A0A5K4F3F0_SCHMA Loading...

Zf-TFIIIC domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F3F0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 560 aa.

Structure Viewer

Loading PAE data...

(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	33.2	Very low	33.3	Very low	241 Å²	241	138.2 Å²	138.2	100%	1.187	79%	0.791	S	S	*	*				0	108.9	0	-74.7	-171.8	-172.6	0	0	107.1	N3	M1-N3 PolarHBondContact O-N 2.74Å
2	N	34.5	Very low	33.3	Very low	164 Å²	164	134.2 Å²	134.2	88%	0.877	77%	0.77	S	S	*	*			trans	-73.8	107.5	-174.7	-66.7	-17.6	0	0	0	109.5
3	N	31.7	Very low	33.7	Very low	153 Å²	153	134.3 Å²	134.3	82%	0.818	77%	0.774	S	S	*	*			trans	-117.7	107.5	154.1	-105.2	-13.4	0	0	0	106.1	M1 T5	M1-N3 PolarHBondContact O-N 2.74Å; N3-T5 PolarHBondContact O-N 3.36Å
4	P	38	Very low	33.9	Very low	108 Å²	108	132.5 Å²	132.5	70%	0.701	76%	0.76	S	S	*	*			trans	-68.1	109.9	179	28.8	-28.8	0	0	0	106.2	I6	P4-I6 VanDerWaalsContact C-N 3.25Å; P4-I6 PolarHBondContact O-N 3.02Å
5	T	35	Very low	34.2	Very low	138 Å²	138	131.4 Å²	131.4	85%	0.847	76%	0.763	S	S	*	*			trans	-55.5	97	164.2	16.3	0	0	0	0	106.9	N3 S7	N3-T5 PolarHBondContact O-N 3.36Å; T5-S7 PolarHBondContact O-N 2.77Å
6	I	34.2	Very low	34.6	Very low	156 Å²	156	127 Å²	127	80%	0.8	74%	0.739	S	S	*	*			trans	-58.2	94.9	164.2	-61.4	168.9	0	0	0	104.3	P4	P4-I6 VanDerWaalsContact C-N 3.25Å; P4-I6 PolarHBondContact O-N 3.02Å
7	S	29.8	Very low	34.8	Very low	96 Å²	96	132.1 Å²	132.1	67%	0.671	75%	0.75	S	S	*	*			trans	-63.2	123.2	170.1	34.1	0	0	0	0	105.6	T5 I9	T5-S7 PolarHBondContact O-N 2.77Å; S7-I9 PolarHBondContact O-N 2.72Å; S7-I9 VanDerWaalsContact O-N 3.16Å
8	P	32	Very low	35.1	Very low	95 Å²	95	126.3 Å²	126.3	62%	0.617	73%	0.725	S	S	*	*			trans	-60	126.3	-179.1	22.4	-29.7	0	0	0	107.9	T10	P8-T10 VanDerWaalsContact C-N 3.27Å; P8-T10 HydrophobicContact CB-CG2 4.25Å; P8-T10 HydrophobicContact CG-CG2 4.1Å; P8-T10 WeakPolarHBondContact O-CG2 3.3Å; P8-T10 PolarHBondContact O-N 2.72Å; P8-T10 PolarHBondContact O-OG1 2.87Å
9	I	29.2	Very low	35.2	Very low	158 Å²	158	127.6 Å²	127.6	81%	0.81	72%	0.723	S	S	*	*			trans	-59.6	96.4	171.2	-61	167.6	0	0	0	105.6	S7	S7-I9 PolarHBondContact O-N 2.72Å; S7-I9 VanDerWaalsContact O-N 3.16Å
10	T	36	Very low	35.3	Very low	123 Å²	123	125 Å²	125	76%	0.755	71%	0.706	S	S	*	*			trans	-94.7	8.2	-165.9	27	0	0	0	0	113.1	P8	P8-T10 VanDerWaalsContact C-N 3.27Å; P8-T10 HydrophobicContact CB-CG2 4.25Å; P8-T10 HydrophobicContact CG-CG2 4.1Å; P8-T10 WeakPolarHBondContact O-CG2 3.3Å; P8-T10 PolarHBondContact O-N 2.72Å; P8-T10 PolarHBondContact O-OG1 2.87Å
11	S	33.3	Very low	35.4	Very low	88 Å²	88	121.9 Å²	121.9	62%	0.615	69%	0.692	S	S	*	*			trans	-148.1	120.5	178.1	59	0	0	0	0	111.1
12	V	33	Very low	35.7	Very low	90 Å²	90	112.8 Å²	112.8	55%	0.545	65%	0.65	S	S	.	*			trans	-114.3	125.9	166.2	176.5	0	0	0	0	107	L14	V12-L14 HydrophobicContact CG1-CD1 4.38Å; V12-L14 HydrophobicContact CG1-CG 4.32Å
13	V	38.3	Very low	35.8	Very low	136 Å²	136	106.9 Å²	106.9	82%	0.824	62%	0.62	S	S	*	*			trans	-84.6	112.5	173.7	-180	0	0	0	0	107.6
14	L	37	Very low	35.8	Very low	109 Å²	109	100.3 Å²	100.3	57%	0.571	59%	0.589	S	S	*	*			trans	-105.1	119.5	176.3	-93.9	148.6	0	0	0	109.6	V12 V16	V12-L14 HydrophobicContact CG1-CD1 4.38Å; V12-L14 HydrophobicContact CG1-CG 4.32Å; L14-V16 PolarHBondContact O-N 2.93Å
15	S	37.4	Very low	35.7	Very low	116 Å²	116	96.5 Å²	96.5	81%	0.811	57%	0.569	S	S	*	*			trans	-75.6	101.3	168.3	-74.1	0	0	0	0	109.1	K17	S15-K17 PolarHBondContact O-N 2.72Å
16	V	40.6	Very low	35.5	Very low	61 Å²	61	92.5 Å²	92.5	37%	0.37	55%	0.546	S	S	.	.			trans	-84.4	107.6	178.1	-173.8	0	0	0	0	109.5	L14 I36 T38	L14-V16 PolarHBondContact O-N 2.93Å; V16-I36 HydrophobicContact CG1-CG2 3.56Å; V16-T38 HydrophobicContact CG1-CG2 3.4Å
17	K	38.6	Very low	35.4	Very low	213 Å²	213	88.7 Å²	88.7	93%	0.926	53%	0.53	S	S	*	.			trans	-92.5	92.7	163.6	-75.5	-174.2	178.1	-178.9	0	108.2	S15	S15-K17 PolarHBondContact O-N 2.72Å
18	G	40.3	Very low	35.5	Very low	29 Å²	29	87 Å²	87	30%	0.299	53%	0.527	S	S	.	.			trans	-138.2	162.9	179.5	0	0	0	0	0	111.5	I20 S37	G18-I20 PolarHBondContact O-N 3.15Å; G18-S37 WeakPolarHBondContact CA-O 3.44Å
19	H	36.8	Very low	35.6	Very low	151 Å²	151	84 Å²	84	70%	0.699	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	123.1	172.1	-69.8	-80.1	0	0	0	108.9	S37	H19-S37 PolarHBondContact N-O 3Å; H19-S37 PolarHBondContact O-N 2.83Å
20	I	36.9	Very low	35.9	Very low	74 Å²	74	81.9 Å²	81.9	38%	0.379	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	124.9	176.6	-59.8	175	0	0	0	107.7	G18 I34 Y215	G18-I20 PolarHBondContact O-N 3.15Å; I20-I34 HydrophobicContact CG2-CG2 3.7Å; I20-Y215 PolarHBondContact O-OH 2.81Å; I20-Y215 VanDerWaalsContact O-OH 3.1Å
21	C	38.8	Very low	36.1	Very low	61 Å²	61	82 Å²	82	41%	0.412	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	124.8	177.5	-58	0	0	0	0	109	A35	C21-A35 PolarHBondContact N-O 3.12Å; C21-A35 PolarHBondContact O-N 2.73Å; C21-A35 VanDerWaalsContact O-O 3.14Å
22	T	38.6	Very low	36.4	Very low	50 Å²	50	78.3 Å²	78.3	31%	0.307	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	123.6	172.5	61.4	0	0	0	0	109.3	G24 Y215 F216 I219	T22-G24 VanDerWaalsContact C-N 3.26Å; T22-G24 PolarHBondContact O-N 3.25Å; T22-Y215 HydrophobicContact CG2-CE1 4.41Å; T22-F216 HydrophobicContact CG2-CE1 3.95Å; T22-I219 HydrophobicContact CG2-CD1 4.35Å
23	T	35.8	Very low	37	Very low	40 Å²	40	79.1 Å²	79.1	25%	0.245	47%	0.469	C	S	.	.			trans	-93.1	37	-178.6	56.7	0	0	0	0	114	K33 A35 L105	T23-K33 PolarHBondContact N-O 2.8Å; T23-K33 VanDerWaalsContact OG1-CB 3.22Å; T23-K33 WeakPolarHBondContact OG1-CB 3.06Å; T23-K33 PolarHBondContact OG1-O 2.87Å; T23-A35 HydrophobicContact CG2-CB 3.47Å; T23-A35 VanDerWaalsContact CG2-CB 3.47Å; T23-L105 HydrophobicContact CG2-CD2 4.49Å
24	G	32.8	Very low	37.5	Very low	15 Å²	15	73.7 Å²	73.7	16%	0.155	44%	0.435	C	S	.	.	S	Bend	trans	87.2	142.1	177.7	0	0	0	0	0	112.9	T22 S103	T22-G24 VanDerWaalsContact C-N 3.26Å; T22-G24 PolarHBondContact O-N 3.25Å; G24-S103 VanDerWaalsContact CA-CB 3.48Å
25	G	34.9	Very low	38	Very low	28 Å²	28	68.7 Å²	68.7	29%	0.289	41%	0.41	S	S	.	.	S	Bend	trans	119.7	152.1	-171.3	0	0	0	0	0	111.8
26	C	31.2	Very low	38.5	Very low	53 Å²	53	64.6 Å²	64.6	36%	0.358	38%	0.378	S	S	.	.			trans	-80.6	140.6	163.3	-69.8	0	0	0	0	108.2	G28 S29 V100	C26-G28 PolarHBondContact O-N 2.94Å; C26-G28 VanDerWaalsContact O-N 3.09Å; C26-S29 WeakPolarHBondContact O-CB 3.13Å; C26-S29 PolarHBondContact O-N 3.1Å; C26-V100 HydrophobicContact CB-CG1 4.15Å
27	V	33.1	Very low	38.5	Very low	77 Å²	77	64.3 Å²	64.3	47%	0.467	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	117.4	178.2	178.9	0	0	0	0	109.8	D32 F216	V27-D32 VanDerWaalsContact CA-OD2 3.26Å; V27-D32 WeakPolarHBondContact CA-OD2 3.4Å; V27-F216 HydrophobicContact CG2-CD1 4.33Å; V27-F216 HydrophobicContact CG2-CE1 3.73Å; V27-F216 HydrophobicContact CG2-CZ 3.85Å
28	G	31.8	Very low	39	Very low	59 Å²	59	56 Å²	56	61%	0.608	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.9	3.3	-175.3	0	0	0	0	0	116.1	C26 D32	C26-G28 PolarHBondContact O-N 2.94Å; C26-G28 VanDerWaalsContact O-N 3.09Å; G28-D32 PolarHBondContact N-OD2 2.66Å
29	S	33.7	Very low	39.2	Very low	32 Å²	32	61.5 Å²	61.5	22%	0.224	38%	0.375	C	S	.	.	S	Bend	trans	-76.9	154.5	166.7	91.1	0	0	0	0	110.8	C26 E31 D32	C26-S29 WeakPolarHBondContact O-CB 3.13Å; C26-S29 PolarHBondContact O-N 3.1Å; S29-E31 PolarHBondContact O-N 2.96Å; S29-E31 VanDerWaalsContact O-N 3.12Å; S29-E31 PolarHBondContact OG-N 2.94Å; S29-D32 VanDerWaalsContact O-CB 3.27Å; S29-D32 WeakPolarHBondContact O-CB 3.29Å; S29-D32 PolarHBondContact O-N 3.29Å; S29-D32 PolarHBondContact OG-N 3.33Å
30	S	36	Very low	39.6	Very low	114 Å²	114	62.2 Å²	62.2	80%	0.797	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-11	174.6	49.4	0	0	0	0	113.9
31	E	38.8	Very low	40.1	Very low	126 Å²	126	61.8 Å²	61.8	59%	0.589	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-5.7	-179.2	-62.2	178.9	177.5	0	0	112.2	S29 K33	S29-E31 PolarHBondContact O-N 2.96Å; S29-E31 VanDerWaalsContact O-N 3.12Å; S29-E31 PolarHBondContact OG-N 2.94Å; E31-K33 PolarHBondContact O-N 2.9Å
32	D	39.6	Very low	40.3	Very low	11 Å²	11	62.4 Å²	62.4	6%	0.059	37%	0.372	C	S	.	.			trans	-68.2	113.4	-174.8	-159.6	35.6	0	0	0	110.5	V27 G28 S29	V27-D32 VanDerWaalsContact CA-OD2 3.26Å; V27-D32 WeakPolarHBondContact CA-OD2 3.4Å; G28-D32 PolarHBondContact N-OD2 2.66Å; S29-D32 VanDerWaalsContact O-CB 3.27Å; S29-D32 WeakPolarHBondContact O-CB 3.29Å; S29-D32 PolarHBondContact O-N 3.29Å; S29-D32 PolarHBondContact OG-N 3.33Å
33	K	46.9	Very low	40.8	Very low	106 Å²	106	62.4 Å²	62.4	46%	0.461	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	127.6	174.5	-74.5	179.3	179.7	-174.6	0	107.4	T23 E31 I44	T23-K33 PolarHBondContact N-O 2.8Å; T23-K33 VanDerWaalsContact OG1-CB 3.22Å; T23-K33 WeakPolarHBondContact OG1-CB 3.06Å; T23-K33 PolarHBondContact OG1-O 2.87Å; E31-K33 PolarHBondContact O-N 2.9Å; K33-I44 HydrophobicContact CB-CG2 3.86Å; K33-I44 HydrophobicContact CD-CG2 3.94Å; K33-I44 HydrophobicContact CG-CG2 4Å
34	I	47.8	Very low	41.5	Very low	22 Å²	22	62.4 Å²	62.4	11%	0.113	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	122.3	174.7	-60.3	175.1	0	0	0	107	I20 I44 L45 F47	I20-I34 HydrophobicContact CG2-CG2 3.7Å; I34-I44 CarbonylContact O-C 3.58Å; I34-I44 WeakPolarHBondContact O-CA 3.16Å; I34-L45 HydrophobicContact CB-CB 4.11Å; I34-L45 HydrophobicContact CB-CD1 4Å; I34-L45 HydrophobicContact CG2-CD1 3.99Å; I34-L45 PolarHBondContact N-O 2.77Å; I34-L45 PolarHBondContact O-N 3.43Å; I34-F47 HydrophobicContact CD1-CE2 3.75Å; I34-F47 HydrophobicContact CD1-CZ 3.83Å; I34-F47 HydrophobicContact CG1-CE2 4.14Å
35	A	47.6	Very low	42.2	Very low	5 Å²	5	63.1 Å²	63.1	4%	0.041	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	132.8	175	0	0	0	0	0	110.5	C21 T23 L42 Y43	C21-A35 PolarHBondContact N-O 3.12Å; C21-A35 PolarHBondContact O-N 2.73Å; C21-A35 VanDerWaalsContact O-O 3.14Å; T23-A35 HydrophobicContact CG2-CB 3.47Å; T23-A35 VanDerWaalsContact CG2-CB 3.47Å; A35-L42 HydrophobicContact CB-CD1 4.13Å; A35-Y43 CarbonylContact C-O 3.58Å; A35-Y43 WeakPolarHBondContact CA-O 3.38Å
36	I	48.7	Very low	42.7	Very low	29 Å²	29	63.5 Å²	63.5	15%	0.149	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	114.1	173.4	-55.2	176	0	0	0	107.4	V16 Y43 L45	V16-I36 HydrophobicContact CG1-CG2 3.56Å; I36-Y43 PolarHBondContact N-O 3.5Å; I36-Y43 PolarHBondContact O-N 2.7Å; I36-L45 HydrophobicContact CD1-CD1 3.67Å; I36-L45 HydrophobicContact CD1-CG 4.4Å; I36-L45 HydrophobicContact CG1-CD1 4.22Å
37	S	39.5	Very low	43.4	Very low	56 Å²	56	65.3 Å²	65.3	39%	0.392	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	126.3	174.6	-165.3	0	0	0	0	109.7	G18 H19	G18-S37 WeakPolarHBondContact CA-O 3.44Å; H19-S37 PolarHBondContact N-O 3Å; H19-S37 PolarHBondContact O-N 2.83Å
38	T	50.2	Low	43.8	Very low	37 Å²	37	64.8 Å²	64.8	23%	0.227	37%	0.365	C	S	.	.			trans	-106.3	177.3	167	70.5	0	0	0	0	109.9	V16 E40 K41 Y43	V16-T38 HydrophobicContact CG1-CG2 3.4Å; T38-E40 PolarHBondContact O-N 3.31Å; T38-E40 PolarHBondContact OG1-N 2.85Å; T38-K41 PolarHBondContact N-O 3.03Å; T38-K41 PolarHBondContact OG1-N 2.8Å; T38-K41 VanDerWaalsContact OG1-N 3.09Å; T38-K41 PolarHBondContact OG1-O 3.24Å; T38-Y43 HydrophobicContact CG2-CD2 4.09Å; T38-Y43 HydrophobicContact CG2-CE2 3.73Å
39	T	44.8	Very low	44	Very low	146 Å²	146	65.7 Å²	65.7	90%	0.896	36%	0.356	S	S	*	.	S	Bend	trans	-60.9	-23	176.3	44.7	0	0	0	0	113.5
40	E	43.9	Very low	44.2	Very low	165 Å²	165	68.1 Å²	68.1	77%	0.771	37%	0.373	S	S	*	.	S	Bend	trans	-115.4	-27.6	-174.2	-63.8	178.7	-175.3	0	0	112.9	T38	T38-E40 PolarHBondContact O-N 3.31Å; T38-E40 PolarHBondContact OG1-N 2.85Å
41	K	47.5	Very low	44.3	Very low	66 Å²	66	71.1 Å²	71.1	29%	0.287	37%	0.374	S	S	.	.			trans	-147.4	155.7	-161.5	-64.6	-178.9	172.6	-168.6	0	113.1	T38 Y43 E64 D66	T38-K41 PolarHBondContact N-O 3.03Å; T38-K41 PolarHBondContact OG1-N 2.8Å; T38-K41 VanDerWaalsContact OG1-N 3.09Å; T38-K41 PolarHBondContact OG1-O 3.24Å; K41-Y43 HydrophobicContact CB-CE2 3.79Å; K41-Y43 WeakPolarHBondContact CD-OH 3.33Å; K41-E64 HydrophobicContact CD-CG 4.27Å; K41-E64 WeakPolarHBondContact CD-OE1 3.36Å; K41-E64 WeakPolarHBondContact CE-OE1 3.11Å; K41-E64 IonicContact NZ-OE1 3.97Å; K41-E64 PolarHBondContact NZ-OE1 3.26Å; K41-D66 IonicContact NZ-OD2 2.86Å
42	L	43	Very low	44.2	Very low	74 Å²	74	73.8 Å²	73.8	39%	0.387	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	122.8	170.7	-173.4	73.2	0	0	0	109.4	A35 V65	A35-L42 HydrophobicContact CB-CD1 4.13Å; L42-V65 PolarHBondContact O-N 3.27Å; L42-V65 VanDerWaalsContact O-N 3.08Å
43	Y	49.5	Very low	44.1	Very low	50 Å²	50	78.4 Å²	78.4	20%	0.196	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132.5	176.9	-60.1	-84.5	0	0	0	109.9	A35 I36 T38 K41 E64	A35-Y43 CarbonylContact C-O 3.58Å; A35-Y43 WeakPolarHBondContact CA-O 3.38Å; I36-Y43 PolarHBondContact N-O 3.5Å; I36-Y43 PolarHBondContact O-N 2.7Å; T38-Y43 HydrophobicContact CG2-CD2 4.09Å; T38-Y43 HydrophobicContact CG2-CE2 3.73Å; K41-Y43 HydrophobicContact CB-CE2 3.79Å; K41-Y43 WeakPolarHBondContact CD-OH 3.33Å; Y43-E64 HydrophobicContact CD1-CB 4.14Å; Y43-E64 HydrophobicContact CD1-CG 4.33Å; Y43-E64 HydrophobicContact CE1-CB 4.05Å; Y43-E64 HydrophobicContact CE1-CG 3.89Å
44	I	49.5	Very low	43.7	Very low	39 Å²	39	81.6 Å²	81.6	20%	0.2	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	115.2	172.5	-60.5	179.9	0	0	0	108.7	K33 I34 Q63 V65	K33-I44 HydrophobicContact CB-CG2 3.86Å; K33-I44 HydrophobicContact CD-CG2 3.94Å; K33-I44 HydrophobicContact CG-CG2 4Å; I34-I44 CarbonylContact O-C 3.58Å; I34-I44 WeakPolarHBondContact O-CA 3.16Å; I44-Q63 PolarHBondContact N-O 3.29Å; I44-Q63 PolarHBondContact O-N 3.2Å; I44-V65 HydrophobicContact CD1-CG2 3.7Å; I44-V65 HydrophobicContact CG1-CG2 3.91Å
45	L	47.6	Very low	43	Very low	30 Å²	30	89.6 Å²	89.6	16%	0.157	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	120.8	172.6	-68.2	163.7	0	0	0	109.3	I34 I36 A60 A62	I34-L45 HydrophobicContact CB-CB 4.11Å; I34-L45 HydrophobicContact CB-CD1 4Å; I34-L45 HydrophobicContact CG2-CD1 3.99Å; I34-L45 PolarHBondContact N-O 2.77Å; I34-L45 PolarHBondContact O-N 3.43Å; I36-L45 HydrophobicContact CD1-CD1 3.67Å; I36-L45 HydrophobicContact CD1-CG 4.4Å; I36-L45 HydrophobicContact CG1-CD1 4.22Å; L45-A60 HydrophobicContact CD2-CB 4.17Å; L45-A62 HydrophobicContact CD2-CB 3.88Å
46	S	46.8	Very low	42.6	Very low	37 Å²	37	95.8 Å²	95.8	26%	0.259	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	123.6	172.4	-58.9	0	0	0	0	109.1	I61	S46-I61 PolarHBondContact N-O 3.48Å; S46-I61 PolarHBondContact O-N 3.47Å
47	F	44.7	Very low	41.8	Very low	91 Å²	91	101.1 Å²	101.1	40%	0.399	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	122.5	177.3	-61.3	-85.6	0	0	0	110.1	I34 L49 A60	I34-F47 HydrophobicContact CD1-CE2 3.75Å; I34-F47 HydrophobicContact CD1-CZ 3.83Å; I34-F47 HydrophobicContact CG1-CE2 4.14Å; F47-L49 PolarHBondContact O-N 3.41Å; F47-A60 HydrophobicContact CD1-CB 3.71Å; F47-A60 HydrophobicContact CE1-CB 3.59Å; F47-A60 HydrophobicContact CZ-CB 4.36Å
48	S	41	Very low	42	Very low	65 Å²	65	106.7 Å²	106.7	46%	0.455	54%	0.541	S	S	.	.			trans	-84.7	98	168.3	46.9	0	0	0	0	109.7	S50	S48-S50 VanDerWaalsContact C-N 3.31Å; S48-S50 PolarHBondContact O-N 3.29Å
49	L	37.4	Very low	41.4	Very low	78 Å²	78	107.6 Å²	107.6	41%	0.408	54%	0.544	S	S	.	.			trans	-78.8	75.5	172	-71.3	162.5	0	0	0	110	F47 H51	F47-L49 PolarHBondContact O-N 3.41Å; L49-H51 PolarHBondContact O-N 3.25Å
50	S	36.9	Very low	41.2	Very low	83 Å²	83	101.3 Å²	101.3	58%	0.58	51%	0.506	S	S	*	.			trans	-70.2	120.7	167.1	52.6	0	0	0	0	109.2	S48 H52	S48-S50 VanDerWaalsContact C-N 3.31Å; S48-S50 PolarHBondContact O-N 3.29Å; S50-H52 PolarHBondContact O-N 2.96Å; S50-H52 VanDerWaalsContact O-N 3.14Å
51	H	39.4	Very low	41.3	Very low	178 Å²	178	96.7 Å²	96.7	82%	0.824	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-1.8	-175.1	-92.8	55.6	0	0	0	114.9	L49	L49-H51 PolarHBondContact O-N 3.25Å
52	H	36.7	Very low	41	Very low	181 Å²	181	94 Å²	94	84%	0.838	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.1	8.5	-166	-78.1	-53.5	0	0	0	116.3	S50	S50-H52 PolarHBondContact O-N 2.96Å; S50-H52 VanDerWaalsContact O-N 3.14Å
53	D	36.3	Very low	41.2	Very low	108 Å²	108	93.9 Å²	93.9	58%	0.578	47%	0.474	S	S	*	.			trans	-103.7	101.8	174.3	-106.1	-41.2	0	0	0	110.6	R55	D53-R55 PolarHBondContact O-N 3.25Å
54	D	38.9	Very low	40.7	Very low	174 Å²	174	93.7 Å²	93.7	93%	0.93	48%	0.475	S	S	*	.			trans	-67.8	17.4	169.5	-86	-27.8	0	0	0	113.1
55	R	32.8	Very low	40	Very low	189 Å²	189	94.6 Å²	94.6	71%	0.713	48%	0.482	S	S	*	.	S	Bend	trans	-93.1	129.2	175.7	-65.5	-176.2	-177.5	-172	2.4	108.6	D53 K57	D53-R55 PolarHBondContact O-N 3.25Å; R55-K57 PolarHBondContact O-N 2.6Å
56	P	39.1	Very low	39.3	Very low	136 Å²	136	96.3 Å²	96.3	88%	0.883	49%	0.491	S	S	*	.	S	Bend	trans	-68.3	14.8	-174.1	27.3	-34.9	0	0	0	114.9
57	K	33.1	Very low	38.6	Very low	141 Å²	141	104.1 Å²	104.1	61%	0.613	52%	0.521	S	S	*	.			trans	-103.1	94.6	179.8	-68.3	-168	169.1	-151.7	0	110	R55 E76	R55-K57 PolarHBondContact O-N 2.6Å; K57-E76 IonicContact NZ-OE1 3.19Å; K57-E76 PolarHBondContact NZ-OE1 2.97Å
58	K	42.1	Very low	37.8	Very low	173 Å²	173	106.5 Å²	106.5	75%	0.752	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-88.9	116.9	166.7	-69.2	-175	-179	176.2	0	109.1
59	I	38.7	Very low	37.1	Very low	56 Å²	56	108.9 Å²	108.9	29%	0.287	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-89	120.2	-177.6	-58.9	155.9	0	0	0	107.8	R74	I59-R74 HydrophobicContact CG2-CG 3.9Å
60	A	40.8	Very low	36.4	Very low	13 Å²	13	115.8 Å²	115.8	11%	0.107	57%	0.569	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.1	131.7	166.1	0	0	0	0	0	109	L45 F47	L45-A60 HydrophobicContact CD2-CB 4.17Å; F47-A60 HydrophobicContact CD1-CB 3.71Å; F47-A60 HydrophobicContact CE1-CB 3.59Å; F47-A60 HydrophobicContact CZ-CB 4.36Å
61	I	44.6	Very low	35.9	Very low	68 Å²	68	113.8 Å²	113.8	35%	0.349	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.2	116.1	175.6	-58.4	171.7	0	0	0	106.9	S46 F72	S46-I61 PolarHBondContact N-O 3.48Å; S46-I61 PolarHBondContact O-N 3.47Å; I61-F72 HydrophobicContact CG2-CD1 4.05Å
62	A	42	Very low	35.3	Very low	10 Å²	10	112 Å²	112	8%	0.083	55%	0.552	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.5	115.5	170.5	0	0	0	0	0	108.5	L45	L45-A62 HydrophobicContact CD2-CB 3.88Å
63	Q	46.6	Very low	34.8	Very low	71 Å²	71	106.6 Å²	106.6	33%	0.332	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	117.4	168.8	-168.9	173.7	1.3	0	0	108.5	I44 V65 F72	I44-Q63 PolarHBondContact N-O 3.29Å; I44-Q63 PolarHBondContact O-N 3.2Å; Q63-V65 PolarHBondContact O-N 2.91Å; Q63-F72 HydrophobicContact CG-CE1 4.15Å
64	E	38.9	Very low	34.2	Very low	47 Å²	47	109.1 Å²	109.1	22%	0.22	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	122	169.6	-172.4	175.7	159.9	0	0	108.7	K41 Y43 D66	K41-E64 HydrophobicContact CD-CG 4.27Å; K41-E64 WeakPolarHBondContact CD-OE1 3.36Å; K41-E64 WeakPolarHBondContact CE-OE1 3.11Å; K41-E64 IonicContact NZ-OE1 3.97Å; K41-E64 PolarHBondContact NZ-OE1 3.26Å; Y43-E64 HydrophobicContact CD1-CB 4.14Å; Y43-E64 HydrophobicContact CD1-CG 4.33Å; Y43-E64 HydrophobicContact CE1-CB 4.05Å; Y43-E64 HydrophobicContact CE1-CG 3.89Å; E64-D66 PolarHBondContact O-N 2.75Å; E64-D66 VanDerWaalsContact OE1-OD2 3.08Å
65	V	35.8	Very low	33.6	Very low	57 Å²	57	104.1 Å²	104.1	35%	0.345	50%	0.502	S	S	.	.			trans	-89.6	70.2	174.1	-170.6	0	0	0	0	107.9	L42 I44 Q63	L42-V65 PolarHBondContact O-N 3.27Å; L42-V65 VanDerWaalsContact O-N 3.08Å; I44-V65 HydrophobicContact CD1-CG2 3.7Å; I44-V65 HydrophobicContact CG1-CG2 3.91Å; Q63-V65 PolarHBondContact O-N 2.91Å
66	D	33.9	Very low	33.2	Very low	66 Å²	66	101.2 Å²	101.2	35%	0.353	50%	0.497	S	S	.	.			trans	-75.7	122.3	163.5	-98	-10.3	0	0	0	107.1	K41 E64 I68	K41-D66 IonicContact NZ-OD2 2.86Å; E64-D66 PolarHBondContact O-N 2.75Å; E64-D66 VanDerWaalsContact OE1-OD2 3.08Å; D66-I68 PolarHBondContact O-N 2.75Å
67	F	31	Very low	32.6	Very low	201 Å²	201	102.4 Å²	102.4	88%	0.882	50%	0.495	S	S	*	.	S	Bend	trans	-59.9	-8.7	178.5	-97.3	-87.1	0	0	0	113
68	I	27.3	Very low	32.3	Very low	142 Å²	142	102.6 Å²	102.6	73%	0.728	50%	0.503	S	S	*	.	S	Bend	trans	-146.5	118	170.7	-49.8	177.5	0	0	0	107.7	D66	D66-I68 PolarHBondContact O-N 2.75Å
69	T	26.4	Very low	31.5	Very low	115 Å²	115	101 Å²	101	71%	0.706	50%	0.503	S	S	*	.			trans	89.5	125.3	176.6	65.7	0	0	0	0	118.8
70	R	23.7	Very low	31	Very low	222 Å²	222	106.3 Å²	106.3	84%	0.838	53%	0.531	S	S	*	.			trans	-98.4	114.5	-173	-68.5	176.9	176.3	175.7	-1.5	110.6
71	G	26.1	Very low	30.3	Very low	42 Å²	42	112 Å²	112	43%	0.433	57%	0.569	S	S	.	*			trans	-127	150.7	165.8	0	0	0	0	0	111.1
72	F	26	Very low	29.4	Very low	141 Å²	141	117.4 Å²	117.4	62%	0.618	60%	0.595	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-119.1	138.4	-179	-62.9	-83.9	0	0	0	110.4	I61 Q63	I61-F72 HydrophobicContact CG2-CD1 4.05Å; Q63-F72 HydrophobicContact CG-CE1 4.15Å
73	L	27	Very low	28.7	Very low	67 Å²	67	125.2 Å²	125.2	35%	0.351	64%	0.635	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.7	140.9	175.3	-167.5	76.5	0	0	0	110.7
74	R	23.9	Very low	27.8	Very low	160 Å²	160	132.1 Å²	132.1	60%	0.604	66%	0.663	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107.6	132.5	-176.4	-174.7	177.1	174.9	-175.6	-4.6	110.5	I59	I59-R74 HydrophobicContact CG2-CG 3.9Å
75	I	26.4	Very low	27.3	Very low	69 Å²	69	133 Å²	133	35%	0.354	69%	0.685	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126	134.5	-179.6	-57.2	176.3	0	0	0	109.3
76	E	23.2	Very low	27.1	Very low	129 Å²	129	135.8 Å²	135.8	60%	0.603	71%	0.707	S	S	*	*			trans	-101	137.7	172.9	-77.9	-172.6	137.9	0	0	110	K57	K57-E76 IonicContact NZ-OE1 3.19Å; K57-E76 PolarHBondContact NZ-OE1 2.97Å
77	L	26.4	Very low	27	Very low	160 Å²	160	142.3 Å²	142.3	84%	0.838	74%	0.735	S	S	*	*			trans	-112.7	146	178.3	-71.6	169.6	0	0	0	110.4
78	D	27.4	Very low	27.2	Very low	146 Å²	146	136.9 Å²	136.9	78%	0.781	72%	0.719	S	S	*	*			trans	-89.1	139.5	-173.1	-131.6	-13.8	0	0	0	112.6
79	N	26.1	Very low	27.7	Very low	139 Å²	139	135.4 Å²	135.4	74%	0.743	71%	0.712	S	S	*	*			trans	-12.7	124	-178	-53.5	-54.9	0	0	0	119.9
80	D	27.2	Very low	28.4	Very low	167 Å²	167	136.6 Å²	136.6	89%	0.893	71%	0.709	S	S	*	*			trans	-134.2	133.4	153.6	-93.7	-31.4	0	0	0	111.7
81	C	26.5	Very low	28.8	Very low	132 Å²	132	133.5 Å²	133.5	89%	0.892	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-80.7	118.2	-172.9	-61.1	0	0	0	0	111.6
82	M	25.4	Very low	29.2	Very low	183 Å²	183	133.2 Å²	133.2	90%	0.901	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-89.1	127.4	167.7	-73.1	-138.2	-41.8	0	0	112
83	L	26.9	Very low	29.6	Very low	174 Å²	174	132.8 Å²	132.8	91%	0.911	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-90.8	125.8	164.2	-80.3	159.2	0	0	0	109.9
84	K	28.8	Very low	29.8	Very low	216 Å²	216	136.5 Å²	136.5	94%	0.939	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-66.6	129.6	177.4	-78	177.2	171.1	179.3	0	111.1
85	G	28.6	Very low	30	Very low	66 Å²	66	131.4 Å²	131.4	68%	0.68	69%	0.693	S	S	*	*			trans	-146.4	109.3	170	0	0	0	0	0	112.4
86	S	31	Very low	30.2	Very low	114 Å²	114	133.4 Å²	133.4	80%	0.797	70%	0.704	S	S	*	*			trans	42	122.7	156	56.3	0	0	0	0	121.4	V88	S86-V88 PolarHBondContact O-N 3.35Å
87	E	32	Very low	30.6	Very low	203 Å²	203	134.4 Å²	134.4	95%	0.949	71%	0.706	S	S	*	*			trans	-47.6	111.5	171.4	-64.5	172.7	152.9	0	0	112.8
88	V	35.1	Very low	30.6	Very low	88 Å²	88	134.6 Å²	134.6	53%	0.533	70%	0.703	S	S	.	*			trans	-90.6	126.3	168.7	-179.1	0	0	0	0	108.8	S86 I92	S86-V88 PolarHBondContact O-N 3.35Å; V88-I92 HydrophobicContact CG1-CB 4.24Å; V88-I92 HydrophobicContact CG1-CD1 4.19Å; V88-I92 HydrophobicContact CG1-CG2 4.29Å
89	D	37.3	Very low	30.6	Very low	111 Å²	111	132.8 Å²	132.8	59%	0.594	69%	0.693	S	S	*	*			trans	-54.8	142	-176.1	-151.7	-18.8	0	0	0	112.9	E91 I92	D89-E91 VanDerWaalsContact C-N 3.29Å; D89-E91 PolarHBondContact O-N 3.18Å; D89-I92 HydrophobicContact CB-CD1 4.24Å; D89-I92 PolarHBondContact O-N 2.83Å
90	H	41	Very low	30.6	Very low	139 Å²	139	129 Å²	129	64%	0.644	68%	0.675	S	S	*	*	H	α-helix	trans	-66.6	-26.3	-168.1	-79.1	3.9	0	0	0	113.8	K93 F94	H90-K93 WeakPolarHBondContact O-CB 3.05Å; H90-K93 PolarHBondContact O-N 3.45Å; H90-F94 PolarHBondContact O-N 2.86Å
91	E	33.4	Very low	30.5	Very low	157 Å²	157	125.6 Å²	125.6	73%	0.734	66%	0.657	S	S	*	*	H	α-helix	trans	-65.9	-40.4	175.8	-82.2	-172	150.4	0	0	112.4	D89 K93 F94 S95	D89-E91 VanDerWaalsContact C-N 3.29Å; D89-E91 PolarHBondContact O-N 3.18Å; E91-K93 VanDerWaalsContact C-N 3.26Å; E91-K93 PolarHBondContact O-N 3.13Å; E91-F94 PolarHBondContact O-N 3.44Å; E91-F94 VanDerWaalsContact O-N 3.07Å; E91-S95 PolarHBondContact O-N 2.86Å; E91-S95 PolarHBondContact O-OG 3.22Å
92	I	33.8	Very low	30.5	Very low	37 Å²	37	122.1 Å²	122.1	19%	0.19	63%	0.625	C	S	.	*	H	α-helix	trans	-66	-35.2	179	-59.8	159.7	0	0	0	110.1	V88 D89 F94 S95 L96 H382	V88-I92 HydrophobicContact CG1-CB 4.24Å; V88-I92 HydrophobicContact CG1-CD1 4.19Å; V88-I92 HydrophobicContact CG1-CG2 4.29Å; D89-I92 HydrophobicContact CB-CD1 4.24Å; D89-I92 PolarHBondContact O-N 2.83Å; I92-F94 VanDerWaalsContact C-N 3.3Å; I92-F94 PolarHBondContact O-N 3.19Å; I92-S95 PolarHBondContact O-N 3.26Å; I92-L96 HydrophobicContact CG2-CD1 3.84Å; I92-L96 HydrophobicContact CG2-CG 4.38Å; I92-L96 WeakPolarHBondContact O-CB 3.22Å; I92-L96 WeakPolarHBondContact O-CG 3.49Å; I92-L96 PolarHBondContact O-N 2.99Å; I92-H382 WeakPolarHBondContact CD1-CD2 3.44Å
93	K	33.5	Very low	30.3	Very low	132 Å²	132	116.2 Å²	116.2	57%	0.574	60%	0.601	S	S	*	*	H	α-helix	trans	-61	-37.1	173.4	-112.7	178.3	-178.5	174.1	0	112.4	H90 E91 K97	H90-K93 WeakPolarHBondContact O-CB 3.05Å; H90-K93 PolarHBondContact O-N 3.45Å; E91-K93 VanDerWaalsContact C-N 3.26Å; E91-K93 PolarHBondContact O-N 3.13Å; K93-K97 WeakPolarHBondContact O-CB 3.23Å; K93-K97 PolarHBondContact O-N 2.87Å
94	F	32	Very low	30.3	Very low	144 Å²	144	111.8 Å²	111.8	63%	0.632	58%	0.578	S	S	*	*	H	α-helix	trans	-72.9	-44.6	176.6	-95.6	-80.2	0	0	0	112.1	H90 E91 I92 L96 K97 E98	H90-F94 PolarHBondContact O-N 2.86Å; E91-F94 PolarHBondContact O-N 3.44Å; E91-F94 VanDerWaalsContact O-N 3.07Å; I92-F94 VanDerWaalsContact C-N 3.3Å; I92-F94 PolarHBondContact O-N 3.19Å; F94-L96 VanDerWaalsContact C-N 3.3Å; F94-L96 PolarHBondContact O-N 2.8Å; F94-K97 WeakPolarHBondContact O-CB 3.42Å; F94-K97 PolarHBondContact O-N 3.48Å; F94-K97 VanDerWaalsContact O-N 3.13Å; F94-E98 PolarHBondContact O-N 2.94Å; F94-E98 VanDerWaalsContact O-N 3.13Å
95	S	29.2	Very low	30	Very low	53 Å²	53	107.1 Å²	107.1	37%	0.371	56%	0.563	S	S	.	*	H	α-helix	trans	-64.9	-33.4	177.7	-53	0	0	0	0	112.9	E91 I92 N99	E91-S95 PolarHBondContact O-N 2.86Å; E91-S95 PolarHBondContact O-OG 3.22Å; I92-S95 PolarHBondContact O-N 3.26Å; S95-N99 PolarHBondContact O-ND2 3.3Å
96	L	29.8	Very low	29.9	Very low	112 Å²	112	113.3 Å²	113.3	59%	0.586	57%	0.571	S	S	*	*	H	α-helix	trans	-72.5	-37.9	172.1	-74.7	168.2	0	0	0	111.7	I92 F94 E98 N99 V100	I92-L96 HydrophobicContact CG2-CD1 3.84Å; I92-L96 HydrophobicContact CG2-CG 4.38Å; I92-L96 WeakPolarHBondContact O-CB 3.22Å; I92-L96 WeakPolarHBondContact O-CG 3.49Å; I92-L96 PolarHBondContact O-N 2.99Å; F94-L96 VanDerWaalsContact C-N 3.3Å; F94-L96 PolarHBondContact O-N 2.8Å; L96-E98 VanDerWaalsContact C-N 3.31Å; L96-E98 PolarHBondContact O-N 2.92Å; L96-N99 PolarHBondContact O-N 3.02Å; L96-N99 VanDerWaalsContact O-N 3.15Å; L96-V100 VanDerWaalsContact O-CG2 3.3Å; L96-V100 WeakPolarHBondContact O-CG2 3.2Å
97	K	30.8	Very low	29.6	Very low	150 Å²	150	113.7 Å²	113.7	65%	0.652	57%	0.571	S	S	*	*	H	α-helix	trans	-59.7	-37.1	176.1	-101.4	-176.8	173.9	-178.9	0	113	K93 F94 N99 V100	K93-K97 WeakPolarHBondContact O-CB 3.23Å; K93-K97 PolarHBondContact O-N 2.87Å; F94-K97 WeakPolarHBondContact O-CB 3.42Å; F94-K97 PolarHBondContact O-N 3.48Å; F94-K97 VanDerWaalsContact O-N 3.13Å; K97-N99 PolarHBondContact O-N 2.85Å; K97-V100 PolarHBondContact O-N 3.18Å
98	E	27.4	Very low	29.2	Very low	164 Å²	164	112.4 Å²	112.4	77%	0.766	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-18.7	179	-77.6	-162.9	137.9	0	0	113.8	F94 L96	F94-E98 PolarHBondContact O-N 2.94Å; F94-E98 VanDerWaalsContact O-N 3.13Å; L96-E98 VanDerWaalsContact C-N 3.31Å; L96-E98 PolarHBondContact O-N 2.92Å
99	N	26.1	Very low	28.7	Very low	108 Å²	108	115.3 Å²	115.3	58%	0.578	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	4.2	-179.8	-80.3	-55.3	0	0	0	115.1	S95 L96 K97	S95-N99 PolarHBondContact O-ND2 3.3Å; L96-N99 PolarHBondContact O-N 3.02Å; L96-N99 VanDerWaalsContact O-N 3.15Å; K97-N99 PolarHBondContact O-N 2.85Å
100	V	27.2	Very low	28	Very low	58 Å²	58	117.8 Å²	117.8	35%	0.352	58%	0.584	S	S	.	*			trans	-94.1	-10.7	-173.3	-169.6	0	0	0	0	114.4	C26 L96 K97 R102	C26-V100 HydrophobicContact CB-CG1 4.15Å; L96-V100 VanDerWaalsContact O-CG2 3.3Å; L96-V100 WeakPolarHBondContact O-CG2 3.2Å; K97-V100 PolarHBondContact O-N 3.18Å; V100-R102 PolarHBondContact O-N 2.75Å; V100-R102 VanDerWaalsContact O-N 3.13Å
101	N	25.3	Very low	27.2	Very low	97 Å²	97	118.8 Å²	118.8	52%	0.519	59%	0.593	S	S	.	*			trans	-88.9	93.2	-172.9	-74.6	-13.9	0	0	0	113.1
102	R	25.1	Very low	26.7	Very low	59 Å²	59	117.5 Å²	117.5	22%	0.223	59%	0.591	C	S	.	*				172.5	110.9	127.1	-92.2	173.2	-108.6	-178.5	2.1	110.7	V100 N120 M145	V100-R102 PolarHBondContact O-N 2.75Å; V100-R102 VanDerWaalsContact O-N 3.13Å; R102-N120 PolarHBondContact NH1-O 3.39Å; R102-M145 HydrophobicContact CB-CB 4.1Å; R102-M145 HydrophobicContact CB-CE 3.65Å; R102-M145 VanDerWaalsContact CD-CE 3.46Å; R102-M145 HydrophobicContact CG-CB 4.45Å; R102-M145 HydrophobicContact CG-CE 4.05Å; R102-M145 VanDerWaalsContact NH1-CG 3.28Å; R102-M145 PolarHBondContact NH1-SD 2.73Å; R102-M145 VanDerWaalsContact O-O 3.04Å
103	S	23.2	Very low	26.3	Very low	58 Å²	58	127 Å²	127	41%	0.406	62%	0.624	S	S	.	*			trans	-137	99.9	158.5	-59.2	0	0	0	0	104.7	G24	G24-S103 VanDerWaalsContact CA-CB 3.48Å
104	I	25.2	Very low	25.9	Very low	81 Å²	81	125.9 Å²	125.9	42%	0.415	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-92.5	131.7	-175.6	-65.8	174	0	0	0	108.4	E146	I104-E146 HydrophobicContact CB-CG 4.14Å
105	L	23.6	Very low	25.6	Very low	119 Å²	119	126.2 Å²	126.2	62%	0.623	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-46.7	143.4	172.8	-72.4	135.6	0	0	0	114.8	T23	T23-L105 HydrophobicContact CG2-CD2 4.49Å
106	F	25.5	Very low	25.7	Very low	196 Å²	196	125.8 Å²	125.8	86%	0.86	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-60.6	146.5	151	-73.4	-84.8	0	0	0	110.1
107	P	25	Very low	25.7	Very low	122 Å²	122	128.3 Å²	128.3	79%	0.792	63%	0.631	S	S	*	*				-137.6	146.1	92.6	31.6	-15.2	0	0	0	114.5
108	H	24.4	Very low	26.1	Very low	175 Å²	175	125.3 Å²	125.3	81%	0.81	62%	0.622	S	S	*	*			trans	-48.7	124.5	170.5	-175.9	58.6	0	0	0	113.9
109	L	23.9	Very low	26.5	Very low	149 Å²	149	125.5 Å²	125.5	78%	0.78	62%	0.62	S	S	*	*			trans	-174.1	105.9	141.2	-106.2	148	0	0	0	109.2	I111	L109-I111 PolarHBondContact O-N 2.92Å
110	Q	22.7	Very low	27.4	Very low	164 Å²	164	123.9 Å²	123.9	77%	0.766	61%	0.611	S	S	*	*			trans	41.3	70.8	154.3	-146.9	170.9	15	0	0	115.6	N112	Q110-N112 VanDerWaalsContact C-N 3.33Å; Q110-N112 PolarHBondContact O-N 2.82Å
111	I	23.8	Very low	28.5	Very low	160 Å²	160	121.7 Å²	121.7	82%	0.821	60%	0.6	S	S	*	*			trans	-68.6	100.3	162.6	-60.5	174.3	0	0	0	105.8	L109 R113	L109-I111 PolarHBondContact O-N 2.92Å; I111-R113 PolarHBondContact O-N 2.93Å
112	N	23.1	Very low	30.1	Very low	129 Å²	129	117.5 Å²	117.5	69%	0.69	58%	0.579	S	S	*	*			trans	-45.7	113.2	165.1	-78	-25.4	0	0	0	107.1	Q110 D114	Q110-N112 VanDerWaalsContact C-N 3.33Å; Q110-N112 PolarHBondContact O-N 2.82Å; N112-D114 PolarHBondContact O-N 3.02Å
113	R	25.4	Very low	32	Very low	238 Å²	238	120.2 Å²	120.2	90%	0.898	59%	0.59	S	S	*	*	S	Bend	trans	-68.8	66.4	178.3	-73.5	-176.7	173	-179.6	-2.2	109.2	I111	I111-R113 PolarHBondContact O-N 2.93Å
114	D	26	Very low	34.2	Very low	107 Å²	107	118.4 Å²	118.4	57%	0.572	58%	0.575	S	S	*	*	S	Bend	trans	-162.8	125.1	165.2	-85.4	-48.2	0	0	0	106.9	N112 K155	N112-D114 PolarHBondContact O-N 3.02Å; D114-K155 IonicContact OD1-NZ 3.79Å; D114-K155 PolarHBondContact OD1-NZ 3.21Å
115	I	25.9	Very low	36.5	Very low	151 Å²	151	115.2 Å²	115.2	77%	0.774	56%	0.56	S	S	*	*	S	Bend	trans	82.3	100.9	180	-45.6	164.1	0	0	0	113.5	K117	I115-K117 VanDerWaalsContact C-N 3.34Å; I115-K117 PolarHBondContact O-N 2.99Å
116	L	30.4	Very low	39.4	Very low	45 Å²	45	109.7 Å²	109.7	24%	0.236	53%	0.531	C	S	.	.			trans	-49.7	92.2	164.9	-115.2	146.3	0	0	0	109.9	L118 L142 W160 E162	L116-L118 HydrophobicContact CB-CG 4.46Å; L116-L118 HydrophobicContact CD2-CD1 4.21Å; L116-L118 HydrophobicContact CD2-CD2 3.51Å; L116-L118 HydrophobicContact CD2-CG 3.52Å; L116-L118 PolarHBondContact O-N 3.49Å; L116-L142 HydrophobicContact CD2-CD2 4.46Å; L116-W160 HydrophobicContact CD1-CB 4.46Å; L116-E162 HydrophobicContact CD1-CG 3.78Å; L116-E162 HydrophobicContact CG-CG 4.19Å
117	K	30.3	Very low	42	Very low	164 Å²	164	101.1 Å²	101.1	71%	0.713	49%	0.493	S	S	*	.			trans	-78.1	80.1	163.9	-77.1	-176.1	-176.4	170.1	0	107	I115 K119	I115-K117 VanDerWaalsContact C-N 3.34Å; I115-K117 PolarHBondContact O-N 2.99Å; K117-K119 HydrophobicContact CB-CG 4.23Å; K117-K119 PolarHBondContact O-N 3.03Å
118	L	38.5	Very low	45	Very low	88 Å²	88	95.3 Å²	95.3	46%	0.461	46%	0.455	S	S	.	.			trans	-59.1	26.5	168.1	-74.8	162.8	0	0	0	113.5	L116 N120 G121 L142	L116-L118 HydrophobicContact CB-CG 4.46Å; L116-L118 HydrophobicContact CD2-CD1 4.21Å; L116-L118 HydrophobicContact CD2-CD2 3.51Å; L116-L118 HydrophobicContact CD2-CG 3.52Å; L116-L118 PolarHBondContact O-N 3.49Å; L118-N120 PolarHBondContact O-N 2.96Å; L118-G121 PolarHBondContact O-N 2.8Å; L118-L142 HydrophobicContact CD2-CD2 3.55Å
119	K	36	Very low	48	Very low	167 Å²	167	87.2 Å²	87.2	73%	0.726	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-23.8	-173.4	-83	-171	171	-167.2	0	113.1	K117	K117-K119 HydrophobicContact CB-CG 4.23Å; K117-K119 PolarHBondContact O-N 3.03Å
120	N	45.6	Very low	50.8	Low	74 Å²	74	87.8 Å²	87.8	40%	0.396	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-4	-178.3	-65.8	-6	0	0	0	113.9	R102 L118 M145 E146	R102-N120 PolarHBondContact NH1-O 3.39Å; L118-N120 PolarHBondContact O-N 2.96Å; N120-M145 VanDerWaalsContact O-CG 3.22Å; N120-M145 WeakPolarHBondContact O-CG 3.45Å; N120-E146 PolarHBondContact ND2-OE1 2.81Å
121	G	49.7	Very low	53.6	Low	12 Å²	12	81 Å²	81	12%	0.124	38%	0.384	C	S	.	.			trans	80.9	166.8	-178.2	0	0	0	0	0	113.7	L118	L118-G121 PolarHBondContact O-N 2.8Å
122	A	58.6	Low	56.5	Low	10 Å²	10	73.4 Å²	73.4	8%	0.083	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	146.1	174.1	0	0	0	0	0	109.8	V125 L142 L528	A122-V125 HydrophobicContact CB-CG2 4.05Å; A122-L142 HydrophobicContact CB-CD1 3.41Å; A122-L142 VanDerWaalsContact CB-CD1 3.41Å; A122-L528 HydrophobicContact CB-CD2 4.31Å; A122-L528 WeakPolarHBondContact O-CD2 3.2Å
