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Copine-5

Probable calcium-dependent phospholipid-binding protein that may play a role in calcium-mediated intracellular processes. Plays a role in dendrite formation by melanocytes.

AlphaFold DB , UniProt , Accession A0A096NHT0, Species PAPAN (Papio anubis, Olive baboon), Gene CPNE5, Length 610 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	30.7	Very low	29.7	Very low	249 Å²	249	149.9 Å²	149.9	100%	1.227	82%	0.815	S	S	*	*				0	82.1	0	-151.8	-178.1	-119.4	0	0	104
2	E	24.4	Very low	29.9	Very low	193 Å²	193	152 Å²	152	90%	0.902	82%	0.815	S	S	*	*			trans	-106.9	126.5	-177.1	-78.9	174.5	155.4	0	0	107.1
3	Q	22.9	Very low	30.3	Very low	187 Å²	187	149.4 Å²	149.4	87%	0.874	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-71.7	144.3	178.2	-75	171.2	-23.3	0	0	109.9
4	P	31.2	Very low	29.9	Very low	126 Å²	126	149.4 Å²	149.4	82%	0.818	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-79.8	137.1	168.6	30.7	-25.8	0	0	0	110.3
5	E	28.3	Very low	29.9	Very low	188 Å²	188	144.2 Å²	144.2	88%	0.879	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-61.1	144	-179.4	-64.7	173.3	153	0	0	112.9	M7	E5-M7 PolarHBondContact O-N 3.21Å
6	D	27.3	Very low	30	Very low	171 Å²	171	146.7 Å²	146.7	91%	0.914	79%	0.785	S	S	*	*			trans	-56.1	111.3	-179.7	-79.6	-46.4	0	0	0	112.6
7	M	30.5	Very low	30.1	Very low	180 Å²	180	143.5 Å²	143.5	89%	0.887	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-78.5	116.2	159.4	-76.1	-174.1	-171	0	0	108.4	E5 S9	E5-M7 PolarHBondContact O-N 3.21Å; M7-S9 PolarHBondContact O-N 3.11Å
8	A	30.4	Very low	30.1	Very low	97 Å²	97	139.3 Å²	139.3	80%	0.802	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-49.7	130.2	168.1	0	0	0	0	0	110.3	L10	A8-L10 PolarHBondContact O-N 3.08Å
9	S	31.4	Very low	30.1	Very low	81 Å²	81	137.4 Å²	137.4	57%	0.566	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-58.7	128.2	-176.5	46.3	0	0	0	0	111.9	M7 S11	M7-S9 PolarHBondContact O-N 3.11Å; S9-S11 PolarHBondContact O-N 3.11Å
10	L	39.4	Very low	30.7	Very low	81 Å²	81	135.5 Å²	135.5	42%	0.424	76%	0.763	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60	6	176	-72.3	162.1	0	0	0	115.2	A8 I231	A8-L10 PolarHBondContact O-N 3.08Å; L10-I231 HydrophobicContact CD2-CD1 4.37Å
11	S	30.4	Very low	31.5	Very low	96 Å²	96	134.2 Å²	134.2	67%	0.671	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-6.6	-169.9	53.9	0	0	0	0	115.4	S9	S9-S11 PolarHBondContact O-N 3.11Å
12	E	32.4	Very low	32.9	Very low	175 Å²	175	123.5 Å²	123.5	82%	0.818	71%	0.711	S	S	*	*			trans	-123.2	71.6	-180	-71.2	-180	171.4	0	0	110.3
13	F	34	Very low	35.4	Very low	118 Å²	118	116.4 Å²	116.4	52%	0.518	68%	0.681	S	S	.	*			trans	-101.3	87.6	160.5	-168.4	-95.7	0	0	0	107.1	S15 I231	F13-S15 PolarHBondContact O-N 3.44Å; F13-I231 HydrophobicContact CD2-CG2 4.05Å; F13-I231 HydrophobicContact CE2-CB 4.45Å; F13-I231 HydrophobicContact CE2-CG2 3.87Å
14	D	25.8	Very low	38.4	Very low	149 Å²	149	112.1 Å²	112.1	80%	0.797	66%	0.66	S	S	*	*			trans	-76.4	118.6	163.6	-142.8	-5.3	0	0	0	106.6	L16	D14-L16 PolarHBondContact O-N 3.04Å
15	S	28.9	Very low	41.2	Very low	72 Å²	72	106.2 Å²	106.2	50%	0.503	62%	0.621	S	S	.	*			trans	-53.7	127.7	174.6	44.6	0	0	0	0	108.6	F13 A17	F13-S15 PolarHBondContact O-N 3.44Å; S15-A17 PolarHBondContact O-N 3.13Å
16	L	31.7	Very low	44.2	Very low	184 Å²	184	98.8 Å²	98.8	96%	0.963	59%	0.586	S	S	*	*	S	Bend	trans	-60.9	29	170.6	-95	154.6	0	0	0	113.9	D14	D14-L16 PolarHBondContact O-N 3.04Å
17	A	31.4	Very low	47.3	Very low	92 Å²	92	90.6 Å²	90.6	76%	0.76	54%	0.543	S	S	*	.			trans	-94	15.1	176.9	0	0	0	0	0	112.9	S15	S15-A17 PolarHBondContact O-N 3.13Å
18	G	30.6	Very low	50.2	Low	68 Å²	68	84 Å²	84	70%	0.701	51%	0.512	S	S	*	.	S	Bend	trans	-120.4	68.2	-174.5	0	0	0	0	0	113.6
19	S	30.2	Very low	53.3	Low	103 Å²	103	79.3 Å²	79.3	72%	0.72	47%	0.474	S	S	*	.	S	Bend	trans	160.2	120.4	151.9	62.4	0	0	0	0	108.1	P21	S19-P21 WeakPolarHBondContact O-CD 3.29Å
20	I	42.8	Very low	56.2	Low	100 Å²	100	76.2 Å²	76.2	51%	0.513	45%	0.452	S	S	.	.			trans	-49.7	110.2	176.2	-57.4	164.6	0	0	0	108.6	A22 A565	I20-A22 PolarHBondContact O-N 3.28Å; I20-A22 VanDerWaalsContact O-N 3.11Å; I20-A565 HydrophobicContact CD1-CB 4.26Å
21	P	46.3	Very low	58.8	Low	109 Å²	109	72.3 Å²	72.3	71%	0.708	43%	0.432	S	S	*	.			trans	-74.6	109.6	169.4	0.6	16.7	0	0	0	105.4	S19 T23	S19-P21 WeakPolarHBondContact O-CD 3.29Å; P21-T23 PolarHBondContact O-N 2.85Å; P21-T23 VanDerWaalsContact O-N 3.15Å
22	A	60.9	Low	61.8	Low	23 Å²	23	71.2 Å²	71.2	19%	0.19	41%	0.413	C	S	.	.			trans	-39.4	124.8	164.3	0	0	0	0	0	109.5	I20 D83 F85	I20-A22 PolarHBondContact O-N 3.28Å; I20-A22 VanDerWaalsContact O-N 3.11Å; A22-D83 HydrophobicContact CB-CB 3.93Å; A22-F85 HydrophobicContact CB-CD1 3.81Å; A22-F85 HydrophobicContact CB-CD2 4.31Å; A22-F85 HydrophobicContact CB-CE1 3.25Å; A22-F85 HydrophobicContact CB-CE2 3.81Å; A22-F85 HydrophobicContact CB-CG 4.31Å; A22-F85 HydrophobicContact CB-CZ 3.25Å
23	T	77.4	Confident	64.5	Low	45 Å²	45	68.3 Å²	68.3	28%	0.276	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	136.3	177.1	-75.3	0	0	0	0	108.5	P21 Y84 E188 L335	P21-T23 PolarHBondContact O-N 2.85Å; P21-T23 VanDerWaalsContact O-N 3.15Å; T23-Y84 PolarHBondContact N-O 3.13Å; T23-Y84 WeakPolarHBondContact O-CA 3.32Å; T23-Y84 WeakPolarHBondContact O-CB 3.43Å; T23-Y84 PolarHBondContact O-N 2.83Å; T23-E188 HydrophobicContact CG2-CB 4.44Å; T23-E188 HydrophobicContact CG2-CG 3.18Å; T23-E188 WeakPolarHBondContact CG2-OE1 3.45Å; T23-L335 HydrophobicContact CG2-CD1 4.02Å
24	K	85.3	Confident	67	Low	97 Å²	97	63 Å²	63	42%	0.422	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	136	174.2	-73.7	-173.3	-176.9	-62	0	110.3	I81 V82 D83 L189	K24-I81 HydrophobicContact CB-CG2 4.45Å; K24-I81 HydrophobicContact CD-CG2 4.23Å; K24-V82 WeakPolarHBondContact CA-O 3.44Å; K24-D83 WeakPolarHBondContact CG-OD1 2.64Å; K24-D83 IonicContact NZ-OD1 3.98Å; K24-D83 PolarHBondContact NZ-OD1 3.05Å; K24-D83 IonicContact NZ-OD2 2.8Å; K24-L189 HydrophobicContact CB-CB 3.96Å; K24-L189 HydrophobicContact CB-CD1 4.24Å; K24-L189 PolarHBondContact O-N 3.37Å
25	V	88.9	Confident	69.5	Low	1 Å²	1	57.1 Å²	57.1	1%	0.006	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	134.3	176	173.3	0	0	0	0	109.5	I27 I81 V82 Y84 L119 A186 E187 L335	V25-I27 HydrophobicContact CG1-CG1 4.39Å; V25-I81 WeakPolarHBondContact O-CA 3.41Å; V25-V82 HydrophobicContact CB-CG2 4.42Å; V25-V82 PolarHBondContact N-O 3.41Å; V25-V82 PolarHBondContact O-N 3.34Å; V25-Y84 HydrophobicContact CG2-CG 4.22Å; V25-L119 HydrophobicContact CG1-CD1 4.35Å; V25-A186 HydrophobicContact CG1-CB 3.58Å; V25-E187 CarbonylContact C-O 3.6Å; V25-E187 WeakPolarHBondContact CA-O 3.44Å; V25-L335 HydrophobicContact CG2-CD1 3.86Å
26	E	91.4	Very high	71.7	Confident	32 Å²	32	57.4 Å²	57.4	15%	0.15	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	119.9	171.1	-169.8	178	37.5	0	0	109.9	K79 F80 I81 A186 E187 L189	E26-K79 VanDerWaalsContact CD-CE 3.46Å; E26-K79 HydrophobicContact CG-CB 3.4Å; E26-K79 HydrophobicContact CG-CD 3.73Å; E26-K79 HydrophobicContact CG-CG 4.09Å; E26-K79 IonicContact OE1-NZ 3.99Å; E26-K79 PolarHBondContact OE1-NZ 2.92Å; E26-K79 VanDerWaalsContact OE2-CB 3.25Å; E26-K79 WeakPolarHBondContact OE2-CB 3.03Å; E26-K79 WeakPolarHBondContact OE2-CD 3.45Å; E26-K79 WeakPolarHBondContact OE2-CE 3.46Å; E26-K79 VanDerWaalsContact OE2-CG 3.28Å; E26-K79 WeakPolarHBondContact OE2-CG 3.48Å; E26-K79 IonicContact OE2-NZ 3.1Å; E26-K79 PolarHBondContact OE2-NZ 3.39Å; E26-K79 VanDerWaalsContact OE2-NZ 3.09Å; E26-F80 CarbonylContact C-O 3.59Å; E26-F80 WeakPolarHBondContact CA-O 3.43Å; E26-I81 HydrophobicContact CG-CG1 4.49Å; E26-A186 WeakPolarHBondContact O-CA 3.03Å; E26-E187 PolarHBondContact N-O 2.89Å; E26-E187 PolarHBondContact O-N 3.3Å; E26-L189 HydrophobicContact CB-CD1 3.91Å; E26-L189 HydrophobicContact CB-CD2 3.94Å; E26-L189 HydrophobicContact CB-CG 3.75Å
27	I	92.5	Very high	73.4	Confident	0 Å²	0	52 Å²	52	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	120.1	177.3	-54.6	173.1	0	0	0	109	V25 V29 M49 K79 F80 V82 L92 F94 L119 I122 L184 S185	V25-I27 HydrophobicContact CG1-CG1 4.39Å; I27-V29 HydrophobicContact CG2-CG2 4.37Å; I27-M49 HydrophobicContact CD1-SD 4.05Å; I27-K79 WeakPolarHBondContact O-CA 3.17Å; I27-K79 WeakPolarHBondContact O-CB 3.21Å; I27-F80 HydrophobicContact CB-CB 4.3Å; I27-F80 PolarHBondContact N-O 2.54Å; I27-F80 PolarHBondContact O-N 3.41Å; I27-V82 HydrophobicContact CD1-CG2 3.8Å; I27-V82 HydrophobicContact CG1-CG2 4.23Å; I27-L92 HydrophobicContact CD1-CD1 3.87Å; I27-F94 HydrophobicContact CG2-CZ 4.36Å; I27-L119 HydrophobicContact CD1-CD1 3.87Å; I27-L119 HydrophobicContact CG1-CD1 4.28Å; I27-I122 HydrophobicContact CD1-CD1 4.45Å; I27-L184 HydrophobicContact CG2-CD2 4.49Å; I27-S185 CarbonylContact C-O 3.58Å; I27-S185 WeakPolarHBondContact CA-O 3.29Å
28	T	93	Very high	74.8	Confident	40 Å²	40	49.9 Å²	49.9	25%	0.245	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	137.1	169.8	-51.8	0	0	0	0	109.4	K79 L184 S185	T28-K79 VanDerWaalsContact OG1-CD 3.28Å; T28-K79 WeakPolarHBondContact OG1-CD 3.5Å; T28-L184 WeakPolarHBondContact O-CA 3.23Å; T28-S185 PolarHBondContact N-O 3.35Å; T28-S185 PolarHBondContact O-N 3.22Å
29	V	93.8	Very high	75.8	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	135.4	179.1	-174.3	0	0	0	0	109.6	I27 C47 F76 F80 F94 I182 L184	I27-V29 HydrophobicContact CG2-CG2 4.37Å; V29-C47 HydrophobicContact CG1-CB 4.42Å; V29-F76 HydrophobicContact CB-CD2 4.1Å; V29-F76 HydrophobicContact CG1-CD2 4.04Å; V29-F76 HydrophobicContact CG1-CE2 4.32Å; V29-F76 WeakPolarHBondContact O-CB 3.34Å; V29-F76 WeakPolarHBondContact O-CD2 3.45Å; V29-F76 PolarHBondContact O-N 3.22Å; V29-F76 VanDerWaalsContact O-N 3.15Å; V29-F80 HydrophobicContact CG2-CD2 4.06Å; V29-F80 HydrophobicContact CG2-CE2 3.85Å; V29-F94 HydrophobicContact CG2-CD1 4.24Å; V29-F94 HydrophobicContact CG2-CE1 3.95Å; V29-I182 HydrophobicContact CG1-CD1 3.9Å; V29-I182 HydrophobicContact CG1-CG1 3.98Å; V29-L184 HydrophobicContact CB-CD2 4.34Å; V29-L184 HydrophobicContact CG1-CD2 4.09Å; V29-L184 HydrophobicContact CG2-CD2 3.78Å
30	S	93.1	Very high	76.8	Confident	15 Å²	15	58.3 Å²	58.3	11%	0.105	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	158.2	165.5	53.9	0	0	0	0	109.5	P74 D75 I183	S30-P74 CarbonylContact C-O 3.48Å; S30-P74 VanDerWaalsContact CA-O 3.29Å; S30-P74 WeakPolarHBondContact CA-O 3.11Å; S30-P74 WeakPolarHBondContact CB-O 3.35Å; S30-D75 WeakPolarHBondContact CB-OD1 3.22Å; S30-I183 PolarHBondContact N-O 2.86Å; S30-I183 PolarHBondContact O-N 2.97Å; S30-I183 WeakPolarHBondContact OG-CB 3.21Å
