A0A5K4F6B5_SCHMA Loading...

Plexin domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F6B5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 452 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	32.9	Very low	42.5	Very low	202 Å²	202	118.5 Å²	118.5	100%	0.995	60%	0.604	S	S	*	*				0	116.1	0	-143.9	172.3	-162.8	0	0	107.2	N3	M1-N3 PolarHBondContact O-N 2.76Å
2	I	37.3	Very low	43.8	Very low	52 Å²	52	114.3 Å²	114.3	27%	0.267	58%	0.58	S	S	.	*			trans	-68.5	116.2	175.6	-65.6	168.9	0	0	0	106.9	K4 L17 Q26	I2-K4 HydrophobicContact CG2-CB 4.09Å; I2-K4 HydrophobicContact CG2-CG 4.42Å; I2-K4 PolarHBondContact O-N 2.93Å; I2-L17 HydrophobicContact CD1-CD1 3.64Å; I2-L17 HydrophobicContact CD1-CG 4.36Å; I2-L17 HydrophobicContact CG1-CD1 3.3Å; I2-L17 HydrophobicContact CG1-CD2 4.18Å; I2-L17 HydrophobicContact CG1-CG 3.46Å; I2-L17 VanDerWaalsContact CG1-CG 3.46Å; I2-Q26 HydrophobicContact CD1-CG 4.3Å
3	N	41.4	Very low	46.1	Very low	124 Å²	124	109.2 Å²	109.2	66%	0.663	55%	0.553	S	S	*	*			trans	-68.4	87.3	161.4	-81.1	-13.4	0	0	0	106.8	M1 I5	M1-N3 PolarHBondContact O-N 2.76Å; N3-I5 PolarHBondContact O-N 2.85Å; N3-I5 VanDerWaalsContact O-N 3.12Å
4	K	41.9	Very low	48.2	Very low	109 Å²	109	107.9 Å²	107.9	47%	0.474	54%	0.539	S	S	.	.			trans	-75.9	99.9	-175.4	-154.8	178.7	-178.4	-173	0	107	I2 I6 E13	I2-K4 HydrophobicContact CG2-CB 4.09Å; I2-K4 HydrophobicContact CG2-CG 4.42Å; I2-K4 PolarHBondContact O-N 2.93Å; K4-I6 HydrophobicContact CD-CD1 4.08Å; K4-I6 HydrophobicContact CD-CG1 4.13Å; K4-I6 HydrophobicContact CG-CD1 4.43Å; K4-I6 HydrophobicContact CG-CG1 3.95Å; K4-I6 PolarHBondContact O-N 3.5Å; K4-E13 WeakPolarHBondContact CE-OE1 3.29Å; K4-E13 WeakPolarHBondContact CE-OE2 3.39Å; K4-E13 VanDerWaalsContact NZ-CD 3.28Å; K4-E13 IonicContact NZ-OE1 3.69Å; K4-E13 PolarHBondContact NZ-OE1 3.49Å; K4-E13 IonicContact NZ-OE2 3.88Å; K4-E13 PolarHBondContact NZ-OE2 2.89Å
5	I	40.4	Very low	50	Low	105 Å²	105	100.9 Å²	100.9	54%	0.538	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	96	170.2	-58.9	177.6	0	0	0	105.1	N3 Y14	N3-I5 PolarHBondContact O-N 2.85Å; N3-I5 VanDerWaalsContact O-N 3.12Å; I5-Y14 HydrophobicContact CD1-CD1 4.48Å; I5-Y14 PolarHBondContact N-O 2.95Å; I5-Y14 PolarHBondContact O-N 3.2Å
6	I	37.7	Very low	51.7	Low	88 Å²	88	99.8 Å²	99.8	45%	0.451	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	115.4	170.5	-58.7	177.7	0	0	0	106.1	K4	K4-I6 HydrophobicContact CD-CD1 4.08Å; K4-I6 HydrophobicContact CD-CG1 4.13Å; K4-I6 HydrophobicContact CG-CD1 4.43Å; K4-I6 HydrophobicContact CG-CG1 3.95Å; K4-I6 PolarHBondContact O-N 3.5Å
7	N	39.6	Very low	53.1	Low	79 Å²	79	94.7 Å²	94.7	42%	0.422	47%	0.471	S	S	.	.			trans	-79.3	142.2	172.8	-122.3	-7.2	0	0	0	109.1	N9 N10	N7-N9 PolarHBondContact O-N 3.43Å; N7-N10 PolarHBondContact O-N 3.48Å
8	N	38.1	Very low	54.2	Low	165 Å²	165	96.1 Å²	96.1	88%	0.882	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	9.2	-166.8	-89.3	-12.2	0	0	0	117.8
9	N	48.1	Very low	54.9	Low	127 Å²	127	91.5 Å²	91.5	68%	0.679	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	4.8	176.8	-72.6	-1.6	0	0	0	114.5	N7 E11	N7-N9 PolarHBondContact O-N 3.43Å; N9-E11 PolarHBondContact O-N 2.85Å
10	N	51.3	Low	54.9	Low	140 Å²	140	89.4 Å²	89.4	75%	0.749	46%	0.458	S	S	*	.	S	Bend	trans	59.2	5.6	-175.5	-66.3	-25.6	0	0	0	115.7	N7	N7-N10 PolarHBondContact O-N 3.48Å
11	E	58.7	Low	54.8	Low	112 Å²	112	90.6 Å²	90.6	52%	0.523	47%	0.465	S	S	.	.	S	Bend	trans	-96.9	-13.6	-173.7	-71	-176.4	163.2	0	0	114.5	N9	N9-E11 PolarHBondContact O-N 2.85Å
12	E	58.6	Low	55.9	Low	68 Å²	68	87.9 Å²	87.9	32%	0.318	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	125.8	-175.1	-58.5	-173.1	157.7	0	0	111.3	T84	E12-T84 HydrophobicContact CB-CG2 4.44Å; E12-T84 HydrophobicContact CG-CG2 3.96Å
13	E	73.1	Confident	57.2	Low	49 Å²	49	90.2 Å²	90.2	23%	0.229	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	119.2	168.3	-61.2	-169.7	158.4	0	0	109.5	K4 N83	K4-E13 WeakPolarHBondContact CE-OE1 3.29Å; K4-E13 WeakPolarHBondContact CE-OE2 3.39Å; K4-E13 VanDerWaalsContact NZ-CD 3.28Å; K4-E13 IonicContact NZ-OE1 3.69Å; K4-E13 PolarHBondContact NZ-OE1 3.49Å; K4-E13 IonicContact NZ-OE2 3.88Å; K4-E13 PolarHBondContact NZ-OE2 2.89Å; E13-N83 HydrophobicContact CB-CB 4.35Å; E13-N83 PolarHBondContact N-O 3.28Å; E13-N83 PolarHBondContact O-N 3.07Å
14	Y	75.7	Confident	58.9	Low	91 Å²	91	87.4 Å²	87.4	36%	0.357	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	141.8	171.5	-179.5	-96.4	0	0	0	110.6	I5 E80 I81 M82	I5-Y14 HydrophobicContact CD1-CD1 4.48Å; I5-Y14 PolarHBondContact N-O 2.95Å; I5-Y14 PolarHBondContact O-N 3.2Å; Y14-E80 PolarHBondContact OH-OE2 3.13Å; Y14-I81 WeakPolarHBondContact CA-O 3.42Å; Y14-I81 WeakPolarHBondContact CD2-O 3.44Å; Y14-M82 HydrophobicContact CD2-CB 4.3Å
15	G	75.2	Confident	60.8	Low	3 Å²	3	87.2 Å²	87.2	3%	0.031	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	140.1	-178.5	0	0	0	0	0	113.3	I81	G15-I81 PolarHBondContact N-O 2.87Å; G15-I81 PolarHBondContact O-N 2.91Å
16	K	78	Confident	63	Low	82 Å²	82	84.5 Å²	84.5	36%	0.357	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128.6	166.7	-176.9	164	-174.2	150.1	0	109.4	E80 I93	K16-E80 HydrophobicContact CB-CG 4.32Å; K16-E80 HydrophobicContact CD-CG 4.12Å; K16-E80 WeakPolarHBondContact CD-OE1 3.16Å; K16-E80 WeakPolarHBondContact CE-OE1 3.39Å; K16-E80 HydrophobicContact CG-CG 3.97Å; K16-E80 IonicContact NZ-OE1 3.5Å; K16-E80 PolarHBondContact NZ-OE1 3.24Å; K16-I93 VanDerWaalsContact CE-CD1 3.49Å
17	L	75.4	Confident	65.4	Low	14 Å²	14	84.9 Å²	84.9	7%	0.073	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	122.2	174.5	-102	148.5	0	0	0	108.5	I2 Q26 G78 V79 I81	I2-L17 HydrophobicContact CD1-CD1 3.64Å; I2-L17 HydrophobicContact CD1-CG 4.36Å; I2-L17 HydrophobicContact CG1-CD1 3.3Å; I2-L17 HydrophobicContact CG1-CD2 4.18Å; I2-L17 HydrophobicContact CG1-CG 3.46Å; I2-L17 VanDerWaalsContact CG1-CG 3.46Å; L17-Q26 HydrophobicContact CD1-CB 3.87Å; L17-Q26 HydrophobicContact CD1-CG 3.52Å; L17-G78 CarbonylContact O-C 3.6Å; L17-G78 WeakPolarHBondContact O-CA 3.4Å; L17-V79 PolarHBondContact N-O 2.9Å; L17-V79 PolarHBondContact O-N 3.07Å; L17-I81 HydrophobicContact CD1-CD1 3.98Å
18	I	71.9	Confident	67.9	Low	120 Å²	120	82 Å²	82	62%	0.615	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.3	164.1	-57.6	-168.5	0	0	0	106.7
19	W	67.9	Low	70.5	Confident	9 Å²	9	78.5 Å²	78.5	3%	0.034	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	127.4	-173.1	-66.4	45.2	0	0	0	107	Y24 R25 Q26 I46 L47 S48 G77 V79	W19-Y24 AromaticContact CE3-CD1 4Å; W19-Y24 HydrophobicContact CE3-CD1 4Å; W19-Y24 HydrophobicContact CE3-CG 4.42Å; W19-Y24 WeakPolarHBondContact CH2-O 3.32Å; W19-Y24 WeakPolarHBondContact CZ3-O 3.27Å; W19-R25 VanDerWaalsContact CH2-CA 3.41Å; W19-Q26 HydrophobicContact CZ2-CB 4.25Å; W19-I46 VanDerWaalsContact CH2-O 3.23Å; W19-I46 WeakPolarHBondContact CH2-O 3.43Å; W19-L47 VanDerWaalsContact CH2-CA 3.47Å; W19-S48 VanDerWaalsContact CE3-OG 3.32Å; W19-S48 WeakPolarHBondContact CZ3-OG 3.33Å; W19-G77 PolarHBondContact N-O 3.45Å; W19-V79 HydrophobicContact CZ2-CG2 4.35Å
20	G	54.5	Low	72.6	Confident	48 Å²	48	72.9 Å²	72.9	50%	0.495	38%	0.376	S	S	.	.			trans	-132.1	130.6	179.5	0	0	0	0	0	110.4	D22 D76	G20-D22 PolarHBondContact O-N 3.44Å; G20-D76 VanDerWaalsContact CA-OD1 3.26Å; G20-D76 WeakPolarHBondContact CA-OD1 3.49Å
21	N	54.2	Low	74.7	Confident	115 Å²	115	69.1 Å²	69.1	62%	0.615	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	33.4	-35.7	174.9	-93.4	-8.1	0	0	0	121.9	Y24 D76	N21-Y24 PolarHBondContact O-OH 3.36Å; N21-Y24 VanDerWaalsContact O-OH 3.04Å; N21-D76 PolarHBondContact N-OD1 3.24Å
22	D	55	Low	76.4	Confident	145 Å²	145	64.5 Å²	64.5	78%	0.775	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.6	-15.5	-165.3	-64.6	-37.3	0	0	0	115.9	G20	G20-D22 PolarHBondContact O-N 3.44Å
23	T	64.2	Low	78.1	Confident	101 Å²	101	64.6 Å²	64.6	62%	0.62	34%	0.34	S	S	*	.			trans	-129.6	86.3	-180	49	0	0	0	0	112.6	R25	T23-R25 PolarHBondContact O-N 2.87Å
24	Y	77.6	Confident	79	Confident	65 Å²	65	62.8 Å²	62.8	26%	0.255	33%	0.332	S	S	.	.			trans	-81.1	45	173.5	-50.6	-72.6	0	0	0	113.1	W19 N21 D74 K75	W19-Y24 AromaticContact CE3-CD1 4Å; W19-Y24 HydrophobicContact CE3-CD1 4Å; W19-Y24 HydrophobicContact CE3-CG 4.42Å; W19-Y24 WeakPolarHBondContact CH2-O 3.32Å; W19-Y24 WeakPolarHBondContact CZ3-O 3.27Å; N21-Y24 PolarHBondContact O-OH 3.36Å; N21-Y24 VanDerWaalsContact O-OH 3.04Å; Y24-D74 HydrophobicContact CD2-CB 4.47Å; Y24-D74 HydrophobicContact CG-CB 4.38Å; Y24-K75 VanDerWaalsContact CE1-C 3.4Å
25	R	82.8	Confident	79.6	Confident	105 Å²	105	63 Å²	63	40%	0.396	34%	0.335	S	S	.	.			trans	-160.1	136.1	-177.4	-165.3	179.4	-87.7	-161.5	-0.6	113.4	W19 T23 N45 I46 S57	W19-R25 VanDerWaalsContact CH2-CA 3.41Å; T23-R25 PolarHBondContact O-N 2.87Å; R25-N45 WeakPolarHBondContact CD-ND2 3.32Å; R25-N45 WeakPolarHBondContact CD-OD1 3.5Å; R25-N45 WeakPolarHBondContact CG-OD1 3.5Å; R25-N45 PolarHBondContact NE-ND2 2.85Å; R25-N45 PolarHBondContact NH1-ND2 3.12Å; R25-I46 WeakPolarHBondContact CA-O 2.89Å; R25-S57 PolarHBondContact NH1-OG 2.91Å
26	Q	85.9	Confident	80.2	Confident	49 Å²	49	63.5 Å²	63.5	23%	0.229	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	120.6	167	-178.4	64	51.3	0	0	111.2	I2 L17 W19 N45 I46	I2-Q26 HydrophobicContact CD1-CG 4.3Å; L17-Q26 HydrophobicContact CD1-CB 3.87Å; L17-Q26 HydrophobicContact CD1-CG 3.52Å; W19-Q26 HydrophobicContact CZ2-CB 4.25Å; Q26-N45 CarbonylContact O-C 3.51Å; Q26-N45 WeakPolarHBondContact O-CA 3.31Å; Q26-I46 HydrophobicContact CB-CB 4.48Å; Q26-I46 PolarHBondContact N-O 2.9Å; Q26-I46 PolarHBondContact O-N 3.34Å
27	N	88.6	Confident	80.3	Confident	96 Å²	96	63 Å²	63	51%	0.513	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	136.3	167	-63.6	-39.9	0	0	0	109.7	V44 N45	N27-V44 WeakPolarHBondContact CA-O 3.32Å; N27-N45 VanDerWaalsContact OD1-CG 3.24Å; N27-N45 PolarHBondContact OD1-ND2 3.24Å
28	L	90.5	Very high	80.4	Confident	18 Å²	18	63 Å²	63	9%	0.094	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	134.7	-179.3	179.3	71.2	0	0	0	109.4	T43 V44 I46 I81 N83 L88	L28-T43 CarbonylContact O-C 3.47Å; L28-T43 VanDerWaalsContact O-CA 3.27Å; L28-T43 WeakPolarHBondContact O-CA 3.34Å; L28-V44 HydrophobicContact CB-CG2 3.91Å; L28-V44 HydrophobicContact CD2-CG2 4.2Å; L28-V44 HydrophobicContact CG-CG2 4.48Å; L28-V44 PolarHBondContact N-O 3.36Å; L28-V44 PolarHBondContact O-N 3.43Å; L28-I46 HydrophobicContact CD2-CD1 4.23Å; L28-I81 HydrophobicContact CD2-CG2 3.82Å; L28-N83 HydrophobicContact CD2-CB 4.5Å; L28-L88 HydrophobicContact CD2-CD1 3.46Å; L28-L88 VanDerWaalsContact CD2-CD1 3.46Å; L28-L88 HydrophobicContact CD2-CD2 4.23Å
29	T	93.3	Very high	80.9	Confident	91 Å²	91	61 Å²	61	56%	0.558	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	127.5	166.8	-55.4	0	0	0	0	108.7	D42 N83	T29-D42 CarbonylContact C-O 3.53Å; T29-D42 VanDerWaalsContact CA-O 3.32Å; T29-D42 WeakPolarHBondContact CA-O 3.41Å; T29-D42 WeakPolarHBondContact CG2-O 3.45Å; T29-N83 PolarHBondContact O-ND2 2.92Å
30	T	93.2	Very high	82	Confident	10 Å²	10	67.3 Å²	67.3	6%	0.061	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	147.9	-179.6	56.9	0	0	0	0	110.7	F32 I34 D42 V44 L88	T30-F32 WeakPolarHBondContact CB-O 3.38Å; T30-F32 PolarHBondContact O-N 3.14Å; T30-F32 PolarHBondContact OG1-O 2.88Å; T30-I34 HydrophobicContact CG2-CD1 3.9Å; T30-D42 PolarHBondContact N-O 2.97Å; T30-D42 PolarHBondContact OG1-O 2.8Å; T30-V44 HydrophobicContact CG2-CG1 4.04Å; T30-V44 HydrophobicContact CG2-CG2 4.25Å; T30-L88 HydrophobicContact CG2-CD2 3.91Å
31	L	94.8	Very high	83.8	Confident	60 Å²	60	67 Å²	67	31%	0.314	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-7.8	178	-64.3	179.3	0	0	0	113.6	N83 N85	L31-N83 WeakPolarHBondContact CD1-O 3.44Å; L31-N83 PolarHBondContact N-OD1 2.72Å; L31-N85 WeakPolarHBondContact CB-OD1 3.46Å
32	F	94.8	Very high	85.6	Confident	15 Å²	15	65.3 Å²	65.3	7%	0.066	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	153.7	172.9	62.2	-85.1	0	0	0	110.1	T30 I34 T84 F87 L88 I115 S117	T30-F32 WeakPolarHBondContact CB-O 3.38Å; T30-F32 PolarHBondContact O-N 3.14Å; T30-F32 PolarHBondContact OG1-O 2.88Å; F32-I34 HydrophobicContact CD2-CG1 4.41Å; F32-I34 HydrophobicContact CE2-CG1 3.8Å; F32-I34 HydrophobicContact CZ-CG1 4.4Å; F32-I34 PolarHBondContact O-N 3Å; F32-T84 VanDerWaalsContact CD1-O 3.25Å; F32-T84 WeakPolarHBondContact CD1-O 3.28Å; F32-T84 WeakPolarHBondContact CE1-O 3.3Å; F32-F87 VanDerWaalsContact CE1-C 3.43Å; F32-L88 HydrophobicContact CE1-CB 4.28Å; F32-L88 HydrophobicContact CZ-CB 4.2Å; F32-I115 WeakPolarHBondContact CZ-O 3.33Å; F32-S117 VanDerWaalsContact CD2-CA 3.48Å
33	P	93.6	Very high	87.4	Confident	71 Å²	71	59.3 Å²	59.3	46%	0.461	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	123.4	174.9	28.5	-33.2	0	0	0	111.2	K40 Y41	P33-K40 HydrophobicContact CB-CB 4.25Å; P33-K40 HydrophobicContact CB-CD 4.46Å; P33-Y41 CarbonylContact C-O 3.57Å; P33-Y41 WeakPolarHBondContact CA-O 3.46Å
34	I	93	Very high	88.8	Confident	10 Å²	10	54.6 Å²	54.6	5%	0.051	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	121.9	170.3	-62.5	172.4	0	0	0	108.6	T30 F32 K40 Y41 V44 I54 I115	T30-I34 HydrophobicContact CG2-CD1 3.9Å; F32-I34 HydrophobicContact CD2-CG1 4.41Å; F32-I34 HydrophobicContact CE2-CG1 3.8Å; F32-I34 HydrophobicContact CZ-CG1 4.4Å; F32-I34 PolarHBondContact O-N 3Å; I34-K40 CarbonylContact O-C 3.55Å; I34-K40 WeakPolarHBondContact O-CA 3.39Å; I34-Y41 PolarHBondContact N-O 3.37Å; I34-Y41 PolarHBondContact O-N 3.36Å; I34-V44 HydrophobicContact CD1-CG1 3.52Å; I34-I54 HydrophobicContact CD1-CD1 4.43Å; I34-I54 HydrophobicContact CG2-CG2 4.27Å; I34-I115 HydrophobicContact CD1-CD1 4.13Å; I34-I115 HydrophobicContact CD1-CG2 4.11Å; I34-I115 HydrophobicContact CG1-CG2 4.12Å; I34-I115 HydrophobicContact CG2-CG2 4.26Å
35	K	88.2	Confident	89.4	Confident	96 Å²	96	51.5 Å²	51.5	42%	0.417	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	118.5	169.2	-69.4	-177.9	179.3	-170.5	0	109.8	I39 K40 E188	K35-I39 CarbonylContact C-O 3.58Å; K35-I39 WeakPolarHBondContact CA-O 3.31Å; K35-K40 HydrophobicContact CG-CG 4.12Å; K35-E188 WeakPolarHBondContact CD-OE1 3.26Å; K35-E188 WeakPolarHBondContact CE-OE1 3.31Å; K35-E188 IonicContact NZ-OE1 2.66Å; K35-E188 PolarHBondContact NZ-OE1 3.44Å; K35-E188 IonicContact NZ-OE2 2.77Å; K35-E188 PolarHBondContact NZ-OE2 3.36Å
36	Y	86.6	Confident	89.8	Confident	14 Å²	14	46.5 Å²	46.5	6%	0.055	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	113.1	177.6	-164.7	-96	0	0	0	108.9	G38 I39 I54 K65 K66 I141 T142 D143	Y36-G38 PolarHBondContact O-N 3.39Å; Y36-I39 PolarHBondContact N-O 2.93Å; Y36-I39 PolarHBondContact O-N 2.88Å; Y36-I54 HydrophobicContact CD2-CG1 4.01Å; Y36-I54 HydrophobicContact CE2-CG1 4.22Å; Y36-I54 HydrophobicContact CG-CB 4.44Å; Y36-I54 HydrophobicContact CG-CG1 4.39Å; Y36-I54 HydrophobicContact CG-CG2 4.25Å; Y36-K65 HydrophobicContact CD1-CB 3.87Å; Y36-K65 HydrophobicContact CD1-CD 4.23Å; Y36-K65 HydrophobicContact CD1-CG 3.88Å; Y36-K65 HydrophobicContact CE1-CB 3.64Å; Y36-K65 HydrophobicContact CE1-CG 3.85Å; Y36-K66 PolarHBondContact OH-O 2.9Å; Y36-I141 HydrophobicContact CE2-CG2 3.84Å; Y36-I141 WeakPolarHBondContact OH-CG2 3.37Å; Y36-T142 PolarHBondContact OH-N 2.83Å; Y36-T142 PolarHBondContact OH-O 2.9Å; Y36-D143 HydrophobicContact CE1-CB 4Å
37	Y	79.4	Confident	89.9	Confident	71 Å²	71	45 Å²	45	28%	0.278	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	41.7	-173.3	-70.8	-100.2	0	0	0	113.3	I39 D143 S163	Y37-I39 PolarHBondContact O-N 2.91Å; Y37-D143 HydrophobicContact CD1-CB 4.49Å; Y37-D143 HydrophobicContact CD2-CB 3.79Å; Y37-D143 HydrophobicContact CE1-CB 4.28Å; Y37-D143 HydrophobicContact CE2-CB 3.56Å; Y37-D143 HydrophobicContact CG-CB 4.26Å; Y37-S163 VanDerWaalsContact OH-CB 3.28Å; Y37-S163 WeakPolarHBondContact OH-CB 3.37Å; Y37-S163 PolarHBondContact OH-OG 3.5Å
38	G	78.4	Confident	89.9	Confident	15 Å²	15	40.7 Å²	40.7	16%	0.155	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	-7.4	179.5	0	0	0	0	0	115.2	Y36	Y36-G38 PolarHBondContact O-N 3.39Å
39	I	83	Confident	89.8	Confident	77 Å²	77	42.5 Å²	42.5	40%	0.395	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	136.7	175.3	-54.5	175.1	0	0	0	109.2	K35 Y36 Y37 Y41 I220	K35-I39 CarbonylContact C-O 3.58Å; K35-I39 WeakPolarHBondContact CA-O 3.31Å; Y36-I39 PolarHBondContact N-O 2.93Å; Y36-I39 PolarHBondContact O-N 2.88Å; Y37-I39 PolarHBondContact O-N 2.91Å; I39-Y41 HydrophobicContact CB-CE2 3.6Å; I39-Y41 HydrophobicContact CG2-CD2 4.33Å; I39-Y41 HydrophobicContact CG2-CE1 4.07Å; I39-Y41 HydrophobicContact CG2-CE2 3.58Å; I39-Y41 VanDerWaalsContact CG2-CZ 3.4Å; I39-Y41 WeakPolarHBondContact CG2-OH 3.47Å; I39-Y41 WeakPolarHBondContact O-CD2 3.44Å; I39-I220 HydrophobicContact CD1-CG2 4.02Å; I39-I220 HydrophobicContact CG1-CG2 3.49Å; I39-I220 VanDerWaalsContact CG1-CG2 3.49Å
40	K	89.5	Confident	89.7	Confident	141 Å²	141	38.1 Å²	38.1	61%	0.613	19%	0.189	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	132.8	177.3	-66.3	-180	-177.5	-179.7	0	110.6	P33 I34 K35	P33-K40 HydrophobicContact CB-CB 4.25Å; P33-K40 HydrophobicContact CB-CD 4.46Å; I34-K40 CarbonylContact O-C 3.55Å; I34-K40 WeakPolarHBondContact O-CA 3.39Å; K35-K40 HydrophobicContact CG-CG 4.12Å
41	Y	92.6	Very high	89.6	Confident	41 Å²	41	38.4 Å²	38.4	16%	0.161	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	141.4	175.9	-61.1	-83.6	0	0	0	110.3	P33 I34 I39 I54 K65	P33-Y41 CarbonylContact C-O 3.57Å; P33-Y41 WeakPolarHBondContact CA-O 3.46Å; I34-Y41 PolarHBondContact N-O 3.37Å; I34-Y41 PolarHBondContact O-N 3.36Å; I39-Y41 HydrophobicContact CB-CE2 3.6Å; I39-Y41 HydrophobicContact CG2-CD2 4.33Å; I39-Y41 HydrophobicContact CG2-CE1 4.07Å; I39-Y41 HydrophobicContact CG2-CE2 3.58Å; I39-Y41 VanDerWaalsContact CG2-CZ 3.4Å; I39-Y41 WeakPolarHBondContact CG2-OH 3.47Å; I39-Y41 WeakPolarHBondContact O-CD2 3.44Å; Y41-I54 HydrophobicContact CD2-CG2 3.6Å; Y41-I54 HydrophobicContact CE2-CG2 4.38Å; Y41-I54 HydrophobicContact CG-CG2 3.75Å; Y41-K65 HydrophobicContact CE1-CD 3.91Å; Y41-K65 HydrophobicContact CE2-CD 3.78Å; Y41-K65 WeakPolarHBondContact OH-CD 3.44Å; Y41-K65 WeakPolarHBondContact OH-CE 3.43Å
42	D	93.3	Very high	89.6	Confident	81 Å²	81	35.6 Å²	35.6	43%	0.433	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-3.5	-179.4	60.4	-16.5	0	0	0	112.7	T29 T30	T29-D42 CarbonylContact C-O 3.53Å; T29-D42 VanDerWaalsContact CA-O 3.32Å; T29-D42 WeakPolarHBondContact CA-O 3.41Å; T29-D42 WeakPolarHBondContact CG2-O 3.45Å; T30-D42 PolarHBondContact N-O 2.97Å; T30-D42 PolarHBondContact OG1-O 2.8Å
43	T	92.6	Very high	89.5	Confident	19 Å²	19	34.9 Å²	34.9	12%	0.117	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	146.9	-179.1	61.9	0	0	0	0	110.9	L28 G55 R56	L28-T43 CarbonylContact O-C 3.47Å; L28-T43 VanDerWaalsContact O-CA 3.27Å; L28-T43 WeakPolarHBondContact O-CA 3.34Å; T43-G55 WeakPolarHBondContact O-CA 3.33Å; T43-G55 PolarHBondContact O-N 3.02Å; T43-G55 WeakPolarHBondContact OG1-CA 3.38Å; T43-G55 PolarHBondContact OG1-O 3.36Å; T43-R56 PolarHBondContact OG1-N 2.93Å
44	V	93	Very high	89.4	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	159.4	165.8	-60.3	0	0	0	0	110.6	N27 L28 T30 I34 I46 I52 G53 I54 L88	N27-V44 WeakPolarHBondContact CA-O 3.32Å; L28-V44 HydrophobicContact CB-CG2 3.91Å; L28-V44 HydrophobicContact CD2-CG2 4.2Å; L28-V44 HydrophobicContact CG-CG2 4.48Å; L28-V44 PolarHBondContact N-O 3.36Å; L28-V44 PolarHBondContact O-N 3.43Å; T30-V44 HydrophobicContact CG2-CG1 4.04Å; T30-V44 HydrophobicContact CG2-CG2 4.25Å; I34-V44 HydrophobicContact CD1-CG1 3.52Å; V44-I46 HydrophobicContact CG2-CD1 4.48Å; V44-I46 HydrophobicContact CG2-CG1 4.23Å; V44-I52 HydrophobicContact CB-CG2 4.02Å; V44-I52 HydrophobicContact CG1-CG2 4.27Å; V44-G53 CarbonylContact C-O 3.53Å; V44-G53 WeakPolarHBondContact CA-O 3.12Å; V44-G53 WeakPolarHBondContact CB-O 3.48Å; V44-I54 HydrophobicContact CG1-CD1 3.93Å; V44-L88 HydrophobicContact CG1-CD2 4.31Å; V44-L88 HydrophobicContact CG2-CD2 3.74Å
45	N	90.1	Very high	89.1	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	113.2	175	-176.7	-17.1	0	0	0	108.8	R25 Q26 N27 I52 G53	R25-N45 WeakPolarHBondContact CD-ND2 3.32Å; R25-N45 WeakPolarHBondContact CD-OD1 3.5Å; R25-N45 WeakPolarHBondContact CG-OD1 3.5Å; R25-N45 PolarHBondContact NE-ND2 2.85Å; R25-N45 PolarHBondContact NH1-ND2 3.12Å; Q26-N45 CarbonylContact O-C 3.51Å; Q26-N45 WeakPolarHBondContact O-CA 3.31Å; N27-N45 VanDerWaalsContact OD1-CG 3.24Å; N27-N45 PolarHBondContact OD1-ND2 3.24Å; N45-I52 CarbonylContact O-C 3.51Å; N45-I52 WeakPolarHBondContact O-CA 3.35Å; N45-G53 PolarHBondContact N-O 3.37Å; N45-G53 PolarHBondContact O-N 3.42Å
46	I	90.8	Very high	88.5	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	128.2	-176.4	-55.6	167.9	0	0	0	107.7	W19 R25 Q26 L28 V44 V79 I81 I90 W92	W19-I46 VanDerWaalsContact CH2-O 3.23Å; W19-I46 WeakPolarHBondContact CH2-O 3.43Å; R25-I46 WeakPolarHBondContact CA-O 2.89Å; Q26-I46 HydrophobicContact CB-CB 4.48Å; Q26-I46 PolarHBondContact N-O 2.9Å; Q26-I46 PolarHBondContact O-N 3.34Å; L28-I46 HydrophobicContact CD2-CD1 4.23Å; V44-I46 HydrophobicContact CG2-CD1 4.48Å; V44-I46 HydrophobicContact CG2-CG1 4.23Å; I46-V79 HydrophobicContact CG2-CG1 4.23Å; I46-I81 HydrophobicContact CD1-CD1 3.56Å; I46-I81 HydrophobicContact CD1-CG1 4.14Å; I46-I90 HydrophobicContact CD1-CD1 3.69Å; I46-I90 HydrophobicContact CD1-CG1 3.88Å; I46-I90 HydrophobicContact CD1-CG2 4.36Å; I46-I90 HydrophobicContact CG1-CD1 3.82Å; I46-I90 HydrophobicContact CG1-CG1 4.49Å; I46-I90 HydrophobicContact CG2-CG2 3.94Å; I46-W92 HydrophobicContact CG2-CZ2 3.84Å
47	L	89.1	Confident	87.2	Confident	18 Å²	18	37.8 Å²	37.8	9%	0.094	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	150.1	176.9	-71	79.6	0	0	0	110.2	W19 K49 G50 I51 W92	W19-L47 VanDerWaalsContact CH2-CA 3.47Å; L47-K49 HydrophobicContact CB-CG 4.08Å; L47-K49 HydrophobicContact CD2-CG 4.49Å; L47-K49 PolarHBondContact O-N 3.42Å; L47-G50 PolarHBondContact O-N 3.34Å; L47-I51 HydrophobicContact CB-CB 4.11Å; L47-I51 HydrophobicContact CD1-CB 4.38Å; L47-I51 HydrophobicContact CD1-CG2 4.31Å; L47-I51 HydrophobicContact CD2-CB 4.48Å; L47-I51 PolarHBondContact N-O 2.92Å; L47-W92 PolarHBondContact O-NE1 2.92Å
48	S	88.1	Confident	86.3	Confident	6 Å²	6	36.6 Å²	36.6	4%	0.042	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-33.8	-175.5	31.9	0	0	0	0	110.2	W19 G50 W92 L95	W19-S48 VanDerWaalsContact CE3-OG 3.32Å; W19-S48 WeakPolarHBondContact CZ3-OG 3.33Å; S48-G50 PolarHBondContact O-N 3.44Å; S48-W92 PolarHBondContact O-NE1 2.66Å; S48-L95 WeakPolarHBondContact O-CD1 2.92Å
49	K	87.8	Confident	85.1	Confident	55 Å²	55	45.2 Å²	45.2	24%	0.239	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	17.8	179	65.8	170.8	162.7	-148.5	0	115.8	L47 I51 G72 M73 D74 L95	L47-K49 HydrophobicContact CB-CG 4.08Å; L47-K49 HydrophobicContact CD2-CG 4.49Å; L47-K49 PolarHBondContact O-N 3.42Å; K49-I51 HydrophobicContact CD-CD1 3.91Å; K49-I51 HydrophobicContact CD-CG1 4.46Å; K49-I51 HydrophobicContact CG-CD1 4.08Å; K49-I51 HydrophobicContact CG-CG1 4.09Å; K49-G72 WeakPolarHBondContact CB-O 3.43Å; K49-G72 WeakPolarHBondContact O-CA 3.29Å; K49-G72 PolarHBondContact O-N 3.26Å; K49-M73 WeakPolarHBondContact CB-O 3.43Å; K49-D74 WeakPolarHBondContact CD-OD1 3.43Å; K49-D74 WeakPolarHBondContact CE-OD1 3.43Å; K49-D74 WeakPolarHBondContact CG-OD1 3.27Å; K49-D74 IonicContact NZ-OD1 3.96Å; K49-D74 IonicContact NZ-OD2 2.74Å; K49-D74 PolarHBondContact NZ-OD2 3.25Å; K49-L95 VanDerWaalsContact C-CD1 3.45Å
50	G	91.9	Very high	83.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	34.6	177.4	0	0	0	0	0	113.5	L47 S48 V69	L47-G50 PolarHBondContact O-N 3.34Å; S48-G50 PolarHBondContact O-N 3.44Å; G50-V69 WeakPolarHBondContact O-CG2 3.4Å; G50-V69 PolarHBondContact O-N 3.49Å