123	R	64.5	Low	59.3	Low	116 Å²	116	67.4 Å²	67.4	44%	0.438	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-38.8	168.6	-174.3	179.1	178.8	176.6	-0.3	110.9	T143 M145 N147	R123-T143 PolarHBondContact N-O 3.01Å; R123-M145 HydrophobicContact CB-CE 4.42Å; R123-M145 HydrophobicContact CB-SD 3.87Å; R123-N147 PolarHBondContact NH1-OD1 3.16Å
124	L	70.6	Confident	61.9	Low	20 Å²	20	63.1 Å²	63.1	11%	0.105	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	140.8	-177.2	-177.1	71.6	0	0	0	110.7	T143 Y226 T227	L124-T143 PolarHBondContact N-O 2.86Å; L124-T143 PolarHBondContact O-N 3.33Å; L124-Y226 HydrophobicContact CD1-CD1 4.5Å; L124-Y226 HydrophobicContact CD1-CD2 4.33Å; L124-Y226 HydrophobicContact CD1-CE1 3.88Å; L124-Y226 HydrophobicContact CD1-CE2 3.7Å; L124-Y226 VanDerWaalsContact CD1-CZ 3.43Å; L124-Y226 HydrophobicContact CD2-CD1 3.37Å; L124-Y226 HydrophobicContact CD2-CD2 3.74Å; L124-Y226 HydrophobicContact CD2-CE1 3.57Å; L124-Y226 HydrophobicContact CD2-CE2 3.94Å; L124-Y226 HydrophobicContact CD2-CG 3.43Å; L124-Y226 VanDerWaalsContact CD2-CG 3.43Å; L124-Y226 HydrophobicContact CG-CE1 4.36Å; L124-Y226 HydrophobicContact CG-CE2 4.45Å; L124-T227 VanDerWaalsContact CD2-N 3.26Å
125	V	74.1	Confident	64.5	Low	14 Å²	14	64.7 Å²	64.7	9%	0.085	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	128.6	172.4	-179.6	0	0	0	0	108.8	A122 W127 M140 L142 S517	A122-V125 HydrophobicContact CB-CG2 4.05Å; V125-W127 HydrophobicContact CG1-CZ2 4.4Å; V125-M140 HydrophobicContact CG1-CG 3.79Å; V125-M140 HydrophobicContact CG1-SD 3.77Å; V125-L142 HydrophobicContact CG2-CD1 3.72Å; V125-S517 PolarHBondContact O-OG 3.19Å
126	S	82.7	Confident	67	Low	3 Å²	3	64.2 Å²	64.2	2%	0.021	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	143.4	175.5	-169.1	0	0	0	0	110	S141 T227	S126-S141 WeakPolarHBondContact CB-OG 3.5Å; S126-S141 PolarHBondContact N-O 2.81Å; S126-S141 PolarHBondContact O-N 3.22Å; S126-S141 PolarHBondContact O-OG 3.04Å; S126-T227 WeakPolarHBondContact CB-O 3.43Å; S126-T227 PolarHBondContact OG-O 2.56Å
127	W	81.7	Confident	69.4	Low	16 Å²	16	64.6 Å²	64.6	6%	0.061	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	137.7	-174.5	-64.8	101.8	0	0	0	110.4	V125 C138 M140 W160 W229 Y524 L546	V125-W127 HydrophobicContact CG1-CZ2 4.4Å; W127-C138 HydrophobicContact CE3-CB 4.23Å; W127-M140 HydrophobicContact CE3-CB 3.93Å; W127-M140 HydrophobicContact CE3-CG 4.28Å; W127-M140 HydrophobicContact CH2-CB 4.08Å; W127-M140 HydrophobicContact CH2-CG 4.08Å; W127-M140 HydrophobicContact CH2-SD 3.83Å; W127-M140 HydrophobicContact CZ2-CG 4.37Å; W127-M140 HydrophobicContact CZ2-SD 4.07Å; W127-M140 HydrophobicContact CZ3-CB 3.61Å; W127-M140 HydrophobicContact CZ3-CG 4.04Å; W127-M140 HydrophobicContact CZ3-SD 4.35Å; W127-W160 AromaticContact CH2-CH2 3.99Å; W127-W160 HydrophobicContact CH2-CH2 3.99Å; W127-W160 AromaticContact CH2-CZ2 3.55Å; W127-W160 HydrophobicContact CH2-CZ2 3.55Å; W127-W160 AromaticContact CZ3-CH2 3.43Å; W127-W160 HydrophobicContact CZ3-CH2 3.43Å; W127-W160 VanDerWaalsContact CZ3-CH2 3.43Å; W127-W160 AromaticContact CZ3-CZ2 3.51Å; W127-W160 HydrophobicContact CZ3-CZ2 3.51Å; W127-W160 HydrophobicContact CZ3-CZ3 4.25Å; W127-W229 WeakPolarHBondContact O-CB 3.33Å; W127-Y524 HydrophobicContact CH2-CG 4.35Å; W127-L546 HydrophobicContact CH2-CD1 4.47Å; W127-L546 HydrophobicContact CZ2-CD1 4.21Å
128	S	88.4	Confident	71.8	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-67.1	168.9	167.8	84.9	0	0	0	0	111	C138 I139	S128-C138 WeakPolarHBondContact OG-CA 3.2Å; S128-I139 VanDerWaalsContact CB-CG1 3.41Å; S128-I139 PolarHBondContact N-O 3.09Å; S128-I139 WeakPolarHBondContact OG-CG1 3.15Å; S128-I139 PolarHBondContact OG-N 3.08Å; S128-I139 PolarHBondContact OG-O 3.19Å
129	P	86.1	Confident	74	Confident	4 Å²	4	52.7 Å²	52.7	3%	0.026	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-64.9	162.3	165.5	27.6	-30.7	0	0	0	111.1	V132 C230 Q231 V233 T279	P129-V132 HydrophobicContact CG-CG2 3.71Å; P129-V132 WeakPolarHBondContact O-CG2 3.02Å; P129-C230 VanDerWaalsContact CD-O 3.31Å; P129-C230 WeakPolarHBondContact CD-O 3.45Å; P129-Q231 WeakPolarHBondContact CB-O 3.28Å; P129-V233 HydrophobicContact CB-CG2 4.12Å; P129-V233 HydrophobicContact CG-CG2 3.66Å; P129-T279 WeakPolarHBondContact CG-OG1 3.34Å
130	R	82.1	Confident	76.3	Confident	161 Å²	161	45.3 Å²	45.3	61%	0.608	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	151.6	171.7	-175.4	178.7	178	168.6	-2.2	109.6	E136 T520	R130-E136 WeakPolarHBondContact CG-O 3.43Å; R130-T520 PolarHBondContact N-OG1 3.31Å
131	G	82.1	Confident	78.3	Confident	22 Å²	22	41.8 Å²	41.8	23%	0.227	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.3	-1.3	176.9	0	0	0	0	0	114.5	E136 V297	G131-E136 VanDerWaalsContact CA-C 3.48Å; G131-E136 WeakPolarHBondContact CA-O 3.29Å; G131-E136 PolarHBondContact N-O 2.91Å; G131-V297 WeakPolarHBondContact O-CG1 3.46Å
132	V	85.1	Confident	79.8	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	18%	0.181	C	C	.	.			trans	-81.5	-39.3	-168.8	173.5	0	0	0	0	112.7	P129 R137 I139 V233 T279 V297 P298 F299	P129-V132 HydrophobicContact CG-CG2 3.71Å; P129-V132 WeakPolarHBondContact O-CG2 3.02Å; V132-R137 PolarHBondContact N-O 3.45Å; V132-I139 HydrophobicContact CB-CG1 4.5Å; V132-I139 HydrophobicContact CG1-CD1 3.67Å; V132-I139 HydrophobicContact CG1-CG1 3.81Å; V132-I139 HydrophobicContact CG1-CG2 4.22Å; V132-V233 HydrophobicContact CG2-CG2 4.1Å; V132-T279 HydrophobicContact CG1-CG2 4.46Å; V132-T279 HydrophobicContact CG2-CG2 4.12Å; V132-V297 HydrophobicContact CG1-CG2 4.39Å; V132-V297 HydrophobicContact CG2-CG2 4.26Å; V132-P298 CarbonylContact O-C 3.53Å; V132-P298 WeakPolarHBondContact O-CA 3.41Å; V132-F299 HydrophobicContact CG1-CB 4.05Å; V132-F299 WeakPolarHBondContact O-CB 3.33Å; V132-F299 PolarHBondContact O-N 2.89Å
133	D	81.6	Confident	80.6	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.021	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-78.5	169.9	176.2	91.4	-11.5	0	0	0	112.2	Y135 E136 R137 I139	D133-Y135 PolarHBondContact O-N 3.06Å; D133-Y135 WeakPolarHBondContact OD1-CA 3.35Å; D133-Y135 PolarHBondContact OD1-N 2.97Å; D133-E136 PolarHBondContact O-N 3.02Å; D133-E136 PolarHBondContact OD1-N 2.76Å; D133-R137 PolarHBondContact N-O 2.81Å; D133-R137 WeakPolarHBondContact OD1-CA 3.43Å; D133-R137 WeakPolarHBondContact OD1-CB 3.44Å; D133-R137 PolarHBondContact OD1-N 2.86Å; D133-R137 IonicContact OD1-NE 2.85Å; D133-R137 IonicContact OD2-CZ 3.28Å; D133-R137 VanDerWaalsContact OD2-CZ 3.25Å; D133-R137 IonicContact OD2-NE 2.9Å; D133-R137 PolarHBondContact OD2-NE 3.02Å; D133-R137 IonicContact OD2-NH2 3.49Å; D133-R137 PolarHBondContact OD2-NH2 2.75Å; D133-I139 HydrophobicContact CB-CG2 3.73Å
134	K	80.4	Confident	80.8	Confident	148 Å²	148	36.4 Å²	36.4	64%	0.643	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-10.7	179	68.1	-175.5	178.6	-178.5	0	115.8	P298	K134-P298 HydrophobicContact CB-CB 4.22Å
135	Y	81	Confident	80.3	Confident	140 Å²	140	36.6 Å²	36.6	55%	0.549	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.2	19.6	177	-55.1	-75.9	0	0	0	111.6	D133 R137	D133-Y135 PolarHBondContact O-N 3.06Å; D133-Y135 WeakPolarHBondContact OD1-CA 3.35Å; D133-Y135 PolarHBondContact OD1-N 2.97Å; Y135-R137 VanDerWaalsContact C-N 3.26Å; Y135-R137 PolarHBondContact O-N 2.85Å
136	E	78.4	Confident	79.7	Confident	141 Å²	141	40.1 Å²	40.1	66%	0.659	18%	0.179	S	C	*	.	S	Bend	trans	62.7	25.5	179.9	-52.8	-176.4	163	0	0	115.2	R130 G131 D133	R130-E136 WeakPolarHBondContact CG-O 3.43Å; G131-E136 VanDerWaalsContact CA-C 3.48Å; G131-E136 WeakPolarHBondContact CA-O 3.29Å; G131-E136 PolarHBondContact N-O 2.91Å; D133-E136 PolarHBondContact O-N 3.02Å; D133-E136 PolarHBondContact OD1-N 2.76Å
137	R	79.3	Confident	78.9	Confident	53 Å²	53	41.4 Å²	41.4	20%	0.2	19%	0.186	C	C	.	.			trans	-98.6	172.5	178.1	-52.8	173	-61.3	-176.2	8.6	110.7	V132 D133 Y135 L154 G156	V132-R137 PolarHBondContact N-O 3.45Å; D133-R137 PolarHBondContact N-O 2.81Å; D133-R137 WeakPolarHBondContact OD1-CA 3.43Å; D133-R137 WeakPolarHBondContact OD1-CB 3.44Å; D133-R137 PolarHBondContact OD1-N 2.86Å; D133-R137 IonicContact OD1-NE 2.85Å; D133-R137 IonicContact OD2-CZ 3.28Å; D133-R137 VanDerWaalsContact OD2-CZ 3.25Å; D133-R137 IonicContact OD2-NE 2.9Å; D133-R137 PolarHBondContact OD2-NE 3.02Å; D133-R137 IonicContact OD2-NH2 3.49Å; D133-R137 PolarHBondContact OD2-NH2 2.75Å; Y135-R137 VanDerWaalsContact C-N 3.26Å; Y135-R137 PolarHBondContact O-N 2.85Å; R137-L154 PolarHBondContact NH2-O 2.77Å; R137-G156 PolarHBondContact NH1-O 2.86Å
138	C	81.3	Confident	78.6	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.007	20%	0.199	C	C	.	.			trans	-77.5	150.2	172.9	-54.1	0	0	0	0	109.9	W127 S128 T520	W127-C138 HydrophobicContact CE3-CB 4.23Å; S128-C138 WeakPolarHBondContact OG-CA 3.2Å; C138-T520 PolarHBondContact SG-OG1 3.48Å
139	I	84.8	Confident	78.3	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	20%	0.199	C	C	.	.			trans	-104	154.8	164.6	65.4	173.5	0	0	0	109.4	S128 V132 D133 T153 W229 F299	S128-I139 VanDerWaalsContact CB-CG1 3.41Å; S128-I139 PolarHBondContact N-O 3.09Å; S128-I139 WeakPolarHBondContact OG-CG1 3.15Å; S128-I139 PolarHBondContact OG-N 3.08Å; S128-I139 PolarHBondContact OG-O 3.19Å; V132-I139 HydrophobicContact CB-CG1 4.5Å; V132-I139 HydrophobicContact CG1-CD1 3.67Å; V132-I139 HydrophobicContact CG1-CG1 3.81Å; V132-I139 HydrophobicContact CG1-CG2 4.22Å; D133-I139 HydrophobicContact CB-CG2 3.73Å; I139-T153 HydrophobicContact CG2-CG2 3.77Å; I139-W229 HydrophobicContact CD1-CH2 3.42Å; I139-W229 VanDerWaalsContact CD1-CH2 3.42Å; I139-W229 HydrophobicContact CD1-CZ2 3.68Å; I139-W229 HydrophobicContact CD1-CZ3 4.23Å; I139-W229 HydrophobicContact CG1-CH2 4.07Å; I139-W229 HydrophobicContact CG1-CZ2 3.95Å; I139-F299 HydrophobicContact CD1-CB 4.43Å; I139-F299 HydrophobicContact CD1-CD1 4.15Å; I139-F299 HydrophobicContact CD1-CD2 4.3Å; I139-F299 HydrophobicContact CD1-CE1 4.43Å; I139-F299 HydrophobicContact CD1-CG 4.05Å; I139-F299 HydrophobicContact CG2-CD1 4.33Å
140	M	83.8	Confident	78.3	Confident	12 Å²	12	44.7 Å²	44.7	6%	0.059	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	129.2	-178.4	-173.6	177.8	61.3	0	0	109.3	V125 W127 L142 L151 C152 W160	V125-M140 HydrophobicContact CG1-CG 3.79Å; V125-M140 HydrophobicContact CG1-SD 3.77Å; W127-M140 HydrophobicContact CE3-CB 3.93Å; W127-M140 HydrophobicContact CE3-CG 4.28Å; W127-M140 HydrophobicContact CH2-CB 4.08Å; W127-M140 HydrophobicContact CH2-CG 4.08Å; W127-M140 HydrophobicContact CH2-SD 3.83Å; W127-M140 HydrophobicContact CZ2-CG 4.37Å; W127-M140 HydrophobicContact CZ2-SD 4.07Å; W127-M140 HydrophobicContact CZ3-CB 3.61Å; W127-M140 HydrophobicContact CZ3-CG 4.04Å; W127-M140 HydrophobicContact CZ3-SD 4.35Å; M140-L142 HydrophobicContact CE-CB 4.49Å; M140-L151 CarbonylContact O-C 3.49Å; M140-L151 WeakPolarHBondContact O-CA 3.48Å; M140-C152 HydrophobicContact CB-CB 4.36Å; M140-C152 HydrophobicContact CE-CB 3.92Å; M140-C152 PolarHBondContact N-O 3.13Å; M140-C152 PolarHBondContact O-N 2.9Å; M140-W160 HydrophobicContact CB-CE3 4.35Å; M140-W160 HydrophobicContact CB-CZ3 4.15Å; M140-W160 HydrophobicContact CE-CD2 4.37Å; M140-W160 HydrophobicContact CE-CG 4.41Å
141	S	88.3	Confident	78.6	Confident	0 Å²	0	37 Å²	37	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	131.7	161.3	63.1	0	0	0	0	109.5	S126 V150 L151 T227 W229	S126-S141 WeakPolarHBondContact CB-OG 3.5Å; S126-S141 PolarHBondContact N-O 2.81Å; S126-S141 PolarHBondContact O-N 3.22Å; S126-S141 PolarHBondContact O-OG 3.04Å; S141-V150 WeakPolarHBondContact CA-O 3.38Å; S141-L151 VanDerWaalsContact CB-CD2 3.49Å; S141-T227 WeakPolarHBondContact CB-OG1 3.44Å; S141-T227 PolarHBondContact OG-OG1 2.83Å; S141-W229 PolarHBondContact OG-NE1 2.9Å
142	L	80.9	Confident	78.8	Confident	3 Å²	3	36 Å²	36	2%	0.016	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	126.1	-174.5	179.1	79.1	0	0	0	109	L116 L118 A122 V125 M140 T144 T149 V150	L116-L142 HydrophobicContact CD2-CD2 4.46Å; L118-L142 HydrophobicContact CD2-CD2 3.55Å; A122-L142 HydrophobicContact CB-CD1 3.41Å; A122-L142 VanDerWaalsContact CB-CD1 3.41Å; V125-L142 HydrophobicContact CG2-CD1 3.72Å; M140-L142 HydrophobicContact CE-CB 4.49Å; L142-T144 HydrophobicContact CD2-CG2 4.28Å; L142-T149 CarbonylContact O-C 3.57Å; L142-T149 VanDerWaalsContact O-CA 3.28Å; L142-T149 WeakPolarHBondContact O-CA 3.45Å; L142-V150 HydrophobicContact CB-CG2 3.95Å; L142-V150 HydrophobicContact CD2-CG2 4.05Å; L142-V150 HydrophobicContact CG-CG2 4.48Å; L142-V150 PolarHBondContact N-O 2.92Å; L142-V150 PolarHBondContact O-N 2.91Å
143	T	75.8	Confident	78.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	116.8	166.4	-56.9	0	0	0	0	108.3	R123 L124 T149	R123-T143 PolarHBondContact N-O 3.01Å; L124-T143 PolarHBondContact N-O 2.86Å; L124-T143 PolarHBondContact O-N 3.33Å; T143-T149 WeakPolarHBondContact CG2-OG1 3.48Å; T143-T149 PolarHBondContact OG1-OG1 2.79Å
144	T	69.4	Low	78.2	Confident	23 Å²	23	37.6 Å²	37.6	14%	0.141	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	168.2	178.5	74.5	0	0	0	0	110.5	L142 E146 N147 R148	L142-T144 HydrophobicContact CD2-CG2 4.28Å; T144-E146 PolarHBondContact O-N 3.28Å; T144-E146 PolarHBondContact OG1-N 2.95Å; T144-N147 PolarHBondContact O-N 3.3Å; T144-R148 HydrophobicContact CG2-CB 4.36Å; T144-R148 PolarHBondContact N-O 2.79Å; T144-R148 WeakPolarHBondContact OG1-CB 3.33Å; T144-R148 PolarHBondContact OG1-N 2.88Å; T144-R148 PolarHBondContact OG1-O 3.39Å
145	M	59.8	Low	77.7	Confident	23 Å²	23	35 Å²	35	11%	0.113	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-16.2	172.6	-66.5	-55.1	-37.6	0	0	114.6	R102 N120 R123	R102-M145 HydrophobicContact CB-CB 4.1Å; R102-M145 HydrophobicContact CB-CE 3.65Å; R102-M145 VanDerWaalsContact CD-CE 3.46Å; R102-M145 HydrophobicContact CG-CB 4.45Å; R102-M145 HydrophobicContact CG-CE 4.05Å; R102-M145 VanDerWaalsContact NH1-CG 3.28Å; R102-M145 PolarHBondContact NH1-SD 2.73Å; R102-M145 VanDerWaalsContact O-O 3.04Å; N120-M145 VanDerWaalsContact O-CG 3.22Å; N120-M145 WeakPolarHBondContact O-CG 3.45Å; R123-M145 HydrophobicContact CB-CE 4.42Å; R123-M145 HydrophobicContact CB-SD 3.87Å
146	E	59.9	Low	77.1	Confident	89 Å²	89	30.6 Å²	30.6	42%	0.416	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	11	175.3	-69.7	158.3	-153.3	0	0	111.2	I104 N120 T144 R148	I104-E146 HydrophobicContact CB-CG 4.14Å; N120-E146 PolarHBondContact ND2-OE1 2.81Å; T144-E146 PolarHBondContact O-N 3.28Å; T144-E146 PolarHBondContact OG1-N 2.95Å; E146-R148 PolarHBondContact O-N 3.38Å; E146-R148 VanDerWaalsContact O-N 3.16Å
147	N	67.8	Low	76.4	Confident	29 Å²	29	29.6 Å²	29.6	16%	0.155	16%	0.158	C	C	.	.	S	Bend	trans	59.7	16.6	-175.4	-46.8	-58.6	0	0	0	114.8	R123 T144 T149 V223	R123-N147 PolarHBondContact NH1-OD1 3.16Å; T144-N147 PolarHBondContact O-N 3.3Å; N147-T149 PolarHBondContact O-N 2.93Å; N147-V223 HydrophobicContact CB-CG1 3.58Å
148	R	74.6	Confident	75.6	Confident	90 Å²	90	35.8 Å²	35.8	34%	0.34	19%	0.189	S	C	.	.			trans	-74	126.7	167.2	-170.4	-179.8	177.4	-131.5	-9.2	107.9	T144 E146 V150 E162 D165	T144-R148 HydrophobicContact CG2-CB 4.36Å; T144-R148 PolarHBondContact N-O 2.79Å; T144-R148 WeakPolarHBondContact OG1-CB 3.33Å; T144-R148 PolarHBondContact OG1-N 2.88Å; T144-R148 PolarHBondContact OG1-O 3.39Å; E146-R148 PolarHBondContact O-N 3.38Å; E146-R148 VanDerWaalsContact O-N 3.16Å; R148-V150 HydrophobicContact CG-CG1 4.14Å; R148-E162 IonicContact CZ-OE2 2.86Å; R148-E162 VanDerWaalsContact CZ-OE2 3.28Å; R148-E162 IonicContact NH1-OE1 3.76Å; R148-E162 PolarHBondContact NH1-OE1 2.94Å; R148-E162 IonicContact NH1-OE2 3.67Å; R148-E162 PolarHBondContact NH1-OE2 2.88Å; R148-E162 IonicContact NH2-OE2 2.79Å; R148-E162 PolarHBondContact NH2-OE2 3.18Å; R148-D165 IonicContact CZ-OD2 3.36Å; R148-D165 IonicContact NE-OD1 3.87Å; R148-D165 IonicContact NE-OD2 3.02Å; R148-D165 PolarHBondContact NE-OD2 3.28Å; R148-D165 IonicContact NH2-OD2 2.75Å; R148-D165 PolarHBondContact NH2-OD2 2.86Å
149	T	82.5	Confident	74.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.7	177.2	-65.9	0	0	0	0	109.8	L142 T143 N147 L166 A167 V224 T227	L142-T149 CarbonylContact O-C 3.57Å; L142-T149 VanDerWaalsContact O-CA 3.28Å; L142-T149 WeakPolarHBondContact O-CA 3.45Å; T143-T149 WeakPolarHBondContact CG2-OG1 3.48Å; T143-T149 PolarHBondContact OG1-OG1 2.79Å; N147-T149 PolarHBondContact O-N 2.93Å; T149-L166 HydrophobicContact CG2-CB 4.15Å; T149-L166 HydrophobicContact CG2-CD2 3.9Å; T149-L166 WeakPolarHBondContact O-CB 3.45Å; T149-L166 PolarHBondContact O-N 2.86Å; T149-A167 PolarHBondContact O-N 2.65Å; T149-V224 HydrophobicContact CG2-CG1 4.03Å; T149-V224 VanDerWaalsContact OG1-CB 3.29Å; T149-V224 WeakPolarHBondContact OG1-CB 3.49Å; T149-V224 WeakPolarHBondContact OG1-CG1 3.44Å; T149-T227 HydrophobicContact CG2-CG2 3.52Å
150	V	84.7	Confident	74.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	150.9	-176.7	-61	0	0	0	0	110.7	S141 L142 R148 E162 V164	S141-V150 WeakPolarHBondContact CA-O 3.38Å; L142-V150 HydrophobicContact CB-CG2 3.95Å; L142-V150 HydrophobicContact CD2-CG2 4.05Å; L142-V150 HydrophobicContact CG-CG2 4.48Å; L142-V150 PolarHBondContact N-O 2.92Å; L142-V150 PolarHBondContact O-N 2.91Å; R148-V150 HydrophobicContact CG-CG1 4.14Å; V150-E162 HydrophobicContact CB-CG 4.47Å; V150-E162 HydrophobicContact CG2-CG 4.36Å; V150-V164 CarbonylContact C-O 3.47Å; V150-V164 VanDerWaalsContact CA-O 3.25Å; V150-V164 WeakPolarHBondContact CA-O 3.24Å
151	L	90.1	Very high	74.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	125.6	166.8	-53.6	-173.9	0	0	0	108.8	M140 S141 S163 V164 W229 L281 F299 M305	M140-L151 CarbonylContact O-C 3.49Å; M140-L151 WeakPolarHBondContact O-CA 3.48Å; S141-L151 VanDerWaalsContact CB-CD2 3.49Å; L151-S163 PolarHBondContact O-N 2.71Å; L151-V164 HydrophobicContact CB-CB 4.15Å; L151-V164 HydrophobicContact CD1-CB 4.45Å; L151-V164 HydrophobicContact CG-CB 4.39Å; L151-V164 PolarHBondContact N-O 2.94Å; L151-V164 PolarHBondContact O-N 2.79Å; L151-W229 HydrophobicContact CD1-CH2 4.32Å; L151-W229 HydrophobicContact CD1-CZ2 4.37Å; L151-W229 HydrophobicContact CD2-CZ2 3.89Å; L151-L281 HydrophobicContact CD1-CD2 4.31Å; L151-L281 HydrophobicContact CD2-CD2 4.1Å; L151-F299 HydrophobicContact CB-CZ 4.23Å; L151-F299 HydrophobicContact CD1-CE2 4.08Å; L151-F299 HydrophobicContact CD1-CZ 3.91Å; L151-M305 HydrophobicContact CD1-CE 3.85Å; L151-M305 HydrophobicContact CD1-SD 3.6Å
152	C	84.7	Confident	73.9	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	137.7	-179	-57.8	0	0	0	0	110.8	M140 W160 E161	M140-C152 HydrophobicContact CB-CB 4.36Å; M140-C152 HydrophobicContact CE-CB 3.92Å; M140-C152 PolarHBondContact N-O 3.13Å; M140-C152 PolarHBondContact O-N 2.9Å; C152-W160 HydrophobicContact CB-CB 4.37Å; C152-W160 HydrophobicContact CB-CE3 3.94Å; C152-E161 CarbonylContact C-O 3.51Å; C152-E161 WeakPolarHBondContact CA-O 3.39Å
153	T	82.3	Confident	74.1	Confident	24 Å²	24	48.8 Å²	48.8	15%	0.147	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	160	169	62.3	0	0	0	0	109.6	I139 K155 W160 E161 S163 F299	I139-T153 HydrophobicContact CG2-CG2 3.77Å; T153-K155 PolarHBondContact O-N 3.1Å; T153-W160 VanDerWaalsContact C-CE3 3.41Å; T153-W160 CarbonylContact O-C 3.52Å; T153-W160 WeakPolarHBondContact O-CA 3.42Å; T153-E161 PolarHBondContact N-O 2.89Å; T153-E161 PolarHBondContact O-N 2.81Å; T153-S163 WeakPolarHBondContact CB-OG 3Å; T153-S163 WeakPolarHBondContact CG2-OG 3.36Å; T153-S163 PolarHBondContact OG1-OG 3.28Å; T153-F299 HydrophobicContact CG2-CD1 3.67Å; T153-F299 HydrophobicContact CG2-CE1 3.85Å
154	L	71.4	Confident	74.6	Confident	13 Å²	13	49 Å²	49	7%	0.068	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	118.3	-179.8	-162.1	79.9	0	0	0	110	R137 G156 S159 W160	R137-L154 PolarHBondContact NH2-O 2.77Å; L154-G156 VanDerWaalsContact CD2-O 3.24Å; L154-G156 WeakPolarHBondContact CD2-O 3.37Å; L154-G156 WeakPolarHBondContact CG-O 3.47Å; L154-G156 PolarHBondContact O-N 2.69Å; L154-S159 CarbonylContact C-O 3.54Å; L154-S159 WeakPolarHBondContact CA-O 3.48Å; L154-S159 VanDerWaalsContact CD1-O 3.31Å; L154-S159 WeakPolarHBondContact CD1-O 3.49Å; L154-W160 HydrophobicContact CB-CE3 4.29Å; L154-W160 HydrophobicContact CB-CH2 4.2Å; L154-W160 HydrophobicContact CB-CZ3 4.1Å; L154-W160 HydrophobicContact CD1-CD2 3.69Å; L154-W160 VanDerWaalsContact CD1-CE2 3.41Å; L154-W160 HydrophobicContact CD1-CE3 4.23Å; L154-W160 HydrophobicContact CD1-CG 4.04Å; L154-W160 HydrophobicContact CD1-CH2 4.16Å; L154-W160 HydrophobicContact CD1-CZ2 3.67Å; L154-W160 HydrophobicContact CD1-CZ3 4.45Å
155	K	71.3	Confident	75.4	Confident	93 Å²	93	49.6 Å²	49.6	40%	0.404	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	101.2	170.9	-174.2	-179.1	-167.8	164.4	0	108.1	D114 T153 S159 E161	D114-K155 IonicContact OD1-NZ 3.79Å; D114-K155 PolarHBondContact OD1-NZ 3.21Å; T153-K155 PolarHBondContact O-N 3.1Å; K155-S159 PolarHBondContact N-O 2.97Å; K155-S159 PolarHBondContact O-OG 3.18Å; K155-E161 HydrophobicContact CB-CB 3.92Å; K155-E161 HydrophobicContact CD-CB 4.34Å; K155-E161 WeakPolarHBondContact CD-OE2 3.24Å; K155-E161 IonicContact NZ-OE1 2.65Å
156	G	67	Low	76.7	Confident	49 Å²	49	48.5 Å²	48.5	51%	0.505	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	-139.2	-172.6	0	0	0	0	0	112.1	R137 L154	R137-G156 PolarHBondContact NH1-O 2.86Å; L154-G156 VanDerWaalsContact CD2-O 3.24Å; L154-G156 WeakPolarHBondContact CD2-O 3.37Å; L154-G156 WeakPolarHBondContact CG-O 3.47Å; L154-G156 PolarHBondContact O-N 2.69Å
157	T	63.9	Low	77.8	Confident	120 Å²	120	45.1 Å²	45.1	74%	0.736	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105	-17.2	-179.1	46.5	0	0	0	0	114.3
158	E	62.9	Low	78.5	Confident	183 Å²	183	46.1 Å²	46.1	86%	0.855	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.2	-11.7	-165.6	-63.8	-174.6	176	0	0	114.5
159	S	67.8	Low	78.8	Confident	54 Å²	54	42 Å²	42	38%	0.378	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	144.5	-173.2	72.1	0	0	0	0	112.8	L154 K155	L154-S159 CarbonylContact C-O 3.54Å; L154-S159 WeakPolarHBondContact CA-O 3.48Å; L154-S159 VanDerWaalsContact CD1-O 3.31Å; L154-S159 WeakPolarHBondContact CD1-O 3.49Å; K155-S159 PolarHBondContact N-O 2.97Å; K155-S159 PolarHBondContact O-OG 3.18Å
160	W	71.9	Confident	79	Confident	41 Å²	41	42.1 Å²	42.1	16%	0.155	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	139.3	171.7	-70.2	93.9	0	0	0	109.7	L116 W127 M140 C152 T153 L154	L116-W160 HydrophobicContact CD1-CB 4.46Å; W127-W160 AromaticContact CH2-CH2 3.99Å; W127-W160 HydrophobicContact CH2-CH2 3.99Å; W127-W160 AromaticContact CH2-CZ2 3.55Å; W127-W160 HydrophobicContact CH2-CZ2 3.55Å; W127-W160 AromaticContact CZ3-CH2 3.43Å; W127-W160 HydrophobicContact CZ3-CH2 3.43Å; W127-W160 VanDerWaalsContact CZ3-CH2 3.43Å; W127-W160 AromaticContact CZ3-CZ2 3.51Å; W127-W160 HydrophobicContact CZ3-CZ2 3.51Å; W127-W160 HydrophobicContact CZ3-CZ3 4.25Å; M140-W160 HydrophobicContact CB-CE3 4.35Å; M140-W160 HydrophobicContact CB-CZ3 4.15Å; M140-W160 HydrophobicContact CE-CD2 4.37Å; M140-W160 HydrophobicContact CE-CG 4.41Å; C152-W160 HydrophobicContact CB-CB 4.37Å; C152-W160 HydrophobicContact CB-CE3 3.94Å; T153-W160 VanDerWaalsContact C-CE3 3.41Å; T153-W160 CarbonylContact O-C 3.52Å; T153-W160 WeakPolarHBondContact O-CA 3.42Å; L154-W160 HydrophobicContact CB-CE3 4.29Å; L154-W160 HydrophobicContact CB-CH2 4.2Å; L154-W160 HydrophobicContact CB-CZ3 4.1Å; L154-W160 HydrophobicContact CD1-CD2 3.69Å; L154-W160 VanDerWaalsContact CD1-CE2 3.41Å; L154-W160 HydrophobicContact CD1-CE3 4.23Å; L154-W160 HydrophobicContact CD1-CG 4.04Å; L154-W160 HydrophobicContact CD1-CH2 4.16Å; L154-W160 HydrophobicContact CD1-CZ2 3.67Å; L154-W160 HydrophobicContact CD1-CZ3 4.45Å
161	E	80.2	Confident	78.8	Confident	82 Å²	82	46.2 Å²	46.2	38%	0.383	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	132.6	178	175.7	168.7	-147.5	0	0	109.7	C152 T153 K155 S163	C152-E161 CarbonylContact C-O 3.51Å; C152-E161 WeakPolarHBondContact CA-O 3.39Å; T153-E161 PolarHBondContact N-O 2.89Å; T153-E161 PolarHBondContact O-N 2.81Å; K155-E161 HydrophobicContact CB-CB 3.92Å; K155-E161 HydrophobicContact CD-CB 4.34Å; K155-E161 WeakPolarHBondContact CD-OE2 3.24Å; K155-E161 IonicContact NZ-OE1 2.65Å; E161-S163 PolarHBondContact O-N 2.9Å; E161-S163 VanDerWaalsContact O-N 3.17Å; E161-S163 PolarHBondContact O-OG 2.95Å
162	E	82.4	Confident	78.3	Confident	70 Å²	70	46.3 Å²	46.3	33%	0.327	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	113.3	171.1	-65.3	-174.3	-176.7	0	0	108.9	L116 R148 V150	L116-E162 HydrophobicContact CD1-CG 3.78Å; L116-E162 HydrophobicContact CG-CG 4.19Å; R148-E162 IonicContact CZ-OE2 2.86Å; R148-E162 VanDerWaalsContact CZ-OE2 3.28Å; R148-E162 IonicContact NH1-OE1 3.76Å; R148-E162 PolarHBondContact NH1-OE1 2.94Å; R148-E162 IonicContact NH1-OE2 3.67Å; R148-E162 PolarHBondContact NH1-OE2 2.88Å; R148-E162 IonicContact NH2-OE2 2.79Å; R148-E162 PolarHBondContact NH2-OE2 3.18Å; V150-E162 HydrophobicContact CB-CG 4.47Å; V150-E162 HydrophobicContact CG2-CG 4.36Å
163	S	85.1	Confident	78.3	Confident	41 Å²	41	46.4 Å²	46.4	29%	0.287	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-33.7	179.1	-56.4	0	0	0	0	111.6	L151 T153 E161	L151-S163 PolarHBondContact O-N 2.71Å; T153-S163 WeakPolarHBondContact CB-OG 3Å; T153-S163 WeakPolarHBondContact CG2-OG 3.36Å; T153-S163 PolarHBondContact OG1-OG 3.28Å; E161-S163 PolarHBondContact O-N 2.9Å; E161-S163 VanDerWaalsContact O-N 3.17Å; E161-S163 PolarHBondContact O-OG 2.95Å
164	V	87.2	Confident	78.3	Confident	5 Å²	5	45.3 Å²	45.3	3%	0.03	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	134.5	-178.1	173.7	0	0	0	0	110.6	V150 L151 I169 F299 V302 M305	V150-V164 CarbonylContact C-O 3.47Å; V150-V164 VanDerWaalsContact CA-O 3.25Å; V150-V164 WeakPolarHBondContact CA-O 3.24Å; L151-V164 HydrophobicContact CB-CB 4.15Å; L151-V164 HydrophobicContact CD1-CB 4.45Å; L151-V164 HydrophobicContact CG-CB 4.39Å; L151-V164 PolarHBondContact N-O 2.94Å; L151-V164 PolarHBondContact O-N 2.79Å; V164-I169 HydrophobicContact CG1-CD1 3.24Å; V164-F299 HydrophobicContact CB-CZ 4.29Å; V164-F299 HydrophobicContact CG2-CE1 4.37Å; V164-F299 HydrophobicContact CG2-CE2 4.28Å; V164-F299 HydrophobicContact CG2-CZ 3.52Å; V164-V302 HydrophobicContact CB-CG2 4.38Å; V164-V302 HydrophobicContact CG1-CG2 4.02Å; V164-V302 HydrophobicContact CG2-CB 4.47Å; V164-V302 HydrophobicContact CG2-CG2 3.71Å; V164-M305 HydrophobicContact CG1-SD 3.97Å; V164-M305 HydrophobicContact CG2-SD 4.44Å
165	D	86.3	Confident	78.6	Confident	35 Å²	35	45.7 Å²	45.7	19%	0.187	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	97.1	166.2	-166.6	-27.8	0	0	0	109.6	R148 A167 L168 I169	R148-D165 IonicContact CZ-OD2 3.36Å; R148-D165 IonicContact NE-OD1 3.87Å; R148-D165 IonicContact NE-OD2 3.02Å; R148-D165 PolarHBondContact NE-OD2 3.28Å; R148-D165 IonicContact NH2-OD2 2.75Å; R148-D165 PolarHBondContact NH2-OD2 2.86Å; D165-A167 VanDerWaalsContact C-N 3.32Å; D165-A167 PolarHBondContact O-N 2.85Å; D165-A167 PolarHBondContact OD1-N 2.65Å; D165-L168 HydrophobicContact CB-CB 3.95Å; D165-L168 PolarHBondContact O-N 2.88Å; D165-L168 PolarHBondContact OD1-N 3.01Å; D165-I169 WeakPolarHBondContact O-CG1 3.5Å; D165-I169 PolarHBondContact O-N 3.42Å
166	L	87.6	Confident	78.9	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-69.2	-33.2	-175.6	-174.1	59.6	0	0	0	111.9	T149 L168 I169 W170 T227 L281 V283 W293 M305	T149-L166 HydrophobicContact CG2-CB 4.15Å; T149-L166 HydrophobicContact CG2-CD2 3.9Å; T149-L166 WeakPolarHBondContact O-CB 3.45Å; T149-L166 PolarHBondContact O-N 2.86Å; L166-L168 VanDerWaalsContact C-N 3.33Å; L166-I169 PolarHBondContact O-N 2.79Å; L166-W170 VanDerWaalsContact O-CB 3.3Å; L166-W170 WeakPolarHBondContact O-CB 3.46Å; L166-W170 PolarHBondContact O-N 2.78Å; L166-T227 HydrophobicContact CD2-CG2 4.42Å; L166-L281 HydrophobicContact CD2-CD2 3.95Å; L166-V283 HydrophobicContact CD2-CG2 3.76Å; L166-W293 HydrophobicContact CD1-CD2 4.47Å; L166-W293 HydrophobicContact CD1-CZ2 4.15Å; L166-M305 HydrophobicContact CD1-CE 3.73Å
167	A	82.3	Confident	79.6	Confident	17 Å²	17	44.3 Å²	44.3	14%	0.14	23%	0.231	C	C	.	.	H	α-helix	trans	-64.4	-41.3	177.4	0	0	0	0	0	110.9	T149 D165 W170 Q171	T149-A167 PolarHBondContact O-N 2.65Å; D165-A167 VanDerWaalsContact C-N 3.32Å; D165-A167 PolarHBondContact O-N 2.85Å; D165-A167 PolarHBondContact OD1-N 2.65Å; A167-W170 PolarHBondContact O-N 3.06Å; A167-Q171 WeakPolarHBondContact O-CB 3.42Å; A167-Q171 PolarHBondContact O-N 2.83Å
168	L	81.3	Confident	80.4	Confident	51 Å²	51	38.6 Å²	38.6	27%	0.267	20%	0.196	S	C	.	.	H	α-helix	trans	-64.3	-46.6	177.1	-172.5	67.6	0	0	0	112.4	D165 L166 W170 Q171 Q172 C201 I204	D165-L168 HydrophobicContact CB-CB 3.95Å; D165-L168 PolarHBondContact O-N 2.88Å; D165-L168 PolarHBondContact OD1-N 3.01Å; L166-L168 VanDerWaalsContact C-N 3.33Å; L168-W170 VanDerWaalsContact C-N 3.32Å; L168-W170 PolarHBondContact O-N 2.82Å; L168-Q171 WeakPolarHBondContact O-CB 3.47Å; L168-Q171 PolarHBondContact O-N 3.16Å; L168-Q172 PolarHBondContact O-N 3.02Å; L168-C201 HydrophobicContact CD2-CB 4.03Å; L168-I204 HydrophobicContact CD1-CD1 3.46Å; L168-I204 VanDerWaalsContact CD1-CD1 3.46Å; L168-I204 HydrophobicContact CG-CD1 4.19Å
169	I	82.9	Confident	81.3	Confident	3 Å²	3	31.8 Å²	31.8	2%	0.015	16%	0.162	C	C	.	.	H	α-helix	trans	-61.4	-44.7	178.2	-64.3	164.9	0	0	0	110.5	V164 D165 L166 Q171 Q172 Y173 F194 F196 W293 V302	V164-I169 HydrophobicContact CG1-CD1 3.24Å; D165-I169 WeakPolarHBondContact O-CG1 3.5Å; D165-I169 PolarHBondContact O-N 3.42Å; L166-I169 PolarHBondContact O-N 2.79Å; I169-Q171 VanDerWaalsContact C-N 3.35Å; I169-Q172 PolarHBondContact O-N 2.86Å; I169-Y173 PolarHBondContact O-N 2.77Å; I169-F194 HydrophobicContact CG2-CE1 3.97Å; I169-F196 HydrophobicContact CG1-CD2 4Å; I169-F196 HydrophobicContact CG1-CE2 3.72Å; I169-F196 HydrophobicContact CG1-CZ 4.16Å; I169-F196 HydrophobicContact CG2-CD2 4.12Å; I169-W293 HydrophobicContact CG2-CH2 3.65Å; I169-W293 HydrophobicContact CG2-CZ2 4.42Å; I169-W293 HydrophobicContact CG2-CZ3 4.27Å; I169-V302 HydrophobicContact CD1-CB 4.23Å; I169-V302 HydrophobicContact CD1-CG1 3.46Å; I169-V302 VanDerWaalsContact CD1-CG1 3.46Å; I169-V302 HydrophobicContact CD1-CG2 3.78Å; I169-V302 HydrophobicContact CG1-CG1 4.17Å
170	W	85.6	Confident	81.5	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.008	15%	0.151	C	C	.	.	H	α-helix	trans	-64.1	-40.5	178.1	177.6	-112.3	0	0	0	112.1	L166 A167 L168 Q172 Y173 Y174 D221 M285 C291 W293 L307 V310	L166-W170 VanDerWaalsContact O-CB 3.3Å; L166-W170 WeakPolarHBondContact O-CB 3.46Å; L166-W170 PolarHBondContact O-N 2.78Å; A167-W170 PolarHBondContact O-N 3.06Å; L168-W170 VanDerWaalsContact C-N 3.32Å; L168-W170 PolarHBondContact O-N 2.82Å; W170-Q172 VanDerWaalsContact C-N 3.34Å; W170-Q172 PolarHBondContact O-N 3.24Å; W170-Y173 HydrophobicContact CD2-CD1 4.48Å; W170-Y173 AromaticContact CE3-CD1 3.71Å; W170-Y173 HydrophobicContact CE3-CD1 3.71Å; W170-Y173 HydrophobicContact CE3-CE1 4.44Å; W170-Y173 HydrophobicContact CE3-CG 4.4Å; W170-Y173 AromaticContact CH2-CD1 3.81Å; W170-Y173 HydrophobicContact CH2-CD1 3.81Å; W170-Y173 AromaticContact CH2-CE1 3.81Å; W170-Y173 HydrophobicContact CH2-CE1 3.81Å; W170-Y173 AromaticContact CZ3-CD1 3.33Å; W170-Y173 HydrophobicContact CZ3-CD1 3.33Å; W170-Y173 AromaticContact CZ3-CE1 3.62Å; W170-Y173 HydrophobicContact CZ3-CE1 3.62Å; W170-Y173 HydrophobicContact CZ3-CG 4.3Å; W170-Y173 PolarHBondContact O-N 2.86Å; W170-Y174 HydrophobicContact CZ2-CD2 4.45Å; W170-Y174 VanDerWaalsContact O-CB 3.32Å; W170-Y174 WeakPolarHBondContact O-CB 3.28Å; W170-Y174 PolarHBondContact O-N 3.46Å; W170-D221 PolarHBondContact NE1-O 3.27Å; W170-M285 HydrophobicContact CD2-CE 3.63Å; W170-M285 VanDerWaalsContact CE2-CE 3.43Å; W170-M285 HydrophobicContact CE3-CE 4.24Å; W170-M285 HydrophobicContact CG-CE 3.85Å; W170-M285 HydrophobicContact CG-SD 4.44Å; W170-M285 HydrophobicContact CH2-CE 4.46Å; W170-M285 HydrophobicContact CZ2-CE 3.89Å; W170-M285 HydrophobicContact CZ2-CG 4.29Å; W170-M285 PolarHBondContact NE1-SD 3.03Å; W170-C291 HydrophobicContact CH2-CB 4.22Å; W170-C291 HydrophobicContact CZ3-CB 4.06Å; W170-W293 HydrophobicContact CE3-CZ2 4.22Å; W170-L307 HydrophobicContact CZ3-CD1 4.35Å; W170-L307 HydrophobicContact CZ3-CD2 4Å; W170-V310 HydrophobicContact CH2-CG1 3.76Å; W170-V310 HydrophobicContact CH2-CG2 3.96Å; W170-V310 HydrophobicContact CZ3-CG2 3.98Å
171	Q	81.5	Confident	81.5	Confident	87 Å²	87	30.1 Å²	30.1	41%	0.407	16%	0.159	S	C	.	.	H	α-helix	trans	-59.3	-45.3	175.1	-178.1	-178.6	-0.6	0	0	111.3	A167 L168 I169 Y174 V175	A167-Q171 WeakPolarHBondContact O-CB 3.42Å; A167-Q171 PolarHBondContact O-N 2.83Å; L168-Q171 WeakPolarHBondContact O-CB 3.47Å; L168-Q171 PolarHBondContact O-N 3.16Å; I169-Q171 VanDerWaalsContact C-N 3.35Å; Q171-Y174 PolarHBondContact O-N 2.77Å; Q171-V175 VanDerWaalsContact O-CG2 3.28Å; Q171-V175 WeakPolarHBondContact O-CG2 3.32Å; Q171-V175 PolarHBondContact O-N 3.29Å
172	Q	79.3	Confident	81.3	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.009	16%	0.159	C	C	.	.	H	α-helix	trans	-60.2	-49	176.8	-174.5	178.7	-6.5	0	0	111.3	L168 I169 W170 Y174 V175 E176 F194 E200 I204	L168-Q172 PolarHBondContact O-N 3.02Å; I169-Q172 PolarHBondContact O-N 2.86Å; W170-Q172 VanDerWaalsContact C-N 3.34Å; W170-Q172 PolarHBondContact O-N 3.24Å; Q172-Y174 VanDerWaalsContact C-N 3.29Å; Q172-Y174 PolarHBondContact O-N 2.75Å; Q172-V175 PolarHBondContact O-N 2.78Å; Q172-E176 PolarHBondContact O-N 3.39Å; Q172-F194 HydrophobicContact CB-CZ 4.16Å; Q172-F194 HydrophobicContact CG-CE2 4.25Å; Q172-F194 HydrophobicContact CG-CZ 3.98Å; Q172-E200 PolarHBondContact NE2-OE2 2.84Å; Q172-I204 HydrophobicContact CB-CD1 4.39Å; Q172-I204 HydrophobicContact CB-CG1 4.44Å
