2-CB 3.71Å; F95-F312 AromaticContact CE2-CD2 3.29Å; F95-F312 HydrophobicContact CE2-CD2 3.29Å; F95-F312 HydrophobicContact CE2-CE2 4.03Å; F95-F312 AromaticContact CE2-CG 3.62Å; F95-F312 HydrophobicContact CE2-CG 3.62Å; F95-F312 HydrophobicContact CG-CB 4.2Å; F95-F312 HydrophobicContact CZ-CB 3.27Å; F95-F312 HydrophobicContact CZ-CD1 4.11Å; F95-F312 AromaticContact CZ-CD2 3.64Å; F95-F312 HydrophobicContact CZ-CD2 3.64Å; F95-F312 HydrophobicContact CZ-CE2 4.48Å; F95-F312 AromaticContact CZ-CG 3.41Å; F95-F312 HydrophobicContact CZ-CG 3.41Å; F95-F312 VanDerWaalsContact CZ-CG 3.41Å; F95-F312 PolarHBondContact N-O 2.97Å; F95-F312 PolarHBondContact O-N 2.89Å; V97-F312 HydrophobicContact CG2-CD2 4.43Å; V97-F312 HydrophobicContact CG2-CE2 4.28Å; L226-F312 HydrophobicContact CB-CZ 4.33Å; L226-F312 HydrophobicContact CD1-CE2 4.33Å; L226-F312 HydrophobicContact CD2-CE1 4.38Å; L226-F312 HydrophobicContact CD2-CE2 3.99Å; L226-F312 HydrophobicContact CD2-CZ 3.84Å; L226-F312 HydrophobicContact CG-CZ 4.45Å; M229-F312 HydrophobicContact CB-CE1 4.47Å; M229-F312 HydrophobicContact CE-CD1 3.48Å; M229-F312 VanDerWaalsContact CE-CD1 3.48Å; M229-F312 HydrophobicContact CE-CE1 3.62Å; M229-F312 HydrophobicContact CE-CG 4.45Å; M229-F312 HydrophobicContact SD-CE1 4.35Å; V230-F312 HydrophobicContact CG2-CZ 4.49Å; I247-F312 HydrophobicContact CB-CD1 3.71Å; I247-F312 HydrophobicContact CB-CE1 3.82Å; I247-F312 HydrophobicContact CG1-CE1 4.15Å; I247-F312 HydrophobicContact CG2-CD1 3.79Å; I247-F312 HydrophobicContact CG2-CE1 3.88Å; I247-F312 CarbonylContact O-C 3.53Å; I247-F312 VanDerWaalsContact O-CA 3.25Å; I247-F312 WeakPolarHBondContact O-CA 3.32Å; I249-F312 HydrophobicContact CD1-CB 3.89Å; I249-F312 HydrophobicContact CD1-CD1 4.12Å; I249-F312 HydrophobicContact CD1-CG 4.41Å; I249-F312 HydrophobicContact CG1-CD1 4.36Å; I310-F312 HydrophobicContact CB-CE2 3.85Å; I310-F312 HydrophobicContact CB-CZ 4.22Å; I310-F312 HydrophobicContact CG2-CD2 4.1Å; I310-F312 HydrophobicContact CG2-CE1 4.21Å; I310-F312 HydrophobicContact CG2-CE2 3.59Å; I310-F312 HydrophobicContact CG2-CZ 3.65Å
313	D	94.4	Very high	93.5	Very high	37 Å²	37	32.9 Å²	32.9	20%	0.198	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	121.3	-179.6	-72.8	-17	0	0	0	110.3	S94 I247 G248 I249 L273 R311	S94-D313 WeakPolarHBondContact CB-OD1 3.2Å; I247-D313 PolarHBondContact O-N 3.43Å; G248-D313 CarbonylContact C-O 3.55Å; G248-D313 WeakPolarHBondContact CA-O 3.35Å; I249-D313 PolarHBondContact N-O 2.88Å; L273-D313 HydrophobicContact CD1-CB 4.1Å; R311-D313 WeakPolarHBondContact CG-OD1 3.36Å; R311-D313 IonicContact CZ-OD1 3.71Å; R311-D313 IonicContact NE-OD1 2.75Å; R311-D313 PolarHBondContact NE-OD1 2.88Å; R311-D313 IonicContact NE-OD2 2.64Å; R311-D313 IonicContact NH2-OD1 3.25Å
314	I	95.6	Very high	93.6	Very high	9 Å²	9	33 Å²	33	5%	0.046	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	110.1	-177.1	-58.3	167.6	0	0	0	109.7	V60 T62 N93 F95 I185 I249 I251 V316	V60-I314 HydrophobicContact CG1-CB 4.3Å; V60-I314 HydrophobicContact CG1-CD1 3.58Å; V60-I314 HydrophobicContact CG1-CG2 3.99Å; V60-I314 HydrophobicContact CG2-CG2 4.01Å; T62-I314 HydrophobicContact CG2-CD1 3.21Å; N93-I314 WeakPolarHBondContact O-CB 3.45Å; N93-I314 PolarHBondContact O-N 3.47Å; F95-I314 HydrophobicContact CD1-CD1 4.31Å; F95-I314 HydrophobicContact CE1-CD1 4.19Å; I185-I314 HydrophobicContact CD1-CD1 4.29Å; I185-I314 HydrophobicContact CG1-CD1 4.48Å; I185-I314 HydrophobicContact CG2-CD1 4.21Å; I249-I314 HydrophobicContact CB-CG1 4.08Å; I249-I314 HydrophobicContact CD1-CD1 4.34Å; I249-I314 HydrophobicContact CD1-CG1 3.72Å; I249-I314 HydrophobicContact CG1-CG1 4.44Å; I249-I314 WeakPolarHBondContact O-CA 3.32Å; I251-I314 HydrophobicContact CD1-CG2 3.7Å; I251-I314 HydrophobicContact CG1-CG2 4.24Å; I314-V316 HydrophobicContact CG2-CG2 4.08Å
315	M	95.3	Very high	93.7	Very high	63 Å²	63	38.4 Å²	38.4	31%	0.31	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	113.3	177.1	-63.6	166.3	-78.5	0	0	109.4	G248 I249 Q250 I251 L273	G248-M315 VanDerWaalsContact CA-CE 3.42Å; I249-M315 PolarHBondContact O-N 2.79Å; Q250-M315 CarbonylContact C-O 3.6Å; Q250-M315 WeakPolarHBondContact CA-O 3.31Å; Q250-M315 HydrophobicContact CG-CE 3.74Å; I251-M315 PolarHBondContact N-O 3.25Å; L273-M315 HydrophobicContact CD1-CE 3.97Å; L273-M315 HydrophobicContact CD2-CE 4.12Å; L273-M315 HydrophobicContact CG-CE 4.5Å
316	V	96.2	Very high	93.9	Very high	25 Å²	25	42.6 Å²	42.6	15%	0.152	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	123.5	176.1	-170.8	0	0	0	0	108.4	S58 V60 I189 I251 I314	S58-V316 WeakPolarHBondContact OG-CB 3.46Å; V60-V316 HydrophobicContact CG2-CG2 3.62Å; I189-V316 HydrophobicContact CG2-CG1 4.15Å; I251-V316 HydrophobicContact CB-CG1 4.39Å; I251-V316 HydrophobicContact CB-CG2 4.24Å; I251-V316 HydrophobicContact CD1-CG2 4.22Å; I251-V316 WeakPolarHBondContact O-CA 3.47Å; I314-V316 HydrophobicContact CG2-CG2 4.08Å
317	F	95.5	Very high	94.1	Very high	84 Å²	84	45 Å²	45	37%	0.368	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	153.1	176.8	53.7	-92.1	0	0	0	110.2	Q250 I251 K252 W253	Q250-F317 HydrophobicContact CB-CE1 3.74Å; Q250-F317 HydrophobicContact CB-CZ 4.04Å; Q250-F317 HydrophobicContact CG-CE1 3.93Å; Q250-F317 HydrophobicContact CG-CZ 4.43Å; I251-F317 PolarHBondContact O-N 3.43Å; I251-F317 VanDerWaalsContact O-N 3.11Å; K252-F317 CarbonylContact C-O 3.51Å; K252-F317 VanDerWaalsContact CA-O 3.29Å; K252-F317 WeakPolarHBondContact CA-O 3.02Å; K252-F317 HydrophobicContact CB-CD2 4.3Å; K252-F317 HydrophobicContact CB-CE2 3.77Å; K252-F317 HydrophobicContact CB-CZ 4.26Å; K252-F317 HydrophobicContact CD-CE2 4.06Å; K252-F317 HydrophobicContact CG-CD2 4.13Å; K252-F317 HydrophobicContact CG-CE2 3.8Å; W253-F317 PolarHBondContact N-O 3.11Å
318	G	94.3	Very high	94.2	Very high	16 Å²	16	46.8 Å²	46.8	17%	0.165	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.7	165.3	-172.4	0	0	0	0	0	113.5	V56 W253	V56-G318 VanDerWaalsContact CG1-N 3.33Å; V56-G318 PolarHBondContact N-O 3.38Å; V56-G318 VanDerWaalsContact N-O 3.14Å; W253-G318 CarbonylContact O-C 3.55Å; W253-G318 WeakPolarHBondContact O-CA 3.37Å
319	Q	95.1	Very high	94.3	Very high	87 Å²	87	50.7 Å²	50.7	41%	0.407	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	147.4	175.3	65.1	-174.4	8.5	0	0	109	F53 D54 W253 C255	F53-Q319 HydrophobicContact CD1-CG 4.37Å; D54-Q319 CarbonylContact O-C 3.56Å; D54-Q319 VanDerWaalsContact O-CA 3.27Å; D54-Q319 WeakPolarHBondContact O-CA 3.32Å; W253-Q319 PolarHBondContact O-N 2.93Å; C255-Q319 PolarHBondContact N-O 2.7Å
320	A	95.6	Very high	94.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	137.7	166.3	0	0	0	0	0	109.1	F53 D54 F191 F194 C255 L257	F53-A320 VanDerWaalsContact CA-O 3.24Å; F53-A320 WeakPolarHBondContact CA-O 3.4Å; D54-A320 PolarHBondContact N-O 3.49Å; D54-A320 PolarHBondContact O-N 2.95Å; F191-A320 HydrophobicContact CB-CB 4.35Å; F191-A320 HydrophobicContact CD1-CB 3.53Å; F191-A320 HydrophobicContact CD2-CB 3.61Å; F191-A320 HydrophobicContact CE1-CB 3.55Å; F191-A320 VanDerWaalsContact CE1-N 3.3Å; F191-A320 HydrophobicContact CE2-CB 3.63Å; F191-A320 HydrophobicContact CG-CB 3.55Å; F191-A320 HydrophobicContact CZ-CB 3.6Å; F194-A320 HydrophobicContact CD2-CB 4Å; F194-A320 HydrophobicContact CE2-CB 4.03Å; F194-A320 WeakPolarHBondContact CE2-O 3.39Å; C255-A320 HydrophobicContact CB-CB 4.11Å; C255-A320 CarbonylContact O-C 3.59Å; C255-A320 VanDerWaalsContact O-CA 3.3Å; C255-A320 WeakPolarHBondContact O-CA 3.02Å; L257-A320 HydrophobicContact CD1-CB 3.7Å; L257-A320 HydrophobicContact CG-CB 4.01Å
321	G	95.1	Very high	94.4	Very high	1 Å²	1	57 Å²	57	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	134.7	167.7	0	0	0	0	0	110.3	E52 C255 L257	E52-G321 WeakPolarHBondContact O-CA 3.35Å; C255-G321 PolarHBondContact O-N 2.85Å; L257-G321 WeakPolarHBondContact CB-O 3.28Å; L257-G321 PolarHBondContact N-O 3.17Å
322	K	94.4	Very high	94.4	Very high	94 Å²	94	56.7 Å²	56.7	41%	0.409	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	136.3	172.2	-171.5	-179.8	179.1	-176.5	0	109.5	Q51 E52 F194 L257 S324	Q51-K322 CarbonylContact C-O 3.37Å; Q51-K322 VanDerWaalsContact CA-O 3.31Å; Q51-K322 WeakPolarHBondContact CA-O 3.43Å; E52-K322 PolarHBondContact N-O 3.4Å; E52-K322 PolarHBondContact O-N 3.42Å; F194-K322 HydrophobicContact CB-CD 4.33Å; F194-K322 HydrophobicContact CD1-CB 3.99Å; F194-K322 HydrophobicContact CD1-CD 3.8Å; F194-K322 HydrophobicContact CD2-CB 4.34Å; F194-K322 HydrophobicContact CE1-CB 3.88Å; F194-K322 HydrophobicContact CE1-CD 4.4Å; F194-K322 HydrophobicContact CE2-CB 4.22Å; F194-K322 HydrophobicContact CG-CB 4.24Å; F194-K322 HydrophobicContact CG-CD 4.1Å; F194-K322 HydrophobicContact CZ-CB 4Å; L257-K322 HydrophobicContact CB-CB 4.21Å; L257-K322 HydrophobicContact CB-CG 4.37Å; K322-S324 PolarHBondContact O-N 2.96Å
323	F	94.1	Very high	94.4	Very high	110 Å²	110	58.9 Å²	58.9	48%	0.482	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-48.7	126.5	174.8	176.7	-94.8	0	0	0	112.1	Y50 D258 F325 L328	Y50-F323 AromaticContact CD2-CD2 3.9Å; Y50-F323 HydrophobicContact CD2-CD2 3.9Å; D258-F323 WeakPolarHBondContact OD1-CB 3.45Å; D258-F323 PolarHBondContact OD1-N 3.5Å; F323-F325 HydrophobicContact CE1-CB 4.46Å; F323-L328 HydrophobicContact CE2-CD2 4.24Å; F323-L328 HydrophobicContact CZ-CD2 4.27Å
324	S	94.2	Very high	94.3	Very high	15 Å²	15	60.1 Å²	60.1	11%	0.105	31%	0.311	C	S	.	.			trans	-131.5	120.6	176.5	-178	0	0	0	0	109.7	Y50 E52 K322 I326 Q327 L328	Y50-S324 PolarHBondContact O-N 3.36Å; Y50-S324 VanDerWaalsContact O-N 3.11Å; E52-S324 PolarHBondContact OE2-OG 2.9Å; K322-S324 PolarHBondContact O-N 2.96Å; S324-I326 PolarHBondContact O-N 3.04Å; S324-Q327 PolarHBondContact O-N 3.35Å; S324-L328 PolarHBondContact O-N 3.42Å; S324-L328 VanDerWaalsContact O-N 3.17Å
325	F	92.9	Very high	94.2	Very high	133 Å²	133	60.3 Å²	60.3	58%	0.583	31%	0.313	S	S	*	.	H	α-helix	trans	-62	-32.2	-179.5	-175.9	-108.8	0	0	0	112.2	F323 L328 I329	F323-F325 HydrophobicContact CE1-CB 4.46Å; F325-L328 PolarHBondContact O-N 3.46Å; F325-I329 HydrophobicContact CD1-CD1 3.71Å; F325-I329 HydrophobicContact CD1-CG1 4.5Å; F325-I329 HydrophobicContact CE1-CD1 3.22Å; F325-I329 HydrophobicContact CE1-CG1 4.15Å; F325-I329 HydrophobicContact CE2-CD1 4.49Å; F325-I329 HydrophobicContact CZ-CD1 3.67Å; F325-I329 HydrophobicContact CZ-CG1 4.22Å; F325-I329 PolarHBondContact O-N 3.06Å; F325-I329 VanDerWaalsContact O-N 3.07Å
326	I	93.8	Very high	94	Very high	116 Å²	116	62.3 Å²	62.3	60%	0.595	32%	0.324	S	S	*	.	H	α-helix	trans	-64.7	-47.6	177.7	-61.2	171.7	0	0	0	110.3	S324 L328 I329 I330	S324-I326 PolarHBondContact O-N 3.04Å; I326-L328 VanDerWaalsContact C-N 3.28Å; I326-L328 PolarHBondContact O-N 2.93Å; I326-I329 PolarHBondContact O-N 3.27Å; I326-I330 HydrophobicContact CG2-CD1 3.85Å; I326-I330 HydrophobicContact CG2-CG1 4.5Å; I326-I330 WeakPolarHBondContact O-CG1 3.32Å; I326-I330 PolarHBondContact O-N 3.34Å
327	Q	93.8	Very high	93.8	Very high	66 Å²	66	64.8 Å²	64.8	31%	0.308	34%	0.343	S	S	.	.	H	α-helix	trans	-63.7	-36.1	178.8	-66.6	-63.9	-1.5	0	0	112.1	E52 S324 I330 Y331	E52-Q327 HydrophobicContact CB-CG 4.16Å; S324-Q327 PolarHBondContact O-N 3.35Å; Q327-I330 PolarHBondContact O-N 2.96Å; Q327-Y331 WeakPolarHBondContact O-CB 3.41Å; Q327-Y331 PolarHBondContact O-N 3.48Å
328	L	93.6	Very high	93.7	Very high	36 Å²	36	67.2 Å²	67.2	19%	0.188	35%	0.35	C	S	.	.	H	α-helix	trans	-61.3	-46.9	173.1	-178.7	64.8	0	0	0	112.1	M44 F323 S324 F325 I326 Y331 I332	M44-L328 HydrophobicContact CE-CD1 3.88Å; M44-L328 HydrophobicContact SD-CD1 4.02Å; F323-L328 HydrophobicContact CE2-CD2 4.24Å; F323-L328 HydrophobicContact CZ-CD2 4.27Å; S324-L328 PolarHBondContact O-N 3.42Å; S324-L328 VanDerWaalsContact O-N 3.17Å; F325-L328 PolarHBondContact O-N 3.46Å; I326-L328 VanDerWaalsContact C-N 3.28Å; I326-L328 PolarHBondContact O-N 2.93Å; L328-Y331 PolarHBondContact O-N 2.96Å; L328-I332 HydrophobicContact CD1-CD1 4.08Å; L328-I332 HydrophobicContact CD1-CG1 4.42Å; L328-I332 HydrophobicContact CG-CD1 3.92Å; L328-I332 VanDerWaalsContact O-CG1 3.31Å; L328-I332 WeakPolarHBondContact O-CG1 3.2Å; L328-I332 PolarHBondContact O-N 2.75Å
329	I	94.8	Very high	93.6	Very high	90 Å²	90	69.7 Å²	69.7	46%	0.462	36%	0.355	S	S	.	.	H	α-helix	trans	-62.6	-44.5	177.5	-70.7	170.6	0	0	0	111	F325 I326 Y331 I332 G333	F325-I329 HydrophobicContact CD1-CD1 3.71Å; F325-I329 HydrophobicContact CD1-CG1 4.5Å; F325-I329 HydrophobicContact CE1-CD1 3.22Å; F325-I329 HydrophobicContact CE1-CG1 4.15Å; F325-I329 HydrophobicContact CE2-CD1 4.49Å; F325-I329 HydrophobicContact CZ-CD1 3.67Å; F325-I329 HydrophobicContact CZ-CG1 4.22Å; F325-I329 PolarHBondContact O-N 3.06Å; F325-I329 VanDerWaalsContact O-N 3.07Å; I326-I329 PolarHBondContact O-N 3.27Å; I329-Y331 VanDerWaalsContact C-N 3.27Å; I329-Y331 PolarHBondContact O-N 3.22Å; I329-I332 PolarHBondContact O-N 3.31Å; I329-G333 PolarHBondContact O-N 3.2Å
330	I	93.4	Very high	93.5	Very high	97 Å²	97	68 Å²	68	50%	0.497	36%	0.356	S	S	.	.	H	α-helix	trans	-59.9	-42	178.3	-68	169	0	0	0	110.4	I326 Q327 G333 S334	I326-I330 HydrophobicContact CG2-CD1 3.85Å; I326-I330 HydrophobicContact CG2-CG1 4.5Å; I326-I330 WeakPolarHBondContact O-CG1 3.32Å; I326-I330 PolarHBondContact O-N 3.34Å; Q327-I330 PolarHBondContact O-N 2.96Å; I330-G333 PolarHBondContact O-N 2.95Å; I330-S334 WeakPolarHBondContact O-CB 3.31Å; I330-S334 PolarHBondContact O-N 3.32Å; I330-S334 PolarHBondContact O-OG 2.8Å
331	Y	94.3	Very high	93.3	Very high	35 Å²	35	72.6 Å²	72.6	14%	0.137	38%	0.38	C	S	.	.	H	α-helix	trans	-66.7	-43	177	-173.5	-93	0	0	0	112.5	I40 M44 K49 Q327 L328 I329 S334 T335	I40-Y331 HydrophobicContact CG2-CE1 3.62Å; I40-Y331 PolarHBondContact O-OH 2.78Å; I40-Y331 VanDerWaalsContact O-OH 3.07Å; M44-Y331 HydrophobicContact CB-CD1 4.32Å; M44-Y331 HydrophobicContact CB-CE1 3.54Å; M44-Y331 HydrophobicContact CE-CD1 3.44Å; M44-Y331 VanDerWaalsContact CE-CD1 3.44Å; M44-Y331 HydrophobicContact CE-CE1 3.54Å; M44-Y331 HydrophobicContact CG-CD1 3.93Å; M44-Y331 HydrophobicContact CG-CE1 3.68Å; M44-Y331 PolarHBondContact N-OH 2.85Å; M44-Y331 HydrophobicContact SD-CD1 4.49Å; M44-Y331 HydrophobicContact SD-CE1 4.47Å; K49-Y331 HydrophobicContact CB-CD2 3.52Å; K49-Y331 HydrophobicContact CB-CE2 3.82Å; K49-Y331 HydrophobicContact CB-CG 4.18Å; K49-Y331 HydrophobicContact CG-CD2 4.03Å; K49-Y331 HydrophobicContact CG-CE2 3.95Å; Q327-Y331 WeakPolarHBondContact O-CB 3.41Å; Q327-Y331 PolarHBondContact O-N 3.48Å; L328-Y331 PolarHBondContact O-N 2.96Å; I329-Y331 VanDerWaalsContact C-N 3.27Å; I329-Y331 PolarHBondContact O-N 3.22Å; Y331-S334 WeakPolarHBondContact CA-OG 3.46Å; Y331-S334 PolarHBondContact O-OG 3.03Å; Y331-T335 HydrophobicContact CD1-CG2 4.16Å; Y331-T335 HydrophobicContact CD2-CG2 4.48Å; Y331-T335 HydrophobicContact CE1-CG2 3.8Å; Y331-T335 HydrophobicContact CE2-CG2 4.12Å; Y331-T335 WeakPolarHBondContact O-CB 3.36Å; Y331-T335 WeakPolarHBondContact O-CG2 3.42Å; Y331-T335 PolarHBondContact O-N 3.25Å; Y331-T335 PolarHBondContact O-OG1 2.98Å
332	I	92.9	Very high	93.1	Very high	77 Å²	77	72.6 Å²	72.6	40%	0.395	38%	0.38	S	S	.	.	H	α-helix	trans	-63.2	-45	174.8	-67.3	167.4	0	0	0	110.6	L328 I329 S334 T335 L336	L328-I332 HydrophobicContact CD1-CD1 4.08Å; L328-I332 HydrophobicContact CD1-CG1 4.42Å; L328-I332 HydrophobicContact CG-CD1 3.92Å; L328-I332 VanDerWaalsContact O-CG1 3.31Å; L328-I332 WeakPolarHBondContact O-CG1 3.2Å; L328-I332 PolarHBondContact O-N 2.75Å; I329-I332 PolarHBondContact O-N 3.31Å; I332-S334 PolarHBondContact O-N 3.08Å; I332-T335 WeakPolarHBondContact CA-OG1 3.48Å; I332-T335 PolarHBondContact O-N 3.46Å; I332-T335 PolarHBondContact O-OG1 3Å; I332-T335 VanDerWaalsContact O-OG1 3.12Å; I332-L336 HydrophobicContact CG2-CD1 4.06Å; I332-L336 HydrophobicContact CG2-CG 4.36Å; I332-L336 VanDerWaalsContact O-CG 3.32Å; I332-L336 WeakPolarHBondContact O-CG 3.29Å; I332-L336 PolarHBondContact O-N 3.49Å
333	G	93.6	Very high	92.8	Very high	46 Å²	46	71.3 Å²	71.3	47%	0.474	38%	0.38	S	S	.	.	H	α-helix	trans	-59.9	-45.5	178.8	0	0	0	0	0	113	I329 I330	I329-G333 PolarHBondContact O-N 3.2Å; I330-G333 PolarHBondContact O-N 2.95Å
