A0A087YSQ6_POEFO Loading...

RNA binding motif protein 12Bb

AlphaFold DB , UniProt , Accession A0A087YSQ6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 643 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.3	Very low	35.2	Very low	245 Å²	245	172.7 Å²	172.7	100%	1.207	88%	0.882	S	S	*	*				0	40.2	0	-146	-170.9	-68.1	0	0	110.9
2	E	34.8	Very low	34.8	Very low	192 Å²	192	171.6 Å²	171.6	90%	0.897	88%	0.878	S	S	*	*			trans	-152.8	27.1	179.1	-84.3	-163.5	149.4	0	0	113.4
3	Q	31.7	Very low	34.7	Very low	186 Å²	186	172.1 Å²	172.1	87%	0.869	88%	0.882	S	S	*	*	S	Bend	trans	-129.4	11.1	174.7	-77.9	-158.9	-14.7	0	0	115.3
4	M	34.8	Very low	34.8	Very low	189 Å²	189	167.9 Å²	167.9	93%	0.931	88%	0.875	S	S	*	*	S	Bend	trans	-107.2	18	-176.4	-111.4	179.4	84	0	0	114.8
5	V	39	Very low	35	Very low	138 Å²	138	168.6 Å²	168.6	84%	0.836	87%	0.873	S	S	*	*	S	Bend	trans	-119.7	-0.3	-174.2	-175.2	0	0	0	0	113.7
6	S	33.3	Very low	34.7	Very low	103 Å²	103	166.3 Å²	166.3	72%	0.72	87%	0.874	S	S	*	*	S	Bend	trans	-101.8	9.6	-173.5	58	0	0	0	0	116.8
7	L	30.7	Very low	34.9	Very low	163 Å²	163	169.3 Å²	169.3	85%	0.853	87%	0.871	S	S	*	*	S	Bend	trans	-105.7	12.9	-178.3	-98.2	152.7	0	0	0	115.4
8	W	31.3	Very low	34.8	Very low	253 Å²	253	167.2 Å²	167.2	96%	0.958	87%	0.872	S	S	*	*	S	Bend	trans	-106.2	29.6	177.8	-83.2	57.1	0	0	0	113.9
9	K	36.2	Very low	34.9	Very low	197 Å²	197	164.8 Å²	164.8	86%	0.857	86%	0.859	S	S	*	*			trans	-135.4	85	169.6	-78.1	-173.9	177.8	179.7	0	110.4
10	S	29.1	Very low	34.8	Very low	104 Å²	104	161.8 Å²	161.8	73%	0.727	85%	0.852	S	S	*	*			trans	-153.5	119	159.5	-72.4	0	0	0	0	109.6	L12	S10-L12 PolarHBondContact O-N 2.87Å
11	P	40.6	Very low	34.9	Very low	130 Å²	130	161 Å²	161	84%	0.844	84%	0.841	S	S	*	*			trans	-89.2	71.7	179.3	35.5	-30.6	0	0	0	109.6
12	L	30.8	Very low	34.9	Very low	159 Å²	159	156.2 Å²	156.2	83%	0.832	82%	0.819	S	S	*	*			trans	-147.2	68.9	176.9	-77.1	174.2	0	0	0	110.4	S10	S10-L12 PolarHBondContact O-N 2.87Å
13	L	33	Very low	35.9	Very low	178 Å²	178	153.3 Å²	153.3	93%	0.932	81%	0.807	S	S	*	*			trans	-152.4	48.7	158.5	-101	151.3	0	0	0	108.4
14	S	35.8	Very low	37.4	Very low	113 Å²	113	146.1 Å²	146.1	79%	0.79	78%	0.779	S	S	*	*			trans	-105	67.3	166.5	177.7	0	0	0	0	108.2
15	Q	38.3	Very low	39.5	Very low	179 Å²	179	138.4 Å²	138.4	84%	0.836	74%	0.743	S	S	*	*	S	Bend	trans	178.7	102.1	157.9	-103.8	157.6	10.6	0	0	109.5
16	C	30.9	Very low	41.6	Very low	132 Å²	132	132.2 Å²	132.2	89%	0.892	71%	0.705	S	S	*	*			trans	155.2	61.2	150.5	-80	0	0	0	0	109
17	R	37.1	Very low	44.1	Very low	217 Å²	217	127.3 Å²	127.3	82%	0.819	67%	0.671	S	S	*	*			trans	-103.4	89	163.5	-93.6	-175.3	157.7	-171.1	-4.9	107.8
18	C	33	Very low	46.8	Very low	132 Å²	132	121.8 Å²	121.8	89%	0.892	64%	0.639	S	S	*	*			trans	-139.5	57.9	156.5	-82.7	0	0	0	0	107
19	L	36.8	Very low	49.5	Very low	121 Å²	121	109.7 Å²	109.7	63%	0.634	59%	0.593	S	S	*	*			trans	-93.3	120.7	164	-82	159.1	0	0	0	106.1	F21	L19-F21 VanDerWaalsContact C-N 3.31Å; L19-F21 WeakPolarHBondContact O-CD2 3.24Å; L19-F21 PolarHBondContact O-N 3.16Å
20	C	33.5	Very low	51.8	Low	104 Å²	104	102.3 Å²	102.3	70%	0.703	56%	0.562	S	S	*	*			trans	-56	97.3	168.8	-59.2	0	0	0	0	108.2	I22	C20-I22 PolarHBondContact O-N 3.42Å
21	F	36.9	Very low	54	Low	146 Å²	146	98.7 Å²	98.7	64%	0.64	54%	0.54	S	S	*	.			trans	-65.8	116.1	168.1	-88.8	-93.3	0	0	0	106.9	L19 M23	L19-F21 VanDerWaalsContact C-N 3.31Å; L19-F21 WeakPolarHBondContact O-CD2 3.24Å; L19-F21 PolarHBondContact O-N 3.16Å; F21-M23 VanDerWaalsContact C-N 3.25Å; F21-M23 HydrophobicContact CB-CG 4.08Å; F21-M23 PolarHBondContact O-N 3.13Å
22	I	44.2	Very low	55.7	Low	144 Å²	144	92.7 Å²	92.7	74%	0.738	50%	0.501	S	S	*	.			trans	-63.2	102.3	151.3	-49.9	170.6	0	0	0	103.4	C20 A24	C20-I22 PolarHBondContact O-N 3.42Å; I22-A24 PolarHBondContact O-N 3.4Å
23	M	57	Low	57.5	Low	132 Å²	132	86.2 Å²	86.2	65%	0.65	47%	0.469	S	S	*	.			trans	-73.4	75.6	-170.6	-69.2	-168.2	73.1	0	0	110.5	F21 V25	F21-M23 VanDerWaalsContact C-N 3.25Å; F21-M23 HydrophobicContact CB-CG 4.08Å; F21-M23 PolarHBondContact O-N 3.13Å; M23-V25 PolarHBondContact O-N 3.09Å
24	A	62.4	Low	59.2	Low	34 Å²	34	83.7 Å²	83.7	28%	0.281	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-64.3	117.7	168.9	0	0	0	0	0	110.1	I22 I68 Y588	I22-A24 PolarHBondContact O-N 3.4Å; A24-I68 HydrophobicContact CB-CG2 4.3Å; A24-Y588 HydrophobicContact CB-CE1 4.11Å; A24-Y588 WeakPolarHBondContact CB-OH 3.28Å
25	V	78.4	Confident	60.6	Low	28 Å²	28	83.7 Å²	83.7	17%	0.17	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124.8	178.1	-177.5	0	0	0	0	108.8	M23 F69 D72 A75 L95	M23-V25 PolarHBondContact O-N 3.09Å; V25-F69 PolarHBondContact N-O 2.92Å; V25-F69 PolarHBondContact O-N 2.83Å; V25-D72 HydrophobicContact CG2-CB 3.99Å; V25-A75 HydrophobicContact CB-CB 3.67Å; V25-A75 HydrophobicContact CG1-CB 3.54Å; V25-A75 HydrophobicContact CG2-CB 4.26Å; V25-L95 HydrophobicContact CG1-CD2 3.95Å
26	V	83.1	Confident	62	Low	7 Å²	7	75.6 Å²	75.6	4%	0.042	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130.1	178.2	-174.1	0	0	0	0	109.2	F66 I68 S96 M101	V26-F66 HydrophobicContact CG1-CD1 3.95Å; V26-I68 HydrophobicContact CG2-CG1 4.34Å; V26-S96 WeakPolarHBondContact CB-O 3.49Å; V26-S96 PolarHBondContact O-N 3.02Å; V26-M101 HydrophobicContact CG1-CB 4.19Å; V26-M101 HydrophobicContact CG1-CG 4.45Å; V26-M101 HydrophobicContact CG1-SD 3.64Å; V26-M101 HydrophobicContact CG2-SD 4.3Å
27	I	87.3	Confident	64.1	Low	0 Å²	0	70.7 Å²	70.7	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	127.7	175.2	-63.8	-172.4	0	0	0	108.4	F66 I67 F69 A75 A78 M79 L93 L94	I27-F66 CarbonylContact O-C 3.52Å; I27-F66 WeakPolarHBondContact O-CA 3.41Å; I27-I67 PolarHBondContact N-O 2.91Å; I27-I67 PolarHBondContact O-N 2.76Å; I27-F69 HydrophobicContact CB-CD2 4.41Å; I27-F69 HydrophobicContact CB-CE2 4.09Å; I27-F69 HydrophobicContact CD1-CD2 3.77Å; I27-F69 HydrophobicContact CD1-CE2 3.56Å; I27-F69 HydrophobicContact CD1-CZ 4.47Å; I27-F69 HydrophobicContact CG1-CD2 3.99Å; I27-F69 HydrophobicContact CG1-CE2 3.98Å; I27-A75 HydrophobicContact CD1-CB 3.98Å; I27-A75 WeakPolarHBondContact CD1-O 3.41Å; I27-A78 HydrophobicContact CD1-CB 3.84Å; I27-M79 HydrophobicContact CD1-CG 3.84Å; I27-M79 HydrophobicContact CD1-SD 3.92Å; I27-M79 HydrophobicContact CG1-SD 4.36Å; I27-M79 HydrophobicContact CG2-SD 4.1Å; I27-L93 HydrophobicContact CG2-CB 3.94Å; I27-L93 HydrophobicContact CG2-CD2 4.17Å; I27-L94 CarbonylContact C-O 3.48Å; I27-L94 WeakPolarHBondContact CA-O 3.22Å
28	R	86.8	Confident	66	Low	47 Å²	47	63.3 Å²	63.3	18%	0.177	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	123.1	170.7	-177.2	176.4	-176.5	-175	-6.2	108.9	Q30 E64 F66 L93 L94 E100	R28-Q30 HydrophobicContact CG-CG 4.32Å; R28-E64 IonicContact CZ-OE1 2.73Å; R28-E64 IonicContact CZ-OE2 3.74Å; R28-E64 VanDerWaalsContact CZ-OE2 3.31Å; R28-E64 IonicContact NE-OE1 3.2Å; R28-E64 PolarHBondContact NE-OE1 3.47Å; R28-E64 IonicContact NE-OE2 3.67Å; R28-E64 PolarHBondContact NE-OE2 2.98Å; R28-E64 VanDerWaalsContact NE-OE2 3.07Å; R28-E64 IonicContact NH2-OE1 2.67Å; R28-E64 PolarHBondContact NH2-OE1 3.41Å; R28-E64 IonicContact NH2-OE2 3.71Å; R28-E64 PolarHBondContact NH2-OE2 2.98Å; R28-F66 HydrophobicContact CB-CD1 4.06Å; R28-F66 HydrophobicContact CB-CE1 3.75Å; R28-F66 HydrophobicContact CB-CZ 4.32Å; R28-F66 HydrophobicContact CG-CD1 4.35Å; R28-F66 HydrophobicContact CG-CE1 3.79Å; R28-F66 HydrophobicContact CG-CE2 4.41Å; R28-F66 HydrophobicContact CG-CZ 3.83Å; R28-L93 CarbonylContact O-C 3.59Å; R28-L93 WeakPolarHBondContact O-CA 3.46Å; R28-L94 HydrophobicContact CB-CB 4.33Å; R28-L94 PolarHBondContact N-O 3.28Å; R28-L94 PolarHBondContact O-N 3.3Å; R28-E100 IonicContact NH1-OE1 2.94Å; R28-E100 PolarHBondContact NH1-OE1 2.77Å
29	L	87.4	Confident	68.1	Low	0 Å²	0	60.2 Å²	60.2	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	125.6	173.6	-175.1	158	0	0	0	108.4	L32 I41 F45 E64 A65 I67 I86 V91 R92 L93	L29-L32 HydrophobicContact CD2-CB 3.8Å; L29-L32 HydrophobicContact CD2-CD1 3.93Å; L29-L32 HydrophobicContact CD2-CG 4.39Å; L29-I41 HydrophobicContact CD1-CG2 4.43Å; L29-F45 HydrophobicContact CD1-CE2 4.12Å; L29-F45 HydrophobicContact CD1-CZ 4.48Å; L29-E64 CarbonylContact O-C 3.48Å; L29-E64 VanDerWaalsContact O-CA 3.26Å; L29-E64 WeakPolarHBondContact O-CA 3.16Å; L29-A65 WeakPolarHBondContact CA-O 3.45Å; L29-A65 HydrophobicContact CB-CB 4.37Å; L29-A65 WeakPolarHBondContact CB-O 3.33Å; L29-A65 HydrophobicContact CD2-CB 4.48Å; L29-A65 PolarHBondContact N-O 2.87Å; L29-A65 PolarHBondContact O-N 3.3Å; L29-I67 HydrophobicContact CB-CD1 4.25Å; L29-I67 HydrophobicContact CD1-CD1 3.8Å; L29-I86 HydrophobicContact CD1-CD1 4Å; L29-V91 HydrophobicContact CD2-CB 4.21Å; L29-V91 HydrophobicContact CD2-CG1 4Å; L29-V91 HydrophobicContact CG-CB 4.24Å; L29-V91 HydrophobicContact CG-CG1 4.49Å; L29-R92 CarbonylContact C-O 3.57Å; L29-R92 WeakPolarHBondContact CA-O 3.28Å; L29-L93 HydrophobicContact CB-CD2 3.77Å; L29-L93 HydrophobicContact CD1-CD2 3.77Å; L29-L93 HydrophobicContact CG-CD2 3.68Å
30	Q	86.1	Confident	70.2	Confident	42 Å²	42	56.7 Å²	56.7	20%	0.196	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	149.4	175.6	-61.1	-175.2	-43	0	0	110.4	R28 E64 V91 R92 L94	R28-Q30 HydrophobicContact CG-CG 4.32Å; Q30-E64 HydrophobicContact CG-CG 4.17Å; Q30-E64 PolarHBondContact NE2-OE1 3.41Å; Q30-V91 CarbonylContact O-C 3.6Å; Q30-V91 WeakPolarHBondContact O-CA 3.45Å; Q30-R92 HydrophobicContact CB-CB 4.43Å; Q30-R92 PolarHBondContact N-O 2.99Å; Q30-R92 PolarHBondContact O-N 3.33Å; Q30-L94 HydrophobicContact CG-CD1 4.21Å; Q30-L94 VanDerWaalsContact OE1-CD1 3.24Å
31	G	73.9	Confident	72.5	Confident	27 Å²	27	51.7 Å²	51.7	28%	0.278	31%	0.306	S	S	.	.			trans	81.6	27.6	177.7	0	0	0	0	0	113.8	L62 D63 S89	G31-L62 PolarHBondContact N-O 2.85Å; G31-D63 PolarHBondContact N-O 3.02Å; G31-S89 WeakPolarHBondContact O-CB 3.24Å
32	L	77.1	Confident	74.5	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.026	29%	0.292	C	S	.	.			trans	-63.3	147.3	169.7	-164.1	67.7	0	0	0	108.8	L29 A36 I41 I57 D63 A65 I86	L29-L32 HydrophobicContact CD2-CB 3.8Å; L29-L32 HydrophobicContact CD2-CD1 3.93Å; L29-L32 HydrophobicContact CD2-CG 4.39Å; L32-A36 HydrophobicContact CD1-CB 3.81Å; L32-A36 HydrophobicContact CG-CB 3.91Å; L32-I41 HydrophobicContact CD1-CD1 3.94Å; L32-I41 HydrophobicContact CD1-CG1 3.72Å; L32-I41 HydrophobicContact CD2-CD1 3.83Å; L32-I41 HydrophobicContact CD2-CG1 4.49Å; L32-I57 HydrophobicContact CD2-CD1 4.29Å; L32-I57 HydrophobicContact CD2-CG1 4.29Å; L32-I57 HydrophobicContact CD2-CG2 3.98Å; L32-D63 HydrophobicContact CB-CB 4.31Å; L32-D63 WeakPolarHBondContact CB-O 3.45Å; L32-D63 PolarHBondContact N-O 3.33Å; L32-D63 WeakPolarHBondContact O-CB 3.11Å; L32-A65 HydrophobicContact CD2-CB 4.21Å; L32-I86 HydrophobicContact CD1-CD1 4.34Å; L32-I86 HydrophobicContact CD1-CG2 4.07Å
33	S	68.9	Low	76.2	Confident	23 Å²	23	51.6 Å²	51.6	16%	0.161	29%	0.292	C	S	.	.			trans	-74.2	142.4	169.9	-179	0	0	0	0	109.4	T35 A36	S33-T35 PolarHBondContact O-N 3.02Å; S33-T35 PolarHBondContact OG-N 3.29Å; S33-T35 PolarHBondContact OG-OG1 3.31Å; S33-A36 WeakPolarHBondContact O-CB 3.43Å; S33-A36 PolarHBondContact O-N 3.3Å
34	V	67.4	Low	77.4	Confident	124 Å²	124	47 Å²	47	75%	0.752	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-22.3	170.3	-175.3	0	0	0	0	112.4	D63	V34-D63 WeakPolarHBondContact CG2-OD1 3.49Å; V34-D63 WeakPolarHBondContact CG2-OD2 3.48Å
35	T	66.6	Low	78.3	Confident	113 Å²	113	45.5 Å²	45.5	69%	0.693	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-9.1	177.9	60.7	0	0	0	0	114.8	S33	S33-T35 PolarHBondContact O-N 3.02Å; S33-T35 PolarHBondContact OG-N 3.29Å; S33-T35 PolarHBondContact OG-OG1 3.31Å
36	A	67.8	Low	78.2	Confident	9 Å²	9	48.1 Å²	48.1	7%	0.074	27%	0.272	C	S	.	.			trans	-88.4	127.7	-174.7	0	0	0	0	0	111.9	L32 S33 D40 I86 N87	L32-A36 HydrophobicContact CD1-CB 3.81Å; L32-A36 HydrophobicContact CG-CB 3.91Å; S33-A36 WeakPolarHBondContact O-CB 3.43Å; S33-A36 PolarHBondContact O-N 3.3Å; A36-D40 WeakPolarHBondContact CA-OD2 3.45Å; A36-D40 HydrophobicContact CB-CB 4.29Å; A36-I86 HydrophobicContact CB-CG2 4.09Å; A36-N87 HydrophobicContact CB-CB 4.43Å; A36-N87 WeakPolarHBondContact CB-ND2 3.45Å
37	G	74.8	Confident	77.6	Confident	30 Å²	30	51.4 Å²	51.4	31%	0.309	31%	0.306	S	S	.	.			trans	-97.3	179.2	-179.6	0	0	0	0	0	113.8	A39 D40 I41	G37-A39 PolarHBondContact O-N 2.92Å; G37-D40 PolarHBondContact N-OD2 3.35Å; G37-D40 VanDerWaalsContact N-OD2 3.07Å; G37-D40 PolarHBondContact O-N 3.1Å; G37-D40 VanDerWaalsContact O-N 3.09Å; G37-I41 PolarHBondContact O-N 3.09Å
38	S	77.2	Confident	77.3	Confident	62 Å²	62	52.3 Å²	52.3	43%	0.434	31%	0.311	S	S	.	.	H	α-helix	trans	-59.1	-29.6	175.2	55.9	0	0	0	0	112.8	R42	S38-R42 WeakPolarHBondContact O-CG 3.5Å; S38-R42 PolarHBondContact O-N 3.47Å; S38-R42 VanDerWaalsContact O-N 3.11Å
39	A	76.7	Confident	76.6	Confident	66 Å²	66	55.8 Å²	55.8	55%	0.545	33%	0.329	S	S	.	.	H	α-helix	trans	-66.6	-38.2	175	0	0	0	0	0	113.1	G37 R42 R43	G37-A39 PolarHBondContact O-N 2.92Å; A39-R42 PolarHBondContact O-N 3.13Å; A39-R43 WeakPolarHBondContact O-CB 3.05Å; A39-R43 PolarHBondContact O-N 3.41Å
40	D	80.8	Confident	76.2	Confident	47 Å²	47	56.8 Å²	56.8	25%	0.251	33%	0.334	S	S	.	.	H	α-helix	trans	-71	-37.2	-179.9	-63	-41.4	0	0	0	111.3	A36 G37 R43 F44 I86 N87	A36-D40 WeakPolarHBondContact CA-OD2 3.45Å; A36-D40 HydrophobicContact CB-CB 4.29Å; G37-D40 PolarHBondContact N-OD2 3.35Å; G37-D40 VanDerWaalsContact N-OD2 3.07Å; G37-D40 PolarHBondContact O-N 3.1Å; G37-D40 VanDerWaalsContact O-N 3.09Å; D40-R43 WeakPolarHBondContact O-CB 3.16Å; D40-R43 PolarHBondContact O-N 2.79Å; D40-F44 PolarHBondContact O-N 2.67Å; D40-I86 HydrophobicContact CB-CG2 4.14Å; D40-N87 PolarHBondContact OD2-ND2 2.82Å
41	I	81.9	Confident	75.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62.1	-46.9	173.1	-62.3	169.7	0	0	0	109.9	L29 L32 G37 R43 F44 F45 V55 I57 A65 I67	L29-I41 HydrophobicContact CD1-CG2 4.43Å; L32-I41 HydrophobicContact CD1-CD1 3.94Å; L32-I41 HydrophobicContact CD1-CG1 3.72Å; L32-I41 HydrophobicContact CD2-CD1 3.83Å; L32-I41 HydrophobicContact CD2-CG1 4.49Å; G37-I41 PolarHBondContact O-N 3.09Å; I41-R43 VanDerWaalsContact C-N 3.28Å; I41-R43 PolarHBondContact O-N 3.43Å; I41-F44 WeakPolarHBondContact O-CB 3.2Å; I41-F44 PolarHBondContact O-N 3.21Å; I41-F45 HydrophobicContact CG2-CD2 3.89Å; I41-F45 HydrophobicContact CG2-CE2 3.92Å; I41-F45 WeakPolarHBondContact O-CD2 3.24Å; I41-F45 PolarHBondContact O-N 3.37Å; I41-F45 VanDerWaalsContact O-N 3.09Å; I41-V55 HydrophobicContact CB-CG1 4.37Å; I41-V55 HydrophobicContact CD1-CG1 3.61Å; I41-V55 HydrophobicContact CG2-CG1 4.15Å; I41-V55 HydrophobicContact CG2-CG2 4.37Å; I41-I57 HydrophobicContact CD1-CD1 3.97Å; I41-I57 HydrophobicContact CD1-CG1 3.97Å; I41-A65 HydrophobicContact CD1-CB 4.03Å; I41-I67 HydrophobicContact CG2-CD1 3.51Å; I41-I67 HydrophobicContact CG2-CG1 4.18Å
42	R	79.6	Confident	74.6	Confident	93 Å²	93	60.7 Å²	60.7	35%	0.351	35%	0.352	S	S	.	.	H	α-helix	trans	-61.1	-37	175.2	-73.8	174.1	172.4	-145.4	-13.2	112.5	S38 A39 F44 F45 T46 P51 D52	S38-R42 WeakPolarHBondContact O-CG 3.5Å; S38-R42 PolarHBondContact O-N 3.47Å; S38-R42 VanDerWaalsContact O-N 3.11Å; A39-R42 PolarHBondContact O-N 3.13Å; R42-F44 VanDerWaalsContact C-N 3.35Å; R42-F45 CarbonylContact O-C 3.58Å; R42-F45 PolarHBondContact O-N 3.05Å; R42-T46 PolarHBondContact O-N 3.01Å; R42-P51 PolarHBondContact NH2-O 3.07Å; R42-D52 IonicContact CZ-OD1 2.67Å; R42-D52 IonicContact NH1-OD1 3.34Å; R42-D52 PolarHBondContact NH1-OD1 3.28Å; R42-D52 VanDerWaalsContact NH2-CA 3.3Å; R42-D52 IonicContact NH2-OD1 3.79Å; R42-D52 PolarHBondContact NH2-OD1 3.05Å
43	R	79.4	Confident	74.2	Confident	194 Å²	194	61.7 Å²	61.7	73%	0.732	36%	0.364	S	S	*	.	H	α-helix	trans	-67.3	-35.8	176.5	-161.7	177.1	-172.3	179.7	2.5	112.3	A39 D40 I41 F45 T46	A39-R43 WeakPolarHBondContact O-CB 3.05Å; A39-R43 PolarHBondContact O-N 3.41Å; D40-R43 WeakPolarHBondContact O-CB 3.16Å; D40-R43 PolarHBondContact O-N 2.79Å; I41-R43 VanDerWaalsContact C-N 3.28Å; I41-R43 PolarHBondContact O-N 3.43Å; R43-F45 VanDerWaalsContact C-N 3.34Å; R43-T46 HydrophobicContact CG-CG2 4.43Å; R43-T46 WeakPolarHBondContact O-CG2 3.3Å; R43-T46 PolarHBondContact O-N 2.64Å; R43-T46 PolarHBondContact O-OG1 3.43Å
44	F	80.9	Confident	74.4	Confident	36 Å²	36	60.9 Å²	60.9	16%	0.158	36%	0.36	C	S	.	.	H	α-helix	trans	-67.2	-36.2	174.5	-177.5	-98.5	0	0	0	112.3	D40 I41 R42 R81 I86 V91	D40-F44 PolarHBondContact O-N 2.67Å; I41-F44 WeakPolarHBondContact O-CB 3.2Å; I41-F44 PolarHBondContact O-N 3.21Å; R42-F44 VanDerWaalsContact C-N 3.35Å; F44-R81 HydrophobicContact CE1-CB 4.02Å; F44-R81 HydrophobicContact CZ-CB 4.16Å; F44-R81 WeakPolarHBondContact CZ-O 2.86Å; F44-R81 PolarHBondContact O-NH1 2.92Å; F44-I86 HydrophobicContact CB-CD1 3.66Å; F44-I86 HydrophobicContact CB-CG1 3.85Å; F44-I86 HydrophobicContact CD1-CD1 3.85Å; F44-I86 HydrophobicContact CD1-CG1 4.23Å; F44-I86 HydrophobicContact CD2-CD1 4.04Å; F44-I86 HydrophobicContact CD2-CG1 3.5Å; F44-I86 HydrophobicContact CE1-CD1 4.5Å; F44-I86 HydrophobicContact CE2-CG1 4.05Å; F44-I86 HydrophobicContact CG-CD1 3.57Å; F44-I86 HydrophobicContact CG-CG1 3.59Å; F44-V91 HydrophobicContact CE1-CG2 4.02Å; F44-V91 HydrophobicContact CE2-CG2 4.26Å; F44-V91 HydrophobicContact CZ-CG2 3.79Å
45	F	81.2	Confident	75.1	Confident	2 Å²	2	56 Å²	56	1%	0.009	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	28	176.7	-63.7	-67.2	0	0	0	113.9	L29 I41 R42 R43 G47 L48 I50 I67 F69 A78 L93	L29-F45 HydrophobicContact CD1-CE2 4.12Å; L29-F45 HydrophobicContact CD1-CZ 4.48Å; I41-F45 HydrophobicContact CG2-CD2 3.89Å; I41-F45 HydrophobicContact CG2-CE2 3.92Å; I41-F45 WeakPolarHBondContact O-CD2 3.24Å; I41-F45 PolarHBondContact O-N 3.37Å; I41-F45 VanDerWaalsContact O-N 3.09Å; R42-F45 CarbonylContact O-C 3.58Å; R42-F45 PolarHBondContact O-N 3.05Å; R43-F45 VanDerWaalsContact C-N 3.34Å; F45-G47 PolarHBondContact O-N 2.89Å; F45-L48 HydrophobicContact CB-CB 4.49Å; F45-L48 HydrophobicContact CB-CD1 4.36Å; F45-L48 HydrophobicContact CD1-CD1 3.86Å; F45-L48 PolarHBondContact O-N 3.3Å; F45-I50 HydrophobicContact CB-CD1 3.55Å; F45-I50 HydrophobicContact CD2-CD1 3.84Å; F45-I50 HydrophobicContact CG-CD1 3.93Å; F45-I67 HydrophobicContact CD2-CD1 3.99Å; F45-I67 HydrophobicContact CE2-CD1 3.29Å; F45-I67 HydrophobicContact CZ-CD1 3.99Å; F45-F69 HydrophobicContact CD1-CZ 4.48Å; F45-A78 HydrophobicContact CD1-CB 3.97Å; F45-A78 HydrophobicContact CE1-CB 3.72Å; F45-L93 HydrophobicContact CE1-CD1 3.63Å; F45-L93 HydrophobicContact CZ-CD1 3.54Å; F45-L93 HydrophobicContact CZ-CD2 3.75Å; F45-L93 HydrophobicContact CZ-CG 4.3Å
46	T	76.9	Confident	75.4	Confident	84 Å²	84	53.5 Å²	53.5	52%	0.515	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	127.1	175.7	50.8	0	0	0	0	111	R42 R43 R81	R42-T46 PolarHBondContact O-N 3.01Å; R43-T46 HydrophobicContact CG-CG2 4.43Å; R43-T46 WeakPolarHBondContact O-CG2 3.3Å; R43-T46 PolarHBondContact O-N 2.64Å; R43-T46 PolarHBondContact O-OG1 3.43Å; T46-R81 PolarHBondContact O-NH1 3.42Å; T46-R81 PolarHBondContact O-NH2 3.28Å; T46-R81 VanDerWaalsContact O-NH2 3.15Å
47	G	70.6	Confident	76.1	Confident	75 Å²	75	56.8 Å²	56.8	77%	0.773	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.3	1.4	-176.6	0	0	0	0	0	114.9	F45	F45-G47 PolarHBondContact O-N 2.89Å
48	L	81.2	Confident	76	Confident	20 Å²	20	56.8 Å²	56.8	11%	0.105	32%	0.318	C	S	.	.	S	Bend	trans	-113.5	140.8	171.1	-55.4	179.4	0	0	0	109.9	F45 I50 F69 D74 R77 A78	F45-L48 HydrophobicContact CB-CB 4.49Å; F45-L48 HydrophobicContact CB-CD1 4.36Å; F45-L48 HydrophobicContact CD1-CD1 3.86Å; F45-L48 PolarHBondContact O-N 3.3Å; L48-I50 PolarHBondContact O-N 3.01Å; L48-I50 VanDerWaalsContact O-N 3.13Å; L48-F69 HydrophobicContact CB-CE1 4.17Å; L48-F69 HydrophobicContact CD1-CE1 4.33Å; L48-D74 HydrophobicContact CB-CB 4.46Å; L48-R77 HydrophobicContact CD1-CB 4.23Å; L48-R77 HydrophobicContact CD2-CB 3.44Å; L48-R77 VanDerWaalsContact CD2-CB 3.44Å; L48-R77 HydrophobicContact CD2-CG 4.27Å; L48-R77 HydrophobicContact CG-CB 4.49Å; L48-A78 HydrophobicContact CD1-CB 3.66Å
49	H	71.8	Confident	75.5	Confident	120 Å²	120	56.5 Å²	56.5	56%	0.556	33%	0.325	S	S	*	.			trans	-83.6	94	-177.6	-169.2	-85.6	0	0	0	110.9	D74	H49-D74 WeakPolarHBondContact CB-OD2 3.44Å; H49-D74 PolarHBondContact N-OD2 2.83Å
50	I	79	Confident	74.6	Confident	20 Å²	20	54.9 Å²	54.9	10%	0.103	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-94.7	117.1	168.5	-56.8	170.4	0	0	0	107.5	F45 L48 V55 I67 F69	F45-I50 HydrophobicContact CB-CD1 3.55Å; F45-I50 HydrophobicContact CD2-CD1 3.84Å; F45-I50 HydrophobicContact CG-CD1 3.93Å; L48-I50 PolarHBondContact O-N 3.01Å; L48-I50 VanDerWaalsContact O-N 3.13Å; I50-V55 HydrophobicContact CG2-CG2 3.83Å; I50-I67 HydrophobicContact CD1-CG2 3.94Å; I50-I67 HydrophobicContact CG1-CG2 4.18Å; I50-I67 HydrophobicContact CG2-CG2 3.99Å; I50-F69 HydrophobicContact CD1-CE1 4.01Å; I50-F69 HydrophobicContact CD1-CZ 4.08Å; I50-F69 HydrophobicContact CG1-CD1 4Å; I50-F69 HydrophobicContact CG1-CE1 3.45Å; I50-F69 VanDerWaalsContact CG1-CE1 3.45Å; I50-F69 HydrophobicContact CG1-CZ 3.96Å
51	P	70.8	Confident	73.3	Confident	39 Å²	39	60.9 Å²	60.9	25%	0.253	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-55.8	152.8	176.6	-24.9	35.1	0	0	0	113	R42 G53 G54 I68 A70	R42-P51 PolarHBondContact NH2-O 3.07Å; P51-G53 PolarHBondContact O-N 2.74Å; P51-G54 PolarHBondContact O-N 2.76Å; P51-I68 WeakPolarHBondContact CD-O 3.45Å; P51-A70 HydrophobicContact CG-CB 3.73Å
52	D	56.2	Low	72	Confident	112 Å²	112	66 Å²	66	60%	0.599	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	127	165	-68	-33.2	0	0	0	110.1	R42	R42-D52 IonicContact CZ-OD1 2.67Å; R42-D52 IonicContact NH1-OD1 3.34Å; R42-D52 PolarHBondContact NH1-OD1 3.28Å; R42-D52 VanDerWaalsContact NH2-CA 3.3Å; R42-D52 IonicContact NH2-OD1 3.79Å; R42-D52 PolarHBondContact NH2-OD1 3.05Å
53	G	67.5	Low	71.7	Confident	27 Å²	27	64.1 Å²	64.1	28%	0.278	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	-14.8	-169	0	0	0	0	0	115.7	P51 V55 H56	P51-G53 PolarHBondContact O-N 2.74Å; G53-V55 PolarHBondContact O-N 3.19Å; G53-H56 PolarHBondContact O-CE1 2.88Å; G53-H56 PolarHBondContact O-ND1 2.84Å
54	G	74.5	Confident	71.8	Confident	6 Å²	6	55.6 Å²	55.6	6%	0.062	33%	0.334	C	S	.	.			trans	-70.6	-0.7	-174.1	0	0	0	0	0	116.7	P51 I67 I68	P51-G54 PolarHBondContact O-N 2.76Å; G54-I67 CarbonylContact O-C 3.51Å; G54-I67 VanDerWaalsContact O-CA 3.3Å; G54-I67 WeakPolarHBondContact O-CA 3.38Å; G54-I68 PolarHBondContact O-N 2.93Å
55	V	82.1	Confident	72	Confident	21 Å²	21	53.9 Å²	53.9	13%	0.127	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	119.9	-180	-177.2	0	0	0	0	109.3	I41 I50 G53 I57 F66 I67	I41-V55 HydrophobicContact CB-CG1 4.37Å; I41-V55 HydrophobicContact CD1-CG1 3.61Å; I41-V55 HydrophobicContact CG2-CG1 4.15Å; I41-V55 HydrophobicContact CG2-CG2 4.37Å; I50-V55 HydrophobicContact CG2-CG2 3.83Å; G53-V55 PolarHBondContact O-N 3.19Å; V55-I57 HydrophobicContact CG1-CG1 4.27Å; V55-F66 CarbonylContact C-O 3.6Å; V55-I67 HydrophobicContact CG2-CG2 4.43Å
56	H	73.5	Confident	72.3	Confident	61 Å²	61	53.8 Å²	53.8	28%	0.282	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	107.6	-179.6	-71.4	18.9	0	0	0	109.7	G53 A65 F66 M101	G53-H56 PolarHBondContact O-CE1 2.88Å; G53-H56 PolarHBondContact O-ND1 2.84Å; H56-A65 CarbonylContact O-C 3.38Å; H56-A65 VanDerWaalsContact O-CA 3.24Å; H56-A65 WeakPolarHBondContact O-CA 3.04Å; H56-F66 HydrophobicContact CB-CB 4.38Å; H56-F66 PolarHBondContact N-O 3.29Å; H56-F66 PolarHBondContact O-N 2.87Å; H56-M101 HydrophobicContact CB-CE 3.85Å; H56-M101 WeakPolarHBondContact CD2-CE 3.31Å
57	I	81.9	Confident	72.7	Confident	77 Å²	77	49.8 Å²	49.8	40%	0.395	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	117.3	179.5	-56.5	172.1	0	0	0	107.8	L32 I41 V55 A65	L32-I57 HydrophobicContact CD2-CD1 4.29Å; L32-I57 HydrophobicContact CD2-CG1 4.29Å; L32-I57 HydrophobicContact CD2-CG2 3.98Å; I41-I57 HydrophobicContact CD1-CD1 3.97Å; I41-I57 HydrophobicContact CD1-CG1 3.97Å; V55-I57 HydrophobicContact CG1-CG1 4.27Å; I57-A65 HydrophobicContact CG1-CB 4.1Å
58	I	72.6	Confident	73.4	Confident	30 Å²	30	47.1 Å²	47.1	15%	0.154	27%	0.269	C	S	.	.			trans	-97.6	-15.8	-174.1	-58.4	-169.9	0	0	0	111.6	G60 E64 F66 V104 L105 T108	I58-G60 VanDerWaalsContact C-N 3.31Å; I58-G60 PolarHBondContact O-N 2.81Å; I58-E64 PolarHBondContact N-O 3.15Å; I58-F66 HydrophobicContact CD1-CD2 3.32Å; I58-F66 HydrophobicContact CD1-CE2 3.43Å; I58-F66 VanDerWaalsContact CD1-CE2 3.43Å; I58-F66 HydrophobicContact CD1-CG 4.5Å; I58-F66 HydrophobicContact CG1-CD2 4.01Å; I58-F66 HydrophobicContact CG1-CE2 4.37Å; I58-V104 HydrophobicContact CD1-CB 4.45Å; I58-V104 HydrophobicContact CD1-CG1 3.77Å; I58-V104 HydrophobicContact CG2-CG1 4.22Å; I58-L105 HydrophobicContact CD1-CD1 3.36Å; I58-L105 HydrophobicContact CD1-CG 4.15Å; I58-L105 HydrophobicContact CG1-CD1 4.27Å; I58-T108 HydrophobicContact CG2-CG2 3.62Å
59	G	65.4	Low	73.5	Confident	56 Å²	56	46.2 Å²	46.2	58%	0.577	26%	0.264	S	S	*	.			trans	54.9	42.2	166.6	0	0	0	0	0	114.1	E64	G59-E64 PolarHBondContact N-O 3.03Å
60	G	58.5	Low	73.7	Confident	33 Å²	33	42.9 Å²	42.9	34%	0.34	26%	0.258	S	S	.	.			trans	-90.7	-170.5	177.7	0	0	0	0	0	113.9	I58 L62 D63	I58-G60 VanDerWaalsContact C-N 3.31Å; I58-G60 PolarHBondContact O-N 2.81Å; G60-L62 PolarHBondContact O-N 3.26Å; G60-D63 PolarHBondContact O-N 2.68Å
61	E	53.2	Low	73.7	Confident	172 Å²	172	43.8 Å²	43.8	80%	0.804	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-13.5	-178	-65.7	170	-156.5	0	0	115	K111	E61-K111 IonicContact OE1-NZ 2.71Å; E61-K111 PolarHBondContact OE1-NZ 2.85Å
62	L	54.6	Low	74.1	Confident	109 Å²	109	45 Å²	45	57%	0.571	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	10.9	179.3	-64.6	175.4	0	0	0	113.1	G31 G60 E64	G31-L62 PolarHBondContact N-O 2.85Å; G60-L62 PolarHBondContact O-N 3.26Å; L62-E64 HydrophobicContact CB-CG 3.68Å; L62-E64 WeakPolarHBondContact CD1-OE1 3.35Å; L62-E64 PolarHBondContact O-N 2.83Å
63	D	73.8	Confident	75.3	Confident	53 Å²	53	43 Å²	43	28%	0.283	26%	0.257	S	S	.	.			trans	45.3	63.8	-177.3	-64.3	-39.2	0	0	0	112.5	G31 L32 V34 G60	G31-D63 PolarHBondContact N-O 3.02Å; L32-D63 HydrophobicContact CB-CB 4.31Å; L32-D63 WeakPolarHBondContact CB-O 3.45Å; L32-D63 PolarHBondContact N-O 3.33Å; L32-D63 WeakPolarHBondContact O-CB 3.11Å; V34-D63 WeakPolarHBondContact CG2-OD1 3.49Å; V34-D63 WeakPolarHBondContact CG2-OD2 3.48Å; G60-D63 PolarHBondContact O-N 2.68Å
64	E	82.4	Confident	76.1	Confident	15 Å²	15	42.9 Å²	42.9	7%	0.07	25%	0.25	C	S	.	.			trans	-98.8	146.3	-172.2	-52.5	-170.9	151.3	0	0	112.6	R28 L29 Q30 I58 G59 L62	R28-E64 IonicContact CZ-OE1 2.73Å; R28-E64 IonicContact CZ-OE2 3.74Å; R28-E64 VanDerWaalsContact CZ-OE2 3.31Å; R28-E64 IonicContact NE-OE1 3.2Å; R28-E64 PolarHBondContact NE-OE1 3.47Å; R28-E64 IonicContact NE-OE2 3.67Å; R28-E64 PolarHBondContact NE-OE2 2.98Å; R28-E64 VanDerWaalsContact NE-OE2 3.07Å; R28-E64 IonicContact NH2-OE1 2.67Å; R28-E64 PolarHBondContact NH2-OE1 3.41Å; R28-E64 IonicContact NH2-OE2 3.71Å; R28-E64 PolarHBondContact NH2-OE2 2.98Å; L29-E64 CarbonylContact O-C 3.48Å; L29-E64 VanDerWaalsContact O-CA 3.26Å; L29-E64 WeakPolarHBondContact O-CA 3.16Å; Q30-E64 HydrophobicContact CG-CG 4.17Å; Q30-E64 PolarHBondContact NE2-OE1 3.41Å; I58-E64 PolarHBondContact N-O 3.15Å; G59-E64 PolarHBondContact N-O 3.03Å; L62-E64 HydrophobicContact CB-CG 3.68Å; L62-E64 WeakPolarHBondContact CD1-OE1 3.35Å; L62-E64 PolarHBondContact O-N 2.83Å
65	A	85.3	Confident	76.6	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	149.4	170.1	0	0	0	0	0	110.4	L29 L32 I41 H56 I57	L29-A65 WeakPolarHBondContact CA-O 3.45Å; L29-A65 HydrophobicContact CB-CB 4.37Å; L29-A65 WeakPolarHBondContact CB-O 3.33Å; L29-A65 HydrophobicContact CD2-CB 4.48Å; L29-A65 PolarHBondContact N-O 2.87Å; L29-A65 PolarHBondContact O-N 3.3Å; L32-A65 HydrophobicContact CD2-CB 4.21Å; I41-A65 HydrophobicContact CD1-CB 4.03Å; H56-A65 CarbonylContact O-C 3.38Å; H56-A65 VanDerWaalsContact O-CA 3.24Å; H56-A65 WeakPolarHBondContact O-CA 3.04Å; I57-A65 HydrophobicContact CG1-CB 4.1Å
66	F	86.3	Confident	76.7	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	139.2	171.4	-71.9	-95.1	0	0	0	109	V26 I27 R28 V55 H56 I58 M101 V104	V26-F66 HydrophobicContact CG1-CD1 3.95Å; I27-F66 CarbonylContact O-C 3.52Å; I27-F66 WeakPolarHBondContact O-CA 3.41Å; R28-F66 HydrophobicContact CB-CD1 4.06Å; R28-F66 HydrophobicContact CB-CE1 3.75Å; R28-F66 HydrophobicContact CB-CZ 4.32Å; R28-F66 HydrophobicContact CG-CD1 4.35Å; R28-F66 HydrophobicContact CG-CE1 3.79Å; R28-F66 HydrophobicContact CG-CE2 4.41Å; R28-F66 HydrophobicContact CG-CZ 3.83Å; V55-F66 CarbonylContact C-O 3.6Å; H56-F66 HydrophobicContact CB-CB 4.38Å; H56-F66 PolarHBondContact N-O 3.29Å; H56-F66 PolarHBondContact O-N 2.87Å; I58-F66 HydrophobicContact CD1-CD2 3.32Å; I58-F66 HydrophobicContact CD1-CE2 3.43Å; I58-F66 VanDerWaalsContact CD1-CE2 3.43Å; I58-F66 HydrophobicContact CD1-CG 4.5Å; I58-F66 HydrophobicContact CG1-CD2 4.01Å; I58-F66 HydrophobicContact CG1-CE2 4.37Å; F66-M101 HydrophobicContact CB-CE 3.63Å; F66-M101 HydrophobicContact CB-CG 4.07Å; F66-M101 HydrophobicContact CB-SD 4.02Å; F66-M101 HydrophobicContact CD1-CB 3.84Å; F66-M101 HydrophobicContact CD1-CG 3.88Å; F66-M101 HydrophobicContact CD1-SD 4.47Å; F66-M101 HydrophobicContact CE1-CB 4.06Å; F66-M101 HydrophobicContact CE1-CG 4.46Å; F66-M101 HydrophobicContact CG-CB 4.35Å; F66-M101 HydrophobicContact CG-CE 4.45Å; F66-M101 HydrophobicContact CG-CG 3.89Å; F66-M101 HydrophobicContact CG-SD 4.44Å; F66-V104 HydrophobicContact CE2-CB 4.27Å; F66-V104 HydrophobicContact CE2-CG1 3.96Å; F66-V104 HydrophobicContact CZ-CB 4.22Å; F66-V104 HydrophobicContact CZ-CG1 4.29Å; F66-V104 HydrophobicContact CZ-CG2 4.21Å
67	I	86.5	Confident	77.2	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	124.9	-178.4	-52.1	171.9	0	0	0	107.6	I27 L29 I41 F45 I50 G54 V55 F69	I27-I67 PolarHBondContact N-O 2.91Å; I27-I67 PolarHBondContact O-N 2.76Å; L29-I67 HydrophobicContact CB-CD1 4.25Å; L29-I67 HydrophobicContact CD1-CD1 3.8Å; I41-I67 HydrophobicContact CG2-CD1 3.51Å; I41-I67 HydrophobicContact CG2-CG1 4.18Å; F45-I67 HydrophobicContact CD2-CD1 3.99Å; F45-I67 HydrophobicContact CE2-CD1 3.29Å; F45-I67 HydrophobicContact CZ-CD1 3.99Å; I50-I67 HydrophobicContact CD1-CG2 3.94Å; I50-I67 HydrophobicContact CG1-CG2 4.18Å; I50-I67 HydrophobicContact CG2-CG2 3.99Å; G54-I67 CarbonylContact O-C 3.51Å; G54-I67 VanDerWaalsContact O-CA 3.3Å; G54-I67 WeakPolarHBondContact O-CA 3.38Å; V55-I67 HydrophobicContact CG2-CG2 4.43Å; I67-F69 HydrophobicContact CB-CE2 3.94Å; I67-F69 HydrophobicContact CG2-CD2 4.05Å; I67-F69 HydrophobicContact CG2-CE1 4.48Å; I67-F69 HydrophobicContact CG2-CE2 3.41Å; I67-F69 VanDerWaalsContact CG2-CE2 3.41Å; I67-F69 HydrophobicContact CG2-CZ 3.68Å
68	I	84.3	Confident	77.4	Confident	19 Å²	19	47.8 Å²	47.8	10%	0.097	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	121.2	178.3	-52.2	176.8	0	0	0	107.5	A24 V26 P51 G54 M101 Y588	A24-I68 HydrophobicContact CB-CG2 4.3Å; V26-I68 HydrophobicContact CG2-CG1 4.34Å; P51-I68 WeakPolarHBondContact CD-O 3.45Å; G54-I68 PolarHBondContact O-N 2.93Å; I68-M101 HydrophobicContact CD1-CE 3.78Å; I68-M101 HydrophobicContact CD1-SD 4.04Å; I68-M101 HydrophobicContact CG1-CE 3.99Å; I68-M101 HydrophobicContact CG1-SD 4.1Å; I68-Y588 WeakPolarHBondContact CG2-OH 3.49Å
69	F	84	Confident	78	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	135.6	174	-69.9	-89.6	0	0	0	109.8	V25 I27 F45 L48 I50 I67 S71 D74 A75 A78	V25-F69 PolarHBondContact N-O 2.92Å; V25-F69 PolarHBondContact O-N 2.83Å; I27-F69 HydrophobicContact CB-CD2 4.41Å; I27-F69 HydrophobicContact CB-CE2 4.09Å; I27-F69 HydrophobicContact CD1-CD2 3.77Å; I27-F69 HydrophobicContact CD1-CE2 3.56Å; I27-F69 HydrophobicContact CD1-CZ 4.47Å; I27-F69 HydrophobicContact CG1-CD2 3.99Å; I27-F69 HydrophobicContact CG1-CE2 3.98Å; F45-F69 HydrophobicContact CD1-CZ 4.48Å; L48-F69 HydrophobicContact CB-CE1 4.17Å; L48-F69 HydrophobicContact CD1-CE1 4.33Å; I50-F69 HydrophobicContact CD1-CE1 4.01Å; I50-F69 HydrophobicContact CD1-CZ 4.08Å; I50-F69 HydrophobicContact CG1-CD1 4Å; I50-F69 HydrophobicContact CG1-CE1 3.45Å; I50-F69 VanDerWaalsContact CG1-CE1 3.45Å; I50-F69 HydrophobicContact CG1-CZ 3.96Å; I67-F69 HydrophobicContact CB-CE2 3.94Å; I67-F69 HydrophobicContact CG2-CD2 4.05Å; I67-F69 HydrophobicContact CG2-CE1 4.48Å; I67-F69 HydrophobicContact CG2-CE2 3.41Å; I67-F69 VanDerWaalsContact CG2-CE2 3.41Å; I67-F69 HydrophobicContact CG2-CZ 3.68Å; F69-S71 PolarHBondContact O-N 2.96Å; F69-D74 HydrophobicContact CD1-CB 3.81Å; F69-A75 HydrophobicContact CB-CB 4.02Å; F69-A75 HydrophobicContact CD2-CB 4.22Å; F69-A75 HydrophobicContact CG-CB 4.16Å; F69-A78 HydrophobicContact CE1-CB 3.86Å; F69-A78 HydrophobicContact CE2-CB 3.83Å; F69-A78 HydrophobicContact CZ-CB 3.35Å
70	A	75.3	Confident	78.7	Confident	51 Å²	51	50.4 Å²	50.4	42%	0.421	27%	0.27	S	S	.	.	S	Bend	trans	-72.5	-19.9	176.2	0	0	0	0	0	112.9	P51	P51-A70 HydrophobicContact CG-CB 3.73Å
71	S	79.2	Confident	79.8	Confident	39 Å²	39	53.5 Å²	53.5	27%	0.273	27%	0.272	S	S	.	.			trans	-127.1	141.8	178.2	178.3	0	0	0	0	111	F69 E73 D74 A75	F69-S71 PolarHBondContact O-N 2.96Å; S71-E73 PolarHBondContact O-N 2.71Å; S71-E73 PolarHBondContact OG-N 2.98Å; S71-E73 VanDerWaalsContact OG-N 3.16Å; S71-D74 PolarHBondContact O-N 3.5Å; S71-A75 PolarHBondContact O-N 3.2Å; S71-A75 VanDerWaalsContact O-N 3.14Å
72	D	79.6	Confident	81.3	Confident	65 Å²	65	47.8 Å²	47.8	35%	0.348	25%	0.25	S	S	.	.	H	α-helix	trans	-65	-29	170.8	65.6	-62.2	0	0	0	112.6	V25 A75 R76	V25-D72 HydrophobicContact CG2-CB 3.99Å; D72-A75 PolarHBondContact O-N 3.01Å; D72-R76 WeakPolarHBondContact O-CG 3.38Å; D72-R76 PolarHBondContact O-N 3.07Å; D72-R76 IonicContact OD2-CZ 2.76Å; D72-R76 IonicContact OD2-NH1 3.49Å; D72-R76 PolarHBondContact OD2-NH1 2.89Å; D72-R76 IonicContact OD2-NH2 3.45Å; D72-R76 PolarHBondContact OD2-NH2 3.29Å
73	E	81	Confident	82.4	Confident	68 Å²	68	44.8 Å²	44.8	32%	0.318	25%	0.246	S	C	.	.	H	α-helix	trans	-69.2	-42.5	176.2	-179.5	56.7	-161.3	0	0	111.6	S71 A75 R76 R77	S71-E73 PolarHBondContact O-N 2.71Å; S71-E73 PolarHBondContact OG-N 2.98Å; S71-E73 VanDerWaalsContact OG-N 3.16Å; E73-A75 VanDerWaalsContact C-N 3.32Å; E73-A75 PolarHBondContact O-N 2.74Å; E73-R76 PolarHBondContact O-N 2.78Å; E73-R76 IonicContact OE2-CZ 3.89Å; E73-R76 IonicContact OE2-NE 3.01Å; E73-R76 PolarHBondContact OE2-NE 3.07Å; E73-R76 VanDerWaalsContact OE2-NE 3.1Å; E73-R76 IonicContact OE2-NH2 3.58Å; E73-R76 PolarHBondContact OE2-NH2 3.32Å; E73-R77 WeakPolarHBondContact O-CG 3.32Å; E73-R77 PolarHBondContact O-N 2.98Å; E73-R77 VanDerWaalsContact O-N 3.09Å; E73-R77 IonicContact OE1-CZ 3.67Å; E73-R77 IonicContact OE1-NE 2.86Å; E73-R77 PolarHBondContact OE1-NE 3.36Å; E73-R77 IonicContact OE1-NH2 3.05Å; E73-R77 PolarHBondContact OE1-NH2 3.25Å
74	D	85.2	Confident	82.7	Confident	25 Å²	25	43.2 Å²	43.2	13%	0.134	24%	0.243	C	C	.	.	H	α-helix	trans	-65.7	-38.2	174.6	-72.5	-35.7	0	0	0	111.5	L48 H49 F69 S71 R77 A78	L48-D74 HydrophobicContact CB-CB 4.46Å; H49-D74 WeakPolarHBondContact CB-OD2 3.44Å; H49-D74 PolarHBondContact N-OD2 2.83Å; F69-D74 HydrophobicContact CD1-CB 3.81Å; S71-D74 PolarHBondContact O-N 3.5Å; D74-R77 PolarHBondContact O-N 3.25Å; D74-A78 WeakPolarHBondContact O-CB 3.19Å; D74-A78 PolarHBondContact O-N 3.04Å
75	A	84.4	Confident	82.6	Confident	3 Å²	3	49.4 Å²	49.4	3%	0.025	27%	0.269	C	S	.	.	H	α-helix	trans	-63	-41.4	174.8	0	0	0	0	0	112.4	V25 I27 F69 S71 D72 E73 R77 A78 M79	V25-A75 HydrophobicContact CB-CB 3.67Å; V25-A75 HydrophobicContact CG1-CB 3.54Å; V25-A75 HydrophobicContact CG2-CB 4.26Å; I27-A75 HydrophobicContact CD1-CB 3.98Å; I27-A75 WeakPolarHBondContact CD1-O 3.41Å; F69-A75 HydrophobicContact CB-CB 4.02Å; F69-A75 HydrophobicContact CD2-CB 4.22Å; F69-A75 HydrophobicContact CG-CB 4.16Å; S71-A75 PolarHBondContact O-N 3.2Å; S71-A75 VanDerWaalsContact O-N 3.14Å; D72-A75 PolarHBondContact O-N 3.01Å; E73-A75 VanDerWaalsContact C-N 3.32Å; E73-A75 PolarHBondContact O-N 2.74Å; A75-R77 PolarHBondContact O-N 3.35Å; A75-A78 WeakPolarHBondContact O-CB 3.33Å; A75-A78 PolarHBondContact O-N 3.15Å; A75-M79 WeakPolarHBondContact O-CG 3.41Å; A75-M79 PolarHBondContact O-N 3.16Å
76	R	82.8	Confident	82.4	Confident	134 Å²	134	49.6 Å²	49.6	51%	0.506	27%	0.271	S	S	.	.	H	α-helix	trans	-61.4	-44.2	174.7	-79.4	-172.8	-70.4	-87	1.4	111.9	D72 E73 A78 M79 A80	D72-R76 WeakPolarHBondContact O-CG 3.38Å; D72-R76 PolarHBondContact O-N 3.07Å; D72-R76 IonicContact OD2-CZ 2.76Å; D72-R76 IonicContact OD2-NH1 3.49Å; D72-R76 PolarHBondContact OD2-NH1 2.89Å; D72-R76 IonicContact OD2-NH2 3.45Å; D72-R76 PolarHBondContact OD2-NH2 3.29Å; E73-R76 PolarHBondContact O-N 2.78Å; E73-R76 IonicContact OE2-CZ 3.89Å; E73-R76 IonicContact OE2-NE 3.01Å; E73-R76 PolarHBondContact OE2-NE 3.07Å; E73-R76 VanDerWaalsContact OE2-NE 3.1Å; E73-R76 IonicContact OE2-NH2 3.58Å; E73-R76 PolarHBondContact OE2-NH2 3.32Å; R76-A78 VanDerWaalsContact C-N 3.33Å; R76-M79 PolarHBondContact O-N 3.24Å; R76-A80 PolarHBondContact O-N 2.83Å