173	Y	83.6	Confident	80.7	Confident	1 Å²	1	30.8 Å²	30.8	0%	0.004	17%	0.171	C	C	.	.	H	α-helix	trans	-54.8	-46.5	173.9	172.1	-98.1	0	0	0	111.7	I169 W170 V175 E176 H177 P192 F194 L307 V310	I169-Y173 PolarHBondContact O-N 2.77Å; W170-Y173 HydrophobicContact CD2-CD1 4.48Å; W170-Y173 AromaticContact CE3-CD1 3.71Å; W170-Y173 HydrophobicContact CE3-CD1 3.71Å; W170-Y173 HydrophobicContact CE3-CE1 4.44Å; W170-Y173 HydrophobicContact CE3-CG 4.4Å; W170-Y173 AromaticContact CH2-CD1 3.81Å; W170-Y173 HydrophobicContact CH2-CD1 3.81Å; W170-Y173 AromaticContact CH2-CE1 3.81Å; W170-Y173 HydrophobicContact CH2-CE1 3.81Å; W170-Y173 AromaticContact CZ3-CD1 3.33Å; W170-Y173 HydrophobicContact CZ3-CD1 3.33Å; W170-Y173 AromaticContact CZ3-CE1 3.62Å; W170-Y173 HydrophobicContact CZ3-CE1 3.62Å; W170-Y173 HydrophobicContact CZ3-CG 4.3Å; W170-Y173 PolarHBondContact O-N 2.86Å; Y173-V175 PolarHBondContact O-N 2.92Å; Y173-E176 PolarHBondContact O-N 2.84Å; Y173-H177 HydrophobicContact CD2-CB 3.94Å; Y173-H177 AromaticContact CD2-ND1 3.9Å; Y173-H177 HydrophobicContact CE1-CB 4.24Å; Y173-H177 HydrophobicContact CE2-CB 3.44Å; Y173-H177 VanDerWaalsContact CE2-CB 3.44Å; Y173-H177 AromaticContact CE2-CG 3.81Å; Y173-H177 WeakPolarHBondContact O-CA 3.23Å; Y173-H177 WeakPolarHBondContact O-CB 3.5Å; Y173-H177 PolarHBondContact O-N 2.9Å; Y173-P192 HydrophobicContact CE2-CB 3.56Å; Y173-P192 HydrophobicContact CE2-CG 4.19Å; Y173-P192 WeakPolarHBondContact OH-CB 3.25Å; Y173-F194 HydrophobicContact CD2-CB 3.67Å; Y173-F194 HydrophobicContact CD2-CD1 4.26Å; Y173-F194 AromaticContact CD2-CD2 3.72Å; Y173-F194 HydrophobicContact CD2-CD2 3.72Å; Y173-F194 HydrophobicContact CD2-CE2 4.43Å; Y173-F194 AromaticContact CD2-CG 3.61Å; Y173-F194 HydrophobicContact CD2-CG 3.61Å; Y173-F194 HydrophobicContact CE2-CB 4.11Å; Y173-F194 HydrophobicContact CG-CD2 4.45Å; Y173-F194 HydrophobicContact CG-CG 4.39Å; Y173-L307 HydrophobicContact CD1-CD2 3.92Å; Y173-L307 HydrophobicContact CD2-CD2 3.76Å; Y173-L307 HydrophobicContact CE1-CD2 3.84Å; Y173-L307 HydrophobicContact CE2-CD2 3.66Å; Y173-L307 HydrophobicContact CG-CD2 3.87Å; Y173-V310 HydrophobicContact CE1-CG2 3.97Å
174	Y	82.1	Confident	79.6	Confident	1 Å²	1	34 Å²	34	0%	0.004	18%	0.176	C	C	.	.	H	α-helix	trans	-66.4	-37.7	-175.7	-173.1	-91.6	0	0	0	112.8	W170 Q171 Q172 E176 G178 R179 V180 L207 A218 D221 V222 Y312	W170-Y174 HydrophobicContact CZ2-CD2 4.45Å; W170-Y174 VanDerWaalsContact O-CB 3.32Å; W170-Y174 WeakPolarHBondContact O-CB 3.28Å; W170-Y174 PolarHBondContact O-N 3.46Å; Q171-Y174 PolarHBondContact O-N 2.77Å; Q172-Y174 VanDerWaalsContact C-N 3.29Å; Q172-Y174 PolarHBondContact O-N 2.75Å; Y174-E176 VanDerWaalsContact C-N 3.25Å; Y174-E176 PolarHBondContact O-N 3.47Å; Y174-G178 WeakPolarHBondContact O-CA 3.37Å; Y174-G178 PolarHBondContact O-N 2.89Å; Y174-R179 HydrophobicContact CE2-CG 4.36Å; Y174-V180 VanDerWaalsContact OH-CG2 3.26Å; Y174-V180 WeakPolarHBondContact OH-CG2 3.48Å; Y174-L207 HydrophobicContact CD1-CD2 4.47Å; Y174-L207 HydrophobicContact CE1-CD2 4.05Å; Y174-A218 HydrophobicContact CE1-CB 3.69Å; Y174-D221 HydrophobicContact CD2-CB 3.95Å; Y174-D221 HydrophobicContact CE1-CB 4.39Å; Y174-D221 HydrophobicContact CE2-CB 3.3Å; Y174-D221 PolarHBondContact OH-OD2 3.04Å; Y174-V222 HydrophobicContact CD1-CG1 3.5Å; Y174-V222 VanDerWaalsContact CD1-CG1 3.5Å; Y174-V222 HydrophobicContact CD2-CG1 4.43Å; Y174-V222 HydrophobicContact CE1-CG1 4.25Å; Y174-V222 HydrophobicContact CG-CG1 3.62Å; Y174-Y312 HydrophobicContact CE2-CE1 4.38Å
175	V	77.9	Confident	78.2	Confident	21 Å²	21	43.5 Å²	43.5	13%	0.127	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-36.2	176.7	171.3	0	0	0	0	111.4	Q171 Q172 Y173 A181 I204 P205 L207	Q171-V175 VanDerWaalsContact O-CG2 3.28Å; Q171-V175 WeakPolarHBondContact O-CG2 3.32Å; Q171-V175 PolarHBondContact O-N 3.29Å; Q172-V175 PolarHBondContact O-N 2.78Å; Y173-V175 PolarHBondContact O-N 2.92Å; V175-A181 WeakPolarHBondContact O-CB 3.26Å; V175-I204 HydrophobicContact CB-CG2 4.49Å; V175-I204 HydrophobicContact CG2-CG2 4.07Å; V175-P205 HydrophobicContact CG1-CB 4.19Å; V175-P205 HydrophobicContact CG1-CG 3.79Å; V175-P205 VanDerWaalsContact CG1-O 3.3Å; V175-P205 WeakPolarHBondContact CG1-O 3.35Å; V175-L207 HydrophobicContact CG2-CB 4.28Å
176	E	77.7	Confident	76.7	Confident	64 Å²	64	46.6 Å²	46.6	30%	0.299	24%	0.238	S	C	.	.	H	α-helix	trans	-88	-41.8	-177.8	-68.2	172.4	-170	0	0	112.7	Q172 Y173 Y174 Q182	Q172-E176 PolarHBondContact O-N 3.39Å; Y173-E176 PolarHBondContact O-N 2.84Å; Y174-E176 VanDerWaalsContact C-N 3.25Å; Y174-E176 PolarHBondContact O-N 3.47Å; E176-Q182 PolarHBondContact O-NE2 3.46Å
177	H	81.9	Confident	76	Confident	49 Å²	49	49.7 Å²	49.7	23%	0.227	26%	0.256	C	S	.	.	H	α-helix	trans	-125.1	-6.6	-165.4	-59.1	93.6	0	0	0	113.8	Y173	Y173-H177 HydrophobicContact CD2-CB 3.94Å; Y173-H177 AromaticContact CD2-ND1 3.9Å; Y173-H177 HydrophobicContact CE1-CB 4.24Å; Y173-H177 HydrophobicContact CE2-CB 3.44Å; Y173-H177 VanDerWaalsContact CE2-CB 3.44Å; Y173-H177 AromaticContact CE2-CG 3.81Å; Y173-H177 WeakPolarHBondContact O-CA 3.23Å; Y173-H177 WeakPolarHBondContact O-CB 3.5Å; Y173-H177 PolarHBondContact O-N 2.9Å
178	G	80	Confident	75.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	-64.4	163.6	-178.6	0	0	0	0	0	113.2	Y174 V180 A181 Q182	Y174-G178 WeakPolarHBondContact O-CA 3.37Å; Y174-G178 PolarHBondContact O-N 2.89Å; G178-V180 VanDerWaalsContact C-N 3.3Å; G178-V180 PolarHBondContact O-N 2.89Å; G178-A181 PolarHBondContact O-N 2.85Å; G178-A181 VanDerWaalsContact O-N 3.16Å; G178-Q182 PolarHBondContact O-N 2.86Å
179	R	81.9	Confident	74.9	Confident	40 Å²	40	50.2 Å²	50.2	15%	0.151	26%	0.259	C	S	.	.	H	α-helix	trans	-56.8	-41.3	-174.1	68.3	169.5	176.4	115.2	-1.8	113.4	Y174 S183 R184 D217 D221 Y312	Y174-R179 HydrophobicContact CE2-CG 4.36Å; R179-S183 WeakPolarHBondContact O-CA 3.35Å; R179-S183 PolarHBondContact O-N 2.73Å; R179-R184 PolarHBondContact O-N 3.14Å; R179-D217 IonicContact CZ-OD2 3.56Å; R179-D217 IonicContact NH1-OD2 3.66Å; R179-D217 PolarHBondContact NH1-OD2 2.79Å; R179-D217 VanDerWaalsContact NH2-CG 3.29Å; R179-D217 PolarHBondContact NH2-O 3.05Å; R179-D217 IonicContact NH2-OD2 2.88Å; R179-D217 PolarHBondContact NH2-OD2 2.91Å; R179-D221 IonicContact CZ-OD2 3.19Å; R179-D221 IonicContact NE-OD1 2.65Å; R179-D221 IonicContact NE-OD2 3.17Å; R179-D221 PolarHBondContact NE-OD2 2.87Å; R179-D221 IonicContact NH2-OD2 3.21Å; R179-D221 PolarHBondContact NH2-OD2 2.81Å; R179-Y312 HydrophobicContact CG-CD1 4.5Å; R179-Y312 HydrophobicContact CG-CE1 4.41Å
180	V	73.9	Confident	74.3	Confident	23 Å²	23	53 Å²	53	14%	0.139	28%	0.278	C	S	.	.	H	α-helix	trans	-69.8	-45.3	179.5	171.9	0	0	0	0	110.2	Y174 G178 Q182 S183 L207 D214 A218	Y174-V180 VanDerWaalsContact OH-CG2 3.26Å; Y174-V180 WeakPolarHBondContact OH-CG2 3.48Å; G178-V180 VanDerWaalsContact C-N 3.3Å; G178-V180 PolarHBondContact O-N 2.89Å; V180-Q182 VanDerWaalsContact C-N 3.35Å; V180-Q182 PolarHBondContact O-N 3.5Å; V180-S183 PolarHBondContact O-N 2.72Å; V180-L207 HydrophobicContact CG1-CD1 4.46Å; V180-L207 HydrophobicContact CG1-CD2 4.37Å; V180-D214 HydrophobicContact CG1-CB 4.21Å; V180-A218 HydrophobicContact CG2-CB 4.23Å
181	A	71.8	Confident	73.5	Confident	38 Å²	38	60.3 Å²	60.3	31%	0.314	31%	0.306	S	S	.	.	H	α-helix	trans	-59.5	-44.7	179	0	0	0	0	0	112.2	V175 G178 L207	V175-A181 WeakPolarHBondContact O-CB 3.26Å; G178-A181 PolarHBondContact O-N 2.85Å; G178-A181 VanDerWaalsContact O-N 3.16Å; A181-L207 HydrophobicContact CB-CD1 3.94Å
182	Q	75.2	Confident	72.8	Confident	83 Å²	83	56.8 Å²	56.8	39%	0.388	29%	0.291	S	S	.	.	H	α-helix	trans	-91	-4.7	-175.3	-67.3	-76.2	-42.5	0	0	113.8	E176 G178 V180 R184	E176-Q182 PolarHBondContact O-NE2 3.46Å; G178-Q182 PolarHBondContact O-N 2.86Å; V180-Q182 VanDerWaalsContact C-N 3.35Å; V180-Q182 PolarHBondContact O-N 3.5Å; Q182-R184 HydrophobicContact CB-CB 4.34Å; Q182-R184 HydrophobicContact CB-CG 3.63Å; Q182-R184 PolarHBondContact O-N 2.91Å
183	S	70.5	Confident	72	Confident	82 Å²	82	65.4 Å²	65.4	57%	0.573	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	31.2	-172.9	-61.6	0	0	0	0	113	R179 V180	R179-S183 WeakPolarHBondContact O-CA 3.35Å; R179-S183 PolarHBondContact O-N 2.73Å; V180-S183 PolarHBondContact O-N 2.72Å
184	R	62.2	Low	71.1	Confident	108 Å²	108	66.6 Å²	66.6	41%	0.408	34%	0.336	S	S	.	.			trans	-74.6	132.3	-170.8	-83.8	170.1	-171	-167.8	7.4	110.2	R179 Q182 D189	R179-R184 PolarHBondContact O-N 3.14Å; Q182-R184 HydrophobicContact CB-CB 4.34Å; Q182-R184 HydrophobicContact CB-CG 3.63Å; Q182-R184 PolarHBondContact O-N 2.91Å; R184-D189 IonicContact NH1-OD2 2.8Å; R184-D189 PolarHBondContact NH1-OD2 2.74Å
185	K	56	Low	70.1	Confident	205 Å²	205	73.4 Å²	73.4	89%	0.891	37%	0.371	S	S	*	.			trans	-71.3	-22.5	163.7	-72.3	-176	177.7	-178.8	0	112.4	V187	K185-V187 PolarHBondContact O-N 3.33Å
186	V	55.4	Low	69.4	Low	101 Å²	101	74.2 Å²	74.2	61%	0.612	37%	0.373	S	S	*	.			trans	-77.8	126.2	-173.5	-172.9	0	0	0	0	109.2	V188	V186-V188 WeakPolarHBondContact CG1-O 3.16Å
187	V	72.1	Confident	68.6	Low	65 Å²	65	75.7 Å²	75.7	39%	0.394	38%	0.38	S	S	.	.	S	Bend	trans	-81.9	-21.7	-172.2	177.5	0	0	0	0	112	K185 Y312 T313	K185-V187 PolarHBondContact O-N 3.33Å; V187-Y312 WeakPolarHBondContact O-CA 3.28Å; V187-Y312 VanDerWaalsContact O-CB 3.25Å; V187-Y312 WeakPolarHBondContact O-CB 3.49Å; V187-Y312 PolarHBondContact O-N 3.28Å; V187-T313 HydrophobicContact CG1-CG2 4.38Å; V187-T313 WeakPolarHBondContact CG1-OG1 3.08Å
188	V	72.2	Confident	67.4	Low	51 Å²	51	78.1 Å²	78.1	31%	0.309	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.8	-173.9	-179.7	0	0	0	0	110.2	V186 W309 V310	V186-V188 WeakPolarHBondContact CG1-O 3.16Å; V188-W309 HydrophobicContact CG1-CD2 4.45Å; V188-W309 HydrophobicContact CG1-CH2 3.97Å; V188-W309 HydrophobicContact CG1-CZ2 3.31Å; V188-V310 CarbonylContact C-O 3.51Å; V188-V310 WeakPolarHBondContact CA-O 3.2Å
189	D	70.3	Confident	66	Low	29 Å²	29	83.5 Å²	83.5	16%	0.155	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	105.9	169.5	-162.1	-26.7	0	0	0	109.5	R184 V310	R184-D189 IonicContact NH1-OD2 2.8Å; R184-D189 PolarHBondContact NH1-OD2 2.74Å; D189-V310 HydrophobicContact CB-CB 4.19Å; D189-V310 PolarHBondContact N-O 2.88Å; D189-V310 PolarHBondContact O-N 3.14Å
190	S	68.6	Low	64.5	Low	60 Å²	60	85 Å²	85	42%	0.42	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	118.7	177.4	63.6	0	0	0	0	110.1
191	R	68.9	Low	63.4	Low	157 Å²	157	85.6 Å²	85.6	59%	0.592	45%	0.446	S	S	*	.	S	Bend	trans	61.9	65.2	-177.9	-55.7	175.4	-66	176.7	0.2	113.2	Q193 L308	R191-Q193 PolarHBondContact O-N 2.84Å; R191-L308 VanDerWaalsContact CA-O 3.27Å; R191-L308 WeakPolarHBondContact CA-O 3.22Å; R191-L308 PolarHBondContact N-O 3.48Å
192	P	66.8	Low	62.6	Low	13 Å²	13	90.9 Å²	90.9	8%	0.084	47%	0.469	C	S	.	.			trans	-61.7	133.6	176.9	24.3	-31.9	0	0	0	110.9	Y173 F194 L307 V310	Y173-P192 HydrophobicContact CE2-CB 3.56Å; Y173-P192 HydrophobicContact CE2-CG 4.19Å; Y173-P192 WeakPolarHBondContact OH-CB 3.25Å; P192-F194 VanDerWaalsContact C-N 3.28Å; P192-F194 PolarHBondContact O-N 3Å; P192-L307 HydrophobicContact CB-CD2 4.16Å; P192-L307 WeakPolarHBondContact CD-O 3.35Å; P192-L307 HydrophobicContact CG-CB 3.82Å; P192-L307 HydrophobicContact CG-CD2 3.34Å; P192-L307 HydrophobicContact CG-CG 3.32Å; P192-V310 HydrophobicContact CG-CG2 4.3Å
193	Q	63.5	Low	61.9	Low	183 Å²	183	93.5 Å²	93.5	86%	0.855	49%	0.486	S	S	*	.			trans	-78.2	81	173.7	-67.8	-178.2	-8.3	0	0	108.9	R191	R191-Q193 PolarHBondContact O-N 2.84Å
194	F	64.2	Low	61.5	Low	26 Å²	26	91.5 Å²	91.5	11%	0.114	47%	0.468	C	S	.	.			trans	-121.7	109.4	176.3	-174.1	-108	0	0	0	110.4	I169 Q172 Y173 P192 F196	I169-F194 HydrophobicContact CG2-CE1 3.97Å; Q172-F194 HydrophobicContact CB-CZ 4.16Å; Q172-F194 HydrophobicContact CG-CE2 4.25Å; Q172-F194 HydrophobicContact CG-CZ 3.98Å; Y173-F194 HydrophobicContact CD2-CB 3.67Å; Y173-F194 HydrophobicContact CD2-CD1 4.26Å; Y173-F194 AromaticContact CD2-CD2 3.72Å; Y173-F194 HydrophobicContact CD2-CD2 3.72Å; Y173-F194 HydrophobicContact CD2-CE2 4.43Å; Y173-F194 AromaticContact CD2-CG 3.61Å; Y173-F194 HydrophobicContact CD2-CG 3.61Å; Y173-F194 HydrophobicContact CE2-CB 4.11Å; Y173-F194 HydrophobicContact CG-CD2 4.45Å; Y173-F194 HydrophobicContact CG-CG 4.39Å; P192-F194 VanDerWaalsContact C-N 3.28Å; P192-F194 PolarHBondContact O-N 3Å; F194-F196 HydrophobicContact CE1-CB 4.11Å; F194-F196 HydrophobicContact CE1-CD2 4.33Å; F194-F196 HydrophobicContact CZ-CD2 4.47Å
195	I	61.9	Low	61.5	Low	144 Å²	144	89.6 Å²	89.6	74%	0.738	47%	0.47	S	S	*	.			trans	-102.2	110	174.1	-60.4	173.1	0	0	0	106.8	Q197	I195-Q197 PolarHBondContact O-N 3.13Å
196	F	63.1	Low	62.1	Low	37 Å²	37	84.5 Å²	84.5	16%	0.162	46%	0.461	C	S	.	.			trans	-72.6	124.9	176.1	179	-95.4	0	0	0	110.9	I169 F194 P198 C201 V302	I169-F196 HydrophobicContact CG1-CD2 4Å; I169-F196 HydrophobicContact CG1-CE2 3.72Å; I169-F196 HydrophobicContact CG1-CZ 4.16Å; I169-F196 HydrophobicContact CG2-CD2 4.12Å; F194-F196 HydrophobicContact CE1-CB 4.11Å; F194-F196 HydrophobicContact CE1-CD2 4.33Å; F194-F196 HydrophobicContact CZ-CD2 4.47Å; F196-P198 HydrophobicContact CD1-CG 4.19Å; F196-P198 VanDerWaalsContact CE1-CA 3.47Å; F196-P198 HydrophobicContact CE1-CB 4.06Å; F196-P198 HydrophobicContact CE1-CG 3.95Å; F196-C201 WeakPolarHBondContact CZ-SG 3.17Å; F196-V302 HydrophobicContact CB-CG1 3.87Å; F196-V302 HydrophobicContact CD1-CB 3.68Å; F196-V302 HydrophobicContact CD1-CG1 3.09Å; F196-V302 HydrophobicContact CD1-CG2 4.26Å; F196-V302 HydrophobicContact CD2-CG1 4.18Å; F196-V302 HydrophobicContact CE1-CB 3.71Å; F196-V302 HydrophobicContact CE1-CG1 3.48Å; F196-V302 VanDerWaalsContact CE1-CG1 3.48Å; F196-V302 HydrophobicContact CE1-CG2 3.78Å; F196-V302 HydrophobicContact CG-CB 4.48Å; F196-V302 HydrophobicContact CG-CG1 3.44Å; F196-V302 VanDerWaalsContact CG-CG1 3.44Å; F196-V302 HydrophobicContact CZ-CG1 4.16Å; F196-V302 HydrophobicContact CZ-CG2 4.3Å
197	Q	60.8	Low	62.8	Low	95 Å²	95	82.2 Å²	82.2	44%	0.444	44%	0.444	S	S	.	.			trans	-104.9	113.8	170.1	-61.1	-167.6	21.1	0	0	109.9	I195 T199 E200	I195-Q197 PolarHBondContact O-N 3.13Å; Q197-T199 PolarHBondContact O-N 2.98Å; Q197-E200 HydrophobicContact CB-CG 3.98Å; Q197-E200 PolarHBondContact O-N 2.85Å
198	P	55.2	Low	62.6	Low	100 Å²	100	86.5 Å²	86.5	65%	0.649	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-55.3	-26.2	-176.4	-25.3	32.1	0	0	0	115.2	F196 E200	F196-P198 HydrophobicContact CD1-CG 4.19Å; F196-P198 VanDerWaalsContact CE1-CA 3.47Å; F196-P198 HydrophobicContact CE1-CB 4.06Å; F196-P198 HydrophobicContact CE1-CG 3.95Å; P198-E200 VanDerWaalsContact C-N 3.25Å; P198-E200 PolarHBondContact O-N 3.14Å
199	T	51.1	Low	62.5	Low	114 Å²	114	85.7 Å²	85.7	70%	0.699	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-69.5	-18.7	178.7	38.9	0	0	0	0	113.7	Q197	Q197-T199 PolarHBondContact O-N 2.98Å
200	E	50.1	Low	62.4	Low	70 Å²	70	92.7 Å²	92.7	33%	0.327	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-91.7	-8.8	-171.1	-65.6	-179.9	163.1	0	0	114.4	Q172 Q197 P198 N202 N203	Q172-E200 PolarHBondContact NE2-OE2 2.84Å; Q197-E200 HydrophobicContact CB-CG 3.98Å; Q197-E200 PolarHBondContact O-N 2.85Å; P198-E200 VanDerWaalsContact C-N 3.25Å; P198-E200 PolarHBondContact O-N 3.14Å; E200-N202 PolarHBondContact O-N 2.88Å; E200-N203 CarbonylContact O-C 3.54Å; E200-N203 PolarHBondContact O-N 2.97Å
201	C	51.8	Low	62.4	Low	36 Å²	36	93.4 Å²	93.4	24%	0.243	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-56	-25.5	178.9	-78.1	0	0	0	0	114.2	L168 F196	L168-C201 HydrophobicContact CD2-CB 4.03Å; F196-C201 WeakPolarHBondContact CZ-SG 3.17Å
202	N	55	Low	62.4	Low	149 Å²	149	90.1 Å²	90.1	80%	0.797	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-81.8	-16.3	179.4	-68.4	-16.4	0	0	0	113.1	E200	E200-N202 PolarHBondContact O-N 2.88Å
203	N	59.7	Low	62.5	Low	138 Å²	138	93.6 Å²	93.6	74%	0.738	50%	0.497	S	S	*	.			trans	-129	42	-172.2	-70.3	-13.7	0	0	0	111.9	E200 P205	E200-N203 CarbonylContact O-C 3.54Å; E200-N203 PolarHBondContact O-N 2.97Å; N203-P205 WeakPolarHBondContact O-CD 3.31Å
204	I	62.2	Low	62.7	Low	40 Å²	40	87 Å²	87	21%	0.205	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-59.9	123.1	173.3	-58.4	175.5	0	0	0	107.9	L168 Q172 V175	L168-I204 HydrophobicContact CD1-CD1 3.46Å; L168-I204 VanDerWaalsContact CD1-CD1 3.46Å; L168-I204 HydrophobicContact CG-CD1 4.19Å; Q172-I204 HydrophobicContact CB-CD1 4.39Å; Q172-I204 HydrophobicContact CB-CG1 4.44Å; V175-I204 HydrophobicContact CB-CG2 4.49Å; V175-I204 HydrophobicContact CG2-CG2 4.07Å
205	P	62.5	Low	62.9	Low	68 Å²	68	89.1 Å²	89.1	44%	0.442	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-60	153.4	179.5	16.2	-23	0	0	0	111.4	V175 N203 L207	V175-P205 HydrophobicContact CG1-CB 4.19Å; V175-P205 HydrophobicContact CG1-CG 3.79Å; V175-P205 VanDerWaalsContact CG1-O 3.3Å; V175-P205 WeakPolarHBondContact CG1-O 3.35Å; N203-P205 WeakPolarHBondContact O-CD 3.31Å; P205-L207 PolarHBondContact O-N 2.81Å
206	S	69	Low	63.2	Low	99 Å²	99	83.1 Å²	83.1	69%	0.692	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-74.8	127.5	175.8	-63.6	0	0	0	0	110.2	I208	S206-I208 PolarHBondContact O-N 2.79Å
207	L	69.8	Low	63.8	Low	52 Å²	52	81.5 Å²	81.5	27%	0.272	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-69.8	119.9	169.1	-177.3	67.5	0	0	0	109.7	Y174 V175 V180 A181 P205 A218	Y174-L207 HydrophobicContact CD1-CD2 4.47Å; Y174-L207 HydrophobicContact CE1-CD2 4.05Å; V175-L207 HydrophobicContact CG2-CB 4.28Å; V180-L207 HydrophobicContact CG1-CD1 4.46Å; V180-L207 HydrophobicContact CG1-CD2 4.37Å; A181-L207 HydrophobicContact CB-CD1 3.94Å; P205-L207 PolarHBondContact O-N 2.81Å; L207-A218 HydrophobicContact CD2-CB 3.47Å; L207-A218 VanDerWaalsContact CD2-CB 3.47Å
208	I	68.6	Low	64.4	Low	156 Å²	156	77.2 Å²	77.2	80%	0.8	42%	0.418	S	S	*	.			trans	-94.2	111.2	175.5	-57.1	176.1	0	0	0	108.5	S206	S206-I208 PolarHBondContact O-N 2.79Å
209	C	69.3	Low	65.3	Low	34 Å²	34	74.6 Å²	74.6	23%	0.23	40%	0.398	C	S	.	.			trans	-95	141.5	176.3	-60.8	0	0	0	0	110.3	D214 Y215	C209-D214 HydrophobicContact CB-CB 4.09Å; C209-Y215 VanDerWaalsContact SG-CA 3.58Å
210	K	68.8	Low	66.6	Low	176 Å²	176	70 Å²	70	77%	0.765	37%	0.369	S	S	*	.	S	Bend	trans	-75.4	-31.5	179.6	-65.4	176.6	-177.4	167.9	0	112.1
211	N	68.8	Low	68.1	Low	75 Å²	75	66.7 Å²	66.7	40%	0.401	35%	0.353	S	S	.	.	S	Bend	trans	-143.8	171	178.9	67.9	62.2	0	0	0	110.9	M213 D214 Y215	N211-M213 VanDerWaalsContact C-N 3.31Å; N211-M213 PolarHBondContact O-N 2.86Å; N211-M213 VanDerWaalsContact OD1-CA 3.31Å; N211-M213 WeakPolarHBondContact OD1-CA 3.39Å; N211-M213 VanDerWaalsContact OD1-CB 3.27Å; N211-M213 WeakPolarHBondContact OD1-CB 3.46Å; N211-M213 PolarHBondContact OD1-N 2.81Å; N211-D214 PolarHBondContact ND2-OD1 2.79Å; N211-D214 PolarHBondContact ND2-OD2 2.79Å; N211-D214 VanDerWaalsContact ND2-OD2 3.1Å; N211-D214 PolarHBondContact OD1-N 2.78Å; N211-D214 PolarHBondContact OD1-OD1 2.87Å; N211-Y215 PolarHBondContact O-N 2.85Å
212	I	69.1	Low	69.4	Low	88 Å²	88	66.6 Å²	66.6	45%	0.451	35%	0.352	S	S	.	.	H	α-helix	trans	-68.7	-28.2	-178.4	-162.1	175	0	0	0	113	Y215 F216	I212-Y215 WeakPolarHBondContact O-CB 3.5Å; I212-Y215 PolarHBondContact O-N 2.83Å; I212-F216 HydrophobicContact CD1-CE2 3.77Å; I212-F216 HydrophobicContact CD1-CZ 4.03Å; I212-F216 HydrophobicContact CG1-CD2 4.03Å; I212-F216 HydrophobicContact CG1-CE2 3.55Å; I212-F216 HydrophobicContact CG1-CZ 4.07Å; I212-F216 WeakPolarHBondContact O-CD2 3.42Å; I212-F216 WeakPolarHBondContact O-CG 3.38Å; I212-F216 PolarHBondContact O-N 3.25Å
213	M	67.6	Low	70.6	Confident	85 Å²	85	60.8 Å²	60.8	42%	0.419	32%	0.322	S	S	.	.	H	α-helix	trans	-68.3	-46.1	177.7	-60.7	-64	-96.5	0	0	110.3	N211 Y215 F216 D217 R318	N211-M213 VanDerWaalsContact C-N 3.31Å; N211-M213 PolarHBondContact O-N 2.86Å; N211-M213 VanDerWaalsContact OD1-CA 3.31Å; N211-M213 WeakPolarHBondContact OD1-CA 3.39Å; N211-M213 VanDerWaalsContact OD1-CB 3.27Å; N211-M213 WeakPolarHBondContact OD1-CB 3.46Å; N211-M213 PolarHBondContact OD1-N 2.81Å; M213-Y215 PolarHBondContact O-N 2.84Å; M213-F216 PolarHBondContact O-N 2.84Å; M213-F216 VanDerWaalsContact O-N 3.11Å; M213-D217 VanDerWaalsContact O-CB 3.26Å; M213-D217 WeakPolarHBondContact O-CB 3.07Å; M213-D217 PolarHBondContact O-N 2.67Å; M213-R318 HydrophobicContact CE-CB 3.55Å
214	D	68.1	Low	71.7	Confident	45 Å²	45	54.2 Å²	54.2	24%	0.241	29%	0.286	C	S	.	.	H	α-helix	trans	-55.8	-38.3	173.2	-61.8	-9.1	0	0	0	111.5	V180 C209 N211 A218	V180-D214 HydrophobicContact CG1-CB 4.21Å; C209-D214 HydrophobicContact CB-CB 4.09Å; N211-D214 PolarHBondContact ND2-OD1 2.79Å; N211-D214 PolarHBondContact ND2-OD2 2.79Å; N211-D214 VanDerWaalsContact ND2-OD2 3.1Å; N211-D214 PolarHBondContact OD1-N 2.78Å; N211-D214 PolarHBondContact OD1-OD1 2.87Å; D214-A218 VanDerWaalsContact O-CB 3.26Å; D214-A218 WeakPolarHBondContact O-CB 3.28Å; D214-A218 PolarHBondContact O-N 2.83Å
215	Y	69.2	Low	72.6	Confident	70 Å²	70	53 Å²	53	28%	0.275	28%	0.281	S	S	.	.	H	α-helix	trans	-65.2	-46	176.5	169.6	-100.8	0	0	0	112.1	I20 T22 C209 N211 I212 M213 A218 I219	I20-Y215 PolarHBondContact O-OH 2.81Å; I20-Y215 VanDerWaalsContact O-OH 3.1Å; T22-Y215 HydrophobicContact CG2-CE1 4.41Å; C209-Y215 VanDerWaalsContact SG-CA 3.58Å; N211-Y215 PolarHBondContact O-N 2.85Å; I212-Y215 WeakPolarHBondContact O-CB 3.5Å; I212-Y215 PolarHBondContact O-N 2.83Å; M213-Y215 PolarHBondContact O-N 2.84Å; Y215-A218 WeakPolarHBondContact O-CB 3.31Å; Y215-A218 PolarHBondContact O-N 2.93Å; Y215-I219 HydrophobicContact CD1-CD1 3.8Å; Y215-I219 HydrophobicContact CE1-CD1 3.2Å; Y215-I219 HydrophobicContact CE1-CG1 4.28Å; Y215-I219 HydrophobicContact CE2-CD1 4.06Å; Y215-I219 HydrophobicContact CE2-CG1 4.38Å; Y215-I219 HydrophobicContact CG-CD1 4.45Å; Y215-I219 WeakPolarHBondContact O-CG1 3.19Å; Y215-I219 PolarHBondContact O-N 3.39Å
216	F	68.4	Low	73.8	Confident	18 Å²	18	51.5 Å²	51.5	8%	0.079	27%	0.267	C	S	.	.	H	α-helix	trans	-66.5	-41.3	178.3	-73.1	-52.8	0	0	0	112.8	T22 V27 I212 M213 A218 I219 E220	T22-F216 HydrophobicContact CG2-CE1 3.95Å; V27-F216 HydrophobicContact CG2-CD1 4.33Å; V27-F216 HydrophobicContact CG2-CE1 3.73Å; V27-F216 HydrophobicContact CG2-CZ 3.85Å; I212-F216 HydrophobicContact CD1-CE2 3.77Å; I212-F216 HydrophobicContact CD1-CZ 4.03Å; I212-F216 HydrophobicContact CG1-CD2 4.03Å; I212-F216 HydrophobicContact CG1-CE2 3.55Å; I212-F216 HydrophobicContact CG1-CZ 4.07Å; I212-F216 WeakPolarHBondContact O-CD2 3.42Å; I212-F216 WeakPolarHBondContact O-CG 3.38Å; I212-F216 PolarHBondContact O-N 3.25Å; M213-F216 PolarHBondContact O-N 2.84Å; M213-F216 VanDerWaalsContact O-N 3.11Å; F216-A218 VanDerWaalsContact C-N 3.32Å; F216-A218 PolarHBondContact O-N 2.88Å; F216-I219 HydrophobicContact CD1-CD1 4.34Å; F216-I219 WeakPolarHBondContact O-CB 3.45Å; F216-I219 PolarHBondContact O-N 3Å; F216-E220 PolarHBondContact O-N 2.83Å
217	D	74.1	Confident	74.9	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-55.9	-47.3	172.1	-95.3	32.9	0	0	0	111.2	R179 M213 I219 E220 D221 V317 R318	R179-D217 IonicContact CZ-OD2 3.56Å; R179-D217 IonicContact NH1-OD2 3.66Å; R179-D217 PolarHBondContact NH1-OD2 2.79Å; R179-D217 VanDerWaalsContact NH2-CG 3.29Å; R179-D217 PolarHBondContact NH2-O 3.05Å; R179-D217 IonicContact NH2-OD2 2.88Å; R179-D217 PolarHBondContact NH2-OD2 2.91Å; M213-D217 VanDerWaalsContact O-CB 3.26Å; M213-D217 WeakPolarHBondContact O-CB 3.07Å; M213-D217 PolarHBondContact O-N 2.67Å; D217-I219 PolarHBondContact O-N 2.8Å; D217-E220 PolarHBondContact O-N 2.93Å; D217-D221 PolarHBondContact O-N 3.38Å; D217-D221 VanDerWaalsContact O-OD2 3.05Å; D217-V317 VanDerWaalsContact OD2-CG1 3.31Å; D217-V317 WeakPolarHBondContact OD2-CG1 3.08Å; D217-R318 PolarHBondContact OD1-N 3.38Å
218	A	74.4	Confident	76	Confident	5 Å²	5	44.3 Å²	44.3	4%	0.041	22%	0.221	C	C	.	.	H	α-helix	trans	-61	-41	174.7	0	0	0	0	0	113.1	Y174 V180 L207 D214 Y215 F216 E220 D221 V222	Y174-A218 HydrophobicContact CE1-CB 3.69Å; V180-A218 HydrophobicContact CG2-CB 4.23Å; L207-A218 HydrophobicContact CD2-CB 3.47Å; L207-A218 VanDerWaalsContact CD2-CB 3.47Å; D214-A218 VanDerWaalsContact O-CB 3.26Å; D214-A218 WeakPolarHBondContact O-CB 3.28Å; D214-A218 PolarHBondContact O-N 2.83Å; Y215-A218 WeakPolarHBondContact O-CB 3.31Å; Y215-A218 PolarHBondContact O-N 2.93Å; F216-A218 VanDerWaalsContact C-N 3.32Å; F216-A218 PolarHBondContact O-N 2.88Å; A218-E220 VanDerWaalsContact C-N 3.32Å; A218-E220 PolarHBondContact O-N 3.45Å; A218-D221 PolarHBondContact O-N 3.06Å; A218-V222 WeakPolarHBondContact O-CG2 3.41Å; A218-V222 PolarHBondContact O-N 3.07Å; A218-V222 VanDerWaalsContact O-N 3.12Å
219	I	74.3	Confident	77.2	Confident	44 Å²	44	37.1 Å²	37.1	23%	0.226	18%	0.184	C	C	.	.	H	α-helix	trans	-59.1	-46.5	174.4	-70.5	164.9	0	0	0	110.3	T22 Y215 F216 D217 D221 V222 V223	T22-I219 HydrophobicContact CG2-CD1 4.35Å; Y215-I219 HydrophobicContact CD1-CD1 3.8Å; Y215-I219 HydrophobicContact CE1-CD1 3.2Å; Y215-I219 HydrophobicContact CE1-CG1 4.28Å; Y215-I219 HydrophobicContact CE2-CD1 4.06Å; Y215-I219 HydrophobicContact CE2-CG1 4.38Å; Y215-I219 HydrophobicContact CG-CD1 4.45Å; Y215-I219 WeakPolarHBondContact O-CG1 3.19Å; Y215-I219 PolarHBondContact O-N 3.39Å; F216-I219 HydrophobicContact CD1-CD1 4.34Å; F216-I219 WeakPolarHBondContact O-CB 3.45Å; F216-I219 PolarHBondContact O-N 3Å; D217-I219 PolarHBondContact O-N 2.8Å; I219-D221 VanDerWaalsContact C-N 3.25Å; I219-D221 PolarHBondContact O-N 2.83Å; I219-V222 VanDerWaalsContact O-CG2 3.29Å; I219-V222 WeakPolarHBondContact O-CG2 3.41Å; I219-V222 PolarHBondContact O-N 3.29Å; I219-V223 HydrophobicContact CG2-CG2 4.12Å; I219-V223 WeakPolarHBondContact O-CG2 3.22Å; I219-V223 PolarHBondContact O-N 3.32Å
220	E	78.1	Confident	78.3	Confident	18 Å²	18	35.6 Å²	35.6	8%	0.084	17%	0.173	C	C	.	.	H	α-helix	trans	-66.1	-30.1	-178.6	-67.3	-169.2	-160.8	0	0	112.4	F216 D217 A218 K286 S287 R318 R325	F216-E220 PolarHBondContact O-N 2.83Å; D217-E220 PolarHBondContact O-N 2.93Å; A218-E220 VanDerWaalsContact C-N 3.32Å; A218-E220 PolarHBondContact O-N 3.45Å; E220-K286 HydrophobicContact CB-CB 4.39Å; E220-K286 HydrophobicContact CG-CD 4.2Å; E220-K286 HydrophobicContact CG-CG 4.4Å; E220-K286 WeakPolarHBondContact O-CB 3.5Å; E220-K286 PolarHBondContact O-N 2.84Å; E220-S287 PolarHBondContact O-N 2.8Å; E220-R318 IonicContact OE1-CZ 2.61Å; E220-R318 IonicContact OE1-NE 3.98Å; E220-R318 IonicContact OE1-NH2 2.83Å; E220-R318 PolarHBondContact OE1-NH2 3.14Å; E220-R325 IonicContact OE2-CZ 2.83Å; E220-R325 IonicContact OE2-NH1 3.72Å; E220-R325 PolarHBondContact OE2-NH1 2.98Å
221	D	81.3	Confident	79.2	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-74	-28.9	175.3	-73.2	-50.8	0	0	0	114.4	W170 Y174 R179 D217 A218 I219 M285 S287	W170-D221 PolarHBondContact NE1-O 3.27Å; Y174-D221 HydrophobicContact CD2-CB 3.95Å; Y174-D221 HydrophobicContact CE1-CB 4.39Å; Y174-D221 HydrophobicContact CE2-CB 3.3Å; Y174-D221 PolarHBondContact OH-OD2 3.04Å; R179-D221 IonicContact CZ-OD2 3.19Å; R179-D221 IonicContact NE-OD1 2.65Å; R179-D221 IonicContact NE-OD2 3.17Å; R179-D221 PolarHBondContact NE-OD2 2.87Å; R179-D221 IonicContact NH2-OD2 3.21Å; R179-D221 PolarHBondContact NH2-OD2 2.81Å; D217-D221 PolarHBondContact O-N 3.38Å; D217-D221 VanDerWaalsContact O-OD2 3.05Å; A218-D221 PolarHBondContact O-N 3.06Å; I219-D221 VanDerWaalsContact C-N 3.25Å; I219-D221 PolarHBondContact O-N 2.83Å; D221-M285 WeakPolarHBondContact O-CB 3.46Å; D221-M285 VanDerWaalsContact O-CG 3.24Å; D221-M285 WeakPolarHBondContact O-CG 3.33Å; D221-S287 WeakPolarHBondContact OD1-CB 3.42Å; D221-S287 PolarHBondContact OD1-OG 2.87Å
222	V	79.4	Confident	80.1	Confident	35 Å²	35	29.7 Å²	29.7	21%	0.212	15%	0.147	C	C	.	.	H	α-helix	trans	-86.9	-17.9	178.9	-61.9	0	0	0	0	113.3	Y174 A218 I219 V224	Y174-V222 HydrophobicContact CD1-CG1 3.5Å; Y174-V222 VanDerWaalsContact CD1-CG1 3.5Å; Y174-V222 HydrophobicContact CD2-CG1 4.43Å; Y174-V222 HydrophobicContact CE1-CG1 4.25Å; Y174-V222 HydrophobicContact CG-CG1 3.62Å; A218-V222 WeakPolarHBondContact O-CG2 3.41Å; A218-V222 PolarHBondContact O-N 3.07Å; A218-V222 VanDerWaalsContact O-N 3.12Å; I219-V222 VanDerWaalsContact O-CG2 3.29Å; I219-V222 WeakPolarHBondContact O-CG2 3.41Å; I219-V222 PolarHBondContact O-N 3.29Å; V222-V224 PolarHBondContact O-N 3Å
223	V	79.5	Confident	81.1	Confident	26 Å²	26	27.5 Å²	27.5	16%	0.158	14%	0.138	C	C	.	.			trans	-82.2	107.5	-176.9	171.1	0	0	0	0	110.5	N147 I219 V225 M285 K286	N147-V223 HydrophobicContact CB-CG1 3.58Å; I219-V223 HydrophobicContact CG2-CG2 4.12Å; I219-V223 WeakPolarHBondContact O-CG2 3.22Å; I219-V223 PolarHBondContact O-N 3.32Å; V223-V225 HydrophobicContact CG1-CG1 4.48Å; V223-M285 CarbonylContact O-C 3.47Å; V223-M285 VanDerWaalsContact O-CA 3.29Å; V223-M285 WeakPolarHBondContact O-CA 3.23Å; V223-K286 HydrophobicContact CB-CB 4.02Å; V223-K286 HydrophobicContact CG1-CB 3.94Å; V223-K286 HydrophobicContact CG1-CD 4.18Å; V223-K286 PolarHBondContact O-N 3.26Å
224	V	83.9	Confident	82.1	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	129.5	174.5	179.8	0	0	0	0	110.7	T149 V222 T227 V283 M285	T149-V224 HydrophobicContact CG2-CG1 4.03Å; T149-V224 VanDerWaalsContact OG1-CB 3.29Å; T149-V224 WeakPolarHBondContact OG1-CB 3.49Å; T149-V224 WeakPolarHBondContact OG1-CG1 3.44Å; V222-V224 PolarHBondContact O-N 3Å; V224-T227 HydrophobicContact CG1-CG2 4.19Å; V224-V283 HydrophobicContact CB-CG1 4.22Å; V224-V283 HydrophobicContact CG1-CG1 3.41Å; V224-V283 VanDerWaalsContact CG1-CG1 3.41Å; V224-V283 HydrophobicContact CG2-CG1 3.82Å; V224-M285 HydrophobicContact CB-SD 4.35Å; V224-M285 HydrophobicContact CG2-CE 4.17Å; V224-M285 HydrophobicContact CG2-SD 3.69Å
225	V	81.2	Confident	82.8	Confident	16 Å²	16	27 Å²	27	10%	0.097	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-26.5	178.1	-64.8	0	0	0	0	113.7	V223 L284 K286	V223-V225 HydrophobicContact CG1-CG1 4.48Å; V225-L284 HydrophobicContact CG2-CB 4.01Å; V225-L284 HydrophobicContact CG2-CD2 3.61Å; V225-L284 HydrophobicContact CG2-CG 3.57Å; V225-L284 VanDerWaalsContact CG2-O 3.3Å; V225-L284 WeakPolarHBondContact CG2-O 3.26Å; V225-L284 PolarHBondContact N-O 2.84Å; V225-K286 HydrophobicContact CG1-CB 3.73Å; V225-K286 HydrophobicContact CG1-CG 4.29Å
226	Y	86.8	Confident	83	Confident	35 Å²	35	25.1 Å²	25.1	14%	0.137	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	146.7	-177.2	-142.1	-78.6	0	0	0	112	L124 V283 L284 Y328 I329	L124-Y226 HydrophobicContact CD1-CD1 4.5Å; L124-Y226 HydrophobicContact CD1-CD2 4.33Å; L124-Y226 HydrophobicContact CD1-CE1 3.88Å; L124-Y226 HydrophobicContact CD1-CE2 3.7Å; L124-Y226 VanDerWaalsContact CD1-CZ 3.43Å; L124-Y226 HydrophobicContact CD2-CD1 3.37Å; L124-Y226 HydrophobicContact CD2-CD2 3.74Å; L124-Y226 HydrophobicContact CD2-CE1 3.57Å; L124-Y226 HydrophobicContact CD2-CE2 3.94Å; L124-Y226 HydrophobicContact CD2-CG 3.43Å; L124-Y226 VanDerWaalsContact CD2-CG 3.43Å; L124-Y226 HydrophobicContact CG-CE1 4.36Å; L124-Y226 HydrophobicContact CG-CE2 4.45Å; Y226-V283 WeakPolarHBondContact O-CA 3.23Å; Y226-L284 PolarHBondContact N-O 3.32Å; Y226-L284 PolarHBondContact O-N 2.81Å; Y226-Y328 HydrophobicContact CE1-CE2 4.42Å; Y226-Y328 AromaticContact CE2-CD2 3.82Å; Y226-Y328 HydrophobicContact CE2-CD2 3.82Å; Y226-Y328 HydrophobicContact CE2-CE2 4.02Å; Y226-Y328 AromaticContact CZ-CD2 3.94Å; Y226-Y328 AromaticContact CZ-CE2 3.67Å; Y226-Y328 VanDerWaalsContact OH-CE2 3.31Å; Y226-Y328 WeakPolarHBondContact OH-CE2 3.47Å; Y226-I329 HydrophobicContact CD1-CG1 3.88Å; Y226-I329 VanDerWaalsContact CD1-O 3.29Å; Y226-I329 WeakPolarHBondContact CD1-O 3.42Å; Y226-I329 WeakPolarHBondContact CE1-O 3.17Å; Y226-I329 HydrophobicContact CG-CG1 4.19Å
227	T	91.6	Very high	82.9	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	139.2	171.7	55.4	0	0	0	0	111.2	L124 S126 S141 T149 L166 V224 A282 V283	L124-T227 VanDerWaalsContact CD2-N 3.26Å; S126-T227 WeakPolarHBondContact CB-O 3.43Å; S126-T227 PolarHBondContact OG-O 2.56Å; S141-T227 WeakPolarHBondContact CB-OG1 3.44Å; S141-T227 PolarHBondContact OG-OG1 2.83Å; T149-T227 HydrophobicContact CG2-CG2 3.52Å; L166-T227 HydrophobicContact CD2-CG2 4.42Å; V224-T227 HydrophobicContact CG1-CG2 4.19Å; T227-A282 CarbonylContact C-O 3.59Å; T227-A282 WeakPolarHBondContact CA-O 3.27Å; T227-V283 HydrophobicContact CG2-CG1 4.34Å; T227-V283 HydrophobicContact CG2-CG2 4.38Å
228	S	93.4	Very high	82	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	131.3	176.2	-170.6	0	0	0	0	112.1	A282 K330 L331	S228-A282 PolarHBondContact N-O 2.86Å; S228-A282 PolarHBondContact O-N 3.39Å; S228-K330 WeakPolarHBondContact OG-CD 3.37Å; S228-L331 PolarHBondContact OG-N 2.9Å
229	W	93.9	Very high	80.6	Confident	6 Å²	6	43.5 Å²	43.5	2%	0.023	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	152	173.1	-63.2	90	0	0	0	111.4	W127 I139 S141 L151 T279 F280 L281 V295 L331	W127-W229 WeakPolarHBondContact O-CB 3.33Å; I139-W229 HydrophobicContact CD1-CH2 3.42Å; I139-W229 VanDerWaalsContact CD1-CH2 3.42Å; I139-W229 HydrophobicContact CD1-CZ2 3.68Å; I139-W229 HydrophobicContact CD1-CZ3 4.23Å; I139-W229 HydrophobicContact CG1-CH2 4.07Å; I139-W229 HydrophobicContact CG1-CZ2 3.95Å; S141-W229 PolarHBondContact OG-NE1 2.9Å; L151-W229 HydrophobicContact CD1-CH2 4.32Å; L151-W229 HydrophobicContact CD1-CZ2 4.37Å; L151-W229 HydrophobicContact CD2-CZ2 3.89Å; W229-T279 HydrophobicContact CE3-CG2 4.05Å; W229-T279 HydrophobicContact CZ3-CG2 3.82Å; W229-F280 WeakPolarHBondContact CA-O 3.25Å; W229-L281 HydrophobicContact CD2-CB 4.3Å; W229-L281 HydrophobicContact CD2-CD1 3.94Å; W229-L281 HydrophobicContact CE3-CB 3.95Å; W229-L281 HydrophobicContact CE3-CD1 4.44Å; W229-L281 HydrophobicContact CG-CD1 4.26Å; W229-L281 HydrophobicContact CH2-CB 4.07Å; W229-L281 HydrophobicContact CH2-CD1 4.5Å; W229-L281 HydrophobicContact CH2-CD2 3.99Å; W229-L281 HydrophobicContact CH2-CG 4.42Å; W229-L281 HydrophobicContact CZ2-CB 4.44Å; W229-L281 HydrophobicContact CZ2-CD1 4.03Å; W229-L281 HydrophobicContact CZ2-CD2 3.95Å; W229-L281 HydrophobicContact CZ2-CG 4.37Å; W229-L281 HydrophobicContact CZ3-CB 3.83Å; W229-V295 HydrophobicContact CH2-CG2 4.05Å; W229-V295 HydrophobicContact CZ3-CB 4.18Å; W229-V295 HydrophobicContact CZ3-CG1 4.44Å; W229-V295 HydrophobicContact CZ3-CG2 3.82Å; W229-L331 VanDerWaalsContact O-O 3.05Å
230	C	93	Very high	79	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.014	23%	0.231	C	C	.	.			trans	-74.6	167.9	157.9	71.5	0	0	0	0	110.4	P129 T279 F280 L331 L339	P129-C230 VanDerWaalsContact CD-O 3.31Å; P129-C230 WeakPolarHBondContact CD-O 3.45Å; C230-T279 PolarHBondContact SG-OG1 3.14Å; C230-F280 HydrophobicContact CB-CB 4.47Å; C230-F280 PolarHBondContact N-O 3.16Å; C230-F280 PolarHBondContact SG-N 2.96Å; C230-L331 HydrophobicContact CB-CD2 3.94Å; C230-L331 HydrophobicContact CB-CG 4.19Å; C230-L339 HydrophobicContact CB-CD2 3.88Å
231	Q	87.1	Confident	77.1	Confident	88 Å²	88	51.7 Å²	51.7	41%	0.411	26%	0.264	S	S	.	.	S	Bend	trans	-97.6	-21.4	-176.2	-60	175.2	-14.8	0	0	113.2	P129 D333	P129-Q231 WeakPolarHBondContact CB-O 3.28Å; Q231-D333 VanDerWaalsContact CA-OD2 3.26Å; Q231-D333 WeakPolarHBondContact CA-OD2 3.4Å; Q231-D333 WeakPolarHBondContact CB-OD2 3.48Å; Q231-D333 PolarHBondContact N-OD2 3.28Å
232	I	88.6	Confident	74.9	Confident	38 Å²	38	59.6 Å²	59.6	20%	0.195	30%	0.301	C	S	.	.			trans	-106.2	121.9	-175.6	-59.9	179.3	0	0	0	111.1	R234 D333 M392	I232-R234 HydrophobicContact CG2-CG 4.16Å; I232-R234 PolarHBondContact O-NH1 3.18Å; I232-D333 HydrophobicContact CD1-CB 3.77Å; I232-D333 HydrophobicContact CG1-CB 4.02Å; I232-D333 PolarHBondContact N-OD2 3.24Å; I232-M392 HydrophobicContact CD1-CE 3.69Å; I232-M392 HydrophobicContact CD1-SD 4.49Å
233	V	88.4	Confident	72.4	Confident	43 Å²	43	63.3 Å²	63.3	26%	0.261	33%	0.329	S	S	.	.			trans	-77.5	125.5	162.9	-179.2	0	0	0	0	108.4	P129 V132 P277 V297	P129-V233 HydrophobicContact CB-CG2 4.12Å; P129-V233 HydrophobicContact CG-CG2 3.66Å; V132-V233 HydrophobicContact CG2-CG2 4.1Å; V233-P277 HydrophobicContact CG1-CB 3.71Å; V233-V297 HydrophobicContact CG1-CB 4.45Å; V233-V297 HydrophobicContact CG1-CG2 4.05Å