31	C	93.3	Very high	78.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	155.3	175.5	-62.8	0	0	0	0	110.8	L34 N73 P74 T181	C31-L34 HydrophobicContact CB-CD1 3.94Å; C31-L34 HydrophobicContact CB-CD2 3.65Å; C31-L34 HydrophobicContact CB-CG 3.82Å; C31-N73 CarbonylContact O-C 3.59Å; C31-N73 VanDerWaalsContact O-C 3.31Å; C31-N73 WeakPolarHBondContact O-CA 3.25Å; C31-P74 HydrophobicContact CB-CG 3.76Å; C31-P74 PolarHBondContact N-O 3.04Å; C31-T181 CarbonylContact C-O 3.58Å; C31-T181 WeakPolarHBondContact CA-O 3.26Å
32	R	93.2	Very high	79.6	Confident	73 Å²	73	56 Å²	56	28%	0.275	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	142.4	176.8	-61	-64.5	178.7	-96.2	3.7	110.8	L34 L72 N73 P74 D75 G180 T181 I183	R32-L34 VanDerWaalsContact C-N 3.28Å; R32-L34 PolarHBondContact O-N 3.3Å; R32-L72 CarbonylContact C-O 3.51Å; R32-N73 VanDerWaalsContact CA-OD1 3.25Å; R32-N73 WeakPolarHBondContact CA-OD1 3.31Å; R32-N73 WeakPolarHBondContact CD-OD1 3.26Å; R32-P74 PolarHBondContact NH1-O 3.5Å; R32-D75 IonicContact CZ-OD1 2.65Å; R32-D75 VanDerWaalsContact CZ-OD1 3.23Å; R32-D75 IonicContact CZ-OD2 2.72Å; R32-D75 IonicContact NH1-OD1 3.75Å; R32-D75 PolarHBondContact NH1-OD1 2.86Å; R32-D75 IonicContact NH1-OD2 2.7Å; R32-D75 IonicContact NH2-OD1 3.04Å; R32-D75 PolarHBondContact NH2-OD1 2.77Å; R32-D75 IonicContact NH2-OD2 2.78Å; R32-D75 PolarHBondContact NH2-OD2 3.02Å; R32-G180 CarbonylContact O-C 3.58Å; R32-G180 VanDerWaalsContact O-CA 3.28Å; R32-G180 WeakPolarHBondContact O-CA 3.46Å; R32-T181 PolarHBondContact N-O 3.15Å; R32-T181 PolarHBondContact O-N 3Å; R32-I183 HydrophobicContact CG-CD1 3.7Å
33	N	89.2	Confident	80.6	Confident	114 Å²	114	54.9 Å²	54.9	61%	0.61	27%	0.271	S	S	*	.	S	Bend	trans	53.1	42.9	176.3	-52	-52.8	0	0	0	113.3	L72 N73 G180	N33-L72 PolarHBondContact N-O 3.2Å; N33-L72 VanDerWaalsContact N-O 3.08Å; N33-N73 PolarHBondContact N-OD1 3Å; N33-G180 WeakPolarHBondContact O-CA 3.48Å; N33-G180 PolarHBondContact O-N 3.42Å
34	L	86.8	Confident	81.1	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.026	27%	0.269	C	S	.	.			trans	-56.4	154.9	175.3	-67.6	-178.8	0	0	0	111.5	C31 R32 D36 P45 L72 P74 L112 L134	C31-L34 HydrophobicContact CB-CD1 3.94Å; C31-L34 HydrophobicContact CB-CD2 3.65Å; C31-L34 HydrophobicContact CB-CG 3.82Å; R32-L34 VanDerWaalsContact C-N 3.28Å; R32-L34 PolarHBondContact O-N 3.3Å; L34-D36 PolarHBondContact O-N 3.04Å; L34-P45 HydrophobicContact CD1-CB 3.69Å; L34-P45 HydrophobicContact CD1-CG 4.13Å; L34-L72 HydrophobicContact CB-CB 4.35Å; L34-L72 HydrophobicContact CB-CD2 4.37Å; L34-L72 PolarHBondContact N-O 3.33Å; L34-P74 HydrophobicContact CD1-CG 3.75Å; L34-L112 HydrophobicContact CD1-CD1 4.21Å; L34-L134 HydrophobicContact CD2-CD1 3.35Å
35	L	79.4	Confident	81.5	Confident	26 Å²	26	50.2 Å²	50.2	14%	0.136	25%	0.249	C	C	.	.			trans	-68.1	124.4	178.8	-164.9	109.7	0	0	0	110.2	K37 S43 L112 K177	L35-K37 HydrophobicContact CD2-CD 3.54Å; L35-K37 HydrophobicContact CD2-CG 3.92Å; L35-K37 PolarHBondContact O-N 2.58Å; L35-S43 PolarHBondContact O-OG 2.88Å; L35-L112 WeakPolarHBondContact O-CD2 3.32Å; L35-K177 HydrophobicContact CD1-CD 4.36Å; L35-K177 HydrophobicContact CD1-CG 4.15Å
36	D	74.5	Confident	81.7	Confident	79 Å²	79	50.8 Å²	50.8	42%	0.422	25%	0.252	S	S	.	.			trans	-76.9	113.8	173.5	-156.6	-6.3	0	0	0	109.6	L34 L72	L34-D36 PolarHBondContact O-N 3.04Å; D36-L72 HydrophobicContact CB-CD1 4.2Å; D36-L72 HydrophobicContact CB-CD2 4.22Å
37	K	67.4	Low	81.9	Confident	71 Å²	71	49.2 Å²	49.2	31%	0.309	25%	0.245	S	C	.	.			trans	-98.7	-17	-179.9	-75.9	-69.6	-165.7	164.8	0	113.1	L35 D110 L112	L35-K37 HydrophobicContact CD2-CD 3.54Å; L35-K37 HydrophobicContact CD2-CG 3.92Å; L35-K37 PolarHBondContact O-N 2.58Å; K37-D110 HydrophobicContact CG-CB 4.48Å; K37-L112 HydrophobicContact CG-CD2 3.69Å
38	D	60.2	Low	82.1	Confident	47 Å²	47	49.2 Å²	49.2	25%	0.251	25%	0.245	S	C	.	.			trans	-91.7	145.6	-172.6	-84.1	-18.1	0	0	0	112.5	S41	D38-S41 WeakPolarHBondContact CB-O 3.48Å; D38-S41 WeakPolarHBondContact CB-OG 3.42Å; D38-S41 VanDerWaalsContact CG-OG 3.32Å; D38-S41 PolarHBondContact OD2-OG 2.65Å
39	M	51.7	Low	82.3	Confident	159 Å²	159	47.3 Å²	47.3	78%	0.783	23%	0.233	S	C	*	.	S	Bend	trans	-84.1	-19.8	-179.1	-168.6	163.1	71.2	0	0	112.8
40	F	52.5	Low	82.4	Confident	188 Å²	188	48.5 Å²	48.5	83%	0.825	24%	0.238	S	C	*	.	S	Bend	trans	-139.4	-1.6	-172.3	-59	-67.6	0	0	0	114.8
41	S	70.3	Confident	82.3	Confident	59 Å²	59	49.7 Å²	49.7	41%	0.413	24%	0.244	S	C	.	.	S	Bend	trans	-138.7	172.9	177.9	37.9	0	0	0	0	109.3	D38	D38-S41 WeakPolarHBondContact CB-O 3.48Å; D38-S41 WeakPolarHBondContact CB-OG 3.42Å; D38-S41 VanDerWaalsContact CG-OG 3.32Å; D38-S41 PolarHBondContact OD2-OG 2.65Å
42	K	76.6	Confident	82	Confident	101 Å²	101	51.5 Å²	51.5	44%	0.439	25%	0.253	S	S	.	.			trans	-92.4	162.3	161.8	-56.4	169.7	-179.9	173.2	0	108.3	N70 L72	K42-N70 WeakPolarHBondContact CB-OD1 3.34Å; K42-N70 WeakPolarHBondContact CG-OD1 3.46Å; K42-N70 PolarHBondContact N-OD1 3.23Å; K42-L72 HydrophobicContact CB-CD2 4.14Å; K42-L72 HydrophobicContact CB-CG 4.22Å; K42-L72 HydrophobicContact CD-CG 4.34Å; K42-L72 HydrophobicContact CG-CG 4.35Å
43	S	82.4	Confident	81.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.244	C	C	.	.			trans	-54.9	152	175.7	-62	0	0	0	0	115	L35 P45 N70 T71 D98	L35-S43 PolarHBondContact O-OG 2.88Å; S43-P45 WeakPolarHBondContact O-CD 3.36Å; S43-N70 CarbonylContact O-C 3.56Å; S43-N70 WeakPolarHBondContact O-CA 3.36Å; S43-N70 PolarHBondContact O-N 3.34Å; S43-T71 PolarHBondContact O-N 3.33Å; S43-D98 VanDerWaalsContact CA-OD1 3.29Å; S43-D98 WeakPolarHBondContact CA-OD1 3.31Å; S43-D98 VanDerWaalsContact CA-OD2 3.3Å; S43-D98 WeakPolarHBondContact CA-OD2 3.37Å; S43-D98 WeakPolarHBondContact CB-OD2 3.4Å; S43-D98 PolarHBondContact OG-OD2 2.9Å
44	D	88.2	Confident	80.1	Confident	45 Å²	45	47 Å²	47	24%	0.241	24%	0.235	C	C	.	.			trans	-105.4	75.2	171.6	-66.1	-24.2	0	0	0	109.5	V67 I68 D69 N70 D98 V99	D44-V67 HydrophobicContact CB-CG1 3.94Å; D44-I68 WeakPolarHBondContact CA-O 3.47Å; D44-D69 WeakPolarHBondContact OD1-CA 3.28Å; D44-N70 PolarHBondContact OD1-N 2.86Å; D44-D98 PolarHBondContact N-OD1 2.87Å; D44-V99 HydrophobicContact CB-CB 4.35Å; D44-V99 WeakPolarHBondContact O-CG2 3.48Å; D44-V99 PolarHBondContact O-N 2.92Å
45	P	92.1	Very high	79	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	140.2	-169.2	24.8	-38.7	0	0	0	114.8	L34 S43 V67 I68 T71 P74 F76 Y97 L112	L34-P45 HydrophobicContact CD1-CB 3.69Å; L34-P45 HydrophobicContact CD1-CG 4.13Å; S43-P45 WeakPolarHBondContact O-CD 3.36Å; P45-V67 WeakPolarHBondContact O-CA 3.45Å; P45-I68 WeakPolarHBondContact CD-O 3.38Å; P45-I68 PolarHBondContact O-N 3.05Å; P45-I68 VanDerWaalsContact O-N 3.15Å; P45-T71 WeakPolarHBondContact CD-O 3.49Å; P45-T71 HydrophobicContact CG-CG2 3.81Å; P45-T71 WeakPolarHBondContact CG-O 3.38Å; P45-P74 HydrophobicContact CB-CB 4.36Å; P45-P74 HydrophobicContact CB-CG 3.93Å; P45-P74 HydrophobicContact CG-CB 3.66Å; P45-P74 HydrophobicContact CG-CG 3.61Å; P45-F76 HydrophobicContact CB-CZ 4.17Å; P45-F76 WeakPolarHBondContact O-CE1 3.47Å; P45-Y97 CarbonylContact C-O 3.55Å; P45-Y97 VanDerWaalsContact CA-O 3.26Å; P45-Y97 WeakPolarHBondContact CA-O 3.19Å; P45-L112 HydrophobicContact CB-CD1 4.4Å
46	L	94.7	Very high	78.6	Confident	12 Å²	12	56 Å²	56	6%	0.063	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	134.3	169.2	175.1	69.4	0	0	0	109.4	V48 R64 T65 V67 L96 Y97 V99 L106	L46-V48 HydrophobicContact CD2-CG2 4.48Å; L46-R64 HydrophobicContact CD1-CB 4.2Å; L46-T65 WeakPolarHBondContact CD1-O 3.32Å; L46-V67 HydrophobicContact CB-CG2 4.34Å; L46-V67 HydrophobicContact CD1-CG2 4.14Å; L46-L96 WeakPolarHBondContact O-CA 3.12Å; L46-Y97 PolarHBondContact N-O 2.92Å; L46-Y97 PolarHBondContact O-N 2.81Å; L46-V99 HydrophobicContact CB-CG2 3.63Å; L46-V99 HydrophobicContact CD2-CG2 4.15Å; L46-L106 HydrophobicContact CD2-CD2 4.31Å
47	C	95.2	Very high	78.5	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133.6	172.6	-173.5	0	0	0	0	111.6	V29 R64 T65 F76 L96	V29-C47 HydrophobicContact CG1-CB 4.42Å; C47-R64 CarbonylContact O-C 3.55Å; C47-R64 WeakPolarHBondContact O-CA 3.16Å; C47-T65 HydrophobicContact CB-CG2 3.83Å; C47-T65 PolarHBondContact N-OG1 3.3Å; C47-T65 PolarHBondContact O-N 3.49Å; C47-T65 PolarHBondContact O-OG1 2.89Å; C47-F76 HydrophobicContact CB-CD2 4.38Å; C47-F76 HydrophobicContact CB-CE2 3.9Å; C47-F76 HydrophobicContact CB-CZ 4.05Å; C47-L96 HydrophobicContact CB-CD1 3.69Å
48	V	97.2	Very high	79.3	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.9	173.6	-172.8	0	0	0	0	108.8	L46 Y50 E61 R64 F94 D95 Y97 L106	L46-V48 HydrophobicContact CD2-CG2 4.48Å; V48-Y50 HydrophobicContact CB-CE2 3.82Å; V48-Y50 HydrophobicContact CG1-CD2 4.07Å; V48-Y50 HydrophobicContact CG1-CE1 4.41Å; V48-Y50 HydrophobicContact CG1-CE2 3.34Å; V48-E61 HydrophobicContact CG1-CG 3.67Å; V48-R64 HydrophobicContact CB-CG 4.48Å; V48-R64 HydrophobicContact CG1-CG 4.13Å; V48-R64 HydrophobicContact CG2-CG 3.97Å; V48-F94 WeakPolarHBondContact O-CA 3.29Å; V48-D95 PolarHBondContact N-O 2.82Å; V48-D95 PolarHBondContact O-N 3.18Å; V48-Y97 HydrophobicContact CG2-CD2 4.04Å; V48-Y97 HydrophobicContact CG2-CE2 4.04Å; V48-L106 HydrophobicContact CG2-CD1 4.11Å; V48-L106 HydrophobicContact CG2-CD2 3.98Å
49	M	96.3	Very high	80.6	Confident	0 Å²	0	58 Å²	58	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	136.1	174.6	-170.1	178.9	75.4	0	0	110.1	I27 F62 G63 F80 V82 L92 R93 F94	I27-M49 HydrophobicContact CD1-SD 4.05Å; M49-F62 HydrophobicContact CE-CB 3.8Å; M49-F62 HydrophobicContact CE-CD1 3.15Å; M49-F62 HydrophobicContact CE-CD2 4.24Å; M49-F62 HydrophobicContact CE-CE1 3.74Å; M49-F62 HydrophobicContact CE-CG 3.44Å; M49-F62 VanDerWaalsContact CE-CG 3.44Å; M49-F62 HydrophobicContact CE-CZ 4.49Å; M49-F62 WeakPolarHBondContact O-CB 3.37Å; M49-F62 PolarHBondContact O-N 3.01Å; M49-G63 PolarHBondContact N-O 2.56Å; M49-G63 PolarHBondContact O-N 3.27Å; M49-F80 HydrophobicContact CB-CD1 4.21Å; M49-F80 HydrophobicContact CB-CD2 4.08Å; M49-F80 HydrophobicContact CB-CE1 3.98Å; M49-F80 HydrophobicContact CB-CE2 3.84Å; M49-F80 HydrophobicContact CB-CG 4.26Å; M49-F80 HydrophobicContact CB-CZ 3.78Å; M49-F80 HydrophobicContact CE-CB 3.52Å; M49-F80 HydrophobicContact CE-CD1 4.02Å; M49-F80 HydrophobicContact CE-CD2 4.33Å; M49-F80 HydrophobicContact CE-CG 3.71Å; M49-F80 HydrophobicContact SD-CB 3.95Å; M49-F80 HydrophobicContact SD-CD2 3.88Å; M49-F80 HydrophobicContact SD-CG 3.87Å; M49-V82 HydrophobicContact CE-CG1 3.76Å; M49-L92 HydrophobicContact SD-CD2 4.41Å; M49-R93 CarbonylContact C-O 3.48Å; M49-R93 WeakPolarHBondContact CA-O 3.24Å; M49-F94 HydrophobicContact CB-CD1 4.14Å; M49-F94 HydrophobicContact CB-CE1 4.02Å; M49-F94 HydrophobicContact CG-CD1 4.02Å; M49-F94 HydrophobicContact CG-CE1 3.58Å; M49-F94 HydrophobicContact CG-CZ 3.92Å; M49-F94 HydrophobicContact SD-CE1 3.59Å; M49-F94 VanDerWaalsContact SD-CE1 3.59Å; M49-F94 HydrophobicContact SD-CZ 3.69Å