77	R	85.1	Confident	81.7	Confident	131 Å²	131	53.8 Å²	53.8	49%	0.494	29%	0.293	S	S	.	.	H	α-helix	trans	-67.7	-33.5	177	-66.6	173.1	-175	-164.8	0.5	112.4	L48 E73 D74 A75 A80	L48-R77 HydrophobicContact CD1-CB 4.23Å; L48-R77 HydrophobicContact CD2-CB 3.44Å; L48-R77 VanDerWaalsContact CD2-CB 3.44Å; L48-R77 HydrophobicContact CD2-CG 4.27Å; L48-R77 HydrophobicContact CG-CB 4.49Å; E73-R77 WeakPolarHBondContact O-CG 3.32Å; E73-R77 PolarHBondContact O-N 2.98Å; E73-R77 VanDerWaalsContact O-N 3.09Å; E73-R77 IonicContact OE1-CZ 3.67Å; E73-R77 IonicContact OE1-NE 2.86Å; E73-R77 PolarHBondContact OE1-NE 3.36Å; E73-R77 IonicContact OE1-NH2 3.05Å; E73-R77 PolarHBondContact OE1-NH2 3.25Å; D74-R77 PolarHBondContact O-N 3.25Å; A75-R77 PolarHBondContact O-N 3.35Å; R77-A80 PolarHBondContact O-N 3.19Å
78	A	85.1	Confident	81	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-64.2	-46	172.8	0	0	0	0	0	111	I27 F45 L48 F69 D74 A75 R76 A80 R81 L93	I27-A78 HydrophobicContact CD1-CB 3.84Å; F45-A78 HydrophobicContact CD1-CB 3.97Å; F45-A78 HydrophobicContact CE1-CB 3.72Å; L48-A78 HydrophobicContact CD1-CB 3.66Å; F69-A78 HydrophobicContact CE1-CB 3.86Å; F69-A78 HydrophobicContact CE2-CB 3.83Å; F69-A78 HydrophobicContact CZ-CB 3.35Å; D74-A78 WeakPolarHBondContact O-CB 3.19Å; D74-A78 PolarHBondContact O-N 3.04Å; A75-A78 WeakPolarHBondContact O-CB 3.33Å; A75-A78 PolarHBondContact O-N 3.15Å; R76-A78 VanDerWaalsContact C-N 3.33Å; A78-A80 PolarHBondContact O-N 3.42Å; A78-R81 WeakPolarHBondContact O-CB 3.09Å; A78-R81 PolarHBondContact O-N 2.9Å; A78-L93 WeakPolarHBondContact O-CD1 3.34Å
79	M	85.3	Confident	80.7	Confident	54 Å²	54	57.7 Å²	57.7	27%	0.266	33%	0.332	S	S	.	.	H	α-helix	trans	-60.4	-32	178	-71.6	-61.7	-67	0	0	113	I27 A75 R76 R81 S82 L93 L95	I27-M79 HydrophobicContact CD1-CG 3.84Å; I27-M79 HydrophobicContact CD1-SD 3.92Å; I27-M79 HydrophobicContact CG1-SD 4.36Å; I27-M79 HydrophobicContact CG2-SD 4.1Å; A75-M79 WeakPolarHBondContact O-CG 3.41Å; A75-M79 PolarHBondContact O-N 3.16Å; R76-M79 PolarHBondContact O-N 3.24Å; M79-R81 PolarHBondContact O-N 3.47Å; M79-S82 WeakPolarHBondContact O-CB 3.42Å; M79-S82 PolarHBondContact O-N 3.13Å; M79-S82 VanDerWaalsContact O-N 3.09Å; M79-L93 WeakPolarHBondContact CE-O 3.5Å; M79-L93 HydrophobicContact SD-CB 3.86Å; M79-L95 HydrophobicContact CE-CD1 4.44Å; M79-L95 HydrophobicContact CE-CG 4.28Å; M79-L95 HydrophobicContact SD-CG 4.39Å
80	A	81.9	Confident	80.6	Confident	88 Å²	88	61.4 Å²	61.4	73%	0.727	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-16.4	174.2	0	0	0	0	0	113.7	R76 R77 A78	R76-A80 PolarHBondContact O-N 2.83Å; R77-A80 PolarHBondContact O-N 3.19Å; A78-A80 PolarHBondContact O-N 3.42Å
81	R	80.4	Confident	81.1	Confident	98 Å²	98	59 Å²	59	37%	0.37	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	7	174.1	-59.7	-172.3	-179	-169.2	5.5	113.2	F44 T46 A78 M79 G83 G84	F44-R81 HydrophobicContact CE1-CB 4.02Å; F44-R81 HydrophobicContact CZ-CB 4.16Å; F44-R81 WeakPolarHBondContact CZ-O 2.86Å; F44-R81 PolarHBondContact O-NH1 2.92Å; T46-R81 PolarHBondContact O-NH1 3.42Å; T46-R81 PolarHBondContact O-NH2 3.28Å; T46-R81 VanDerWaalsContact O-NH2 3.15Å; A78-R81 WeakPolarHBondContact O-CB 3.09Å; A78-R81 PolarHBondContact O-N 2.9Å; M79-R81 PolarHBondContact O-N 3.47Å; R81-G83 PolarHBondContact O-N 2.89Å; R81-G84 PolarHBondContact O-N 2.98Å
82	S	84.3	Confident	81.3	Confident	51 Å²	51	62.9 Å²	62.9	36%	0.357	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	135.5	175.3	-165.7	0	0	0	0	110.8	M79 L93	M79-S82 WeakPolarHBondContact O-CB 3.42Å; M79-S82 PolarHBondContact O-N 3.13Å; M79-S82 VanDerWaalsContact O-N 3.09Å; S82-L93 PolarHBondContact OG-N 3.27Å; S82-L93 PolarHBondContact OG-O 3.39Å
83	G	78.2	Confident	81.7	Confident	46 Å²	46	60 Å²	60	47%	0.474	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.5	2.8	-174.9	0	0	0	0	0	115	R81 V91	R81-G83 PolarHBondContact O-N 2.89Å; G83-V91 VanDerWaalsContact CA-O 3.24Å; G83-V91 WeakPolarHBondContact CA-O 3.29Å; G83-V91 PolarHBondContact N-O 3.41Å
84	G	79.7	Confident	81.8	Confident	21 Å²	21	59.4 Å²	59.4	22%	0.216	33%	0.328	C	S	.	.			trans	-71.1	173.7	171.2	0	0	0	0	0	113	R81 P90 V91	R81-G84 PolarHBondContact O-N 2.98Å; G84-P90 CarbonylContact O-C 3.46Å; G84-P90 WeakPolarHBondContact O-CA 3.37Å; G84-V91 WeakPolarHBondContact O-CG2 3.26Å; G84-V91 PolarHBondContact O-N 2.86Å
85	F	80.8	Confident	81.8	Confident	144 Å²	144	64 Å²	64	63%	0.632	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	125.8	-178.6	-64.7	-92.6	0	0	0	111.1	S89 P90	F85-S89 CarbonylContact C-O 3.53Å; F85-S89 WeakPolarHBondContact CA-O 3.12Å; F85-P90 HydrophobicContact CD1-CB 4.22Å; F85-P90 HydrophobicContact CE1-CB 3.98Å; F85-P90 HydrophobicContact CE1-CG 4.48Å
86	I	81.8	Confident	81.5	Confident	5 Å²	5	64.5 Å²	64.5	3%	0.026	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	118.7	169	-57.4	-172.5	0	0	0	107.5	L29 L32 A36 D40 F44 G88 S89 V91	L29-I86 HydrophobicContact CD1-CD1 4Å; L32-I86 HydrophobicContact CD1-CD1 4.34Å; L32-I86 HydrophobicContact CD1-CG2 4.07Å; A36-I86 HydrophobicContact CB-CG2 4.09Å; D40-I86 HydrophobicContact CB-CG2 4.14Å; F44-I86 HydrophobicContact CB-CD1 3.66Å; F44-I86 HydrophobicContact CB-CG1 3.85Å; F44-I86 HydrophobicContact CD1-CD1 3.85Å; F44-I86 HydrophobicContact CD1-CG1 4.23Å; F44-I86 HydrophobicContact CD2-CD1 4.04Å; F44-I86 HydrophobicContact CD2-CG1 3.5Å; F44-I86 HydrophobicContact CE1-CD1 4.5Å; F44-I86 HydrophobicContact CE2-CG1 4.05Å; F44-I86 HydrophobicContact CG-CD1 3.57Å; F44-I86 HydrophobicContact CG-CG1 3.59Å; I86-G88 PolarHBondContact O-N 3.49Å; I86-G88 VanDerWaalsContact O-N 3.13Å; I86-S89 PolarHBondContact N-O 2.72Å; I86-S89 PolarHBondContact O-N 2.82Å; I86-V91 HydrophobicContact CB-CG1 3.78Å; I86-V91 HydrophobicContact CD1-CB 4.34Å; I86-V91 HydrophobicContact CD1-CG1 3.77Å; I86-V91 HydrophobicContact CD1-CG2 3.87Å; I86-V91 HydrophobicContact CG1-CB 4.36Å; I86-V91 HydrophobicContact CG1-CG1 3.65Å; I86-V91 HydrophobicContact CG1-CG2 3.76Å
87	N	71.1	Confident	81.3	Confident	87 Å²	87	61 Å²	61	47%	0.465	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	39.6	-177	-70.7	-17	0	0	0	114	A36 D40 S89	A36-N87 HydrophobicContact CB-CB 4.43Å; A36-N87 WeakPolarHBondContact CB-ND2 3.45Å; D40-N87 PolarHBondContact OD2-ND2 2.82Å; N87-S89 VanDerWaalsContact C-N 3.28Å; N87-S89 PolarHBondContact O-N 3.25Å
88	G	70.6	Confident	80.5	Confident	65 Å²	65	60.2 Å²	60.2	67%	0.67	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.8	-6.1	178.5	0	0	0	0	0	115.4	I86	I86-G88 PolarHBondContact O-N 3.49Å; I86-G88 VanDerWaalsContact O-N 3.13Å
89	S	78.4	Confident	79.8	Confident	36 Å²	36	66 Å²	66	25%	0.252	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131	173	-64	0	0	0	0	110.8	G31 F85 I86 N87 V91	G31-S89 WeakPolarHBondContact O-CB 3.24Å; F85-S89 CarbonylContact C-O 3.53Å; F85-S89 WeakPolarHBondContact CA-O 3.12Å; I86-S89 PolarHBondContact N-O 2.72Å; I86-S89 PolarHBondContact O-N 2.82Å; N87-S89 VanDerWaalsContact C-N 3.28Å; N87-S89 PolarHBondContact O-N 3.25Å; S89-V91 PolarHBondContact O-N 3.05Å
90	P	82	Confident	79.4	Confident	78 Å²	78	66.6 Å²	66.6	51%	0.506	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	125.1	172.6	28.8	-32.2	0	0	0	109.4	G84 F85	G84-P90 CarbonylContact O-C 3.46Å; G84-P90 WeakPolarHBondContact O-CA 3.37Å; F85-P90 HydrophobicContact CD1-CB 4.22Å; F85-P90 HydrophobicContact CE1-CB 3.98Å; F85-P90 HydrophobicContact CE1-CG 4.48Å
91	V	87.1	Confident	79.2	Confident	2 Å²	2	63 Å²	63	1%	0.012	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-100.9	135.2	180	-64	0	0	0	0	111.3	L29 Q30 F44 G83 G84 I86 S89	L29-V91 HydrophobicContact CD2-CB 4.21Å; L29-V91 HydrophobicContact CD2-CG1 4Å; L29-V91 HydrophobicContact CG-CB 4.24Å; L29-V91 HydrophobicContact CG-CG1 4.49Å; Q30-V91 CarbonylContact O-C 3.6Å; Q30-V91 WeakPolarHBondContact O-CA 3.45Å; F44-V91 HydrophobicContact CE1-CG2 4.02Å; F44-V91 HydrophobicContact CE2-CG2 4.26Å; F44-V91 HydrophobicContact CZ-CG2 3.79Å; G83-V91 VanDerWaalsContact CA-O 3.24Å; G83-V91 WeakPolarHBondContact CA-O 3.29Å; G83-V91 PolarHBondContact N-O 3.41Å; G84-V91 WeakPolarHBondContact O-CG2 3.26Å; G84-V91 PolarHBondContact O-N 2.86Å; I86-V91 HydrophobicContact CB-CG1 3.78Å; I86-V91 HydrophobicContact CD1-CB 4.34Å; I86-V91 HydrophobicContact CD1-CG1 3.77Å; I86-V91 HydrophobicContact CD1-CG2 3.87Å; I86-V91 HydrophobicContact CG1-CB 4.36Å; I86-V91 HydrophobicContact CG1-CG1 3.65Å; I86-V91 HydrophobicContact CG1-CG2 3.76Å; S89-V91 PolarHBondContact O-N 3.05Å
92	R	83.1	Confident	78.7	Confident	120 Å²	120	60.9 Å²	60.9	45%	0.453	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.6	175.5	-173.9	178.1	-176	151	-0.2	109.4	L29 Q30 L94 D156	L29-R92 CarbonylContact C-O 3.57Å; L29-R92 WeakPolarHBondContact CA-O 3.28Å; Q30-R92 HydrophobicContact CB-CB 4.43Å; Q30-R92 PolarHBondContact N-O 2.99Å; Q30-R92 PolarHBondContact O-N 3.33Å; R92-L94 HydrophobicContact CG-CG 4.43Å; R92-D156 IonicContact NH1-OD1 2.83Å
93	L	87.8	Confident	78.3	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.021	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.2	177.4	-53.6	174.2	0	0	0	109.7	I27 R28 L29 F45 A78 M79 S82	I27-L93 HydrophobicContact CG2-CB 3.94Å; I27-L93 HydrophobicContact CG2-CD2 4.17Å; R28-L93 CarbonylContact O-C 3.59Å; R28-L93 WeakPolarHBondContact O-CA 3.46Å; L29-L93 HydrophobicContact CB-CD2 3.77Å; L29-L93 HydrophobicContact CD1-CD2 3.77Å; L29-L93 HydrophobicContact CG-CD2 3.68Å; F45-L93 HydrophobicContact CE1-CD1 3.63Å; F45-L93 HydrophobicContact CZ-CD1 3.54Å; F45-L93 HydrophobicContact CZ-CD2 3.75Å; F45-L93 HydrophobicContact CZ-CG 4.3Å; A78-L93 WeakPolarHBondContact O-CD1 3.34Å; M79-L93 WeakPolarHBondContact CE-O 3.5Å; M79-L93 HydrophobicContact SD-CB 3.86Å; S82-L93 PolarHBondContact OG-N 3.27Å; S82-L93 PolarHBondContact OG-O 3.39Å
94	L	83.8	Confident	77.9	Confident	55 Å²	55	60.5 Å²	60.5	29%	0.288	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	139.2	-177.9	-68.8	158.9	0	0	0	108.8	I27 R28 Q30 R92 S96	I27-L94 CarbonylContact C-O 3.48Å; I27-L94 WeakPolarHBondContact CA-O 3.22Å; R28-L94 HydrophobicContact CB-CB 4.33Å; R28-L94 PolarHBondContact N-O 3.28Å; R28-L94 PolarHBondContact O-N 3.3Å; Q30-L94 HydrophobicContact CG-CD1 4.21Å; Q30-L94 VanDerWaalsContact OE1-CD1 3.24Å; R92-L94 HydrophobicContact CG-CG 4.43Å; L94-S96 PolarHBondContact O-N 3.3Å
95	L	83.7	Confident	77.5	Confident	121 Å²	121	62.1 Å²	62.1	63%	0.634	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.3	128.3	168.4	-80.2	149.4	0	0	0	108.6	V25 M79	V25-L95 HydrophobicContact CG1-CD2 3.95Å; M79-L95 HydrophobicContact CE-CD1 4.44Å; M79-L95 HydrophobicContact CE-CG 4.28Å; M79-L95 HydrophobicContact SD-CG 4.39Å
96	S	78.3	Confident	76.9	Confident	14 Å²	14	59.7 Å²	59.7	10%	0.098	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	152.9	177.8	-170.1	0	0	0	0	110.1	V26 L94 E100	V26-S96 WeakPolarHBondContact CB-O 3.49Å; V26-S96 PolarHBondContact O-N 3.02Å; L94-S96 PolarHBondContact O-N 3.3Å; S96-E100 WeakPolarHBondContact OG-CB 3.41Å; S96-E100 PolarHBondContact OG-OE2 3.42Å
97	S	78.8	Confident	76.2	Confident	61 Å²	61	68 Å²	68	43%	0.427	35%	0.353	S	S	.	.			trans	-89.5	154.4	177.9	69.7	0	0	0	0	111.1	Q99 E100 M101	S97-Q99 PolarHBondContact O-N 3.12Å; S97-Q99 VanDerWaalsContact O-N 3.15Å; S97-E100 PolarHBondContact O-N 2.98Å; S97-E100 WeakPolarHBondContact OG-CB 3.34Å; S97-E100 PolarHBondContact OG-N 3.47Å; S97-E100 VanDerWaalsContact OG-N 3.1Å; S97-M101 PolarHBondContact O-N 3.3Å; S97-M101 VanDerWaalsContact O-N 3.09Å
98	K	69.4	Low	75.6	Confident	115 Å²	115	66.1 Å²	66.1	50%	0.5	35%	0.345	S	S	.	.	H	α-helix	trans	-52.9	-35	172	-170.9	177.9	-179	179.2	0	111.8	Q102 Y588	K98-Q102 WeakPolarHBondContact O-CB 3.24Å; K98-Q102 PolarHBondContact O-N 2.84Å; K98-Q102 VanDerWaalsContact O-N 3.14Å; K98-Y588 PolarHBondContact NZ-O 2.86Å
99	Q	70.3	Confident	75	Confident	120 Å²	120	66.8 Å²	66.8	56%	0.561	34%	0.336	S	S	*	.	H	α-helix	trans	-70.4	-38.5	177.2	-169.5	63.4	42.3	0	0	112.9	S97 Q102 N103	S97-Q99 PolarHBondContact O-N 3.12Å; S97-Q99 VanDerWaalsContact O-N 3.15Å; Q99-Q102 PolarHBondContact O-N 3.37Å; Q99-N103 PolarHBondContact NE2-OD1 3.1Å; Q99-N103 WeakPolarHBondContact O-CB 3.24Å; Q99-N103 PolarHBondContact O-N 3.4Å; Q99-N103 PolarHBondContact O-OD1 2.81Å
100	E	76.3	Confident	74	Confident	68 Å²	68	71 Å²	71	32%	0.318	35%	0.351	S	S	.	.	H	α-helix	trans	-66.4	-45.2	178.2	-173	-173.4	172.2	0	0	110.8	R28 S96 S97 Q102 N103 V104	R28-E100 IonicContact NH1-OE1 2.94Å; R28-E100 PolarHBondContact NH1-OE1 2.77Å; S96-E100 WeakPolarHBondContact OG-CB 3.41Å; S96-E100 PolarHBondContact OG-OE2 3.42Å; S97-E100 PolarHBondContact O-N 2.98Å; S97-E100 WeakPolarHBondContact OG-CB 3.34Å; S97-E100 PolarHBondContact OG-N 3.47Å; S97-E100 VanDerWaalsContact OG-N 3.1Å; E100-Q102 PolarHBondContact O-N 3.27Å; E100-N103 PolarHBondContact O-N 3.19Å; E100-V104 VanDerWaalsContact O-CG2 3.29Å; E100-V104 WeakPolarHBondContact O-CG2 3.36Å; E100-V104 PolarHBondContact O-N 3.35Å
101	M	78.3	Confident	72.8	Confident	12 Å²	12	72.8 Å²	72.8	6%	0.059	35%	0.351	C	S	.	.	H	α-helix	trans	-55.5	-49	173.1	179.6	179.1	-170.6	0	0	111.8	V26 H56 F66 I68 S97 N103 V104 L105	V26-M101 HydrophobicContact CG1-CB 4.19Å; V26-M101 HydrophobicContact CG1-CG 4.45Å; V26-M101 HydrophobicContact CG1-SD 3.64Å; V26-M101 HydrophobicContact CG2-SD 4.3Å; H56-M101 HydrophobicContact CB-CE 3.85Å; H56-M101 WeakPolarHBondContact CD2-CE 3.31Å; F66-M101 HydrophobicContact CB-CE 3.63Å; F66-M101 HydrophobicContact CB-CG 4.07Å; F66-M101 HydrophobicContact CB-SD 4.02Å; F66-M101 HydrophobicContact CD1-CB 3.84Å; F66-M101 HydrophobicContact CD1-CG 3.88Å; F66-M101 HydrophobicContact CD1-SD 4.47Å; F66-M101 HydrophobicContact CE1-CB 4.06Å; F66-M101 HydrophobicContact CE1-CG 4.46Å; F66-M101 HydrophobicContact CG-CB 4.35Å; F66-M101 HydrophobicContact CG-CE 4.45Å; F66-M101 HydrophobicContact CG-CG 3.89Å; F66-M101 HydrophobicContact CG-SD 4.44Å; I68-M101 HydrophobicContact CD1-CE 3.78Å; I68-M101 HydrophobicContact CD1-SD 4.04Å; I68-M101 HydrophobicContact CG1-CE 3.99Å; I68-M101 HydrophobicContact CG1-SD 4.1Å; S97-M101 PolarHBondContact O-N 3.3Å; S97-M101 VanDerWaalsContact O-N 3.09Å; M101-N103 PolarHBondContact O-N 3.21Å; M101-V104 PolarHBondContact O-N 3.24Å; M101-L105 HydrophobicContact CG-CD1 4Å; M101-L105 VanDerWaalsContact O-CD1 3.25Å; M101-L105 WeakPolarHBondContact O-CD1 3.12Å; M101-L105 PolarHBondContact O-N 3.49Å
102	Q	70.1	Confident	71.4	Confident	53 Å²	53	76.6 Å²	76.6	25%	0.248	38%	0.375	C	S	.	.	H	α-helix	trans	-61.2	-45.3	179.8	-173.7	64.4	32.2	0	0	112.1	K98 Q99 E100 V104 L105 E106	K98-Q102 WeakPolarHBondContact O-CB 3.24Å; K98-Q102 PolarHBondContact O-N 2.84Å; K98-Q102 VanDerWaalsContact O-N 3.14Å; Q99-Q102 PolarHBondContact O-N 3.37Å; E100-Q102 PolarHBondContact O-N 3.27Å; Q102-V104 VanDerWaalsContact C-N 3.28Å; Q102-V104 PolarHBondContact O-N 3.05Å; Q102-L105 PolarHBondContact O-N 3.31Å; Q102-E106 WeakPolarHBondContact CG-OE1 3.42Å; Q102-E106 PolarHBondContact NE2-OE1 3.33Å; Q102-E106 WeakPolarHBondContact O-CG 3.4Å; Q102-E106 PolarHBondContact O-N 2.97Å
103	N	73.9	Confident	70	Confident	61 Å²	61	76.4 Å²	76.4	33%	0.326	38%	0.379	S	S	.	.	H	α-helix	trans	-62.5	-35.1	178	-72.6	-2.8	0	0	0	112.2	Q99 E100 M101 R107	Q99-N103 PolarHBondContact NE2-OD1 3.1Å; Q99-N103 WeakPolarHBondContact O-CB 3.24Å; Q99-N103 PolarHBondContact O-N 3.4Å; Q99-N103 PolarHBondContact O-OD1 2.81Å; E100-N103 PolarHBondContact O-N 3.19Å; M101-N103 PolarHBondContact O-N 3.21Å; N103-R107 WeakPolarHBondContact O-CB 3.45Å; N103-R107 VanDerWaalsContact O-CG 3.29Å; N103-R107 WeakPolarHBondContact O-CG 3.41Å; N103-R107 PolarHBondContact O-N 3.18Å; N103-R107 VanDerWaalsContact O-N 3.1Å
104	V	71.7	Confident	68.3	Low	29 Å²	29	81.1 Å²	81.1	18%	0.176	40%	0.403	C	S	.	.	H	α-helix	trans	-73.1	-40.8	178.9	175.1	0	0	0	0	111.1	I58 F66 E100 M101 Q102 R107 T108	I58-V104 HydrophobicContact CD1-CB 4.45Å; I58-V104 HydrophobicContact CD1-CG1 3.77Å; I58-V104 HydrophobicContact CG2-CG1 4.22Å; F66-V104 HydrophobicContact CE2-CB 4.27Å; F66-V104 HydrophobicContact CE2-CG1 3.96Å; F66-V104 HydrophobicContact CZ-CB 4.22Å; F66-V104 HydrophobicContact CZ-CG1 4.29Å; F66-V104 HydrophobicContact CZ-CG2 4.21Å; E100-V104 VanDerWaalsContact O-CG2 3.29Å; E100-V104 WeakPolarHBondContact O-CG2 3.36Å; E100-V104 PolarHBondContact O-N 3.35Å; M101-V104 PolarHBondContact O-N 3.24Å; Q102-V104 VanDerWaalsContact C-N 3.28Å; Q102-V104 PolarHBondContact O-N 3.05Å; V104-R107 PolarHBondContact O-N 3.45Å; V104-T108 PolarHBondContact O-N 3.29Å; V104-T108 VanDerWaalsContact O-N 3.12Å; V104-T108 PolarHBondContact O-OG1 3.01Å
105	L	71.1	Confident	66.8	Low	54 Å²	54	82.1 Å²	82.1	28%	0.283	41%	0.409	S	S	.	.	H	α-helix	trans	-59.4	-46.6	171.6	-94.9	83.6	0	0	0	111.2	I58 M101 Q102 R107 T108 T109	I58-L105 HydrophobicContact CD1-CD1 3.36Å; I58-L105 HydrophobicContact CD1-CG 4.15Å; I58-L105 HydrophobicContact CG1-CD1 4.27Å; M101-L105 HydrophobicContact CG-CD1 4Å; M101-L105 VanDerWaalsContact O-CD1 3.25Å; M101-L105 WeakPolarHBondContact O-CD1 3.12Å; M101-L105 PolarHBondContact O-N 3.49Å; Q102-L105 PolarHBondContact O-N 3.31Å; L105-R107 PolarHBondContact O-N 3.31Å; L105-T108 WeakPolarHBondContact CA-OG1 3.4Å; L105-T108 PolarHBondContact O-N 2.87Å; L105-T108 PolarHBondContact O-OG1 3.24Å; L105-T109 WeakPolarHBondContact O-CG2 3.24Å; L105-T109 PolarHBondContact O-N 3.18Å; L105-T109 PolarHBondContact O-OG1 3.16Å
106	E	68.3	Low	65.3	Low	93 Å²	93	82.4 Å²	82.4	44%	0.435	41%	0.407	S	S	.	.	H	α-helix	trans	-62.8	-41.6	-179.4	-75.5	172.7	-166.7	0	0	112.4	Q102 T108 T109 Q110	Q102-E106 WeakPolarHBondContact CG-OE1 3.42Å; Q102-E106 PolarHBondContact NE2-OE1 3.33Å; Q102-E106 WeakPolarHBondContact O-CG 3.4Å; Q102-E106 PolarHBondContact O-N 2.97Å; E106-T108 PolarHBondContact O-N 3.44Å; E106-T109 WeakPolarHBondContact CA-OG1 3.47Å; E106-T109 PolarHBondContact O-N 3.2Å; E106-T109 PolarHBondContact O-OG1 3.28Å; E106-Q110 PolarHBondContact O-N 3.08Å
107	R	65.6	Low	64.3	Low	180 Å²	180	86.3 Å²	86.3	68%	0.679	43%	0.426	S	S	*	.	H	α-helix	trans	-65.3	-36.3	176.7	-75.9	175.2	-175.6	-178.6	2.3	113.2	N103 V104 L105 K111	N103-R107 WeakPolarHBondContact O-CB 3.45Å; N103-R107 VanDerWaalsContact O-CG 3.29Å; N103-R107 WeakPolarHBondContact O-CG 3.41Å; N103-R107 PolarHBondContact O-N 3.18Å; N103-R107 VanDerWaalsContact O-N 3.1Å; V104-R107 PolarHBondContact O-N 3.45Å; L105-R107 PolarHBondContact O-N 3.31Å; R107-K111 PolarHBondContact O-N 3.41Å; R107-K111 VanDerWaalsContact O-N 3.15Å
108	T	58.4	Low	62.9	Low	48 Å²	48	92.4 Å²	92.4	29%	0.294	44%	0.439	S	S	.	.	H	α-helix	trans	-69.8	-39	176.5	22.2	0	0	0	0	111.1	I58 V104 L105 E106 Q110 K111 V112	I58-T108 HydrophobicContact CG2-CG2 3.62Å; V104-T108 PolarHBondContact O-N 3.29Å; V104-T108 VanDerWaalsContact O-N 3.12Å; V104-T108 PolarHBondContact O-OG1 3.01Å; L105-T108 WeakPolarHBondContact CA-OG1 3.4Å; L105-T108 PolarHBondContact O-N 2.87Å; L105-T108 PolarHBondContact O-OG1 3.24Å; E106-T108 PolarHBondContact O-N 3.44Å; T108-Q110 PolarHBondContact O-N 3.28Å; T108-K111 PolarHBondContact O-N 3.33Å; T108-V112 WeakPolarHBondContact O-CG2 3.17Å; T108-V112 PolarHBondContact O-N 3.37Å; T108-V112 VanDerWaalsContact O-N 3.12Å
109	T	58.9	Low	61.9	Low	79 Å²	79	94.1 Å²	94.1	49%	0.485	45%	0.449	S	S	.	.	H	α-helix	trans	-63.9	-38.8	175	60.1	0	0	0	0	113.2	L105 E106 V112 E113	L105-T109 WeakPolarHBondContact O-CG2 3.24Å; L105-T109 PolarHBondContact O-N 3.18Å; L105-T109 PolarHBondContact O-OG1 3.16Å; E106-T109 WeakPolarHBondContact CA-OG1 3.47Å; E106-T109 PolarHBondContact O-N 3.2Å; E106-T109 PolarHBondContact O-OG1 3.28Å; T109-V112 PolarHBondContact O-N 3.06Å; T109-E113 PolarHBondContact O-N 3.06Å; T109-E113 VanDerWaalsContact O-N 3.09Å
110	Q	57.2	Low	60.8	Low	124 Å²	124	93.1 Å²	93.1	58%	0.579	46%	0.456	S	S	*	.	H	α-helix	trans	-67.2	-35.1	174.8	-87.1	-178.1	-1.8	0	0	113.4	E106 T108 E113 L114	E106-Q110 PolarHBondContact O-N 3.08Å; T108-Q110 PolarHBondContact O-N 3.28Å; Q110-E113 PolarHBondContact O-N 2.92Å; Q110-L114 WeakPolarHBondContact O-CB 3.37Å; Q110-L114 WeakPolarHBondContact O-CD1 3.4Å; Q110-L114 WeakPolarHBondContact O-CG 3.43Å; Q110-L114 PolarHBondContact O-N 3.24Å
111	K	57	Low	59.4	Low	115 Å²	115	98 Å²	98	50%	0.5	48%	0.478	S	S	.	.	H	α-helix	trans	-69.4	-37.9	178.8	-151.3	178.1	-179.9	-172.4	0	110.9	E61 R107 T108 L114 D115	E61-K111 IonicContact OE1-NZ 2.71Å; E61-K111 PolarHBondContact OE1-NZ 2.85Å; R107-K111 PolarHBondContact O-N 3.41Å; R107-K111 VanDerWaalsContact O-N 3.15Å; T108-K111 PolarHBondContact O-N 3.33Å; K111-L114 PolarHBondContact O-N 2.93Å; K111-D115 PolarHBondContact O-N 3.28Å; K111-D115 VanDerWaalsContact O-N 3.1Å
112	V	56.6	Low	57.7	Low	83 Å²	83	100.2 Å²	100.2	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-64.6	-44.9	173.4	175.5	0	0	0	0	111.1	T108 T109 L114 D115 E116	T108-V112 WeakPolarHBondContact O-CG2 3.17Å; T108-V112 PolarHBondContact O-N 3.37Å; T108-V112 VanDerWaalsContact O-N 3.12Å; T109-V112 PolarHBondContact O-N 3.06Å; V112-L114 VanDerWaalsContact C-N 3.34Å; V112-L114 PolarHBondContact O-N 2.95Å; V112-D115 PolarHBondContact O-N 3.22Å; V112-E116 HydrophobicContact CG1-CG 4.46Å; V112-E116 WeakPolarHBondContact O-CG 3.4Å; V112-E116 PolarHBondContact O-N 3.4Å
113	E	54.2	Low	56.4	Low	115 Å²	115	105.5 Å²	105.5	54%	0.537	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-35.7	178.8	-160.4	171.2	-164.2	0	0	112.2	T109 Q110 I117	T109-E113 PolarHBondContact O-N 3.06Å; T109-E113 VanDerWaalsContact O-N 3.09Å; Q110-E113 PolarHBondContact O-N 2.92Å; E113-I117 WeakPolarHBondContact O-CD1 3.48Å; E113-I117 VanDerWaalsContact O-CG1 3.23Å; E113-I117 WeakPolarHBondContact O-CG1 3.49Å; E113-I117 PolarHBondContact O-N 2.93Å; E113-I117 VanDerWaalsContact O-N 3.17Å
114	L	53.1	Low	54.8	Low	103 Å²	103	105.4 Å²	105.4	54%	0.539	55%	0.548	S	S	.	.	H	α-helix	trans	-70.6	-31.6	174.9	-78.6	161.6	0	0	0	113.5	Q110 K111 V112 R118	Q110-L114 WeakPolarHBondContact O-CB 3.37Å; Q110-L114 WeakPolarHBondContact O-CD1 3.4Å; Q110-L114 WeakPolarHBondContact O-CG 3.43Å; Q110-L114 PolarHBondContact O-N 3.24Å; K111-L114 PolarHBondContact O-N 2.93Å; V112-L114 VanDerWaalsContact C-N 3.34Å; V112-L114 PolarHBondContact O-N 2.95Å; L114-R118 WeakPolarHBondContact O-CG 3.16Å; L114-R118 PolarHBondContact O-N 3.42Å
115	D	51.3	Low	53.4	Low	76 Å²	76	115.4 Å²	115.4	41%	0.406	58%	0.583	S	S	.	*	H	α-helix	trans	-80.3	-31.7	176.1	-78.5	-24.3	0	0	0	112.2	K111 V112 R118 Q119	K111-D115 PolarHBondContact O-N 3.28Å; K111-D115 VanDerWaalsContact O-N 3.1Å; V112-D115 PolarHBondContact O-N 3.22Å; D115-R118 PolarHBondContact O-N 3.01Å; D115-Q119 WeakPolarHBondContact O-CG 2.93Å; D115-Q119 PolarHBondContact O-N 2.9Å; D115-Q119 VanDerWaalsContact O-N 3.09Å
116	E	52.5	Low	51.6	Low	128 Å²	128	119.6 Å²	119.6	60%	0.598	61%	0.611	S	S	*	*	H	α-helix	trans	-67.6	-38.2	173	-74.3	-175	160.9	0	0	112.3	V112 R118 Q119 S120	V112-E116 HydrophobicContact CG1-CG 4.46Å; V112-E116 WeakPolarHBondContact O-CG 3.4Å; V112-E116 PolarHBondContact O-N 3.4Å; E116-R118 VanDerWaalsContact C-N 3.35Å; E116-R118 PolarHBondContact O-N 3.29Å; E116-Q119 PolarHBondContact O-N 2.89Å; E116-S120 WeakPolarHBondContact O-CB 3.46Å; E116-S120 PolarHBondContact O-N 3.46Å; E116-S120 VanDerWaalsContact O-N 3.07Å
117	I	56.9	Low	50.2	Low	95 Å²	95	119.7 Å²	119.7	49%	0.487	63%	0.627	S	S	.	*	H	α-helix	trans	-65.6	-38.6	174.4	-66.4	164.6	0	0	0	111	E113 Q119 S120 E121	E113-I117 WeakPolarHBondContact O-CD1 3.48Å; E113-I117 VanDerWaalsContact O-CG1 3.23Å; E113-I117 WeakPolarHBondContact O-CG1 3.49Å; E113-I117 PolarHBondContact O-N 2.93Å; E113-I117 VanDerWaalsContact O-N 3.17Å; I117-Q119 VanDerWaalsContact C-N 3.34Å; I117-Q119 PolarHBondContact O-N 2.95Å; I117-S120 PolarHBondContact O-N 2.95Å; I117-E121 PolarHBondContact O-N 3.01Å
118	R	50.3	Low	48.7	Very low	189 Å²	189	120 Å²	120	71%	0.713	64%	0.636	S	S	*	*	H	α-helix	trans	-69.2	-29.1	177.6	-76.2	174	168	-175.9	-2.7	113.5	L114 D115 E116	L114-R118 WeakPolarHBondContact O-CG 3.16Å; L114-R118 PolarHBondContact O-N 3.42Å; D115-R118 PolarHBondContact O-N 3.01Å; E116-R118 VanDerWaalsContact C-N 3.35Å; E116-R118 PolarHBondContact O-N 3.29Å
119	Q	47.9	Very low	47.3	Very low	152 Å²	152	129.3 Å²	129.3	71%	0.71	67%	0.666	S	S	*	*	H	α-helix	trans	-82.3	-26.6	176.4	-70.3	179.1	24.3	0	0	112.8	D115 E116 I117	D115-Q119 WeakPolarHBondContact O-CG 2.93Å; D115-Q119 PolarHBondContact O-N 2.9Å; D115-Q119 VanDerWaalsContact O-N 3.09Å; E116-Q119 PolarHBondContact O-N 2.89Å; I117-Q119 VanDerWaalsContact C-N 3.34Å; I117-Q119 PolarHBondContact O-N 2.95Å
120	S	47.6	Very low	45.9	Very low	99 Å²	99	131 Å²	131	69%	0.692	68%	0.681	S	S	*	*	H	α-helix	trans	-70.6	-33.8	176.1	173.4	0	0	0	0	113.6	E116 I117	E116-S120 WeakPolarHBondContact O-CB 3.46Å; E116-S120 PolarHBondContact O-N 3.46Å; E116-S120 VanDerWaalsContact O-N 3.07Å; I117-S120 PolarHBondContact O-N 2.95Å
121	E	46.2	Very low	44.6	Very low	169 Å²	169	133.6 Å²	133.6	79%	0.79	70%	0.696	S	S	*	*	S	Bend	trans	-90	-4.1	-177.6	-66.9	-165.9	138	0	0	114.6	I117	I117-E121 PolarHBondContact O-N 3.01Å
122	G	42.8	Very low	43.2	Very low	59 Å²	59	136 Å²	136	61%	0.608	71%	0.708	S	S	*	*	S	Bend	trans	-90	-7.8	-176	0	0	0	0	0	116.4
123	N	42.3	Very low	42	Very low	164 Å²	164	143 Å²	143	88%	0.877	73%	0.726	S	S	*	*	S	Bend	trans	-101.4	22	-166	-118.5	19.9	0	0	0	115.8
124	G	41.7	Very low	40.9	Very low	60 Å²	60	146.4 Å²	146.4	62%	0.619	74%	0.742	S	S	*	*	S	Bend	trans	-134.5	57.4	-176	0	0	0	0	0	113.7
125	R	40.9	Very low	39.9	Very low	239 Å²	239	148.4 Å²	148.4	90%	0.902	76%	0.758	S	S	*	*	S	Bend	trans	166.3	103.1	152.7	-90.5	148.1	-169.8	-166.4	3.7	109.5
126	T	34.4	Very low	38.9	Very low	142 Å²	142	147.7 Å²	147.7	87%	0.871	77%	0.769	S	S	*	*			trans	177.8	82.2	130.4	-64.9	0	0	0	0	107.4
127	A	38.1	Very low	37.9	Very low	95 Å²	95	151.6 Å²	151.6	79%	0.785	78%	0.778	S	S	*	*			trans	-132.7	68.1	164	0	0	0	0	0	107.6
128	Q	34.2	Very low	36.6	Very low	185 Å²	185	156.1 Å²	156.1	86%	0.864	79%	0.789	S	S	*	*			trans	-178.4	92.6	158.6	-109.5	167	-28.2	0	0	110.7
129	R	29.8	Very low	35.6	Very low	245 Å²	245	152.5 Å²	152.5	93%	0.925	79%	0.792	S	S	*	*				174.1	89.7	127.1	-105.9	-179.9	159.6	-172.6	-5	110.3
130	S	28.2	Very low	34.8	Very low	114 Å²	114	151.3 Å²	151.3	80%	0.797	80%	0.801	S	S	*	*			trans	-77.6	124.2	146.2	17.9	0	0	0	0	108.1
131	M	30.3	Very low	34	Very low	179 Å²	179	152.3 Å²	152.3	88%	0.882	81%	0.808	S	S	*	*			trans	170.3	105.3	138	-91.3	178.9	-170	0	0	110.1
132	E	27.4	Very low	33.3	Very low	165 Å²	165	155.9 Å²	155.9	77%	0.771	81%	0.814	S	S	*	*				62.7	112.9	127.3	-143.9	179.7	-179.8	0	0	119.9
133	R	31.5	Very low	32.8	Very low	231 Å²	231	158.8 Å²	158.8	87%	0.872	83%	0.825	S	S	*	*				-176.3	135.2	103.3	-98.6	179.4	-177.1	134.1	2.8	113.2
134	E	31.2	Very low	32.1	Very low	185 Å²	185	154.1 Å²	154.1	86%	0.864	82%	0.816	S	S	*	*			trans	-90.7	124.8	176.5	-178.8	-176.2	-150.8	0	0	109.5
135	V	32.1	Very low	31.5	Very low	145 Å²	145	162.3 Å²	162.3	88%	0.879	83%	0.83	S	S	*	*			trans	-153.9	119.4	151.2	-171.5	0	0	0	0	108.6
136	G	31.2	Very low	30.8	Very low	62 Å²	62	156.5 Å²	156.5	64%	0.639	83%	0.826	S	S	*	*			trans	-81.4	161.6	175.3	0	0	0	0	0	114.4
137	R	31	Very low	30.7	Very low	209 Å²	209	154.8 Å²	154.8	79%	0.789	82%	0.819	S	S	*	*				172.3	136.5	126.7	-100.4	-179.8	177.1	-177.2	3.4	112.8
138	R	28.8	Very low	30.4	Very low	191 Å²	191	155.6 Å²	155.6	72%	0.721	82%	0.817	S	S	*	*			trans	78.7	103.9	139.8	-68.4	171.8	-179.7	-172.5	-2.6	119.4
139	S	30	Very low	30.4	Very low	112 Å²	112	152.5 Å²	152.5	78%	0.783	81%	0.812	S	S	*	*				21.6	117.7	120.1	-27.4	0	0	0	0	117.6
140	S	30.5	Very low	30.3	Very low	127 Å²	127	148.1 Å²	148.1	89%	0.888	80%	0.802	S	S	*	*			trans	-161.3	122	137.6	-80.4	0	0	0	0	110.6
141	S	31.7	Very low	30.7	Very low	120 Å²	120	151.7 Å²	151.7	84%	0.839	81%	0.806	S	S	*	*			trans	-57.6	140.3	176.5	-39	0	0	0	0	112.5
142	R	31.9	Very low	30.7	Very low	245 Å²	245	150.3 Å²	150.3	93%	0.925	80%	0.797	S	S	*	*			trans	-153.6	112.2	148.6	-116	171.5	-179.2	-177.8	-0.5	111.8
143	S	30.8	Very low	31.2	Very low	119 Å²	119	153.8 Å²	153.8	83%	0.832	80%	0.803	S	S	*	*			trans	-15.4	133.1	159	54.6	0	0	0	0	118
144	G	28	Very low	31.3	Very low	66 Å²	66	149 Å²	149	68%	0.68	80%	0.802	S	S	*	*			trans	-163.4	112.9	160.6	0	0	0	0	0	110.2	S146	G144-S146 PolarHBondContact O-N 3.24Å
145	Y	29.9	Very low	31.4	Very low	233 Å²	233	143.8 Å²	143.8	91%	0.914	79%	0.791	S	S	*	*			trans	-38.2	123.3	179.3	-89.8	-106.3	0	0	0	114.4
146	S	26.3	Very low	31.8	Very low	117 Å²	117	143.3 Å²	143.3	82%	0.818	78%	0.783	S	S	*	*			trans	-97.5	110.7	166.3	-32.5	0	0	0	0	108.1	G144	G144-S146 PolarHBondContact O-N 3.24Å
147	S	31.1	Very low	32.7	Very low	105 Å²	105	144.5 Å²	144.5	73%	0.734	78%	0.778	S	S	*	*			trans	-88	142.9	159.2	-61.8	0	0	0	0	108.3
148	P	33.1	Very low	34	Very low	113 Å²	113	138.7 Å²	138.7	73%	0.734	76%	0.763	S	S	*	*			trans	-70.7	150.2	-178.2	-1.8	16.6	0	0	0	110.9	H150	P148-H150 PolarHBondContact O-N 2.93Å; P148-H150 VanDerWaalsContact O-N 3.1Å
149	P	33.1	Very low	35.9	Very low	119 Å²	119	131 Å²	131	77%	0.773	74%	0.736	S	S	*	*			trans	-69.5	109.8	172.7	28	-29.7	0	0	0	109.1	H151	P149-H151 VanDerWaalsContact C-N 3.29Å; P149-H151 PolarHBondContact O-N 3.09Å
150	H	29.1	Very low	37.8	Very low	154 Å²	154	128.2 Å²	128.2	71%	0.713	72%	0.716	S	S	*	*			trans	-67.1	89.6	166.8	-113.1	-59.1	0	0	0	108.8	P148 Q152	P148-H150 PolarHBondContact O-N 2.93Å; P148-H150 VanDerWaalsContact O-N 3.1Å; H150-Q152 VanDerWaalsContact C-N 3.32Å; H150-Q152 PolarHBondContact CE1-NE2 2.96Å; H150-Q152 PolarHBondContact O-N 3.27Å
151	H	36.5	Very low	40.1	Very low	188 Å²	188	127.2 Å²	127.2	87%	0.87	69%	0.693	S	S	*	*			trans	-73.7	93.2	151.3	-86.8	-22.5	0	0	0	107.9	P149	P149-H151 VanDerWaalsContact C-N 3.29Å; P149-H151 PolarHBondContact O-N 3.09Å
152	Q	29.8	Very low	42.6	Very low	151 Å²	151	121.5 Å²	121.5	71%	0.706	65%	0.653	S	S	*	*			trans	-124.8	106.7	160.6	-79	-176.6	-7.5	0	0	108.6	H150	H150-Q152 VanDerWaalsContact C-N 3.32Å; H150-Q152 PolarHBondContact CE1-NE2 2.96Å; H150-Q152 PolarHBondContact O-N 3.27Å
153	R	37	Very low	45.3	Very low	238 Å²	238	109.9 Å²	109.9	90%	0.898	61%	0.609	S	S	*	*			trans	-19.4	128.6	146.6	-99	171.1	159.6	171.1	-5.4	112.1
154	P	34.8	Very low	48	Very low	129 Å²	129	106.1 Å²	106.1	84%	0.838	58%	0.578	S	S	*	*			trans	-83.3	123.3	158.2	11.5	5.7	0	0	0	108.7
155	A	33.2	Very low	50.9	Low	77 Å²	77	103 Å²	103	64%	0.636	55%	0.546	S	S	*	.			trans	-72.7	138	169.2	0	0	0	0	0	110.2	T157	A155-T157 PolarHBondContact O-N 2.83Å; A155-T157 PolarHBondContact O-OG1 3.37Å
156	D	40.8	Very low	53.7	Low	134 Å²	134	94.5 Å²	94.5	72%	0.717	52%	0.516	S	S	*	.	S	Bend	trans	-54.4	89.6	167.2	-90.5	-46.4	0	0	0	111	R92	R92-D156 IonicContact NH1-OD1 2.83Å
157	T	49.9	Very low	56.3	Low	88 Å²	88	89.9 Å²	89.9	54%	0.54	49%	0.487	S	S	.	.			trans	-144.7	52.9	168.3	21.1	0	0	0	0	109.4	A155 D159 T235	A155-T157 PolarHBondContact O-N 2.83Å; A155-T157 PolarHBondContact O-OG1 3.37Å; T157-D159 PolarHBondContact O-N 2.76Å; T157-T235 WeakPolarHBondContact O-CB 3.46Å; T157-T235 WeakPolarHBondContact O-CG2 3.45Å
158	D	57.7	Low	58.9	Low	87 Å²	87	84.9 Å²	84.9	47%	0.465	45%	0.452	S	S	.	.			trans	-64.8	120.1	169.7	-75.6	-9.9	0	0	0	108.7	P160 T233	D158-P160 WeakPolarHBondContact O-CD 3.22Å; D158-T233 PolarHBondContact OD2-OG1 2.83Å
159	D	68.2	Low	61.3	Low	28 Å²	28	80 Å²	80	15%	0.15	42%	0.42	C	S	.	.			trans	-78.8	116.9	170.7	-173.2	-33	0	0	0	107.2	T157 Y161 V162 T234 A236	T157-D159 PolarHBondContact O-N 2.76Å; D159-Y161 PolarHBondContact O-N 3.24Å; D159-Y161 VanDerWaalsContact OD1-CD2 3.24Å; D159-Y161 WeakPolarHBondContact OD1-CD2 3.41Å; D159-Y161 PolarHBondContact OD1-N 3.16Å; D159-V162 HydrophobicContact CB-CG2 4.38Å; D159-V162 PolarHBondContact O-N 3.21Å; D159-T234 PolarHBondContact N-O 3.45Å; D159-A236 HydrophobicContact CB-CB 4.02Å; D159-A236 WeakPolarHBondContact OD2-CB 3.27Å
160	P	71.3	Confident	63.6	Low	55 Å²	55	79.9 Å²	79.9	36%	0.357	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-4.6	-174.2	27	-33.8	0	0	0	114.1	D158 K210 A213	D158-P160 WeakPolarHBondContact O-CD 3.22Å; P160-K210 HydrophobicContact CB-CB 4.38Å; P160-K210 HydrophobicContact CB-CD 3.64Å; P160-K210 HydrophobicContact CB-CG 3.78Å; P160-K210 HydrophobicContact CG-CD 4.31Å; P160-A213 WeakPolarHBondContact O-CB 3.48Å
161	Y	78.8	Confident	66.1	Low	105 Å²	105	77.1 Å²	77.1	41%	0.412	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-8.5	-177.7	-56.9	-77.3	0	0	0	114	D159 R206 F207 K210	D159-Y161 PolarHBondContact O-N 3.24Å; D159-Y161 VanDerWaalsContact OD1-CD2 3.24Å; D159-Y161 WeakPolarHBondContact OD1-CD2 3.41Å; D159-Y161 PolarHBondContact OD1-N 3.16Å; Y161-R206 CarbonylContact O-C 3.56Å; Y161-R206 WeakPolarHBondContact O-CA 3.47Å; Y161-F207 PolarHBondContact O-N 3.15Å; Y161-K210 HydrophobicContact CD1-CB 4.35Å; Y161-K210 HydrophobicContact CE1-CB 3.88Å
162	V	83.4	Confident	68.4	Low	1 Å²	1	68.5 Å²	68.5	1%	0.006	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.2	-174.4	-169	0	0	0	0	112.1	D159 R206 T234 W239	D159-V162 HydrophobicContact CB-CG2 4.38Å; D159-V162 PolarHBondContact O-N 3.21Å; V162-R206 HydrophobicContact CG2-CB 4.35Å; V162-R206 HydrophobicContact CG2-CG 4.01Å; V162-T234 HydrophobicContact CB-CG2 4.03Å; V162-T234 HydrophobicContact CG1-CG2 3.52Å; V162-T234 PolarHBondContact O-N 3.1Å; V162-W239 HydrophobicContact CG1-CB 4.12Å; V162-W239 HydrophobicContact CG1-CD2 4.26Å; V162-W239 HydrophobicContact CG1-CE3 3.85Å; V162-W239 HydrophobicContact CG1-CG 4.41Å; V162-W239 HydrophobicContact CG2-CB 4.5Å; V162-W239 HydrophobicContact CG2-CG 4.49Å
163	V	88.2	Confident	70.9	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.006	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	146.3	171.3	-50.1	0	0	0	0	111.8	L165 F204 A205 F207 A213 A216 L217 V231 R232	V163-L165 HydrophobicContact CG2-CD2 4.04Å; V163-F204 CarbonylContact O-C 3.41Å; V163-F204 VanDerWaalsContact O-CA 3.3Å; V163-F204 WeakPolarHBondContact O-CA 3.45Å; V163-A205 HydrophobicContact CG2-CB 3.96Å; V163-A205 PolarHBondContact N-O 3.32Å; V163-A205 PolarHBondContact O-N 2.72Å; V163-F207 HydrophobicContact CB-CE2 4.27Å; V163-F207 HydrophobicContact CG1-CD2 4.2Å; V163-F207 HydrophobicContact CG1-CE2 3.77Å; V163-F207 HydrophobicContact CG2-CD2 4.48Å; V163-F207 HydrophobicContact CG2-CE2 3.54Å; V163-F207 HydrophobicContact CG2-CZ 4.3Å; V163-A213 HydrophobicContact CG1-CB 4.36Å; V163-A216 HydrophobicContact CG1-CB 4.32Å; V163-L217 HydrophobicContact CG1-CD2 4.3Å; V163-L217 HydrophobicContact CG1-CG 4.48Å; V163-V231 HydrophobicContact CB-CG1 4.2Å; V163-V231 HydrophobicContact CG2-CG1 4.2Å; V163-R232 CarbonylContact C-O 3.59Å; V163-R232 WeakPolarHBondContact CA-O 3.39Å
164	F	88.6	Confident	73.1	Confident	40 Å²	40	57 Å²	57	18%	0.175	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	134	171.3	175.2	-114.3	0	0	0	110.4	N166 K202 G203 F204 V231 R232 T234	F164-N166 HydrophobicContact CD1-CB 4.35Å; F164-N166 HydrophobicContact CE1-CB 3.63Å; F164-N166 HydrophobicContact CZ-CB 4.01Å; F164-K202 HydrophobicContact CE2-CB 4.04Å; F164-K202 HydrophobicContact CE2-CD 4.29Å; F164-K202 HydrophobicContact CE2-CG 4.26Å; F164-K202 HydrophobicContact CZ-CB 4.27Å; F164-K202 HydrophobicContact CZ-CD 3.96Å; F164-K202 HydrophobicContact CZ-CG 3.98Å; F164-G203 WeakPolarHBondContact CD2-O 2.88Å; F164-F204 HydrophobicContact CB-CD1 4.22Å; F164-F204 HydrophobicContact CB-CE1 4.11Å; F164-F204 AromaticContact CD2-CD1 3.92Å; F164-F204 HydrophobicContact CD2-CD1 3.92Å; F164-F204 HydrophobicContact CD2-CD2 4.44Å; F164-F204 AromaticContact CD2-CE1 3.46Å; F164-F204 HydrophobicContact CD2-CE1 3.46Å; F164-F204 VanDerWaalsContact CD2-CE1 3.46Å; F164-F204 HydrophobicContact CD2-CE2 4.02Å; F164-F204 HydrophobicContact CD2-CG 4.38Å; F164-F204 AromaticContact CD2-CZ 3.51Å; F164-F204 HydrophobicContact CD2-CZ 3.51Å; F164-F204 HydrophobicContact CE2-CE1 4.29Å; F164-F204 HydrophobicContact CE2-CE2 4.2Å; F164-F204 AromaticContact CE2-CZ 3.89Å; F164-F204 HydrophobicContact CE2-CZ 3.89Å; F164-F204 HydrophobicContact CG-CE1 4.19Å; F164-V231 WeakPolarHBondContact O-CA 3.5Å; F164-R232 PolarHBondContact N-O 3.32Å; F164-R232 PolarHBondContact O-N 3.1Å; F164-T234 HydrophobicContact CB-CG2 4.05Å