51	I	92.1	Very high	82.1	Confident	16 Å²	16	42.9 Å²	42.9	8%	0.082	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.5	174.9	-60.5	-180	0	0	0	110.1	L47 K49 K66 I67 E68	L47-I51 HydrophobicContact CB-CB 4.11Å; L47-I51 HydrophobicContact CD1-CB 4.38Å; L47-I51 HydrophobicContact CD1-CG2 4.31Å; L47-I51 HydrophobicContact CD2-CB 4.48Å; L47-I51 PolarHBondContact N-O 2.92Å; K49-I51 HydrophobicContact CD-CD1 3.91Å; K49-I51 HydrophobicContact CD-CG1 4.46Å; K49-I51 HydrophobicContact CG-CD1 4.08Å; K49-I51 HydrophobicContact CG-CG1 4.09Å; I51-K66 HydrophobicContact CG2-CB 4.23Å; I51-I67 CarbonylContact C-O 3.52Å; I51-I67 WeakPolarHBondContact CA-O 3.37Å; I51-E68 HydrophobicContact CD1-CG 4.34Å; I51-E68 HydrophobicContact CG1-CB 4.12Å; I51-E68 HydrophobicContact CG1-CG 3.99Å
52	I	93.6	Very high	80.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	118.7	167.9	-48.9	168.1	0	0	0	107.4	V44 N45 I54 K66 I67 I90 W92 C113 I115	V44-I52 HydrophobicContact CB-CG2 4.02Å; V44-I52 HydrophobicContact CG1-CG2 4.27Å; N45-I52 CarbonylContact O-C 3.51Å; N45-I52 WeakPolarHBondContact O-CA 3.35Å; I52-I54 HydrophobicContact CG2-CD1 4.01Å; I52-K66 CarbonylContact O-C 3.52Å; I52-K66 VanDerWaalsContact O-CA 3.31Å; I52-K66 WeakPolarHBondContact O-CA 3.47Å; I52-I67 HydrophobicContact CB-CB 4.28Å; I52-I67 PolarHBondContact N-O 3.44Å; I52-I67 PolarHBondContact O-N 2.95Å; I52-I90 HydrophobicContact CD1-CD1 3.61Å; I52-I90 HydrophobicContact CG1-CD1 3.93Å; I52-I90 HydrophobicContact CG2-CD1 4.37Å; I52-W92 HydrophobicContact CD1-CH2 3.9Å; I52-W92 HydrophobicContact CG1-CH2 3.59Å; I52-W92 HydrophobicContact CG1-CZ2 4.19Å; I52-C113 HydrophobicContact CD1-CB 3.96Å; I52-C113 VanDerWaalsContact CD1-SG 3.57Å; I52-I115 HydrophobicContact CD1-CD1 4.33Å
53	G	92.5	Very high	79.8	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	135.2	163.8	0	0	0	0	0	112.5	V44 N45 K65	V44-G53 CarbonylContact C-O 3.53Å; V44-G53 WeakPolarHBondContact CA-O 3.12Å; V44-G53 WeakPolarHBondContact CB-O 3.48Å; N45-G53 PolarHBondContact N-O 3.37Å; N45-G53 PolarHBondContact O-N 3.42Å; G53-K65 WeakPolarHBondContact CA-O 3.5Å
54	I	92	Very high	79.1	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	125.9	176.3	-50.3	-58.7	0	0	0	108.8	I34 Y36 Y41 V44 I52 K65 I67 I115	I34-I54 HydrophobicContact CD1-CD1 4.43Å; I34-I54 HydrophobicContact CG2-CG2 4.27Å; Y36-I54 HydrophobicContact CD2-CG1 4.01Å; Y36-I54 HydrophobicContact CE2-CG1 4.22Å; Y36-I54 HydrophobicContact CG-CB 4.44Å; Y36-I54 HydrophobicContact CG-CG1 4.39Å; Y36-I54 HydrophobicContact CG-CG2 4.25Å; Y41-I54 HydrophobicContact CD2-CG2 3.6Å; Y41-I54 HydrophobicContact CE2-CG2 4.38Å; Y41-I54 HydrophobicContact CG-CG2 3.75Å; V44-I54 HydrophobicContact CG1-CD1 3.93Å; I52-I54 HydrophobicContact CG2-CD1 4.01Å; I54-K65 HydrophobicContact CB-CB 4.01Å; I54-K65 PolarHBondContact N-O 2.89Å; I54-K65 WeakPolarHBondContact O-CE 3.35Å; I54-I67 HydrophobicContact CD1-CD1 4.19Å; I54-I115 HydrophobicContact CD1-CD1 4.22Å
55	G	87.1	Confident	78.9	Confident	3 Å²	3	40.4 Å²	40.4	3%	0.031	20%	0.196	C	C	.	.	S	Bend	trans	87.9	-173.8	-175.3	0	0	0	0	0	114	T43	T43-G55 WeakPolarHBondContact O-CA 3.33Å; T43-G55 PolarHBondContact O-N 3.02Å; T43-G55 WeakPolarHBondContact OG1-CA 3.38Å; T43-G55 PolarHBondContact OG1-O 3.36Å
56	R	74.3	Confident	78.9	Confident	205 Å²	205	41.7 Å²	41.7	77%	0.774	20%	0.201	S	C	*	.	S	Bend	trans	-70.2	143.7	179.7	-67.4	-175.2	-176.8	157	3.3	110.8	T43	T43-R56 PolarHBondContact OG1-N 2.93Å
57	S	60.6	Low	79.1	Confident	43 Å²	43	41.8 Å²	41.8	30%	0.301	20%	0.202	S	C	.	.			trans	-25.4	133.7	-171.2	-174.4	0	0	0	0	116.7	R25 R59	R25-S57 PolarHBondContact NH1-OG 2.91Å; S57-R59 PolarHBondContact O-N 2.88Å
58	F	59.3	Low	79.3	Confident	45 Å²	45	42 Å²	42	20%	0.197	20%	0.202	C	C	.	.			trans	-62.4	94.5	156.1	-37.6	-87.6	0	0	0	108.8	K65 K66	F58-K65 VanDerWaalsContact CZ-O 3.29Å; F58-K65 WeakPolarHBondContact CZ-O 3.45Å; F58-K66 HydrophobicContact CZ-CB 4.12Å
59	R	53.8	Low	79.6	Confident	197 Å²	197	41.7 Å²	41.7	74%	0.743	20%	0.2	S	C	*	.			trans	-99.7	144.2	152.5	-78.4	-172.2	174	-170.2	-1.7	106	S57 S61	S57-R59 PolarHBondContact O-N 2.88Å; R59-S61 PolarHBondContact O-N 3.4Å
60	H	55.5	Low	79.7	Confident	100 Å²	100	39.2 Å²	39.2	46%	0.463	19%	0.19	S	C	.	.	S	Bend	trans	-44.8	139.8	-172.3	-50.4	-27.3	0	0	0	111	A148 I157	H60-A148 HydrophobicContact CB-CB 3.67Å; H60-I157 WeakPolarHBondContact CE1-CD1 3.42Å; H60-I157 VanDerWaalsContact ND1-CD1 3.3Å; H60-I157 WeakPolarHBondContact ND1-CD1 3.43Å
61	S	54.4	Low	79.4	Confident	68 Å²	68	42.3 Å²	42.3	48%	0.476	21%	0.206	S	C	.	.	S	Bend	trans	79.7	44.4	-175.1	-48.5	0	0	0	0	113.6	R59 D146 A148	R59-S61 PolarHBondContact O-N 3.4Å; S61-D146 CarbonylContact C-O 3.56Å; S61-D146 WeakPolarHBondContact CA-O 3.1Å; S61-D146 PolarHBondContact N-OD1 2.89Å; S61-A148 PolarHBondContact OG-N 2.91Å
62	G	65.7	Low	79.1	Confident	16 Å²	16	42.3 Å²	42.3	17%	0.165	21%	0.21	C	C	.	.	S	Bend	trans	-139.4	168.2	180	0	0	0	0	0	114.5	M64 Y145 D146	G62-M64 PolarHBondContact O-N 2.81Å; G62-Y145 CarbonylContact O-C 3.57Å; G62-Y145 VanDerWaalsContact O-CA 3.27Å; G62-Y145 WeakPolarHBondContact O-CA 3.2Å; G62-D146 PolarHBondContact N-O 2.84Å; G62-D146 PolarHBondContact N-OD1 2.81Å; G62-D146 PolarHBondContact O-N 2.91Å
63	A	71	Confident	78.6	Confident	42 Å²	42	44.2 Å²	44.2	35%	0.347	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	118.8	176.3	0	0	0	0	0	111.2	K65 G144	A63-K65 VanDerWaalsContact CB-NZ 3.29Å; A63-K65 PolarHBondContact O-N 3.19Å; A63-K65 PolarHBondContact O-NZ 3.48Å; A63-G144 CarbonylContact C-O 3.48Å; A63-G144 VanDerWaalsContact CA-O 3.31Å; A63-G144 WeakPolarHBondContact CA-O 3.49Å
64	M	78.4	Confident	77.9	Confident	10 Å²	10	47.6 Å²	47.6	5%	0.049	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	96.1	178.8	-177.2	177.2	60.5	0	0	110.4	G62 K66 T142 D143 G144 K159 S161	G62-M64 PolarHBondContact O-N 2.81Å; M64-K66 HydrophobicContact CG-CD 4.37Å; M64-K66 HydrophobicContact CG-CG 4.15Å; M64-K66 HydrophobicContact SD-CD 4.27Å; M64-T142 HydrophobicContact CE-CG2 3.65Å; M64-D143 CarbonylContact O-C 3.43Å; M64-D143 VanDerWaalsContact O-CA 3.31Å; M64-D143 WeakPolarHBondContact O-CA 3.39Å; M64-G144 PolarHBondContact N-O 3.26Å; M64-G144 PolarHBondContact O-N 3.48Å; M64-K159 HydrophobicContact CE-CB 4.48Å; M64-K159 HydrophobicContact SD-CD 4.31Å; M64-S161 VanDerWaalsContact CE-OG 3.3Å; M64-S161 WeakPolarHBondContact CE-OG 3.5Å
65	K	88.8	Confident	77.3	Confident	22 Å²	22	51.1 Å²	51.1	10%	0.096	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	94.8	174.8	-59.8	168.1	-70.1	-70.1	0	109.5	Y36 Y41 G53 I54 F58 A63 D143	Y36-K65 HydrophobicContact CD1-CB 3.87Å; Y36-K65 HydrophobicContact CD1-CD 4.23Å; Y36-K65 HydrophobicContact CD1-CG 3.88Å; Y36-K65 HydrophobicContact CE1-CB 3.64Å; Y36-K65 HydrophobicContact CE1-CG 3.85Å; Y41-K65 HydrophobicContact CE1-CD 3.91Å; Y41-K65 HydrophobicContact CE2-CD 3.78Å; Y41-K65 WeakPolarHBondContact OH-CD 3.44Å; Y41-K65 WeakPolarHBondContact OH-CE 3.43Å; G53-K65 WeakPolarHBondContact CA-O 3.5Å; I54-K65 HydrophobicContact CB-CB 4.01Å; I54-K65 PolarHBondContact N-O 2.89Å; I54-K65 WeakPolarHBondContact O-CE 3.35Å; F58-K65 VanDerWaalsContact CZ-O 3.29Å; F58-K65 WeakPolarHBondContact CZ-O 3.45Å; A63-K65 VanDerWaalsContact CB-NZ 3.29Å; A63-K65 PolarHBondContact O-N 3.19Å; A63-K65 PolarHBondContact O-NZ 3.48Å; K65-D143 WeakPolarHBondContact CG-OD1 3.32Å
66	K	90.6	Very high	76.7	Confident	28 Å²	28	54.4 Å²	54.4	12%	0.122	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	146.6	-172	67.3	163.9	-175.9	161.5	0	113.9	Y36 I51 I52 F58 M64 E68 T142	Y36-K66 PolarHBondContact OH-O 2.9Å; I51-K66 HydrophobicContact CG2-CB 4.23Å; I52-K66 CarbonylContact O-C 3.52Å; I52-K66 VanDerWaalsContact O-CA 3.31Å; I52-K66 WeakPolarHBondContact O-CA 3.47Å; F58-K66 HydrophobicContact CZ-CB 4.12Å; M64-K66 HydrophobicContact CG-CD 4.37Å; M64-K66 HydrophobicContact CG-CG 4.15Å; M64-K66 HydrophobicContact SD-CD 4.27Å; K66-E68 IonicContact NZ-OE2 3.34Å; K66-E68 PolarHBondContact NZ-OE2 3.48Å; K66-T142 PolarHBondContact N-O 3.26Å; K66-T142 PolarHBondContact O-N 2.83Å
67	I	94.5	Very high	77	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	114.7	163.1	-55.1	168.4	0	0	0	106.1	I51 I52 I54 V69 I115 I121 I141	I51-I67 CarbonylContact C-O 3.52Å; I51-I67 WeakPolarHBondContact CA-O 3.37Å; I52-I67 HydrophobicContact CB-CB 4.28Å; I52-I67 PolarHBondContact N-O 3.44Å; I52-I67 PolarHBondContact O-N 2.95Å; I54-I67 HydrophobicContact CD1-CD1 4.19Å; I67-V69 HydrophobicContact CG2-CG1 4.07Å; I67-I115 HydrophobicContact CD1-CD1 3.89Å; I67-I115 HydrophobicContact CD1-CG1 4.33Å; I67-I121 HydrophobicContact CD1-CD1 3.93Å; I67-I141 HydrophobicContact CG1-CG1 4.35Å; I67-I141 HydrophobicContact CG1-CG2 4.46Å; I67-I141 HydrophobicContact CG2-CG1 4.33Å
68	E	93.6	Very high	78.1	Confident	22 Å²	22	43.3 Å²	43.3	10%	0.103	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	110.4	176.7	177	166.3	-139.5	0	0	106.9	I51 K66 K138 L139 T140	I51-E68 HydrophobicContact CD1-CG 4.34Å; I51-E68 HydrophobicContact CG1-CB 4.12Å; I51-E68 HydrophobicContact CG1-CG 3.99Å; K66-E68 IonicContact NZ-OE2 3.34Å; K66-E68 PolarHBondContact NZ-OE2 3.48Å; E68-K138 HydrophobicContact CG-CD 4.45Å; E68-K138 WeakPolarHBondContact OE2-CE 3.39Å; E68-K138 IonicContact OE2-NZ 2.98Å; E68-K138 PolarHBondContact OE2-NZ 3.37Å; E68-L139 CarbonylContact O-C 3.41Å; E68-L139 VanDerWaalsContact O-CA 3.29Å; E68-L139 WeakPolarHBondContact O-CA 3.01Å; E68-T140 PolarHBondContact N-O 3.05Å; E68-T140 PolarHBondContact O-N 2.92Å; E68-T140 PolarHBondContact OE2-OG1 3.25Å
69	V	94	Very high	79.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.217	C	C	.	.			trans	-89.2	-21.6	-171.8	-55.5	0	0	0	0	112.8	G50 I67 W92 V111 C113 I123 F125 K138	G50-V69 WeakPolarHBondContact O-CG2 3.4Å; G50-V69 PolarHBondContact O-N 3.49Å; I67-V69 HydrophobicContact CG2-CG1 4.07Å; V69-W92 HydrophobicContact CG1-CZ3 4.31Å; V69-W92 HydrophobicContact CG2-CE3 3.99Å; V69-W92 HydrophobicContact CG2-CH2 4.27Å; V69-W92 HydrophobicContact CG2-CZ3 3.84Å; V69-V111 HydrophobicContact CB-CG1 4Å; V69-V111 HydrophobicContact CG2-CB 4.33Å; V69-V111 HydrophobicContact CG2-CG1 3.83Å; V69-C113 HydrophobicContact CG1-CB 3.91Å; V69-I123 HydrophobicContact CB-CG2 4.42Å; V69-I123 HydrophobicContact CG1-CG1 4.5Å; V69-F125 WeakPolarHBondContact O-CE1 3.37Å; V69-K138 CarbonylContact C-O 3.55Å
70	F	90.5	Very high	81.4	Confident	3 Å²	3	32.5 Å²	32.5	1%	0.013	18%	0.184	C	C	.	.	S	Bend	trans	-160.7	164.7	176.4	-146.1	-100.6	0	0	0	110.5	G72 L95 I97 V111 F125 I128 K138 I172	F70-G72 PolarHBondContact O-N 3.38Å; F70-L95 HydrophobicContact CB-CD2 3.51Å; F70-L95 HydrophobicContact CD1-CD2 4.38Å; F70-L95 HydrophobicContact CG-CD2 4.16Å; F70-I97 HydrophobicContact CD1-CG2 3.6Å; F70-I97 HydrophobicContact CE1-CB 4.5Å; F70-I97 HydrophobicContact CE1-CG2 3.54Å; F70-V111 HydrophobicContact CD2-CG2 4.39Å; F70-F125 HydrophobicContact CD2-CE1 4.15Å; F70-I128 HydrophobicContact CD2-CD1 4.04Å; F70-I128 HydrophobicContact CE2-CD1 3.5Å; F70-I128 VanDerWaalsContact CE2-CD1 3.5Å; F70-I128 HydrophobicContact CE2-CG1 4.26Å; F70-I128 HydrophobicContact CE2-CG2 4.08Å; F70-I128 HydrophobicContact CZ-CD1 4.03Å; F70-I128 HydrophobicContact CZ-CG2 3.89Å; F70-K138 WeakPolarHBondContact CA-O 3.5Å; F70-K138 PolarHBondContact N-O 2.69Å; F70-I172 HydrophobicContact CD2-CG2 4.07Å; F70-I172 HydrophobicContact CE2-CG2 3.55Å
71	N	85.3	Confident	83.2	Confident	64 Å²	64	28.1 Å²	28.1	34%	0.342	16%	0.164	S	C	.	.			trans	-80.3	69.9	168.1	-72.3	-32	0	0	0	110.2	G136 K138	N71-G136 WeakPolarHBondContact CB-O 3.44Å; N71-G136 PolarHBondContact ND2-O 3.31Å; N71-K138 VanDerWaalsContact CG-CB 3.46Å; N71-K138 WeakPolarHBondContact OD1-CB 3.23Å; N71-K138 WeakPolarHBondContact OD1-CD 3.47Å
72	G	86.2	Confident	85.1	Confident	16 Å²	16	26 Å²	26	17%	0.165	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-79	166.3	175.1	0	0	0	0	0	113	K49 F70 S96	K49-G72 WeakPolarHBondContact CB-O 3.43Å; K49-G72 WeakPolarHBondContact O-CA 3.29Å; K49-G72 PolarHBondContact O-N 3.26Å; F70-G72 PolarHBondContact O-N 3.38Å; G72-S96 CarbonylContact C-O 3.56Å; G72-S96 VanDerWaalsContact CA-O 3.28Å; G72-S96 WeakPolarHBondContact CA-O 3.28Å
73	M	82.8	Confident	86.4	Confident	40 Å²	40	25.3 Å²	25.3	20%	0.197	14%	0.14	C	C	.	.			trans	-101.8	151.9	169.6	-65.1	-165.3	-66.8	0	0	111.7	K49 K75 S96 I97 S98	K49-M73 WeakPolarHBondContact CB-O 3.43Å; M73-K75 HydrophobicContact CB-CG 4.16Å; M73-K75 HydrophobicContact CE-CD 3.8Å; M73-K75 HydrophobicContact CE-CG 4.46Å; M73-K75 PolarHBondContact O-N 3.05Å; M73-S96 VanDerWaalsContact CE-OG 3.25Å; M73-S96 WeakPolarHBondContact CE-OG 3.34Å; M73-S96 PolarHBondContact N-O 2.88Å; M73-I97 WeakPolarHBondContact CE-O 3.26Å; M73-S98 WeakPolarHBondContact CG-OG 3.42Å; M73-S98 PolarHBondContact SD-OG 2.83Å
74	D	78.1	Confident	87.5	Confident	71 Å²	71	23.5 Å²	23.5	38%	0.38	12%	0.124	S	C	.	.	S	Bend	trans	-76.7	70.8	170.6	-68.4	-41.8	0	0	0	109.3	Y24 K49	Y24-D74 HydrophobicContact CD2-CB 4.47Å; Y24-D74 HydrophobicContact CG-CB 4.38Å; K49-D74 WeakPolarHBondContact CD-OD1 3.43Å; K49-D74 WeakPolarHBondContact CE-OD1 3.43Å; K49-D74 WeakPolarHBondContact CG-OD1 3.27Å; K49-D74 IonicContact NZ-OD1 3.96Å; K49-D74 IonicContact NZ-OD2 2.74Å; K49-D74 PolarHBondContact NZ-OD2 3.25Å
75	K	78.8	Confident	88.2	Confident	77 Å²	77	26.3 Å²	26.3	34%	0.335	14%	0.139	S	C	.	.	S	Bend	trans	-123	173.8	175.8	-71.7	-163.3	-179.2	176.1	0	111.3	Y24 M73 E106	Y24-K75 VanDerWaalsContact CE1-C 3.4Å; M73-K75 HydrophobicContact CB-CG 4.16Å; M73-K75 HydrophobicContact CE-CD 3.8Å; M73-K75 HydrophobicContact CE-CG 4.46Å; M73-K75 PolarHBondContact O-N 3.05Å; K75-E106 WeakPolarHBondContact CD-OE1 3.28Å; K75-E106 IonicContact NZ-OE1 3.6Å; K75-E106 PolarHBondContact NZ-OE1 2.87Å
76	D	74.4	Confident	88.5	Confident	72 Å²	72	30.4 Å²	30.4	39%	0.385	16%	0.163	S	C	.	.	S	Bend	trans	-54.4	141	171.6	-74.3	-13.6	0	0	0	110.8	G20 N21	G20-D76 VanDerWaalsContact CA-OD1 3.26Å; G20-D76 WeakPolarHBondContact CA-OD1 3.49Å; N21-D76 PolarHBondContact N-OD1 3.24Å
77	G	79.9	Confident	88.7	Confident	11 Å²	11	30.2 Å²	30.2	11%	0.113	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.4	-172.7	-170.9	0	0	0	0	0	111.9	W19 N94	W19-G77 PolarHBondContact N-O 3.45Å; G77-N94 WeakPolarHBondContact CA-O 3.48Å
78	G	84.9	Confident	88.8	Confident	4 Å²	4	30.1 Å²	30.1	4%	0.041	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	139.7	179.4	0	0	0	0	0	111.4	L17 W92 I93	L17-G78 CarbonylContact O-C 3.6Å; L17-G78 WeakPolarHBondContact O-CA 3.4Å; G78-W92 CarbonylContact O-C 3.57Å; G78-W92 WeakPolarHBondContact O-CA 3.3Å; G78-I93 VanDerWaalsContact C-CG1 3.47Å; G78-I93 VanDerWaalsContact O-CG1 3.27Å; G78-I93 WeakPolarHBondContact O-CG1 3.25Å; G78-I93 PolarHBondContact O-N 2.98Å
79	V	90.8	Very high	89	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.006	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	133.3	172.9	-173.3	0	0	0	0	109.3	L17 W19 I46 I81 I90 K91 W92	L17-V79 PolarHBondContact N-O 2.9Å; L17-V79 PolarHBondContact O-N 3.07Å; W19-V79 HydrophobicContact CZ2-CG2 4.35Å; I46-V79 HydrophobicContact CG2-CG1 4.23Å; V79-I81 HydrophobicContact CG1-CD1 4.43Å; V79-I81 HydrophobicContact CG1-CG1 3.92Å; V79-I90 HydrophobicContact CG1-CG2 3.44Å; V79-I90 VanDerWaalsContact CG1-CG2 3.44Å; V79-K91 CarbonylContact C-O 3.6Å; V79-K91 VanDerWaalsContact CA-O 3.28Å; V79-K91 WeakPolarHBondContact CA-O 3.36Å; V79-W92 HydrophobicContact CG2-CG 4.18Å
80	E	92	Very high	89.1	Confident	13 Å²	13	29.7 Å²	29.7	6%	0.061	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	136.9	168.8	-63.1	-169.2	-170.7	0	0	109.7	Y14 K16 I90 K91 I93 W387	Y14-E80 PolarHBondContact OH-OE2 3.13Å; K16-E80 HydrophobicContact CB-CG 4.32Å; K16-E80 HydrophobicContact CD-CG 4.12Å; K16-E80 WeakPolarHBondContact CD-OE1 3.16Å; K16-E80 WeakPolarHBondContact CE-OE1 3.39Å; K16-E80 HydrophobicContact CG-CG 3.97Å; K16-E80 IonicContact NZ-OE1 3.5Å; K16-E80 PolarHBondContact NZ-OE1 3.24Å; E80-I90 CarbonylContact O-C 3.59Å; E80-I90 WeakPolarHBondContact O-CA 3.27Å; E80-K91 HydrophobicContact CB-CB 4.49Å; E80-K91 PolarHBondContact N-O 2.86Å; E80-K91 PolarHBondContact O-N 2.68Å; E80-I93 HydrophobicContact CG-CD1 4.47Å; E80-I93 HydrophobicContact CG-CG2 4Å; E80-W387 VanDerWaalsContact OE1-CH2 3.29Å; E80-W387 WeakPolarHBondContact OE1-CH2 3.46Å; E80-W387 WeakPolarHBondContact OE2-CH2 3.02Å; E80-W387 WeakPolarHBondContact OE2-CZ2 3.45Å
81	I	93.1	Very high	89.3	Confident	8 Å²	8	30.4 Å²	30.4	4%	0.041	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	131.6	-171.3	-56	172.3	0	0	0	108.4	Y14 G15 L17 L28 I46 V79 L88 A89	Y14-I81 WeakPolarHBondContact CA-O 3.42Å; Y14-I81 WeakPolarHBondContact CD2-O 3.44Å; G15-I81 PolarHBondContact N-O 2.87Å; G15-I81 PolarHBondContact O-N 2.91Å; L17-I81 HydrophobicContact CD1-CD1 3.98Å; L28-I81 HydrophobicContact CD2-CG2 3.82Å; I46-I81 HydrophobicContact CD1-CD1 3.56Å; I46-I81 HydrophobicContact CD1-CG1 4.14Å; V79-I81 HydrophobicContact CG1-CD1 4.43Å; V79-I81 HydrophobicContact CG1-CG1 3.92Å; I81-L88 HydrophobicContact CG2-CD1 3.93Å; I81-A89 WeakPolarHBondContact CA-O 3.4Å
82	M	93.3	Very high	89.7	Confident	25 Å²	25	27.4 Å²	27.4	12%	0.123	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	114.8	167.7	-173.4	177.4	-175.8	0	0	108.3	Y14 T84 F87 L88 A89 F385	Y14-M82 HydrophobicContact CD2-CB 4.3Å; M82-T84 HydrophobicContact CE-CG2 3.85Å; M82-T84 HydrophobicContact CG-CG2 4.03Å; M82-F87 HydrophobicContact CE-CZ 4.05Å; M82-F87 HydrophobicContact CG-CE2 4.12Å; M82-F87 HydrophobicContact SD-CE2 3.86Å; M82-F87 HydrophobicContact SD-CZ 3.91Å; M82-L88 CarbonylContact O-C 3.58Å; M82-L88 WeakPolarHBondContact O-CA 3.21Å; M82-A89 HydrophobicContact CB-CB 4.31Å; M82-A89 PolarHBondContact N-O 3.32Å; M82-A89 PolarHBondContact O-N 3.34Å; M82-F385 HydrophobicContact CE-CD1 3.77Å; M82-F385 HydrophobicContact CE-CE1 4.2Å; M82-F385 HydrophobicContact SD-CD1 4.41Å
83	N	93.3	Very high	90	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	114.8	-178.8	-175	19.3	0	0	0	108.3	E13 L28 T29 L31 L88	E13-N83 HydrophobicContact CB-CB 4.35Å; E13-N83 PolarHBondContact N-O 3.28Å; E13-N83 PolarHBondContact O-N 3.07Å; L28-N83 HydrophobicContact CD2-CB 4.5Å; T29-N83 PolarHBondContact O-ND2 2.92Å; L31-N83 WeakPolarHBondContact CD1-O 3.44Å; L31-N83 PolarHBondContact N-OD1 2.72Å; N83-L88 HydrophobicContact CB-CD1 3.98Å
84	T	94.2	Very high	90.2	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.025	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	169.9	-179.7	72.7	0	0	0	0	109.5	E12 F32 M82 N86 F87	E12-T84 HydrophobicContact CB-CG2 4.44Å; E12-T84 HydrophobicContact CG-CG2 3.96Å; F32-T84 VanDerWaalsContact CD1-O 3.25Å; F32-T84 WeakPolarHBondContact CD1-O 3.28Å; F32-T84 WeakPolarHBondContact CE1-O 3.3Å; M82-T84 HydrophobicContact CE-CG2 3.85Å; M82-T84 HydrophobicContact CG-CG2 4.03Å; T84-N86 PolarHBondContact O-N 2.69Å; T84-N86 PolarHBondContact OG1-N 3.33Å; T84-F87 HydrophobicContact CG2-CE1 4.26Å; T84-F87 HydrophobicContact CG2-CE2 4.14Å; T84-F87 HydrophobicContact CG2-CZ 3.91Å; T84-F87 PolarHBondContact N-O 2.73Å; T84-F87 WeakPolarHBondContact OG1-CD1 2.9Å; T84-F87 PolarHBondContact OG1-N 3.41Å; T84-F87 PolarHBondContact OG1-O 2.73Å
85	N	94.1	Very high	90.8	Very high	68 Å²	68	26.1 Å²	26.1	36%	0.364	14%	0.138	S	C	.	.	S	Bend	trans	-62.6	-20.2	172.6	-66.7	-30.6	0	0	0	113.8	L31	L31-N85 WeakPolarHBondContact CB-OD1 3.46Å
86	N	94.3	Very high	91.2	Very high	109 Å²	109	22.6 Å²	22.6	58%	0.583	12%	0.123	S	C	*	.	S	Bend	trans	-104.1	-27.9	-173.4	-67.1	-33.2	0	0	0	113.4	T84 S117	T84-N86 PolarHBondContact O-N 2.69Å; T84-N86 PolarHBondContact OG1-N 3.33Å; N86-S117 WeakPolarHBondContact O-CB 3.25Å; N86-S117 PolarHBondContact O-N 2.91Å; N86-S117 PolarHBondContact O-OG 2.83Å
87	F	95.7	Very high	91.6	Very high	24 Å²	24	19.3 Å²	19.3	11%	0.105	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	154.9	-179.9	63.4	-93.4	0	0	0	112.2	F32 M82 T84 A89 I114 I115 Y116 P383	F32-F87 VanDerWaalsContact CE1-C 3.43Å; M82-F87 HydrophobicContact CE-CZ 4.05Å; M82-F87 HydrophobicContact CG-CE2 4.12Å; M82-F87 HydrophobicContact SD-CE2 3.86Å; M82-F87 HydrophobicContact SD-CZ 3.91Å; T84-F87 HydrophobicContact CG2-CE1 4.26Å; T84-F87 HydrophobicContact CG2-CE2 4.14Å; T84-F87 HydrophobicContact CG2-CZ 3.91Å; T84-F87 PolarHBondContact N-O 2.73Å; T84-F87 WeakPolarHBondContact OG1-CD1 2.9Å; T84-F87 PolarHBondContact OG1-N 3.41Å; T84-F87 PolarHBondContact OG1-O 2.73Å; F87-A89 HydrophobicContact CD2-CB 4.01Å; F87-A89 HydrophobicContact CE2-CB 4.09Å; F87-I114 HydrophobicContact CB-CG2 3.95Å; F87-I114 HydrophobicContact CD2-CG2 4.17Å; F87-I114 HydrophobicContact CG-CG2 4.28Å; F87-I115 CarbonylContact C-O 3.56Å; F87-I115 WeakPolarHBondContact CA-O 3.34Å; F87-I115 WeakPolarHBondContact CB-O 3.36Å; F87-Y116 HydrophobicContact CB-CD1 3.88Å; F87-Y116 HydrophobicContact CB-CE1 4.3Å; F87-Y116 HydrophobicContact CB-CG 4.43Å; F87-P383 HydrophobicContact CD1-CG 4.39Å; F87-P383 HydrophobicContact CE1-CB 4.29Å; F87-P383 HydrophobicContact CE1-CG 4.05Å; F87-P383 HydrophobicContact CE2-CG 4.49Å; F87-P383 HydrophobicContact CZ-CB 4.17Å; F87-P383 HydrophobicContact CZ-CG 4.1Å
88	L	96.1	Very high	91.1	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	115.9	165.3	171.9	65.4	0	0	0	108.2	L28 T30 F32 V44 I81 M82 N83 I90 I114 I115	L28-L88 HydrophobicContact CD2-CD1 3.46Å; L28-L88 VanDerWaalsContact CD2-CD1 3.46Å; L28-L88 HydrophobicContact CD2-CD2 4.23Å; T30-L88 HydrophobicContact CG2-CD2 3.91Å; F32-L88 HydrophobicContact CE1-CB 4.28Å; F32-L88 HydrophobicContact CZ-CB 4.2Å; V44-L88 HydrophobicContact CG1-CD2 4.31Å; V44-L88 HydrophobicContact CG2-CD2 3.74Å; I81-L88 HydrophobicContact CG2-CD1 3.93Å; M82-L88 CarbonylContact O-C 3.58Å; M82-L88 WeakPolarHBondContact O-CA 3.21Å; N83-L88 HydrophobicContact CB-CD1 3.98Å; L88-I90 HydrophobicContact CD1-CG1 4.27Å; L88-I90 HydrophobicContact CD2-CD1 3.92Å; L88-I90 HydrophobicContact CD2-CG1 4.43Å; L88-I90 HydrophobicContact CG-CD1 4.11Å; L88-I90 HydrophobicContact CG-CG1 4.11Å; L88-I114 CarbonylContact O-C 3.56Å; L88-I114 WeakPolarHBondContact O-CA 3.46Å; L88-I115 PolarHBondContact N-O 3.28Å; L88-I115 PolarHBondContact O-N 2.8Å
89	A	96.8	Very high	89.7	Confident	11 Å²	11	22.8 Å²	22.8	9%	0.091	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	132.7	173.9	0	0	0	0	0	110.4	I81 M82 F87 C113 I114	I81-A89 WeakPolarHBondContact CA-O 3.4Å; M82-A89 HydrophobicContact CB-CB 4.31Å; M82-A89 PolarHBondContact N-O 3.32Å; M82-A89 PolarHBondContact O-N 3.34Å; F87-A89 HydrophobicContact CD2-CB 4.01Å; F87-A89 HydrophobicContact CE2-CB 4.09Å; A89-C113 CarbonylContact C-O 3.49Å; A89-C113 WeakPolarHBondContact CA-O 3.44Å; A89-I114 HydrophobicContact CB-CG1 4.05Å; A89-I114 HydrophobicContact CB-CG2 4.46Å
90	I	96.2	Very high	88.1	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	118.5	-179.8	-58	159.3	0	0	0	107.4	I46 I52 V79 E80 L88 W92 A112 C113	I46-I90 HydrophobicContact CD1-CD1 3.69Å; I46-I90 HydrophobicContact CD1-CG1 3.88Å; I46-I90 HydrophobicContact CD1-CG2 4.36Å; I46-I90 HydrophobicContact CG1-CD1 3.82Å; I46-I90 HydrophobicContact CG1-CG1 4.49Å; I46-I90 HydrophobicContact CG2-CG2 3.94Å; I52-I90 HydrophobicContact CD1-CD1 3.61Å; I52-I90 HydrophobicContact CG1-CD1 3.93Å; I52-I90 HydrophobicContact CG2-CD1 4.37Å; V79-I90 HydrophobicContact CG1-CG2 3.44Å; V79-I90 VanDerWaalsContact CG1-CG2 3.44Å; E80-I90 CarbonylContact O-C 3.59Å; E80-I90 WeakPolarHBondContact O-CA 3.27Å; L88-I90 HydrophobicContact CD1-CG1 4.27Å; L88-I90 HydrophobicContact CD2-CD1 3.92Å; L88-I90 HydrophobicContact CD2-CG1 4.43Å; L88-I90 HydrophobicContact CG-CD1 4.11Å; L88-I90 HydrophobicContact CG-CG1 4.11Å; I90-W92 HydrophobicContact CB-CH2 4.11Å; I90-W92 HydrophobicContact CB-CZ3 4.06Å; I90-W92 HydrophobicContact CG2-CD2 4.32Å; I90-W92 HydrophobicContact CG2-CE3 4.04Å; I90-W92 HydrophobicContact CG2-CH2 3.47Å; I90-W92 VanDerWaalsContact CG2-CH2 3.47Å; I90-W92 HydrophobicContact CG2-CZ2 3.78Å; I90-W92 HydrophobicContact CG2-CZ3 3.61Å; I90-A112 CarbonylContact O-C 3.53Å; I90-A112 WeakPolarHBondContact O-CA 3.14Å; I90-C113 PolarHBondContact N-O 2.89Å; I90-C113 PolarHBondContact O-N 2.88Å