50	Y	95.3	Very high	82.4	Confident	25 Å²	25	57.5 Å²	57.5	10%	0.098	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	145.5	173.4	-59.4	-103.1	0	0	0	110.3	V48 R60 E61 L92 R93 D95 L106	V48-Y50 HydrophobicContact CB-CE2 3.82Å; V48-Y50 HydrophobicContact CG1-CD2 4.07Å; V48-Y50 HydrophobicContact CG1-CE1 4.41Å; V48-Y50 HydrophobicContact CG1-CE2 3.34Å; Y50-R60 CarbonylContact C-O 3.48Å; Y50-R60 WeakPolarHBondContact CA-O 3.43Å; Y50-R60 WeakPolarHBondContact CB-O 3.48Å; Y50-E61 VanDerWaalsContact CD1-CA 3.46Å; Y50-E61 HydrophobicContact CD1-CB 4.01Å; Y50-E61 HydrophobicContact CE1-CB 3.79Å; Y50-E61 HydrophobicContact CE1-CG 4.25Å; Y50-L92 WeakPolarHBondContact O-CA 3.48Å; Y50-R93 VanDerWaalsContact CE2-NH2 3.33Å; Y50-R93 VanDerWaalsContact CZ-NH2 3.32Å; Y50-R93 PolarHBondContact N-O 3.26Å; Y50-R93 PolarHBondContact O-N 3.07Å; Y50-D95 HydrophobicContact CE2-CB 4.01Å; Y50-D95 WeakPolarHBondContact CE2-OD2 3.49Å; Y50-L106 WeakPolarHBondContact OH-CD1 3.31Å
51	T	92.1	Very high	84.4	Confident	39 Å²	39	52.6 Å²	52.6	24%	0.239	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	149.4	171.3	54.1	0	0	0	0	109.6	W59 R60 F62 L92	T51-W59 WeakPolarHBondContact O-CA 3.09Å; T51-R60 PolarHBondContact N-O 3.3Å; T51-R60 PolarHBondContact O-N 2.93Å; T51-F62 HydrophobicContact CG2-CB 4.06Å; T51-F62 HydrophobicContact CG2-CD2 3.69Å; T51-F62 HydrophobicContact CG2-CG 4.13Å; T51-L92 HydrophobicContact CG2-CD2 3.91Å
52	Q	87.9	Confident	85.5	Confident	38 Å²	38	54.2 Å²	54.2	18%	0.178	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	127.7	176.7	-162.3	176.1	40.3	0	0	110.7	K57 Q58 W59 N91	Q52-K57 HydrophobicContact CG-CB 4.48Å; Q52-K57 WeakPolarHBondContact CG-O 3.35Å; Q52-K57 PolarHBondContact NE2-O 3.24Å; Q52-Q58 WeakPolarHBondContact CA-O 3.21Å; Q52-W59 HydrophobicContact CB-CD2 4.19Å; Q52-W59 HydrophobicContact CB-CE3 3.91Å; Q52-W59 HydrophobicContact CB-CH2 4.13Å; Q52-W59 HydrophobicContact CB-CZ2 4.37Å; Q52-W59 HydrophobicContact CB-CZ3 3.88Å; Q52-W59 HydrophobicContact CG-CD2 4.35Å; Q52-N91 HydrophobicContact CB-CB 4Å; Q52-N91 PolarHBondContact N-O 2.93Å; Q52-N91 PolarHBondContact OE1-ND2 3.14Å
53	G	74.8	Confident	86.2	Confident	9 Å²	9	50 Å²	50	9%	0.093	24%	0.235	C	C	.	.			trans	-69.8	139.3	173.2	0	0	0	0	0	112.2	E55 K57 Q58	G53-E55 PolarHBondContact O-N 2.77Å; G53-K57 VanDerWaalsContact O-CA 3.29Å; G53-K57 WeakPolarHBondContact O-CA 3.09Å; G53-K57 PolarHBondContact O-N 3.24Å; G53-K57 VanDerWaalsContact O-N 3.07Å; G53-Q58 PolarHBondContact N-O 3.23Å
54	M	67.7	Low	86.9	Confident	84 Å²	84	52.9 Å²	52.9	41%	0.414	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-40.1	-179.1	-68.8	-175.2	-155.8	0	0	113.8	E88 A557	M54-E88 HydrophobicContact CE-CB 4.32Å; M54-E88 HydrophobicContact CE-CG 3.98Å; M54-E88 VanDerWaalsContact CE-OE1 3.22Å; M54-E88 WeakPolarHBondContact CE-OE1 3.34Å; M54-E88 WeakPolarHBondContact CE-OE2 3.3Å; M54-A557 HydrophobicContact SD-CB 4.36Å
55	E	63.3	Low	87.1	Confident	139 Å²	139	51.1 Å²	51.1	65%	0.65	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-43.4	-172	-69.5	-176.3	165.7	0	0	113.3	G53 L554	G53-E55 PolarHBondContact O-N 2.77Å; E55-L554 HydrophobicContact CG-CD1 3.73Å; E55-L554 HydrophobicContact CG-CD2 4.4Å
56	N	69.3	Low	87.1	Confident	80 Å²	80	53.9 Å²	53.9	43%	0.428	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-1.3	-170	65.9	3.5	0	0	0	113.6	Q58	N56-Q58 HydrophobicContact CB-CG 4.1Å; N56-Q58 PolarHBondContact ND2-OE1 2.64Å; N56-Q58 PolarHBondContact O-N 2.69Å; N56-Q58 WeakPolarHBondContact OD1-CB 3.26Å; N56-Q58 PolarHBondContact OD1-N 2.83Å
57	K	74.4	Confident	87	Confident	82 Å²	82	56 Å²	56	36%	0.357	26%	0.264	S	S	.	.			trans	51.3	21.8	-174.3	-63.5	-171.9	178.1	178.7	0	113.9	Q52 G53 V553	Q52-K57 HydrophobicContact CG-CB 4.48Å; Q52-K57 WeakPolarHBondContact CG-O 3.35Å; Q52-K57 PolarHBondContact NE2-O 3.24Å; G53-K57 VanDerWaalsContact O-CA 3.29Å; G53-K57 WeakPolarHBondContact O-CA 3.09Å; G53-K57 PolarHBondContact O-N 3.24Å; G53-K57 VanDerWaalsContact O-N 3.07Å; K57-V553 VanDerWaalsContact CE-CG1 3.5Å
58	Q	83.6	Confident	86.5	Confident	99 Å²	99	58 Å²	58	46%	0.463	27%	0.274	S	S	.	.			trans	-82.7	134.4	180	-69.3	-174.6	-17.7	0	0	110.3	Q52 G53 N56	Q52-Q58 WeakPolarHBondContact CA-O 3.21Å; G53-Q58 PolarHBondContact N-O 3.23Å; N56-Q58 HydrophobicContact CB-CG 4.1Å; N56-Q58 PolarHBondContact ND2-OE1 2.64Å; N56-Q58 PolarHBondContact O-N 2.69Å; N56-Q58 WeakPolarHBondContact OD1-CB 3.26Å; N56-Q58 PolarHBondContact OD1-N 2.83Å
59	W	87.8	Confident	86	Confident	59 Å²	59	63.9 Å²	63.9	22%	0.223	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	128.9	170.8	-67.9	102.8	0	0	0	109.8	T51 Q52 N91 R93 F116	T51-W59 WeakPolarHBondContact O-CA 3.09Å; Q52-W59 HydrophobicContact CB-CD2 4.19Å; Q52-W59 HydrophobicContact CB-CE3 3.91Å; Q52-W59 HydrophobicContact CB-CH2 4.13Å; Q52-W59 HydrophobicContact CB-CZ2 4.37Å; Q52-W59 HydrophobicContact CB-CZ3 3.88Å; Q52-W59 HydrophobicContact CG-CD2 4.35Å; W59-N91 HydrophobicContact CH2-CB 3.94Å; W59-N91 HydrophobicContact CZ3-CB 4.49Å; W59-R93 HydrophobicContact CD2-CB 4.41Å; W59-R93 HydrophobicContact CE3-CB 3.87Å; W59-R93 HydrophobicContact CH2-CB 3.76Å; W59-R93 HydrophobicContact CZ2-CB 4.32Å; W59-R93 HydrophobicContact CZ3-CB 3.52Å; W59-F116 HydrophobicContact CH2-CD1 4.01Å; W59-F116 HydrophobicContact CH2-CE1 4.3Å; W59-F116 AromaticContact CZ2-CD1 3.82Å; W59-F116 HydrophobicContact CZ2-CD1 3.82Å; W59-F116 AromaticContact CZ2-CE1 3.76Å; W59-F116 HydrophobicContact CZ2-CE1 3.76Å
60	R	89.8	Confident	85.5	Confident	148 Å²	148	68.2 Å²	68.2	56%	0.558	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	133.7	175	-71	-173.7	-80.3	-171.5	-4	109	Y50 T51 F62	Y50-R60 CarbonylContact C-O 3.48Å; Y50-R60 WeakPolarHBondContact CA-O 3.43Å; Y50-R60 WeakPolarHBondContact CB-O 3.48Å; T51-R60 PolarHBondContact N-O 3.3Å; T51-R60 PolarHBondContact O-N 2.93Å; R60-F62 PolarHBondContact O-N 2.97Å
61	E	94.1	Very high	85	Confident	86 Å²	86	68.4 Å²	68.4	40%	0.402	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	121.2	173.7	-171.6	-177.8	136.1	0	0	108.1	V48 Y50 R64	V48-E61 HydrophobicContact CG1-CG 3.67Å; Y50-E61 VanDerWaalsContact CD1-CA 3.46Å; Y50-E61 HydrophobicContact CD1-CB 4.01Å; Y50-E61 HydrophobicContact CE1-CB 3.79Å; Y50-E61 HydrophobicContact CE1-CG 4.25Å; E61-R64 VanDerWaalsContact CD-NE 3.35Å; E61-R64 VanDerWaalsContact OE1-CG 3.3Å; E61-R64 WeakPolarHBondContact OE1-CG 3.48Å; E61-R64 IonicContact OE1-CZ 3.23Å; E61-R64 IonicContact OE1-NE 2.76Å; E61-R64 PolarHBondContact OE1-NE 3.14Å; E61-R64 IonicContact OE1-NH2 3.68Å; E61-R64 PolarHBondContact OE1-NH2 3.3Å; E61-R64 IonicContact OE2-CZ 3.31Å; E61-R64 IonicContact OE2-NE 3.51Å; E61-R64 PolarHBondContact OE2-NE 3.34Å; E61-R64 IonicContact OE2-NH2 2.91Å; E61-R64 PolarHBondContact OE2-NH2 3.14Å
62	F	92	Very high	84.8	Confident	92 Å²	92	68.1 Å²	68.1	40%	0.404	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-44.1	176.6	-174.5	-87	0	0	0	110.4	M49 T51 R60 F80 I81 V82	M49-F62 HydrophobicContact CE-CB 3.8Å; M49-F62 HydrophobicContact CE-CD1 3.15Å; M49-F62 HydrophobicContact CE-CD2 4.24Å; M49-F62 HydrophobicContact CE-CE1 3.74Å; M49-F62 HydrophobicContact CE-CG 3.44Å; M49-F62 VanDerWaalsContact CE-CG 3.44Å; M49-F62 HydrophobicContact CE-CZ 4.49Å; M49-F62 WeakPolarHBondContact O-CB 3.37Å; M49-F62 PolarHBondContact O-N 3.01Å; T51-F62 HydrophobicContact CG2-CB 4.06Å; T51-F62 HydrophobicContact CG2-CD2 3.69Å; T51-F62 HydrophobicContact CG2-CG 4.13Å; R60-F62 PolarHBondContact O-N 2.97Å; F62-F80 HydrophobicContact CD1-CD1 4.07Å; F62-F80 HydrophobicContact CE1-CB 4.32Å; F62-F80 HydrophobicContact CE1-CD1 4.44Å; F62-I81 WeakPolarHBondContact CZ-O 3.38Å; F62-V82 HydrophobicContact CE1-CG1 4Å; F62-V82 HydrophobicContact CE2-CG1 3.92Å; F62-V82 HydrophobicContact CZ-CG1 3.65Å
63	G	92.5	Very high	84.8	Confident	13 Å²	13	69.7 Å²	69.7	13%	0.134	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.5	178.8	176.5	0	0	0	0	0	112.7	M49	M49-G63 PolarHBondContact N-O 2.56Å; M49-G63 PolarHBondContact O-N 3.27Å
64	R	96.6	Very high	85.6	Confident	60 Å²	60	69.3 Å²	69.3	23%	0.226	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	147.5	179.2	-46.1	-170.7	-176.8	177.8	-0.7	110.7	L46 C47 V48 E61 R78 P104	L46-R64 HydrophobicContact CD1-CB 4.2Å; C47-R64 CarbonylContact O-C 3.55Å; C47-R64 WeakPolarHBondContact O-CA 3.16Å; V48-R64 HydrophobicContact CB-CG 4.48Å; V48-R64 HydrophobicContact CG1-CG 4.13Å; V48-R64 HydrophobicContact CG2-CG 3.97Å; E61-R64 VanDerWaalsContact CD-NE 3.35Å; E61-R64 VanDerWaalsContact OE1-CG 3.3Å; E61-R64 WeakPolarHBondContact OE1-CG 3.48Å; E61-R64 IonicContact OE1-CZ 3.23Å; E61-R64 IonicContact OE1-NE 2.76Å; E61-R64 PolarHBondContact OE1-NE 3.14Å; E61-R64 IonicContact OE1-NH2 3.68Å; E61-R64 PolarHBondContact OE1-NH2 3.3Å; E61-R64 IonicContact OE2-CZ 3.31Å; E61-R64 IonicContact OE2-NE 3.51Å; E61-R64 PolarHBondContact OE2-NE 3.34Å; E61-R64 IonicContact OE2-NH2 2.91Å; E61-R64 PolarHBondContact OE2-NH2 3.14Å; R64-R78 VanDerWaalsContact O-CD 3.29Å; R64-R78 WeakPolarHBondContact O-CD 3.35Å; R64-R78 PolarHBondContact O-NE 2.93Å; R64-R78 PolarHBondContact O-NH1 3.01Å; R64-P104 PolarHBondContact NH1-O 3.3Å
65	T	92.6	Very high	86.5	Confident	8 Å²	8	69.7 Å²	69.7	5%	0.049	34%	0.338	C	S	.	.			trans	-72.8	179.4	168.8	62	0	0	0	0	110.9	L46 C47 F76 F80	L46-T65 WeakPolarHBondContact CD1-O 3.32Å; C47-T65 HydrophobicContact CB-CG2 3.83Å; C47-T65 PolarHBondContact N-OG1 3.3Å; C47-T65 PolarHBondContact O-N 3.49Å; C47-T65 PolarHBondContact O-OG1 2.89Å; T65-F76 HydrophobicContact CG2-CB 3.9Å; T65-F76 HydrophobicContact CG2-CD1 4.07Å; T65-F76 HydrophobicContact CG2-CD2 4.34Å; T65-F76 HydrophobicContact CG2-CG 3.86Å; T65-F76 VanDerWaalsContact OG1-CD1 3.29Å; T65-F76 WeakPolarHBondContact OG1-CD1 3.47Å; T65-F76 WeakPolarHBondContact OG1-CE1 3.2Å; T65-F80 HydrophobicContact CG2-CE2 3.9Å; T65-F80 HydrophobicContact CG2-CZ 3.72Å
66	E	91	Very high	87.6	Confident	59 Å²	59	63.5 Å²	63.5	28%	0.276	31%	0.309	S	S	.	.			trans	-69.1	167.1	157	75	-72.8	177.4	0	0	111.8	I68 F76 V77 R78	E66-I68 HydrophobicContact CG-CG1 4.44Å; E66-F76 WeakPolarHBondContact O-CE1 3.37Å; E66-F76 VanDerWaalsContact OE1-CA 3.31Å; E66-F76 WeakPolarHBondContact OE1-CA 3.17Å; E66-V77 PolarHBondContact OE1-N 2.79Å; E66-R78 WeakPolarHBondContact OE2-CB 3.43Å; E66-R78 PolarHBondContact OE2-N 3.13Å