165	L	88.8	Confident	75.5	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	119.3	179.1	-52.6	176.2	0	0	0	109.1	V163 L168 I177 F181 K202 G203 A205 I229 V231	V163-L165 HydrophobicContact CG2-CD2 4.04Å; L165-L168 HydrophobicContact CB-CD1 3.98Å; L165-L168 HydrophobicContact CB-CD2 4.38Å; L165-L168 HydrophobicContact CB-CG 4.17Å; L165-L168 HydrophobicContact CD1-CD1 4.44Å; L165-I177 HydrophobicContact CD1-CG2 3.6Å; L165-F181 HydrophobicContact CD1-CE2 3.88Å; L165-F181 HydrophobicContact CD2-CE2 3.68Å; L165-F181 HydrophobicContact CD2-CZ 3.5Å; L165-F181 VanDerWaalsContact CD2-CZ 3.5Å; L165-F181 HydrophobicContact CG-CE2 4.42Å; L165-K202 CarbonylContact O-C 3.58Å; L165-K202 WeakPolarHBondContact O-CA 3.44Å; L165-G203 PolarHBondContact N-O 2.93Å; L165-G203 PolarHBondContact O-N 3.45Å; L165-A205 HydrophobicContact CD1-CB 4.31Å; L165-I229 HydrophobicContact CB-CG2 4.42Å; L165-I229 HydrophobicContact CD2-CG2 4.41Å; L165-V231 HydrophobicContact CD2-CB 4.35Å; L165-V231 HydrophobicContact CD2-CG1 3.92Å; L165-V231 HydrophobicContact CD2-CG2 3.85Å
166	N	87.4	Confident	77.9	Confident	55 Å²	55	59 Å²	59	29%	0.294	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	148.7	176.6	-174.1	46	0	0	0	110.7	F164 I229 D230	F164-N166 HydrophobicContact CD1-CB 4.35Å; F164-N166 HydrophobicContact CE1-CB 3.63Å; F164-N166 HydrophobicContact CZ-CB 4.01Å; N166-I229 WeakPolarHBondContact O-CA 3.37Å; N166-D230 HydrophobicContact CB-CB 4.12Å; N166-D230 PolarHBondContact N-O 2.96Å; N166-D230 PolarHBondContact O-N 2.82Å
167	G	81.8	Confident	80	Confident	19 Å²	19	52.6 Å²	52.6	20%	0.196	27%	0.27	C	S	.	.	S	Bend	trans	85.8	11.7	-178.9	0	0	0	0	0	114.6	G201 R227 I229	G167-G201 PolarHBondContact N-O 3.07Å; G167-R227 WeakPolarHBondContact O-CB 3.36Å; G167-I229 WeakPolarHBondContact O-CD1 3.33Å
168	L	86.2	Confident	81.7	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	27%	0.265	C	S	.	.			trans	-58.5	137	176.8	-67.7	172.1	0	0	0	111.2	L165 V172 I177 G201 I224 I229	L165-L168 HydrophobicContact CB-CD1 3.98Å; L165-L168 HydrophobicContact CB-CD2 4.38Å; L165-L168 HydrophobicContact CB-CG 4.17Å; L165-L168 HydrophobicContact CD1-CD1 4.44Å; L168-V172 HydrophobicContact CB-CG1 3.91Å; L168-V172 HydrophobicContact CD1-CG1 4.31Å; L168-V172 HydrophobicContact CD2-CG2 4.33Å; L168-V172 HydrophobicContact CG-CG1 4.49Å; L168-I177 HydrophobicContact CD1-CD1 3.92Å; L168-I177 HydrophobicContact CD2-CD1 4.25Å; L168-I177 HydrophobicContact CD2-CG1 4.12Å; L168-G201 PolarHBondContact N-O 2.85Å; L168-G201 WeakPolarHBondContact O-CA 3.46Å; L168-I224 HydrophobicContact CD2-CD1 3.86Å; L168-I229 HydrophobicContact CD2-CD1 3.89Å; L168-I229 HydrophobicContact CD2-CG1 4.44Å; L168-I229 HydrophobicContact CD2-CG2 4.41Å; L168-I229 HydrophobicContact CG-CD1 4.48Å
169	P	83.3	Confident	83.1	Confident	11 Å²	11	56.5 Å²	56.5	7%	0.071	27%	0.274	C	S	.	.			trans	-55	146.3	170.5	-23.8	31.9	0	0	0	111.6	S171 V172 I224 R227	P169-S171 PolarHBondContact O-N 3.44Å; P169-V172 HydrophobicContact CB-CB 4.42Å; P169-V172 VanDerWaalsContact O-CB 3.26Å; P169-V172 WeakPolarHBondContact O-CB 3.45Å; P169-V172 VanDerWaalsContact O-CG1 3.29Å; P169-V172 WeakPolarHBondContact O-CG1 3.06Å; P169-V172 PolarHBondContact O-N 3.31Å; P169-I224 HydrophobicContact CG-CB 4.5Å; P169-I224 HydrophobicContact CG-CG2 4.24Å; P169-I224 WeakPolarHBondContact CG-O 3.43Å; P169-R227 HydrophobicContact CB-CG 4.43Å; P169-R227 HydrophobicContact CG-CB 4.06Å; P169-R227 HydrophobicContact CG-CG 3.99Å
170	F	81.3	Confident	83.8	Confident	116 Å²	116	56.4 Å²	56.4	51%	0.509	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-20.2	178.7	-58	-41.8	0	0	0	113.1	N199	F170-N199 WeakPolarHBondContact CD1-O 3.44Å; F170-N199 WeakPolarHBondContact O-CB 3.29Å
171	S	81.5	Confident	84.5	Confident	95 Å²	95	53.9 Å²	53.9	66%	0.664	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	5.2	173.6	59.8	0	0	0	0	113.8	P169 T173	P169-S171 PolarHBondContact O-N 3.44Å; S171-T173 PolarHBondContact O-N 2.99Å
172	V	83.8	Confident	84.6	Confident	7 Å²	7	56 Å²	56	4%	0.042	27%	0.269	C	S	.	.			trans	-62.9	134.9	-173.9	77.6	0	0	0	0	110.9	L168 P169 E176 I177 V191 I224	L168-V172 HydrophobicContact CB-CG1 3.91Å; L168-V172 HydrophobicContact CD1-CG1 4.31Å; L168-V172 HydrophobicContact CD2-CG2 4.33Å; L168-V172 HydrophobicContact CG-CG1 4.49Å; P169-V172 HydrophobicContact CB-CB 4.42Å; P169-V172 VanDerWaalsContact O-CB 3.26Å; P169-V172 WeakPolarHBondContact O-CB 3.45Å; P169-V172 VanDerWaalsContact O-CG1 3.29Å; P169-V172 WeakPolarHBondContact O-CG1 3.06Å; P169-V172 PolarHBondContact O-N 3.31Å; V172-E176 HydrophobicContact CG2-CB 4.04Å; V172-I177 HydrophobicContact CG1-CD1 4.28Å; V172-I177 HydrophobicContact CG2-CD1 4.2Å; V172-I177 HydrophobicContact CG2-CG1 3.76Å; V172-V191 HydrophobicContact CG1-CG1 4.38Å; V172-I224 HydrophobicContact CG2-CG2 4.08Å
173	T	83.9	Confident	84.3	Confident	60 Å²	60	59.2 Å²	59.2	37%	0.368	30%	0.303	S	S	.	.			trans	-101.4	155.2	171.2	61.1	0	0	0	0	110.7	S171 R175 E176 I177	S171-T173 PolarHBondContact O-N 2.99Å; T173-R175 PolarHBondContact O-N 3.5Å; T173-R175 VanDerWaalsContact O-N 3.15Å; T173-E176 WeakPolarHBondContact O-CB 3.2Å; T173-E176 PolarHBondContact O-N 3.43Å; T173-E176 WeakPolarHBondContact OG1-CG 3.42Å; T173-E176 PolarHBondContact OG1-N 3.36Å; T173-E176 PolarHBondContact OG1-OE1 3.1Å; T173-I177 PolarHBondContact O-N 3.16Å
174	E	83.4	Confident	84.2	Confident	89 Å²	89	60.4 Å²	60.4	42%	0.416	31%	0.309	S	S	.	.	H	α-helix	trans	-56	-32	174.7	-162.6	-160.4	127.6	0	0	112.1	I177 R178 I189	E174-I177 PolarHBondContact O-N 2.91Å; E174-R178 PolarHBondContact O-N 2.93Å; E174-R178 IonicContact OE1-CZ 3.93Å; E174-R178 IonicContact OE1-NH1 2.68Å; E174-R178 PolarHBondContact OE1-NH1 2.95Å; E174-R178 VanDerWaalsContact OE1-NH1 3.15Å; E174-R178 IonicContact OE1-NH2 3.36Å; E174-R178 PolarHBondContact OE1-NH2 2.97Å; E174-I189 HydrophobicContact CG-CB 3.68Å; E174-I189 HydrophobicContact CG-CD1 3.73Å; E174-I189 HydrophobicContact CG-CG1 4.25Å; E174-I189 HydrophobicContact CG-CG2 3.86Å
175	R	83.5	Confident	83.9	Confident	184 Å²	184	64.1 Å²	64.1	69%	0.694	33%	0.33	S	S	*	.	H	α-helix	trans	-63	-42.9	175.6	-173	177.9	65	169.6	1.3	112.3	T173 I177 R178 E179	T173-R175 PolarHBondContact O-N 3.5Å; T173-R175 VanDerWaalsContact O-N 3.15Å; R175-I177 VanDerWaalsContact C-N 3.33Å; R175-R178 PolarHBondContact O-N 3.42Å; R175-E179 PolarHBondContact O-N 3.32Å
176	E	84.2	Confident	83.7	Confident	63 Å²	63	65.4 Å²	65.4	29%	0.294	34%	0.337	S	S	.	.	H	α-helix	trans	-66	-36.4	177.4	-73.9	161.3	-145.2	0	0	111.9	V172 T173 R178 E179 F180 I224	V172-E176 HydrophobicContact CG2-CB 4.04Å; T173-E176 WeakPolarHBondContact O-CB 3.2Å; T173-E176 PolarHBondContact O-N 3.43Å; T173-E176 WeakPolarHBondContact OG1-CG 3.42Å; T173-E176 PolarHBondContact OG1-N 3.36Å; T173-E176 PolarHBondContact OG1-OE1 3.1Å; E176-R178 VanDerWaalsContact C-N 3.35Å; E176-E179 PolarHBondContact O-N 3.35Å; E176-F180 WeakPolarHBondContact O-CB 3.38Å; E176-F180 PolarHBondContact O-N 3.39Å; E176-I224 HydrophobicContact CB-CG2 4.36Å
177	I	85.3	Confident	83.4	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-66	-40.8	174.2	-61.1	171.6	0	0	0	110.3	L165 L168 V172 T173 E174 R175 F180 F181 I189 V191	L165-I177 HydrophobicContact CD1-CG2 3.6Å; L168-I177 HydrophobicContact CD1-CD1 3.92Å; L168-I177 HydrophobicContact CD2-CD1 4.25Å; L168-I177 HydrophobicContact CD2-CG1 4.12Å; V172-I177 HydrophobicContact CG1-CD1 4.28Å; V172-I177 HydrophobicContact CG2-CD1 4.2Å; V172-I177 HydrophobicContact CG2-CG1 3.76Å; T173-I177 PolarHBondContact O-N 3.16Å; E174-I177 PolarHBondContact O-N 2.91Å; R175-I177 VanDerWaalsContact C-N 3.33Å; I177-F180 WeakPolarHBondContact O-CB 3.4Å; I177-F180 PolarHBondContact O-N 3.43Å; I177-F181 HydrophobicContact CG2-CD2 4.05Å; I177-F181 HydrophobicContact CG2-CE2 4.09Å; I177-F181 VanDerWaalsContact O-CD2 3.28Å; I177-F181 WeakPolarHBondContact O-CD2 3.43Å; I177-F181 PolarHBondContact O-N 3.4Å; I177-I189 HydrophobicContact CB-CD1 4.36Å; I177-I189 HydrophobicContact CB-CG2 4.46Å; I177-I189 HydrophobicContact CD1-CG2 3.99Å; I177-I189 HydrophobicContact CG2-CD1 4.07Å; I177-I189 HydrophobicContact CG2-CG2 4.1Å; I177-V191 HydrophobicContact CD1-CG2 3.61Å
178	R	86.3	Confident	83.3	Confident	115 Å²	115	69.5 Å²	69.5	43%	0.434	35%	0.352	S	S	.	.	H	α-helix	trans	-65.8	-36.9	175.6	-172.9	-178.7	-76.7	97.4	-5.8	112.5	E174 R175 E176 F181 H182 I189	E174-R178 PolarHBondContact O-N 2.93Å; E174-R178 IonicContact OE1-CZ 3.93Å; E174-R178 IonicContact OE1-NH1 2.68Å; E174-R178 PolarHBondContact OE1-NH1 2.95Å; E174-R178 VanDerWaalsContact OE1-NH1 3.15Å; E174-R178 IonicContact OE1-NH2 3.36Å; E174-R178 PolarHBondContact OE1-NH2 2.97Å; R175-R178 PolarHBondContact O-N 3.42Å; E176-R178 VanDerWaalsContact C-N 3.35Å; R178-F181 CarbonylContact O-C 3.56Å; R178-F181 PolarHBondContact O-N 2.67Å; R178-H182 PolarHBondContact O-N 2.85Å; R178-I189 HydrophobicContact CB-CD1 4.3Å
179	E	85.1	Confident	83.3	Confident	141 Å²	141	70.2 Å²	70.2	66%	0.659	36%	0.356	S	S	*	.	H	α-helix	trans	-68.7	-38.3	174.8	-172.2	171	-171.8	0	0	112	R175 E176 F181 H182	R175-E179 PolarHBondContact O-N 3.32Å; E176-E179 PolarHBondContact O-N 3.35Å; E179-F181 PolarHBondContact O-N 3.24Å; E179-H182 VanDerWaalsContact O-CB 3.22Å; E179-H182 WeakPolarHBondContact O-CB 3.32Å; E179-H182 PolarHBondContact O-N 2.81Å
180	F	84.4	Confident	83.4	Confident	27 Å²	27	70.6 Å²	70.6	12%	0.118	36%	0.357	C	S	.	.	H	α-helix	trans	-59.1	-37.4	173.6	179.7	-96.4	0	0	0	112.7	E176 I177 H182 R219 K222 I224 I229 V231	E176-F180 WeakPolarHBondContact O-CB 3.38Å; E176-F180 PolarHBondContact O-N 3.39Å; I177-F180 WeakPolarHBondContact O-CB 3.4Å; I177-F180 PolarHBondContact O-N 3.43Å; F180-H182 VanDerWaalsContact C-N 3.35Å; F180-R219 HydrophobicContact CE1-CB 4.17Å; F180-R219 HydrophobicContact CZ-CB 4.31Å; F180-K222 HydrophobicContact CE2-CB 3.39Å; F180-K222 HydrophobicContact CZ-CB 3.66Å; F180-I224 HydrophobicContact CB-CD1 3.67Å; F180-I224 HydrophobicContact CB-CG1 3.92Å; F180-I224 HydrophobicContact CD1-CD1 4.22Å; F180-I224 HydrophobicContact CD2-CD1 3.75Å; F180-I224 HydrophobicContact CD2-CG1 3.29Å; F180-I224 HydrophobicContact CE2-CD1 4.37Å; F180-I224 HydrophobicContact CE2-CG1 3.86Å; F180-I224 HydrophobicContact CG-CD1 3.63Å; F180-I224 HydrophobicContact CG-CG1 3.73Å; F180-I229 HydrophobicContact CE2-CG1 4.39Å; F180-I229 HydrophobicContact CZ-CB 4.16Å; F180-I229 HydrophobicContact CZ-CG1 4.47Å; F180-V231 HydrophobicContact CE1-CG2 4.22Å
181	F	85.6	Confident	83.6	Confident	1 Å²	1	66.5 Å²	66.5	0%	0.004	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	28.7	174.8	-67.4	-61.6	0	0	0	113.4	L165 I177 R178 E179 G183 L184 I186 F207 A216 R219 V231	L165-F181 HydrophobicContact CD1-CE2 3.88Å; L165-F181 HydrophobicContact CD2-CE2 3.68Å; L165-F181 HydrophobicContact CD2-CZ 3.5Å; L165-F181 VanDerWaalsContact CD2-CZ 3.5Å; L165-F181 HydrophobicContact CG-CE2 4.42Å; I177-F181 HydrophobicContact CG2-CD2 4.05Å; I177-F181 HydrophobicContact CG2-CE2 4.09Å; I177-F181 VanDerWaalsContact O-CD2 3.28Å; I177-F181 WeakPolarHBondContact O-CD2 3.43Å; I177-F181 PolarHBondContact O-N 3.4Å; R178-F181 CarbonylContact O-C 3.56Å; R178-F181 PolarHBondContact O-N 2.67Å; E179-F181 PolarHBondContact O-N 3.24Å; F181-G183 PolarHBondContact O-N 3.34Å; F181-L184 HydrophobicContact CB-CD1 4.3Å; F181-L184 HydrophobicContact CD1-CD1 3.96Å; F181-L184 WeakPolarHBondContact O-CB 3.33Å; F181-L184 PolarHBondContact O-N 2.93Å; F181-L184 VanDerWaalsContact O-N 3.08Å; F181-I186 HydrophobicContact CB-CD1 3.56Å; F181-I186 HydrophobicContact CB-CG1 4.48Å; F181-I186 HydrophobicContact CD2-CD1 3.98Å; F181-I186 HydrophobicContact CG-CD1 4.12Å; F181-F207 HydrophobicContact CB-CE1 4.41Å; F181-F207 HydrophobicContact CD1-CE1 4.5Å; F181-F207 HydrophobicContact CD1-CZ 4.06Å; F181-F207 HydrophobicContact CD2-CZ 4.29Å; F181-F207 HydrophobicContact CE1-CZ 4.31Å; F181-F207 HydrophobicContact CG-CE1 4.34Å; F181-F207 HydrophobicContact CG-CZ 4.07Å; F181-A216 HydrophobicContact CD1-CB 3.82Å; F181-A216 HydrophobicContact CE1-CB 3.53Å; F181-A216 HydrophobicContact CZ-CB 4.35Å; F181-R219 HydrophobicContact CE1-CB 4.5Å; F181-V231 HydrophobicContact CZ-CG1 4.28Å; F181-V231 HydrophobicContact CZ-CG2 4.26Å
182	H	80.6	Confident	83.5	Confident	150 Å²	150	63.2 Å²	63.2	69%	0.694	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	132.1	177.9	-177	82.6	0	0	0	111.7	R178 E179 F180 R219	R178-H182 PolarHBondContact O-N 2.85Å; E179-H182 VanDerWaalsContact O-CB 3.22Å; E179-H182 WeakPolarHBondContact O-CB 3.32Å; E179-H182 PolarHBondContact O-N 2.81Å; F180-H182 VanDerWaalsContact C-N 3.35Å; H182-R219 PolarHBondContact O-NH2 2.95Å; H182-R219 VanDerWaalsContact O-NH2 3.16Å
183	G	76.8	Confident	83.3	Confident	69 Å²	69	69.8 Å²	69.8	71%	0.711	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	0.6	-176.6	0	0	0	0	0	115.1	F181	F181-G183 PolarHBondContact O-N 3.34Å
184	L	86.7	Confident	82.8	Confident	25 Å²	25	71.4 Å²	71.4	13%	0.131	35%	0.349	C	S	.	.	S	Bend	trans	-113.8	143.6	175.7	-54.6	179.5	0	0	0	110.9	F181 I186 F207 D212 E215 A216	F181-L184 HydrophobicContact CB-CD1 4.3Å; F181-L184 HydrophobicContact CD1-CD1 3.96Å; F181-L184 WeakPolarHBondContact O-CB 3.33Å; F181-L184 PolarHBondContact O-N 2.93Å; F181-L184 VanDerWaalsContact O-N 3.08Å; L184-I186 PolarHBondContact O-N 2.79Å; L184-F207 HydrophobicContact CB-CD1 4.08Å; L184-F207 HydrophobicContact CB-CE1 3.82Å; L184-F207 HydrophobicContact CD1-CE1 3.91Å; L184-F207 HydrophobicContact CD1-CZ 4.45Å; L184-D212 HydrophobicContact CB-CB 4.22Å; L184-D212 HydrophobicContact CD2-CB 4.25Å; L184-E215 HydrophobicContact CD1-CB 4.26Å; L184-E215 HydrophobicContact CD2-CB 3.63Å; L184-E215 HydrophobicContact CD2-CG 4.42Å; L184-A216 HydrophobicContact CD1-CB 3.87Å
185	L	81.5	Confident	82.1	Confident	118 Å²	118	75.8 Å²	75.8	62%	0.618	38%	0.375	S	S	*	.			trans	-84.6	101.7	178.9	-64.2	176	0	0	0	110.7	F207 A208 D212	L185-F207 WeakPolarHBondContact O-CA 3.16Å; L185-A208 HydrophobicContact CB-CB 3.97Å; L185-A208 PolarHBondContact O-N 3.23Å; L185-D212 WeakPolarHBondContact CB-OD2 3.49Å; L185-D212 PolarHBondContact N-OD2 2.85Å
186	I	84.8	Confident	81.4	Confident	28 Å²	28	72 Å²	72	14%	0.144	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	123.9	175	-60.3	168.1	0	0	0	109.5	F181 L184 I189 R206 F207	F181-I186 HydrophobicContact CB-CD1 3.56Å; F181-I186 HydrophobicContact CB-CG1 4.48Å; F181-I186 HydrophobicContact CD2-CD1 3.98Å; F181-I186 HydrophobicContact CG-CD1 4.12Å; L184-I186 PolarHBondContact O-N 2.79Å; I186-I189 HydrophobicContact CD1-CD1 4.16Å; I186-I189 HydrophobicContact CG2-CD1 3.9Å; I186-I189 HydrophobicContact CG2-CG1 3.46Å; I186-I189 VanDerWaalsContact CG2-CG1 3.46Å; I186-R206 WeakPolarHBondContact CG2-O 3.4Å; I186-F207 HydrophobicContact CD1-CE1 4.04Å; I186-F207 HydrophobicContact CG1-CD1 3.69Å; I186-F207 HydrophobicContact CG1-CE1 3.37Å; I186-F207 HydrophobicContact CG1-CZ 4.13Å
187	D	81.5	Confident	80.6	Confident	98 Å²	98	71.5 Å²	71.5	52%	0.524	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-44	176.7	-158.5	10.9	0	0	0	110.6	R206	D187-R206 PolarHBondContact N-O 3.36Å; D187-R206 IonicContact OD1-NH2 3.62Å; D187-R206 IonicContact OD2-CZ 3.03Å; D187-R206 IonicContact OD2-NH1 2.64Å; D187-R206 PolarHBondContact OD2-NH1 3.09Å; D187-R206 IonicContact OD2-NH2 3.39Å; D187-R206 PolarHBondContact OD2-NH2 3.26Å
188	E	80.1	Confident	79.9	Confident	61 Å²	61	77.7 Å²	77.7	29%	0.285	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	145.9	-177.4	-163.9	175.3	172.2	0	0	112.5	R206 W239	E188-R206 PolarHBondContact N-O 3.33Å; E188-R206 PolarHBondContact O-N 2.92Å; E188-R206 IonicContact OE2-NH2 2.67Å; E188-W239 HydrophobicContact CB-CH2 3.73Å; E188-W239 HydrophobicContact CB-CZ2 3.7Å; E188-W239 HydrophobicContact CG-CH2 3.79Å; E188-W239 HydrophobicContact CG-CZ2 3.72Å; E188-W239 WeakPolarHBondContact O-CH2 3.41Å; E188-W239 WeakPolarHBondContact OE2-CZ2 3.49Å
189	I	86.2	Confident	79.6	Confident	17 Å²	17	73.7 Å²	73.7	9%	0.087	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130.1	178.1	-59.7	167.6	0	0	0	108.8	E174 I177 R178 I186 V191 F204 A205	E174-I189 HydrophobicContact CG-CB 3.68Å; E174-I189 HydrophobicContact CG-CD1 3.73Å; E174-I189 HydrophobicContact CG-CG1 4.25Å; E174-I189 HydrophobicContact CG-CG2 3.86Å; I177-I189 HydrophobicContact CB-CD1 4.36Å; I177-I189 HydrophobicContact CB-CG2 4.46Å; I177-I189 HydrophobicContact CD1-CG2 3.99Å; I177-I189 HydrophobicContact CG2-CD1 4.07Å; I177-I189 HydrophobicContact CG2-CG2 4.1Å; R178-I189 HydrophobicContact CB-CD1 4.3Å; I186-I189 HydrophobicContact CD1-CD1 4.16Å; I186-I189 HydrophobicContact CG2-CD1 3.9Å; I186-I189 HydrophobicContact CG2-CG1 3.46Å; I186-I189 VanDerWaalsContact CG2-CG1 3.46Å; I189-V191 HydrophobicContact CG2-CG2 4.4Å; I189-F204 WeakPolarHBondContact CA-O 3.35Å; I189-A205 HydrophobicContact CG1-CB 4.34Å
190	V	84.4	Confident	79.2	Confident	18 Å²	18	69.9 Å²	69.9	11%	0.109	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	115.4	179.9	174.6	0	0	0	0	109.2	G203 F204 W239 A242	V190-G203 CarbonylContact O-C 3.5Å; V190-G203 WeakPolarHBondContact O-CA 3.22Å; V190-F204 PolarHBondContact N-O 3.24Å; V190-F204 PolarHBondContact O-N 3.17Å; V190-W239 HydrophobicContact CB-CH2 4.17Å; V190-W239 HydrophobicContact CB-CZ3 3.91Å; V190-W239 HydrophobicContact CG2-CE3 4.37Å; V190-W239 HydrophobicContact CG2-CH2 3.47Å; V190-W239 VanDerWaalsContact CG2-CH2 3.47Å; V190-W239 HydrophobicContact CG2-CZ2 3.98Å; V190-W239 HydrophobicContact CG2-CZ3 3.7Å; V190-A242 HydrophobicContact CG1-CB 3.89Å; V190-A242 WeakPolarHBondContact CG1-O 3.32Å
191	V	85.5	Confident	78.9	Confident	31 Å²	31	68.8 Å²	68.8	19%	0.188	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	120.7	175.4	-175.6	0	0	0	0	109.4	V172 I177 I189 K193 N199	V172-V191 HydrophobicContact CG1-CG1 4.38Å; I177-V191 HydrophobicContact CD1-CG2 3.61Å; I189-V191 HydrophobicContact CG2-CG2 4.4Å; V191-K193 PolarHBondContact O-N 2.89Å; V191-N199 HydrophobicContact CG1-CB 4.41Å
192	C	80.8	Confident	78.9	Confident	26 Å²	26	72.9 Å²	72.9	18%	0.176	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	126.3	-179.3	-59.5	0	0	0	0	110.8	N200 K202 F204	C192-N200 PolarHBondContact O-N 2.86Å; C192-K202 HydrophobicContact CB-CB 4.22Å; C192-K202 WeakPolarHBondContact CB-O 3.47Å; C192-K202 PolarHBondContact N-O 3.38Å; C192-F204 WeakPolarHBondContact SG-CE2 3.32Å
193	K	79.8	Confident	79.2	Confident	144 Å²	144	65.8 Å²	65.8	63%	0.626	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	147.6	173.6	-61.4	177.9	-176.4	176.5	0	109.5	V191 Q198	V191-K193 PolarHBondContact O-N 2.89Å; K193-Q198 CarbonylContact C-O 3.45Å; K193-Q198 WeakPolarHBondContact CA-O 3.43Å
194	K	72.8	Confident	79.7	Confident	95 Å²	95	63.1 Å²	63.1	41%	0.413	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-75	166	168.9	-65.9	-176.5	178.1	177.9	0	109.7	T196 G197 Q198 N200	K194-T196 PolarHBondContact O-N 3.47Å; K194-G197 PolarHBondContact O-N 3.45Å; K194-Q198 PolarHBondContact N-O 3.34Å; K194-N200 WeakPolarHBondContact CE-OD1 3.48Å; K194-N200 HydrophobicContact CG-CB 3.78Å
195	D	67.5	Low	79.8	Confident	180 Å²	180	61.9 Å²	61.9	96%	0.963	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.1	175.5	-50.7	-42.8	0	0	0	113.2	G197	D195-G197 VanDerWaalsContact C-N 3.3Å
196	T	69.7	Low	80	Confident	106 Å²	106	57.9 Å²	57.9	65%	0.65	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	2.3	173.9	60.5	0	0	0	0	113.9	K194 Q198	K194-T196 PolarHBondContact O-N 3.47Å; T196-Q198 PolarHBondContact O-N 3.16Å
197	G	67	Low	80.1	Confident	51 Å²	51	56.6 Å²	56.6	53%	0.526	30%	0.298	S	S	.	.	S	Bend	trans	79.3	-5.3	-178.1	0	0	0	0	0	115.2	K194 D195	K194-G197 PolarHBondContact O-N 3.45Å; D195-G197 VanDerWaalsContact C-N 3.3Å
198	Q	70.3	Confident	80.2	Confident	131 Å²	131	54.5 Å²	54.5	61%	0.612	29%	0.294	S	S	*	.	S	Bend	trans	-83.7	144.8	177	-68.3	-176.8	-10.7	0	0	111.9	K193 K194 T196 N200	K193-Q198 CarbonylContact C-O 3.45Å; K193-Q198 WeakPolarHBondContact CA-O 3.43Å; K194-Q198 PolarHBondContact N-O 3.34Å; T196-Q198 PolarHBondContact O-N 3.16Å; Q198-N200 PolarHBondContact O-N 2.91Å
199	N	79.7	Confident	80.3	Confident	30 Å²	30	53.8 Å²	53.8	16%	0.16	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	133.4	179	-61.6	25.6	0	0	0	110.2	F170 V191 G201	F170-N199 WeakPolarHBondContact CD1-O 3.44Å; F170-N199 WeakPolarHBondContact O-CB 3.29Å; V191-N199 HydrophobicContact CG1-CB 4.41Å; N199-G201 PolarHBondContact O-N 2.98Å
200	N	77.7	Confident	80.1	Confident	61 Å²	61	57.5 Å²	57.5	33%	0.326	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	7.8	-177.8	-162.9	14.5	0	0	0	113	C192 K194 Q198 K202	C192-N200 PolarHBondContact O-N 2.86Å; K194-N200 WeakPolarHBondContact CE-OD1 3.48Å; K194-N200 HydrophobicContact CG-CB 3.78Å; Q198-N200 PolarHBondContact O-N 2.91Å; N200-K202 PolarHBondContact O-N 2.95Å
201	G	78.4	Confident	80	Confident	5 Å²	5	62.6 Å²	62.6	5%	0.052	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	62.8	18.2	-172.9	0	0	0	0	0	113.9	G167 L168 N199	G167-G201 PolarHBondContact N-O 3.07Å; L168-G201 PolarHBondContact N-O 2.85Å; L168-G201 WeakPolarHBondContact O-CA 3.46Å; N199-G201 PolarHBondContact O-N 2.98Å
202	K	84.7	Confident	80	Confident	87 Å²	87	62.2 Å²	62.2	38%	0.378	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	143.2	176	-67	-178.1	179.5	-173.2	0	108.9	F164 L165 C192 N200	F164-K202 HydrophobicContact CE2-CB 4.04Å; F164-K202 HydrophobicContact CE2-CD 4.29Å; F164-K202 HydrophobicContact CE2-CG 4.26Å; F164-K202 HydrophobicContact CZ-CB 4.27Å; F164-K202 HydrophobicContact CZ-CD 3.96Å; F164-K202 HydrophobicContact CZ-CG 3.98Å; L165-K202 CarbonylContact O-C 3.58Å; L165-K202 WeakPolarHBondContact O-CA 3.44Å; C192-K202 HydrophobicContact CB-CB 4.22Å; C192-K202 WeakPolarHBondContact CB-O 3.47Å; C192-K202 PolarHBondContact N-O 3.38Å; N200-K202 PolarHBondContact O-N 2.95Å
203	G	87.2	Confident	80.3	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	172.9	176.2	0	0	0	0	0	111.1	F164 L165 V190	F164-G203 WeakPolarHBondContact CD2-O 2.88Å; L165-G203 PolarHBondContact N-O 2.93Å; L165-G203 PolarHBondContact O-N 3.45Å; V190-G203 CarbonylContact O-C 3.5Å; V190-G203 WeakPolarHBondContact O-CA 3.22Å
204	F	88.3	Confident	80.5	Confident	13 Å²	13	58.6 Å²	58.6	6%	0.057	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145.6	178.4	-62.8	-96.6	0	0	0	108.5	V163 F164 I189 V190 C192 T234 W239 A242	V163-F204 CarbonylContact O-C 3.41Å; V163-F204 VanDerWaalsContact O-CA 3.3Å; V163-F204 WeakPolarHBondContact O-CA 3.45Å; F164-F204 HydrophobicContact CB-CD1 4.22Å; F164-F204 HydrophobicContact CB-CE1 4.11Å; F164-F204 AromaticContact CD2-CD1 3.92Å; F164-F204 HydrophobicContact CD2-CD1 3.92Å; F164-F204 HydrophobicContact CD2-CD2 4.44Å; F164-F204 AromaticContact CD2-CE1 3.46Å; F164-F204 HydrophobicContact CD2-CE1 3.46Å; F164-F204 VanDerWaalsContact CD2-CE1 3.46Å; F164-F204 HydrophobicContact CD2-CE2 4.02Å; F164-F204 HydrophobicContact CD2-CG 4.38Å; F164-F204 AromaticContact CD2-CZ 3.51Å; F164-F204 HydrophobicContact CD2-CZ 3.51Å; F164-F204 HydrophobicContact CE2-CE1 4.29Å; F164-F204 HydrophobicContact CE2-CE2 4.2Å; F164-F204 AromaticContact CE2-CZ 3.89Å; F164-F204 HydrophobicContact CE2-CZ 3.89Å; F164-F204 HydrophobicContact CG-CE1 4.19Å; I189-F204 WeakPolarHBondContact CA-O 3.35Å; V190-F204 PolarHBondContact N-O 3.24Å; V190-F204 PolarHBondContact O-N 3.17Å; C192-F204 WeakPolarHBondContact SG-CE2 3.32Å; F204-T234 HydrophobicContact CD1-CG2 3.76Å; F204-T234 HydrophobicContact CE1-CG2 3.91Å; F204-W239 HydrophobicContact CB-CE3 3.43Å; F204-W239 VanDerWaalsContact CB-CE3 3.43Å; F204-W239 HydrophobicContact CB-CZ3 3.53Å; F204-W239 HydrophobicContact CG-CE3 4.26Å; F204-A242 HydrophobicContact CD2-CB 3.43Å; F204-A242 VanDerWaalsContact CD2-CB 3.43Å; F204-A242 HydrophobicContact CE2-CB 3.41Å; F204-A242 VanDerWaalsContact CE2-CB 3.41Å; F204-A242 HydrophobicContact CG-CB 4.33Å; F204-A242 HydrophobicContact CZ-CB 4.27Å
205	A	88.4	Confident	81.2	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	130.8	172.6	0	0	0	0	0	109.3	V163 L165 I189 F207	V163-A205 HydrophobicContact CG2-CB 3.96Å; V163-A205 PolarHBondContact N-O 3.32Å; V163-A205 PolarHBondContact O-N 2.72Å; L165-A205 HydrophobicContact CD1-CB 4.31Å; I189-A205 HydrophobicContact CG1-CB 4.34Å; A205-F207 HydrophobicContact CB-CE2 4.23Å; A205-F207 HydrophobicContact CB-CZ 4.36Å
206	R	85.3	Confident	82	Confident	33 Å²	33	49.1 Å²	49.1	13%	0.125	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126	175.5	-173.8	171.3	68.2	76.3	2	109.3	Y161 V162 I186 D187 E188 W239	Y161-R206 CarbonylContact O-C 3.56Å; Y161-R206 WeakPolarHBondContact O-CA 3.47Å; V162-R206 HydrophobicContact CG2-CB 4.35Å; V162-R206 HydrophobicContact CG2-CG 4.01Å; I186-R206 WeakPolarHBondContact CG2-O 3.4Å; D187-R206 PolarHBondContact N-O 3.36Å; D187-R206 IonicContact OD1-NH2 3.62Å; D187-R206 IonicContact OD2-CZ 3.03Å; D187-R206 IonicContact OD2-NH1 2.64Å; D187-R206 PolarHBondContact OD2-NH1 3.09Å; D187-R206 IonicContact OD2-NH2 3.39Å; D187-R206 PolarHBondContact OD2-NH2 3.26Å; E188-R206 PolarHBondContact N-O 3.33Å; E188-R206 PolarHBondContact O-N 2.92Å; E188-R206 IonicContact OE2-NH2 2.67Å; R206-W239 HydrophobicContact CB-CH2 3.83Å; R206-W239 HydrophobicContact CB-CZ2 3.9Å; R206-W239 HydrophobicContact CB-CZ3 4.19Å
207	F	87.4	Confident	82.8	Confident	1 Å²	1	46.1 Å²	46.1	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	153.4	179.8	-63.8	-89.1	0	0	0	111.1	Y161 V163 F181 L184 L185 I186 A205 T209 D212 A213 A216	Y161-F207 PolarHBondContact O-N 3.15Å; V163-F207 HydrophobicContact CB-CE2 4.27Å; V163-F207 HydrophobicContact CG1-CD2 4.2Å; V163-F207 HydrophobicContact CG1-CE2 3.77Å; V163-F207 HydrophobicContact CG2-CD2 4.48Å; V163-F207 HydrophobicContact CG2-CE2 3.54Å; V163-F207 HydrophobicContact CG2-CZ 4.3Å; F181-F207 HydrophobicContact CB-CE1 4.41Å; F181-F207 HydrophobicContact CD1-CE1 4.5Å; F181-F207 HydrophobicContact CD1-CZ 4.06Å; F181-F207 HydrophobicContact CD2-CZ 4.29Å; F181-F207 HydrophobicContact CE1-CZ 4.31Å; F181-F207 HydrophobicContact CG-CE1 4.34Å; F181-F207 HydrophobicContact CG-CZ 4.07Å; L184-F207 HydrophobicContact CB-CD1 4.08Å; L184-F207 HydrophobicContact CB-CE1 3.82Å; L184-F207 HydrophobicContact CD1-CE1 3.91Å; L184-F207 HydrophobicContact CD1-CZ 4.45Å; L185-F207 WeakPolarHBondContact O-CA 3.16Å; I186-F207 HydrophobicContact CD1-CE1 4.04Å; I186-F207 HydrophobicContact CG1-CD1 3.69Å; I186-F207 HydrophobicContact CG1-CE1 3.37Å; I186-F207 HydrophobicContact CG1-CZ 4.13Å; A205-F207 HydrophobicContact CB-CE2 4.23Å; A205-F207 HydrophobicContact CB-CZ 4.36Å; F207-T209 VanDerWaalsContact C-N 3.33Å; F207-D212 HydrophobicContact CB-CB 3.99Å; F207-D212 HydrophobicContact CD1-CB 3.87Å; F207-D212 HydrophobicContact CG-CB 4.17Å; F207-A213 HydrophobicContact CB-CB 4.22Å; F207-A213 HydrophobicContact CD2-CB 3.84Å; F207-A213 HydrophobicContact CG-CB 4.27Å; F207-A216 HydrophobicContact CD2-CB 4.42Å; F207-A216 HydrophobicContact CE1-CB 4Å; F207-A216 HydrophobicContact CE2-CB 3.5Å; F207-A216 VanDerWaalsContact CE2-CB 3.5Å; F207-A216 HydrophobicContact CZ-CB 3.26Å
208	A	83.1	Confident	83.7	Confident	54 Å²	54	50.8 Å²	50.8	45%	0.446	25%	0.252	S	S	.	.	S	Bend	trans	-72.3	-30.2	177.3	0	0	0	0	0	112.1	L185	L185-A208 HydrophobicContact CB-CB 3.97Å; L185-A208 PolarHBondContact O-N 3.23Å
209	T	81.9	Confident	84.2	Confident	46 Å²	46	47 Å²	47	28%	0.282	23%	0.232	S	C	.	.	S	Bend	trans	-122.9	153.7	-179.8	72.3	0	0	0	0	111.1	F207 E211 D212 A213	F207-T209 VanDerWaalsContact C-N 3.33Å; T209-E211 VanDerWaalsContact C-N 3.29Å; T209-E211 WeakPolarHBondContact CB-OE2 3.44Å; T209-D212 PolarHBondContact O-N 2.88Å; T209-D212 VanDerWaalsContact OG1-CB 3.24Å; T209-D212 WeakPolarHBondContact OG1-CB 3.41Å; T209-D212 PolarHBondContact OG1-N 3.2Å; T209-D212 PolarHBondContact OG1-OD2 3.43Å; T209-A213 PolarHBondContact O-N 3.02Å
210	K	81.8	Confident	84.5	Confident	95 Å²	95	49.5 Å²	49.5	41%	0.413	25%	0.246	S	C	.	.	H	α-helix	trans	-69.9	-34.6	176.6	170.9	173.1	-175.4	-177.6	0	110.5	P160 Y161 D212 A213 L214	P160-K210 HydrophobicContact CB-CB 4.38Å; P160-K210 HydrophobicContact CB-CD 3.64Å; P160-K210 HydrophobicContact CB-CG 3.78Å; P160-K210 HydrophobicContact CG-CD 4.31Å; Y161-K210 HydrophobicContact CD1-CB 4.35Å; Y161-K210 HydrophobicContact CE1-CB 3.88Å; K210-D212 VanDerWaalsContact C-N 3.34Å; K210-A213 PolarHBondContact O-N 2.96Å; K210-L214 HydrophobicContact CG-CD1 4.43Å; K210-L214 WeakPolarHBondContact O-CG 3.46Å; K210-L214 PolarHBondContact O-N 2.85Å
211	E	82.4	Confident	84.5	Confident	125 Å²	125	48.6 Å²	48.6	58%	0.584	25%	0.251	S	S	*	.	H	α-helix	trans	-61.5	-43.6	177.4	-64.2	68.6	-150.1	0	0	110.4	T209 A213 L214 E215	T209-E211 VanDerWaalsContact C-N 3.29Å; T209-E211 WeakPolarHBondContact CB-OE2 3.44Å; E211-A213 PolarHBondContact O-N 3.2Å; E211-L214 PolarHBondContact O-N 3.28Å; E211-E215 WeakPolarHBondContact O-CG 3.07Å; E211-E215 PolarHBondContact O-N 3.09Å
212	D	86.6	Confident	84.8	Confident	24 Å²	24	53.4 Å²	53.4	13%	0.128	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-39.4	176.5	-71.9	-32	0	0	0	112.3	L184 L185 F207 T209 K210 L214 E215 A216	L184-D212 HydrophobicContact CB-CB 4.22Å; L184-D212 HydrophobicContact CD2-CB 4.25Å; L185-D212 WeakPolarHBondContact CB-OD2 3.49Å; L185-D212 PolarHBondContact N-OD2 2.85Å; F207-D212 HydrophobicContact CB-CB 3.99Å; F207-D212 HydrophobicContact CD1-CB 3.87Å; F207-D212 HydrophobicContact CG-CB 4.17Å; T209-D212 PolarHBondContact O-N 2.88Å; T209-D212 VanDerWaalsContact OG1-CB 3.24Å; T209-D212 WeakPolarHBondContact OG1-CB 3.41Å; T209-D212 PolarHBondContact OG1-N 3.2Å; T209-D212 PolarHBondContact OG1-OD2 3.43Å; K210-D212 VanDerWaalsContact C-N 3.34Å; D212-L214 VanDerWaalsContact C-N 3.32Å; D212-L214 PolarHBondContact O-N 3.46Å; D212-E215 PolarHBondContact O-N 2.81Å; D212-A216 WeakPolarHBondContact O-CB 3.45Å; D212-A216 PolarHBondContact O-N 3.07Å
213	A	85.6	Confident	84.7	Confident	4 Å²	4	56.8 Å²	56.8	3%	0.033	28%	0.282	C	S	.	.	H	α-helix	trans	-63	-38.4	175	0	0	0	0	0	111.9	P160 V163 F207 T209 K210 E211 A216 L217	P160-A213 WeakPolarHBondContact O-CB 3.48Å; V163-A213 HydrophobicContact CG1-CB 4.36Å; F207-A213 HydrophobicContact CB-CB 4.22Å; F207-A213 HydrophobicContact CD2-CB 3.84Å; F207-A213 HydrophobicContact CG-CB 4.27Å; T209-A213 PolarHBondContact O-N 3.02Å; K210-A213 PolarHBondContact O-N 2.96Å; E211-A213 PolarHBondContact O-N 3.2Å; A213-A216 WeakPolarHBondContact O-CB 3.14Å; A213-A216 PolarHBondContact O-N 3.05Å; A213-L217 WeakPolarHBondContact O-CG 3.24Å; A213-L217 PolarHBondContact O-N 3.09Å
214	L	85.3	Confident	84.5	Confident	89 Å²	89	57.4 Å²	57.4	47%	0.466	29%	0.285	S	S	.	.	H	α-helix	trans	-67.1	-40.1	174.5	-68.8	172.4	0	0	0	112.2	K210 E211 D212 A216 L217 K218	K210-L214 HydrophobicContact CG-CD1 4.43Å; K210-L214 WeakPolarHBondContact O-CG 3.46Å; K210-L214 PolarHBondContact O-N 2.85Å; E211-L214 PolarHBondContact O-N 3.28Å; D212-L214 VanDerWaalsContact C-N 3.32Å; D212-L214 PolarHBondContact O-N 3.46Å; L214-A216 VanDerWaalsContact C-N 3.26Å; L214-A216 PolarHBondContact O-N 2.9Å; L214-L217 HydrophobicContact CD2-CD1 4.14Å; L214-L217 PolarHBondContact O-N 3.5Å; L214-K218 PolarHBondContact O-N 3.32Å
215	E	86.7	Confident	84.2	Confident	76 Å²	76	60.3 Å²	60.3	36%	0.355	32%	0.319	S	S	.	.	H	α-helix	trans	-67.9	-26.1	174	-71.7	-59.4	138.5	0	0	112.9	L184 E211 D212 K218 R219	L184-E215 HydrophobicContact CD1-CB 4.26Å; L184-E215 HydrophobicContact CD2-CB 3.63Å; L184-E215 HydrophobicContact CD2-CG 4.42Å; E211-E215 WeakPolarHBondContact O-CG 3.07Å; E211-E215 PolarHBondContact O-N 3.09Å; D212-E215 PolarHBondContact O-N 2.81Å; E215-K218 IonicContact OE1-NZ 2.76Å; E215-K218 PolarHBondContact OE1-NZ 2.76Å; E215-K218 IonicContact OE2-NZ 3.45Å; E215-R219 PolarHBondContact O-NH1 2.71Å
216	A	85.4	Confident	83.8	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-69.2	-41	172.2	0	0	0	0	0	111.8	V163 F181 L184 F207 D212 A213 L214 K218 R219	V163-A216 HydrophobicContact CG1-CB 4.32Å; F181-A216 HydrophobicContact CD1-CB 3.82Å; F181-A216 HydrophobicContact CE1-CB 3.53Å; F181-A216 HydrophobicContact CZ-CB 4.35Å; L184-A216 HydrophobicContact CD1-CB 3.87Å; F207-A216 HydrophobicContact CD2-CB 4.42Å; F207-A216 HydrophobicContact CE1-CB 4Å; F207-A216 HydrophobicContact CE2-CB 3.5Å; F207-A216 VanDerWaalsContact CE2-CB 3.5Å; F207-A216 HydrophobicContact CZ-CB 3.26Å; D212-A216 WeakPolarHBondContact O-CB 3.45Å; D212-A216 PolarHBondContact O-N 3.07Å; A213-A216 WeakPolarHBondContact O-CB 3.14Å; A213-A216 PolarHBondContact O-N 3.05Å; L214-A216 VanDerWaalsContact C-N 3.26Å; L214-A216 PolarHBondContact O-N 2.9Å; A216-K218 VanDerWaalsContact C-N 3.27Å; A216-K218 PolarHBondContact O-N 2.99Å; A216-R219 WeakPolarHBondContact O-CB 3.18Å; A216-R219 PolarHBondContact O-N 3.33Å
217	L	86.3	Confident	83.6	Confident	44 Å²	44	69.3 Å²	69.3	23%	0.23	37%	0.37	C	S	.	.	H	α-helix	trans	-62.7	-33.1	176.3	-64.1	166	0	0	0	112.3	V163 A213 L214 R219 D220 V231 R232 T233	V163-L217 HydrophobicContact CG1-CD2 4.3Å; V163-L217 HydrophobicContact CG1-CG 4.48Å; A213-L217 WeakPolarHBondContact O-CG 3.24Å; A213-L217 PolarHBondContact O-N 3.09Å; L214-L217 HydrophobicContact CD2-CD1 4.14Å; L214-L217 PolarHBondContact O-N 3.5Å; L217-R219 PolarHBondContact O-N 3.32Å; L217-R219 VanDerWaalsContact O-N 3.16Å; L217-D220 VanDerWaalsContact O-CB 3.29Å; L217-D220 WeakPolarHBondContact O-CB 3.26Å; L217-D220 PolarHBondContact O-N 3.4Å; L217-D220 VanDerWaalsContact O-N 3.1Å; L217-V231 HydrophobicContact CD2-CG1 4.31Å; L217-R232 VanDerWaalsContact CD2-C 3.45Å; L217-T233 HydrophobicContact CD1-CG2 3.39Å; L217-T233 HydrophobicContact CD2-CG2 3.79Å; L217-T233 HydrophobicContact CG-CG2 4.19Å
218	K	85.1	Confident	83.5	Confident	148 Å²	148	76.5 Å²	76.5	64%	0.643	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-13.9	174.4	-66.7	178.5	-174.6	171.7	0	113.6	L214 E215 A216 D220	L214-K218 PolarHBondContact O-N 3.32Å; E215-K218 IonicContact OE1-NZ 2.76Å; E215-K218 PolarHBondContact OE1-NZ 2.76Å; E215-K218 IonicContact OE2-NZ 3.45Å; A216-K218 VanDerWaalsContact C-N 3.27Å; A216-K218 PolarHBondContact O-N 2.99Å; K218-D220 VanDerWaalsContact C-N 3.32Å
219	R	80.8	Confident	83.8	Confident	52 Å²	52	73.9 Å²	73.9	20%	0.196	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	8.2	175.6	-66.6	-173.8	168.5	74.8	-12	113.1	F180 F181 H182 E215 A216 L217 K222	F180-R219 HydrophobicContact CE1-CB 4.17Å; F180-R219 HydrophobicContact CZ-CB 4.31Å; F181-R219 HydrophobicContact CE1-CB 4.5Å; H182-R219 PolarHBondContact O-NH2 2.95Å; H182-R219 VanDerWaalsContact O-NH2 3.16Å; E215-R219 PolarHBondContact O-NH1 2.71Å; A216-R219 WeakPolarHBondContact O-CB 3.18Å; A216-R219 PolarHBondContact O-N 3.33Å; L217-R219 PolarHBondContact O-N 3.32Å; L217-R219 VanDerWaalsContact O-N 3.16Å; R219-K222 HydrophobicContact CB-CD 4.1Å; R219-K222 HydrophobicContact CG-CD 4.27Å; R219-K222 WeakPolarHBondContact O-CB 3.46Å; R219-K222 WeakPolarHBondContact O-CG 3.38Å; R219-K222 PolarHBondContact O-N 2.77Å
220	D	85.3	Confident	84	Confident	83 Å²	83	73 Å²	73	44%	0.444	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	139.3	171.7	-177.1	49.4	0	0	0	112.3	L217 K218 K222 D230 V231	L217-D220 VanDerWaalsContact O-CB 3.29Å; L217-D220 WeakPolarHBondContact O-CB 3.26Å; L217-D220 PolarHBondContact O-N 3.4Å; L217-D220 VanDerWaalsContact O-N 3.1Å; K218-D220 VanDerWaalsContact C-N 3.32Å; D220-K222 VanDerWaalsContact C-N 3.32Å; D220-K222 PolarHBondContact O-N 2.98Å; D220-D230 VanDerWaalsContact OD1-CA 3.24Å; D220-D230 WeakPolarHBondContact OD1-CA 3.45Å; D220-V231 HydrophobicContact CB-CB 4.3Å; D220-V231 PolarHBondContact OD1-N 3.43Å
221	G	79.4	Confident	84.3	Confident	41 Å²	41	68.8 Å²	68.8	42%	0.423	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	3.4	179.8	0	0	0	0	0	115.7	I229	G221-I229 WeakPolarHBondContact CA-O 3.35Å; G221-I229 PolarHBondContact N-O 3.21Å
222	K	84.1	Confident	84.5	Confident	107 Å²	107	69.5 Å²	69.5	47%	0.465	35%	0.35	S	S	.	.			trans	-80.4	161.3	172.4	-68.7	-174.3	-177.6	-176.8	0	111.8	F180 R219 D220 I229	F180-K222 HydrophobicContact CE2-CB 3.39Å; F180-K222 HydrophobicContact CZ-CB 3.66Å; R219-K222 HydrophobicContact CB-CD 4.1Å; R219-K222 HydrophobicContact CG-CD 4.27Å; R219-K222 WeakPolarHBondContact O-CB 3.46Å; R219-K222 WeakPolarHBondContact O-CG 3.38Å; R219-K222 PolarHBondContact O-N 2.77Å; D220-K222 VanDerWaalsContact C-N 3.32Å; D220-K222 PolarHBondContact O-N 2.98Å; K222-I229 PolarHBondContact O-N 3.17Å
223	Y	82.1	Confident	84.3	Confident	158 Å²	158	71.6 Å²	71.6	62%	0.62	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	138.2	-174.2	-68.5	-101.4	0	0	0	112.4	R227	Y223-R227 CarbonylContact C-O 3.52Å; Y223-R227 VanDerWaalsContact CA-O 3.22Å; Y223-R227 WeakPolarHBondContact CA-O 3.43Å; Y223-R227 VanDerWaalsContact CD1-C 3.49Å