91	K	95.5	Very high	86.3	Confident	18 Å²	18	33.9 Å²	33.9	8%	0.078	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	117.2	177	-178	176.6	172.4	176.3	0	110	V79 E80 I93 I110 V111 A112 E126 W387	V79-K91 CarbonylContact C-O 3.6Å; V79-K91 VanDerWaalsContact CA-O 3.28Å; V79-K91 WeakPolarHBondContact CA-O 3.36Å; E80-K91 HydrophobicContact CB-CB 4.49Å; E80-K91 PolarHBondContact N-O 2.86Å; E80-K91 PolarHBondContact O-N 2.68Å; K91-I93 HydrophobicContact CD-CG2 4.1Å; K91-I93 HydrophobicContact CG-CG2 4.01Å; K91-I93 PolarHBondContact O-N 3.47Å; K91-I110 HydrophobicContact CD-CG2 4.43Å; K91-I110 HydrophobicContact CG-CG2 4.4Å; K91-V111 CarbonylContact C-O 3.46Å; K91-V111 WeakPolarHBondContact CA-O 3.07Å; K91-A112 HydrophobicContact CB-CB 4.13Å; K91-A112 HydrophobicContact CG-CB 4.17Å; K91-E126 WeakPolarHBondContact CE-OE2 3.47Å; K91-E126 IonicContact NZ-OE1 2.76Å; K91-E126 PolarHBondContact NZ-OE1 2.82Å; K91-E126 IonicContact NZ-OE2 3.2Å; K91-E126 PolarHBondContact NZ-OE2 3.16Å; K91-W387 HydrophobicContact CD-CZ2 3.67Å; K91-W387 VanDerWaalsContact NZ-CE2 3.34Å; K91-W387 VanDerWaalsContact NZ-NE1 3.19Å
92	W	93.9	Very high	84.6	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.008	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	109.4	166.1	-66.5	-101	0	0	0	107.8	I46 L47 S48 I52 V69 G78 V79 I90 L95 I110 V111 C113	I46-W92 HydrophobicContact CG2-CZ2 3.84Å; L47-W92 PolarHBondContact O-NE1 2.92Å; S48-W92 PolarHBondContact O-NE1 2.66Å; I52-W92 HydrophobicContact CD1-CH2 3.9Å; I52-W92 HydrophobicContact CG1-CH2 3.59Å; I52-W92 HydrophobicContact CG1-CZ2 4.19Å; V69-W92 HydrophobicContact CG1-CZ3 4.31Å; V69-W92 HydrophobicContact CG2-CE3 3.99Å; V69-W92 HydrophobicContact CG2-CH2 4.27Å; V69-W92 HydrophobicContact CG2-CZ3 3.84Å; G78-W92 CarbonylContact O-C 3.57Å; G78-W92 WeakPolarHBondContact O-CA 3.3Å; V79-W92 HydrophobicContact CG2-CG 4.18Å; I90-W92 HydrophobicContact CB-CH2 4.11Å; I90-W92 HydrophobicContact CB-CZ3 4.06Å; I90-W92 HydrophobicContact CG2-CD2 4.32Å; I90-W92 HydrophobicContact CG2-CE3 4.04Å; I90-W92 HydrophobicContact CG2-CH2 3.47Å; I90-W92 VanDerWaalsContact CG2-CH2 3.47Å; I90-W92 HydrophobicContact CG2-CZ2 3.78Å; I90-W92 HydrophobicContact CG2-CZ3 3.61Å; W92-L95 HydrophobicContact CB-CB 3.92Å; W92-L95 HydrophobicContact CB-CD1 4.5Å; W92-L95 HydrophobicContact CG-CD1 4.35Å; W92-I110 WeakPolarHBondContact O-CA 3.15Å; W92-V111 PolarHBondContact N-O 2.77Å; W92-V111 PolarHBondContact O-N 2.82Å; W92-C113 HydrophobicContact CZ3-CB 4Å
93	I	91.5	Very high	83.1	Confident	40 Å²	40	48.3 Å²	48.3	21%	0.205	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-17.3	-178.6	56.8	166	0	0	0	112.5	K16 G78 E80 K91 W387	K16-I93 VanDerWaalsContact CE-CD1 3.49Å; G78-I93 VanDerWaalsContact C-CG1 3.47Å; G78-I93 VanDerWaalsContact O-CG1 3.27Å; G78-I93 WeakPolarHBondContact O-CG1 3.25Å; G78-I93 PolarHBondContact O-N 2.98Å; E80-I93 HydrophobicContact CG-CD1 4.47Å; E80-I93 HydrophobicContact CG-CG2 4Å; K91-I93 HydrophobicContact CD-CG2 4.1Å; K91-I93 HydrophobicContact CG-CG2 4.01Å; K91-I93 PolarHBondContact O-N 3.47Å; I93-W387 HydrophobicContact CG2-CZ2 4.44Å
94	N	88.1	Confident	81.7	Confident	60 Å²	60	52.8 Å²	52.8	32%	0.321	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	70.8	176.6	-157.1	39.1	0	0	0	109.4	G77 S96 Y108	G77-N94 WeakPolarHBondContact CA-O 3.48Å; N94-S96 PolarHBondContact O-N 3.01Å; N94-Y108 VanDerWaalsContact CG-CD1 3.42Å; N94-Y108 WeakPolarHBondContact ND2-CE1 3.47Å; N94-Y108 WeakPolarHBondContact OD1-CB 3.36Å; N94-Y108 WeakPolarHBondContact OD1-CD1 3.2Å; N94-Y108 WeakPolarHBondContact OD1-CD2 3.35Å
95	L	89.5	Confident	80.2	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	101.6	179.1	-177.1	57.4	0	0	0	109	S48 K49 F70 W92 I97 Y108 A109 V111	S48-L95 WeakPolarHBondContact O-CD1 2.92Å; K49-L95 VanDerWaalsContact C-CD1 3.45Å; F70-L95 HydrophobicContact CB-CD2 3.51Å; F70-L95 HydrophobicContact CD1-CD2 4.38Å; F70-L95 HydrophobicContact CG-CD2 4.16Å; W92-L95 HydrophobicContact CB-CB 3.92Å; W92-L95 HydrophobicContact CB-CD1 4.5Å; W92-L95 HydrophobicContact CG-CD1 4.35Å; L95-I97 PolarHBondContact O-N 3.49Å; L95-Y108 VanDerWaalsContact O-CA 3.3Å; L95-Y108 WeakPolarHBondContact O-CA 3.41Å; L95-A109 HydrophobicContact CB-CB 4.22Å; L95-A109 VanDerWaalsContact CB-O 3.27Å; L95-A109 WeakPolarHBondContact CB-O 3.39Å; L95-A109 HydrophobicContact CD2-CB 4.41Å; L95-A109 PolarHBondContact N-O 2.9Å; L95-A109 PolarHBondContact O-N 2.95Å; L95-V111 HydrophobicContact CD2-CG2 4.08Å
96	S	86.9	Confident	79.1	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.014	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	132.2	177.3	-174.3	0	0	0	0	110.3	G72 M73 N94	G72-S96 CarbonylContact C-O 3.56Å; G72-S96 VanDerWaalsContact CA-O 3.28Å; G72-S96 WeakPolarHBondContact CA-O 3.28Å; M73-S96 VanDerWaalsContact CE-OG 3.25Å; M73-S96 WeakPolarHBondContact CE-OG 3.34Å; M73-S96 PolarHBondContact N-O 2.88Å; N94-S96 PolarHBondContact O-N 3.01Å
97	I	82.5	Confident	78.5	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.021	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143	178.6	57.1	167.9	0	0	0	109.2	F70 M73 L95 A99 E107 A109 P129 F132	F70-I97 HydrophobicContact CD1-CG2 3.6Å; F70-I97 HydrophobicContact CE1-CB 4.5Å; F70-I97 HydrophobicContact CE1-CG2 3.54Å; M73-I97 WeakPolarHBondContact CE-O 3.26Å; L95-I97 PolarHBondContact O-N 3.49Å; I97-A99 PolarHBondContact O-N 3.12Å; I97-A99 VanDerWaalsContact O-N 3.15Å; I97-E107 HydrophobicContact CD1-CB 3.77Å; I97-E107 HydrophobicContact CG1-CB 3.73Å; I97-E107 VanDerWaalsContact CG1-O 3.25Å; I97-E107 WeakPolarHBondContact CG1-O 3.12Å; I97-E107 PolarHBondContact N-O 3.01Å; I97-E107 VanDerWaalsContact N-O 3.14Å; I97-A109 HydrophobicContact CG2-CB 4.36Å; I97-P129 HydrophobicContact CD1-CB 4.49Å; I97-P129 HydrophobicContact CD1-CG 3.79Å; I97-F132 HydrophobicContact CD1-CD2 3.82Å; I97-F132 HydrophobicContact CD1-CE2 4.03Å; I97-F132 HydrophobicContact CD1-CG 4.43Å
98	S	69.4	Low	78.1	Confident	65 Å²	65	58.3 Å²	58.3	46%	0.455	31%	0.308	S	S	.	.			trans	-62.7	118.4	177.6	-55.7	0	0	0	0	108.8	M73 F132	M73-S98 WeakPolarHBondContact CG-OG 3.42Å; M73-S98 PolarHBondContact SD-OG 2.83Å; S98-F132 WeakPolarHBondContact O-CZ 3.36Å
99	A	57.5	Low	77.8	Confident	22 Å²	22	58.3 Å²	58.3	18%	0.182	31%	0.308	C	S	.	.			trans	-60.7	144.5	161.4	0	0	0	0	0	107.9	I97 H101 E104	I97-A99 PolarHBondContact O-N 3.12Å; I97-A99 VanDerWaalsContact O-N 3.15Å; A99-H101 WeakPolarHBondContact CB-O 3.43Å; A99-H101 PolarHBondContact O-N 3.25Å; A99-H101 VanDerWaalsContact O-N 3.08Å; A99-E104 HydrophobicContact CB-CB 3.86Å
100	L	55.2	Low	77.6	Confident	124 Å²	124	59.6 Å²	59.6	65%	0.649	31%	0.313	S	S	*	.	S	Bend	trans	-60.5	-20.4	179.2	-73	165.7	0	0	0	111.8	F132	L100-F132 HydrophobicContact CD1-CE1 4.3Å; L100-F132 HydrophobicContact CD1-CZ 4.5Å; L100-F132 HydrophobicContact CD2-CE1 4.16Å; L100-F132 HydrophobicContact CG-CE1 3.79Å; L100-F132 HydrophobicContact CG-CZ 3.96Å
101	H	55.2	Low	77.5	Confident	123 Å²	123	59.5 Å²	59.5	57%	0.569	31%	0.313	S	S	*	.	S	Bend	trans	-134	137.9	-179.4	-61.2	-46.1	0	0	0	110.7	A99 D103 E104	A99-H101 WeakPolarHBondContact CB-O 3.43Å; A99-H101 PolarHBondContact O-N 3.25Å; A99-H101 VanDerWaalsContact O-N 3.08Å; H101-D103 PolarHBondContact O-N 3.2Å; H101-D103 VanDerWaalsContact O-N 3.1Å; H101-E104 HydrophobicContact CB-CG 4.45Å; H101-E104 PolarHBondContact O-N 3.2Å; H101-E104 VanDerWaalsContact O-N 3.15Å
102	D	57.2	Low	77.6	Confident	172 Å²	172	59 Å²	59	92%	0.92	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.4	-176.8	-72.5	-37.9	0	0	0	113.8
103	D	61.8	Low	77.7	Confident	165 Å²	165	59 Å²	59	88%	0.882	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-7.4	-178.2	-61.5	-37.7	0	0	0	113.6	H101	H101-D103 PolarHBondContact O-N 3.2Å; H101-D103 VanDerWaalsContact O-N 3.1Å
104	E	63.3	Low	78	Confident	94 Å²	94	57.2 Å²	57.2	44%	0.439	30%	0.303	S	S	.	.	S	Bend	trans	-88.4	146.6	-177.9	-77	-161.6	170.3	0	0	112.6	A99 H101 E106	A99-E104 HydrophobicContact CB-CB 3.86Å; H101-E104 HydrophobicContact CB-CG 4.45Å; H101-E104 PolarHBondContact O-N 3.2Å; H101-E104 VanDerWaalsContact O-N 3.15Å; E104-E106 PolarHBondContact O-N 2.92Å
105	P	64.4	Low	78.5	Confident	105 Å²	105	54.5 Å²	54.5	68%	0.682	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-58.5	136.6	-179.4	24.6	-33.2	0	0	0	110.1	E107	P105-E107 PolarHBondContact O-N 2.94Å; P105-E107 VanDerWaalsContact O-N 3.11Å
106	E	70.4	Confident	78.8	Confident	84 Å²	84	56.6 Å²	56.6	39%	0.393	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-54.9	122.6	176.2	-71.8	-171.1	176.7	0	0	110.3	K75 E104 Y108	K75-E106 WeakPolarHBondContact CD-OE1 3.28Å; K75-E106 IonicContact NZ-OE1 3.6Å; K75-E106 PolarHBondContact NZ-OE1 2.87Å; E104-E106 PolarHBondContact O-N 2.92Å; E106-Y108 HydrophobicContact CB-CE1 4.48Å; E106-Y108 HydrophobicContact CB-CE2 4.16Å; E106-Y108 WeakPolarHBondContact O-CE2 3.45Å; E106-Y108 PolarHBondContact OE2-OH 2.82Å
107	E	81	Confident	79.2	Confident	53 Å²	53	59.3 Å²	59.3	25%	0.248	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	155.4	172.2	-66.6	-160.1	141.5	0	0	110.7	I97 P105 P129 F132	I97-E107 HydrophobicContact CD1-CB 3.77Å; I97-E107 HydrophobicContact CG1-CB 3.73Å; I97-E107 VanDerWaalsContact CG1-O 3.25Å; I97-E107 WeakPolarHBondContact CG1-O 3.12Å; I97-E107 PolarHBondContact N-O 3.01Å; I97-E107 VanDerWaalsContact N-O 3.14Å; P105-E107 PolarHBondContact O-N 2.94Å; P105-E107 VanDerWaalsContact O-N 3.11Å; E107-P129 HydrophobicContact CB-CG 4.02Å; E107-P129 WeakPolarHBondContact OE2-CB 3.35Å; E107-P129 WeakPolarHBondContact OE2-CG 3.33Å; E107-F132 WeakPolarHBondContact OE2-CD2 3.32Å; E107-F132 WeakPolarHBondContact OE2-CE2 3.27Å
108	Y	87	Confident	79.6	Confident	80 Å²	80	64.1 Å²	64.1	31%	0.314	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	136.5	-179	-54.5	-82.1	0	0	0	111.1	N94 L95 E106	N94-Y108 VanDerWaalsContact CG-CD1 3.42Å; N94-Y108 WeakPolarHBondContact ND2-CE1 3.47Å; N94-Y108 WeakPolarHBondContact OD1-CB 3.36Å; N94-Y108 WeakPolarHBondContact OD1-CD1 3.2Å; N94-Y108 WeakPolarHBondContact OD1-CD2 3.35Å; L95-Y108 VanDerWaalsContact O-CA 3.3Å; L95-Y108 WeakPolarHBondContact O-CA 3.41Å; E106-Y108 HydrophobicContact CB-CE1 4.48Å; E106-Y108 HydrophobicContact CB-CE2 4.16Å; E106-Y108 WeakPolarHBondContact O-CE2 3.45Å; E106-Y108 PolarHBondContact OE2-OH 2.82Å
109	A	90.3	Very high	80.7	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	153.7	169.7	0	0	0	0	0	111.1	L95 I97 V111 K127 I128	L95-A109 HydrophobicContact CB-CB 4.22Å; L95-A109 VanDerWaalsContact CB-O 3.27Å; L95-A109 WeakPolarHBondContact CB-O 3.39Å; L95-A109 HydrophobicContact CD2-CB 4.41Å; L95-A109 PolarHBondContact N-O 2.9Å; L95-A109 PolarHBondContact O-N 2.95Å; I97-A109 HydrophobicContact CG2-CB 4.36Å; A109-V111 HydrophobicContact CB-CG2 4.13Å; A109-K127 CarbonylContact C-O 3.55Å; A109-K127 VanDerWaalsContact CA-O 3.28Å; A109-K127 WeakPolarHBondContact CA-O 3.37Å; A109-I128 HydrophobicContact CB-CD1 3.79Å
110	I	93	Very high	82.5	Confident	37 Å²	37	63.2 Å²	63.2	19%	0.19	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	113.5	168	-54.7	179.4	0	0	0	107.6	K91 W92 E126 K127	K91-I110 HydrophobicContact CD-CG2 4.43Å; K91-I110 HydrophobicContact CG-CG2 4.4Å; W92-I110 WeakPolarHBondContact O-CA 3.15Å; I110-E126 HydrophobicContact CB-CB 4.1Å; I110-E126 HydrophobicContact CG2-CB 3.83Å; I110-E126 HydrophobicContact CG2-CG 4.15Å; I110-E126 PolarHBondContact O-N 2.73Å; I110-K127 HydrophobicContact CB-CB 4.05Å; I110-K127 HydrophobicContact CD1-CB 4.23Å; I110-K127 HydrophobicContact CD1-CD 4.42Å; I110-K127 HydrophobicContact CG1-CB 4.13Å; I110-K127 PolarHBondContact N-O 2.97Å; I110-K127 PolarHBondContact O-N 3.25Å; I110-K127 VanDerWaalsContact O-N 3.16Å
111	V	94.4	Very high	84.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	134.3	-175.5	-171.5	0	0	0	0	109.1	V69 F70 K91 W92 L95 A109 I123 Y124 F125 I128	V69-V111 HydrophobicContact CB-CG1 4Å; V69-V111 HydrophobicContact CG2-CB 4.33Å; V69-V111 HydrophobicContact CG2-CG1 3.83Å; F70-V111 HydrophobicContact CD2-CG2 4.39Å; K91-V111 CarbonylContact C-O 3.46Å; K91-V111 WeakPolarHBondContact CA-O 3.07Å; W92-V111 PolarHBondContact N-O 2.77Å; W92-V111 PolarHBondContact O-N 2.82Å; L95-V111 HydrophobicContact CD2-CG2 4.08Å; A109-V111 HydrophobicContact CB-CG2 4.13Å; V111-I123 HydrophobicContact CG1-CG2 3.93Å; V111-Y124 WeakPolarHBondContact CA-O 3.33Å; V111-F125 HydrophobicContact CG1-CD1 3.93Å; V111-F125 HydrophobicContact CG1-CE1 4.01Å; V111-F125 HydrophobicContact CG2-CD1 4.07Å; V111-I128 HydrophobicContact CG2-CD1 3.91Å
112	A	96.7	Very high	86.4	Confident	8 Å²	8	52.6 Å²	52.6	7%	0.066	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	139.5	173.2	0	0	0	0	0	110.6	I90 K91 I123 Y124	I90-A112 CarbonylContact O-C 3.53Å; I90-A112 WeakPolarHBondContact O-CA 3.14Å; K91-A112 HydrophobicContact CB-CB 4.13Å; K91-A112 HydrophobicContact CG-CB 4.17Å; A112-I123 CarbonylContact O-C 3.56Å; A112-I123 VanDerWaalsContact O-CA 3.3Å; A112-I123 WeakPolarHBondContact O-CA 3.45Å; A112-Y124 PolarHBondContact N-O 2.85Å; A112-Y124 PolarHBondContact O-N 2.98Å
113	C	97.5	Very high	88.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	132.1	172.9	-178.3	0	0	0	0	109.1	I52 V69 A89 I90 W92 S122	I52-C113 HydrophobicContact CD1-CB 3.96Å; I52-C113 VanDerWaalsContact CD1-SG 3.57Å; V69-C113 HydrophobicContact CG1-CB 3.91Å; A89-C113 CarbonylContact C-O 3.49Å; A89-C113 WeakPolarHBondContact CA-O 3.44Å; I90-C113 PolarHBondContact N-O 2.89Å; I90-C113 PolarHBondContact O-N 2.88Å; W92-C113 HydrophobicContact CZ3-CB 4Å; C113-S122 CarbonylContact C-O 3.57Å; C113-S122 WeakPolarHBondContact CA-O 3.49Å
114	I	97.7	Very high	89.9	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.015	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	121.9	179.8	-51.2	163	0	0	0	107.6	F87 L88 A89 Y116 I121 S122 L382 I386	F87-I114 HydrophobicContact CB-CG2 3.95Å; F87-I114 HydrophobicContact CD2-CG2 4.17Å; F87-I114 HydrophobicContact CG-CG2 4.28Å; L88-I114 CarbonylContact O-C 3.56Å; L88-I114 WeakPolarHBondContact O-CA 3.46Å; A89-I114 HydrophobicContact CB-CG1 4.05Å; A89-I114 HydrophobicContact CB-CG2 4.46Å; I114-Y116 HydrophobicContact CB-CE2 4.07Å; I114-Y116 HydrophobicContact CG2-CD1 4.39Å; I114-Y116 HydrophobicContact CG2-CD2 4.12Å; I114-Y116 HydrophobicContact CG2-CE1 3.95Å; I114-Y116 HydrophobicContact CG2-CE2 3.67Å; I114-Y116 HydrophobicContact CG2-CG 4.47Å; I114-I121 CarbonylContact O-C 3.57Å; I114-I121 VanDerWaalsContact O-CA 3.28Å; I114-I121 WeakPolarHBondContact O-CA 3.37Å; I114-S122 PolarHBondContact N-O 2.81Å; I114-S122 PolarHBondContact O-N 2.81Å; I114-L382 HydrophobicContact CD1-CD2 3.34Å; I114-I386 HydrophobicContact CD1-CD1 3.4Å; I114-I386 HydrophobicContact CG1-CD1 4.25Å
115	I	97.2	Very high	91.3	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.021	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	117.8	173.3	-56.2	172.1	0	0	0	106.9	F32 I34 I52 I54 I67 F87 L88 I121	F32-I115 WeakPolarHBondContact CZ-O 3.33Å; I34-I115 HydrophobicContact CD1-CD1 4.13Å; I34-I115 HydrophobicContact CD1-CG2 4.11Å; I34-I115 HydrophobicContact CG1-CG2 4.12Å; I34-I115 HydrophobicContact CG2-CG2 4.26Å; I52-I115 HydrophobicContact CD1-CD1 4.33Å; I54-I115 HydrophobicContact CD1-CD1 4.22Å; I67-I115 HydrophobicContact CD1-CD1 3.89Å; I67-I115 HydrophobicContact CD1-CG1 4.33Å; F87-I115 CarbonylContact C-O 3.56Å; F87-I115 WeakPolarHBondContact CA-O 3.34Å; F87-I115 WeakPolarHBondContact CB-O 3.36Å; L88-I115 PolarHBondContact N-O 3.28Å; L88-I115 PolarHBondContact O-N 2.8Å; I115-I121 HydrophobicContact CG1-CG2 4.31Å
116	Y	96.6	Very high	92.7	Very high	43 Å²	43	33.7 Å²	33.7	17%	0.169	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	152.5	179.4	-64.1	-89.4	0	0	0	111.1	F87 I114 N118 G119 N120 S122	F87-Y116 HydrophobicContact CB-CD1 3.88Å; F87-Y116 HydrophobicContact CB-CE1 4.3Å; F87-Y116 HydrophobicContact CB-CG 4.43Å; I114-Y116 HydrophobicContact CB-CE2 4.07Å; I114-Y116 HydrophobicContact CG2-CD1 4.39Å; I114-Y116 HydrophobicContact CG2-CD2 4.12Å; I114-Y116 HydrophobicContact CG2-CE1 3.95Å; I114-Y116 HydrophobicContact CG2-CE2 3.67Å; I114-Y116 HydrophobicContact CG2-CG 4.47Å; Y116-N118 WeakPolarHBondContact CB-OD1 3.41Å; Y116-N118 PolarHBondContact O-N 2.83Å; Y116-G119 PolarHBondContact O-N 3.36Å; Y116-N120 HydrophobicContact CD2-CB 3.9Å; Y116-N120 WeakPolarHBondContact CD2-O 3.49Å; Y116-N120 HydrophobicContact CG-CB 4.41Å; Y116-N120 PolarHBondContact N-O 3.44Å; Y116-S122 WeakPolarHBondContact CE2-OG 3.3Å
117	S	94.3	Very high	93.7	Very high	60 Å²	60	35.5 Å²	35.5	42%	0.42	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-21.5	179	63.7	0	0	0	0	113.8	F32 N86 G119	F32-S117 VanDerWaalsContact CD2-CA 3.48Å; N86-S117 WeakPolarHBondContact O-CB 3.25Å; N86-S117 PolarHBondContact O-N 2.91Å; N86-S117 PolarHBondContact O-OG 2.83Å; S117-G119 VanDerWaalsContact C-N 3.28Å
118	N	92.4	Very high	94	Very high	104 Å²	104	33.3 Å²	33.3	56%	0.556	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-3.4	172.8	70.3	-5	0	0	0	113.8	Y116 N120	Y116-N118 WeakPolarHBondContact CB-OD1 3.41Å; Y116-N118 PolarHBondContact O-N 2.83Å; N118-N120 WeakPolarHBondContact OD1-CB 3.28Å; N118-N120 PolarHBondContact OD1-N 2.88Å
119	G	92.5	Very high	93.7	Very high	22 Å²	22	30.3 Å²	30.3	23%	0.227	16%	0.158	C	C	.	.	S	Bend	trans	93.2	-3.2	179.1	0	0	0	0	0	115.3	Y116 S117	Y116-G119 PolarHBondContact O-N 3.36Å; S117-G119 VanDerWaalsContact C-N 3.28Å
120	N	94.8	Very high	92.4	Very high	47 Å²	47	36.7 Å²	36.7	25%	0.251	20%	0.197	S	C	.	.			trans	-66.4	149.7	170.5	-70.9	2.8	0	0	0	110.3	Y116 N118 F180 P182	Y116-N120 HydrophobicContact CD2-CB 3.9Å; Y116-N120 WeakPolarHBondContact CD2-O 3.49Å; Y116-N120 HydrophobicContact CG-CB 4.41Å; Y116-N120 PolarHBondContact N-O 3.44Å; N118-N120 WeakPolarHBondContact OD1-CB 3.28Å; N118-N120 PolarHBondContact OD1-N 2.88Å; N120-F180 WeakPolarHBondContact CA-O 3.18Å; N120-P182 WeakPolarHBondContact OD1-CD 3.25Å
121	I	96.2	Very high	90.9	Very high	20 Å²	20	41.6 Å²	41.6	10%	0.103	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	127.1	174.9	-48.4	172.5	0	0	0	108.5	I67 I114 I115 I123 I141 F180	I67-I121 HydrophobicContact CD1-CD1 3.93Å; I114-I121 CarbonylContact O-C 3.57Å; I114-I121 VanDerWaalsContact O-CA 3.28Å; I114-I121 WeakPolarHBondContact O-CA 3.37Å; I115-I121 HydrophobicContact CG1-CG2 4.31Å; I121-I123 HydrophobicContact CB-CD1 4.47Å; I121-I123 HydrophobicContact CG2-CD1 3.68Å; I121-I141 HydrophobicContact CD1-CD1 3.96Å; I121-F180 HydrophobicContact CB-CB 4.23Å; I121-F180 HydrophobicContact CB-CD2 4.34Å; I121-F180 PolarHBondContact N-O 2.7Å; I121-F180 PolarHBondContact O-N 3.19Å
122	S	96.9	Very high	89.1	Confident	4 Å²	4	42.6 Å²	42.6	3%	0.028	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	129.2	177.4	-60.8	0	0	0	0	110.3	C113 I114 Y116 V178	C113-S122 CarbonylContact C-O 3.57Å; C113-S122 WeakPolarHBondContact CA-O 3.49Å; I114-S122 PolarHBondContact N-O 2.81Å; I114-S122 PolarHBondContact O-N 2.81Å; Y116-S122 WeakPolarHBondContact CE2-OG 3.3Å; S122-V178 WeakPolarHBondContact CA-O 3.41Å
123	I	96.1	Very high	86.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120.1	179.3	-58.7	73	0	0	0	107.9	V69 V111 A112 I121 F125 L139 L177 V178 F180	V69-I123 HydrophobicContact CB-CG2 4.42Å; V69-I123 HydrophobicContact CG1-CG1 4.5Å; V111-I123 HydrophobicContact CG1-CG2 3.93Å; A112-I123 CarbonylContact O-C 3.56Å; A112-I123 VanDerWaalsContact O-CA 3.3Å; A112-I123 WeakPolarHBondContact O-CA 3.45Å; I121-I123 HydrophobicContact CB-CD1 4.47Å; I121-I123 HydrophobicContact CG2-CD1 3.68Å; I123-F125 HydrophobicContact CG2-CE1 4.08Å; I123-F125 HydrophobicContact CG2-CE2 4.12Å; I123-F125 HydrophobicContact CG2-CZ 3.82Å; I123-L139 HydrophobicContact CB-CD2 4.18Å; I123-L139 HydrophobicContact CD1-CD1 4.36Å; I123-L139 HydrophobicContact CG1-CD1 3.9Å; I123-L139 HydrophobicContact CG1-CD2 4.27Å; I123-L139 HydrophobicContact CG2-CD1 4.44Å; I123-L139 HydrophobicContact CG2-CD2 4.31Å; I123-L177 WeakPolarHBondContact O-CA 3.31Å; I123-V178 PolarHBondContact N-O 2.82Å; I123-V178 PolarHBondContact O-N 2.9Å; I123-F180 HydrophobicContact CD1-CD2 3.5Å; I123-F180 VanDerWaalsContact CD1-CD2 3.5Å; I123-F180 HydrophobicContact CD1-CE2 3.39Å; I123-F180 HydrophobicContact CG1-CE2 4.47Å
124	Y	95.9	Very high	84.5	Confident	69 Å²	69	46.8 Å²	46.8	27%	0.271	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	122.7	178.7	-178.6	-118.5	0	0	0	110.5	V111 A112 E126 T176 L177	V111-Y124 WeakPolarHBondContact CA-O 3.33Å; A112-Y124 PolarHBondContact N-O 2.85Å; A112-Y124 PolarHBondContact O-N 2.98Å; Y124-E126 HydrophobicContact CD1-CB 3.96Å; Y124-E126 HydrophobicContact CE1-CB 3.61Å; Y124-E126 HydrophobicContact CE1-CG 3.97Å; Y124-E126 PolarHBondContact O-N 2.93Å; Y124-T176 WeakPolarHBondContact CD2-O 3.36Å; Y124-L177 HydrophobicContact CD2-CB 4.36Å
125	F	93.2	Very high	82.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	87.4	176.7	-62.7	-71.5	0	0	0	108.8	V69 F70 V111 I123 I128 L139 I172 R173 S174 G175 T176 V178	V69-F125 WeakPolarHBondContact O-CE1 3.37Å; F70-F125 HydrophobicContact CD2-CE1 4.15Å; V111-F125 HydrophobicContact CG1-CD1 3.93Å; V111-F125 HydrophobicContact CG1-CE1 4.01Å; V111-F125 HydrophobicContact CG2-CD1 4.07Å; I123-F125 HydrophobicContact CG2-CE1 4.08Å; I123-F125 HydrophobicContact CG2-CE2 4.12Å; I123-F125 HydrophobicContact CG2-CZ 3.82Å; F125-I128 HydrophobicContact CB-CD1 4.3Å; F125-I128 HydrophobicContact CB-CG1 3.92Å; F125-I128 HydrophobicContact CD1-CD1 3.88Å; F125-I128 HydrophobicContact CD1-CG1 4.18Å; F125-I128 HydrophobicContact CG-CG1 4.39Å; F125-L139 HydrophobicContact CE2-CD2 4.12Å; F125-L139 HydrophobicContact CZ-CB 4.19Å; F125-L139 HydrophobicContact CZ-CD2 3.83Å; F125-I172 HydrophobicContact CD1-CG2 3.99Å; F125-I172 HydrophobicContact CE1-CG2 3.65Å; F125-I172 HydrophobicContact CE2-CG1 4.29Å; F125-I172 HydrophobicContact CE2-CG2 4.32Å; F125-I172 HydrophobicContact CG-CG2 4.45Å; F125-I172 HydrophobicContact CZ-CB 4.36Å; F125-I172 HydrophobicContact CZ-CG1 4.01Å; F125-I172 HydrophobicContact CZ-CG2 3.82Å; F125-R173 WeakPolarHBondContact CB-O 3.13Å; F125-S174 CarbonylContact O-C 3.51Å; F125-S174 WeakPolarHBondContact O-CA 3.42Å; F125-G175 PolarHBondContact O-N 3Å; F125-T176 PolarHBondContact N-O 2.79Å; F125-V178 HydrophobicContact CE2-CG2 3.85Å
126	E	93.2	Very high	80.7	Confident	70 Å²	70	53.7 Å²	53.7	33%	0.327	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	-47.3	-176	-175.6	172.4	138	0	0	111.5	K91 I110 Y124	K91-E126 WeakPolarHBondContact CE-OE2 3.47Å; K91-E126 IonicContact NZ-OE1 2.76Å; K91-E126 PolarHBondContact NZ-OE1 2.82Å; K91-E126 IonicContact NZ-OE2 3.2Å; K91-E126 PolarHBondContact NZ-OE2 3.16Å; I110-E126 HydrophobicContact CB-CB 4.1Å; I110-E126 HydrophobicContact CG2-CB 3.83Å; I110-E126 HydrophobicContact CG2-CG 4.15Å; I110-E126 PolarHBondContact O-N 2.73Å; Y124-E126 HydrophobicContact CD1-CB 3.96Å; Y124-E126 HydrophobicContact CE1-CB 3.61Å; Y124-E126 HydrophobicContact CE1-CG 3.97Å; Y124-E126 PolarHBondContact O-N 2.93Å