67	V	93.4	Very high	88.2	Confident	57 Å²	57	65.4 Å²	65.4	35%	0.345	32%	0.324	S	S	.	.			trans	-90.4	136.9	170.3	-174.1	0	0	0	0	108.1	D44 P45 L46 V99	D44-V67 HydrophobicContact CB-CG1 3.94Å; P45-V67 WeakPolarHBondContact O-CA 3.45Å; L46-V67 HydrophobicContact CB-CG2 4.34Å; L46-V67 HydrophobicContact CD1-CG2 4.14Å; V67-V99 HydrophobicContact CG1-CB 3.97Å; V67-V99 HydrophobicContact CG1-CG1 4.49Å; V67-V99 HydrophobicContact CG1-CG2 4.01Å; V67-V99 HydrophobicContact CG2-CB 4.35Å; V67-V99 HydrophobicContact CG2-CG1 4.3Å; V67-V99 HydrophobicContact CG2-CG2 3.85Å
68	I	84.8	Confident	88.6	Confident	42 Å²	42	68.6 Å²	68.6	22%	0.215	33%	0.333	C	S	.	.			trans	-113.1	119.8	174.2	-53.7	-173.3	0	0	0	109.1	D44 P45 E66 T71 P74 D75 F76	D44-I68 WeakPolarHBondContact CA-O 3.47Å; P45-I68 WeakPolarHBondContact CD-O 3.38Å; P45-I68 PolarHBondContact O-N 3.05Å; P45-I68 VanDerWaalsContact O-N 3.15Å; E66-I68 HydrophobicContact CG-CG1 4.44Å; I68-T71 HydrophobicContact CB-CG2 3.96Å; I68-T71 HydrophobicContact CG2-CG2 3.52Å; I68-P74 HydrophobicContact CB-CB 4.36Å; I68-P74 HydrophobicContact CD1-CB 3.74Å; I68-P74 HydrophobicContact CG1-CB 4.4Å; I68-D75 VanDerWaalsContact CD1-O 3.23Å; I68-D75 WeakPolarHBondContact CD1-O 3.32Å; I68-F76 HydrophobicContact CD1-CD1 3.79Å; I68-F76 HydrophobicContact CD1-CE1 4.15Å; I68-F76 HydrophobicContact CD1-CG 4.34Å; I68-F76 HydrophobicContact CG1-CD1 3.97Å; I68-F76 HydrophobicContact CG1-CE1 4.06Å
69	D	87.1	Confident	88.8	Confident	123 Å²	123	67.4 Å²	67.4	66%	0.658	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	136.4	-173.1	-56.2	-14.5	0	0	0	112.4	D44 T71	D44-D69 WeakPolarHBondContact OD1-CA 3.28Å; D69-T71 PolarHBondContact O-N 2.87Å
70	N	84.8	Confident	89	Confident	90 Å²	90	64.9 Å²	64.9	48%	0.481	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	51.7	164.2	-168.8	26.1	0	0	0	114.3	K42 S43 D44	K42-N70 WeakPolarHBondContact CB-OD1 3.34Å; K42-N70 WeakPolarHBondContact CG-OD1 3.46Å; K42-N70 PolarHBondContact N-OD1 3.23Å; S43-N70 CarbonylContact O-C 3.56Å; S43-N70 WeakPolarHBondContact O-CA 3.36Å; S43-N70 PolarHBondContact O-N 3.34Å; D44-N70 PolarHBondContact OD1-N 2.86Å
71	T	86.1	Confident	89	Confident	29 Å²	29	62 Å²	62	18%	0.178	31%	0.312	C	S	.	.			trans	-142.4	140.5	-179.8	-170.8	0	0	0	0	113.7	S43 P45 I68 D69 N73 P74	S43-T71 PolarHBondContact O-N 3.33Å; P45-T71 WeakPolarHBondContact CD-O 3.49Å; P45-T71 HydrophobicContact CG-CG2 3.81Å; P45-T71 WeakPolarHBondContact CG-O 3.38Å; I68-T71 HydrophobicContact CB-CG2 3.96Å; I68-T71 HydrophobicContact CG2-CG2 3.52Å; D69-T71 PolarHBondContact O-N 2.87Å; T71-N73 PolarHBondContact OG1-N 3.47Å; T71-N73 VanDerWaalsContact OG1-N 3.09Å; T71-P74 HydrophobicContact CG2-CB 3.97Å
72	L	87.3	Confident	88.8	Confident	34 Å²	34	58.4 Å²	58.4	18%	0.178	30%	0.296	C	S	.	.	S	Bend	trans	-97.7	0.1	169.7	-55.1	-179.6	0	0	0	112.3	R32 N33 L34 D36 K42 P74	R32-L72 CarbonylContact C-O 3.51Å; N33-L72 PolarHBondContact N-O 3.2Å; N33-L72 VanDerWaalsContact N-O 3.08Å; L34-L72 HydrophobicContact CB-CB 4.35Å; L34-L72 HydrophobicContact CB-CD2 4.37Å; L34-L72 PolarHBondContact N-O 3.33Å; D36-L72 HydrophobicContact CB-CD1 4.2Å; D36-L72 HydrophobicContact CB-CD2 4.22Å; K42-L72 HydrophobicContact CB-CD2 4.14Å; K42-L72 HydrophobicContact CB-CG 4.22Å; K42-L72 HydrophobicContact CD-CG 4.34Å; K42-L72 HydrophobicContact CG-CG 4.35Å; L72-P74 VanDerWaalsContact C-CD 3.48Å
73	N	88.8	Confident	88.6	Confident	70 Å²	70	57.2 Å²	57.2	37%	0.374	29%	0.294	S	S	.	.	S	Bend	trans	-132.9	58.9	-176.6	-59.2	-69.4	0	0	0	110.9	C31 R32 N33 T71	C31-N73 CarbonylContact O-C 3.59Å; C31-N73 VanDerWaalsContact O-C 3.31Å; C31-N73 WeakPolarHBondContact O-CA 3.25Å; R32-N73 VanDerWaalsContact CA-OD1 3.25Å; R32-N73 WeakPolarHBondContact CA-OD1 3.31Å; R32-N73 WeakPolarHBondContact CD-OD1 3.26Å; N33-N73 PolarHBondContact N-OD1 3Å; T71-N73 PolarHBondContact OG1-N 3.47Å; T71-N73 VanDerWaalsContact OG1-N 3.09Å
74	P	89.8	Confident	88.4	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.006	29%	0.289	C	S	.	.			trans	-68	140.3	-177.1	29.8	-36.7	0	0	0	111.8	S30 C31 R32 L34 P45 I68 T71 L72 F76	S30-P74 CarbonylContact C-O 3.48Å; S30-P74 VanDerWaalsContact CA-O 3.29Å; S30-P74 WeakPolarHBondContact CA-O 3.11Å; S30-P74 WeakPolarHBondContact CB-O 3.35Å; C31-P74 HydrophobicContact CB-CG 3.76Å; C31-P74 PolarHBondContact N-O 3.04Å; R32-P74 PolarHBondContact NH1-O 3.5Å; L34-P74 HydrophobicContact CD1-CG 3.75Å; P45-P74 HydrophobicContact CB-CB 4.36Å; P45-P74 HydrophobicContact CB-CG 3.93Å; P45-P74 HydrophobicContact CG-CB 3.66Å; P45-P74 HydrophobicContact CG-CG 3.61Å; I68-P74 HydrophobicContact CB-CB 4.36Å; I68-P74 HydrophobicContact CD1-CB 3.74Å; I68-P74 HydrophobicContact CG1-CB 4.4Å; T71-P74 HydrophobicContact CG2-CB 3.97Å; L72-P74 VanDerWaalsContact C-CD 3.48Å; P74-F76 HydrophobicContact CB-CD2 4.46Å; P74-F76 HydrophobicContact CB-CE1 4.15Å; P74-F76 HydrophobicContact CB-CE2 3.94Å; P74-F76 HydrophobicContact CB-CZ 3.77Å; P74-F76 HydrophobicContact CG-CE2 3.83Å; P74-F76 HydrophobicContact CG-CZ 3.83Å
75	D	86.5	Confident	88.1	Confident	93 Å²	93	56.9 Å²	56.9	50%	0.497	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-116	103.1	164.8	-68.9	-44.5	0	0	0	107.2	S30 R32 I68	S30-D75 WeakPolarHBondContact CB-OD1 3.22Å; R32-D75 IonicContact CZ-OD1 2.65Å; R32-D75 VanDerWaalsContact CZ-OD1 3.23Å; R32-D75 IonicContact CZ-OD2 2.72Å; R32-D75 IonicContact NH1-OD1 3.75Å; R32-D75 PolarHBondContact NH1-OD1 2.86Å; R32-D75 IonicContact NH1-OD2 2.7Å; R32-D75 IonicContact NH2-OD1 3.04Å; R32-D75 PolarHBondContact NH2-OD1 2.77Å; R32-D75 IonicContact NH2-OD2 2.78Å; R32-D75 PolarHBondContact NH2-OD2 3.02Å; I68-D75 VanDerWaalsContact CD1-O 3.23Å; I68-D75 WeakPolarHBondContact CD1-O 3.32Å
76	F	87	Confident	88	Confident	8 Å²	8	56.8 Å²	56.8	4%	0.035	29%	0.289	C	S	.	.			trans	-78.1	134	-175.2	-59.7	-78.4	0	0	0	110.9	V29 P45 C47 T65 E66 I68 P74 L96	V29-F76 HydrophobicContact CB-CD2 4.1Å; V29-F76 HydrophobicContact CG1-CD2 4.04Å; V29-F76 HydrophobicContact CG1-CE2 4.32Å; V29-F76 WeakPolarHBondContact O-CB 3.34Å; V29-F76 WeakPolarHBondContact O-CD2 3.45Å; V29-F76 PolarHBondContact O-N 3.22Å; V29-F76 VanDerWaalsContact O-N 3.15Å; P45-F76 HydrophobicContact CB-CZ 4.17Å; P45-F76 WeakPolarHBondContact O-CE1 3.47Å; C47-F76 HydrophobicContact CB-CD2 4.38Å; C47-F76 HydrophobicContact CB-CE2 3.9Å; C47-F76 HydrophobicContact CB-CZ 4.05Å; T65-F76 HydrophobicContact CG2-CB 3.9Å; T65-F76 HydrophobicContact CG2-CD1 4.07Å; T65-F76 HydrophobicContact CG2-CD2 4.34Å; T65-F76 HydrophobicContact CG2-CG 3.86Å; T65-F76 VanDerWaalsContact OG1-CD1 3.29Å; T65-F76 WeakPolarHBondContact OG1-CD1 3.47Å; T65-F76 WeakPolarHBondContact OG1-CE1 3.2Å; E66-F76 WeakPolarHBondContact O-CE1 3.37Å; E66-F76 VanDerWaalsContact OE1-CA 3.31Å; E66-F76 WeakPolarHBondContact OE1-CA 3.17Å; I68-F76 HydrophobicContact CD1-CD1 3.79Å; I68-F76 HydrophobicContact CD1-CE1 4.15Å; I68-F76 HydrophobicContact CD1-CG 4.34Å; I68-F76 HydrophobicContact CG1-CD1 3.97Å; I68-F76 HydrophobicContact CG1-CE1 4.06Å; P74-F76 HydrophobicContact CB-CD2 4.46Å; P74-F76 HydrophobicContact CB-CE1 4.15Å; P74-F76 HydrophobicContact CB-CE2 3.94Å; P74-F76 HydrophobicContact CB-CZ 3.77Å; P74-F76 HydrophobicContact CG-CE2 3.83Å; P74-F76 HydrophobicContact CG-CZ 3.83Å; F76-L96 HydrophobicContact CE2-CD1 4.29Å; F76-L96 HydrophobicContact CZ-CD1 4.3Å
77	V	82.9	Confident	87.9	Confident	121 Å²	121	54.6 Å²	54.6	73%	0.733	28%	0.279	S	S	*	.			trans	-81.4	-40	177.5	-178.1	0	0	0	0	110.5	E66 K79	E66-V77 PolarHBondContact OE1-N 2.79Å; V77-K79 VanDerWaalsContact O-CG 3.31Å; V77-K79 WeakPolarHBondContact O-CG 3.14Å; V77-K79 PolarHBondContact O-N 2.65Å
78	R	82.9	Confident	87.6	Confident	148 Å²	148	53.8 Å²	53.8	56%	0.558	27%	0.271	S	S	*	.			trans	-70.5	125.2	178.3	-175.3	169.4	-177.2	176.3	5.2	110.3	R64 E66	R64-R78 VanDerWaalsContact O-CD 3.29Å; R64-R78 WeakPolarHBondContact O-CD 3.35Å; R64-R78 PolarHBondContact O-NE 2.93Å; R64-R78 PolarHBondContact O-NH1 3.01Å; E66-R78 WeakPolarHBondContact OE2-CB 3.43Å; E66-R78 PolarHBondContact OE2-N 3.13Å
79	K	87.9	Confident	87.7	Confident	75 Å²	75	55.8 Å²	55.8	33%	0.326	28%	0.278	S	S	.	.			trans	-104.4	155.3	-179.1	-39.8	-153.7	-129.1	149.3	0	110.9	E26 I27 T28 V77	E26-K79 VanDerWaalsContact CD-CE 3.46Å; E26-K79 HydrophobicContact CG-CB 3.4Å; E26-K79 HydrophobicContact CG-CD 3.73Å; E26-K79 HydrophobicContact CG-CG 4.09Å; E26-K79 IonicContact OE1-NZ 3.99Å; E26-K79 PolarHBondContact OE1-NZ 2.92Å; E26-K79 VanDerWaalsContact OE2-CB 3.25Å; E26-K79 WeakPolarHBondContact OE2-CB 3.03Å; E26-K79 WeakPolarHBondContact OE2-CD 3.45Å; E26-K79 WeakPolarHBondContact OE2-CE 3.46Å; E26-K79 VanDerWaalsContact OE2-CG 3.28Å; E26-K79 WeakPolarHBondContact OE2-CG 3.48Å; E26-K79 IonicContact OE2-NZ 3.1Å; E26-K79 PolarHBondContact OE2-NZ 3.39Å; E26-K79 VanDerWaalsContact OE2-NZ 3.09Å; I27-K79 WeakPolarHBondContact O-CA 3.17Å; I27-K79 WeakPolarHBondContact O-CB 3.21Å; T28-K79 VanDerWaalsContact OG1-CD 3.28Å; T28-K79 WeakPolarHBondContact OG1-CD 3.5Å; V77-K79 VanDerWaalsContact O-CG 3.31Å; V77-K79 WeakPolarHBondContact O-CG 3.14Å; V77-K79 PolarHBondContact O-N 2.65Å
80	F	90.8	Very high	87.8	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.026	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	124.3	175.6	-58	-72	0	0	0	110.2	E26 I27 V29 M49 F62 T65	E26-F80 CarbonylContact C-O 3.59Å; E26-F80 WeakPolarHBondContact CA-O 3.43Å; I27-F80 HydrophobicContact CB-CB 4.3Å; I27-F80 PolarHBondContact N-O 2.54Å; I27-F80 PolarHBondContact O-N 3.41Å; V29-F80 HydrophobicContact CG2-CD2 4.06Å; V29-F80 HydrophobicContact CG2-CE2 3.85Å; M49-F80 HydrophobicContact CB-CD1 4.21Å; M49-F80 HydrophobicContact CB-CD2 4.08Å; M49-F80 HydrophobicContact CB-CE1 3.98Å; M49-F80 HydrophobicContact CB-CE2 3.84Å; M49-F80 HydrophobicContact CB-CG 4.26Å; M49-F80 HydrophobicContact CB-CZ 3.78Å; M49-F80 HydrophobicContact CE-CB 3.52Å; M49-F80 HydrophobicContact CE-CD1 4.02Å; M49-F80 HydrophobicContact CE-CD2 4.33Å; M49-F80 HydrophobicContact CE-CG 3.71Å; M49-F80 HydrophobicContact SD-CB 3.95Å; M49-F80 HydrophobicContact SD-CD2 3.88Å; M49-F80 HydrophobicContact SD-CG 3.87Å; F62-F80 HydrophobicContact CD1-CD1 4.07Å; F62-F80 HydrophobicContact CE1-CB 4.32Å; F62-F80 HydrophobicContact CE1-CD1 4.44Å; T65-F80 HydrophobicContact CG2-CE2 3.9Å; T65-F80 HydrophobicContact CG2-CZ 3.72Å