234	R	88.9	Confident	70.1	Confident	7 Å²	7	69.9 Å²	69.9	3%	0.026	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-104.3	132.9	-175	-69.1	175.1	174.1	80.2	-6	110.6	I232 P277 V278 D333 D335 N336 L365	I232-R234 HydrophobicContact CG2-CG 4.16Å; I232-R234 PolarHBondContact O-NH1 3.18Å; R234-P277 CarbonylContact O-C 3.51Å; R234-P277 VanDerWaalsContact O-CA 3.22Å; R234-P277 WeakPolarHBondContact O-CA 3.08Å; R234-V278 PolarHBondContact N-O 2.96Å; R234-V278 PolarHBondContact O-N 2.82Å; R234-D333 IonicContact CZ-OD1 2.79Å; R234-D333 IonicContact NH1-OD1 2.73Å; R234-D333 PolarHBondContact NH1-OD1 3.32Å; R234-D333 IonicContact NH2-OD1 2.81Å; R234-D333 PolarHBondContact NH2-OD1 2.82Å; R234-D335 PolarHBondContact NH2-O 2.97Å; R234-N336 PolarHBondContact NE-O 2.98Å; R234-L365 HydrophobicContact CB-CD1 3.86Å
235	Q	82.9	Confident	67.5	Low	113 Å²	113	77.2 Å²	77.2	53%	0.528	40%	0.398	S	S	.	.			trans	-82.8	139.7	171.2	-64.1	-63.8	-17.9	0	0	109.9	Y359	Q235-Y359 WeakPolarHBondContact O-CE1 3.08Å; Q235-Y359 PolarHBondContact O-OH 3.12Å
236	P	73.1	Confident	65.1	Low	29 Å²	29	84 Å²	84	19%	0.188	43%	0.434	C	S	.	.			trans	-59.6	140.4	169.2	22.2	-28.1	0	0	0	109.9	L275	P236-L275 HydrophobicContact CB-CB 3.85Å; P236-L275 HydrophobicContact CB-CD2 3.79Å; P236-L275 HydrophobicContact CB-CG 4.26Å; P236-L275 HydrophobicContact CG-CB 3.62Å; P236-L275 HydrophobicContact CG-CD2 4.48Å; P236-L275 WeakPolarHBondContact CG-O 3.17Å
237	R	66.7	Low	62.5	Low	148 Å²	148	90.8 Å²	90.8	56%	0.558	46%	0.464	S	S	*	.			trans	-122.8	116	176.6	-68.7	-176	178.4	-178.9	-1.4	108.6	Y359	R237-Y359 HydrophobicContact CB-CD1 3.83Å; R237-Y359 HydrophobicContact CB-CD2 4.15Å; R237-Y359 HydrophobicContact CB-CE1 3.71Å; R237-Y359 HydrophobicContact CB-CE2 4.06Å; R237-Y359 HydrophobicContact CB-CG 4.02Å; R237-Y359 HydrophobicContact CG-CE1 3.92Å; R237-Y359 HydrophobicContact CG-CE2 4.06Å
238	I	55.5	Low	59.6	Low	77 Å²	77	97.2 Å²	97.2	40%	0.395	50%	0.503	S	S	.	.			trans	-89.2	128.2	167	-59.6	163.2	0	0	0	107.2	S240 Y259 L275	I238-S240 PolarHBondContact O-N 3Å; I238-S240 VanDerWaalsContact O-N 3.15Å; I238-Y259 HydrophobicContact CD1-CD2 3.38Å; I238-Y259 HydrophobicContact CD1-CE2 3.7Å; I238-Y259 HydrophobicContact CD1-CG 4.05Å; I238-L275 HydrophobicContact CD1-CD1 3.5Å; I238-L275 VanDerWaalsContact CD1-CD1 3.5Å; I238-L275 HydrophobicContact CG1-CD1 3.72Å
239	K	45.6	Very low	56.6	Low	189 Å²	189	101.7 Å²	101.7	82%	0.822	54%	0.54	S	S	*	.			trans	-67.2	110.2	162.2	-75.9	-178.1	179.1	175.4	0	106.5	T241	K239-T241 VanDerWaalsContact C-N 3.33Å; K239-T241 PolarHBondContact O-N 2.8Å
240	S	40.7	Very low	53.7	Low	107 Å²	107	106.9 Å²	106.9	75%	0.748	58%	0.575	S	S	*	*			trans	-62.4	97.7	172.4	64.8	0	0	0	0	108.4	I238 H242	I238-S240 PolarHBondContact O-N 3Å; I238-S240 VanDerWaalsContact O-N 3.15Å; S240-H242 VanDerWaalsContact C-N 3.35Å; S240-H242 PolarHBondContact O-N 3.21Å
241	T	38.1	Very low	50.7	Low	126 Å²	126	114.6 Å²	114.6	77%	0.773	62%	0.616	S	S	*	*			trans	-70.6	98.4	167.4	38.8	0	0	0	0	107.4	K239	K239-T241 VanDerWaalsContact C-N 3.33Å; K239-T241 PolarHBondContact O-N 2.8Å
242	H	34	Very low	48.1	Very low	166 Å²	166	117.5 Å²	117.5	77%	0.769	63%	0.633	S	S	*	*			trans	55.3	117.6	172.9	-74.1	-73	0	0	0	116.6	S240 M244	S240-H242 VanDerWaalsContact C-N 3.35Å; S240-H242 PolarHBondContact O-N 3.21Å; H242-M244 PolarHBondContact O-N 2.84Å
243	S	27.9	Very low	45.3	Very low	114 Å²	114	123.5 Å²	123.5	80%	0.797	67%	0.665	S	S	*	*			trans	-54.1	77.4	157.7	56.8	0	0	0	0	111.1
244	M	30	Very low	42.5	Very low	164 Å²	164	127 Å²	127	81%	0.808	68%	0.683	S	S	*	*			trans	-82.6	111.9	156.3	-75.7	-142	-151.2	0	0	106.7	H242 L246	H242-M244 PolarHBondContact O-N 2.84Å; M244-L246 VanDerWaalsContact C-N 3.32Å; M244-L246 PolarHBondContact O-N 3.41Å
245	N	29.6	Very low	39.9	Very low	153 Å²	153	135 Å²	135	82%	0.818	73%	0.726	S	S	*	*			trans	-28.4	82.1	169.7	-73.6	-47.2	0	0	0	114.5	K247	N245-K247 VanDerWaalsContact C-N 3.31Å; N245-K247 PolarHBondContact O-N 3.37Å
246	L	31.1	Very low	37.5	Very low	160 Å²	160	133 Å²	133	84%	0.838	72%	0.717	S	S	*	*			trans	-91.1	78.9	156	-108.6	84.6	0	0	0	107.2	M244	M244-L246 VanDerWaalsContact C-N 3.32Å; M244-L246 PolarHBondContact O-N 3.41Å
247	K	31.6	Very low	35.6	Very low	176 Å²	176	133.9 Å²	133.9	77%	0.765	72%	0.724	S	S	*	*			trans	-64	142	148.1	-77.5	179.8	175.2	177.8	0	106.3	N245	N245-K247 VanDerWaalsContact C-N 3.31Å; N245-K247 PolarHBondContact O-N 3.37Å
248	T	31.5	Very low	33.9	Very low	135 Å²	135	133.4 Å²	133.4	83%	0.828	72%	0.723	S	S	*	*			trans	78.4	89.9	172.5	68.1	0	0	0	0	117.8
249	A	29.5	Very low	32.9	Very low	95 Å²	95	136.2 Å²	136.2	79%	0.785	73%	0.73	S	S	*	*				-158.9	134.9	126.3	0	0	0	0	0	109
250	P	35	Very low	32.1	Very low	115 Å²	115	132 Å²	132	75%	0.747	72%	0.72	S	S	*	*			trans	-83.8	152.9	-166.1	34.3	-34.4	0	0	0	113.1	I252	P250-I252 PolarHBondContact O-N 3.31Å
251	D	29.4	Very low	31.9	Very low	163 Å²	163	129.8 Å²	129.8	87%	0.872	70%	0.699	S	S	*	*			trans	-20	92.6	170	-64.5	-40.5	0	0	0	115.6
252	I	32.5	Very low	31.5	Very low	150 Å²	150	128.2 Å²	128.2	77%	0.769	69%	0.691	S	S	*	*			trans	-92.2	103.5	157.8	-62.8	178.3	0	0	0	106.8	P250 N254	P250-I252 PolarHBondContact O-N 3.31Å; I252-N254 HydrophobicContact CG2-CB 4.45Å; I252-N254 PolarHBondContact O-N 2.96Å
253	N	29.1	Very low	31.6	Very low	163 Å²	163	124.3 Å²	124.3	87%	0.872	68%	0.679	S	S	*	*			trans	-74.4	53.2	-177.6	-131.9	0.8	0	0	0	112.1
254	N	29.6	Very low	31.9	Very low	118 Å²	118	124.5 Å²	124.5	63%	0.631	67%	0.671	S	S	*	*			trans	-126.1	120.9	167.4	-91.5	-19.2	0	0	0	107.5	I252 M256	I252-N254 HydrophobicContact CG2-CB 4.45Å; I252-N254 PolarHBondContact O-N 2.96Å; N254-M256 PolarHBondContact O-N 3.43Å
255	N	35.1	Very low	32.6	Very low	175 Å²	175	122.1 Å²	122.1	94%	0.936	67%	0.667	S	S	*	*	S	Bend	trans	-61.6	19.1	176.4	-87	-13.2	0	0	0	114.7
256	M	31.2	Very low	33	Very low	70 Å²	70	120.7 Å²	120.7	35%	0.345	66%	0.664	S	S	.	*			trans	-106.5	92.7	172.4	-69.9	-78.8	-98.8	0	0	106.8	N254 Y258	N254-M256 PolarHBondContact O-N 3.43Å; M256-Y258 HydrophobicContact CB-CD2 4.31Å; M256-Y258 HydrophobicContact CB-CE2 3.63Å; M256-Y258 WeakPolarHBondContact O-CD2 3.31Å; M256-Y258 WeakPolarHBondContact O-CE2 3.42Å; M256-Y258 PolarHBondContact O-N 3.17Å; M256-Y258 VanDerWaalsContact O-N 3.1Å
257	S	33.5	Very low	33	Very low	48 Å²	48	119.7 Å²	119.7	34%	0.336	66%	0.655	S	S	.	*			trans	-75.3	99.7	174.6	59.7	0	0	0	0	108.9	Y259	S257-Y259 VanDerWaalsContact OG-CE2 3.3Å; S257-Y259 WeakPolarHBondContact OG-CE2 3.34Å
258	Y	30.7	Very low	32.9	Very low	137 Å²	137	117.9 Å²	117.9	54%	0.537	65%	0.648	S	S	.	*			trans	-80.3	117.6	173	-61.4	-86.6	0	0	0	108.6	M256	M256-Y258 HydrophobicContact CB-CD2 4.31Å; M256-Y258 HydrophobicContact CB-CE2 3.63Å; M256-Y258 WeakPolarHBondContact O-CD2 3.31Å; M256-Y258 WeakPolarHBondContact O-CE2 3.42Å; M256-Y258 PolarHBondContact O-N 3.17Å; M256-Y258 VanDerWaalsContact O-N 3.1Å
259	Y	35.6	Very low	32.8	Very low	136 Å²	136	114.9 Å²	114.9	53%	0.533	63%	0.629	S	S	.	*			trans	-118.1	132.6	176.5	-65.8	-72.5	0	0	0	110.7	I238 S257	I238-Y259 HydrophobicContact CD1-CD2 3.38Å; I238-Y259 HydrophobicContact CD1-CE2 3.7Å; I238-Y259 HydrophobicContact CD1-CG 4.05Å; S257-Y259 VanDerWaalsContact OG-CE2 3.3Å; S257-Y259 WeakPolarHBondContact OG-CE2 3.34Å
260	V	28.6	Very low	32.8	Very low	102 Å²	102	115.3 Å²	115.3	62%	0.618	62%	0.622	S	S	*	*			trans	-86.8	117.4	176.3	-179.7	0	0	0	0	108	F268 T270	V260-F268 HydrophobicContact CG1-CD1 4.41Å; V260-T270 HydrophobicContact CG1-CG2 4.37Å
261	I	37.3	Very low	32.7	Very low	59 Å²	59	115.9 Å²	115.9	30%	0.303	62%	0.615	S	S	.	*			trans	-99.6	123.9	-178.2	-57.1	174.2	0	0	0	108.5	V263 T362	I261-V263 HydrophobicContact CG2-CG2 4.4Å; I261-V263 PolarHBondContact O-N 3.3Å; I261-V263 VanDerWaalsContact O-N 3.16Å; I261-T362 HydrophobicContact CD1-CG2 3.81Å
262	P	29.5	Very low	33	Very low	93 Å²	93	111.3 Å²	111.3	60%	0.604	60%	0.596	S	S	*	*			trans	-75.3	104.3	172.7	28.5	-29.5	0	0	0	109.3	F268	P262-F268 HydrophobicContact CB-CE1 4.25Å
263	V	35.5	Very low	33.5	Very low	84 Å²	84	109.6 Å²	109.6	51%	0.509	58%	0.583	S	S	.	*	S	Bend	trans	-93	95.1	166.5	-175	0	0	0	0	106.5	I261 Q267	I261-V263 HydrophobicContact CG2-CG2 4.4Å; I261-V263 PolarHBondContact O-N 3.3Å; I261-V263 VanDerWaalsContact O-N 3.16Å; V263-Q267 CarbonylContact O-C 3.55Å
264	D	34.3	Very low	34.5	Very low	119 Å²	119	104.4 Å²	104.4	64%	0.636	56%	0.559	S	S	*	*	S	Bend	trans	69	143.4	-174.9	-112.3	-25.9	0	0	0	115.2	T266 Q267	D264-T266 PolarHBondContact O-N 3.07Å; D264-Q267 PolarHBondContact O-N 3.43Å
265	P	44.9	Very low	36.2	Very low	113 Å²	113	100 Å²	100	73%	0.734	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-11.6	-177.8	-11.7	21.9	0	0	0	114.3
266	T	38.3	Very low	38.3	Very low	123 Å²	123	92.8 Å²	92.8	76%	0.755	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	-7.2	-174.1	50.5	0	0	0	0	114.8	D264	D264-T266 PolarHBondContact O-N 3.07Å
267	Q	30.4	Very low	41	Very low	139 Å²	139	90.8 Å²	90.8	65%	0.65	49%	0.491	S	S	*	.			trans	-141.1	90.3	179.5	-75	-171.8	-7.1	0	0	112.4	V263 D264 V269	V263-Q267 CarbonylContact O-C 3.55Å; D264-Q267 PolarHBondContact O-N 3.43Å; Q267-V269 VanDerWaalsContact C-N 3.33Å; Q267-V269 PolarHBondContact O-N 3.19Å
268	F	29.2	Very low	43.7	Very low	138 Å²	138	89 Å²	89	61%	0.605	48%	0.478	S	S	*	.			trans	-68	91.1	166	-67.8	-84.2	0	0	0	109.9	V260 P262 T270	V260-F268 HydrophobicContact CG1-CD1 4.41Å; P262-F268 HydrophobicContact CB-CE1 4.25Å; F268-T270 PolarHBondContact O-N 3.09Å
269	V	29.2	Very low	46.7	Very low	73 Å²	73	82.4 Å²	82.4	44%	0.442	45%	0.452	S	S	.	.			trans	-76.9	98	163.8	-175.8	0	0	0	0	107.1	Q267 E271	Q267-V269 VanDerWaalsContact C-N 3.33Å; Q267-V269 PolarHBondContact O-N 3.19Å; V269-E271 HydrophobicContact CG1-CB 4.22Å; V269-E271 HydrophobicContact CG1-CG 3.94Å; V269-E271 PolarHBondContact O-N 3.33Å
270	T	29.3	Very low	49.5	Very low	103 Å²	103	76 Å²	76	63%	0.632	43%	0.427	S	S	*	.			trans	-75.6	58.6	170.5	46.3	0	0	0	0	110.6	V260 F268 S272	V260-T270 HydrophobicContact CG1-CG2 4.37Å; F268-T270 PolarHBondContact O-N 3.09Å; T270-S272 VanDerWaalsContact C-N 3.32Å; T270-S272 PolarHBondContact O-N 3.07Å
271	E	32.8	Very low	52.7	Low	127 Å²	127	71.1 Å²	71.1	59%	0.593	40%	0.397	S	S	*	.			trans	-86	87.9	158.9	-78.6	-174.8	-175.4	0	0	106.8	V269 F273	V269-E271 HydrophobicContact CG1-CB 4.22Å; V269-E271 HydrophobicContact CG1-CG 3.94Å; V269-E271 PolarHBondContact O-N 3.33Å; E271-F273 HydrophobicContact CB-CD2 4.45Å; E271-F273 HydrophobicContact CB-CE2 3.74Å; E271-F273 HydrophobicContact CB-CZ 3.92Å; E271-F273 VanDerWaalsContact O-CD2 3.23Å; E271-F273 WeakPolarHBondContact O-CD2 3.45Å; E271-F273 PolarHBondContact O-N 2.9Å; E271-F273 WeakPolarHBondContact OE2-CZ 3.4Å
272	S	35.9	Very low	55.5	Low	68 Å²	68	68.3 Å²	68.3	48%	0.476	38%	0.383	S	S	.	.			trans	-70.4	95.6	173.8	59.8	0	0	0	0	108.7	T270 S274	T270-S272 VanDerWaalsContact C-N 3.32Å; T270-S272 PolarHBondContact O-N 3.07Å; S272-S274 PolarHBondContact O-N 2.92Å
273	F	44	Very low	58.6	Low	113 Å²	113	63.9 Å²	63.9	50%	0.496	35%	0.354	S	S	.	.			trans	-74.3	120.7	169.2	-61.9	-80.4	0	0	0	108.3	E271 L275	E271-F273 HydrophobicContact CB-CD2 4.45Å; E271-F273 HydrophobicContact CB-CE2 3.74Å; E271-F273 HydrophobicContact CB-CZ 3.92Å; E271-F273 VanDerWaalsContact O-CD2 3.23Å; E271-F273 WeakPolarHBondContact O-CD2 3.45Å; E271-F273 PolarHBondContact O-N 2.9Å; E271-F273 WeakPolarHBondContact OE2-CZ 3.4Å; F273-L275 PolarHBondContact O-N 3.01Å
274	S	49.1	Very low	61.3	Low	54 Å²	54	59.9 Å²	59.9	38%	0.378	33%	0.33	S	S	.	.			trans	-64	109.4	167.3	53.9	0	0	0	0	108.3	S272 C276	S272-S274 PolarHBondContact O-N 2.92Å; S274-C276 VanDerWaalsContact C-N 3.26Å; S274-C276 PolarHBondContact O-N 2.92Å
275	L	66.3	Low	63.9	Low	26 Å²	26	54.2 Å²	54.2	14%	0.136	30%	0.3	C	S	.	.			trans	-74	87	174.7	-75.7	170.2	0	0	0	108.1	P236 I238 F273 I364	P236-L275 HydrophobicContact CB-CB 3.85Å; P236-L275 HydrophobicContact CB-CD2 3.79Å; P236-L275 HydrophobicContact CB-CG 4.26Å; P236-L275 HydrophobicContact CG-CB 3.62Å; P236-L275 HydrophobicContact CG-CD2 4.48Å; P236-L275 WeakPolarHBondContact CG-O 3.17Å; I238-L275 HydrophobicContact CD1-CD1 3.5Å; I238-L275 VanDerWaalsContact CD1-CD1 3.5Å; I238-L275 HydrophobicContact CG1-CD1 3.72Å; F273-L275 PolarHBondContact O-N 3.01Å; L275-I364 HydrophobicContact CD2-CG1 4.48Å
276	C	79.3	Confident	65.8	Low	24 Å²	24	51.9 Å²	51.9	16%	0.162	28%	0.278	C	S	.	.			trans	-87.7	151.2	174.5	-61.5	0	0	0	0	110.1	S274 V278	S274-C276 VanDerWaalsContact C-N 3.26Å; S274-C276 PolarHBondContact O-N 2.92Å; C276-V278 WeakPolarHBondContact O-CG1 3.27Å
277	P	88	Confident	68	Low	28 Å²	28	46 Å²	46	18%	0.182	24%	0.242	C	C	.	.			trans	-54.7	147.8	163.2	0.6	0.6	0	0	0	110.8	V233 R234 V297	V233-P277 HydrophobicContact CG1-CB 3.71Å; R234-P277 CarbonylContact O-C 3.51Å; R234-P277 VanDerWaalsContact O-CA 3.22Å; R234-P277 WeakPolarHBondContact O-CA 3.08Å; P277-V297 HydrophobicContact CB-CB 4.19Å; P277-V297 WeakPolarHBondContact CD-O 3.31Å; P277-V297 HydrophobicContact CG-CB 4.38Å; P277-V297 WeakPolarHBondContact O-CB 3.43Å; P277-V297 PolarHBondContact O-N 3.33Å
278	V	90.1	Very high	70.7	Confident	9 Å²	9	39.4 Å²	39.4	6%	0.055	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	155.2	-178.3	-54.4	0	0	0	0	112.4	R234 C276 F280 M294 V295 L365	R234-V278 PolarHBondContact N-O 2.96Å; R234-V278 PolarHBondContact O-N 2.82Å; C276-V278 WeakPolarHBondContact O-CG1 3.27Å; V278-F280 HydrophobicContact CG2-CZ 4.47Å; V278-M294 HydrophobicContact CB-CG 3.83Å; V278-M294 HydrophobicContact CB-SD 4.31Å; V278-M294 HydrophobicContact CG1-CG 3.93Å; V278-M294 HydrophobicContact CG1-SD 3.95Å; V278-M294 HydrophobicContact CG2-CG 4.2Å; V278-M294 HydrophobicContact CG2-SD 4.33Å; V278-V295 CarbonylContact C-O 3.56Å; V278-V295 VanDerWaalsContact CA-O 3.25Å; V278-V295 WeakPolarHBondContact CA-O 3.38Å; V278-L365 HydrophobicContact CG2-CB 4.46Å; V278-L365 HydrophobicContact CG2-CD1 3.22Å; V278-L365 HydrophobicContact CG2-CG 4.44Å
279	T	92.8	Very high	73.6	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	171.9	168.4	-171.3	0	0	0	0	109.6	P129 V132 W229 C230 V295 V297	P129-T279 WeakPolarHBondContact CG-OG1 3.34Å; V132-T279 HydrophobicContact CG1-CG2 4.46Å; V132-T279 HydrophobicContact CG2-CG2 4.12Å; W229-T279 HydrophobicContact CE3-CG2 4.05Å; W229-T279 HydrophobicContact CZ3-CG2 3.82Å; C230-T279 PolarHBondContact SG-OG1 3.14Å; T279-V295 HydrophobicContact CG2-CB 3.88Å; T279-V295 HydrophobicContact CG2-CG1 4.42Å; T279-V295 PolarHBondContact N-O 2.85Å; T279-V295 PolarHBondContact O-N 2.93Å; T279-V297 HydrophobicContact CG2-CG2 4.46Å
280	F	94.6	Very high	76.7	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	141.4	-177.8	-58.2	-71.9	0	0	0	112.1	W229 C230 V278 I292 W293 M294 L308 L331 L339 I357 L365 L367	W229-F280 WeakPolarHBondContact CA-O 3.25Å; C230-F280 HydrophobicContact CB-CB 4.47Å; C230-F280 PolarHBondContact N-O 3.16Å; C230-F280 PolarHBondContact SG-N 2.96Å; V278-F280 HydrophobicContact CG2-CZ 4.47Å; F280-I292 HydrophobicContact CB-CG2 4.29Å; F280-I292 HydrophobicContact CD1-CG2 4.33Å; F280-W293 VanDerWaalsContact CA-O 3.31Å; F280-W293 WeakPolarHBondContact CA-O 3.35Å; F280-M294 HydrophobicContact CD1-CB 4.5Å; F280-M294 HydrophobicContact CE1-CB 4.41Å; F280-M294 HydrophobicContact CE1-CG 4.24Å; F280-L308 HydrophobicContact CD1-CD1 4Å; F280-L308 HydrophobicContact CE1-CD1 3.56Å; F280-L331 HydrophobicContact CB-CD2 3.88Å; F280-L339 HydrophobicContact CB-CD1 4.38Å; F280-L339 HydrophobicContact CD2-CD1 3.65Å; F280-L339 HydrophobicContact CD2-CD2 4.19Å; F280-L339 HydrophobicContact CD2-CG 4.46Å; F280-L339 HydrophobicContact CE2-CD1 4.05Å; F280-L339 HydrophobicContact CG-CD1 4.03Å; F280-I357 HydrophobicContact CE2-CD1 3.78Å; F280-I357 HydrophobicContact CE2-CG1 4.47Å; F280-I357 HydrophobicContact CZ-CD1 4.44Å; F280-L365 HydrophobicContact CZ-CB 4.48Å; F280-L367 HydrophobicContact CZ-CD2 4.46Å
281	L	95.7	Very high	79.7	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	115.7	175.8	170.3	64.2	0	0	0	109	L151 L166 W229 V283 I292 W293 V295 M305	L151-L281 HydrophobicContact CD1-CD2 4.31Å; L151-L281 HydrophobicContact CD2-CD2 4.1Å; L166-L281 HydrophobicContact CD2-CD2 3.95Å; W229-L281 HydrophobicContact CD2-CB 4.3Å; W229-L281 HydrophobicContact CD2-CD1 3.94Å; W229-L281 HydrophobicContact CE3-CB 3.95Å; W229-L281 HydrophobicContact CE3-CD1 4.44Å; W229-L281 HydrophobicContact CG-CD1 4.26Å; W229-L281 HydrophobicContact CH2-CB 4.07Å; W229-L281 HydrophobicContact CH2-CD1 4.5Å; W229-L281 HydrophobicContact CH2-CD2 3.99Å; W229-L281 HydrophobicContact CH2-CG 4.42Å; W229-L281 HydrophobicContact CZ2-CB 4.44Å; W229-L281 HydrophobicContact CZ2-CD1 4.03Å; W229-L281 HydrophobicContact CZ2-CD2 3.95Å; W229-L281 HydrophobicContact CZ2-CG 4.37Å; W229-L281 HydrophobicContact CZ3-CB 3.83Å; L281-V283 HydrophobicContact CD2-CG2 4.42Å; L281-V283 HydrophobicContact CG-CG2 4.12Å; L281-I292 WeakPolarHBondContact O-CA 3.34Å; L281-W293 HydrophobicContact CB-CB 4.27Å; L281-W293 PolarHBondContact N-O 2.68Å; L281-W293 PolarHBondContact O-N 2.86Å; L281-V295 HydrophobicContact CB-CG2 4.37Å; L281-M305 HydrophobicContact CD2-CE 4.2Å
282	A	95.9	Very high	82.6	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	141.3	169.9	0	0	0	0	0	110.6	T227 S228 C291 I292 I329 L331 L341	T227-A282 CarbonylContact C-O 3.59Å; T227-A282 WeakPolarHBondContact CA-O 3.27Å; S228-A282 PolarHBondContact N-O 2.86Å; S228-A282 PolarHBondContact O-N 3.39Å; A282-C291 CarbonylContact C-O 3.51Å; A282-C291 WeakPolarHBondContact CA-O 3.29Å; A282-I292 HydrophobicContact CB-CG1 4.45Å; A282-I329 HydrophobicContact CB-CD1 3.86Å; A282-L331 HydrophobicContact CB-CB 4.12Å; A282-L331 HydrophobicContact CB-CD2 4.13Å; A282-L341 HydrophobicContact CB-CD1 3.92Å
283	V	95.2	Very high	85.3	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	132	-178.7	-171.8	0	0	0	0	108.7	L166 V224 Y226 T227 L281 M285 F290 C291	L166-V283 HydrophobicContact CD2-CG2 3.76Å; V224-V283 HydrophobicContact CB-CG1 4.22Å; V224-V283 HydrophobicContact CG1-CG1 3.41Å; V224-V283 VanDerWaalsContact CG1-CG1 3.41Å; V224-V283 HydrophobicContact CG2-CG1 3.82Å; Y226-V283 WeakPolarHBondContact O-CA 3.23Å; T227-V283 HydrophobicContact CG2-CG1 4.34Å; T227-V283 HydrophobicContact CG2-CG2 4.38Å; L281-V283 HydrophobicContact CD2-CG2 4.42Å; L281-V283 HydrophobicContact CG-CG2 4.12Å; V283-M285 HydrophobicContact CB-CE 4.03Å; V283-M285 HydrophobicContact CG1-CE 3.49Å; V283-M285 VanDerWaalsContact CG1-CE 3.49Å; V283-M285 HydrophobicContact CG1-SD 4.21Å; V283-F290 CarbonylContact O-C 3.59Å; V283-F290 WeakPolarHBondContact O-CA 3.48Å; V283-F290 VanDerWaalsContact O-CB 3.31Å; V283-F290 WeakPolarHBondContact O-CB 3.47Å; V283-C291 PolarHBondContact N-O 3.32Å; V283-C291 PolarHBondContact O-N 2.86Å
284	L	93.3	Very high	87.5	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	135.9	174.7	177.3	70.5	0	0	0	109.5	V225 Y226 A289 F290 P326 I329	V225-L284 HydrophobicContact CG2-CB 4.01Å; V225-L284 HydrophobicContact CG2-CD2 3.61Å; V225-L284 HydrophobicContact CG2-CG 3.57Å; V225-L284 VanDerWaalsContact CG2-O 3.3Å; V225-L284 WeakPolarHBondContact CG2-O 3.26Å; V225-L284 PolarHBondContact N-O 2.84Å; Y226-L284 PolarHBondContact N-O 3.32Å; Y226-L284 PolarHBondContact O-N 2.81Å; L284-A289 WeakPolarHBondContact CD1-O 3.01Å; L284-F290 HydrophobicContact CD1-CB 4.29Å; L284-P326 HydrophobicContact CD1-CB 4.08Å; L284-P326 HydrophobicContact CD1-CG 3.82Å; L284-I329 HydrophobicContact CB-CB 4.47Å; L284-I329 HydrophobicContact CB-CD1 3.71Å; L284-I329 HydrophobicContact CB-CG1 3.78Å; L284-I329 HydrophobicContact CB-CG2 3.88Å; L284-I329 HydrophobicContact CD1-CG2 4.03Å; L284-I329 HydrophobicContact CD2-CG2 4.07Å; L284-I329 HydrophobicContact CG-CG2 4.19Å
285	M	88.8	Confident	89.6	Confident	1 Å²	1	8.6 Å²	8.6	1%	0.005	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	157.4	175.4	-49.1	-54.8	163.9	0	0	110.8	W170 D221 V223 V224 V283 S287 G288 A289 C291	W170-M285 HydrophobicContact CD2-CE 3.63Å; W170-M285 VanDerWaalsContact CE2-CE 3.43Å; W170-M285 HydrophobicContact CE3-CE 4.24Å; W170-M285 HydrophobicContact CG-CE 3.85Å; W170-M285 HydrophobicContact CG-SD 4.44Å; W170-M285 HydrophobicContact CH2-CE 4.46Å; W170-M285 HydrophobicContact CZ2-CE 3.89Å; W170-M285 HydrophobicContact CZ2-CG 4.29Å; W170-M285 PolarHBondContact NE1-SD 3.03Å; D221-M285 WeakPolarHBondContact O-CB 3.46Å; D221-M285 VanDerWaalsContact O-CG 3.24Å; D221-M285 WeakPolarHBondContact O-CG 3.33Å; V223-M285 CarbonylContact O-C 3.47Å; V223-M285 VanDerWaalsContact O-CA 3.29Å; V223-M285 WeakPolarHBondContact O-CA 3.23Å; V224-M285 HydrophobicContact CB-SD 4.35Å; V224-M285 HydrophobicContact CG2-CE 4.17Å; V224-M285 HydrophobicContact CG2-SD 3.69Å; V283-M285 HydrophobicContact CB-CE 4.03Å; V283-M285 HydrophobicContact CG1-CE 3.49Å; V283-M285 VanDerWaalsContact CG1-CE 3.49Å; V283-M285 HydrophobicContact CG1-SD 4.21Å; M285-S287 PolarHBondContact O-N 2.74Å; M285-G288 PolarHBondContact O-N 2.88Å; M285-A289 HydrophobicContact CB-CB 4.15Å; M285-A289 WeakPolarHBondContact CB-O 3.48Å; M285-A289 HydrophobicContact CG-CB 4.14Å; M285-A289 PolarHBondContact N-O 3.13Å; M285-C291 VanDerWaalsContact CE-SG 3.54Å
286	K	84.3	Confident	90.7	Very high	64 Å²	64	8.9 Å²	8.9	28%	0.278	5%	0.049	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-33.2	-178.9	-175.1	178.1	175	-171.9	0	112	E220 V223 V225 G288 R325	E220-K286 HydrophobicContact CB-CB 4.39Å; E220-K286 HydrophobicContact CG-CD 4.2Å; E220-K286 HydrophobicContact CG-CG 4.4Å; E220-K286 WeakPolarHBondContact O-CB 3.5Å; E220-K286 PolarHBondContact O-N 2.84Å; V223-K286 HydrophobicContact CB-CB 4.02Å; V223-K286 HydrophobicContact CG1-CB 3.94Å; V223-K286 HydrophobicContact CG1-CD 4.18Å; V223-K286 PolarHBondContact O-N 3.26Å; V225-K286 HydrophobicContact CG1-CB 3.73Å; V225-K286 HydrophobicContact CG1-CG 4.29Å; K286-G288 PolarHBondContact O-N 2.82Å; K286-R325 WeakPolarHBondContact O-CD 3.27Å; K286-R325 PolarHBondContact O-NH1 2.97Å
287	S	83.7	Confident	91.1	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-24.4	175.9	60.5	0	0	0	0	113.4	E220 D221 M285 A289 T315 V316	E220-S287 PolarHBondContact O-N 2.8Å; D221-S287 WeakPolarHBondContact OD1-CB 3.42Å; D221-S287 PolarHBondContact OD1-OG 2.87Å; M285-S287 PolarHBondContact O-N 2.74Å; S287-A289 WeakPolarHBondContact OG-CB 3.5Å; S287-A289 PolarHBondContact OG-N 2.94Å; S287-T315 VanDerWaalsContact O-CA 3.31Å; S287-T315 WeakPolarHBondContact O-CA 3.43Å; S287-V316 PolarHBondContact O-N 2.85Å
288	G	87.3	Confident	91.2	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.06	C	C	.	.	S	Bend	trans	104.8	-5.3	-168.3	0	0	0	0	0	113.4	M285 K286 P326	M285-G288 PolarHBondContact O-N 2.88Å; K286-G288 PolarHBondContact O-N 2.82Å; G288-P326 WeakPolarHBondContact O-CG 3.34Å
289	A	90.4	Very high	91.2	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.059	C	C	.	.			trans	-66.1	147.1	171.9	0	0	0	0	0	109.8	L284 M285 S287 D311 Y312 T315	L284-A289 WeakPolarHBondContact CD1-O 3.01Å; M285-A289 HydrophobicContact CB-CB 4.15Å; M285-A289 WeakPolarHBondContact CB-O 3.48Å; M285-A289 HydrophobicContact CG-CB 4.14Å; M285-A289 PolarHBondContact N-O 3.13Å; S287-A289 WeakPolarHBondContact OG-CB 3.5Å; S287-A289 PolarHBondContact OG-N 2.94Å; A289-D311 CarbonylContact C-O 3.6Å; A289-D311 VanDerWaalsContact CA-O 3.27Å; A289-D311 WeakPolarHBondContact CA-O 3.45Å; A289-Y312 HydrophobicContact CB-CD1 3.55Å; A289-Y312 HydrophobicContact CB-CE1 3.81Å; A289-Y312 HydrophobicContact CB-CG 4.48Å; A289-T315 HydrophobicContact CB-CG2 3.54Å
290	F	93.7	Very high	90.8	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	156.5	169.7	69.5	-91.7	0	0	0	111.2	V283 L284 D311 Y314 L341 L343 L353 F355	V283-F290 CarbonylContact O-C 3.59Å; V283-F290 WeakPolarHBondContact O-CA 3.48Å; V283-F290 VanDerWaalsContact O-CB 3.31Å; V283-F290 WeakPolarHBondContact O-CB 3.47Å; L284-F290 HydrophobicContact CD1-CB 4.29Å; F290-D311 HydrophobicContact CD1-CB 4Å; F290-D311 HydrophobicContact CD2-CB 4.23Å; F290-D311 HydrophobicContact CE1-CB 3.49Å; F290-D311 VanDerWaalsContact CE1-CB 3.49Å; F290-D311 HydrophobicContact CE2-CB 3.74Å; F290-D311 HydrophobicContact CG-CB 4.35Å; F290-D311 HydrophobicContact CZ-CB 3.33Å; F290-D311 VanDerWaalsContact CZ-OD2 3.32Å; F290-D311 WeakPolarHBondContact CZ-OD2 3.18Å; F290-D311 PolarHBondContact N-O 3.05Å; F290-D311 PolarHBondContact O-N 2.95Å; F290-Y314 HydrophobicContact CD1-CD2 4.47Å; F290-Y314 HydrophobicContact CE1-CD2 4.03Å; F290-Y314 HydrophobicContact CE1-CE2 4.04Å; F290-L341 HydrophobicContact CD2-CD2 3.64Å; F290-L341 HydrophobicContact CE2-CD2 3.51Å; F290-L341 HydrophobicContact CG-CD2 4.23Å; F290-L341 HydrophobicContact CZ-CD2 3.99Å; F290-L343 HydrophobicContact CE1-CD1 4.45Å; F290-L353 HydrophobicContact CE1-CD1 4.07Å; F290-L353 HydrophobicContact CZ-CD1 3.65Å; F290-F355 HydrophobicContact CE2-CZ 4Å; F290-F355 HydrophobicContact CZ-CZ 4.34Å
291	C	93.2	Very high	90.4	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	155.6	175.2	65.7	0	0	0	0	112.1	W170 A282 V283 M285 W293 L307 W309 V310	W170-C291 HydrophobicContact CH2-CB 4.22Å; W170-C291 HydrophobicContact CZ3-CB 4.06Å; A282-C291 CarbonylContact C-O 3.51Å; A282-C291 WeakPolarHBondContact CA-O 3.29Å; V283-C291 PolarHBondContact N-O 3.32Å; V283-C291 PolarHBondContact O-N 2.86Å; M285-C291 VanDerWaalsContact CE-SG 3.54Å; C291-W293 PolarHBondContact SG-NE1 3.15Å; C291-L307 HydrophobicContact CB-CD1 3.85Å; C291-W309 CarbonylContact C-O 3.6Å; C291-W309 WeakPolarHBondContact CA-O 3.06Å; C291-W309 WeakPolarHBondContact CB-O 3.46Å; C291-V310 HydrophobicContact CB-CG2 4.04Å
292	I	93.7	Very high	89.9	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.1	177.6	-56	175.6	0	0	0	108.8	F280 L281 A282 L308 W309 F355 L367	F280-I292 HydrophobicContact CB-CG2 4.29Å; F280-I292 HydrophobicContact CD1-CG2 4.33Å; L281-I292 WeakPolarHBondContact O-CA 3.34Å; A282-I292 HydrophobicContact CB-CG1 4.45Å; I292-L308 WeakPolarHBondContact O-CB 3.5Å; I292-L308 PolarHBondContact O-N 3.46Å; I292-W309 HydrophobicContact CB-CB 4.15Å; I292-W309 HydrophobicContact CG1-CB 4.46Å; I292-W309 PolarHBondContact N-O 2.76Å; I292-W309 PolarHBondContact O-N 3.02Å; I292-F355 HydrophobicContact CD1-CD1 4.18Å; I292-F355 HydrophobicContact CD1-CD2 4.2Å; I292-F355 HydrophobicContact CD1-CE1 3.89Å; I292-F355 HydrophobicContact CD1-CE2 3.93Å; I292-F355 HydrophobicContact CD1-CG 4.33Å; I292-F355 HydrophobicContact CD1-CZ 3.77Å; I292-L367 HydrophobicContact CB-CD1 4.12Å; I292-L367 HydrophobicContact CD1-CD1 3.89Å; I292-L367 HydrophobicContact CG2-CD1 3.83Å
293	W	92.6	Very high	89.3	Confident	6 Å²	6	21.6 Å²	21.6	2%	0.023	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	136.1	175.2	-64.2	80.9	0	0	0	110	L166 I169 W170 F280 L281 C291 M305 S306 L307	L166-W293 HydrophobicContact CD1-CD2 4.47Å; L166-W293 HydrophobicContact CD1-CZ2 4.15Å; I169-W293 HydrophobicContact CG2-CH2 3.65Å; I169-W293 HydrophobicContact CG2-CZ2 4.42Å; I169-W293 HydrophobicContact CG2-CZ3 4.27Å; W170-W293 HydrophobicContact CE3-CZ2 4.22Å; F280-W293 VanDerWaalsContact CA-O 3.31Å; F280-W293 WeakPolarHBondContact CA-O 3.35Å; L281-W293 HydrophobicContact CB-CB 4.27Å; L281-W293 PolarHBondContact N-O 2.68Å; L281-W293 PolarHBondContact O-N 2.86Å; C291-W293 PolarHBondContact SG-NE1 3.15Å; W293-M305 HydrophobicContact CB-CE 4.25Å; W293-M305 HydrophobicContact CD2-CE 4.05Å; W293-M305 HydrophobicContact CE3-CB 4.12Å; W293-M305 HydrophobicContact CE3-CE 4.04Å; W293-M305 HydrophobicContact CG-CE 4.16Å; W293-M305 HydrophobicContact CZ3-CB 4.47Å; W293-S306 CarbonylContact C-O 3.57Å; W293-S306 WeakPolarHBondContact CA-O 3.38Å; W293-L307 HydrophobicContact CD2-CB 4.32Å; W293-L307 HydrophobicContact CD2-CD1 3.86Å; W293-L307 HydrophobicContact CE3-CB 3.91Å; W293-L307 HydrophobicContact CE3-CD1 4.33Å; W293-L307 HydrophobicContact CG-CD1 4.29Å; W293-L307 HydrophobicContact CH2-CB 3.95Å; W293-L307 HydrophobicContact CH2-CD1 4.24Å; W293-L307 HydrophobicContact CH2-CD2 4.45Å; W293-L307 HydrophobicContact CH2-CG 4.44Å; W293-L307 HydrophobicContact CZ2-CB 4.37Å; W293-L307 HydrophobicContact CZ2-CD1 3.78Å; W293-L307 HydrophobicContact CZ2-CD2 4.47Å; W293-L307 HydrophobicContact CZ2-CG 4.43Å; W293-L307 HydrophobicContact CZ3-CB 3.72Å
294	M	90.8	Very high	88.9	Confident	23 Å²	23	21.8 Å²	21.8	11%	0.113	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	136.7	160.6	-168.8	170.8	63.5	0	0	109	V278 F280 M305 S306 L308	V278-M294 HydrophobicContact CB-CG 3.83Å; V278-M294 HydrophobicContact CB-SD 4.31Å; V278-M294 HydrophobicContact CG1-CG 3.93Å; V278-M294 HydrophobicContact CG1-SD 3.95Å; V278-M294 HydrophobicContact CG2-CG 4.2Å; V278-M294 HydrophobicContact CG2-SD 4.33Å; F280-M294 HydrophobicContact CD1-CB 4.5Å; F280-M294 HydrophobicContact CE1-CB 4.41Å; F280-M294 HydrophobicContact CE1-CG 4.24Å; M294-M305 CarbonylContact O-C 3.59Å; M294-M305 WeakPolarHBondContact O-CA 3.38Å; M294-S306 PolarHBondContact N-O 3.41Å; M294-S306 PolarHBondContact O-N 2.86Å; M294-L308 HydrophobicContact CB-CD1 3.64Å; M294-L308 HydrophobicContact CB-CD2 4.24Å; M294-L308 HydrophobicContact CB-CG 3.76Å; M294-L308 HydrophobicContact CG-CD1 4.34Å; M294-L308 HydrophobicContact SD-CD1 4.41Å
295	V	91.3	Very high	88.7	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	116.7	177.6	-175.9	0	0	0	0	109	W229 V278 T279 L281 F299 S304 M305	W229-V295 HydrophobicContact CH2-CG2 4.05Å; W229-V295 HydrophobicContact CZ3-CB 4.18Å; W229-V295 HydrophobicContact CZ3-CG1 4.44Å; W229-V295 HydrophobicContact CZ3-CG2 3.82Å; V278-V295 CarbonylContact C-O 3.56Å; V278-V295 VanDerWaalsContact CA-O 3.25Å; V278-V295 WeakPolarHBondContact CA-O 3.38Å; T279-V295 HydrophobicContact CG2-CB 3.88Å; T279-V295 HydrophobicContact CG2-CG1 4.42Å; T279-V295 PolarHBondContact N-O 2.85Å; T279-V295 PolarHBondContact O-N 2.93Å; L281-V295 HydrophobicContact CB-CG2 4.37Å; V295-F299 HydrophobicContact CG1-CD2 3.57Å; V295-F299 HydrophobicContact CG1-CE2 4.2Å; V295-F299 HydrophobicContact CG1-CG 4.48Å; V295-S304 CarbonylContact C-O 3.47Å; V295-S304 WeakPolarHBondContact CA-O 3.4Å; V295-M305 HydrophobicContact CG2-CE 4.37Å; V295-M305 HydrophobicContact CG2-CG 4.37Å
296	S	89.3	Confident	88.6	Confident	31 Å²	31	24.8 Å²	24.8	22%	0.217	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	143.2	175.5	-59.7	0	0	0	0	111.1	P298 F299 S304	S296-P298 CarbonylContact O-C 3.53Å; S296-F299 PolarHBondContact O-N 2.99Å; S296-S304 PolarHBondContact N-O 2.69Å
297	V	89.1	Confident	88.9	Confident	13 Å²	13	22.1 Å²	22.1	8%	0.079	15%	0.146	C	C	.	.	S	Bend	trans	-115.4	128.1	-179.3	177.8	0	0	0	0	108.9	G131 V132 V233 P277 T279	G131-V297 WeakPolarHBondContact O-CG1 3.46Å; V132-V297 HydrophobicContact CG1-CG2 4.39Å; V132-V297 HydrophobicContact CG2-CG2 4.26Å; V233-V297 HydrophobicContact CG1-CB 4.45Å; V233-V297 HydrophobicContact CG1-CG2 4.05Å; P277-V297 HydrophobicContact CB-CB 4.19Å; P277-V297 WeakPolarHBondContact CD-O 3.31Å; P277-V297 HydrophobicContact CG-CB 4.38Å; P277-V297 WeakPolarHBondContact O-CB 3.43Å; P277-V297 PolarHBondContact O-N 3.33Å; T279-V297 HydrophobicContact CG2-CG2 4.46Å
298	P	90	Very high	89	Confident	76 Å²	76	22.9 Å²	22.9	49%	0.494	15%	0.15	S	C	.	.	S	Bend	cis	-74.1	142.7	2.4	30.6	-34.8	0	0	0	113.1	V132 K134 S296 S300	V132-P298 CarbonylContact O-C 3.53Å; V132-P298 WeakPolarHBondContact O-CA 3.41Å; K134-P298 HydrophobicContact CB-CB 4.22Å; S296-P298 CarbonylContact O-C 3.53Å; P298-S300 PolarHBondContact O-N 2.92Å
299	F	89.6	Confident	89.1	Confident	6 Å²	6	23.7 Å²	23.7	3%	0.026	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-67.3	118.8	175.2	179.5	-104.1	0	0	0	110.4	V132 I139 L151 T153 V164 V295 S296 G301 M305	V132-F299 HydrophobicContact CG1-CB 4.05Å; V132-F299 WeakPolarHBondContact O-CB 3.33Å; V132-F299 PolarHBondContact O-N 2.89Å; I139-F299 HydrophobicContact CD1-CB 4.43Å; I139-F299 HydrophobicContact CD1-CD1 4.15Å; I139-F299 HydrophobicContact CD1-CD2 4.3Å; I139-F299 HydrophobicContact CD1-CE1 4.43Å; I139-F299 HydrophobicContact CD1-CG 4.05Å; I139-F299 HydrophobicContact CG2-CD1 4.33Å; L151-F299 HydrophobicContact CB-CZ 4.23Å; L151-F299 HydrophobicContact CD1-CE2 4.08Å; L151-F299 HydrophobicContact CD1-CZ 3.91Å; T153-F299 HydrophobicContact CG2-CD1 3.67Å; T153-F299 HydrophobicContact CG2-CE1 3.85Å; V164-F299 HydrophobicContact CB-CZ 4.29Å; V164-F299 HydrophobicContact CG2-CE1 4.37Å; V164-F299 HydrophobicContact CG2-CE2 4.28Å; V164-F299 HydrophobicContact CG2-CZ 3.52Å; V295-F299 HydrophobicContact CG1-CD2 3.57Å; V295-F299 HydrophobicContact CG1-CE2 4.2Å; V295-F299 HydrophobicContact CG1-CG 4.48Å; S296-F299 PolarHBondContact O-N 2.99Å; F299-G301 WeakPolarHBondContact CE2-O 3.38Å; F299-M305 HydrophobicContact CE2-CG 3.96Å; F299-M305 HydrophobicContact CE2-SD 4.12Å
300	S	84.7	Confident	89.1	Confident	90 Å²	90	23.7 Å²	23.7	63%	0.629	15%	0.153	S	C	*	.			trans	-115.3	8.9	-179	57.2	0	0	0	0	113.6	P298 S303 S304	P298-S300 PolarHBondContact O-N 2.92Å; S300-S303 PolarHBondContact OG-OG 3.24Å; S300-S304 PolarHBondContact N-OG 2.83Å; S300-S304 PolarHBondContact OG-OG 3.15Å
301	G	86	Confident	88.9	Confident	8 Å²	8	24 Å²	24	8%	0.082	16%	0.155	C	C	.	.	S	Bend	trans	114.3	-150.7	-177.6	0	0	0	0	0	111.8	F299 S303 S304	F299-G301 WeakPolarHBondContact CE2-O 3.38Å; G301-S303 VanDerWaalsContact C-N 3.28Å; G301-S303 PolarHBondContact O-N 3.07Å; G301-S304 WeakPolarHBondContact O-CB 3.33Å; G301-S304 PolarHBondContact O-N 3.28Å
302	V	84.2	Confident	88.6	Confident	31 Å²	31	24.8 Å²	24.8	19%	0.188	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-63.6	-33.8	-171.8	-167.9	0	0	0	0	112.9	V164 I169 F196 S304 M305	V164-V302 HydrophobicContact CB-CG2 4.38Å; V164-V302 HydrophobicContact CG1-CG2 4.02Å; V164-V302 HydrophobicContact CG2-CB 4.47Å; V164-V302 HydrophobicContact CG2-CG2 3.71Å; I169-V302 HydrophobicContact CD1-CB 4.23Å; I169-V302 HydrophobicContact CD1-CG1 3.46Å; I169-V302 VanDerWaalsContact CD1-CG1 3.46Å; I169-V302 HydrophobicContact CD1-CG2 3.78Å; I169-V302 HydrophobicContact CG1-CG1 4.17Å; F196-V302 HydrophobicContact CB-CG1 3.87Å; F196-V302 HydrophobicContact CD1-CB 3.68Å; F196-V302 HydrophobicContact CD1-CG1 3.09Å; F196-V302 HydrophobicContact CD1-CG2 4.26Å; F196-V302 HydrophobicContact CD2-CG1 4.18Å; F196-V302 HydrophobicContact CE1-CB 3.71Å; F196-V302 HydrophobicContact CE1-CG1 3.48Å; F196-V302 VanDerWaalsContact CE1-CG1 3.48Å; F196-V302 HydrophobicContact CE1-CG2 3.78Å; F196-V302 HydrophobicContact CG-CB 4.48Å; F196-V302 HydrophobicContact CG-CG1 3.44Å; F196-V302 VanDerWaalsContact CG-CG1 3.44Å; F196-V302 HydrophobicContact CZ-CG1 4.16Å; F196-V302 HydrophobicContact CZ-CG2 4.3Å; V302-S304 PolarHBondContact O-N 2.79Å; V302-S304 VanDerWaalsContact O-N 3.07Å; V302-M305 PolarHBondContact O-N 3.21Å