127	K	91.2	Very high	79.6	Confident	121 Å²	121	51.9 Å²	51.9	53%	0.526	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	116.6	177.7	-173.8	-174.7	177.6	-170.5	0	110.2	A109 I110	A109-K127 CarbonylContact C-O 3.55Å; A109-K127 VanDerWaalsContact CA-O 3.28Å; A109-K127 WeakPolarHBondContact CA-O 3.37Å; I110-K127 HydrophobicContact CB-CB 4.05Å; I110-K127 HydrophobicContact CD1-CB 4.23Å; I110-K127 HydrophobicContact CD1-CD 4.42Å; I110-K127 HydrophobicContact CG1-CB 4.13Å; I110-K127 PolarHBondContact N-O 2.97Å; I110-K127 PolarHBondContact O-N 3.25Å; I110-K127 VanDerWaalsContact O-N 3.16Å
128	I	87.5	Confident	79.2	Confident	8 Å²	8	51.3 Å²	51.3	4%	0.041	27%	0.27	C	S	.	.			trans	-120.7	126.4	170.9	-55.5	-55.2	0	0	0	107.8	F70 A109 V111 F125 T130 S174	F70-I128 HydrophobicContact CD2-CD1 4.04Å; F70-I128 HydrophobicContact CE2-CD1 3.5Å; F70-I128 VanDerWaalsContact CE2-CD1 3.5Å; F70-I128 HydrophobicContact CE2-CG1 4.26Å; F70-I128 HydrophobicContact CE2-CG2 4.08Å; F70-I128 HydrophobicContact CZ-CD1 4.03Å; F70-I128 HydrophobicContact CZ-CG2 3.89Å; A109-I128 HydrophobicContact CB-CD1 3.79Å; V111-I128 HydrophobicContact CG2-CD1 3.91Å; F125-I128 HydrophobicContact CB-CD1 4.3Å; F125-I128 HydrophobicContact CB-CG1 3.92Å; F125-I128 HydrophobicContact CD1-CD1 3.88Å; F125-I128 HydrophobicContact CD1-CG1 4.18Å; F125-I128 HydrophobicContact CG-CG1 4.39Å; I128-T130 PolarHBondContact O-N 3.16Å; I128-S174 PolarHBondContact N-OG 3.18Å; I128-S174 PolarHBondContact O-OG 2.81Å
129	P	80.1	Confident	79.2	Confident	16 Å²	16	46.4 Å²	46.4	10%	0.104	24%	0.243	C	C	.	.			trans	-57.4	136.8	174.6	-25.6	36.2	0	0	0	112.1	I97 E107 E131 F132	I97-P129 HydrophobicContact CD1-CB 4.49Å; I97-P129 HydrophobicContact CD1-CG 3.79Å; E107-P129 HydrophobicContact CB-CG 4.02Å; E107-P129 WeakPolarHBondContact OE2-CB 3.35Å; E107-P129 WeakPolarHBondContact OE2-CG 3.33Å; P129-E131 VanDerWaalsContact C-N 3.3Å; P129-E131 PolarHBondContact O-N 3.05Å; P129-F132 PolarHBondContact O-N 3.48Å
130	T	64.1	Low	79.2	Confident	134 Å²	134	45.3 Å²	45.3	82%	0.822	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-66.7	-27.3	-168.3	29.7	0	0	0	0	114.1	I128 F132 G133	I128-T130 PolarHBondContact O-N 3.16Å; T130-F132 VanDerWaalsContact C-N 3.3Å; T130-F132 PolarHBondContact O-N 3.39Å; T130-G133 PolarHBondContact O-N 3.32Å
131	E	59.7	Low	79.1	Confident	140 Å²	140	43.4 Å²	43.4	65%	0.654	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-73.1	-24	-176.8	-61.2	-169.2	175.3	0	0	112.6	P129	P129-E131 VanDerWaalsContact C-N 3.3Å; P129-E131 PolarHBondContact O-N 3.05Å
132	F	57.4	Low	78.8	Confident	22 Å²	22	42.5 Å²	42.5	10%	0.096	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-90.6	-1.9	176.3	-74.6	-79.6	0	0	0	114.5	I97 S98 L100 E107 P129 T130 N134 I135 G136	I97-F132 HydrophobicContact CD1-CD2 3.82Å; I97-F132 HydrophobicContact CD1-CE2 4.03Å; I97-F132 HydrophobicContact CD1-CG 4.43Å; S98-F132 WeakPolarHBondContact O-CZ 3.36Å; L100-F132 HydrophobicContact CD1-CE1 4.3Å; L100-F132 HydrophobicContact CD1-CZ 4.5Å; L100-F132 HydrophobicContact CD2-CE1 4.16Å; L100-F132 HydrophobicContact CG-CE1 3.79Å; L100-F132 HydrophobicContact CG-CZ 3.96Å; E107-F132 WeakPolarHBondContact OE2-CD2 3.32Å; E107-F132 WeakPolarHBondContact OE2-CE2 3.27Å; P129-F132 PolarHBondContact O-N 3.48Å; T130-F132 VanDerWaalsContact C-N 3.3Å; T130-F132 PolarHBondContact O-N 3.39Å; F132-N134 PolarHBondContact O-N 3.32Å; F132-I135 PolarHBondContact O-N 2.91Å; F132-G136 PolarHBondContact O-N 3.22Å; F132-G136 VanDerWaalsContact O-N 3.13Å
133	G	47.2	Very low	78.3	Confident	9 Å²	9	42.7 Å²	42.7	9%	0.093	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	6.6	-166.5	0	0	0	0	0	117.4	T130 R173	T130-G133 PolarHBondContact O-N 3.32Å; G133-R173 PolarHBondContact O-NH1 2.66Å; G133-R173 PolarHBondContact O-NH2 3.45Å
134	N	49.5	Very low	77.7	Confident	86 Å²	86	42.8 Å²	42.8	46%	0.46	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-139.4	-12.3	170.1	-78.8	-27	0	0	0	115.4	F132 R173	F132-N134 PolarHBondContact O-N 3.32Å; N134-R173 PolarHBondContact OD1-NH2 3.42Å
135	I	54.9	Low	77.1	Confident	140 Å²	140	44.3 Å²	44.3	72%	0.718	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.3	-23	-166.1	-43.2	176.3	0	0	0	112.6	F132	F132-I135 PolarHBondContact O-N 2.91Å
136	G	61.4	Low	76.4	Confident	12 Å²	12	45 Å²	45	12%	0.124	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-25.9	-174.4	0	0	0	0	0	115.4	N71 F132	N71-G136 WeakPolarHBondContact CB-O 3.44Å; N71-G136 PolarHBondContact ND2-O 3.31Å; F132-G136 PolarHBondContact O-N 3.22Å; F132-G136 VanDerWaalsContact O-N 3.13Å
137	G	73.4	Confident	75.7	Confident	5 Å²	5	45.6 Å²	45.6	5%	0.052	23%	0.228	C	C	.	.			trans	-78.3	130.3	-172.9	0	0	0	0	0	112.6	I172	G137-I172 VanDerWaalsContact C-CD1 3.48Å; G137-I172 WeakPolarHBondContact O-CD1 2.9Å
138	K	84.7	Confident	75.3	Confident	49 Å²	49	41.3 Å²	41.3	21%	0.213	22%	0.215	C	C	.	.			trans	-128.7	117.9	170.5	-175.2	178.7	-177.1	-175.7	0	110.3	E68 V69 F70 N71 T140	E68-K138 HydrophobicContact CG-CD 4.45Å; E68-K138 WeakPolarHBondContact OE2-CE 3.39Å; E68-K138 IonicContact OE2-NZ 2.98Å; E68-K138 PolarHBondContact OE2-NZ 3.37Å; V69-K138 CarbonylContact C-O 3.55Å; F70-K138 WeakPolarHBondContact CA-O 3.5Å; F70-K138 PolarHBondContact N-O 2.69Å; N71-K138 VanDerWaalsContact CG-CB 3.46Å; N71-K138 WeakPolarHBondContact OD1-CB 3.23Å; N71-K138 WeakPolarHBondContact OD1-CD 3.47Å; K138-T140 HydrophobicContact CD-CG2 4.4Å; K138-T140 HydrophobicContact CG-CG2 3.85Å
139	L	92.3	Very high	75.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.223	C	C	.	.			trans	-117.1	107.5	168.6	171.4	58.5	0	0	0	108.9	E68 I123 F125 T167 I172 V178 F180	E68-L139 CarbonylContact O-C 3.41Å; E68-L139 VanDerWaalsContact O-CA 3.29Å; E68-L139 WeakPolarHBondContact O-CA 3.01Å; I123-L139 HydrophobicContact CB-CD2 4.18Å; I123-L139 HydrophobicContact CD1-CD1 4.36Å; I123-L139 HydrophobicContact CG1-CD1 3.9Å; I123-L139 HydrophobicContact CG1-CD2 4.27Å; I123-L139 HydrophobicContact CG2-CD1 4.44Å; I123-L139 HydrophobicContact CG2-CD2 4.31Å; F125-L139 HydrophobicContact CE2-CD2 4.12Å; F125-L139 HydrophobicContact CZ-CB 4.19Å; F125-L139 HydrophobicContact CZ-CD2 3.83Å; L139-T167 HydrophobicContact CD2-CG2 4.27Å; L139-T167 VanDerWaalsContact CD2-OG1 3.28Å; L139-T167 WeakPolarHBondContact CD2-OG1 3.41Å; L139-T167 WeakPolarHBondContact CG-OG1 3.21Å; L139-T167 PolarHBondContact O-N 3.22Å; L139-I172 HydrophobicContact CB-CD1 3.94Å; L139-V178 HydrophobicContact CD2-CB 3.96Å; L139-V178 HydrophobicContact CD2-CG1 3.89Å; L139-V178 HydrophobicContact CD2-CG2 4.15Å; L139-F180 HydrophobicContact CD1-CE2 4.32Å; L139-F180 HydrophobicContact CD2-CE2 3.94Å; L139-F180 HydrophobicContact CD2-CZ 3.99Å; L139-F180 HydrophobicContact CG-CE2 4.27Å; L139-F180 HydrophobicContact CG-CZ 4.14Å
140	T	92.9	Very high	75.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	137.9	179.9	55.9	0	0	0	0	113.2	E68 K138 M164 I165 K166	E68-T140 PolarHBondContact N-O 3.05Å; E68-T140 PolarHBondContact O-N 2.92Å; E68-T140 PolarHBondContact OE2-OG1 3.25Å; K138-T140 HydrophobicContact CD-CG2 4.4Å; K138-T140 HydrophobicContact CG-CG2 3.85Å; T140-M164 HydrophobicContact CG2-CG 4.4Å; T140-M164 HydrophobicContact CG2-SD 4.18Å; T140-I165 CarbonylContact C-O 3.58Å; T140-I165 WeakPolarHBondContact CA-O 3.15Å; T140-K166 HydrophobicContact CG2-CB 4.07Å; T140-K166 HydrophobicContact CG2-CG 3.96Å
141	I	93.3	Very high	76.2	Confident	7 Å²	7	47.2 Å²	47.2	4%	0.036	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	122.1	165.2	-57.5	174.6	0	0	0	106.6	Y36 I67 I121 M164 I165 F180	Y36-I141 HydrophobicContact CE2-CG2 3.84Å; Y36-I141 WeakPolarHBondContact OH-CG2 3.37Å; I67-I141 HydrophobicContact CG1-CG1 4.35Å; I67-I141 HydrophobicContact CG1-CG2 4.46Å; I67-I141 HydrophobicContact CG2-CG1 4.33Å; I121-I141 HydrophobicContact CD1-CD1 3.96Å; I141-M164 WeakPolarHBondContact O-CA 2.95Å; I141-I165 HydrophobicContact CB-CB 4.27Å; I141-I165 HydrophobicContact CB-CD1 4.46Å; I141-I165 PolarHBondContact N-O 3.15Å; I141-I165 PolarHBondContact O-N 2.96Å; I141-F180 HydrophobicContact CD1-CB 4.34Å; I141-F180 HydrophobicContact CD1-CD1 3.98Å; I141-F180 HydrophobicContact CD1-CD2 3.77Å; I141-F180 HydrophobicContact CD1-CE1 4.21Å; I141-F180 HydrophobicContact CD1-CE2 3.98Å; I141-F180 HydrophobicContact CD1-CG 3.76Å; I141-F180 HydrophobicContact CD1-CZ 4.2Å
142	T	89.8	Confident	77.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	132.7	-170.5	-46.3	0	0	0	0	111.4	Y36 M64 K66 S161 S163 M164	Y36-T142 PolarHBondContact OH-N 2.83Å; Y36-T142 PolarHBondContact OH-O 2.9Å; M64-T142 HydrophobicContact CE-CG2 3.65Å; K66-T142 PolarHBondContact N-O 3.26Å; K66-T142 PolarHBondContact O-N 2.83Å; T142-S161 VanDerWaalsContact CG2-OG 3.22Å; T142-S161 WeakPolarHBondContact CG2-OG 3.48Å; T142-S163 WeakPolarHBondContact CA-O 3.28Å; T142-M164 HydrophobicContact CG2-CE 3.96Å
143	D	86	Confident	78.5	Confident	9 Å²	9	51.5 Å²	51.5	5%	0.048	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.4	164.6	-159	24.8	0	0	0	110.2	Y36 Y37 M64 K65 Y162 S163	Y36-D143 HydrophobicContact CE1-CB 4Å; Y37-D143 HydrophobicContact CD1-CB 4.49Å; Y37-D143 HydrophobicContact CD2-CB 3.79Å; Y37-D143 HydrophobicContact CE1-CB 4.28Å; Y37-D143 HydrophobicContact CE2-CB 3.56Å; Y37-D143 HydrophobicContact CG-CB 4.26Å; M64-D143 CarbonylContact O-C 3.43Å; M64-D143 VanDerWaalsContact O-CA 3.31Å; M64-D143 WeakPolarHBondContact O-CA 3.39Å; K65-D143 WeakPolarHBondContact CG-OD1 3.32Å; D143-Y162 HydrophobicContact CB-CE2 3.74Å; D143-Y162 VanDerWaalsContact CG-CZ 3.48Å; D143-Y162 PolarHBondContact O-N 2.86Å; D143-Y162 VanDerWaalsContact O-N 3.09Å; D143-Y162 PolarHBondContact OD1-OH 3.19Å; D143-Y162 WeakPolarHBondContact OD2-CE2 3.29Å; D143-Y162 VanDerWaalsContact OD2-CZ 3.23Å; D143-Y162 PolarHBondContact OD2-OH 2.93Å; D143-S163 PolarHBondContact N-O 2.81Å; D143-S163 PolarHBondContact O-N 3.04Å; D143-S163 VanDerWaalsContact O-N 3.12Å; D143-S163 VanDerWaalsContact O-O 3.13Å
144	G	85	Confident	80.2	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.6	-167.7	-165.1	0	0	0	0	0	112.8	A63 M64 T160	A63-G144 CarbonylContact C-O 3.48Å; A63-G144 VanDerWaalsContact CA-O 3.31Å; A63-G144 WeakPolarHBondContact CA-O 3.49Å; M64-G144 PolarHBondContact N-O 3.26Å; M64-G144 PolarHBondContact O-N 3.48Å; G144-T160 CarbonylContact C-O 3.5Å; G144-T160 WeakPolarHBondContact CA-O 3.44Å
145	Y	81.4	Confident	81.8	Confident	101 Å²	101	52.5 Å²	52.5	40%	0.396	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	152	168.1	63.6	-84	0	0	0	109.5	G62 Y147 T160 Y162	G62-Y145 CarbonylContact O-C 3.57Å; G62-Y145 VanDerWaalsContact O-CA 3.27Å; G62-Y145 WeakPolarHBondContact O-CA 3.2Å; Y145-Y147 HydrophobicContact CD2-CD1 4.05Å; Y145-Y147 AromaticContact CE2-CD1 3.7Å; Y145-Y147 HydrophobicContact CE2-CD1 3.7Å; Y145-Y147 HydrophobicContact CE2-CE1 4.01Å; Y145-T160 HydrophobicContact CD1-CG2 4.41Å; Y145-T160 HydrophobicContact CE1-CG2 3.6Å; Y145-T160 VanDerWaalsContact CZ-CB 3.49Å; Y145-T160 PolarHBondContact N-O 3.38Å; Y145-T160 PolarHBondContact O-N 3.15Å; Y145-Y162 HydrophobicContact CD1-CD1 4.41Å
146	D	79.4	Confident	83.1	Confident	15 Å²	15	49.8 Å²	49.8	8%	0.08	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	157	162.3	67.9	16.2	0	0	0	109.6	S61 G62 I157 I158 K159	S61-D146 CarbonylContact C-O 3.56Å; S61-D146 WeakPolarHBondContact CA-O 3.1Å; S61-D146 PolarHBondContact N-OD1 2.89Å; G62-D146 PolarHBondContact N-O 2.84Å; G62-D146 PolarHBondContact N-OD1 2.81Å; G62-D146 PolarHBondContact O-N 2.91Å; D146-I157 HydrophobicContact CB-CG2 3.73Å; D146-I158 CarbonylContact C-O 3.5Å; D146-I158 WeakPolarHBondContact CA-O 3.44Å; D146-K159 HydrophobicContact CB-CG 4.13Å
147	Y	79.1	Confident	83.9	Confident	82 Å²	82	52.2 Å²	52.2	32%	0.322	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	137.7	164.3	68.2	-82.8	0	0	0	111.1	Y145 T149 I157 I158	Y145-Y147 HydrophobicContact CD2-CD1 4.05Å; Y145-Y147 AromaticContact CE2-CD1 3.7Å; Y145-Y147 HydrophobicContact CE2-CD1 3.7Å; Y145-Y147 HydrophobicContact CE2-CE1 4.01Å; Y147-T149 HydrophobicContact CD2-CG2 4.03Å; Y147-T149 HydrophobicContact CE2-CG2 3.82Å; Y147-I157 WeakPolarHBondContact O-CA 3.43Å; Y147-I158 HydrophobicContact CD1-CB 4.08Å; Y147-I158 HydrophobicContact CD1-CG2 4.33Å; Y147-I158 HydrophobicContact CE1-CB 3.64Å; Y147-I158 HydrophobicContact CE1-CD1 4.2Å; Y147-I158 HydrophobicContact CE1-CG1 4.5Å; Y147-I158 HydrophobicContact CE1-CG2 3.6Å; Y147-I158 HydrophobicContact CE2-CB 4.31Å; Y147-I158 HydrophobicContact CE2-CD1 3.81Å; Y147-I158 HydrophobicContact CE2-CG1 4.46Å; Y147-I158 VanDerWaalsContact CZ-CD1 3.45Å; Y147-I158 PolarHBondContact N-O 2.8Å; Y147-I158 PolarHBondContact O-N 3.11Å; Y147-I158 WeakPolarHBondContact OH-CD1 3.09Å
148	A	82	Confident	84.3	Confident	31 Å²	31	53.9 Å²	53.9	26%	0.256	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	136.7	174.1	0	0	0	0	0	109.9	H60 S61 L155 Y156	H60-A148 HydrophobicContact CB-CB 3.67Å; S61-A148 PolarHBondContact OG-N 2.91Å; A148-L155 HydrophobicContact CB-CD1 3.7Å; A148-Y156 WeakPolarHBondContact CA-O 3.36Å
149	T	83.1	Confident	84.1	Confident	34 Å²	34	58 Å²	58	21%	0.209	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	172	177.5	169.3	0	0	0	0	108.3	Y147 Y156 I158	Y147-T149 HydrophobicContact CD2-CG2 4.03Å; Y147-T149 HydrophobicContact CE2-CG2 3.82Å; T149-Y156 HydrophobicContact CG2-CD1 3.82Å; T149-Y156 HydrophobicContact CG2-CD2 3.77Å; T149-Y156 HydrophobicContact CG2-CE1 3.31Å; T149-Y156 HydrophobicContact CG2-CE2 3.29Å; T149-Y156 HydrophobicContact CG2-CG 4.03Å; T149-Y156 WeakPolarHBondContact CG2-OH 3.35Å; T149-Y156 PolarHBondContact N-O 2.79Å; T149-Y156 WeakPolarHBondContact O-CD1 3.46Å; T149-Y156 PolarHBondContact O-N 2.69Å; T149-Y156 VanDerWaalsContact OG1-CE1 3.26Å; T149-Y156 WeakPolarHBondContact OG1-CE1 3.21Å; T149-Y156 PolarHBondContact OG1-OH 3.14Å; T149-I158 HydrophobicContact CG2-CD1 3.86Å; T149-I158 HydrophobicContact CG2-CG1 4.02Å
150	Y	83	Confident	83.5	Confident	176 Å²	176	59.8 Å²	59.8	69%	0.69	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	131.8	-173.4	-69.1	-92	0	0	0	111.6	G154 L155 Y156	Y150-G154 WeakPolarHBondContact CA-O 3.23Å; Y150-L155 HydrophobicContact CD1-CB 4.35Å; Y150-L155 HydrophobicContact CD1-CD1 4.42Å; Y150-L155 HydrophobicContact CD2-CD1 4.49Å; Y150-L155 HydrophobicContact CE1-CB 4Å; Y150-L155 HydrophobicContact CE1-CD1 3.91Å; Y150-L155 HydrophobicContact CE2-CD1 3.98Å; Y150-Y156 VanDerWaalsContact C-CD1 3.42Å; Y150-Y156 VanDerWaalsContact N-CE1 3.34Å; Y150-Y156 WeakPolarHBondContact O-CE1 3.48Å
151	N	84.2	Confident	82.9	Confident	73 Å²	73	62.2 Å²	62.2	39%	0.39	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	-175.2	170.6	71	-1.2	0	0	0	109.1	T153 G154 Y156	N151-T153 VanDerWaalsContact CG-OG1 3.26Å; N151-T153 PolarHBondContact ND2-OG1 2.79Å; N151-T153 VanDerWaalsContact ND2-OG1 3.1Å; N151-T153 PolarHBondContact O-N 3.36Å; N151-T153 VanDerWaalsContact O-N 3.08Å; N151-T153 WeakPolarHBondContact OD1-CA 3.42Å; N151-T153 PolarHBondContact OD1-N 2.94Å; N151-T153 PolarHBondContact OD1-OG1 2.85Å; N151-G154 PolarHBondContact N-O 2.82Å; N151-G154 PolarHBondContact O-N 3.31Å; N151-G154 VanDerWaalsContact O-N 3.1Å; N151-G154 PolarHBondContact OD1-N 3.46Å; N151-G154 VanDerWaalsContact OD1-N 3.11Å; N151-G154 PolarHBondContact OD1-O 2.91Å; N151-G154 VanDerWaalsContact OD1-O 3.05Å; N151-Y156 HydrophobicContact CB-CD1 3.69Å; N151-Y156 HydrophobicContact CB-CE1 3.83Å; N151-Y156 HydrophobicContact CB-CG 4.46Å; N151-Y156 VanDerWaalsContact N-CD1 3.3Å
152	S	82.4	Confident	82.2	Confident	128 Å²	128	67.4 Å²	67.4	90%	0.895	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-18.4	178.2	51.9	0	0	0	0	114.3
153	T	82.8	Confident	81.8	Confident	124 Å²	124	67.9 Å²	67.9	76%	0.761	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-2.3	-179.9	59.7	0	0	0	0	113.7	N151	N151-T153 VanDerWaalsContact CG-OG1 3.26Å; N151-T153 PolarHBondContact ND2-OG1 2.79Å; N151-T153 VanDerWaalsContact ND2-OG1 3.1Å; N151-T153 PolarHBondContact O-N 3.36Å; N151-T153 VanDerWaalsContact O-N 3.08Å; N151-T153 WeakPolarHBondContact OD1-CA 3.42Å; N151-T153 PolarHBondContact OD1-N 2.94Å; N151-T153 PolarHBondContact OD1-OG1 2.85Å
154	G	84.4	Confident	81.9	Confident	28 Å²	28	70.5 Å²	70.5	29%	0.289	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	118.3	-150.3	178.3	0	0	0	0	0	113.8	Y150 N151 Y156	Y150-G154 WeakPolarHBondContact CA-O 3.23Å; N151-G154 PolarHBondContact N-O 2.82Å; N151-G154 PolarHBondContact O-N 3.31Å; N151-G154 VanDerWaalsContact O-N 3.1Å; N151-G154 PolarHBondContact OD1-N 3.46Å; N151-G154 VanDerWaalsContact OD1-N 3.11Å; N151-G154 PolarHBondContact OD1-O 2.91Å; N151-G154 VanDerWaalsContact OD1-O 3.05Å; G154-Y156 PolarHBondContact O-N 2.63Å
155	L	81.2	Confident	82.1	Confident	88 Å²	88	71.6 Å²	71.6	46%	0.461	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	123.4	-179.1	-175.5	73.1	0	0	0	110.3	A148 Y150	A148-L155 HydrophobicContact CB-CD1 3.7Å; Y150-L155 HydrophobicContact CD1-CB 4.35Å; Y150-L155 HydrophobicContact CD1-CD1 4.42Å; Y150-L155 HydrophobicContact CD2-CD1 4.49Å; Y150-L155 HydrophobicContact CE1-CB 4Å; Y150-L155 HydrophobicContact CE1-CD1 3.91Å; Y150-L155 HydrophobicContact CE2-CD1 3.98Å
156	Y	82.4	Confident	82.6	Confident	83 Å²	83	72.1 Å²	72.1	33%	0.325	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.3	172.7	79.5	-80.5	0	0	0	110.8	A148 T149 Y150 N151 G154 I158	A148-Y156 WeakPolarHBondContact CA-O 3.36Å; T149-Y156 HydrophobicContact CG2-CD1 3.82Å; T149-Y156 HydrophobicContact CG2-CD2 3.77Å; T149-Y156 HydrophobicContact CG2-CE1 3.31Å; T149-Y156 HydrophobicContact CG2-CE2 3.29Å; T149-Y156 HydrophobicContact CG2-CG 4.03Å; T149-Y156 WeakPolarHBondContact CG2-OH 3.35Å; T149-Y156 PolarHBondContact N-O 2.79Å; T149-Y156 WeakPolarHBondContact O-CD1 3.46Å; T149-Y156 PolarHBondContact O-N 2.69Å; T149-Y156 VanDerWaalsContact OG1-CE1 3.26Å; T149-Y156 WeakPolarHBondContact OG1-CE1 3.21Å; T149-Y156 PolarHBondContact OG1-OH 3.14Å; Y150-Y156 VanDerWaalsContact C-CD1 3.42Å; Y150-Y156 VanDerWaalsContact N-CE1 3.34Å; Y150-Y156 WeakPolarHBondContact O-CE1 3.48Å; N151-Y156 HydrophobicContact CB-CD1 3.69Å; N151-Y156 HydrophobicContact CB-CE1 3.83Å; N151-Y156 HydrophobicContact CB-CG 4.46Å; N151-Y156 VanDerWaalsContact N-CD1 3.3Å; G154-Y156 PolarHBondContact O-N 2.63Å; Y156-I158 HydrophobicContact CD2-CG1 3.96Å; Y156-I158 HydrophobicContact CE2-CD1 3.56Å; Y156-I158 HydrophobicContact CE2-CG1 3.48Å; Y156-I158 VanDerWaalsContact CE2-CG1 3.48Å
157	I	79.7	Confident	83.1	Confident	63 Å²	63	71.7 Å²	71.7	32%	0.323	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.6	-176.3	-58.8	161.1	0	0	0	108.5	H60 D146 Y147 K159	H60-I157 WeakPolarHBondContact CE1-CD1 3.42Å; H60-I157 VanDerWaalsContact ND1-CD1 3.3Å; H60-I157 WeakPolarHBondContact ND1-CD1 3.43Å; D146-I157 HydrophobicContact CB-CG2 3.73Å; Y147-I157 WeakPolarHBondContact O-CA 3.43Å; I157-K159 HydrophobicContact CG2-CG 4.35Å
158	I	80.1	Confident	83.4	Confident	39 Å²	39	69.9 Å²	69.9	20%	0.2	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	130.8	169.6	-65.1	173.6	0	0	0	107.9	D146 Y147 T149 Y156	D146-I158 CarbonylContact C-O 3.5Å; D146-I158 WeakPolarHBondContact CA-O 3.44Å; Y147-I158 HydrophobicContact CD1-CB 4.08Å; Y147-I158 HydrophobicContact CD1-CG2 4.33Å; Y147-I158 HydrophobicContact CE1-CB 3.64Å; Y147-I158 HydrophobicContact CE1-CD1 4.2Å; Y147-I158 HydrophobicContact CE1-CG1 4.5Å; Y147-I158 HydrophobicContact CE1-CG2 3.6Å; Y147-I158 HydrophobicContact CE2-CB 4.31Å; Y147-I158 HydrophobicContact CE2-CD1 3.81Å; Y147-I158 HydrophobicContact CE2-CG1 4.46Å; Y147-I158 VanDerWaalsContact CZ-CD1 3.45Å; Y147-I158 PolarHBondContact N-O 2.8Å; Y147-I158 PolarHBondContact O-N 3.11Å; Y147-I158 WeakPolarHBondContact OH-CD1 3.09Å; T149-I158 HydrophobicContact CG2-CD1 3.86Å; T149-I158 HydrophobicContact CG2-CG1 4.02Å; Y156-I158 HydrophobicContact CD2-CG1 3.96Å; Y156-I158 HydrophobicContact CE2-CD1 3.56Å; Y156-I158 HydrophobicContact CE2-CG1 3.48Å; Y156-I158 VanDerWaalsContact CE2-CG1 3.48Å
159	K	80.7	Confident	83.5	Confident	137 Å²	137	71.6 Å²	71.6	60%	0.596	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	119.9	174.1	-62.7	176.7	-175	169.3	0	108.8	M64 D146 I157	M64-K159 HydrophobicContact CE-CB 4.48Å; M64-K159 HydrophobicContact SD-CD 4.31Å; D146-K159 HydrophobicContact CB-CG 4.13Å; I157-K159 HydrophobicContact CG2-CG 4.35Å
160	T	80.2	Confident	83.4	Confident	37 Å²	37	75 Å²	75	23%	0.227	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116	175.7	-57.5	0	0	0	0	108.5	G144 Y145	G144-T160 CarbonylContact C-O 3.5Å; G144-T160 WeakPolarHBondContact CA-O 3.44Å; Y145-T160 HydrophobicContact CD1-CG2 4.41Å; Y145-T160 HydrophobicContact CE1-CG2 3.6Å; Y145-T160 VanDerWaalsContact CZ-CB 3.49Å; Y145-T160 PolarHBondContact N-O 3.38Å; Y145-T160 PolarHBondContact O-N 3.15Å
161	S	80.6	Confident	83.3	Confident	50 Å²	50	68.5 Å²	68.5	35%	0.35	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.1	173.2	-51.4	0	0	0	0	108.3	M64 T142	M64-S161 VanDerWaalsContact CE-OG 3.3Å; M64-S161 WeakPolarHBondContact CE-OG 3.5Å; T142-S161 VanDerWaalsContact CG2-OG 3.22Å; T142-S161 WeakPolarHBondContact CG2-OG 3.48Å
162	Y	77.9	Confident	83.5	Confident	116 Å²	116	65.1 Å²	65.1	46%	0.455	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-15.4	171.5	52.4	-105.2	0	0	0	111.9	D143 Y145	D143-Y162 HydrophobicContact CB-CE2 3.74Å; D143-Y162 VanDerWaalsContact CG-CZ 3.48Å; D143-Y162 PolarHBondContact O-N 2.86Å; D143-Y162 VanDerWaalsContact O-N 3.09Å; D143-Y162 PolarHBondContact OD1-OH 3.19Å; D143-Y162 WeakPolarHBondContact OD2-CE2 3.29Å; D143-Y162 VanDerWaalsContact OD2-CZ 3.23Å; D143-Y162 PolarHBondContact OD2-OH 2.93Å; Y145-Y162 HydrophobicContact CD1-CD1 4.41Å
163	S	83	Confident	83.7	Confident	10 Å²	10	63.8 Å²	63.8	7%	0.07	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	132.2	168.9	-159.6	0	0	0	0	111.1	Y37 T142 D143	Y37-S163 VanDerWaalsContact OH-CB 3.28Å; Y37-S163 WeakPolarHBondContact OH-CB 3.37Å; Y37-S163 PolarHBondContact OH-OG 3.5Å; T142-S163 WeakPolarHBondContact CA-O 3.28Å; D143-S163 PolarHBondContact N-O 2.81Å; D143-S163 PolarHBondContact O-N 3.04Å; D143-S163 VanDerWaalsContact O-N 3.12Å; D143-S163 VanDerWaalsContact O-O 3.13Å
164	M	87	Confident	84.1	Confident	64 Å²	64	60.8 Å²	60.8	32%	0.315	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	126.6	177.5	-172.7	-179.9	-63.1	0	0	110.1	T140 I141 T142	T140-M164 HydrophobicContact CG2-CG 4.4Å; T140-M164 HydrophobicContact CG2-SD 4.18Å; I141-M164 WeakPolarHBondContact O-CA 2.95Å; T142-M164 HydrophobicContact CG2-CE 3.96Å
165	I	89.5	Confident	84.4	Confident	25 Å²	25	61.4 Å²	61.4	13%	0.128	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	116.6	167.2	-56.5	169.1	0	0	0	106.1	T140 I141 F180 F368	T140-I165 CarbonylContact C-O 3.58Å; T140-I165 WeakPolarHBondContact CA-O 3.15Å; I141-I165 HydrophobicContact CB-CB 4.27Å; I141-I165 HydrophobicContact CB-CD1 4.46Å; I141-I165 PolarHBondContact N-O 3.15Å; I141-I165 PolarHBondContact O-N 2.96Å; I165-F180 HydrophobicContact CG2-CD1 4.12Å; I165-F180 HydrophobicContact CG2-CE1 3.59Å; I165-F368 HydrophobicContact CD1-CD2 3.81Å; I165-F368 HydrophobicContact CD1-CE2 3.95Å; I165-F368 HydrophobicContact CD1-CG 4.35Å; I165-F368 HydrophobicContact CG1-CD2 4.06Å; I165-F368 HydrophobicContact CG1-CE2 4.32Å
166	K	91.1	Very high	84.9	Confident	111 Å²	111	58.3 Å²	58.3	48%	0.483	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.1	175.9	-174.8	176.2	179.4	-175.1	0	109.5	T140 E169	T140-K166 HydrophobicContact CG2-CB 4.07Å; T140-K166 HydrophobicContact CG2-CG 3.96Å; K166-E169 WeakPolarHBondContact CE-OE1 3.22Å; K166-E169 IonicContact NZ-OE1 3.86Å; K166-E169 PolarHBondContact NZ-OE1 2.96Å