81	I	89.9	Confident	88.2	Confident	87 Å²	87	49.3 Å²	49.3	45%	0.446	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	113.6	179.7	-58.8	-179.5	0	0	0	108.9	K24 V25 E26 F62 L189	K24-I81 HydrophobicContact CB-CG2 4.45Å; K24-I81 HydrophobicContact CD-CG2 4.23Å; V25-I81 WeakPolarHBondContact O-CA 3.41Å; E26-I81 HydrophobicContact CG-CG1 4.49Å; F62-I81 WeakPolarHBondContact CZ-O 3.38Å; I81-L189 HydrophobicContact CB-CD1 4.14Å; I81-L189 HydrophobicContact CD1-CD1 3.81Å; I81-L189 HydrophobicContact CG1-CD1 3.76Å; I81-L189 HydrophobicContact CG2-CD1 3.46Å; I81-L189 VanDerWaalsContact CG2-CD1 3.46Å
82	V	89.4	Confident	88.6	Confident	11 Å²	11	48.2 Å²	48.2	7%	0.067	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	151	-177.8	-64.9	0	0	0	0	110.9	K24 V25 I27 M49 F62 L119	K24-V82 WeakPolarHBondContact CA-O 3.44Å; V25-V82 HydrophobicContact CB-CG2 4.42Å; V25-V82 PolarHBondContact N-O 3.41Å; V25-V82 PolarHBondContact O-N 3.34Å; I27-V82 HydrophobicContact CD1-CG2 3.8Å; I27-V82 HydrophobicContact CG1-CG2 4.23Å; M49-V82 HydrophobicContact CE-CG1 3.76Å; F62-V82 HydrophobicContact CE1-CG1 4Å; F62-V82 HydrophobicContact CE2-CG1 3.92Å; F62-V82 HydrophobicContact CZ-CG1 3.65Å; V82-L119 HydrophobicContact CG2-CD1 4.19Å; V82-L119 HydrophobicContact CG2-CD2 3.63Å
83	D	88.1	Confident	89	Confident	66 Å²	66	47.9 Å²	47.9	35%	0.353	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	135.5	168.4	-63.6	-45.8	0	0	0	109	A22 K24 F85 Q90	A22-D83 HydrophobicContact CB-CB 3.93Å; K24-D83 WeakPolarHBondContact CG-OD1 2.64Å; K24-D83 IonicContact NZ-OD1 3.98Å; K24-D83 PolarHBondContact NZ-OD1 3.05Å; K24-D83 IonicContact NZ-OD2 2.8Å; D83-F85 HydrophobicContact CB-CD2 4.47Å; D83-F85 HydrophobicContact CB-CE2 3.68Å; D83-F85 HydrophobicContact CB-CZ 4.22Å; D83-Q90 PolarHBondContact O-NE2 3.1Å
84	Y	89.1	Confident	89.3	Confident	11 Å²	11	44.6 Å²	44.6	4%	0.043	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	129.4	177.8	167.6	-103.7	0	0	0	110.1	T23 V25 F86 L119 V123 L335 Y390	T23-Y84 PolarHBondContact N-O 3.13Å; T23-Y84 WeakPolarHBondContact O-CA 3.32Å; T23-Y84 WeakPolarHBondContact O-CB 3.43Å; T23-Y84 PolarHBondContact O-N 2.83Å; V25-Y84 HydrophobicContact CG2-CG 4.22Å; Y84-F86 HydrophobicContact CE1-CB 4.29Å; Y84-L119 HydrophobicContact CD2-CD2 3.86Å; Y84-L119 HydrophobicContact CD2-CG 3.94Å; Y84-L119 HydrophobicContact CG-CD2 4.38Å; Y84-V123 HydrophobicContact CD2-CG2 4.44Å; Y84-V123 HydrophobicContact CE2-CG2 3.69Å; Y84-L335 HydrophobicContact CD1-CD1 3.86Å; Y84-L335 HydrophobicContact CD1-CD2 4.21Å; Y84-L335 HydrophobicContact CD1-CG 4.27Å; Y84-L335 HydrophobicContact CE1-CD1 4.06Å; Y84-L335 HydrophobicContact CE1-CD2 3.57Å; Y84-L335 HydrophobicContact CE1-CG 3.96Å; Y84-Y390 WeakPolarHBondContact CE2-OH 3.15Å; Y84-Y390 WeakPolarHBondContact OH-CE1 3.47Å; Y84-Y390 VanDerWaalsContact OH-CZ 3.31Å; Y84-Y390 PolarHBondContact OH-OH 2.82Å
85	F	89.4	Confident	89.6	Confident	56 Å²	56	44.5 Å²	44.5	25%	0.246	21%	0.214	C	C	.	.			trans	-124.7	117.5	176.3	-60.4	-89.9	0	0	0	107.2	A22 D83 E87 E88 Q90	A22-F85 HydrophobicContact CB-CD1 3.81Å; A22-F85 HydrophobicContact CB-CD2 4.31Å; A22-F85 HydrophobicContact CB-CE1 3.25Å; A22-F85 HydrophobicContact CB-CE2 3.81Å; A22-F85 HydrophobicContact CB-CG 4.31Å; A22-F85 HydrophobicContact CB-CZ 3.25Å; D83-F85 HydrophobicContact CB-CD2 4.47Å; D83-F85 HydrophobicContact CB-CE2 3.68Å; D83-F85 HydrophobicContact CB-CZ 4.22Å; F85-E87 PolarHBondContact O-N 2.9Å; F85-E88 HydrophobicContact CB-CB 3.87Å; F85-E88 HydrophobicContact CB-CG 3.63Å; F85-E88 WeakPolarHBondContact CD2-OE2 3.39Å; F85-E88 HydrophobicContact CG-CG 4.28Å; F85-E88 PolarHBondContact O-N 3.32Å; F85-Q90 PolarHBondContact O-OE1 3.36Å
86	F	90.3	Very high	89.9	Confident	5 Å²	5	40.1 Å²	40.1	2%	0.022	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-38.4	-177.9	164.4	-103.3	0	0	0	111.1	Y84 E88 F334 I344 I386 Y390 L564 I567 P568	Y84-F86 HydrophobicContact CE1-CB 4.29Å; F86-E88 VanDerWaalsContact C-N 3.26Å; F86-E88 PolarHBondContact O-N 2.68Å; F86-F334 AromaticContact CD2-CE1 3.62Å; F86-F334 HydrophobicContact CD2-CE1 3.62Å; F86-F334 AromaticContact CD2-CZ 3.55Å; F86-F334 HydrophobicContact CD2-CZ 3.55Å; F86-F334 HydrophobicContact CE2-CE1 4.17Å; F86-F334 HydrophobicContact CE2-CE2 4.48Å; F86-F334 AromaticContact CE2-CZ 3.62Å; F86-F334 HydrophobicContact CE2-CZ 3.62Å; F86-F334 HydrophobicContact CG-CE1 4.34Å; F86-F334 HydrophobicContact CG-CZ 4.41Å; F86-I344 HydrophobicContact CE2-CD1 4.05Å; F86-I344 HydrophobicContact CZ-CD1 4.29Å; F86-I386 WeakPolarHBondContact O-CG2 3.22Å; F86-Y390 HydrophobicContact CD2-CD2 4.39Å; F86-Y390 HydrophobicContact CD2-CE1 4.21Å; F86-Y390 AromaticContact CD2-CE2 3.77Å; F86-Y390 HydrophobicContact CD2-CE2 3.77Å; F86-Y390 AromaticContact CD2-CZ 3.67Å; F86-Y390 AromaticContact CE2-CD2 3.74Å; F86-Y390 HydrophobicContact CE2-CD2 3.74Å; F86-Y390 HydrophobicContact CE2-CE1 4.35Å; F86-Y390 AromaticContact CE2-CE2 3.53Å; F86-Y390 HydrophobicContact CE2-CE2 3.53Å; F86-Y390 HydrophobicContact CE2-CG 4.26Å; F86-Y390 AromaticContact CE2-CZ 3.87Å; F86-L564 HydrophobicContact CD1-CB 4.09Å; F86-L564 WeakPolarHBondContact CD1-O 3.33Å; F86-L564 HydrophobicContact CE1-CB 3.76Å; F86-L564 HydrophobicContact CE1-CD2 4Å; F86-L564 HydrophobicContact CE1-CG 4.31Å; F86-L564 WeakPolarHBondContact CE1-O 3.19Å; F86-L564 HydrophobicContact CZ-CD2 4.36Å; F86-I567 HydrophobicContact CE1-CB 3.75Å; F86-I567 HydrophobicContact CE1-CG1 4.33Å; F86-I567 HydrophobicContact CE1-CG2 4.05Å; F86-I567 HydrophobicContact CZ-CB 4.21Å; F86-I567 HydrophobicContact CZ-CG2 3.99Å; F86-P568 HydrophobicContact CB-CG 3.83Å; F86-P568 HydrophobicContact CD1-CG 3.59Å; F86-P568 HydrophobicContact CE1-CG 4.3Å; F86-P568 HydrophobicContact CG-CG 3.72Å
87	E	88.9	Confident	90.1	Very high	14 Å²	14	40.1 Å²	40.1	7%	0.065	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	4.5	-173	74	-80.5	-169	0	0	113.8	F85 I386 R561 L564	F85-E87 PolarHBondContact O-N 2.9Å; E87-I386 WeakPolarHBondContact O-CD1 3.49Å; E87-R561 HydrophobicContact CG-CB 3.96Å; E87-R561 HydrophobicContact CG-CG 3.5Å; E87-L564 HydrophobicContact CB-CB 3.69Å
88	E	86.8	Confident	90.5	Very high	40 Å²	40	34.4 Å²	34.4	19%	0.187	16%	0.156	C	C	.	.	S	Bend	trans	-121.5	140.7	-178.5	-60.6	-174.8	166	0	0	113.7	M54 F85 F86 Q90	M54-E88 HydrophobicContact CE-CB 4.32Å; M54-E88 HydrophobicContact CE-CG 3.98Å; M54-E88 VanDerWaalsContact CE-OE1 3.22Å; M54-E88 WeakPolarHBondContact CE-OE1 3.34Å; M54-E88 WeakPolarHBondContact CE-OE2 3.3Å; F85-E88 HydrophobicContact CB-CB 3.87Å; F85-E88 HydrophobicContact CB-CG 3.63Å; F85-E88 WeakPolarHBondContact CD2-OE2 3.39Å; F85-E88 HydrophobicContact CG-CG 4.28Å; F85-E88 PolarHBondContact O-N 3.32Å; F86-E88 VanDerWaalsContact C-N 3.26Å; F86-E88 PolarHBondContact O-N 2.68Å; E88-Q90 HydrophobicContact CB-CG 3.92Å; E88-Q90 PolarHBondContact O-N 3.39Å; E88-Q90 VanDerWaalsContact O-N 3.09Å
89	K	87	Confident	90.8	Very high	84 Å²	84	28.5 Å²	28.5	37%	0.365	14%	0.136	S	C	.	.			trans	-82	85.9	169.1	-167	-179.2	-172	173	0	111.1	N91 T118 E385 I386	K89-N91 PolarHBondContact O-N 3.1Å; K89-T118 HydrophobicContact CG-CG2 4.01Å; K89-E385 IonicContact NZ-OE1 3.72Å; K89-E385 IonicContact NZ-OE2 3.61Å; K89-E385 PolarHBondContact NZ-OE2 2.89Å; K89-I386 HydrophobicContact CB-CG1 4.21Å
90	Q	90.3	Very high	90.5	Very high	35 Å²	35	28.3 Å²	28.3	16%	0.164	14%	0.138	C	C	.	.			trans	-86	92.8	-177.5	-57.4	178.1	-87.2	0	0	111.6	D83 F85 E88 T118 L119	D83-Q90 PolarHBondContact O-NE2 3.1Å; F85-Q90 PolarHBondContact O-OE1 3.36Å; E88-Q90 HydrophobicContact CB-CG 3.92Å; E88-Q90 PolarHBondContact O-N 3.39Å; E88-Q90 VanDerWaalsContact O-N 3.09Å; Q90-T118 CarbonylContact O-C 3.59Å; Q90-T118 VanDerWaalsContact O-CA 3.24Å; Q90-T118 WeakPolarHBondContact O-CA 3.49Å; Q90-L119 HydrophobicContact CB-CB 3.97Å; Q90-L119 PolarHBondContact O-N 3.29Å
91	N	92.2	Very high	90.3	Very high	42 Å²	42	30.3 Å²	30.3	23%	0.225	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	132.1	-177.9	-63	-38.7	0	0	0	112.4	Q52 W59 K89 T118	Q52-N91 HydrophobicContact CB-CB 4Å; Q52-N91 PolarHBondContact N-O 2.93Å; Q52-N91 PolarHBondContact OE1-ND2 3.14Å; W59-N91 HydrophobicContact CH2-CB 3.94Å; W59-N91 HydrophobicContact CZ3-CB 4.49Å; K89-N91 PolarHBondContact O-N 3.1Å; N91-T118 WeakPolarHBondContact OD1-CG2 3.42Å
92	L	95.4	Very high	89.9	Confident	5 Å²	5	36.6 Å²	36.6	3%	0.026	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143.2	178.6	-56.8	178.3	0	0	0	110.6	I27 M49 Y50 T51 F94 F116 C117 L119 I122	I27-L92 HydrophobicContact CD1-CD1 3.87Å; M49-L92 HydrophobicContact SD-CD2 4.41Å; Y50-L92 WeakPolarHBondContact O-CA 3.48Å; T51-L92 HydrophobicContact CG2-CD2 3.91Å; L92-F94 HydrophobicContact CB-CE2 3.76Å; L92-F94 HydrophobicContact CB-CZ 4.32Å; L92-F94 HydrophobicContact CD1-CE2 4.24Å; L92-F94 HydrophobicContact CD1-CZ 4.18Å; L92-F116 WeakPolarHBondContact O-CA 3.42Å; L92-C117 PolarHBondContact N-O 2.81Å; L92-C117 PolarHBondContact O-N 3.37Å; L92-C117 VanDerWaalsContact O-N 3.12Å; L92-C117 VanDerWaalsContact O-O 3.05Å; L92-L119 HydrophobicContact CD1-CB 4.11Å; L92-L119 HydrophobicContact CD1-CD1 4.29Å; L92-I122 HydrophobicContact CD1-CD1 3.81Å
93	R	95.4	Very high	89.8	Confident	28 Å²	28	37.3 Å²	37.3	11%	0.106	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	134.6	169.6	-177.9	-174.8	85.4	-164.2	2.8	109.3	M49 Y50 W59 D95 A115 F116	M49-R93 CarbonylContact C-O 3.48Å; M49-R93 WeakPolarHBondContact CA-O 3.24Å; Y50-R93 VanDerWaalsContact CE2-NH2 3.33Å; Y50-R93 VanDerWaalsContact CZ-NH2 3.32Å; Y50-R93 PolarHBondContact N-O 3.26Å; Y50-R93 PolarHBondContact O-N 3.07Å; W59-R93 HydrophobicContact CD2-CB 4.41Å; W59-R93 HydrophobicContact CE3-CB 3.87Å; W59-R93 HydrophobicContact CH2-CB 3.76Å; W59-R93 HydrophobicContact CZ2-CB 4.32Å; W59-R93 HydrophobicContact CZ3-CB 3.52Å; R93-D95 WeakPolarHBondContact CD-OD1 3.45Å; R93-D95 WeakPolarHBondContact CG-OD1 3.4Å; R93-D95 IonicContact CZ-OD1 3.5Å; R93-D95 IonicContact CZ-OD2 3.23Å; R93-D95 VanDerWaalsContact CZ-OD2 3.23Å; R93-D95 IonicContact NE-OD1 3.69Å; R93-D95 PolarHBondContact NE-OD1 2.84Å; R93-D95 VanDerWaalsContact NE-OD1 3.1Å; R93-D95 IonicContact NE-OD2 3.65Å; R93-D95 PolarHBondContact NE-OD2 2.99Å; R93-D95 IonicContact NH2-OD2 3.53Å; R93-D95 PolarHBondContact NH2-OD2 3.34Å; R93-A115 WeakPolarHBondContact CA-O 3.37Å; R93-F116 HydrophobicContact CB-CD1 3.85Å; R93-F116 HydrophobicContact CB-CE1 3.86Å; R93-F116 HydrophobicContact CG-CD1 3.82Å; R93-F116 HydrophobicContact CG-CE1 3.51Å; R93-F116 HydrophobicContact CG-CG 4.48Å; R93-F116 HydrophobicContact CG-CZ 3.89Å