303	S	84	Confident	88.2	Confident	104 Å²	104	28.2 Å²	28.2	73%	0.727	18%	0.179	S	C	*	.	G	3₁₀ helix	trans	-59.9	-18.7	175.9	54.3	0	0	0	0	113.8	S300 G301 M305	S300-S303 PolarHBondContact OG-OG 3.24Å; G301-S303 VanDerWaalsContact C-N 3.28Å; G301-S303 PolarHBondContact O-N 3.07Å; S303-M305 VanDerWaalsContact C-N 3.34Å
304	S	87.7	Confident	87.8	Confident	5 Å²	5	29.5 Å²	29.5	4%	0.035	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-86.9	-4	176.2	-54.9	0	0	0	0	113	V295 S296 S300 G301 V302	V295-S304 CarbonylContact C-O 3.47Å; V295-S304 WeakPolarHBondContact CA-O 3.4Å; S296-S304 PolarHBondContact N-O 2.69Å; S300-S304 PolarHBondContact N-OG 2.83Å; S300-S304 PolarHBondContact OG-OG 3.15Å; G301-S304 WeakPolarHBondContact O-CB 3.33Å; G301-S304 PolarHBondContact O-N 3.28Å; V302-S304 PolarHBondContact O-N 2.79Å; V302-S304 VanDerWaalsContact O-N 3.07Å
305	M	89	Confident	87.4	Confident	17 Å²	17	29.5 Å²	29.5	8%	0.084	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	139.7	-174.7	-59	-171.4	66.1	0	0	111.3	L151 V164 L166 L281 W293 M294 V295 F299 V302 S303	L151-M305 HydrophobicContact CD1-CE 3.85Å; L151-M305 HydrophobicContact CD1-SD 3.6Å; V164-M305 HydrophobicContact CG1-SD 3.97Å; V164-M305 HydrophobicContact CG2-SD 4.44Å; L166-M305 HydrophobicContact CD1-CE 3.73Å; L281-M305 HydrophobicContact CD2-CE 4.2Å; W293-M305 HydrophobicContact CB-CE 4.25Å; W293-M305 HydrophobicContact CD2-CE 4.05Å; W293-M305 HydrophobicContact CE3-CB 4.12Å; W293-M305 HydrophobicContact CE3-CE 4.04Å; W293-M305 HydrophobicContact CG-CE 4.16Å; W293-M305 HydrophobicContact CZ3-CB 4.47Å; M294-M305 CarbonylContact O-C 3.59Å; M294-M305 WeakPolarHBondContact O-CA 3.38Å; V295-M305 HydrophobicContact CG2-CE 4.37Å; V295-M305 HydrophobicContact CG2-CG 4.37Å; F299-M305 HydrophobicContact CE2-CG 3.96Å; F299-M305 HydrophobicContact CE2-SD 4.12Å; V302-M305 PolarHBondContact O-N 3.21Å; S303-M305 VanDerWaalsContact C-N 3.34Å
306	S	87	Confident	86.6	Confident	46 Å²	46	30 Å²	30	32%	0.322	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	130.3	174	-51.6	0	0	0	0	109.9	W293 M294	W293-S306 CarbonylContact C-O 3.57Å; W293-S306 WeakPolarHBondContact CA-O 3.38Å; M294-S306 PolarHBondContact N-O 3.41Å; M294-S306 PolarHBondContact O-N 2.86Å
307	L	88.9	Confident	85.6	Confident	8 Å²	8	30.5 Å²	30.5	4%	0.042	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	122.3	-179.8	-175.6	62.9	0	0	0	109.5	W170 Y173 P192 C291 W293 V310	W170-L307 HydrophobicContact CZ3-CD1 4.35Å; W170-L307 HydrophobicContact CZ3-CD2 4Å; Y173-L307 HydrophobicContact CD1-CD2 3.92Å; Y173-L307 HydrophobicContact CD2-CD2 3.76Å; Y173-L307 HydrophobicContact CE1-CD2 3.84Å; Y173-L307 HydrophobicContact CE2-CD2 3.66Å; Y173-L307 HydrophobicContact CG-CD2 3.87Å; P192-L307 HydrophobicContact CB-CD2 4.16Å; P192-L307 WeakPolarHBondContact CD-O 3.35Å; P192-L307 HydrophobicContact CG-CB 3.82Å; P192-L307 HydrophobicContact CG-CD2 3.34Å; P192-L307 HydrophobicContact CG-CG 3.32Å; C291-L307 HydrophobicContact CB-CD1 3.85Å; W293-L307 HydrophobicContact CD2-CB 4.32Å; W293-L307 HydrophobicContact CD2-CD1 3.86Å; W293-L307 HydrophobicContact CE3-CB 3.91Å; W293-L307 HydrophobicContact CE3-CD1 4.33Å; W293-L307 HydrophobicContact CG-CD1 4.29Å; W293-L307 HydrophobicContact CH2-CB 3.95Å; W293-L307 HydrophobicContact CH2-CD1 4.24Å; W293-L307 HydrophobicContact CH2-CD2 4.45Å; W293-L307 HydrophobicContact CH2-CG 4.44Å; W293-L307 HydrophobicContact CZ2-CB 4.37Å; W293-L307 HydrophobicContact CZ2-CD1 3.78Å; W293-L307 HydrophobicContact CZ2-CD2 4.47Å; W293-L307 HydrophobicContact CZ2-CG 4.43Å; W293-L307 HydrophobicContact CZ3-CB 3.72Å; L307-V310 HydrophobicContact CD1-CG2 4.11Å; L307-V310 HydrophobicContact CD2-CG2 3.78Å; L307-V310 HydrophobicContact CG-CG2 4.11Å
308	L	86.9	Confident	84.4	Confident	17 Å²	17	33.7 Å²	33.7	9%	0.089	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-32.9	-175.6	-70.6	-174.8	0	0	0	113.9	R191 F280 I292 M294 L367	R191-L308 VanDerWaalsContact CA-O 3.27Å; R191-L308 WeakPolarHBondContact CA-O 3.22Å; R191-L308 PolarHBondContact N-O 3.48Å; F280-L308 HydrophobicContact CD1-CD1 4Å; F280-L308 HydrophobicContact CE1-CD1 3.56Å; I292-L308 WeakPolarHBondContact O-CB 3.5Å; I292-L308 PolarHBondContact O-N 3.46Å; M294-L308 HydrophobicContact CB-CD1 3.64Å; M294-L308 HydrophobicContact CB-CD2 4.24Å; M294-L308 HydrophobicContact CB-CG 3.76Å; M294-L308 HydrophobicContact CG-CD1 4.34Å; M294-L308 HydrophobicContact SD-CD1 4.41Å; L308-L367 HydrophobicContact CB-CD1 4.32Å; L308-L367 HydrophobicContact CD1-CD1 4.18Å; L308-L367 HydrophobicContact CD1-CG 4.17Å
309	W	88.8	Confident	82.8	Confident	16 Å²	16	34.5 Å²	34.5	6%	0.061	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	136.8	-172	-165.6	-88.4	0	0	0	110.1	V188 C291 I292 F355 P370	V188-W309 HydrophobicContact CG1-CD2 4.45Å; V188-W309 HydrophobicContact CG1-CH2 3.97Å; V188-W309 HydrophobicContact CG1-CZ2 3.31Å; C291-W309 CarbonylContact C-O 3.6Å; C291-W309 WeakPolarHBondContact CA-O 3.06Å; C291-W309 WeakPolarHBondContact CB-O 3.46Å; I292-W309 HydrophobicContact CB-CB 4.15Å; I292-W309 HydrophobicContact CG1-CB 4.46Å; I292-W309 PolarHBondContact N-O 2.76Å; I292-W309 PolarHBondContact O-N 3.02Å; W309-F355 HydrophobicContact CD2-CE1 4.29Å; W309-F355 HydrophobicContact CG-CE1 4.38Å; W309-P370 HydrophobicContact CZ2-CG 4.1Å
310	V	90.2	Very high	81.4	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	129.7	169.5	-177.3	0	0	0	0	108.2	W170 Y173 V188 D189 P192 C291 L307 Y312	W170-V310 HydrophobicContact CH2-CG1 3.76Å; W170-V310 HydrophobicContact CH2-CG2 3.96Å; W170-V310 HydrophobicContact CZ3-CG2 3.98Å; Y173-V310 HydrophobicContact CE1-CG2 3.97Å; V188-V310 CarbonylContact C-O 3.51Å; V188-V310 WeakPolarHBondContact CA-O 3.2Å; D189-V310 HydrophobicContact CB-CB 4.19Å; D189-V310 PolarHBondContact N-O 2.88Å; D189-V310 PolarHBondContact O-N 3.14Å; P192-V310 HydrophobicContact CG-CG2 4.3Å; C291-V310 HydrophobicContact CB-CG2 4.04Å; L307-V310 HydrophobicContact CD1-CG2 4.11Å; L307-V310 HydrophobicContact CD2-CG2 3.78Å; L307-V310 HydrophobicContact CG-CG2 4.11Å; V310-Y312 HydrophobicContact CB-CE2 4.41Å; V310-Y312 HydrophobicContact CG1-CD2 3.94Å; V310-Y312 HydrophobicContact CG1-CE1 4.24Å; V310-Y312 HydrophobicContact CG1-CE2 3.29Å; V310-Y312 VanDerWaalsContact CG1-CZ 3.46Å
311	D	89.1	Confident	79.7	Confident	8 Å²	8	40.1 Å²	40.1	4%	0.043	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	119.2	-177.9	-162.1	-32.3	0	0	0	110	A289 F290 T313	A289-D311 CarbonylContact C-O 3.6Å; A289-D311 VanDerWaalsContact CA-O 3.27Å; A289-D311 WeakPolarHBondContact CA-O 3.45Å; F290-D311 HydrophobicContact CD1-CB 4Å; F290-D311 HydrophobicContact CD2-CB 4.23Å; F290-D311 HydrophobicContact CE1-CB 3.49Å; F290-D311 VanDerWaalsContact CE1-CB 3.49Å; F290-D311 HydrophobicContact CE2-CB 3.74Å; F290-D311 HydrophobicContact CG-CB 4.35Å; F290-D311 HydrophobicContact CZ-CB 3.33Å; F290-D311 VanDerWaalsContact CZ-OD2 3.32Å; F290-D311 WeakPolarHBondContact CZ-OD2 3.18Å; F290-D311 PolarHBondContact N-O 3.05Å; F290-D311 PolarHBondContact O-N 2.95Å; D311-T313 WeakPolarHBondContact OD1-CA 3.42Å; D311-T313 WeakPolarHBondContact OD1-CB 3.5Å; D311-T313 PolarHBondContact OD1-N 2.79Å; D311-T313 PolarHBondContact OD1-OG1 2.77Å
312	Y	87.5	Confident	78.3	Confident	16 Å²	16	44.8 Å²	44.8	6%	0.063	26%	0.263	C	S	.	.			trans	-103.4	11.3	176.5	-60	-79.6	0	0	0	112.2	Y174 R179 V187 A289 V310 Y314 T315	Y174-Y312 HydrophobicContact CE2-CE1 4.38Å; R179-Y312 HydrophobicContact CG-CD1 4.5Å; R179-Y312 HydrophobicContact CG-CE1 4.41Å; V187-Y312 WeakPolarHBondContact O-CA 3.28Å; V187-Y312 VanDerWaalsContact O-CB 3.25Å; V187-Y312 WeakPolarHBondContact O-CB 3.49Å; V187-Y312 PolarHBondContact O-N 3.28Å; A289-Y312 HydrophobicContact CB-CD1 3.55Å; A289-Y312 HydrophobicContact CB-CE1 3.81Å; A289-Y312 HydrophobicContact CB-CG 4.48Å; V310-Y312 HydrophobicContact CB-CE2 4.41Å; V310-Y312 HydrophobicContact CG1-CD2 3.94Å; V310-Y312 HydrophobicContact CG1-CE1 4.24Å; V310-Y312 HydrophobicContact CG1-CE2 3.29Å; V310-Y312 VanDerWaalsContact CG1-CZ 3.46Å; Y312-Y314 PolarHBondContact O-N 3.14Å; Y312-Y314 VanDerWaalsContact O-N 3.08Å; Y312-T315 HydrophobicContact CD1-CG2 3.65Å; Y312-T315 HydrophobicContact CG-CG2 4.29Å; Y312-T315 PolarHBondContact O-N 2.8Å; Y312-T315 PolarHBondContact O-OG1 2.99Å
313	T	84.8	Confident	77.3	Confident	72 Å²	72	48.7 Å²	48.7	44%	0.442	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-29.4	-174.1	-57.1	0	0	0	0	113.2	V187 D311	V187-T313 HydrophobicContact CG1-CG2 4.38Å; V187-T313 WeakPolarHBondContact CG1-OG1 3.08Å; D311-T313 WeakPolarHBondContact OD1-CA 3.42Å; D311-T313 WeakPolarHBondContact OD1-CB 3.5Å; D311-T313 PolarHBondContact OD1-N 2.79Å; D311-T313 PolarHBondContact OD1-OG1 2.77Å
314	Y	84.4	Confident	76.9	Confident	32 Å²	32	49.1 Å²	49.1	13%	0.125	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	16.6	-178.2	-46.7	-70.2	0	0	0	112.8	F290 Y312 V316 P326 L343 F345 L353	F290-Y314 HydrophobicContact CD1-CD2 4.47Å; F290-Y314 HydrophobicContact CE1-CD2 4.03Å; F290-Y314 HydrophobicContact CE1-CE2 4.04Å; Y312-Y314 PolarHBondContact O-N 3.14Å; Y312-Y314 VanDerWaalsContact O-N 3.08Å; Y314-V316 PolarHBondContact O-N 2.86Å; Y314-P326 HydrophobicContact CG-CG 4.48Å; Y314-L343 HydrophobicContact CD2-CD1 3.94Å; Y314-L343 HydrophobicContact CE2-CD1 3.47Å; Y314-L343 VanDerWaalsContact CE2-CD1 3.47Å; Y314-F345 AromaticContact CD1-CE1 3.64Å; Y314-F345 HydrophobicContact CD1-CE1 3.64Å; Y314-F345 AromaticContact CD1-CZ 3.66Å; Y314-F345 HydrophobicContact CD1-CZ 3.66Å; Y314-F345 HydrophobicContact CD2-CZ 4.36Å; Y314-F345 HydrophobicContact CE1-CE1 4.21Å; Y314-F345 AromaticContact CE1-CZ 3.8Å; Y314-F345 HydrophobicContact CE1-CZ 3.8Å; Y314-F345 HydrophobicContact CE2-CZ 4.49Å; Y314-F345 AromaticContact CG-CE1 3.93Å; Y314-F345 HydrophobicContact CG-CE1 3.93Å; Y314-F345 AromaticContact CG-CZ 3.93Å; Y314-F345 HydrophobicContact CG-CZ 3.93Å; Y314-L353 HydrophobicContact CE2-CD1 4.42Å
315	T	83.2	Confident	76.7	Confident	24 Å²	24	51.5 Å²	51.5	15%	0.147	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-69.3	127.9	172.4	53.2	0	0	0	0	110.8	S287 A289 Y312	S287-T315 VanDerWaalsContact O-CA 3.31Å; S287-T315 WeakPolarHBondContact O-CA 3.43Å; A289-T315 HydrophobicContact CB-CG2 3.54Å; Y312-T315 HydrophobicContact CD1-CG2 3.65Å; Y312-T315 HydrophobicContact CG-CG2 4.29Å; Y312-T315 PolarHBondContact O-N 2.8Å; Y312-T315 PolarHBondContact O-OG1 2.99Å
316	V	73.8	Confident	76.7	Confident	11 Å²	11	50.8 Å²	50.8	7%	0.067	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-82	122.1	168	173.8	0	0	0	0	108.3	S287 Y314 D323 R325	S287-V316 PolarHBondContact O-N 2.85Å; Y314-V316 PolarHBondContact O-N 2.86Å; V316-D323 WeakPolarHBondContact CG1-OD1 3.2Å; V316-R325 HydrophobicContact CG2-CB 3.74Å; V316-R325 HydrophobicContact CG2-CG 4.2Å
317	V	68.2	Low	76.6	Confident	40 Å²	40	51.2 Å²	51.2	24%	0.242	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-91.3	134.7	167.6	-173.6	0	0	0	0	106.3	D217 S319 D320	D217-V317 VanDerWaalsContact OD2-CG1 3.31Å; D217-V317 WeakPolarHBondContact OD2-CG1 3.08Å; V317-S319 WeakPolarHBondContact CG1-OG 3.34Å; V317-S319 PolarHBondContact O-N 2.82Å; V317-D320 WeakPolarHBondContact O-CB 3.5Å; V317-D320 PolarHBondContact O-N 2.85Å
318	R	64.1	Low	76.6	Confident	80 Å²	80	51 Å²	51	30%	0.302	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-13.9	-179.3	-71.6	-175.9	176.6	-178	6.1	114.7	M213 D217 E220 D320	M213-R318 HydrophobicContact CE-CB 3.55Å; D217-R318 PolarHBondContact OD1-N 3.38Å; E220-R318 IonicContact OE1-CZ 2.61Å; E220-R318 IonicContact OE1-NE 3.98Å; E220-R318 IonicContact OE1-NH2 2.83Å; E220-R318 PolarHBondContact OE1-NH2 3.14Å; R318-D320 PolarHBondContact O-N 3.42Å
319	S	56.5	Low	76.9	Confident	94 Å²	94	50.1 Å²	50.1	66%	0.657	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-21.4	169.7	57	0	0	0	0	113.2	V317	V317-S319 WeakPolarHBondContact CG1-OG 3.34Å; V317-S319 PolarHBondContact O-N 2.82Å
320	D	60	Low	77.1	Confident	89 Å²	89	51.5 Å²	51.5	48%	0.476	28%	0.276	S	S	.	.	S	Bend	trans	-94.2	125	-170.6	-61.8	-7.6	0	0	0	109.7	V317 R318 I322	V317-D320 WeakPolarHBondContact O-CB 3.5Å; V317-D320 PolarHBondContact O-N 2.85Å; R318-D320 PolarHBondContact O-N 3.42Å; D320-I322 PolarHBondContact O-N 2.73Å
321	S	50.4	Low	77.4	Confident	124 Å²	124	51.5 Å²	51.5	87%	0.867	28%	0.276	S	S	*	.	S	Bend	trans	-66.2	-2.4	-177.9	60.7	0	0	0	0	115.4
322	I	56.2	Low	77.6	Confident	106 Å²	106	51.4 Å²	51.4	54%	0.544	28%	0.275	S	S	.	.			trans	-117.9	100.5	-169.3	-57.4	175.1	0	0	0	109.8	D320 K324	D320-I322 PolarHBondContact O-N 2.73Å; I322-K324 HydrophobicContact CG2-CB 3.96Å; I322-K324 HydrophobicContact CG2-CD 3.85Å; I322-K324 HydrophobicContact CG2-CG 3.61Å; I322-K324 PolarHBondContact O-N 2.96Å
323	D	62.7	Low	77.9	Confident	113 Å²	113	50.6 Å²	50.6	60%	0.604	27%	0.272	S	S	*	.			trans	-76.1	42.6	176.8	-88.9	-27.1	0	0	0	113.3	V316 R325 T346	V316-D323 WeakPolarHBondContact CG1-OD1 3.2Å; D323-R325 PolarHBondContact O-N 2.94Å; D323-T346 PolarHBondContact O-OG1 3.11Å
324	K	75.7	Confident	78.2	Confident	113 Å²	113	47.5 Å²	47.5	49%	0.491	25%	0.253	S	S	.	.			trans	-89.8	92.1	174.2	-70.4	-174.6	-177.1	-143.8	0	109.8	I322 D347	I322-K324 HydrophobicContact CG2-CB 3.96Å; I322-K324 HydrophobicContact CG2-CD 3.85Å; I322-K324 HydrophobicContact CG2-CG 3.61Å; I322-K324 PolarHBondContact O-N 2.96Å; K324-D347 HydrophobicContact CD-CB 4.46Å; K324-D347 VanDerWaalsContact CD-OD2 3.31Å; K324-D347 WeakPolarHBondContact CD-OD2 3.47Å; K324-D347 WeakPolarHBondContact CE-OD2 3.45Å; K324-D347 HydrophobicContact CG-CB 4.21Å; K324-D347 IonicContact NZ-OD2 2.73Å; K324-D347 PolarHBondContact NZ-OD2 2.99Å
325	R	84.2	Confident	78.3	Confident	55 Å²	55	47.5 Å²	47.5	21%	0.208	25%	0.254	C	S	.	.			trans	-122.9	151.5	173.5	54.9	177.5	170.4	-160.4	-14.8	112.1	E220 K286 V316 D323 N327 F345 T346	E220-R325 IonicContact OE2-CZ 2.83Å; E220-R325 IonicContact OE2-NH1 3.72Å; E220-R325 PolarHBondContact OE2-NH1 2.98Å; K286-R325 WeakPolarHBondContact O-CD 3.27Å; K286-R325 PolarHBondContact O-NH1 2.97Å; V316-R325 HydrophobicContact CG2-CB 3.74Å; V316-R325 HydrophobicContact CG2-CG 4.2Å; D323-R325 PolarHBondContact O-N 2.94Å; R325-N327 PolarHBondContact O-N 3.32Å; R325-F345 WeakPolarHBondContact O-CA 3.28Å; R325-T346 HydrophobicContact CG-CG2 3.97Å; R325-T346 PolarHBondContact N-OG1 2.87Å; R325-T346 PolarHBondContact O-N 3.4Å; R325-T346 PolarHBondContact O-OG1 3.31Å
326	P	88.2	Confident	78.4	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.013	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	132.9	167.1	26.3	-32.5	0	0	0	109.5	L284 G288 Y314 G344 F345	L284-P326 HydrophobicContact CD1-CB 4.08Å; L284-P326 HydrophobicContact CD1-CG 3.82Å; G288-P326 WeakPolarHBondContact O-CG 3.34Å; Y314-P326 HydrophobicContact CG-CG 4.48Å; P326-G344 CarbonylContact C-O 3.43Å; P326-G344 WeakPolarHBondContact CA-O 3.25Å; P326-F345 HydrophobicContact CB-CE1 4.42Å; P326-F345 HydrophobicContact CB-CZ 4.49Å; P326-F345 HydrophobicContact CG-CE1 4.46Å
327	N	85.1	Confident	79.1	Confident	56 Å²	56	53.5 Å²	53.5	30%	0.299	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	-2.9	172.1	64.5	-7	0	0	0	112.2	R325 G344 T346	R325-N327 PolarHBondContact O-N 3.32Å; N327-G344 PolarHBondContact N-O 2.83Å; N327-G344 PolarHBondContact OD1-O 2.96Å; N327-T346 HydrophobicContact CB-CG2 4.25Å
328	Y	88.5	Confident	80.1	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.008	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	135.8	-179.4	179.9	-93.9	0	0	0	110.2	Y226 K330 G344 I385 L386 S388	Y226-Y328 HydrophobicContact CE1-CE2 4.42Å; Y226-Y328 AromaticContact CE2-CD2 3.82Å; Y226-Y328 HydrophobicContact CE2-CD2 3.82Å; Y226-Y328 HydrophobicContact CE2-CE2 4.02Å; Y226-Y328 AromaticContact CZ-CD2 3.94Å; Y226-Y328 AromaticContact CZ-CE2 3.67Å; Y226-Y328 VanDerWaalsContact OH-CE2 3.31Å; Y226-Y328 WeakPolarHBondContact OH-CE2 3.47Å; Y328-K330 HydrophobicContact CE1-CB 3.82Å; Y328-G344 PolarHBondContact N-O 2.72Å; Y328-G344 PolarHBondContact O-N 3.5Å; Y328-I385 HydrophobicContact CD1-CB 4.39Å; Y328-I385 HydrophobicContact CD1-CG2 3.61Å; Y328-I385 HydrophobicContact CD2-CG2 4.06Å; Y328-I385 WeakPolarHBondContact CD2-O 3.49Å; Y328-I385 HydrophobicContact CE1-CG2 3.85Å; Y328-I385 HydrophobicContact CE2-CG2 4.27Å; Y328-I385 HydrophobicContact CG-CB 4.15Å; Y328-I385 HydrophobicContact CG-CG2 3.72Å; Y328-L386 WeakPolarHBondContact CE2-O 3.39Å; Y328-S388 PolarHBondContact OH-N 3.26Å; Y328-S388 PolarHBondContact OH-OG 3.21Å
329	I	93.6	Very high	81.5	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	148.1	166.1	62.6	164.7	0	0	0	111.8	Y226 A282 L284 L341 V342 L343	Y226-I329 HydrophobicContact CD1-CG1 3.88Å; Y226-I329 VanDerWaalsContact CD1-O 3.29Å; Y226-I329 WeakPolarHBondContact CD1-O 3.42Å; Y226-I329 WeakPolarHBondContact CE1-O 3.17Å; Y226-I329 HydrophobicContact CG-CG1 4.19Å; A282-I329 HydrophobicContact CB-CD1 3.86Å; L284-I329 HydrophobicContact CB-CB 4.47Å; L284-I329 HydrophobicContact CB-CD1 3.71Å; L284-I329 HydrophobicContact CB-CG1 3.78Å; L284-I329 HydrophobicContact CB-CG2 3.88Å; L284-I329 HydrophobicContact CD1-CG2 4.03Å; L284-I329 HydrophobicContact CD2-CG2 4.07Å; L284-I329 HydrophobicContact CG-CG2 4.19Å; I329-L341 HydrophobicContact CB-CD1 4.07Å; I329-V342 CarbonylContact C-O 3.5Å; I329-V342 VanDerWaalsContact CA-O 3.25Å; I329-V342 WeakPolarHBondContact CA-O 3.24Å; I329-L343 HydrophobicContact CG2-CD2 3.51Å
330	K	93.6	Very high	83.4	Confident	44 Å²	44	44 Å²	44	19%	0.191	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	128.8	165.5	-161.2	73.1	-176.3	179.9	0	110.8	S228 Y328 Y332 L341 V342	S228-K330 WeakPolarHBondContact OG-CD 3.37Å; Y328-K330 HydrophobicContact CE1-CB 3.82Å; K330-Y332 HydrophobicContact CB-CE2 3.86Å; K330-Y332 HydrophobicContact CG-CD1 4.45Å; K330-Y332 HydrophobicContact CG-CD2 4.34Å; K330-Y332 HydrophobicContact CG-CE1 3.73Å; K330-Y332 HydrophobicContact CG-CE2 3.6Å; K330-Y332 WeakPolarHBondContact CG-OH 3.49Å; K330-L341 WeakPolarHBondContact O-CA 3.29Å; K330-V342 PolarHBondContact N-O 3.19Å; K330-V342 PolarHBondContact O-N 2.87Å
331	L	95.2	Very high	85.1	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	128.1	179	-170.2	66.3	0	0	0	109.4	S228 W229 C230 F280 A282 L339 L340 L341	S228-L331 PolarHBondContact OG-N 2.9Å; W229-L331 VanDerWaalsContact O-O 3.05Å; C230-L331 HydrophobicContact CB-CD2 3.94Å; C230-L331 HydrophobicContact CB-CG 4.19Å; F280-L331 HydrophobicContact CB-CD2 3.88Å; A282-L331 HydrophobicContact CB-CB 4.12Å; A282-L331 HydrophobicContact CB-CD2 4.13Å; L331-L339 HydrophobicContact CD1-CB 4.03Å; L331-L339 HydrophobicContact CD1-CD1 4.43Å; L331-L340 CarbonylContact C-O 3.57Å; L331-L340 WeakPolarHBondContact CA-O 3.13Å; L331-L341 HydrophobicContact CB-CD1 4.4Å; L331-L341 HydrophobicContact CD1-CB 4.24Å; L331-L341 HydrophobicContact CD1-CD1 4.21Å
332	Y	94.5	Very high	87.2	Confident	5 Å²	5	33.8 Å²	33.8	2%	0.02	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	156	178.5	-62.9	-63.2	0	0	0	111	K330 L339 L340 V342 S388 A389 W390 L397	K330-Y332 HydrophobicContact CB-CE2 3.86Å; K330-Y332 HydrophobicContact CG-CD1 4.45Å; K330-Y332 HydrophobicContact CG-CD2 4.34Å; K330-Y332 HydrophobicContact CG-CE1 3.73Å; K330-Y332 HydrophobicContact CG-CE2 3.6Å; K330-Y332 WeakPolarHBondContact CG-OH 3.49Å; Y332-L339 CarbonylContact O-C 3.53Å; Y332-L339 VanDerWaalsContact O-CA 3.32Å; Y332-L339 WeakPolarHBondContact O-CA 3.47Å; Y332-L340 PolarHBondContact N-O 2.86Å; Y332-L340 PolarHBondContact O-N 2.83Å; Y332-V342 HydrophobicContact CD2-CG2 3.96Å; Y332-V342 HydrophobicContact CE2-CG2 3.93Å; Y332-S388 VanDerWaalsContact OH-CB 3.29Å; Y332-S388 WeakPolarHBondContact OH-CB 3.39Å; Y332-S388 PolarHBondContact OH-O 3.41Å; Y332-S388 PolarHBondContact OH-OG 3.18Å; Y332-A389 WeakPolarHBondContact OH-CA 3.44Å; Y332-A389 PolarHBondContact OH-N 2.79Å; Y332-W390 HydrophobicContact CD1-CB 3.38Å; Y332-W390 HydrophobicContact CD1-CG 4.16Å; Y332-W390 HydrophobicContact CD2-CB 3.95Å; Y332-W390 HydrophobicContact CE1-CB 3.56Å; Y332-W390 HydrophobicContact CE2-CB 4.1Å; Y332-W390 HydrophobicContact CG-CB 3.55Å; Y332-W390 HydrophobicContact CG-CG 4.05Å; Y332-L397 HydrophobicContact CD2-CD1 4.15Å; Y332-L397 HydrophobicContact CE2-CD1 3.62Å
333	D	92.9	Very high	89	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	120.3	167	-56.8	-75.5	0	0	0	108.8	Q231 I232 R234 L339 W390 M392	Q231-D333 VanDerWaalsContact CA-OD2 3.26Å; Q231-D333 WeakPolarHBondContact CA-OD2 3.4Å; Q231-D333 WeakPolarHBondContact CB-OD2 3.48Å; Q231-D333 PolarHBondContact N-OD2 3.28Å; I232-D333 HydrophobicContact CD1-CB 3.77Å; I232-D333 HydrophobicContact CG1-CB 4.02Å; I232-D333 PolarHBondContact N-OD2 3.24Å; R234-D333 IonicContact CZ-OD1 2.79Å; R234-D333 IonicContact NH1-OD1 2.73Å; R234-D333 PolarHBondContact NH1-OD1 3.32Å; R234-D333 IonicContact NH2-OD1 2.81Å; R234-D333 PolarHBondContact NH2-OD1 2.82Å; D333-L339 WeakPolarHBondContact OD1-CD2 3.23Å; D333-W390 PolarHBondContact O-NE1 3.28Å; D333-M392 HydrophobicContact CB-CE 3.69Å; D333-M392 WeakPolarHBondContact O-CE 3.47Å
334	L	90.9	Very high	90.3	Very high	7 Å²	7	23.4 Å²	23.4	4%	0.037	11%	0.113	C	C	.	.	S	Bend	trans	-77.2	-40.5	169.5	-70.5	171.9	0	0	0	110.5	N338 L340 V354 W390 I410 Y443	L334-N338 HydrophobicContact CB-CB 4.11Å; L334-N338 HydrophobicContact CD1-CB 4.38Å; L334-N338 PolarHBondContact N-O 3Å; L334-L340 HydrophobicContact CD1-CB 3.88Å; L334-L340 HydrophobicContact CD2-CB 3.99Å; L334-L340 HydrophobicContact CD2-CD2 4.08Å; L334-L340 HydrophobicContact CG-CB 3.68Å; L334-V354 HydrophobicContact CD1-CG1 3.93Å; L334-V354 HydrophobicContact CD1-CG2 3.92Å; L334-W390 HydrophobicContact CD2-CH2 3.81Å; L334-W390 HydrophobicContact CD2-CZ2 3.61Å; L334-I410 HydrophobicContact CD2-CG2 4.37Å; L334-Y443 HydrophobicContact CB-CD1 4.45Å; L334-Y443 HydrophobicContact CB-CE1 3.87Å; L334-Y443 HydrophobicContact CB-CE2 4.17Å; L334-Y443 HydrophobicContact CD1-CD1 3.93Å; L334-Y443 HydrophobicContact CD1-CD2 3.71Å; L334-Y443 HydrophobicContact CD1-CE1 4.15Å; L334-Y443 HydrophobicContact CD1-CE2 3.95Å; L334-Y443 HydrophobicContact CD1-CG 3.7Å; L334-Y443 HydrophobicContact CD2-CD1 4.26Å; L334-Y443 HydrophobicContact CD2-CE1 4.33Å; L334-Y443 HydrophobicContact CG-CD1 4.46Å; L334-Y443 HydrophobicContact CG-CE1 4.35Å
335	D	87.7	Confident	90.8	Very high	31 Å²	31	18.2 Å²	18.2	17%	0.166	9%	0.09	C	C	.	.	S	Bend	trans	-154.7	-168.4	171.4	63.9	29.8	0	0	0	109.6	R234 L337 N338 K412 Y443	R234-D335 PolarHBondContact NH2-O 2.97Å; D335-L337 PolarHBondContact O-N 3.48Å; D335-L337 VanDerWaalsContact OD1-C 3.31Å; D335-L337 WeakPolarHBondContact OD1-CA 3.31Å; D335-L337 PolarHBondContact OD1-N 3.46Å; D335-N338 VanDerWaalsContact CG-ND2 3.33Å; D335-N338 PolarHBondContact N-O 3.5Å; D335-N338 WeakPolarHBondContact OD1-CB 3.19Å; D335-N338 PolarHBondContact OD1-N 3.46Å; D335-N338 PolarHBondContact OD1-ND2 2.92Å; D335-N338 PolarHBondContact OD2-ND2 3.24Å; D335-K412 IonicContact OD2-NZ 3.89Å; D335-Y443 PolarHBondContact OD2-OH 2.65Å
336	N	84.8	Confident	90.7	Very high	93 Å²	93	17.8 Å²	17.8	50%	0.497	9%	0.094	S	C	.	.	S	Bend	trans	-63.2	-20.6	179.4	-69.1	-29.3	0	0	0	114.1	R234	R234-N336 PolarHBondContact NE-O 2.98Å
337	L	87.5	Confident	90.2	Very high	68 Å²	68	19 Å²	19	36%	0.356	10%	0.1	S	C	.	.	S	Bend	trans	-121.5	-2.1	-172	-61.3	178.3	0	0	0	113.5	D335 P356 I357 Y359	D335-L337 PolarHBondContact O-N 3.48Å; D335-L337 VanDerWaalsContact OD1-C 3.31Å; D335-L337 WeakPolarHBondContact OD1-CA 3.31Å; D335-L337 PolarHBondContact OD1-N 3.46Å; L337-P356 CarbonylContact O-C 3.59Å; L337-I357 WeakPolarHBondContact O-CA 3.45Å; L337-I357 WeakPolarHBondContact O-CB 2.96Å; L337-I357 PolarHBondContact O-N 2.96Å; L337-Y359 HydrophobicContact CD2-CD2 4.47Å; L337-Y359 HydrophobicContact CD2-CE2 3.81Å
338	N	90.5	Very high	89.9	Confident	14 Å²	14	16.3 Å²	16.3	8%	0.075	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	124.9	-176.2	-65.4	-79.8	0	0	0	110.5	L334 D335 V354 Y443	L334-N338 HydrophobicContact CB-CB 4.11Å; L334-N338 HydrophobicContact CD1-CB 4.38Å; L334-N338 PolarHBondContact N-O 3Å; D335-N338 VanDerWaalsContact CG-ND2 3.33Å; D335-N338 PolarHBondContact N-O 3.5Å; D335-N338 WeakPolarHBondContact OD1-CB 3.19Å; D335-N338 PolarHBondContact OD1-N 3.46Å; D335-N338 PolarHBondContact OD1-ND2 2.92Å; D335-N338 PolarHBondContact OD2-ND2 3.24Å; N338-V354 HydrophobicContact CB-CG1 4.21Å; N338-Y443 HydrophobicContact CB-CE2 3.88Å
339	L	93.7	Very high	89.8	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	142.6	170.9	-60.6	166.9	0	0	0	109.6	C230 F280 L331 Y332 D333 V354 F355 I357 L367	C230-L339 HydrophobicContact CB-CD2 3.88Å; F280-L339 HydrophobicContact CB-CD1 4.38Å; F280-L339 HydrophobicContact CD2-CD1 3.65Å; F280-L339 HydrophobicContact CD2-CD2 4.19Å; F280-L339 HydrophobicContact CD2-CG 4.46Å; F280-L339 HydrophobicContact CE2-CD1 4.05Å; F280-L339 HydrophobicContact CG-CD1 4.03Å; L331-L339 HydrophobicContact CD1-CB 4.03Å; L331-L339 HydrophobicContact CD1-CD1 4.43Å; Y332-L339 CarbonylContact O-C 3.53Å; Y332-L339 VanDerWaalsContact O-CA 3.32Å; Y332-L339 WeakPolarHBondContact O-CA 3.47Å; D333-L339 WeakPolarHBondContact OD1-CD2 3.23Å; L339-V354 CarbonylContact O-C 3.51Å; L339-V354 VanDerWaalsContact O-CA 3.23Å; L339-V354 WeakPolarHBondContact O-CA 3.43Å; L339-F355 HydrophobicContact CB-CB 4.24Å; L339-F355 PolarHBondContact N-O 3.33Å; L339-F355 PolarHBondContact O-N 3.23Å; L339-I357 HydrophobicContact CD1-CD1 3.96Å; L339-I357 HydrophobicContact CD1-CG1 4.22Å; L339-I357 HydrophobicContact CD2-CD1 4.24Å; L339-I357 HydrophobicContact CG-CD1 3.68Å; L339-I357 HydrophobicContact CG-CG1 4.2Å; L339-L367 HydrophobicContact CD1-CD2 3.92Å
340	L	94.9	Very high	89.7	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.3	166.3	173.4	66.3	0	0	0	109	L331 Y332 L334 V342 L353 V354 F373 L397 I410	L331-L340 CarbonylContact C-O 3.57Å; L331-L340 WeakPolarHBondContact CA-O 3.13Å; Y332-L340 PolarHBondContact N-O 2.86Å; Y332-L340 PolarHBondContact O-N 2.83Å; L334-L340 HydrophobicContact CD1-CB 3.88Å; L334-L340 HydrophobicContact CD2-CB 3.99Å; L334-L340 HydrophobicContact CD2-CD2 4.08Å; L334-L340 HydrophobicContact CG-CB 3.68Å; L340-V342 HydrophobicContact CD2-CG2 3.94Å; L340-V342 HydrophobicContact CG-CG2 3.98Å; L340-L353 CarbonylContact C-O 3.6Å; L340-L353 WeakPolarHBondContact CA-O 3.01Å; L340-V354 HydrophobicContact CD1-CG2 4.16Å; L340-F373 HydrophobicContact CD1-CE1 3.82Å; L340-F373 HydrophobicContact CD1-CZ 3.87Å; L340-L397 HydrophobicContact CD2-CD2 4.26Å; L340-I410 HydrophobicContact CD2-CD1 3.89Å
341	L	96.1	Very high	89.6	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	111.2	166.5	-176.8	67.7	0	0	0	108.8	A282 F290 I329 K330 L331 L343 L353 F355	A282-L341 HydrophobicContact CB-CD1 3.92Å; F290-L341 HydrophobicContact CD2-CD2 3.64Å; F290-L341 HydrophobicContact CE2-CD2 3.51Å; F290-L341 HydrophobicContact CG-CD2 4.23Å; F290-L341 HydrophobicContact CZ-CD2 3.99Å; I329-L341 HydrophobicContact CB-CD1 4.07Å; K330-L341 WeakPolarHBondContact O-CA 3.29Å; L331-L341 HydrophobicContact CB-CD1 4.4Å; L331-L341 HydrophobicContact CD1-CB 4.24Å; L331-L341 HydrophobicContact CD1-CD1 4.21Å; L341-L343 HydrophobicContact CD2-CD2 3.93Å; L341-L343 HydrophobicContact CG-CD2 3.93Å; L341-L353 HydrophobicContact CB-CB 4.23Å; L341-L353 HydrophobicContact CD2-CD1 4.34Å; L341-L353 PolarHBondContact N-O 3.32Å; L341-L353 PolarHBondContact O-N 3.16Å; L341-F355 HydrophobicContact CB-CD2 4.32Å; L341-F355 HydrophobicContact CB-CE2 3.8Å; L341-F355 HydrophobicContact CD2-CE2 4.01Å; L341-F355 HydrophobicContact CD2-CZ 4.42Å
342	V	95.3	Very high	89.5	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126.8	173.5	-179.9	0	0	0	0	108.6	I329 K330 Y332 L340 V350 L375 L397 I399	I329-V342 CarbonylContact C-O 3.5Å; I329-V342 VanDerWaalsContact CA-O 3.25Å; I329-V342 WeakPolarHBondContact CA-O 3.24Å; K330-V342 PolarHBondContact N-O 3.19Å; K330-V342 PolarHBondContact O-N 2.87Å; Y332-V342 HydrophobicContact CD2-CG2 3.96Å; Y332-V342 HydrophobicContact CE2-CG2 3.93Å; L340-V342 HydrophobicContact CD2-CG2 3.94Å; L340-V342 HydrophobicContact CG-CG2 3.98Å; V342-V350 HydrophobicContact CG1-CG1 3.91Å; V342-L375 HydrophobicContact CG1-CD1 4.17Å; V342-L375 HydrophobicContact CG2-CD1 4.38Å; V342-L397 HydrophobicContact CG2-CD1 4.17Å; V342-L397 HydrophobicContact CG2-CD2 3.89Å; V342-I399 HydrophobicContact CG1-CD1 3.94Å
343	L	93.4	Very high	89.4	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	123	176.1	-58.3	-176.9	0	0	0	109.5	F290 Y314 I329 L341 F345 V350 K351 L353	F290-L343 HydrophobicContact CE1-CD1 4.45Å; Y314-L343 HydrophobicContact CD2-CD1 3.94Å; Y314-L343 HydrophobicContact CE2-CD1 3.47Å; Y314-L343 VanDerWaalsContact CE2-CD1 3.47Å; I329-L343 HydrophobicContact CG2-CD2 3.51Å; L341-L343 HydrophobicContact CD2-CD2 3.93Å; L341-L343 HydrophobicContact CG-CD2 3.93Å; L343-F345 HydrophobicContact CB-CD2 4.39Å; L343-F345 HydrophobicContact CB-CE2 3.67Å; L343-F345 HydrophobicContact CB-CZ 4.32Å; L343-F345 HydrophobicContact CD1-CE2 4.29Å; L343-F345 HydrophobicContact CD1-CZ 4.21Å; L343-V350 WeakPolarHBondContact O-CA 3.18Å; L343-K351 HydrophobicContact CB-CB 4.49Å; L343-K351 PolarHBondContact N-O 3.27Å; L343-K351 PolarHBondContact O-N 2.85Å; L343-L353 HydrophobicContact CD1-CD1 3.67Å; L343-L353 HydrophobicContact CD1-CG 4.34Å; L343-L353 HydrophobicContact CG-CD1 4.33Å
344	G	90.2	Very high	89.3	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.6	169.3	0	0	0	0	0	110.5	P326 N327 Y328	P326-G344 CarbonylContact C-O 3.43Å; P326-G344 WeakPolarHBondContact CA-O 3.25Å; N327-G344 PolarHBondContact N-O 2.83Å; N327-G344 PolarHBondContact OD1-O 2.96Å; Y328-G344 PolarHBondContact N-O 2.72Å; Y328-G344 PolarHBondContact O-N 3.5Å
345	F	86.7	Confident	89.3	Confident	5 Å²	5	16.9 Å²	16.9	2%	0.022	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	157.2	-175.3	-71.1	-102.9	0	0	0	112.5	Y314 R325 P326 L343 D347 G348 S349 K351	Y314-F345 AromaticContact CD1-CE1 3.64Å; Y314-F345 HydrophobicContact CD1-CE1 3.64Å; Y314-F345 AromaticContact CD1-CZ 3.66Å; Y314-F345 HydrophobicContact CD1-CZ 3.66Å; Y314-F345 HydrophobicContact CD2-CZ 4.36Å; Y314-F345 HydrophobicContact CE1-CE1 4.21Å; Y314-F345 AromaticContact CE1-CZ 3.8Å; Y314-F345 HydrophobicContact CE1-CZ 3.8Å; Y314-F345 HydrophobicContact CE2-CZ 4.49Å; Y314-F345 AromaticContact CG-CE1 3.93Å; Y314-F345 HydrophobicContact CG-CE1 3.93Å; Y314-F345 AromaticContact CG-CZ 3.93Å; Y314-F345 HydrophobicContact CG-CZ 3.93Å; R325-F345 WeakPolarHBondContact O-CA 3.28Å; P326-F345 HydrophobicContact CB-CE1 4.42Å; P326-F345 HydrophobicContact CB-CZ 4.49Å; P326-F345 HydrophobicContact CG-CE1 4.46Å; L343-F345 HydrophobicContact CB-CD2 4.39Å; L343-F345 HydrophobicContact CB-CE2 3.67Å; L343-F345 HydrophobicContact CB-CZ 4.32Å; L343-F345 HydrophobicContact CD1-CE2 4.29Å; L343-F345 HydrophobicContact CD1-CZ 4.21Å; F345-D347 VanDerWaalsContact CB-OD1 3.22Å; F345-D347 WeakPolarHBondContact CB-OD1 3.25Å; F345-D347 PolarHBondContact O-N 3.49Å; F345-G348 PolarHBondContact O-N 3.47Å; F345-S349 WeakPolarHBondContact CB-OG 3.43Å; F345-S349 PolarHBondContact N-O 3.22Å; F345-K351 HydrophobicContact CD2-CG 4.43Å; F345-K351 HydrophobicContact CE2-CB 4.16Å; F345-K351 HydrophobicContact CE2-CD 3.72Å; F345-K351 HydrophobicContact CE2-CG 3.82Å; F345-K351 HydrophobicContact CZ-CD 4.03Å
346	T	81.1	Confident	89.3	Confident	46 Å²	46	16.2 Å²	16.2	28%	0.282	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.7	175.6	45.9	0	0	0	0	114.5	D323 R325 N327 G348	D323-T346 PolarHBondContact O-OG1 3.11Å; R325-T346 HydrophobicContact CG-CG2 3.97Å; R325-T346 PolarHBondContact N-OG1 2.87Å; R325-T346 PolarHBondContact O-N 3.4Å; R325-T346 PolarHBondContact O-OG1 3.31Å; N327-T346 HydrophobicContact CB-CG2 4.25Å; T346-G348 VanDerWaalsContact C-N 3.32Å
347	D	78.3	Confident	89.4	Confident	27 Å²	27	12 Å²	12	14%	0.144	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-0.7	175.5	72.6	-14.6	0	0	0	113.5	K324 F345 S349 P379	K324-D347 HydrophobicContact CD-CB 4.46Å; K324-D347 VanDerWaalsContact CD-OD2 3.31Å; K324-D347 WeakPolarHBondContact CD-OD2 3.47Å; K324-D347 WeakPolarHBondContact CE-OD2 3.45Å; K324-D347 HydrophobicContact CG-CB 4.21Å; K324-D347 IonicContact NZ-OD2 2.73Å; K324-D347 PolarHBondContact NZ-OD2 2.99Å; F345-D347 VanDerWaalsContact CB-OD1 3.22Å; F345-D347 WeakPolarHBondContact CB-OD1 3.25Å; F345-D347 PolarHBondContact O-N 3.49Å; D347-S349 VanDerWaalsContact C-N 3.35Å; D347-S349 VanDerWaalsContact OD1-CB 3.29Å; D347-S349 WeakPolarHBondContact OD1-CB 3.23Å; D347-S349 PolarHBondContact OD1-N 2.85Å; D347-S349 PolarHBondContact OD1-OG 2.9Å; D347-P379 WeakPolarHBondContact O-CB 3.29Å
348	G	78.9	Confident	89.2	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.07	C	C	.	.	S	Bend	trans	85.9	1	-177.2	0	0	0	0	0	114.5	F345 T346 Y401	F345-G348 PolarHBondContact O-N 3.47Å; T346-G348 VanDerWaalsContact C-N 3.32Å; G348-Y401 WeakPolarHBondContact CA-OH 3.48Å; G348-Y401 WeakPolarHBondContact O-CE2 3.47Å; G348-Y401 PolarHBondContact O-OH 3.23Å; G348-Y401 VanDerWaalsContact O-OH 3.11Å
349	S	86.6	Confident	88.5	Confident	16 Å²	16	15.6 Å²	15.6	11%	0.112	8%	0.077	C	C	.	.			trans	-73.1	148.9	171.5	66	0	0	0	0	111.6	F345 D347 W376	F345-S349 WeakPolarHBondContact CB-OG 3.43Å; F345-S349 PolarHBondContact N-O 3.22Å; D347-S349 VanDerWaalsContact C-N 3.35Å; D347-S349 VanDerWaalsContact OD1-CB 3.29Å; D347-S349 WeakPolarHBondContact OD1-CB 3.23Å; D347-S349 PolarHBondContact OD1-N 2.85Å; D347-S349 PolarHBondContact OD1-OG 2.9Å; S349-W376 WeakPolarHBondContact CA-O 3.3Å
350	V	90.3	Very high	87.4	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	130.4	177.7	-167.1	0	0	0	0	110	V342 L343 L375 W376 I385 I399 Y401	V342-V350 HydrophobicContact CG1-CG1 3.91Å; L343-V350 WeakPolarHBondContact O-CA 3.18Å; V350-L375 HydrophobicContact CB-CB 4.05Å; V350-L375 HydrophobicContact CG1-CB 3.95Å; V350-L375 HydrophobicContact CG1-CD1 3.84Å; V350-L375 PolarHBondContact O-N 3.21Å; V350-W376 HydrophobicContact CB-CB 3.87Å; V350-W376 HydrophobicContact CG2-CB 3.92Å; V350-W376 PolarHBondContact N-O 3.19Å; V350-W376 PolarHBondContact O-N 3.41Å; V350-I385 HydrophobicContact CB-CD1 4.5Å; V350-I385 HydrophobicContact CG2-CD1 3.31Å; V350-I399 HydrophobicContact CG1-CD1 3.67Å; V350-Y401 HydrophobicContact CG2-CD2 4.49Å; V350-Y401 HydrophobicContact CG2-CE2 4.46Å
351	K	91.4	Very high	85.9	Confident	47 Å²	47	22.9 Å²	22.9	20%	0.204	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.2	179.6	-56.1	-174.4	-177.5	176.3	0	111	L343 F345 L372	L343-K351 HydrophobicContact CB-CB 4.49Å; L343-K351 PolarHBondContact N-O 3.27Å; L343-K351 PolarHBondContact O-N 2.85Å; F345-K351 HydrophobicContact CD2-CG 4.43Å; F345-K351 HydrophobicContact CE2-CB 4.16Å; F345-K351 HydrophobicContact CE2-CD 3.72Å; F345-K351 HydrophobicContact CE2-CG 3.82Å; F345-K351 HydrophobicContact CZ-CD 4.03Å; K351-L372 HydrophobicContact CB-CD1 3.92Å; K351-L372 HydrophobicContact CD-CD1 4.05Å; K351-L372 HydrophobicContact CD-CD2 4.32Å