224	I	84.3	Confident	84	Confident	12 Å²	12	72 Å²	72	6%	0.062	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	112.6	160.8	-63	177.8	0	0	0	106.7	L168 P169 V172 E176 F180 S226 R227 I229	L168-I224 HydrophobicContact CD2-CD1 3.86Å; P169-I224 HydrophobicContact CG-CB 4.5Å; P169-I224 HydrophobicContact CG-CG2 4.24Å; P169-I224 WeakPolarHBondContact CG-O 3.43Å; V172-I224 HydrophobicContact CG2-CG2 4.08Å; E176-I224 HydrophobicContact CB-CG2 4.36Å; F180-I224 HydrophobicContact CB-CD1 3.67Å; F180-I224 HydrophobicContact CB-CG1 3.92Å; F180-I224 HydrophobicContact CD1-CD1 4.22Å; F180-I224 HydrophobicContact CD2-CD1 3.75Å; F180-I224 HydrophobicContact CD2-CG1 3.29Å; F180-I224 HydrophobicContact CE2-CD1 4.37Å; F180-I224 HydrophobicContact CE2-CG1 3.86Å; F180-I224 HydrophobicContact CG-CD1 3.63Å; F180-I224 HydrophobicContact CG-CG1 3.73Å; I224-S226 PolarHBondContact O-N 2.93Å; I224-R227 PolarHBondContact N-O 2.98Å; I224-R227 PolarHBondContact O-N 3.35Å; I224-I229 HydrophobicContact CB-CD1 4.04Å; I224-I229 HydrophobicContact CB-CG1 3.93Å; I224-I229 HydrophobicContact CD1-CD1 4.21Å; I224-I229 HydrophobicContact CD1-CG1 3.71Å; I224-I229 HydrophobicContact CG1-CD1 4.2Å; I224-I229 HydrophobicContact CG1-CG1 3.59Å
225	G	80.7	Confident	83.7	Confident	75 Å²	75	68.7 Å²	68.7	77%	0.773	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	-116.9	-172.4	0	0	0	0	0	111.7
226	S	79.7	Confident	83	Confident	111 Å²	111	66 Å²	66	78%	0.776	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	5.7	-177.9	60.1	0	0	0	0	114.9	I224	I224-S226 PolarHBondContact O-N 2.93Å
227	R	82.4	Confident	82.3	Confident	110 Å²	110	70.4 Å²	70.4	42%	0.415	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.8	-177.3	-65.9	-83.9	-156.1	168.5	6	110.9	G167 P169 Y223 I224 I229	G167-R227 WeakPolarHBondContact O-CB 3.36Å; P169-R227 HydrophobicContact CB-CG 4.43Å; P169-R227 HydrophobicContact CG-CB 4.06Å; P169-R227 HydrophobicContact CG-CG 3.99Å; Y223-R227 CarbonylContact C-O 3.52Å; Y223-R227 VanDerWaalsContact CA-O 3.22Å; Y223-R227 WeakPolarHBondContact CA-O 3.43Å; Y223-R227 VanDerWaalsContact CD1-C 3.49Å; I224-R227 PolarHBondContact N-O 2.98Å; I224-R227 PolarHBondContact O-N 3.35Å; R227-I229 HydrophobicContact CB-CD1 4.45Å
228	Y	85	Confident	81.8	Confident	152 Å²	152	74.6 Å²	74.6	60%	0.596	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	140.6	165.6	64.5	-91.1	0	0	0	109.1
229	I	89.3	Confident	81.4	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.346	C	S	.	.			trans	-106.2	128.5	-179.1	-52.4	-50.1	0	0	0	108.8	L165 N166 G167 L168 F180 G221 K222 I224 R227 V231	L165-I229 HydrophobicContact CB-CG2 4.42Å; L165-I229 HydrophobicContact CD2-CG2 4.41Å; N166-I229 WeakPolarHBondContact O-CA 3.37Å; G167-I229 WeakPolarHBondContact O-CD1 3.33Å; L168-I229 HydrophobicContact CD2-CD1 3.89Å; L168-I229 HydrophobicContact CD2-CG1 4.44Å; L168-I229 HydrophobicContact CD2-CG2 4.41Å; L168-I229 HydrophobicContact CG-CD1 4.48Å; F180-I229 HydrophobicContact CE2-CG1 4.39Å; F180-I229 HydrophobicContact CZ-CB 4.16Å; F180-I229 HydrophobicContact CZ-CG1 4.47Å; G221-I229 WeakPolarHBondContact CA-O 3.35Å; G221-I229 PolarHBondContact N-O 3.21Å; K222-I229 PolarHBondContact O-N 3.17Å; I224-I229 HydrophobicContact CB-CD1 4.04Å; I224-I229 HydrophobicContact CB-CG1 3.93Å; I224-I229 HydrophobicContact CD1-CD1 4.21Å; I224-I229 HydrophobicContact CD1-CG1 3.71Å; I224-I229 HydrophobicContact CG1-CD1 4.2Å; I224-I229 HydrophobicContact CG1-CG1 3.59Å; R227-I229 HydrophobicContact CB-CD1 4.45Å; I229-V231 HydrophobicContact CG2-CG2 3.96Å
230	D	85.4	Confident	81.2	Confident	26 Å²	26	69.1 Å²	69.1	14%	0.139	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	115.6	174.1	173.8	8	0	0	0	108.1	N166 D220 R232	N166-D230 HydrophobicContact CB-CB 4.12Å; N166-D230 PolarHBondContact N-O 2.96Å; N166-D230 PolarHBondContact O-N 2.82Å; D220-D230 VanDerWaalsContact OD1-CA 3.24Å; D220-D230 WeakPolarHBondContact OD1-CA 3.45Å; D230-R232 VanDerWaalsContact CG-NE 3.33Å; D230-R232 VanDerWaalsContact OD1-CG 3.31Å; D230-R232 WeakPolarHBondContact OD1-CG 3.41Å; D230-R232 IonicContact OD1-CZ 3.58Å; D230-R232 IonicContact OD1-NE 2.72Å; D230-R232 PolarHBondContact OD1-NE 3.32Å; D230-R232 IonicContact OD1-NH2 3.24Å; D230-R232 IonicContact OD2-CZ 3.15Å; D230-R232 VanDerWaalsContact OD2-CZ 3.24Å; D230-R232 IonicContact OD2-NE 3.71Å; D230-R232 PolarHBondContact OD2-NE 3.37Å; D230-R232 IonicContact OD2-NH2 2.83Å; D230-R232 PolarHBondContact OD2-NH2 3.15Å
231	V	89.1	Confident	80.7	Confident	7 Å²	7	74.7 Å²	74.7	4%	0.042	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	117.8	-173.9	-172.5	0	0	0	0	109.1	V163 F164 L165 F180 F181 L217 D220 I229	V163-V231 HydrophobicContact CB-CG1 4.2Å; V163-V231 HydrophobicContact CG2-CG1 4.2Å; F164-V231 WeakPolarHBondContact O-CA 3.5Å; L165-V231 HydrophobicContact CD2-CB 4.35Å; L165-V231 HydrophobicContact CD2-CG1 3.92Å; L165-V231 HydrophobicContact CD2-CG2 3.85Å; F180-V231 HydrophobicContact CE1-CG2 4.22Å; F181-V231 HydrophobicContact CZ-CG1 4.28Å; F181-V231 HydrophobicContact CZ-CG2 4.26Å; L217-V231 HydrophobicContact CD2-CG1 4.31Å; D220-V231 HydrophobicContact CB-CB 4.3Å; D220-V231 PolarHBondContact OD1-N 3.43Å; I229-V231 HydrophobicContact CG2-CG2 3.96Å
232	R	85.7	Confident	80	Confident	141 Å²	141	74 Å²	74	53%	0.532	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	156.2	-176.1	-56.4	-172.2	-174	-167	1.2	112.2	V163 F164 L217 D230	V163-R232 CarbonylContact C-O 3.59Å; V163-R232 WeakPolarHBondContact CA-O 3.39Å; F164-R232 PolarHBondContact N-O 3.32Å; F164-R232 PolarHBondContact O-N 3.1Å; L217-R232 VanDerWaalsContact CD2-C 3.45Å; D230-R232 VanDerWaalsContact CG-NE 3.33Å; D230-R232 VanDerWaalsContact OD1-CG 3.31Å; D230-R232 WeakPolarHBondContact OD1-CG 3.41Å; D230-R232 IonicContact OD1-CZ 3.58Å; D230-R232 IonicContact OD1-NE 2.72Å; D230-R232 PolarHBondContact OD1-NE 3.32Å; D230-R232 IonicContact OD1-NH2 3.24Å; D230-R232 IonicContact OD2-CZ 3.15Å; D230-R232 VanDerWaalsContact OD2-CZ 3.24Å; D230-R232 IonicContact OD2-NE 3.71Å; D230-R232 PolarHBondContact OD2-NE 3.37Å; D230-R232 IonicContact OD2-NH2 2.83Å; D230-R232 PolarHBondContact OD2-NH2 3.15Å
233	T	83.1	Confident	79.2	Confident	67 Å²	67	71.8 Å²	71.8	41%	0.411	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	149.8	166.5	51.5	0	0	0	0	109.8	D158 L217	D158-T233 PolarHBondContact OD2-OG1 2.83Å; L217-T233 HydrophobicContact CD1-CG2 3.39Å; L217-T233 HydrophobicContact CD2-CG2 3.79Å; L217-T233 HydrophobicContact CG-CG2 4.19Å
234	T	79	Confident	78.3	Confident	14 Å²	14	64.6 Å²	64.6	9%	0.086	34%	0.344	C	S	.	.			trans	-147.5	160.8	178.2	-161.9	0	0	0	0	110.6	D159 V162 F164 F204	D159-T234 PolarHBondContact N-O 3.45Å; V162-T234 HydrophobicContact CB-CG2 4.03Å; V162-T234 HydrophobicContact CG1-CG2 3.52Å; V162-T234 PolarHBondContact O-N 3.1Å; F164-T234 HydrophobicContact CB-CG2 4.05Å; F204-T234 HydrophobicContact CD1-CG2 3.76Å; F204-T234 HydrophobicContact CE1-CG2 3.91Å
235	T	78.6	Confident	76.9	Confident	19 Å²	19	67.9 Å²	67.9	12%	0.117	37%	0.368	C	S	.	.			trans	-85.6	154.1	-178.1	75.6	0	0	0	0	110.6	T157 D237 Y238 W239	T157-T235 WeakPolarHBondContact O-CB 3.46Å; T157-T235 WeakPolarHBondContact O-CG2 3.45Å; T235-D237 PolarHBondContact O-N 2.83Å; T235-D237 VanDerWaalsContact O-N 3.13Å; T235-Y238 HydrophobicContact CG2-CD2 4.48Å; T235-Y238 PolarHBondContact O-N 2.75Å; T235-Y238 VanDerWaalsContact O-N 3.09Å; T235-Y238 WeakPolarHBondContact OG1-CD2 3.45Å; T235-W239 PolarHBondContact O-N 3.06Å
236	A	71.9	Confident	75.7	Confident	19 Å²	19	68.3 Å²	68.3	16%	0.157	35%	0.351	C	S	.	.	H	α-helix	trans	-55.3	-28.9	174.2	0	0	0	0	0	112.6	D159 Y238 W239 I240 M246	D159-A236 HydrophobicContact CB-CB 4.02Å; D159-A236 WeakPolarHBondContact OD2-CB 3.27Å; A236-Y238 PolarHBondContact O-N 2.83Å; A236-W239 WeakPolarHBondContact O-CB 3.35Å; A236-W239 PolarHBondContact O-N 3.11Å; A236-I240 VanDerWaalsContact O-CG1 3.28Å; A236-I240 WeakPolarHBondContact O-CG1 3.09Å; A236-I240 PolarHBondContact O-N 2.76Å; A236-M246 HydrophobicContact CB-CE 4.48Å; A236-M246 HydrophobicContact CB-SD 4.41Å
237	D	70.6	Confident	74	Confident	93 Å²	93	67.5 Å²	67.5	50%	0.497	34%	0.343	S	S	.	.	H	α-helix	trans	-65.5	-37.3	178.3	-66	-43.7	0	0	0	112.7	T235 R241	T235-D237 PolarHBondContact O-N 2.83Å; T235-D237 VanDerWaalsContact O-N 3.13Å; D237-R241 WeakPolarHBondContact O-CB 3.31Å; D237-R241 VanDerWaalsContact O-CG 3.24Å; D237-R241 WeakPolarHBondContact O-CG 3.31Å; D237-R241 PolarHBondContact O-N 3.37Å; D237-R241 VanDerWaalsContact O-N 3.13Å
238	Y	75.5	Confident	71.9	Confident	131 Å²	131	66.7 Å²	66.7	51%	0.514	36%	0.36	S	S	.	.	H	α-helix	trans	-70.7	-34.4	176.1	-75.1	-74.7	0	0	0	111.7	T235 A236 A242	T235-Y238 HydrophobicContact CG2-CD2 4.48Å; T235-Y238 PolarHBondContact O-N 2.75Å; T235-Y238 VanDerWaalsContact O-N 3.09Å; T235-Y238 WeakPolarHBondContact OG1-CD2 3.45Å; A236-Y238 PolarHBondContact O-N 2.83Å; Y238-A242 WeakPolarHBondContact O-CB 3.47Å; Y238-A242 PolarHBondContact O-N 3.11Å
239	W	78.6	Confident	69.6	Low	0 Å²	0	64.1 Å²	64.1	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-61.5	-49.7	173.2	172.7	-104.4	0	0	0	112.4	V162 E188 V190 F204 R206 T235 A236 R241 A242 G243 G244	V162-W239 HydrophobicContact CG1-CB 4.12Å; V162-W239 HydrophobicContact CG1-CD2 4.26Å; V162-W239 HydrophobicContact CG1-CE3 3.85Å; V162-W239 HydrophobicContact CG1-CG 4.41Å; V162-W239 HydrophobicContact CG2-CB 4.5Å; V162-W239 HydrophobicContact CG2-CG 4.49Å; E188-W239 HydrophobicContact CB-CH2 3.73Å; E188-W239 HydrophobicContact CB-CZ2 3.7Å; E188-W239 HydrophobicContact CG-CH2 3.79Å; E188-W239 HydrophobicContact CG-CZ2 3.72Å; E188-W239 WeakPolarHBondContact O-CH2 3.41Å; E188-W239 WeakPolarHBondContact OE2-CZ2 3.49Å; V190-W239 HydrophobicContact CB-CH2 4.17Å; V190-W239 HydrophobicContact CB-CZ3 3.91Å; V190-W239 HydrophobicContact CG2-CE3 4.37Å; V190-W239 HydrophobicContact CG2-CH2 3.47Å; V190-W239 VanDerWaalsContact CG2-CH2 3.47Å; V190-W239 HydrophobicContact CG2-CZ2 3.98Å; V190-W239 HydrophobicContact CG2-CZ3 3.7Å; F204-W239 HydrophobicContact CB-CE3 3.43Å; F204-W239 VanDerWaalsContact CB-CE3 3.43Å; F204-W239 HydrophobicContact CB-CZ3 3.53Å; F204-W239 HydrophobicContact CG-CE3 4.26Å; R206-W239 HydrophobicContact CB-CH2 3.83Å; R206-W239 HydrophobicContact CB-CZ2 3.9Å; R206-W239 HydrophobicContact CB-CZ3 4.19Å; T235-W239 PolarHBondContact O-N 3.06Å; A236-W239 WeakPolarHBondContact O-CB 3.35Å; A236-W239 PolarHBondContact O-N 3.11Å; W239-R241 VanDerWaalsContact C-N 3.31Å; W239-R241 PolarHBondContact O-N 3.11Å; W239-A242 WeakPolarHBondContact O-CB 3.44Å; W239-A242 PolarHBondContact O-N 3.2Å; W239-A242 VanDerWaalsContact O-N 3.07Å; W239-G243 PolarHBondContact O-N 3.09Å; W239-G244 VanDerWaalsContact CE2-CA 3.49Å; W239-G244 PolarHBondContact O-N 3.19Å
240	I	75.2	Confident	67	Low	86 Å²	86	70.6 Å²	70.6	44%	0.441	41%	0.409	S	S	.	.	H	α-helix	trans	-61.7	-42.8	179.6	-65.1	162.7	0	0	0	110.3	A236 A242 G243 M246	A236-I240 VanDerWaalsContact O-CG1 3.28Å; A236-I240 WeakPolarHBondContact O-CG1 3.09Å; A236-I240 PolarHBondContact O-N 2.76Å; I240-A242 PolarHBondContact O-N 3.33Å; I240-G243 PolarHBondContact O-N 3.38Å; I240-G243 VanDerWaalsContact O-N 3.09Å; I240-M246 HydrophobicContact CD1-CG 3.9Å; I240-M246 HydrophobicContact CG1-CG 3.98Å
241	R	74.8	Confident	64.5	Low	200 Å²	200	76.4 Å²	76.4	76%	0.755	44%	0.44	S	S	*	.	H	α-helix	trans	-65.1	-27.3	176.5	-72.2	173.2	-175.3	-167.3	3.5	113.4	D237 W239 G243	D237-R241 WeakPolarHBondContact O-CB 3.31Å; D237-R241 VanDerWaalsContact O-CG 3.24Å; D237-R241 WeakPolarHBondContact O-CG 3.31Å; D237-R241 PolarHBondContact O-N 3.37Å; D237-R241 VanDerWaalsContact O-N 3.13Å; W239-R241 VanDerWaalsContact C-N 3.31Å; W239-R241 PolarHBondContact O-N 3.11Å; R241-G243 VanDerWaalsContact C-N 3.26Å
242	A	65.9	Low	62.1	Low	26 Å²	26	85.3 Å²	85.3	22%	0.215	48%	0.481	C	S	.	.	H	α-helix	trans	-78.9	-10.1	176.1	0	0	0	0	0	113.2	V190 F204 Y238 W239 I240	V190-A242 HydrophobicContact CG1-CB 3.89Å; V190-A242 WeakPolarHBondContact CG1-O 3.32Å; F204-A242 HydrophobicContact CD2-CB 3.43Å; F204-A242 VanDerWaalsContact CD2-CB 3.43Å; F204-A242 HydrophobicContact CE2-CB 3.41Å; F204-A242 VanDerWaalsContact CE2-CB 3.41Å; F204-A242 HydrophobicContact CG-CB 4.33Å; F204-A242 HydrophobicContact CZ-CB 4.27Å; Y238-A242 WeakPolarHBondContact O-CB 3.47Å; Y238-A242 PolarHBondContact O-N 3.11Å; W239-A242 WeakPolarHBondContact O-CB 3.44Å; W239-A242 PolarHBondContact O-N 3.2Å; W239-A242 VanDerWaalsContact O-N 3.07Å; I240-A242 PolarHBondContact O-N 3.33Å
243	G	66.6	Low	59.3	Low	61 Å²	61	89.8 Å²	89.8	63%	0.629	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.6	12	179.4	0	0	0	0	0	114.6	W239 I240 R241	W239-G243 PolarHBondContact O-N 3.09Å; I240-G243 PolarHBondContact O-N 3.38Å; I240-G243 VanDerWaalsContact O-N 3.09Å; R241-G243 VanDerWaalsContact C-N 3.26Å
244	G	62.2	Low	56.9	Low	6 Å²	6	94 Å²	94	6%	0.062	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-81.1	142.4	175	0	0	0	0	0	112.8	W239	W239-G244 VanDerWaalsContact CE2-CA 3.49Å; W239-G244 PolarHBondContact O-N 3.19Å
245	S	55.4	Low	55.3	Low	81 Å²	81	98 Å²	98	57%	0.566	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-92.6	136.4	178.8	-164.4	0	0	0	0	110.9
246	M	55.1	Low	52.8	Low	84 Å²	84	103.3 Å²	103.3	41%	0.414	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-88.2	142.5	169.5	-78.3	-73.1	-79.8	0	0	109.6	A236 I240 A248	A236-M246 HydrophobicContact CB-CE 4.48Å; A236-M246 HydrophobicContact CB-SD 4.41Å; I240-M246 HydrophobicContact CD1-CG 3.9Å; I240-M246 HydrophobicContact CG1-CG 3.98Å; M246-A248 PolarHBondContact O-N 3.13Å
247	P	44	Very low	50.9	Low	95 Å²	95	111.6 Å²	111.6	62%	0.617	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-62.4	128.2	165.3	25.6	-29.9	0	0	0	109	A249	P247-A249 PolarHBondContact O-N 2.75Å
248	A	38.2	Very low	48.9	Very low	92 Å²	92	116.3 Å²	116.3	76%	0.76	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-56.2	128.7	-178.1	0	0	0	0	0	110.8	M246 V250	M246-A248 PolarHBondContact O-N 3.13Å; A248-V250 PolarHBondContact O-N 2.78Å
249	A	37.6	Very low	47.2	Very low	98 Å²	98	114.4 Å²	114.4	81%	0.81	63%	0.627	S	S	*	*			trans	-54.5	109.3	175.1	0	0	0	0	0	110.7	P247 N251	P247-A249 PolarHBondContact O-N 2.75Å; A249-N251 PolarHBondContact O-N 3.28Å; A249-N251 VanDerWaalsContact O-N 3.16Å
250	V	34.2	Very low	44.9	Very low	136 Å²	136	126 Å²	126	82%	0.824	67%	0.67	S	S	*	*			trans	-78.5	97.8	166.4	173.7	0	0	0	0	107.5	A248 Q252	A248-V250 PolarHBondContact O-N 2.78Å; V250-Q252 PolarHBondContact O-N 3.15Å
251	N	34.1	Very low	42.9	Very low	148 Å²	148	127 Å²	127	79%	0.791	69%	0.685	S	S	*	*			trans	-48.4	121.2	161.1	-94.4	-33.9	0	0	0	109.8	A249 R253	A249-N251 PolarHBondContact O-N 3.28Å; A249-N251 VanDerWaalsContact O-N 3.16Å; N251-R253 VanDerWaalsContact C-N 3.29Å; N251-R253 PolarHBondContact O-N 3.1Å
252	Q	38.8	Very low	40.9	Very low	195 Å²	195	129.3 Å²	129.3	91%	0.911	69%	0.694	S	S	*	*	S	Bend	trans	-69.1	85.5	171.3	-71.6	177.6	3.6	0	0	110.3	V250	V250-Q252 PolarHBondContact O-N 3.15Å
253	R	26.7	Very low	39.2	Very low	234 Å²	234	133.5 Å²	133.5	88%	0.883	72%	0.721	S	S	*	*			trans	-137.6	116.9	150	-90.6	-176.7	173.2	176.1	-2.6	107.2	N251	N251-R253 VanDerWaalsContact C-N 3.29Å; N251-R253 PolarHBondContact O-N 3.1Å
254	N	32.8	Very low	37.9	Very low	157 Å²	157	136.4 Å²	136.4	84%	0.84	73%	0.729	S	S	*	*			trans	-43	146	159.4	-109.6	-2.6	0	0	0	109.3
255	P	44	Very low	36.4	Very low	97 Å²	97	143.8 Å²	143.8	63%	0.63	77%	0.766	S	S	*	*			cis	-152.5	164.6	50	37.8	-14.9	0	0	0	117.5
256	Q	27.9	Very low	35.3	Very low	131 Å²	131	145.8 Å²	145.8	61%	0.612	78%	0.778	S	S	*	*			trans	77.4	115.4	130.8	-78	178.6	-21.8	0	0	123.3
257	Y	30.9	Very low	34.1	Very low	192 Å²	192	150.9 Å²	150.9	75%	0.753	80%	0.8	S	S	*	*			trans	60.1	128.6	147.5	-35.9	-62.1	0	0	0	117.2
258	E	28.8	Very low	33.5	Very low	193 Å²	193	157 Å²	157	90%	0.902	81%	0.811	S	S	*	*				-158.8	145.5	63.7	-79.2	-178.4	137.5	0	0	113.1
259	A	39	Very low	33.1	Very low	90 Å²	90	158.7 Å²	158.7	74%	0.744	81%	0.814	S	S	*	*			trans	-69.1	135.8	175.9	0	0	0	0	0	113.2
260	R	30.5	Very low	33	Very low	244 Å²	244	160.4 Å²	160.4	92%	0.921	81%	0.814	S	S	*	*			trans	-141.3	84.9	146	-76.7	-164	176	157.8	0.6	111.7
261	S	34.1	Very low	32.9	Very low	106 Å²	106	157.3 Å²	157.3	74%	0.741	80%	0.803	S	S	*	*			trans	29.6	104.7	133.4	-42.5	0	0	0	0	118.5
262	R	31.8	Very low	33	Very low	250 Å²	250	156 Å²	156	94%	0.943	80%	0.802	S	S	*	*			trans	-128.9	119.6	132.1	-77.9	-168.4	177.9	-150.5	0.1	109.1
263	S	31.2	Very low	33.1	Very low	114 Å²	114	152.6 Å²	152.6	80%	0.797	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-63.3	160.7	-177.4	-52.7	0	0	0	0	112.7
264	P	38.5	Very low	34.2	Very low	122 Å²	122	146.4 Å²	146.4	79%	0.792	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-92.2	141	-148.3	34.5	-32.2	0	0	0	113.4
265	L	31.9	Very low	35.2	Very low	160 Å²	160	145.2 Å²	145.2	84%	0.838	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-85.2	141.4	157.2	-74.9	166.3	0	0	0	108.7	Q267	L265-Q267 PolarHBondContact O-N 3.48Å
266	P	30.8	Very low	36.1	Very low	124 Å²	124	142.6 Å²	142.6	81%	0.805	75%	0.748	S	S	*	*			trans	-71	105.3	-168.8	28	-32	0	0	0	110.1	R268	P266-R268 PolarHBondContact O-N 3.43Å
267	Q	30.9	Very low	38.1	Very low	190 Å²	190	139.3 Å²	139.3	89%	0.888	73%	0.731	S	S	*	*			trans	-71.6	114.1	161.5	-70.4	-171.7	-8.5	0	0	107.5	L265	L265-Q267 PolarHBondContact O-N 3.48Å
268	R	30.1	Very low	40	Very low	225 Å²	225	130.3 Å²	130.3	85%	0.849	70%	0.696	S	S	*	*			trans	-47.5	136.3	155.3	-92.5	177	159.8	163.6	-6.1	107.9	P266 V270	P266-R268 PolarHBondContact O-N 3.43Å; R268-V270 PolarHBondContact O-N 2.77Å
269	P	30.3	Very low	42.1	Very low	126 Å²	126	121.1 Å²	121.1	82%	0.818	65%	0.653	S	S	*	*			trans	-62.6	108.2	173.5	25.3	-29.9	0	0	0	107.7	A271	P269-A271 PolarHBondContact O-N 2.78Å
270	V	35.1	Very low	43.9	Very low	135 Å²	135	117.9 Å²	117.9	82%	0.818	62%	0.623	S	S	*	*			trans	-69.4	112.7	159.2	176.7	0	0	0	0	104.5	R268	R268-V270 PolarHBondContact O-N 2.77Å
271	A	32.6	Very low	46	Very low	71 Å²	71	106.3 Å²	106.3	59%	0.587	58%	0.579	S	S	*	*			trans	-54	147.2	174.4	0	0	0	0	0	110	P269 T273	P269-A271 PolarHBondContact O-N 2.78Å; A271-T273 PolarHBondContact O-N 2.79Å
272	P	37.1	Very low	47.7	Very low	119 Å²	119	102.7 Å²	102.7	77%	0.773	55%	0.552	S	S	*	*			trans	-58.6	127.2	173.3	25.8	-31	0	0	0	108.4	D274	P272-D274 VanDerWaalsContact C-N 3.3Å; P272-D274 PolarHBondContact O-N 3.02Å
273	T	39.9	Very low	49.4	Very low	124 Å²	124	92.3 Å²	92.3	76%	0.761	52%	0.515	S	S	*	.			trans	-69.4	93.9	170.6	45.1	0	0	0	0	107.8	A271 E275	A271-T273 PolarHBondContact O-N 2.79Å; T273-E275 PolarHBondContact O-N 2.75Å
274	D	49.3	Very low	51.3	Low	104 Å²	104	87 Å²	87	56%	0.556	48%	0.478	S	S	*	.			trans	-75.5	65.3	178.4	-147.3	19.5	0	0	0	109.5	P272 E276	P272-D274 VanDerWaalsContact C-N 3.3Å; P272-D274 PolarHBondContact O-N 3.02Å; D274-E276 PolarHBondContact O-N 3.12Å
275	E	54.7	Low	52.4	Low	133 Å²	133	83.2 Å²	83.2	62%	0.621	45%	0.454	S	S	*	.			trans	-76.6	80.6	172.9	-70	-166.3	-179	0	0	109.4	T273 Y277	T273-E275 PolarHBondContact O-N 2.75Å; E275-Y277 WeakPolarHBondContact O-CD2 3.38Å; E275-Y277 WeakPolarHBondContact O-CE2 3.35Å; E275-Y277 PolarHBondContact OE2-OH 3.46Å
276	E	62.7	Low	53.8	Low	41 Å²	41	81.3 Å²	81.3	19%	0.192	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-78.7	118.7	175.6	-58.6	177.4	126.7	0	0	110.5	D274 L324 R354	D274-E276 PolarHBondContact O-N 3.12Å; E276-L324 HydrophobicContact CB-CD2 4.44Å; E276-R354 IonicContact OE2-CZ 2.72Å; E276-R354 IonicContact OE2-NE 3.53Å; E276-R354 PolarHBondContact OE2-NE 3.26Å; E276-R354 IonicContact OE2-NH2 3.49Å; E276-R354 PolarHBondContact OE2-NH2 3.46Å
277	Y	69.1	Low	55.2	Low	62 Å²	62	78.9 Å²	78.9	24%	0.243	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	116	-179.6	-60.2	-82.7	0	0	0	110.6	E275 F325 I328 Y331	E275-Y277 WeakPolarHBondContact O-CD2 3.38Å; E275-Y277 WeakPolarHBondContact O-CE2 3.35Å; E275-Y277 PolarHBondContact OE2-OH 3.46Å; Y277-F325 PolarHBondContact N-O 3.17Å; Y277-F325 PolarHBondContact O-N 2.76Å; Y277-I328 HydrophobicContact CD2-CB 4.29Å; Y277-I328 HydrophobicContact CE1-CB 4.41Å; Y277-I328 HydrophobicContact CE1-CD1 4.02Å; Y277-I328 HydrophobicContact CE1-CG1 4.13Å; Y277-I328 HydrophobicContact CE2-CB 3.73Å; Y277-I328 HydrophobicContact CE2-CG1 4.35Å; Y277-Y331 HydrophobicContact CD1-CD1 4.44Å; Y277-Y331 HydrophobicContact CG-CG 4.27Å
278	C	70.8	Confident	56.9	Low	3 Å²	3	69.9 Å²	69.9	2%	0.02	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	141.1	-172.1	-41.3	0	0	0	0	112.1	L324 V352 M357	C278-L324 HydrophobicContact CB-CD2 3.86Å; C278-L324 WeakPolarHBondContact SG-CD2 3.46Å; C278-V352 CarbonylContact C-O 3.5Å; C278-V352 VanDerWaalsContact CB-O 3.32Å; C278-V352 WeakPolarHBondContact CB-O 3.33Å; C278-V352 PolarHBondContact O-N 3.49Å; C278-V352 VanDerWaalsContact O-N 3.11Å; C278-M357 HydrophobicContact CB-SD 4.27Å
279	V	74.6	Confident	58.7	Low	0 Å²	0	65.2 Å²	65.2	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.2	177.4	179.4	0	0	0	0	109.5	L281 F322 V323 F325 Y331 I349 R350	V279-L281 HydrophobicContact CG1-CD2 4.43Å; V279-F322 CarbonylContact O-C 3.6Å; V279-F322 VanDerWaalsContact O-CA 3.31Å; V279-F322 WeakPolarHBondContact O-CA 3.37Å; V279-V323 PolarHBondContact N-O 3.42Å; V279-V323 PolarHBondContact O-N 3.07Å; V279-F325 HydrophobicContact CB-CD2 4.48Å; V279-F325 HydrophobicContact CB-CE2 4.06Å; V279-F325 HydrophobicContact CG2-CD2 3.85Å; V279-F325 HydrophobicContact CG2-CE2 3.72Å; V279-Y331 HydrophobicContact CG2-CD2 3.41Å; V279-Y331 VanDerWaalsContact CG2-CD2 3.41Å; V279-Y331 HydrophobicContact CG2-CE2 3.55Å; V279-I349 HydrophobicContact CG1-CB 4.49Å; V279-I349 HydrophobicContact CG1-CG2 3.18Å; V279-R350 WeakPolarHBondContact CA-O 3.43Å
280	L	76.6	Confident	60.5	Low	23 Å²	23	63 Å²	63	12%	0.12	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.1	171.8	176.8	63.5	0	0	0	109.7	L310 F322 R350 V352	L280-L310 HydrophobicContact CD1-CD1 3.94Å; L280-F322 HydrophobicContact CB-CD1 3.95Å; L280-F322 HydrophobicContact CB-CE1 3.83Å; L280-F322 HydrophobicContact CD1-CD1 3.8Å; L280-F322 HydrophobicContact CD1-CE1 3.58Å; L280-F322 HydrophobicContact CD1-CG 4.38Å; L280-F322 HydrophobicContact CD1-CZ 3.99Å; L280-F322 HydrophobicContact CD2-CE1 4.36Å; L280-F322 HydrophobicContact CG-CD1 4.45Å; L280-F322 HydrophobicContact CG-CE1 4.12Å; L280-R350 PolarHBondContact N-O 3.14Å; L280-R350 PolarHBondContact O-N 3.46Å; L280-V352 HydrophobicContact CB-CB 4.47Å; L280-V352 HydrophobicContact CB-CG2 3.49Å; L280-V352 VanDerWaalsContact CB-CG2 3.49Å; L280-V352 HydrophobicContact CD2-CG2 4.32Å
281	L	73.4	Confident	62	Low	1 Å²	1	58.7 Å²	58.7	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	120.5	172.5	-58.6	172.5	0	0	0	108.3	V279 L284 L293 F297 S320 A321 V323 I347 H348 I349	V279-L281 HydrophobicContact CG1-CD2 4.43Å; L281-L284 HydrophobicContact CB-CD1 3.85Å; L281-L284 HydrophobicContact CB-CD2 4.38Å; L281-L284 HydrophobicContact CB-CG 4.17Å; L281-L284 HydrophobicContact CD1-CD1 4.37Å; L281-L293 HydrophobicContact CD1-CD2 3.61Å; L281-F297 HydrophobicContact CD1-CE2 3.96Å; L281-F297 HydrophobicContact CD1-CZ 4.34Å; L281-F297 HydrophobicContact CD2-CE2 4.42Å; L281-F297 HydrophobicContact CD2-CZ 3.98Å; L281-S320 CarbonylContact O-C 3.59Å; L281-S320 WeakPolarHBondContact O-CA 3.43Å; L281-A321 WeakPolarHBondContact CB-O 3.34Å; L281-A321 PolarHBondContact N-O 3.42Å; L281-A321 PolarHBondContact O-N 3.46Å; L281-V323 HydrophobicContact CD1-CG2 3.48Å; L281-V323 VanDerWaalsContact CD1-CG2 3.48Å; L281-V323 HydrophobicContact CG-CG2 4.23Å; L281-I347 HydrophobicContact CB-CG2 4.43Å; L281-I347 HydrophobicContact CD2-CG2 4.22Å; L281-H348 CarbonylContact C-O 3.35Å; L281-H348 WeakPolarHBondContact CA-O 3.38Å; L281-I349 HydrophobicContact CD2-CB 4.17Å; L281-I349 HydrophobicContact CD2-CD1 3.99Å; L281-I349 HydrophobicContact CD2-CG1 3.61Å; L281-I349 HydrophobicContact CD2-CG2 3.94Å
282	D	69.4	Low	63.7	Low	30 Å²	30	58.1 Å²	58.1	16%	0.16	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	154.7	177.2	-70.9	-37.4	0	0	0	111.4	S320 H348	D282-S320 VanDerWaalsContact OD1-CB 3.26Å; D282-S320 WeakPolarHBondContact OD1-CB 3.21Å; D282-S320 PolarHBondContact OD1-OG 3.4Å; D282-H348 HydrophobicContact CB-CB 4.19Å; D282-H348 PolarHBondContact N-O 3.45Å; D282-H348 PolarHBondContact O-N 3.16Å
283	N	67.4	Low	65.2	Low	31 Å²	31	52.5 Å²	52.5	17%	0.166	29%	0.286	C	S	.	.	S	Bend	trans	65.9	30.2	-178.7	-165.8	38.6	0	0	0	114.6	R319 R345 W346	N283-R319 PolarHBondContact N-O 3.15Å; N283-R319 VanDerWaalsContact N-O 3.09Å; N283-R345 PolarHBondContact OD1-NE 3.23Å; N283-R345 PolarHBondContact OD1-NH2 3.29Å; N283-R345 VanDerWaalsContact OD1-NH2 3.1Å; N283-W346 PolarHBondContact ND2-O 3.14Å
284	L	71.4	Confident	66.5	Low	4 Å²	4	49.6 Å²	49.6	2%	0.021	26%	0.263	C	S	.	.			trans	-65.9	144.9	169.1	-64.1	173.4	0	0	0	111	L281 L293 F309 R319 A321 I347	L281-L284 HydrophobicContact CB-CD1 3.85Å; L281-L284 HydrophobicContact CB-CD2 4.38Å; L281-L284 HydrophobicContact CB-CG 4.17Å; L281-L284 HydrophobicContact CD1-CD1 4.37Å; L284-L293 HydrophobicContact CD1-CD1 4.41Å; L284-L293 HydrophobicContact CD1-CD2 4.36Å; L284-L293 HydrophobicContact CD2-CD2 4.05Å; L284-F309 HydrophobicContact CD1-CE1 4.4Å; L284-R319 WeakPolarHBondContact CB-O 3.3Å; L284-R319 PolarHBondContact N-O 3.01Å; L284-R319 VanDerWaalsContact O-CB 3.3Å; L284-R319 WeakPolarHBondContact O-CB 3.45Å; L284-R319 WeakPolarHBondContact O-CG 3.48Å; L284-A321 HydrophobicContact CD1-CB 3.52Å; L284-I347 HydrophobicContact CD2-CD1 3.55Å; L284-I347 HydrophobicContact CD2-CG1 3.96Å; L284-I347 HydrophobicContact CD2-CG2 4.06Å
285	S	62.3	Low	67.2	Low	42 Å²	42	52.7 Å²	52.7	29%	0.294	27%	0.268	S	S	.	.			trans	-71.7	144.6	173.1	179.9	0	0	0	0	110.4	A287 V288	S285-A287 PolarHBondContact O-N 3.09Å; S285-A287 VanDerWaalsContact O-N 3.11Å; S285-V288 WeakPolarHBondContact O-CB 3.47Å; S285-V288 VanDerWaalsContact O-CG2 3.27Å; S285-V288 WeakPolarHBondContact O-CG2 3.29Å; S285-V288 PolarHBondContact O-N 3.34Å
286	F	61.7	Low	67.7	Low	120 Å²	120	47.2 Å²	47.2	53%	0.526	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-17.2	179.5	-63.3	-68.3	0	0	0	113.9	V288 R317 R319	F286-V288 VanDerWaalsContact C-N 3.34Å; F286-R317 WeakPolarHBondContact CD1-O 3.5Å; F286-R317 WeakPolarHBondContact CE1-O 3.49Å; F286-R319 HydrophobicContact CD1-CG 4.08Å; F286-R319 HydrophobicContact CE1-CG 3.51Å; F286-R319 HydrophobicContact CE2-CG 4.18Å; F286-R319 HydrophobicContact CZ-CG 3.58Å
287	A	59.6	Low	67.8	Low	72 Å²	72	45.5 Å²	45.5	60%	0.595	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-2.9	177.3	0	0	0	0	0	113.6	S285 E289	S285-A287 PolarHBondContact O-N 3.09Å; S285-A287 VanDerWaalsContact O-N 3.11Å; A287-E289 PolarHBondContact O-N 2.64Å
288	V	66.2	Low	67.3	Low	1 Å²	1	48.4 Å²	48.4	1%	0.006	25%	0.251	C	S	.	.			trans	-73.3	121.8	-177.5	175.9	0	0	0	0	110.4	S285 F286 D292 L293 R317 F342 L343	S285-V288 WeakPolarHBondContact O-CB 3.47Å; S285-V288 VanDerWaalsContact O-CG2 3.27Å; S285-V288 WeakPolarHBondContact O-CG2 3.29Å; S285-V288 PolarHBondContact O-N 3.34Å; F286-V288 VanDerWaalsContact C-N 3.34Å; V288-D292 HydrophobicContact CG1-CB 4.06Å; V288-L293 HydrophobicContact CG1-CD1 4.14Å; V288-L293 HydrophobicContact CG1-CD2 4.29Å; V288-L293 HydrophobicContact CG1-CG 3.76Å; V288-R317 PolarHBondContact O-NH2 3.45Å; V288-F342 HydrophobicContact CG1-CE1 4.33Å; V288-F342 HydrophobicContact CG2-CD1 4.29Å; V288-F342 HydrophobicContact CG2-CE1 3.95Å; V288-L343 HydrophobicContact CG2-CD1 3.94Å
289	E	68.6	Low	66.3	Low	128 Å²	128	53.9 Å²	53.9	60%	0.598	28%	0.28	S	S	*	.			trans	-93.6	165.5	174.3	-63.9	-169.4	169.8	0	0	111.9	A287 G291 D292 L293	A287-E289 PolarHBondContact O-N 2.64Å; E289-G291 PolarHBondContact O-N 3.35Å; E289-D292 PolarHBondContact N-OD2 2.78Å; E289-D292 PolarHBondContact O-N 3.24Å; E289-D292 VanDerWaalsContact O-N 3.1Å; E289-L293 PolarHBondContact O-N 3.05Å
290	K	68.2	Low	65.3	Low	79 Å²	79	54.4 Å²	54.4	34%	0.343	28%	0.283	S	S	.	.	H	α-helix	trans	-57.4	-30.6	175.6	-70	-171	172.7	-160.1	0	111.8	K294 N304 I307 F309	K290-K294 WeakPolarHBondContact O-CG 3.42Å; K290-K294 PolarHBondContact O-N 2.83Å; K290-N304 PolarHBondContact NZ-O 2.63Å; K290-I307 PolarHBondContact NZ-O 3.38Å; K290-F309 HydrophobicContact CG-CD2 4.37Å; K290-F309 HydrophobicContact CG-CE2 3.65Å
291	G	65.5	Low	64.3	Low	45 Å²	45	63 Å²	63	46%	0.464	32%	0.32	S	S	.	.	H	α-helix	trans	-69.2	-34.9	176.7	0	0	0	0	0	113.9	E289 K294 Y295	E289-G291 PolarHBondContact O-N 3.35Å; G291-K294 WeakPolarHBondContact O-CB 3.29Å; G291-K294 PolarHBondContact O-N 3.23Å; G291-Y295 PolarHBondContact O-N 3.1Å
292	D	69.3	Low	63.9	Low	59 Å²	59	63.7 Å²	63.7	32%	0.316	32%	0.323	S	S	.	.	H	α-helix	trans	-69.9	-37.5	-179.8	-64.8	-39.8	0	0	0	111.9	V288 E289 K294 Y295 L296 F342	V288-D292 HydrophobicContact CG1-CB 4.06Å; E289-D292 PolarHBondContact N-OD2 2.78Å; E289-D292 PolarHBondContact O-N 3.24Å; E289-D292 VanDerWaalsContact O-N 3.1Å; D292-K294 VanDerWaalsContact C-N 3.33Å; D292-Y295 PolarHBondContact O-N 2.83Å; D292-L296 PolarHBondContact O-N 3.09Å; D292-F342 HydrophobicContact CB-CE1 4.3Å; D292-F342 HydrophobicContact CB-CZ 3.98Å
293	L	69.3	Low	63.4	Low	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-68	-33	173.5	-74.4	167.6	0	0	0	112	L281 L284 V288 E289 L296 F297 I307 F309	L281-L293 HydrophobicContact CD1-CD2 3.61Å; L284-L293 HydrophobicContact CD1-CD1 4.41Å; L284-L293 HydrophobicContact CD1-CD2 4.36Å; L284-L293 HydrophobicContact CD2-CD2 4.05Å; V288-L293 HydrophobicContact CG1-CD1 4.14Å; V288-L293 HydrophobicContact CG1-CD2 4.29Å; V288-L293 HydrophobicContact CG1-CG 3.76Å; E289-L293 PolarHBondContact O-N 3.05Å; L293-L296 WeakPolarHBondContact O-CB 3.37Å; L293-L296 PolarHBondContact O-N 3.04Å; L293-F297 VanDerWaalsContact O-CD2 3.24Å; L293-F297 WeakPolarHBondContact O-CD2 3.44Å; L293-F297 PolarHBondContact O-N 2.83Å; L293-F297 VanDerWaalsContact O-N 3.12Å; L293-I307 HydrophobicContact CB-CD1 4.1Å; L293-I307 HydrophobicContact CD1-CG2 3.7Å; L293-F309 HydrophobicContact CD1-CE1 3.9Å; L293-F309 HydrophobicContact CD1-CE2 4.49Å; L293-F309 HydrophobicContact CD1-CZ 3.59Å
294	K	65.9	Low	63	Low	63 Å²	63	69.6 Å²	69.6	27%	0.274	35%	0.352	S	S	.	.	H	α-helix	trans	-67.9	-36.6	171.8	-70.9	-179.2	177.6	-156.5	0	112.5	K290 G291 D292 L296 F297 Q298 L302 N304 I307	K290-K294 WeakPolarHBondContact O-CG 3.42Å; K290-K294 PolarHBondContact O-N 2.83Å; G291-K294 WeakPolarHBondContact O-CB 3.29Å; G291-K294 PolarHBondContact O-N 3.23Å; D292-K294 VanDerWaalsContact C-N 3.33Å; K294-L296 VanDerWaalsContact C-N 3.28Å; K294-F297 CarbonylContact O-C 3.57Å; K294-F297 PolarHBondContact O-N 2.6Å; K294-Q298 PolarHBondContact O-N 3.4Å; K294-L302 WeakPolarHBondContact CE-O 3.4Å; K294-L302 PolarHBondContact NZ-O 2.71Å; K294-N304 WeakPolarHBondContact CE-OD1 3.49Å; K294-N304 PolarHBondContact NZ-OD1 2.67Å; K294-I307 HydrophobicContact CG-CD1 3.99Å
295	Y	64.7	Low	62.5	Low	169 Å²	169	75.7 Å²	75.7	66%	0.663	38%	0.384	S	S	*	.	H	α-helix	trans	-67.8	-30.9	173	-169.8	-87.2	0	0	0	111.8	G291 D292 Q298	G291-Y295 PolarHBondContact O-N 3.1Å; D292-Y295 PolarHBondContact O-N 2.83Å; Y295-Q298 VanDerWaalsContact O-CG 3.32Å; Y295-Q298 WeakPolarHBondContact O-CG 3.3Å; Y295-Q298 PolarHBondContact O-NE2 3.1Å
296	L	65.3	Low	62.6	Low	18 Å²	18	74.2 Å²	74.2	9%	0.094	37%	0.373	C	S	.	.	H	α-helix	trans	-69.9	-35	175.9	-169.7	142.4	0	0	0	112.5	D292 L293 K294 F342 I347	D292-L296 PolarHBondContact O-N 3.09Å; L293-L296 WeakPolarHBondContact O-CB 3.37Å; L293-L296 PolarHBondContact O-N 3.04Å; K294-L296 VanDerWaalsContact C-N 3.28Å; L296-F342 HydrophobicContact CB-CE2 4.29Å; L296-F342 HydrophobicContact CD1-CB 4.15Å; L296-F342 HydrophobicContact CD1-CD1 4.2Å; L296-F342 HydrophobicContact CD1-CD2 3.48Å; L296-F342 VanDerWaalsContact CD1-CD2 3.48Å; L296-F342 HydrophobicContact CD1-CE1 4.45Å; L296-F342 HydrophobicContact CD1-CE2 3.77Å; L296-F342 HydrophobicContact CD1-CG 3.69Å; L296-F342 HydrophobicContact CD1-CZ 4.24Å; L296-I347 HydrophobicContact CD1-CD1 3.76Å
297	F	65.4	Low	63.1	Low	6 Å²	6	68.5 Å²	68.5	3%	0.026	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	47.4	178.9	-59.4	-70.8	0	0	0	112.7	L281 L293 K294 N299 S300 L302 F325 A334 I349	L281-F297 HydrophobicContact CD1-CE2 3.96Å; L281-F297 HydrophobicContact CD1-CZ 4.34Å; L281-F297 HydrophobicContact CD2-CE2 4.42Å; L281-F297 HydrophobicContact CD2-CZ 3.98Å; L293-F297 VanDerWaalsContact O-CD2 3.24Å; L293-F297 WeakPolarHBondContact O-CD2 3.44Å; L293-F297 PolarHBondContact O-N 2.83Å; L293-F297 VanDerWaalsContact O-N 3.12Å; K294-F297 CarbonylContact O-C 3.57Å; K294-F297 PolarHBondContact O-N 2.6Å; F297-N299 PolarHBondContact O-N 2.86Å; F297-S300 PolarHBondContact O-N 2.82Å; F297-S300 VanDerWaalsContact O-O 3.06Å; F297-L302 HydrophobicContact CB-CD1 3.67Å; F297-L302 HydrophobicContact CD2-CD1 3.93Å; F297-L302 HydrophobicContact CG-CD1 4.07Å; F297-F325 HydrophobicContact CD1-CZ 4.12Å; F297-F325 HydrophobicContact CE1-CZ 4.26Å; F297-F325 HydrophobicContact CG-CZ 4.27Å; F297-A334 HydrophobicContact CD1-CB 4.07Å; F297-A334 HydrophobicContact CE1-CB 3.58Å; F297-A334 HydrophobicContact CZ-CB 4.42Å; F297-I349 HydrophobicContact CE1-CD1 4.43Å; F297-I349 HydrophobicContact CZ-CD1 4.26Å
298	Q	56.9	Low	63.5	Low	122 Å²	122	68 Å²	68	57%	0.57	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-22.9	-179.1	-83.1	169.6	15.7	0	0	115.2	K294 Y295 S300	K294-Q298 PolarHBondContact O-N 3.4Å; Y295-Q298 VanDerWaalsContact O-CG 3.32Å; Y295-Q298 WeakPolarHBondContact O-CG 3.3Å; Y295-Q298 PolarHBondContact O-NE2 3.1Å; Q298-S300 VanDerWaalsContact C-N 3.34Å
299	N	50	Low	63.6	Low	119 Å²	119	69.8 Å²	69.8	64%	0.636	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-22.5	-179.8	-69.9	12.9	0	0	0	112.8	F297	F297-N299 PolarHBondContact O-N 2.86Å
300	S	54.7	Low	63.5	Low	10 Å²	10	65.6 Å²	65.6	7%	0.07	32%	0.324	C	S	.	.	S	Bend	trans	-109.3	119.8	-175.3	-43.6	0	0	0	0	108	F297 Q298 L302 D330	F297-S300 PolarHBondContact O-N 2.82Å; F297-S300 VanDerWaalsContact O-O 3.06Å; Q298-S300 VanDerWaalsContact C-N 3.34Å; S300-L302 PolarHBondContact O-N 3.48Å; S300-D330 WeakPolarHBondContact CA-OD1 3.38Å; S300-D330 VanDerWaalsContact CB-CG 3.44Å; S300-D330 WeakPolarHBondContact CB-OD1 3.48Å; S300-D330 WeakPolarHBondContact OG-CB 3.32Å; S300-D330 PolarHBondContact OG-OD1 3.38Å
301	K	55.1	Low	63.5	Low	205 Å²	205	65.1 Å²	65.1	89%	0.891	33%	0.328	S	S	*	.			trans	-70.9	71.1	-179.9	-68.2	179.7	-179	176.2	0	111
302	L	64.1	Low	63.2	Low	15 Å²	15	65.7 Å²	65.7	8%	0.079	32%	0.32	C	S	.	.			trans	-76.5	123.5	-177.1	-66.4	174.8	0	0	0	111.1	K294 F297 S300 I307 V323 F325	K294-L302 WeakPolarHBondContact CE-O 3.4Å; K294-L302 PolarHBondContact NZ-O 2.71Å; F297-L302 HydrophobicContact CB-CD1 3.67Å; F297-L302 HydrophobicContact CD2-CD1 3.93Å; F297-L302 HydrophobicContact CG-CD1 4.07Å; S300-L302 PolarHBondContact O-N 3.48Å; L302-I307 HydrophobicContact CD1-CD1 4.49Å; L302-V323 HydrophobicContact CD1-CG1 3.69Å; L302-V323 HydrophobicContact CD2-CG1 3.9Å; L302-V323 HydrophobicContact CG-CG1 4.46Å; L302-F325 HydrophobicContact CD1-CE1 3.98Å; L302-F325 HydrophobicContact CD1-CZ 4.33Å; L302-F325 HydrophobicContact CD2-CD1 3.75Å; L302-F325 HydrophobicContact CD2-CE1 3.78Å; L302-F325 HydrophobicContact CD2-CG 4.49Å; L302-F325 HydrophobicContact CG-CE1 4.22Å
303	E	60.5	Low	62.4	Low	102 Å²	102	68.5 Å²	68.5	48%	0.477	34%	0.335	S	S	.	.			trans	-78.7	157.5	170.4	-68.5	174.9	153.3	0	0	110.4	D305 Q306 K326	E303-D305 PolarHBondContact O-N 3.24Å; E303-D305 VanDerWaalsContact O-N 3.16Å; E303-Q306 HydrophobicContact CB-CG 4.23Å; E303-Q306 PolarHBondContact O-N 2.81Å; E303-K326 IonicContact OE2-NZ 3.09Å; E303-K326 PolarHBondContact OE2-NZ 2.86Å
304	N	58.3	Low	61.4	Low	83 Å²	83	77.3 Å²	77.3	44%	0.444	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-63.7	-21	-178.7	-80.1	-23	0	0	0	113.3	K290 K294 Q306	K290-N304 PolarHBondContact NZ-O 2.63Å; K294-N304 WeakPolarHBondContact CE-OD1 3.49Å; K294-N304 PolarHBondContact NZ-OD1 2.67Å; N304-Q306 VanDerWaalsContact C-N 3.34Å
305	D	60.4	Low	60.9	Low	131 Å²	131	77.3 Å²	77.3	70%	0.701	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-86.1	-13.6	-176	-55.2	-25.3	0	0	0	111.6	E303 I307	E303-D305 PolarHBondContact O-N 3.24Å; E303-D305 VanDerWaalsContact O-N 3.16Å; D305-I307 VanDerWaalsContact C-N 3.34Å
306	Q	65	Low	60.5	Low	12 Å²	12	76.9 Å²	76.9	6%	0.056	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-88.3	-3	177.3	-64	-177.9	-65.1	0	0	113	E303 N304 V323 L324 K326	E303-Q306 HydrophobicContact CB-CG 4.23Å; E303-Q306 PolarHBondContact O-N 2.81Å; N304-Q306 VanDerWaalsContact C-N 3.34Å; Q306-V323 CarbonylContact O-C 3.53Å; Q306-V323 WeakPolarHBondContact O-CA 3.31Å; Q306-L324 HydrophobicContact CB-CB 4.07Å; Q306-L324 WeakPolarHBondContact CB-O 3.26Å; Q306-L324 HydrophobicContact CG-CB 4.45Å; Q306-L324 PolarHBondContact NE2-O 3.28Å; Q306-L324 PolarHBondContact O-N 2.73Å; Q306-K326 VanDerWaalsContact NE2-CD 3.28Å; Q306-K326 VanDerWaalsContact NE2-CE 3.27Å; Q306-K326 VanDerWaalsContact NE2-CG 3.3Å