167	T	90.2	Very high	85.4	Confident	7 Å²	7	55.4 Å²	55.4	4%	0.043	29%	0.286	C	S	.	.			trans	-79.1	138	172.4	-55.3	0	0	0	0	109.5	L139 E169 M171 V178	L139-T167 HydrophobicContact CD2-CG2 4.27Å; L139-T167 VanDerWaalsContact CD2-OG1 3.28Å; L139-T167 WeakPolarHBondContact CD2-OG1 3.41Å; L139-T167 WeakPolarHBondContact CG-OG1 3.21Å; L139-T167 PolarHBondContact O-N 3.22Å; T167-E169 PolarHBondContact O-N 3.02Å; T167-M171 HydrophobicContact CG2-CB 4.22Å; T167-M171 HydrophobicContact CG2-SD 4.5Å; T167-V178 HydrophobicContact CG2-CG1 4.34Å; T167-V178 HydrophobicContact CG2-CG2 4.26Å
168	P	86.5	Confident	86.1	Confident	44 Å²	44	52.4 Å²	52.4	29%	0.286	27%	0.271	S	S	.	.			trans	-56.5	128.8	172.8	-24.2	33.9	0	0	0	111.3	I170 M171	P168-I170 HydrophobicContact CB-CG1 3.98Å; P168-I170 PolarHBondContact O-N 3.17Å; P168-I170 VanDerWaalsContact O-N 3.17Å; P168-M171 HydrophobicContact CB-CE 4.38Å; P168-M171 HydrophobicContact CB-CG 4.26Å; P168-M171 HydrophobicContact CB-SD 4.31Å; P168-M171 HydrophobicContact CG-CE 4.07Å; P168-M171 HydrophobicContact CG-SD 4.08Å; P168-M171 WeakPolarHBondContact O-CB 3.46Å; P168-M171 PolarHBondContact O-N 2.74Å
169	E	83.3	Confident	86.8	Confident	66 Å²	66	53.1 Å²	53.1	31%	0.308	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-60.2	-32.9	-173.4	-64.1	173.7	-165.4	0	0	111.9	K166 T167 M171 I172	K166-E169 WeakPolarHBondContact CE-OE1 3.22Å; K166-E169 IonicContact NZ-OE1 3.86Å; K166-E169 PolarHBondContact NZ-OE1 2.96Å; T167-E169 PolarHBondContact O-N 3.02Å; E169-M171 PolarHBondContact O-N 3.21Å; E169-I172 WeakPolarHBondContact O-CB 3.45Å; E169-I172 PolarHBondContact O-N 3.13Å
170	I	81.4	Confident	87.5	Confident	106 Å²	106	47.3 Å²	47.3	54%	0.544	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-57.8	-19.9	175.4	62.4	164.5	0	0	0	114.4	P168 R173	P168-I170 HydrophobicContact CB-CG1 3.98Å; P168-I170 PolarHBondContact O-N 3.17Å; P168-I170 VanDerWaalsContact O-N 3.17Å; I170-R173 PolarHBondContact O-NE 2.68Å
171	M	80.5	Confident	88	Confident	40 Å²	40	49.4 Å²	49.4	20%	0.197	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-88.7	-17.1	179.3	-61.6	-176.9	179.4	0	0	112.4	T167 P168 E169 R173 T176 Y370 T372	T167-M171 HydrophobicContact CG2-CB 4.22Å; T167-M171 HydrophobicContact CG2-SD 4.5Å; P168-M171 HydrophobicContact CB-CE 4.38Å; P168-M171 HydrophobicContact CB-CG 4.26Å; P168-M171 HydrophobicContact CB-SD 4.31Å; P168-M171 HydrophobicContact CG-CE 4.07Å; P168-M171 HydrophobicContact CG-SD 4.08Å; P168-M171 WeakPolarHBondContact O-CB 3.46Å; P168-M171 PolarHBondContact O-N 2.74Å; E169-M171 PolarHBondContact O-N 3.21Å; M171-R173 PolarHBondContact O-N 3.02Å; M171-T176 WeakPolarHBondContact O-CB 3.24Å; M171-T176 VanDerWaalsContact O-CG2 3.3Å; M171-T176 WeakPolarHBondContact O-CG2 3.47Å; M171-T176 PolarHBondContact O-OG1 2.85Å; M171-Y370 HydrophobicContact CE-CE2 3.84Å; M171-Y370 HydrophobicContact SD-CE2 4Å; M171-T372 HydrophobicContact SD-CG2 3.75Å
172	I	87.6	Confident	88.3	Confident	2 Å²	2	50 Å²	50	1%	0.01	26%	0.264	C	S	.	.			trans	-82.7	89.1	-177	-57.9	174.4	0	0	0	108.6	F70 F125 G137 L139 E169	F70-I172 HydrophobicContact CD2-CG2 4.07Å; F70-I172 HydrophobicContact CE2-CG2 3.55Å; F125-I172 HydrophobicContact CD1-CG2 3.99Å; F125-I172 HydrophobicContact CE1-CG2 3.65Å; F125-I172 HydrophobicContact CE2-CG1 4.29Å; F125-I172 HydrophobicContact CE2-CG2 4.32Å; F125-I172 HydrophobicContact CG-CG2 4.45Å; F125-I172 HydrophobicContact CZ-CB 4.36Å; F125-I172 HydrophobicContact CZ-CG1 4.01Å; F125-I172 HydrophobicContact CZ-CG2 3.82Å; G137-I172 VanDerWaalsContact C-CD1 3.48Å; G137-I172 WeakPolarHBondContact O-CD1 2.9Å; L139-I172 HydrophobicContact CB-CD1 3.94Å; E169-I172 WeakPolarHBondContact O-CB 3.45Å; E169-I172 PolarHBondContact O-N 3.13Å
173	R	87.1	Confident	88.6	Confident	99 Å²	99	46.4 Å²	46.4	37%	0.374	25%	0.252	S	S	.	.			trans	-144.4	158.9	-177.8	-59.3	-177.5	-170.4	-90.4	-6.7	110.7	F125 G133 N134 I170 M171 G175 T176	F125-R173 WeakPolarHBondContact CB-O 3.13Å; G133-R173 PolarHBondContact O-NH1 2.66Å; G133-R173 PolarHBondContact O-NH2 3.45Å; N134-R173 PolarHBondContact OD1-NH2 3.42Å; I170-R173 PolarHBondContact O-NE 2.68Å; M171-R173 PolarHBondContact O-N 3.02Å; R173-G175 PolarHBondContact O-N 2.82Å; R173-T176 WeakPolarHBondContact O-CB 3.29Å; R173-T176 PolarHBondContact O-N 2.85Å; R173-T176 VanDerWaalsContact O-N 3.16Å; R173-T176 PolarHBondContact O-OG1 3Å
174	S	90.8	Very high	88.6	Confident	62 Å²	62	52.3 Å²	52.3	43%	0.434	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	135.8	172.9	-59	0	0	0	0	112	F125 I128 T176	F125-S174 CarbonylContact O-C 3.51Å; F125-S174 WeakPolarHBondContact O-CA 3.42Å; I128-S174 PolarHBondContact N-OG 3.18Å; I128-S174 PolarHBondContact O-OG 2.81Å; S174-T176 VanDerWaalsContact C-N 3.3Å; S174-T176 PolarHBondContact O-N 3.18Å
175	G	90.9	Very high	88.5	Confident	41 Å²	41	51 Å²	51	42%	0.423	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	1.7	-178.8	0	0	0	0	0	115.3	F125 R173	F125-G175 PolarHBondContact O-N 3Å; R173-G175 PolarHBondContact O-N 2.82Å
176	T	91.3	Very high	88.5	Confident	22 Å²	22	49.8 Å²	49.8	14%	0.135	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	136.6	179.3	-55.9	0	0	0	0	112	Y124 F125 M171 R173 S174 V178	Y124-T176 WeakPolarHBondContact CD2-O 3.36Å; F125-T176 PolarHBondContact N-O 2.79Å; M171-T176 WeakPolarHBondContact O-CB 3.24Å; M171-T176 VanDerWaalsContact O-CG2 3.3Å; M171-T176 WeakPolarHBondContact O-CG2 3.47Å; M171-T176 PolarHBondContact O-OG1 2.85Å; R173-T176 WeakPolarHBondContact O-CB 3.29Å; R173-T176 PolarHBondContact O-N 2.85Å; R173-T176 VanDerWaalsContact O-N 3.16Å; R173-T176 PolarHBondContact O-OG1 3Å; S174-T176 VanDerWaalsContact C-N 3.3Å; S174-T176 PolarHBondContact O-N 3.18Å; T176-V178 HydrophobicContact CG2-CG2 4.22Å
177	L	94.7	Very high	88.4	Confident	22 Å²	22	45.4 Å²	45.4	12%	0.115	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128	166.9	-179.3	67.4	0	0	0	109.5	I123 Y124 E179	I123-L177 WeakPolarHBondContact O-CA 3.31Å; Y124-L177 HydrophobicContact CD2-CB 4.36Å; L177-E179 HydrophobicContact CD2-CG 4.11Å; L177-E179 HydrophobicContact CG-CG 4.03Å
178	V	94.1	Very high	88.4	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.4	172.7	-179.2	0	0	0	0	108.6	S122 I123 F125 L139 T167 T176 F180	S122-V178 WeakPolarHBondContact CA-O 3.41Å; I123-V178 PolarHBondContact N-O 2.82Å; I123-V178 PolarHBondContact O-N 2.9Å; F125-V178 HydrophobicContact CE2-CG2 3.85Å; L139-V178 HydrophobicContact CD2-CB 3.96Å; L139-V178 HydrophobicContact CD2-CG1 3.89Å; L139-V178 HydrophobicContact CD2-CG2 4.15Å; T167-V178 HydrophobicContact CG2-CG1 4.34Å; T167-V178 HydrophobicContact CG2-CG2 4.26Å; T176-V178 HydrophobicContact CG2-CG2 4.22Å; V178-F180 HydrophobicContact CG1-CD2 4.46Å; V178-F180 HydrophobicContact CG1-CE1 4.46Å; V178-F180 HydrophobicContact CG1-CE2 3.81Å; V178-F180 HydrophobicContact CG1-CZ 3.81Å
179	E	95.2	Very high	88.7	Confident	53 Å²	53	48.8 Å²	48.8	25%	0.248	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	126.5	-179.9	-60.3	-169.6	112.2	0	0	111.1	L177	L177-E179 HydrophobicContact CD2-CG 4.11Å; L177-E179 HydrophobicContact CG-CG 4.03Å
180	F	93.6	Very high	89.2	Confident	16 Å²	16	54.1 Å²	54.1	7%	0.07	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.5	170.8	-59.4	-81.8	0	0	0	109.2	N120 I121 I123 L139 I141 I165 V178	N120-F180 WeakPolarHBondContact CA-O 3.18Å; I121-F180 HydrophobicContact CB-CB 4.23Å; I121-F180 HydrophobicContact CB-CD2 4.34Å; I121-F180 PolarHBondContact N-O 2.7Å; I121-F180 PolarHBondContact O-N 3.19Å; I123-F180 HydrophobicContact CD1-CD2 3.5Å; I123-F180 VanDerWaalsContact CD1-CD2 3.5Å; I123-F180 HydrophobicContact CD1-CE2 3.39Å; I123-F180 HydrophobicContact CG1-CE2 4.47Å; L139-F180 HydrophobicContact CD1-CE2 4.32Å; L139-F180 HydrophobicContact CD2-CE2 3.94Å; L139-F180 HydrophobicContact CD2-CZ 3.99Å; L139-F180 HydrophobicContact CG-CE2 4.27Å; L139-F180 HydrophobicContact CG-CZ 4.14Å; I141-F180 HydrophobicContact CD1-CB 4.34Å; I141-F180 HydrophobicContact CD1-CD1 3.98Å; I141-F180 HydrophobicContact CD1-CD2 3.77Å; I141-F180 HydrophobicContact CD1-CE1 4.21Å; I141-F180 HydrophobicContact CD1-CE2 3.98Å; I141-F180 HydrophobicContact CD1-CG 3.76Å; I141-F180 HydrophobicContact CD1-CZ 4.2Å; I165-F180 HydrophobicContact CG2-CD1 4.12Å; I165-F180 HydrophobicContact CG2-CE1 3.59Å; V178-F180 HydrophobicContact CG1-CD2 4.46Å; V178-F180 HydrophobicContact CG1-CE1 4.46Å; V178-F180 HydrophobicContact CG1-CE2 3.81Å; V178-F180 HydrophobicContact CG1-CZ 3.81Å
181	T	91.2	Very high	89.8	Confident	81 Å²	81	54.3 Å²	54.3	50%	0.497	28%	0.283	S	S	.	.			trans	-108	130.4	171.8	-56.2	0	0	0	0	108.2
182	P	88	Confident	90.5	Very high	61 Å²	61	53.4 Å²	53.4	40%	0.396	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-66.7	139.5	178.9	28.1	-33.1	0	0	0	110.6	N120	N120-P182 WeakPolarHBondContact OD1-CD 3.25Å
183	N	83.1	Confident	90.8	Very high	41 Å²	41	59.3 Å²	59.3	22%	0.219	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-68.6	161.4	167.5	-79.7	-7.8	0	0	0	109.7	I185 E203 F368	N183-I185 PolarHBondContact O-N 2.82Å; N183-E203 PolarHBondContact ND2-OE2 3.04Å; N183-F368 HydrophobicContact CB-CD1 4.35Å; N183-F368 HydrophobicContact CB-CE1 3.5Å; N183-F368 VanDerWaalsContact CB-CE1 3.5Å; N183-F368 HydrophobicContact CB-CZ 4.13Å; N183-F368 VanDerWaalsContact CG-CD1 3.45Å; N183-F368 WeakPolarHBondContact ND2-CE1 3.36Å; N183-F368 VanDerWaalsContact ND2-CZ 3.34Å; N183-F368 WeakPolarHBondContact ND2-CZ 3.21Å; N183-F368 VanDerWaalsContact OD1-CD1 3.29Å; N183-F368 WeakPolarHBondContact OD1-CD1 3.36Å; N183-F368 VanDerWaalsContact OD1-CE1 3.29Å; N183-F368 WeakPolarHBondContact OD1-CE1 3.42Å
184	K	84.3	Confident	91.2	Very high	135 Å²	135	57.1 Å²	57.1	59%	0.587	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-59.8	123.5	167.4	-67	-178.5	-179.6	178.5	0	108.9	C186 A198	K184-C186 PolarHBondContact O-N 2.79Å; K184-A198 HydrophobicContact CB-CB 4.02Å; K184-A198 HydrophobicContact CD-CB 4.15Å
185	I	83.9	Confident	91.4	Very high	36 Å²	36	54.2 Å²	54.2	19%	0.185	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-83.1	119.6	-178.1	-56.8	173.4	0	0	0	108.4	N183 S187 E188 Q189	N183-I185 PolarHBondContact O-N 2.82Å; I185-S187 VanDerWaalsContact C-N 3.33Å; I185-S187 WeakPolarHBondContact CG2-OG 3.19Å; I185-S187 PolarHBondContact O-N 3.35Å; I185-E188 HydrophobicContact CB-CB 4.3Å; I185-E188 HydrophobicContact CB-CG 3.88Å; I185-E188 HydrophobicContact CD1-CG 4.44Å; I185-E188 HydrophobicContact CG2-CG 3.95Å; I185-E188 PolarHBondContact O-N 2.99Å; I185-E188 VanDerWaalsContact O-N 3.15Å; I185-Q189 PolarHBondContact O-NE2 3.28Å
186	C	89.9	Confident	91.5	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-56.8	-46.9	-179.9	-56.5	0	0	0	0	111.4	K184 E188 Q189 C205 C214 H216	K184-C186 PolarHBondContact O-N 2.79Å; C186-E188 PolarHBondContact O-N 2.91Å; C186-Q189 WeakPolarHBondContact O-CB 3.38Å; C186-Q189 WeakPolarHBondContact O-CG 3.2Å; C186-Q189 PolarHBondContact O-N 2.85Å; C186-C205 VanDerWaalsContact CA-SG 3.53Å; C186-C205 HydrophobicContact CB-CB 3.73Å; C186-C205 WeakPolarHBondContact CB-SG 3.33Å; C186-C205 WeakPolarHBondContact SG-CA 3.29Å; C186-C205 WeakPolarHBondContact SG-CB 3.34Å; C186-C205 CovalentContact SG-SG 2.03Å; C186-C205 PolarHBondContact SG-SG 3.35Å; C186-C214 WeakPolarHBondContact O-CB 3.29Å; C186-C214 PolarHBondContact O-SG 2.96Å; C186-H216 HydrophobicContact CB-CB 4.49Å
187	S	89.9	Confident	91.5	Very high	18 Å²	18	58.5 Å²	58.5	13%	0.126	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-63.4	-13.2	-179	58.9	0	0	0	0	115	I185 C214	I185-S187 VanDerWaalsContact C-N 3.33Å; I185-S187 WeakPolarHBondContact CG2-OG 3.19Å; I185-S187 PolarHBondContact O-N 3.35Å; S187-C214 WeakPolarHBondContact CA-O 3.03Å
188	E	89	Confident	91.4	Very high	77 Å²	77	57.8 Å²	57.8	36%	0.36	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-85.5	-15	173.4	-65.5	-166.2	157.4	0	0	113.1	K35 I185 C186 K190	K35-E188 WeakPolarHBondContact CD-OE1 3.26Å; K35-E188 WeakPolarHBondContact CE-OE1 3.31Å; K35-E188 IonicContact NZ-OE1 2.66Å; K35-E188 PolarHBondContact NZ-OE1 3.44Å; K35-E188 IonicContact NZ-OE2 2.77Å; K35-E188 PolarHBondContact NZ-OE2 3.36Å; I185-E188 HydrophobicContact CB-CB 4.3Å; I185-E188 HydrophobicContact CB-CG 3.88Å; I185-E188 HydrophobicContact CD1-CG 4.44Å; I185-E188 HydrophobicContact CG2-CG 3.95Å; I185-E188 PolarHBondContact O-N 2.99Å; I185-E188 VanDerWaalsContact O-N 3.15Å; C186-E188 PolarHBondContact O-N 2.91Å; E188-K190 PolarHBondContact O-N 2.82Å
189	Q	92.9	Very high	91.2	Very high	45 Å²	45	59.4 Å²	59.4	21%	0.21	31%	0.306	C	S	.	.			trans	-77.8	123.5	-179.8	-49.5	-49.8	-50.9	0	0	110.4	I185 C186 C195 A198 C214	I185-Q189 PolarHBondContact O-NE2 3.28Å; C186-Q189 WeakPolarHBondContact O-CB 3.38Å; C186-Q189 WeakPolarHBondContact O-CG 3.2Å; C186-Q189 PolarHBondContact O-N 2.85Å; Q189-C195 HydrophobicContact CB-CB 4.07Å; Q189-A198 HydrophobicContact CG-CB 3.62Å; Q189-C214 HydrophobicContact CB-CB 3.91Å; Q189-C214 WeakPolarHBondContact O-CB 3.34Å
190	K	93.4	Very high	90.7	Very high	179 Å²	179	59.1 Å²	59.1	78%	0.778	31%	0.31	S	S	*	.			trans	-95.5	-17	-174.2	-63.4	-174.5	-179	-179.9	0	114.1	E188 W207	E188-K190 PolarHBondContact O-N 2.82Å; K190-W207 VanDerWaalsContact O-CH2 3.29Å; K190-W207 WeakPolarHBondContact O-CH2 3.36Å
191	L	94.6	Very high	90.1	Very high	110 Å²	110	66 Å²	66	58%	0.576	35%	0.347	S	S	*	.	S	Bend	trans	-121	146.8	-177.8	-57.8	173.4	0	0	0	109.4	E193 T194 C195	L191-E193 VanDerWaalsContact C-N 3.3Å; L191-E193 PolarHBondContact O-N 3.03Å; L191-T194 HydrophobicContact CB-CG2 4.29Å; L191-T194 WeakPolarHBondContact CB-OG1 3.36Å; L191-T194 PolarHBondContact N-OG1 3.48Å; L191-T194 PolarHBondContact O-N 3.1Å; L191-T194 PolarHBondContact O-OG1 3.23Å; L191-C195 WeakPolarHBondContact O-CB 3.42Å; L191-C195 PolarHBondContact O-N 3.34Å
192	C	95.2	Very high	89.4	Confident	20 Å²	20	66 Å²	66	14%	0.135	34%	0.343	C	S	.	.	H	α-helix	trans	-53.4	-48.3	179.1	-177.3	0	0	0	0	111.4	T194 C195 I196 W207 C238	C192-T194 PolarHBondContact O-N 2.77Å; C192-C195 WeakPolarHBondContact O-CA 3.08Å; C192-C195 WeakPolarHBondContact O-CB 3.47Å; C192-C195 PolarHBondContact O-N 2.96Å; C192-C195 VanDerWaalsContact O-N 3.08Å; C192-I196 WeakPolarHBondContact O-CG1 3.05Å; C192-I196 PolarHBondContact O-N 2.86Å; C192-W207 HydrophobicContact CB-CB 4.37Å; C192-W207 HydrophobicContact CB-CD2 3.78Å; C192-W207 HydrophobicContact CB-CE3 4.44Å; C192-W207 HydrophobicContact CB-CG 3.72Å; C192-W207 HydrophobicContact CB-CZ2 4.39Å; C192-W207 VanDerWaalsContact SG-CD1 3.53Å; C192-W207 VanDerWaalsContact SG-CG 3.56Å; C192-C238 HydrophobicContact CB-CB 3.69Å; C192-C238 WeakPolarHBondContact CB-SG 3.09Å; C192-C238 PolarHBondContact O-SG 3.06Å; C192-C238 VanDerWaalsContact O-SG 3.34Å; C192-C238 WeakPolarHBondContact SG-CA 3.02Å; C192-C238 WeakPolarHBondContact SG-CB 3.46Å; C192-C238 CovalentContact SG-SG 2.03Å; C192-C238 PolarHBondContact SG-SG 2.01Å
193	E	94.2	Very high	89	Confident	126 Å²	126	64.7 Å²	64.7	59%	0.589	33%	0.332	S	S	*	.	H	α-helix	trans	-61.9	-46.7	-178.3	-64.5	177.4	172	0	0	111.8	L191 C195 I196 N197 C238	L191-E193 VanDerWaalsContact C-N 3.3Å; L191-E193 PolarHBondContact O-N 3.03Å; E193-C195 PolarHBondContact O-N 3.06Å; E193-I196 PolarHBondContact O-N 3.32Å; E193-N197 VanDerWaalsContact O-CB 3.31Å; E193-N197 WeakPolarHBondContact O-CB 3.48Å; E193-N197 PolarHBondContact O-N 2.8Å; E193-N197 PolarHBondContact O-ND2 3.08Å; E193-C238 HydrophobicContact CG-CB 3.99Å; E193-C238 PolarHBondContact N-SG 3.06Å; E193-C238 VanDerWaalsContact N-SG 3.37Å
194	T	94.6	Very high	89.2	Confident	54 Å²	54	67.9 Å²	67.9	33%	0.331	34%	0.344	S	S	.	.	H	α-helix	trans	-62.5	-31.9	176.2	59	0	0	0	0	112.3	L191 C192 A198	L191-T194 HydrophobicContact CB-CG2 4.29Å; L191-T194 WeakPolarHBondContact CB-OG1 3.36Å; L191-T194 PolarHBondContact N-OG1 3.48Å; L191-T194 PolarHBondContact O-N 3.1Å; L191-T194 PolarHBondContact O-OG1 3.23Å; C192-T194 PolarHBondContact O-N 2.77Å; T194-A198 WeakPolarHBondContact O-CB 3.29Å; T194-A198 PolarHBondContact O-N 3.31Å
195	C	94.9	Very high	89.6	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.2	-53.1	175.5	179.1	0	0	0	0	111.5	Q189 L191 C192 E193 N197 A198 C205 Y206 W207 C214	Q189-C195 HydrophobicContact CB-CB 4.07Å; L191-C195 WeakPolarHBondContact O-CB 3.42Å; L191-C195 PolarHBondContact O-N 3.34Å; C192-C195 WeakPolarHBondContact O-CA 3.08Å; C192-C195 WeakPolarHBondContact O-CB 3.47Å; C192-C195 PolarHBondContact O-N 2.96Å; C192-C195 VanDerWaalsContact O-N 3.08Å; E193-C195 PolarHBondContact O-N 3.06Å; C195-N197 VanDerWaalsContact C-N 3.3Å; C195-N197 PolarHBondContact O-N 2.72Å; C195-A198 WeakPolarHBondContact O-CB 3.19Å; C195-A198 PolarHBondContact O-N 2.82Å; C195-A198 VanDerWaalsContact O-N 3.1Å; C195-C205 WeakPolarHBondContact O-CB 3.22Å; C195-Y206 PolarHBondContact SG-O 2.83Å; C195-Y206 VanDerWaalsContact SG-O 3.38Å; C195-W207 HydrophobicContact CB-CE3 3.71Å; C195-W207 HydrophobicContact CB-CZ3 4.34Å; C195-C214 WeakPolarHBondContact CA-SG 3.44Å; C195-C214 HydrophobicContact CB-CB 3.47Å; C195-C214 VanDerWaalsContact CB-CB 3.47Å; C195-C214 WeakPolarHBondContact CB-SG 3.42Å; C195-C214 WeakPolarHBondContact SG-CA 3.41Å; C195-C214 WeakPolarHBondContact SG-CB 3.31Å; C195-C214 CovalentContact SG-SG 2.01Å; C195-C214 PolarHBondContact SG-SG 3.39Å
196	I	92.9	Very high	90.1	Very high	37 Å²	37	63.9 Å²	63.9	19%	0.19	32%	0.324	C	S	.	.	H	α-helix	trans	-65.1	-40.3	-177.6	-55.6	-44.9	0	0	0	110.2	C192 E193 A198 S199 W207 T236	C192-I196 WeakPolarHBondContact O-CG1 3.05Å; C192-I196 PolarHBondContact O-N 2.86Å; E193-I196 PolarHBondContact O-N 3.32Å; I196-A198 PolarHBondContact O-N 2.73Å; I196-S199 VanDerWaalsContact O-CB 3.23Å; I196-S199 WeakPolarHBondContact O-CB 3.43Å; I196-S199 PolarHBondContact O-N 2.75Å; I196-S199 VanDerWaalsContact O-N 3.12Å; I196-S199 PolarHBondContact O-OG 2.81Å; I196-S199 VanDerWaalsContact O-OG 3.06Å; I196-W207 HydrophobicContact CD1-CB 4.29Å; I196-T236 HydrophobicContact CD1-CG2 4.38Å
197	N	92.6	Very high	90.4	Very high	116 Å²	116	64.6 Å²	64.6	62%	0.62	33%	0.326	S	S	*	.	H	α-helix	trans	-70.2	-13.4	176.8	-66.7	-17.3	0	0	0	114.3	E193 C195 S199	E193-N197 VanDerWaalsContact O-CB 3.31Å; E193-N197 WeakPolarHBondContact O-CB 3.48Å; E193-N197 PolarHBondContact O-N 2.8Å; E193-N197 PolarHBondContact O-ND2 3.08Å; C195-N197 VanDerWaalsContact C-N 3.3Å; C195-N197 PolarHBondContact O-N 2.72Å; N197-S199 VanDerWaalsContact C-N 3.3Å
198	A	91.6	Very high	90.7	Very high	7 Å²	7	63.8 Å²	63.8	6%	0.058	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-14.8	172.6	0	0	0	0	0	112.7	K184 Q189 T194 C195 I196	K184-A198 HydrophobicContact CB-CB 4.02Å; K184-A198 HydrophobicContact CD-CB 4.15Å; Q189-A198 HydrophobicContact CG-CB 3.62Å; T194-A198 WeakPolarHBondContact O-CB 3.29Å; T194-A198 PolarHBondContact O-N 3.31Å; C195-A198 WeakPolarHBondContact O-CB 3.19Å; C195-A198 PolarHBondContact O-N 2.82Å; C195-A198 VanDerWaalsContact O-N 3.1Å; I196-A198 PolarHBondContact O-N 2.73Å
199	S	90	Very high	90.8	Very high	36 Å²	36	63.5 Å²	63.5	25%	0.252	33%	0.325	S	S	.	.			trans	-60.6	140.5	175	-59.8	0	0	0	0	111.6	I196 N197 E203 C205	I196-S199 VanDerWaalsContact O-CB 3.23Å; I196-S199 WeakPolarHBondContact O-CB 3.43Å; I196-S199 PolarHBondContact O-N 2.75Å; I196-S199 VanDerWaalsContact O-N 3.12Å; I196-S199 PolarHBondContact O-OG 2.81Å; I196-S199 VanDerWaalsContact O-OG 3.06Å; N197-S199 VanDerWaalsContact C-N 3.3Å; S199-E203 CarbonylContact C-O 3.47Å; S199-E203 WeakPolarHBondContact CA-O 3.48Å; S199-C205 PolarHBondContact OG-N 3.03Å; S199-C205 PolarHBondContact OG-O 3.35Å
200	S	86	Confident	90.8	Very high	46 Å²	46	65.5 Å²	65.5	32%	0.322	34%	0.336	S	S	.	.			trans	-114.2	-172.1	172.9	72.9	0	0	0	0	110.8	N202 E203 K204	S200-N202 VanDerWaalsContact C-N 3.29Å; S200-N202 PolarHBondContact OG-N 2.88Å; S200-E203 PolarHBondContact N-O 2.83Å; S200-E203 PolarHBondContact OG-N 3.48Å; S200-E203 VanDerWaalsContact OG-N 3.12Å; S200-K204 PolarHBondContact O-NZ 2.71Å
201	L	80.9	Confident	90.8	Very high	162 Å²	162	58.4 Å²	58.4	85%	0.848	31%	0.307	S	S	*	.	S	Bend	trans	-63.7	-38.8	174.7	-139.8	96.4	0	0	0	111.2
202	N	75	Confident	90.8	Very high	80 Å²	80	58.2 Å²	58.2	43%	0.428	31%	0.306	S	S	.	.	S	Bend	trans	-105.8	-9.7	-169.9	-60.9	-15	0	0	0	113.5	S200 T367	S200-N202 VanDerWaalsContact C-N 3.29Å; S200-N202 PolarHBondContact OG-N 2.88Å; N202-T367 PolarHBondContact ND2-O 3.12Å
203	E	79.4	Confident	90.8	Very high	34 Å²	34	62.1 Å²	62.1	16%	0.159	32%	0.321	C	S	.	.			trans	-138.7	116.6	-178.3	-167.1	164.2	-173.4	0	0	109.7	N183 S199 S200 H216	N183-E203 PolarHBondContact ND2-OE2 3.04Å; S199-E203 CarbonylContact C-O 3.47Å; S199-E203 WeakPolarHBondContact CA-O 3.48Å; S200-E203 PolarHBondContact N-O 2.83Å; S200-E203 PolarHBondContact OG-N 3.48Å; S200-E203 VanDerWaalsContact OG-N 3.12Å; E203-H216 IonicContact OE1-CD2 2.63Å; E203-H216 IonicContact OE1-NE2 3.31Å
204	K	89.2	Confident	90.8	Very high	107 Å²	107	56.1 Å²	56.1	47%	0.465	29%	0.293	S	S	.	.			trans	-101.6	125.9	-179.1	-64.3	-57.5	-175.2	-163.8	0	110.4	S200 Y206 H216	S200-K204 PolarHBondContact O-NZ 2.71Å; K204-Y206 HydrophobicContact CB-CE2 3.75Å; K204-Y206 WeakPolarHBondContact O-CE2 2.93Å; K204-H216 VanDerWaalsContact O-CB 3.25Å; K204-H216 WeakPolarHBondContact O-CB 3.18Å
205	C	92.1	Very high	90.7	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.014	28%	0.277	C	S	.	.			trans	-96.3	140.9	171	-59.3	0	0	0	0	109.8	C186 C195 S199	C186-C205 VanDerWaalsContact CA-SG 3.53Å; C186-C205 HydrophobicContact CB-CB 3.73Å; C186-C205 WeakPolarHBondContact CB-SG 3.33Å; C186-C205 WeakPolarHBondContact SG-CA 3.29Å; C186-C205 WeakPolarHBondContact SG-CB 3.34Å; C186-C205 CovalentContact SG-SG 2.03Å; C186-C205 PolarHBondContact SG-SG 3.35Å; C195-C205 WeakPolarHBondContact O-CB 3.22Å; S199-C205 PolarHBondContact OG-N 3.03Å; S199-C205 PolarHBondContact OG-O 3.35Å
206	Y	94.3	Very high	90.3	Very high	85 Å²	85	55.8 Å²	55.8	33%	0.333	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	140.1	179.8	-58.7	-86	0	0	0	109.8	C195 K204 C214 S215 N234 T236	C195-Y206 PolarHBondContact SG-O 2.83Å; C195-Y206 VanDerWaalsContact SG-O 3.38Å; K204-Y206 HydrophobicContact CB-CE2 3.75Å; K204-Y206 WeakPolarHBondContact O-CE2 2.93Å; Y206-C214 WeakPolarHBondContact O-CA 3.43Å; Y206-S215 PolarHBondContact N-O 3.41Å; Y206-S215 PolarHBondContact O-N 3.2Å; Y206-S215 VanDerWaalsContact O-O 3.14Å; Y206-N234 WeakPolarHBondContact CD1-OD1 3.43Å; Y206-T236 HydrophobicContact CD1-CG2 4.22Å; Y206-T236 HydrophobicContact CE1-CG2 4.49Å
207	W	95.8	Very high	89.8	Confident	16 Å²	16	54.5 Å²	54.5	6%	0.061	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	130.6	173.4	-172.3	-109.2	0	0	0	109.9	K190 C192 C195 I196 P209 N212 K213 C214 N234 T235	K190-W207 VanDerWaalsContact O-CH2 3.29Å; K190-W207 WeakPolarHBondContact O-CH2 3.36Å; C192-W207 HydrophobicContact CB-CB 4.37Å; C192-W207 HydrophobicContact CB-CD2 3.78Å; C192-W207 HydrophobicContact CB-CE3 4.44Å; C192-W207 HydrophobicContact CB-CG 3.72Å; C192-W207 HydrophobicContact CB-CZ2 4.39Å; C192-W207 VanDerWaalsContact SG-CD1 3.53Å; C192-W207 VanDerWaalsContact SG-CG 3.56Å; C195-W207 HydrophobicContact CB-CE3 3.71Å; C195-W207 HydrophobicContact CB-CZ3 4.34Å; I196-W207 HydrophobicContact CD1-CB 4.29Å; W207-P209 WeakPolarHBondContact O-CD 3.11Å; W207-N212 WeakPolarHBondContact CZ2-OD1 3.31Å; W207-K213 VanDerWaalsContact CE3-C 3.46Å; W207-C214 HydrophobicContact CE3-CB 3.71Å; W207-C214 HydrophobicContact CZ3-CB 3.82Å; W207-C214 VanDerWaalsContact CZ3-N 3.34Å; W207-N234 CarbonylContact O-C 3.13Å; W207-N234 WeakPolarHBondContact O-CA 3.42Å; W207-N234 WeakPolarHBondContact O-CB 3.46Å; W207-T235 HydrophobicContact CB-CG2 4.27Å; W207-T235 PolarHBondContact N-O 3.18Å; W207-T235 PolarHBondContact O-N 3.21Å