352	G	93.3	Very high	84.4	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127.4	170.6	0	0	0	0	0	110.1	L372 F373	G352-L372 WeakPolarHBondContact O-CA 3.4Å; G352-F373 PolarHBondContact N-O 2.65Å; G352-F373 WeakPolarHBondContact O-CD1 2.93Å; G352-F373 PolarHBondContact O-N 2.98Å
353	L	93	Very high	83	Confident	8 Å²	8	25.1 Å²	25.1	4%	0.042	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.5	168.4	-75.8	169.1	0	0	0	108.6	F290 Y314 L340 L341 L343 F355 P370 Y371 L372	F290-L353 HydrophobicContact CE1-CD1 4.07Å; F290-L353 HydrophobicContact CZ-CD1 3.65Å; Y314-L353 HydrophobicContact CE2-CD1 4.42Å; L340-L353 CarbonylContact C-O 3.6Å; L340-L353 WeakPolarHBondContact CA-O 3.01Å; L341-L353 HydrophobicContact CB-CB 4.23Å; L341-L353 HydrophobicContact CD2-CD1 4.34Å; L341-L353 PolarHBondContact N-O 3.32Å; L341-L353 PolarHBondContact O-N 3.16Å; L343-L353 HydrophobicContact CD1-CD1 3.67Å; L343-L353 HydrophobicContact CD1-CG 4.34Å; L343-L353 HydrophobicContact CG-CD1 4.33Å; L353-F355 HydrophobicContact CB-CD2 4.45Å; L353-F355 HydrophobicContact CB-CE2 3.75Å; L353-F355 HydrophobicContact CB-CZ 4.36Å; L353-F355 HydrophobicContact CD1-CE2 4.46Å; L353-F355 HydrophobicContact CD1-CZ 4.42Å; L353-P370 HydrophobicContact CD2-CB 4.29Å; L353-P370 HydrophobicContact CD2-CG 4.49Å; L353-Y371 WeakPolarHBondContact CA-O 2.99Å; L353-L372 HydrophobicContact CD2-CB 3.96Å; L353-L372 HydrophobicContact CD2-CD1 3.46Å; L353-L372 VanDerWaalsContact CD2-CD1 3.46Å; L353-L372 HydrophobicContact CD2-CG 4.35Å; L353-L372 HydrophobicContact CG-CD1 3.83Å
354	V	91.9	Very high	81.9	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	124.2	174.6	-177.3	0	0	0	0	109.1	L334 N338 L339 L340 P356 P370 Y371 F373 Y443	L334-V354 HydrophobicContact CD1-CG1 3.93Å; L334-V354 HydrophobicContact CD1-CG2 3.92Å; N338-V354 HydrophobicContact CB-CG1 4.21Å; L339-V354 CarbonylContact O-C 3.51Å; L339-V354 VanDerWaalsContact O-CA 3.23Å; L339-V354 WeakPolarHBondContact O-CA 3.43Å; L340-V354 HydrophobicContact CD1-CG2 4.16Å; V354-P356 WeakPolarHBondContact O-CD 3.29Å; V354-P370 WeakPolarHBondContact O-CA 3.32Å; V354-P370 VanDerWaalsContact O-CB 3.27Å; V354-P370 WeakPolarHBondContact O-CB 3.44Å; V354-Y371 HydrophobicContact CB-CD1 4.01Å; V354-Y371 HydrophobicContact CB-CD2 4.45Å; V354-Y371 HydrophobicContact CB-CE1 3.45Å; V354-Y371 VanDerWaalsContact CB-CE1 3.45Å; V354-Y371 HydrophobicContact CB-CE2 3.94Å; V354-Y371 HydrophobicContact CB-CG 4.47Å; V354-Y371 HydrophobicContact CG1-CD1 4.49Å; V354-Y371 HydrophobicContact CG1-CE1 3.64Å; V354-Y371 HydrophobicContact CG2-CE1 4.11Å; V354-Y371 HydrophobicContact CG2-CE2 3.73Å; V354-Y371 VanDerWaalsContact CG2-CZ 3.49Å; V354-Y371 WeakPolarHBondContact CG2-OH 3.5Å; V354-Y371 PolarHBondContact N-O 3.02Å; V354-Y371 PolarHBondContact O-N 2.79Å; V354-Y371 VanDerWaalsContact O-N 3.14Å; V354-F373 HydrophobicContact CG2-CD1 4.11Å; V354-F373 HydrophobicContact CG2-CE1 3.57Å; V354-Y443 HydrophobicContact CG1-CD2 4.43Å
355	F	90.6	Very high	81.2	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	105.9	173.7	-63.2	-98.4	0	0	0	109.1	F290 I292 W309 L339 L341 L353 L367 P370	F290-F355 HydrophobicContact CE2-CZ 4Å; F290-F355 HydrophobicContact CZ-CZ 4.34Å; I292-F355 HydrophobicContact CD1-CD1 4.18Å; I292-F355 HydrophobicContact CD1-CD2 4.2Å; I292-F355 HydrophobicContact CD1-CE1 3.89Å; I292-F355 HydrophobicContact CD1-CE2 3.93Å; I292-F355 HydrophobicContact CD1-CG 4.33Å; I292-F355 HydrophobicContact CD1-CZ 3.77Å; W309-F355 HydrophobicContact CD2-CE1 4.29Å; W309-F355 HydrophobicContact CG-CE1 4.38Å; L339-F355 HydrophobicContact CB-CB 4.24Å; L339-F355 PolarHBondContact N-O 3.33Å; L339-F355 PolarHBondContact O-N 3.23Å; L341-F355 HydrophobicContact CB-CD2 4.32Å; L341-F355 HydrophobicContact CB-CE2 3.8Å; L341-F355 HydrophobicContact CD2-CE2 4.01Å; L341-F355 HydrophobicContact CD2-CZ 4.42Å; L353-F355 HydrophobicContact CB-CD2 4.45Å; L353-F355 HydrophobicContact CB-CE2 3.75Å; L353-F355 HydrophobicContact CB-CZ 4.36Å; L353-F355 HydrophobicContact CD1-CE2 4.46Å; L353-F355 HydrophobicContact CD1-CZ 4.42Å; F355-L367 HydrophobicContact CB-CD2 4.2Å; F355-L367 HydrophobicContact CD1-CD1 4.4Å; F355-P370 HydrophobicContact CD1-CB 3.68Å; F355-P370 HydrophobicContact CD1-CG 3.98Å; F355-P370 HydrophobicContact CD2-CB 4.26Å; F355-P370 HydrophobicContact CE1-CB 3.62Å; F355-P370 HydrophobicContact CE1-CG 3.5Å; F355-P370 HydrophobicContact CE2-CB 4.18Å; F355-P370 HydrophobicContact CG-CB 4.01Å; F355-P370 HydrophobicContact CZ-CB 3.87Å; F355-P370 HydrophobicContact CZ-CG 3.89Å
356	P	87.9	Confident	80.7	Confident	16 Å²	16	29.4 Å²	29.4	10%	0.104	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	136.5	167.2	-9.1	22.4	0	0	0	109.6	L337 V354 T368	L337-P356 CarbonylContact O-C 3.59Å; V354-P356 WeakPolarHBondContact O-CD 3.29Å; P356-T368 VanDerWaalsContact CB-OG1 3.23Å; P356-T368 WeakPolarHBondContact CB-OG1 3.31Å; P356-T368 VanDerWaalsContact CD-OG1 3.25Å; P356-T368 WeakPolarHBondContact CD-OG1 3.15Å; P356-T368 VanDerWaalsContact CG-OG1 3.27Å; P356-T368 WeakPolarHBondContact CG-OG1 3.14Å; P356-T368 PolarHBondContact O-N 2.95Å; P356-T368 PolarHBondContact O-OG1 2.81Å
357	I	86.5	Confident	80.7	Confident	6 Å²	6	27.7 Å²	27.7	3%	0.031	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	122.1	-180	-53	163	0	0	0	108.4	F280 L337 L339 L365 V366 L367	F280-I357 HydrophobicContact CE2-CD1 3.78Å; F280-I357 HydrophobicContact CE2-CG1 4.47Å; F280-I357 HydrophobicContact CZ-CD1 4.44Å; L337-I357 WeakPolarHBondContact O-CA 3.45Å; L337-I357 WeakPolarHBondContact O-CB 2.96Å; L337-I357 PolarHBondContact O-N 2.96Å; L339-I357 HydrophobicContact CD1-CD1 3.96Å; L339-I357 HydrophobicContact CD1-CG1 4.22Å; L339-I357 HydrophobicContact CD2-CD1 4.24Å; L339-I357 HydrophobicContact CG-CD1 3.68Å; L339-I357 HydrophobicContact CG-CG1 4.2Å; I357-L365 HydrophobicContact CG2-CB 4.21Å; I357-L365 HydrophobicContact CG2-CD2 3.3Å; I357-L365 HydrophobicContact CG2-CG 4.37Å; I357-V366 WeakPolarHBondContact CA-O 3.44Å; I357-L367 HydrophobicContact CG1-CD2 3.78Å
358	E	81.8	Confident	80.7	Confident	99 Å²	99	27.9 Å²	27.9	46%	0.463	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	149	177	-69.2	-174.9	170.8	0	0	110.8	L365 V366 T368	E358-L365 CarbonylContact O-C 3.6Å; E358-L365 WeakPolarHBondContact O-CA 3.14Å; E358-V366 PolarHBondContact N-O 3.48Å; E358-V366 PolarHBondContact O-N 2.98Å; E358-T368 HydrophobicContact CB-CG2 4.2Å; E358-T368 HydrophobicContact CG-CG2 3.59Å
359	Y	76.5	Confident	80.7	Confident	57 Å²	57	33.6 Å²	33.6	22%	0.224	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	121.3	167.6	-65.9	-87	0	0	0	108.5	Q235 R237 L337 L365	Q235-Y359 WeakPolarHBondContact O-CE1 3.08Å; Q235-Y359 PolarHBondContact O-OH 3.12Å; R237-Y359 HydrophobicContact CB-CD1 3.83Å; R237-Y359 HydrophobicContact CB-CD2 4.15Å; R237-Y359 HydrophobicContact CB-CE1 3.71Å; R237-Y359 HydrophobicContact CB-CE2 4.06Å; R237-Y359 HydrophobicContact CB-CG 4.02Å; R237-Y359 HydrophobicContact CG-CE1 3.92Å; R237-Y359 HydrophobicContact CG-CE2 4.06Å; L337-Y359 HydrophobicContact CD2-CD2 4.47Å; L337-Y359 HydrophobicContact CD2-CE2 3.81Å; Y359-L365 HydrophobicContact CD1-CD2 3.63Å; Y359-L365 HydrophobicContact CD1-CG 3.81Å; Y359-L365 HydrophobicContact CD2-CD2 4.32Å; Y359-L365 HydrophobicContact CE1-CD1 4Å; Y359-L365 HydrophobicContact CE1-CD2 3.26Å; Y359-L365 HydrophobicContact CE1-CG 3.55Å; Y359-L365 HydrophobicContact CE2-CD2 4Å; Y359-L365 HydrophobicContact CG-CD2 4.17Å; Y359-L365 VanDerWaalsContact CZ-CD2 3.49Å
360	S	70.3	Confident	80.6	Confident	26 Å²	26	33.9 Å²	33.9	18%	0.182	19%	0.19	C	C	.	.			trans	-58.7	162.4	169.2	74	0	0	0	0	110.2	T362 G363 I364	S360-T362 PolarHBondContact O-N 2.71Å; S360-T362 VanDerWaalsContact O-N 3.1Å; S360-T362 PolarHBondContact OG-N 2.57Å; S360-T362 PolarHBondContact OG-OG1 2.78Å; S360-G363 PolarHBondContact O-N 2.97Å; S360-G363 PolarHBondContact OG-N 2.73Å; S360-I364 WeakPolarHBondContact CB-O 3.37Å; S360-I364 PolarHBondContact N-O 3.35Å; S360-I364 WeakPolarHBondContact OG-CB 3.07Å; S360-I364 PolarHBondContact OG-N 2.95Å; S360-I364 PolarHBondContact OG-O 2.95Å
361	P	64.7	Low	80.4	Confident	128 Å²	128	36.4 Å²	36.4	83%	0.831	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-27.2	169.8	-25.2	34.9	0	0	0	113	G363	P361-G363 VanDerWaalsContact C-N 3.27Å; P361-G363 PolarHBondContact O-N 3.08Å
362	T	63	Low	80.2	Confident	47 Å²	47	38 Å²	38	29%	0.288	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-1.3	176.7	61.9	0	0	0	0	113.9	I261 S360 I364	I261-T362 HydrophobicContact CD1-CG2 3.81Å; S360-T362 PolarHBondContact O-N 2.71Å; S360-T362 VanDerWaalsContact O-N 3.1Å; S360-T362 PolarHBondContact OG-N 2.57Å; S360-T362 PolarHBondContact OG-OG1 2.78Å; T362-I364 VanDerWaalsContact C-N 3.3Å
363	G	66.7	Low	79.8	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.216	C	C	.	.	S	Bend	trans	83.3	0.8	-178.5	0	0	0	0	0	114.8	S360 P361	S360-G363 PolarHBondContact O-N 2.97Å; S360-G363 PolarHBondContact OG-N 2.73Å; P361-G363 VanDerWaalsContact C-N 3.27Å; P361-G363 PolarHBondContact O-N 3.08Å
364	I	70.8	Confident	79.4	Confident	58 Å²	58	43 Å²	43	30%	0.297	24%	0.236	S	C	.	.			trans	-77.1	135.2	177.8	-59.1	174.8	0	0	0	109.1	L275 S360 T362	L275-I364 HydrophobicContact CD2-CG1 4.48Å; S360-I364 WeakPolarHBondContact CB-O 3.37Å; S360-I364 PolarHBondContact N-O 3.35Å; S360-I364 WeakPolarHBondContact OG-CB 3.07Å; S360-I364 PolarHBondContact OG-N 2.95Å; S360-I364 PolarHBondContact OG-O 2.95Å; T362-I364 VanDerWaalsContact C-N 3.3Å
365	L	74.6	Confident	79.2	Confident	7 Å²	7	43.2 Å²	43.2	4%	0.037	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	128.5	175.9	-75.9	153.3	0	0	0	110.4	R234 V278 F280 I357 E358 Y359	R234-L365 HydrophobicContact CB-CD1 3.86Å; V278-L365 HydrophobicContact CG2-CB 4.46Å; V278-L365 HydrophobicContact CG2-CD1 3.22Å; V278-L365 HydrophobicContact CG2-CG 4.44Å; F280-L365 HydrophobicContact CZ-CB 4.48Å; I357-L365 HydrophobicContact CG2-CB 4.21Å; I357-L365 HydrophobicContact CG2-CD2 3.3Å; I357-L365 HydrophobicContact CG2-CG 4.37Å; E358-L365 CarbonylContact O-C 3.6Å; E358-L365 WeakPolarHBondContact O-CA 3.14Å; Y359-L365 HydrophobicContact CD1-CD2 3.63Å; Y359-L365 HydrophobicContact CD1-CG 3.81Å; Y359-L365 HydrophobicContact CD2-CD2 4.32Å; Y359-L365 HydrophobicContact CE1-CD1 4Å; Y359-L365 HydrophobicContact CE1-CD2 3.26Å; Y359-L365 HydrophobicContact CE1-CG 3.55Å; Y359-L365 HydrophobicContact CE2-CD2 4Å; Y359-L365 HydrophobicContact CG-CD2 4.17Å; Y359-L365 VanDerWaalsContact CZ-CD2 3.49Å
366	V	76	Confident	78.9	Confident	29 Å²	29	44.1 Å²	44.1	18%	0.176	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136	-179.4	-177.3	0	0	0	0	109	I357 E358	I357-V366 WeakPolarHBondContact CA-O 3.44Å; E358-V366 PolarHBondContact N-O 3.48Å; E358-V366 PolarHBondContact O-N 2.98Å
367	L	81.9	Confident	78.4	Confident	11 Å²	11	47.6 Å²	47.6	6%	0.058	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	129	167.9	-60	179.4	0	0	0	109	F280 I292 L308 L339 F355 I357	F280-L367 HydrophobicContact CZ-CD2 4.46Å; I292-L367 HydrophobicContact CB-CD1 4.12Å; I292-L367 HydrophobicContact CD1-CD1 3.89Å; I292-L367 HydrophobicContact CG2-CD1 3.83Å; L308-L367 HydrophobicContact CB-CD1 4.32Å; L308-L367 HydrophobicContact CD1-CD1 4.18Å; L308-L367 HydrophobicContact CD1-CG 4.17Å; L339-L367 HydrophobicContact CD1-CD2 3.92Å; F355-L367 HydrophobicContact CB-CD2 4.2Å; F355-L367 HydrophobicContact CD1-CD1 4.4Å; I357-L367 HydrophobicContact CG1-CD2 3.78Å
368	T	78.8	Confident	77.7	Confident	30 Å²	30	51.2 Å²	51.2	18%	0.184	28%	0.284	C	S	.	.			trans	-87.8	175.5	173	60.6	0	0	0	0	110.8	P356 E358 P370	P356-T368 VanDerWaalsContact CB-OG1 3.23Å; P356-T368 WeakPolarHBondContact CB-OG1 3.31Å; P356-T368 VanDerWaalsContact CD-OG1 3.25Å; P356-T368 WeakPolarHBondContact CD-OG1 3.15Å; P356-T368 VanDerWaalsContact CG-OG1 3.27Å; P356-T368 WeakPolarHBondContact CG-OG1 3.14Å; P356-T368 PolarHBondContact O-N 2.95Å; P356-T368 PolarHBondContact O-OG1 2.81Å; E358-T368 HydrophobicContact CB-CG2 4.2Å; E358-T368 HydrophobicContact CG-CG2 3.59Å; T368-P370 WeakPolarHBondContact O-CD 3.33Å
369	V	79.4	Confident	76.9	Confident	120 Å²	120	49.7 Å²	49.7	73%	0.727	28%	0.283	S	S	*	.			trans	-59.1	121.8	178	179.6	0	0	0	0	109
370	P	84.4	Confident	76.2	Confident	23 Å²	23	50.2 Å²	50.2	15%	0.149	29%	0.289	C	S	.	.			trans	-71.2	151.4	-179.9	29.9	-35.5	0	0	0	111.1	W309 L353 V354 F355 T368	W309-P370 HydrophobicContact CZ2-CG 4.1Å; L353-P370 HydrophobicContact CD2-CB 4.29Å; L353-P370 HydrophobicContact CD2-CG 4.49Å; V354-P370 WeakPolarHBondContact O-CA 3.32Å; V354-P370 VanDerWaalsContact O-CB 3.27Å; V354-P370 WeakPolarHBondContact O-CB 3.44Å; F355-P370 HydrophobicContact CD1-CB 3.68Å; F355-P370 HydrophobicContact CD1-CG 3.98Å; F355-P370 HydrophobicContact CD2-CB 4.26Å; F355-P370 HydrophobicContact CE1-CB 3.62Å; F355-P370 HydrophobicContact CE1-CG 3.5Å; F355-P370 HydrophobicContact CE2-CB 4.18Å; F355-P370 HydrophobicContact CG-CB 4.01Å; F355-P370 HydrophobicContact CZ-CB 3.87Å; F355-P370 HydrophobicContact CZ-CG 3.89Å; T368-P370 WeakPolarHBondContact O-CD 3.33Å
371	Y	84.9	Confident	75.5	Confident	53 Å²	53	58.8 Å²	58.8	21%	0.208	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	148.2	163	69.9	-91.3	0	0	0	110.7	L353 V354 F373 L442 Y443	L353-Y371 WeakPolarHBondContact CA-O 2.99Å; V354-Y371 HydrophobicContact CB-CD1 4.01Å; V354-Y371 HydrophobicContact CB-CD2 4.45Å; V354-Y371 HydrophobicContact CB-CE1 3.45Å; V354-Y371 VanDerWaalsContact CB-CE1 3.45Å; V354-Y371 HydrophobicContact CB-CE2 3.94Å; V354-Y371 HydrophobicContact CB-CG 4.47Å; V354-Y371 HydrophobicContact CG1-CD1 4.49Å; V354-Y371 HydrophobicContact CG1-CE1 3.64Å; V354-Y371 HydrophobicContact CG2-CE1 4.11Å; V354-Y371 HydrophobicContact CG2-CE2 3.73Å; V354-Y371 VanDerWaalsContact CG2-CZ 3.49Å; V354-Y371 WeakPolarHBondContact CG2-OH 3.5Å; V354-Y371 PolarHBondContact N-O 3.02Å; V354-Y371 PolarHBondContact O-N 2.79Å; V354-Y371 VanDerWaalsContact O-N 3.14Å; Y371-F373 HydrophobicContact CE2-CD1 4.1Å; Y371-L442 HydrophobicContact CD2-CD2 4.1Å; Y371-L442 HydrophobicContact CE2-CD2 3.99Å; Y371-L442 HydrophobicContact CG-CD2 4.49Å; Y371-Y443 WeakPolarHBondContact OH-CA 3.43Å; Y371-Y443 VanDerWaalsContact OH-CB 3.24Å; Y371-Y443 WeakPolarHBondContact OH-CB 3.22Å; Y371-Y443 WeakPolarHBondContact OH-CD2 3.42Å; Y371-Y443 PolarHBondContact OH-N 2.95Å
372	L	87.2	Confident	75.2	Confident	81 Å²	81	57.5 Å²	57.5	42%	0.424	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	137	-177.5	-176.5	78.8	0	0	0	109.9	K351 G352 L353	K351-L372 HydrophobicContact CB-CD1 3.92Å; K351-L372 HydrophobicContact CD-CD1 4.05Å; K351-L372 HydrophobicContact CD-CD2 4.32Å; G352-L372 WeakPolarHBondContact O-CA 3.4Å; L353-L372 HydrophobicContact CD2-CB 3.96Å; L353-L372 HydrophobicContact CD2-CD1 3.46Å; L353-L372 VanDerWaalsContact CD2-CD1 3.46Å; L353-L372 HydrophobicContact CD2-CG 4.35Å; L353-L372 HydrophobicContact CG-CD1 3.83Å
373	F	84.7	Confident	75.2	Confident	24 Å²	24	56.4 Å²	56.4	11%	0.105	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	147.7	161.9	68.3	-82.7	0	0	0	110.6	L340 G352 V354 Y371 L375 I410 V445	L340-F373 HydrophobicContact CD1-CE1 3.82Å; L340-F373 HydrophobicContact CD1-CZ 3.87Å; G352-F373 PolarHBondContact N-O 2.65Å; G352-F373 WeakPolarHBondContact O-CD1 2.93Å; G352-F373 PolarHBondContact O-N 2.98Å; V354-F373 HydrophobicContact CG2-CD1 4.11Å; V354-F373 HydrophobicContact CG2-CE1 3.57Å; Y371-F373 HydrophobicContact CE2-CD1 4.1Å; F373-L375 HydrophobicContact CD2-CD2 4.31Å; F373-L375 HydrophobicContact CD2-CG 4.39Å; F373-L375 HydrophobicContact CE2-CD2 3.48Å; F373-L375 VanDerWaalsContact CE2-CD2 3.48Å; F373-L375 HydrophobicContact CE2-CG 3.85Å; F373-L375 HydrophobicContact CZ-CD2 4.2Å; F373-I410 HydrophobicContact CZ-CD1 4.32Å; F373-V445 HydrophobicContact CD2-CG2 3.89Å; F373-V445 HydrophobicContact CE2-CG2 3.65Å
374	N	85.3	Confident	75.3	Confident	89 Å²	89	58 Å²	58	48%	0.476	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	127.8	178.2	-64.7	-47.8	0	0	0	109.3	T377	N374-T377 HydrophobicContact CB-CG2 3.58Å
375	L	87.8	Confident	75.8	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.021	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-46.7	173.7	-75.4	165.1	0	0	0	109.8	V342 V350 F373 L397 I399 F408 I410 V445	V342-L375 HydrophobicContact CG1-CD1 4.17Å; V342-L375 HydrophobicContact CG2-CD1 4.38Å; V350-L375 HydrophobicContact CB-CB 4.05Å; V350-L375 HydrophobicContact CG1-CB 3.95Å; V350-L375 HydrophobicContact CG1-CD1 3.84Å; V350-L375 PolarHBondContact O-N 3.21Å; F373-L375 HydrophobicContact CD2-CD2 4.31Å; F373-L375 HydrophobicContact CD2-CG 4.39Å; F373-L375 HydrophobicContact CE2-CD2 3.48Å; F373-L375 VanDerWaalsContact CE2-CD2 3.48Å; F373-L375 HydrophobicContact CE2-CG 3.85Å; F373-L375 HydrophobicContact CZ-CD2 4.2Å; L375-L397 HydrophobicContact CD1-CD2 3.73Å; L375-L397 HydrophobicContact CD2-CD2 3.99Å; L375-I399 HydrophobicContact CD1-CD1 4.39Å; L375-F408 HydrophobicContact CB-CE1 4.31Å; L375-F408 HydrophobicContact CB-CE2 4.45Å; L375-F408 HydrophobicContact CB-CZ 4.21Å; L375-F408 HydrophobicContact CD2-CB 4.21Å; L375-F408 HydrophobicContact CD2-CD1 4.13Å; L375-F408 HydrophobicContact CD2-CD2 4.19Å; L375-F408 HydrophobicContact CD2-CG 3.89Å; L375-F408 WeakPolarHBondContact O-CE1 3.37Å; L375-I410 HydrophobicContact CD2-CD1 4.34Å; L375-V445 HydrophobicContact CD2-CG2 3.85Å
376	W	84.8	Confident	75.9	Confident	19 Å²	19	58.2 Å²	58.2	7%	0.072	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	119.6	-177	-164.5	-104	0	0	0	110.5	S349 V350 T378 L380 L406 F408 Q448 V450	S349-W376 WeakPolarHBondContact CA-O 3.3Å; V350-W376 HydrophobicContact CB-CB 3.87Å; V350-W376 HydrophobicContact CG2-CB 3.92Å; V350-W376 PolarHBondContact N-O 3.19Å; V350-W376 PolarHBondContact O-N 3.41Å; W376-T378 PolarHBondContact NE1-O 2.68Å; W376-L380 HydrophobicContact CZ2-CD1 4.39Å; W376-L406 HydrophobicContact CB-CD1 4.2Å; W376-L406 HydrophobicContact CD2-CD1 3.87Å; W376-L406 HydrophobicContact CD2-CD2 4.18Å; W376-L406 HydrophobicContact CE3-CD1 4.38Å; W376-L406 HydrophobicContact CE3-CD2 4.28Å; W376-L406 HydrophobicContact CG-CD1 3.78Å; W376-L406 HydrophobicContact CH2-CD2 4.14Å; W376-L406 HydrophobicContact CZ2-CD2 4.03Å; W376-L406 HydrophobicContact CZ3-CD2 4.25Å; W376-F408 HydrophobicContact CB-CZ 4.12Å; W376-F408 AromaticContact CE3-CE1 3.98Å; W376-F408 HydrophobicContact CE3-CE1 3.98Å; W376-F408 AromaticContact CE3-CZ 3.99Å; W376-F408 HydrophobicContact CE3-CZ 3.99Å; W376-Q448 HydrophobicContact CZ3-CG 4.46Å; W376-V450 HydrophobicContact CH2-CG2 3.46Å; W376-V450 VanDerWaalsContact CH2-CG2 3.46Å; W376-V450 HydrophobicContact CZ2-CG2 4.16Å; W376-V450 HydrophobicContact CZ3-CG2 4.05Å
377	T	76.7	Confident	76.3	Confident	89 Å²	89	57.1 Å²	57.1	55%	0.546	30%	0.3	S	S	.	.			trans	-115.2	-7.6	-177.8	57.1	0	0	0	0	113.6	N374 P379	N374-T377 HydrophobicContact CB-CG2 3.58Å; T377-P379 WeakPolarHBondContact O-CD 3.11Å
378	T	71.7	Confident	76.7	Confident	81 Å²	81	57 Å²	57	50%	0.497	30%	0.301	S	S	.	.	S	Bend	trans	-100.3	83.6	-179.6	38.5	0	0	0	0	109.5	W376 L380	W376-T378 PolarHBondContact NE1-O 2.68Å; T378-L380 PolarHBondContact O-N 3.02Å; T378-L380 VanDerWaalsContact O-N 3.14Å
379	P	65	Low	77.3	Confident	67 Å²	67	56 Å²	56	44%	0.435	30%	0.295	S	S	.	.			trans	-62	122.3	-175.1	27.3	-35.8	0	0	0	109.9	D347 T377 Y381	D347-P379 WeakPolarHBondContact O-CB 3.29Å; T377-P379 WeakPolarHBondContact O-CD 3.11Å; P379-Y381 PolarHBondContact O-N 3.36Å
380	L	61.3	Low	77.8	Confident	69 Å²	69	50.9 Å²	50.9	36%	0.361	26%	0.263	S	S	.	.			trans	-80.7	73.9	166	-60.4	162.3	0	0	0	106.3	W376 T378 V383 Y401	W376-L380 HydrophobicContact CZ2-CD1 4.39Å; T378-L380 PolarHBondContact O-N 3.02Å; T378-L380 VanDerWaalsContact O-N 3.14Å; L380-V383 WeakPolarHBondContact O-CG2 3.3Å; L380-Y401 HydrophobicContact CB-CD1 4.45Å; L380-Y401 HydrophobicContact CB-CE1 3.79Å; L380-Y401 HydrophobicContact CD1-CD1 4.37Å; L380-Y401 HydrophobicContact CD1-CE1 4.43Å; L380-Y401 HydrophobicContact CG-CE1 4.49Å; L380-Y401 PolarHBondContact N-OH 3.47Å
381	Y	56.4	Low	78	Confident	205 Å²	205	50.2 Å²	50.2	80%	0.804	26%	0.258	S	S	*	.	S	Bend	trans	56.4	176.5	-175.8	-64.3	-85.7	0	0	0	114.8	P379 V383 Y401	P379-Y381 PolarHBondContact O-N 3.36Å; Y381-V383 PolarHBondContact O-N 3.03Å; Y381-Y401 PolarHBondContact O-OH 2.89Å
382	H	57.7	Low	78	Confident	102 Å²	102	51.1 Å²	51.1	47%	0.472	27%	0.265	S	S	.	.	S	Bend	trans	-64.3	63.8	-177.2	-67.6	-79.6	0	0	0	113.2	I92	I92-H382 WeakPolarHBondContact CD1-CD2 3.44Å
383	V	64	Low	77.9	Confident	23 Å²	23	50.9 Å²	50.9	14%	0.139	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-99.1	128	-172.2	168.6	0	0	0	0	109	L380 Y381 Y401	L380-V383 WeakPolarHBondContact O-CG2 3.3Å; Y381-V383 PolarHBondContact O-N 3.03Å; V383-Y401 HydrophobicContact CB-CD1 4.11Å; V383-Y401 HydrophobicContact CB-CE1 3.49Å; V383-Y401 VanDerWaalsContact CB-CE1 3.49Å; V383-Y401 VanDerWaalsContact CG1-C 3.41Å; V383-Y401 HydrophobicContact CG1-CD1 3.61Å; V383-Y401 HydrophobicContact CG1-CE1 3.54Å; V383-Y401 HydrophobicContact CG1-CG 4.13Å; V383-Y401 HydrophobicContact CG2-CE1 4.13Å
384	T	69.1	Low	77.9	Confident	33 Å²	33	53.7 Å²	53.7	20%	0.202	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-78.9	140.6	179	50.9	0	0	0	0	110.9	G402	T384-G402 PolarHBondContact O-N 3.33Å
385	I	80.1	Confident	78	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.026	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	119.2	170.1	-64.9	154	0	0	0	107.1	Y328 V350 I399 Y401	Y328-I385 HydrophobicContact CD1-CB 4.39Å; Y328-I385 HydrophobicContact CD1-CG2 3.61Å; Y328-I385 HydrophobicContact CD2-CG2 4.06Å; Y328-I385 WeakPolarHBondContact CD2-O 3.49Å; Y328-I385 HydrophobicContact CE1-CG2 3.85Å; Y328-I385 HydrophobicContact CE2-CG2 4.27Å; Y328-I385 HydrophobicContact CG-CB 4.15Å; Y328-I385 HydrophobicContact CG-CG2 3.72Å; V350-I385 HydrophobicContact CB-CD1 4.5Å; V350-I385 HydrophobicContact CG2-CD1 3.31Å; I385-I399 HydrophobicContact CG1-CG2 4.2Å; I385-I399 HydrophobicContact CG2-CG2 3.55Å; I385-Y401 HydrophobicContact CD1-CD2 4.06Å; I385-Y401 HydrophobicContact CD1-CE2 4.19Å; I385-Y401 HydrophobicContact CG1-CD2 3.76Å; I385-Y401 HydrophobicContact CG1-CE2 4.2Å
386	L	76.6	Confident	78.2	Confident	65 Å²	65	55 Å²	55	34%	0.34	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	-24.7	-176	-60.5	179.2	0	0	0	112.3	Y328 T461	Y328-L386 WeakPolarHBondContact CE2-O 3.39Å; L386-T461 HydrophobicContact CD1-CG2 4.06Å
387	A	83.9	Confident	78.6	Confident	7 Å²	7	54 Å²	54	6%	0.058	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	150	-175	0	0	0	0	0	111.9	G400 I463	A387-G400 PolarHBondContact O-N 3.04Å; A387-I463 HydrophobicContact CB-CB 4.25Å; A387-I463 HydrophobicContact CB-CD1 4.16Å; A387-I463 HydrophobicContact CB-CG1 3.82Å
388	S	90.9	Very high	79.3	Confident	9 Å²	9	49.8 Å²	49.8	6%	0.063	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	157	166.5	56.6	0	0	0	0	109.5	Y328 Y332 C398	Y328-S388 PolarHBondContact OH-N 3.26Å; Y328-S388 PolarHBondContact OH-OG 3.21Å; Y332-S388 VanDerWaalsContact OH-CB 3.29Å; Y332-S388 WeakPolarHBondContact OH-CB 3.39Å; Y332-S388 PolarHBondContact OH-O 3.41Å; Y332-S388 PolarHBondContact OH-OG 3.18Å; S388-C398 CarbonylContact C-O 3.53Å; S388-C398 WeakPolarHBondContact CA-O 3.5Å; S388-C398 WeakPolarHBondContact CB-O 3.44Å
389	A	90.6	Very high	80.3	Confident	9 Å²	9	46 Å²	46	7%	0.074	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	149.8	171.8	0	0	0	0	0	110.7	Y332 C398 I463 L465	Y332-A389 WeakPolarHBondContact OH-CA 3.44Å; Y332-A389 PolarHBondContact OH-N 2.79Å; A389-C398 PolarHBondContact N-O 3.35Å; A389-C398 PolarHBondContact O-N 3.47Å; A389-I463 HydrophobicContact CB-CB 4.2Å; A389-I463 HydrophobicContact CB-CG2 3.6Å; A389-L465 HydrophobicContact CB-CB 3.62Å
390	W	91.3	Very high	81.4	Confident	12 Å²	12	42.8 Å²	42.8	5%	0.045	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	137.5	179.6	167.9	-111.6	0	0	0	109.9	Y332 D333 L334 R395 L396 L397 I410	Y332-W390 HydrophobicContact CD1-CB 3.38Å; Y332-W390 HydrophobicContact CD1-CG 4.16Å; Y332-W390 HydrophobicContact CD2-CB 3.95Å; Y332-W390 HydrophobicContact CE1-CB 3.56Å; Y332-W390 HydrophobicContact CE2-CB 4.1Å; Y332-W390 HydrophobicContact CG-CB 3.55Å; Y332-W390 HydrophobicContact CG-CG 4.05Å; D333-W390 PolarHBondContact O-NE1 3.28Å; L334-W390 HydrophobicContact CD2-CH2 3.81Å; L334-W390 HydrophobicContact CD2-CZ2 3.61Å; W390-R395 VanDerWaalsContact CH2-C 3.42Å; W390-R395 VanDerWaalsContact CH2-CA 3.42Å; W390-R395 HydrophobicContact CH2-CB 3.95Å; W390-L396 WeakPolarHBondContact CA-O 3.22Å; W390-L397 HydrophobicContact CB-CD1 4.41Å; W390-L397 HydrophobicContact CE3-CB 3.76Å; W390-L397 HydrophobicContact CZ3-CB 4.09Å; W390-I410 HydrophobicContact CH2-CB 4.04Å; W390-I410 HydrophobicContact CZ3-CB 4.05Å; W390-I410 HydrophobicContact CZ3-CD1 3.93Å; W390-I410 HydrophobicContact CZ3-CG1 4.22Å
391	S	88.7	Confident	82.5	Confident	8 Å²	8	39.5 Å²	39.5	6%	0.056	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	113	170.9	171.1	0	0	0	0	108.7	S393 R394 R395 L396	S391-S393 VanDerWaalsContact C-N 3.31Å; S391-S393 PolarHBondContact OG-OG 3.47Å; S391-R394 PolarHBondContact OG-N 2.82Å; S391-R395 WeakPolarHBondContact O-CA 3.49Å; S391-R395 PolarHBondContact O-N 3.47Å; S391-L396 PolarHBondContact N-O 2.78Å; S391-L396 PolarHBondContact O-N 3.04Å; S391-L396 VanDerWaalsContact O-N 3.13Å
392	M	85.3	Confident	83.7	Confident	72 Å²	72	29.8 Å²	29.8	36%	0.355	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-35.9	176.5	-175.3	179.3	-71.7	0	0	111.8	I232 D333 R395	I232-M392 HydrophobicContact CD1-CE 3.69Å; I232-M392 HydrophobicContact CD1-SD 4.49Å; D333-M392 HydrophobicContact CB-CE 3.69Å; D333-M392 WeakPolarHBondContact O-CE 3.47Å; M392-R395 PolarHBondContact O-N 3.26Å
393	S	83.9	Confident	84.9	Confident	77 Å²	77	30 Å²	30	54%	0.538	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-45.6	-178.5	57.2	0	0	0	0	112.2	S391 N467	S391-S393 VanDerWaalsContact C-N 3.31Å; S391-S393 PolarHBondContact OG-OG 3.47Å; S393-N467 PolarHBondContact OG-OD1 2.77Å
394	R	84.5	Confident	85.9	Confident	82 Å²	82	30.9 Å²	30.9	31%	0.309	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-7	177.5	-67.8	-169.9	174.1	-114	5.3	113.6	S391 L396 N467 L484 D485	S391-R394 PolarHBondContact OG-N 2.82Å; R394-L396 HydrophobicContact CB-CB 4.06Å; R394-L396 PolarHBondContact O-N 3.21Å; R394-N467 VanDerWaalsContact CZ-O 3.23Å; R394-N467 PolarHBondContact NE-O 3.4Å; R394-N467 PolarHBondContact NH2-O 3.41Å; R394-L484 PolarHBondContact NH1-O 3.34Å; R394-L484 VanDerWaalsContact NH1-O 3.12Å; R394-D485 IonicContact CZ-OD1 2.72Å; R394-D485 IonicContact NH1-OD1 3.89Å; R394-D485 IonicContact NH2-OD1 3.31Å; R394-D485 PolarHBondContact NH2-OD1 3.43Å
395	R	88.3	Confident	86.8	Confident	113 Å²	113	29.3 Å²	29.3	43%	0.426	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	42.3	-171.7	-46.5	-179	171.6	178.4	-4.6	113.2	W390 S391 M392 I410	W390-R395 VanDerWaalsContact CH2-C 3.42Å; W390-R395 VanDerWaalsContact CH2-CA 3.42Å; W390-R395 HydrophobicContact CH2-CB 3.95Å; S391-R395 WeakPolarHBondContact O-CA 3.49Å; S391-R395 PolarHBondContact O-N 3.47Å; M392-R395 PolarHBondContact O-N 3.26Å; R395-I410 WeakPolarHBondContact CB-O 3.4Å; R395-I410 PolarHBondContact O-N 3.33Å
396	L	90.6	Very high	87.3	Confident	7 Å²	7	29.1 Å²	29.1	4%	0.037	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.2	-171.8	-171.7	70.3	0	0	0	109.8	W390 S391 R394 L407 F408 L465 L484	W390-L396 WeakPolarHBondContact CA-O 3.22Å; S391-L396 PolarHBondContact N-O 2.78Å; S391-L396 PolarHBondContact O-N 3.04Å; S391-L396 VanDerWaalsContact O-N 3.13Å; R394-L396 HydrophobicContact CB-CB 4.06Å; R394-L396 PolarHBondContact O-N 3.21Å; L396-L407 HydrophobicContact CD1-CB 4.28Å; L396-L407 HydrophobicContact CD1-CD2 4.49Å; L396-L407 HydrophobicContact CD2-CD2 4.22Å; L396-F408 WeakPolarHBondContact CA-O 3.25Å; L396-L465 HydrophobicContact CB-CD2 4.45Å; L396-L484 HydrophobicContact CD2-CD2 3.98Å
397	L	93.4	Very high	88	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	121.9	172.1	176.1	66.4	0	0	0	109.2	Y332 L340 V342 L375 W390 I399 L407 F408 I410	Y332-L397 HydrophobicContact CD2-CD1 4.15Å; Y332-L397 HydrophobicContact CE2-CD1 3.62Å; L340-L397 HydrophobicContact CD2-CD2 4.26Å; V342-L397 HydrophobicContact CG2-CD1 4.17Å; V342-L397 HydrophobicContact CG2-CD2 3.89Å; L375-L397 HydrophobicContact CD1-CD2 3.73Å; L375-L397 HydrophobicContact CD2-CD2 3.99Å; W390-L397 HydrophobicContact CB-CD1 4.41Å; W390-L397 HydrophobicContact CE3-CB 3.76Å; W390-L397 HydrophobicContact CZ3-CB 4.09Å; L397-I399 HydrophobicContact CD1-CG1 4.42Å; L397-I399 HydrophobicContact CD2-CD1 4.02Å; L397-I399 HydrophobicContact CD2-CG1 4.35Å; L397-I399 HydrophobicContact CG-CD1 4.28Å; L397-I399 HydrophobicContact CG-CG1 4.05Å; L397-L407 CarbonylContact O-C 3.59Å; L397-L407 WeakPolarHBondContact O-CA 3.49Å; L397-F408 HydrophobicContact CB-CB 4.24Å; L397-F408 HydrophobicContact CD2-CD2 4.23Å; L397-F408 HydrophobicContact CG-CD2 4.36Å; L397-F408 PolarHBondContact N-O 3.31Å; L397-F408 PolarHBondContact O-N 3.41Å; L397-I410 HydrophobicContact CB-CD1 3.88Å; L397-I410 HydrophobicContact CD2-CD1 3.93Å
398	C	92.2	Very high	88.3	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.3	176.1	-64.6	0	0	0	0	109.6	S388 A389 L405 L406 I463 L470	S388-C398 CarbonylContact C-O 3.53Å; S388-C398 WeakPolarHBondContact CA-O 3.5Å; S388-C398 WeakPolarHBondContact CB-O 3.44Å; A389-C398 PolarHBondContact N-O 3.35Å; A389-C398 PolarHBondContact O-N 3.47Å; C398-L405 HydrophobicContact CB-CD1 4.2Å; C398-L406 CarbonylContact C-O 3.57Å; C398-L406 WeakPolarHBondContact CA-O 3.3Å; C398-I463 HydrophobicContact CB-CG2 4.27Å; C398-L470 HydrophobicContact CB-CD1 4.29Å
399	I	92	Very high	88.2	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	126.9	-179.7	-53.7	-174.4	0	0	0	109.5	V342 V350 L375 I385 L397 Y401 L405 L406 F408	V342-I399 HydrophobicContact CG1-CD1 3.94Å; V350-I399 HydrophobicContact CG1-CD1 3.67Å; L375-I399 HydrophobicContact CD1-CD1 4.39Å; I385-I399 HydrophobicContact CG1-CG2 4.2Å; I385-I399 HydrophobicContact CG2-CG2 3.55Å; L397-I399 HydrophobicContact CD1-CG1 4.42Å; L397-I399 HydrophobicContact CD2-CD1 4.02Å; L397-I399 HydrophobicContact CD2-CG1 4.35Å; L397-I399 HydrophobicContact CG-CD1 4.28Å; L397-I399 HydrophobicContact CG-CG1 4.05Å; I399-Y401 PolarHBondContact O-N 3.34Å; I399-L405 WeakPolarHBondContact O-CA 3.48Å; I399-L406 HydrophobicContact CB-CB 4.32Å; I399-L406 PolarHBondContact N-O 3Å; I399-L406 PolarHBondContact O-N 2.91Å; I399-F408 HydrophobicContact CD1-CD2 4.19Å; I399-F408 HydrophobicContact CD1-CE2 3.76Å; I399-F408 HydrophobicContact CG1-CD2 4.4Å; I399-F408 HydrophobicContact CG1-CE2 4.13Å
400	G	87.8	Confident	88.2	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	103.9	172.8	0	0	0	0	0	108.4	A387	A387-G400 PolarHBondContact O-N 3.04Å
401	Y	85	Confident	88	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	84	-176.5	-167	-85.3	0	0	0	108.7	G348 V350 L380 Y381 V383 I385 I399 R403 H404 L406	G348-Y401 WeakPolarHBondContact CA-OH 3.48Å; G348-Y401 WeakPolarHBondContact O-CE2 3.47Å; G348-Y401 PolarHBondContact O-OH 3.23Å; G348-Y401 VanDerWaalsContact O-OH 3.11Å; V350-Y401 HydrophobicContact CG2-CD2 4.49Å; V350-Y401 HydrophobicContact CG2-CE2 4.46Å; L380-Y401 HydrophobicContact CB-CD1 4.45Å; L380-Y401 HydrophobicContact CB-CE1 3.79Å; L380-Y401 HydrophobicContact CD1-CD1 4.37Å; L380-Y401 HydrophobicContact CD1-CE1 4.43Å; L380-Y401 HydrophobicContact CG-CE1 4.49Å; L380-Y401 PolarHBondContact N-OH 3.47Å; Y381-Y401 PolarHBondContact O-OH 2.89Å; V383-Y401 HydrophobicContact CB-CD1 4.11Å; V383-Y401 HydrophobicContact CB-CE1 3.49Å; V383-Y401 VanDerWaalsContact CB-CE1 3.49Å; V383-Y401 VanDerWaalsContact CG1-C 3.41Å; V383-Y401 HydrophobicContact CG1-CD1 3.61Å; V383-Y401 HydrophobicContact CG1-CE1 3.54Å; V383-Y401 HydrophobicContact CG1-CG 4.13Å; V383-Y401 HydrophobicContact CG2-CE1 4.13Å; I385-Y401 HydrophobicContact CD1-CD2 4.06Å; I385-Y401 HydrophobicContact CD1-CE2 4.19Å; I385-Y401 HydrophobicContact CG1-CD2 3.76Å; I385-Y401 HydrophobicContact CG1-CE2 4.2Å; I399-Y401 PolarHBondContact O-N 3.34Å; Y401-R403 PolarHBondContact O-N 3.32Å; Y401-R403 VanDerWaalsContact O-N 3.13Å; Y401-H404 CarbonylContact C-O 3.53Å; Y401-H404 PolarHBondContact N-O 3.27Å; Y401-H404 PolarHBondContact O-N 3.21Å; Y401-L406 HydrophobicContact CD2-CD1 3.69Å; Y401-L406 HydrophobicContact CG-CD1 3.72Å; Y401-L406 HydrophobicContact CG-CG 4.14Å
402	G	81.9	Confident	87.9	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.01	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	-116.4	-171.7	0	0	0	0	0	110.7	T384 H404 Y459 V460	T384-G402 PolarHBondContact O-N 3.33Å; G402-H404 VanDerWaalsContact C-N 3.34Å; G402-Y459 CarbonylContact O-C 3.53Å; G402-Y459 WeakPolarHBondContact O-CA 3.34Å; G402-V460 PolarHBondContact O-N 3.03Å
403	R	82.7	Confident	87.6	Confident	107 Å²	107	30.9 Å²	30.9	40%	0.404	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-5.7	177.8	-49.7	-175	-63.4	-175.5	-4.1	113.3	Y401 P453 L457 G458 Y459	Y401-R403 PolarHBondContact O-N 3.32Å; Y401-R403 VanDerWaalsContact O-N 3.13Å; R403-P453 WeakPolarHBondContact O-CD 3.29Å; R403-L457 WeakPolarHBondContact CD-O 3.06Å; R403-G458 WeakPolarHBondContact CG-O 3.16Å; R403-Y459 HydrophobicContact CG-CD1 4.36Å
404	H	85.9	Confident	86.7	Confident	42 Å²	42	32 Å²	32	19%	0.194	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	158.9	-177.4	-55	89.2	0	0	0	109.7	Y401 G402 V450	Y401-H404 CarbonylContact C-O 3.53Å; Y401-H404 PolarHBondContact N-O 3.27Å; Y401-H404 PolarHBondContact O-N 3.21Å; G402-H404 VanDerWaalsContact C-N 3.34Å; H404-V450 HydrophobicContact CB-CG1 4Å
405	L	88.2	Confident	85.2	Confident	0 Å²	0	30 Å²	30	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	118.4	169.6	-175.2	77.8	0	0	0	107.7	C398 I399 L407 V450 S451 I463 L470 L492 W494	C398-L405 HydrophobicContact CB-CD1 4.2Å; I399-L405 WeakPolarHBondContact O-CA 3.48Å; L405-L407 HydrophobicContact CD2-CD1 3.79Å; L405-L407 HydrophobicContact CD2-CD2 4.21Å; L405-L407 HydrophobicContact CD2-CG 4.01Å; L405-L407 HydrophobicContact CG-CD1 4.04Å; L405-L407 HydrophobicContact CG-CG 4.25Å; L405-V450 WeakPolarHBondContact O-CA 3.45Å; L405-S451 PolarHBondContact N-O 3.03Å; L405-S451 PolarHBondContact O-N 2.53Å; L405-I463 HydrophobicContact CD1-CD1 3.54Å; L405-I463 HydrophobicContact CD1-CG1 4.47Å; L405-L470 HydrophobicContact CD1-CD2 4.47Å; L405-L470 HydrophobicContact CD2-CD2 3.27Å; L405-L470 HydrophobicContact CG-CD2 4.47Å; L405-L492 HydrophobicContact CD2-CD1 3.9Å; L405-W494 HydrophobicContact CD2-CH2 3.94Å; L405-W494 HydrophobicContact CD2-CZ2 3.73Å