334	S	92.6	Very high	92.7	Very high	63 Å²	63	70.4 Å²	70.4	44%	0.441	38%	0.383	S	S	.	.	H	α-helix	trans	-66.9	-37.5	176.5	51.9	0	0	0	0	112.5	I330 Y331 I332 S337	I330-S334 WeakPolarHBondContact O-CB 3.31Å; I330-S334 PolarHBondContact O-N 3.32Å; I330-S334 PolarHBondContact O-OG 2.8Å; Y331-S334 WeakPolarHBondContact CA-OG 3.46Å; Y331-S334 PolarHBondContact O-OG 3.03Å; I332-S334 PolarHBondContact O-N 3.08Å; S334-S337 PolarHBondContact O-OG 3.2Å
335	T	93.1	Very high	92.4	Very high	12 Å²	12	72.7 Å²	72.7	7%	0.074	39%	0.394	C	S	.	.	H	α-helix	trans	-81.2	-20.9	-176.1	55.6	0	0	0	0	114.4	I40 Y331 I332 S337 Y338	I40-T335 HydrophobicContact CG1-CG2 4.2Å; I40-T335 HydrophobicContact CG2-CG2 3.86Å; Y331-T335 HydrophobicContact CD1-CG2 4.16Å; Y331-T335 HydrophobicContact CD2-CG2 4.48Å; Y331-T335 HydrophobicContact CE1-CG2 3.8Å; Y331-T335 HydrophobicContact CE2-CG2 4.12Å; Y331-T335 WeakPolarHBondContact O-CB 3.36Å; Y331-T335 WeakPolarHBondContact O-CG2 3.42Å; Y331-T335 PolarHBondContact O-N 3.25Å; Y331-T335 PolarHBondContact O-OG1 2.98Å; I332-T335 WeakPolarHBondContact CA-OG1 3.48Å; I332-T335 PolarHBondContact O-N 3.46Å; I332-T335 PolarHBondContact O-OG1 3Å; I332-T335 VanDerWaalsContact O-OG1 3.12Å; T335-S337 PolarHBondContact O-N 3.41Å; T335-Y338 HydrophobicContact CG2-CD2 4.29Å; T335-Y338 HydrophobicContact CG2-CE2 4.17Å; T335-Y338 WeakPolarHBondContact O-CB 3.23Å; T335-Y338 WeakPolarHBondContact O-CD2 3.35Å; T335-Y338 PolarHBondContact O-N 3.28Å; T335-Y338 VanDerWaalsContact O-N 3.08Å
336	L	91.4	Very high	92.2	Very high	106 Å²	106	67.3 Å²	67.3	56%	0.555	37%	0.371	S	S	*	.	H	α-helix	trans	-57.4	-31.2	174.8	-86.3	162.3	0	0	0	112.7	I332 Y338 Y339	I332-L336 HydrophobicContact CG2-CD1 4.06Å; I332-L336 HydrophobicContact CG2-CG 4.36Å; I332-L336 VanDerWaalsContact O-CG 3.32Å; I332-L336 WeakPolarHBondContact O-CG 3.29Å; I332-L336 PolarHBondContact O-N 3.49Å; L336-Y338 VanDerWaalsContact C-N 3.25Å; L336-Y338 PolarHBondContact O-N 3.36Å; L336-Y339 PolarHBondContact O-N 3.1Å
337	S	91.9	Very high	91.8	Very high	77 Å²	77	64.2 Å²	64.2	54%	0.538	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-30.1	177.5	67.1	0	0	0	0	113.3	S334 T335 Y339 A340	S334-S337 PolarHBondContact O-OG 3.2Å; T335-S337 PolarHBondContact O-N 3.41Å; S337-Y339 PolarHBondContact O-N 2.75Å; S337-A340 VanDerWaalsContact O-CB 3.31Å; S337-A340 WeakPolarHBondContact O-CB 3.38Å; S337-A340 PolarHBondContact O-N 3.47Å; S337-A340 VanDerWaalsContact O-N 3.09Å
338	Y	92.8	Very high	91.5	Very high	135 Å²	135	67.9 Å²	67.9	53%	0.529	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-25.6	-179.2	-67.8	-65.1	0	0	0	113.1	T335 L336 A340 L341	T335-Y338 HydrophobicContact CG2-CD2 4.29Å; T335-Y338 HydrophobicContact CG2-CE2 4.17Å; T335-Y338 WeakPolarHBondContact O-CB 3.23Å; T335-Y338 WeakPolarHBondContact O-CD2 3.35Å; T335-Y338 PolarHBondContact O-N 3.28Å; T335-Y338 VanDerWaalsContact O-N 3.08Å; L336-Y338 VanDerWaalsContact C-N 3.25Å; L336-Y338 PolarHBondContact O-N 3.36Å; Y338-A340 PolarHBondContact O-N 3.35Å; Y338-L341 WeakPolarHBondContact O-CB 3.39Å; Y338-L341 PolarHBondContact O-N 3.32Å
339	Y	93.3	Very high	91	Very high	67 Å²	67	68.5 Å²	68.5	26%	0.263	37%	0.37	S	S	.	.	H	α-helix	trans	-66.2	-21.8	176.4	-71.1	-77.7	0	0	0	113.4	N33 I36 L37 I40 L336 S337 L341 T342	N33-Y339 HydrophobicContact CB-CD1 4.17Å; N33-Y339 HydrophobicContact CB-CE1 4.08Å; I36-Y339 HydrophobicContact CG2-CD1 4.39Å; I36-Y339 HydrophobicContact CG2-CE1 4.21Å; L37-Y339 WeakPolarHBondContact CB-OH 3.37Å; L37-Y339 WeakPolarHBondContact CD1-OH 3.35Å; I40-Y339 HydrophobicContact CD1-CE2 4.33Å; L336-Y339 PolarHBondContact O-N 3.1Å; S337-Y339 PolarHBondContact O-N 2.75Å; Y339-L341 PolarHBondContact O-N 3.09Å; Y339-T342 WeakPolarHBondContact O-CB 3.25Å; Y339-T342 PolarHBondContact O-N 3.42Å
340	A	91.6	Very high	90.4	Very high	53 Å²	53	64.6 Å²	64.6	44%	0.438	35%	0.35	S	S	.	.	H	α-helix	trans	-66.1	-24.4	173.4	0	0	0	0	0	112.1	S337 Y338 T342 T343 V344	S337-A340 VanDerWaalsContact O-CB 3.31Å; S337-A340 WeakPolarHBondContact O-CB 3.38Å; S337-A340 PolarHBondContact O-N 3.47Å; S337-A340 VanDerWaalsContact O-N 3.09Å; Y338-A340 PolarHBondContact O-N 3.35Å; A340-T342 VanDerWaalsContact C-N 3.26Å; A340-T342 PolarHBondContact O-N 2.92Å; A340-T343 PolarHBondContact O-N 3.28Å; A340-T343 PolarHBondContact O-OG1 2.9Å; A340-V344 WeakPolarHBondContact O-CG2 3.49Å; A340-V344 PolarHBondContact O-N 3.28Å; A340-V344 VanDerWaalsContact O-N 3.1Å
341	L	91.3	Very high	89.5	Confident	95 Å²	95	66.6 Å²	66.6	50%	0.497	36%	0.357	S	S	.	.	H	α-helix	trans	-61.9	-37.2	176.1	-173.3	62.1	0	0	0	111.2	Y338 Y339 T343 V344 L345	Y338-L341 WeakPolarHBondContact O-CB 3.39Å; Y338-L341 PolarHBondContact O-N 3.32Å; Y339-L341 PolarHBondContact O-N 3.09Å; L341-T343 VanDerWaalsContact C-N 3.32Å; L341-T343 PolarHBondContact O-N 2.98Å; L341-V344 PolarHBondContact O-N 3.5Å; L341-L345 HydrophobicContact CD1-CD1 4.47Å; L341-L345 HydrophobicContact CD1-CG 4.31Å; L341-L345 HydrophobicContact CG-CD1 3.94Å; L341-L345 HydrophobicContact CG-CG 4.25Å; L341-L345 WeakPolarHBondContact O-CB 3.32Å; L341-L345 VanDerWaalsContact O-CG 3.25Å; L341-L345 WeakPolarHBondContact O-CG 3.26Å; L341-L345 PolarHBondContact O-N 3.38Å
342	T	91.5	Very high	88.4	Confident	1 Å²	1	67 Å²	67	1%	0.006	36%	0.364	C	S	.	.	H	α-helix	trans	-60.1	-43.2	176.6	-55.3	0	0	0	0	111.5	K29 L32 N33 I36 Y339 A340 L345 I346	K29-T342 HydrophobicContact CB-CG2 4.48Å; K29-T342 HydrophobicContact CG-CG2 3.98Å; L32-T342 HydrophobicContact CB-CG2 3.84Å; L32-T342 HydrophobicContact CD1-CG2 4.06Å; N33-T342 VanDerWaalsContact OD1-CB 3.29Å; N33-T342 WeakPolarHBondContact OD1-CB 3.12Å; N33-T342 WeakPolarHBondContact OD1-CG2 3.17Å; N33-T342 PolarHBondContact OD1-OG1 2.86Å; I36-T342 VanDerWaalsContact CD1-OG1 3.31Å; I36-T342 WeakPolarHBondContact CD1-OG1 3.46Å; Y339-T342 WeakPolarHBondContact O-CB 3.25Å; Y339-T342 PolarHBondContact O-N 3.42Å; A340-T342 VanDerWaalsContact C-N 3.26Å; A340-T342 PolarHBondContact O-N 2.92Å; T342-L345 PolarHBondContact O-N 3.39Å; T342-I346 HydrophobicContact CG2-CD1 3.8Å; T342-I346 WeakPolarHBondContact O-CB 3.47Å; T342-I346 WeakPolarHBondContact O-CD1 3.38Å; T342-I346 VanDerWaalsContact O-CG1 3.23Å; T342-I346 WeakPolarHBondContact O-CG1 3.27Å; T342-I346 PolarHBondContact O-N 2.87Å
343	T	89.4	Confident	86.7	Confident	68 Å²	68	69.1 Å²	69.1	42%	0.417	39%	0.386	S	S	.	.	H	α-helix	trans	-68.2	-41	179.6	48.3	0	0	0	0	111.7	A340 L341 I346 D347	A340-T343 PolarHBondContact O-N 3.28Å; A340-T343 PolarHBondContact O-OG1 2.9Å; L341-T343 VanDerWaalsContact C-N 3.32Å; L341-T343 PolarHBondContact O-N 2.98Å; T343-I346 PolarHBondContact O-N 3.4Å; T343-D347 WeakPolarHBondContact O-CB 3.31Å; T343-D347 PolarHBondContact O-N 3.26Å
344	V	90.4	Very high	84.9	Confident	90 Å²	90	71.9 Å²	71.9	55%	0.545	40%	0.396	S	S	.	.	H	α-helix	trans	-64.1	-42.9	176.6	174	0	0	0	0	111.2	A340 L341 D347 W348	A340-V344 WeakPolarHBondContact O-CG2 3.49Å; A340-V344 PolarHBondContact O-N 3.28Å; A340-V344 VanDerWaalsContact O-N 3.1Å; L341-V344 PolarHBondContact O-N 3.5Å; V344-D347 PolarHBondContact O-N 2.78Å; V344-W348 VanDerWaalsContact O-CB 3.27Å; V344-W348 WeakPolarHBondContact O-CB 3.18Å; V344-W348 PolarHBondContact O-N 3.38Å
345	L	88.5	Confident	83.4	Confident	64 Å²	64	71 Å²	71	34%	0.335	38%	0.384	S	S	.	.	H	α-helix	trans	-64.7	-41.1	177.7	-73.3	172.6	0	0	0	112	L341 T342 L349	L341-L345 HydrophobicContact CD1-CD1 4.47Å; L341-L345 HydrophobicContact CD1-CG 4.31Å; L341-L345 HydrophobicContact CG-CD1 3.94Å; L341-L345 HydrophobicContact CG-CG 4.25Å; L341-L345 WeakPolarHBondContact O-CB 3.32Å; L341-L345 VanDerWaalsContact O-CG 3.25Å; L341-L345 WeakPolarHBondContact O-CG 3.26Å; L341-L345 PolarHBondContact O-N 3.38Å; T342-L345 PolarHBondContact O-N 3.39Å; L345-L349 WeakPolarHBondContact O-CB 3.3Å; L345-L349 WeakPolarHBondContact O-CG 3.09Å; L345-L349 PolarHBondContact O-N 2.94Å
346	I	88.1	Confident	81.8	Confident	19 Å²	19	73.5 Å²	73.5	10%	0.097	40%	0.401	C	S	.	.	H	α-helix	trans	-66.8	-44.6	177	-68.6	167	0	0	0	110.6	K29 T342 T343 W348 L349 L350	K29-I346 HydrophobicContact CB-CD1 3.61Å; K29-I346 HydrophobicContact CD-CD1 4.48Å; K29-I346 HydrophobicContact CG-CD1 3.92Å; T342-I346 HydrophobicContact CG2-CD1 3.8Å; T342-I346 WeakPolarHBondContact O-CB 3.47Å; T342-I346 WeakPolarHBondContact O-CD1 3.38Å; T342-I346 VanDerWaalsContact O-CG1 3.23Å; T342-I346 WeakPolarHBondContact O-CG1 3.27Å; T342-I346 PolarHBondContact O-N 2.87Å; T343-I346 PolarHBondContact O-N 3.4Å; I346-W348 VanDerWaalsContact C-N 3.35Å; I346-W348 PolarHBondContact O-N 3.13Å; I346-L349 PolarHBondContact O-N 3.48Å; I346-L350 HydrophobicContact CG2-CD1 3.89Å; I346-L350 HydrophobicContact CG2-CG 4.36Å; I346-L350 WeakPolarHBondContact O-CB 3.47Å; I346-L350 VanDerWaalsContact O-CG 3.26Å; I346-L350 WeakPolarHBondContact O-CG 3.36Å; I346-L350 PolarHBondContact O-N 3.22Å
347	D	86.6	Confident	80.4	Confident	52 Å²	52	71.5 Å²	71.5	28%	0.278	40%	0.4	S	S	.	.	H	α-helix	trans	-60.9	-45.1	176.8	-79.4	-5.8	0	0	0	111	T343 V344 L349 L350 E351 Y363 K367	T343-D347 WeakPolarHBondContact O-CB 3.31Å; T343-D347 PolarHBondContact O-N 3.26Å; V344-D347 PolarHBondContact O-N 2.78Å; D347-L349 PolarHBondContact O-N 2.93Å; D347-L350 PolarHBondContact O-N 3.44Å; D347-E351 WeakPolarHBondContact O-CG 3.47Å; D347-E351 PolarHBondContact O-N 2.88Å; D347-Y363 PolarHBondContact OD1-OH 3.11Å; D347-K367 IonicContact OD1-NZ 3.14Å; D347-K367 PolarHBondContact OD1-NZ 3.39Å; D347-K367 IonicContact OD2-NZ 2.85Å; D347-K367 PolarHBondContact OD2-NZ 3.34Å
348	W	86.1	Confident	79	Confident	143 Å²	143	73.9 Å²	73.9	54%	0.542	41%	0.407	S	S	.	.	H	α-helix	trans	-60.9	-43.3	175	177	75.1	0	0	0	112.4	V344 I346 L350 E351 T352	V344-W348 VanDerWaalsContact O-CB 3.27Å; V344-W348 WeakPolarHBondContact O-CB 3.18Å; V344-W348 PolarHBondContact O-N 3.38Å; I346-W348 VanDerWaalsContact C-N 3.35Å; I346-W348 PolarHBondContact O-N 3.13Å; W348-L350 VanDerWaalsContact C-N 3.3Å; W348-L350 PolarHBondContact O-N 2.62Å; W348-E351 PolarHBondContact O-N 3.03Å; W348-T352 HydrophobicContact CZ2-CG2 4.15Å; W348-T352 WeakPolarHBondContact O-CB 3.48Å; W348-T352 PolarHBondContact O-N 3.32Å; W348-T352 PolarHBondContact O-OG1 2.98Å
349	L	83.8	Confident	77.8	Confident	48 Å²	48	70.6 Å²	70.6	25%	0.251	40%	0.401	S	S	.	.	H	α-helix	trans	-65.8	-30.3	176.7	-76.5	171	0	0	0	113.3	L28 L345 I346 D347	L28-L349 HydrophobicContact CD2-CD1 3.94Å; L345-L349 WeakPolarHBondContact O-CB 3.3Å; L345-L349 WeakPolarHBondContact O-CG 3.09Å; L345-L349 PolarHBondContact O-N 2.94Å; I346-L349 PolarHBondContact O-N 3.48Å; D347-L349 PolarHBondContact O-N 2.93Å
350	L	81.6	Confident	76.5	Confident	8 Å²	8	68.1 Å²	68.1	4%	0.042	40%	0.396	C	S	.	.	H	α-helix	trans	-77.6	-32.1	176.2	-72.9	171.3	0	0	0	112.1	I20 L25 I346 D347 W348 Y355 Y363	I20-L350 HydrophobicContact CD1-CD1 3.94Å; L25-L350 HydrophobicContact CD1-CD2 3.92Å; L25-L350 HydrophobicContact CD2-CD2 4.17Å; I346-L350 HydrophobicContact CG2-CD1 3.89Å; I346-L350 HydrophobicContact CG2-CG 4.36Å; I346-L350 WeakPolarHBondContact O-CB 3.47Å; I346-L350 VanDerWaalsContact O-CG 3.26Å; I346-L350 WeakPolarHBondContact O-CG 3.36Å; I346-L350 PolarHBondContact O-N 3.22Å; D347-L350 PolarHBondContact O-N 3.44Å; W348-L350 VanDerWaalsContact C-N 3.3Å; W348-L350 PolarHBondContact O-N 2.62Å; L350-Y355 HydrophobicContact CD2-CD1 4.38Å; L350-Y363 HydrophobicContact CB-CD1 4.18Å; L350-Y363 HydrophobicContact CB-CE1 4.21Å; L350-Y363 HydrophobicContact CD1-CD1 4.29Å; L350-Y363 HydrophobicContact CD1-CE1 4.03Å; L350-Y363 HydrophobicContact CD1-CE2 4.33Å
351	E	74.6	Confident	75.4	Confident	139 Å²	139	71.2 Å²	71.2	65%	0.65	40%	0.401	S	S	*	.	H	α-helix	trans	-81.6	-28.6	176.5	-73.2	176.7	-170.1	0	0	112.8	D347 W348	D347-E351 WeakPolarHBondContact O-CG 3.47Å; D347-E351 PolarHBondContact O-N 2.88Å; W348-E351 PolarHBondContact O-N 3.03Å
352	T	71.1	Confident	74.5	Confident	44 Å²	44	70.5 Å²	70.5	27%	0.27	40%	0.398	S	S	.	.	S	Bend	trans	-84.4	149.1	174.5	39.2	0	0	0	0	112.6	W348 C354	W348-T352 HydrophobicContact CZ2-CG2 4.15Å; W348-T352 WeakPolarHBondContact O-CB 3.48Å; W348-T352 PolarHBondContact O-N 3.32Å; W348-T352 PolarHBondContact O-OG1 2.98Å; T352-C354 PolarHBondContact O-N 2.94Å
353	S	57.1	Low	73.8	Confident	122 Å²	122	71.9 Å²	71.9	85%	0.853	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	6.4	-175.8	-173.9	0	0	0	0	116.5	Y355	S353-Y355 VanDerWaalsContact C-N 3.28Å
354	C	56.8	Low	73	Confident	104 Å²	104	71.3 Å²	71.3	70%	0.703	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-15.8	177.5	-76	0	0	0	0	113.2	T352	T352-C354 PolarHBondContact O-N 2.94Å
355	Y	61.3	Low	72.4	Confident	45 Å²	45	74.1 Å²	74.1	18%	0.176	41%	0.409	C	S	.	.	S	Bend	trans	-109.8	152.3	170.7	-128.5	-104	0	0	0	110.2	R24 L25 L350 S353 A357 V359	R24-Y355 WeakPolarHBondContact CD-OH 3.35Å; L25-Y355 HydrophobicContact CD1-CE1 4.49Å; L25-Y355 HydrophobicContact CD2-CE2 4.13Å; L350-Y355 HydrophobicContact CD2-CD1 4.38Å; S353-Y355 VanDerWaalsContact C-N 3.28Å; Y355-A357 PolarHBondContact O-N 2.71Å; Y355-V359 HydrophobicContact CD1-CG1 4.34Å
356	S	59.7	Low	72	Confident	63 Å²	63	79.3 Å²	79.3	44%	0.441	42%	0.424	S	S	.	.			trans	-50.4	127.1	-174.3	52.2	0	0	0	0	111.9	D358 V359 G360	S356-D358 PolarHBondContact O-N 3.26Å; S356-V359 PolarHBondContact O-N 2.78Å; S356-V359 VanDerWaalsContact OG-CB 3.3Å; S356-V359 WeakPolarHBondContact OG-CB 3.46Å; S356-V359 WeakPolarHBondContact OG-CG2 3.27Å; S356-G360 PolarHBondContact O-N 3.09Å; S356-G360 VanDerWaalsContact O-N 3.11Å
357	A	62.1	Low	71.7	Confident	65 Å²	65	82.1 Å²	82.1	54%	0.537	44%	0.436	S	S	.	.	H	α-helix	trans	-50.1	-37.3	-178	0	0	0	0	0	112.5	Y355 V359 G360 Q361	Y355-A357 PolarHBondContact O-N 2.71Å; A357-V359 PolarHBondContact O-N 3.4Å; A357-G360 PolarHBondContact O-N 3.07Å; A357-Q361 WeakPolarHBondContact O-CG 3.3Å; A357-Q361 PolarHBondContact O-N 3.35Å
358	D	62.1	Low	71.4	Confident	127 Å²	127	84.2 Å²	84.2	68%	0.679	45%	0.45	S	S	*	.	H	α-helix	trans	-67.2	-35.2	179.9	-53.4	-32	0	0	0	113.5	S356 N362	S356-D358 PolarHBondContact O-N 3.26Å; D358-N362 PolarHBondContact O-N 3.48Å
359	V	66.7	Low	71.1	Confident	65 Å²	65	85.5 Å²	85.5	39%	0.394	46%	0.462	S	S	.	.	H	α-helix	trans	-78.5	-36.5	177.5	176.6	0	0	0	0	110.6	Y355 S356 A357 Y363	Y355-V359 HydrophobicContact CD1-CG1 4.34Å; S356-V359 PolarHBondContact O-N 2.78Å; S356-V359 VanDerWaalsContact OG-CB 3.3Å; S356-V359 WeakPolarHBondContact OG-CB 3.46Å; S356-V359 WeakPolarHBondContact OG-CG2 3.27Å; A357-V359 PolarHBondContact O-N 3.4Å; V359-Y363 WeakPolarHBondContact O-CB 3.4Å; V359-Y363 PolarHBondContact O-N 3.3Å
360	G	67.2	Low	70.5	Confident	15 Å²	15	88.5 Å²	88.5	16%	0.155	49%	0.487	C	S	.	.	H	α-helix	trans	-61.7	-45.9	174.5	0	0	0	0	0	112.1	S356 A357 Y363 S364	S356-G360 PolarHBondContact O-N 3.09Å; S356-G360 VanDerWaalsContact O-N 3.11Å; A357-G360 PolarHBondContact O-N 3.07Å; G360-Y363 PolarHBondContact O-N 3.04Å; G360-S364 PolarHBondContact O-N 3.38Å; G360-S364 PolarHBondContact O-OG 3.31Å
361	Q	67.1	Low	69.9	Low	119 Å²	119	94 Å²	94	56%	0.556	52%	0.52	S	S	*	.	H	α-helix	trans	-61.9	-49.7	178.3	-75	177.9	-2.7	0	0	112.3	A357 Y363 S364 E365	A357-Q361 WeakPolarHBondContact O-CG 3.3Å; A357-Q361 PolarHBondContact O-N 3.35Å; Q361-Y363 VanDerWaalsContact C-N 3.25Å; Q361-Y363 PolarHBondContact O-N 3.04Å; Q361-S364 WeakPolarHBondContact CA-OG 3.34Å; Q361-S364 PolarHBondContact O-N 2.79Å; Q361-S364 PolarHBondContact O-OG 3.18Å; Q361-E365 WeakPolarHBondContact O-CG 3.47Å; Q361-E365 PolarHBondContact O-N 2.9Å
362	N	73.9	Confident	69.4	Low	79 Å²	79	92.1 Å²	92.1	42%	0.422	52%	0.52	S	S	.	.	H	α-helix	trans	-62.6	-32.2	177.4	-172.4	6.8	0	0	0	112.3	D358 R366	D358-N362 PolarHBondContact O-N 3.48Å; N362-R366 WeakPolarHBondContact O-CG 3.35Å; N362-R366 PolarHBondContact OD1-NE 2.99Å