208	C	95.3	Very high	89.2	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	107.2	169.5	-172.9	0	0	0	0	110.6	I210 I211 N212 K213 W225 C230	C208-I210 PolarHBondContact O-N 3.5Å; C208-I211 HydrophobicContact CB-CD1 4.2Å; C208-I211 HydrophobicContact CB-CG1 3.75Å; C208-I211 PolarHBondContact O-N 2.65Å; C208-N212 WeakPolarHBondContact O-CA 3.28Å; C208-N212 PolarHBondContact O-N 3.28Å; C208-K213 PolarHBondContact N-O 2.86Å; C208-K213 PolarHBondContact O-N 2.8Å; C208-W225 HydrophobicContact CB-CE3 3.95Å; C208-W225 HydrophobicContact CB-CH2 3.88Å; C208-W225 HydrophobicContact CB-CZ3 3.36Å; C208-C230 HydrophobicContact CB-CB 3.58Å; C208-C230 WeakPolarHBondContact CB-SG 3.05Å; C208-C230 WeakPolarHBondContact SG-CB 3.42Å; C208-C230 CovalentContact SG-SG 2.03Å; C208-C230 PolarHBondContact SG-SG 2.87Å
209	P	92.9	Very high	88.8	Confident	71 Å²	71	56.3 Å²	56.3	46%	0.461	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-32.3	-178.1	-24.2	34.2	0	0	0	113.4	W207 I211 N212 K233 T235	W207-P209 WeakPolarHBondContact O-CD 3.11Å; P209-I211 PolarHBondContact O-N 3.42Å; P209-N212 PolarHBondContact O-N 3.47Å; P209-K233 WeakPolarHBondContact CD-O 3.09Å; P209-T235 HydrophobicContact CG-CG2 3.75Å
210	I	92.8	Very high	88.5	Confident	87 Å²	87	58 Å²	58	45%	0.446	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-38.2	-175.2	-64.8	172	0	0	0	112.4	C208 K228 K233	C208-I210 PolarHBondContact O-N 3.5Å; I210-K228 HydrophobicContact CG2-CB 4.09Å; I210-K228 HydrophobicContact CG2-CD 4.24Å; I210-K228 HydrophobicContact CG2-CG 4.28Å; I210-K233 HydrophobicContact CD1-CB 3.9Å; I210-K233 HydrophobicContact CD1-CD 3.2Å; I210-K233 HydrophobicContact CD1-CG 4.21Å
211	I	93.3	Very high	88.5	Confident	30 Å²	30	56.9 Å²	56.9	15%	0.154	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-4.5	178.1	61.1	172.8	0	0	0	112.3	C208 P209 K213 L224 W225 K228	C208-I211 HydrophobicContact CB-CD1 4.2Å; C208-I211 HydrophobicContact CB-CG1 3.75Å; C208-I211 PolarHBondContact O-N 2.65Å; P209-I211 PolarHBondContact O-N 3.42Å; I211-K213 VanDerWaalsContact C-N 3.3Å; I211-K213 HydrophobicContact CD1-CB 3.93Å; I211-K213 HydrophobicContact CD1-CG 4.3Å; I211-K213 HydrophobicContact CG1-CB 3.96Å; I211-K213 HydrophobicContact CG1-CG 4.26Å; I211-K213 WeakPolarHBondContact O-CG 3.14Å; I211-K213 PolarHBondContact O-N 2.84Å; I211-L224 HydrophobicContact CD1-CB 4.32Å; I211-L224 HydrophobicContact CG2-CD2 4.39Å; I211-W225 HydrophobicContact CD1-CE3 4.23Å; I211-K228 HydrophobicContact CG2-CB 3.91Å; I211-K228 HydrophobicContact CG2-CG 3.57Å
212	N	94.2	Very high	88.7	Confident	106 Å²	106	54.4 Å²	54.4	57%	0.567	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	45.5	-177.3	-158.2	45.7	0	0	0	112.5	W207 C208 P209	W207-N212 WeakPolarHBondContact CZ2-OD1 3.31Å; C208-N212 WeakPolarHBondContact O-CA 3.28Å; C208-N212 PolarHBondContact O-N 3.28Å; P209-N212 PolarHBondContact O-N 3.47Å
213	K	95	Very high	89.2	Confident	102 Å²	102	55.3 Å²	55.3	44%	0.443	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	149.3	-179.3	-63.8	-65.3	177.4	-178.3	0	111.7	W207 C208 I211	W207-K213 VanDerWaalsContact CE3-C 3.46Å; C208-K213 PolarHBondContact N-O 2.86Å; C208-K213 PolarHBondContact O-N 2.8Å; I211-K213 VanDerWaalsContact C-N 3.3Å; I211-K213 HydrophobicContact CD1-CB 3.93Å; I211-K213 HydrophobicContact CD1-CG 4.3Å; I211-K213 HydrophobicContact CG1-CB 3.96Å; I211-K213 HydrophobicContact CG1-CG 4.26Å; I211-K213 WeakPolarHBondContact O-CG 3.14Å; I211-K213 PolarHBondContact O-N 2.84Å
214	C	94.4	Very high	89.7	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.007	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	138	170.2	-174	0	0	0	0	110.4	C186 S187 Q189 C195 Y206 W207 H221	C186-C214 WeakPolarHBondContact O-CB 3.29Å; C186-C214 PolarHBondContact O-SG 2.96Å; S187-C214 WeakPolarHBondContact CA-O 3.03Å; Q189-C214 HydrophobicContact CB-CB 3.91Å; Q189-C214 WeakPolarHBondContact O-CB 3.34Å; C195-C214 WeakPolarHBondContact CA-SG 3.44Å; C195-C214 HydrophobicContact CB-CB 3.47Å; C195-C214 VanDerWaalsContact CB-CB 3.47Å; C195-C214 WeakPolarHBondContact CB-SG 3.42Å; C195-C214 WeakPolarHBondContact SG-CA 3.41Å; C195-C214 WeakPolarHBondContact SG-CB 3.31Å; C195-C214 CovalentContact SG-SG 2.01Å; C195-C214 PolarHBondContact SG-SG 3.39Å; Y206-C214 WeakPolarHBondContact O-CA 3.43Å; W207-C214 HydrophobicContact CE3-CB 3.71Å; W207-C214 HydrophobicContact CZ3-CB 3.82Å; W207-C214 VanDerWaalsContact CZ3-N 3.34Å; C214-H221 PolarHBondContact O-CD2 3.04Å
215	S	92.1	Very high	89.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	154	177.5	-177.7	0	0	0	0	112	Y206 G217 D219 W225	Y206-S215 PolarHBondContact N-O 3.41Å; Y206-S215 PolarHBondContact O-N 3.2Å; Y206-S215 VanDerWaalsContact O-O 3.14Å; S215-G217 VanDerWaalsContact C-N 3.35Å; S215-G217 PolarHBondContact OG-N 3.12Å; S215-D219 WeakPolarHBondContact CA-OD2 3.23Å; S215-D219 VanDerWaalsContact CB-OD2 3.22Å; S215-D219 WeakPolarHBondContact CB-OD2 3.39Å; S215-D219 PolarHBondContact OG-OD1 2.95Å; S215-D219 PolarHBondContact OG-OD2 2.96Å; S215-W225 VanDerWaalsContact CB-CZ3 3.41Å
216	H	86.8	Confident	89.6	Confident	46 Å²	46	56 Å²	56	21%	0.213	28%	0.278	C	S	.	.			trans	-94.8	9.4	164.8	65	78.2	0	0	0	112.7	C186 E203 K204 F218 D219	C186-H216 HydrophobicContact CB-CB 4.49Å; E203-H216 IonicContact OE1-CD2 2.63Å; E203-H216 IonicContact OE1-NE2 3.31Å; K204-H216 VanDerWaalsContact O-CB 3.25Å; K204-H216 WeakPolarHBondContact O-CB 3.18Å; H216-F218 VanDerWaalsContact C-N 3.25Å; H216-F218 PolarHBondContact CE1-O 2.9Å; H216-F218 PolarHBondContact ND1-N 2.83Å; H216-F218 PolarHBondContact O-N 3.22Å; H216-D219 IonicContact CD2-OD2 2.69Å; H216-D219 PolarHBondContact N-OD2 2.83Å
217	G	83	Confident	89.5	Confident	10 Å²	10	58.2 Å²	58.2	10%	0.103	30%	0.295	C	S	.	.	S	Bend	trans	81.7	-9.8	179.3	0	0	0	0	0	115.4	S215 R222	S215-G217 VanDerWaalsContact C-N 3.35Å; S215-G217 PolarHBondContact OG-N 3.12Å; G217-R222 WeakPolarHBondContact O-CG 3.22Å
218	F	79.9	Confident	89.5	Confident	144 Å²	144	62.1 Å²	62.1	63%	0.632	31%	0.312	S	S	*	.	S	Bend	trans	-127.6	29.9	178.2	-66.4	-89	0	0	0	112.9	H216	H216-F218 VanDerWaalsContact C-N 3.25Å; H216-F218 PolarHBondContact CE1-O 2.9Å; H216-F218 PolarHBondContact ND1-N 2.83Å; H216-F218 PolarHBondContact O-N 3.22Å
219	D	83	Confident	89.3	Confident	18 Å²	18	69.5 Å²	69.5	10%	0.096	34%	0.34	C	S	.	.	S	Bend	trans	-110.3	-168.3	176.8	56.7	42.6	0	0	0	111.8	S215 H216 H221 R222	S215-D219 WeakPolarHBondContact CA-OD2 3.23Å; S215-D219 VanDerWaalsContact CB-OD2 3.22Å; S215-D219 WeakPolarHBondContact CB-OD2 3.39Å; S215-D219 PolarHBondContact OG-OD1 2.95Å; S215-D219 PolarHBondContact OG-OD2 2.96Å; H216-D219 IonicContact CD2-OD2 2.69Å; H216-D219 PolarHBondContact N-OD2 2.83Å; D219-H221 PolarHBondContact O-N 3.22Å; D219-H221 WeakPolarHBondContact OD1-CA 3.19Å; D219-H221 VanDerWaalsContact OD1-CB 3.32Å; D219-H221 WeakPolarHBondContact OD1-CB 3.31Å; D219-H221 IonicContact OD1-CD2 2.72Å; D219-H221 IonicContact OD1-CG 2.71Å; D219-H221 PolarHBondContact OD1-N 2.74Å; D219-R222 WeakPolarHBondContact O-CB 3.16Å; D219-R222 PolarHBondContact O-N 2.76Å
220	I	82.5	Confident	89.3	Confident	70 Å²	70	66.1 Å²	66.1	36%	0.359	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-21.7	177.4	64.3	169.3	0	0	0	114.2	I39	I39-I220 HydrophobicContact CD1-CG2 4.02Å; I39-I220 HydrophobicContact CG1-CG2 3.49Å; I39-I220 VanDerWaalsContact CG1-CG2 3.49Å
221	H	86	Confident	89.1	Confident	23 Å²	23	67.7 Å²	67.7	11%	0.106	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-2.6	179.1	-59.7	-41.1	0	0	0	113.2	C214 D219 P223 L224 W225	C214-H221 PolarHBondContact O-CD2 3.04Å; D219-H221 PolarHBondContact O-N 3.22Å; D219-H221 WeakPolarHBondContact OD1-CA 3.19Å; D219-H221 VanDerWaalsContact OD1-CB 3.32Å; D219-H221 WeakPolarHBondContact OD1-CB 3.31Å; D219-H221 IonicContact OD1-CD2 2.72Å; D219-H221 IonicContact OD1-CG 2.71Å; D219-H221 PolarHBondContact OD1-N 2.74Å; H221-P223 VanDerWaalsContact C-CD 3.44Å; H221-L224 PolarHBondContact O-N 3.46Å; H221-L224 VanDerWaalsContact O-N 3.09Å; H221-W225 WeakPolarHBondContact O-CB 3.27Å; H221-W225 PolarHBondContact O-N 2.93Å
222	R	85.5	Confident	88.9	Confident	110 Å²	110	71.7 Å²	71.7	42%	0.415	34%	0.34	S	S	.	.	H	α-helix	trans	-48.9	-43.8	-176.7	-175.8	174.4	-169.7	-84.9	-1.5	114.5	G217 D219 L224 W225 M226	G217-R222 WeakPolarHBondContact O-CG 3.22Å; D219-R222 WeakPolarHBondContact O-CB 3.16Å; D219-R222 PolarHBondContact O-N 2.76Å; R222-L224 PolarHBondContact O-N 3.4Å; R222-W225 WeakPolarHBondContact O-CB 3.22Å; R222-W225 PolarHBondContact O-N 3.24Å; R222-M226 HydrophobicContact CG-CG 4.29Å; R222-M226 WeakPolarHBondContact O-CG 3.02Å; R222-M226 PolarHBondContact O-N 3.15Å
223	P	85.7	Confident	88.6	Confident	99 Å²	99	72.2 Å²	72.2	64%	0.643	34%	0.337	S	S	*	.	H	α-helix	trans	-59.4	-47.9	178.8	-24.5	35.2	0	0	0	112.7	H221 M226 L227	H221-P223 VanDerWaalsContact C-CD 3.44Å; P223-M226 PolarHBondContact O-N 3.15Å; P223-L227 WeakPolarHBondContact O-CB 3.3Å; P223-L227 PolarHBondContact O-N 3.02Å
224	L	89.3	Confident	88.2	Confident	83 Å²	83	69.5 Å²	69.5	44%	0.435	33%	0.327	S	S	.	.	H	α-helix	trans	-67.6	-37.6	176.2	-84.3	138.1	0	0	0	111.9	I211 H221 R222 M226 L227 K228	I211-L224 HydrophobicContact CD1-CB 4.32Å; I211-L224 HydrophobicContact CG2-CD2 4.39Å; H221-L224 PolarHBondContact O-N 3.46Å; H221-L224 VanDerWaalsContact O-N 3.09Å; R222-L224 PolarHBondContact O-N 3.4Å; L224-M226 VanDerWaalsContact C-N 3.33Å; L224-M226 PolarHBondContact O-N 3.27Å; L224-L227 PolarHBondContact O-N 3.02Å; L224-K228 WeakPolarHBondContact O-CB 3Å; L224-K228 PolarHBondContact O-N 3.32Å
225	W	89.9	Confident	87.9	Confident	7 Å²	7	71.2 Å²	71.2	3%	0.027	34%	0.338	C	S	.	.	H	α-helix	trans	-58.5	-45.2	177.2	-167.7	-93.3	0	0	0	111.6	C208 I211 S215 H221 R222 R229 C230 N234	C208-W225 HydrophobicContact CB-CE3 3.95Å; C208-W225 HydrophobicContact CB-CH2 3.88Å; C208-W225 HydrophobicContact CB-CZ3 3.36Å; I211-W225 HydrophobicContact CD1-CE3 4.23Å; S215-W225 VanDerWaalsContact CB-CZ3 3.41Å; H221-W225 WeakPolarHBondContact O-CB 3.27Å; H221-W225 PolarHBondContact O-N 2.93Å; R222-W225 WeakPolarHBondContact O-CB 3.22Å; R222-W225 PolarHBondContact O-N 3.24Å; W225-R229 PolarHBondContact O-N 3.23Å; W225-C230 HydrophobicContact CB-CB 4.38Å; W225-C230 HydrophobicContact CD2-CB 3.24Å; W225-C230 VanDerWaalsContact CE2-CB 3.45Å; W225-C230 HydrophobicContact CE3-CB 3.45Å; W225-C230 VanDerWaalsContact CE3-CB 3.45Å; W225-C230 HydrophobicContact CG-CB 3.69Å; W225-C230 HydrophobicContact CH2-CB 4.03Å; W225-C230 HydrophobicContact CZ2-CB 3.85Å; W225-C230 WeakPolarHBondContact CZ2-O 3.39Å; W225-C230 HydrophobicContact CZ3-CB 3.85Å; W225-C230 WeakPolarHBondContact O-CB 2.94Å; W225-C230 PolarHBondContact O-N 3.37Å; W225-N234 HydrophobicContact CH2-CB 3.78Å; W225-N234 HydrophobicContact CZ2-CB 3.82Å
226	M	89.9	Confident	87.5	Confident	69 Å²	69	75.2 Å²	75.2	34%	0.34	36%	0.362	S	S	.	.	H	α-helix	trans	-70.3	-48.7	176.1	-66.1	-56.4	-66.1	0	0	111.3	R222 P223 L224 K228 R229 Y231	R222-M226 HydrophobicContact CG-CG 4.29Å; R222-M226 WeakPolarHBondContact O-CG 3.02Å; R222-M226 PolarHBondContact O-N 3.15Å; P223-M226 PolarHBondContact O-N 3.15Å; L224-M226 VanDerWaalsContact C-N 3.33Å; L224-M226 PolarHBondContact O-N 3.27Å; M226-K228 VanDerWaalsContact C-N 3.32Å; M226-K228 PolarHBondContact O-N 3.42Å; M226-R229 PolarHBondContact O-N 3.27Å; M226-Y231 HydrophobicContact CE-CD1 4.37Å; M226-Y231 HydrophobicContact CE-CE1 4.35Å; M226-Y231 HydrophobicContact SD-CD1 4.13Å
227	L	92.4	Very high	87.4	Confident	130 Å²	130	80.6 Å²	80.6	68%	0.681	39%	0.385	S	S	*	.	H	α-helix	trans	-57.7	-42.4	-177.6	-179.3	64.6	0	0	0	112.6	P223 L224 R229	P223-L227 WeakPolarHBondContact O-CB 3.3Å; P223-L227 PolarHBondContact O-N 3.02Å; L224-L227 PolarHBondContact O-N 3.02Å; L227-R229 VanDerWaalsContact C-N 3.31Å
228	K	94.8	Very high	87.6	Confident	99 Å²	99	82.1 Å²	82.1	43%	0.43	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	8	-179.8	-61.8	-62.8	-172.2	178	0	113.4	I210 I211 L224 M226 C230	I210-K228 HydrophobicContact CG2-CB 4.09Å; I210-K228 HydrophobicContact CG2-CD 4.24Å; I210-K228 HydrophobicContact CG2-CG 4.28Å; I211-K228 HydrophobicContact CG2-CB 3.91Å; I211-K228 HydrophobicContact CG2-CG 3.57Å; L224-K228 WeakPolarHBondContact O-CB 3Å; L224-K228 PolarHBondContact O-N 3.32Å; M226-K228 VanDerWaalsContact C-N 3.32Å; M226-K228 PolarHBondContact O-N 3.42Å; K228-C230 PolarHBondContact O-N 3.32Å
229	R	92.3	Very high	87.4	Confident	154 Å²	154	83.4 Å²	83.4	58%	0.581	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	38.2	180	-55.3	-176.5	-178.4	169.2	0.1	113.1	W225 M226 L227 Y231 I232 K233	W225-R229 PolarHBondContact O-N 3.23Å; M226-R229 PolarHBondContact O-N 3.27Å; L227-R229 VanDerWaalsContact C-N 3.31Å; R229-Y231 HydrophobicContact CB-CD1 4.48Å; R229-Y231 HydrophobicContact CB-CE1 3.88Å; R229-Y231 HydrophobicContact CG-CE1 4.06Å; R229-Y231 PolarHBondContact O-N 3Å; R229-I232 PolarHBondContact O-N 3.31Å; R229-K233 PolarHBondContact O-N 3.31Å
230	C	93.3	Very high	86.1	Confident	0 Å²	0	91 Å²	91	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-65	-18.4	178.2	-67.3	0	0	0	0	112.5	C208 W225 K228 I232 K233 N234	C208-C230 HydrophobicContact CB-CB 3.58Å; C208-C230 WeakPolarHBondContact CB-SG 3.05Å; C208-C230 WeakPolarHBondContact SG-CB 3.42Å; C208-C230 CovalentContact SG-SG 2.03Å; C208-C230 PolarHBondContact SG-SG 2.87Å; W225-C230 HydrophobicContact CB-CB 4.38Å; W225-C230 HydrophobicContact CD2-CB 3.24Å; W225-C230 VanDerWaalsContact CE2-CB 3.45Å; W225-C230 HydrophobicContact CE3-CB 3.45Å; W225-C230 VanDerWaalsContact CE3-CB 3.45Å; W225-C230 HydrophobicContact CG-CB 3.69Å; W225-C230 HydrophobicContact CH2-CB 4.03Å; W225-C230 HydrophobicContact CZ2-CB 3.85Å; W225-C230 WeakPolarHBondContact CZ2-O 3.39Å; W225-C230 HydrophobicContact CZ3-CB 3.85Å; W225-C230 WeakPolarHBondContact O-CB 2.94Å; W225-C230 PolarHBondContact O-N 3.37Å; K228-C230 PolarHBondContact O-N 3.32Å; C230-I232 PolarHBondContact O-N 3.34Å; C230-K233 PolarHBondContact O-N 3.02Å; C230-N234 WeakPolarHBondContact O-CB 3.49Å; C230-N234 PolarHBondContact O-N 3.08Å; C230-N234 PolarHBondContact O-ND2 3.41Å
231	Y	88.7	Confident	84.4	Confident	120 Å²	120	92.8 Å²	92.8	47%	0.471	46%	0.456	S	S	.	.	H	α-helix	trans	-62.3	-23.5	170.5	64.7	-86.1	0	0	0	113	M226 R229 N234	M226-Y231 HydrophobicContact CE-CD1 4.37Å; M226-Y231 HydrophobicContact CE-CE1 4.35Å; M226-Y231 HydrophobicContact SD-CD1 4.13Å; R229-Y231 HydrophobicContact CB-CD1 4.48Å; R229-Y231 HydrophobicContact CB-CE1 3.88Å; R229-Y231 HydrophobicContact CG-CE1 4.06Å; R229-Y231 PolarHBondContact O-N 3Å; Y231-N234 PolarHBondContact O-ND2 3.1Å
232	I	87.9	Confident	81.9	Confident	115 Å²	115	97.6 Å²	97.6	59%	0.59	49%	0.487	S	S	*	.	H	α-helix	trans	-99.6	-41.1	171.7	-63.4	159.9	0	0	0	110.9	R229 C230	R229-I232 PolarHBondContact O-N 3.31Å; C230-I232 PolarHBondContact O-N 3.34Å
233	K	87.7	Confident	79.5	Confident	116 Å²	116	98.5 Å²	98.5	50%	0.504	51%	0.505	S	S	.	.	H	α-helix	trans	-95.2	11.9	-167.5	-57.2	-172.2	-177.3	-177.5	0	114.4	P209 I210 R229 C230	P209-K233 WeakPolarHBondContact CD-O 3.09Å; I210-K233 HydrophobicContact CD1-CB 3.9Å; I210-K233 HydrophobicContact CD1-CD 3.2Å; I210-K233 HydrophobicContact CD1-CG 4.21Å; R229-K233 PolarHBondContact O-N 3.31Å; C230-K233 PolarHBondContact O-N 3.02Å
234	N	88.2	Confident	76.9	Confident	45 Å²	45	97.6 Å²	97.6	24%	0.241	50%	0.501	C	S	.	.			trans	-72.5	163.2	173.3	65.6	66.2	0	0	0	111.5	Y206 W207 W225 C230 Y231	Y206-N234 WeakPolarHBondContact CD1-OD1 3.43Å; W207-N234 CarbonylContact O-C 3.13Å; W207-N234 WeakPolarHBondContact O-CA 3.42Å; W207-N234 WeakPolarHBondContact O-CB 3.46Å; W225-N234 HydrophobicContact CH2-CB 3.78Å; W225-N234 HydrophobicContact CZ2-CB 3.82Å; C230-N234 WeakPolarHBondContact O-CB 3.49Å; C230-N234 PolarHBondContact O-N 3.08Å; C230-N234 PolarHBondContact O-ND2 3.41Å; Y231-N234 PolarHBondContact O-ND2 3.1Å
235	T	86.6	Confident	74.2	Confident	38 Å²	38	99 Å²	99	23%	0.233	51%	0.513	C	S	.	.	B	Isolated β-bridge	trans	-136.5	147.5	175.7	-174.8	0	0	0	0	110.3	W207 P209 K237	W207-T235 HydrophobicContact CB-CG2 4.27Å; W207-T235 PolarHBondContact N-O 3.18Å; W207-T235 PolarHBondContact O-N 3.21Å; P209-T235 HydrophobicContact CG-CG2 3.75Å; T235-K237 WeakPolarHBondContact CG2-O 3.22Å; T235-K237 PolarHBondContact OG1-N 2.88Å; T235-K237 PolarHBondContact OG1-O 3.12Å
236	T	84.2	Confident	71.6	Confident	83 Å²	83	108.5 Å²	108.5	51%	0.509	55%	0.55	S	S	.	.	S	Bend	trans	-102.2	-3.7	164	55.4	0	0	0	0	112.2	I196 Y206	I196-T236 HydrophobicContact CD1-CG2 4.38Å; Y206-T236 HydrophobicContact CD1-CG2 4.22Å; Y206-T236 HydrophobicContact CE1-CG2 4.49Å
237	K	85.5	Confident	68.7	Low	159 Å²	159	110.2 Å²	110.2	69%	0.691	56%	0.564	S	S	*	*			trans	-104.2	113.3	176.8	-63	-177.7	-177.4	179.8	0	108.8	T235 Q239	T235-K237 WeakPolarHBondContact CG2-O 3.22Å; T235-K237 PolarHBondContact OG1-N 2.88Å; T235-K237 PolarHBondContact OG1-O 3.12Å; K237-Q239 PolarHBondContact O-N 2.03Å
238	C	87	Confident	65.9	Low	42 Å²	42	109 Å²	109	28%	0.284	57%	0.567	S	S	.	*			trans	-88.7	95.1	174.3	-55.4	0	0	0	0	107.5	C192 E193	C192-C238 HydrophobicContact CB-CB 3.69Å; C192-C238 WeakPolarHBondContact CB-SG 3.09Å; C192-C238 PolarHBondContact O-SG 3.06Å; C192-C238 VanDerWaalsContact O-SG 3.34Å; C192-C238 WeakPolarHBondContact SG-CA 3.02Å; C192-C238 WeakPolarHBondContact SG-CB 3.46Å; C192-C238 CovalentContact SG-SG 2.03Å; C192-C238 PolarHBondContact SG-SG 2.01Å; E193-C238 HydrophobicContact CG-CB 3.99Å; E193-C238 PolarHBondContact N-SG 3.06Å; E193-C238 VanDerWaalsContact N-SG 3.37Å
239	Q	75.5	Confident	62.7	Low	172 Å²	172	110.4 Å²	110.4	80%	0.804	58%	0.579	S	S	*	*			trans	-87.9	133.3	166.2	-70.9	-176.6	-57.9	0	0	107.7	K237 S241	K237-Q239 PolarHBondContact O-N 2.03Å; Q239-S241 PolarHBondContact O-N 2.62Å
240	E	56.2	Low	59.8	Low	176 Å²	176	111.9 Å²	111.9	82%	0.822	59%	0.592	S	S	*	*			trans	-53.1	113.5	166.6	-73.9	-176.9	166.7	0	0	107.1	T242	E240-T242 PolarHBondContact O-N 2.93Å
241	S	46.4	Very low	56.8	Low	109 Å²	109	120.9 Å²	120.9	76%	0.762	63%	0.634	S	S	*	*			trans	-69.3	86.9	172.4	-59.4	0	0	0	0	106.8	Q239 T243	Q239-S241 PolarHBondContact O-N 2.62Å; S241-T243 PolarHBondContact O-N 3Å
242	T	33.6	Very low	54	Low	124 Å²	124	123.2 Å²	123.2	76%	0.761	65%	0.654	S	S	*	*			trans	-52.7	113.7	149.2	38.2	0	0	0	0	105.1	E240 S244	E240-T242 PolarHBondContact O-N 2.93Å; T242-S244 VanDerWaalsContact C-N 3.28Å; T242-S244 PolarHBondContact O-N 2.88Å
243	T	33.5	Very low	51	Low	129 Å²	129	123.6 Å²	123.6	79%	0.791	67%	0.666	S	S	*	*			trans	-30.2	85.2	178.4	-51.4	0	0	0	0	112.2	S241 V245	S241-T243 PolarHBondContact O-N 3Å; T243-V245 VanDerWaalsContact C-N 3.31Å; T243-V245 HydrophobicContact CG2-CG2 4.17Å; T243-V245 PolarHBondContact O-N 2.74Å; T243-V245 VanDerWaalsContact O-N 3.15Å
244	S	32.6	Very low	48.2	Very low	80 Å²	80	123.5 Å²	123.5	56%	0.559	68%	0.681	S	S	*	*			trans	-79.4	98.9	159.7	62	0	0	0	0	103.6	T242 Y246	T242-S244 VanDerWaalsContact C-N 3.28Å; T242-S244 PolarHBondContact O-N 2.88Å; S244-Y246 PolarHBondContact O-N 3.12Å
245	V	32.4	Very low	45.3	Very low	113 Å²	113	128.3 Å²	128.3	69%	0.685	70%	0.703	S	S	*	*			trans	-48.7	94.9	160.8	177.9	0	0	0	0	106.1	T243 T247	T243-V245 VanDerWaalsContact C-N 3.31Å; T243-V245 HydrophobicContact CG2-CG2 4.17Å; T243-V245 PolarHBondContact O-N 2.74Å; T243-V245 VanDerWaalsContact O-N 3.15Å; V245-T247 HydrophobicContact CG1-CG2 4.23Å; V245-T247 PolarHBondContact O-N 3.06Å
246	Y	35.1	Very low	42.3	Very low	205 Å²	205	137.8 Å²	137.8	80%	0.804	74%	0.735	S	S	*	*			trans	-67.5	98.4	157.2	-85.6	-81.5	0	0	0	104	S244 S248	S244-Y246 PolarHBondContact O-N 3.12Å; Y246-S248 PolarHBondContact O-N 2.93Å
247	T	29.9	Very low	39.6	Very low	105 Å²	105	139 Å²	139	64%	0.644	74%	0.742	S	S	*	*			trans	-51.5	106.6	164.1	36.9	0	0	0	0	106.9	V245 D249	V245-T247 HydrophobicContact CG1-CG2 4.23Å; V245-T247 PolarHBondContact O-N 3.06Å; T247-D249 PolarHBondContact O-N 2.78Å
248	S	32.5	Very low	36.8	Very low	105 Å²	105	136.3 Å²	136.3	73%	0.734	74%	0.739	S	S	*	*			trans	-75.9	65.5	173.5	65.1	0	0	0	0	108.9	Y246	Y246-S248 PolarHBondContact O-N 2.93Å
249	D	28	Very low	33.9	Very low	128 Å²	128	143.3 Å²	143.3	68%	0.684	77%	0.768	S	S	*	*			trans	-111.5	74.6	174.5	-65.7	-32.4	0	0	0	108.3	T247	T247-D249 PolarHBondContact O-N 2.78Å
250	H	31	Very low	31.5	Very low	185 Å²	185	142.4 Å²	142.4	86%	0.856	76%	0.763	S	S	*	*	S	Bend	trans	168.3	121.6	131.7	-98.5	-84	0	0	0	109.5
251	E	29.5	Very low	30	Very low	190 Å²	190	143.5 Å²	143.5	89%	0.888	76%	0.761	S	S	*	*			trans	73.6	66.8	176	-61	-158.8	142.4	0	0	118
252	L	30.2	Very low	28.9	Very low	169 Å²	169	142.2 Å²	142.2	89%	0.885	75%	0.752	S	S	*	*			trans	-133	77.1	147.6	-159.7	78.2	0	0	0	109.6
253	S	26.3	Very low	28.4	Very low	122 Å²	122	143.1 Å²	143.1	85%	0.853	75%	0.752	S	S	*	*			trans	-119.3	116.7	159.6	-152.9	0	0	0	0	108.1
254	S	27.8	Very low	27.9	Very low	115 Å²	115	142.4 Å²	142.4	80%	0.804	75%	0.748	S	S	*	*	S	Bend	trans	71.3	83.3	170.9	-173.2	0	0	0	0	118.5
255	M	27.6	Very low	27.5	Very low	145 Å²	145	145.9 Å²	145.9	71%	0.714	75%	0.753	S	S	*	*				-158.3	100.9	124.5	-124	-175.4	-150.6	0	0	111	T257	M255-T257 HydrophobicContact CG-CG2 4.16Å; M255-T257 PolarHBondContact O-N 3.31Å; M255-T257 HydrophobicContact SD-CG2 3.93Å
256	R	24.4	Very low	27.1	Very low	238 Å²	238	145.6 Å²	145.6	90%	0.898	75%	0.754	S	S	*	*			trans	-76.7	89.9	161.1	179.5	179.8	166.6	148.2	-2.5	106.8
257	T	26.7	Very low	26.5	Very low	108 Å²	108	143.4 Å²	143.4	66%	0.663	76%	0.756	S	S	*	*			trans	-94.4	105.3	169.2	36.9	0	0	0	0	109.1	M255 E259	M255-T257 HydrophobicContact CG-CG2 4.16Å; M255-T257 PolarHBondContact O-N 3.31Å; M255-T257 HydrophobicContact SD-CG2 3.93Å; T257-E259 PolarHBondContact O-N 2.92Å
258	T	26.5	Very low	26.3	Very low	102 Å²	102	146.4 Å²	146.4	63%	0.626	76%	0.762	S	S	*	*			trans	-48.7	131.1	160.3	38.2	0	0	0	0	110.2	H260	T258-H260 VanDerWaalsContact C-N 3.27Å; T258-H260 PolarHBondContact O-N 3.04Å
259	E	26.8	Very low	25.9	Very low	190 Å²	190	145.8 Å²	145.8	89%	0.888	76%	0.758	S	S	*	*			trans	-62	85.6	170.4	-66	-173.3	162.6	0	0	110.1	T257	T257-E259 PolarHBondContact O-N 2.92Å
260	H	24.6	Very low	25.6	Very low	153 Å²	153	148.4 Å²	148.4	71%	0.708	76%	0.764	S	S	*	*			trans	-104.9	99.3	160.1	-91.8	-64.5	0	0	0	107.9	T258 S262	T258-H260 VanDerWaalsContact C-N 3.27Å; T258-H260 PolarHBondContact O-N 3.04Å; H260-S262 PolarHBondContact O-N 3.36Å
261	Y	25.2	Very low	25.3	Very low	199 Å²	199	144.5 Å²	144.5	78%	0.78	75%	0.754	S	S	*	*			trans	-64.9	77.2	155.6	-95.9	-88.9	0	0	0	108	N263	Y261-N263 PolarHBondContact O-N 2.81Å
262	S	22.3	Very low	24.9	Very low	82 Å²	82	142.5 Å²	142.5	57%	0.573	75%	0.749	S	S	*	*			trans	-79.6	93.1	166.7	-67.6	0	0	0	0	107.4	H260 T264	H260-S262 PolarHBondContact O-N 3.36Å; S262-T264 PolarHBondContact O-N 3.49Å
263	N	24.6	Very low	24.5	Very low	142 Å²	142	144.8 Å²	144.8	76%	0.759	75%	0.747	S	S	*	*			trans	-69.5	65.4	159.7	-75.1	-18.1	0	0	0	108.7	Y261 F265	Y261-N263 PolarHBondContact O-N 2.81Å; N263-F265 PolarHBondContact O-N 3.47Å
264	T	22.3	Very low	24.3	Very low	115 Å²	115	143.4 Å²	143.4	71%	0.706	74%	0.737	S	S	*	*			trans	-95.2	91.4	169.2	-36.5	0	0	0	0	106.5	S262	S262-T264 PolarHBondContact O-N 3.49Å
265	F	25	Very low	24	Very low	152 Å²	152	146.4 Å²	146.4	67%	0.667	74%	0.739	S	S	*	*			trans	-52.8	135	155.3	-78.8	-91.5	0	0	0	107.3	N263 N267	N263-F265 PolarHBondContact O-N 3.47Å; F265-N267 PolarHBondContact O-N 2.98Å
266	P	22.8	Very low	23.9	Very low	108 Å²	108	145.5 Å²	145.5	70%	0.701	74%	0.742	S	S	*	*			trans	-59.2	112.5	167.2	-11.8	25.2	0	0	0	106.5	H268	P266-H268 PolarHBondContact O-N 3.42Å
267	N	23.1	Very low	23.8	Very low	159 Å²	159	139.9 Å²	139.9	85%	0.85	73%	0.734	S	S	*	*			trans	-58.4	95.9	157.1	-88.4	-16.3	0	0	0	105.5	F265 S269	F265-N267 PolarHBondContact O-N 2.98Å; N267-S269 VanDerWaalsContact C-N 3.25Å; N267-S269 PolarHBondContact O-N 2.92Å