406	L	89.8	Confident	83.3	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	130.3	169.2	-52.9	177.3	0	0	0	108.2	W376 C398 I399 Y401 F408 F449 V450	W376-L406 HydrophobicContact CB-CD1 4.2Å; W376-L406 HydrophobicContact CD2-CD1 3.87Å; W376-L406 HydrophobicContact CD2-CD2 4.18Å; W376-L406 HydrophobicContact CE3-CD1 4.38Å; W376-L406 HydrophobicContact CE3-CD2 4.28Å; W376-L406 HydrophobicContact CG-CD1 3.78Å; W376-L406 HydrophobicContact CH2-CD2 4.14Å; W376-L406 HydrophobicContact CZ2-CD2 4.03Å; W376-L406 HydrophobicContact CZ3-CD2 4.25Å; C398-L406 CarbonylContact C-O 3.57Å; C398-L406 WeakPolarHBondContact CA-O 3.3Å; I399-L406 HydrophobicContact CB-CB 4.32Å; I399-L406 PolarHBondContact N-O 3Å; I399-L406 PolarHBondContact O-N 2.91Å; Y401-L406 HydrophobicContact CD2-CD1 3.69Å; Y401-L406 HydrophobicContact CG-CD1 3.72Å; Y401-L406 HydrophobicContact CG-CG 4.14Å; L406-F408 HydrophobicContact CB-CD2 4.49Å; L406-F408 HydrophobicContact CB-CE2 3.52Å; L406-F408 HydrophobicContact CB-CZ 3.72Å; L406-F408 HydrophobicContact CD1-CE2 4.33Å; L406-F408 HydrophobicContact CD1-CZ 4.06Å; L406-F408 HydrophobicContact CG-CZ 4.47Å; L406-F449 WeakPolarHBondContact CA-O 3.43Å; L406-V450 HydrophobicContact CD2-CB 4.39Å; L406-V450 HydrophobicContact CD2-CG1 4.12Å; L406-V450 HydrophobicContact CD2-CG2 3.66Å
407	L	90.4	Very high	80.9	Confident	5 Å²	5	38 Å²	38	3%	0.026	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	131.7	175	-58	98.1	0	0	0	109.3	L396 L397 L405 Q448 F449 L492	L396-L407 HydrophobicContact CD1-CB 4.28Å; L396-L407 HydrophobicContact CD1-CD2 4.49Å; L396-L407 HydrophobicContact CD2-CD2 4.22Å; L397-L407 CarbonylContact O-C 3.59Å; L397-L407 WeakPolarHBondContact O-CA 3.49Å; L405-L407 HydrophobicContact CD2-CD1 3.79Å; L405-L407 HydrophobicContact CD2-CD2 4.21Å; L405-L407 HydrophobicContact CD2-CG 4.01Å; L405-L407 HydrophobicContact CG-CD1 4.04Å; L405-L407 HydrophobicContact CG-CG 4.25Å; L407-Q448 CarbonylContact O-C 3.57Å; L407-Q448 VanDerWaalsContact O-CA 3.26Å; L407-Q448 WeakPolarHBondContact O-CA 3.41Å; L407-F449 HydrophobicContact CB-CB 4.32Å; L407-F449 HydrophobicContact CB-CD2 4.46Å; L407-F449 HydrophobicContact CD1-CB 4.35Å; L407-F449 PolarHBondContact N-O 2.92Å; L407-F449 PolarHBondContact O-N 2.75Å; L407-L492 HydrophobicContact CD1-CD1 4.16Å; L407-L492 HydrophobicContact CD2-CD1 4.05Å
408	F	91	Very high	78.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.2	178.8	-54.7	-82.4	0	0	0	109.8	L375 W376 L396 L397 I399 L406 I410 V445 G447 Q448	L375-F408 HydrophobicContact CB-CE1 4.31Å; L375-F408 HydrophobicContact CB-CE2 4.45Å; L375-F408 HydrophobicContact CB-CZ 4.21Å; L375-F408 HydrophobicContact CD2-CB 4.21Å; L375-F408 HydrophobicContact CD2-CD1 4.13Å; L375-F408 HydrophobicContact CD2-CD2 4.19Å; L375-F408 HydrophobicContact CD2-CG 3.89Å; L375-F408 WeakPolarHBondContact O-CE1 3.37Å; W376-F408 HydrophobicContact CB-CZ 4.12Å; W376-F408 AromaticContact CE3-CE1 3.98Å; W376-F408 HydrophobicContact CE3-CE1 3.98Å; W376-F408 AromaticContact CE3-CZ 3.99Å; W376-F408 HydrophobicContact CE3-CZ 3.99Å; L396-F408 WeakPolarHBondContact CA-O 3.25Å; L397-F408 HydrophobicContact CB-CB 4.24Å; L397-F408 HydrophobicContact CD2-CD2 4.23Å; L397-F408 HydrophobicContact CG-CD2 4.36Å; L397-F408 PolarHBondContact N-O 3.31Å; L397-F408 PolarHBondContact O-N 3.41Å; I399-F408 HydrophobicContact CD1-CD2 4.19Å; I399-F408 HydrophobicContact CD1-CE2 3.76Å; I399-F408 HydrophobicContact CG1-CD2 4.4Å; I399-F408 HydrophobicContact CG1-CE2 4.13Å; L406-F408 HydrophobicContact CB-CD2 4.49Å; L406-F408 HydrophobicContact CB-CE2 3.52Å; L406-F408 HydrophobicContact CB-CZ 3.72Å; L406-F408 HydrophobicContact CD1-CE2 4.33Å; L406-F408 HydrophobicContact CD1-CZ 4.06Å; L406-F408 HydrophobicContact CG-CZ 4.47Å; F408-I410 HydrophobicContact CB-CG1 4.3Å; F408-V445 HydrophobicContact CB-CG1 4.43Å; F408-V445 HydrophobicContact CD1-CG1 4.12Å; F408-G447 WeakPolarHBondContact CA-O 3.27Å; F408-Q448 HydrophobicContact CD1-CB 3.83Å; F408-Q448 HydrophobicContact CE1-CB 3.95Å
409	H	89.8	Confident	75.5	Confident	72 Å²	72	47.4 Å²	47.4	33%	0.333	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	111.3	169.2	-174.6	-82.7	0	0	0	108.7	V445 K446 G447	H409-V445 CarbonylContact O-C 3.58Å; H409-K446 PolarHBondContact O-N 3.25Å; H409-G447 PolarHBondContact N-O 2.75Å
410	I	90.2	Very high	73	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	123.8	-176.1	-57.5	178.2	0	0	0	108	L334 L340 F373 L375 W390 R395 L397 F408 Y443 L444	L334-I410 HydrophobicContact CD2-CG2 4.37Å; L340-I410 HydrophobicContact CD2-CD1 3.89Å; F373-I410 HydrophobicContact CZ-CD1 4.32Å; L375-I410 HydrophobicContact CD2-CD1 4.34Å; W390-I410 HydrophobicContact CH2-CB 4.04Å; W390-I410 HydrophobicContact CZ3-CB 4.05Å; W390-I410 HydrophobicContact CZ3-CD1 3.93Å; W390-I410 HydrophobicContact CZ3-CG1 4.22Å; R395-I410 WeakPolarHBondContact CB-O 3.4Å; R395-I410 PolarHBondContact O-N 3.33Å; L397-I410 HydrophobicContact CB-CD1 3.88Å; L397-I410 HydrophobicContact CD2-CD1 3.93Å; F408-I410 HydrophobicContact CB-CG1 4.3Å; I410-Y443 HydrophobicContact CG2-CD1 4.01Å; I410-L444 CarbonylContact C-O 3.59Å; I410-L444 WeakPolarHBondContact CA-O 3.22Å
411	A	87.1	Confident	70.8	Confident	9 Å²	9	62 Å²	62	7%	0.074	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	145.3	177.6	0	0	0	0	0	111.3	Y443 L444 K446	A411-Y443 WeakPolarHBondContact O-CA 3.07Å; A411-L444 PolarHBondContact N-O 3.16Å; A411-L444 PolarHBondContact O-N 2.92Å; A411-K446 HydrophobicContact CB-CD 4.45Å; A411-K446 HydrophobicContact CB-CG 3.53Å
412	K	85.9	Confident	68.6	Low	66 Å²	66	68.7 Å²	68.7	29%	0.287	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	123.9	165.9	-168.9	178.5	-177.7	172.5	0	108.6	D335 P441 Y443	D335-K412 IonicContact OD2-NZ 3.89Å; K412-P441 HydrophobicContact CD-CB 4.1Å; K412-P441 HydrophobicContact CD-CG 4.43Å; K412-P441 HydrophobicContact CG-CB 3.8Å; K412-Y443 HydrophobicContact CB-CD1 4.08Å; K412-Y443 HydrophobicContact CB-CE1 3.74Å; K412-Y443 HydrophobicContact CD-CE2 4.49Å; K412-Y443 HydrophobicContact CG-CE1 4.31Å; K412-Y443 HydrophobicContact CG-CE2 4.31Å
413	E	78.5	Confident	66.4	Low	67 Å²	67	74.8 Å²	74.8	31%	0.313	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	112.9	173.6	-169.7	157.9	-103.9	0	0	108.9	L415 L442 L444 K446	E413-L415 PolarHBondContact O-N 3.49Å; E413-L442 PolarHBondContact N-O 3.3Å; E413-L444 HydrophobicContact CB-CD1 4.08Å; E413-L444 WeakPolarHBondContact OE2-CD1 3.21Å; E413-K446 IonicContact OE1-NZ 2.96Å; E413-K446 PolarHBondContact OE1-NZ 2.78Å
414	D	66.1	Low	64.5	Low	100 Å²	100	77.9 Å²	77.9	54%	0.535	38%	0.381	S	S	.	.			trans	-78.9	104.3	174.6	-64.3	-37.6	0	0	0	107.9	E416	D414-E416 PolarHBondContact O-N 3.48Å
415	L	53	Low	62.1	Low	40 Å²	40	83.9 Å²	83.9	21%	0.209	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	2.8	-175.2	-100.9	151.3	0	0	0	114.8	E413 I417 C418 R439 L442	E413-L415 PolarHBondContact O-N 3.49Å; L415-I417 PolarHBondContact O-N 3.16Å; L415-C418 HydrophobicContact CD2-CB 4.28Å; L415-R439 HydrophobicContact CD1-CB 4.11Å; L415-L442 HydrophobicContact CD1-CD1 3.5Å
416	E	47.2	Very low	59.4	Low	171 Å²	171	92.4 Å²	92.4	80%	0.799	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-25.5	174	-73.3	-167.9	155.9	0	0	112.6	D414	D414-E416 PolarHBondContact O-N 3.48Å
417	I	41.6	Very low	56.7	Low	118 Å²	118	101.7 Å²	101.7	61%	0.605	49%	0.492	S	S	*	.	S	Bend	trans	-87.7	-21.4	-172.4	-56.4	178.2	0	0	0	113.2	L415 F419 Q420	L415-I417 PolarHBondContact O-N 3.16Å; I417-F419 PolarHBondContact O-N 3.26Å; I417-Q420 PolarHBondContact O-N 3.06Å
418	C	35.8	Very low	54	Low	73 Å²	73	110 Å²	110	49%	0.493	53%	0.531	S	S	.	.	H	α-helix	trans	-68.3	-21.6	179.5	-81.2	0	0	0	0	113.8	L415	L415-C418 HydrophobicContact CD2-CB 4.28Å
419	F	36	Very low	51.5	Low	125 Å²	125	116.4 Å²	116.4	55%	0.548	57%	0.572	S	S	.	*	H	α-helix	trans	-87.5	-21.9	179.7	-77.7	-78.6	0	0	0	114.2	I417 Q421 Q422 N423	I417-F419 PolarHBondContact O-N 3.26Å; F419-Q421 VanDerWaalsContact C-N 3.33Å; F419-Q421 PolarHBondContact O-N 2.82Å; F419-Q422 PolarHBondContact O-N 3.42Å; F419-N423 PolarHBondContact O-N 3.4Å
420	Q	39.3	Very low	48.7	Very low	147 Å²	147	117.8 Å²	117.8	69%	0.687	59%	0.59	S	S	*	*	H	α-helix	trans	-71.5	-28.7	177.1	-76.7	-170.9	-6.2	0	0	112.7	I417	I417-Q420 PolarHBondContact O-N 3.06Å
421	Q	41.5	Very low	45.8	Very low	159 Å²	159	124.8 Å²	124.8	74%	0.743	63%	0.627	S	S	*	*	H	α-helix	trans	-77.1	-25.5	175.9	-76.6	-174	-8.2	0	0	113.6	F419	F419-Q421 VanDerWaalsContact C-N 3.33Å; F419-Q421 PolarHBondContact O-N 2.82Å
422	Q	38.3	Very low	43	Very low	140 Å²	140	132.4 Å²	132.4	65%	0.654	67%	0.666	S	S	*	*	H	α-helix	trans	-82.4	-29.6	174.8	-80.1	-173.1	-17.6	0	0	113.2	F419 Q424 H425	F419-Q422 PolarHBondContact O-N 3.42Å; Q422-Q424 VanDerWaalsContact C-N 3.26Å; Q422-Q424 PolarHBondContact O-N 3.33Å; Q422-H425 PolarHBondContact O-N 2.97Å
423	N	37.4	Very low	40.2	Very low	129 Å²	129	134.5 Å²	134.5	69%	0.69	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-5.8	-178.8	-75.7	-12.2	0	0	0	114.9	F419 H425	F419-N423 PolarHBondContact O-N 3.4Å; N423-H425 VanDerWaalsContact C-N 3.26Å; N423-H425 PolarHBondContact O-N 2.77Å
424	Q	41.4	Very low	37.7	Very low	172 Å²	172	137 Å²	137	80%	0.804	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-5.5	169.6	-74.1	-166.7	-4.4	0	0	113.8	Q422	Q422-Q424 VanDerWaalsContact C-N 3.26Å; Q422-Q424 PolarHBondContact O-N 3.33Å
425	H	36.1	Very low	35.9	Very low	169 Å²	169	138 Å²	138	78%	0.782	72%	0.721	S	S	*	*	S	Bend	trans	-118.1	7.2	-174.1	-91.2	-56.4	0	0	0	117.5	Q422 N423	Q422-H425 PolarHBondContact O-N 2.97Å; N423-H425 VanDerWaalsContact C-N 3.26Å; N423-H425 PolarHBondContact O-N 2.77Å
426	Q	32	Very low	34.8	Very low	179 Å²	179	141.2 Å²	141.2	84%	0.836	75%	0.746	S	S	*	*			trans	-136.8	92.8	172.9	-83.2	-178.8	-12.5	0	0	113	Q428	Q426-Q428 PolarHBondContact O-N 3.21Å
427	E	32.3	Very low	34	Very low	195 Å²	195	144.5 Å²	144.5	91%	0.911	75%	0.751	S	S	*	*			trans	-68	99	153.7	-70.5	-177.8	154.3	0	0	109
428	Q	33.2	Very low	33.7	Very low	180 Å²	180	142.2 Å²	142.2	84%	0.841	76%	0.756	S	S	*	*			trans	-170.6	128.2	141.2	-109	173	13.3	0	0	110.8	Q426	Q426-Q428 PolarHBondContact O-N 3.21Å
429	P	40	Very low	34.3	Very low	134 Å²	134	148.2 Å²	148.2	87%	0.87	77%	0.768	S	S	*	*			trans	-92.2	112.5	-174.9	33.9	-28.4	0	0	0	110.3
430	S	29.9	Very low	35.2	Very low	101 Å²	101	147.1 Å²	147.1	71%	0.706	77%	0.768	S	S	*	*			trans	-148.2	111.9	161.8	63.1	0	0	0	0	112.1
431	N	28.6	Very low	36.1	Very low	146 Å²	146	141.7 Å²	141.7	78%	0.781	75%	0.746	S	S	*	*	S	Bend	trans	68.2	104.3	148.6	-59.8	-19.4	0	0	0	118.9	S433	N431-S433 PolarHBondContact O-N 3.48Å
432	L	28.5	Very low	37.8	Very low	169 Å²	169	136.8 Å²	136.8	89%	0.885	72%	0.724	S	S	*	*			trans	36.4	68.4	147	-74.1	102	0	0	0	115.2	T434	L432-T434 PolarHBondContact O-N 2.73Å
433	S	27.6	Very low	40.1	Very low	111 Å²	111	130.6 Å²	130.6	78%	0.776	70%	0.695	S	S	*	*			trans	-65.7	103.8	156.2	57.1	0	0	0	0	107.8	N431	N431-S433 PolarHBondContact O-N 3.48Å
434	T	25.8	Very low	42.4	Very low	120 Å²	120	127.4 Å²	127.4	74%	0.736	68%	0.677	S	S	*	*			trans	-43.3	130.2	159.3	20	0	0	0	0	108.1	L432 C436	L432-T434 PolarHBondContact O-N 2.73Å; T434-C436 PolarHBondContact O-N 3.04Å
435	P	29.1	Very low	44.6	Very low	120 Å²	120	121.4 Å²	121.4	78%	0.779	65%	0.653	S	S	*	*			trans	-59.5	109.3	179.8	23.9	-30.2	0	0	0	106.4	R437	P435-R437 PolarHBondContact O-N 2.88Å
436	C	28.4	Very low	46.9	Very low	108 Å²	108	119 Å²	119	73%	0.73	64%	0.64	S	S	*	*			trans	-51.4	114.3	173	-68.6	0	0	0	0	105.6	T434 G438	T434-C436 PolarHBondContact O-N 3.04Å; C436-G438 PolarHBondContact O-N 2.91Å
437	R	30.5	Very low	49.4	Very low	240 Å²	240	111.4 Å²	111.4	91%	0.906	61%	0.609	S	S	*	*			trans	-42.2	114.8	168.9	-85.4	-175.8	176.1	-177.1	-1	106	P435 R439	P435-R437 PolarHBondContact O-N 2.88Å; R437-R439 PolarHBondContact O-N 2.81Å
438	G	36.1	Very low	52	Low	69 Å²	69	107.1 Å²	107.1	71%	0.711	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-47.1	119.2	-178.1	0	0	0	0	0	107.6	C436 D440	C436-G438 PolarHBondContact O-N 2.91Å; G438-D440 PolarHBondContact O-N 2.71Å
439	R	47.4	Very low	54.5	Low	199 Å²	199	101.3 Å²	101.3	75%	0.751	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-57.2	131.6	173.6	-82.6	-176	178.8	177.3	0.1	106.6	L415 R437	L415-R439 HydrophobicContact CD1-CB 4.11Å; R437-R439 PolarHBondContact O-N 2.81Å
440	D	55.1	Low	56.7	Low	102 Å²	102	97.6 Å²	97.6	55%	0.545	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-51.8	141.5	176.5	-66.2	-53.4	0	0	0	109.8	G438 L442	G438-D440 PolarHBondContact O-N 2.71Å; D440-L442 PolarHBondContact O-N 3.34Å
441	P	59.4	Low	59.4	Low	34 Å²	34	93.1 Å²	93.1	22%	0.221	51%	0.505	C	S	.	.	P	Polyproline II helix	trans	-57.9	131.2	-176	22.7	-33.3	0	0	0	110.7	K412	K412-P441 HydrophobicContact CD-CB 4.1Å; K412-P441 HydrophobicContact CD-CG 4.43Å; K412-P441 HydrophobicContact CG-CB 3.8Å
442	L	77.1	Confident	62.1	Low	55 Å²	55	91.7 Å²	91.7	29%	0.288	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.6	-178.1	-90.9	133.3	0	0	0	110	Y371 E413 L415 D440	Y371-L442 HydrophobicContact CD2-CD2 4.1Å; Y371-L442 HydrophobicContact CE2-CD2 3.99Å; Y371-L442 HydrophobicContact CG-CD2 4.49Å; E413-L442 PolarHBondContact N-O 3.3Å; L415-L442 HydrophobicContact CD1-CD1 3.5Å; D440-L442 PolarHBondContact O-N 3.34Å
443	Y	85.6	Confident	64.8	Low	11 Å²	11	83.7 Å²	83.7	4%	0.043	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	132	168.8	-73	-94.3	0	0	0	109.2	L334 D335 N338 V354 Y371 I410 A411 K412	L334-Y443 HydrophobicContact CB-CD1 4.45Å; L334-Y443 HydrophobicContact CB-CE1 3.87Å; L334-Y443 HydrophobicContact CB-CE2 4.17Å; L334-Y443 HydrophobicContact CD1-CD1 3.93Å; L334-Y443 HydrophobicContact CD1-CD2 3.71Å; L334-Y443 HydrophobicContact CD1-CE1 4.15Å; L334-Y443 HydrophobicContact CD1-CE2 3.95Å; L334-Y443 HydrophobicContact CD1-CG 3.7Å; L334-Y443 HydrophobicContact CD2-CD1 4.26Å; L334-Y443 HydrophobicContact CD2-CE1 4.33Å; L334-Y443 HydrophobicContact CG-CD1 4.46Å; L334-Y443 HydrophobicContact CG-CE1 4.35Å; D335-Y443 PolarHBondContact OD2-OH 2.65Å; N338-Y443 HydrophobicContact CB-CE2 3.88Å; V354-Y443 HydrophobicContact CG1-CD2 4.43Å; Y371-Y443 WeakPolarHBondContact OH-CA 3.43Å; Y371-Y443 VanDerWaalsContact OH-CB 3.24Å; Y371-Y443 WeakPolarHBondContact OH-CB 3.22Å; Y371-Y443 WeakPolarHBondContact OH-CD2 3.42Å; Y371-Y443 PolarHBondContact OH-N 2.95Å; I410-Y443 HydrophobicContact CG2-CD1 4.01Å; A411-Y443 WeakPolarHBondContact O-CA 3.07Å; K412-Y443 HydrophobicContact CB-CD1 4.08Å; K412-Y443 HydrophobicContact CB-CE1 3.74Å; K412-Y443 HydrophobicContact CD-CE2 4.49Å; K412-Y443 HydrophobicContact CG-CE1 4.31Å; K412-Y443 HydrophobicContact CG-CE2 4.31Å
444	L	86.8	Confident	67.3	Low	61 Å²	61	84.6 Å²	84.6	32%	0.319	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	151.2	-175.8	-65.2	162.3	0	0	0	110.3	I410 A411 E413 K446	I410-L444 CarbonylContact C-O 3.59Å; I410-L444 WeakPolarHBondContact CA-O 3.22Å; A411-L444 PolarHBondContact N-O 3.16Å; A411-L444 PolarHBondContact O-N 2.92Å; E413-L444 HydrophobicContact CB-CD1 4.08Å; E413-L444 WeakPolarHBondContact OE2-CD1 3.21Å; L444-K446 PolarHBondContact O-N 2.83Å
445	V	87.3	Confident	69.9	Low	47 Å²	47	81.2 Å²	81.2	29%	0.285	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	114.7	171.4	-177.4	0	0	0	0	108.4	F373 L375 F408 H409 G447	F373-V445 HydrophobicContact CD2-CG2 3.89Å; F373-V445 HydrophobicContact CE2-CG2 3.65Å; L375-V445 HydrophobicContact CD2-CG2 3.85Å; F408-V445 HydrophobicContact CB-CG1 4.43Å; F408-V445 HydrophobicContact CD1-CG1 4.12Å; H409-V445 CarbonylContact O-C 3.58Å; V445-G447 WeakPolarHBondContact CG1-O 3.48Å
446	K	85	Confident	72.2	Confident	119 Å²	119	75.8 Å²	75.8	52%	0.517	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-22.8	176.1	-67.4	-66.8	-177	-175.1	0	112.7	H409 A411 E413 L444	H409-K446 PolarHBondContact O-N 3.25Å; A411-K446 HydrophobicContact CB-CD 4.45Å; A411-K446 HydrophobicContact CB-CG 3.53Å; E413-K446 IonicContact OE1-NZ 2.96Å; E413-K446 PolarHBondContact OE1-NZ 2.78Å; L444-K446 PolarHBondContact O-N 2.83Å
447	G	84	Confident	74.5	Confident	19 Å²	19	77 Å²	77	20%	0.196	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	149.4	178.8	0	0	0	0	0	111	F408 H409 V445	F408-G447 WeakPolarHBondContact CA-O 3.27Å; H409-G447 PolarHBondContact N-O 2.75Å; V445-G447 WeakPolarHBondContact CG1-O 3.48Å
448	Q	86.4	Confident	76.5	Confident	104 Å²	104	66.2 Å²	66.2	49%	0.486	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	139.2	175.7	67.2	-179.9	18.1	0	0	109.9	W376 L407 F408	W376-Q448 HydrophobicContact CZ3-CG 4.46Å; L407-Q448 CarbonylContact O-C 3.57Å; L407-Q448 VanDerWaalsContact O-CA 3.26Å; L407-Q448 WeakPolarHBondContact O-CA 3.41Å; F408-Q448 HydrophobicContact CD1-CB 3.83Å; F408-Q448 HydrophobicContact CE1-CB 3.95Å
449	F	86	Confident	78.6	Confident	58 Å²	58	67 Å²	67	25%	0.254	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	148.8	-178.3	-49.1	-74.8	0	0	0	110	L406 L407 C490	L406-F449 WeakPolarHBondContact CA-O 3.43Å; L407-F449 HydrophobicContact CB-CB 4.32Å; L407-F449 HydrophobicContact CB-CD2 4.46Å; L407-F449 HydrophobicContact CD1-CB 4.35Å; L407-F449 PolarHBondContact N-O 2.92Å; L407-F449 PolarHBondContact O-N 2.75Å; F449-C490 WeakPolarHBondContact CD1-SG 3.24Å
450	V	86.2	Confident	80.1	Confident	56 Å²	56	57.6 Å²	57.6	34%	0.339	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122.2	174.2	-173.4	0	0	0	0	108	W376 H404 L405 L406	W376-V450 HydrophobicContact CH2-CG2 3.46Å; W376-V450 VanDerWaalsContact CH2-CG2 3.46Å; W376-V450 HydrophobicContact CZ2-CG2 4.16Å; W376-V450 HydrophobicContact CZ3-CG2 4.05Å; H404-V450 HydrophobicContact CB-CG1 4Å; L405-V450 WeakPolarHBondContact O-CA 3.45Å; L406-V450 HydrophobicContact CD2-CB 4.39Å; L406-V450 HydrophobicContact CD2-CG1 4.12Å; L406-V450 HydrophobicContact CD2-CG2 3.66Å
451	S	86.5	Confident	81.2	Confident	8 Å²	8	53.1 Å²	53.1	6%	0.056	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	142.4	173.2	165	0	0	0	0	109.3	L405 W494	L405-S451 PolarHBondContact N-O 3.03Å; L405-S451 PolarHBondContact O-N 2.53Å; S451-W494 PolarHBondContact OG-NE1 3.04Å
452	Q	85.5	Confident	82.2	Confident	115 Å²	115	51.6 Å²	51.6	54%	0.537	27%	0.268	S	S	.	.			trans	-113.3	105	172	-171.5	-180	-7.8	0	0	109.3	N454	Q452-N454 PolarHBondContact O-N 3.36Å
453	P	84.3	Confident	82.5	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.006	26%	0.257	C	S	.	.			trans	-63.8	126	174.4	-17.9	31.1	0	0	0	111.3	R403 I456 L472 M480 W494	R403-P453 WeakPolarHBondContact O-CD 3.29Å; P453-I456 HydrophobicContact CB-CD1 4.01Å; P453-I456 PolarHBondContact O-N 3.28Å; P453-L472 HydrophobicContact CB-CD2 4.2Å; P453-L472 HydrophobicContact CG-CD2 3.62Å; P453-M480 HydrophobicContact CB-SD 4.11Å; P453-W494 HydrophobicContact CB-CD2 3.89Å; P453-W494 HydrophobicContact CB-CE3 4.47Å; P453-W494 HydrophobicContact CB-CG 4.07Å; P453-W494 HydrophobicContact CB-CZ2 4.36Å; P453-W494 HydrophobicContact CG-CD2 4.23Å; P453-W494 HydrophobicContact CG-CH2 4.36Å; P453-W494 HydrophobicContact CG-CZ2 3.78Å
454	N	81.2	Confident	82.5	Confident	131 Å²	131	52 Å²	52	70%	0.701	27%	0.269	S	S	*	.	S	Bend	trans	-108.4	129.2	175	-171.8	-7.5	0	0	0	107.7	Q452 M480	Q452-N454 PolarHBondContact O-N 3.36Å; N454-M480 WeakPolarHBondContact O-CE 3.44Å
455	P	79.9	Confident	82.4	Confident	49 Å²	49	49.9 Å²	49.9	32%	0.318	26%	0.258	S	S	.	.	S	Bend	cis	-107.2	30.4	19.9	41.7	-35.9	0	0	0	117	L457 Y478	P455-L457 PolarHBondContact O-N 3.12Å; P455-Y478 HydrophobicContact CG-CE1 3.99Å
456	I	78	Confident	82	Confident	6 Å²	6	50 Å²	50	3%	0.031	26%	0.257	C	S	.	.			trans	-62.6	129.7	-179.6	-69.8	170.8	0	0	0	111	P453 G458 L472 Y478 M480	P453-I456 HydrophobicContact CB-CD1 4.01Å; P453-I456 PolarHBondContact O-N 3.28Å; I456-G458 WeakPolarHBondContact CG2-O 3.49Å; I456-L472 HydrophobicContact CD1-CD1 3.27Å; I456-Y478 HydrophobicContact CG1-CD2 4.03Å; I456-Y478 HydrophobicContact CG1-CG 4.24Å; I456-M480 HydrophobicContact CD1-CG 4.15Å; I456-M480 HydrophobicContact CD1-SD 3.28Å; I456-M480 WeakPolarHBondContact CD1-SD 3.37Å; I456-M480 HydrophobicContact CG1-SD 3.57Å; I456-M480 VanDerWaalsContact CG1-SD 3.57Å
457	L	76.4	Confident	81.5	Confident	134 Å²	134	49.3 Å²	49.3	70%	0.702	26%	0.258	S	S	*	.			trans	-108.1	-22.7	177.1	-65.1	179.2	0	0	0	112.7	R403 P455 D476	R403-L457 WeakPolarHBondContact CD-O 3.06Å; P455-L457 PolarHBondContact O-N 3.12Å; L457-D476 PolarHBondContact N-OD2 3.28Å
458	G	72.9	Confident	81.3	Confident	13 Å²	13	54.5 Å²	54.5	13%	0.134	28%	0.278	C	S	.	.	S	Bend	trans	-108.4	-174.1	180	0	0	0	0	0	112.9	R403 I456 D476	R403-G458 WeakPolarHBondContact CG-O 3.16Å; I456-G458 WeakPolarHBondContact CG2-O 3.49Å; G458-D476 VanDerWaalsContact CA-OD1 3.23Å; G458-D476 WeakPolarHBondContact CA-OD1 3.32Å; G458-D476 WeakPolarHBondContact CA-OD2 3.35Å; G458-D476 VanDerWaalsContact N-CG 3.26Å; G458-D476 PolarHBondContact N-OD1 3.47Å; G458-D476 VanDerWaalsContact N-OD1 3.15Å; G458-D476 PolarHBondContact N-OD2 2.95Å
459	Y	79.6	Confident	81.3	Confident	86 Å²	86	52.5 Å²	52.5	34%	0.337	27%	0.268	S	S	.	.			trans	-76.5	144.3	-169.6	-58	-52.6	0	0	0	112.9	G402 R403 T461 S474 V475	G402-Y459 CarbonylContact O-C 3.53Å; G402-Y459 WeakPolarHBondContact O-CA 3.34Å; R403-Y459 HydrophobicContact CG-CD1 4.36Å; Y459-T461 PolarHBondContact O-N 3.24Å; Y459-S474 CarbonylContact O-C 3.59Å; Y459-S474 VanDerWaalsContact O-CA 3.22Å; Y459-S474 WeakPolarHBondContact O-CA 3.4Å; Y459-S474 WeakPolarHBondContact O-CB 3.48Å; Y459-V475 PolarHBondContact O-N 3.39Å
460	V	79.9	Confident	81.4	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	122.1	166.5	177.6	0	0	0	0	107.8	G402 I463 L472 T473	G402-V460 PolarHBondContact O-N 3.03Å; V460-I463 HydrophobicContact CG1-CD1 3.95Å; V460-I463 HydrophobicContact CG1-CG1 3.67Å; V460-L472 HydrophobicContact CG1-CB 4.29Å; V460-L472 HydrophobicContact CG2-CD2 4.47Å; V460-T473 WeakPolarHBondContact CA-O 3.35Å
461	T	77.5	Confident	81.4	Confident	7 Å²	7	49.1 Å²	49.1	4%	0.043	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-17.5	-175.3	56.1	0	0	0	0	113.5	L386 Y459 T473 V475 F513 G515	L386-T461 HydrophobicContact CD1-CG2 4.06Å; Y459-T461 PolarHBondContact O-N 3.24Å; T461-T473 PolarHBondContact N-O 3.35Å; T461-T473 PolarHBondContact OG1-O 3.15Å; T461-T473 PolarHBondContact OG1-OG1 3.37Å; T461-V475 HydrophobicContact CG2-CB 4.33Å; T461-V475 HydrophobicContact CG2-CG2 3.27Å; T461-F513 VanDerWaalsContact CB-O 3.24Å; T461-F513 WeakPolarHBondContact CB-O 3.31Å; T461-F513 WeakPolarHBondContact CG2-O 3.49Å; T461-F513 PolarHBondContact OG1-O 2.92Å; T461-G515 WeakPolarHBondContact O-CA 3.27Å
462	G	79.8	Confident	81.3	Confident	2 Å²	2	48.7 Å²	48.7	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	140.9	-176.9	0	0	0	0	0	110.2	L472 T473	G462-L472 CarbonylContact O-C 3.57Å; G462-L472 WeakPolarHBondContact O-CA 3.07Å; G462-L472 WeakPolarHBondContact O-CB 3.14Å; G462-T473 VanDerWaalsContact CA-OG1 3.28Å; G462-T473 WeakPolarHBondContact CA-OG1 3.02Å; G462-T473 PolarHBondContact N-O 3.22Å; G462-T473 PolarHBondContact N-OG1 3.05Å; G462-T473 VanDerWaalsContact N-OG1 3.16Å; G462-T473 PolarHBondContact O-N 3.29Å
463	I	84.7	Confident	81	Confident	12 Å²	12	43.2 Å²	43.2	6%	0.062	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	132.1	176.5	-59.7	175.9	0	0	0	107.5	A387 A389 C398 L405 V460 L470 L471 L472	A387-I463 HydrophobicContact CB-CB 4.25Å; A387-I463 HydrophobicContact CB-CD1 4.16Å; A387-I463 HydrophobicContact CB-CG1 3.82Å; A389-I463 HydrophobicContact CB-CB 4.2Å; A389-I463 HydrophobicContact CB-CG2 3.6Å; C398-I463 HydrophobicContact CB-CG2 4.27Å; L405-I463 HydrophobicContact CD1-CD1 3.54Å; L405-I463 HydrophobicContact CD1-CG1 4.47Å; V460-I463 HydrophobicContact CG1-CD1 3.95Å; V460-I463 HydrophobicContact CG1-CG1 3.67Å; I463-L470 HydrophobicContact CG2-CD1 3.43Å; I463-L470 VanDerWaalsContact CG2-CD1 3.43Å; I463-L471 CarbonylContact C-O 3.53Å; I463-L471 WeakPolarHBondContact CA-O 3.31Å; I463-L472 HydrophobicContact CG1-CB 4.4Å
464	H	85.4	Confident	80.6	Confident	64 Å²	64	43.2 Å²	43.2	30%	0.296	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	131.8	169.1	-176.7	76	0	0	0	108.9	L471 L516	H464-L471 HydrophobicContact CB-CB 4.28Å; H464-L471 PolarHBondContact N-O 3.13Å; H464-L471 PolarHBondContact O-N 3.13Å; H464-L516 HydrophobicContact CB-CD2 3.96Å
465	L	83.7	Confident	80.1	Confident	16 Å²	16	38.6 Å²	38.6	8%	0.084	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	118.6	-177.4	-177.2	71.3	0	0	0	107.4	A389 L396 L470 L484	A389-L465 HydrophobicContact CB-CB 3.62Å; L396-L465 HydrophobicContact CB-CD2 4.45Å; L465-L470 HydrophobicContact CB-CD1 4.21Å; L465-L470 HydrophobicContact CD1-CB 4.08Å; L465-L470 HydrophobicContact CD1-CD1 3.8Å; L465-L484 HydrophobicContact CD1-CD1 3.39Å; L465-L484 HydrophobicContact CD1-CD2 3.79Å; L465-L484 HydrophobicContact CD1-CG 4.14Å; L465-L484 HydrophobicContact CG-CD1 4.4Å
466	D	78.5	Confident	79.6	Confident	50 Å²	50	37.9 Å²	37.9	27%	0.267	19%	0.192	S	C	.	.			trans	-105	-169.6	167.6	69.4	47.9	0	0	0	109.7	E468 Q469 L484	D466-E468 VanDerWaalsContact C-N 3.33Å; D466-E468 PolarHBondContact OD1-N 3.04Å; D466-Q469 PolarHBondContact N-O 3.39Å; D466-Q469 PolarHBondContact OD1-N 3.07Å; D466-L484 WeakPolarHBondContact O-CD1 3.37Å
467	N	75.4	Confident	79.3	Confident	103 Å²	103	37.6 Å²	37.6	55%	0.551	19%	0.191	S	C	*	.	S	Bend	trans	-75.5	-18.5	-176.7	-74.4	-23	0	0	0	113.9	S393 R394	S393-N467 PolarHBondContact OG-OD1 2.77Å; R394-N467 VanDerWaalsContact CZ-O 3.23Å; R394-N467 PolarHBondContact NE-O 3.4Å; R394-N467 PolarHBondContact NH2-O 3.41Å
468	E	79.7	Confident	79.3	Confident	129 Å²	129	33.8 Å²	33.8	60%	0.603	17%	0.167	S	C	*	.	S	Bend	trans	-118.9	-32.6	-173.4	-63.5	-171.5	174.1	0	0	112	D466 L484	D466-E468 VanDerWaalsContact C-N 3.33Å; D466-E468 PolarHBondContact OD1-N 3.04Å; E468-L484 PolarHBondContact O-N 3.46Å
469	Q	86.9	Confident	79.6	Confident	62 Å²	62	34.8 Å²	34.8	29%	0.29	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	149.8	-168.3	-59.4	-176.8	19	0	0	111.7	D466 T482	D466-Q469 PolarHBondContact N-O 3.39Å; D466-Q469 PolarHBondContact OD1-N 3.07Å; Q469-T482 VanDerWaalsContact CA-O 3.29Å; Q469-T482 WeakPolarHBondContact CA-O 3.2Å
470	L	87.6	Confident	79.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	121.9	168.7	173.5	70.7	0	0	0	108.2	C398 L405 I463 L465 R481 T482 L484 L492 W494	C398-L470 HydrophobicContact CB-CD1 4.29Å; L405-L470 HydrophobicContact CD1-CD2 4.47Å; L405-L470 HydrophobicContact CD2-CD2 3.27Å; L405-L470 HydrophobicContact CG-CD2 4.47Å; I463-L470 HydrophobicContact CG2-CD1 3.43Å; I463-L470 VanDerWaalsContact CG2-CD1 3.43Å; L465-L470 HydrophobicContact CB-CD1 4.21Å; L465-L470 HydrophobicContact CD1-CB 4.08Å; L465-L470 HydrophobicContact CD1-CD1 3.8Å; L470-R481 CarbonylContact O-C 3.47Å; L470-R481 WeakPolarHBondContact O-CA 3.31Å; L470-T482 HydrophobicContact CB-CG2 3.86Å; L470-T482 HydrophobicContact CD2-CG2 4.13Å; L470-T482 HydrophobicContact CG-CG2 4.39Å; L470-T482 PolarHBondContact N-O 2.79Å; L470-T482 PolarHBondContact O-N 3.02Å; L470-L484 HydrophobicContact CB-CD2 3.97Å; L470-L484 HydrophobicContact CB-CG 4.42Å; L470-L492 HydrophobicContact CD2-CD1 4.37Å; L470-W494 HydrophobicContact CD2-CH2 3.56Å; L470-W494 HydrophobicContact CD2-CZ2 4.25Å; L470-W494 HydrophobicContact CD2-CZ3 4.44Å; L470-W494 HydrophobicContact CG-CH2 4.09Å
471	L	85.4	Confident	80.2	Confident	42 Å²	42	35.4 Å²	35.4	22%	0.22	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	139.8	174.4	-70.7	156.5	0	0	0	109.3	I463 H464 L479 M480 R481	I463-L471 CarbonylContact C-O 3.53Å; I463-L471 WeakPolarHBondContact CA-O 3.31Å; H464-L471 HydrophobicContact CB-CB 4.28Å; H464-L471 PolarHBondContact N-O 3.13Å; H464-L471 PolarHBondContact O-N 3.13Å; L471-L479 HydrophobicContact CD2-CD1 4.5Å; L471-M480 CarbonylContact C-O 3.44Å; L471-M480 VanDerWaalsContact CA-O 3.31Å; L471-M480 WeakPolarHBondContact CA-O 3.29Å; L471-R481 HydrophobicContact CD2-CB 3.65Å; L471-R481 HydrophobicContact CG-CB 4.43Å
472	L	85.9	Confident	80.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	155.3	171	64.1	75.3	0	0	0	112.4	P453 I456 V460 G462 I463 L479 M480 W494	P453-L472 HydrophobicContact CB-CD2 4.2Å; P453-L472 HydrophobicContact CG-CD2 3.62Å; I456-L472 HydrophobicContact CD1-CD1 3.27Å; V460-L472 HydrophobicContact CG1-CB 4.29Å; V460-L472 HydrophobicContact CG2-CD2 4.47Å; G462-L472 CarbonylContact O-C 3.57Å; G462-L472 WeakPolarHBondContact O-CA 3.07Å; G462-L472 WeakPolarHBondContact O-CB 3.14Å; I463-L472 HydrophobicContact CG1-CB 4.4Å; L472-L479 WeakPolarHBondContact O-CA 3.49Å; L472-M480 HydrophobicContact CD1-CB 3.75Å; L472-M480 HydrophobicContact CD1-CG 3.99Å; L472-M480 HydrophobicContact CD1-SD 4.17Å; L472-M480 HydrophobicContact CG-CB 4.17Å; L472-M480 PolarHBondContact N-O 2.82Å; L472-M480 PolarHBondContact O-N 2.98Å; L472-W494 HydrophobicContact CD2-CE3 4.09Å; L472-W494 HydrophobicContact CD2-CH2 3.2Å; L472-W494 HydrophobicContact CD2-CZ2 3.92Å; L472-W494 HydrophobicContact CD2-CZ3 3.31Å; L472-W494 HydrophobicContact CG-CE3 4.35Å; L472-W494 HydrophobicContact CG-CH2 4Å; L472-W494 HydrophobicContact CG-CZ3 3.62Å
473	T	79.1	Confident	81.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	148.8	169.2	59.2	0	0	0	0	110.6	V460 T461 G462 Y478 L479 L516 F527	V460-T473 WeakPolarHBondContact CA-O 3.35Å; T461-T473 PolarHBondContact N-O 3.35Å; T461-T473 PolarHBondContact OG1-O 3.15Å; T461-T473 PolarHBondContact OG1-OG1 3.37Å; G462-T473 VanDerWaalsContact CA-OG1 3.28Å; G462-T473 WeakPolarHBondContact CA-OG1 3.02Å; G462-T473 PolarHBondContact N-O 3.22Å; G462-T473 PolarHBondContact N-OG1 3.05Å; G462-T473 VanDerWaalsContact N-OG1 3.16Å; G462-T473 PolarHBondContact O-N 3.29Å; T473-Y478 CarbonylContact C-O 3.59Å; T473-Y478 WeakPolarHBondContact CA-O 3.26Å; T473-L479 HydrophobicContact CG2-CD1 3.71Å; T473-L516 HydrophobicContact CG2-CB 4.09Å; T473-L516 HydrophobicContact CG2-CD2 4.3Å; T473-F527 HydrophobicContact CG2-CE1 4.16Å
474	S	74.8	Confident	80.9	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	161.4	174	74.7	0	0	0	0	113.5	Y459 D476 G477 Y478	Y459-S474 CarbonylContact O-C 3.59Å; Y459-S474 VanDerWaalsContact O-CA 3.22Å; Y459-S474 WeakPolarHBondContact O-CA 3.4Å; Y459-S474 WeakPolarHBondContact O-CB 3.48Å; S474-D476 PolarHBondContact O-N 2.99Å; S474-D476 PolarHBondContact OG-N 3.45Å; S474-G477 PolarHBondContact O-N 3.39Å; S474-Y478 PolarHBondContact N-O 3.13Å; S474-Y478 PolarHBondContact OG-N 3.39Å
475	V	70	Confident	80.4	Confident	34 Å²	34	39.1 Å²	39.1	21%	0.206	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-31	172.8	178.6	0	0	0	0	111.3	Y459 T461 G477 E512	Y459-V475 PolarHBondContact O-N 3.39Å; T461-V475 HydrophobicContact CG2-CB 4.33Å; T461-V475 HydrophobicContact CG2-CG2 3.27Å; V475-G477 PolarHBondContact O-N 2.99Å; V475-G477 VanDerWaalsContact O-N 3.15Å; V475-E512 HydrophobicContact CG1-CG 4.41Å; V475-E512 VanDerWaalsContact O-CA 3.23Å; V475-E512 WeakPolarHBondContact O-CA 3.28Å; V475-E512 WeakPolarHBondContact O-CB 3.3Å; V475-E512 WeakPolarHBondContact O-CG 3.41Å
476	D	71.1	Confident	79.3	Confident	34 Å²	34	41.7 Å²	41.7	18%	0.182	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	6.2	-180	-33.8	-47.5	0	0	0	113.5	L457 G458 S474 Y478 H510 W511	L457-D476 PolarHBondContact N-OD2 3.28Å; G458-D476 VanDerWaalsContact CA-OD1 3.23Å; G458-D476 WeakPolarHBondContact CA-OD1 3.32Å; G458-D476 WeakPolarHBondContact CA-OD2 3.35Å; G458-D476 VanDerWaalsContact N-CG 3.26Å; G458-D476 PolarHBondContact N-OD1 3.47Å; G458-D476 VanDerWaalsContact N-OD1 3.15Å; G458-D476 PolarHBondContact N-OD2 2.95Å; S474-D476 PolarHBondContact O-N 2.99Å; S474-D476 PolarHBondContact OG-N 3.45Å; D476-Y478 HydrophobicContact CB-CD2 3.88Å; D476-Y478 HydrophobicContact CB-CE2 3.87Å; D476-H510 PolarHBondContact O-NE2 2.89Å; D476-W511 CarbonylContact C-O 3.52Å
477	G	70.2	Confident	78.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	83	24.3	177	0	0	0	0	0	114.1	S474 V475 W498 W511 F513	S474-G477 PolarHBondContact O-N 3.39Å; V475-G477 PolarHBondContact O-N 2.99Å; V475-G477 VanDerWaalsContact O-N 3.15Å; G477-W498 WeakPolarHBondContact O-CZ3 3.14Å; G477-W511 WeakPolarHBondContact CA-O 3.38Å; G477-W511 PolarHBondContact N-O 3.01Å; G477-F513 WeakPolarHBondContact O-CE2 3.43Å
478	Y	77.4	Confident	77.8	Confident	55 Å²	55	40.5 Å²	40.5	22%	0.216	21%	0.21	C	C	.	.			trans	-91	136.5	170.8	-66.7	-82.3	0	0	0	110.7	P455 I456 T473 S474 D476 V496 W498	P455-Y478 HydrophobicContact CG-CE1 3.99Å; I456-Y478 HydrophobicContact CG1-CD2 4.03Å; I456-Y478 HydrophobicContact CG1-CG 4.24Å; T473-Y478 CarbonylContact C-O 3.59Å; T473-Y478 WeakPolarHBondContact CA-O 3.26Å; S474-Y478 PolarHBondContact N-O 3.13Å; S474-Y478 PolarHBondContact OG-N 3.39Å; D476-Y478 HydrophobicContact CB-CD2 3.88Å; D476-Y478 HydrophobicContact CB-CE2 3.87Å; Y478-V496 HydrophobicContact CD1-CG1 4Å; Y478-V496 HydrophobicContact CD1-CG2 4.26Å; Y478-W498 WeakPolarHBondContact CA-O 3.26Å
479	L	78.7	Confident	76.6	Confident	34 Å²	34	41.4 Å²	41.4	18%	0.178	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	119.4	156	176.8	67.5	0	0	0	106.8	L471 L472 T473 V497 W498	L471-L479 HydrophobicContact CD2-CD1 4.5Å; L472-L479 WeakPolarHBondContact O-CA 3.49Å; T473-L479 HydrophobicContact CG2-CD1 3.71Å; L479-V497 HydrophobicContact CD2-CB 4.15Å; L479-V497 HydrophobicContact CD2-CG1 3.97Å; L479-V497 HydrophobicContact CG-CB 4.07Å; L479-V497 HydrophobicContact CG-CG1 4.44Å; L479-V497 WeakPolarHBondContact O-CA 3.31Å; L479-V497 WeakPolarHBondContact O-CB 3.26Å; L479-V497 PolarHBondContact O-N 3.31Å; L479-W498 HydrophobicContact CB-CB 3.99Å; L479-W498 HydrophobicContact CD2-CB 4.47Å; L479-W498 PolarHBondContact N-O 3.28Å; L479-W498 PolarHBondContact O-N 3.24Å
480	M	84.2	Confident	75.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	154.9	-179.1	-54.7	-174.7	77.8	0	0	110.7	P453 N454 I456 L471 L472 W494 Q495 V496	P453-M480 HydrophobicContact CB-SD 4.11Å; N454-M480 WeakPolarHBondContact O-CE 3.44Å; I456-M480 HydrophobicContact CD1-CG 4.15Å; I456-M480 HydrophobicContact CD1-SD 3.28Å; I456-M480 WeakPolarHBondContact CD1-SD 3.37Å; I456-M480 HydrophobicContact CG1-SD 3.57Å; I456-M480 VanDerWaalsContact CG1-SD 3.57Å; L471-M480 CarbonylContact C-O 3.44Å; L471-M480 VanDerWaalsContact CA-O 3.31Å; L471-M480 WeakPolarHBondContact CA-O 3.29Å; L472-M480 HydrophobicContact CD1-CB 3.75Å; L472-M480 HydrophobicContact CD1-CG 3.99Å; L472-M480 HydrophobicContact CD1-SD 4.17Å; L472-M480 HydrophobicContact CG-CB 4.17Å; L472-M480 PolarHBondContact N-O 2.82Å; L472-M480 PolarHBondContact O-N 2.98Å; M480-W494 HydrophobicContact CB-CE3 3.98Å; M480-W494 HydrophobicContact CB-CZ3 4.48Å; M480-W494 HydrophobicContact CE-CB 3.57Å; M480-W494 HydrophobicContact CE-CG 4.33Å; M480-Q495 CarbonylContact C-O 3.56Å; M480-Q495 VanDerWaalsContact CA-O 3.29Å; M480-Q495 WeakPolarHBondContact CA-O 3.46Å; M480-V496 HydrophobicContact CE-CG2 3.8Å; M480-V496 HydrophobicContact CG-CG2 4.4Å