363	Y	76.2	Confident	68.2	Low	30 Å²	30	97.4 Å²	97.4	12%	0.118	55%	0.547	C	S	.	.	H	α-helix	trans	-70.1	-46.8	173.3	173.6	-106.4	0	0	0	112.2	I20 D347 L350 V359 G360 Q361 E365 R366 K367	I20-Y363 HydrophobicContact CD1-CD2 3.53Å; I20-Y363 HydrophobicContact CD1-CE2 3.53Å; I20-Y363 HydrophobicContact CD1-CG 4.5Å; I20-Y363 HydrophobicContact CG1-CD2 4.18Å; I20-Y363 HydrophobicContact CG1-CE2 4.26Å; D347-Y363 PolarHBondContact OD1-OH 3.11Å; L350-Y363 HydrophobicContact CB-CD1 4.18Å; L350-Y363 HydrophobicContact CB-CE1 4.21Å; L350-Y363 HydrophobicContact CD1-CD1 4.29Å; L350-Y363 HydrophobicContact CD1-CE1 4.03Å; L350-Y363 HydrophobicContact CD1-CE2 4.33Å; V359-Y363 WeakPolarHBondContact O-CB 3.4Å; V359-Y363 PolarHBondContact O-N 3.3Å; G360-Y363 PolarHBondContact O-N 3.04Å; Q361-Y363 VanDerWaalsContact C-N 3.25Å; Q361-Y363 PolarHBondContact O-N 3.04Å; Y363-E365 VanDerWaalsContact C-N 3.31Å; Y363-E365 PolarHBondContact O-N 3.29Å; Y363-R366 PolarHBondContact O-N 3.27Å; Y363-R366 VanDerWaalsContact O-N 3.12Å; Y363-K367 HydrophobicContact CE1-CB 4.48Å; Y363-K367 HydrophobicContact CE1-CD 3.74Å; Y363-K367 HydrophobicContact CE2-CB 4.48Å; Y363-K367 WeakPolarHBondContact O-CB 3.37Å; Y363-K367 PolarHBondContact O-N 3.34Å; Y363-K367 VanDerWaalsContact OH-CD 3.3Å; Y363-K367 WeakPolarHBondContact OH-CD 3.42Å; Y363-K367 VanDerWaalsContact OH-CE 3.27Å; Y363-K367 WeakPolarHBondContact OH-CE 3.47Å; Y363-K367 PolarHBondContact OH-NZ 3.12Å
364	S	72.8	Confident	68.2	Low	56 Å²	56	95.5 Å²	95.5	39%	0.392	53%	0.534	S	S	.	.	H	α-helix	trans	-60.9	-39	180	56.5	0	0	0	0	112.7	G360 Q361 R366 K367 V368	G360-S364 PolarHBondContact O-N 3.38Å; G360-S364 PolarHBondContact O-OG 3.31Å; Q361-S364 WeakPolarHBondContact CA-OG 3.34Å; Q361-S364 PolarHBondContact O-N 2.79Å; Q361-S364 PolarHBondContact O-OG 3.18Å; S364-R366 VanDerWaalsContact C-N 3.26Å; S364-R366 PolarHBondContact O-N 2.99Å; S364-K367 PolarHBondContact O-N 2.96Å; S364-V368 PolarHBondContact O-N 3.33Å
365	E	77.6	Confident	68	Low	150 Å²	150	98.8 Å²	98.8	70%	0.701	54%	0.539	S	S	*	.	H	α-helix	trans	-64.7	-29.3	177.1	-73.1	177.6	177.3	0	0	112.9	Q361 Y363	Q361-E365 WeakPolarHBondContact O-CG 3.47Å; Q361-E365 PolarHBondContact O-N 2.9Å; Y363-E365 VanDerWaalsContact C-N 3.31Å; Y363-E365 PolarHBondContact O-N 3.29Å
366	R	80.1	Confident	67.7	Low	173 Å²	173	102.1 Å²	102.1	65%	0.653	56%	0.556	S	S	*	*	H	α-helix	trans	-89.8	-25	178.5	-66.4	179.9	-171.7	-142	-2.8	113.4	V18 N362 Y363 S364	V18-R366 HydrophobicContact CG1-CB 4.4Å; N362-R366 WeakPolarHBondContact O-CG 3.35Å; N362-R366 PolarHBondContact OD1-NE 2.99Å; Y363-R366 PolarHBondContact O-N 3.27Å; Y363-R366 VanDerWaalsContact O-N 3.12Å; S364-R366 VanDerWaalsContact C-N 3.26Å; S364-R366 PolarHBondContact O-N 2.99Å
367	K	80.8	Confident	68	Low	77 Å²	77	101 Å²	101	34%	0.335	55%	0.548	S	S	.	.	H	α-helix	trans	-86.7	-41.2	-178.7	-170.7	-169.7	-164.3	163.8	0	112.4	D347 Y363 S364	D347-K367 IonicContact OD1-NZ 3.14Å; D347-K367 PolarHBondContact OD1-NZ 3.39Å; D347-K367 IonicContact OD2-NZ 2.85Å; D347-K367 PolarHBondContact OD2-NZ 3.34Å; Y363-K367 HydrophobicContact CE1-CB 4.48Å; Y363-K367 HydrophobicContact CE1-CD 3.74Å; Y363-K367 HydrophobicContact CE2-CB 4.48Å; Y363-K367 WeakPolarHBondContact O-CB 3.37Å; Y363-K367 PolarHBondContact O-N 3.34Å; Y363-K367 VanDerWaalsContact OH-CD 3.3Å; Y363-K367 WeakPolarHBondContact OH-CD 3.42Å; Y363-K367 VanDerWaalsContact OH-CE 3.27Å; Y363-K367 WeakPolarHBondContact OH-CE 3.47Å; Y363-K367 PolarHBondContact OH-NZ 3.12Å; S364-K367 PolarHBondContact O-N 2.96Å
368	V	80.8	Confident	68.7	Low	96 Å²	96	100.1 Å²	100.1	58%	0.582	53%	0.534	S	S	*	.			trans	-113.3	121.5	-170.2	-175.7	0	0	0	0	110.2	S364	S364-V368 PolarHBondContact O-N 3.33Å
369	E	79.3	Confident	69.7	Low	171 Å²	171	94.1 Å²	94.1	80%	0.799	50%	0.502	S	S	*	.			trans	-104.7	113.2	170.4	-173	170.9	-171.2	0	0	108.6	V371	E369-V371 PolarHBondContact O-N 3.2Å
370	S	70.8	Confident	70.5	Confident	111 Å²	111	91 Å²	91	78%	0.776	48%	0.483	S	S	*	.			trans	-79.4	109.7	179.9	60.6	0	0	0	0	110.3
371	V	71	Confident	71.5	Confident	122 Å²	122	90.4 Å²	90.4	74%	0.739	48%	0.476	S	S	*	.			trans	-101.4	118.8	176.1	-176.5	0	0	0	0	109.4	E369	E369-V371 PolarHBondContact O-N 3.2Å
372	P	62.6	Low	72.5	Confident	100 Å²	100	85.2 Å²	85.2	65%	0.649	45%	0.453	S	S	*	.			trans	-73.8	139.9	174.7	29.4	-32.2	0	0	0	111.2	S374	P372-S374 PolarHBondContact O-N 3.25Å
373	D	46.4	Very low	73.2	Confident	155 Å²	155	81.9 Å²	81.9	83%	0.829	43%	0.434	S	S	*	.			trans	-74.6	114	-177	-147.9	-2	0	0	0	110.9	Q375	D373-Q375 PolarHBondContact O-N 3.26Å
374	S	57.2	Low	73.6	Confident	82 Å²	82	83.3 Å²	83.3	57%	0.573	45%	0.446	S	S	*	.			trans	-77.9	85.3	-167.6	67.1	0	0	0	0	112.6	P372	P372-S374 PolarHBondContact O-N 3.25Å
375	Q	51.7	Low	74.2	Confident	173 Å²	173	83.4 Å²	83.4	81%	0.808	44%	0.442	S	S	*	.			trans	-123.5	-1.3	173.6	-73.3	-166	-4	0	0	116	D373	D373-Q375 PolarHBondContact O-N 3.26Å
376	Q	55.7	Low	74.5	Confident	116 Å²	116	78.4 Å²	78.4	54%	0.542	42%	0.419	S	S	.	.	S	Bend	trans	-126.6	121.4	-178.1	-67.1	177.4	12.8	0	0	110.5	I378	Q376-I378 WeakPolarHBondContact O-CG1 3.44Å; Q376-I378 PolarHBondContact O-N 3.25Å
377	C	65.3	Low	74.3	Confident	39 Å²	39	78.6 Å²	78.6	26%	0.264	43%	0.427	S	S	.	.			trans	-66.9	101.1	173.4	177.3	0	0	0	0	108.9	H536	C377-H536 PolarHBondContact SG-ND1 3.3Å
378	I	77	Confident	74.4	Confident	47 Å²	47	80.9 Å²	80.9	24%	0.241	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	124.4	178.9	-61.3	169.7	0	0	0	107.9	Q376 L391 S535 H536	Q376-I378 WeakPolarHBondContact O-CG1 3.44Å; Q376-I378 PolarHBondContact O-N 3.25Å; I378-L391 HydrophobicContact CG2-CB 3.82Å; I378-L391 HydrophobicContact CG2-CD2 3.8Å; I378-L391 HydrophobicContact CG2-CG 4.28Å; I378-S535 CarbonylContact O-C 3.58Å; I378-S535 WeakPolarHBondContact O-CA 3.03Å; I378-H536 PolarHBondContact O-N 3.49Å
379	L	82.6	Confident	74.5	Confident	1 Å²	1	76.5 Å²	76.5	1%	0.005	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.8	176.3	-60.4	177.5	0	0	0	109.6	V392 R394 L400 H536 V538 F561	L379-V392 PolarHBondContact N-O 3.24Å; L379-V392 PolarHBondContact O-N 3.18Å; L379-R394 HydrophobicContact CD1-CB 4.27Å; L379-R394 HydrophobicContact CD1-CG 4.5Å; L379-L400 HydrophobicContact CD1-CD1 4Å; L379-L400 HydrophobicContact CD1-CD2 4.46Å; L379-H536 CarbonylContact C-O 3.57Å; L379-H536 WeakPolarHBondContact CA-O 3.39Å; L379-H536 HydrophobicContact CD2-CB 4.16Å; L379-V538 HydrophobicContact CB-CG2 3.94Å; L379-V538 HydrophobicContact CD1-CG2 4.3Å; L379-V538 HydrophobicContact CD2-CG2 3.89Å; L379-V538 HydrophobicContact CG-CG2 4.25Å; L379-F561 HydrophobicContact CD2-CE1 3.72Å; L379-F561 HydrophobicContact CD2-CZ 3.93Å
380	C	84.6	Confident	74.8	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	127.3	174.8	-170.3	0	0	0	0	110.3	R390 L391 F528 H536 P537 V538	C380-R390 WeakPolarHBondContact CA-O 3.46Å; C380-L391 HydrophobicContact CB-CD2 3.84Å; C380-F528 HydrophobicContact CB-CD1 4.34Å; C380-F528 HydrophobicContact CB-CE1 4.27Å; C380-F528 VanDerWaalsContact O-CE1 3.32Å; C380-F528 WeakPolarHBondContact O-CE1 3.47Å; C380-H536 PolarHBondContact N-O 3.38Å; C380-P537 WeakPolarHBondContact O-CA 3.46Å; C380-V538 PolarHBondContact O-N 2.79Å
381	V	87.6	Confident	75.4	Confident	2 Å²	2	66 Å²	66	1%	0.012	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	138.4	-175.3	-179.6	0	0	0	0	110.5	Y383 R390 V392 L400 L467	V381-Y383 HydrophobicContact CG1-CD2 4.46Å; V381-Y383 HydrophobicContact CG1-CE1 4.3Å; V381-Y383 HydrophobicContact CG1-CE2 3.82Å; V381-R390 PolarHBondContact N-O 3.17Å; V381-R390 PolarHBondContact O-N 3.19Å; V381-V392 HydrophobicContact CG2-CG2 4.35Å; V381-L400 HydrophobicContact CG2-CD1 4.3Å; V381-L400 HydrophobicContact CG2-CD2 3.93Å; V381-L400 HydrophobicContact CG2-CG 4.11Å; V381-L467 HydrophobicContact CG1-CD1 3.44Å; V381-L467 VanDerWaalsContact CG1-CD1 3.44Å; V381-L467 HydrophobicContact CG1-CD2 3.87Å; V381-L467 HydrophobicContact CG1-CG 4.29Å
382	S	88.4	Confident	75.9	Confident	10 Å²	10	60.4 Å²	60.4	7%	0.07	31%	0.314	C	S	.	.			trans	-123.4	135.6	176.8	-177.9	0	0	0	0	110.4	R527	S382-R527 PolarHBondContact OG-NH2 3.01Å
383	Y	87.9	Confident	76.6	Confident	9 Å²	9	60.2 Å²	60.2	4%	0.035	30%	0.303	C	S	.	.			trans	-112.5	151.5	171.2	-63.7	-69.9	0	0	0	109.8	V381 D385 Q401 L467 C468 C469 R471 R527	V381-Y383 HydrophobicContact CG1-CD2 4.46Å; V381-Y383 HydrophobicContact CG1-CE1 4.3Å; V381-Y383 HydrophobicContact CG1-CE2 3.82Å; Y383-D385 VanDerWaalsContact C-N 3.35Å; Y383-Q401 PolarHBondContact OH-OE1 3.08Å; Y383-L467 HydrophobicContact CE1-CD1 3.85Å; Y383-L467 WeakPolarHBondContact OH-CD1 3.31Å; Y383-C468 WeakPolarHBondContact CE1-O 3.44Å; Y383-C469 WeakPolarHBondContact CA-O 3.42Å; Y383-R471 HydrophobicContact CD1-CG 3.59Å; Y383-R471 HydrophobicContact CD2-CG 3.76Å; Y383-R471 HydrophobicContact CE1-CG 3.74Å; Y383-R471 HydrophobicContact CE2-CG 3.91Å; Y383-R471 HydrophobicContact CG-CG 3.59Å; Y383-R527 PolarHBondContact O-NH2 2.95Å; Y383-R527 VanDerWaalsContact O-NH2 3.07Å
384	V	85.9	Confident	77.9	Confident	59 Å²	59	58.6 Å²	58.6	36%	0.358	29%	0.285	S	S	.	.	S	Bend	trans	-71.9	-33.9	176.1	178.2	0	0	0	0	111.7	E386 C469 I477	V384-E386 VanDerWaalsContact C-N 3.25Å; V384-E386 PolarHBondContact O-N 3Å; V384-C469 PolarHBondContact N-O 3.41Å; V384-I477 HydrophobicContact CG2-CB 3.87Å; V384-I477 HydrophobicContact CG2-CD1 3.72Å; V384-I477 HydrophobicContact CG2-CG1 4Å
385	D	84.5	Confident	78.7	Confident	59 Å²	59	56.4 Å²	56.4	32%	0.316	27%	0.27	S	S	.	.	S	Bend	trans	-80.8	-5.7	-175.1	-34.8	-41.7	0	0	0	112.8	Y383 R470 R471 S472	Y383-D385 VanDerWaalsContact C-N 3.35Å; D385-R470 IonicContact OD1-CZ 2.73Å; D385-R470 IonicContact OD1-NE 3.84Å; D385-R470 PolarHBondContact OD1-NE 2.81Å; D385-R470 IonicContact OD1-NH2 3.18Å; D385-R470 PolarHBondContact OD1-NH2 3.17Å; D385-R470 WeakPolarHBondContact OD2-CA 3.44Å; D385-R470 WeakPolarHBondContact OD2-CB 3.08Å; D385-R471 PolarHBondContact OD2-N 3.43Å; D385-S472 PolarHBondContact OD2-N 3.3Å; D385-S472 PolarHBondContact OD2-OG 3.27Å
386	E	83.7	Confident	79.4	Confident	44 Å²	44	58.4 Å²	58.4	21%	0.206	27%	0.27	C	S	.	.			trans	-126.6	131.8	-179.6	-61	-175.7	-173.8	0	0	110.2	V384 K388 R390 R471	V384-E386 VanDerWaalsContact C-N 3.25Å; V384-E386 PolarHBondContact O-N 3Å; E386-K388 PolarHBondContact O-N 2.91Å; E386-R390 IonicContact OE1-CZ 3.83Å; E386-R390 IonicContact OE1-NE 3.88Å; E386-R390 IonicContact OE1-NH2 3.25Å; E386-R390 PolarHBondContact OE1-NH2 3.16Å; E386-R390 IonicContact OE2-CZ 2.94Å; E386-R390 IonicContact OE2-NE 3.36Å; E386-R390 PolarHBondContact OE2-NE 3.11Å; E386-R390 IonicContact OE2-NH2 2.94Å; E386-R390 PolarHBondContact OE2-NH2 2.83Å; E386-R471 WeakPolarHBondContact OE1-CD 3.46Å; E386-R471 IonicContact OE1-CZ 3.9Å; E386-R471 IonicContact OE1-NE 3.93Å; E386-R471 IonicContact OE1-NH1 3.35Å; E386-R471 PolarHBondContact OE1-NH1 2.83Å
387	E	76.3	Confident	80.2	Confident	178 Å²	178	62.3 Å²	62.3	83%	0.832	29%	0.285	S	S	*	.	S	Bend	trans	-78.6	-5.3	177.6	-63.3	-172.5	161.5	0	0	113.7	R411	E387-R411 VanDerWaalsContact O-CB 3.27Å; E387-R411 WeakPolarHBondContact O-CB 3.5Å
388	K	82.5	Confident	80.9	Confident	124 Å²	124	67 Å²	67	54%	0.539	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	144.4	-175.3	-56.1	179.1	-175.1	178.3	0	111.3	E386 V408 L409	E386-K388 PolarHBondContact O-N 2.91Å; K388-V408 HydrophobicContact CB-CG1 3.43Å; K388-V408 VanDerWaalsContact CB-CG1 3.43Å; K388-V408 HydrophobicContact CD-CG1 3.61Å; K388-V408 HydrophobicContact CG-CG1 4.1Å; K388-L409 CarbonylContact C-O 3.51Å; K388-L409 WeakPolarHBondContact CA-O 3.48Å
389	L	83.7	Confident	81	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.026	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	143.6	172.2	-62.7	177.5	0	0	0	110.2	V408 L409 R411 F528	L389-V408 CarbonylContact O-C 3.45Å; L389-V408 WeakPolarHBondContact O-CA 3.4Å; L389-L409 HydrophobicContact CB-CB 4.48Å; L389-L409 PolarHBondContact N-O 3.14Å; L389-L409 PolarHBondContact O-N 3.4Å; L389-R411 HydrophobicContact CG-CB 4.33Å; L389-F528 HydrophobicContact CD1-CD1 4.42Å; L389-F528 HydrophobicContact CD2-CD1 3.82Å; L389-F528 HydrophobicContact CD2-CE1 4.21Å
390	R	84.7	Confident	80.9	Confident	39 Å²	39	65.6 Å²	65.6	15%	0.147	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.7	179.6	-69.5	-178.6	-179.1	-138.8	-9.4	110.8	C380 V381 E386 V392 P405 V408 R471	C380-R390 WeakPolarHBondContact CA-O 3.46Å; V381-R390 PolarHBondContact N-O 3.17Å; V381-R390 PolarHBondContact O-N 3.19Å; E386-R390 IonicContact OE1-CZ 3.83Å; E386-R390 IonicContact OE1-NE 3.88Å; E386-R390 IonicContact OE1-NH2 3.25Å; E386-R390 PolarHBondContact OE1-NH2 3.16Å; E386-R390 IonicContact OE2-CZ 2.94Å; E386-R390 IonicContact OE2-NE 3.36Å; E386-R390 PolarHBondContact OE2-NE 3.11Å; E386-R390 IonicContact OE2-NH2 2.94Å; E386-R390 PolarHBondContact OE2-NH2 2.83Å; R390-V392 HydrophobicContact CB-CG2 4.39Å; R390-P405 HydrophobicContact CB-CB 4.08Å; R390-P405 HydrophobicContact CG-CB 4.14Å; R390-V408 HydrophobicContact CG-CG2 4.48Å; R390-R471 VanDerWaalsContact CZ-NH1 3.34Å
391	L	83.3	Confident	80.7	Confident	22 Å²	22	66.2 Å²	66.2	12%	0.115	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	125.7	172.7	-65.8	173.7	0	0	0	109.4	I378 C380 M406 S407 P532	I378-L391 HydrophobicContact CG2-CB 3.82Å; I378-L391 HydrophobicContact CG2-CD2 3.8Å; I378-L391 HydrophobicContact CG2-CG 4.28Å; C380-L391 HydrophobicContact CB-CD2 3.84Å; L391-M406 PolarHBondContact O-N 3.5Å; L391-S407 WeakPolarHBondContact CD1-OG 3.43Å; L391-S407 PolarHBondContact N-O 3.29Å; L391-P532 HydrophobicContact CD1-CG 4.34Å; L391-P532 HydrophobicContact CD2-CG 4.2Å
392	V	82.1	Confident	80.3	Confident	5 Å²	5	71.7 Å²	71.7	3%	0.03	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	135	-169	-175.8	0	0	0	0	110.1	L379 V381 R390 L400 I403	L379-V392 PolarHBondContact N-O 3.24Å; L379-V392 PolarHBondContact O-N 3.18Å; V381-V392 HydrophobicContact CG2-CG2 4.35Å; R390-V392 HydrophobicContact CB-CG2 4.39Å; V392-L400 HydrophobicContact CB-CD1 4.41Å; V392-L400 HydrophobicContact CG1-CD1 4Å; V392-I403 HydrophobicContact CG1-CB 3.68Å; V392-I403 HydrophobicContact CG1-CD1 4.12Å; V392-I403 HydrophobicContact CG1-CG1 4.49Å; V392-I403 HydrophobicContact CG1-CG2 3.35Å
393	K	78.2	Confident	80.1	Confident	96 Å²	96	72.8 Å²	72.8	42%	0.417	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	134.3	170.7	-100	166.4	-143.6	-147.3	0	110.8	S395 M406	K393-S395 PolarHBondContact O-N 3.46Å; K393-M406 HydrophobicContact CB-SD 4.1Å; K393-M406 HydrophobicContact CD-CE 4.35Å; K393-M406 HydrophobicContact CD-CG 4.43Å; K393-M406 HydrophobicContact CD-SD 3.69Å; K393-M406 WeakPolarHBondContact CE-SD 3.32Å; K393-M406 HydrophobicContact CG-CG 4.42Å; K393-M406 HydrophobicContact CG-SD 3.42Å; K393-M406 WeakPolarHBondContact CG-SD 3.34Å
394	R	72.7	Confident	79.6	Confident	121 Å²	121	81.3 Å²	81.3	46%	0.457	37%	0.369	S	S	.	.			trans	-57	123.6	172.1	-175.8	179.4	178.9	-177.5	2.3	110.8	L379 Q464	L379-R394 HydrophobicContact CD1-CB 4.27Å; L379-R394 HydrophobicContact CD1-CG 4.5Å; R394-Q464 HydrophobicContact CG-CG 4.14Å
395	S	73.3	Confident	79.4	Confident	35 Å²	35	80.5 Å²	80.5	25%	0.245	37%	0.365	C	S	.	.			trans	-112.2	149.5	171	-175.1	0	0	0	0	110.9	K393 K397 K398 Q464	K393-S395 PolarHBondContact O-N 3.46Å; S395-K397 PolarHBondContact OG-N 3.5Å; S395-K398 PolarHBondContact OG-N 3.41Å; S395-Q464 PolarHBondContact O-NE2 3.29Å
396	R	68.4	Low	78.9	Confident	215 Å²	215	82.3 Å²	82.3	81%	0.811	37%	0.373	S	S	*	.	S	Bend	trans	-97.5	-9.6	172.2	-64.4	-173.2	-176.7	-172	1.9	113.3
397	K	71.3	Confident	78.5	Confident	198 Å²	198	82.9 Å²	82.9	86%	0.861	38%	0.382	S	S	*	.	S	Bend	trans	-116.1	-21.2	-170.7	-65.7	-175	177.8	-176.9	0	114.6	S395	S395-K397 PolarHBondContact OG-N 3.5Å
398	K	79.4	Confident	78.6	Confident	138 Å²	138	77.9 Å²	77.9	60%	0.6	36%	0.363	S	S	*	.	S	Bend	trans	-118.9	138.6	-175.6	-65.4	-173.6	178.9	-176.2	0	110.5	S395 I403 P463	S395-K398 PolarHBondContact OG-N 3.41Å; K398-I403 HydrophobicContact CB-CD1 4.5Å; K398-I403 HydrophobicContact CB-CG1 4.09Å; K398-P463 WeakPolarHBondContact O-CB 3.4Å
399	S	79.3	Confident	78.3	Confident	14 Å²	14	75.4 Å²	75.4	10%	0.098	36%	0.356	C	S	.	.			trans	-53.9	133.2	169.4	179.8	0	0	0	0	110.9	Q401 N402 I403 E466	S399-Q401 PolarHBondContact O-N 3.15Å; S399-Q401 VanDerWaalsContact O-N 3.16Å; S399-N402 PolarHBondContact O-N 3.47Å; S399-I403 WeakPolarHBondContact O-CG1 3.45Å; S399-E466 VanDerWaalsContact CA-OE2 3.26Å; S399-E466 WeakPolarHBondContact CA-OE2 3.14Å; S399-E466 WeakPolarHBondContact CB-OE2 3.42Å; S399-E466 VanDerWaalsContact OG-CB 3.22Å; S399-E466 WeakPolarHBondContact OG-CB 3.43Å; S399-E466 PolarHBondContact OG-O 3.34Å; S399-E466 PolarHBondContact OG-OE2 2.97Å