307	I	72.1	Confident	60.4	Low	0 Å²	0	81 Å²	81	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	108.8	-178.9	-55.9	174.2	0	0	0	108.5	K290 L293 K294 L302 D305 F309 F322 V323	K290-I307 PolarHBondContact NZ-O 3.38Å; L293-I307 HydrophobicContact CB-CD1 4.1Å; L293-I307 HydrophobicContact CD1-CG2 3.7Å; K294-I307 HydrophobicContact CG-CD1 3.99Å; L302-I307 HydrophobicContact CD1-CD1 4.49Å; D305-I307 VanDerWaalsContact C-N 3.34Å; I307-F309 HydrophobicContact CG2-CE2 4.49Å; I307-F322 WeakPolarHBondContact CA-O 3.12Å; I307-V323 HydrophobicContact CG1-CG1 4.39Å; I307-V323 HydrophobicContact CG1-CG2 4.34Å; I307-V323 HydrophobicContact CG2-CG2 4.4Å
308	L	67.7	Low	60.3	Low	61 Å²	61	82.9 Å²	82.9	32%	0.319	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	113.7	-177.4	-61.2	174.8	0	0	0	109.6	A321 F322 L361	L308-A321 CarbonylContact O-C 3.58Å; L308-A321 VanDerWaalsContact O-CA 3.31Å; L308-A321 WeakPolarHBondContact O-CA 3.4Å; L308-F322 HydrophobicContact CB-CB 4.32Å; L308-F322 PolarHBondContact N-O 3.07Å; L308-F322 PolarHBondContact O-N 3.35Å; L308-L361 HydrophobicContact CD1-CD1 4.38Å
309	F	68.4	Low	60.7	Low	38 Å²	38	82.2 Å²	82.2	17%	0.167	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	129.9	171.3	-73.7	-76.7	0	0	0	109.4	L284 K290 L293 I307 A321	L284-F309 HydrophobicContact CD1-CE1 4.4Å; K290-F309 HydrophobicContact CG-CD2 4.37Å; K290-F309 HydrophobicContact CG-CE2 3.65Å; L293-F309 HydrophobicContact CD1-CE1 3.9Å; L293-F309 HydrophobicContact CD1-CE2 4.49Å; L293-F309 HydrophobicContact CD1-CZ 3.59Å; I307-F309 HydrophobicContact CG2-CE2 4.49Å; F309-A321 HydrophobicContact CD1-CB 3.7Å; F309-A321 HydrophobicContact CE1-CB 3.96Å; F309-A321 HydrophobicContact CG-CB 4.41Å
310	L	66.6	Low	61.8	Low	41 Å²	41	77.8 Å²	77.8	22%	0.215	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	130.6	168.9	-79	168.3	0	0	0	108.1	L280 T318 S320 F322	L280-L310 HydrophobicContact CD1-CD1 3.94Å; L310-T318 VanDerWaalsContact C-OG1 3.26Å; L310-T318 WeakPolarHBondContact CB-OG1 3.12Å; L310-T318 VanDerWaalsContact O-CB 3.31Å; L310-T318 WeakPolarHBondContact O-CB 3.48Å; L310-T318 WeakPolarHBondContact O-CG2 3.31Å; L310-T318 PolarHBondContact O-N 2.89Å; L310-T318 PolarHBondContact O-OG1 3.38Å; L310-S320 PolarHBondContact N-O 2.76Å; L310-F322 HydrophobicContact CD1-CD2 4.14Å; L310-F322 HydrophobicContact CD1-CE2 3.57Å; L310-F322 HydrophobicContact CD1-CZ 3.96Å; L310-F322 HydrophobicContact CD2-CD2 4.06Å; L310-F322 HydrophobicContact CD2-CE2 3.49Å; L310-F322 VanDerWaalsContact CD2-CE2 3.49Å; L310-F322 HydrophobicContact CD2-CZ 4.46Å; L310-F322 HydrophobicContact CG-CD2 3.89Å; L310-F322 HydrophobicContact CG-CE2 3.59Å; L310-F322 HydrophobicContact CG-CZ 4.46Å
311	T	67.4	Low	62.8	Low	69 Å²	69	77.3 Å²	77.3	42%	0.423	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.8	174.7	48.8	0	0	0	0	109.5	R316 Q364	T311-R316 CarbonylContact C-O 3.58Å; T311-R316 WeakPolarHBondContact CA-O 3.33Å; T311-Q364 PolarHBondContact O-OE1 3.05Å
312	D	60.1	Low	63.8	Low	57 Å²	57	67.6 Å²	67.6	31%	0.305	34%	0.336	S	S	.	.			trans	-72.9	162.8	175	-174.6	24	0	0	0	110.1	Y314 G315 R316 T318	D312-Y314 PolarHBondContact O-N 3.39Å; D312-G315 PolarHBondContact O-N 2.94Å; D312-R316 PolarHBondContact N-O 2.94Å; D312-R316 IonicContact OD2-NH2 3.58Å; D312-R316 PolarHBondContact OD2-NH2 3.07Å; D312-T318 HydrophobicContact CB-CG2 3.99Å
313	D	51.6	Low	64.4	Low	118 Å²	118	66.9 Å²	66.9	63%	0.631	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-13.2	-175.5	-58.5	-29.7	0	0	0	113.7	Q364	D313-Q364 PolarHBondContact OD1-NE2 3.33Å
314	Y	49.3	Very low	65.1	Low	184 Å²	184	62.7 Å²	62.7	72%	0.722	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	13	177.7	-56	-84.3	0	0	0	113.9	D312 R316	D312-Y314 PolarHBondContact O-N 3.39Å; Y314-R316 VanDerWaalsContact C-N 3.28Å; Y314-R316 PolarHBondContact O-N 3.42Å
315	G	55	Low	65.9	Low	63 Å²	63	58.9 Å²	58.9	65%	0.649	29%	0.293	S	S	*	.	S	Bend	trans	72.7	15	179.2	0	0	0	0	0	114.7	D312	D312-G315 PolarHBondContact O-N 2.94Å
316	R	57.2	Low	66.3	Low	160 Å²	160	58.7 Å²	58.7	60%	0.604	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-92.9	136.7	178.7	-62.7	-176.3	-60.7	-173.2	0.3	110.2	T311 D312 Y314 T318	T311-R316 CarbonylContact C-O 3.58Å; T311-R316 WeakPolarHBondContact CA-O 3.33Å; D312-R316 PolarHBondContact N-O 2.94Å; D312-R316 IonicContact OD2-NH2 3.58Å; D312-R316 PolarHBondContact OD2-NH2 3.07Å; Y314-R316 VanDerWaalsContact C-N 3.28Å; Y314-R316 PolarHBondContact O-N 3.42Å; R316-T318 PolarHBondContact O-N 3.3Å
317	R	61.7	Low	66.5	Low	105 Å²	105	62.1 Å²	62.1	40%	0.396	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	120.2	177.6	-61.1	172.4	80.7	-172.4	-5.2	109.2	F286 V288	F286-R317 WeakPolarHBondContact CD1-O 3.5Å; F286-R317 WeakPolarHBondContact CE1-O 3.49Å; V288-R317 PolarHBondContact O-NH2 3.45Å
318	T	63.5	Low	66.4	Low	46 Å²	46	66.5 Å²	66.5	28%	0.282	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	165.5	172.2	69.3	0	0	0	0	109.9	L310 D312 R316 S320	L310-T318 VanDerWaalsContact C-OG1 3.26Å; L310-T318 WeakPolarHBondContact CB-OG1 3.12Å; L310-T318 VanDerWaalsContact O-CB 3.31Å; L310-T318 WeakPolarHBondContact O-CB 3.48Å; L310-T318 WeakPolarHBondContact O-CG2 3.31Å; L310-T318 PolarHBondContact O-N 2.89Å; L310-T318 PolarHBondContact O-OG1 3.38Å; D312-T318 HydrophobicContact CB-CG2 3.99Å; R316-T318 PolarHBondContact O-N 3.3Å; T318-S320 PolarHBondContact O-N 3.01Å; T318-S320 VanDerWaalsContact O-N 3.1Å; T318-S320 PolarHBondContact OG1-N 3.2Å; T318-S320 PolarHBondContact OG1-O 3.09Å
319	R	66.8	Low	66.4	Low	108 Å²	108	65.1 Å²	65.1	41%	0.408	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	15.8	175.6	-63.2	-173.9	-178.1	161.5	2.3	112.8	N283 L284 F286	N283-R319 PolarHBondContact N-O 3.15Å; N283-R319 VanDerWaalsContact N-O 3.09Å; L284-R319 WeakPolarHBondContact CB-O 3.3Å; L284-R319 PolarHBondContact N-O 3.01Å; L284-R319 VanDerWaalsContact O-CB 3.3Å; L284-R319 WeakPolarHBondContact O-CB 3.45Å; L284-R319 WeakPolarHBondContact O-CG 3.48Å; F286-R319 HydrophobicContact CD1-CG 4.08Å; F286-R319 HydrophobicContact CE1-CG 3.51Å; F286-R319 HydrophobicContact CE2-CG 4.18Å; F286-R319 HydrophobicContact CZ-CG 3.58Å
320	S	72.8	Confident	66.5	Low	25 Å²	25	64.7 Å²	64.7	18%	0.175	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	142.1	-175	-60.8	0	0	0	0	111.2	L281 D282 L310 T318	L281-S320 CarbonylContact O-C 3.59Å; L281-S320 WeakPolarHBondContact O-CA 3.43Å; D282-S320 VanDerWaalsContact OD1-CB 3.26Å; D282-S320 WeakPolarHBondContact OD1-CB 3.21Å; D282-S320 PolarHBondContact OD1-OG 3.4Å; L310-S320 PolarHBondContact N-O 2.76Å; T318-S320 PolarHBondContact O-N 3.01Å; T318-S320 VanDerWaalsContact O-N 3.1Å; T318-S320 PolarHBondContact OG1-N 3.2Å; T318-S320 PolarHBondContact OG1-O 3.09Å
321	A	74.9	Confident	66.9	Low	0 Å²	0	65 Å²	65	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	140.5	179	0	0	0	0	0	111.2	L281 L284 L308 F309	L281-A321 WeakPolarHBondContact CB-O 3.34Å; L281-A321 PolarHBondContact N-O 3.42Å; L281-A321 PolarHBondContact O-N 3.46Å; L284-A321 HydrophobicContact CD1-CB 3.52Å; L308-A321 CarbonylContact O-C 3.58Å; L308-A321 VanDerWaalsContact O-CA 3.31Å; L308-A321 WeakPolarHBondContact O-CA 3.4Å; F309-A321 HydrophobicContact CD1-CB 3.7Å; F309-A321 HydrophobicContact CE1-CB 3.96Å; F309-A321 HydrophobicContact CG-CB 4.41Å
322	F	76.6	Confident	66.9	Low	1 Å²	1	64.7 Å²	64.7	0%	0.004	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	140.5	168.7	-64.7	-70.9	0	0	0	110.9	V279 L280 I307 L308 L310 V352 M357 L360	V279-F322 CarbonylContact O-C 3.6Å; V279-F322 VanDerWaalsContact O-CA 3.31Å; V279-F322 WeakPolarHBondContact O-CA 3.37Å; L280-F322 HydrophobicContact CB-CD1 3.95Å; L280-F322 HydrophobicContact CB-CE1 3.83Å; L280-F322 HydrophobicContact CD1-CD1 3.8Å; L280-F322 HydrophobicContact CD1-CE1 3.58Å; L280-F322 HydrophobicContact CD1-CG 4.38Å; L280-F322 HydrophobicContact CD1-CZ 3.99Å; L280-F322 HydrophobicContact CD2-CE1 4.36Å; L280-F322 HydrophobicContact CG-CD1 4.45Å; L280-F322 HydrophobicContact CG-CE1 4.12Å; I307-F322 WeakPolarHBondContact CA-O 3.12Å; L308-F322 HydrophobicContact CB-CB 4.32Å; L308-F322 PolarHBondContact N-O 3.07Å; L308-F322 PolarHBondContact O-N 3.35Å; L310-F322 HydrophobicContact CD1-CD2 4.14Å; L310-F322 HydrophobicContact CD1-CE2 3.57Å; L310-F322 HydrophobicContact CD1-CZ 3.96Å; L310-F322 HydrophobicContact CD2-CD2 4.06Å; L310-F322 HydrophobicContact CD2-CE2 3.49Å; L310-F322 VanDerWaalsContact CD2-CE2 3.49Å; L310-F322 HydrophobicContact CD2-CZ 4.46Å; L310-F322 HydrophobicContact CG-CD2 3.89Å; L310-F322 HydrophobicContact CG-CE2 3.59Å; L310-F322 HydrophobicContact CG-CZ 4.46Å; F322-V352 HydrophobicContact CE1-CB 4.46Å; F322-V352 HydrophobicContact CE1-CG1 4.15Å; F322-V352 HydrophobicContact CE1-CG2 4.47Å; F322-M357 HydrophobicContact CB-CG 4.44Å; F322-M357 HydrophobicContact CB-SD 4.16Å; F322-M357 HydrophobicContact CD1-CG 4.04Å; F322-M357 HydrophobicContact CD2-CG 3.97Å; F322-M357 HydrophobicContact CE1-CB 4.42Å; F322-M357 HydrophobicContact CE1-CG 4.21Å; F322-M357 HydrophobicContact CE2-CG 4.11Å; F322-M357 HydrophobicContact CG-CG 3.92Å; F322-M357 HydrophobicContact CG-SD 4.27Å; F322-M357 HydrophobicContact CZ-CG 4.25Å; F322-L360 HydrophobicContact CZ-CB 4.44Å; F322-L360 HydrophobicContact CZ-CD1 3.97Å
323	V	77.5	Confident	67.3	Low	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	129.8	172.2	-177.2	0	0	0	0	109.4	V279 L281 L302 Q306 I307 F325	V279-V323 PolarHBondContact N-O 3.42Å; V279-V323 PolarHBondContact O-N 3.07Å; L281-V323 HydrophobicContact CD1-CG2 3.48Å; L281-V323 VanDerWaalsContact CD1-CG2 3.48Å; L281-V323 HydrophobicContact CG-CG2 4.23Å; L302-V323 HydrophobicContact CD1-CG1 3.69Å; L302-V323 HydrophobicContact CD2-CG1 3.9Å; L302-V323 HydrophobicContact CG-CG1 4.46Å; Q306-V323 CarbonylContact O-C 3.53Å; Q306-V323 WeakPolarHBondContact O-CA 3.31Å; I307-V323 HydrophobicContact CG1-CG1 4.39Å; I307-V323 HydrophobicContact CG1-CG2 4.34Å; I307-V323 HydrophobicContact CG2-CG2 4.4Å; V323-F325 HydrophobicContact CB-CE2 4Å; V323-F325 HydrophobicContact CB-CZ 4.37Å; V323-F325 HydrophobicContact CG1-CD2 4.18Å; V323-F325 HydrophobicContact CG1-CE1 4.21Å; V323-F325 HydrophobicContact CG1-CE2 3.57Å; V323-F325 HydrophobicContact CG1-CZ 3.59Å
324	L	73.9	Confident	68.1	Low	15 Å²	15	59.9 Å²	59.9	8%	0.079	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	117	-179.3	-66.5	169.6	0	0	0	110.2	E276 C278 Q306 M357	E276-L324 HydrophobicContact CB-CD2 4.44Å; C278-L324 HydrophobicContact CB-CD2 3.86Å; C278-L324 WeakPolarHBondContact SG-CD2 3.46Å; Q306-L324 HydrophobicContact CB-CB 4.07Å; Q306-L324 WeakPolarHBondContact CB-O 3.26Å; Q306-L324 HydrophobicContact CG-CB 4.45Å; Q306-L324 PolarHBondContact NE2-O 3.28Å; Q306-L324 PolarHBondContact O-N 2.73Å; L324-M357 HydrophobicContact CD1-CE 4.45Å; L324-M357 HydrophobicContact CD2-CE 3.87Å; L324-M357 HydrophobicContact CD2-SD 3.76Å; L324-M357 HydrophobicContact CG-SD 4.33Å
325	F	74.9	Confident	69.2	Low	2 Å²	2	53.2 Å²	53.2	1%	0.009	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	126.9	176.3	-64.7	-84.5	0	0	0	110.1	Y277 V279 F297 L302 V323 N327 D330 A334	Y277-F325 PolarHBondContact N-O 3.17Å; Y277-F325 PolarHBondContact O-N 2.76Å; V279-F325 HydrophobicContact CB-CD2 4.48Å; V279-F325 HydrophobicContact CB-CE2 4.06Å; V279-F325 HydrophobicContact CG2-CD2 3.85Å; V279-F325 HydrophobicContact CG2-CE2 3.72Å; F297-F325 HydrophobicContact CD1-CZ 4.12Å; F297-F325 HydrophobicContact CE1-CZ 4.26Å; F297-F325 HydrophobicContact CG-CZ 4.27Å; L302-F325 HydrophobicContact CD1-CE1 3.98Å; L302-F325 HydrophobicContact CD1-CZ 4.33Å; L302-F325 HydrophobicContact CD2-CD1 3.75Å; L302-F325 HydrophobicContact CD2-CE1 3.78Å; L302-F325 HydrophobicContact CD2-CG 4.49Å; L302-F325 HydrophobicContact CG-CE1 4.22Å; V323-F325 HydrophobicContact CB-CE2 4Å; V323-F325 HydrophobicContact CB-CZ 4.37Å; V323-F325 HydrophobicContact CG1-CD2 4.18Å; V323-F325 HydrophobicContact CG1-CE1 4.21Å; V323-F325 HydrophobicContact CG1-CE2 3.57Å; V323-F325 HydrophobicContact CG1-CZ 3.59Å; F325-N327 VanDerWaalsContact C-N 3.26Å; F325-D330 HydrophobicContact CD1-CB 3.76Å; F325-D330 HydrophobicContact CE1-CB 4.39Å; F325-D330 HydrophobicContact CG-CB 4.49Å; F325-A334 HydrophobicContact CE1-CB 4.35Å; F325-A334 HydrophobicContact CE2-CB 3.86Å; F325-A334 HydrophobicContact CZ-CB 3.62Å
326	K	69.6	Low	69.7	Low	128 Å²	128	55 Å²	55	56%	0.557	28%	0.279	S	S	*	.	S	Bend	trans	-77.5	-11.6	173.9	-78.6	166.4	-178.6	173	0	112.8	E303 Q306	E303-K326 IonicContact OE2-NZ 3.09Å; E303-K326 PolarHBondContact OE2-NZ 2.86Å; Q306-K326 VanDerWaalsContact NE2-CD 3.28Å; Q306-K326 VanDerWaalsContact NE2-CE 3.27Å; Q306-K326 VanDerWaalsContact NE2-CG 3.3Å
327	N	69.9	Low	69.8	Low	84 Å²	84	49.6 Å²	49.6	45%	0.449	26%	0.261	S	S	.	.	S	Bend	trans	-129.4	132.3	-174.3	-173	4.4	0	0	0	110.4	F325 G329 D330 Y331	F325-N327 VanDerWaalsContact C-N 3.26Å; N327-G329 VanDerWaalsContact C-N 3.28Å; N327-G329 PolarHBondContact O-N 3.41Å; N327-G329 PolarHBondContact OD1-N 3.23Å; N327-D330 HydrophobicContact CB-CB 4.28Å; N327-D330 WeakPolarHBondContact CB-OD2 3.33Å; N327-D330 PolarHBondContact O-N 3.38Å; N327-Y331 PolarHBondContact O-N 2.95Å
328	I	69.8	Low	69.6	Low	91 Å²	91	49.1 Å²	49.1	47%	0.467	26%	0.263	S	S	.	.	H	α-helix	trans	-65.1	-31.9	-179.6	-166.7	166.1	0	0	0	112.3	Y277 Y331 C332	Y277-I328 HydrophobicContact CD2-CB 4.29Å; Y277-I328 HydrophobicContact CE1-CB 4.41Å; Y277-I328 HydrophobicContact CE1-CD1 4.02Å; Y277-I328 HydrophobicContact CE1-CG1 4.13Å; Y277-I328 HydrophobicContact CE2-CB 3.73Å; Y277-I328 HydrophobicContact CE2-CG1 4.35Å; I328-Y331 WeakPolarHBondContact O-CB 3.35Å; I328-Y331 PolarHBondContact O-N 2.97Å; I328-C332 PolarHBondContact O-N 3.03Å; I328-C332 PolarHBondContact O-SG 3.09Å
329	G	67.3	Low	69.2	Low	33 Å²	33	53.9 Å²	53.9	34%	0.34	28%	0.28	S	S	.	.	H	α-helix	trans	-64.2	-44.7	177.3	0	0	0	0	0	112.4	N327 Y331 C332 D333	N327-G329 VanDerWaalsContact C-N 3.28Å; N327-G329 PolarHBondContact O-N 3.41Å; N327-G329 PolarHBondContact OD1-N 3.23Å; G329-Y331 VanDerWaalsContact C-N 3.34Å; G329-Y331 PolarHBondContact O-N 3.47Å; G329-C332 PolarHBondContact O-N 3.35Å; G329-D333 PolarHBondContact O-N 3.5Å
330	D	70.8	Confident	68.7	Low	29 Å²	29	55.3 Å²	55.3	16%	0.155	29%	0.285	C	S	.	.	H	α-helix	trans	-64.3	-38.3	176.8	-76.3	-43.5	0	0	0	112.4	S300 F325 N327 D333 A334	S300-D330 WeakPolarHBondContact CA-OD1 3.38Å; S300-D330 VanDerWaalsContact CB-CG 3.44Å; S300-D330 WeakPolarHBondContact CB-OD1 3.48Å; S300-D330 WeakPolarHBondContact OG-CB 3.32Å; S300-D330 PolarHBondContact OG-OD1 3.38Å; F325-D330 HydrophobicContact CD1-CB 3.76Å; F325-D330 HydrophobicContact CE1-CB 4.39Å; F325-D330 HydrophobicContact CG-CB 4.49Å; N327-D330 HydrophobicContact CB-CB 4.28Å; N327-D330 WeakPolarHBondContact CB-OD2 3.33Å; N327-D330 PolarHBondContact O-N 3.38Å; D330-D333 PolarHBondContact O-N 3.24Å; D330-A334 WeakPolarHBondContact O-CB 3.42Å; D330-A334 PolarHBondContact O-N 3.09Å
331	Y	74.8	Confident	67.8	Low	47 Å²	47	60.6 Å²	60.6	18%	0.184	31%	0.307	C	S	.	.	H	α-helix	trans	-63.5	-45.3	173.9	167.8	-98.3	0	0	0	112.4	Y277 V279 N327 I328 G329 D333 A334 I335 P351	Y277-Y331 HydrophobicContact CD1-CD1 4.44Å; Y277-Y331 HydrophobicContact CG-CG 4.27Å; V279-Y331 HydrophobicContact CG2-CD2 3.41Å; V279-Y331 VanDerWaalsContact CG2-CD2 3.41Å; V279-Y331 HydrophobicContact CG2-CE2 3.55Å; N327-Y331 PolarHBondContact O-N 2.95Å; I328-Y331 WeakPolarHBondContact O-CB 3.35Å; I328-Y331 PolarHBondContact O-N 2.97Å; G329-Y331 VanDerWaalsContact C-N 3.34Å; G329-Y331 PolarHBondContact O-N 3.47Å; Y331-D333 VanDerWaalsContact C-N 3.33Å; Y331-D333 PolarHBondContact O-N 3.05Å; Y331-A334 PolarHBondContact O-N 3.47Å; Y331-I335 HydrophobicContact CD1-CD1 4.02Å; Y331-I335 HydrophobicContact CD2-CD1 4.09Å; Y331-I335 HydrophobicContact CE1-CD1 3.47Å; Y331-I335 VanDerWaalsContact CE1-CD1 3.47Å; Y331-I335 HydrophobicContact CE2-CD1 3.57Å; Y331-I335 HydrophobicContact CE2-CG1 4.49Å; Y331-I335 HydrophobicContact CG-CD1 4.3Å; Y331-I335 WeakPolarHBondContact O-CG1 3.35Å; Y331-I335 PolarHBondContact O-N 3.46Å; Y331-I335 VanDerWaalsContact O-N 3.1Å; Y331-P351 HydrophobicContact CE2-CB 4.47Å; Y331-P351 WeakPolarHBondContact OH-CB 3.37Å
332	C	67.6	Low	66.8	Low	62 Å²	62	62.5 Å²	62.5	42%	0.419	32%	0.315	S	S	.	.	H	α-helix	trans	-64	-38.9	176	-71.6	0	0	0	0	111.9	I328 G329 S336	I328-C332 PolarHBondContact O-N 3.03Å; I328-C332 PolarHBondContact O-SG 3.09Å; G329-C332 PolarHBondContact O-N 3.35Å; C332-S336 WeakPolarHBondContact O-CB 3.38Å; C332-S336 PolarHBondContact O-N 3.12Å; C332-S336 PolarHBondContact O-OG 3.47Å
333	D	69	Low	65.6	Low	73 Å²	73	67.4 Å²	67.4	39%	0.39	34%	0.341	S	S	.	.	H	α-helix	trans	-66.1	-38.1	175.9	-77.3	-8.5	0	0	0	111.9	G329 D330 Y331 S336 Q337	G329-D333 PolarHBondContact O-N 3.5Å; D330-D333 PolarHBondContact O-N 3.24Å; Y331-D333 VanDerWaalsContact C-N 3.33Å; Y331-D333 PolarHBondContact O-N 3.05Å; D333-S336 PolarHBondContact O-N 3.32Å; D333-Q337 VanDerWaalsContact O-CG 3.32Å; D333-Q337 WeakPolarHBondContact O-CG 3.23Å; D333-Q337 PolarHBondContact O-N 3.02Å
334	A	68.2	Low	64.6	Low	1 Å²	1	74.2 Å²	74.2	1%	0.008	38%	0.377	C	S	.	.	H	α-helix	trans	-65.9	-44	177.2	0	0	0	0	0	112.3	F297 F325 D330 Y331 S336 Q337 I349	F297-A334 HydrophobicContact CD1-CB 4.07Å; F297-A334 HydrophobicContact CE1-CB 3.58Å; F297-A334 HydrophobicContact CZ-CB 4.42Å; F325-A334 HydrophobicContact CE1-CB 4.35Å; F325-A334 HydrophobicContact CE2-CB 3.86Å; F325-A334 HydrophobicContact CZ-CB 3.62Å; D330-A334 WeakPolarHBondContact O-CB 3.42Å; D330-A334 PolarHBondContact O-N 3.09Å; Y331-A334 PolarHBondContact O-N 3.47Å; A334-S336 VanDerWaalsContact C-N 3.33Å; A334-Q337 PolarHBondContact O-N 2.9Å; A334-I349 WeakPolarHBondContact O-CD1 3.41Å
335	I	71.9	Confident	63.7	Low	45 Å²	45	78 Å²	78	23%	0.231	39%	0.39	C	S	.	.	H	α-helix	trans	-68.2	-35.9	177	-66.6	168.5	0	0	0	111.1	Y331 Q337 E338 P351	Y331-I335 HydrophobicContact CD1-CD1 4.02Å; Y331-I335 HydrophobicContact CD2-CD1 4.09Å; Y331-I335 HydrophobicContact CE1-CD1 3.47Å; Y331-I335 VanDerWaalsContact CE1-CD1 3.47Å; Y331-I335 HydrophobicContact CE2-CD1 3.57Å; Y331-I335 HydrophobicContact CE2-CG1 4.49Å; Y331-I335 HydrophobicContact CG-CD1 4.3Å; Y331-I335 WeakPolarHBondContact O-CG1 3.35Å; Y331-I335 PolarHBondContact O-N 3.46Å; Y331-I335 VanDerWaalsContact O-N 3.1Å; I335-Q337 PolarHBondContact O-N 3.32Å; I335-Q337 VanDerWaalsContact O-N 3.16Å; I335-E338 WeakPolarHBondContact O-CB 3.42Å; I335-E338 PolarHBondContact O-N 3.02Å; I335-E338 VanDerWaalsContact O-N 3.15Å; I335-P351 HydrophobicContact CD1-CB 3.88Å; I335-P351 HydrophobicContact CD1-CG 4.48Å
336	S	64.4	Low	63	Low	100 Å²	100	85.3 Å²	85.3	70%	0.699	42%	0.418	S	S	*	.	H	α-helix	trans	-66.2	-15.7	177.1	-59.8	0	0	0	0	113.1	C332 D333 A334	C332-S336 WeakPolarHBondContact O-CB 3.38Å; C332-S336 PolarHBondContact O-N 3.12Å; C332-S336 PolarHBondContact O-OG 3.47Å; D333-S336 PolarHBondContact O-N 3.32Å; A334-S336 VanDerWaalsContact C-N 3.33Å
337	Q	60.9	Low	63.1	Low	47 Å²	47	79.5 Å²	79.5	22%	0.22	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	16.1	176.2	-68.7	179.6	37.4	0	0	113.7	D333 A334 I335 K339 R340	D333-Q337 VanDerWaalsContact O-CG 3.32Å; D333-Q337 WeakPolarHBondContact O-CG 3.23Å; D333-Q337 PolarHBondContact O-N 3.02Å; A334-Q337 PolarHBondContact O-N 2.9Å; I335-Q337 PolarHBondContact O-N 3.32Å; I335-Q337 VanDerWaalsContact O-N 3.16Å; Q337-K339 PolarHBondContact O-N 3.44Å; Q337-R340 PolarHBondContact O-N 2.74Å
338	E	56	Low	62.8	Low	94 Å²	94	78.2 Å²	78.2	44%	0.439	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	131.5	174.5	-160.3	-173.3	167.2	0	0	110.9	I335	I335-E338 WeakPolarHBondContact O-CB 3.42Å; I335-E338 PolarHBondContact O-N 3.02Å; I335-E338 VanDerWaalsContact O-N 3.15Å
339	K	55.2	Low	63.1	Low	147 Å²	147	74.1 Å²	74.1	64%	0.639	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	26.4	-177.3	-48.2	171.5	-176.9	170.6	0	116.4	Q337 I347	Q337-K339 PolarHBondContact O-N 3.44Å; K339-I347 PolarHBondContact N-O 2.98Å
340	R	56.5	Low	63.3	Low	138 Å²	138	79.4 Å²	79.4	52%	0.521	37%	0.373	S	S	.	.			trans	-67.9	140.3	167.3	-104.2	-174.8	170.8	-173.6	-6.3	112.1	Q337 F342 I347	Q337-R340 PolarHBondContact O-N 2.74Å; R340-F342 PolarHBondContact O-N 3.42Å; R340-I347 PolarHBondContact O-N 3.48Å
341	H	53.9	Low	63.4	Low	136 Å²	136	81.6 Å²	81.6	63%	0.63	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	111.4	174.5	-136.8	-100	0	0	0	108.8
342	F	53.6	Low	63.2	Low	39 Å²	39	80.6 Å²	80.6	17%	0.171	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	124.2	177.5	-165.3	-111	0	0	0	109.7	V288 D292 L296 R340 N344 R345 I347	V288-F342 HydrophobicContact CG1-CE1 4.33Å; V288-F342 HydrophobicContact CG2-CD1 4.29Å; V288-F342 HydrophobicContact CG2-CE1 3.95Å; D292-F342 HydrophobicContact CB-CE1 4.3Å; D292-F342 HydrophobicContact CB-CZ 3.98Å; L296-F342 HydrophobicContact CB-CE2 4.29Å; L296-F342 HydrophobicContact CD1-CB 4.15Å; L296-F342 HydrophobicContact CD1-CD1 4.2Å; L296-F342 HydrophobicContact CD1-CD2 3.48Å; L296-F342 VanDerWaalsContact CD1-CD2 3.48Å; L296-F342 HydrophobicContact CD1-CE1 4.45Å; L296-F342 HydrophobicContact CD1-CE2 3.77Å; L296-F342 HydrophobicContact CD1-CG 3.69Å; L296-F342 HydrophobicContact CD1-CZ 4.24Å; R340-F342 PolarHBondContact O-N 3.42Å; F342-N344 PolarHBondContact O-N 3.1Å; F342-R345 PolarHBondContact N-O 3.47Å; F342-R345 PolarHBondContact O-N 2.96Å; F342-I347 HydrophobicContact CB-CD1 3.29Å; F342-I347 HydrophobicContact CB-CG1 3.91Å; F342-I347 HydrophobicContact CD1-CD1 3.78Å; F342-I347 HydrophobicContact CG-CD1 3.74Å
343	L	52.5	Low	63.1	Low	105 Å²	105	80.4 Å²	80.4	55%	0.55	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.5	47.8	-178.4	-61.8	171.9	0	0	0	113.1	V288 R345	V288-L343 HydrophobicContact CG2-CD1 3.94Å; L343-R345 VanDerWaalsContact C-N 3.29Å; L343-R345 PolarHBondContact O-N 3.06Å
344	N	55.2	Low	62.9	Low	142 Å²	142	82.4 Å²	82.4	76%	0.759	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	20.7	178.8	-145.2	30.6	0	0	0	115.6	F342	F342-N344 PolarHBondContact O-N 3.1Å
345	R	56.8	Low	62.7	Low	95 Å²	95	87.8 Å²	87.8	36%	0.358	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	141.7	171.6	-59.4	-179	81.4	101.3	0.6	110.9	N283 F342 L343	N283-R345 PolarHBondContact OD1-NE 3.23Å; N283-R345 PolarHBondContact OD1-NH2 3.29Å; N283-R345 VanDerWaalsContact OD1-NH2 3.1Å; F342-R345 PolarHBondContact N-O 3.47Å; F342-R345 PolarHBondContact O-N 2.96Å; L343-R345 VanDerWaalsContact C-N 3.29Å; L343-R345 PolarHBondContact O-N 3.06Å
346	W	59	Low	62.1	Low	156 Å²	156	89.6 Å²	89.6	59%	0.591	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.5	121.9	161.4	44.7	-6.4	0	0	0	112.9	N283	N283-W346 PolarHBondContact ND2-O 3.14Å
347	I	72.1	Confident	62.2	Low	5 Å²	5	85.1 Å²	85.1	3%	0.026	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-91.4	137	170.3	-60.1	174	0	0	0	109.1	L281 L284 L296 K339 R340 F342 I349	L281-I347 HydrophobicContact CB-CG2 4.43Å; L281-I347 HydrophobicContact CD2-CG2 4.22Å; L284-I347 HydrophobicContact CD2-CD1 3.55Å; L284-I347 HydrophobicContact CD2-CG1 3.96Å; L284-I347 HydrophobicContact CD2-CG2 4.06Å; L296-I347 HydrophobicContact CD1-CD1 3.76Å; K339-I347 PolarHBondContact N-O 2.98Å; R340-I347 PolarHBondContact O-N 3.48Å; F342-I347 HydrophobicContact CB-CD1 3.29Å; F342-I347 HydrophobicContact CB-CG1 3.91Å; F342-I347 HydrophobicContact CD1-CD1 3.78Å; F342-I347 HydrophobicContact CG-CD1 3.74Å; I347-I349 HydrophobicContact CG2-CG1 4.13Å
348	H	63.6	Low	62.1	Low	58 Å²	58	85.9 Å²	85.9	27%	0.269	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127.8	170.6	-69.9	-75.9	0	0	0	109.7	L281 D282	L281-H348 CarbonylContact C-O 3.35Å; L281-H348 WeakPolarHBondContact CA-O 3.38Å; D282-H348 HydrophobicContact CB-CB 4.19Å; D282-H348 PolarHBondContact N-O 3.45Å; D282-H348 PolarHBondContact O-N 3.16Å
349	I	76.1	Confident	62.3	Low	5 Å²	5	88.5 Å²	88.5	3%	0.026	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	114.8	-177.3	-52.9	-170.7	0	0	0	106.8	V279 L281 F297 A334 I347	V279-I349 HydrophobicContact CG1-CB 4.49Å; V279-I349 HydrophobicContact CG1-CG2 3.18Å; L281-I349 HydrophobicContact CD2-CB 4.17Å; L281-I349 HydrophobicContact CD2-CD1 3.99Å; L281-I349 HydrophobicContact CD2-CG1 3.61Å; L281-I349 HydrophobicContact CD2-CG2 3.94Å; F297-I349 HydrophobicContact CE1-CD1 4.43Å; F297-I349 HydrophobicContact CZ-CD1 4.26Å; A334-I349 WeakPolarHBondContact O-CD1 3.41Å; I347-I349 HydrophobicContact CG2-CG1 4.13Å
350	R	70.6	Confident	62.7	Low	143 Å²	143	85.7 Å²	85.7	54%	0.54	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	135	-176.6	-64	-174.2	67.1	166.7	0	111.1	V279 L280 V352	V279-R350 WeakPolarHBondContact CA-O 3.43Å; L280-R350 PolarHBondContact N-O 3.14Å; L280-R350 PolarHBondContact O-N 3.46Å; R350-V352 PolarHBondContact O-N 3.1Å
351	P	73.4	Confident	63.1	Low	75 Å²	75	82.1 Å²	82.1	49%	0.487	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	132.4	171.5	28.5	-33.8	0	0	0	110	Y331 I335	Y331-P351 HydrophobicContact CE2-CB 4.47Å; Y331-P351 WeakPolarHBondContact OH-CB 3.37Å; I335-P351 HydrophobicContact CD1-CB 3.88Å; I335-P351 HydrophobicContact CD1-CG 4.48Å
352	V	70.6	Confident	63	Low	26 Å²	26	82 Å²	82	16%	0.158	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	138	176.5	177.9	0	0	0	0	108.9	C278 L280 F322 R350 N356 M357	C278-V352 CarbonylContact C-O 3.5Å; C278-V352 VanDerWaalsContact CB-O 3.32Å; C278-V352 WeakPolarHBondContact CB-O 3.33Å; C278-V352 PolarHBondContact O-N 3.49Å; C278-V352 VanDerWaalsContact O-N 3.11Å; L280-V352 HydrophobicContact CB-CB 4.47Å; L280-V352 HydrophobicContact CB-CG2 3.49Å; L280-V352 VanDerWaalsContact CB-CG2 3.49Å; L280-V352 HydrophobicContact CD2-CG2 4.32Å; F322-V352 HydrophobicContact CE1-CB 4.46Å; F322-V352 HydrophobicContact CE1-CG1 4.15Å; F322-V352 HydrophobicContact CE1-CG2 4.47Å; R350-V352 PolarHBondContact O-N 3.1Å; V352-N356 HydrophobicContact CG1-CB 3.84Å; V352-M357 HydrophobicContact CG1-CB 4.47Å
353	S	66.1	Low	62.9	Low	58 Å²	58	84.4 Å²	84.4	41%	0.406	41%	0.407	S	S	.	.			trans	-74.5	149.5	175.3	63.1	0	0	0	0	110.8	E355 N356 M357	S353-E355 PolarHBondContact O-N 2.79Å; S353-N356 PolarHBondContact O-N 3.36Å; S353-N356 WeakPolarHBondContact OG-CB 2.86Å; S353-N356 VanDerWaalsContact OG-CG 3.23Å; S353-N356 PolarHBondContact OG-N 3.45Å; S353-N356 PolarHBondContact OG-ND2 2.83Å; S353-M357 PolarHBondContact O-N 2.82Å
354	R	65.2	Low	62.9	Low	116 Å²	116	83.8 Å²	83.8	44%	0.438	40%	0.401	S	S	.	.	H	α-helix	trans	-55.2	-36.4	176.8	-168.8	176.3	-174.3	-89.2	4	112.4	E276 M357 L358	E276-R354 IonicContact OE2-CZ 2.72Å; E276-R354 IonicContact OE2-NE 3.53Å; E276-R354 PolarHBondContact OE2-NE 3.26Å; E276-R354 IonicContact OE2-NH2 3.49Å; E276-R354 PolarHBondContact OE2-NH2 3.46Å; R354-M357 HydrophobicContact CG-CE 4.21Å; R354-M357 PolarHBondContact O-N 2.8Å; R354-L358 HydrophobicContact CG-CD1 4.35Å; R354-L358 WeakPolarHBondContact O-CB 3.47Å; R354-L358 WeakPolarHBondContact O-CG 3.22Å; R354-L358 PolarHBondContact O-N 3.01Å
355	E	62.1	Low	62.5	Low	114 Å²	114	83.6 Å²	83.6	53%	0.533	40%	0.4	S	S	.	.	H	α-helix	trans	-65.8	-41.1	175.6	-169.6	178.8	173.7	0	0	112.4	S353 L358 R359	S353-E355 PolarHBondContact O-N 2.79Å; E355-L358 PolarHBondContact O-N 3.21Å; E355-R359 WeakPolarHBondContact O-CB 3.25Å; E355-R359 VanDerWaalsContact O-CG 3.31Å; E355-R359 WeakPolarHBondContact O-CG 3.49Å; E355-R359 PolarHBondContact O-N 3.03Å; E355-R359 IonicContact OE1-CZ 2.91Å; E355-R359 IonicContact OE1-NE 3.07Å; E355-R359 IonicContact OE1-NH2 2.76Å; E355-R359 PolarHBondContact OE1-NH2 3.15Å
356	N	60.3	Low	61.5	Low	82 Å²	82	85.6 Å²	85.6	44%	0.439	42%	0.418	S	S	.	.	H	α-helix	trans	-70.9	-34.8	176.3	-74.5	-8.8	0	0	0	111.9	V352 S353 L360	V352-N356 HydrophobicContact CG1-CB 3.84Å; S353-N356 PolarHBondContact O-N 3.36Å; S353-N356 WeakPolarHBondContact OG-CB 2.86Å; S353-N356 VanDerWaalsContact OG-CG 3.23Å; S353-N356 PolarHBondContact OG-N 3.45Å; S353-N356 PolarHBondContact OG-ND2 2.83Å; N356-L360 WeakPolarHBondContact O-CB 3.46Å; N356-L360 WeakPolarHBondContact O-CD1 3.37Å; N356-L360 WeakPolarHBondContact O-CG 3.43Å; N356-L360 PolarHBondContact O-N 3.35Å
357	M	66.6	Low	60.9	Low	7 Å²	7	83.9 Å²	83.9	3%	0.034	43%	0.427	C	S	.	.	H	α-helix	trans	-61.7	-46.4	171.4	-176.7	-169.8	68	0	0	111.1	C278 F322 L324 V352 S353 R354 L360 L361	C278-M357 HydrophobicContact CB-SD 4.27Å; F322-M357 HydrophobicContact CB-CG 4.44Å; F322-M357 HydrophobicContact CB-SD 4.16Å; F322-M357 HydrophobicContact CD1-CG 4.04Å; F322-M357 HydrophobicContact CD2-CG 3.97Å; F322-M357 HydrophobicContact CE1-CB 4.42Å; F322-M357 HydrophobicContact CE1-CG 4.21Å; F322-M357 HydrophobicContact CE2-CG 4.11Å; F322-M357 HydrophobicContact CG-CG 3.92Å; F322-M357 HydrophobicContact CG-SD 4.27Å; F322-M357 HydrophobicContact CZ-CG 4.25Å; L324-M357 HydrophobicContact CD1-CE 4.45Å; L324-M357 HydrophobicContact CD2-CE 3.87Å; L324-M357 HydrophobicContact CD2-SD 3.76Å; L324-M357 HydrophobicContact CG-SD 4.33Å; V352-M357 HydrophobicContact CG1-CB 4.47Å; S353-M357 PolarHBondContact O-N 2.82Å; R354-M357 HydrophobicContact CG-CE 4.21Å; R354-M357 PolarHBondContact O-N 2.8Å; M357-L360 PolarHBondContact O-N 3.39Å; M357-L361 HydrophobicContact CG-CD1 3.91Å; M357-L361 WeakPolarHBondContact O-CD1 3.48Å; M357-L361 PolarHBondContact O-N 3.34Å
358	L	59.7	Low	59.6	Low	62 Å²	62	88.8 Å²	88.8	33%	0.325	46%	0.457	S	S	.	.	H	α-helix	trans	-65.3	-42.7	177.8	-72.9	169.3	0	0	0	112.1	R354 E355 L360 L361 E362	R354-L358 HydrophobicContact CG-CD1 4.35Å; R354-L358 WeakPolarHBondContact O-CB 3.47Å; R354-L358 WeakPolarHBondContact O-CG 3.22Å; R354-L358 PolarHBondContact O-N 3.01Å; E355-L358 PolarHBondContact O-N 3.21Å; L358-L360 VanDerWaalsContact C-N 3.28Å; L358-L360 PolarHBondContact O-N 2.72Å; L358-L361 CarbonylContact O-C 3.52Å; L358-L361 PolarHBondContact O-N 2.97Å; L358-L361 VanDerWaalsContact O-N 3.09Å; L358-E362 WeakPolarHBondContact O-CB 3.41Å; L358-E362 WeakPolarHBondContact O-CG 3.48Å; L358-E362 PolarHBondContact O-N 2.92Å
359	R	60.3	Low	58.1	Low	149 Å²	149	92.5 Å²	92.5	56%	0.562	48%	0.484	S	S	*	.	H	α-helix	trans	-61.3	-35.1	174.8	-74.4	-178.1	-172.4	-163.7	6.2	113.1	E355 L361 S363	E355-R359 WeakPolarHBondContact O-CB 3.25Å; E355-R359 VanDerWaalsContact O-CG 3.31Å; E355-R359 WeakPolarHBondContact O-CG 3.49Å; E355-R359 PolarHBondContact O-N 3.03Å; E355-R359 IonicContact OE1-CZ 2.91Å; E355-R359 IonicContact OE1-NE 3.07Å; E355-R359 IonicContact OE1-NH2 2.76Å; E355-R359 PolarHBondContact OE1-NH2 3.15Å; R359-L361 VanDerWaalsContact C-N 3.35Å; R359-S363 WeakPolarHBondContact O-CB 3.12Å; R359-S363 PolarHBondContact O-N 2.98Å; R359-S363 VanDerWaalsContact O-N 3.15Å; R359-S363 PolarHBondContact O-OG 3.28Å
360	L	62.6	Low	56.4	Low	88 Å²	88	97.6 Å²	97.6	46%	0.461	52%	0.517	S	S	.	.	H	α-helix	trans	-77.1	-20.5	176.4	-70.6	170.2	0	0	0	113.1	F322 N356 M357 L358 S363	F322-L360 HydrophobicContact CZ-CB 4.44Å; F322-L360 HydrophobicContact CZ-CD1 3.97Å; N356-L360 WeakPolarHBondContact O-CB 3.46Å; N356-L360 WeakPolarHBondContact O-CD1 3.37Å; N356-L360 WeakPolarHBondContact O-CG 3.43Å; N356-L360 PolarHBondContact O-N 3.35Å; M357-L360 PolarHBondContact O-N 3.39Å; L358-L360 VanDerWaalsContact C-N 3.28Å; L358-L360 PolarHBondContact O-N 2.72Å; L360-S363 PolarHBondContact O-OG 3.28Å
361	L	64.1	Low	55.1	Low	64 Å²	64	97.3 Å²	97.3	34%	0.335	53%	0.534	S	S	.	.	H	α-helix	trans	-88.2	-33.7	171.8	-80.4	154.3	0	0	0	112.4	L308 M357 L358 R359	L308-L361 HydrophobicContact CD1-CD1 4.38Å; M357-L361 HydrophobicContact CG-CD1 3.91Å; M357-L361 WeakPolarHBondContact O-CD1 3.48Å; M357-L361 PolarHBondContact O-N 3.34Å; L358-L361 CarbonylContact O-C 3.52Å; L358-L361 PolarHBondContact O-N 2.97Å; L358-L361 VanDerWaalsContact O-N 3.09Å; R359-L361 VanDerWaalsContact C-N 3.35Å
362	E	53.1	Low	53.2	Low	132 Å²	132	97 Å²	97	62%	0.617	55%	0.545	S	S	*	.	H	α-helix	trans	-75.7	-33.1	179.5	-77.8	176.1	174	0	0	112.4	L358 Q364 N365	L358-E362 WeakPolarHBondContact O-CB 3.41Å; L358-E362 WeakPolarHBondContact O-CG 3.48Å; L358-E362 PolarHBondContact O-N 2.92Å; E362-Q364 PolarHBondContact O-N 2.83Å; E362-N365 PolarHBondContact O-N 2.94Å
363	S	51.7	Low	51.8	Low	90 Å²	90	103.6 Å²	103.6	63%	0.629	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-2.8	176.2	63.3	0	0	0	0	114.6	R359 L360	R359-S363 WeakPolarHBondContact O-CB 3.12Å; R359-S363 PolarHBondContact O-N 2.98Å; R359-S363 VanDerWaalsContact O-N 3.15Å; R359-S363 PolarHBondContact O-OG 3.28Å; L360-S363 PolarHBondContact O-OG 3.28Å
364	Q	50.9	Low	50.3	Low	92 Å²	92	106.4 Å²	106.4	43%	0.43	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.5	-2.4	-178	-71.2	-98.8	-54.8	0	0	113.5	T311 D313 E362	T311-Q364 PolarHBondContact O-OE1 3.05Å; D313-Q364 PolarHBondContact OD1-NE2 3.33Å; E362-Q364 PolarHBondContact O-N 2.83Å
365	N	47.2	Very low	49	Very low	138 Å²	138	109.6 Å²	109.6	74%	0.738	62%	0.619	S	S	*	*	S	Bend	trans	-118.7	9.8	-167.6	-85.4	-39.9	0	0	0	117.8	E362	E362-N365 PolarHBondContact O-N 2.94Å
366	D	35.8	Very low	47.5	Very low	137 Å²	137	114.3 Å²	114.3	73%	0.733	63%	0.632	S	S	*	*			trans	-121.5	117.8	179.9	-155.4	-6.3	0	0	0	113.5
367	P	47.6	Very low	46.3	Very low	121 Å²	121	119.1 Å²	119.1	79%	0.786	65%	0.651	S	S	*	*			trans	-91.3	15.9	-170	33.9	-34.2	0	0	0	116.9
368	T	44.3	Very low	44.6	Very low	107 Å²	107	126 Å²	126	66%	0.656	68%	0.683	S	S	*	*			trans	-143.7	108.3	-178.4	45.2	0	0	0	0	114.2
369	T	32.4	Very low	43.1	Very low	137 Å²	137	129.9 Å²	129.9	84%	0.84	70%	0.7	S	S	*	*			trans	175.5	145.1	137.9	-63.5	0	0	0	0	110.2
370	P	39	Very low	41.9	Very low	111 Å²	111	131.6 Å²	131.6	72%	0.721	71%	0.711	S	S	*	*			trans	-77.6	165.9	-170.5	-7.2	25.1	0	0	0	114.9
371	P	44.4	Very low	40.5	Very low	138 Å²	138	132.7 Å²	132.7	90%	0.896	72%	0.723	S	S	*	*			trans	-86.4	125.5	-160.9	34.1	-31.7	0	0	0	112.5
372	G	32.5	Very low	38.8	Very low	69 Å²	69	134.2 Å²	134.2	71%	0.711	74%	0.74	S	S	*	*			trans	-152	102.3	169.8	0	0	0	0	0	110.4
373	N	42	Very low	38.1	Very low	163 Å²	163	132.6 Å²	132.6	87%	0.872	74%	0.743	S	S	*	*			trans	42.9	103	161.8	-74	-2.6	0	0	0	118.7
374	S	34.9	Very low	37	Very low	118 Å²	118	137.9 Å²	137.9	83%	0.825	76%	0.755	S	S	*	*			trans	-165	108	138.8	-65.9	0	0	0	0	110.2
375	E	36.7	Very low	35.8	Very low	182 Å²	182	138.7 Å²	138.7	85%	0.85	77%	0.771	S	S	*	*			trans	39.1	89.4	144.8	-61.6	-175.5	135.9	0	0	119.2	H377	E375-H377 PolarHBondContact O-N 3.24Å
376	R	31	Very low	35	Very low	214 Å²	214	138.1 Å²	138.1	81%	0.808	77%	0.772	S	S	*	*			trans	-84.1	94.4	163	-147.3	179.6	-160.2	-159.8	6.2	109.1	Q378	R376-Q378 PolarHBondContact O-N 3.11Å
377	H	35.6	Very low	34.7	Very low	182 Å²	182	138.9 Å²	138.9	84%	0.843	78%	0.776	S	S	*	*			trans	-64.3	110.9	156	-87.8	-93.7	0	0	0	108.1	E375	E375-H377 PolarHBondContact O-N 3.24Å
378	Q	30.9	Very low	34.5	Very low	152 Å²	152	137.4 Å²	137.4	71%	0.71	77%	0.767	S	S	*	*			trans	-117.6	125.2	167.7	-140.6	172.2	29.4	0	0	108.8	R376	R376-Q378 PolarHBondContact O-N 3.11Å
379	E	28.1	Very low	34.3	Very low	144 Å²	144	143.1 Å²	143.1	67%	0.673	78%	0.778	S	S	*	*			trans	-74	133.9	175.3	-67.1	-173.9	118.2	0	0	112.4
380	K	34.6	Very low	34.6	Very low	185 Å²	185	144.1 Å²	144.1	80%	0.804	78%	0.778	S	S	*	*			trans	57.9	172.3	134.2	-78	175.3	177.4	166.4	0	119
381	P	34.8	Very low	35	Very low	110 Å²	110	142.2 Å²	142.2	71%	0.714	77%	0.767	S	S	*	*			cis	-137	-176.3	-3.2	30.5	-5.6	0	0	0	115.3
382	S	26.6	Very low	35.4	Very low	97 Å²	97	142.9 Å²	142.9	68%	0.678	76%	0.759	S	S	*	*			trans	12.2	121.7	152.1	58.8	0	0	0	0	122.3
383	S	38.6	Very low	36.5	Very low	98 Å²	98	144.9 Å²	144.9	69%	0.685	75%	0.748	S	S	*	*			trans	48.9	124.9	134	68.7	0	0	0	0	122.2
384	F	28.8	Very low	37.5	Very low	201 Å²	201	139.4 Å²	139.4	88%	0.882	72%	0.718	S	S	*	*			trans	80.1	99.2	161	-69.6	-80.2	0	0	0	119.2
385	S	25.5	Very low	38.9	Very low	109 Å²	109	134 Å²	134	76%	0.762	68%	0.68	S	S	*	*				167.3	100.4	116.5	50.7	0	0	0	0	108.1
386	T	30.4	Very low	40.7	Very low	125 Å²	125	125.3 Å²	125.3	77%	0.767	64%	0.639	S	S	*	*				62.5	98.5	109.1	-44.5	0	0	0	0	112.5
387	D	30.8	Very low	43	Very low	153 Å²	153	116.5 Å²	116.5	82%	0.818	61%	0.607	S	S	*	*				-159.9	153	111.6	-101.8	-19.9	0	0	0	112.7
388	P	43.2	Very low	45.2	Very low	90 Å²	90	107.8 Å²	107.8	58%	0.584	57%	0.567	S	S	*	*			trans	-93.4	170.3	-159.4	38.1	-33.9	0	0	0	111.4
389	Y	40.6	Very low	47.4	Very low	227 Å²	227	106 Å²	106	89%	0.89	55%	0.554	S	S	*	*			trans	88	121.9	-175.2	-61.7	-87.4	0	0	0	113.7
390	D	37.3	Very low	49.4	Very low	159 Å²	159	103.7 Å²	103.7	85%	0.85	55%	0.546	S	S	*	.	S	Bend	trans	87.2	73.7	166.5	-113.9	14.7	0	0	0	117.7
391	S	47.8	Very low	51.4	Low	70 Å²	70	95.2 Å²	95.2	49%	0.49	51%	0.509	S	S	.	.				180	75	127	-71.5	0	0	0	0	110.4	K393	S391-K393 VanDerWaalsContact C-N 3.35Å; S391-K393 PolarHBondContact O-N 3.4Å