268	H	25	Very low	23.6	Very low	167 Å²	167	143 Å²	143	77%	0.773	75%	0.745	S	S	*	*			trans	-62.4	104	153.6	-94.6	-73.8	0	0	0	105.6	P266 F270	P266-H268 PolarHBondContact O-N 3.42Å; H268-F270 PolarHBondContact O-N 2.83Å
269	S	23.9	Very low	23.4	Very low	93 Å²	93	141.5 Å²	141.5	65%	0.65	75%	0.75	S	S	*	*			trans	-51	112.3	164.3	50.1	0	0	0	0	107.8	N267 T271	N267-S269 VanDerWaalsContact C-N 3.25Å; N267-S269 PolarHBondContact O-N 2.92Å; S269-T271 VanDerWaalsContact C-N 3.32Å; S269-T271 PolarHBondContact O-N 3.34Å
270	F	22.8	Very low	23.1	Very low	182 Å²	182	140.8 Å²	140.8	80%	0.798	75%	0.752	S	S	*	*			trans	-62.5	99.4	158.2	-74.3	-93.3	0	0	0	106.7	H268 N272	H268-F270 PolarHBondContact O-N 2.83Å; F270-N272 VanDerWaalsContact C-N 3.33Å; F270-N272 PolarHBondContact O-N 2.92Å; F270-N272 VanDerWaalsContact O-N 3.12Å
271	T	23.2	Very low	23	Very low	104 Å²	104	138.8 Å²	138.8	64%	0.638	76%	0.755	S	S	*	*			trans	-72.6	98.9	158.5	45.4	0	0	0	0	106.6	S269 Y273	S269-T271 VanDerWaalsContact C-N 3.32Å; S269-T271 PolarHBondContact O-N 3.34Å; T271-Y273 PolarHBondContact O-N 3.01Å
272	N	22.4	Very low	22.8	Very low	148 Å²	148	134.6 Å²	134.6	79%	0.791	75%	0.751	S	S	*	*			trans	-54.4	106.4	159.8	-79.6	-22	0	0	0	108.1	F270	F270-N272 VanDerWaalsContact C-N 3.33Å; F270-N272 PolarHBondContact O-N 2.92Å; F270-N272 VanDerWaalsContact O-N 3.12Å
273	Y	21.5	Very low	22.9	Very low	216 Å²	216	137.3 Å²	137.3	85%	0.847	76%	0.764	S	S	*	*			trans	-98.1	98	151.1	-77.1	-78.9	0	0	0	106.7	T271	T271-Y273 PolarHBondContact O-N 3.01Å
274	S	22.2	Very low	22.9	Very low	93 Å²	93	137.7 Å²	137.7	65%	0.65	77%	0.766	S	S	*	*			trans	-79.9	136.9	161.9	46.7	0	0	0	0	109.3
275	E	22.2	Very low	22.9	Very low	178 Å²	178	137.2 Å²	137.2	83%	0.832	77%	0.767	S	S	*	*			trans	74.2	130.3	161.9	-60	170.5	-176.4	0	0	115
276	T	25.1	Very low	22.7	Very low	126 Å²	126	135.9 Å²	135.9	77%	0.773	77%	0.771	S	S	*	*				-165.1	148.4	50.5	-39.3	0	0	0	0	110.7
277	T	21.2	Very low	22.7	Very low	120 Å²	120	140.2 Å²	140.2	74%	0.736	78%	0.779	S	S	*	*			trans	-40.8	146.8	162.2	26.4	0	0	0	0	116.2
278	L	22.8	Very low	22.6	Very low	173 Å²	173	138.4 Å²	138.4	91%	0.906	77%	0.774	S	S	*	*			trans	126.1	121.5	144.1	-75.6	148.5	0	0	0	116.1
279	G	22	Very low	23.1	Very low	71 Å²	71	135.2 Å²	135.2	73%	0.732	77%	0.769	S	S	*	*				108.4	112.5	126.9	0	0	0	0	0	117.9
280	L	21.4	Very low	23	Very low	175 Å²	175	137.2 Å²	137.2	92%	0.916	77%	0.772	S	S	*	*			trans	-42.1	144.2	167.8	-76.5	69.7	0	0	0	115
281	S	21.9	Very low	23.2	Very low	111 Å²	111	137.2 Å²	137.2	78%	0.776	77%	0.774	S	S	*	*				165.2	149	100.4	-165.6	0	0	0	0	113
282	T	21.4	Very low	23	Very low	112 Å²	112	135.6 Å²	135.6	69%	0.687	78%	0.778	S	S	*	*			trans	-56.6	148.9	179.4	46	0	0	0	0	117
283	T	25.1	Very low	23.2	Very low	138 Å²	138	137.2 Å²	137.2	85%	0.847	79%	0.786	S	S	*	*				174.3	166.2	115.6	34.5	0	0	0	0	112.9
284	N	23.3	Very low	23.2	Very low	150 Å²	150	131.7 Å²	131.7	80%	0.802	78%	0.779	S	S	*	*			trans	-85.8	169	-153.1	-66.3	-32.8	0	0	0	118.5
285	S	22.2	Very low	23.2	Very low	105 Å²	105	132.2 Å²	132.2	73%	0.734	78%	0.783	S	S	*	*			trans	80.9	113.5	142.3	58.9	0	0	0	0	120.5
286	V	21.7	Very low	23.1	Very low	124 Å²	124	132.4 Å²	132.4	75%	0.752	79%	0.786	S	S	*	*				79	108.4	93.5	-170	0	0	0	0	114.2
287	F	22.7	Very low	22.9	Very low	199 Å²	199	137.7 Å²	137.7	87%	0.873	79%	0.791	S	S	*	*				164.3	145.1	127.4	-107.5	-89.1	0	0	0	112.8
288	T	21.7	Very low	22.9	Very low	122 Å²	122	138.2 Å²	138.2	75%	0.748	80%	0.795	S	S	*	*			trans	-129	176.2	168.8	47.4	0	0	0	0	107.9
289	P	34.1	Very low	22.9	Very low	100 Å²	100	136.3 Å²	136.3	65%	0.649	79%	0.79	S	S	*	*			cis	-135.9	-174.1	-35.4	31.7	-9.5	0	0	0	113.4
290	D	22.7	Very low	22.9	Very low	135 Å²	135	141.1 Å²	141.1	72%	0.722	79%	0.794	S	S	*	*			trans	126.5	138.8	137.3	-75	-23.2	0	0	0	122.2
291	H	25.6	Very low	22.9	Very low	181 Å²	181	141.2 Å²	141.2	84%	0.838	79%	0.789	S	S	*	*			trans	90.1	98.3	156.9	-71	-64.1	0	0	0	123.1
292	G	21	Very low	22.8	Very low	71 Å²	71	144.8 Å²	144.8	73%	0.732	79%	0.787	S	S	*	*				87.1	113.6	105	0	0	0	0	0	121.1
293	L	24.6	Very low	22.8	Very low	181 Å²	181	144 Å²	144	95%	0.948	79%	0.786	S	S	*	*				-172	159.1	128	-117.8	122.2	0	0	0	112.9
294	S	21.6	Very low	22.7	Very low	101 Å²	101	144.2 Å²	144.2	71%	0.706	78%	0.782	S	S	*	*			trans	-75.2	154.1	-163.7	56	0	0	0	0	116.9
295	S	22.3	Very low	22.7	Very low	104 Å²	104	143.3 Å²	143.3	73%	0.727	78%	0.782	S	S	*	*				164.9	119.4	121.8	-173.5	0	0	0	0	112.7
296	M	20.3	Very low	22.7	Very low	181 Å²	181	146.9 Å²	146.9	89%	0.892	79%	0.785	S	S	*	*			trans	41.7	96.7	136.3	-151.5	176.5	-72.5	0	0	118.5
297	R	21.6	Very low	22.8	Very low	237 Å²	237	147.4 Å²	147.4	89%	0.894	78%	0.782	S	S	*	*			trans	-153.1	130.5	142.1	-133.8	171.9	-178.2	156.2	-0.5	111.4	T299	R297-T299 PolarHBondContact O-N 2.73Å
298	T	20.8	Very low	22.7	Very low	132 Å²	132	145.8 Å²	145.8	81%	0.81	78%	0.783	S	S	*	*			trans	-55.8	119.9	176.5	48.1	0	0	0	0	111.8
299	T	23.4	Very low	22.8	Very low	132 Å²	132	147.5 Å²	147.5	81%	0.81	78%	0.777	S	S	*	*			trans	-147.4	129.5	156.8	41.6	0	0	0	0	110.3	R297	R297-T299 PolarHBondContact O-N 2.73Å
300	E	20.7	Very low	22.2	Very low	172 Å²	172	148.4 Å²	148.4	80%	0.804	79%	0.786	S	S	*	*			trans	-57.4	128.1	-176.9	-61.2	173.7	159	0	0	112	Y302	E300-Y302 PolarHBondContact O-N 3.28Å
301	H	21.8	Very low	22.3	Very low	177 Å²	177	149.5 Å²	149.5	82%	0.819	78%	0.784	S	S	*	*			trans	-73.4	102.5	168.7	-89.3	-78.5	0	0	0	109.6
302	Y	21.1	Very low	22	Very low	187 Å²	187	147.2 Å²	147.2	73%	0.733	78%	0.783	S	S	*	*			trans	-109.7	100.8	152.9	-82.4	-79.3	0	0	0	109.3	E300 N304	E300-Y302 PolarHBondContact O-N 3.28Å; Y302-N304 PolarHBondContact O-N 2.87Å; Y302-N304 VanDerWaalsContact O-N 3.11Å
303	S	21.7	Very low	22.2	Very low	95 Å²	95	149.1 Å²	149.1	66%	0.664	78%	0.776	S	S	*	*			trans	-70.6	93.5	175.5	-42.2	0	0	0	0	110	T305	S303-T305 PolarHBondContact O-N 2.88Å
304	N	21.8	Very low	22.1	Very low	143 Å²	143	149.6 Å²	149.6	77%	0.765	77%	0.767	S	S	*	*			trans	-82.8	89.4	160.6	-82.9	-18.8	0	0	0	108.6	Y302 F306	Y302-N304 PolarHBondContact O-N 2.87Å; Y302-N304 VanDerWaalsContact O-N 3.11Å; N304-F306 VanDerWaalsContact C-N 3.34Å; N304-F306 PolarHBondContact O-N 3.38Å
305	T	22.8	Very low	22.4	Very low	131 Å²	131	149.2 Å²	149.2	80%	0.804	76%	0.764	S	S	*	*			trans	-70	90.2	165.2	19.3	0	0	0	0	109.3	S303 L307	S303-T305 PolarHBondContact O-N 2.88Å; T305-L307 PolarHBondContact O-N 2.87Å
306	F	23.5	Very low	22.5	Very low	180 Å²	180	153.3 Å²	153.3	79%	0.789	77%	0.772	S	S	*	*			trans	-69.1	110.9	153.1	-81.7	-87.2	0	0	0	107.4	N304 N308	N304-F306 VanDerWaalsContact C-N 3.34Å; N304-F306 PolarHBondContact O-N 3.38Å; F306-N308 PolarHBondContact O-N 2.03Å; F306-N308 VanDerWaalsContact O-N 3.09Å
307	L	22.7	Very low	22.8	Very low	134 Å²	134	149.6 Å²	149.6	70%	0.702	76%	0.76	S	S	*	*			trans	-59.4	111.1	163.8	-85.4	154.9	0	0	0	107.6	T305 Y309	T305-L307 PolarHBondContact O-N 2.87Å; L307-Y309 HydrophobicContact CB-CD2 4.1Å; L307-Y309 HydrophobicContact CB-CE2 3.82Å; L307-Y309 HydrophobicContact CD1-CE2 4.48Å; L307-Y309 PolarHBondContact O-N 3.23Å
308	N	20.8	Very low	22.8	Very low	165 Å²	165	145.4 Å²	145.4	88%	0.882	76%	0.761	S	S	*	*			trans	-56.6	96.7	166.9	-89.3	-15.9	0	0	0	108.9	F306	F306-N308 PolarHBondContact O-N 2.03Å; F306-N308 VanDerWaalsContact O-N 3.09Å
309	Y	23.9	Very low	22.9	Very low	158 Å²	158	146 Å²	146	62%	0.62	76%	0.758	S	S	*	*			trans	-93.3	112	159.8	-77.1	-80	0	0	0	107.3	L307 F311	L307-Y309 HydrophobicContact CB-CD2 4.1Å; L307-Y309 HydrophobicContact CB-CE2 3.82Å; L307-Y309 HydrophobicContact CD1-CE2 4.48Å; L307-Y309 PolarHBondContact O-N 3.23Å; Y309-F311 WeakPolarHBondContact O-CD2 3.3Å; Y309-F311 PolarHBondContact O-N 3.38Å
310	S	20.6	Very low	22.8	Very low	120 Å²	120	143.1 Å²	143.1	84%	0.839	75%	0.754	S	S	*	*			trans	-65.6	100.6	167	52.4	0	0	0	0	108.5
311	F	25	Very low	22.8	Very low	158 Å²	158	143 Å²	143	69%	0.693	76%	0.758	S	S	*	*			trans	-79.8	119.6	166.3	-72.7	-87.2	0	0	0	108.5	Y309 N313	Y309-F311 WeakPolarHBondContact O-CD2 3.3Å; Y309-F311 PolarHBondContact O-N 3.38Å; F311-N313 PolarHBondContact O-N 2.81Å; F311-N313 VanDerWaalsContact O-N 3.13Å
312	T	20.8	Very low	22.8	Very low	132 Å²	132	139.7 Å²	139.7	81%	0.81	76%	0.755	S	S	*	*			trans	-69	103.3	162.1	34	0	0	0	0	107.9	Y314	T312-Y314 PolarHBondContact O-N 2.88Å
313	N	24.9	Very low	22.8	Very low	111 Å²	111	136.5 Å²	136.5	59%	0.594	76%	0.755	S	S	*	*			trans	-71.5	121.1	178.1	-75.2	-31.7	0	0	0	110.4	F311	F311-N313 PolarHBondContact O-N 2.81Å; F311-N313 VanDerWaalsContact O-N 3.13Å
314	Y	21.1	Very low	22.8	Very low	192 Å²	192	138.2 Å²	138.2	75%	0.753	76%	0.762	S	S	*	*			trans	-88.5	106.7	153.1	-76.7	-86.5	0	0	0	107.6	T312	T312-Y314 PolarHBondContact O-N 2.88Å
315	S	28	Very low	22.8	Very low	93 Å²	93	139.5 Å²	139.5	65%	0.65	77%	0.769	S	S	*	*			trans	-84.8	120.3	171.1	52.4	0	0	0	0	109.9	T317	S315-T317 PolarHBondContact O-N 3Å
316	E	24.2	Very low	22.8	Very low	189 Å²	189	138.9 Å²	138.9	88%	0.883	77%	0.77	S	S	*	*			trans	-73.5	100.7	161.3	-80.9	-177.3	166.8	0	0	108.4
317	T	27.1	Very low	22.7	Very low	104 Å²	104	136.6 Å²	136.6	64%	0.638	77%	0.77	S	S	*	*			trans	-80.6	111.9	169.2	35.9	0	0	0	0	110	S315 L319	S315-T317 PolarHBondContact O-N 3Å; T317-L319 HydrophobicContact CG2-CD1 4.16Å
318	T	22.6	Very low	22.7	Very low	149 Å²	149	139.8 Å²	139.8	91%	0.914	78%	0.779	S	S	*	*			trans	-91	89.9	153.1	43.1	0	0	0	0	107.9
319	L	23.3	Very low	22.8	Very low	145 Å²	145	137.6 Å²	137.6	76%	0.759	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-98.7	117.9	169.5	-93	154.2	0	0	0	108.1	T317	T317-L319 HydrophobicContact CG2-CD1 4.16Å
320	G	21.1	Very low	22.9	Very low	70 Å²	70	135.5 Å²	135.5	72%	0.722	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-61.2	139.7	167.5	0	0	0	0	0	110.3	S322	G320-S322 PolarHBondContact O-N 2.69Å
321	L	19.8	Very low	23.1	Very low	169 Å²	169	136.8 Å²	136.8	89%	0.885	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-56.5	125.3	-179.4	-85.1	88.9	0	0	0	111.2
322	S	21.9	Very low	23.1	Very low	109 Å²	109	138 Å²	138	76%	0.762	78%	0.783	S	S	*	*			trans	-130	110.7	147.2	175.8	0	0	0	0	107.5	G320 T324	G320-S322 PolarHBondContact O-N 2.69Å; S322-T324 PolarHBondContact O-N 2.81Å
323	T	20.5	Very low	23.2	Very low	120 Å²	120	135.6 Å²	135.6	74%	0.736	78%	0.783	S	S	*	*			trans	-66.9	119.2	176.8	43.4	0	0	0	0	111.3
324	T	23.1	Very low	23.1	Very low	131 Å²	131	138.9 Å²	138.9	80%	0.804	80%	0.8	S	S	*	*			trans	-150	125.3	150	45.7	0	0	0	0	110.6	S322	S322-T324 PolarHBondContact O-N 2.81Å
325	N	21.8	Very low	23.2	Very low	169 Å²	169	135.2 Å²	135.2	90%	0.904	80%	0.802	S	S	*	*			trans	-65.2	131.7	176.7	-66.1	-30.5	0	0	0	112.1
326	S	22.8	Very low	22.9	Very low	119 Å²	119	135.6 Å²	135.6	83%	0.832	81%	0.805	S	S	*	*			trans	-167.7	128.9	142.8	52.8	0	0	0	0	112.5
327	V	21.2	Very low	22.7	Very low	131 Å²	131	135.6 Å²	135.6	79%	0.794	81%	0.807	S	S	*	*			trans	-66.4	138.7	173	172.2	0	0	0	0	111.2
328	F	22.5	Very low	22.3	Very low	201 Å²	201	141.4 Å²	141.4	88%	0.882	82%	0.818	S	S	*	*			trans	-167.4	140.4	141.9	-119.2	-84.3	0	0	0	112.9
329	T	22.3	Very low	22.3	Very low	119 Å²	119	140.6 Å²	140.6	73%	0.73	81%	0.813	S	S	*	*			trans	-89.9	164	-175.4	40.9	0	0	0	0	113.8
330	P	25.7	Very low	22.2	Very low	115 Å²	115	139.3 Å²	139.3	75%	0.747	81%	0.811	S	S	*	*			trans	-100.9	156.9	-166.8	38.3	-30.9	0	0	0	114.2
331	D	24.8	Very low	22.3	Very low	147 Å²	147	144.5 Å²	144.5	79%	0.786	82%	0.817	S	S	*	*			trans	-153	129.8	161.9	-98.6	-25.5	0	0	0	115.2
332	H	25.3	Very low	22.4	Very low	184 Å²	184	144.6 Å²	144.6	85%	0.852	81%	0.812	S	S	*	*			trans	64.6	128.8	145.1	-73.1	-70.9	0	0	0	125.3
333	G	24.2	Very low	22.4	Very low	80 Å²	80	149.9 Å²	149.9	83%	0.825	82%	0.817	S	S	*	*			trans	153.8	71.4	144	0	0	0	0	0	117.6
334	L	21.3	Very low	22.4	Very low	180 Å²	180	149.6 Å²	149.6	94%	0.942	82%	0.82	S	S	*	*			trans	-84.8	132.8	171	-106.4	151.6	0	0	0	111.2
335	S	23.5	Very low	22.5	Very low	115 Å²	115	150.7 Å²	150.7	80%	0.804	82%	0.821	S	S	*	*			trans	-155.3	94.7	159.2	172.3	0	0	0	0	111.5
336	S	21.3	Very low	22.5	Very low	102 Å²	102	149.5 Å²	149.5	71%	0.713	82%	0.82	S	S	*	*			trans	33.9	109.2	134.6	173.9	0	0	0	0	119.8
337	M	20.7	Very low	22.5	Very low	188 Å²	188	153.2 Å²	153.2	93%	0.926	82%	0.822	S	S	*	*			trans	-141.9	126	133.3	-156.3	172.2	-83.7	0	0	110.8
338	R	19.3	Very low	22.5	Very low	226 Å²	226	154.4 Å²	154.4	85%	0.853	82%	0.823	S	S	*	*			trans	-91.3	117.1	-171.4	-164.5	-177.5	-161	164.6	3.3	108.4
339	T	23	Very low	22.4	Very low	133 Å²	133	151.6 Å²	151.6	82%	0.816	82%	0.817	S	S	*	*			trans	-131	111.1	159.7	48.1	0	0	0	0	109
340	T	20.6	Very low	22.4	Very low	118 Å²	118	157.3 Å²	157.3	72%	0.724	83%	0.827	S	S	*	*			trans	-82.4	110.3	170.5	36.8	0	0	0	0	108.4
341	E	23.1	Very low	22.1	Very low	178 Å²	178	156.5 Å²	156.5	83%	0.832	82%	0.824	S	S	*	*			trans	-129.6	111.7	159.8	-72.5	-163.6	172.2	0	0	110.1
342	H	21.3	Very low	21.9	Very low	171 Å²	171	159.3 Å²	159.3	79%	0.792	83%	0.83	S	S	*	*			trans	-74.5	117.5	173.4	-83.5	-91.4	0	0	0	109.9
343	Y	22.6	Very low	21.7	Very low	220 Å²	220	156.8 Å²	156.8	86%	0.863	83%	0.827	S	S	*	*			trans	-138.7	126.1	147	-81.4	-75.9	0	0	0	110.7
344	S	20.9	Very low	21.4	Very low	115 Å²	115	159.3 Å²	159.3	80%	0.804	82%	0.822	S	S	*	*			trans	-74.6	116.4	-172.2	18.2	0	0	0	0	111.7
345	N	24	Very low	21.5	Very low	153 Å²	153	160.5 Å²	160.5	82%	0.818	82%	0.815	S	S	*	*			trans	-104.2	119.3	157.5	-85.8	-16.7	0	0	0	109.1
346	T	23	Very low	21.4	Very low	145 Å²	145	159.9 Å²	159.9	89%	0.89	81%	0.811	S	S	*	*			trans	-61.3	124.1	173.8	24.4	0	0	0	0	111.1
347	F	21.2	Very low	21.4	Very low	197 Å²	197	163.4 Å²	163.4	86%	0.864	82%	0.816	S	S	*	*			trans	-77.4	152	165.7	-82.8	-95.7	0	0	0	111.4
348	L	22.5	Very low	21.5	Very low	156 Å²	156	160.1 Å²	160.1	82%	0.817	81%	0.807	S	S	*	*			trans	159.3	132.3	150.9	-85.5	155.1	0	0	0	106.5
349	N	20.7	Very low	21.7	Very low	142 Å²	142	156 Å²	156	76%	0.759	81%	0.807	S	S	*	*			cis	-163.8	131.3	-5.6	-118.8	-3.2	0	0	0	104.6
350	Y	22.6	Very low	21.6	Very low	238 Å²	238	157.8 Å²	157.8	93%	0.933	81%	0.811	S	S	*	*			trans	-117.1	114.7	161.8	-82	-80.9	0	0	0	108.2
351	S	19.2	Very low	21.8	Very low	99 Å²	99	154.5 Å²	154.5	69%	0.692	80%	0.8	S	S	*	*			trans	-95.2	118	158.4	55.3	0	0	0	0	107.7
352	F	20.6	Very low	21.9	Very low	206 Å²	206	152 Å²	152	90%	0.904	80%	0.799	S	S	*	*				-175.3	147.2	128.1	-92.5	-69.6	0	0	0	109.7
353	T	19.6	Very low	22	Very low	130 Å²	130	147.8 Å²	147.8	80%	0.798	79%	0.789	S	S	*	*			trans	-80.2	143.5	-158.9	36.7	0	0	0	0	116.4
354	N	19.5	Very low	22.3	Very low	134 Å²	134	142.5 Å²	142.5	72%	0.717	78%	0.78	S	S	*	*			trans	-0.4	141.9	162.8	-64.9	-14.9	0	0	0	119.8
355	Y	21.9	Very low	22.6	Very low	204 Å²	204	141.2 Å²	141.2	80%	0.8	77%	0.767	S	S	*	*				-152.1	141.2	51	-89.6	-93.3	0	0	0	114.8
356	S	21.1	Very low	22.9	Very low	102 Å²	102	136.9 Å²	136.9	71%	0.713	74%	0.744	S	S	*	*			trans	45.5	131.7	150.1	57.3	0	0	0	0	120.1
357	E	22.7	Very low	23.1	Very low	177 Å²	177	134 Å²	134	83%	0.827	73%	0.727	S	S	*	*			cis	-161.7	140	17.8	-116	167.8	-173.6	0	0	109.1
358	T	21.6	Very low	23.8	Very low	119 Å²	119	126.4 Å²	126.4	73%	0.73	69%	0.693	S	S	*	*			trans	19	134.3	147.2	47	0	0	0	0	120.2
359	T	24	Very low	24.2	Very low	138 Å²	138	125.7 Å²	125.7	85%	0.847	69%	0.69	S	S	*	*			cis	-163	154.9	43.6	-1.8	0	0	0	0	112.4
360	L	21.8	Very low	25.2	Very low	172 Å²	172	124.1 Å²	124.1	90%	0.901	67%	0.674	S	S	*	*			trans	-76	147.8	-171.3	-75.9	79.9	0	0	0	116.5
361	G	24.2	Very low	25.8	Very low	49 Å²	49	119.5 Å²	119.5	51%	0.505	66%	0.659	S	S	.	*			trans	-159.8	134.1	150.2	0	0	0	0	0	109.5	S363	G361-S363 PolarHBondContact O-N 3.23Å
362	P	24.4	Very low	26.5	Very low	125 Å²	125	117.5 Å²	117.5	81%	0.812	64%	0.643	S	S	*	*			trans	-82.1	94.6	-165.6	32.9	-31.7	0	0	0	110.8
363	S	24.9	Very low	27.1	Very low	83 Å²	83	111.2 Å²	111.2	58%	0.58	62%	0.617	S	S	*	*			trans	-77.4	118.2	156.2	151.9	0	0	0	0	107.7	G361 T365	G361-S363 PolarHBondContact O-N 3.23Å; S363-T365 PolarHBondContact O-N 3.29Å; S363-T365 PolarHBondContact O-OG1 3.19Å; S363-T365 PolarHBondContact OG-N 2.92Å
364	T	27.8	Very low	27.6	Very low	108 Å²	108	113.6 Å²	113.6	66%	0.663	62%	0.617	S	S	*	*			trans	-67.3	79.6	158.8	49.1	0	0	0	0	108.1	N366	T364-N366 VanDerWaalsContact C-N 3.33Å; T364-N366 PolarHBondContact O-N 2.86Å
365	T	27.6	Very low	28.3	Very low	88 Å²	88	115 Å²	115	54%	0.54	62%	0.624	S	S	.	*			trans	-69.4	95.4	164.8	21.9	0	0	0	0	106.8	S363 T367	S363-T365 PolarHBondContact O-N 3.29Å; S363-T365 PolarHBondContact O-OG1 3.19Å; S363-T365 PolarHBondContact OG-N 2.92Å; T365-T367 VanDerWaalsContact C-N 3.29Å; T365-T367 PolarHBondContact O-N 3.09Å
366	N	30.8	Very low	28.5	Very low	63 Å²	63	108 Å²	108	34%	0.337	61%	0.614	S	S	.	*			trans	-62.6	100.1	160.5	-76.2	-8	0	0	0	106.6	T364 F368	T364-N366 VanDerWaalsContact C-N 3.33Å; T364-N366 PolarHBondContact O-N 2.86Å; N366-F368 HydrophobicContact CB-CD2 4.24Å; N366-F368 HydrophobicContact CB-CE2 3.96Å; N366-F368 PolarHBondContact O-N 2.81Å
367	T	27.3	Very low	28.9	Very low	85 Å²	85	106.2 Å²	106.2	52%	0.521	60%	0.596	S	S	.	*			trans	-76.2	104.7	176.7	12.9	0	0	0	0	107.5	N202 T365	N202-T367 PolarHBondContact ND2-O 3.12Å; T365-T367 VanDerWaalsContact C-N 3.29Å; T365-T367 PolarHBondContact O-N 3.09Å
368	F	34	Very low	29.3	Very low	37 Å²	37	105.1 Å²	105.1	16%	0.162	59%	0.591	C	S	.	*			trans	-86.1	151.3	171.1	-84.1	-101.2	0	0	0	110.6	I165 N183 N366 Y370	I165-F368 HydrophobicContact CD1-CD2 3.81Å; I165-F368 HydrophobicContact CD1-CE2 3.95Å; I165-F368 HydrophobicContact CD1-CG 4.35Å; I165-F368 HydrophobicContact CG1-CD2 4.06Å; I165-F368 HydrophobicContact CG1-CE2 4.32Å; N183-F368 HydrophobicContact CB-CD1 4.35Å; N183-F368 HydrophobicContact CB-CE1 3.5Å; N183-F368 VanDerWaalsContact CB-CE1 3.5Å; N183-F368 HydrophobicContact CB-CZ 4.13Å; N183-F368 VanDerWaalsContact CG-CD1 3.45Å; N183-F368 WeakPolarHBondContact ND2-CE1 3.36Å; N183-F368 VanDerWaalsContact ND2-CZ 3.34Å; N183-F368 WeakPolarHBondContact ND2-CZ 3.21Å; N183-F368 VanDerWaalsContact OD1-CD1 3.29Å; N183-F368 WeakPolarHBondContact OD1-CD1 3.36Å; N183-F368 VanDerWaalsContact OD1-CE1 3.29Å; N183-F368 WeakPolarHBondContact OD1-CE1 3.42Å; N366-F368 HydrophobicContact CB-CD2 4.24Å; N366-F368 HydrophobicContact CB-CE2 3.96Å; N366-F368 PolarHBondContact O-N 2.81Å; F368-Y370 VanDerWaalsContact O-CD1 3.23Å; F368-Y370 WeakPolarHBondContact O-CD1 3.5Å; F368-Y370 PolarHBondContact O-N 2.86Å
369	N	32.9	Very low	29.9	Very low	141 Å²	141	104.8 Å²	104.8	75%	0.754	59%	0.589	S	S	*	*			trans	-70.7	97.5	170.8	-72.5	-32.3	0	0	0	109.1
370	Y	40.7	Very low	30.3	Very low	109 Å²	109	103.5 Å²	103.5	43%	0.427	58%	0.577	S	S	.	*			trans	-97.5	144.7	166.8	56.8	-89.7	0	0	0	108.8	M171 F368 T372	M171-Y370 HydrophobicContact CE-CE2 3.84Å; M171-Y370 HydrophobicContact SD-CE2 4Å; F368-Y370 VanDerWaalsContact O-CD1 3.23Å; F368-Y370 WeakPolarHBondContact O-CD1 3.5Å; F368-Y370 PolarHBondContact O-N 2.86Å; Y370-T372 HydrophobicContact CD2-CG2 4.33Å
371	K	35.4	Very low	30.9	Very low	140 Å²	140	101.1 Å²	101.1	61%	0.609	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115.1	123.9	172	-159.8	174.9	-177	-178.4	0	107.4
372	T	33.5	Very low	31.6	Very low	58 Å²	58	100.5 Å²	100.5	36%	0.356	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	128	172.1	44.2	0	0	0	0	108.3	M171 Y370	M171-T372 HydrophobicContact SD-CG2 3.75Å; Y370-T372 HydrophobicContact CD2-CG2 4.33Å
373	M	32.6	Very low	32.1	Very low	73 Å²	73	96 Å²	96	36%	0.36	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.9	170	-62.4	-137.4	-144.9	0	0	108.4	L377	M373-L377 HydrophobicContact CB-CD1 3.22Å; M373-L377 HydrophobicContact CE-CD1 3.76Å; M373-L377 HydrophobicContact CE-CG 4.4Å; M373-L377 HydrophobicContact CG-CD1 3.39Å; M373-L377 HydrophobicContact SD-CD1 3.2Å; M373-L377 WeakPolarHBondContact SD-CD1 3.48Å; M373-L377 HydrophobicContact SD-CG 4.18Å
374	K	31.7	Very low	32.7	Very low	181 Å²	181	96.5 Å²	96.5	79%	0.787	52%	0.52	S	S	*	.			trans	-99.7	121.8	177.4	-145.7	179.5	-173.9	-177.5	0	107.5	G376	K374-G376 PolarHBondContact O-N 2.92Å
375	N	34	Very low	32.9	Very low	163 Å²	163	96 Å²	96	87%	0.872	51%	0.509	S	S	*	.	S	Bend	trans	53.8	48.7	170.7	-63.5	-7.3	0	0	0	116.4
376	G	25.7	Very low	33.4	Very low	58 Å²	58	94.1 Å²	94.1	60%	0.598	50%	0.495	S	S	*	.			trans	176.7	68.2	175.9	0	0	0	0	0	114.8	K374	K374-G376 PolarHBondContact O-N 2.92Å
377	L	28.1	Very low	33.6	Very low	63 Å²	63	97.1 Å²	97.1	33%	0.33	50%	0.502	S	S	.	.			trans	-128.9	128	152	-96.6	95.9	0	0	0	108.8	M373 T379 Q381	M373-L377 HydrophobicContact CB-CD1 3.22Å; M373-L377 HydrophobicContact CE-CD1 3.76Å; M373-L377 HydrophobicContact CE-CG 4.4Å; M373-L377 HydrophobicContact CG-CD1 3.39Å; M373-L377 HydrophobicContact SD-CD1 3.2Å; M373-L377 WeakPolarHBondContact SD-CD1 3.48Å; M373-L377 HydrophobicContact SD-CG 4.18Å; L377-T379 PolarHBondContact O-N 3.17Å; L377-Q381 HydrophobicContact CD2-CB 3.96Å; L377-Q381 HydrophobicContact CD2-CG 4.05Å
378	Q	32.4	Very low	33.7	Very low	155 Å²	155	99.7 Å²	99.7	72%	0.724	51%	0.512	S	S	*	.			trans	-50.3	132.5	154.7	-72.4	179.6	-11.3	0	0	107.6	N380	Q378-N380 HydrophobicContact CB-CB 4.34Å; Q378-N380 PolarHBondContact O-N 3.31Å; Q378-N380 PolarHBondContact OE1-ND2 3.04Å; Q378-N380 VanDerWaalsContact OE1-ND2 3.13Å
379	T	34	Very low	33.6	Very low	112 Å²	112	104.9 Å²	104.9	69%	0.687	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	12.8	176.5	47.3	0	0	0	0	115	L377	L377-T379 PolarHBondContact O-N 3.17Å
380	N	32	Very low	33.4	Very low	111 Å²	111	106.4 Å²	106.4	59%	0.594	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-9.3	-172.4	-61.7	-16	0	0	0	113.4	Q378	Q378-N380 HydrophobicContact CB-CB 4.34Å; Q378-N380 PolarHBondContact O-N 3.31Å; Q378-N380 PolarHBondContact OE1-ND2 3.04Å; Q378-N380 VanDerWaalsContact OE1-ND2 3.13Å
381	Q	34.7	Very low	32.9	Very low	121 Å²	121	107.8 Å²	107.8	57%	0.565	55%	0.552	S	S	*	*	S	Bend	trans	-96.8	-26.6	175.2	-74.8	-161	-27.6	0	0	114.4	L377	L377-Q381 HydrophobicContact CD2-CB 3.96Å; L377-Q381 HydrophobicContact CD2-CG 4.05Å
382	L	38	Very low	32.6	Very low	37 Å²	37	108.5 Å²	108.5	19%	0.194	56%	0.561	C	S	.	*	S	Bend	trans	-71.6	143.7	160.4	-79.2	148.4	0	0	0	106.8	I114 S384 I386	I114-L382 HydrophobicContact CD1-CD2 3.34Å; L382-S384 PolarHBondContact O-N 3.46Å; L382-I386 HydrophobicContact CB-CD1 4.37Å; L382-I386 HydrophobicContact CD2-CD1 3.76Å
383	P	35.5	Very low	32.4	Very low	30 Å²	30	112.5 Å²	112.5	20%	0.195	58%	0.58	C	S	.	*			trans	-46.2	118.5	171.8	-24.2	30.8	0	0	0	108	F87 F385 I386	F87-P383 HydrophobicContact CD1-CG 4.39Å; F87-P383 HydrophobicContact CE1-CB 4.29Å; F87-P383 HydrophobicContact CE1-CG 4.05Å; F87-P383 HydrophobicContact CE2-CG 4.49Å; F87-P383 HydrophobicContact CZ-CB 4.17Å; F87-P383 HydrophobicContact CZ-CG 4.1Å; P383-F385 HydrophobicContact CB-CB 4.44Å; P383-F385 PolarHBondContact O-N 2.82Å; P383-I386 HydrophobicContact CG-CD1 4.46Å; P383-I386 PolarHBondContact O-N 2.83Å
384	S	37.3	Very low	32.1	Very low	93 Å²	93	116.2 Å²	116.2	65%	0.65	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	-0.3	-178.6	49.9	0	0	0	0	113.5	L382	L382-S384 PolarHBondContact O-N 3.46Å
385	F	32.4	Very low	32.1	Very low	99 Å²	99	112.5 Å²	112.5	43%	0.434	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88	-15.8	176.4	-119.4	-108.2	0	0	0	115.5	M82 P383 W387	M82-F385 HydrophobicContact CE-CD1 3.77Å; M82-F385 HydrophobicContact CE-CE1 4.2Å; M82-F385 HydrophobicContact SD-CD1 4.41Å; P383-F385 HydrophobicContact CB-CB 4.44Å; P383-F385 PolarHBondContact O-N 2.82Å; F385-W387 PolarHBondContact O-N 3.48Å
386	I	37.3	Very low	31.8	Very low	48 Å²	48	108.3 Å²	108.3	25%	0.246	59%	0.593	C	S	.	*	T	Hydrogen-bonded Turn	trans	-57.2	-36.1	-166.1	-86	177.3	0	0	0	111.6	I114 L382 P383	I114-I386 HydrophobicContact CD1-CD1 3.4Å; I114-I386 HydrophobicContact CG1-CD1 4.25Å; L382-I386 HydrophobicContact CB-CD1 4.37Å; L382-I386 HydrophobicContact CD2-CD1 3.76Å; P383-I386 HydrophobicContact CG-CD1 4.46Å; P383-I386 PolarHBondContact O-N 2.83Å