400	L	81.7	Confident	77.8	Confident	4 Å²	4	79.5 Å²	79.5	2%	0.021	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-56.6	-31.7	-178.8	-169.9	62.2	0	0	0	112.5	L379 V381 V392 N402 I403 P463 Q464 L467 V538	L379-L400 HydrophobicContact CD1-CD1 4Å; L379-L400 HydrophobicContact CD1-CD2 4.46Å; V381-L400 HydrophobicContact CG2-CD1 4.3Å; V381-L400 HydrophobicContact CG2-CD2 3.93Å; V381-L400 HydrophobicContact CG2-CG 4.11Å; V392-L400 HydrophobicContact CB-CD1 4.41Å; V392-L400 HydrophobicContact CG1-CD1 4Å; L400-N402 PolarHBondContact O-N 3.45Å; L400-I403 HydrophobicContact CD1-CD1 4.11Å; L400-P463 PolarHBondContact N-O 3.22Å; L400-Q464 WeakPolarHBondContact CD2-O 3.37Å; L400-L467 HydrophobicContact CD2-CB 4.26Å; L400-L467 HydrophobicContact CD2-CD1 4.49Å; L400-L467 HydrophobicContact CD2-CD2 4.28Å; L400-L467 HydrophobicContact CG-CD1 4.47Å; L400-V538 HydrophobicContact CD2-CB 4.07Å; L400-V538 HydrophobicContact CD2-CG1 3.74Å; L400-V538 HydrophobicContact CD2-CG2 4.08Å
401	Q	80.9	Confident	76.9	Confident	13 Å²	13	80.5 Å²	80.5	6%	0.061	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-58.2	-30.1	175	-170.4	67.9	14.1	0	0	114.1	Y383 S399 W451 E466 R470	Y383-Q401 PolarHBondContact OH-OE1 3.08Å; S399-Q401 PolarHBondContact O-N 3.15Å; S399-Q401 VanDerWaalsContact O-N 3.16Å; Q401-W451 HydrophobicContact CB-CB 4.4Å; Q401-E466 PolarHBondContact N-O 3.47Å; Q401-E466 VanDerWaalsContact N-O 3.15Å; Q401-R470 PolarHBondContact NE2-O 2.87Å
402	N	79.1	Confident	75.9	Confident	117 Å²	117	88.1 Å²	88.1	63%	0.626	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-107.8	5.9	-170.1	-66.3	-27.3	0	0	0	113.6	S399 L400	S399-N402 PolarHBondContact O-N 3.47Å; L400-N402 PolarHBondContact O-N 3.45Å
403	I	82.8	Confident	74.7	Confident	34 Å²	34	92 Å²	92	17%	0.174	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-84	136.4	-179.7	-55.2	177.8	0	0	0	110.2	V392 K398 S399 L400	V392-I403 HydrophobicContact CG1-CB 3.68Å; V392-I403 HydrophobicContact CG1-CD1 4.12Å; V392-I403 HydrophobicContact CG1-CG1 4.49Å; V392-I403 HydrophobicContact CG1-CG2 3.35Å; K398-I403 HydrophobicContact CB-CD1 4.5Å; K398-I403 HydrophobicContact CB-CG1 4.09Å; S399-I403 WeakPolarHBondContact O-CG1 3.45Å; L400-I403 HydrophobicContact CD1-CD1 4.11Å
404	K	78.6	Confident	73.5	Confident	187 Å²	187	88.6 Å²	88.6	81%	0.813	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-71	135.8	173.6	-68	-174.4	178.3	-176.5	0	110.3
405	P	80.2	Confident	72.7	Confident	42 Å²	42	85.3 Å²	85.3	27%	0.273	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-69	147.1	179.5	29.6	-34.3	0	0	0	111.4	R390 V408	R390-P405 HydrophobicContact CB-CB 4.08Å; R390-P405 HydrophobicContact CG-CB 4.14Å; P405-V408 HydrophobicContact CB-CG2 4.16Å; P405-V408 HydrophobicContact CG-CG2 4.01Å
406	M	74.8	Confident	71.9	Confident	97 Å²	97	91.3 Å²	91.3	48%	0.478	45%	0.454	S	S	.	.	S	Bend	trans	-77.6	-41.6	170	-68.7	175.6	60.6	0	0	111.8	L391 K393	L391-M406 PolarHBondContact O-N 3.5Å; K393-M406 HydrophobicContact CB-SD 4.1Å; K393-M406 HydrophobicContact CD-CE 4.35Å; K393-M406 HydrophobicContact CD-CG 4.43Å; K393-M406 HydrophobicContact CD-SD 3.69Å; K393-M406 WeakPolarHBondContact CE-SD 3.32Å; K393-M406 HydrophobicContact CG-CG 4.42Å; K393-M406 HydrophobicContact CG-SD 3.42Å; K393-M406 WeakPolarHBondContact CG-SD 3.34Å
407	S	75.3	Confident	71.4	Confident	57 Å²	57	82.4 Å²	82.4	40%	0.399	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	154.3	177.2	56.6	0	0	0	0	108.9	L391	L391-S407 WeakPolarHBondContact CD1-OG 3.43Å; L391-S407 PolarHBondContact N-O 3.29Å
408	V	78.3	Confident	70.7	Confident	72 Å²	72	81.4 Å²	81.4	44%	0.436	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	117.7	-178.6	-178.6	0	0	0	0	107	K388 L389 R390 P405	K388-V408 HydrophobicContact CB-CG1 3.43Å; K388-V408 VanDerWaalsContact CB-CG1 3.43Å; K388-V408 HydrophobicContact CD-CG1 3.61Å; K388-V408 HydrophobicContact CG-CG1 4.1Å; L389-V408 CarbonylContact O-C 3.45Å; L389-V408 WeakPolarHBondContact O-CA 3.4Å; R390-V408 HydrophobicContact CG-CG2 4.48Å; P405-V408 HydrophobicContact CB-CG2 4.16Å; P405-V408 HydrophobicContact CG-CG2 4.01Å
409	L	75.8	Confident	69.5	Low	73 Å²	73	77.4 Å²	77.4	38%	0.382	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	136.7	-176.5	-165.2	76.8	0	0	0	109.7	K388 L389 R411 P532	K388-L409 CarbonylContact C-O 3.51Å; K388-L409 WeakPolarHBondContact CA-O 3.48Å; L389-L409 HydrophobicContact CB-CB 4.48Å; L389-L409 PolarHBondContact N-O 3.14Å; L389-L409 PolarHBondContact O-N 3.4Å; L409-R411 PolarHBondContact O-N 3.33Å; L409-P532 HydrophobicContact CD2-CG 4.36Å
410	P	73.1	Confident	68.6	Low	90 Å²	90	78.6 Å²	78.6	58%	0.584	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.6	136.5	167.1	27.3	-33.3	0	0	0	109.8	K412	P410-K412 PolarHBondContact O-N 3.17Å
411	R	66.3	Low	67.4	Low	61 Å²	61	80.7 Å²	80.7	23%	0.23	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-70.4	117.1	173.9	177.2	-179.6	158.5	146.7	1	109	E387 L389 L409 D413 W526 R527	E387-R411 VanDerWaalsContact O-CB 3.27Å; E387-R411 WeakPolarHBondContact O-CB 3.5Å; L389-R411 HydrophobicContact CG-CB 4.33Å; L409-R411 PolarHBondContact O-N 3.33Å; R411-D413 IonicContact CZ-OD1 3.49Å; R411-D413 IonicContact NE-OD1 3.85Å; R411-D413 PolarHBondContact NE-OD1 3Å; R411-D413 IonicContact NH2-OD1 2.78Å; R411-D413 PolarHBondContact NH2-OD1 3.46Å; R411-D413 PolarHBondContact O-N 3.5Å; R411-W526 PolarHBondContact NH1-O 3Å; R411-W526 PolarHBondContact NH2-O 2.63Å; R411-R527 PolarHBondContact NH1-O 3.44Å
412	K	62.9	Low	66.2	Low	182 Å²	182	83.9 Å²	83.9	79%	0.791	45%	0.451	S	S	*	.			trans	-80.3	111	166.7	-78	-175.3	179.6	178.5	0	108.5	P410 S414	P410-K412 PolarHBondContact O-N 3.17Å; K412-S414 PolarHBondContact O-N 3.02Å
413	D	56.7	Low	64.9	Low	87 Å²	87	85.7 Å²	85.7	47%	0.465	46%	0.459	S	S	.	.			trans	-74.1	118.7	177.3	-116.6	9.1	0	0	0	109.7	R411 G415	R411-D413 IonicContact CZ-OD1 3.49Å; R411-D413 IonicContact NE-OD1 3.85Å; R411-D413 PolarHBondContact NE-OD1 3Å; R411-D413 IonicContact NH2-OD1 2.78Å; R411-D413 PolarHBondContact NH2-OD1 3.46Å; R411-D413 PolarHBondContact O-N 3.5Å; D413-G415 PolarHBondContact O-N 3.08Å; D413-G415 VanDerWaalsContact O-N 3.17Å
414	S	53.7	Low	63.6	Low	24 Å²	24	87.4 Å²	87.4	17%	0.168	47%	0.469	C	S	.	.			trans	-76.5	97.5	166.3	45.9	0	0	0	0	107.7	K412 H416 L417	K412-S414 PolarHBondContact O-N 3.02Å; S414-H416 PolarHBondContact O-N 3Å; S414-L417 PolarHBondContact O-N 2.74Å
415	G	54.1	Low	61.8	Low	51 Å²	51	85.2 Å²	85.2	53%	0.526	46%	0.461	S	S	.	.	H	α-helix	trans	-51.3	-15.7	-174.5	0	0	0	0	0	116.1	D413 L417 R418 A419	D413-G415 PolarHBondContact O-N 3.08Å; D413-G415 VanDerWaalsContact O-N 3.17Å; G415-L417 PolarHBondContact O-N 3.5Å; G415-R418 PolarHBondContact O-N 2.97Å; G415-A419 PolarHBondContact O-N 2.7Å; G415-A419 VanDerWaalsContact O-N 3.15Å
416	H	58.2	Low	59.9	Low	161 Å²	161	87.1 Å²	87.1	75%	0.745	47%	0.474	S	S	*	.	H	α-helix	trans	-61.5	-38.8	178.2	-60.7	-69.1	0	0	0	115	S414 A419 A420	S414-H416 PolarHBondContact O-N 3Å; H416-A419 PolarHBondContact O-N 2.92Å; H416-A420 PolarHBondContact O-N 3.46Å
417	L	57.9	Low	57.9	Low	29 Å²	29	90.2 Å²	90.2	15%	0.152	49%	0.492	C	S	.	.	H	α-helix	trans	-76.3	-30.2	-178.9	-88.7	153.5	0	0	0	112.7	S414 G415 A420 L421	S414-L417 PolarHBondContact O-N 2.74Å; G415-L417 PolarHBondContact O-N 3.5Å; L417-A420 PolarHBondContact O-N 3.36Å; L417-L421 PolarHBondContact O-N 3.46Å; L417-L421 VanDerWaalsContact O-N 3.08Å
418	R	55.3	Low	55.8	Low	177 Å²	177	93.9 Å²	93.9	67%	0.668	51%	0.512	S	S	*	.	H	α-helix	trans	-69.4	-39.2	173.1	-163.6	170	-174.1	161	-2.3	110.9	G415 L421 C422	G415-R418 PolarHBondContact O-N 2.97Å; R418-L421 PolarHBondContact O-N 3.49Å; R418-C422 PolarHBondContact O-N 3.41Å; R418-C422 PolarHBondContact O-SG 3.18Å; R418-C422 VanDerWaalsContact O-SG 3.41Å
419	A	54.8	Low	53.6	Low	53 Å²	53	98 Å²	98	44%	0.438	53%	0.532	S	S	.	.	H	α-helix	trans	-65.3	-41.2	172.5	0	0	0	0	0	112.6	G415 H416 L421 C422 L423	G415-A419 PolarHBondContact O-N 2.7Å; G415-A419 VanDerWaalsContact O-N 3.15Å; H416-A419 PolarHBondContact O-N 2.92Å; A419-L421 VanDerWaalsContact C-N 3.35Å; A419-L421 PolarHBondContact O-N 2.91Å; A419-C422 WeakPolarHBondContact O-CB 3.2Å; A419-C422 PolarHBondContact O-N 2.92Å; A419-L423 PolarHBondContact O-N 3.2Å; A419-L423 VanDerWaalsContact O-N 3.17Å
420	A	59.3	Low	51.3	Low	39 Å²	39	99 Å²	99	32%	0.322	55%	0.55	S	S	.	.	H	α-helix	trans	-64.2	-36.1	175.7	0	0	0	0	0	113	H416 L417 C422 L423 L424	H416-A420 PolarHBondContact O-N 3.46Å; L417-A420 PolarHBondContact O-N 3.36Å; A420-C422 VanDerWaalsContact C-N 3.35Å; A420-L423 PolarHBondContact O-N 3.07Å; A420-L424 WeakPolarHBondContact O-CG 3.43Å; A420-L424 PolarHBondContact O-N 2.81Å
421	L	57.7	Low	49.3	Very low	49 Å²	49	103.3 Å²	103.3	26%	0.257	57%	0.568	S	S	.	*	H	α-helix	trans	-64.7	-36.1	172.7	-84.7	167.7	0	0	0	113	L417 R418 A419 L423 L424 P482 L486	L417-L421 PolarHBondContact O-N 3.46Å; L417-L421 VanDerWaalsContact O-N 3.08Å; R418-L421 PolarHBondContact O-N 3.49Å; A419-L421 VanDerWaalsContact C-N 3.35Å; A419-L421 PolarHBondContact O-N 2.91Å; L421-L423 VanDerWaalsContact C-N 3.34Å; L421-L424 PolarHBondContact O-N 3.36Å; L421-P482 HydrophobicContact CD2-CB 4.22Å; L421-L486 HydrophobicContact CD1-CD1 3.78Å; L421-L486 HydrophobicContact CD2-CD1 3.7Å; L421-L486 HydrophobicContact CD2-CD2 3.88Å; L421-L486 HydrophobicContact CD2-CG 3.72Å; L421-L486 HydrophobicContact CG-CD1 3.79Å; L421-L486 HydrophobicContact CG-CD2 4.05Å; L421-L486 HydrophobicContact CG-CG 4.19Å
422	C	54.7	Low	47.4	Very low	79 Å²	79	104.8 Å²	104.8	53%	0.534	59%	0.594	S	S	.	*	H	α-helix	trans	-66.9	-34.6	174.9	-70.5	0	0	0	0	112.1	R418 A419 A420 L424	R418-C422 PolarHBondContact O-N 3.41Å; R418-C422 PolarHBondContact O-SG 3.18Å; R418-C422 VanDerWaalsContact O-SG 3.41Å; A419-C422 WeakPolarHBondContact O-CB 3.2Å; A419-C422 PolarHBondContact O-N 2.92Å; A420-C422 VanDerWaalsContact C-N 3.35Å; C422-L424 VanDerWaalsContact C-N 3.3Å; C422-L424 PolarHBondContact O-N 2.84Å
423	L	53.4	Low	45.8	Very low	155 Å²	155	104.8 Å²	104.8	81%	0.812	60%	0.596	S	S	*	*	H	α-helix	trans	-73.7	-18.6	175.9	-68.4	169.5	0	0	0	113.7	A419 A420 L421	A419-L423 PolarHBondContact O-N 3.2Å; A419-L423 VanDerWaalsContact O-N 3.17Å; A420-L423 PolarHBondContact O-N 3.07Å; L421-L423 VanDerWaalsContact C-N 3.34Å
424	L	54.9	Low	44.4	Very low	70 Å²	70	106 Å²	106	37%	0.366	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.2	17.6	178.6	-70.9	166.7	0	0	0	113.2	A420 L421 C422 R485 L486	A420-L424 WeakPolarHBondContact O-CG 3.43Å; A420-L424 PolarHBondContact O-N 2.81Å; L421-L424 PolarHBondContact O-N 3.36Å; C422-L424 VanDerWaalsContact C-N 3.3Å; C422-L424 PolarHBondContact O-N 2.84Å; L424-R485 PolarHBondContact O-NH1 2.75Å; L424-L486 HydrophobicContact CD1-CD2 4.49Å
425	Q	40.9	Very low	43.3	Very low	141 Å²	141	111 Å²	111	66%	0.659	64%	0.641	S	S	*	*			trans	-72.1	136.1	173.2	-76	-175.6	-35.7	0	0	110.8
426	P	40.7	Very low	42	Very low	82 Å²	82	117.3 Å²	117.3	53%	0.532	66%	0.657	S	S	.	*			trans	-73.8	150.4	157	32.1	-30.6	0	0	0	109.3	V428	P426-V428 PolarHBondContact O-N 3.01Å
427	D	31.2	Very low	40.8	Very low	163 Å²	163	117.8 Å²	117.8	87%	0.872	67%	0.665	S	S	*	*			trans	-44.7	125.4	168.9	-74.9	-48.9	0	0	0	110.8	N429	D427-N429 PolarHBondContact O-N 3.21Å; D427-N429 VanDerWaalsContact O-N 3.08Å
428	V	32.8	Very low	39.4	Very low	133 Å²	133	125.1 Å²	125.1	81%	0.806	70%	0.698	S	S	*	*			trans	-72.1	99.1	167.3	177.3	0	0	0	0	106.7	P426	P426-V428 PolarHBondContact O-N 3.01Å
429	N	31.1	Very low	38	Very low	160 Å²	160	126 Å²	126	86%	0.856	71%	0.707	S	S	*	*			trans	-158.7	88.5	152.7	-94.8	-20.1	0	0	0	109.2	D427	D427-N429 PolarHBondContact O-N 3.21Å; D427-N429 VanDerWaalsContact O-N 3.08Å
430	A	28.1	Very low	36.8	Very low	92 Å²	92	129.1 Å²	129.1	76%	0.76	72%	0.722	S	S	*	*			trans	-164.1	113.7	154.7	0	0	0	0	0	108.4	A432	A430-A432 PolarHBondContact O-N 2.76Å
431	D	31.4	Very low	35.4	Very low	181 Å²	181	133.7 Å²	133.7	97%	0.968	75%	0.746	S	S	*	*			trans	-54.2	120.2	160.3	-80.3	-48.1	0	0	0	109.1
432	A	26.7	Very low	34.2	Very low	93 Å²	93	136.9 Å²	136.9	77%	0.769	77%	0.77	S	S	*	*			trans	-145.7	118.6	168.2	0	0	0	0	0	109.9	A430	A430-A432 PolarHBondContact O-N 2.76Å
433	Q	28.2	Very low	33.1	Very low	181 Å²	181	140.1 Å²	140.1	85%	0.846	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-53.8	157.5	171.2	-91	147.1	-68.7	0	0	113.1
434	P	28.5	Very low	32.4	Very low	112 Å²	112	138.4 Å²	138.4	73%	0.727	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-62.4	137	-176.3	25.1	-33.2	0	0	0	111.4	Q436	P434-Q436 PolarHBondContact O-N 3.44Å
435	P	29.6	Very low	31.9	Very low	130 Å²	130	144.4 Å²	144.4	84%	0.844	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-69.7	123.5	170.2	2.5	10.4	0	0	0	109.3
436	Q	27.5	Very low	32.3	Very low	184 Å²	184	146.7 Å²	146.7	86%	0.86	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-57.6	147.3	166.5	-76.2	176.8	-37.7	0	0	111.4	P434 Q438	P434-Q436 PolarHBondContact O-N 3.44Å; Q436-Q438 PolarHBondContact O-N 2.99Å
437	D	32.9	Very low	33.2	Very low	170 Å²	170	154.2 Å²	154.2	91%	0.909	82%	0.824	S	S	*	*			trans	-43.7	101.3	170	-81	-52.7	0	0	0	112.4
438	Q	27.5	Very low	35	Very low	184 Å²	184	152.1 Å²	152.1	86%	0.86	81%	0.809	S	S	*	*			trans	-101.7	95	161.2	-78.1	-175.7	0.5	0	0	109	Q436	Q436-Q438 PolarHBondContact O-N 2.99Å
439	K	26.3	Very low	37.3	Very low	196 Å²	196	146.2 Å²	146.2	85%	0.852	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-55.4	122.1	161.6	-148.3	174.8	-169.2	176.2	0	107.6	T441	K439-T441 PolarHBondContact O-N 2.96Å
440	P	30.2	Very low	39.6	Very low	117 Å²	117	142.6 Å²	142.6	76%	0.76	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-62.9	125.6	171.1	-12.7	25.5	0	0	0	108.1
441	T	28.7	Very low	42.2	Very low	135 Å²	135	139.4 Å²	139.4	83%	0.828	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-55.4	129	166.6	13.4	0	0	0	0	108.8	K439 D443	K439-T441 PolarHBondContact O-N 2.96Å; T441-D443 PolarHBondContact O-N 2.98Å; T441-D443 VanDerWaalsContact O-N 3.16Å
442	P	32.9	Very low	44.9	Very low	117 Å²	117	131 Å²	131	76%	0.76	70%	0.697	S	S	*	*			trans	-72.7	112.4	-179.7	27.3	-30.1	0	0	0	109.4
443	D	32.6	Very low	47.7	Very low	146 Å²	146	130 Å²	130	78%	0.781	68%	0.676	S	S	*	*			trans	-68.1	119.6	166.2	-152.5	-9.1	0	0	0	108.2	T441 K445	T441-D443 PolarHBondContact O-N 2.98Å; T441-D443 VanDerWaalsContact O-N 3.16Å; D443-K445 PolarHBondContact O-N 2.97Å
444	P	38.8	Very low	50.4	Low	119 Å²	119	122 Å²	122	77%	0.773	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	18.4	-159.4	-14.6	29.9	0	0	0	116.2
445	K	43.8	Very low	53	Low	197 Å²	197	118.9 Å²	118.9	86%	0.857	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.6	36.3	-171.3	-70.6	-172.9	-179.7	176.3	0	115.6	D443	D443-K445 PolarHBondContact O-N 2.97Å
446	R	49.4	Very low	55.6	Low	189 Å²	189	115.7 Å²	115.7	71%	0.713	61%	0.608	S	S	*	*			trans	-129.2	110.2	161.7	-73.4	-174.9	180	-171.1	-0.9	110.8	Q448	R446-Q448 PolarHBondContact O-N 2.81Å
447	R	58.3	Low	58.4	Low	240 Å²	240	107.4 Å²	107.4	91%	0.906	57%	0.57	S	S	*	*			trans	-67.3	112.3	171.9	-72.6	-176.7	-177.7	-176.1	0.7	108.9
448	Q	69.9	Low	60.7	Low	118 Å²	118	102.2 Å²	102.2	55%	0.551	55%	0.545	S	S	*	.			trans	-72.7	131.5	178.2	-175	173.4	-12.4	0	0	110.8	R446 C452	R446-Q448 PolarHBondContact O-N 2.81Å; Q448-C452 HydrophobicContact CG-CB 4.2Å; Q448-C452 PolarHBondContact NE2-O 3.26Å
449	P	81.7	Confident	63	Low	10 Å²	10	97.6 Å²	97.6	7%	0.065	53%	0.532	C	S	.	.			trans	-67.3	138.6	174.3	-15.5	27.6	0	0	0	111.5	W451 C452 C457	P449-W451 HydrophobicContact CB-CD2 4.15Å; P449-W451 HydrophobicContact CB-CG 4.32Å; P449-W451 HydrophobicContact CB-CZ2 3.98Å; P449-W451 HydrophobicContact CG-CZ2 4.08Å; P449-W451 PolarHBondContact O-N 3.48Å; P449-C452 HydrophobicContact CB-CB 4.46Å; P449-C452 VanDerWaalsContact O-CB 3.31Å; P449-C452 WeakPolarHBondContact O-CB 3.27Å; P449-C452 PolarHBondContact O-N 3.36Å; P449-C457 VanDerWaalsContact CD-O 3.32Å; P449-C457 WeakPolarHBondContact CD-O 3.4Å
450	G	78	Confident	65.2	Low	83 Å²	83	89.8 Å²	89.8	86%	0.856	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-15.5	-178.2	0	0	0	0	0	115.7