392	E	53.6	Low	53.2	Low	153 Å²	153	90.9 Å²	90.9	72%	0.715	48%	0.481	S	S	*	.			trans	-79.5	-1.5	-173.6	-77.3	-176	162.4	0	0	115.3	T470	E392-T470 HydrophobicContact CB-CG2 4.44Å; E392-T470 WeakPolarHBondContact O-CA 3.46Å; E392-T470 VanDerWaalsContact O-CB 3.22Å; E392-T470 WeakPolarHBondContact O-CB 3.47Å; E392-T470 VanDerWaalsContact O-CG2 3.26Å; E392-T470 WeakPolarHBondContact O-CG2 3.45Å
393	K	54.8	Low	55.1	Low	110 Å²	110	94.3 Å²	94.3	48%	0.478	48%	0.484	S	S	.	.			trans	-129.5	45.1	-172.4	-63.1	-177.6	-174.6	171.3	0	115.4	S391 E445 A448	S391-K393 VanDerWaalsContact C-N 3.35Å; S391-K393 PolarHBondContact O-N 3.4Å; K393-E445 HydrophobicContact CB-CG 4.19Å; K393-A448 VanDerWaalsContact O-CB 3.26Å; K393-A448 WeakPolarHBondContact O-CB 3.43Å
394	I	64	Low	56.5	Low	48 Å²	48	95.5 Å²	95.5	25%	0.246	48%	0.483	C	S	.	.			trans	-88.2	-6.8	179.2	-59.5	177.6	0	0	0	113	F442	I394-F442 HydrophobicContact CG2-CB 4.45Å; I394-F442 WeakPolarHBondContact CG2-O 3.25Å; I394-F442 WeakPolarHBondContact O-CB 3.4Å; I394-F442 PolarHBondContact O-N 2.97Å
395	C	64.3	Low	58.6	Low	4 Å²	4	86.5 Å²	86.5	3%	0.027	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	140.6	-173.9	-49.8	0	0	0	0	111.8	V440 C468 V469	C395-V440 WeakPolarHBondContact CA-O 3.04Å; C395-C468 CarbonylContact O-C 3.54Å; C395-C468 WeakPolarHBondContact O-CA 3.23Å; C395-V469 WeakPolarHBondContact CB-O 3.45Å; C395-V469 PolarHBondContact O-N 3.28Å; C395-V469 VanDerWaalsContact O-O 3.09Å
396	A	74.4	Confident	60.9	Low	0 Å²	0	88.8 Å²	88.8	0%	0	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.4	166.4	0	0	0	0	0	111.5	V440 F442 V466 K467	A396-V440 PolarHBondContact N-O 3.23Å; A396-V440 PolarHBondContact O-N 2.93Å; A396-F442 HydrophobicContact CB-CD2 4.21Å; A396-F442 HydrophobicContact CB-CE2 3.44Å; A396-F442 VanDerWaalsContact CB-CE2 3.44Å; A396-F442 HydrophobicContact CB-CZ 4.31Å; A396-V466 HydrophobicContact CB-CG1 3.8Å; A396-K467 CarbonylContact C-O 3.57Å; A396-K467 WeakPolarHBondContact CA-O 3.36Å
397	F	79.4	Confident	63	Low	29 Å²	29	86.9 Å²	86.9	13%	0.127	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	124.1	169.8	179.7	-107.6	0	0	0	109.5	R399 L427 Q437 L439 V466 K467 V469	F397-R399 HydrophobicContact CE1-CB 3.97Å; F397-L427 HydrophobicContact CE2-CD1 3.9Å; F397-Q437 HydrophobicContact CE2-CB 4.19Å; F397-Q437 HydrophobicContact CZ-CB 4.13Å; F397-Q437 HydrophobicContact CZ-CG 4.09Å; F397-L439 HydrophobicContact CB-CD2 4.21Å; F397-L439 HydrophobicContact CD2-CD2 3.68Å; F397-L439 HydrophobicContact CD2-CG 4.14Å; F397-L439 HydrophobicContact CG-CD2 4.44Å; F397-V466 CarbonylContact O-C 3.58Å; F397-K467 PolarHBondContact N-O 3.07Å; F397-K467 PolarHBondContact O-N 2.85Å; F397-V469 HydrophobicContact CB-CB 4.16Å; F397-V469 HydrophobicContact CB-CG2 3.45Å; F397-V469 VanDerWaalsContact CB-CG2 3.45Å; F397-V469 HydrophobicContact CG-CG2 4.37Å
398	V	80.5	Confident	65.1	Low	0 Å²	0	83.8 Å²	83.8	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	124.5	-177.2	-168.8	0	0	0	0	108.1	L401 F414 Q437 A438 V440 V464 G465 V466	V398-L401 HydrophobicContact CB-CD1 4.15Å; V398-L401 HydrophobicContact CG1-CD1 3.74Å; V398-L401 HydrophobicContact CG1-CD2 3.91Å; V398-L401 HydrophobicContact CG1-CG 3.82Å; V398-F414 HydrophobicContact CG2-CE2 3.77Å; V398-F414 HydrophobicContact CG2-CZ 3.63Å; V398-Q437 CarbonylContact O-C 3.53Å; V398-Q437 VanDerWaalsContact O-CA 3.3Å; V398-Q437 WeakPolarHBondContact O-CA 3.44Å; V398-A438 HydrophobicContact CB-CB 4.43Å; V398-A438 PolarHBondContact N-O 3.04Å; V398-A438 PolarHBondContact O-N 3.27Å; V398-V440 HydrophobicContact CG2-CG2 4.06Å; V398-V464 HydrophobicContact CG1-CG1 3.28Å; V398-G465 CarbonylContact C-O 3.57Å; V398-G465 WeakPolarHBondContact CA-O 3.4Å; V398-V466 HydrophobicContact CG1-CG2 4.41Å
399	R	77.7	Confident	66.7	Low	115 Å²	115	81.4 Å²	81.4	43%	0.434	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	158.8	-177.9	65.6	176.2	-167.1	167.1	8.1	110.7	F397 L401 G436 G465	F397-R399 HydrophobicContact CE1-CB 3.97Å; R399-L401 VanDerWaalsContact C-N 3.31Å; R399-G436 CarbonylContact C-O 3.54Å; R399-G465 WeakPolarHBondContact CG-O 3.45Å; R399-G465 PolarHBondContact N-O 3.21Å; R399-G465 PolarHBondContact O-N 2.99Å
400	N	70.6	Confident	68.3	Low	95 Å²	95	70.6 Å²	70.6	51%	0.508	34%	0.342	S	S	.	.	S	Bend	trans	64.8	35.8	178.4	-158	43.4	0	0	0	113	G436 E463	N400-G436 PolarHBondContact N-O 3.49Å; N400-E463 WeakPolarHBondContact CB-O 3.4Å; N400-E463 PolarHBondContact ND2-O 3.48Å
401	L	76.9	Confident	70	Confident	7 Å²	7	65.1 Å²	65.1	4%	0.037	31%	0.312	C	S	.	.			trans	-78.9	151	166.3	-64.5	165.3	0	0	0	109.6	V398 R399 V405 I410 G436 A438 F459 V464	V398-L401 HydrophobicContact CB-CD1 4.15Å; V398-L401 HydrophobicContact CG1-CD1 3.74Å; V398-L401 HydrophobicContact CG1-CD2 3.91Å; V398-L401 HydrophobicContact CG1-CG 3.82Å; R399-L401 VanDerWaalsContact C-N 3.31Å; L401-V405 HydrophobicContact CB-CB 4.19Å; L401-V405 HydrophobicContact CB-CG1 3.79Å; L401-V405 HydrophobicContact CB-CG2 4.36Å; L401-V405 HydrophobicContact CD1-CG1 4.19Å; L401-V405 HydrophobicContact CD2-CG2 4.37Å; L401-I410 HydrophobicContact CD1-CD1 3.91Å; L401-I410 HydrophobicContact CD1-CG1 4.05Å; L401-G436 PolarHBondContact N-O 2.76Å; L401-G436 WeakPolarHBondContact O-CA 3.1Å; L401-A438 HydrophobicContact CD1-CB 3.65Å; L401-F459 HydrophobicContact CD2-CD1 4.34Å; L401-V464 HydrophobicContact CD2-CG1 3.89Å; L401-V464 HydrophobicContact CD2-CG2 3.78Å
402	P	70.6	Confident	71.1	Confident	18 Å²	18	66.7 Å²	66.7	12%	0.117	32%	0.315	C	S	.	.			trans	-55	148.6	170.8	-23.9	34	0	0	0	112.4	D404 V405 L460	P402-D404 WeakPolarHBondContact CB-OD1 3.12Å; P402-D404 PolarHBondContact O-N 3.29Å; P402-V405 VanDerWaalsContact O-CB 3.25Å; P402-V405 WeakPolarHBondContact O-CB 3.16Å; P402-V405 WeakPolarHBondContact O-CG1 3.4Å; P402-V405 PolarHBondContact O-N 3Å; P402-V405 VanDerWaalsContact O-N 3.11Å; P402-L460 HydrophobicContact CG-CB 3.98Å; P402-L460 HydrophobicContact CG-CD1 4.2Å
403	F	67.1	Low	72.1	Confident	169 Å²	169	59.8 Å²	59.8	74%	0.741	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-21.1	-177.8	-58.4	-82.4	0	0	0	113.4	G434	F403-G434 VanDerWaalsContact CD1-O 3.28Å; F403-G434 WeakPolarHBondContact CD1-O 3.34Å
404	D	68.3	Low	72.8	Confident	124 Å²	124	54.7 Å²	54.7	66%	0.663	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	8	177.6	60.1	-24.4	0	0	0	113.5	P402 R406	P402-D404 WeakPolarHBondContact CB-OD1 3.12Å; P402-D404 PolarHBondContact O-N 3.29Å; D404-R406 PolarHBondContact O-N 3.28Å
405	V	71.9	Confident	72.6	Confident	11 Å²	11	60.1 Å²	60.1	7%	0.067	29%	0.285	C	S	.	.			trans	-61.9	129	-177.2	74.1	0	0	0	0	111.6	L401 P402 E409 I410 I426 F459	L401-V405 HydrophobicContact CB-CB 4.19Å; L401-V405 HydrophobicContact CB-CG1 3.79Å; L401-V405 HydrophobicContact CB-CG2 4.36Å; L401-V405 HydrophobicContact CD1-CG1 4.19Å; L401-V405 HydrophobicContact CD2-CG2 4.37Å; P402-V405 VanDerWaalsContact O-CB 3.25Å; P402-V405 WeakPolarHBondContact O-CB 3.16Å; P402-V405 WeakPolarHBondContact O-CG1 3.4Å; P402-V405 PolarHBondContact O-N 3Å; P402-V405 VanDerWaalsContact O-N 3.11Å; V405-E409 WeakPolarHBondContact CA-OE2 3.14Å; V405-E409 HydrophobicContact CG2-CB 4.07Å; V405-I410 HydrophobicContact CG1-CD1 4.4Å; V405-I410 HydrophobicContact CG2-CD1 4.26Å; V405-I410 HydrophobicContact CG2-CG1 3.79Å; V405-I426 WeakPolarHBondContact O-CD1 3.31Å; V405-F459 HydrophobicContact CG2-CE1 4.32Å
406	R	74.4	Confident	72.4	Confident	157 Å²	157	63.4 Å²	63.4	59%	0.592	32%	0.319	S	S	*	.			trans	-99.3	159.1	176.3	-64.6	179.2	-63.6	154.1	3.8	111.3	D404 V408 E409 I410	D404-R406 PolarHBondContact O-N 3.28Å; R406-V408 PolarHBondContact O-N 3.23Å; R406-E409 IonicContact CZ-OE1 2.94Å; R406-E409 PolarHBondContact N-OE2 2.88Å; R406-E409 IonicContact NE-OE1 2.83Å; R406-E409 PolarHBondContact NE-OE1 3.46Å; R406-E409 IonicContact NH2-OE1 2.98Å; R406-E409 PolarHBondContact NH2-OE1 3.2Å; R406-E409 WeakPolarHBondContact O-CB 3.37Å; R406-E409 PolarHBondContact O-N 3.29Å; R406-I410 PolarHBondContact O-N 3.26Å
407	K	75.4	Confident	72	Confident	86 Å²	86	64.9 Å²	64.9	37%	0.374	33%	0.326	S	S	.	.	H	α-helix	trans	-56.5	-37.9	178.6	-65.7	-175.2	179.9	-175.9	0	112.2	E409 I410 I411 E421 I426	K407-E409 VanDerWaalsContact C-N 3.31Å; K407-E409 PolarHBondContact O-N 3.47Å; K407-I410 PolarHBondContact O-N 3.37Å; K407-I411 VanDerWaalsContact O-CG1 3.28Å; K407-I411 WeakPolarHBondContact O-CG1 3.41Å; K407-I411 PolarHBondContact O-N 3.28Å; K407-E421 HydrophobicContact CB-CG 4.13Å; K407-E421 HydrophobicContact CD-CG 4.06Å; K407-I426 HydrophobicContact CB-CD1 4.45Å; K407-I426 HydrophobicContact CG-CD1 3.66Å; K407-I426 HydrophobicContact CG-CG1 4.12Å
408	V	74.8	Confident	71.2	Confident	88 Å²	88	69 Å²	69	53%	0.533	35%	0.349	S	S	.	.	H	α-helix	trans	-60.8	-38.4	177	-175.6	0	0	0	0	112.1	R406 I411 D412	R406-V408 PolarHBondContact O-N 3.23Å; V408-I411 PolarHBondContact O-N 3.16Å; V408-D412 PolarHBondContact O-N 2.55Å
409	E	75.6	Confident	70.6	Confident	39 Å²	39	69.5 Å²	69.5	18%	0.182	35%	0.352	C	S	.	.	H	α-helix	trans	-71.8	-31.5	179.3	-73.4	156.3	-161.4	0	0	111.9	V405 R406 K407 D412 F413 F459	V405-E409 WeakPolarHBondContact CA-OE2 3.14Å; V405-E409 HydrophobicContact CG2-CB 4.07Å; R406-E409 IonicContact CZ-OE1 2.94Å; R406-E409 PolarHBondContact N-OE2 2.88Å; R406-E409 IonicContact NE-OE1 2.83Å; R406-E409 PolarHBondContact NE-OE1 3.46Å; R406-E409 IonicContact NH2-OE1 2.98Å; R406-E409 PolarHBondContact NH2-OE1 3.2Å; R406-E409 WeakPolarHBondContact O-CB 3.37Å; R406-E409 PolarHBondContact O-N 3.29Å; K407-E409 VanDerWaalsContact C-N 3.31Å; K407-E409 PolarHBondContact O-N 3.47Å; E409-D412 PolarHBondContact O-N 3.22Å; E409-F413 PolarHBondContact O-N 3.43Å; E409-F459 HydrophobicContact CB-CE1 4.22Å; E409-F459 HydrophobicContact CB-CZ 3.9Å; E409-F459 VanDerWaalsContact O-CZ 3.25Å; E409-F459 WeakPolarHBondContact O-CZ 3.43Å
410	I	74	Confident	69.9	Low	1 Å²	1	66.6 Å²	66.6	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-71.7	-39.4	173.4	-61.3	167	0	0	0	110.4	L401 V405 R406 K407 D412 F413 F414 V424 I426 A438 V440	L401-I410 HydrophobicContact CD1-CD1 3.91Å; L401-I410 HydrophobicContact CD1-CG1 4.05Å; V405-I410 HydrophobicContact CG1-CD1 4.4Å; V405-I410 HydrophobicContact CG2-CD1 4.26Å; V405-I410 HydrophobicContact CG2-CG1 3.79Å; R406-I410 PolarHBondContact O-N 3.26Å; K407-I410 PolarHBondContact O-N 3.37Å; I410-D412 VanDerWaalsContact C-N 3.28Å; I410-D412 PolarHBondContact O-N 3.35Å; I410-F413 WeakPolarHBondContact O-CB 3.24Å; I410-F413 PolarHBondContact O-N 3.08Å; I410-F414 HydrophobicContact CG2-CD2 3.95Å; I410-F414 HydrophobicContact CG2-CE2 3.89Å; I410-F414 WeakPolarHBondContact O-CD2 3.26Å; I410-F414 PolarHBondContact O-N 3.15Å; I410-V424 HydrophobicContact CB-CG1 3.99Å; I410-V424 HydrophobicContact CD1-CG1 3.93Å; I410-V424 HydrophobicContact CG2-CG1 3.73Å; I410-V424 HydrophobicContact CG2-CG2 4.48Å; I410-I426 HydrophobicContact CD1-CD1 3.81Å; I410-I426 HydrophobicContact CD1-CG1 3.59Å; I410-A438 HydrophobicContact CD1-CB 3.54Å; I410-V440 HydrophobicContact CG2-CG2 3.83Å
411	I	74.9	Confident	69.6	Low	44 Å²	44	67.1 Å²	67.1	23%	0.226	35%	0.347	C	S	.	.	H	α-helix	trans	-62.6	-39.2	174.3	-63.5	162.7	0	0	0	110.3	K407 V408 F414 H415 E421 V424	K407-I411 VanDerWaalsContact O-CG1 3.28Å; K407-I411 WeakPolarHBondContact O-CG1 3.41Å; K407-I411 PolarHBondContact O-N 3.28Å; V408-I411 PolarHBondContact O-N 3.16Å; I411-F414 CarbonylContact O-C 3.53Å; I411-F414 VanDerWaalsContact O-C 3.26Å; I411-F414 PolarHBondContact O-N 3.21Å; I411-H415 PolarHBondContact O-N 2.98Å; I411-H415 VanDerWaalsContact O-N 3.11Å; I411-E421 HydrophobicContact CD1-CB 3.65Å; I411-E421 HydrophobicContact CD1-CG 4.02Å; I411-V424 HydrophobicContact CG1-CG2 4.05Å
412	D	71	Confident	69	Low	103 Å²	103	72.7 Å²	72.7	55%	0.551	38%	0.376	S	S	*	.	H	α-helix	trans	-65.1	-39.4	174.6	-170.2	59.8	0	0	0	112.5	V408 E409 I410 F414 H415	V408-D412 PolarHBondContact O-N 2.55Å; E409-D412 PolarHBondContact O-N 3.22Å; I410-D412 VanDerWaalsContact C-N 3.28Å; I410-D412 PolarHBondContact O-N 3.35Å; D412-F414 PolarHBondContact O-N 3.14Å; D412-H415 WeakPolarHBondContact O-CB 3.08Å; D412-H415 PolarHBondContact O-N 2.81Å; D412-H415 VanDerWaalsContact O-N 3.14Å
413	F	72.8	Confident	68.8	Low	8 Å²	8	76 Å²	76	4%	0.035	39%	0.387	C	S	.	.	H	α-helix	trans	-60.4	-30.6	173	-177.8	-94.9	0	0	0	112.7	E409 I410 L454 R457 F459 V464 V466	E409-F413 PolarHBondContact O-N 3.43Å; I410-F413 WeakPolarHBondContact O-CB 3.24Å; I410-F413 PolarHBondContact O-N 3.08Å; F413-L454 HydrophobicContact CE1-CB 3.91Å; F413-L454 HydrophobicContact CE1-CD1 4.1Å; F413-L454 HydrophobicContact CZ-CB 3.85Å; F413-R457 HydrophobicContact CE2-CB 4.04Å; F413-R457 HydrophobicContact CE2-CG 4.44Å; F413-R457 HydrophobicContact CZ-CB 4.22Å; F413-F459 HydrophobicContact CB-CD2 4.26Å; F413-F459 HydrophobicContact CB-CE2 4.06Å; F413-F459 HydrophobicContact CB-CZ 4.45Å; F413-F459 HydrophobicContact CD2-CB 4.03Å; F413-F459 AromaticContact CD2-CD2 3.64Å; F413-F459 HydrophobicContact CD2-CD2 3.64Å; F413-F459 HydrophobicContact CD2-CE2 4.29Å; F413-F459 AromaticContact CD2-CG 3.92Å; F413-F459 HydrophobicContact CD2-CG 3.92Å; F413-F459 HydrophobicContact CE2-CB 4.18Å; F413-F459 HydrophobicContact CG-CD2 4.41Å; F413-V464 HydrophobicContact CE1-CG1 4.21Å; F413-V464 HydrophobicContact CE2-CB 4.11Å; F413-V464 HydrophobicContact CE2-CG1 4.34Å; F413-V464 HydrophobicContact CE2-CG2 4.37Å; F413-V464 HydrophobicContact CZ-CB 4.04Å; F413-V464 HydrophobicContact CZ-CG1 3.94Å; F413-V466 HydrophobicContact CE1-CG2 3.77Å; F413-V466 HydrophobicContact CZ-CG2 4.22Å
414	F	71.2	Confident	69.2	Low	2 Å²	2	68 Å²	68	1%	0.009	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	24.5	177	-65.7	-69.9	0	0	0	113.5	V398 I410 I411 D412 G416 F417 V419 V440 F442 A451 L454 V466	V398-F414 HydrophobicContact CG2-CE2 3.77Å; V398-F414 HydrophobicContact CG2-CZ 3.63Å; I410-F414 HydrophobicContact CG2-CD2 3.95Å; I410-F414 HydrophobicContact CG2-CE2 3.89Å; I410-F414 WeakPolarHBondContact O-CD2 3.26Å; I410-F414 PolarHBondContact O-N 3.15Å; I411-F414 CarbonylContact O-C 3.53Å; I411-F414 VanDerWaalsContact O-C 3.26Å; I411-F414 PolarHBondContact O-N 3.21Å; D412-F414 PolarHBondContact O-N 3.14Å; F414-G416 PolarHBondContact O-N 3.18Å; F414-F417 HydrophobicContact CB-CD2 4.03Å; F414-F417 AromaticContact CD1-CD2 3.86Å; F414-F417 HydrophobicContact CD1-CD2 3.86Å; F414-F417 HydrophobicContact CD1-CE2 4.26Å; F414-F417 HydrophobicContact CG-CD2 4.43Å; F414-F417 PolarHBondContact O-N 3.33Å; F414-V419 HydrophobicContact CB-CG2 4.32Å; F414-V440 HydrophobicContact CD2-CG1 4.48Å; F414-V440 HydrophobicContact CD2-CG2 4.22Å; F414-V440 HydrophobicContact CE2-CB 4.49Å; F414-V440 HydrophobicContact CE2-CG2 3.78Å; F414-F442 HydrophobicContact CD1-CE1 4.16Å; F414-F442 AromaticContact CD1-CZ 3.82Å; F414-F442 HydrophobicContact CD1-CZ 3.82Å; F414-F442 AromaticContact CE1-CZ 3.9Å; F414-F442 HydrophobicContact CE1-CZ 3.9Å; F414-F442 HydrophobicContact CG-CE1 4.48Å; F414-F442 HydrophobicContact CG-CZ 4.23Å; F414-F442 HydrophobicContact CZ-CZ 4.37Å; F414-A451 HydrophobicContact CD1-CB 4.17Å; F414-A451 HydrophobicContact CE1-CB 3.79Å; F414-L454 HydrophobicContact CD1-CD1 3.96Å; F414-L454 HydrophobicContact CE1-CD1 4.15Å; F414-V466 HydrophobicContact CE1-CG1 4.41Å; F414-V466 HydrophobicContact CE1-CG2 4.41Å; F414-V466 HydrophobicContact CZ-CG1 4.31Å; F414-V466 HydrophobicContact CZ-CG2 4.13Å
415	H	59.4	Low	69.5	Low	163 Å²	163	68 Å²	68	76%	0.755	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	65.4	-176	-169	81.5	0	0	0	114.7	I411 D412	I411-H415 PolarHBondContact O-N 2.98Å; I411-H415 VanDerWaalsContact O-N 3.11Å; D412-H415 WeakPolarHBondContact O-CB 3.08Å; D412-H415 PolarHBondContact O-N 2.81Å; D412-H415 VanDerWaalsContact O-N 3.14Å
416	G	58.8	Low	69.9	Low	73 Å²	73	68.6 Å²	68.6	75%	0.753	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	175.7	-17.1	-172.7	0	0	0	0	0	111.4	F414	F414-G416 PolarHBondContact O-N 3.18Å
417	F	67.4	Low	69.9	Low	31 Å²	31	62.9 Å²	62.9	14%	0.136	33%	0.326	C	S	.	.	S	Bend	trans	-99.2	145	166.4	-56.4	-71.4	0	0	0	109.3	F414 V419 F442 E447 E450 A451 L454	F414-F417 HydrophobicContact CB-CD2 4.03Å; F414-F417 AromaticContact CD1-CD2 3.86Å; F414-F417 HydrophobicContact CD1-CD2 3.86Å; F414-F417 HydrophobicContact CD1-CE2 4.26Å; F414-F417 HydrophobicContact CG-CD2 4.43Å; F414-F417 PolarHBondContact O-N 3.33Å; F417-V419 HydrophobicContact CB-CG2 3.75Å; F417-V419 PolarHBondContact O-N 3.26Å; F417-F442 HydrophobicContact CB-CD1 3.84Å; F417-F442 HydrophobicContact CB-CE1 3.58Å; F417-F442 HydrophobicContact CD1-CD1 4.42Å; F417-F442 HydrophobicContact CD1-CE1 4.29Å; F417-F442 HydrophobicContact CD2-CE1 4.15Å; F417-F442 HydrophobicContact CG-CD1 4.16Å; F417-F442 AromaticContact CG-CE1 3.71Å; F417-F442 HydrophobicContact CG-CE1 3.71Å; F417-E447 HydrophobicContact CD1-CB 3.74Å; F417-E447 HydrophobicContact CD1-CG 4.12Å; F417-E447 WeakPolarHBondContact CD1-O 3.24Å; F417-E447 HydrophobicContact CE1-CB 4.42Å; F417-E447 WeakPolarHBondContact CE1-O 3.36Å; F417-E450 HydrophobicContact CE1-CB 3.33Å; F417-E450 HydrophobicContact CE1-CG 4.42Å; F417-E450 WeakPolarHBondContact CE1-OE2 3.43Å; F417-E450 HydrophobicContact CZ-CB 3.53Å; F417-A451 HydrophobicContact CE2-CB 4.3Å; F417-A451 HydrophobicContact CZ-CB 4.39Å; F417-L454 HydrophobicContact CE2-CD1 3.79Å
418	N	61.6	Low	69.9	Low	115 Å²	115	64.2 Å²	64.2	62%	0.615	33%	0.333	S	S	*	.			trans	-76	59.5	179.1	-166.3	32.1	0	0	0	111.5
419	V	68.5	Low	69.8	Low	11 Å²	11	63 Å²	63	7%	0.067	32%	0.323	C	S	.	.			trans	-95.8	114	-177.7	179	0	0	0	0	108.9	F414 F417 V424 V440 F442	F414-V419 HydrophobicContact CB-CG2 4.32Å; F417-V419 HydrophobicContact CB-CG2 3.75Å; F417-V419 PolarHBondContact O-N 3.26Å; V419-V424 HydrophobicContact CG1-CG2 3.53Å; V419-V440 HydrophobicContact CB-CG1 4.36Å; V419-V440 HydrophobicContact CG1-CG1 3.46Å; V419-V440 VanDerWaalsContact CG1-CG1 3.46Å; V419-V440 HydrophobicContact CG2-CG1 3.89Å; V419-F442 HydrophobicContact CG2-CD1 3.5Å; V419-F442 HydrophobicContact CG2-CE1 3.28Å; V419-F442 HydrophobicContact CG2-CG 4.45Å; V419-F442 HydrophobicContact CG2-CZ 4.03Å
420	T	63.4	Low	68.9	Low	53 Å²	53	68.8 Å²	68.8	33%	0.325	35%	0.35	S	S	.	.			trans	-95.1	156.4	177.4	54	0	0	0	0	111.1	D422 R423	T420-D422 WeakPolarHBondContact CB-OD1 2.98Å; T420-D422 PolarHBondContact O-N 2.81Å; T420-D422 PolarHBondContact OG1-OD1 3.23Å; T420-R423 WeakPolarHBondContact O-CB 3.46Å; T420-R423 PolarHBondContact O-N 2.9Å; T420-R423 WeakPolarHBondContact OG1-CD 3.33Å; T420-R423 WeakPolarHBondContact OG1-CG 3.42Å
421	E	63.1	Low	68.1	Low	107 Å²	107	76.2 Å²	76.2	50%	0.5	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-60.5	-29.1	-173.9	-170.7	179.3	179	0	0	114.2	K407 I411 R423 V424	K407-E421 HydrophobicContact CB-CG 4.13Å; K407-E421 HydrophobicContact CD-CG 4.06Å; I411-E421 HydrophobicContact CD1-CB 3.65Å; I411-E421 HydrophobicContact CD1-CG 4.02Å; E421-R423 PolarHBondContact O-N 2.79Å; E421-V424 PolarHBondContact O-N 3.39Å
422	D	64.7	Low	67.3	Low	123 Å²	123	76.8 Å²	76.8	66%	0.658	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-67.4	-19.4	174.4	59.9	-58.6	0	0	0	113.3	T420	T420-D422 WeakPolarHBondContact CB-OD1 2.98Å; T420-D422 PolarHBondContact O-N 2.81Å; T420-D422 PolarHBondContact OG1-OD1 3.23Å
423	R	66.8	Low	66.9	Low	88 Å²	88	77 Å²	77	33%	0.332	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-96.4	-0.6	179.9	-61.6	-175.8	-179.4	-173.4	-1.2	113.7	T420 E421 L441	T420-R423 WeakPolarHBondContact O-CB 3.46Å; T420-R423 PolarHBondContact O-N 2.9Å; T420-R423 WeakPolarHBondContact OG1-CD 3.33Å; T420-R423 WeakPolarHBondContact OG1-CG 3.42Å; E421-R423 PolarHBondContact O-N 2.79Å; R423-L441 HydrophobicContact CB-CB 4.14Å; R423-L441 WeakPolarHBondContact CB-O 3.49Å; R423-L441 PolarHBondContact O-N 3.19Å
424	V	75.9	Confident	66.6	Low	1 Å²	1	77.1 Å²	77.1	1%	0.006	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	117.5	178.4	-177.9	0	0	0	0	110.3	I410 I411 V419 E421 L439 V440	I410-V424 HydrophobicContact CB-CG1 3.99Å; I410-V424 HydrophobicContact CD1-CG1 3.93Å; I410-V424 HydrophobicContact CG2-CG1 3.73Å; I410-V424 HydrophobicContact CG2-CG2 4.48Å; I411-V424 HydrophobicContact CG1-CG2 4.05Å; V419-V424 HydrophobicContact CG1-CG2 3.53Å; E421-V424 PolarHBondContact O-N 3.39Å; V424-L439 WeakPolarHBondContact CA-O 3.48Å; V424-V440 HydrophobicContact CG1-CG2 4.38Å; V424-V440 HydrophobicContact CG2-CG1 4.34Å; V424-V440 HydrophobicContact CG2-CG2 4.29Å
425	R	74.6	Confident	66.4	Low	125 Å²	125	79.6 Å²	79.6	47%	0.472	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	116	177	-65.1	-175.1	-176.8	167.9	1.7	110.2	A438 L439	R425-A438 CarbonylContact O-C 3.47Å; R425-A438 VanDerWaalsContact O-CA 3.32Å; R425-A438 WeakPolarHBondContact O-CA 2.88Å; R425-L439 HydrophobicContact CB-CB 4.35Å; R425-L439 PolarHBondContact N-O 3.29Å; R425-L439 PolarHBondContact O-N 3.38Å
426	I	79.1	Confident	66.9	Low	22 Å²	22	72 Å²	72	11%	0.113	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	128.6	174	-59.4	174.1	0	0	0	108.2	V405 K407 I410 H428 A438	V405-I426 WeakPolarHBondContact O-CD1 3.31Å; K407-I426 HydrophobicContact CB-CD1 4.45Å; K407-I426 HydrophobicContact CG-CD1 3.66Å; K407-I426 HydrophobicContact CG-CG1 4.12Å; I410-I426 HydrophobicContact CD1-CD1 3.81Å; I410-I426 HydrophobicContact CD1-CG1 3.59Å; I426-H428 PolarHBondContact O-CE1 2.9Å; I426-H428 VanDerWaalsContact O-CE1 3.31Å; I426-H428 PolarHBondContact O-ND1 2.55Å; I426-A438 HydrophobicContact CG1-CB 4.36Å
427	L	74.4	Confident	67.8	Low	37 Å²	37	72.1 Å²	72.1	19%	0.194	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	135.1	174.5	-65.2	171.5	0	0	0	108.9	F397 V435 Q437 L439	F397-L427 HydrophobicContact CE2-CD1 3.9Å; L427-V435 HydrophobicContact CB-CG2 3.71Å; L427-V435 WeakPolarHBondContact O-CG2 3.5Å; L427-V435 PolarHBondContact O-N 3.42Å; L427-Q437 HydrophobicContact CB-CB 4.22Å; L427-Q437 HydrophobicContact CD1-CB 4Å; L427-Q437 PolarHBondContact N-O 2.8Å; L427-L439 HydrophobicContact CD1-CD1 4.33Å; L427-L439 HydrophobicContact CD2-CD1 4.19Å; L427-L439 HydrophobicContact CG-CD1 4.42Å
428	H	76	Confident	68.3	Low	115 Å²	115	70.6 Å²	70.6	53%	0.532	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	144.2	179.1	-60.8	76.2	0	0	0	108.9	I426 N433	I426-H428 PolarHBondContact O-CE1 2.9Å; I426-H428 VanDerWaalsContact O-CE1 3.31Å; I426-H428 PolarHBondContact O-ND1 2.55Å; H428-N433 WeakPolarHBondContact CA-O 3.31Å
429	D	72.3	Confident	69	Low	61 Å²	61	65.2 Å²	65.2	33%	0.326	33%	0.33	S	S	.	.			trans	-66.5	165.7	172.5	-170.4	21.3	0	0	0	110.4	K431 G432 N433 V435	D429-K431 PolarHBondContact O-N 2.83Å; D429-G432 PolarHBondContact O-N 2.86Å; D429-N433 PolarHBondContact N-O 3.29Å; D429-V435 HydrophobicContact CB-CG1 3.6Å
430	H	57.3	Low	69.6	Low	161 Å²	161	64.7 Å²	64.7	75%	0.745	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-11.8	173.1	58.5	33	0	0	0	114.2
431	K	56.8	Low	70.2	Confident	158 Å²	158	64 Å²	64	69%	0.687	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	1.2	177.5	-81.1	164.3	-173.4	178.7	0	113.6	D429 N433	D429-K431 PolarHBondContact O-N 2.83Å; K431-N433 VanDerWaalsContact C-N 3.3Å; K431-N433 PolarHBondContact O-N 3.35Å
432	G	58.3	Low	70.8	Confident	55 Å²	55	59.2 Å²	59.2	57%	0.567	30%	0.298	S	S	*	.	S	Bend	trans	80.1	3.8	-178.9	0	0	0	0	0	115.1	D429	D429-G432 PolarHBondContact O-N 2.86Å
433	N	62	Low	71	Confident	107 Å²	107	55.6 Å²	55.6	57%	0.572	29%	0.29	S	S	*	.			trans	-84.6	136.7	174.5	-62.5	-32.8	0	0	0	109.9	H428 D429 K431 V435	H428-N433 WeakPolarHBondContact CA-O 3.31Å; D429-N433 PolarHBondContact N-O 3.29Å; K431-N433 VanDerWaalsContact C-N 3.3Å; K431-N433 PolarHBondContact O-N 3.35Å; N433-V435 PolarHBondContact O-N 2.94Å
434	G	67.3	Low	71.2	Confident	11 Å²	11	53.8 Å²	53.8	11%	0.113	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	122.7	177.6	0	0	0	0	0	110.7	F403 G436	F403-G434 VanDerWaalsContact CD1-O 3.28Å; F403-G434 WeakPolarHBondContact CD1-O 3.34Å; G434-G436 PolarHBondContact O-N 2.85Å; G434-G436 VanDerWaalsContact O-N 3.08Å
435	V	67.8	Low	71	Confident	55 Å²	55	57.2 Å²	57.2	33%	0.333	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	9.9	-176.2	-77.7	0	0	0	0	113.8	L427 D429 N433 Q437	L427-V435 HydrophobicContact CB-CG2 3.71Å; L427-V435 WeakPolarHBondContact O-CG2 3.5Å; L427-V435 PolarHBondContact O-N 3.42Å; D429-V435 HydrophobicContact CB-CG1 3.6Å; N433-V435 PolarHBondContact O-N 2.94Å; V435-Q437 HydrophobicContact CG2-CB 4.03Å; V435-Q437 HydrophobicContact CG2-CG 4.26Å; V435-Q437 PolarHBondContact O-N 3.28Å
436	G	68.1	Low	70.9	Confident	3 Å²	3	54 Å²	54	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	66.5	25.3	-173.7	0	0	0	0	0	113	R399 N400 L401 G434	R399-G436 CarbonylContact C-O 3.54Å; N400-G436 PolarHBondContact N-O 3.49Å; L401-G436 PolarHBondContact N-O 2.76Å; L401-G436 WeakPolarHBondContact O-CA 3.1Å; G434-G436 PolarHBondContact O-N 2.85Å; G434-G436 VanDerWaalsContact O-N 3.08Å
437	Q	77.6	Confident	70.7	Confident	75 Å²	75	55 Å²	55	35%	0.35	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	139.4	178.2	-59.9	179.1	-4.6	0	0	110.1	F397 V398 L427 V435	F397-Q437 HydrophobicContact CE2-CB 4.19Å; F397-Q437 HydrophobicContact CZ-CB 4.13Å; F397-Q437 HydrophobicContact CZ-CG 4.09Å; V398-Q437 CarbonylContact O-C 3.53Å; V398-Q437 VanDerWaalsContact O-CA 3.3Å; V398-Q437 WeakPolarHBondContact O-CA 3.44Å; L427-Q437 HydrophobicContact CB-CB 4.22Å; L427-Q437 HydrophobicContact CD1-CB 4Å; L427-Q437 PolarHBondContact N-O 2.8Å; V435-Q437 HydrophobicContact CG2-CB 4.03Å; V435-Q437 HydrophobicContact CG2-CG 4.26Å; V435-Q437 PolarHBondContact O-N 3.28Å
438	A	79	Confident	70.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	151.9	177.9	0	0	0	0	0	111.6	V398 L401 I410 R425 I426	V398-A438 HydrophobicContact CB-CB 4.43Å; V398-A438 PolarHBondContact N-O 3.04Å; V398-A438 PolarHBondContact O-N 3.27Å; L401-A438 HydrophobicContact CD1-CB 3.65Å; I410-A438 HydrophobicContact CD1-CB 3.54Å; R425-A438 CarbonylContact O-C 3.47Å; R425-A438 VanDerWaalsContact O-CA 3.32Å; R425-A438 WeakPolarHBondContact O-CA 2.88Å; I426-A438 HydrophobicContact CG1-CB 4.36Å
439	L	77.2	Confident	70.4	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	130.1	175	-74.3	160.8	0	0	0	108.4	F397 V424 R425 L427 M474	F397-L439 HydrophobicContact CB-CD2 4.21Å; F397-L439 HydrophobicContact CD2-CD2 3.68Å; F397-L439 HydrophobicContact CD2-CG 4.14Å; F397-L439 HydrophobicContact CG-CD2 4.44Å; V424-L439 WeakPolarHBondContact CA-O 3.48Å; R425-L439 HydrophobicContact CB-CB 4.35Å; R425-L439 PolarHBondContact N-O 3.29Å; R425-L439 PolarHBondContact O-N 3.38Å; L427-L439 HydrophobicContact CD1-CD1 4.33Å; L427-L439 HydrophobicContact CD2-CD1 4.19Å; L427-L439 HydrophobicContact CG-CD1 4.42Å; L439-M474 HydrophobicContact CB-CE 4.35Å; L439-M474 HydrophobicContact CD1-CE 4.25Å; L439-M474 HydrophobicContact CD1-CG 3.97Å; L439-M474 HydrophobicContact CD2-CG 4.2Å
440	V	80.1	Confident	70.4	Confident	0 Å²	0	56 Å²	56	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	124	179.3	-177.2	0	0	0	0	108.7	C395 A396 V398 I410 F414 V419 V424 F442	C395-V440 WeakPolarHBondContact CA-O 3.04Å; A396-V440 PolarHBondContact N-O 3.23Å; A396-V440 PolarHBondContact O-N 2.93Å; V398-V440 HydrophobicContact CG2-CG2 4.06Å; I410-V440 HydrophobicContact CG2-CG2 3.83Å; F414-V440 HydrophobicContact CD2-CG1 4.48Å; F414-V440 HydrophobicContact CD2-CG2 4.22Å; F414-V440 HydrophobicContact CE2-CB 4.49Å; F414-V440 HydrophobicContact CE2-CG2 3.78Å; V419-V440 HydrophobicContact CB-CG1 4.36Å; V419-V440 HydrophobicContact CG1-CG1 3.46Å; V419-V440 VanDerWaalsContact CG1-CG1 3.46Å; V419-V440 HydrophobicContact CG2-CG1 3.89Å; V424-V440 HydrophobicContact CG1-CG2 4.38Å; V424-V440 HydrophobicContact CG2-CG1 4.34Å; V424-V440 HydrophobicContact CG2-CG2 4.29Å; V440-F442 HydrophobicContact CB-CE2 3.91Å; V440-F442 HydrophobicContact CB-CZ 4.21Å; V440-F442 HydrophobicContact CG1-CD2 4.27Å; V440-F442 HydrophobicContact CG1-CE1 4.24Å; V440-F442 HydrophobicContact CG1-CE2 3.59Å; V440-F442 HydrophobicContact CG1-CZ 3.59Å
441	L	76.4	Confident	71.3	Confident	38 Å²	38	48.3 Å²	48.3	20%	0.199	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.5	170.1	-77.2	103.8	0	0	0	110.4	R423 M474	R423-L441 HydrophobicContact CB-CB 4.14Å; R423-L441 WeakPolarHBondContact CB-O 3.49Å; R423-L441 PolarHBondContact O-N 3.19Å; L441-M474 HydrophobicContact CD1-CE 3.59Å; L441-M474 HydrophobicContact CD1-SD 3.95Å; L441-M474 HydrophobicContact CG-SD 4.48Å
442	F	76.1	Confident	72.1	Confident	6 Å²	6	44.4 Å²	44.4	3%	0.026	27%	0.265	C	S	.	.			trans	-88.7	164.8	173.3	-65.7	-88.3	0	0	0	110.6	I394 A396 F414 F417 V419 V440 E447 A448 A451	I394-F442 HydrophobicContact CG2-CB 4.45Å; I394-F442 WeakPolarHBondContact CG2-O 3.25Å; I394-F442 WeakPolarHBondContact O-CB 3.4Å; I394-F442 PolarHBondContact O-N 2.97Å; A396-F442 HydrophobicContact CB-CD2 4.21Å; A396-F442 HydrophobicContact CB-CE2 3.44Å; A396-F442 VanDerWaalsContact CB-CE2 3.44Å; A396-F442 HydrophobicContact CB-CZ 4.31Å; F414-F442 HydrophobicContact CD1-CE1 4.16Å; F414-F442 AromaticContact CD1-CZ 3.82Å; F414-F442 HydrophobicContact CD1-CZ 3.82Å; F414-F442 AromaticContact CE1-CZ 3.9Å; F414-F442 HydrophobicContact CE1-CZ 3.9Å; F414-F442 HydrophobicContact CG-CE1 4.48Å; F414-F442 HydrophobicContact CG-CZ 4.23Å; F414-F442 HydrophobicContact CZ-CZ 4.37Å; F417-F442 HydrophobicContact CB-CD1 3.84Å; F417-F442 HydrophobicContact CB-CE1 3.58Å; F417-F442 HydrophobicContact CD1-CD1 4.42Å; F417-F442 HydrophobicContact CD1-CE1 4.29Å; F417-F442 HydrophobicContact CD2-CE1 4.15Å; F417-F442 HydrophobicContact CG-CD1 4.16Å; F417-F442 AromaticContact CG-CE1 3.71Å; F417-F442 HydrophobicContact CG-CE1 3.71Å; V419-F442 HydrophobicContact CG2-CD1 3.5Å; V419-F442 HydrophobicContact CG2-CE1 3.28Å; V419-F442 HydrophobicContact CG2-CG 4.45Å; V419-F442 HydrophobicContact CG2-CZ 4.03Å; V440-F442 HydrophobicContact CB-CE2 3.91Å; V440-F442 HydrophobicContact CB-CZ 4.21Å; V440-F442 HydrophobicContact CG1-CD2 4.27Å; V440-F442 HydrophobicContact CG1-CE1 4.24Å; V440-F442 HydrophobicContact CG1-CE2 3.59Å; V440-F442 HydrophobicContact CG1-CZ 3.59Å; F442-E447 HydrophobicContact CB-CB 3.94Å; F442-E447 HydrophobicContact CD1-CB 3.82Å; F442-E447 HydrophobicContact CG-CB 4.17Å; F442-A448 HydrophobicContact CB-CB 4.24Å; F442-A448 HydrophobicContact CD2-CB 3.93Å; F442-A448 HydrophobicContact CG-CB 4.19Å; F442-A451 HydrophobicContact CE1-CB 3.97Å; F442-A451 HydrophobicContact CE2-CB 4.07Å; F442-A451 HydrophobicContact CZ-CB 3.56Å
443	G	68.5	Low	72.8	Confident	47 Å²	47	46.5 Å²	46.5	49%	0.485	27%	0.271	S	S	.	.	S	Bend	trans	-81.2	-22.8	173	0	0	0	0	0	112.2	E447	G443-E447 WeakPolarHBondContact CA-OE2 3.25Å; G443-E447 PolarHBondContact N-OE2 3.45Å
444	S	70.9	Confident	73.3	Confident	50 Å²	50	43.1 Å²	43.1	35%	0.35	25%	0.253	S	S	.	.	S	Bend	trans	-139	150.5	-174.2	175.2	0	0	0	0	112	A446 E447 A448	S444-A446 VanDerWaalsContact C-N 3.27Å; S444-A446 PolarHBondContact O-N 3.33Å; S444-A446 PolarHBondContact OG-N 2.85Å; S444-E447 PolarHBondContact N-OE2 2.97Å; S444-E447 VanDerWaalsContact N-OE2 3.15Å; S444-E447 PolarHBondContact O-N 3.31Å; S444-A448 PolarHBondContact O-N 2.94Å
445	E	72.1	Confident	73.5	Confident	74 Å²	74	46.5 Å²	46.5	35%	0.346	27%	0.268	S	S	.	.	H	α-helix	trans	-63.2	-34.2	170.7	179	174.1	-166.1	0	0	111.8	K393 E447 A448 M449	K393-E445 HydrophobicContact CB-CG 4.19Å; E445-E447 VanDerWaalsContact C-N 3.33Å; E445-E447 PolarHBondContact O-N 3.03Å; E445-A448 PolarHBondContact O-N 2.81Å; E445-M449 WeakPolarHBondContact O-CB 3.32Å; E445-M449 PolarHBondContact O-N 3.24Å
446	A	71.4	Confident	73.3	Confident	56 Å²	56	46 Å²	46	46%	0.463	27%	0.274	S	S	.	.	H	α-helix	trans	-62.1	-42.7	177	0	0	0	0	0	111.3	S444 A448 M449 E450	S444-A446 VanDerWaalsContact C-N 3.27Å; S444-A446 PolarHBondContact O-N 3.33Å; S444-A446 PolarHBondContact OG-N 2.85Å; A446-A448 PolarHBondContact O-N 3.2Å; A446-M449 PolarHBondContact O-N 3.01Å; A446-E450 WeakPolarHBondContact O-CB 3.03Å; A446-E450 WeakPolarHBondContact O-CG 3.32Å; A446-E450 PolarHBondContact O-N 2.83Å
447	E	74.3	Confident	73.4	Confident	44 Å²	44	52.6 Å²	52.6	21%	0.206	30%	0.298	C	S	.	.	H	α-helix	trans	-63.6	-41.4	175.4	-67.2	175.5	159.4	0	0	111.4	F417 F442 G443 S444 E445 M449 E450 A451	F417-E447 HydrophobicContact CD1-CB 3.74Å; F417-E447 HydrophobicContact CD1-CG 4.12Å; F417-E447 WeakPolarHBondContact CD1-O 3.24Å; F417-E447 HydrophobicContact CE1-CB 4.42Å; F417-E447 WeakPolarHBondContact CE1-O 3.36Å; F442-E447 HydrophobicContact CB-CB 3.94Å; F442-E447 HydrophobicContact CD1-CB 3.82Å; F442-E447 HydrophobicContact CG-CB 4.17Å; G443-E447 WeakPolarHBondContact CA-OE2 3.25Å; G443-E447 PolarHBondContact N-OE2 3.45Å; S444-E447 PolarHBondContact N-OE2 2.97Å; S444-E447 VanDerWaalsContact N-OE2 3.15Å; S444-E447 PolarHBondContact O-N 3.31Å; E445-E447 VanDerWaalsContact C-N 3.33Å; E445-E447 PolarHBondContact O-N 3.03Å; E447-M449 VanDerWaalsContact C-N 3.33Å; E447-M449 PolarHBondContact O-N 2.94Å; E447-E450 PolarHBondContact O-N 2.87Å; E447-A451 WeakPolarHBondContact O-CB 3.43Å; E447-A451 PolarHBondContact O-N 3.43Å
448	A	73.8	Confident	72.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.1	-34.8	176.8	0	0	0	0	0	112.5	K393 F442 S444 E445 A446 L452 C468	K393-A448 VanDerWaalsContact O-CB 3.26Å; K393-A448 WeakPolarHBondContact O-CB 3.43Å; F442-A448 HydrophobicContact CB-CB 4.24Å; F442-A448 HydrophobicContact CD2-CB 3.93Å; F442-A448 HydrophobicContact CG-CB 4.19Å; S444-A448 PolarHBondContact O-N 2.94Å; E445-A448 PolarHBondContact O-N 2.81Å; A446-A448 PolarHBondContact O-N 3.2Å; A448-L452 PolarHBondContact O-N 2.84Å; A448-C468 PolarHBondContact O-SG 2.93Å
449	M	71.8	Confident	72.3	Confident	118 Å²	118	58.8 Å²	58.8	58%	0.581	32%	0.319	S	S	*	.	H	α-helix	trans	-74.2	-38.7	177.7	-168.7	175.5	-61.6	0	0	112	E445 A446 E447 A451 L452	E445-M449 WeakPolarHBondContact O-CB 3.32Å; E445-M449 PolarHBondContact O-N 3.24Å; A446-M449 PolarHBondContact O-N 3.01Å; E447-M449 VanDerWaalsContact C-N 3.33Å; E447-M449 PolarHBondContact O-N 2.94Å; M449-A451 VanDerWaalsContact C-N 3.32Å; M449-L452 VanDerWaalsContact O-CB 3.26Å; M449-L452 WeakPolarHBondContact O-CB 3.34Å; M449-L452 PolarHBondContact O-N 3.28Å
450	E	72.6	Confident	71.4	Confident	116 Å²	116	64.1 Å²	64.1	54%	0.542	35%	0.347	S	S	.	.	H	α-helix	trans	-66.6	-34.6	171.7	-76.6	-178.6	-172.6	0	0	111.5	F417 A446 E447 L452 S453	F417-E450 HydrophobicContact CE1-CB 3.33Å; F417-E450 HydrophobicContact CE1-CG 4.42Å; F417-E450 WeakPolarHBondContact CE1-OE2 3.43Å; F417-E450 HydrophobicContact CZ-CB 3.53Å; A446-E450 WeakPolarHBondContact O-CB 3.03Å; A446-E450 WeakPolarHBondContact O-CG 3.32Å; A446-E450 PolarHBondContact O-N 2.83Å; E447-E450 PolarHBondContact O-N 2.87Å; E450-L452 PolarHBondContact O-N 2.74Å; E450-S453 WeakPolarHBondContact O-CB 3.16Å; E450-S453 PolarHBondContact O-N 2.9Å; E450-S453 PolarHBondContact O-OG 2.8Å
451	A	75	Confident	70.5	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-62	-25.8	173	0	0	0	0	0	113.1	F414 F417 F442 E447 M449 S453 L454 V466	F414-A451 HydrophobicContact CD1-CB 4.17Å; F414-A451 HydrophobicContact CE1-CB 3.79Å; F417-A451 HydrophobicContact CE2-CB 4.3Å; F417-A451 HydrophobicContact CZ-CB 4.39Å; F442-A451 HydrophobicContact CE1-CB 3.97Å; F442-A451 HydrophobicContact CE2-CB 4.07Å; F442-A451 HydrophobicContact CZ-CB 3.56Å; E447-A451 WeakPolarHBondContact O-CB 3.43Å; E447-A451 PolarHBondContact O-N 3.43Å; M449-A451 VanDerWaalsContact C-N 3.32Å; A451-S453 PolarHBondContact O-N 2.83Å; A451-L454 WeakPolarHBondContact O-CB 3.44Å; A451-L454 PolarHBondContact O-N 2.98Å; A451-V466 WeakPolarHBondContact O-CG1 3.23Å
452	L	73.9	Confident	70	Confident	76 Å²	76	67.7 Å²	67.7	40%	0.398	39%	0.386	S	S	.	.	H	α-helix	trans	-65.8	-28.1	171.7	-171.1	66.2	0	0	0	112.2	A448 M449 E450 L454 N455 V466	A448-L452 PolarHBondContact O-N 2.84Å; M449-L452 VanDerWaalsContact O-CB 3.26Å; M449-L452 WeakPolarHBondContact O-CB 3.34Å; M449-L452 PolarHBondContact O-N 3.28Å; E450-L452 PolarHBondContact O-N 2.74Å; L452-L454 PolarHBondContact O-N 2.94Å; L452-N455 HydrophobicContact CD1-CB 4.48Å; L452-N455 WeakPolarHBondContact O-CB 3.36Å; L452-N455 PolarHBondContact O-N 3.33Å; L452-V466 VanDerWaalsContact CD1-O 3.28Å; L452-V466 WeakPolarHBondContact CD1-O 3.4Å
453	S	73.4	Confident	69.9	Low	98 Å²	98	72.1 Å²	72.1	69%	0.685	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.2	176.3	78.2	0	0	0	0	112.7	E450 A451 N455	E450-S453 WeakPolarHBondContact O-CB 3.16Å; E450-S453 PolarHBondContact O-N 2.9Å; E450-S453 PolarHBondContact O-OG 2.8Å; A451-S453 PolarHBondContact O-N 2.83Å; S453-N455 VanDerWaalsContact C-N 3.32Å