94	F	95.9	Very high	89.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	119.4	176.9	-62.4	-93.7	0	0	0	108.8	I27 V29 V48 M49 L92 Q114 A115 I182 L184	I27-F94 HydrophobicContact CG2-CZ 4.36Å; V29-F94 HydrophobicContact CG2-CD1 4.24Å; V29-F94 HydrophobicContact CG2-CE1 3.95Å; V48-F94 WeakPolarHBondContact O-CA 3.29Å; M49-F94 HydrophobicContact CB-CD1 4.14Å; M49-F94 HydrophobicContact CB-CE1 4.02Å; M49-F94 HydrophobicContact CG-CD1 4.02Å; M49-F94 HydrophobicContact CG-CE1 3.58Å; M49-F94 HydrophobicContact CG-CZ 3.92Å; M49-F94 HydrophobicContact SD-CE1 3.59Å; M49-F94 VanDerWaalsContact SD-CE1 3.59Å; M49-F94 HydrophobicContact SD-CZ 3.69Å; L92-F94 HydrophobicContact CB-CE2 3.76Å; L92-F94 HydrophobicContact CB-CZ 4.32Å; L92-F94 HydrophobicContact CD1-CE2 4.24Å; L92-F94 HydrophobicContact CD1-CZ 4.18Å; F94-Q114 CarbonylContact O-C 3.57Å; F94-Q114 WeakPolarHBondContact O-CA 3.45Å; F94-A115 PolarHBondContact N-O 2.89Å; F94-A115 PolarHBondContact O-N 2.88Å; F94-I182 HydrophobicContact CB-CD1 3.55Å; F94-I182 HydrophobicContact CD1-CD1 4.18Å; F94-I182 HydrophobicContact CD2-CD1 4.44Å; F94-I182 HydrophobicContact CG-CD1 3.81Å; F94-L184 HydrophobicContact CD1-CD2 4.05Å; F94-L184 HydrophobicContact CD2-CD1 3.9Å; F94-L184 HydrophobicContact CD2-CD2 4.33Å; F94-L184 HydrophobicContact CE1-CD2 3.75Å; F94-L184 HydrophobicContact CE2-CD1 3.51Å; F94-L184 HydrophobicContact CE2-CD2 4.07Å; F94-L184 HydrophobicContact CE2-CG 4.46Å; F94-L184 HydrophobicContact CG-CD2 4.33Å; F94-L184 HydrophobicContact CZ-CD1 3.93Å; F94-L184 HydrophobicContact CZ-CD2 3.77Å; F94-L184 HydrophobicContact CZ-CG 4.5Å
95	D	94.9	Very high	89.5	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130.5	177.5	-62.9	-15	0	0	0	108.9	V48 Y50 R93 Y97 F111 Q114	V48-D95 PolarHBondContact N-O 2.82Å; V48-D95 PolarHBondContact O-N 3.18Å; Y50-D95 HydrophobicContact CE2-CB 4.01Å; Y50-D95 WeakPolarHBondContact CE2-OD2 3.49Å; R93-D95 WeakPolarHBondContact CD-OD1 3.45Å; R93-D95 WeakPolarHBondContact CG-OD1 3.4Å; R93-D95 IonicContact CZ-OD1 3.5Å; R93-D95 IonicContact CZ-OD2 3.23Å; R93-D95 VanDerWaalsContact CZ-OD2 3.23Å; R93-D95 IonicContact NE-OD1 3.69Å; R93-D95 PolarHBondContact NE-OD1 2.84Å; R93-D95 VanDerWaalsContact NE-OD1 3.1Å; R93-D95 IonicContact NE-OD2 3.65Å; R93-D95 PolarHBondContact NE-OD2 2.99Å; R93-D95 IonicContact NH2-OD2 3.53Å; R93-D95 PolarHBondContact NH2-OD2 3.34Å; D95-Y97 HydrophobicContact CB-CD2 4.44Å; D95-Y97 HydrophobicContact CB-CE2 3.63Å; D95-F111 HydrophobicContact CB-CE2 4.08Å; D95-Q114 WeakPolarHBondContact OD1-CB 3.33Å
96	L	93.4	Very high	89.4	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.3	179.9	-78	-66.2	0	0	0	110	L46 C47 F76 F111 L112 G113 L134 I182	L46-L96 WeakPolarHBondContact O-CA 3.12Å; C47-L96 HydrophobicContact CB-CD1 3.69Å; F76-L96 HydrophobicContact CE2-CD1 4.29Å; F76-L96 HydrophobicContact CZ-CD1 4.3Å; L96-F111 WeakPolarHBondContact O-CD2 3.22Å; L96-L112 HydrophobicContact CB-CB 3.97Å; L96-L112 PolarHBondContact O-N 2.85Å; L96-G113 PolarHBondContact N-O 3.03Å; L96-L134 HydrophobicContact CD2-CD2 3.89Å; L96-L134 HydrophobicContact CG-CD1 4.31Å; L96-L134 HydrophobicContact CG-CD2 4.45Å; L96-I182 HydrophobicContact CD2-CD1 4.17Å
97	Y	92.1	Very high	89.1	Confident	9 Å²	9	41 Å²	41	4%	0.035	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	150.6	-179.6	-65.6	-92.2	0	0	0	111.2	P45 L46 V48 D95 L106 H109 D110 F111	P45-Y97 CarbonylContact C-O 3.55Å; P45-Y97 VanDerWaalsContact CA-O 3.26Å; P45-Y97 WeakPolarHBondContact CA-O 3.19Å; L46-Y97 PolarHBondContact N-O 2.92Å; L46-Y97 PolarHBondContact O-N 2.81Å; V48-Y97 HydrophobicContact CG2-CD2 4.04Å; V48-Y97 HydrophobicContact CG2-CE2 4.04Å; D95-Y97 HydrophobicContact CB-CD2 4.44Å; D95-Y97 HydrophobicContact CB-CE2 3.63Å; Y97-L106 HydrophobicContact CD2-CD2 4.06Å; Y97-L106 HydrophobicContact CE1-CB 4.16Å; Y97-L106 HydrophobicContact CE2-CD1 4.08Å; Y97-L106 HydrophobicContact CE2-CD2 4.09Å; Y97-L106 HydrophobicContact CE2-CG 4.5Å; Y97-L106 HydrophobicContact CG-CD2 4.34Å; Y97-H109 HydrophobicContact CD1-CB 4.12Å; Y97-D110 CarbonylContact C-O 3.55Å; Y97-D110 VanDerWaalsContact CA-O 3.29Å; Y97-D110 WeakPolarHBondContact CA-O 3.46Å; Y97-F111 HydrophobicContact CD1-CB 4.44Å; Y97-F111 HydrophobicContact CD1-CD2 4.27Å; Y97-F111 HydrophobicContact CE1-CB 4.32Å; Y97-F111 AromaticContact CE1-CD2 3.83Å; Y97-F111 HydrophobicContact CE1-CD2 3.83Å; Y97-F111 HydrophobicContact CE2-CD2 4.46Å; Y97-F111 AromaticContact CZ-CD2 3.94Å
98	D	90.6	Very high	88.9	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	119.2	169.6	-167.2	-2.4	0	0	0	109.3	S43 D44 D100 H109 D110 L112	S43-D98 VanDerWaalsContact CA-OD1 3.29Å; S43-D98 WeakPolarHBondContact CA-OD1 3.31Å; S43-D98 VanDerWaalsContact CA-OD2 3.3Å; S43-D98 WeakPolarHBondContact CA-OD2 3.37Å; S43-D98 WeakPolarHBondContact CB-OD2 3.4Å; S43-D98 PolarHBondContact OG-OD2 2.9Å; D44-D98 PolarHBondContact N-OD1 2.87Å; D98-D100 PolarHBondContact O-N 3.48Å; D98-H109 VanDerWaalsContact O-CB 3.3Å; D98-H109 WeakPolarHBondContact O-CB 3.35Å; D98-D110 HydrophobicContact CB-CB 3.94Å; D98-D110 PolarHBondContact N-O 2.86Å; D98-D110 PolarHBondContact O-N 2.85Å; D98-L112 HydrophobicContact CB-CD1 4.03Å; D98-L112 HydrophobicContact CB-CD2 3.9Å; D98-L112 HydrophobicContact CB-CG 3.96Å
99	V	88.9	Confident	88.9	Confident	23 Å²	23	43.2 Å²	43.2	14%	0.139	22%	0.222	C	C	.	.			trans	-89.2	91.5	-165.3	179.9	0	0	0	0	111.9	D44 L46 V67 S101	D44-V99 HydrophobicContact CB-CB 4.35Å; D44-V99 WeakPolarHBondContact O-CG2 3.48Å; D44-V99 PolarHBondContact O-N 2.92Å; L46-V99 HydrophobicContact CB-CG2 3.63Å; L46-V99 HydrophobicContact CD2-CG2 4.15Å; V67-V99 HydrophobicContact CG1-CB 3.97Å; V67-V99 HydrophobicContact CG1-CG1 4.49Å; V67-V99 HydrophobicContact CG1-CG2 4.01Å; V67-V99 HydrophobicContact CG2-CB 4.35Å; V67-V99 HydrophobicContact CG2-CG1 4.3Å; V67-V99 HydrophobicContact CG2-CG2 3.85Å; V99-S101 VanDerWaalsContact C-N 3.3Å; V99-S101 VanDerWaalsContact CG1-O 3.3Å; V99-S101 WeakPolarHBondContact CG1-O 3.36Å; V99-S101 PolarHBondContact O-N 2.96Å
100	D	82.3	Confident	88.9	Confident	71 Å²	71	40.7 Å²	40.7	38%	0.38	21%	0.213	S	C	.	.			trans	-74.7	-10.9	180	-51.7	-70.9	0	0	0	115.9	D98 H109 D110 K147	D98-D100 PolarHBondContact O-N 3.48Å; D100-H109 PolarHBondContact N-ND1 2.92Å; D100-D110 PolarHBondContact OD2-N 3.41Å; D100-K147 IonicContact OD2-NZ 3.55Å; D100-K147 PolarHBondContact OD2-NZ 3.07Å
101	S	85.6	Confident	88.8	Confident	49 Å²	49	39.4 Å²	39.4	34%	0.343	21%	0.206	S	C	.	.	S	Bend	trans	-156.6	167.8	-171.6	78	0	0	0	0	113.1	V99 S103 H109	V99-S101 VanDerWaalsContact C-N 3.3Å; V99-S101 VanDerWaalsContact CG1-O 3.3Å; V99-S101 WeakPolarHBondContact CG1-O 3.36Å; V99-S101 PolarHBondContact O-N 2.96Å; S101-S103 PolarHBondContact O-N 2.87Å; S101-S103 WeakPolarHBondContact OG-CB 3.37Å; S101-S103 PolarHBondContact OG-N 2.62Å; S101-H109 PolarHBondContact O-CE1 2.77Å
102	K	83.1	Confident	88.6	Confident	218 Å²	218	37.4 Å²	37.4	95%	0.948	20%	0.196	S	C	*	.	S	Bend	trans	-76.3	2.2	175.2	-60.5	-173.3	178.5	-175.9	0	114.4
103	S	86.9	Confident	88.3	Confident	27 Å²	27	37.1 Å²	37.1	19%	0.189	20%	0.195	C	C	.	.			trans	-74.9	135.5	-176.6	-171.1	0	0	0	0	110.5	S101 D105 K108 H109	S101-S103 PolarHBondContact O-N 2.87Å; S101-S103 WeakPolarHBondContact OG-CB 3.37Å; S101-S103 PolarHBondContact OG-N 2.62Å; S103-D105 PolarHBondContact O-N 2.78Å; S103-D105 VanDerWaalsContact O-N 3.09Å; S103-D105 WeakPolarHBondContact OG-CB 3.22Å; S103-K108 WeakPolarHBondContact OG-CD 3.41Å; S103-K108 PolarHBondContact OG-NZ 2.93Å; S103-H109 PolarHBondContact O-CE1 3.48Å; S103-H109 PolarHBondContact O-NE2 2.86Å
104	P	83.4	Confident	88.2	Confident	106 Å²	106	36.8 Å²	36.8	69%	0.688	19%	0.194	S	C	*	.	S	Bend	trans	-75.1	6.6	174.5	32.2	-36.9	0	0	0	113.8	R64	R64-P104 PolarHBondContact NH1-O 3.3Å
105	D	87.1	Confident	88	Confident	68 Å²	68	37 Å²	37	36%	0.364	20%	0.196	S	C	.	.			trans	-93.8	107.8	-172.2	174.9	3.9	0	0	0	108.7	S103 S107 K108	S103-D105 PolarHBondContact O-N 2.78Å; S103-D105 VanDerWaalsContact O-N 3.09Å; S103-D105 WeakPolarHBondContact OG-CB 3.22Å; D105-S107 PolarHBondContact O-N 3.39Å; D105-S107 VanDerWaalsContact OD1-CB 3.24Å; D105-S107 WeakPolarHBondContact OD1-CB 3.3Å; D105-S107 PolarHBondContact OD1-N 2.84Å; D105-S107 PolarHBondContact OD1-OG 3.4Å; D105-S107 PolarHBondContact OD2-OG 3.46Å; D105-S107 VanDerWaalsContact OD2-OG 3.08Å; D105-K108 HydrophobicContact CB-CD 4.3Å; D105-K108 HydrophobicContact CB-CG 4.33Å; D105-K108 WeakPolarHBondContact O-CB 3.28Å; D105-K108 PolarHBondContact O-N 2.96Å; D105-K108 WeakPolarHBondContact OD2-CE 3.27Å
106	L	87.6	Confident	88	Confident	20 Å²	20	40.9 Å²	40.9	11%	0.105	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-57.4	-23.1	-177.1	-63.3	177.7	0	0	0	113	L46 V48 Y50 Y97 K108 H109	L46-L106 HydrophobicContact CD2-CD2 4.31Å; V48-L106 HydrophobicContact CG2-CD1 4.11Å; V48-L106 HydrophobicContact CG2-CD2 3.98Å; Y50-L106 WeakPolarHBondContact OH-CD1 3.31Å; Y97-L106 HydrophobicContact CD2-CD2 4.06Å; Y97-L106 HydrophobicContact CE1-CB 4.16Å; Y97-L106 HydrophobicContact CE2-CD1 4.08Å; Y97-L106 HydrophobicContact CE2-CD2 4.09Å; Y97-L106 HydrophobicContact CE2-CG 4.5Å; Y97-L106 HydrophobicContact CG-CD2 4.34Å; L106-K108 PolarHBondContact O-N 3.46Å; L106-H109 PolarHBondContact O-N 3.1Å
107	S	83.9	Confident	88	Confident	21 Å²	21	41.3 Å²	41.3	15%	0.147	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-71.3	-9.7	-179.9	82	0	0	0	0	114.3	D105 N142 T145 M149	D105-S107 PolarHBondContact O-N 3.39Å; D105-S107 VanDerWaalsContact OD1-CB 3.24Å; D105-S107 WeakPolarHBondContact OD1-CB 3.3Å; D105-S107 PolarHBondContact OD1-N 2.84Å; D105-S107 PolarHBondContact OD1-OG 3.4Å; D105-S107 PolarHBondContact OD2-OG 3.46Å; D105-S107 VanDerWaalsContact OD2-OG 3.08Å; S107-N142 VanDerWaalsContact CB-ND2 3.31Å; S107-N142 WeakPolarHBondContact CB-ND2 3.46Å; S107-N142 PolarHBondContact O-ND2 3.09Å; S107-N142 PolarHBondContact OG-ND2 2.79Å; S107-T145 PolarHBondContact O-OG1 2.88Å; S107-M149 VanDerWaalsContact CA-SD 3.6Å; S107-M149 WeakPolarHBondContact CB-SD 3.39Å
108	K	84.8	Confident	88.1	Confident	94 Å²	94	41.4 Å²	41.4	41%	0.409	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-98.1	-10.1	176.5	-60.7	-175.8	-169.3	167.3	0	113.5	S103 D105 L106 K147	S103-K108 WeakPolarHBondContact OG-CD 3.41Å; S103-K108 PolarHBondContact OG-NZ 2.93Å; D105-K108 HydrophobicContact CB-CD 4.3Å; D105-K108 HydrophobicContact CB-CG 4.33Å; D105-K108 WeakPolarHBondContact O-CB 3.28Å; D105-K108 PolarHBondContact O-N 2.96Å; D105-K108 WeakPolarHBondContact OD2-CE 3.27Å; L106-K108 PolarHBondContact O-N 3.46Å; K108-K147 PolarHBondContact O-NZ 3.07Å; K108-K147 VanDerWaalsContact O-NZ 3.1Å