451	W	83.9	Confident	67	Low	25 Å²	25	89.2 Å²	89.2	10%	0.095	51%	0.507	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-7.3	174.6	56.1	-102	0	0	0	113.8	Q401 P449 C457 E466 L467 C468	Q401-W451 HydrophobicContact CB-CB 4.4Å; P449-W451 HydrophobicContact CB-CD2 4.15Å; P449-W451 HydrophobicContact CB-CG 4.32Å; P449-W451 HydrophobicContact CB-CZ2 3.98Å; P449-W451 HydrophobicContact CG-CZ2 4.08Å; P449-W451 PolarHBondContact O-N 3.48Å; W451-C457 HydrophobicContact CH2-CB 3.67Å; W451-C457 HydrophobicContact CZ3-CB 3.88Å; W451-E466 HydrophobicContact CD2-CB 4.04Å; W451-E466 HydrophobicContact CG-CB 4.38Å; W451-E466 HydrophobicContact CZ2-CB 3.99Å; W451-E466 HydrophobicContact CZ2-CG 4.11Å; W451-L467 VanDerWaalsContact CZ3-C 3.41Å; W451-L467 WeakPolarHBondContact CZ3-O 3.42Å; W451-C468 HydrophobicContact CE3-CB 4.28Å; W451-C468 HydrophobicContact CZ3-CB 4.26Å
452	C	87.1	Confident	69.3	Low	5 Å²	5	86.9 Å²	86.9	3%	0.034	49%	0.489	C	S	.	.			trans	-84.5	128.3	-177.4	179.1	0	0	0	0	112.2	Q448 P449 G455 C457	Q448-C452 HydrophobicContact CG-CB 4.2Å; Q448-C452 PolarHBondContact NE2-O 3.26Å; P449-C452 HydrophobicContact CB-CB 4.46Å; P449-C452 VanDerWaalsContact O-CB 3.31Å; P449-C452 WeakPolarHBondContact O-CB 3.27Å; P449-C452 PolarHBondContact O-N 3.36Å; C452-G455 PolarHBondContact SG-N 2.86Å; C452-G455 VanDerWaalsContact SG-N 3.39Å; C452-C457 HydrophobicContact CB-CB 3.89Å; C452-C457 WeakPolarHBondContact SG-CB 3.49Å
453	K	85.9	Confident	71.3	Confident	73 Å²	73	82.7 Å²	82.7	32%	0.317	46%	0.463	S	S	.	.	S	Bend	trans	-109.8	-4.7	179.8	-60.1	-64.7	-177.5	-179	0	114.8	C468 R470 D473 G474	K453-C468 PolarHBondContact N-SG 3.32Å; K453-R470 HydrophobicContact CB-CG 4.46Å; K453-D473 WeakPolarHBondContact CD-OD1 3.39Å; K453-D473 IonicContact NZ-OD1 3.8Å; K453-D473 IonicContact NZ-OD2 3.69Å; K453-D473 WeakPolarHBondContact O-CA 3.46Å; K453-G474 PolarHBondContact O-N 3.32Å
454	C	85.3	Confident	73.3	Confident	12 Å²	12	76.7 Å²	76.7	8%	0.081	43%	0.43	C	S	.	.	S	Bend	trans	-110.8	-4.4	-177	73.4	0	0	0	0	114.7	C456 C457 R470 G474 C476	C454-C456 PolarHBondContact O-N 3.08Å; C454-C456 VanDerWaalsContact O-N 3.15Å; C454-C457 VanDerWaalsContact SG-SG 3.7Å; C454-R470 HydrophobicContact CB-CG 4.01Å; C454-G474 WeakPolarHBondContact CA-O 3.3Å; C454-C476 HydrophobicContact CB-CB 3.94Å
455	G	81.6	Confident	75.2	Confident	46 Å²	46	73.2 Å²	73.2	47%	0.474	40%	0.403	S	S	.	.	S	Bend	trans	76.3	-15.7	-176.8	0	0	0	0	0	116.2	C452	C452-G455 PolarHBondContact SG-N 2.86Å; C452-G455 VanDerWaalsContact SG-N 3.39Å
456	C	84.8	Confident	77.1	Confident	64 Å²	64	65.8 Å²	65.8	43%	0.432	37%	0.371	S	S	.	.			trans	-105.7	16.2	-171.6	-54.7	0	0	0	0	115.7	C454 C476 C542 Q545	C454-C456 PolarHBondContact O-N 3.08Å; C454-C456 VanDerWaalsContact O-N 3.15Å; C456-C476 HydrophobicContact CB-CB 4.29Å; C456-C542 HydrophobicContact CB-CB 3.96Å; C456-C542 WeakPolarHBondContact O-CA 3.4Å; C456-C542 WeakPolarHBondContact O-CB 3.45Å; C456-Q545 PolarHBondContact O-OE1 3.16Å
457	C	85.6	Confident	79	Confident	10 Å²	10	56.8 Å²	56.8	7%	0.068	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-97.2	149.2	-179.4	-62	0	0	0	0	112.8	P449 W451 C452 C454	P449-C457 VanDerWaalsContact CD-O 3.32Å; P449-C457 WeakPolarHBondContact CD-O 3.4Å; W451-C457 HydrophobicContact CH2-CB 3.67Å; W451-C457 HydrophobicContact CZ3-CB 3.88Å; C452-C457 HydrophobicContact CB-CB 3.89Å; C452-C457 WeakPolarHBondContact SG-CB 3.49Å; C454-C457 VanDerWaalsContact SG-SG 3.7Å
458	T	81.7	Confident	80.5	Confident	61 Å²	61	45.3 Å²	45.3	37%	0.374	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-101.9	151.1	169.8	45.7	0	0	0	0	112.6	S541	T458-S541 PolarHBondContact N-OG 2.83Å; T458-S541 PolarHBondContact O-OG 3.26Å
459	S	75.5	Confident	81.4	Confident	86 Å²	86	39.9 Å²	39.9	60%	0.601	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-64.5	133.9	172.2	-58.9	0	0	0	0	110.9
460	S	73.4	Confident	81.7	Confident	33 Å²	33	41.3 Å²	41.3	23%	0.231	27%	0.273	C	S	.	.			trans	-118.6	152.4	170.7	-179.2	0	0	0	0	109.7	L462 E465	S460-L462 VanDerWaalsContact C-N 3.27Å; S460-L462 PolarHBondContact OG-N 3.39Å; S460-E465 PolarHBondContact OG-OE2 3.5Å
461	A	68.1	Low	82	Confident	104 Å²	104	42.6 Å²	42.6	86%	0.86	25%	0.252	S	S	*	.	S	Bend	trans	-77.6	-13.4	175.7	0	0	0	0	0	112.9
462	L	76.5	Confident	82.1	Confident	86 Å²	86	44.5 Å²	44.5	45%	0.45	27%	0.27	S	S	.	.	S	Bend	trans	-104.5	120	-177.4	-70	172.6	0	0	0	110.9	S460 Q464 E465	S460-L462 VanDerWaalsContact C-N 3.27Å; S460-L462 PolarHBondContact OG-N 3.39Å; L462-Q464 PolarHBondContact O-N 3.37Å; L462-E465 HydrophobicContact CB-CG 4.16Å; L462-E465 PolarHBondContact O-N 2.81Å
463	P	75.3	Confident	81.9	Confident	30 Å²	30	49.8 Å²	49.8	20%	0.195	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.9	179	-25.9	34.2	0	0	0	114.6	K398 L400 E465	K398-P463 WeakPolarHBondContact O-CB 3.4Å; L400-P463 PolarHBondContact N-O 3.22Å; P463-E465 VanDerWaalsContact C-N 3.33Å
464	Q	73.9	Confident	81.9	Confident	20 Å²	20	48 Å²	48	9%	0.093	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-19.1	177.2	-57.4	85.9	5.2	0	0	113.3	R394 S395 L400 L462	R394-Q464 HydrophobicContact CG-CG 4.14Å; S395-Q464 PolarHBondContact O-NE2 3.29Å; L400-Q464 WeakPolarHBondContact CD2-O 3.37Å; L462-Q464 PolarHBondContact O-N 3.37Å
465	E	78.4	Confident	82	Confident	45 Å²	45	51 Å²	51	21%	0.21	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-6.3	178.3	-60	-173.4	161.6	0	0	112.1	S460 L462 P463 L467 G560 F561	S460-E465 PolarHBondContact OG-OE2 3.5Å; L462-E465 HydrophobicContact CB-CG 4.16Å; L462-E465 PolarHBondContact O-N 2.81Å; P463-E465 VanDerWaalsContact C-N 3.33Å; E465-L467 PolarHBondContact O-N 2.86Å; E465-G560 WeakPolarHBondContact OE1-CA 3.32Å; E465-F561 PolarHBondContact OE1-N 3.39Å
466	E	85.4	Confident	82.3	Confident	41 Å²	41	49.3 Å²	49.3	19%	0.192	31%	0.306	C	S	.	.			trans	-78.8	71.3	175.4	-60.9	-174.2	145.2	0	0	111.1	S399 Q401 W451	S399-E466 VanDerWaalsContact CA-OE2 3.26Å; S399-E466 WeakPolarHBondContact CA-OE2 3.14Å; S399-E466 WeakPolarHBondContact CB-OE2 3.42Å; S399-E466 VanDerWaalsContact OG-CB 3.22Å; S399-E466 WeakPolarHBondContact OG-CB 3.43Å; S399-E466 PolarHBondContact OG-O 3.34Å; S399-E466 PolarHBondContact OG-OE2 2.97Å; Q401-E466 PolarHBondContact N-O 3.47Å; Q401-E466 VanDerWaalsContact N-O 3.15Å; W451-E466 HydrophobicContact CD2-CB 4.04Å; W451-E466 HydrophobicContact CG-CB 4.38Å; W451-E466 HydrophobicContact CZ2-CB 3.99Å; W451-E466 HydrophobicContact CZ2-CG 4.11Å
467	L	88.1	Confident	82.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	29%	0.289	C	S	.	.			trans	-129.5	127.8	179.2	-179.6	67.7	0	0	0	111	V381 Y383 L400 W451 E465 V538 P540 S541	V381-L467 HydrophobicContact CG1-CD1 3.44Å; V381-L467 VanDerWaalsContact CG1-CD1 3.44Å; V381-L467 HydrophobicContact CG1-CD2 3.87Å; V381-L467 HydrophobicContact CG1-CG 4.29Å; Y383-L467 HydrophobicContact CE1-CD1 3.85Å; Y383-L467 WeakPolarHBondContact OH-CD1 3.31Å; L400-L467 HydrophobicContact CD2-CB 4.26Å; L400-L467 HydrophobicContact CD2-CD1 4.49Å; L400-L467 HydrophobicContact CD2-CD2 4.28Å; L400-L467 HydrophobicContact CG-CD1 4.47Å; W451-L467 VanDerWaalsContact CZ3-C 3.41Å; W451-L467 WeakPolarHBondContact CZ3-O 3.42Å; E465-L467 PolarHBondContact O-N 2.86Å; L467-V538 HydrophobicContact CD2-CB 4.16Å; L467-V538 HydrophobicContact CD2-CG1 3.9Å; L467-P540 HydrophobicContact CD2-CG 4.28Å; L467-P540 HydrophobicContact CG-CB 4.5Å; L467-P540 WeakPolarHBondContact O-CA 3.46Å; L467-S541 PolarHBondContact O-N 2.84Å
468	C	89.9	Confident	82.4	Confident	0 Å²	0	47 Å²	47	0%	0	29%	0.29	C	S	.	.			trans	-95.1	154.9	172.5	-164	0	0	0	0	110.5	Y383 W451 K453 R470	Y383-C468 WeakPolarHBondContact CE1-O 3.44Å; W451-C468 HydrophobicContact CE3-CB 4.28Å; W451-C468 HydrophobicContact CZ3-CB 4.26Å; K453-C468 PolarHBondContact N-SG 3.32Å; C468-R470 PolarHBondContact O-N 2.83Å
469	C	88.6	Confident	82.6	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.02	30%	0.302	C	S	.	.	S	Bend	trans	-70.8	-12.3	177.5	56.7	0	0	0	0	113.2	Y383 V384 I477 P540	Y383-C469 WeakPolarHBondContact CA-O 3.42Å; V384-C469 PolarHBondContact N-O 3.41Å; C469-I477 HydrophobicContact CB-CB 4.2Å; C469-I477 HydrophobicContact CB-CG2 3.47Å; C469-I477 VanDerWaalsContact CB-CG2 3.47Å; C469-P540 HydrophobicContact CB-CB 4.03Å; C469-P540 HydrophobicContact CB-CG 4.01Å
470	R	87.8	Confident	83.1	Confident	40 Å²	40	45.7 Å²	45.7	15%	0.151	28%	0.284	C	S	.	.			trans	-141.3	165.3	-177.5	33.1	-179.9	34.1	172.6	-12.5	113.4	D385 Q401 K453 C454 C468 S472 G474 A475	D385-R470 IonicContact OD1-CZ 2.73Å; D385-R470 IonicContact OD1-NE 3.84Å; D385-R470 PolarHBondContact OD1-NE 2.81Å; D385-R470 IonicContact OD1-NH2 3.18Å; D385-R470 PolarHBondContact OD1-NH2 3.17Å; D385-R470 WeakPolarHBondContact OD2-CA 3.44Å; D385-R470 WeakPolarHBondContact OD2-CB 3.08Å; Q401-R470 PolarHBondContact NE2-O 2.87Å; K453-R470 HydrophobicContact CB-CG 4.46Å; C454-R470 HydrophobicContact CB-CG 4.01Å; C468-R470 PolarHBondContact O-N 2.83Å; R470-S472 WeakPolarHBondContact CD-O 3.32Å; R470-G474 WeakPolarHBondContact CD-O 3.28Å; R470-G474 VanDerWaalsContact NH1-CA 3.3Å; R470-G474 PolarHBondContact NH1-O 3.03Å; R470-A475 WeakPolarHBondContact CD-O 3.43Å; R470-A475 PolarHBondContact NE-O 3.28Å; R470-A475 PolarHBondContact NH1-O 3.36Å
471	R	85.9	Confident	83.6	Confident	110 Å²	110	48.7 Å²	48.7	42%	0.415	30%	0.303	S	S	.	.	S	Bend	trans	-106.6	-32.4	178.3	-63.1	-168.5	75.2	-151	-7.2	112.5	Y383 D385 E386 R390	Y383-R471 HydrophobicContact CD1-CG 3.59Å; Y383-R471 HydrophobicContact CD2-CG 3.76Å; Y383-R471 HydrophobicContact CE1-CG 3.74Å; Y383-R471 HydrophobicContact CE2-CG 3.91Å; Y383-R471 HydrophobicContact CG-CG 3.59Å; D385-R471 PolarHBondContact OD2-N 3.43Å; E386-R471 WeakPolarHBondContact OE1-CD 3.46Å; E386-R471 IonicContact OE1-CZ 3.9Å; E386-R471 IonicContact OE1-NE 3.93Å; E386-R471 IonicContact OE1-NH1 3.35Å; E386-R471 PolarHBondContact OE1-NH1 2.83Å; R390-R471 VanDerWaalsContact CZ-NH1 3.34Å
472	S	85.3	Confident	84.3	Confident	66 Å²	66	45.7 Å²	45.7	46%	0.462	27%	0.274	S	S	.	.	S	Bend	trans	-97.5	158.3	170	46.4	0	0	0	0	111.1	D385 R470	D385-S472 PolarHBondContact OD2-N 3.3Å; D385-S472 PolarHBondContact OD2-OG 3.27Å; R470-S472 WeakPolarHBondContact CD-O 3.32Å
473	D	83.6	Confident	84.8	Confident	115 Å²	115	41.6 Å²	41.6	62%	0.615	25%	0.253	S	S	*	.	S	Bend	trans	-68.3	137.7	179.6	-66.2	-56.3	0	0	0	111.8	K453	K453-D473 WeakPolarHBondContact CD-OD1 3.39Å; K453-D473 IonicContact NZ-OD1 3.8Å; K453-D473 IonicContact NZ-OD2 3.69Å; K453-D473 WeakPolarHBondContact O-CA 3.46Å
474	G	84.9	Confident	85.3	Confident	36 Å²	36	49.3 Å²	49.3	37%	0.371	28%	0.278	S	S	.	.			trans	162.6	-171.4	173.4	0	0	0	0	0	114.9	K453 C454 R470	K453-G474 PolarHBondContact O-N 3.32Å; C454-G474 WeakPolarHBondContact CA-O 3.3Å; R470-G474 WeakPolarHBondContact CD-O 3.28Å; R470-G474 VanDerWaalsContact NH1-CA 3.3Å; R470-G474 PolarHBondContact NH1-O 3.03Å
475	A	86.8	Confident	85.7	Confident	76 Å²	76	53.4 Å²	53.4	63%	0.628	29%	0.292	S	S	*	.			trans	-45.1	143.8	177	0	0	0	0	0	116.5	R470	R470-A475 WeakPolarHBondContact CD-O 3.43Å; R470-A475 PolarHBondContact NE-O 3.28Å; R470-A475 PolarHBondContact NH1-O 3.36Å
476	C	88.3	Confident	85.9	Confident	9 Å²	9	51.5 Å²	51.5	6%	0.061	28%	0.284	C	S	.	.			trans	-83.5	144.5	-178.6	-172.4	0	0	0	0	112.3	C454 C456 A478 S479 C542	C454-C476 HydrophobicContact CB-CB 3.94Å; C456-C476 HydrophobicContact CB-CB 4.29Å; C476-A478 PolarHBondContact O-N 3.44Å; C476-A478 PolarHBondContact SG-N 3.49Å; C476-A478 VanDerWaalsContact SG-N 3.43Å; C476-S479 PolarHBondContact O-N 3.1Å; C476-S479 PolarHBondContact O-OG 3.46Å; C476-C542 VanDerWaalsContact SG-SG 3.69Å
477	I	87.9	Confident	86	Confident	14 Å²	14	49.6 Å²	49.6	7%	0.072	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-63.7	-31.6	172.1	-164.2	-179.2	0	0	0	111.9	V384 C469 S479 S480 F483 F523 W526 R527 C543	V384-I477 HydrophobicContact CG2-CB 3.87Å; V384-I477 HydrophobicContact CG2-CD1 3.72Å; V384-I477 HydrophobicContact CG2-CG1 4Å; C469-I477 HydrophobicContact CB-CB 4.2Å; C469-I477 HydrophobicContact CB-CG2 3.47Å; C469-I477 VanDerWaalsContact CB-CG2 3.47Å; I477-S479 PolarHBondContact O-N 3.46Å; I477-S480 VanDerWaalsContact O-CB 3.28Å; I477-S480 WeakPolarHBondContact O-CB 3.25Å; I477-S480 PolarHBondContact O-N 3.34Å; I477-S480 VanDerWaalsContact O-N 3.07Å; I477-S480 PolarHBondContact O-OG 3.1Å; I477-F483 WeakPolarHBondContact O-CB 3.46Å; I477-F523 HydrophobicContact CD1-CE2 4.18Å; I477-W526 HydrophobicContact CD1-CH2 3.94Å; I477-W526 HydrophobicContact CD1-CZ3 3.86Å; I477-W526 HydrophobicContact CG1-CH2 4.12Å; I477-W526 HydrophobicContact CG1-CZ3 4.27Å; I477-R527 HydrophobicContact CD1-CG 4.47Å; I477-C543 WeakPolarHBondContact CG2-SG 3.26Å
478	A	85.7	Confident	85.9	Confident	12 Å²	12	50.2 Å²	50.2	10%	0.099	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-69.7	-18.7	-177.9	0	0	0	0	0	113.1	C476 F483 R546	C476-A478 PolarHBondContact O-N 3.44Å; C476-A478 PolarHBondContact SG-N 3.49Å; C476-A478 VanDerWaalsContact SG-N 3.43Å; A478-F483 HydrophobicContact CB-CD1 4.4Å; A478-F483 HydrophobicContact CB-CE1 4.17Å; A478-F483 HydrophobicContact CB-CZ 4.27Å; A478-F483 WeakPolarHBondContact O-CD1 3.43Å; A478-R546 HydrophobicContact CB-CB 4.08Å; A478-R546 HydrophobicContact CB-CG 4.28Å
479	S	84.6	Confident	85.7	Confident	89 Å²	89	53.2 Å²	53.2	62%	0.622	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-90.5	-1.3	173.5	53.3	0	0	0	0	113.2	C476 I477	C476-S479 PolarHBondContact O-N 3.1Å; C476-S479 PolarHBondContact O-OG 3.46Å; I477-S479 PolarHBondContact O-N 3.46Å
480	S	86.2	Confident	85.5	Confident	30 Å²	30	59.1 Å²	59.1	21%	0.21	32%	0.316	C	S	.	.	S	Bend	trans	-75.8	143.1	-178.4	72.2	0	0	0	0	112	I477 P482 F483 R484	I477-S480 VanDerWaalsContact O-CB 3.28Å; I477-S480 WeakPolarHBondContact O-CB 3.25Å; I477-S480 PolarHBondContact O-N 3.34Å; I477-S480 VanDerWaalsContact O-N 3.07Å; I477-S480 PolarHBondContact O-OG 3.1Å; S480-P482 VanDerWaalsContact C-CD 3.47Å; S480-F483 WeakPolarHBondContact O-CB 3.47Å; S480-F483 PolarHBondContact O-N 3Å; S480-F483 VanDerWaalsContact O-N 3.12Å; S480-F483 WeakPolarHBondContact OG-CB 3.46Å; S480-F483 PolarHBondContact OG-N 3.34Å; S480-R484 PolarHBondContact O-N 3.39Å
481	P	83.8	Confident	85.2	Confident	97 Å²	97	66.6 Å²	66.6	63%	0.63	35%	0.345	S	S	*	.	H	α-helix	trans	-51.3	-42.9	173.2	-25.9	33.8	0	0	0	115.5	F483 R484 R485	P481-F483 VanDerWaalsContact C-N 3.31Å; P481-F483 PolarHBondContact O-N 2.88Å; P481-R484 PolarHBondContact O-N 3.11Å; P481-R485 PolarHBondContact O-N 3.44Å
482	P	84	Confident	85.1	Confident	40 Å²	40	63.5 Å²	63.5	26%	0.26	34%	0.336	S	S	.	.	H	α-helix	trans	-66.7	-29.8	178.2	24.9	-34.6	0	0	0	113	L421 S480 R484 R485 L486 W526	L421-P482 HydrophobicContact CD2-CB 4.22Å; S480-P482 VanDerWaalsContact C-CD 3.47Å; P482-R484 VanDerWaalsContact C-N 3.33Å; P482-R484 PolarHBondContact O-N 3.17Å; P482-R485 PolarHBondContact O-N 2.92Å; P482-L486 VanDerWaalsContact O-CB 3.3Å; P482-L486 WeakPolarHBondContact O-CB 3.34Å; P482-L486 WeakPolarHBondContact O-CG 3.34Å; P482-L486 PolarHBondContact O-N 3.33Å; P482-W526 HydrophobicContact CB-CH2 4.27Å; P482-W526 HydrophobicContact CB-CZ2 4Å; P482-W526 HydrophobicContact CG-CH2 4.18Å; P482-W526 HydrophobicContact CG-CZ2 4.09Å