454	L	71.8	Confident	70.4	Confident	36 Å²	36	69.9 Å²	69.9	19%	0.188	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-0.9	174.9	-60.1	176.6	0	0	0	113.4	F413 F414 F417 A451 L452 G456 R457	F413-L454 HydrophobicContact CE1-CB 3.91Å; F413-L454 HydrophobicContact CE1-CD1 4.1Å; F413-L454 HydrophobicContact CZ-CB 3.85Å; F414-L454 HydrophobicContact CD1-CD1 3.96Å; F414-L454 HydrophobicContact CE1-CD1 4.15Å; F417-L454 HydrophobicContact CE2-CD1 3.79Å; A451-L454 WeakPolarHBondContact O-CB 3.44Å; A451-L454 PolarHBondContact O-N 2.98Å; L452-L454 PolarHBondContact O-N 2.94Å; L454-G456 PolarHBondContact O-N 2.92Å; L454-R457 VanDerWaalsContact O-CB 3.31Å; L454-R457 WeakPolarHBondContact O-CB 3.19Å; L454-R457 PolarHBondContact O-N 3.34Å
455	N	72.6	Confident	70.6	Confident	82 Å²	82	67.7 Å²	67.7	44%	0.439	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	124.2	177.1	-177.5	33	0	0	0	111.3	L452 S453 G465 V466	L452-N455 HydrophobicContact CD1-CB 4.48Å; L452-N455 WeakPolarHBondContact O-CB 3.36Å; L452-N455 PolarHBondContact O-N 3.33Å; S453-N455 VanDerWaalsContact C-N 3.32Å; N455-G465 VanDerWaalsContact OD1-CA 3.24Å; N455-G465 WeakPolarHBondContact OD1-CA 3.41Å; N455-V466 HydrophobicContact CB-CB 4.35Å; N455-V466 PolarHBondContact OD1-N 2.8Å; N455-V466 VanDerWaalsContact OD1-N 3.1Å; N455-V466 PolarHBondContact OD1-O 2.86Å
456	G	63.9	Low	70.9	Confident	44 Å²	44	64.2 Å²	64.2	45%	0.454	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.2	4.3	-177.7	0	0	0	0	0	114.3	L454 V464	L454-G456 PolarHBondContact O-N 2.92Å; G456-V464 WeakPolarHBondContact CA-O 3.12Å; G456-V464 PolarHBondContact N-O 3.01Å
457	R	69	Low	71	Confident	143 Å²	143	66 Å²	66	54%	0.54	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	135.3	174.5	-164.5	179.3	-170.5	-122.8	2.5	110.1	F413 L454 F459 V464	F413-R457 HydrophobicContact CE2-CB 4.04Å; F413-R457 HydrophobicContact CE2-CG 4.44Å; F413-R457 HydrophobicContact CZ-CB 4.22Å; L454-R457 VanDerWaalsContact O-CB 3.31Å; L454-R457 WeakPolarHBondContact O-CB 3.19Å; L454-R457 PolarHBondContact O-N 3.34Å; R457-F459 PolarHBondContact O-N 3.35Å; R457-V464 PolarHBondContact O-N 3.22Å
458	R	65.1	Low	70.8	Confident	183 Å²	183	66 Å²	66	69%	0.691	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	118	175.5	-74.5	-178.5	169.6	-160.9	-6.2	110.1	S462 E463	R458-S462 CarbonylContact C-O 3.36Å; R458-S462 WeakPolarHBondContact CA-O 3.36Å; R458-E463 HydrophobicContact CG-CG 3.63Å; R458-E463 IonicContact CZ-OE1 3.48Å; R458-E463 IonicContact NE-OE1 3.04Å; R458-E463 PolarHBondContact NE-OE1 3.39Å; R458-E463 IonicContact NH2-OE1 3.1Å; R458-E463 PolarHBondContact NH2-OE1 3.03Å
459	F	67.9	Low	70.4	Confident	21 Å²	21	66.7 Å²	66.7	9%	0.092	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.4	174.9	-172.3	-108.7	0	0	0	108.5	L401 V405 E409 F413 R457 G461 S462 V464	L401-F459 HydrophobicContact CD2-CD1 4.34Å; V405-F459 HydrophobicContact CG2-CE1 4.32Å; E409-F459 HydrophobicContact CB-CE1 4.22Å; E409-F459 HydrophobicContact CB-CZ 3.9Å; E409-F459 VanDerWaalsContact O-CZ 3.25Å; E409-F459 WeakPolarHBondContact O-CZ 3.43Å; F413-F459 HydrophobicContact CB-CD2 4.26Å; F413-F459 HydrophobicContact CB-CE2 4.06Å; F413-F459 HydrophobicContact CB-CZ 4.45Å; F413-F459 HydrophobicContact CD2-CB 4.03Å; F413-F459 AromaticContact CD2-CD2 3.64Å; F413-F459 HydrophobicContact CD2-CD2 3.64Å; F413-F459 HydrophobicContact CD2-CE2 4.29Å; F413-F459 AromaticContact CD2-CG 3.92Å; F413-F459 HydrophobicContact CD2-CG 3.92Å; F413-F459 HydrophobicContact CE2-CB 4.18Å; F413-F459 HydrophobicContact CG-CD2 4.41Å; R457-F459 PolarHBondContact O-N 3.35Å; F459-G461 PolarHBondContact O-N 3.23Å; F459-G461 VanDerWaalsContact O-N 3.08Å; F459-S462 PolarHBondContact N-O 3.47Å; F459-S462 PolarHBondContact O-N 3.42Å; F459-S462 VanDerWaalsContact O-O 3.06Å; F459-V464 HydrophobicContact CB-CB 4.5Å; F459-V464 HydrophobicContact CB-CG2 3.38Å; F459-V464 HydrophobicContact CD1-CG2 4.35Å; F459-V464 HydrophobicContact CG-CG2 4.23Å
460	L	58.7	Low	70.1	Confident	115 Å²	115	62.7 Å²	62.7	60%	0.602	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	37.2	-179.4	-59.6	174.5	0	0	0	113.8	P402 S462	P402-L460 HydrophobicContact CG-CB 3.98Å; P402-L460 HydrophobicContact CG-CD1 4.2Å; L460-S462 VanDerWaalsContact C-N 3.31Å; L460-S462 PolarHBondContact O-N 2.98Å
461	G	60.5	Low	69.4	Low	74 Å²	74	65.4 Å²	65.4	76%	0.763	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	-4.7	-179.3	0	0	0	0	0	115.8	F459	F459-G461 PolarHBondContact O-N 3.23Å; F459-G461 VanDerWaalsContact O-N 3.08Å
462	S	67	Low	68.4	Low	38 Å²	38	68.4 Å²	68.4	27%	0.266	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	140.9	176.9	-60.5	0	0	0	0	111.5	R458 F459 L460 V464	R458-S462 CarbonylContact C-O 3.36Å; R458-S462 WeakPolarHBondContact CA-O 3.36Å; F459-S462 PolarHBondContact N-O 3.47Å; F459-S462 PolarHBondContact O-N 3.42Å; F459-S462 VanDerWaalsContact O-O 3.06Å; L460-S462 VanDerWaalsContact C-N 3.31Å; L460-S462 PolarHBondContact O-N 2.98Å; S462-V464 PolarHBondContact O-N 3.46Å
463	E	74.6	Confident	67.6	Low	99 Å²	99	68.8 Å²	68.8	46%	0.463	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	105.3	177.5	-73.2	174.2	-169	0	0	109.8	N400 R458 G465	N400-E463 WeakPolarHBondContact CB-O 3.4Å; N400-E463 PolarHBondContact ND2-O 3.48Å; R458-E463 HydrophobicContact CG-CG 3.63Å; R458-E463 IonicContact CZ-OE1 3.48Å; R458-E463 IonicContact NE-OE1 3.04Å; R458-E463 PolarHBondContact NE-OE1 3.39Å; R458-E463 IonicContact NH2-OE1 3.1Å; R458-E463 PolarHBondContact NH2-OE1 3.03Å; E463-G465 PolarHBondContact O-N 2.64Å
464	V	77.3	Confident	67	Low	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	125.6	-175.3	178.4	0	0	0	0	109.5	V398 L401 F413 G456 R457 F459 S462 V466	V398-V464 HydrophobicContact CG1-CG1 3.28Å; L401-V464 HydrophobicContact CD2-CG1 3.89Å; L401-V464 HydrophobicContact CD2-CG2 3.78Å; F413-V464 HydrophobicContact CE1-CG1 4.21Å; F413-V464 HydrophobicContact CE2-CB 4.11Å; F413-V464 HydrophobicContact CE2-CG1 4.34Å; F413-V464 HydrophobicContact CE2-CG2 4.37Å; F413-V464 HydrophobicContact CZ-CB 4.04Å; F413-V464 HydrophobicContact CZ-CG1 3.94Å; G456-V464 WeakPolarHBondContact CA-O 3.12Å; G456-V464 PolarHBondContact N-O 3.01Å; R457-V464 PolarHBondContact O-N 3.22Å; F459-V464 HydrophobicContact CB-CB 4.5Å; F459-V464 HydrophobicContact CB-CG2 3.38Å; F459-V464 HydrophobicContact CD1-CG2 4.35Å; F459-V464 HydrophobicContact CG-CG2 4.23Å; S462-V464 PolarHBondContact O-N 3.46Å; V464-V466 HydrophobicContact CG1-CG2 4.28Å
465	G	75.2	Confident	66.1	Low	5 Å²	5	67 Å²	67	5%	0.052	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	121.9	174.2	0	0	0	0	0	110.6	V398 R399 N455 E463	V398-G465 CarbonylContact C-O 3.57Å; V398-G465 WeakPolarHBondContact CA-O 3.4Å; R399-G465 WeakPolarHBondContact CG-O 3.45Å; R399-G465 PolarHBondContact N-O 3.21Å; R399-G465 PolarHBondContact O-N 2.99Å; N455-G465 VanDerWaalsContact OD1-CA 3.24Å; N455-G465 WeakPolarHBondContact OD1-CA 3.41Å; E463-G465 PolarHBondContact O-N 2.64Å
466	V	78.3	Confident	65.1	Low	0 Å²	0	69.9 Å²	69.9	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	132.4	173.8	-172.9	0	0	0	0	108.3	A396 F397 V398 F413 F414 A451 L452 N455 V464	A396-V466 HydrophobicContact CB-CG1 3.8Å; F397-V466 CarbonylContact O-C 3.58Å; V398-V466 HydrophobicContact CG1-CG2 4.41Å; F413-V466 HydrophobicContact CE1-CG2 3.77Å; F413-V466 HydrophobicContact CZ-CG2 4.22Å; F414-V466 HydrophobicContact CE1-CG1 4.41Å; F414-V466 HydrophobicContact CE1-CG2 4.41Å; F414-V466 HydrophobicContact CZ-CG1 4.31Å; F414-V466 HydrophobicContact CZ-CG2 4.13Å; A451-V466 WeakPolarHBondContact O-CG1 3.23Å; L452-V466 VanDerWaalsContact CD1-O 3.28Å; L452-V466 WeakPolarHBondContact CD1-O 3.4Å; N455-V466 HydrophobicContact CB-CB 4.35Å; N455-V466 PolarHBondContact OD1-N 2.8Å; N455-V466 VanDerWaalsContact OD1-N 3.1Å; N455-V466 PolarHBondContact OD1-O 2.86Å; V464-V466 HydrophobicContact CG1-CG2 4.28Å
467	K	75.5	Confident	64.6	Low	94 Å²	94	71.5 Å²	71.5	41%	0.409	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	130.4	176	-69.1	-172.2	176.1	-173.8	0	109.7	A396 F397 V469	A396-K467 CarbonylContact C-O 3.57Å; A396-K467 WeakPolarHBondContact CA-O 3.36Å; F397-K467 PolarHBondContact N-O 3.07Å; F397-K467 PolarHBondContact O-N 2.85Å; K467-V469 HydrophobicContact CB-CG2 4.46Å; K467-V469 PolarHBondContact O-N 2.94Å
468	C	68.2	Low	63.7	Low	44 Å²	44	68.2 Å²	68.2	30%	0.297	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	128.4	170.9	-47.1	0	0	0	0	108.9	C395 A448	C395-C468 CarbonylContact O-C 3.54Å; C395-C468 WeakPolarHBondContact O-CA 3.23Å; A448-C468 PolarHBondContact O-SG 2.93Å
469	V	66.7	Low	62.7	Low	15 Å²	15	63 Å²	63	9%	0.091	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	143.5	-174.7	172	0	0	0	0	107.9	C395 F397 K467 Q473	C395-V469 WeakPolarHBondContact CB-O 3.45Å; C395-V469 PolarHBondContact O-N 3.28Å; C395-V469 VanDerWaalsContact O-O 3.09Å; F397-V469 HydrophobicContact CB-CB 4.16Å; F397-V469 HydrophobicContact CB-CG2 3.45Å; F397-V469 VanDerWaalsContact CB-CG2 3.45Å; F397-V469 HydrophobicContact CG-CG2 4.37Å; K467-V469 HydrophobicContact CB-CG2 4.46Å; K467-V469 PolarHBondContact O-N 2.94Å; V469-Q473 HydrophobicContact CG1-CB 3.32Å; V469-Q473 HydrophobicContact CG1-CG 4.35Å
470	T	66	Low	61.1	Low	33 Å²	33	70.3 Å²	70.3	20%	0.202	39%	0.389	C	S	.	.			trans	-77.2	156.3	-177.7	69.1	0	0	0	0	111.5	E392 A472 Q473 M474	E392-T470 HydrophobicContact CB-CG2 4.44Å; E392-T470 WeakPolarHBondContact O-CA 3.46Å; E392-T470 VanDerWaalsContact O-CB 3.22Å; E392-T470 WeakPolarHBondContact O-CB 3.47Å; E392-T470 VanDerWaalsContact O-CG2 3.26Å; E392-T470 WeakPolarHBondContact O-CG2 3.45Å; T470-A472 PolarHBondContact O-N 2.9Å; T470-Q473 WeakPolarHBondContact O-CB 3.34Å; T470-Q473 PolarHBondContact O-N 2.76Å; T470-Q473 PolarHBondContact OG1-N 3.39Å; T470-M474 PolarHBondContact O-N 2.95Å
471	R	56.6	Low	60.2	Low	173 Å²	173	70.3 Å²	70.3	65%	0.653	40%	0.396	S	S	*	.	H	α-helix	trans	-57.2	-33.3	177.7	-172.3	171.3	179	151.2	-1.2	112.4	M474 D475	R471-M474 WeakPolarHBondContact O-CB 3.33Å; R471-M474 PolarHBondContact O-N 3.39Å; R471-D475 PolarHBondContact O-N 3.05Å; R471-D475 VanDerWaalsContact O-N 3.16Å
472	A	54.8	Low	58.9	Low	63 Å²	63	71.8 Å²	71.8	52%	0.521	39%	0.392	S	S	.	.	H	α-helix	trans	-67.3	-35	175.1	0	0	0	0	0	113.3	T470 Q476	T470-A472 PolarHBondContact O-N 2.9Å; A472-Q476 WeakPolarHBondContact O-CG 3.5Å; A472-Q476 PolarHBondContact O-N 3.39Å
473	Q	56.3	Low	57.1	Low	85 Å²	85	75.1 Å²	75.1	40%	0.397	42%	0.415	S	S	.	.	H	α-helix	trans	-73.7	-28	173.7	-74.5	171.2	-18.1	0	0	111.9	V469 T470 L477	V469-Q473 HydrophobicContact CG1-CB 3.32Å; V469-Q473 HydrophobicContact CG1-CG 4.35Å; T470-Q473 WeakPolarHBondContact O-CB 3.34Å; T470-Q473 PolarHBondContact O-N 2.76Å; T470-Q473 PolarHBondContact OG1-N 3.39Å; Q473-L477 WeakPolarHBondContact O-CD1 3.28Å; Q473-L477 VanDerWaalsContact O-CG 3.29Å; Q473-L477 WeakPolarHBondContact O-CG 3.4Å; Q473-L477 PolarHBondContact O-N 3.05Å
474	M	60.4	Low	55.2	Low	6 Å²	6	79 Å²	79	3%	0.03	44%	0.436	C	S	.	.	H	α-helix	trans	-67.8	-44.3	174.3	-172	-161.2	178.9	0	0	112.4	L439 L441 T470 R471 Q476 L477 T478	L439-M474 HydrophobicContact CB-CE 4.35Å; L439-M474 HydrophobicContact CD1-CE 4.25Å; L439-M474 HydrophobicContact CD1-CG 3.97Å; L439-M474 HydrophobicContact CD2-CG 4.2Å; L441-M474 HydrophobicContact CD1-CE 3.59Å; L441-M474 HydrophobicContact CD1-SD 3.95Å; L441-M474 HydrophobicContact CG-SD 4.48Å; T470-M474 PolarHBondContact O-N 2.95Å; R471-M474 WeakPolarHBondContact O-CB 3.33Å; R471-M474 PolarHBondContact O-N 3.39Å; M474-Q476 VanDerWaalsContact C-N 3.3Å; M474-Q476 PolarHBondContact O-N 3.36Å; M474-L477 PolarHBondContact O-N 3.38Å; M474-T478 WeakPolarHBondContact O-CB 3.2Å; M474-T478 PolarHBondContact O-N 3.46Å; M474-T478 VanDerWaalsContact O-N 3.09Å; M474-T478 PolarHBondContact O-OG1 2.75Å
475	D	53	Low	52.9	Low	90 Å²	90	88 Å²	88	48%	0.481	48%	0.478	S	S	.	.	H	α-helix	trans	-68.6	-30.8	-178.8	-71.4	-28.7	0	0	0	111.6	R471 T478 A479	R471-D475 PolarHBondContact O-N 3.05Å; R471-D475 VanDerWaalsContact O-N 3.16Å; D475-T478 PolarHBondContact O-N 2.8Å; D475-A479 PolarHBondContact O-N 3.08Å
476	Q	52.8	Low	50.9	Low	142 Å²	142	95.2 Å²	95.2	66%	0.664	52%	0.515	S	S	*	.	H	α-helix	trans	-72.4	-29.4	172.1	-71	176.2	10.3	0	0	113.8	A472 M474	A472-Q476 WeakPolarHBondContact O-CG 3.5Å; A472-Q476 PolarHBondContact O-N 3.39Å; M474-Q476 VanDerWaalsContact C-N 3.3Å; M474-Q476 PolarHBondContact O-N 3.36Å
477	L	52.5	Low	48.5	Very low	79 Å²	79	101.6 Å²	101.6	41%	0.414	55%	0.554	S	S	.	*	H	α-helix	trans	-83.4	-14	175.9	-71.4	166.6	0	0	0	113	Q473 M474	Q473-L477 WeakPolarHBondContact O-CD1 3.28Å; Q473-L477 VanDerWaalsContact O-CG 3.29Å; Q473-L477 WeakPolarHBondContact O-CG 3.4Å; Q473-L477 PolarHBondContact O-N 3.05Å; M474-L477 PolarHBondContact O-N 3.38Å
478	T	49.6	Very low	46.3	Very low	74 Å²	74	104.2 Å²	104.2	45%	0.454	57%	0.571	S	S	.	*	H	α-helix	trans	-98.2	-20.2	-179.5	-50	0	0	0	0	112.3	M474 D475	M474-T478 WeakPolarHBondContact O-CB 3.2Å; M474-T478 PolarHBondContact O-N 3.46Å; M474-T478 VanDerWaalsContact O-N 3.09Å; M474-T478 PolarHBondContact O-OG1 2.75Å; D475-T478 PolarHBondContact O-N 2.8Å
479	A	45.3	Very low	44.5	Very low	72 Å²	72	107.5 Å²	107.5	60%	0.595	59%	0.593	S	S	*	*	S	Bend	trans	-110	96.1	179.4	0	0	0	0	0	111.9	D475	D475-A479 PolarHBondContact O-N 3.08Å
480	E	33.7	Very low	42.7	Very low	175 Å²	175	116 Å²	116	82%	0.818	63%	0.628	S	S	*	*	S	Bend	trans	67.2	149.5	171.8	-71.4	-150.4	148	0	0	118.7	P482	E480-P482 WeakPolarHBondContact O-CD 3.49Å
481	P	40.7	Very low	40.9	Very low	116 Å²	116	124 Å²	124	75%	0.753	66%	0.664	S	S	*	*			trans	-85.2	129.8	-159.7	33.3	-30	0	0	0	111.2
482	P	32.7	Very low	39.5	Very low	104 Å²	104	119.1 Å²	119.1	68%	0.675	67%	0.667	S	S	*	*			trans	-89.4	116.3	159.3	29.5	-19.9	0	0	0	108.7	E480	E480-P482 WeakPolarHBondContact O-CD 3.49Å
483	S	28.7	Very low	38.1	Very low	108 Å²	108	124.2 Å²	124.2	76%	0.755	68%	0.679	S	S	*	*			trans	-39.8	143.9	149.1	48.5	0	0	0	0	111.6	Q485	S483-Q485 PolarHBondContact O-N 3.48Å
484	M	35.1	Very low	36.7	Very low	182 Å²	182	129.8 Å²	129.8	90%	0.897	70%	0.703	S	S	*	*	S	Bend	trans	-26.9	124	171.1	-63	-160.8	177.3	0	0	115.1
485	Q	29.6	Very low	35.1	Very low	188 Å²	188	134.8 Å²	134.8	88%	0.879	74%	0.738	S	S	*	*				173.7	138.8	125.7	-94.6	167	12.6	0	0	111	S483	S483-Q485 PolarHBondContact O-N 3.48Å
486	D	33.7	Very low	33.8	Very low	156 Å²	156	134.2 Å²	134.2	83%	0.834	75%	0.754	S	S	*	*			trans	-50.3	129.4	175.6	-71.1	-66	0	0	0	113.7
487	V	27	Very low	32.5	Very low	134 Å²	134	138 Å²	138	81%	0.812	76%	0.762	S	S	*	*			trans	-139.9	102.4	156	-175.7	0	0	0	0	110.2
488	L	28.3	Very low	31.2	Very low	149 Å²	149	139.9 Å²	139.9	78%	0.78	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-69.6	141.1	156.3	-92.6	109.8	0	0	0	110.2
489	P	31.6	Very low	30.2	Very low	114 Å²	114	143.4 Å²	143.4	74%	0.74	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-85.3	134.6	158.4	-4.9	23.6	0	0	0	111.4
490	K	29.6	Very low	29.2	Very low	193 Å²	193	148.4 Å²	148.4	84%	0.839	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-83.3	144.3	175.3	-70	171.4	172.6	172.5	0	111.9
491	E	27.3	Very low	29.5	Very low	202 Å²	202	144 Å²	144	94%	0.944	79%	0.786	S	S	*	*			trans	-147.3	140.3	138	-71	-166.8	155.7	0	0	105.9
492	G	26.5	Very low	28.7	Very low	70 Å²	70	145.9 Å²	145.9	72%	0.722	78%	0.782	S	S	*	*			cis	-153.1	162.2	-3.5	0	0	0	0	0	107.4
493	H	26.6	Very low	28.6	Very low	169 Å²	169	150.8 Å²	150.8	78%	0.782	79%	0.789	S	S	*	*			trans	-64.8	147.9	-163.6	-59.8	0.3	0	0	0	115.5
494	F	25.8	Very low	28.4	Very low	203 Å²	203	148.5 Å²	148.5	89%	0.89	78%	0.783	S	S	*	*				-157.8	116.5	119.3	-104.8	-77.7	0	0	0	110.8
495	S	27	Very low	28	Very low	111 Å²	111	146.1 Å²	146.1	78%	0.776	78%	0.779	S	S	*	*			trans	19.5	133	154.5	58.2	0	0	0	0	119.5
496	G	25.2	Very low	27.8	Very low	78 Å²	78	142.6 Å²	142.6	80%	0.804	77%	0.774	S	S	*	*			cis	168.2	-179.4	22	0	0	0	0	0	104.3
497	R	27	Very low	27.4	Very low	222 Å²	222	138.6 Å²	138.6	84%	0.838	77%	0.77	S	S	*	*			cis	-171.5	141.1	7.9	-156	-163.4	170.9	166.1	-1.5	103.5
498	N	25.3	Very low	27.3	Very low	117 Å²	117	139 Å²	139	63%	0.626	77%	0.768	S	S	*	*			trans	84.6	118.2	152.3	-59.4	-20.5	0	0	0	122.8
499	N	27.8	Very low	27.2	Very low	149 Å²	149	137.2 Å²	137.2	80%	0.797	76%	0.763	S	S	*	*				83	95.8	126.6	-65.6	9.8	0	0	0	121.5
500	E	23.4	Very low	27	Very low	176 Å²	176	137 Å²	137	82%	0.822	77%	0.765	S	S	*	*				-25.3	172.7	128.3	-79.9	-95.1	124.8	0	0	116.9
501	P	41	Very low	26.8	Very low	83 Å²	83	136.1 Å²	136.1	54%	0.539	76%	0.761	S	S	.	*			cis	-143.2	-177.7	-37.5	34.9	-15	0	0	0	113.7
502	F	24.3	Very low	26.7	Very low	155 Å²	155	134.4 Å²	134.4	68%	0.68	75%	0.751	S	S	*	*				150	140.1	125.8	-106.6	-71.4	0	0	0	116.6
503	Y	30.6	Very low	26.5	Very low	208 Å²	208	137 Å²	137	82%	0.816	75%	0.748	S	S	*	*			trans	52.8	137.1	162	-67.5	-68	0	0	0	117.6
504	G	24.5	Very low	26.5	Very low	60 Å²	60	133.2 Å²	133.2	62%	0.619	74%	0.737	S	S	*	*			cis	142.5	140.1	17.9	0	0	0	0	0	107.7
505	T	25.9	Very low	26.5	Very low	132 Å²	132	134.4 Å²	134.4	81%	0.81	74%	0.736	S	S	*	*			trans	82.4	101.4	145.4	-42.3	0	0	0	0	119.3
506	S	24.6	Very low	26.7	Very low	113 Å²	113	138.6 Å²	138.6	79%	0.79	74%	0.74	S	S	*	*				69.4	133.7	123.6	-48.7	0	0	0	0	123.3
507	G	25.9	Very low	27.4	Very low	73 Å²	73	140.2 Å²	140.2	75%	0.753	74%	0.736	S	S	*	*			trans	80	149.3	143.1	0	0	0	0	0	115.3
508	D	24.6	Very low	27.4	Very low	143 Å²	143	139.7 Å²	139.7	77%	0.765	73%	0.734	S	S	*	*			cis	-170.4	163.4	-19.3	-144.5	-17.9	0	0	0	103.3
509	T	27.4	Very low	27.4	Very low	111 Å²	111	140.5 Å²	140.5	68%	0.681	74%	0.739	S	S	*	*			trans	65.8	121.2	151.4	51.8	0	0	0	0	121.6
510	S	26.3	Very low	27.3	Very low	110 Å²	110	136.4 Å²	136.4	77%	0.769	73%	0.731	S	S	*	*			trans	73.5	139.1	134.6	76.9	0	0	0	0	116.3
511	F	25.2	Very low	27.4	Very low	174 Å²	174	136 Å²	136	76%	0.763	74%	0.735	S	S	*	*			cis	163	136.2	1.5	-147	-113	0	0	0	101
512	F	25.2	Very low	26.9	Very low	166 Å²	166	139.3 Å²	139.3	73%	0.728	75%	0.747	S	S	*	*			trans	36.4	131.3	156.7	-65.5	-105	0	0	0	118.5
513	D	23	Very low	27.4	Very low	123 Å²	123	137.4 Å²	137.4	66%	0.658	75%	0.75	S	S	*	*				177.6	158.9	55.5	-160	10.1	0	0	0	109.7
514	T	26.2	Very low	27.3	Very low	91 Å²	91	134 Å²	134	56%	0.558	75%	0.745	S	S	*	*			trans	2.2	149.9	158	61.7	0	0	0	0	122.7
515	R	25.3	Very low	27.3	Very low	228 Å²	228	138.4 Å²	138.4	86%	0.86	75%	0.747	S	S	*	*			trans	109	101.3	146.7	-63.6	172.6	-148.8	-167.7	3.8	117.4
516	K	32.1	Very low	27.2	Very low	198 Å²	198	138.3 Å²	138.3	86%	0.861	74%	0.738	S	S	*	*			trans	-40.2	157	135.6	-74.4	-172.4	176.1	-177.3	0	110.7
517	P	39.4	Very low	27.2	Very low	112 Å²	112	138.8 Å²	138.8	73%	0.727	73%	0.727	S	S	*	*			cis	-158.4	174.7	43.4	42.7	-20.2	0	0	0	119.2
518	R	26.6	Very low	27.2	Very low	211 Å²	211	144.5 Å²	144.5	80%	0.796	73%	0.726	S	S	*	*			trans	70.9	133.7	134.1	-96.7	-172.8	145.1	173.4	5.7	124.2
519	D	26.8	Very low	27.4	Very low	135 Å²	135	142.9 Å²	142.9	72%	0.722	72%	0.716	S	S	*	*			trans	84.3	128.5	134.5	-65.2	-22.4	0	0	0	119.4
520	G	24.5	Very low	27.4	Very low	62 Å²	62	145.9 Å²	145.9	64%	0.639	72%	0.722	S	S	*	*			trans	148.2	84.4	144.3	0	0	0	0	0	117.6
521	N	26.8	Very low	27.4	Very low	167 Å²	167	144.6 Å²	144.6	89%	0.893	73%	0.726	S	S	*	*			trans	80.6	116.9	130.5	-62.2	-13	0	0	0	122.3
522	L	30.6	Very low	27.4	Very low	153 Å²	153	139.6 Å²	139.6	80%	0.801	72%	0.724	S	S	*	*			trans	-61.6	164	147.1	-64.9	157.9	0	0	0	111.5
523	P	34.1	Very low	27.5	Very low	115 Å²	115	140.7 Å²	140.7	75%	0.747	73%	0.731	S	S	*	*				-138	145.1	89.6	15.1	8.7	0	0	0	113.5
524	I	27.9	Very low	27.7	Very low	138 Å²	138	141.1 Å²	141.1	71%	0.708	73%	0.733	S	S	*	*				65.2	121.7	79.6	-59.3	177.1	0	0	0	111.4
525	K	25.2	Very low	27.9	Very low	151 Å²	151	147.3 Å²	147.3	66%	0.657	75%	0.748	S	S	*	*				-176.3	152.5	58.8	-139.2	163.9	-175.6	-119.2	0	114.8
526	E	24.4	Very low	28	Very low	131 Å²	131	139.2 Å²	139.2	61%	0.612	74%	0.736	S	S	*	*			trans	64.9	137.6	137.9	-90.3	157.4	-161.4	0	0	122.1
527	E	24.8	Very low	27.7	Very low	123 Å²	123	139.7 Å²	139.7	58%	0.575	73%	0.734	S	S	*	*			cis	-178.2	156.8	0.6	-137.9	-171.9	166.2	0	0	113
528	R	25.4	Very low	27	Very low	192 Å²	192	144 Å²	144	73%	0.725	74%	0.736	S	S	*	*			trans	83.2	138	147.2	-66	-167.8	175.1	-170.6	5.4	120.8
529	I	27.9	Very low	26.9	Very low	110 Å²	110	137.1 Å²	137.1	56%	0.564	73%	0.731	S	S	*	*			cis	-168.9	145.2	10.8	-114.6	178	0	0	0	114
530	H	28.5	Very low	27	Very low	174 Å²	174	137.2 Å²	137.2	81%	0.806	74%	0.735	S	S	*	*			trans	60.9	140.8	147.5	-59.6	2.8	0	0	0	123.2
531	G	26.4	Very low	27.2	Very low	82 Å²	82	145.5 Å²	145.5	85%	0.845	75%	0.748	S	S	*	*			cis	169.8	166.2	2.8	0	0	0	0	0	113
532	G	25	Very low	27.8	Very low	70 Å²	70	142.4 Å²	142.4	72%	0.722	74%	0.737	S	S	*	*			trans	143.8	81	169.5	0	0	0	0	0	113.9
533	Q	27.4	Very low	27.6	Very low	189 Å²	189	146.2 Å²	146.2	88%	0.883	74%	0.74	S	S	*	*				75	102.2	104.8	-74.5	177.4	-24.6	0	0	115.1
534	D	26.4	Very low	27.5	Very low	131 Å²	131	146.1 Å²	146.1	70%	0.701	74%	0.743	S	S	*	*				66.8	127.6	91.3	-106.6	-17	0	0	0	113
535	Y	30.5	Very low	28	Very low	221 Å²	221	145 Å²	145	87%	0.867	74%	0.744	S	S	*	*			cis	-148.5	157.3	40.3	-65.2	-98.6	0	0	0	108.7
536	G	26.5	Very low	28.2	Very low	59 Å²	59	149 Å²	149	61%	0.608	76%	0.755	S	S	*	*			cis	144.7	111.2	7.5	0	0	0	0	0	110
537	Y	26.4	Very low	28.6	Very low	207 Å²	207	150.5 Å²	150.5	81%	0.812	77%	0.767	S	S	*	*			trans	56.2	155.4	135.2	-86.1	-69.9	0	0	0	121.2
538	R	25.2	Very low	29	Very low	203 Å²	203	156.5 Å²	156.5	77%	0.766	79%	0.785	S	S	*	*			cis	-171.8	133.7	0.1	-159.2	174.1	-113.2	-128.9	0.8	102.8
539	G	25	Very low	29.1	Very low	67 Å²	67	150.6 Å²	150.6	69%	0.691	78%	0.784	S	S	*	*				101.8	156.3	87.9	0	0	0	0	0	114.2
540	V	27.3	Very low	29.1	Very low	136 Å²	136	152 Å²	152	82%	0.824	80%	0.803	S	S	*	*			trans	89.8	95.1	155.2	-163.4	0	0	0	0	117.6
541	R	30	Very low	29.1	Very low	237 Å²	237	147.6 Å²	147.6	89%	0.894	81%	0.805	S	S	*	*			trans	-62.8	150.7	140.5	-77.9	-168.6	179.4	-152.7	1.1	108.2
542	P	39	Very low	29.3	Very low	102 Å²	102	146.8 Å²	146.8	66%	0.662	80%	0.797	S	S	*	*				-159.3	-177.2	59.5	38.7	-14.8	0	0	0	117.7
543	R	25.3	Very low	29.5	Very low	232 Å²	232	153.1 Å²	153.1	88%	0.875	81%	0.807	S	S	*	*			trans	87.6	114.9	157.2	-60.3	178.3	-177.7	-173.8	-0	118.8
544	S	32.4	Very low	29.8	Very low	114 Å²	114	147.6 Å²	147.6	80%	0.797	80%	0.801	S	S	*	*			trans	-71.7	151.7	143.6	-42.5	0	0	0	0	108.5
545	P	39.8	Very low	30	Very low	115 Å²	115	152.5 Å²	152.5	75%	0.747	81%	0.809	S	S	*	*				-154.9	-179.6	67.3	39.8	-18.1	0	0	0	116.5
546	R	27.8	Very low	30.3	Very low	235 Å²	235	151.7 Å²	151.7	89%	0.887	81%	0.811	S	S	*	*			trans	95.7	110.7	158	-76	-177	169.5	175	-2.9	120.1
547	D	34.5	Very low	30.5	Very low	162 Å²	162	152.2 Å²	152.2	87%	0.866	82%	0.816	S	S	*	*			trans	-1.4	119.1	132.4	-83.3	-47.2	0	0	0	118
548	R	32.4	Very low	31	Very low	249 Å²	249	148.2 Å²	148.2	94%	0.94	82%	0.815	S	S	*	*			trans	-153.1	118	134	-114.7	-177	-165.4	174.6	4.3	108.8
549	G	27.3	Very low	31.8	Very low	68 Å²	68	144.6 Å²	144.6	70%	0.701	82%	0.818	S	S	*	*			trans	-77.1	176.5	174.3	0	0	0	0	0	114.2
550	S	28.3	Very low	32.3	Very low	139 Å²	139	148.5 Å²	148.5	97%	0.972	82%	0.823	S	S	*	*			trans	95	114.1	160	-62.3	0	0	0	0	118.2
551	G	27.3	Very low	33	Very low	82 Å²	82	150.9 Å²	150.9	85%	0.845	83%	0.825	S	S	*	*			trans	149.3	77.7	160.5	0	0	0	0	0	112.5
552	G	31.8	Very low	33.7	Very low	65 Å²	65	149.6 Å²	149.6	67%	0.67	82%	0.821	S	S	*	*			trans	-72.1	161	-178.7	0	0	0	0	0	114.5
553	H	29.5	Very low	34	Very low	202 Å²	202	155.1 Å²	155.1	94%	0.935	83%	0.83	S	S	*	*			trans	-167.4	126.9	132	-85.2	-59.4	0	0	0	107.2
554	G	32.7	Very low	35.5	Very low	73 Å²	73	148.7 Å²	148.7	75%	0.753	81%	0.813	S	S	*	*			trans	-78.9	175.1	-165	0	0	0	0	0	116.1
555	R	30.5	Very low	37.2	Very low	234 Å²	234	144.6 Å²	144.6	88%	0.883	79%	0.789	S	S	*	*			trans	-173.1	118.3	139.9	-102.9	177.1	-160.9	-101.5	4.9	109.6
556	F	36.6	Very low	39.2	Very low	205 Å²	205	143.4 Å²	143.4	90%	0.899	78%	0.781	S	S	*	*			trans	28.5	99.2	144.8	-69.4	-94	0	0	0	118.1
557	G	31.1	Very low	41.9	Very low	69 Å²	69	133.1 Å²	133.1	71%	0.711	74%	0.744	S	S	*	*			trans	-106.9	142	152.9	0	0	0	0	0	109.6
558	P	37.9	Very low	44.2	Very low	124 Å²	124	128 Å²	128	81%	0.805	72%	0.72	S	S	*	*			trans	-70	151.8	-178.4	29.4	-32.5	0	0	0	111.6
559	P	41.8	Very low	46.8	Very low	127 Å²	127	116.1 Å²	116.1	83%	0.825	68%	0.675	S	S	*	*			trans	-74.5	144.5	-175	30.8	-32.6	0	0	0	112	Q561	P559-Q561 PolarHBondContact O-N 2.87Å
560	D	35.8	Very low	49.7	Very low	148 Å²	148	115.2 Å²	115.2	79%	0.791	65%	0.653	S	S	*	*			trans	-35.5	115.8	177.4	-72.6	-45.2	0	0	0	114.7	R562	D560-R562 VanDerWaalsContact C-N 3.3Å; D560-R562 PolarHBondContact O-N 3.47Å
561	Q	41.1	Very low	52.4	Low	187 Å²	187	108.6 Å²	108.6	87%	0.874	61%	0.607	S	S	*	*			trans	-65.5	93.3	154	-87	164.1	-24.6	0	0	108.3	P559 Y563	P559-Q561 PolarHBondContact O-N 2.87Å; Q561-Y563 PolarHBondContact O-N 2.87Å
562	R	44.3	Very low	55.1	Low	210 Å²	210	107.3 Å²	107.3	79%	0.792	58%	0.58	S	S	*	*			trans	-67.6	114.3	167.2	-66.9	-171.7	178.6	-164.3	0.8	108	D560 D564	D560-R562 VanDerWaalsContact C-N 3.3Å; D560-R562 PolarHBondContact O-N 3.47Å; R562-D564 PolarHBondContact O-N 2.82Å
563	Y	45.3	Very low	57.5	Low	217 Å²	217	107.4 Å²	107.4	85%	0.851	57%	0.565	S	S	*	*			trans	-58.7	106.7	165.7	-77.2	-94.3	0	0	0	108.6	Q561	Q561-Y563 PolarHBondContact O-N 2.87Å
564	D	57.7	Low	60	Low	98 Å²	98	97.8 Å²	97.8	52%	0.524	52%	0.521	S	S	.	.			trans	-98.3	80.2	173.3	-155.7	19.3	0	0	0	108.2	R562 S617 R618 Q619	R562-D564 PolarHBondContact O-N 2.82Å; D564-S617 PolarHBondContact OD1-OG 3.45Å; D564-S617 PolarHBondContact OD2-OG 2.9Å; D564-R618 PolarHBondContact OD1-N 2.92Å; D564-Q619 PolarHBondContact OD1-N 2.97Å
565	G	67.6	Low	62.2	Low	28 Å²	28	95.4 Å²	95.4	29%	0.289	49%	0.492	S	S	.	.			trans	-105.3	166.9	-179.6	0	0	0	0	0	112.3	T567 R618	G565-T567 PolarHBondContact O-N 2.93Å; G565-T567 PolarHBondContact O-OG1 2.72Å; G565-T567 VanDerWaalsContact O-OG1 3.09Å; G565-R618 PolarHBondContact O-N 3.25Å
566	P	80.9	Confident	64.4	Low	90 Å²	90	89.6 Å²	89.6	58%	0.584	47%	0.473	S	S	*	.			trans	-59.7	131.2	179.6	25.4	-34.2	0	0	0	110.5	I593 V614 F615	P566-I593 HydrophobicContact CB-CD1 4.06Å; P566-V614 HydrophobicContact CB-CG1 3.92Å; P566-F615 CarbonylContact C-O 3.54Å; P566-F615 WeakPolarHBondContact CA-O 3.37Å
567	T	84.8	Confident	66.1	Low	18 Å²	18	88.1 Å²	88.1	11%	0.11	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	126.9	-170.1	-63.7	0	0	0	0	111.1	G565 F615 R618 A621 L642	G565-T567 PolarHBondContact O-N 2.93Å; G565-T567 PolarHBondContact O-OG1 2.72Å; G565-T567 VanDerWaalsContact O-OG1 3.09Å; T567-F615 PolarHBondContact N-O 3.27Å; T567-F615 PolarHBondContact O-N 2.9Å; T567-R618 HydrophobicContact CG2-CG 4.42Å; T567-R618 WeakPolarHBondContact OG1-CA 3.22Å; T567-R618 VanDerWaalsContact OG1-CB 3.24Å; T567-R618 WeakPolarHBondContact OG1-CB 3.37Å; T567-A621 HydrophobicContact CG2-CB 3.74Å; T567-L642 HydrophobicContact CG2-CD1 3.68Å; T567-L642 HydrophobicContact CG2-CD2 4.42Å; T567-L642 HydrophobicContact CG2-CG 4.02Å
568	C	83.4	Confident	68.3	Low	54 Å²	54	85.5 Å²	85.5	37%	0.365	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	134.2	179.7	-60.9	0	0	0	0	111.4	L613 V643	C568-L613 WeakPolarHBondContact CA-O 3.38Å; C568-V643 HydrophobicContact CB-CB 4.22Å; C568-V643 PolarHBondContact O-N 3.04Å; C568-V643 VanDerWaalsContact O-N 3.1Å
569	V	87.7	Confident	70.3	Confident	0 Å²	0	86.3 Å²	86.3	0%	0	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	135.3	176.1	175.8	0	0	0	0	109.3	L571 T612 L613 F615 A621 I625 L640 L641	V569-L571 HydrophobicContact CG1-CD1 4.33Å; V569-T612 WeakPolarHBondContact O-CA 3.37Å; V569-L613 HydrophobicContact CB-CD1 4.02Å; V569-L613 PolarHBondContact N-O 3.39Å; V569-L613 PolarHBondContact O-N 2.86Å; V569-F615 HydrophobicContact CB-CD2 4.06Å; V569-F615 HydrophobicContact CB-CE2 3.69Å; V569-F615 HydrophobicContact CG1-CE2 4.16Å; V569-F615 HydrophobicContact CG2-CD2 3.58Å; V569-F615 HydrophobicContact CG2-CE2 3.52Å; V569-A621 HydrophobicContact CG2-CB 3.82Å; V569-I625 HydrophobicContact CG1-CD1 4.34Å; V569-I625 HydrophobicContact CG1-CG1 4.11Å; V569-I625 HydrophobicContact CG2-CD1 4.05Å; V569-I625 HydrophobicContact CG2-CG1 4.45Å; V569-L640 HydrophobicContact CG1-CB 3.94Å; V569-L640 HydrophobicContact CG1-CD2 4.25Å; V569-L640 HydrophobicContact CG1-CG 4.42Å; V569-L641 CarbonylContact C-O 3.59Å; V569-L641 WeakPolarHBondContact CA-O 3.43Å; V569-L641 WeakPolarHBondContact CG1-O 3.21Å
570	Q	86.7	Confident	72	Confident	50 Å²	50	82.7 Å²	82.7	23%	0.234	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	127	176.3	-174.1	173.7	14.7	0	0	110.3	I572 A611 L640 L641 V643	Q570-I572 HydrophobicContact CG-CG1 4.11Å; Q570-A611 CarbonylContact C-O 3.57Å; Q570-A611 WeakPolarHBondContact CA-O 3.29Å; Q570-L640 CarbonylContact O-C 3.54Å; Q570-L640 WeakPolarHBondContact O-CA 3.43Å; Q570-L641 PolarHBondContact N-O 2.84Å; Q570-L641 PolarHBondContact O-N 3.34Å; Q570-V643 HydrophobicContact CB-CG2 3.48Å; Q570-V643 VanDerWaalsContact CB-CG2 3.48Å
571	L	86.8	Confident	74	Confident	0 Å²	0	80 Å²	80	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	133.2	171.4	-78.2	69.2	0	0	0	108.4	V569 L574 V583 F586 S610 A611 L613 I638 Q639 L640	V569-L571 HydrophobicContact CG1-CD1 4.33Å; L571-L574 HydrophobicContact CB-CD1 3.89Å; L571-L574 HydrophobicContact CB-CD2 4.22Å; L571-L574 HydrophobicContact CB-CG 4.18Å; L571-L574 HydrophobicContact CD2-CD2 4.1Å; L571-V583 HydrophobicContact CD2-CG1 3.89Å; L571-F586 HydrophobicContact CD2-CD1 4.07Å; L571-F586 HydrophobicContact CD2-CE1 4.2Å; L571-S610 CarbonylContact O-C 3.52Å; L571-S610 WeakPolarHBondContact O-CA 3.25Å; L571-S610 WeakPolarHBondContact O-CB 3.46Å; L571-A611 HydrophobicContact CB-CB 4.35Å; L571-A611 PolarHBondContact N-O 3.26Å; L571-A611 PolarHBondContact O-N 3.19Å; L571-L613 HydrophobicContact CD1-CD1 4.27Å; L571-L613 HydrophobicContact CD1-CD2 3.23Å; L571-L613 HydrophobicContact CD1-CG 3.51Å; L571-L613 HydrophobicContact CD2-CD2 4.01Å; L571-L613 HydrophobicContact CG-CD2 4.27Å; L571-I638 HydrophobicContact CB-CG2 4.16Å; L571-I638 HydrophobicContact CD2-CG2 4.13Å; L571-I638 HydrophobicContact CG-CG2 4.13Å; L571-Q639 CarbonylContact C-O 3.26Å; L571-Q639 WeakPolarHBondContact CA-O 3.42Å; L571-L640 HydrophobicContact CD1-CD2 4.43Å; L571-L640 HydrophobicContact CD1-CG 4.3Å; L571-L640 HydrophobicContact CG-CG 4.1Å
572	I	84.2	Confident	75.8	Confident	54 Å²	54	74.7 Å²	74.7	28%	0.277	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	150.6	-178.8	-56.7	-177.8	0	0	0	108.6	Q570 Q639 L641	Q570-I572 HydrophobicContact CG-CG1 4.11Å; I572-Q639 HydrophobicContact CB-CB 4.35Å; I572-Q639 PolarHBondContact N-O 3.32Å; I572-Q639 PolarHBondContact O-N 2.86Å; I572-L641 HydrophobicContact CD1-CD1 3.44Å; I572-L641 VanDerWaalsContact CD1-CD1 3.44Å; I572-L641 HydrophobicContact CD1-CG 4.28Å
573	N	81.1	Confident	77.5	Confident	68 Å²	68	64.7 Å²	64.7	36%	0.364	32%	0.323	S	S	.	.	S	Bend	trans	71.6	29.6	179.4	-162.7	35.8	0	0	0	114.4	G609 R636 K637 I638	N573-G609 PolarHBondContact N-O 3.46Å; N573-R636 WeakPolarHBondContact O-CB 3.26Å; N573-K637 PolarHBondContact ND2-O 2.95Å; N573-I638 VanDerWaalsContact O-CD1 3.24Å; N573-I638 WeakPolarHBondContact O-CD1 3.18Å
574	L	82.4	Confident	79.3	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.296	C	S	.	.			trans	-68.5	146.2	173.1	-60.5	166.9	0	0	0	111	L571 I578 V583 G609 A611 I633 R636 I638	L571-L574 HydrophobicContact CB-CD1 3.89Å; L571-L574 HydrophobicContact CB-CD2 4.22Å; L571-L574 HydrophobicContact CB-CG 4.18Å; L571-L574 HydrophobicContact CD2-CD2 4.1Å; L574-I578 HydrophobicContact CB-CD1 4.27Å; L574-I578 HydrophobicContact CB-CG2 4.01Å; L574-I578 HydrophobicContact CD2-CD1 3.68Å; L574-I578 HydrophobicContact CG-CD1 4.41Å; L574-V583 HydrophobicContact CD1-CG2 4.42Å; L574-G609 PolarHBondContact N-O 3.23Å; L574-G609 WeakPolarHBondContact O-CA 3.45Å; L574-A611 HydrophobicContact CD1-CB 3.34Å; L574-I633 HydrophobicContact CD2-CD1 3.82Å; L574-R636 PolarHBondContact O-NH1 3.09Å; L574-I638 HydrophobicContact CD2-CD1 3.59Å; L574-I638 HydrophobicContact CD2-CG1 4.03Å; L574-I638 HydrophobicContact CD2-CG2 3.9Å; L574-I638 HydrophobicContact CG-CD1 4.29Å
575	P	78.2	Confident	80.2	Confident	23 Å²	23	56.1 Å²	56.1	15%	0.149	29%	0.287	C	S	.	.			trans	-54.9	141.6	168.9	-23.5	32.9	0	0	0	111.6	Q577 I578 I633	P575-Q577 PolarHBondContact O-N 3.48Å; P575-I578 HydrophobicContact CB-CB 4.39Å; P575-I578 VanDerWaalsContact O-CB 3.31Å; P575-I578 WeakPolarHBondContact O-CB 3.46Å; P575-I578 WeakPolarHBondContact O-CG2 3.47Å; P575-I578 PolarHBondContact O-N 2.89Å; P575-I578 VanDerWaalsContact O-N 3.14Å; P575-I633 HydrophobicContact CG-CG2 4.24Å; P575-I633 WeakPolarHBondContact CG-O 3.43Å
576	F	76.2	Confident	80.8	Confident	111 Å²	111	56 Å²	56	49%	0.487	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-20.7	-178.3	-63	-56.4	0	0	0	113.8	P607 R636	F576-P607 HydrophobicContact CB-CG 3.92Å; F576-P607 HydrophobicContact CD1-CG 4.25Å; F576-P607 WeakPolarHBondContact CD1-O 3.01Å; F576-P607 WeakPolarHBondContact CE1-O 3.22Å; F576-P607 WeakPolarHBondContact O-CG 3.22Å; F576-R636 VanDerWaalsContact CE2-NH2 3.27Å
577	Q	72.8	Confident	80.7	Confident	175 Å²	175	51.8 Å²	51.8	82%	0.818	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	4.8	179.1	-157.7	63.2	22.8	0	0	113.1	P575	P575-Q577 PolarHBondContact O-N 3.48Å
578	I	78.3	Confident	80.3	Confident	13 Å²	13	55.3 Å²	55.3	7%	0.067	26%	0.264	C	S	.	.			trans	-64.3	135.9	-174.5	-162.2	172.2	0	0	0	111.3	L574 P575 E582 V583 L599 I633	L574-I578 HydrophobicContact CB-CD1 4.27Å; L574-I578 HydrophobicContact CB-CG2 4.01Å; L574-I578 HydrophobicContact CD2-CD1 3.68Å; L574-I578 HydrophobicContact CG-CD1 4.41Å; P575-I578 HydrophobicContact CB-CB 4.39Å; P575-I578 VanDerWaalsContact O-CB 3.31Å; P575-I578 WeakPolarHBondContact O-CB 3.46Å; P575-I578 WeakPolarHBondContact O-CG2 3.47Å; P575-I578 PolarHBondContact O-N 2.89Å; P575-I578 VanDerWaalsContact O-N 3.14Å; I578-E582 HydrophobicContact CD1-CB 4.23Å; I578-E582 HydrophobicContact CG1-CB 3.69Å; I578-V583 HydrophobicContact CD1-CG2 3.66Å; I578-V583 HydrophobicContact CG1-CG2 4.17Å; I578-L599 HydrophobicContact CG2-CD2 3.77Å; I578-I633 HydrophobicContact CD1-CD1 3.84Å; I578-I633 HydrophobicContact CD1-CG2 3.96Å
579	R	79.4	Confident	79.7	Confident	141 Å²	141	55.7 Å²	55.7	53%	0.532	28%	0.277	S	S	.	.			trans	-91.1	157.1	172.9	-59.7	174.9	69.6	96.2	2.2	110.5	E581 E582 V583	R579-E581 HydrophobicContact CB-CB 4.44Å; R579-E581 IonicContact CZ-OE2 3.05Å; R579-E581 IonicContact NE-OE2 2.9Å; R579-E581 PolarHBondContact NE-OE2 3.22Å; R579-E581 IonicContact NH2-OE1 3.31Å; R579-E581 IonicContact NH2-OE2 3.4Å; R579-E581 PolarHBondContact O-N 2.7Å; R579-E582 HydrophobicContact CB-CG 4.45Å; R579-E582 PolarHBondContact O-N 3.11Å; R579-E582 VanDerWaalsContact O-N 3.11Å; R579-V583 PolarHBondContact O-N 3.36Å
580	S	78.4	Confident	79.4	Confident	51 Å²	51	57.6 Å²	57.6	36%	0.357	28%	0.284	S	S	.	.	H	α-helix	trans	-58.2	-32.4	173.7	47.6	0	0	0	0	112.1	V583 Y584	S580-V583 PolarHBondContact O-N 2.83Å; S580-Y584 WeakPolarHBondContact O-CD2 3.47Å; S580-Y584 PolarHBondContact O-N 2.85Å
581	E	77.2	Confident	79	Confident	92 Å²	92	60 Å²	60	43%	0.43	29%	0.291	S	S	.	.	H	α-helix	trans	-57.9	-46.5	173.5	-66.2	151	-169.1	0	0	112	R579 V583 Y584 D585	R579-E581 HydrophobicContact CB-CB 4.44Å; R579-E581 IonicContact CZ-OE2 3.05Å; R579-E581 IonicContact NE-OE2 2.9Å; R579-E581 PolarHBondContact NE-OE2 3.22Å; R579-E581 IonicContact NH2-OE1 3.31Å; R579-E581 IonicContact NH2-OE2 3.4Å; R579-E581 PolarHBondContact O-N 2.7Å; E581-V583 PolarHBondContact O-N 2.76Å; E581-Y584 WeakPolarHBondContact O-CB 3.37Å; E581-Y584 PolarHBondContact O-N 3.17Å; E581-D585 PolarHBondContact O-N 2.76Å
582	E	79.3	Confident	78.9	Confident	76 Å²	76	61 Å²	61	36%	0.355	30%	0.297	S	S	.	.	H	α-helix	trans	-66.4	-27.4	179.6	-67.5	172.8	-136.8	0	0	112.6	I578 R579 F586	I578-E582 HydrophobicContact CD1-CB 4.23Å; I578-E582 HydrophobicContact CG1-CB 3.69Å; R579-E582 HydrophobicContact CB-CG 4.45Å; R579-E582 PolarHBondContact O-N 3.11Å; R579-E582 VanDerWaalsContact O-N 3.11Å; E582-F586 WeakPolarHBondContact O-CB 3.49Å; E582-F586 PolarHBondContact O-N 3.03Å
583	V	80.4	Confident	78.7	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-72.6	-36.1	173.8	178.2	0	0	0	0	110.9	L571 L574 I578 R579 S580 E581 F586 C587 V597 L599 L613	L571-V583 HydrophobicContact CD2-CG1 3.89Å; L574-V583 HydrophobicContact CD1-CG2 4.42Å; I578-V583 HydrophobicContact CD1-CG2 3.66Å; I578-V583 HydrophobicContact CG1-CG2 4.17Å; R579-V583 PolarHBondContact O-N 3.36Å; S580-V583 PolarHBondContact O-N 2.83Å; E581-V583 PolarHBondContact O-N 2.76Å; V583-F586 PolarHBondContact O-N 3.24Å; V583-C587 PolarHBondContact O-N 3.14Å; V583-V597 HydrophobicContact CB-CG1 3.87Å; V583-V597 HydrophobicContact CG1-CG1 3.76Å; V583-V597 HydrophobicContact CG1-CG2 4.05Å; V583-V597 HydrophobicContact CG2-CG1 4.32Å; V583-L599 HydrophobicContact CG2-CD2 4.37Å; V583-L613 HydrophobicContact CG1-CD2 3.83Å