481	R	88.6	Confident	74.4	Confident	100 Å²	100	49 Å²	49	38%	0.377	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	156.4	171.9	72.9	-178.7	179.1	-173.3	-1.1	111.2	L470 L471 Q495 V497	L470-R481 CarbonylContact O-C 3.47Å; L470-R481 WeakPolarHBondContact O-CA 3.31Å; L471-R481 HydrophobicContact CD2-CB 3.65Å; L471-R481 HydrophobicContact CG-CB 4.43Å; R481-Q495 HydrophobicContact CG-CB 4.05Å; R481-Q495 PolarHBondContact N-O 2.96Å; R481-Q495 VanDerWaalsContact NE-OE1 3.08Å; R481-Q495 VanDerWaalsContact NH2-OE1 3.16Å; R481-Q495 PolarHBondContact O-N 2.88Å; R481-V497 HydrophobicContact CB-CG2 3.74Å; R481-V497 HydrophobicContact CG-CG2 3.49Å; R481-V497 VanDerWaalsContact CG-CG2 3.49Å
482	T	89.2	Confident	74.2	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	153.5	168.6	-172.4	0	0	0	0	109.8	Q469 L470 L492 N493 W494	Q469-T482 VanDerWaalsContact CA-O 3.29Å; Q469-T482 WeakPolarHBondContact CA-O 3.2Å; L470-T482 HydrophobicContact CB-CG2 3.86Å; L470-T482 HydrophobicContact CD2-CG2 4.13Å; L470-T482 HydrophobicContact CG-CG2 4.39Å; L470-T482 PolarHBondContact N-O 2.79Å; L470-T482 PolarHBondContact O-N 3.02Å; T482-L492 HydrophobicContact CG2-CB 4Å; T482-L492 HydrophobicContact CG2-CD1 4.09Å; T482-L492 HydrophobicContact CG2-CD2 4.16Å; T482-L492 HydrophobicContact CG2-CG 4.3Å; T482-N493 WeakPolarHBondContact CB-O 3.41Å; T482-N493 VanDerWaalsContact OG1-C 3.31Å; T482-N493 PolarHBondContact OG1-N 3.28Å; T482-N493 PolarHBondContact OG1-O 3.38Å; T482-W494 HydrophobicContact CG2-CD2 4.13Å; T482-W494 HydrophobicContact CG2-CE3 3.83Å; T482-W494 HydrophobicContact CG2-CH2 3.56Å; T482-W494 HydrophobicContact CG2-CZ2 3.87Å; T482-W494 HydrophobicContact CG2-CZ3 3.53Å
483	S	86.2	Confident	74.1	Confident	43 Å²	43	52.3 Å²	52.3	30%	0.301	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	141.1	174	-179.6	0	0	0	0	110.2	D485	S483-D485 VanDerWaalsContact C-N 3.32Å; S483-D485 PolarHBondContact OG-N 2.8Å
484	L	81.1	Confident	74.5	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-86.1	-3.6	177.3	-66.2	168.9	0	0	0	113.4	R394 L396 L465 D466 E468 L470 E486 V487	R394-L484 PolarHBondContact NH1-O 3.34Å; R394-L484 VanDerWaalsContact NH1-O 3.12Å; L396-L484 HydrophobicContact CD2-CD2 3.98Å; L465-L484 HydrophobicContact CD1-CD1 3.39Å; L465-L484 HydrophobicContact CD1-CD2 3.79Å; L465-L484 HydrophobicContact CD1-CG 4.14Å; L465-L484 HydrophobicContact CG-CD1 4.4Å; D466-L484 WeakPolarHBondContact O-CD1 3.37Å; E468-L484 PolarHBondContact O-N 3.46Å; L470-L484 HydrophobicContact CB-CD2 3.97Å; L470-L484 HydrophobicContact CB-CG 4.42Å; L484-E486 PolarHBondContact O-N 3.5Å; L484-V487 HydrophobicContact CB-CG2 4.15Å; L484-V487 HydrophobicContact CD2-CG2 3.87Å; L484-V487 WeakPolarHBondContact O-CG2 3.37Å; L484-V487 PolarHBondContact O-N 2.88Å
485	D	73.8	Confident	75.1	Confident	115 Å²	115	59.1 Å²	59.1	62%	0.615	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-71.2	-18	179.1	-60.4	-26.6	0	0	0	111.9	R394 S483	R394-D485 IonicContact CZ-OD1 2.72Å; R394-D485 IonicContact NH1-OD1 3.89Å; R394-D485 IonicContact NH2-OD1 3.31Å; R394-D485 PolarHBondContact NH2-OD1 3.43Å; S483-D485 VanDerWaalsContact C-N 3.32Å; S483-D485 PolarHBondContact OG-N 2.8Å
486	E	62.5	Low	75.9	Confident	71 Å²	71	60.6 Å²	60.6	33%	0.332	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-95.7	6.9	-179	-61	177.8	164.8	0	0	113.8	L484 S488 E489 N493	L484-E486 PolarHBondContact O-N 3.5Å; E486-S488 PolarHBondContact O-N 3.32Å; E486-E489 PolarHBondContact O-N 3.21Å; E486-N493 PolarHBondContact OE1-ND2 2.89Å; E486-N493 VanDerWaalsContact OE2-CB 3.23Å; E486-N493 WeakPolarHBondContact OE2-CB 3.3Å; E486-N493 VanDerWaalsContact OE2-CG 3.23Å; E486-N493 PolarHBondContact OE2-N 3.46Å; E486-N493 PolarHBondContact OE2-ND2 3.2Å
487	V	61.7	Low	76.4	Confident	27 Å²	27	61.9 Å²	61.9	16%	0.164	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-59.8	-21.8	-172.2	173.1	0	0	0	0	112.9	L484 E489 L492	L484-V487 HydrophobicContact CB-CG2 4.15Å; L484-V487 HydrophobicContact CD2-CG2 3.87Å; L484-V487 WeakPolarHBondContact O-CG2 3.37Å; L484-V487 PolarHBondContact O-N 2.88Å; V487-E489 VanDerWaalsContact C-N 3.25Å; V487-E489 PolarHBondContact O-N 3.03Å; V487-L492 HydrophobicContact CG2-CD2 4Å
488	S	60.2	Low	76.6	Confident	101 Å²	101	65.4 Å²	65.4	71%	0.706	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-62.5	-25.3	179	50.2	0	0	0	0	114.6	E486	E486-S488 PolarHBondContact O-N 3.32Å
489	E	55	Low	76.5	Confident	147 Å²	147	63.1 Å²	63.1	69%	0.687	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-102.1	10.8	-170.2	-66.4	-163.9	168.9	0	0	115.2	E486 V487 K491	E486-E489 PolarHBondContact O-N 3.21Å; V487-E489 VanDerWaalsContact C-N 3.25Å; V487-E489 PolarHBondContact O-N 3.03Å; E489-K491 PolarHBondContact O-N 3.33Å
490	C	60.4	Low	75.9	Confident	67 Å²	67	62.6 Å²	62.6	45%	0.453	32%	0.324	S	S	.	.	S	Bend	trans	56.7	2.8	-173	-54.7	0	0	0	0	114.8	F449	F449-C490 WeakPolarHBondContact CD1-SG 3.24Å
491	K	66.9	Low	74.8	Confident	155 Å²	155	66.3 Å²	66.3	67%	0.674	35%	0.35	S	S	*	.			trans	-118	96.5	-177.3	-73	-175.4	-178.8	178	0	108.1	E489	E489-K491 PolarHBondContact O-N 3.33Å
492	L	80.8	Confident	73.4	Confident	15 Å²	15	66.2 Å²	66.2	8%	0.079	36%	0.357	C	S	.	.			trans	-80.2	121.7	170	-67.6	173.1	0	0	0	108.4	L405 L407 L470 T482 V487 W494	L405-L492 HydrophobicContact CD2-CD1 3.9Å; L407-L492 HydrophobicContact CD1-CD1 4.16Å; L407-L492 HydrophobicContact CD2-CD1 4.05Å; L470-L492 HydrophobicContact CD2-CD1 4.37Å; T482-L492 HydrophobicContact CG2-CB 4Å; T482-L492 HydrophobicContact CG2-CD1 4.09Å; T482-L492 HydrophobicContact CG2-CD2 4.16Å; T482-L492 HydrophobicContact CG2-CG 4.3Å; V487-L492 HydrophobicContact CG2-CD2 4Å; L492-W494 HydrophobicContact CB-CZ2 4.23Å; L492-W494 HydrophobicContact CD1-CZ2 3.8Å; L492-W494 PolarHBondContact O-N 3.36Å
493	N	84.7	Confident	71.9	Confident	97 Å²	97	70.7 Å²	70.7	52%	0.519	37%	0.374	S	S	.	.			trans	-76.5	102.7	172.9	-72.6	-38.4	0	0	0	109.7	T482 E486	T482-N493 WeakPolarHBondContact CB-O 3.41Å; T482-N493 VanDerWaalsContact OG1-C 3.31Å; T482-N493 PolarHBondContact OG1-N 3.28Å; T482-N493 PolarHBondContact OG1-O 3.38Å; E486-N493 PolarHBondContact OE1-ND2 2.89Å; E486-N493 VanDerWaalsContact OE2-CB 3.23Å; E486-N493 WeakPolarHBondContact OE2-CB 3.3Å; E486-N493 VanDerWaalsContact OE2-CG 3.23Å; E486-N493 PolarHBondContact OE2-N 3.46Å; E486-N493 PolarHBondContact OE2-ND2 3.2Å
494	W	87.6	Confident	70.4	Confident	39 Å²	39	76.7 Å²	76.7	15%	0.148	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	133.3	-178.1	-67	95.3	0	0	0	112.2	L405 S451 P453 L470 L472 M480 T482 L492	L405-W494 HydrophobicContact CD2-CH2 3.94Å; L405-W494 HydrophobicContact CD2-CZ2 3.73Å; S451-W494 PolarHBondContact OG-NE1 3.04Å; P453-W494 HydrophobicContact CB-CD2 3.89Å; P453-W494 HydrophobicContact CB-CE3 4.47Å; P453-W494 HydrophobicContact CB-CG 4.07Å; P453-W494 HydrophobicContact CB-CZ2 4.36Å; P453-W494 HydrophobicContact CG-CD2 4.23Å; P453-W494 HydrophobicContact CG-CH2 4.36Å; P453-W494 HydrophobicContact CG-CZ2 3.78Å; L470-W494 HydrophobicContact CD2-CH2 3.56Å; L470-W494 HydrophobicContact CD2-CZ2 4.25Å; L470-W494 HydrophobicContact CD2-CZ3 4.44Å; L470-W494 HydrophobicContact CG-CH2 4.09Å; L472-W494 HydrophobicContact CD2-CE3 4.09Å; L472-W494 HydrophobicContact CD2-CH2 3.2Å; L472-W494 HydrophobicContact CD2-CZ2 3.92Å; L472-W494 HydrophobicContact CD2-CZ3 3.31Å; L472-W494 HydrophobicContact CG-CE3 4.35Å; L472-W494 HydrophobicContact CG-CH2 4Å; L472-W494 HydrophobicContact CG-CZ3 3.62Å; M480-W494 HydrophobicContact CB-CE3 3.98Å; M480-W494 HydrophobicContact CB-CZ3 4.48Å; M480-W494 HydrophobicContact CE-CB 3.57Å; M480-W494 HydrophobicContact CE-CG 4.33Å; T482-W494 HydrophobicContact CG2-CD2 4.13Å; T482-W494 HydrophobicContact CG2-CE3 3.83Å; T482-W494 HydrophobicContact CG2-CH2 3.56Å; T482-W494 HydrophobicContact CG2-CZ2 3.87Å; T482-W494 HydrophobicContact CG2-CZ3 3.53Å; L492-W494 HydrophobicContact CB-CZ2 4.23Å; L492-W494 HydrophobicContact CD1-CZ2 3.8Å; L492-W494 PolarHBondContact O-N 3.36Å
495	Q	87.9	Confident	69.3	Low	104 Å²	104	82.8 Å²	82.8	49%	0.486	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129	172.6	-63.7	179	-0	0	0	109.2	M480 R481 V497	M480-Q495 CarbonylContact C-O 3.56Å; M480-Q495 VanDerWaalsContact CA-O 3.29Å; M480-Q495 WeakPolarHBondContact CA-O 3.46Å; R481-Q495 HydrophobicContact CG-CB 4.05Å; R481-Q495 PolarHBondContact N-O 2.96Å; R481-Q495 VanDerWaalsContact NE-OE1 3.08Å; R481-Q495 VanDerWaalsContact NH2-OE1 3.16Å; R481-Q495 PolarHBondContact O-N 2.88Å; Q495-V497 PolarHBondContact O-N 3.49Å
496	V	85.5	Confident	68.5	Low	64 Å²	64	79.3 Å²	79.3	39%	0.388	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	117.2	170.1	179.2	0	0	0	0	108.2	Y478 M480	Y478-V496 HydrophobicContact CD1-CG1 4Å; Y478-V496 HydrophobicContact CD1-CG2 4.26Å; M480-V496 HydrophobicContact CE-CG2 3.8Å; M480-V496 HydrophobicContact CG-CG2 4.4Å
497	V	80.9	Confident	68.4	Low	61 Å²	61	83.2 Å²	83.2	37%	0.37	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-40.5	174.4	-178.1	0	0	0	0	109.7	L479 R481 Q495	L479-V497 HydrophobicContact CD2-CB 4.15Å; L479-V497 HydrophobicContact CD2-CG1 3.97Å; L479-V497 HydrophobicContact CG-CB 4.07Å; L479-V497 HydrophobicContact CG-CG1 4.44Å; L479-V497 WeakPolarHBondContact O-CA 3.31Å; L479-V497 WeakPolarHBondContact O-CB 3.26Å; L479-V497 PolarHBondContact O-N 3.31Å; R481-V497 HydrophobicContact CB-CG2 3.74Å; R481-V497 HydrophobicContact CG-CG2 3.49Å; R481-V497 VanDerWaalsContact CG-CG2 3.49Å; Q495-V497 PolarHBondContact O-N 3.49Å
498	W	75.3	Confident	68.2	Low	75 Å²	75	85.2 Å²	85.2	28%	0.284	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	145	177.9	-172.5	91.9	0	0	0	111.3	G477 Y478 L479 W511 F513	G477-W498 WeakPolarHBondContact O-CZ3 3.14Å; Y478-W498 WeakPolarHBondContact CA-O 3.26Å; L479-W498 HydrophobicContact CB-CB 3.99Å; L479-W498 HydrophobicContact CD2-CB 4.47Å; L479-W498 PolarHBondContact N-O 3.28Å; L479-W498 PolarHBondContact O-N 3.24Å; W498-W511 HydrophobicContact CH2-CB 3.88Å; W498-W511 AromaticContact CH2-CD1 3.98Å; W498-W511 HydrophobicContact CH2-CD2 4.49Å; W498-W511 AromaticContact CH2-CG 3.84Å; W498-W511 HydrophobicContact CH2-CG 3.84Å; W498-W511 HydrophobicContact CZ3-CB 4.28Å; W498-F513 AromaticContact CE3-CE2 3.53Å; W498-F513 HydrophobicContact CE3-CE2 3.53Å; W498-F513 AromaticContact CE3-CZ 3.65Å; W498-F513 HydrophobicContact CE3-CZ 3.65Å; W498-F513 HydrophobicContact CH2-CE2 4.36Å; W498-F513 AromaticContact CH2-CZ 3.98Å; W498-F513 HydrophobicContact CH2-CZ 3.98Å; W498-F513 AromaticContact CZ3-CE2 3.31Å; W498-F513 HydrophobicContact CZ3-CE2 3.31Å; W498-F513 AromaticContact CZ3-CZ 3.3Å; W498-F513 HydrophobicContact CZ3-CZ 3.3Å
499	S	74.6	Confident	68.1	Low	7 Å²	7	82.4 Å²	82.4	5%	0.049	43%	0.426	C	S	.	.			trans	-147	159.6	170.8	50.9	0	0	0	0	109.6	S501 N502	S499-S501 PolarHBondContact O-N 3.5Å; S499-S501 VanDerWaalsContact O-N 3.14Å; S499-S501 PolarHBondContact OG-OG 3.06Å; S499-N502 VanDerWaalsContact O-CB 3.28Å; S499-N502 WeakPolarHBondContact O-CB 3.48Å; S499-N502 PolarHBondContact O-N 3.1Å
500	S	66.9	Low	68.2	Low	22 Å²	22	77.5 Å²	77.5	15%	0.154	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-55.8	-29	176.7	57.3	0	0	0	0	113.3	N502 Y503 S506	S500-N502 PolarHBondContact O-N 3.37Å; S500-N502 VanDerWaalsContact O-N 3.13Å; S500-Y503 WeakPolarHBondContact O-CB 3.26Å; S500-Y503 PolarHBondContact O-N 3.25Å; S500-S506 WeakPolarHBondContact O-CB 3.47Å
501	S	61.2	Low	68.2	Low	78 Å²	78	76.6 Å²	76.6	55%	0.545	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-59.6	-18.3	173.2	62.2	0	0	0	0	114	S499	S499-S501 PolarHBondContact O-N 3.5Å; S499-S501 VanDerWaalsContact O-N 3.14Å; S499-S501 PolarHBondContact OG-OG 3.06Å
502	N	59.3	Low	67.8	Low	98 Å²	98	70.3 Å²	70.3	52%	0.524	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-83.8	0.2	176.5	-61.2	-12.2	0	0	0	112.6	S499 S500	S499-N502 VanDerWaalsContact O-CB 3.28Å; S499-N502 WeakPolarHBondContact O-CB 3.48Å; S499-N502 PolarHBondContact O-N 3.1Å; S500-N502 PolarHBondContact O-N 3.37Å; S500-N502 VanDerWaalsContact O-N 3.13Å
503	Y	57.2	Low	66.7	Low	97 Å²	97	70 Å²	70	38%	0.38	36%	0.362	S	S	.	.	S	Bend	trans	-104.3	134.3	-179.7	-173.4	-113.1	0	0	0	111.3	S500 K505 S506	S500-Y503 WeakPolarHBondContact O-CB 3.26Å; S500-Y503 PolarHBondContact O-N 3.25Å; Y503-K505 HydrophobicContact CD1-CB 4.03Å; Y503-K505 HydrophobicContact CE1-CB 3.76Å; Y503-K505 HydrophobicContact CE1-CG 4.33Å; Y503-K505 PolarHBondContact O-N 3.11Å; Y503-S506 PolarHBondContact O-N 3.06Å
504	D	54.4	Low	65.6	Low	169 Å²	169	69.3 Å²	69.3	90%	0.904	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-10.1	-175.8	-66.8	-20.7	0	0	0	115.3
505	K	59.2	Low	64.3	Low	129 Å²	129	68 Å²	68	56%	0.561	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	34.2	176.5	-53.8	-176.6	178.8	-179.3	0	112.9	Y503 D507 V508 I509	Y503-K505 HydrophobicContact CD1-CB 4.03Å; Y503-K505 HydrophobicContact CE1-CB 3.76Å; Y503-K505 HydrophobicContact CE1-CG 4.33Å; Y503-K505 PolarHBondContact O-N 3.11Å; K505-D507 PolarHBondContact O-N 2.82Å; K505-D507 VanDerWaalsContact O-N 3.07Å; K505-V508 PolarHBondContact O-N 3.26Å; K505-V508 VanDerWaalsContact O-N 3.09Å; K505-I509 PolarHBondContact O-N 2.84Å
506	S	57.3	Low	63.1	Low	42 Å²	42	64.4 Å²	64.4	29%	0.294	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-34.4	177.3	54.3	0	0	0	0	113.4	S500 Y503 V508	S500-S506 WeakPolarHBondContact O-CB 3.47Å; Y503-S506 PolarHBondContact O-N 3.06Å; S506-V508 PolarHBondContact O-N 3.46Å
507	D	59.5	Low	62.1	Low	153 Å²	153	62.3 Å²	62.3	82%	0.818	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-16.2	-173.7	-55.1	-12	0	0	0	113.5	K505	K505-D507 PolarHBondContact O-N 2.82Å; K505-D507 VanDerWaalsContact O-N 3.07Å
508	V	58.2	Low	61.2	Low	70 Å²	70	61.2 Å²	61.2	42%	0.424	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-30.2	-176	-174.3	0	0	0	0	111.8	K505 S506 N533	K505-V508 PolarHBondContact O-N 3.26Å; K505-V508 VanDerWaalsContact O-N 3.09Å; S506-V508 PolarHBondContact O-N 3.46Å; V508-N533 PolarHBondContact O-OD1 3.35Å
509	I	58.2	Low	60.4	Low	42 Å²	42	57.8 Å²	57.8	22%	0.215	31%	0.307	C	S	.	.			trans	-129.9	112.5	-171	-56.7	176.7	0	0	0	109.1	K505 W511 P531	K505-I509 PolarHBondContact O-N 2.84Å; I509-W511 HydrophobicContact CG2-CD2 4.48Å; I509-W511 HydrophobicContact CG2-CZ2 4.32Å; I509-P531 HydrophobicContact CG2-CB 4.06Å
510	H	57.1	Low	59.8	Low	44 Å²	44	61 Å²	61	20%	0.204	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	135.8	166.7	-173.6	-86.6	0	0	0	109.5	D476 C532 Y534	D476-H510 PolarHBondContact O-NE2 2.89Å; H510-C532 PolarHBondContact N-O 3.32Å; H510-C532 PolarHBondContact O-N 2.9Å; H510-C532 VanDerWaalsContact O-O 3.12Å; H510-Y534 HydrophobicContact CB-CD2 3.85Å; H510-Y534 HydrophobicContact CB-CE2 3.33Å; H510-Y534 AromaticContact CG-CE2 3.57Å
511	W	59.5	Low	59.5	Low	47 Å²	47	62.3 Å²	62.3	18%	0.178	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	123.3	179.8	-69.6	90.1	0	0	0	109.3	D476 G477 W498 I509 P531	D476-W511 CarbonylContact C-O 3.52Å; G477-W511 WeakPolarHBondContact CA-O 3.38Å; G477-W511 PolarHBondContact N-O 3.01Å; W498-W511 HydrophobicContact CH2-CB 3.88Å; W498-W511 AromaticContact CH2-CD1 3.98Å; W498-W511 HydrophobicContact CH2-CD2 4.49Å; W498-W511 AromaticContact CH2-CG 3.84Å; W498-W511 HydrophobicContact CH2-CG 3.84Å; W498-W511 HydrophobicContact CZ3-CB 4.28Å; I509-W511 HydrophobicContact CG2-CD2 4.48Å; I509-W511 HydrophobicContact CG2-CZ2 4.32Å; W511-P531 HydrophobicContact CE3-CB 4.22Å; W511-P531 HydrophobicContact CH2-CB 4.37Å; W511-P531 HydrophobicContact CZ3-CB 4.08Å; W511-P531 HydrophobicContact CZ3-CG 4.49Å
512	E	58.3	Low	59.4	Low	23 Å²	23	60.1 Å²	60.1	11%	0.107	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	124.3	171.4	-62.7	172.8	-177.7	0	0	109.6	V475 H514 K530 C532	V475-E512 HydrophobicContact CG1-CG 4.41Å; V475-E512 VanDerWaalsContact O-CA 3.23Å; V475-E512 WeakPolarHBondContact O-CA 3.28Å; V475-E512 WeakPolarHBondContact O-CB 3.3Å; V475-E512 WeakPolarHBondContact O-CG 3.41Å; E512-H514 IonicContact OE2-CE1 3.25Å; E512-H514 PolarHBondContact OE2-CE1 3.1Å; E512-H514 IonicContact OE2-NE2 2.76Å; E512-H514 PolarHBondContact OE2-NE2 2.91Å; E512-K530 HydrophobicContact CB-CB 4.36Å; E512-K530 PolarHBondContact N-O 3.09Å; E512-K530 PolarHBondContact O-N 3.22Å; E512-K530 IonicContact OE2-NZ 3.13Å; E512-K530 PolarHBondContact OE2-NZ 3.42Å; E512-C532 HydrophobicContact CG-CB 4.49Å; E512-C532 PolarHBondContact OE1-SG 3.08Å; E512-C532 PolarHBondContact OE2-SG 2.9Å
513	F	58	Low	59.1	Low	10 Å²	10	58.2 Å²	58.2	4%	0.044	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	116.6	168.8	-62.8	-62.1	0	0	0	109.4	T461 G477 W498 F527 E529	T461-F513 VanDerWaalsContact CB-O 3.24Å; T461-F513 WeakPolarHBondContact CB-O 3.31Å; T461-F513 WeakPolarHBondContact CG2-O 3.49Å; T461-F513 PolarHBondContact OG1-O 2.92Å; G477-F513 WeakPolarHBondContact O-CE2 3.43Å; W498-F513 AromaticContact CE3-CE2 3.53Å; W498-F513 HydrophobicContact CE3-CE2 3.53Å; W498-F513 AromaticContact CE3-CZ 3.65Å; W498-F513 HydrophobicContact CE3-CZ 3.65Å; W498-F513 HydrophobicContact CH2-CE2 4.36Å; W498-F513 AromaticContact CH2-CZ 3.98Å; W498-F513 HydrophobicContact CH2-CZ 3.98Å; W498-F513 AromaticContact CZ3-CE2 3.31Å; W498-F513 HydrophobicContact CZ3-CE2 3.31Å; W498-F513 AromaticContact CZ3-CZ 3.3Å; W498-F513 HydrophobicContact CZ3-CZ 3.3Å; F513-F527 HydrophobicContact CD1-CB 4.37Å; F513-F527 AromaticContact CD1-CD1 3.96Å; F513-F527 HydrophobicContact CD1-CD1 3.96Å; F513-F527 HydrophobicContact CD1-CG 4.46Å; F513-F527 HydrophobicContact CE1-CD1 4.13Å; F513-F527 HydrophobicContact CE1-CG 4.49Å; F513-E529 HydrophobicContact CD1-CG 3.96Å; F513-E529 HydrophobicContact CE1-CG 3.94Å
514	H	60.7	Low	59.1	Low	81 Å²	81	55.3 Å²	55.3	38%	0.375	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	10.6	177.3	-61.8	-68.6	0	0	0	113.9	E512 L528 K530	E512-H514 IonicContact OE2-CE1 3.25Å; E512-H514 PolarHBondContact OE2-CE1 3.1Å; E512-H514 IonicContact OE2-NE2 2.76Å; E512-H514 PolarHBondContact OE2-NE2 2.91Å; H514-L528 HydrophobicContact CB-CB 3.89Å; H514-L528 WeakPolarHBondContact CB-O 3.22Å; H514-L528 PolarHBondContact N-O 2.84Å; H514-K530 WeakPolarHBondContact NE2-CB 3.4Å; H514-K530 WeakPolarHBondContact NE2-CD 3.11Å
515	G	61.3	Low	59.2	Low	12 Å²	12	48.4 Å²	48.4	12%	0.124	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.1	150.1	176.1	0	0	0	0	0	112.6	T461 F527 L528	T461-G515 WeakPolarHBondContact O-CA 3.27Å; G515-F527 WeakPolarHBondContact O-CA 3.31Å; G515-L528 PolarHBondContact O-N 3.37Å
516	L	62.2	Low	59.1	Low	28 Å²	28	42.6 Å²	42.6	15%	0.147	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	119.6	167.9	174.4	66	0	0	0	107.4	H464 T473 V518 I525 F527	H464-L516 HydrophobicContact CB-CD2 3.96Å; T473-L516 HydrophobicContact CG2-CB 4.09Å; T473-L516 HydrophobicContact CG2-CD2 4.3Å; L516-V518 HydrophobicContact CD1-CG2 3.95Å; L516-V518 HydrophobicContact CG-CG2 4.09Å; L516-I525 HydrophobicContact CD1-CG2 3.72Å; L516-F527 HydrophobicContact CD1-CD1 4.07Å; L516-F527 HydrophobicContact CD1-CE1 3.52Å; L516-F527 HydrophobicContact CD1-CZ 3.84Å
517	S	64.2	Low	59.1	Low	21 Å²	21	41.9 Å²	41.9	15%	0.147	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	112.3	173.8	-164.4	0	0	0	0	108.8	V125 C526	V125-S517 PolarHBondContact O-OG 3.19Å; S517-C526 PolarHBondContact N-O 3.19Å; S517-C526 PolarHBondContact O-N 3.12Å
518	V	61.8	Low	58.9	Low	38 Å²	38	35.9 Å²	35.9	23%	0.23	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	125.5	178.7	-175.4	0	0	0	0	107.6	L516 Y524 I525	L516-V518 HydrophobicContact CD1-CG2 3.95Å; L516-V518 HydrophobicContact CG-CG2 4.09Å; V518-Y524 WeakPolarHBondContact CA-O 3.07Å; V518-I525 HydrophobicContact CG1-CG1 4.12Å; V518-I525 HydrophobicContact CG2-CG1 4.19Å; V518-I525 HydrophobicContact CG2-CG2 4.42Å
519	S	59.9	Low	58.6	Low	3 Å²	3	34.4 Å²	34.4	2%	0.021	19%	0.187	C	C	.	.			trans	-65	153.9	173.8	59.2	0	0	0	0	110.6	N521 G522 V523 Y524	S519-N521 WeakPolarHBondContact CB-OD1 3.41Å; S519-N521 PolarHBondContact O-N 3.35Å; S519-N521 VanDerWaalsContact O-N 3.08Å; S519-N521 PolarHBondContact OG-OD1 2.83Å; S519-G522 WeakPolarHBondContact O-CA 3.27Å; S519-G522 PolarHBondContact O-N 2.8Å; S519-V523 PolarHBondContact OG-N 3.34Å; S519-Y524 PolarHBondContact N-O 2.91Å; S519-Y524 WeakPolarHBondContact OG-CB 3.49Å; S519-Y524 PolarHBondContact OG-N 2.78Å; S519-Y524 PolarHBondContact OG-O 3.02Å
520	T	62.4	Low	58.4	Low	75 Å²	75	34.2 Å²	34.2	46%	0.46	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-22.6	-177.7	51.8	0	0	0	0	114.3	R130 C138 G522	R130-T520 PolarHBondContact N-OG1 3.31Å; C138-T520 PolarHBondContact SG-OG1 3.48Å; T520-G522 VanDerWaalsContact C-N 3.35Å
521	N	59.5	Low	58	Low	49 Å²	49	33.8 Å²	33.8	26%	0.262	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	0.2	173.1	65.4	-3.3	0	0	0	113.8	S519 V523	S519-N521 WeakPolarHBondContact CB-OD1 3.41Å; S519-N521 PolarHBondContact O-N 3.35Å; S519-N521 VanDerWaalsContact O-N 3.08Å; S519-N521 PolarHBondContact OG-OD1 2.83Å; N521-V523 HydrophobicContact CB-CG2 4.13Å; N521-V523 WeakPolarHBondContact ND2-CG2 3.43Å; N521-V523 PolarHBondContact O-N 3.32Å; N521-V523 WeakPolarHBondContact OD1-CB 3.26Å; N521-V523 PolarHBondContact OD1-N 2.77Å; N521-V523 VanDerWaalsContact OD1-N 3.09Å
522	G	58.4	Low	57.6	Low	31 Å²	31	32 Å²	32	32%	0.32	18%	0.181	S	C	.	.	S	Bend	trans	66.3	-0.8	-175.8	0	0	0	0	0	115.1	S519 T520	S519-G522 WeakPolarHBondContact O-CA 3.27Å; S519-G522 PolarHBondContact O-N 2.8Å; T520-G522 VanDerWaalsContact C-N 3.35Å
523	V	54.4	Low	57.2	Low	58 Å²	58	33.5 Å²	33.5	35%	0.352	19%	0.19	S	C	.	.			trans	-74.8	-37.9	-173.9	174.5	0	0	0	0	111.5	S519 N521	S519-V523 PolarHBondContact OG-N 3.34Å; N521-V523 HydrophobicContact CB-CG2 4.13Å; N521-V523 WeakPolarHBondContact ND2-CG2 3.43Å; N521-V523 PolarHBondContact O-N 3.32Å; N521-V523 WeakPolarHBondContact OD1-CB 3.26Å; N521-V523 PolarHBondContact OD1-N 2.77Å; N521-V523 VanDerWaalsContact OD1-N 3.09Å
524	Y	57.8	Low	56.8	Low	37 Å²	37	40.5 Å²	40.5	15%	0.145	22%	0.217	C	C	.	.			trans	-108.5	119.8	-176.9	-54.5	-72.1	0	0	0	109.2	W127 V518 S519	W127-Y524 HydrophobicContact CH2-CG 4.35Å; V518-Y524 WeakPolarHBondContact CA-O 3.07Å; S519-Y524 PolarHBondContact N-O 2.91Å; S519-Y524 WeakPolarHBondContact OG-CB 3.49Å; S519-Y524 PolarHBondContact OG-N 2.78Å; S519-Y524 PolarHBondContact OG-O 3.02Å
525	I	54.5	Low	56	Low	24 Å²	24	43.7 Å²	43.7	12%	0.123	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	119.5	170.7	-60.5	177.7	0	0	0	105.9	L516 V518 F527 I550	L516-I525 HydrophobicContact CD1-CG2 3.72Å; V518-I525 HydrophobicContact CG1-CG1 4.12Å; V518-I525 HydrophobicContact CG2-CG1 4.19Å; V518-I525 HydrophobicContact CG2-CG2 4.42Å; I525-F527 HydrophobicContact CB-CE2 4.5Å; I525-F527 HydrophobicContact CG2-CD2 3.97Å; I525-F527 HydrophobicContact CG2-CE2 3.41Å; I525-F527 VanDerWaalsContact CG2-CE2 3.41Å; I525-F527 HydrophobicContact CG2-CZ 3.73Å; I525-I550 HydrophobicContact CB-CD1 3.79Å; I525-I550 HydrophobicContact CB-CG1 4.23Å; I525-I550 HydrophobicContact CD1-CB 4.06Å; I525-I550 HydrophobicContact CD1-CD1 3.69Å; I525-I550 HydrophobicContact CD1-CG1 4.05Å; I525-I550 HydrophobicContact CG1-CD1 4.24Å; I525-I550 HydrophobicContact CG2-CD1 3.95Å
526	C	58.5	Low	55.1	Low	6 Å²	6	46.4 Å²	46.4	4%	0.041	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	120.6	175.1	-175	0	0	0	0	108.4	S517	S517-C526 PolarHBondContact N-O 3.19Å; S517-C526 PolarHBondContact O-N 3.12Å
527	F	57.4	Low	54	Low	27 Å²	27	52.2 Å²	52.2	12%	0.118	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.2	163.8	-62.3	-85.6	0	0	0	108.1	T473 F513 G515 L516 I525 E529 I550	T473-F527 HydrophobicContact CG2-CE1 4.16Å; F513-F527 HydrophobicContact CD1-CB 4.37Å; F513-F527 AromaticContact CD1-CD1 3.96Å; F513-F527 HydrophobicContact CD1-CD1 3.96Å; F513-F527 HydrophobicContact CD1-CG 4.46Å; F513-F527 HydrophobicContact CE1-CD1 4.13Å; F513-F527 HydrophobicContact CE1-CG 4.49Å; G515-F527 WeakPolarHBondContact O-CA 3.31Å; L516-F527 HydrophobicContact CD1-CD1 4.07Å; L516-F527 HydrophobicContact CD1-CE1 3.52Å; L516-F527 HydrophobicContact CD1-CZ 3.84Å; I525-F527 HydrophobicContact CB-CE2 4.5Å; I525-F527 HydrophobicContact CG2-CD2 3.97Å; I525-F527 HydrophobicContact CG2-CE2 3.41Å; I525-F527 VanDerWaalsContact CG2-CE2 3.41Å; I525-F527 HydrophobicContact CG2-CZ 3.73Å; F527-E529 HydrophobicContact CB-CG 3.5Å; F527-E529 HydrophobicContact CG-CG 4.5Å; F527-E529 PolarHBondContact O-N 2.89Å; F527-E529 VanDerWaalsContact O-N 3.07Å; F527-I550 HydrophobicContact CE2-CD1 3.87Å
528	L	54.7	Low	52.8	Low	28 Å²	28	57.2 Å²	57.2	15%	0.147	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	78.9	162.3	-89.2	152.3	0	0	0	107.5	A122 H514 G515 A544	A122-L528 HydrophobicContact CB-CD2 4.31Å; A122-L528 WeakPolarHBondContact O-CD2 3.2Å; H514-L528 HydrophobicContact CB-CB 3.89Å; H514-L528 WeakPolarHBondContact CB-O 3.22Å; H514-L528 PolarHBondContact N-O 2.84Å; G515-L528 PolarHBondContact O-N 3.37Å; L528-A544 HydrophobicContact CD2-CB 4.17Å
529	E	51.9	Low	51.6	Low	38 Å²	38	63.7 Å²	63.7	18%	0.178	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	139.2	178.2	-61.8	-179.4	178.8	0	0	110.3	F513 F527	F513-E529 HydrophobicContact CD1-CG 3.96Å; F513-E529 HydrophobicContact CE1-CG 3.94Å; F527-E529 HydrophobicContact CB-CG 3.5Å; F527-E529 HydrophobicContact CG-CG 4.5Å; F527-E529 PolarHBondContact O-N 2.89Å; F527-E529 VanDerWaalsContact O-N 3.07Å
530	K	53.6	Low	50.6	Low	38 Å²	38	68.9 Å²	68.9	17%	0.165	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	102.4	165.5	-174.1	176.7	149.6	-119.6	0	107.9	E512 H514 C532	E512-K530 HydrophobicContact CB-CB 4.36Å; E512-K530 PolarHBondContact N-O 3.09Å; E512-K530 PolarHBondContact O-N 3.22Å; E512-K530 IonicContact OE2-NZ 3.13Å; E512-K530 PolarHBondContact OE2-NZ 3.42Å; H514-K530 WeakPolarHBondContact NE2-CB 3.4Å; H514-K530 WeakPolarHBondContact NE2-CD 3.11Å; K530-C532 VanDerWaalsContact CE-SG 3.56Å; K530-C532 PolarHBondContact NZ-SG 3.14Å; K530-C532 PolarHBondContact O-N 2.85Å; K530-C532 VanDerWaalsContact O-N 3.14Å
531	P	49.9	Very low	49.4	Very low	36 Å²	36	74.2 Å²	74.2	23%	0.234	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	114	169.1	26.6	-30.9	0	0	0	108.1	I509 W511 R541	I509-P531 HydrophobicContact CG2-CB 4.06Å; W511-P531 HydrophobicContact CE3-CB 4.22Å; W511-P531 HydrophobicContact CH2-CB 4.37Å; W511-P531 HydrophobicContact CZ3-CB 4.08Å; W511-P531 HydrophobicContact CZ3-CG 4.49Å; P531-R541 HydrophobicContact CG-CB 4.42Å
532	C	51.2	Low	48.4	Very low	10 Å²	10	77 Å²	77	7%	0.068	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	106.8	172.5	-81.8	0	0	0	0	108.4	H510 E512 K530 Y534	H510-C532 PolarHBondContact N-O 3.32Å; H510-C532 PolarHBondContact O-N 2.9Å; H510-C532 VanDerWaalsContact O-O 3.12Å; E512-C532 HydrophobicContact CG-CB 4.49Å; E512-C532 PolarHBondContact OE1-SG 3.08Å; E512-C532 PolarHBondContact OE2-SG 2.9Å; K530-C532 VanDerWaalsContact CE-SG 3.56Å; K530-C532 PolarHBondContact NZ-SG 3.14Å; K530-C532 PolarHBondContact O-N 2.85Å; K530-C532 VanDerWaalsContact O-N 3.14Å; C532-Y534 PolarHBondContact O-N 2.87Å
533	N	47.9	Very low	47.3	Very low	53 Å²	53	78.3 Å²	78.3	28%	0.283	38%	0.379	S	S	.	.			trans	-85.2	105.2	161.2	-177.7	-6.6	0	0	0	107.2	V508 L535 D536	V508-N533 PolarHBondContact O-OD1 3.35Å; N533-L535 PolarHBondContact O-N 3.4Å; N533-L535 VanDerWaalsContact O-N 3.12Å; N533-L535 WeakPolarHBondContact OD1-CA 3.36Å; N533-L535 VanDerWaalsContact OD1-CB 3.3Å; N533-L535 WeakPolarHBondContact OD1-CB 3.49Å; N533-L535 PolarHBondContact OD1-N 3.16Å; N533-D536 HydrophobicContact CB-CB 3.92Å; N533-D536 PolarHBondContact O-N 3.06Å
534	Y	50.2	Low	46.5	Very low	158 Å²	158	77.8 Å²	77.8	62%	0.62	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-16.5	178.7	-70.8	-70.4	0	0	0	112.9	H510 C532	H510-Y534 HydrophobicContact CB-CD2 3.85Å; H510-Y534 HydrophobicContact CB-CE2 3.33Å; H510-Y534 AromaticContact CG-CE2 3.57Å; C532-Y534 PolarHBondContact O-N 2.87Å
535	L	44.8	Very low	45.5	Very low	147 Å²	147	80.5 Å²	80.5	77%	0.77	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-15.9	174.7	-57	172	0	0	0	113.1	N533	N533-L535 PolarHBondContact O-N 3.4Å; N533-L535 VanDerWaalsContact O-N 3.12Å; N533-L535 WeakPolarHBondContact OD1-CA 3.36Å; N533-L535 VanDerWaalsContact OD1-CB 3.3Å; N533-L535 WeakPolarHBondContact OD1-CB 3.49Å; N533-L535 PolarHBondContact OD1-N 3.16Å
536	D	41.9	Very low	44.7	Very low	69 Å²	69	82.6 Å²	82.6	37%	0.369	41%	0.408	S	S	.	.			trans	-107.2	92	180	-167.1	-4.4	0	0	0	110.7	N533 N538 R539	N533-D536 HydrophobicContact CB-CB 3.92Å; N533-D536 PolarHBondContact O-N 3.06Å; D536-N538 PolarHBondContact O-N 3.09Å; D536-N538 WeakPolarHBondContact OD1-CB 3.45Å; D536-N538 PolarHBondContact OD1-N 3.47Å; D536-R539 PolarHBondContact O-N 3.48Å
537	N	39.8	Very low	43.6	Very low	151 Å²	151	83.9 Å²	83.9	81%	0.807	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-17.2	177.7	-84.2	-23.4	0	0	0	113.8	R539	N537-R539 PolarHBondContact O-N 3.19Å
538	N	38	Very low	42.4	Very low	126 Å²	126	86.6 Å²	86.6	67%	0.674	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-5.6	-173.3	-75.6	-27.5	0	0	0	114.8	D536 T540	D536-N538 PolarHBondContact O-N 3.09Å; D536-N538 WeakPolarHBondContact OD1-CB 3.45Å; D536-N538 PolarHBondContact OD1-N 3.47Å; N538-T540 HydrophobicContact CB-CG2 4.16Å; N538-T540 WeakPolarHBondContact O-CA 3.17Å; N538-T540 VanDerWaalsContact O-CG2 3.31Å; N538-T540 WeakPolarHBondContact O-CG2 3.17Å; N538-T540 PolarHBondContact O-N 2.61Å
539	R	37.7	Very low	41.3	Very low	173 Å²	173	94.1 Å²	94.1	65%	0.653	46%	0.464	S	S	*	.			trans	40.1	33.9	169	-64.6	-177.1	175.4	-173.8	-3	114.7	D536 N537 R541	D536-R539 PolarHBondContact O-N 3.48Å; N537-R539 PolarHBondContact O-N 3.19Å; R539-R541 VanDerWaalsContact C-N 3.34Å; R539-R541 PolarHBondContact O-N 2.95Å
540	T	37.7	Very low	40.2	Very low	112 Å²	112	95.5 Å²	95.5	69%	0.687	47%	0.472	S	S	*	.			trans	-78	-16.4	-163.1	38.5	0	0	0	0	113.6	N538	N538-T540 HydrophobicContact CB-CG2 4.16Å; N538-T540 WeakPolarHBondContact O-CA 3.17Å; N538-T540 VanDerWaalsContact O-CG2 3.31Å; N538-T540 WeakPolarHBondContact O-CG2 3.17Å; N538-T540 PolarHBondContact O-N 2.61Å
541	R	37	Very low	38.9	Very low	188 Å²	188	103 Å²	103	71%	0.709	50%	0.501	S	S	*	.			trans	-101.4	86.4	-178.9	-67.4	-173.4	180	-172.6	0.5	111.2	P531 R539	P531-R541 HydrophobicContact CG-CB 4.42Å; R539-R541 VanDerWaalsContact C-N 3.34Å; R539-R541 PolarHBondContact O-N 2.95Å
542	R	39.5	Very low	37.8	Very low	107 Å²	107	104.3 Å²	104.3	40%	0.404	51%	0.511	S	S	.	.			trans	-95.9	103.8	164.1	-68.2	172	172.3	175.1	-2.4	107.2
543	S	35.7	Very low	36.5	Very low	58 Å²	58	110.6 Å²	110.6	41%	0.406	55%	0.548	S	S	.	.			trans	-128.9	107.1	-172.8	-55.2	0	0	0	0	109.1	L545	S543-L545 PolarHBondContact O-N 2.77Å
544	A	36.7	Very low	35.5	Very low	48 Å²	48	117.1 Å²	117.1	40%	0.397	57%	0.57	S	S	.	*			trans	-72.4	114	159.3	0	0	0	0	0	106.7	L528 L546	L528-A544 HydrophobicContact CD2-CB 4.17Å; A544-L546 PolarHBondContact O-N 3.21Å
545	L	36.8	Very low	34.3	Very low	93 Å²	93	113.2 Å²	113.2	49%	0.487	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.2	106	173.8	-156.4	95.6	0	0	0	107.7	S543 S547	S543-L545 PolarHBondContact O-N 2.77Å; L545-S547 PolarHBondContact O-N 2.86Å
546	L	37.4	Very low	33.2	Very low	68 Å²	68	115.7 Å²	115.7	36%	0.356	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.4	106.8	163.1	-166.5	93.5	0	0	0	106.2	W127 A544 P548	W127-L546 HydrophobicContact CH2-CD1 4.47Å; W127-L546 HydrophobicContact CZ2-CD1 4.21Å; A544-L546 PolarHBondContact O-N 3.21Å; L546-P548 WeakPolarHBondContact O-CD 3.42Å
547	S	36.3	Very low	32.5	Very low	33 Å²	33	120 Å²	120	23%	0.231	60%	0.597	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.4	108.3	170.7	-174.1	0	0	0	0	108.3	L545 R549	L545-S547 PolarHBondContact O-N 2.86Å; S547-R549 PolarHBondContact O-N 3.16Å; S547-R549 VanDerWaalsContact O-N 3.13Å
548	P	32.2	Very low	31.8	Very low	85 Å²	85	123.1 Å²	123.1	55%	0.552	60%	0.597	S	S	*	*	S	Bend	trans	-67.4	-12.6	-173.3	22.7	-31.4	0	0	0	114.1	L546	L546-P548 WeakPolarHBondContact O-CD 3.42Å
549	R	32	Very low	31.5	Very low	185 Å²	185	125.2 Å²	125.2	70%	0.698	60%	0.603	S	S	*	*			trans	-157.8	109.3	173.9	-64.9	-174	179.8	160.5	-0.2	109.1	S547	S547-R549 PolarHBondContact O-N 3.16Å; S547-R549 VanDerWaalsContact O-N 3.13Å
550	I	28.7	Very low	31.1	Very low	67 Å²	67	131.6 Å²	131.6	34%	0.344	63%	0.627	S	S	.	*			trans	-82.6	116.7	155.2	-57.1	-165.1	0	0	0	104.9	I525 F527 S552	I525-I550 HydrophobicContact CB-CD1 3.79Å; I525-I550 HydrophobicContact CB-CG1 4.23Å; I525-I550 HydrophobicContact CD1-CB 4.06Å; I525-I550 HydrophobicContact CD1-CD1 3.69Å; I525-I550 HydrophobicContact CD1-CG1 4.05Å; I525-I550 HydrophobicContact CG1-CD1 4.24Å; I525-I550 HydrophobicContact CG2-CD1 3.95Å; F527-I550 HydrophobicContact CE2-CD1 3.87Å; I550-S552 PolarHBondContact O-N 2.81Å
551	Y	25.8	Very low	30.8	Very low	196 Å²	196	132.6 Å²	132.6	77%	0.769	62%	0.623	S	S	*	*			trans	-60.8	96.2	160.7	-71.9	-84.3	0	0	0	105.1	V553	Y551-V553 VanDerWaalsContact C-N 3.32Å; Y551-V553 PolarHBondContact O-N 3.16Å
552	S	26	Very low	30.4	Very low	64 Å²	64	129.6 Å²	129.6	45%	0.448	62%	0.619	S	S	.	*			trans	-53	109.6	165.6	-52.8	0	0	0	0	104.6	I550 Y554	I550-S552 PolarHBondContact O-N 2.81Å; S552-Y554 PolarHBondContact O-N 2.81Å
553	V	24.1	Very low	29.9	Very low	141 Å²	141	130.9 Å²	130.9	86%	0.855	63%	0.631	S	S	*	*			trans	-69.1	65.3	160.3	-173.8	0	0	0	0	104.7	Y551 A555	Y551-V553 VanDerWaalsContact C-N 3.32Å; Y551-V553 PolarHBondContact O-N 3.16Å; V553-A555 PolarHBondContact O-N 2.81Å
554	Y	26.7	Very low	29.6	Very low	190 Å²	190	135.2 Å²	135.2	75%	0.745	64%	0.644	S	S	*	*			trans	-60.6	103	153.8	-90.8	-76.7	0	0	0	102.4	S552 Q556	S552-Y554 PolarHBondContact O-N 2.81Å; Y554-Q556 PolarHBondContact O-N 3.28Å
555	A	24.8	Very low	29.1	Very low	77 Å²	77	140.6 Å²	140.6	64%	0.636	66%	0.66	S	S	*	*			trans	-47.4	96.9	159.1	0	0	0	0	0	105.9	V553 Q557	V553-A555 PolarHBondContact O-N 2.81Å; A555-Q557 PolarHBondContact O-N 3.03Å
556	Q	23.6	Very low	28.6	Very low	198 Å²	198	143.8 Å²	143.8	93%	0.925	67%	0.671	S	S	*	*			trans	-64.9	74.3	157.9	-84.2	-174.5	-27	0	0	105.7	Y554	Y554-Q556 PolarHBondContact O-N 3.28Å
557	Q	25.6	Very low	28	Very low	160 Å²	160	149.2 Å²	149.2	75%	0.748	69%	0.694	S	S	*	*			trans	-111.2	109.9	160.1	-89.5	-169.6	-14.1	0	0	107.3	A555	A555-Q557 PolarHBondContact O-N 3.03Å
558	R	25.3	Very low	27.4	Very low	216 Å²	216	158.2 Å²	158.2	82%	0.815	73%	0.729	S	S	*	*			trans	83.2	122.6	164.3	-54.4	175.6	174.1	170.3	-1.7	113.7
559	H	31.9	Very low	27	Very low	171 Å²	171	164.3 Å²	164.3	79%	0.792	74%	0.744	S	S	*	*			cis	-141.9	126.5	32.4	-83.6	-84.9	0	0	0	111.8
560	R	29.2	Very low	26.5	Very low	306 Å²	306	162.4 Å²	162.4	100%	1.155	75%	0.748	S	S	*	*				-72	0	129.5	-75.9	-176.9	179	176.9	-0.5	106.9

Retrieved 560 of 560 residues in 204 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).