483	F	86.4	Confident	85	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.1	-42.1	174.3	-172.8	-87.6	0	0	0	111	I477 A478 S480 P481 V487 L488 F523 W526 C543 R546 I547	I477-F483 WeakPolarHBondContact O-CB 3.46Å; A478-F483 HydrophobicContact CB-CD1 4.4Å; A478-F483 HydrophobicContact CB-CE1 4.17Å; A478-F483 HydrophobicContact CB-CZ 4.27Å; A478-F483 WeakPolarHBondContact O-CD1 3.43Å; S480-F483 WeakPolarHBondContact O-CB 3.47Å; S480-F483 PolarHBondContact O-N 3Å; S480-F483 VanDerWaalsContact O-N 3.12Å; S480-F483 WeakPolarHBondContact OG-CB 3.46Å; S480-F483 PolarHBondContact OG-N 3.34Å; P481-F483 VanDerWaalsContact C-N 3.31Å; P481-F483 PolarHBondContact O-N 2.88Å; F483-V487 HydrophobicContact CD2-CB 4.36Å; F483-V487 HydrophobicContact CD2-CG2 4.17Å; F483-V487 HydrophobicContact CE1-CG1 4.47Å; F483-V487 HydrophobicContact CE2-CB 4.32Å; F483-V487 HydrophobicContact CE2-CG1 4.14Å; F483-V487 HydrophobicContact CE2-CG2 4.35Å; F483-V487 HydrophobicContact CG-CB 4.47Å; F483-V487 HydrophobicContact CZ-CB 4.41Å; F483-V487 HydrophobicContact CZ-CG1 4.03Å; F483-V487 VanDerWaalsContact O-CB 3.29Å; F483-V487 WeakPolarHBondContact O-CB 3.49Å; F483-V487 PolarHBondContact O-N 2.7Å; F483-L488 HydrophobicContact CD1-CD1 3.91Å; F483-L488 HydrophobicContact CD1-CG 4.01Å; F483-L488 HydrophobicContact CE1-CD1 3.83Å; F483-L488 HydrophobicContact CE1-CD2 3.99Å; F483-L488 HydrophobicContact CE1-CG 3.8Å; F483-L488 PolarHBondContact O-N 3.19Å; F483-F523 HydrophobicContact CD2-CD2 4.12Å; F483-F523 HydrophobicContact CD2-CE2 4.2Å; F483-F523 AromaticContact CE2-CD2 3.65Å; F483-F523 HydrophobicContact CE2-CD2 3.65Å; F483-F523 AromaticContact CE2-CE2 3.84Å; F483-F523 HydrophobicContact CE2-CE2 3.84Å; F483-W526 HydrophobicContact CB-CZ3 4.35Å; F483-W526 HydrophobicContact CD2-CZ3 4.07Å; F483-C543 HydrophobicContact CE2-CB 3.84Å; F483-C543 HydrophobicContact CZ-CB 3.99Å; F483-R546 HydrophobicContact CE1-CB 4.15Å; F483-R546 HydrophobicContact CE1-CG 3.99Å; F483-R546 HydrophobicContact CZ-CB 4.48Å; F483-I547 HydrophobicContact CZ-CD1 4.25Å; F483-I547 HydrophobicContact CZ-CG1 4.01Å
484	R	84.9	Confident	84.9	Confident	192 Å²	192	57.5 Å²	57.5	73%	0.725	30%	0.297	S	S	*	.	I	π-helix	trans	-62.6	-44.1	176.8	-171.1	177.2	-179.8	-179.9	-0.6	112	S480 P481 P482 L488 D489	S480-R484 PolarHBondContact O-N 3.39Å; P481-R484 PolarHBondContact O-N 3.11Å; P482-R484 VanDerWaalsContact C-N 3.33Å; P482-R484 PolarHBondContact O-N 3.17Å; R484-L488 CarbonylContact O-C 3.57Å; R484-L488 PolarHBondContact O-N 2.77Å; R484-D489 PolarHBondContact O-N 3.27Å; R484-D489 VanDerWaalsContact O-N 3.07Å
485	R	84.1	Confident	84.6	Confident	106 Å²	106	58 Å²	58	40%	0.4	30%	0.298	S	S	.	.	I	π-helix	trans	-76.3	-40.2	-177.5	-66.7	-172.2	-177.1	171.4	5.4	114	L424 P481 P482 D489 L492	L424-R485 PolarHBondContact O-NH1 2.75Å; P481-R485 PolarHBondContact O-N 3.44Å; P482-R485 PolarHBondContact O-N 2.92Å; R485-D489 VanDerWaalsContact O-CB 3.24Å; R485-D489 WeakPolarHBondContact O-CB 3.3Å; R485-L492 VanDerWaalsContact O-CD2 3.3Å; R485-L492 WeakPolarHBondContact O-CD2 3.49Å
486	L	82.4	Confident	84.4	Confident	6 Å²	6	55.7 Å²	55.7	3%	0.031	28%	0.275	C	S	.	.	I	π-helix	trans	-88.6	-31.1	-174.6	-67.7	178.9	0	0	0	114	L421 L424 P482 L492 W526	L421-L486 HydrophobicContact CD1-CD1 3.78Å; L421-L486 HydrophobicContact CD2-CD1 3.7Å; L421-L486 HydrophobicContact CD2-CD2 3.88Å; L421-L486 HydrophobicContact CD2-CG 3.72Å; L421-L486 HydrophobicContact CG-CD1 3.79Å; L421-L486 HydrophobicContact CG-CD2 4.05Å; L421-L486 HydrophobicContact CG-CG 4.19Å; L424-L486 HydrophobicContact CD1-CD2 4.49Å; P482-L486 VanDerWaalsContact O-CB 3.3Å; P482-L486 WeakPolarHBondContact O-CB 3.34Å; P482-L486 WeakPolarHBondContact O-CG 3.34Å; P482-L486 PolarHBondContact O-N 3.33Å; L486-L492 HydrophobicContact CD2-CD2 4.42Å; L486-W526 HydrophobicContact CD1-CD2 4.07Å; L486-W526 HydrophobicContact CD1-CG 4.01Å
487	V	86.3	Confident	84	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.283	C	S	.	.	I	π-helix	trans	-112.4	-32.6	-168.5	-175.3	0	0	0	0	112	F483 A519 F523 W526 I547	F483-V487 HydrophobicContact CD2-CB 4.36Å; F483-V487 HydrophobicContact CD2-CG2 4.17Å; F483-V487 HydrophobicContact CE1-CG1 4.47Å; F483-V487 HydrophobicContact CE2-CB 4.32Å; F483-V487 HydrophobicContact CE2-CG1 4.14Å; F483-V487 HydrophobicContact CE2-CG2 4.35Å; F483-V487 HydrophobicContact CG-CB 4.47Å; F483-V487 HydrophobicContact CZ-CB 4.41Å; F483-V487 HydrophobicContact CZ-CG1 4.03Å; F483-V487 VanDerWaalsContact O-CB 3.29Å; F483-V487 WeakPolarHBondContact O-CB 3.49Å; F483-V487 PolarHBondContact O-N 2.7Å; V487-A519 HydrophobicContact CG1-CB 4.17Å; V487-A519 VanDerWaalsContact O-CB 3.27Å; V487-A519 WeakPolarHBondContact O-CB 3.39Å; V487-F523 HydrophobicContact CG1-CB 4.17Å; V487-F523 HydrophobicContact CG2-CB 4.21Å; V487-F523 HydrophobicContact CG2-CD2 4.3Å; V487-W526 HydrophobicContact CG2-CE3 4.17Å; V487-I547 HydrophobicContact CG1-CD1 3.63Å; V487-I547 HydrophobicContact CG1-CG1 3.89Å
488	L	86.4	Confident	83.7	Confident	14 Å²	14	60.5 Å²	60.5	7%	0.073	30%	0.3	C	S	.	.	I	π-helix	trans	-104.7	-17	-176	-58.8	-179.8	0	0	0	114.2	F483 R484 R490 R546 I547 E550 Y551	F483-L488 HydrophobicContact CD1-CD1 3.91Å; F483-L488 HydrophobicContact CD1-CG 4.01Å; F483-L488 HydrophobicContact CE1-CD1 3.83Å; F483-L488 HydrophobicContact CE1-CD2 3.99Å; F483-L488 HydrophobicContact CE1-CG 3.8Å; F483-L488 PolarHBondContact O-N 3.19Å; R484-L488 CarbonylContact O-C 3.57Å; R484-L488 PolarHBondContact O-N 2.77Å; L488-R490 PolarHBondContact O-N 2.82Å; L488-R546 HydrophobicContact CD1-CG 4.12Å; L488-I547 HydrophobicContact CD2-CB 4.44Å; L488-I547 HydrophobicContact CD2-CG1 3.9Å; L488-E550 HydrophobicContact CB-CG 4.49Å; L488-E550 HydrophobicContact CD2-CB 4.09Å; L488-E550 HydrophobicContact CD2-CG 4.37Å; L488-Y551 PolarHBondContact O-OH 2.78Å
489	D	86.8	Confident	83.4	Confident	63 Å²	63	69.6 Å²	69.6	34%	0.337	33%	0.333	S	S	.	.			trans	-65.6	117.2	-177	-174.1	1.6	0	0	0	111.9	R484 R485 W491 L492 L493	R484-D489 PolarHBondContact O-N 3.27Å; R484-D489 VanDerWaalsContact O-N 3.07Å; R485-D489 VanDerWaalsContact O-CB 3.24Å; R485-D489 WeakPolarHBondContact O-CB 3.3Å; D489-W491 VanDerWaalsContact C-N 3.32Å; D489-W491 PolarHBondContact O-N 3.07Å; D489-W491 PolarHBondContact OD1-N 2.78Å; D489-W491 VanDerWaalsContact OD1-N 3.15Å; D489-L492 HydrophobicContact CB-CB 4.1Å; D489-L492 PolarHBondContact O-N 2.87Å; D489-L493 VanDerWaalsContact O-CG 3.3Å; D489-L493 WeakPolarHBondContact O-CG 3.24Å; D489-L493 PolarHBondContact O-N 2.87Å; D489-L493 VanDerWaalsContact O-N 3.1Å
490	R	84.3	Confident	83.2	Confident	126 Å²	126	70.9 Å²	70.9	48%	0.475	33%	0.329	S	S	.	.	H	α-helix	trans	-63.6	-38.1	-176.1	-169	177.6	-173.2	-165.1	3.3	112.2	L488 L493 Q494 L515 Y551	L488-R490 PolarHBondContact O-N 2.82Å; R490-L493 PolarHBondContact O-N 3.39Å; R490-Q494 WeakPolarHBondContact O-CB 3.29Å; R490-Q494 WeakPolarHBondContact O-CG 3.27Å; R490-Q494 PolarHBondContact O-N 3.24Å; R490-L515 HydrophobicContact CG-CD1 4.25Å; R490-Y551 VanDerWaalsContact CA-OH 3.3Å; R490-Y551 WeakPolarHBondContact CA-OH 3.39Å; R490-Y551 WeakPolarHBondContact CB-OH 3.05Å; R490-Y551 PolarHBondContact N-OH 3.08Å
491	W	81.7	Confident	82.8	Confident	198 Å²	198	73.7 Å²	73.7	75%	0.75	34%	0.342	S	S	*	.	H	α-helix	trans	-66.3	-46.3	-178.6	179.5	-105.3	0	0	0	111	D489 L493 Q494 A495	D489-W491 VanDerWaalsContact C-N 3.32Å; D489-W491 PolarHBondContact O-N 3.07Å; D489-W491 PolarHBondContact OD1-N 2.78Å; D489-W491 VanDerWaalsContact OD1-N 3.15Å; W491-L493 PolarHBondContact O-N 2.95Å; W491-Q494 PolarHBondContact O-N 3.27Å; W491-A495 WeakPolarHBondContact O-CB 3.38Å; W491-A495 PolarHBondContact O-N 3.43Å
492	L	83.4	Confident	82.4	Confident	44 Å²	44	73.7 Å²	73.7	23%	0.23	34%	0.342	C	S	.	.	H	α-helix	trans	-60.4	-45.1	176.5	-178.7	66	0	0	0	111.8	R485 L486 D489 Q494 A495 V496	R485-L492 VanDerWaalsContact O-CD2 3.3Å; R485-L492 WeakPolarHBondContact O-CD2 3.49Å; L486-L492 HydrophobicContact CD2-CD2 4.42Å; D489-L492 HydrophobicContact CB-CB 4.1Å; D489-L492 PolarHBondContact O-N 2.87Å; L492-Q494 PolarHBondContact O-N 2.88Å; L492-A495 PolarHBondContact O-N 3.5Å; L492-V496 WeakPolarHBondContact O-CG2 3.32Å; L492-V496 PolarHBondContact O-N 3.4Å
493	L	83	Confident	81.8	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-65.6	-38	179.7	-66.8	176.1	0	0	0	112.4	D489 R490 W491 V496 L497 L515 C518 A519 Q522 Y551	D489-L493 VanDerWaalsContact O-CG 3.3Å; D489-L493 WeakPolarHBondContact O-CG 3.24Å; D489-L493 PolarHBondContact O-N 2.87Å; D489-L493 VanDerWaalsContact O-N 3.1Å; R490-L493 PolarHBondContact O-N 3.39Å; W491-L493 PolarHBondContact O-N 2.95Å; L493-V496 PolarHBondContact O-N 3.33Å; L493-L497 VanDerWaalsContact O-CG 3.3Å; L493-L497 WeakPolarHBondContact O-CG 3.3Å; L493-L497 PolarHBondContact O-N 3.45Å; L493-L515 HydrophobicContact CB-CD2 3.76Å; L493-C518 HydrophobicContact CD2-CB 4.13Å; L493-A519 HydrophobicContact CD1-CB 4.01Å; L493-A519 HydrophobicContact CD2-CB 4.29Å; L493-Q522 HydrophobicContact CD2-CG 3.85Å; L493-Y551 HydrophobicContact CD1-CE2 3.69Å
494	Q	81.3	Confident	80.9	Confident	55 Å²	55	81.1 Å²	81.1	26%	0.257	38%	0.382	S	S	.	.	H	α-helix	trans	-66.1	-43.7	174.1	-76.5	177.8	-30.2	0	0	111.6	R490 W491 L492 V496 L497 L498 L515	R490-Q494 WeakPolarHBondContact O-CB 3.29Å; R490-Q494 WeakPolarHBondContact O-CG 3.27Å; R490-Q494 PolarHBondContact O-N 3.24Å; W491-Q494 PolarHBondContact O-N 3.27Å; L492-Q494 PolarHBondContact O-N 2.88Å; Q494-V496 VanDerWaalsContact C-N 3.32Å; Q494-V496 PolarHBondContact O-N 3.02Å; Q494-L497 PolarHBondContact O-N 2.94Å; Q494-L498 WeakPolarHBondContact O-CG 3.3Å; Q494-L498 PolarHBondContact O-N 3.5Å; Q494-L515 HydrophobicContact CG-CD2 3.92Å
495	A	79.3	Confident	79.7	Confident	47 Å²	47	77.1 Å²	77.1	39%	0.388	38%	0.38	S	S	.	.	H	α-helix	trans	-60	-41.2	176	0	0	0	0	0	112	W491 L492 L498 Y499	W491-A495 WeakPolarHBondContact O-CB 3.38Å; W491-A495 PolarHBondContact O-N 3.43Å; L492-A495 PolarHBondContact O-N 3.5Å; A495-L498 PolarHBondContact O-N 3.15Å; A495-Y499 WeakPolarHBondContact O-CB 3.15Å; A495-Y499 PolarHBondContact O-N 3.19Å
496	V	81.3	Confident	78.4	Confident	27 Å²	27	78.4 Å²	78.4	16%	0.164	40%	0.402	C	S	.	.	H	α-helix	trans	-65.6	-40.2	176.1	173.6	0	0	0	0	111.8	L492 L493 Q494 Y499 Q500	L492-V496 WeakPolarHBondContact O-CG2 3.32Å; L492-V496 PolarHBondContact O-N 3.4Å; L493-V496 PolarHBondContact O-N 3.33Å; Q494-V496 VanDerWaalsContact C-N 3.32Å; Q494-V496 PolarHBondContact O-N 3.02Å; V496-Y499 PolarHBondContact O-N 3.36Å; V496-Q500 PolarHBondContact O-N 2.81Å; V496-Q500 VanDerWaalsContact O-N 3.17Å
497	L	81.4	Confident	76.7	Confident	41 Å²	41	80.8 Å²	80.8	22%	0.215	42%	0.423	C	S	.	.	H	α-helix	trans	-65.8	-43.3	177.7	-73.5	172.1	0	0	0	111.3	L493 Q494 Y499 Q500 D501 A514 L515 C518	L493-L497 VanDerWaalsContact O-CG 3.3Å; L493-L497 WeakPolarHBondContact O-CG 3.3Å; L493-L497 PolarHBondContact O-N 3.45Å; Q494-L497 PolarHBondContact O-N 2.94Å; L497-Y499 VanDerWaalsContact C-N 3.31Å; L497-Y499 PolarHBondContact O-N 3.41Å; L497-Q500 PolarHBondContact O-N 3.42Å; L497-D501 PolarHBondContact O-N 3.04Å; L497-A514 HydrophobicContact CD1-CB 4.3Å; L497-L515 HydrophobicContact CD1-CD2 3.9Å; L497-C518 HydrophobicContact CD1-CB 4.37Å; L497-C518 HydrophobicContact CD2-CB 4.02Å; L497-C518 HydrophobicContact CG-CB 4.14Å
498	L	79.8	Confident	75.2	Confident	84 Å²	84	85.2 Å²	85.2	44%	0.44	47%	0.469	S	S	.	.	H	α-helix	trans	-65.6	-32.3	174.7	-71.5	168.4	0	0	0	112.5	Q494 A495 Q500 D501 P502	Q494-L498 WeakPolarHBondContact O-CG 3.3Å; Q494-L498 PolarHBondContact O-N 3.5Å; A495-L498 PolarHBondContact O-N 3.15Å; L498-Q500 VanDerWaalsContact C-N 3.33Å; L498-D501 CarbonylContact O-C 3.57Å; L498-D501 VanDerWaalsContact O-C 3.27Å; L498-P502 WeakPolarHBondContact O-CA 3.5Å; L498-P502 WeakPolarHBondContact O-CG 3.3Å
499	Y	81.1	Confident	73.7	Confident	202 Å²	202	86.6 Å²	86.6	79%	0.792	49%	0.486	S	S	*	.	H	α-helix	trans	-66.1	-35.6	173.2	-178.8	-95.3	0	0	0	112.5	A495 V496 L497	A495-Y499 WeakPolarHBondContact O-CB 3.15Å; A495-Y499 PolarHBondContact O-N 3.19Å; V496-Y499 PolarHBondContact O-N 3.36Å; L497-Y499 VanDerWaalsContact C-N 3.31Å; L497-Y499 PolarHBondContact O-N 3.41Å
500	Q	79.2	Confident	72.3	Confident	116 Å²	116	84.8 Å²	84.8	54%	0.542	48%	0.48	S	S	.	.	H	α-helix	trans	-78.3	-36.7	177.7	-70.7	178.8	8.3	0	0	112.5	V496 L497 L498	V496-Q500 PolarHBondContact O-N 2.81Å; V496-Q500 VanDerWaalsContact O-N 3.17Å; L497-Q500 PolarHBondContact O-N 3.42Å; L498-Q500 VanDerWaalsContact C-N 3.33Å
501	D	77.8	Confident	71.6	Confident	90 Å²	90	85.7 Å²	85.7	48%	0.481	49%	0.49	S	S	.	.			trans	-138.7	87.2	177.9	-173.4	5.3	0	0	0	110.7	L497 L498 L503 S504	L497-D501 PolarHBondContact O-N 3.04Å; L498-D501 CarbonylContact O-C 3.57Å; L498-D501 VanDerWaalsContact O-C 3.27Å; D501-L503 PolarHBondContact O-N 3.35Å; D501-L503 VanDerWaalsContact O-N 3.16Å; D501-S504 WeakPolarHBondContact O-CB 3.1Å; D501-S504 PolarHBondContact O-N 3.17Å; D501-S504 PolarHBondContact O-OG 2.98Å
502	P	75.1	Confident	71.4	Confident	97 Å²	97	79 Å²	79	63%	0.63	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.1	-173.7	-22.3	32.8	0	0	0	114.8	L498	L498-P502 WeakPolarHBondContact O-CA 3.5Å; L498-P502 WeakPolarHBondContact O-CG 3.3Å
503	L	71.6	Confident	71.2	Confident	161 Å²	161	78.3 Å²	78.3	84%	0.843	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	6.8	-177.3	-60.9	176	0	0	0	112.4	D501	D501-L503 PolarHBondContact O-N 3.35Å; D501-L503 VanDerWaalsContact O-N 3.16Å
504	S	67.7	Low	71.1	Confident	34 Å²	34	80.2 Å²	80.2	24%	0.238	49%	0.488	C	S	.	.	S	Bend	trans	-57.5	131.9	173.1	54.8	0	0	0	0	109.7	D501	D501-S504 WeakPolarHBondContact O-CB 3.1Å; D501-S504 PolarHBondContact O-N 3.17Å; D501-S504 PolarHBondContact O-OG 2.98Å
505	P	60.8	Low	71.2	Confident	108 Å²	108	77.7 Å²	77.7	70%	0.701	48%	0.476	S	S	*	.			trans	-58.9	136.8	-172.9	20.9	-31.5	0	0	0	109.9	A507	P505-A507 PolarHBondContact O-N 2.91Å
506	P	56.4	Low	71.6	Confident	133 Å²	133	76.4 Å²	76.4	86%	0.864	46%	0.461	S	S	*	.			trans	-70.9	74.7	173.5	29.1	-32.5	0	0	0	108.4	G508	P506-G508 PolarHBondContact O-N 2.99Å
507	A	47.2	Very low	71.8	Confident	57 Å²	57	79.5 Å²	79.5	47%	0.471	47%	0.474	S	S	.	.			trans	-68.5	116.2	174.8	0	0	0	0	0	107.1	P505 G509 A510	P505-A507 PolarHBondContact O-N 2.91Å; A507-G509 CarbonylContact O-C 3.54Å; A507-G509 PolarHBondContact O-N 3.19Å; A507-A510 PolarHBondContact O-N 2.84Å
508	G	53.2	Low	71.9	Confident	93 Å²	93	77.8 Å²	77.8	96%	0.959	47%	0.465	S	S	*	.	S	Bend	trans	-50.9	96.1	155.4	0	0	0	0	0	107.9	P506	P506-G508 PolarHBondContact O-N 2.99Å
509	G	55.2	Low	72.3	Confident	42 Å²	42	73.8 Å²	73.8	43%	0.433	44%	0.444	S	S	.	.	S	Bend	trans	92.3	71	-166.5	0	0	0	0	0	114.2	A507 Q511	A507-G509 CarbonylContact O-C 3.54Å; A507-G509 PolarHBondContact O-N 3.19Å; G509-Q511 PolarHBondContact O-N 2.89Å; G509-Q511 VanDerWaalsContact O-N 3.12Å
510	A	57.7	Low	72.6	Confident	25 Å²	25	65.9 Å²	65.9	21%	0.207	41%	0.413	C	S	.	.			trans	-44.7	123.5	156.6	0	0	0	0	0	108.9	A507 L515	A507-A510 PolarHBondContact O-N 2.84Å; A510-L515 HydrophobicContact CB-CD1 4.2Å; A510-L515 HydrophobicContact CB-CG 4.3Å
511	Q	69.6	Low	72.9	Confident	145 Å²	145	67.8 Å²	67.8	68%	0.678	42%	0.415	S	S	*	.			trans	-50.9	126.5	-174.2	-72.7	-175.5	7.1	0	0	109.2	G509 A513 A514	G509-Q511 PolarHBondContact O-N 2.89Å; G509-Q511 VanDerWaalsContact O-N 3.12Å; Q511-A513 PolarHBondContact O-N 3.12Å; Q511-A514 PolarHBondContact O-N 2.94Å
512	P	76.9	Confident	73.3	Confident	58 Å²	58	65 Å²	65	38%	0.377	40%	0.4	S	S	.	.	H	α-helix	trans	-49.6	-27	179.5	-30.5	35.1	0	0	0	113.5	R516 P552	P512-R516 WeakPolarHBondContact O-CB 3.46Å; P512-R516 PolarHBondContact O-N 3.18Å; P512-P552 VanDerWaalsContact CB-O 3.28Å; P512-P552 WeakPolarHBondContact CB-O 3.28Å
513	A	79.6	Confident	73.8	Confident	29 Å²	29	60.7 Å²	60.7	24%	0.24	37%	0.371	C	S	.	.	H	α-helix	trans	-60.3	-47.2	172.4	0	0	0	0	0	113.9	Q511 R516 H517	Q511-A513 PolarHBondContact O-N 3.12Å; A513-R516 PolarHBondContact O-N 2.92Å; A513-H517 PolarHBondContact O-CD2 3.4Å; A513-H517 PolarHBondContact O-N 3.42Å
514	A	81.1	Confident	74.5	Confident	40 Å²	40	54.9 Å²	54.9	33%	0.331	34%	0.34	S	S	.	.	H	α-helix	trans	-66.5	-43.2	-177.9	0	0	0	0	0	111.5	L497 Q511 H517 C518	L497-A514 HydrophobicContact CD1-CB 4.3Å; Q511-A514 PolarHBondContact O-N 2.94Å; A514-H517 PolarHBondContact O-N 3.39Å; A514-C518 WeakPolarHBondContact O-CB 3.44Å; A514-C518 PolarHBondContact O-N 2.73Å
515	L	83.5	Confident	75.3	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-62.2	-43	174.3	-67.1	172	0	0	0	111.3	R490 L493 Q494 L497 A510 C518 A519 Y551	R490-L515 HydrophobicContact CG-CD1 4.25Å; L493-L515 HydrophobicContact CB-CD2 3.76Å; Q494-L515 HydrophobicContact CG-CD2 3.92Å; L497-L515 HydrophobicContact CD1-CD2 3.9Å; A510-L515 HydrophobicContact CB-CD1 4.2Å; A510-L515 HydrophobicContact CB-CG 4.3Å; L515-C518 PolarHBondContact O-N 3.47Å; L515-A519 WeakPolarHBondContact O-CB 3.44Å; L515-A519 PolarHBondContact O-N 3.21Å; L515-Y551 HydrophobicContact CB-CD1 3.91Å; L515-Y551 HydrophobicContact CB-CE1 4.01Å; L515-Y551 HydrophobicContact CB-CG 4.24Å; L515-Y551 HydrophobicContact CD1-CD1 4.1Å; L515-Y551 HydrophobicContact CD1-CE1 3.84Å