387	W	36.8	Very low	32.1	Very low	126 Å²	126	111.8 Å²	111.8	48%	0.477	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-156	57.4	170.4	-72	90.9	0	0	0	113.3	E80 K91 I93 F385 N389	E80-W387 VanDerWaalsContact OE1-CH2 3.29Å; E80-W387 WeakPolarHBondContact OE1-CH2 3.46Å; E80-W387 WeakPolarHBondContact OE2-CH2 3.02Å; E80-W387 WeakPolarHBondContact OE2-CZ2 3.45Å; K91-W387 HydrophobicContact CD-CZ2 3.67Å; K91-W387 VanDerWaalsContact NZ-CE2 3.34Å; K91-W387 VanDerWaalsContact NZ-NE1 3.19Å; I93-W387 HydrophobicContact CG2-CZ2 4.44Å; F385-W387 PolarHBondContact O-N 3.48Å; W387-N389 PolarHBondContact O-N 3.19Å
388	N	28.2	Very low	32.3	Very low	138 Å²	138	114.5 Å²	114.5	74%	0.738	62%	0.621	S	S	*	*			trans	-75.5	109.8	156.1	-117.5	-2.8	0	0	0	106.4	R390	N388-R390 PolarHBondContact O-N 3.48Å
389	N	31.4	Very low	32.4	Very low	146 Å²	146	113.5 Å²	113.5	78%	0.781	62%	0.62	S	S	*	*			trans	-45.5	90.7	162.4	-105.2	-19.1	0	0	0	107.7	W387 N391	W387-N389 PolarHBondContact O-N 3.19Å; N389-N391 PolarHBondContact O-N 3.37Å
390	R	29.7	Very low	32.7	Very low	174 Å²	174	112.4 Å²	112.4	66%	0.657	62%	0.615	S	S	*	*			trans	-71.5	91.8	164.7	-111.7	-169.5	-87.2	-177.2	-4.4	104.2	N388 I392	N388-R390 PolarHBondContact O-N 3.48Å; R390-I392 PolarHBondContact O-N 2.85Å
391	N	29.2	Very low	33.3	Very low	138 Å²	138	114.7 Å²	114.7	74%	0.738	63%	0.626	S	S	*	*			trans	-0.7	89.1	161	-74	-31.4	0	0	0	112.1	N389 N393	N389-N391 PolarHBondContact O-N 3.37Å; N391-N393 VanDerWaalsContact C-N 3.28Å; N391-N393 PolarHBondContact O-N 3.06Å; N391-N393 VanDerWaalsContact O-N 3.14Å
392	I	29.3	Very low	34	Very low	155 Å²	155	117.7 Å²	117.7	80%	0.795	63%	0.634	S	S	*	*			trans	-59.3	113.6	137.5	-63.6	173.9	0	0	0	102.2	R390 N394	R390-I392 PolarHBondContact O-N 2.85Å; I392-N394 VanDerWaalsContact C-N 3.29Å; I392-N394 PolarHBondContact O-N 2.68Å
393	N	29.1	Very low	34.7	Very low	141 Å²	141	119.2 Å²	119.2	75%	0.754	65%	0.648	S	S	*	*			trans	-41.6	101.2	172.2	-70.7	-38.4	0	0	0	108.1	N391 S395	N391-N393 VanDerWaalsContact C-N 3.28Å; N391-N393 PolarHBondContact O-N 3.06Å; N391-N393 VanDerWaalsContact O-N 3.14Å; N393-S395 PolarHBondContact O-N 2.79Å
394	N	28.2	Very low	35.5	Very low	152 Å²	152	126.2 Å²	126.2	81%	0.813	68%	0.675	S	S	*	*			trans	-59.3	99.6	155.5	-90.8	-18.9	0	0	0	103.4	I392 G396	I392-N394 VanDerWaalsContact C-N 3.29Å; I392-N394 PolarHBondContact O-N 2.68Å; N394-G396 PolarHBondContact O-N 3.43Å
395	S	30	Very low	36.6	Very low	102 Å²	102	127.3 Å²	127.3	71%	0.713	67%	0.673	S	S	*	*			trans	-46.2	107.3	143.7	38.3	0	0	0	0	105.6	N393 I397	N393-S395 PolarHBondContact O-N 2.79Å; S395-I397 PolarHBondContact O-N 3.34Å
396	G	27.7	Very low	38.2	Very low	75 Å²	75	127.5 Å²	127.5	77%	0.773	68%	0.678	S	S	*	*			trans	-57.7	101	178.1	0	0	0	0	0	108.8	N394	N394-G396 PolarHBondContact O-N 3.43Å
397	I	32.5	Very low	39.8	Very low	131 Å²	131	130.9 Å²	130.9	67%	0.672	69%	0.694	S	S	*	*			trans	-130.2	90.3	153.3	-53.5	179.6	0	0	0	105	S395 L399	S395-I397 PolarHBondContact O-N 3.34Å; I397-L399 VanDerWaalsContact C-N 3.28Å; I397-L399 HydrophobicContact CG2-CD1 3.98Å; I397-L399 HydrophobicContact CG2-CG 3.94Å; I397-L399 PolarHBondContact O-N 2.92Å
398	S	33	Very low	41.8	Very low	121 Å²	121	128.4 Å²	128.4	85%	0.846	69%	0.694	S	S	*	*			trans	-64.2	92.1	163.6	56.6	0	0	0	0	108.2
399	L	33.7	Very low	44.3	Very low	134 Å²	134	125.9 Å²	125.9	70%	0.702	68%	0.679	S	S	*	*			trans	-82.8	125.3	165.5	-84.9	147.1	0	0	0	108	I397	I397-L399 VanDerWaalsContact C-N 3.28Å; I397-L399 HydrophobicContact CG2-CD1 3.98Å; I397-L399 HydrophobicContact CG2-CG 3.94Å; I397-L399 PolarHBondContact O-N 2.92Å
400	P	40.7	Very low	46.8	Very low	89 Å²	89	121.6 Å²	121.6	58%	0.578	67%	0.665	S	S	*	*			trans	-69.8	145.6	-173.8	28.5	-32.3	0	0	0	110.4	Y402 S403	P400-Y402 PolarHBondContact O-N 3.24Å; P400-S403 PolarHBondContact O-N 3.39Å
401	L	44.4	Very low	49.5	Very low	158 Å²	158	118.1 Å²	118.1	83%	0.827	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.6	-3.7	177.5	-84.8	138.4	0	0	0	115.7	S403	L401-S403 VanDerWaalsContact C-N 3.31Å; L401-S403 PolarHBondContact O-N 2.82Å
402	Y	49	Very low	52.4	Low	184 Å²	184	114 Å²	114	72%	0.722	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-19.2	172.8	-101.5	-90	0	0	0	114.4	P400 F404 L406	P400-Y402 PolarHBondContact O-N 3.24Å; Y402-F404 PolarHBondContact O-N 3.09Å; Y402-L406 HydrophobicContact CD1-CD1 4.27Å
403	S	52.8	Low	55.4	Low	70 Å²	70	111.2 Å²	111.2	49%	0.49	63%	0.629	S	S	.	*	H	α-helix	trans	-79.2	-17.8	-174.6	-135.7	0	0	0	0	114.6	P400 L401	P400-S403 PolarHBondContact O-N 3.39Å; L401-S403 VanDerWaalsContact C-N 3.31Å; L401-S403 PolarHBondContact O-N 2.82Å
404	F	53.4	Low	58.3	Low	176 Å²	176	109.3 Å²	109.3	77%	0.772	62%	0.618	S	S	*	*	H	α-helix	trans	-85.9	-17.4	-178.2	-76.8	-80.4	0	0	0	114.2	Y402 P408	Y402-F404 PolarHBondContact O-N 3.09Å; F404-P408 VanDerWaalsContact O-CD 3.26Å; F404-P408 WeakPolarHBondContact O-CD 3.25Å
405	I	60.6	Low	61.4	Low	117 Å²	117	108 Å²	108	60%	0.6	61%	0.606	S	S	*	*	H	α-helix	trans	-97.6	-34.2	178.1	-58.2	175.2	0	0	0	111	P408 I409	I405-P408 WeakPolarHBondContact O-CD 3.45Å; I405-P408 WeakPolarHBondContact O-CG 3.48Å; I405-I409 HydrophobicContact CG2-CD1 3.92Å; I405-I409 WeakPolarHBondContact O-CD1 3.32Å; I405-I409 VanDerWaalsContact O-CG1 3.32Å; I405-I409 WeakPolarHBondContact O-CG1 3.37Å
406	L	65.2	Low	64.4	Low	103 Å²	103	108.9 Å²	108.9	54%	0.539	60%	0.602	S	S	.	*	H	α-helix	trans	-72.1	-30.4	-179.2	-77.4	165	0	0	0	113.4	Y402 I409 A410	Y402-L406 HydrophobicContact CD1-CD1 4.27Å; L406-I409 PolarHBondContact O-N 2.9Å; L406-A410 VanDerWaalsContact O-CB 3.29Å; L406-A410 WeakPolarHBondContact O-CB 3.49Å; L406-A410 PolarHBondContact O-N 3.21Å
407	M	71.7	Confident	67.5	Low	119 Å²	119	108.9 Å²	108.9	59%	0.586	59%	0.587	S	S	*	*	H	α-helix	trans	-66.6	-48.5	-177.9	-132.9	-98.6	155.8	0	0	113.4	I409 A410 L411	M407-I409 VanDerWaalsContact C-N 3.32Å; M407-I409 PolarHBondContact O-N 3.04Å; M407-A410 PolarHBondContact O-N 2.03Å; M407-L411 HydrophobicContact CE-CD1 4.42Å; M407-L411 WeakPolarHBondContact O-CG 3.41Å; M407-L411 PolarHBondContact O-N 2.83Å; M407-L411 HydrophobicContact SD-CD1 3.94Å; M407-L411 HydrophobicContact SD-CG 4.45Å
408	P	78	Confident	70.4	Confident	74 Å²	74	107 Å²	107	48%	0.481	58%	0.578	S	S	.	*	H	α-helix	trans	-66.5	-32.4	174.2	22	-30.3	0	0	0	112.9	F404 I405 L411 A412	F404-P408 VanDerWaalsContact O-CD 3.26Å; F404-P408 WeakPolarHBondContact O-CD 3.25Å; I405-P408 WeakPolarHBondContact O-CD 3.45Å; I405-P408 WeakPolarHBondContact O-CG 3.48Å; P408-L411 PolarHBondContact O-N 3.37Å; P408-A412 VanDerWaalsContact O-CB 3.31Å; P408-A412 WeakPolarHBondContact O-CB 3.46Å; P408-A412 PolarHBondContact O-N 2.84Å
409	I	81.5	Confident	73.2	Confident	84 Å²	84	106 Å²	106	43%	0.431	56%	0.561	S	S	.	*	H	α-helix	trans	-67.7	-43.5	175.3	-64.7	171.6	0	0	0	110.7	I405 L406 M407 L411 A412 I413	I405-I409 HydrophobicContact CG2-CD1 3.92Å; I405-I409 WeakPolarHBondContact O-CD1 3.32Å; I405-I409 VanDerWaalsContact O-CG1 3.32Å; I405-I409 WeakPolarHBondContact O-CG1 3.37Å; L406-I409 PolarHBondContact O-N 2.9Å; M407-I409 VanDerWaalsContact C-N 3.32Å; M407-I409 PolarHBondContact O-N 3.04Å; I409-L411 PolarHBondContact O-N 2.93Å; I409-A412 PolarHBondContact O-N 2.77Å; I409-I413 HydrophobicContact CG2-CD1 3.84Å; I409-I413 HydrophobicContact CG2-CG1 4.43Å; I409-I413 VanDerWaalsContact O-CG1 3.27Å; I409-I413 WeakPolarHBondContact O-CG1 3.13Å; I409-I413 PolarHBondContact O-N 3.4Å
410	A	82.6	Confident	75.9	Confident	57 Å²	57	103 Å²	103	47%	0.471	55%	0.55	S	S	.	*	H	α-helix	trans	-63.5	-41	176.7	0	0	0	0	0	111.8	L406 M407 I413 L414	L406-A410 VanDerWaalsContact O-CB 3.29Å; L406-A410 WeakPolarHBondContact O-CB 3.49Å; L406-A410 PolarHBondContact O-N 3.21Å; M407-A410 PolarHBondContact O-N 2.03Å; A410-I413 PolarHBondContact O-N 3.2Å; A410-L414 WeakPolarHBondContact O-CB 3.04Å; A410-L414 PolarHBondContact O-N 3.12Å
411	L	87.1	Confident	78.3	Confident	101 Å²	101	102.4 Å²	102.4	53%	0.529	55%	0.545	S	S	.	.	H	α-helix	trans	-65.6	-39.7	174.4	-71.2	173.9	0	0	0	112.1	M407 P408 I409 L414 F415	M407-L411 HydrophobicContact CE-CD1 4.42Å; M407-L411 WeakPolarHBondContact O-CG 3.41Å; M407-L411 PolarHBondContact O-N 2.83Å; M407-L411 HydrophobicContact SD-CD1 3.94Å; M407-L411 HydrophobicContact SD-CG 4.45Å; P408-L411 PolarHBondContact O-N 3.37Å; I409-L411 PolarHBondContact O-N 2.93Å; L411-L414 PolarHBondContact O-N 3.07Å; L411-F415 WeakPolarHBondContact O-CB 3.38Å; L411-F415 PolarHBondContact O-N 2.85Å
412	A	89.6	Confident	80.5	Confident	50 Å²	50	99.9 Å²	99.9	41%	0.413	53%	0.532	S	S	.	.	H	α-helix	trans	-64.5	-42.6	175.2	0	0	0	0	0	112.1	P408 I409 F415 L416	P408-A412 VanDerWaalsContact O-CB 3.31Å; P408-A412 WeakPolarHBondContact O-CB 3.46Å; P408-A412 PolarHBondContact O-N 2.84Å; I409-A412 PolarHBondContact O-N 2.77Å; A412-F415 PolarHBondContact O-N 3.15Å; A412-L416 WeakPolarHBondContact O-CB 3.46Å; A412-L416 VanDerWaalsContact O-CG 3.31Å; A412-L416 WeakPolarHBondContact O-CG 3.48Å; A412-L416 PolarHBondContact O-N 3.44Å
413	I	92.1	Very high	82.5	Confident	97 Å²	97	99 Å²	99	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-63.3	-44.3	174.9	-67.5	166.6	0	0	0	110.2	I409 A410 F415 L416 T417	I409-I413 HydrophobicContact CG2-CD1 3.84Å; I409-I413 HydrophobicContact CG2-CG1 4.43Å; I409-I413 VanDerWaalsContact O-CG1 3.27Å; I409-I413 WeakPolarHBondContact O-CG1 3.13Å; I409-I413 PolarHBondContact O-N 3.4Å; A410-I413 PolarHBondContact O-N 3.2Å; I413-F415 VanDerWaalsContact C-N 3.33Å; I413-F415 PolarHBondContact O-N 2.95Å; I413-L416 PolarHBondContact O-N 2.93Å; I413-T417 HydrophobicContact CG2-CG2 4.37Å; I413-T417 WeakPolarHBondContact O-CG2 3.03Å; I413-T417 PolarHBondContact O-N 3.07Å; I413-T417 PolarHBondContact O-OG1 3.01Å
414	L	91.2	Very high	84.2	Confident	102 Å²	102	99.6 Å²	99.6	53%	0.534	53%	0.525	S	S	.	.	H	α-helix	trans	-63.6	-41	179.3	-158	143.2	0	0	0	111	A410 L411 T417 L418	A410-L414 WeakPolarHBondContact O-CB 3.04Å; A410-L414 PolarHBondContact O-N 3.12Å; L411-L414 PolarHBondContact O-N 3.07Å; L414-T417 WeakPolarHBondContact CA-OG1 3.47Å; L414-T417 PolarHBondContact O-N 3.32Å; L414-T417 PolarHBondContact O-OG1 3.38Å; L414-L418 HydrophobicContact CD2-CD1 3.77Å; L414-L418 HydrophobicContact CD2-CG 4.38Å; L414-L418 WeakPolarHBondContact O-CG 3.17Å; L414-L418 PolarHBondContact O-N 2.98Å
415	F	92.7	Very high	85.8	Confident	124 Å²	124	95.2 Å²	95.2	54%	0.544	52%	0.515	S	S	.	.	H	α-helix	trans	-63.8	-42.4	174.1	-161.1	-92.9	0	0	0	112.5	L411 A412 I413 L418 M419	L411-F415 WeakPolarHBondContact O-CB 3.38Å; L411-F415 PolarHBondContact O-N 2.85Å; A412-F415 PolarHBondContact O-N 3.15Å; I413-F415 VanDerWaalsContact C-N 3.33Å; I413-F415 PolarHBondContact O-N 2.95Å; F415-L418 PolarHBondContact O-N 3.26Å; F415-M419 HydrophobicContact CD1-CE 4.39Å; F415-M419 HydrophobicContact CD1-CG 4.11Å; F415-M419 HydrophobicContact CE1-CE 3.46Å; F415-M419 VanDerWaalsContact CE1-CE 3.46Å; F415-M419 HydrophobicContact CE1-CG 3.98Å; F415-M419 HydrophobicContact CE2-CE 4.35Å; F415-M419 HydrophobicContact CZ-CE 3.43Å; F415-M419 VanDerWaalsContact CZ-CE 3.43Å; F415-M419 WeakPolarHBondContact O-CG 3.21Å; F415-M419 PolarHBondContact O-N 3.48Å
416	L	93.2	Very high	87	Confident	120 Å²	120	94.5 Å²	94.5	63%	0.628	51%	0.511	S	S	*	.	H	α-helix	trans	-63.8	-41.3	175.5	-75.7	167.5	0	0	0	112.1	A412 I413 M419 C420	A412-L416 WeakPolarHBondContact O-CB 3.46Å; A412-L416 VanDerWaalsContact O-CG 3.31Å; A412-L416 WeakPolarHBondContact O-CG 3.48Å; A412-L416 PolarHBondContact O-N 3.44Å; I413-L416 PolarHBondContact O-N 2.93Å; L416-M419 PolarHBondContact O-N 2.82Å; L416-C420 WeakPolarHBondContact O-CB 3.17Å; L416-C420 PolarHBondContact O-N 2.93Å
417	T	92.7	Very high	87.9	Confident	75 Å²	75	95.2 Å²	95.2	46%	0.46	51%	0.507	S	S	.	.	H	α-helix	trans	-66.2	-39.4	176.3	60.9	0	0	0	0	112	I413 L414 C420 T421	I413-T417 HydrophobicContact CG2-CG2 4.37Å; I413-T417 WeakPolarHBondContact O-CG2 3.03Å; I413-T417 PolarHBondContact O-N 3.07Å; I413-T417 PolarHBondContact O-OG1 3.01Å; L414-T417 WeakPolarHBondContact CA-OG1 3.47Å; L414-T417 PolarHBondContact O-N 3.32Å; L414-T417 PolarHBondContact O-OG1 3.38Å; T417-C420 PolarHBondContact O-N 3.46Å; T417-T421 VanDerWaalsContact O-CG2 3.31Å; T417-T421 WeakPolarHBondContact O-CG2 3.45Å; T417-T421 PolarHBondContact O-N 3.21Å; T417-T421 PolarHBondContact O-OG1 3.03Å; T417-T421 VanDerWaalsContact O-OG1 3.12Å
418	L	93.3	Very high	88.3	Confident	92 Å²	92	96.8 Å²	96.8	48%	0.482	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-46	173	-78	171.7	0	0	0	111.5	L414 F415 C420 T421 L422	L414-L418 HydrophobicContact CD2-CD1 3.77Å; L414-L418 HydrophobicContact CD2-CG 4.38Å; L414-L418 WeakPolarHBondContact O-CG 3.17Å; L414-L418 PolarHBondContact O-N 2.98Å; F415-L418 PolarHBondContact O-N 3.26Å; L418-C420 VanDerWaalsContact C-N 3.33Å; L418-C420 PolarHBondContact O-N 3.45Å; L418-T421 WeakPolarHBondContact CA-OG1 3.4Å; L418-T421 PolarHBondContact O-N 3.02Å; L418-T421 PolarHBondContact O-OG1 2.93Å; L418-L422 WeakPolarHBondContact O-CB 3.36Å; L418-L422 PolarHBondContact O-N 3.17Å
419	M	91.9	Very high	88.1	Confident	101 Å²	101	103 Å²	103	50%	0.498	53%	0.525	S	S	.	.	H	α-helix	trans	-62.1	-40.6	176.1	-73.6	-64.1	171.9	0	0	112.2	F415 L416 L422 W423	F415-M419 HydrophobicContact CD1-CE 4.39Å; F415-M419 HydrophobicContact CD1-CG 4.11Å; F415-M419 HydrophobicContact CE1-CE 3.46Å; F415-M419 VanDerWaalsContact CE1-CE 3.46Å; F415-M419 HydrophobicContact CE1-CG 3.98Å; F415-M419 HydrophobicContact CE2-CE 4.35Å; F415-M419 HydrophobicContact CZ-CE 3.43Å; F415-M419 VanDerWaalsContact CZ-CE 3.43Å; F415-M419 WeakPolarHBondContact O-CG 3.21Å; F415-M419 PolarHBondContact O-N 3.48Å; L416-M419 PolarHBondContact O-N 2.82Å; M419-L422 PolarHBondContact O-N 2.94Å; M419-W423 WeakPolarHBondContact O-CB 3.46Å; M419-W423 PolarHBondContact O-N 3.3Å
420	C	91.2	Very high	87.6	Confident	70 Å²	70	102 Å²	102	47%	0.473	53%	0.526	S	S	.	.	H	α-helix	trans	-66.7	-41.5	178.6	-148.9	0	0	0	0	111.8	L416 T417 L418 W423 L424	L416-C420 WeakPolarHBondContact O-CB 3.17Å; L416-C420 PolarHBondContact O-N 2.93Å; T417-C420 PolarHBondContact O-N 3.46Å; L418-C420 VanDerWaalsContact C-N 3.33Å; L418-C420 PolarHBondContact O-N 3.45Å; C420-W423 PolarHBondContact O-N 2.84Å; C420-L424 WeakPolarHBondContact O-CB 3.35Å; C420-L424 WeakPolarHBondContact O-CG 3.1Å; C420-L424 PolarHBondContact O-N 3.02Å
421	T	91.2	Very high	86.8	Confident	77 Å²	77	104.9 Å²	104.9	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-67	-39.9	175.7	56	0	0	0	0	112.1	T417 L418 L424 C425	T417-T421 VanDerWaalsContact O-CG2 3.31Å; T417-T421 WeakPolarHBondContact O-CG2 3.45Å; T417-T421 PolarHBondContact O-N 3.21Å; T417-T421 PolarHBondContact O-OG1 3.03Å; T417-T421 VanDerWaalsContact O-OG1 3.12Å; L418-T421 WeakPolarHBondContact CA-OG1 3.4Å; L418-T421 PolarHBondContact O-N 3.02Å; L418-T421 PolarHBondContact O-OG1 2.93Å; T421-L424 PolarHBondContact O-N 3.31Å; T421-C425 WeakPolarHBondContact O-CB 3.32Å; T421-C425 PolarHBondContact O-N 2.7Å; T421-C425 PolarHBondContact O-SG 2.99Å
422	L	90.2	Very high	85.5	Confident	105 Å²	105	108.3 Å²	108.3	55%	0.55	54%	0.538	S	S	.	.	H	α-helix	trans	-62.2	-44.5	174.5	-126	122.4	0	0	0	111.2	L418 M419 C425 I426	L418-L422 WeakPolarHBondContact O-CB 3.36Å; L418-L422 PolarHBondContact O-N 3.17Å; M419-L422 PolarHBondContact O-N 2.94Å; L422-C425 WeakPolarHBondContact O-CB 3.26Å; L422-C425 PolarHBondContact O-N 3.1Å; L422-I426 HydrophobicContact CD2-CD1 4.23Å; L422-I426 WeakPolarHBondContact O-CG1 3.32Å; L422-I426 PolarHBondContact O-N 3.05Å
423	W	90.5	Very high	83.9	Confident	166 Å²	166	114 Å²	114	63%	0.629	55%	0.553	S	S	*	*	H	α-helix	trans	-63.5	-43	177	-171.3	73.6	0	0	0	112.1	M419 C420 C425 I426 Y427	M419-W423 WeakPolarHBondContact O-CB 3.46Å; M419-W423 PolarHBondContact O-N 3.3Å; C420-W423 PolarHBondContact O-N 2.84Å; W423-C425 VanDerWaalsContact C-N 3.33Å; W423-C425 PolarHBondContact O-N 2.96Å; W423-I426 PolarHBondContact O-N 3.11Å; W423-Y427 VanDerWaalsContact O-CB 3.32Å; W423-Y427 WeakPolarHBondContact O-CB 3.42Å; W423-Y427 PolarHBondContact O-N 3.1Å
424	L	89.4	Confident	82	Confident	82 Å²	82	115.2 Å²	115.2	43%	0.429	56%	0.561	S	S	.	*	H	α-helix	trans	-63.1	-37.6	174.4	-75.9	169.6	0	0	0	112.5	C420 T421 Y427 K428	C420-L424 WeakPolarHBondContact O-CB 3.35Å; C420-L424 WeakPolarHBondContact O-CG 3.1Å; C420-L424 PolarHBondContact O-N 3.02Å; T421-L424 PolarHBondContact O-N 3.31Å; L424-Y427 PolarHBondContact O-N 3.25Å; L424-K428 WeakPolarHBondContact O-CB 3.36Å; L424-K428 WeakPolarHBondContact O-CG 3.45Å; L424-K428 PolarHBondContact O-N 2.94Å
425	C	85.4	Confident	80	Confident	83 Å²	83	118.7 Å²	118.7	56%	0.561	57%	0.572	S	S	*	*	H	α-helix	trans	-63.8	-44.1	174.2	-82.6	0	0	0	0	111.8	T421 L422 W423 R429	T421-C425 WeakPolarHBondContact O-CB 3.32Å; T421-C425 PolarHBondContact O-N 2.7Å; T421-C425 PolarHBondContact O-SG 2.99Å; L422-C425 WeakPolarHBondContact O-CB 3.26Å; L422-C425 PolarHBondContact O-N 3.1Å; W423-C425 VanDerWaalsContact C-N 3.33Å; W423-C425 PolarHBondContact O-N 2.96Å; C425-R429 WeakPolarHBondContact O-CB 3.37Å; C425-R429 PolarHBondContact O-N 3.08Å
426	I	86.1	Confident	77.8	Confident	102 Å²	102	123.6 Å²	123.6	52%	0.523	59%	0.587	S	S	.	*	H	α-helix	trans	-65.5	-44.9	175.8	-66.8	166.8	0	0	0	110.5	L422 W423 K428 R429 S430	L422-I426 HydrophobicContact CD2-CD1 4.23Å; L422-I426 WeakPolarHBondContact O-CG1 3.32Å; L422-I426 PolarHBondContact O-N 3.05Å; W423-I426 PolarHBondContact O-N 3.11Å; I426-K428 PolarHBondContact O-N 2.76Å; I426-R429 WeakPolarHBondContact O-CB 3.33Å; I426-R429 PolarHBondContact O-N 2.91Å; I426-S430 PolarHBondContact O-N 3.43Å
427	Y	83.9	Confident	75.2	Confident	118 Å²	118	126.6 Å²	126.6	46%	0.463	60%	0.595	S	S	.	*	H	α-helix	trans	-62.3	-44	178.9	-175.8	-97.9	0	0	0	112	W423 L424 R429 S430 K431	W423-Y427 VanDerWaalsContact O-CB 3.32Å; W423-Y427 WeakPolarHBondContact O-CB 3.42Å; W423-Y427 PolarHBondContact O-N 3.1Å; L424-Y427 PolarHBondContact O-N 3.25Å; Y427-R429 PolarHBondContact O-N 3.06Å; Y427-S430 PolarHBondContact O-N 3.13Å; Y427-K431 HydrophobicContact CE1-CD 4.14Å; Y427-K431 WeakPolarHBondContact O-CB 3.11Å; Y427-K431 PolarHBondContact O-N 3.02Å
428	K	80.1	Confident	72.8	Confident	153 Å²	153	128.7 Å²	128.7	67%	0.665	61%	0.607	S	S	*	*	H	α-helix	trans	-64.2	-37.5	174.2	-79.1	-177.2	178.6	176.8	0	112.2	L424 I426 K432	L424-K428 WeakPolarHBondContact O-CB 3.36Å; L424-K428 WeakPolarHBondContact O-CG 3.45Å; L424-K428 PolarHBondContact O-N 2.94Å; I426-K428 PolarHBondContact O-N 2.76Å; K428-K432 PolarHBondContact O-N 3.28Å
429	R	75	Confident	70.1	Confident	204 Å²	204	129.8 Å²	129.8	77%	0.77	62%	0.619	S	S	*	*	H	α-helix	trans	-64.5	-40.6	173.1	-92.7	-177.8	171.4	174.1	-1.3	112.1	C425 I426 Y427 K432 K433	C425-R429 WeakPolarHBondContact O-CB 3.37Å; C425-R429 PolarHBondContact O-N 3.08Å; I426-R429 WeakPolarHBondContact O-CB 3.33Å; I426-R429 PolarHBondContact O-N 2.91Å; Y427-R429 PolarHBondContact O-N 3.06Å; R429-K432 PolarHBondContact O-N 3.03Å; R429-K433 PolarHBondContact O-N 3.23Å
430	S	70.9	Confident	67.6	Low	64 Å²	64	135.5 Å²	135.5	45%	0.448	64%	0.637	S	S	.	*	H	α-helix	trans	-65.4	-44.5	176	-178.7	0	0	0	0	112	I426 Y427 K432 K433 N434	I426-S430 PolarHBondContact O-N 3.43Å; Y427-S430 PolarHBondContact O-N 3.13Å; S430-K432 VanDerWaalsContact C-N 3.33Å; S430-K432 PolarHBondContact O-N 3.09Å; S430-K433 PolarHBondContact O-N 3.45Å; S430-N434 PolarHBondContact O-N 2.92Å; S430-N434 VanDerWaalsContact O-N 3.07Å
431	K	65	Low	65.2	Low	116 Å²	116	137.8 Å²	137.8	50%	0.504	65%	0.651	S	S	.	*	H	α-helix	trans	-67.9	-30.2	179	-150.4	173.1	-173.4	171.6	0	113	Y427 N434 K435	Y427-K431 HydrophobicContact CE1-CD 4.14Å; Y427-K431 WeakPolarHBondContact O-CB 3.11Å; Y427-K431 PolarHBondContact O-N 3.02Å; K431-N434 PolarHBondContact O-N 3.26Å; K431-K435 PolarHBondContact O-N 3.11Å
432	K	60	Low	62.4	Low	174 Å²	174	141.6 Å²	141.6	76%	0.757	67%	0.669	S	S	*	*	H	α-helix	trans	-68.7	-30.1	170.2	-97	-174.4	176.2	-178.7	0	113	K428 R429 S430	K428-K432 PolarHBondContact O-N 3.28Å; R429-K432 PolarHBondContact O-N 3.03Å; S430-K432 VanDerWaalsContact C-N 3.33Å; S430-K432 PolarHBondContact O-N 3.09Å
433	K	56.8	Low	59.8	Low	169 Å²	169	145.4 Å²	145.4	74%	0.735	68%	0.684	S	S	*	*	H	α-helix	trans	-73.9	-34.5	172.8	-74.4	-174.3	176	-175.8	0	112.2	R429 S430	R429-K433 PolarHBondContact O-N 3.23Å; S430-K433 PolarHBondContact O-N 3.45Å
434	N	50.9	Low	57	Low	123 Å²	123	142.3 Å²	142.3	66%	0.658	69%	0.688	S	S	*	*	H	α-helix	trans	-78.8	-14.2	178.4	-84.2	-4.6	0	0	0	115.3	S430 K431 R436	S430-N434 PolarHBondContact O-N 2.92Å; S430-N434 VanDerWaalsContact O-N 3.07Å; K431-N434 PolarHBondContact O-N 3.26Å; N434-R436 VanDerWaalsContact C-N 3.33Å
435	K	49.9	Very low	54.4	Low	174 Å²	174	143.6 Å²	143.6	76%	0.757	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	2	172.9	-80.9	-169.7	173.5	-169.9	0	114.9	K431	K431-K435 PolarHBondContact O-N 3.11Å
436	R	45.8	Very low	52	Low	228 Å²	228	144.5 Å²	144.5	86%	0.86	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	15.8	174.6	-83	-170.2	-177.4	174	0.5	114.6	N434	N434-R436 VanDerWaalsContact C-N 3.33Å
437	K	39.9	Very low	49.7	Very low	183 Å²	183	147.7 Å²	147.7	80%	0.796	72%	0.723	S	S	*	*			trans	-115.7	88.5	168.4	-72.1	-172.7	176.6	-175.5	0	109.1
438	V	41.8	Very low	47.5	Very low	118 Å²	118	150.7 Å²	150.7	72%	0.715	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-79.2	132.4	164.7	176.4	0	0	0	0	107.4
439	P	37.2	Very low	45.4	Very low	115 Å²	115	147.7 Å²	147.7	75%	0.747	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-88.5	132.4	174.4	33.7	-27.7	0	0	0	110
440	Y	37.6	Very low	43.8	Very low	221 Å²	221	145.5 Å²	145.5	87%	0.867	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-88.4	135.2	162.1	-83.8	-82.5	0	0	0	109.4
441	P	40.8	Very low	42.4	Very low	119 Å²	119	150.8 Å²	150.8	77%	0.773	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-90.1	158.5	177	35.1	-31.2	0	0	0	113.1
442	N	33.8	Very low	41.4	Very low	157 Å²	157	158.3 Å²	158.3	84%	0.84	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-56.8	155.4	-174.7	-63.6	-37	0	0	0	117.3
443	Q	35.3	Very low	40.4	Very low	184 Å²	184	157.5 Å²	157.5	86%	0.86	79%	0.785	S	S	*	*				177.9	112.7	126.2	-97.2	175.9	-18	0	0	107.9
444	S	31.1	Very low	39.6	Very low	102 Å²	102	156.9 Å²	156.9	71%	0.713	79%	0.788	S	S	*	*				79.9	108.9	69.2	74.9	0	0	0	0	115.2
445	S	36	Very low	39	Very low	108 Å²	108	158.8 Å²	158.8	76%	0.755	80%	0.795	S	S	*	*			trans	170.7	99.1	138.5	56.2	0	0	0	0	108.7
446	S	34.1	Very low	38.3	Very low	103 Å²	103	157.9 Å²	157.9	72%	0.72	80%	0.797	S	S	*	*				73.3	112.1	103.3	72.2	0	0	0	0	114.9
447	Q	37.5	Very low	37.8	Very low	168 Å²	168	153.5 Å²	153.5	79%	0.785	79%	0.793	S	S	*	*				178.3	140.2	100.3	-106.1	-175.2	-8.4	0	0	113.8
448	F	36.9	Very low	37.7	Very low	181 Å²	181	151.5 Å²	151.5	79%	0.794	79%	0.793	S	S	*	*			trans	82.9	114.2	150.2	-88.8	-82.8	0	0	0	122.6
449	S	37.9	Very low	37.4	Very low	90 Å²	90	153.9 Å²	153.9	63%	0.629	80%	0.799	S	S	*	*			trans	-86.6	147.2	163.3	53.2	0	0	0	0	112.5
450	Q	40.2	Very low	37.4	Very low	158 Å²	158	156.9 Å²	156.9	74%	0.738	80%	0.803	S	S	*	*			trans	86.2	131.9	130.1	-98.6	178.9	-4.4	0	0	124.2
451	F	41	Very low	37.4	Very low	175 Å²	175	151.6 Å²	151.6	77%	0.768	80%	0.797	S	S	*	*			trans	81.6	105.6	149.6	-75	-68.8	0	0	0	121.8
452	K	44	Very low	37.1	Very low	274 Å²	274	154.5 Å²	154.5	100%	1.191	80%	0.799	S	S	*	*				-143.4	0	103.8	-157	175.5	-171.3	179	0	110.5

Retrieved 452 of 452 residues in 288.3 ms (Link to these results)

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