109	H	86.7	Confident	88.3	Confident	7 Å²	7	41.4 Å²	41.4	3%	0.032	22%	0.217	C	C	.	.	S	Bend	trans	-99.5	156.4	-179	-58.9	-44.5	0	0	0	111	Y97 D98 D100 S101 S103 L106	Y97-H109 HydrophobicContact CD1-CB 4.12Å; D98-H109 VanDerWaalsContact O-CB 3.3Å; D98-H109 WeakPolarHBondContact O-CB 3.35Å; D100-H109 PolarHBondContact N-ND1 2.92Å; S101-H109 PolarHBondContact O-CE1 2.77Å; S103-H109 PolarHBondContact O-CE1 3.48Å; S103-H109 PolarHBondContact O-NE2 2.86Å; L106-H109 PolarHBondContact O-N 3.1Å
110	D	86.8	Confident	88.5	Confident	30 Å²	30	40.6 Å²	40.6	16%	0.16	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	123.8	-179.5	-92	17.5	0	0	0	110.9	K37 Y97 D98 D100 L112 K147	K37-D110 HydrophobicContact CG-CB 4.48Å; Y97-D110 CarbonylContact C-O 3.55Å; Y97-D110 VanDerWaalsContact CA-O 3.29Å; Y97-D110 WeakPolarHBondContact CA-O 3.46Å; D98-D110 HydrophobicContact CB-CB 3.94Å; D98-D110 PolarHBondContact N-O 2.86Å; D98-D110 PolarHBondContact O-N 2.85Å; D100-D110 PolarHBondContact OD2-N 3.41Å; D110-L112 PolarHBondContact O-N 2.78Å; D110-K147 VanDerWaalsContact OD1-CD 3.23Å; D110-K147 WeakPolarHBondContact OD1-CD 3.13Å; D110-K147 WeakPolarHBondContact OD1-CE 3.49Å; D110-K147 IonicContact OD1-NZ 2.95Å; D110-K147 PolarHBondContact OD1-NZ 2.76Å
111	F	88.1	Confident	89	Confident	8 Å²	8	39.1 Å²	39.1	4%	0.035	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	124.8	179.8	-177.2	-110.3	0	0	0	111.4	D95 L96 Y97 G113 Q114 P150	D95-F111 HydrophobicContact CB-CE2 4.08Å; L96-F111 WeakPolarHBondContact O-CD2 3.22Å; Y97-F111 HydrophobicContact CD1-CB 4.44Å; Y97-F111 HydrophobicContact CD1-CD2 4.27Å; Y97-F111 HydrophobicContact CE1-CB 4.32Å; Y97-F111 AromaticContact CE1-CD2 3.83Å; Y97-F111 HydrophobicContact CE1-CD2 3.83Å; Y97-F111 HydrophobicContact CE2-CD2 4.46Å; Y97-F111 AromaticContact CZ-CD2 3.94Å; F111-G113 WeakPolarHBondContact CE2-O 3.48Å; F111-G113 WeakPolarHBondContact CZ-O 3.42Å; F111-Q114 HydrophobicContact CE2-CB 4.42Å; F111-Q114 HydrophobicContact CZ-CB 3.79Å; F111-Q114 HydrophobicContact CZ-CG 3.97Å; F111-P150 HydrophobicContact CD2-CG 4.4Å; F111-P150 HydrophobicContact CE2-CB 4.5Å; F111-P150 HydrophobicContact CE2-CG 4.14Å; F111-P150 HydrophobicContact CZ-CB 4.39Å
112	L	87.9	Confident	89.4	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-34	-177.9	-64.8	179.6	0	0	0	112.4	L34 L35 K37 P45 L96 D98 D110	L34-L112 HydrophobicContact CD1-CD1 4.21Å; L35-L112 WeakPolarHBondContact O-CD2 3.32Å; K37-L112 HydrophobicContact CG-CD2 3.69Å; P45-L112 HydrophobicContact CB-CD1 4.4Å; L96-L112 HydrophobicContact CB-CB 3.97Å; L96-L112 PolarHBondContact O-N 2.85Å; D98-L112 HydrophobicContact CB-CD1 4.03Å; D98-L112 HydrophobicContact CB-CD2 3.9Å; D98-L112 HydrophobicContact CB-CG 3.96Å; D110-L112 PolarHBondContact O-N 2.78Å
113	G	89.6	Confident	89.9	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.4	172.2	177.6	0	0	0	0	0	113	L96 F111 T135	L96-G113 PolarHBondContact N-O 3.03Å; F111-G113 WeakPolarHBondContact CE2-O 3.48Å; F111-G113 WeakPolarHBondContact CZ-O 3.42Å; G113-T135 CarbonylContact C-O 3.37Å; G113-T135 WeakPolarHBondContact CA-O 3.3Å
114	Q	92.6	Very high	90.1	Very high	20 Å²	20	26.2 Å²	26.2	9%	0.093	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	155.4	175.8	57.7	-178.6	23.4	0	0	112.2	F94 D95 F111 F116 T135	F94-Q114 CarbonylContact O-C 3.57Å; F94-Q114 WeakPolarHBondContact O-CA 3.45Å; D95-Q114 WeakPolarHBondContact OD1-CB 3.33Å; F111-Q114 HydrophobicContact CE2-CB 4.42Å; F111-Q114 HydrophobicContact CZ-CB 3.79Å; F111-Q114 HydrophobicContact CZ-CG 3.97Å; Q114-F116 HydrophobicContact CG-CE2 4.17Å; Q114-T135 WeakPolarHBondContact CG-O 3.38Å; Q114-T135 PolarHBondContact N-O 3.49Å; Q114-T135 PolarHBondContact O-N 3.4Å; Q114-T135 PolarHBondContact O-OG1 3.19Å
115	A	92.9	Very high	90.5	Very high	5 Å²	5	22.1 Å²	22.1	4%	0.041	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	147.8	167.8	0	0	0	0	0	110.9	R93 F94 L134 I182	R93-A115 WeakPolarHBondContact CA-O 3.37Å; F94-A115 PolarHBondContact N-O 2.89Å; F94-A115 PolarHBondContact O-N 2.88Å; A115-L134 HydrophobicContact CB-CD2 4.19Å; A115-I182 HydrophobicContact CB-CG2 3.59Å
116	F	93.7	Very high	90.5	Very high	82 Å²	82	23.2 Å²	23.2	36%	0.36	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139.3	173	-62.1	-94.4	0	0	0	109.6	W59 L92 R93 Q114 K132	W59-F116 HydrophobicContact CH2-CD1 4.01Å; W59-F116 HydrophobicContact CH2-CE1 4.3Å; W59-F116 AromaticContact CZ2-CD1 3.82Å; W59-F116 HydrophobicContact CZ2-CD1 3.82Å; W59-F116 AromaticContact CZ2-CE1 3.76Å; W59-F116 HydrophobicContact CZ2-CE1 3.76Å; L92-F116 WeakPolarHBondContact O-CA 3.42Å; R93-F116 HydrophobicContact CB-CD1 3.85Å; R93-F116 HydrophobicContact CB-CE1 3.86Å; R93-F116 HydrophobicContact CG-CD1 3.82Å; R93-F116 HydrophobicContact CG-CE1 3.51Å; R93-F116 HydrophobicContact CG-CG 4.48Å; R93-F116 HydrophobicContact CG-CZ 3.89Å; Q114-F116 HydrophobicContact CG-CE2 4.17Å; F116-K132 PolarHBondContact O-NZ 3.42Å
117	C	94.6	Very high	90.4	Very high	9 Å²	9	23.1 Å²	23.1	6%	0.061	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	175.3	171.7	57.6	0	0	0	0	109.8	L92 E121 L130 K132	L92-C117 PolarHBondContact N-O 2.81Å; L92-C117 PolarHBondContact O-N 3.37Å; L92-C117 VanDerWaalsContact O-N 3.12Å; L92-C117 VanDerWaalsContact O-O 3.05Å; C117-E121 VanDerWaalsContact CA-OE2 3.24Å; C117-E121 WeakPolarHBondContact CA-OE2 3.27Å; C117-E121 HydrophobicContact CB-CB 4.5Å; C117-E121 WeakPolarHBondContact CB-OE2 3.06Å; C117-L130 HydrophobicContact CB-CD2 3.74Å; C117-K132 HydrophobicContact CB-CD 4.37Å
118	T	94.1	Very high	90.7	Very high	10 Å²	10	22.3 Å²	22.3	6%	0.061	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	157	165.1	65.5	0	0	0	0	109.8	K89 Q90 N91 G120 E121 I122 H389	K89-T118 HydrophobicContact CG-CG2 4.01Å; Q90-T118 CarbonylContact O-C 3.59Å; Q90-T118 VanDerWaalsContact O-CA 3.24Å; Q90-T118 WeakPolarHBondContact O-CA 3.49Å; N91-T118 WeakPolarHBondContact OD1-CG2 3.42Å; T118-G120 PolarHBondContact O-N 3.02Å; T118-E121 WeakPolarHBondContact O-CB 3.39Å; T118-E121 PolarHBondContact O-N 3.45Å; T118-E121 VanDerWaalsContact O-N 3.14Å; T118-E121 WeakPolarHBondContact OG1-CB 3.38Å; T118-E121 PolarHBondContact OG1-N 2.72Å; T118-I122 PolarHBondContact O-N 2.8Å; T118-H389 PolarHBondContact OG1-NE2 3.03Å
119	L	93.9	Very high	91	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-58.9	-40.5	170.9	-175.4	53.9	0	0	0	110.8	V25 I27 V82 Y84 Q90 L92 E121 I122 V123	V25-L119 HydrophobicContact CG1-CD1 4.35Å; I27-L119 HydrophobicContact CD1-CD1 3.87Å; I27-L119 HydrophobicContact CG1-CD1 4.28Å; V82-L119 HydrophobicContact CG2-CD1 4.19Å; V82-L119 HydrophobicContact CG2-CD2 3.63Å; Y84-L119 HydrophobicContact CD2-CD2 3.86Å; Y84-L119 HydrophobicContact CD2-CG 3.94Å; Y84-L119 HydrophobicContact CG-CD2 4.38Å; Q90-L119 HydrophobicContact CB-CB 3.97Å; Q90-L119 PolarHBondContact O-N 3.29Å; L92-L119 HydrophobicContact CD1-CB 4.11Å; L92-L119 HydrophobicContact CD1-CD1 4.29Å; L119-E121 VanDerWaalsContact C-N 3.3Å; L119-E121 PolarHBondContact O-N 2.83Å; L119-I122 HydrophobicContact CD1-CD1 4.47Å; L119-I122 PolarHBondContact O-N 2.92Å; L119-I122 VanDerWaalsContact O-N 3.07Å; L119-V123 HydrophobicContact CD1-CG1 4.29Å; L119-V123 WeakPolarHBondContact O-CG2 3.38Å; L119-V123 PolarHBondContact O-N 3.2Å
120	G	92.5	Very high	91.3	Very high	6 Å²	6	21.1 Å²	21.1	6%	0.062	12%	0.122	C	C	.	.	H	α-helix	trans	-51.7	-43.1	171.3	0	0	0	0	0	113.5	T118 I122 V123 G124	T118-G120 PolarHBondContact O-N 3.02Å; G120-I122 VanDerWaalsContact C-N 3.35Å; G120-I122 PolarHBondContact O-N 3.47Å; G120-V123 WeakPolarHBondContact O-CG2 3.39Å; G120-V123 PolarHBondContact O-N 2.86Å; G120-G124 PolarHBondContact O-N 3.37Å
121	E	94.4	Very high	91.7	Very high	40 Å²	40	23.4 Å²	23.4	19%	0.187	13%	0.131	C	C	.	.	H	α-helix	trans	-63.8	-37.8	176.9	-166.3	-174.4	174.1	0	0	112.2	C117 T118 L119 S125 L130 K132	C117-E121 VanDerWaalsContact CA-OE2 3.24Å; C117-E121 WeakPolarHBondContact CA-OE2 3.27Å; C117-E121 HydrophobicContact CB-CB 4.5Å; C117-E121 WeakPolarHBondContact CB-OE2 3.06Å; T118-E121 WeakPolarHBondContact O-CB 3.39Å; T118-E121 PolarHBondContact O-N 3.45Å; T118-E121 VanDerWaalsContact O-N 3.14Å; T118-E121 WeakPolarHBondContact OG1-CB 3.38Å; T118-E121 PolarHBondContact OG1-N 2.72Å; L119-E121 VanDerWaalsContact C-N 3.3Å; L119-E121 PolarHBondContact O-N 2.83Å; E121-S125 WeakPolarHBondContact O-CB 3.38Å; E121-S125 PolarHBondContact O-N 3.42Å; E121-S125 PolarHBondContact O-OG 3.07Å; E121-L130 HydrophobicContact CB-CD2 4.3Å; E121-L130 HydrophobicContact CG-CD1 4.18Å; E121-L130 HydrophobicContact CG-CD2 3.84Å; E121-K132 VanDerWaalsContact CD-NZ 3.26Å; E121-K132 WeakPolarHBondContact OE1-CE 3.33Å; E121-K132 IonicContact OE1-NZ 3.23Å; E121-K132 PolarHBondContact OE1-NZ 2.97Å; E121-K132 IonicContact OE2-NZ 3.91Å; E121-K132 PolarHBondContact OE2-NZ 3.41Å
122	I	94	Very high	91.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-69.6	-50.9	177.8	-54.4	169.3	0	0	0	110.1	I27 L92 T118 L119 G120 S125 S128 L130 L184 A186	I27-I122 HydrophobicContact CD1-CD1 4.45Å; L92-I122 HydrophobicContact CD1-CD1 3.81Å; T118-I122 PolarHBondContact O-N 2.8Å; L119-I122 HydrophobicContact CD1-CD1 4.47Å; L119-I122 PolarHBondContact O-N 2.92Å; L119-I122 VanDerWaalsContact O-N 3.07Å; G120-I122 VanDerWaalsContact C-N 3.35Å; G120-I122 PolarHBondContact O-N 3.47Å; I122-S125 PolarHBondContact O-N 3.02Å; I122-S128 CarbonylContact O-C 3.57Å; I122-S128 VanDerWaalsContact O-C 3.29Å; I122-S128 VanDerWaalsContact O-CA 3.3Å; I122-S128 WeakPolarHBondContact O-CA 3.29Å; I122-L130 HydrophobicContact CG1-CB 4.35Å; I122-L130 HydrophobicContact CG1-CD2 3.92Å; I122-L130 HydrophobicContact CG2-CB 4.47Å; I122-L184 HydrophobicContact CD1-CB 4.13Å; I122-L184 HydrophobicContact CD1-CD1 3.84Å; I122-L184 HydrophobicContact CG1-CB 4.27Å; I122-L184 HydrophobicContact CG1-CD1 4.16Å; I122-L184 HydrophobicContact CG2-CB 4.19Å; I122-A186 HydrophobicContact CG2-CB 3.66Å
123	V	92.7	Very high	92.1	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.012	17%	0.169	C	C	.	.	H	α-helix	trans	-68.4	-37	-175.5	-60.6	0	0	0	0	112.5	Y84 L119 G120 S125 S128 A186 L335 I338 Y390	Y84-V123 HydrophobicContact CD2-CG2 4.44Å; Y84-V123 HydrophobicContact CE2-CG2 3.69Å; L119-V123 HydrophobicContact CD1-CG1 4.29Å; L119-V123 WeakPolarHBondContact O-CG2 3.38Å; L119-V123 PolarHBondContact O-N 3.2Å; G120-V123 WeakPolarHBondContact O-CG2 3.39Å; G120-V123 PolarHBondContact O-N 2.86Å; V123-S125 VanDerWaalsContact C-N 3.35Å; V123-S128 PolarHBondContact O-OG 2.77Å; V123-A186 HydrophobicContact CG1-CB 3.84Å; V123-L335 HydrophobicContact CB-CD2 4.07Å; V123-L335 HydrophobicContact CG1-CD2 4.45Å; V123-L335 HydrophobicContact CG2-CD2 4.22Å; V123-I338 WeakPolarHBondContact O-CG2 3.44Å; V123-Y390 HydrophobicContact CG2-CE1 3.96Å