516	R	87.7	Confident	76.4	Confident	20 Å²	20	51.8 Å²	51.8	8%	0.075	32%	0.316	C	S	.	.	H	α-helix	trans	-61.6	-43.9	175.1	-178.8	-178.5	65.4	-170	-1.7	112.7	P512 A513 A519 Y520 I547 S553	P512-R516 WeakPolarHBondContact O-CB 3.46Å; P512-R516 PolarHBondContact O-N 3.18Å; A513-R516 PolarHBondContact O-N 2.92Å; R516-A519 PolarHBondContact O-N 2.67Å; R516-Y520 HydrophobicContact CG-CD2 4.48Å; R516-Y520 HydrophobicContact CG-CE1 4.33Å; R516-Y520 HydrophobicContact CG-CE2 3.69Å; R516-Y520 VanDerWaalsContact O-CD2 3.32Å; R516-Y520 WeakPolarHBondContact O-CD2 3.41Å; R516-Y520 VanDerWaalsContact O-CG 3.28Å; R516-Y520 PolarHBondContact O-N 3.29Å; R516-I547 HydrophobicContact CG-CG2 4.07Å; R516-S553 PolarHBondContact NH1-OG 3.26Å
517	H	84.8	Confident	77.7	Confident	93 Å²	93	47.2 Å²	47.2	43%	0.431	28%	0.282	S	S	.	.	H	α-helix	trans	-67.4	-36.4	175.8	-75	-67.1	0	0	0	112.1	A513 A514 Y520 R521	A513-H517 PolarHBondContact O-CD2 3.4Å; A513-H517 PolarHBondContact O-N 3.42Å; A514-H517 PolarHBondContact O-N 3.39Å; H517-Y520 PolarHBondContact O-N 3.25Å; H517-R521 WeakPolarHBondContact O-CG 3.36Å; H517-R521 PolarHBondContact O-N 3.01Å; H517-R521 VanDerWaalsContact O-N 3.11Å
518	C	84.5	Confident	79.3	Confident	4 Å²	4	44.6 Å²	44.6	3%	0.027	26%	0.26	C	S	.	.	H	α-helix	trans	-65	-44.2	173.6	-165.8	0	0	0	0	111.1	L493 L497 A514 L515 Y520 R521 Q522	L493-C518 HydrophobicContact CD2-CB 4.13Å; L497-C518 HydrophobicContact CD1-CB 4.37Å; L497-C518 HydrophobicContact CD2-CB 4.02Å; L497-C518 HydrophobicContact CG-CB 4.14Å; A514-C518 WeakPolarHBondContact O-CB 3.44Å; A514-C518 PolarHBondContact O-N 2.73Å; L515-C518 PolarHBondContact O-N 3.47Å; C518-Y520 VanDerWaalsContact C-N 3.35Å; C518-Y520 PolarHBondContact O-N 3.12Å; C518-R521 WeakPolarHBondContact O-CB 3.5Å; C518-R521 PolarHBondContact O-N 3.23Å; C518-R521 VanDerWaalsContact O-N 3.1Å; C518-Q522 WeakPolarHBondContact O-CG 3.22Å; C518-Q522 PolarHBondContact O-N 3.46Å
519	A	87.3	Confident	80.6	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.8	-42.1	174.8	0	0	0	0	0	112.4	V487 L493 L515 R516 R521 Q522 F523 I547	V487-A519 HydrophobicContact CG1-CB 4.17Å; V487-A519 VanDerWaalsContact O-CB 3.27Å; V487-A519 WeakPolarHBondContact O-CB 3.39Å; L493-A519 HydrophobicContact CD1-CB 4.01Å; L493-A519 HydrophobicContact CD2-CB 4.29Å; L515-A519 WeakPolarHBondContact O-CB 3.44Å; L515-A519 PolarHBondContact O-N 3.21Å; R516-A519 PolarHBondContact O-N 2.67Å; A519-R521 PolarHBondContact O-N 3.39Å; A519-Q522 PolarHBondContact O-N 3.3Å; A519-F523 PolarHBondContact O-N 3.27Å; A519-I547 HydrophobicContact CB-CD1 4.34Å; A519-I547 HydrophobicContact CB-CG1 4.41Å; A519-I547 HydrophobicContact CB-CG2 3.66Å
520	Y	88.3	Confident	81.2	Confident	36 Å²	36	47.1 Å²	47.1	14%	0.141	24%	0.237	C	C	.	.	H	α-helix	trans	-60.8	-44.4	173.2	-63	-31.5	0	0	0	112.3	R516 H517 C518 F523 I524 I539 V544 I547 R548	R516-Y520 HydrophobicContact CG-CD2 4.48Å; R516-Y520 HydrophobicContact CG-CE1 4.33Å; R516-Y520 HydrophobicContact CG-CE2 3.69Å; R516-Y520 VanDerWaalsContact O-CD2 3.32Å; R516-Y520 WeakPolarHBondContact O-CD2 3.41Å; R516-Y520 VanDerWaalsContact O-CG 3.28Å; R516-Y520 PolarHBondContact O-N 3.29Å; H517-Y520 PolarHBondContact O-N 3.25Å; C518-Y520 VanDerWaalsContact C-N 3.35Å; C518-Y520 PolarHBondContact O-N 3.12Å; Y520-F523 PolarHBondContact O-N 3.03Å; Y520-I524 WeakPolarHBondContact O-CD1 3.25Å; Y520-I524 VanDerWaalsContact O-CG1 3.25Å; Y520-I524 WeakPolarHBondContact O-CG1 3.49Å; Y520-I524 PolarHBondContact O-N 3.28Å; Y520-I539 HydrophobicContact CD1-CD1 3.8Å; Y520-I539 HydrophobicContact CG-CD1 3.96Å; Y520-V544 HydrophobicContact CE1-CG1 4.38Å; Y520-I547 HydrophobicContact CD1-CD1 3.71Å; Y520-I547 HydrophobicContact CD1-CG2 4.13Å; Y520-I547 HydrophobicContact CE1-CB 4.02Å; Y520-I547 HydrophobicContact CE1-CD1 3.95Å; Y520-I547 HydrophobicContact CE1-CG2 3.73Å; Y520-R548 WeakPolarHBondContact OH-CG 3.28Å; Y520-R548 PolarHBondContact OH-NE 3.07Å
521	R	84.9	Confident	81.6	Confident	156 Å²	156	47.9 Å²	47.9	59%	0.589	24%	0.239	S	C	*	.	H	α-helix	trans	-63.9	-40.8	176.8	-72.3	177.6	175.6	175.7	-1.4	112	H517 C518 A519 I524 S525	H517-R521 WeakPolarHBondContact O-CG 3.36Å; H517-R521 PolarHBondContact O-N 3.01Å; H517-R521 VanDerWaalsContact O-N 3.11Å; C518-R521 WeakPolarHBondContact O-CB 3.5Å; C518-R521 PolarHBondContact O-N 3.23Å; C518-R521 VanDerWaalsContact O-N 3.1Å; A519-R521 PolarHBondContact O-N 3.39Å; R521-I524 PolarHBondContact O-N 3.44Å; R521-S525 WeakPolarHBondContact O-CB 3.46Å; R521-S525 PolarHBondContact O-N 3.01Å
522	Q	85.6	Confident	81.4	Confident	33 Å²	33	43.1 Å²	43.1	15%	0.154	22%	0.221	C	C	.	.	H	α-helix	trans	-63.9	-44.6	176.9	-74.8	-59.3	-20.3	0	0	112	L493 C518 A519 I524 S525 W526	L493-Q522 HydrophobicContact CD2-CG 3.85Å; C518-Q522 WeakPolarHBondContact O-CG 3.22Å; C518-Q522 PolarHBondContact O-N 3.46Å; A519-Q522 PolarHBondContact O-N 3.3Å; Q522-I524 VanDerWaalsContact C-N 3.3Å; Q522-I524 PolarHBondContact O-N 2.88Å; Q522-S525 PolarHBondContact O-N 3.07Å; Q522-W526 VanDerWaalsContact O-CB 3.31Å; Q522-W526 WeakPolarHBondContact O-CB 3.21Å; Q522-W526 PolarHBondContact O-N 3.29Å
523	F	87.4	Confident	80.5	Confident	5 Å²	5	47.8 Å²	47.8	2%	0.022	24%	0.243	C	C	.	.	H	α-helix	trans	-59.9	-42.8	174	-178.7	-89	0	0	0	111.9	I477 F483 V487 A519 Y520 W526 R527 F528 I539 P540 C543	I477-F523 HydrophobicContact CD1-CE2 4.18Å; F483-F523 HydrophobicContact CD2-CD2 4.12Å; F483-F523 HydrophobicContact CD2-CE2 4.2Å; F483-F523 AromaticContact CE2-CD2 3.65Å; F483-F523 HydrophobicContact CE2-CD2 3.65Å; F483-F523 AromaticContact CE2-CE2 3.84Å; F483-F523 HydrophobicContact CE2-CE2 3.84Å; V487-F523 HydrophobicContact CG1-CB 4.17Å; V487-F523 HydrophobicContact CG2-CB 4.21Å; V487-F523 HydrophobicContact CG2-CD2 4.3Å; A519-F523 PolarHBondContact O-N 3.27Å; Y520-F523 PolarHBondContact O-N 3.03Å; F523-W526 HydrophobicContact CD2-CE3 4.22Å; F523-W526 HydrophobicContact CD2-CZ3 4.47Å; F523-W526 HydrophobicContact CE2-CE3 4.48Å; F523-W526 HydrophobicContact CE2-CZ3 4.45Å; F523-W526 PolarHBondContact O-N 3.02Å; F523-R527 HydrophobicContact CE1-CB 4.39Å; F523-R527 HydrophobicContact CE1-CG 4.09Å; F523-R527 HydrophobicContact CE2-CG 4.02Å; F523-R527 HydrophobicContact CZ-CG 3.8Å; F523-R527 PolarHBondContact O-N 3.46Å; F523-F528 HydrophobicContact CE1-CE2 4.38Å; F523-I539 HydrophobicContact CD1-CB 4.27Å; F523-I539 HydrophobicContact CD1-CD1 4.24Å; F523-I539 HydrophobicContact CD1-CG1 3.89Å; F523-I539 HydrophobicContact CD1-CG2 3.71Å; F523-I539 HydrophobicContact CE1-CB 4.34Å; F523-I539 HydrophobicContact CE1-CG1 4.34Å; F523-I539 HydrophobicContact CE1-CG2 3.77Å; F523-I539 HydrophobicContact CG-CG2 4.31Å; F523-I539 HydrophobicContact CZ-CG2 4.41Å; F523-P540 HydrophobicContact CZ-CG 4.36Å; F523-C543 HydrophobicContact CE2-CB 4.14Å; F523-C543 HydrophobicContact CZ-CB 4.34Å
524	I	86.3	Confident	79.8	Confident	39 Å²	39	50.3 Å²	50.3	20%	0.2	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-49	177.8	-71.1	163.1	0	0	0	110.3	Y520 R521 Q522 W526 R527 F528 P537 I539	Y520-I524 WeakPolarHBondContact O-CD1 3.25Å; Y520-I524 VanDerWaalsContact O-CG1 3.25Å; Y520-I524 WeakPolarHBondContact O-CG1 3.49Å; Y520-I524 PolarHBondContact O-N 3.28Å; R521-I524 PolarHBondContact O-N 3.44Å; Q522-I524 VanDerWaalsContact C-N 3.3Å; Q522-I524 PolarHBondContact O-N 2.88Å; I524-W526 VanDerWaalsContact C-N 3.31Å; I524-W526 PolarHBondContact O-N 2.95Å; I524-R527 PolarHBondContact O-N 2.91Å; I524-F528 HydrophobicContact CB-CD2 4.47Å; I524-F528 HydrophobicContact CG2-CB 4.44Å; I524-F528 HydrophobicContact CG2-CD2 4.29Å; I524-F528 WeakPolarHBondContact O-CA 3.36Å; I524-F528 VanDerWaalsContact O-CB 3.28Å; I524-F528 WeakPolarHBondContact O-CB 3.45Å; I524-F528 WeakPolarHBondContact O-CD2 3.41Å; I524-F528 PolarHBondContact O-N 3.05Å; I524-P537 HydrophobicContact CB-CG 4.42Å; I524-P537 HydrophobicContact CD1-CG 3.96Å; I524-P537 HydrophobicContact CG1-CB 4.21Å; I524-P537 HydrophobicContact CG1-CG 4.07Å; I524-P537 HydrophobicContact CG2-CB 3.86Å; I524-P537 HydrophobicContact CG2-CG 3.46Å; I524-P537 VanDerWaalsContact CG2-CG 3.46Å; I524-I539 HydrophobicContact CD1-CD1 4.07Å; I524-I539 HydrophobicContact CD1-CG1 4.29Å; I524-I539 HydrophobicContact CG1-CD1 4.04Å; I524-I539 HydrophobicContact CG1-CG1 4.01Å
525	S	83.1	Confident	79.5	Confident	46 Å²	46	49.1 Å²	49.1	32%	0.322	24%	0.242	S	C	.	.	H	α-helix	trans	-60.2	-42.1	177.7	-170	0	0	0	0	111.7	R521 Q522 R527 G529	R521-S525 WeakPolarHBondContact O-CB 3.46Å; R521-S525 PolarHBondContact O-N 3.01Å; Q522-S525 PolarHBondContact O-N 3.07Å; S525-R527 PolarHBondContact O-N 3.33Å; S525-G529 WeakPolarHBondContact O-CA 2.99Å; S525-G529 PolarHBondContact O-N 3.39Å
526	W	84.1	Confident	79.5	Confident	31 Å²	31	50.8 Å²	50.8	12%	0.117	25%	0.249	C	C	.	.	H	α-helix	trans	-65.7	-38.3	178.7	178.6	42.9	0	0	0	114.2	R411 I477 P482 F483 L486 V487 Q522 F523 I524	R411-W526 PolarHBondContact NH1-O 3Å; R411-W526 PolarHBondContact NH2-O 2.63Å; I477-W526 HydrophobicContact CD1-CH2 3.94Å; I477-W526 HydrophobicContact CD1-CZ3 3.86Å; I477-W526 HydrophobicContact CG1-CH2 4.12Å; I477-W526 HydrophobicContact CG1-CZ3 4.27Å; P482-W526 HydrophobicContact CB-CH2 4.27Å; P482-W526 HydrophobicContact CB-CZ2 4Å; P482-W526 HydrophobicContact CG-CH2 4.18Å; P482-W526 HydrophobicContact CG-CZ2 4.09Å; F483-W526 HydrophobicContact CB-CZ3 4.35Å; F483-W526 HydrophobicContact CD2-CZ3 4.07Å; L486-W526 HydrophobicContact CD1-CD2 4.07Å; L486-W526 HydrophobicContact CD1-CG 4.01Å; V487-W526 HydrophobicContact CG2-CE3 4.17Å; Q522-W526 VanDerWaalsContact O-CB 3.31Å; Q522-W526 WeakPolarHBondContact O-CB 3.21Å; Q522-W526 PolarHBondContact O-N 3.29Å; F523-W526 HydrophobicContact CD2-CE3 4.22Å; F523-W526 HydrophobicContact CD2-CZ3 4.47Å; F523-W526 HydrophobicContact CE2-CE3 4.48Å; F523-W526 HydrophobicContact CE2-CZ3 4.45Å; F523-W526 PolarHBondContact O-N 3.02Å; I524-W526 VanDerWaalsContact C-N 3.31Å; I524-W526 PolarHBondContact O-N 2.95Å
527	R	84.4	Confident	79.3	Confident	37 Å²	37	51 Å²	51	14%	0.14	25%	0.253	C	S	.	.	H	α-helix	trans	-97	-29.8	-175.8	-68.9	-56.2	-56.4	176.5	-1.6	114.8	S382 Y383 R411 I477 F523 I524 S525	S382-R527 PolarHBondContact OG-NH2 3.01Å; Y383-R527 PolarHBondContact O-NH2 2.95Å; Y383-R527 VanDerWaalsContact O-NH2 3.07Å; R411-R527 PolarHBondContact NH1-O 3.44Å; I477-R527 HydrophobicContact CD1-CG 4.47Å; F523-R527 HydrophobicContact CE1-CB 4.39Å; F523-R527 HydrophobicContact CE1-CG 4.09Å; F523-R527 HydrophobicContact CE2-CG 4.02Å; F523-R527 HydrophobicContact CZ-CG 3.8Å; F523-R527 PolarHBondContact O-N 3.46Å; I524-R527 PolarHBondContact O-N 2.91Å; S525-R527 PolarHBondContact O-N 3.33Å
528	F	80.9	Confident	79.5	Confident	3 Å²	3	47 Å²	47	1%	0.013	24%	0.235	C	C	.	.	H	α-helix	trans	-111.1	-16.3	-173.1	-59.6	-95.4	0	0	0	113.1	C380 L389 F523 I524 F530 P537	C380-F528 HydrophobicContact CB-CD1 4.34Å; C380-F528 HydrophobicContact CB-CE1 4.27Å; C380-F528 VanDerWaalsContact O-CE1 3.32Å; C380-F528 WeakPolarHBondContact O-CE1 3.47Å; L389-F528 HydrophobicContact CD1-CD1 4.42Å; L389-F528 HydrophobicContact CD2-CD1 3.82Å; L389-F528 HydrophobicContact CD2-CE1 4.21Å; F523-F528 HydrophobicContact CE1-CE2 4.38Å; I524-F528 HydrophobicContact CB-CD2 4.47Å; I524-F528 HydrophobicContact CG2-CB 4.44Å; I524-F528 HydrophobicContact CG2-CD2 4.29Å; I524-F528 WeakPolarHBondContact O-CA 3.36Å; I524-F528 VanDerWaalsContact O-CB 3.28Å; I524-F528 WeakPolarHBondContact O-CB 3.45Å; I524-F528 WeakPolarHBondContact O-CD2 3.41Å; I524-F528 PolarHBondContact O-N 3.05Å; F528-F530 PolarHBondContact O-N 3.21Å; F528-F530 VanDerWaalsContact O-N 3.14Å; F528-P537 HydrophobicContact CD1-CB 4Å; F528-P537 HydrophobicContact CD2-CB 4.03Å; F528-P537 HydrophobicContact CE1-CB 4.1Å; F528-P537 HydrophobicContact CE2-CB 4.11Å; F528-P537 HydrophobicContact CG-CB 3.95Å; F528-P537 HydrophobicContact CZ-CB 4.14Å
529	G	79.3	Confident	79.7	Confident	12 Å²	12	47.9 Å²	47.9	12%	0.124	24%	0.239	C	C	.	.	S	Bend	trans	62.1	-113.5	-177.6	0	0	0	0	0	110.9	S525 P531	S525-G529 WeakPolarHBondContact O-CA 2.99Å; S525-G529 PolarHBondContact O-N 3.39Å; G529-P531 WeakPolarHBondContact O-CD 3.38Å
530	F	69.1	Low	79.8	Confident	176 Å²	176	48 Å²	48	77%	0.772	24%	0.24	S	C	*	.	S	Bend	trans	-102.3	95.5	169.6	-64.6	-80.9	0	0	0	109.1	F528	F528-F530 PolarHBondContact O-N 3.21Å; F528-F530 VanDerWaalsContact O-N 3.14Å
531	P	65.2	Low	79.8	Confident	40 Å²	40	47 Å²	47	26%	0.26	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-62.1	146.7	173.6	27.9	-33.4	0	0	0	109.5	G529	G529-P531 WeakPolarHBondContact O-CD 3.38Å
532	P	65.3	Low	79.9	Confident	45 Å²	45	39.7 Å²	39.7	29%	0.292	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-59.9	143.9	177	21.2	-28.5	0	0	0	110.7	L391 L409 D534 S535	L391-P532 HydrophobicContact CD1-CG 4.34Å; L391-P532 HydrophobicContact CD2-CG 4.2Å; L409-P532 HydrophobicContact CD2-CG 4.36Å; P532-D534 PolarHBondContact O-N 3.25Å; P532-S535 WeakPolarHBondContact CD-OG 3.46Å; P532-S535 WeakPolarHBondContact CG-OG 3.28Å; P532-S535 WeakPolarHBondContact O-CB 3.46Å; P532-S535 PolarHBondContact O-N 3.25Å; P532-S535 VanDerWaalsContact O-N 3.08Å; P532-S535 PolarHBondContact O-OG 2.64Å
533	D	58.8	Low	80.1	Confident	157 Å²	157	38.1 Å²	38.1	84%	0.84	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.2	139.2	174.6	-64.1	-43	0	0	0	109.3	S535	D533-S535 VanDerWaalsContact C-N 3.34Å; D533-S535 PolarHBondContact O-N 3.19Å
534	D	64.9	Low	80.1	Confident	82 Å²	82	39.1 Å²	39.1	44%	0.439	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	6.8	-172.5	-53.8	-38.3	0	0	0	117.9	P532	P532-D534 PolarHBondContact O-N 3.25Å
535	S	73.4	Confident	80.1	Confident	15 Å²	15	38.6 Å²	38.6	11%	0.105	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	142	169.7	76.3	0	0	0	0	113.1	I378 P532 D533	I378-S535 CarbonylContact O-C 3.58Å; I378-S535 WeakPolarHBondContact O-CA 3.03Å; P532-S535 WeakPolarHBondContact CD-OG 3.46Å; P532-S535 WeakPolarHBondContact CG-OG 3.28Å; P532-S535 WeakPolarHBondContact O-CB 3.46Å; P532-S535 PolarHBondContact O-N 3.25Å; P532-S535 VanDerWaalsContact O-N 3.08Å; P532-S535 PolarHBondContact O-OG 2.64Å; D533-S535 VanDerWaalsContact C-N 3.34Å; D533-S535 PolarHBondContact O-N 3.19Å
536	H	83.1	Confident	80.3	Confident	37 Å²	37	41.6 Å²	41.6	17%	0.171	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	113.6	175.9	-58	93.3	0	0	0	111.2	C377 I378 L379 C380 F561 V564	C377-H536 PolarHBondContact SG-ND1 3.3Å; I378-H536 PolarHBondContact O-N 3.49Å; L379-H536 CarbonylContact C-O 3.57Å; L379-H536 WeakPolarHBondContact CA-O 3.39Å; L379-H536 HydrophobicContact CD2-CB 4.16Å; C380-H536 PolarHBondContact N-O 3.38Å; H536-F561 HydrophobicContact CB-CE1 4.43Å; H536-F561 HydrophobicContact CB-CE2 3.83Å; H536-F561 HydrophobicContact CB-CZ 3.34Å; H536-F561 AromaticContact CG-CZ 3.78Å; H536-V564 PolarHBondContact NE2-O 2.93Å
537	P	85.4	Confident	80.5	Confident	24 Å²	24	40.1 Å²	40.1	16%	0.156	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	134.1	179.6	27.5	-32.7	0	0	0	111.4	C380 I524 F528	C380-P537 WeakPolarHBondContact O-CA 3.46Å; I524-P537 HydrophobicContact CB-CG 4.42Å; I524-P537 HydrophobicContact CD1-CG 3.96Å; I524-P537 HydrophobicContact CG1-CB 4.21Å; I524-P537 HydrophobicContact CG1-CG 4.07Å; I524-P537 HydrophobicContact CG2-CB 3.86Å; I524-P537 HydrophobicContact CG2-CG 3.46Å; I524-P537 VanDerWaalsContact CG2-CG 3.46Å; F528-P537 HydrophobicContact CD1-CB 4Å; F528-P537 HydrophobicContact CD2-CB 4.03Å; F528-P537 HydrophobicContact CE1-CB 4.1Å; F528-P537 HydrophobicContact CE2-CB 4.11Å; F528-P537 HydrophobicContact CG-CB 3.95Å; F528-P537 HydrophobicContact CZ-CB 4.14Å
538	V	86.9	Confident	80.7	Confident	8 Å²	8	41.1 Å²	41.1	5%	0.048	21%	0.209	C	C	.	.			trans	-108.5	129.2	-179.4	-173.7	0	0	0	0	110.5	L379 C380 L400 L467	L379-V538 HydrophobicContact CB-CG2 3.94Å; L379-V538 HydrophobicContact CD1-CG2 4.3Å; L379-V538 HydrophobicContact CD2-CG2 3.89Å; L379-V538 HydrophobicContact CG-CG2 4.25Å; C380-V538 PolarHBondContact O-N 2.79Å; L400-V538 HydrophobicContact CD2-CB 4.07Å; L400-V538 HydrophobicContact CD2-CG1 3.74Å; L400-V538 HydrophobicContact CD2-CG2 4.08Å; L467-V538 HydrophobicContact CD2-CB 4.16Å; L467-V538 HydrophobicContact CD2-CG1 3.9Å