584	Y	82.3	Confident	78.2	Confident	70 Å²	70	64.1 Å²	64.1	28%	0.275	32%	0.319	S	S	.	.	H	α-helix	trans	-66	-40.9	171.7	-73.8	-66.2	0	0	0	111.7	S580 E581 F586 C587 Y588 I592 G595 S596 V597	S580-Y584 WeakPolarHBondContact O-CD2 3.47Å; S580-Y584 PolarHBondContact O-N 2.85Å; E581-Y584 WeakPolarHBondContact O-CB 3.37Å; E581-Y584 PolarHBondContact O-N 3.17Å; Y584-F586 VanDerWaalsContact C-N 3.32Å; Y584-F586 PolarHBondContact O-N 3.25Å; Y584-C587 CarbonylContact O-C 3.56Å; Y584-C587 PolarHBondContact O-N 2.99Å; Y584-Y588 PolarHBondContact O-N 2.75Å; Y584-I592 HydrophobicContact CD1-CG2 4.49Å; Y584-I592 HydrophobicContact CE1-CG2 3.94Å; Y584-G595 VanDerWaalsContact OH-CA 3.26Å; Y584-G595 WeakPolarHBondContact OH-CA 3.14Å; Y584-G595 PolarHBondContact OH-N 2.94Å; Y584-S596 PolarHBondContact OH-N 2.93Å; Y584-V597 HydrophobicContact CD1-CG2 3.98Å; Y584-V597 HydrophobicContact CD2-CG2 4.25Å; Y584-V597 HydrophobicContact CE1-CB 4.35Å; Y584-V597 HydrophobicContact CE1-CG2 3.43Å; Y584-V597 VanDerWaalsContact CE1-CG2 3.43Å; Y584-V597 HydrophobicContact CE2-CB 3.86Å; Y584-V597 HydrophobicContact CE2-CG2 3.73Å; Y584-V597 HydrophobicContact CG-CG2 4.35Å; Y584-V597 WeakPolarHBondContact OH-CG2 3.44Å; Y584-V597 PolarHBondContact OH-N 2.7Å
585	D	77.2	Confident	77.8	Confident	64 Å²	64	67.5 Å²	67.5	34%	0.342	35%	0.354	S	S	.	.	H	α-helix	trans	-61.5	-41.9	175.4	-70.9	-20.3	0	0	0	111.7	E581 C587 Y588	E581-D585 PolarHBondContact O-N 2.76Å; D585-C587 VanDerWaalsContact C-N 3.28Å; D585-C587 PolarHBondContact O-N 3.35Å; D585-Y588 WeakPolarHBondContact O-CB 3.48Å; D585-Y588 PolarHBondContact O-N 3.18Å
586	F	80.3	Confident	77.8	Confident	25 Å²	25	67.6 Å²	67.6	11%	0.11	36%	0.355	C	S	.	.	H	α-helix	trans	-62.6	-36.8	177.8	175.6	-102.9	0	0	0	112.8	L571 E582 V583 Y584 Y588 L628 R631 I633 I638 L640	L571-F586 HydrophobicContact CD2-CD1 4.07Å; L571-F586 HydrophobicContact CD2-CE1 4.2Å; E582-F586 WeakPolarHBondContact O-CB 3.49Å; E582-F586 PolarHBondContact O-N 3.03Å; V583-F586 PolarHBondContact O-N 3.24Å; Y584-F586 VanDerWaalsContact C-N 3.32Å; Y584-F586 PolarHBondContact O-N 3.25Å; F586-Y588 VanDerWaalsContact C-N 3.27Å; F586-Y588 PolarHBondContact O-N 3.11Å; F586-L628 HydrophobicContact CD1-CD1 4.28Å; F586-L628 HydrophobicContact CE1-CB 3.78Å; F586-L628 HydrophobicContact CE1-CD1 4.02Å; F586-L628 HydrophobicContact CE1-CG 4.39Å; F586-L628 HydrophobicContact CZ-CB 3.8Å; F586-L628 WeakPolarHBondContact CZ-O 3.32Å; F586-R631 HydrophobicContact CE2-CB 3.5Å; F586-R631 VanDerWaalsContact CE2-CB 3.5Å; F586-R631 HydrophobicContact CZ-CB 3.93Å; F586-I633 HydrophobicContact CB-CD1 3.55Å; F586-I633 HydrophobicContact CB-CG1 4.08Å; F586-I633 HydrophobicContact CD1-CD1 4.08Å; F586-I633 HydrophobicContact CD2-CD1 3.49Å; F586-I633 VanDerWaalsContact CD2-CD1 3.49Å; F586-I633 HydrophobicContact CD2-CG1 3.27Å; F586-I633 HydrophobicContact CE2-CD1 4.09Å; F586-I633 HydrophobicContact CE2-CG1 3.75Å; F586-I633 HydrophobicContact CG-CD1 3.44Å; F586-I633 VanDerWaalsContact CG-CD1 3.44Å; F586-I633 HydrophobicContact CG-CG1 3.81Å; F586-I638 HydrophobicContact CE1-CB 4.44Å; F586-I638 HydrophobicContact CE1-CG2 4.22Å; F586-I638 HydrophobicContact CE2-CB 4.34Å; F586-I638 HydrophobicContact CE2-CG1 4.26Å; F586-I638 HydrophobicContact CZ-CB 3.89Å; F586-I638 HydrophobicContact CZ-CG1 4.27Å; F586-I638 HydrophobicContact CZ-CG2 4.16Å; F586-L640 HydrophobicContact CE1-CD1 3.9Å; F586-L640 HydrophobicContact CE1-CD2 4.45Å; F586-L640 HydrophobicContact CZ-CD1 4.11Å
587	C	78.2	Confident	78	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.02	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	24.8	178.2	-64	0	0	0	0	113.8	V583 Y584 D585 G589 Y590 I592 L628	V583-C587 PolarHBondContact O-N 3.14Å; Y584-C587 CarbonylContact O-C 3.56Å; Y584-C587 PolarHBondContact O-N 2.99Å; D585-C587 VanDerWaalsContact C-N 3.28Å; D585-C587 PolarHBondContact O-N 3.35Å; C587-G589 PolarHBondContact O-N 3.1Å; C587-G589 VanDerWaalsContact O-N 3.16Å; C587-Y590 WeakPolarHBondContact O-CD2 3.11Å; C587-Y590 PolarHBondContact O-N 3.17Å; C587-I592 HydrophobicContact CB-CD1 3.03Å; C587-I592 HydrophobicContact CB-CG1 4.37Å; C587-L628 HydrophobicContact CB-CD1 4.14Å
588	Y	75.5	Confident	78.4	Confident	92 Å²	92	58.2 Å²	58.2	36%	0.361	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	113	-177	-173.3	-100.7	0	0	0	113.7	A24 I68 K98 Y584 D585 F586	A24-Y588 HydrophobicContact CB-CE1 4.11Å; A24-Y588 WeakPolarHBondContact CB-OH 3.28Å; I68-Y588 WeakPolarHBondContact CG2-OH 3.49Å; K98-Y588 PolarHBondContact NZ-O 2.86Å; Y584-Y588 PolarHBondContact O-N 2.75Å; D585-Y588 WeakPolarHBondContact O-CB 3.48Å; D585-Y588 PolarHBondContact O-N 3.18Å; F586-Y588 VanDerWaalsContact C-N 3.27Å; F586-Y588 PolarHBondContact O-N 3.11Å
589	G	71.6	Confident	78.6	Confident	62 Å²	62	59 Å²	59	64%	0.639	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	117.7	-4.1	-179.2	0	0	0	0	0	114.5	C587	C587-G589 PolarHBondContact O-N 3.1Å; C587-G589 VanDerWaalsContact O-N 3.16Å
590	Y	82.1	Confident	78.6	Confident	40 Å²	40	54.8 Å²	54.8	16%	0.157	31%	0.313	C	S	.	.	S	Bend	trans	-107.9	153.1	169.7	-53.8	-84.8	0	0	0	110.1	C587 I592 F615 A624 E627 L628	C587-Y590 WeakPolarHBondContact O-CD2 3.11Å; C587-Y590 PolarHBondContact O-N 3.17Å; Y590-I592 PolarHBondContact O-N 3.37Å; Y590-I592 VanDerWaalsContact O-N 3.15Å; Y590-F615 HydrophobicContact CG-CE1 4.1Å; Y590-A624 HydrophobicContact CD1-CB 3.79Å; Y590-A624 HydrophobicContact CD2-CB 4.09Å; Y590-A624 HydrophobicContact CE1-CB 3.89Å; Y590-A624 HydrophobicContact CE2-CB 4.18Å; Y590-A624 HydrophobicContact CG-CB 3.91Å; Y590-E627 WeakPolarHBondContact OH-CB 3.32Å; Y590-E627 PolarHBondContact OH-OE2 3.48Å; Y590-L628 HydrophobicContact CD2-CD1 3.92Å; Y590-L628 HydrophobicContact CE2-CD1 3.58Å; Y590-L628 HydrophobicContact CE2-CD2 3.95Å; Y590-L628 HydrophobicContact CE2-CG 3.74Å
591	R	78.3	Confident	78.6	Confident	101 Å²	101	58.9 Å²	58.9	38%	0.381	32%	0.321	S	S	.	.			trans	-87	92.6	179.1	-47.9	180	179.2	-169.1	-3.4	108.9	F615 E616 E620	R591-F615 WeakPolarHBondContact O-CA 3.49Å; R591-E616 HydrophobicContact CB-CB 4.02Å; R591-E616 VanDerWaalsContact CB-OE2 3.25Å; R591-E616 WeakPolarHBondContact CB-OE2 3.35Å; R591-E616 WeakPolarHBondContact CD-OE2 3.21Å; R591-E616 IonicContact NH1-OE2 3.34Å; R591-E616 PolarHBondContact O-N 2.87Å; R591-E620 VanDerWaalsContact CA-OE2 3.31Å; R591-E620 WeakPolarHBondContact CA-OE2 3.45Å; R591-E620 WeakPolarHBondContact CB-OE2 3.18Å; R591-E620 VanDerWaalsContact CD-OE1 3.25Å; R591-E620 WeakPolarHBondContact CD-OE1 3.44Å; R591-E620 WeakPolarHBondContact CG-OE1 3.25Å; R591-E620 VanDerWaalsContact CG-OE2 3.32Å; R591-E620 WeakPolarHBondContact CG-OE2 3.36Å; R591-E620 PolarHBondContact N-OE2 3.15Å; R591-E620 IonicContact NE-OE1 2.93Å
592	I	83.6	Confident	78.4	Confident	21 Å²	21	59.7 Å²	59.7	11%	0.108	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-93.7	138.8	171	-64.4	169.5	0	0	0	107.9	Y584 C587 Y590 P594 S596 L613 V614 F615	Y584-I592 HydrophobicContact CD1-CG2 4.49Å; Y584-I592 HydrophobicContact CE1-CG2 3.94Å; C587-I592 HydrophobicContact CB-CD1 3.03Å; C587-I592 HydrophobicContact CB-CG1 4.37Å; Y590-I592 PolarHBondContact O-N 3.37Å; Y590-I592 VanDerWaalsContact O-N 3.15Å; I592-P594 VanDerWaalsContact O-CD 3.24Å; I592-P594 WeakPolarHBondContact O-CD 3.2Å; I592-S596 WeakPolarHBondContact CG2-OG 2.85Å; I592-L613 HydrophobicContact CD1-CD1 4.16Å; I592-L613 HydrophobicContact CD1-CD2 4.19Å; I592-L613 HydrophobicContact CG1-CD1 4.4Å; I592-L613 HydrophobicContact CG2-CB 4.4Å; I592-V614 WeakPolarHBondContact CG2-O 3.44Å; I592-F615 HydrophobicContact CD1-CD1 4.44Å; I592-F615 HydrophobicContact CD1-CE1 3.83Å; I592-F615 HydrophobicContact CD1-CZ 4.16Å; I592-F615 HydrophobicContact CG1-CD1 3.6Å; I592-F615 HydrophobicContact CG1-CE1 3.47Å; I592-F615 VanDerWaalsContact CG1-CE1 3.47Å; I592-F615 HydrophobicContact CG1-CG 4.34Å; I592-F615 HydrophobicContact CG1-CZ 4.15Å
593	I	79.5	Confident	77.8	Confident	69 Å²	69	62.9 Å²	62.9	35%	0.354	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-62.8	118.2	175.7	-60.1	177.8	0	0	0	108.2	P566 G595 S596 V614	P566-I593 HydrophobicContact CB-CD1 4.06Å; I593-G595 PolarHBondContact O-N 3.05Å; I593-S596 WeakPolarHBondContact O-CB 3.49Å; I593-S596 PolarHBondContact O-N 3.08Å; I593-S596 PolarHBondContact O-OG 3.38Å; I593-V614 HydrophobicContact CD1-CB 4.15Å; I593-V614 HydrophobicContact CD1-CG1 3.67Å; I593-V614 HydrophobicContact CG1-CG1 4.49Å; I593-V614 PolarHBondContact N-O 3.09Å
594	P	72.3	Confident	77.1	Confident	118 Å²	118	66.3 Å²	66.3	77%	0.766	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	133.6	178.9	-23.6	34.5	0	0	0	110.8	I592 S596	I592-P594 VanDerWaalsContact O-CD 3.24Å; I592-P594 WeakPolarHBondContact O-CD 3.2Å; P594-S596 VanDerWaalsContact C-N 3.32Å; P594-S596 PolarHBondContact O-N 3.21Å
595	G	72.7	Confident	76.3	Confident	71 Å²	71	65.6 Å²	65.6	73%	0.732	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	-5.9	-173.1	0	0	0	0	0	116.1	Y584 I593 V597	Y584-G595 VanDerWaalsContact OH-CA 3.26Å; Y584-G595 WeakPolarHBondContact OH-CA 3.14Å; Y584-G595 PolarHBondContact OH-N 2.94Å; I593-G595 PolarHBondContact O-N 3.05Å; G595-V597 VanDerWaalsContact C-N 3.3Å; G595-V597 PolarHBondContact O-N 3.19Å
596	S	77.8	Confident	75.9	Confident	25 Å²	25	69.5 Å²	69.5	18%	0.175	40%	0.404	C	S	.	.			trans	-78.3	-7.6	179.1	70.6	0	0	0	0	115.3	Y584 I592 I593 P594 S598 V614	Y584-S596 PolarHBondContact OH-N 2.93Å; I592-S596 WeakPolarHBondContact CG2-OG 2.85Å; I593-S596 WeakPolarHBondContact O-CB 3.49Å; I593-S596 PolarHBondContact O-N 3.08Å; I593-S596 PolarHBondContact O-OG 3.38Å; P594-S596 VanDerWaalsContact C-N 3.32Å; P594-S596 PolarHBondContact O-N 3.21Å; S596-S598 PolarHBondContact O-N 3.44Å; S596-V614 PolarHBondContact OG-N 3.03Å; S596-V614 PolarHBondContact OG-O 2.9Å
597	V	82.1	Confident	75.6	Confident	16 Å²	16	70.4 Å²	70.4	10%	0.097	41%	0.413	C	S	.	.			trans	-76.7	111.7	178.3	173.5	0	0	0	0	109.1	V583 Y584 G595 T612 L613	V583-V597 HydrophobicContact CB-CG1 3.87Å; V583-V597 HydrophobicContact CG1-CG1 3.76Å; V583-V597 HydrophobicContact CG1-CG2 4.05Å; V583-V597 HydrophobicContact CG2-CG1 4.32Å; Y584-V597 HydrophobicContact CD1-CG2 3.98Å; Y584-V597 HydrophobicContact CD2-CG2 4.25Å; Y584-V597 HydrophobicContact CE1-CB 4.35Å; Y584-V597 HydrophobicContact CE1-CG2 3.43Å; Y584-V597 VanDerWaalsContact CE1-CG2 3.43Å; Y584-V597 HydrophobicContact CE2-CB 3.86Å; Y584-V597 HydrophobicContact CE2-CG2 3.73Å; Y584-V597 HydrophobicContact CG-CG2 4.35Å; Y584-V597 WeakPolarHBondContact OH-CG2 3.44Å; Y584-V597 PolarHBondContact OH-N 2.7Å; G595-V597 VanDerWaalsContact C-N 3.3Å; G595-V597 PolarHBondContact O-N 3.19Å; V597-T612 CarbonylContact C-O 3.55Å; V597-T612 WeakPolarHBondContact CA-O 3.49Å; V597-L613 HydrophobicContact CG2-CB 3.91Å
598	S	80.3	Confident	75.4	Confident	72 Å²	72	77.1 Å²	77.1	50%	0.503	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	115.4	175.7	-175.4	0	0	0	0	110.3	S596 A611 T612	S596-S598 PolarHBondContact O-N 3.44Å; S598-A611 CarbonylContact O-C 3.55Å; S598-A611 VanDerWaalsContact O-CA 3.23Å; S598-A611 WeakPolarHBondContact O-CA 3.24Å; S598-T612 PolarHBondContact N-O 3.06Å; S598-T612 PolarHBondContact O-N 3.45Å
599	L	82.8	Confident	75.3	Confident	29 Å²	29	73 Å²	73	15%	0.152	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	127.8	172.7	-68	167.4	0	0	0	108.8	I578 V583 Y601 A611	I578-L599 HydrophobicContact CG2-CD2 3.77Å; V583-L599 HydrophobicContact CG2-CD2 4.37Å; L599-Y601 HydrophobicContact CB-CD2 4.4Å; L599-Y601 HydrophobicContact CB-CE2 3.57Å; L599-Y601 WeakPolarHBondContact CD1-OH 3.3Å; L599-Y601 WeakPolarHBondContact O-CD2 3.49Å; L599-Y601 WeakPolarHBondContact O-CE2 3.28Å; L599-A611 HydrophobicContact CD2-CB 4.01Å
600	Q	78.9	Confident	75.8	Confident	54 Å²	54	70.5 Å²	70.5	25%	0.252	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	119.7	179.4	-63.5	-179.4	-1.4	0	0	110.2	K608 S610 T612	Q600-K608 WeakPolarHBondContact O-CB 3.21Å; Q600-K608 PolarHBondContact O-N 3.08Å; Q600-S610 WeakPolarHBondContact CB-O 3.42Å; Q600-S610 PolarHBondContact N-O 3Å; Q600-S610 PolarHBondContact OE1-OG 3.16Å; Q600-T612 PolarHBondContact NE2-OG1 2.72Å
601	Y	77.9	Confident	75.9	Confident	136 Å²	136	68.6 Å²	68.6	53%	0.533	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	143.6	173.9	-60.5	-90	0	0	0	110.2	L599 P607	L599-Y601 HydrophobicContact CB-CD2 4.4Å; L599-Y601 HydrophobicContact CB-CE2 3.57Å; L599-Y601 WeakPolarHBondContact CD1-OH 3.3Å; L599-Y601 WeakPolarHBondContact O-CD2 3.49Å; L599-Y601 WeakPolarHBondContact O-CE2 3.28Å; Y601-P607 HydrophobicContact CD1-CB 4.04Å; Y601-P607 HydrophobicContact CE1-CB 3.94Å
602	E	74.6	Confident	76.3	Confident	109 Å²	109	65.4 Å²	65.4	51%	0.509	38%	0.384	S	S	.	.			trans	-71	154.3	169.1	-169.6	172.1	-116.8	0	0	109.8	S604 G605 K606	E602-S604 PolarHBondContact O-N 3.21Å; E602-S604 PolarHBondContact OE2-OG 3.22Å; E602-G605 PolarHBondContact O-N 2.77Å; E602-K606 PolarHBondContact N-O 2.84Å
603	P	65.4	Low	76.5	Confident	143 Å²	143	64.4 Å²	64.4	93%	0.929	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-15.8	175	-27.2	35.4	0	0	0	114.7	G605	P603-G605 VanDerWaalsContact C-N 3.27Å
604	S	66.4	Low	76.9	Confident	72 Å²	72	62.4 Å²	62.4	50%	0.503	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-2.8	172.9	67.6	0	0	0	0	114.1	E602 K606	E602-S604 PolarHBondContact O-N 3.21Å; E602-S604 PolarHBondContact OE2-OG 3.22Å; S604-K606 VanDerWaalsContact C-N 3.31Å
605	G	64.8	Low	77.5	Confident	56 Å²	56	56.8 Å²	56.8	58%	0.577	33%	0.334	S	S	*	.	S	Bend	trans	80.6	3.3	-176.2	0	0	0	0	0	114.6	E602 P603	E602-G605 PolarHBondContact O-N 2.77Å; P603-G605 VanDerWaalsContact C-N 3.27Å
606	K	68.9	Low	77.9	Confident	145 Å²	145	58.5 Å²	58.5	63%	0.63	32%	0.322	S	S	*	.			trans	-85.5	135.1	178.3	-67.5	-178.6	-179.5	177.2	0	111.4	E602 S604 K608	E602-K606 PolarHBondContact N-O 2.84Å; S604-K606 VanDerWaalsContact C-N 3.31Å; K606-K608 PolarHBondContact O-N 3.42Å
607	P	73.8	Confident	78.2	Confident	45 Å²	45	58 Å²	58	29%	0.292	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	128.6	176.6	25.9	-31.4	0	0	0	110.2	F576 Y601 G609	F576-P607 HydrophobicContact CB-CG 3.92Å; F576-P607 HydrophobicContact CD1-CG 4.25Å; F576-P607 WeakPolarHBondContact CD1-O 3.01Å; F576-P607 WeakPolarHBondContact CE1-O 3.22Å; F576-P607 WeakPolarHBondContact O-CG 3.22Å; Y601-P607 HydrophobicContact CD1-CB 4.04Å; Y601-P607 HydrophobicContact CE1-CB 3.94Å; P607-G609 PolarHBondContact O-N 2.89Å
608	K	74.1	Confident	78.2	Confident	144 Å²	144	63.7 Å²	63.7	63%	0.626	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	-8.1	-178.3	-165.3	175	176.9	-177.7	0	112.8	Q600 K606	Q600-K608 WeakPolarHBondContact O-CB 3.21Å; Q600-K608 PolarHBondContact O-N 3.08Å; K606-K608 PolarHBondContact O-N 3.42Å
609	G	74.1	Confident	78.2	Confident	6 Å²	6	65.2 Å²	65.2	6%	0.062	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	69.6	25.1	-172.4	0	0	0	0	0	112.2	N573 L574 P607	N573-G609 PolarHBondContact N-O 3.46Å; L574-G609 PolarHBondContact N-O 3.23Å; L574-G609 WeakPolarHBondContact O-CA 3.45Å; P607-G609 PolarHBondContact O-N 2.89Å
610	S	81.4	Confident	78.2	Confident	8 Å²	8	65.5 Å²	65.5	6%	0.056	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	146.5	172.2	50.8	0	0	0	0	110.7	L571 Q600	L571-S610 CarbonylContact O-C 3.52Å; L571-S610 WeakPolarHBondContact O-CA 3.25Å; L571-S610 WeakPolarHBondContact O-CB 3.46Å; Q600-S610 WeakPolarHBondContact CB-O 3.42Å; Q600-S610 PolarHBondContact N-O 3Å; Q600-S610 PolarHBondContact OE1-OG 3.16Å
611	A	84.4	Confident	78.5	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	156.3	174.7	0	0	0	0	0	109.8	Q570 L571 L574 S598 L599	Q570-A611 CarbonylContact C-O 3.57Å; Q570-A611 WeakPolarHBondContact CA-O 3.29Å; L571-A611 HydrophobicContact CB-CB 4.35Å; L571-A611 PolarHBondContact N-O 3.26Å; L571-A611 PolarHBondContact O-N 3.19Å; L574-A611 HydrophobicContact CD1-CB 3.34Å; S598-A611 CarbonylContact O-C 3.55Å; S598-A611 VanDerWaalsContact O-CA 3.23Å; S598-A611 WeakPolarHBondContact O-CA 3.24Å; L599-A611 HydrophobicContact CD2-CB 4.01Å
612	T	86.3	Confident	78.8	Confident	35 Å²	35	60 Å²	60	22%	0.215	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	138.4	169.9	-55.2	0	0	0	0	108.1	V569 V597 S598 Q600	V569-T612 WeakPolarHBondContact O-CA 3.37Å; V597-T612 CarbonylContact C-O 3.55Å; V597-T612 WeakPolarHBondContact CA-O 3.49Å; S598-T612 PolarHBondContact N-O 3.06Å; S598-T612 PolarHBondContact O-N 3.45Å; Q600-T612 PolarHBondContact NE2-OG1 2.72Å
613	L	88.4	Confident	79.2	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	156.8	175	58.5	81.5	0	0	0	110.5	C568 V569 L571 V583 I592 V597 F615	C568-L613 WeakPolarHBondContact CA-O 3.38Å; V569-L613 HydrophobicContact CB-CD1 4.02Å; V569-L613 PolarHBondContact N-O 3.39Å; V569-L613 PolarHBondContact O-N 2.86Å; L571-L613 HydrophobicContact CD1-CD1 4.27Å; L571-L613 HydrophobicContact CD1-CD2 3.23Å; L571-L613 HydrophobicContact CD1-CG 3.51Å; L571-L613 HydrophobicContact CD2-CD2 4.01Å; L571-L613 HydrophobicContact CG-CD2 4.27Å; V583-L613 HydrophobicContact CG1-CD2 3.83Å; I592-L613 HydrophobicContact CD1-CD1 4.16Å; I592-L613 HydrophobicContact CD1-CD2 4.19Å; I592-L613 HydrophobicContact CG1-CD1 4.4Å; I592-L613 HydrophobicContact CG2-CB 4.4Å; V597-L613 HydrophobicContact CG2-CB 3.91Å; L613-F615 HydrophobicContact CD1-CD2 3.58Å; L613-F615 HydrophobicContact CD1-CE1 4.29Å; L613-F615 HydrophobicContact CD1-CE2 3.04Å; L613-F615 HydrophobicContact CD1-CG 4.43Å; L613-F615 HydrophobicContact CD1-CZ 3.43Å; L613-F615 VanDerWaalsContact CD1-CZ 3.43Å; L613-F615 HydrophobicContact CG-CE2 4.49Å
614	V	86.8	Confident	80	Confident	27 Å²	27	50 Å²	50	16%	0.164	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	120.4	-176.1	-171.8	0	0	0	0	109.3	P566 I592 I593 S596	P566-V614 HydrophobicContact CB-CG1 3.92Å; I592-V614 WeakPolarHBondContact CG2-O 3.44Å; I593-V614 HydrophobicContact CD1-CB 4.15Å; I593-V614 HydrophobicContact CD1-CG1 3.67Å; I593-V614 HydrophobicContact CG1-CG1 4.49Å; I593-V614 PolarHBondContact N-O 3.09Å; S596-V614 PolarHBondContact OG-N 3.03Å; S596-V614 PolarHBondContact OG-O 2.9Å
615	F	86.6	Confident	80.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	147.5	171.7	-67.5	-87.9	0	0	0	110.3	P566 T567 V569 Y590 R591 I592 L613 S617 E620 A621 A624	P566-F615 CarbonylContact C-O 3.54Å; P566-F615 WeakPolarHBondContact CA-O 3.37Å; T567-F615 PolarHBondContact N-O 3.27Å; T567-F615 PolarHBondContact O-N 2.9Å; V569-F615 HydrophobicContact CB-CD2 4.06Å; V569-F615 HydrophobicContact CB-CE2 3.69Å; V569-F615 HydrophobicContact CG1-CE2 4.16Å; V569-F615 HydrophobicContact CG2-CD2 3.58Å; V569-F615 HydrophobicContact CG2-CE2 3.52Å; Y590-F615 HydrophobicContact CG-CE1 4.1Å; R591-F615 WeakPolarHBondContact O-CA 3.49Å; I592-F615 HydrophobicContact CD1-CD1 4.44Å; I592-F615 HydrophobicContact CD1-CE1 3.83Å; I592-F615 HydrophobicContact CD1-CZ 4.16Å; I592-F615 HydrophobicContact CG1-CD1 3.6Å; I592-F615 HydrophobicContact CG1-CE1 3.47Å; I592-F615 VanDerWaalsContact CG1-CE1 3.47Å; I592-F615 HydrophobicContact CG1-CG 4.34Å; I592-F615 HydrophobicContact CG1-CZ 4.15Å; L613-F615 HydrophobicContact CD1-CD2 3.58Å; L613-F615 HydrophobicContact CD1-CE1 4.29Å; L613-F615 HydrophobicContact CD1-CE2 3.04Å; L613-F615 HydrophobicContact CD1-CG 4.43Å; L613-F615 HydrophobicContact CD1-CZ 3.43Å; L613-F615 VanDerWaalsContact CD1-CZ 3.43Å; L613-F615 HydrophobicContact CG-CE2 4.49Å; F615-S617 PolarHBondContact O-N 3.47Å; F615-E620 HydrophobicContact CD1-CB 4.48Å; F615-A621 HydrophobicContact CB-CB 3.93Å; F615-A621 HydrophobicContact CD2-CB 3.58Å; F615-A621 HydrophobicContact CE2-CB 4.28Å; F615-A621 HydrophobicContact CG-CB 3.89Å; F615-A624 HydrophobicContact CD1-CB 4.47Å; F615-A624 HydrophobicContact CE1-CB 3.53Å; F615-A624 HydrophobicContact CE2-CB 4.08Å; F615-A624 HydrophobicContact CZ-CB 3.29Å
616	E	80.8	Confident	81.6	Confident	106 Å²	106	53.3 Å²	53.3	50%	0.495	26%	0.257	S	S	.	.	S	Bend	trans	-62.9	-32.7	177.2	-169.7	178.2	-173.1	0	0	111.8	R591	R591-E616 HydrophobicContact CB-CB 4.02Å; R591-E616 VanDerWaalsContact CB-OE2 3.25Å; R591-E616 WeakPolarHBondContact CB-OE2 3.35Å; R591-E616 WeakPolarHBondContact CD-OE2 3.21Å; R591-E616 IonicContact NH1-OE2 3.34Å; R591-E616 PolarHBondContact O-N 2.87Å
617	S	83.6	Confident	82.1	Confident	14 Å²	14	52 Å²	52	10%	0.098	25%	0.252	C	S	.	.			trans	-129.5	147.9	-178	160.2	0	0	0	0	111.6	D564 F615 Q619 E620 A621	D564-S617 PolarHBondContact OD1-OG 3.45Å; D564-S617 PolarHBondContact OD2-OG 2.9Å; F615-S617 PolarHBondContact O-N 3.47Å; S617-Q619 VanDerWaalsContact C-N 3.3Å; S617-Q619 WeakPolarHBondContact OG-CB 3.26Å; S617-Q619 PolarHBondContact OG-N 3.47Å; S617-Q619 VanDerWaalsContact OG-N 3.08Å; S617-E620 PolarHBondContact O-N 3.23Å; S617-E620 PolarHBondContact OG-N 3.3Å; S617-A621 PolarHBondContact O-N 3.5Å
618	R	82.9	Confident	82.4	Confident	137 Å²	137	50 Å²	50	52%	0.517	24%	0.239	S	C	.	.	H	α-helix	trans	-66.9	-36.6	173.2	-175.2	178.4	175.7	-160.1	-0.4	111.1	D564 G565 T567 E620 A621 L622	D564-R618 PolarHBondContact OD1-N 2.92Å; G565-R618 PolarHBondContact O-N 3.25Å; T567-R618 HydrophobicContact CG2-CG 4.42Å; T567-R618 WeakPolarHBondContact OG1-CA 3.22Å; T567-R618 VanDerWaalsContact OG1-CB 3.24Å; T567-R618 WeakPolarHBondContact OG1-CB 3.37Å; R618-E620 VanDerWaalsContact C-N 3.3Å; R618-A621 PolarHBondContact O-N 2.85Å; R618-L622 HydrophobicContact CG-CD1 4.39Å; R618-L622 WeakPolarHBondContact O-CG 3.32Å; R618-L622 PolarHBondContact O-N 2.77Å
619	Q	80.2	Confident	82.8	Confident	103 Å²	103	47 Å²	47	48%	0.481	23%	0.23	S	C	.	.	H	α-helix	trans	-63.2	-42.1	177.7	-171.9	61.2	32.1	0	0	110.4	D564 S617 L622 T623	D564-Q619 PolarHBondContact OD1-N 2.97Å; S617-Q619 VanDerWaalsContact C-N 3.3Å; S617-Q619 WeakPolarHBondContact OG-CB 3.26Å; S617-Q619 PolarHBondContact OG-N 3.47Å; S617-Q619 VanDerWaalsContact OG-N 3.08Å; Q619-L622 PolarHBondContact O-N 3.47Å; Q619-T623 WeakPolarHBondContact O-CG2 3.26Å; Q619-T623 PolarHBondContact O-N 3.31Å; Q619-T623 PolarHBondContact O-OG1 3.46Å
620	E	82.9	Confident	82.8	Confident	36 Å²	36	48.3 Å²	48.3	17%	0.168	24%	0.244	C	C	.	.	H	α-helix	trans	-65.8	-42	176.5	-69.4	-167.5	-179.4	0	0	112.5	R591 F615 S617 R618 L622 T623 A624	R591-E620 VanDerWaalsContact CA-OE2 3.31Å; R591-E620 WeakPolarHBondContact CA-OE2 3.45Å; R591-E620 WeakPolarHBondContact CB-OE2 3.18Å; R591-E620 VanDerWaalsContact CD-OE1 3.25Å; R591-E620 WeakPolarHBondContact CD-OE1 3.44Å; R591-E620 WeakPolarHBondContact CG-OE1 3.25Å; R591-E620 VanDerWaalsContact CG-OE2 3.32Å; R591-E620 WeakPolarHBondContact CG-OE2 3.36Å; R591-E620 PolarHBondContact N-OE2 3.15Å; R591-E620 IonicContact NE-OE1 2.93Å; F615-E620 HydrophobicContact CD1-CB 4.48Å; S617-E620 PolarHBondContact O-N 3.23Å; S617-E620 PolarHBondContact OG-N 3.3Å; R618-E620 VanDerWaalsContact C-N 3.3Å; E620-L622 VanDerWaalsContact C-N 3.31Å; E620-L622 PolarHBondContact O-N 2.77Å; E620-T623 WeakPolarHBondContact CA-OG1 3.46Å; E620-T623 PolarHBondContact O-N 2.81Å; E620-T623 PolarHBondContact O-OG1 2.8Å; E620-A624 WeakPolarHBondContact O-CB 3.46Å; E620-A624 PolarHBondContact O-N 3.49Å
621	A	85.1	Confident	82.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-56.9	-43.7	174.3	0	0	0	0	0	112.3	T567 V569 F615 S617 R618 A624 I625 L642	T567-A621 HydrophobicContact CG2-CB 3.74Å; V569-A621 HydrophobicContact CG2-CB 3.82Å; F615-A621 HydrophobicContact CB-CB 3.93Å; F615-A621 HydrophobicContact CD2-CB 3.58Å; F615-A621 HydrophobicContact CE2-CB 4.28Å; F615-A621 HydrophobicContact CG-CB 3.89Å; S617-A621 PolarHBondContact O-N 3.5Å; R618-A621 PolarHBondContact O-N 2.85Å; A621-A624 PolarHBondContact O-N 3.1Å; A621-I625 WeakPolarHBondContact O-CD1 3.43Å; A621-I625 VanDerWaalsContact O-CG1 3.22Å; A621-I625 WeakPolarHBondContact O-CG1 3.39Å; A621-I625 PolarHBondContact O-N 2.95Å; A621-L642 HydrophobicContact CB-CD1 4.38Å
622	L	82.9	Confident	82.3	Confident	75 Å²	75	55.8 Å²	55.8	39%	0.393	28%	0.281	S	S	.	.	H	α-helix	trans	-67.3	-42.4	178.5	-70.5	172.1	0	0	0	112	R618 Q619 E620 A624 I625 E626 L642	R618-L622 HydrophobicContact CG-CD1 4.39Å; R618-L622 WeakPolarHBondContact O-CG 3.32Å; R618-L622 PolarHBondContact O-N 2.77Å; Q619-L622 PolarHBondContact O-N 3.47Å; E620-L622 VanDerWaalsContact C-N 3.31Å; E620-L622 PolarHBondContact O-N 2.77Å; L622-A624 VanDerWaalsContact C-N 3.33Å; L622-A624 PolarHBondContact O-N 2.82Å; L622-I625 PolarHBondContact O-N 3.38Å; L622-E626 PolarHBondContact O-N 3.18Å; L622-L642 HydrophobicContact CD2-CD1 3.99Å
623	T	82.7	Confident	82	Confident	42 Å²	42	55 Å²	55	26%	0.258	28%	0.275	S	S	.	.	H	α-helix	trans	-64.1	-38.9	175.1	52.7	0	0	0	0	112.1	Q619 E620 E626 E627	Q619-T623 WeakPolarHBondContact O-CG2 3.26Å; Q619-T623 PolarHBondContact O-N 3.31Å; Q619-T623 PolarHBondContact O-OG1 3.46Å; E620-T623 WeakPolarHBondContact CA-OG1 3.46Å; E620-T623 PolarHBondContact O-N 2.81Å; E620-T623 PolarHBondContact O-OG1 2.8Å; T623-E626 PolarHBondContact O-N 3.1Å; T623-E627 WeakPolarHBondContact O-CB 3.37Å; T623-E627 PolarHBondContact O-N 3.22Å
624	A	83.7	Confident	81.3	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.8	-39.6	176.1	0	0	0	0	0	111.4	Y590 F615 E620 A621 L622 E626 L628	Y590-A624 HydrophobicContact CD1-CB 3.79Å; Y590-A624 HydrophobicContact CD2-CB 4.09Å; Y590-A624 HydrophobicContact CE1-CB 3.89Å; Y590-A624 HydrophobicContact CE2-CB 4.18Å; Y590-A624 HydrophobicContact CG-CB 3.91Å; F615-A624 HydrophobicContact CD1-CB 4.47Å; F615-A624 HydrophobicContact CE1-CB 3.53Å; F615-A624 HydrophobicContact CE2-CB 4.08Å; F615-A624 HydrophobicContact CZ-CB 3.29Å; E620-A624 WeakPolarHBondContact O-CB 3.46Å; E620-A624 PolarHBondContact O-N 3.49Å; A621-A624 PolarHBondContact O-N 3.1Å; L622-A624 VanDerWaalsContact C-N 3.33Å; L622-A624 PolarHBondContact O-N 2.82Å; A624-E626 VanDerWaalsContact C-N 3.33Å; A624-L628 HydrophobicContact CB-CD1 4.14Å; A624-L628 WeakPolarHBondContact O-CA 3.45Å; A624-L628 WeakPolarHBondContact O-CB 3.4Å; A624-L628 WeakPolarHBondContact O-CG 3.28Å; A624-L628 PolarHBondContact O-N 3.4Å
625	I	84.6	Confident	80.6	Confident	32 Å²	32	62.9 Å²	62.9	16%	0.164	34%	0.339	C	S	.	.	H	α-helix	trans	-63.6	-40	173.5	-69.1	162.4	0	0	0	110.8	V569 A621 L622 N629 L640 L642	V569-I625 HydrophobicContact CG1-CD1 4.34Å; V569-I625 HydrophobicContact CG1-CG1 4.11Å; V569-I625 HydrophobicContact CG2-CD1 4.05Å; V569-I625 HydrophobicContact CG2-CG1 4.45Å; A621-I625 WeakPolarHBondContact O-CD1 3.43Å; A621-I625 VanDerWaalsContact O-CG1 3.22Å; A621-I625 WeakPolarHBondContact O-CG1 3.39Å; A621-I625 PolarHBondContact O-N 2.95Å; L622-I625 PolarHBondContact O-N 3.38Å; I625-N629 WeakPolarHBondContact O-CB 3.33Å; I625-N629 PolarHBondContact O-N 3.02Å; I625-L640 HydrophobicContact CB-CB 4.45Å; I625-L640 HydrophobicContact CG1-CB 3.87Å; I625-L642 HydrophobicContact CD1-CB 3.94Å; I625-L642 HydrophobicContact CD1-CD1 3.73Å; I625-L642 HydrophobicContact CD1-CG 4.44Å
626	E	79.3	Confident	80	Confident	165 Å²	165	66.6 Å²	66.6	77%	0.771	35%	0.353	S	S	*	.	H	α-helix	trans	-70.1	-40.4	-180	-169.1	169.8	-170.3	0	0	112.7	L622 T623 A624	L622-E626 PolarHBondContact O-N 3.18Å; T623-E626 PolarHBondContact O-N 3.1Å; A624-E626 VanDerWaalsContact C-N 3.33Å
627	E	79.1	Confident	80.1	Confident	116 Å²	116	68.1 Å²	68.1	54%	0.542	36%	0.358	S	S	.	.	H	α-helix	trans	-94.6	-25.1	-171.7	-69.4	-174.2	175.7	0	0	114.7	Y590 T623 R631	Y590-E627 WeakPolarHBondContact OH-CB 3.32Å; Y590-E627 PolarHBondContact OH-OE2 3.48Å; T623-E627 WeakPolarHBondContact O-CB 3.37Å; T623-E627 PolarHBondContact O-N 3.22Å; E627-R631 PolarHBondContact O-NE 3.21Å
628	L	80.3	Confident	80.2	Confident	3 Å²	3	67.5 Å²	67.5	2%	0.016	35%	0.353	C	S	.	.	H	α-helix	trans	-101	-17.8	-179.5	-56.2	178.7	0	0	0	113.2	F586 C587 Y590 A624 G630 R631 L640	F586-L628 HydrophobicContact CD1-CD1 4.28Å; F586-L628 HydrophobicContact CE1-CB 3.78Å; F586-L628 HydrophobicContact CE1-CD1 4.02Å; F586-L628 HydrophobicContact CE1-CG 4.39Å; F586-L628 HydrophobicContact CZ-CB 3.8Å; F586-L628 WeakPolarHBondContact CZ-O 3.32Å; C587-L628 HydrophobicContact CB-CD1 4.14Å; Y590-L628 HydrophobicContact CD2-CD1 3.92Å; Y590-L628 HydrophobicContact CE2-CD1 3.58Å; Y590-L628 HydrophobicContact CE2-CD2 3.95Å; Y590-L628 HydrophobicContact CE2-CG 3.74Å; A624-L628 HydrophobicContact CB-CD1 4.14Å; A624-L628 WeakPolarHBondContact O-CA 3.45Å; A624-L628 WeakPolarHBondContact O-CB 3.4Å; A624-L628 WeakPolarHBondContact O-CG 3.28Å; A624-L628 PolarHBondContact O-N 3.4Å; L628-G630 PolarHBondContact O-N 3.24Å; L628-R631 WeakPolarHBondContact O-CB 3.49Å; L628-R631 PolarHBondContact O-N 3.19Å; L628-R631 VanDerWaalsContact O-N 3.08Å; L628-L640 HydrophobicContact CB-CD1 3.86Å; L628-L640 HydrophobicContact CB-CD2 3.95Å; L628-L640 HydrophobicContact CD1-CD2 4.17Å
629	N	82.6	Confident	80.2	Confident	81 Å²	81	65.9 Å²	65.9	43%	0.433	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	125.7	-179.8	-174.1	25.3	0	0	0	111	I625 Q639 L640	I625-N629 WeakPolarHBondContact O-CB 3.33Å; I625-N629 PolarHBondContact O-N 3.02Å; N629-Q639 WeakPolarHBondContact OD1-CA 3.24Å; N629-L640 HydrophobicContact CB-CD1 4.35Å
630	G	73.5	Confident	80.5	Confident	35 Å²	35	61 Å²	61	36%	0.361	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	-5.1	-175.1	0	0	0	0	0	114.8	L628 I638	L628-G630 PolarHBondContact O-N 3.24Å; G630-I638 WeakPolarHBondContact CA-O 3.31Å; G630-I638 PolarHBondContact N-O 2.98Å
631	R	79.4	Confident	80.4	Confident	89 Å²	89	63.5 Å²	63.5	34%	0.336	34%	0.343	S	S	.	.			trans	-68.6	139	174	-75	-166.9	-174.3	-148.4	-3.5	110.9	F586 E627 L628 I638	F586-R631 HydrophobicContact CE2-CB 3.5Å; F586-R631 VanDerWaalsContact CE2-CB 3.5Å; F586-R631 HydrophobicContact CZ-CB 3.93Å; E627-R631 PolarHBondContact O-NE 3.21Å; L628-R631 WeakPolarHBondContact O-CB 3.49Å; L628-R631 PolarHBondContact O-N 3.19Å; L628-R631 VanDerWaalsContact O-N 3.08Å; R631-I638 PolarHBondContact O-N 3.4Å
632	P	76.5	Confident	80.3	Confident	76 Å²	76	67.3 Å²	67.3	49%	0.494	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	136.5	178.9	31.2	-32.6	0	0	0	111.9	R636	P632-R636 CarbonylContact C-O 3.51Å; P632-R636 VanDerWaalsContact CA-O 3.23Å; P632-R636 WeakPolarHBondContact CA-O 3.07Å
633	I	79.6	Confident	79.9	Confident	18 Å²	18	70 Å²	70	9%	0.092	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	112.3	157.7	-60.6	176.3	0	0	0	106.7	L574 P575 I578 F586 R636 I638	L574-I633 HydrophobicContact CD2-CD1 3.82Å; P575-I633 HydrophobicContact CG-CG2 4.24Å; P575-I633 WeakPolarHBondContact CG-O 3.43Å; I578-I633 HydrophobicContact CD1-CD1 3.84Å; I578-I633 HydrophobicContact CD1-CG2 3.96Å; F586-I633 HydrophobicContact CB-CD1 3.55Å; F586-I633 HydrophobicContact CB-CG1 4.08Å; F586-I633 HydrophobicContact CD1-CD1 4.08Å; F586-I633 HydrophobicContact CD2-CD1 3.49Å; F586-I633 VanDerWaalsContact CD2-CD1 3.49Å; F586-I633 HydrophobicContact CD2-CG1 3.27Å; F586-I633 HydrophobicContact CE2-CD1 4.09Å; F586-I633 HydrophobicContact CE2-CG1 3.75Å; F586-I633 HydrophobicContact CG-CD1 3.44Å; F586-I633 VanDerWaalsContact CG-CD1 3.44Å; F586-I633 HydrophobicContact CG-CG1 3.81Å; I633-R636 PolarHBondContact N-O 3.41Å; I633-R636 PolarHBondContact O-N 2.57Å; I633-I638 HydrophobicContact CB-CD1 4.08Å; I633-I638 HydrophobicContact CB-CG1 3.94Å; I633-I638 HydrophobicContact CD1-CD1 4.14Å; I633-I638 HydrophobicContact CD1-CG1 3.6Å; I633-I638 HydrophobicContact CG1-CD1 4.19Å; I633-I638 HydrophobicContact CG1-CG1 3.54Å
634	G	75	Confident	79.7	Confident	65 Å²	65	71.4 Å²	71.4	67%	0.67	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	-127.4	-169.7	0	0	0	0	0	111.1
635	P	71.4	Confident	79.5	Confident	127 Å²	127	75.1 Å²	75.1	83%	0.825	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	1.7	-179.1	34.1	-34.7	0	0	0	114.5
636	R	74.4	Confident	79.2	Confident	79 Å²	79	77.5 Å²	77.5	30%	0.298	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.9	-171.8	-66.6	-171.9	176.5	-175.8	-3	112.5	N573 L574 F576 P632 I633	N573-R636 WeakPolarHBondContact O-CB 3.26Å; L574-R636 PolarHBondContact O-NH1 3.09Å; F576-R636 VanDerWaalsContact CE2-NH2 3.27Å; P632-R636 CarbonylContact C-O 3.51Å; P632-R636 VanDerWaalsContact CA-O 3.23Å; P632-R636 WeakPolarHBondContact CA-O 3.07Å; I633-R636 PolarHBondContact N-O 3.41Å; I633-R636 PolarHBondContact O-N 2.57Å
637	K	81.8	Confident	79.2	Confident	138 Å²	138	72.4 Å²	72.4	60%	0.6	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	123.6	172	-64.3	-177.5	-178.5	178.8	0	110.3	N573	N573-K637 PolarHBondContact ND2-O 2.95Å
638	I	85.8	Confident	79.2	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	39%	0.393	C	S	.	.			trans	-88.7	141.8	-177.2	-52.7	-50	0	0	0	110.1	L571 N573 L574 F586 G630 R631 I633 L640	L571-I638 HydrophobicContact CB-CG2 4.16Å; L571-I638 HydrophobicContact CD2-CG2 4.13Å; L571-I638 HydrophobicContact CG-CG2 4.13Å; N573-I638 VanDerWaalsContact O-CD1 3.24Å; N573-I638 WeakPolarHBondContact O-CD1 3.18Å; L574-I638 HydrophobicContact CD2-CD1 3.59Å; L574-I638 HydrophobicContact CD2-CG1 4.03Å; L574-I638 HydrophobicContact CD2-CG2 3.9Å; L574-I638 HydrophobicContact CG-CD1 4.29Å; F586-I638 HydrophobicContact CE1-CB 4.44Å; F586-I638 HydrophobicContact CE1-CG2 4.22Å; F586-I638 HydrophobicContact CE2-CB 4.34Å; F586-I638 HydrophobicContact CE2-CG1 4.26Å; F586-I638 HydrophobicContact CZ-CB 3.89Å; F586-I638 HydrophobicContact CZ-CG1 4.27Å; F586-I638 HydrophobicContact CZ-CG2 4.16Å; G630-I638 WeakPolarHBondContact CA-O 3.31Å; G630-I638 PolarHBondContact N-O 2.98Å; R631-I638 PolarHBondContact O-N 3.4Å; I633-I638 HydrophobicContact CB-CD1 4.08Å; I633-I638 HydrophobicContact CB-CG1 3.94Å; I633-I638 HydrophobicContact CD1-CD1 4.14Å; I633-I638 HydrophobicContact CD1-CG1 3.6Å; I633-I638 HydrophobicContact CG1-CD1 4.19Å; I633-I638 HydrophobicContact CG1-CG1 3.54Å; I638-L640 HydrophobicContact CG2-CD1 4.27Å
639	Q	82.7	Confident	79.2	Confident	103 Å²	103	74.1 Å²	74.1	48%	0.481	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	133.3	172.9	-68.5	-179.4	-19.3	0	0	110.3	L571 I572 N629	L571-Q639 CarbonylContact C-O 3.26Å; L571-Q639 WeakPolarHBondContact CA-O 3.42Å; I572-Q639 HydrophobicContact CB-CB 4.35Å; I572-Q639 PolarHBondContact N-O 3.32Å; I572-Q639 PolarHBondContact O-N 2.86Å; N629-Q639 WeakPolarHBondContact OD1-CA 3.24Å
640	L	86.7	Confident	78.9	Confident	1 Å²	1	73.6 Å²	73.6	1%	0.005	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.1	176.7	-66.7	80.1	0	0	0	108.8	V569 Q570 L571 F586 I625 L628 N629 I638	V569-L640 HydrophobicContact CG1-CB 3.94Å; V569-L640 HydrophobicContact CG1-CD2 4.25Å; V569-L640 HydrophobicContact CG1-CG 4.42Å; Q570-L640 CarbonylContact O-C 3.54Å; Q570-L640 WeakPolarHBondContact O-CA 3.43Å; L571-L640 HydrophobicContact CD1-CD2 4.43Å; L571-L640 HydrophobicContact CD1-CG 4.3Å; L571-L640 HydrophobicContact CG-CG 4.1Å; F586-L640 HydrophobicContact CE1-CD1 3.9Å; F586-L640 HydrophobicContact CE1-CD2 4.45Å; F586-L640 HydrophobicContact CZ-CD1 4.11Å; I625-L640 HydrophobicContact CB-CB 4.45Å; I625-L640 HydrophobicContact CG1-CB 3.87Å; L628-L640 HydrophobicContact CB-CD1 3.86Å; L628-L640 HydrophobicContact CB-CD2 3.95Å; L628-L640 HydrophobicContact CD1-CD2 4.17Å; N629-L640 HydrophobicContact CB-CD1 4.35Å; I638-L640 HydrophobicContact CG2-CD1 4.27Å
641	L	81.9	Confident	79.4	Confident	88 Å²	88	76.5 Å²	76.5	46%	0.461	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136	178	-64.2	178.4	0	0	0	109.9	V569 Q570 I572	V569-L641 CarbonylContact C-O 3.59Å; V569-L641 WeakPolarHBondContact CA-O 3.43Å; V569-L641 WeakPolarHBondContact CG1-O 3.21Å; Q570-L641 PolarHBondContact N-O 2.84Å; Q570-L641 PolarHBondContact O-N 3.34Å; I572-L641 HydrophobicContact CD1-CD1 3.44Å; I572-L641 VanDerWaalsContact CD1-CD1 3.44Å; I572-L641 HydrophobicContact CD1-CG 4.28Å
642	L	83.4	Confident	79.3	Confident	80 Å²	80	75.5 Å²	75.5	42%	0.419	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	136.9	170.7	-152.3	112.4	0	0	0	109.2	T567 A621 L622 I625	T567-L642 HydrophobicContact CG2-CD1 3.68Å; T567-L642 HydrophobicContact CG2-CD2 4.42Å; T567-L642 HydrophobicContact CG2-CG 4.02Å; A621-L642 HydrophobicContact CB-CD1 4.38Å; L622-L642 HydrophobicContact CD2-CD1 3.99Å; I625-L642 HydrophobicContact CD1-CB 3.94Å; I625-L642 HydrophobicContact CD1-CD1 3.73Å; I625-L642 HydrophobicContact CD1-CG 4.44Å
643	V	73	Confident	79.6	Confident	131 Å²	131	75.5 Å²	75.5	79%	0.794	42%	0.422	S	S	*	.			trans	-103.1	0	-177.6	-176.9	0	0	0	0	111.6	C568 Q570	C568-V643 HydrophobicContact CB-CB 4.22Å; C568-V643 PolarHBondContact O-N 3.04Å; C568-V643 VanDerWaalsContact O-N 3.1Å; Q570-V643 HydrophobicContact CB-CG2 3.48Å; Q570-V643 VanDerWaalsContact CB-CG2 3.48Å

Retrieved 643 of 643 residues in 1299.5 ms (Link to these results)

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