539	I	88.9	Confident	80.9	Confident	23 Å²	23	45 Å²	45	12%	0.118	23%	0.227	C	C	.	.			trans	-89.5	134.2	179.4	-54.1	-179.3	0	0	0	109.4	Y520 F523 I524 C543 V544	Y520-I539 HydrophobicContact CD1-CD1 3.8Å; Y520-I539 HydrophobicContact CG-CD1 3.96Å; F523-I539 HydrophobicContact CD1-CB 4.27Å; F523-I539 HydrophobicContact CD1-CD1 4.24Å; F523-I539 HydrophobicContact CD1-CG1 3.89Å; F523-I539 HydrophobicContact CD1-CG2 3.71Å; F523-I539 HydrophobicContact CE1-CB 4.34Å; F523-I539 HydrophobicContact CE1-CG1 4.34Å; F523-I539 HydrophobicContact CE1-CG2 3.77Å; F523-I539 HydrophobicContact CG-CG2 4.31Å; F523-I539 HydrophobicContact CZ-CG2 4.41Å; I524-I539 HydrophobicContact CD1-CD1 4.07Å; I524-I539 HydrophobicContact CD1-CG1 4.29Å; I524-I539 HydrophobicContact CG1-CD1 4.04Å; I524-I539 HydrophobicContact CG1-CG1 4.01Å; I539-C543 HydrophobicContact CG2-CB 3.8Å; I539-V544 HydrophobicContact CB-CG2 3.73Å; I539-V544 HydrophobicContact CG2-CG2 3.55Å
540	P	90.3	Very high	81.3	Confident	4 Å²	4	49.2 Å²	49.2	3%	0.026	24%	0.244	C	C	.	.			trans	-60.8	147.2	176.4	-23.9	34	0	0	0	113.7	L467 C469 F523 C542 C543 V544	L467-P540 HydrophobicContact CD2-CG 4.28Å; L467-P540 HydrophobicContact CG-CB 4.5Å; L467-P540 WeakPolarHBondContact O-CA 3.46Å; C469-P540 HydrophobicContact CB-CB 4.03Å; C469-P540 HydrophobicContact CB-CG 4.01Å; F523-P540 HydrophobicContact CZ-CG 4.36Å; P540-C542 PolarHBondContact O-N 3.34Å; P540-C543 WeakPolarHBondContact O-CB 3.22Å; P540-C543 PolarHBondContact O-N 3.36Å; P540-V544 PolarHBondContact O-N 2.92Å
541	S	87.8	Confident	82.1	Confident	13 Å²	13	41.5 Å²	41.5	9%	0.091	21%	0.21	C	C	.	.	H	α-helix	trans	-55.3	-44.4	-177.4	173.3	0	0	0	0	113.2	T458 L467 C543 V544 Q545	T458-S541 PolarHBondContact N-OG 2.83Å; T458-S541 PolarHBondContact O-OG 3.26Å; L467-S541 PolarHBondContact O-N 2.84Å; S541-C543 VanDerWaalsContact C-N 3.29Å; S541-C543 PolarHBondContact O-N 3.15Å; S541-V544 PolarHBondContact O-N 2.95Å; S541-Q545 WeakPolarHBondContact O-CB 3.42Å; S541-Q545 PolarHBondContact O-N 3.19Å
542	C	88.5	Confident	83.1	Confident	3 Å²	3	42.9 Å²	42.9	2%	0.02	22%	0.218	C	C	.	.	H	α-helix	trans	-58	-37.3	176.5	53.8	0	0	0	0	113.7	C456 C476 P540 R546	C456-C542 HydrophobicContact CB-CB 3.96Å; C456-C542 WeakPolarHBondContact O-CA 3.4Å; C456-C542 WeakPolarHBondContact O-CB 3.45Å; C476-C542 VanDerWaalsContact SG-SG 3.69Å; P540-C542 PolarHBondContact O-N 3.34Å; C542-R546 WeakPolarHBondContact O-CB 3.43Å; C542-R546 PolarHBondContact O-N 3.13Å; C542-R546 VanDerWaalsContact O-N 3.13Å
543	C	89.1	Confident	83.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-75.3	-44.2	178.9	-60.6	0	0	0	0	110.8	I477 F483 F523 I539 P540 S541 Q545 R546 I547	I477-C543 WeakPolarHBondContact CG2-SG 3.26Å; F483-C543 HydrophobicContact CE2-CB 3.84Å; F483-C543 HydrophobicContact CZ-CB 3.99Å; F523-C543 HydrophobicContact CE2-CB 4.14Å; F523-C543 HydrophobicContact CZ-CB 4.34Å; I539-C543 HydrophobicContact CG2-CB 3.8Å; P540-C543 WeakPolarHBondContact O-CB 3.22Å; P540-C543 PolarHBondContact O-N 3.36Å; S541-C543 VanDerWaalsContact C-N 3.29Å; S541-C543 PolarHBondContact O-N 3.15Å; C543-Q545 VanDerWaalsContact C-N 3.31Å; C543-Q545 PolarHBondContact O-N 3.16Å; C543-R546 PolarHBondContact O-N 2.97Å; C543-I547 WeakPolarHBondContact O-CD1 3.44Å; C543-I547 VanDerWaalsContact O-CG1 3.25Å; C543-I547 WeakPolarHBondContact O-CG1 3.04Å; C543-I547 PolarHBondContact O-N 3.43Å
544	V	87.1	Confident	84.5	Confident	26 Å²	26	40 Å²	40	16%	0.158	21%	0.209	C	C	.	.	H	α-helix	trans	-58.5	-46.1	176.3	174.2	0	0	0	0	110.4	Y520 I539 P540 S541 I547 R548	Y520-V544 HydrophobicContact CE1-CG1 4.38Å; I539-V544 HydrophobicContact CB-CG2 3.73Å; I539-V544 HydrophobicContact CG2-CG2 3.55Å; P540-V544 PolarHBondContact O-N 2.92Å; S541-V544 PolarHBondContact O-N 2.95Å; V544-I547 PolarHBondContact O-N 2.86Å; V544-R548 HydrophobicContact CG1-CG 4.43Å; V544-R548 VanDerWaalsContact CG1-CZ 3.4Å; V544-R548 WeakPolarHBondContact O-CB 3.45Å; V544-R548 WeakPolarHBondContact O-CG 3.43Å; V544-R548 PolarHBondContact O-N 3.36Å
545	Q	86.3	Confident	84.8	Confident	28 Å²	28	42.5 Å²	42.5	13%	0.131	22%	0.222	C	C	.	.	H	α-helix	trans	-60.4	-49.2	177.3	-177.8	-177.1	-11.7	0	0	111.2	C456 S541 C543 I547 R548 E549	C456-Q545 PolarHBondContact O-OE1 3.16Å; S541-Q545 WeakPolarHBondContact O-CB 3.42Å; S541-Q545 PolarHBondContact O-N 3.19Å; C543-Q545 VanDerWaalsContact C-N 3.31Å; C543-Q545 PolarHBondContact O-N 3.16Å; Q545-I547 VanDerWaalsContact C-N 3.3Å; Q545-I547 PolarHBondContact O-N 3.29Å; Q545-R548 CarbonylContact O-C 3.59Å; Q545-R548 PolarHBondContact O-N 3.22Å; Q545-E549 HydrophobicContact CG-CG 4.41Å; Q545-E549 PolarHBondContact NE2-OE1 2.68Å; Q545-E549 WeakPolarHBondContact O-CG 3.39Å; Q545-E549 PolarHBondContact O-N 3.44Å
546	R	87.9	Confident	84.6	Confident	110 Å²	110	44.2 Å²	44.2	42%	0.415	24%	0.243	S	C	.	.	H	α-helix	trans	-60.9	-38.9	-178.4	-165.1	66.1	179	150.1	2.9	112.8	A478 F483 L488 C542 C543 E549 E550	A478-R546 HydrophobicContact CB-CB 4.08Å; A478-R546 HydrophobicContact CB-CG 4.28Å; F483-R546 HydrophobicContact CE1-CB 4.15Å; F483-R546 HydrophobicContact CE1-CG 3.99Å; F483-R546 HydrophobicContact CZ-CB 4.48Å; L488-R546 HydrophobicContact CD1-CG 4.12Å; C542-R546 WeakPolarHBondContact O-CB 3.43Å; C542-R546 PolarHBondContact O-N 3.13Å; C542-R546 VanDerWaalsContact O-N 3.13Å; C543-R546 PolarHBondContact O-N 2.97Å; R546-E549 IonicContact CZ-OE2 3.03Å; R546-E549 IonicContact NH1-OE2 2.89Å; R546-E549 PolarHBondContact NH1-OE2 3.2Å; R546-E549 PolarHBondContact O-N 2.87Å; R546-E550 PolarHBondContact O-N 3.25Å
547	I	88.1	Confident	84.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.9	-38.4	175	-64.8	165	0	0	0	111.1	F483 V487 L488 R516 A519 Y520 C543 V544 Q545 E550 Y551	F483-I547 HydrophobicContact CZ-CD1 4.25Å; F483-I547 HydrophobicContact CZ-CG1 4.01Å; V487-I547 HydrophobicContact CG1-CD1 3.63Å; V487-I547 HydrophobicContact CG1-CG1 3.89Å; L488-I547 HydrophobicContact CD2-CB 4.44Å; L488-I547 HydrophobicContact CD2-CG1 3.9Å; R516-I547 HydrophobicContact CG-CG2 4.07Å; A519-I547 HydrophobicContact CB-CD1 4.34Å; A519-I547 HydrophobicContact CB-CG1 4.41Å; A519-I547 HydrophobicContact CB-CG2 3.66Å; Y520-I547 HydrophobicContact CD1-CD1 3.71Å; Y520-I547 HydrophobicContact CD1-CG2 4.13Å; Y520-I547 HydrophobicContact CE1-CB 4.02Å; Y520-I547 HydrophobicContact CE1-CD1 3.95Å; Y520-I547 HydrophobicContact CE1-CG2 3.73Å; C543-I547 WeakPolarHBondContact O-CD1 3.44Å; C543-I547 VanDerWaalsContact O-CG1 3.25Å; C543-I547 WeakPolarHBondContact O-CG1 3.04Å; C543-I547 PolarHBondContact O-N 3.43Å; V544-I547 PolarHBondContact O-N 2.86Å; Q545-I547 VanDerWaalsContact C-N 3.3Å; Q545-I547 PolarHBondContact O-N 3.29Å; I547-E550 PolarHBondContact O-N 3.27Å; I547-Y551 HydrophobicContact CG2-CD2 4.44Å; I547-Y551 PolarHBondContact O-N 3.47Å
548	R	88	Confident	83.9	Confident	58 Å²	58	55.4 Å²	55.4	22%	0.219	28%	0.281	C	S	.	.	H	α-helix	trans	-71.5	-28.7	177.5	-70.1	174.8	-177.7	-177.1	1	113.2	Y520 V544 Q545 Y551 P552 Y558	Y520-R548 WeakPolarHBondContact OH-CG 3.28Å; Y520-R548 PolarHBondContact OH-NE 3.07Å; V544-R548 HydrophobicContact CG1-CG 4.43Å; V544-R548 VanDerWaalsContact CG1-CZ 3.4Å; V544-R548 WeakPolarHBondContact O-CB 3.45Å; V544-R548 WeakPolarHBondContact O-CG 3.43Å; V544-R548 PolarHBondContact O-N 3.36Å; Q545-R548 CarbonylContact O-C 3.59Å; Q545-R548 PolarHBondContact O-N 3.22Å; R548-Y551 CarbonylContact O-C 3.58Å; R548-P552 VanDerWaalsContact O-CA 3.28Å; R548-P552 WeakPolarHBondContact O-CA 3.47Å; R548-Y558 HydrophobicContact CB-CE1 3.81Å; R548-Y558 HydrophobicContact CG-CD1 3.76Å; R548-Y558 HydrophobicContact CG-CE1 3.45Å; R548-Y558 VanDerWaalsContact CG-CE1 3.45Å; R548-Y558 HydrophobicContact CG-CG 4.49Å
549	E	86.4	Confident	83.2	Confident	83 Å²	83	58.6 Å²	58.6	39%	0.388	30%	0.304	S	S	.	.	H	α-helix	trans	-67.7	-43	172.3	-73.7	172.6	-179.7	0	0	111	Q545 R546	Q545-E549 HydrophobicContact CG-CG 4.41Å; Q545-E549 PolarHBondContact NE2-OE1 2.68Å; Q545-E549 WeakPolarHBondContact O-CG 3.39Å; Q545-E549 PolarHBondContact O-N 3.44Å; R546-E549 IonicContact CZ-OE2 3.03Å; R546-E549 IonicContact NH1-OE2 2.89Å; R546-E549 PolarHBondContact NH1-OE2 3.2Å; R546-E549 PolarHBondContact O-N 2.87Å
550	E	86.1	Confident	82.2	Confident	101 Å²	101	59 Å²	59	47%	0.472	31%	0.313	S	S	.	.	H	α-helix	trans	-74	-38.1	179	-162.9	68.5	-152.6	0	0	112.6	L488 R546 I547 P552	L488-E550 HydrophobicContact CB-CG 4.49Å; L488-E550 HydrophobicContact CD2-CB 4.09Å; L488-E550 HydrophobicContact CD2-CG 4.37Å; R546-E550 PolarHBondContact O-N 3.25Å; I547-E550 PolarHBondContact O-N 3.27Å; E550-P552 WeakPolarHBondContact O-CD 3.48Å
551	Y	87.1	Confident	81.2	Confident	15 Å²	15	62.3 Å²	62.3	6%	0.059	33%	0.327	C	S	.	.	S	Bend	trans	-123.6	76.7	-178.7	-58.5	-66.9	0	0	0	111	L488 R490 L493 L515 I547 R548	L488-Y551 PolarHBondContact O-OH 2.78Å; R490-Y551 VanDerWaalsContact CA-OH 3.3Å; R490-Y551 WeakPolarHBondContact CA-OH 3.39Å; R490-Y551 WeakPolarHBondContact CB-OH 3.05Å; R490-Y551 PolarHBondContact N-OH 3.08Å; L493-Y551 HydrophobicContact CD1-CE2 3.69Å; L515-Y551 HydrophobicContact CB-CD1 3.91Å; L515-Y551 HydrophobicContact CB-CE1 4.01Å; L515-Y551 HydrophobicContact CB-CG 4.24Å; L515-Y551 HydrophobicContact CD1-CD1 4.1Å; L515-Y551 HydrophobicContact CD1-CE1 3.84Å; I547-Y551 HydrophobicContact CG2-CD2 4.44Å; I547-Y551 PolarHBondContact O-N 3.47Å; R548-Y551 CarbonylContact O-C 3.58Å
552	P	84.6	Confident	80.1	Confident	68 Å²	68	71.1 Å²	71.1	44%	0.442	36%	0.358	S	S	.	.			trans	-72.6	152.9	-173.6	28.5	-35	0	0	0	113.1	P512 R548 E550	P512-P552 VanDerWaalsContact CB-O 3.28Å; P512-P552 WeakPolarHBondContact CB-O 3.28Å; R548-P552 VanDerWaalsContact O-CA 3.28Å; R548-P552 WeakPolarHBondContact O-CA 3.47Å; E550-P552 WeakPolarHBondContact O-CD 3.48Å
553	S	81.1	Confident	78.8	Confident	23 Å²	23	73 Å²	73	16%	0.161	37%	0.371	C	S	.	.			trans	-82.3	137.1	169.3	-140.1	0	0	0	0	110.2	R516 D555 G556 Y558	R516-S553 PolarHBondContact NH1-OG 3.26Å; S553-D555 VanDerWaalsContact C-N 3.25Å; S553-D555 PolarHBondContact O-N 3.14Å; S553-G556 PolarHBondContact O-N 2.9Å; S553-G556 VanDerWaalsContact O-N 3.14Å; S553-Y558 PolarHBondContact N-OH 3.21Å
554	P	73	Confident	77.2	Confident	120 Å²	120	78.2 Å²	78.2	78%	0.779	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-34.4	179.3	20.5	-30.6	0	0	0	113.2
555	D	71.9	Confident	75	Confident	133 Å²	133	87.5 Å²	87.5	71%	0.711	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	3.2	-179.2	-49.4	-49.7	0	0	0	114.3	S553 R557	S553-D555 VanDerWaalsContact C-N 3.25Å; S553-D555 PolarHBondContact O-N 3.14Å; D555-R557 PolarHBondContact O-N 3.31Å
556	G	68.8	Low	72.4	Confident	52 Å²	52	91.6 Å²	91.6	54%	0.536	46%	0.462	S	S	.	.	S	Bend	trans	64.6	-3.4	-177.3	0	0	0	0	0	116.4	S553 Y558	S553-G556 PolarHBondContact O-N 2.9Å; S553-G556 VanDerWaalsContact O-N 3.14Å; G556-Y558 WeakPolarHBondContact O-CD2 3.5Å; G556-Y558 WeakPolarHBondContact O-CE2 3.31Å
557	R	74.6	Confident	69.4	Low	218 Å²	218	91.4 Å²	91.4	82%	0.823	47%	0.472	S	S	*	.			trans	-92.6	133.7	177.8	-65.8	-178.9	-178.8	-179	1.1	111.2	D555	D555-R557 PolarHBondContact O-N 3.31Å
558	Y	78.8	Confident	66.6	Low	78 Å²	78	96.5 Å²	96.5	31%	0.306	51%	0.508	S	S	.	.			trans	-121.7	136	178.4	-59.5	-90.2	0	0	0	110.6	R548 S553 G556	R548-Y558 HydrophobicContact CB-CE1 3.81Å; R548-Y558 HydrophobicContact CG-CD1 3.76Å; R548-Y558 HydrophobicContact CG-CE1 3.45Å; R548-Y558 VanDerWaalsContact CG-CE1 3.45Å; R548-Y558 HydrophobicContact CG-CG 4.49Å; S553-Y558 PolarHBondContact N-OH 3.21Å; G556-Y558 WeakPolarHBondContact O-CD2 3.5Å; G556-Y558 WeakPolarHBondContact O-CE2 3.31Å
559	S	72.3	Confident	63.5	Low	75 Å²	75	99.7 Å²	99.7	52%	0.524	53%	0.534	S	S	.	.			trans	-78.5	131.3	167.5	47.9	0	0	0	0	110.1
560	G	69	Low	60.6	Low	30 Å²	30	100.7 Å²	100.7	31%	0.309	55%	0.547	S	S	.	.			trans	-72.1	-176.3	174.4	0	0	0	0	0	113.2	E465 R562	E465-G560 WeakPolarHBondContact OE1-CA 3.32Å; G560-R562 PolarHBondContact O-N 3.15Å
561	F	68.1	Low	57.7	Low	74 Å²	74	101.5 Å²	101.5	33%	0.325	56%	0.559	S	S	.	*			trans	-57.6	119.1	178.9	173.2	-96.5	0	0	0	111.8	L379 E465 H536 P563	L379-F561 HydrophobicContact CD2-CE1 3.72Å; L379-F561 HydrophobicContact CD2-CZ 3.93Å; E465-F561 PolarHBondContact OE1-N 3.39Å; H536-F561 HydrophobicContact CB-CE1 4.43Å; H536-F561 HydrophobicContact CB-CE2 3.83Å; H536-F561 HydrophobicContact CB-CZ 3.34Å; H536-F561 AromaticContact CG-CZ 3.78Å; F561-P563 HydrophobicContact CE1-CB 4.06Å; F561-P563 HydrophobicContact CE1-CG 4.41Å; F561-P563 HydrophobicContact CZ-CB 4.17Å
562	R	65.9	Low	54.7	Low	199 Å²	199	111.6 Å²	111.6	75%	0.751	60%	0.597	S	S	*	*			trans	-110	116.7	171.6	-68	-176	-179.7	-175.8	0.1	108.2	G560 V564	G560-R562 PolarHBondContact O-N 3.15Å; R562-V564 PolarHBondContact O-N 3.31Å
563	P	59.7	Low	51.9	Low	43 Å²	43	115.8 Å²	115.8	28%	0.279	62%	0.616	S	S	.	*			trans	-62	124.5	171.3	25.9	-30.4	0	0	0	107.2	F561 R565	F561-P563 HydrophobicContact CE1-CB 4.06Å; F561-P563 HydrophobicContact CE1-CG 4.41Å; F561-P563 HydrophobicContact CZ-CB 4.17Å; P563-R565 PolarHBondContact O-N 2.97Å
564	V	55.7	Low	49.4	Very low	109 Å²	109	121.5 Å²	121.5	66%	0.661	65%	0.645	S	S	*	*			trans	-60.3	107.4	167.6	178.7	0	0	0	0	104.6	H536 R562 T566	H536-V564 PolarHBondContact NE2-O 2.93Å; R562-V564 PolarHBondContact O-N 3.31Å; V564-T566 PolarHBondContact O-N 3.4Å
565	R	42.3	Very low	47.1	Very low	220 Å²	220	119.3 Å²	119.3	83%	0.83	64%	0.644	S	S	*	*			trans	-58.1	120.3	157.5	-81.8	-178.2	175.6	175.1	-2.4	103.4	P563 V567	P563-R565 PolarHBondContact O-N 2.97Å; R565-V567 PolarHBondContact O-N 3.07Å
566	T	31.8	Very low	45	Very low	115 Å²	115	122 Å²	122	71%	0.706	65%	0.652	S	S	*	*			trans	-54.1	91.6	158.8	25.6	0	0	0	0	105.6	V564 S568	V564-T566 PolarHBondContact O-N 3.4Å; T566-S568 PolarHBondContact O-N 2.89Å; T566-S568 VanDerWaalsContact O-N 3.11Å
567	V	25.1	Very low	43	Very low	105 Å²	105	131.3 Å²	131.3	64%	0.636	69%	0.688	S	S	*	*			trans	-63.6	111.7	164.2	173.8	0	0	0	0	102.3	R565 V569	R565-V567 PolarHBondContact O-N 3.07Å; V567-V569 PolarHBondContact O-N 2.89Å
568	S	27.9	Very low	41.5	Very low	107 Å²	107	127 Å²	127	75%	0.748	68%	0.682	S	S	*	*			trans	-39.8	111.7	159.9	48.7	0	0	0	0	107.6	T566	T566-S568 PolarHBondContact O-N 2.89Å; T566-S568 VanDerWaalsContact O-N 3.11Å
569	V	24.1	Very low	39.5	Very low	126 Å²	126	129.6 Å²	129.6	76%	0.764	70%	0.701	S	S	*	*			trans	-0.7	107.2	171.3	-177.8	0	0	0	0	113.3	V567 T571	V567-V569 PolarHBondContact O-N 2.89Å; V569-T571 PolarHBondContact O-N 2.95Å
570	P	23.7	Very low	37.7	Very low	104 Å²	104	132.6 Å²	132.6	68%	0.675	71%	0.711	S	S	*	*			trans	-71.9	115.3	160.1	25.9	-20.2	0	0	0	106.8	R572	P570-R572 PolarHBondContact O-N 3.23Å
571	T	26.1	Very low	35.8	Very low	117 Å²	117	138.6 Å²	138.6	72%	0.718	74%	0.735	S	S	*	*			trans	-45.8	123.4	166.7	27.5	0	0	0	0	109.8	V569 N573	V569-T571 PolarHBondContact O-N 2.95Å; T571-N573 PolarHBondContact O-N 3.22Å; T571-N573 VanDerWaalsContact O-N 3.08Å
572	R	25.2	Very low	33.8	Very low	228 Å²	228	142.7 Å²	142.7	86%	0.86	76%	0.76	S	S	*	*			trans	-68	101.3	175.3	-144.5	-178.6	-168.4	-179.2	0.6	107.2	P570 N574	P570-R572 PolarHBondContact O-N 3.23Å; R572-N574 PolarHBondContact O-N 3.16Å
573	N	25.2	Very low	31.7	Very low	155 Å²	155	138.9 Å²	138.9	83%	0.829	76%	0.761	S	S	*	*			trans	-70.6	105.7	162.8	-90.2	0.3	0	0	0	107.3	T571 G575	T571-N573 PolarHBondContact O-N 3.22Å; T571-N573 VanDerWaalsContact O-N 3.08Å; N573-G575 PolarHBondContact O-N 2.86Å
574	N	28.6	Very low	29.7	Very low	144 Å²	144	145.8 Å²	145.8	77%	0.77	80%	0.795	S	S	*	*			trans	-70.1	107.1	161.8	-74.2	-14	0	0	0	107.3	R572	R572-N574 PolarHBondContact O-N 3.16Å
575	G	25.1	Very low	27.7	Very low	73 Å²	73	148.6 Å²	148.6	75%	0.753	81%	0.806	S	S	*	*			trans	-86.7	129	157	0	0	0	0	0	108.4	N573	N573-G575 PolarHBondContact O-N 2.86Å
576	E	27.2	Very low	26.5	Very low	190 Å²	190	142.7 Å²	142.7	89%	0.888	80%	0.804	S	S	*	*			trans	-57.3	127	173.4	-63.3	164.1	130.1	0	0	111.6
577	L	27.4	Very low	26	Very low	248 Å²	248	145.2 Å²	145.2	100%	1.298	81%	0.813	S	S	*	*				176.8	0	113.2	-100.8	148.6	0	0	0	110.2

Retrieved 577 of 577 residues in 381.2 ms (Link to these results)

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