124	G	91.1	Very high	92.1	Very high	21 Å²	21	30.2 Å²	30.2	22%	0.216	17%	0.17	C	C	.	.	H	α-helix	trans	-79	-13.1	178.8	0	0	0	0	0	114.4	G120	G120-G124 PolarHBondContact O-N 3.37Å
125	S	91.1	Very high	91.8	Very high	20 Å²	20	31.3 Å²	31.3	14%	0.14	18%	0.179	C	C	.	.	S	Bend	trans	-66.4	150.2	172.2	-70.7	0	0	0	0	111.2	E121 I122 V123 G127 S128 R129	E121-S125 WeakPolarHBondContact O-CB 3.38Å; E121-S125 PolarHBondContact O-N 3.42Å; E121-S125 PolarHBondContact O-OG 3.07Å; I122-S125 PolarHBondContact O-N 3.02Å; V123-S125 VanDerWaalsContact C-N 3.35Å; S125-G127 PolarHBondContact O-N 3Å; S125-S128 VanDerWaalsContact O-CA 3.28Å; S125-S128 WeakPolarHBondContact O-CA 3.24Å; S125-S128 PolarHBondContact O-N 3.21Å; S125-R129 WeakPolarHBondContact CB-O 3.48Å
126	P	87.4	Confident	91	Very high	92 Å²	92	32.4 Å²	32.4	60%	0.597	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-51.1	124.1	177.9	-29.1	35.9	0	0	0	113	S128 R129 P586	P126-S128 PolarHBondContact O-N 2.88Å; P126-R129 PolarHBondContact O-N 3.04Å; P126-P586 HydrophobicContact CB-CG 4.37Å
127	G	85.1	Confident	89.5	Confident	17 Å²	17	29.1 Å²	29.1	18%	0.175	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	68.6	15.8	-176.6	0	0	0	0	0	114.4	S125 R129	S125-G127 PolarHBondContact O-N 3Å; G127-R129 PolarHBondContact O-N 2.94Å
128	S	90.4	Very high	87.7	Confident	5 Å²	5	31.6 Å²	31.6	4%	0.035	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	55.7	35.3	-172.7	-54.2	0	0	0	0	112.6	I122 V123 S125 P126 S185 A186	I122-S128 CarbonylContact O-C 3.57Å; I122-S128 VanDerWaalsContact O-C 3.29Å; I122-S128 VanDerWaalsContact O-CA 3.3Å; I122-S128 WeakPolarHBondContact O-CA 3.29Å; V123-S128 PolarHBondContact O-OG 2.77Å; S125-S128 VanDerWaalsContact O-CA 3.28Å; S125-S128 WeakPolarHBondContact O-CA 3.24Å; S125-S128 PolarHBondContact O-N 3.21Å; P126-S128 PolarHBondContact O-N 2.88Å; S128-S185 WeakPolarHBondContact O-CA 3.21Å; S128-A186 WeakPolarHBondContact CB-O 3.42Å; S128-A186 PolarHBondContact O-N 3.09Å
129	R	91.9	Very high	85.7	Confident	59 Å²	59	35.8 Å²	35.8	22%	0.223	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	115.3	-179.6	-177.9	-175	178.5	-76.6	5.4	110.1	S125 P126 G127 E131 I183 L184	S125-R129 WeakPolarHBondContact CB-O 3.48Å; P126-R129 PolarHBondContact O-N 3.04Å; G127-R129 PolarHBondContact O-N 2.94Å; R129-E131 IonicContact CZ-OE2 2.79Å; R129-E131 IonicContact NH1-OE2 3.8Å; R129-E131 PolarHBondContact NH1-OE2 3.3Å; R129-E131 IonicContact NH2-OE2 3.88Å; R129-E131 PolarHBondContact NH2-OE2 2.7Å; R129-I183 HydrophobicContact CG-CG2 4.12Å; R129-I183 VanDerWaalsContact CZ-CG2 3.45Å; R129-L184 CarbonylContact C-O 3.3Å; R129-L184 WeakPolarHBondContact CA-O 3.49Å
130	L	93.5	Very high	83.5	Confident	17 Å²	17	38.1 Å²	38.1	9%	0.089	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	133.6	177.1	177.8	66.1	0	0	0	110.5	C117 E121 I122 K132 I183 L184	C117-L130 HydrophobicContact CB-CD2 3.74Å; E121-L130 HydrophobicContact CB-CD2 4.3Å; E121-L130 HydrophobicContact CG-CD1 4.18Å; E121-L130 HydrophobicContact CG-CD2 3.84Å; I122-L130 HydrophobicContact CG1-CB 4.35Å; I122-L130 HydrophobicContact CG1-CD2 3.92Å; I122-L130 HydrophobicContact CG2-CB 4.47Å; L130-K132 HydrophobicContact CD1-CG 4.35Å; L130-K132 HydrophobicContact CD2-CD 4.15Å; L130-K132 HydrophobicContact CD2-CG 4.47Å; L130-K132 HydrophobicContact CG-CG 4.29Å; L130-I183 WeakPolarHBondContact O-CA 3.48Å; L130-L184 PolarHBondContact N-O 3.19Å; L130-L184 PolarHBondContact O-N 3.45Å
131	E	94.3	Very high	81.5	Confident	78 Å²	78	43.2 Å²	43.2	36%	0.364	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	124.8	175.3	-172.2	166.1	154.8	0	0	109.5	R129 T181 I182 I183 H591	R129-E131 IonicContact CZ-OE2 2.79Å; R129-E131 IonicContact NH1-OE2 3.8Å; R129-E131 PolarHBondContact NH1-OE2 3.3Å; R129-E131 IonicContact NH2-OE2 3.88Å; R129-E131 PolarHBondContact NH2-OE2 2.7Å; E131-T181 HydrophobicContact CG-CG2 3.31Å; E131-I182 WeakPolarHBondContact CA-O 3.38Å; E131-I183 HydrophobicContact CG-CG1 3.94Å; E131-H591 IonicContact OE2-NE2 2.69Å
132	K	93.2	Very high	79.5	Confident	52 Å²	52	42.2 Å²	42.2	23%	0.226	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	142.6	-176.8	-89.3	-172.5	145.7	164	0	112.5	F116 C117 E121 L130 T181 I182	F116-K132 PolarHBondContact O-NZ 3.42Å; C117-K132 HydrophobicContact CB-CD 4.37Å; E121-K132 VanDerWaalsContact CD-NZ 3.26Å; E121-K132 WeakPolarHBondContact OE1-CE 3.33Å; E121-K132 IonicContact OE1-NZ 3.23Å; E121-K132 PolarHBondContact OE1-NZ 2.97Å; E121-K132 IonicContact OE2-NZ 3.91Å; E121-K132 PolarHBondContact OE2-NZ 3.41Å; L130-K132 HydrophobicContact CD1-CG 4.35Å; L130-K132 HydrophobicContact CD2-CD 4.15Å; L130-K132 HydrophobicContact CD2-CG 4.47Å; L130-K132 HydrophobicContact CG-CG 4.29Å; K132-T181 CarbonylContact O-C 3.57Å; K132-T181 WeakPolarHBondContact O-CA 3.39Å; K132-T181 WeakPolarHBondContact O-CG2 3.28Å; K132-I182 HydrophobicContact CB-CG2 4.04Å; K132-I182 PolarHBondContact N-O 3.23Å; K132-I182 WeakPolarHBondContact O-CG2 3.13Å; K132-I182 PolarHBondContact O-N 3.42Å
133	P	92.3	Very high	77.2	Confident	92 Å²	92	48 Å²	48	60%	0.597	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	141.1	171.2	29.4	-33.8	0	0	0	110.4
134	L	88.6	Confident	75.3	Confident	6 Å²	6	59 Å²	59	3%	0.031	33%	0.331	C	S	.	.			trans	-78.5	141.7	168.4	-71	167.8	0	0	0	109.8	L34 L96 A115 C179 G180 I182	L34-L134 HydrophobicContact CD2-CD1 3.35Å; L96-L134 HydrophobicContact CD2-CD2 3.89Å; L96-L134 HydrophobicContact CG-CD1 4.31Å; L96-L134 HydrophobicContact CG-CD2 4.45Å; A115-L134 HydrophobicContact CB-CD2 4.19Å; L134-C179 HydrophobicContact CB-CB 3.95Å; L134-C179 WeakPolarHBondContact CD1-O 3.39Å; L134-G180 WeakPolarHBondContact CB-O 3.34Å; L134-G180 PolarHBondContact N-O 3.33Å; L134-I182 HydrophobicContact CD2-CB 4.06Å; L134-I182 HydrophobicContact CD2-CG2 4.16Å; L134-I182 HydrophobicContact CG-CB 4.29Å
135	T	86.5	Confident	73.6	Confident	44 Å²	44	61.1 Å²	61.1	27%	0.27	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-123.2	145.2	178.8	61.8	0	0	0	0	110.7	G113 Q114	G113-T135 CarbonylContact C-O 3.37Å; G113-T135 WeakPolarHBondContact CA-O 3.3Å; Q114-T135 WeakPolarHBondContact CG-O 3.38Å; Q114-T135 PolarHBondContact N-O 3.49Å; Q114-T135 PolarHBondContact O-N 3.4Å; Q114-T135 PolarHBondContact O-OG1 3.19Å
136	I	75.1	Confident	71.9	Confident	27 Å²	27	62.6 Å²	62.6	14%	0.138	36%	0.358	C	S	.	.			trans	-92.9	96.8	163.9	-63.5	161.1	0	0	0	104.9	F139 G173 K177 C179	I136-F139 HydrophobicContact CG2-CD1 3.93Å; I136-F139 HydrophobicContact CG2-CE1 4.45Å; I136-G173 WeakPolarHBondContact O-CA 3.39Å; I136-K177 HydrophobicContact CD1-CD 4.32Å; I136-C179 WeakPolarHBondContact CD1-SG 3.48Å; I136-C179 WeakPolarHBondContact CG1-SG 3.2Å
137	G	63.9	Low	70.5	Confident	13 Å²	13	60.7 Å²	60.7	13%	0.134	34%	0.34	C	S	.	.			trans	-65.1	-168.9	176.3	0	0	0	0	0	112.5	F139	G137-F139 PolarHBondContact O-N 3.39Å; G137-F139 VanDerWaalsContact O-N 3.09Å
138	A	55.1	Low	69	Low	61 Å²	61	61.8 Å²	61.8	50%	0.504	34%	0.344	S	S	.	.	S	Bend	trans	-59	117.4	169.2	0	0	0	0	0	109.6	A151	A138-A151 VanDerWaalsContact O-CB 3.29Å; A138-A151 WeakPolarHBondContact O-CB 3.42Å; A138-A151 PolarHBondContact O-N 2.95Å; A138-A151 VanDerWaalsContact O-N 3.17Å
139	F	52	Low	67.3	Low	98 Å²	98	63.8 Å²	63.8	43%	0.43	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	146.8	179	57.2	-88.7	0	0	0	110.4	I136 G137 P148 M149	I136-F139 HydrophobicContact CG2-CD1 3.93Å; I136-F139 HydrophobicContact CG2-CE1 4.45Å; G137-F139 PolarHBondContact O-N 3.39Å; G137-F139 VanDerWaalsContact O-N 3.09Å; F139-P148 HydrophobicContact CB-CB 4.11Å; F139-P148 HydrophobicContact CD2-CB 3.84Å; F139-P148 HydrophobicContact CG-CB 4.05Å; F139-M149 CarbonylContact C-O 3.53Å; F139-M149 WeakPolarHBondContact CA-O 3.29Å; F139-M149 WeakPolarHBondContact CB-O 3.25Å
140	S	48.3	Very low	65.8	Low	50 Å²	50	61.6 Å²	61.6	35%	0.35	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	147.5	163.1	72.6	0	0	0	0	108.8	M149	S140-M149 PolarHBondContact N-O 3.32Å; S140-M149 PolarHBondContact O-N 3.21Å
141	L	50.3	Low	63.9	Low	114 Å²	114	63.1 Å²	63.1	60%	0.597	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	128.6	171.7	-72.1	159.4	0	0	0	108.5	S143 G146	L141-S143 PolarHBondContact O-N 3.45Å; L141-G146 WeakPolarHBondContact CD2-O 3.43Å
142	N	52.9	Low	61.6	Low	19 Å²	19	64.6 Å²	64.6	10%	0.102	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-61.1	123.6	171.5	-178.4	-20.9	0	0	0	109.2	S107 R144 T145 G146 K147 M149	S107-N142 VanDerWaalsContact CB-ND2 3.31Å; S107-N142 WeakPolarHBondContact CB-ND2 3.46Å; S107-N142 PolarHBondContact O-ND2 3.09Å; S107-N142 PolarHBondContact OG-ND2 2.79Å; N142-R144 PolarHBondContact O-N 3.35Å; N142-R144 VanDerWaalsContact O-N 3.13Å; N142-R144 PolarHBondContact OD1-N 3.38Å; N142-T145 VanDerWaalsContact CB-OG1 3.29Å; N142-T145 WeakPolarHBondContact CB-OG1 3.21Å; N142-T145 VanDerWaalsContact CG-OG1 3.26Å; N142-T145 PolarHBondContact ND2-OG1 3.01Å; N142-T145 VanDerWaalsContact ND2-OG1 3.15Å; N142-T145 PolarHBondContact O-N 3.33Å; N142-G146 WeakPolarHBondContact O-CA 3.46Å; N142-G146 PolarHBondContact O-N 3.01Å; N142-K147 PolarHBondContact N-O 3.09Å; N142-M149 HydrophobicContact CB-CE 4Å; N142-M149 HydrophobicContact CB-CG 4.29Å; N142-M149 HydrophobicContact CB-SD 4.39Å
143	S	46.3	Very low	59.2	Low	122 Å²	122	66 Å²	66	85%	0.853	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.7	-176.8	57.2	0	0	0	0	114.4	L141	L141-S143 PolarHBondContact O-N 3.45Å
144	R	52.1	Low	56.4	Low	233 Å²	233	68.3 Å²	68.3	88%	0.879	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-34.9	178.7	-65.4	-176.1	-175.4	178.7	2	114	N142	N142-R144 PolarHBondContact O-N 3.35Å; N142-R144 VanDerWaalsContact O-N 3.13Å; N142-R144 PolarHBondContact OD1-N 3.38Å
145	T	56	Low	53.9	Low	65 Å²	65	71.3 Å²	71.3	40%	0.399	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-14	-172.5	63	0	0	0	0	113.7	S107 N142 K147	S107-T145 PolarHBondContact O-OG1 2.88Å; N142-T145 VanDerWaalsContact CB-OG1 3.29Å; N142-T145 WeakPolarHBondContact CB-OG1 3.21Å; N142-T145 VanDerWaalsContact CG-OG1 3.26Å; N142-T145 PolarHBondContact ND2-OG1 3.01Å; N142-T145 VanDerWaalsContact ND2-OG1 3.15Å; N142-T145 PolarHBondContact O-N 3.33Å; T145-K147 PolarHBondContact O-N 3.12Å; T145-K147 VanDerWaalsContact O-N 3.12Å
146	G	55	Low	51.3	Low	50 Å²	50	73.2 Å²	73.2	52%	0.515	45%	0.447	S	S	.	.			trans	66.7	4.7	-175.5	0	0	0	0	0	114.2	L141 N142	L141-G146 WeakPolarHBondContact CD2-O 3.43Å; N142-G146 WeakPolarHBondContact O-CA 3.46Å; N142-G146 PolarHBondContact O-N 3.01Å
147	K	57.9	Low	49.6	Very low	52 Å²	52	74 Å²	74	23%	0.226	46%	0.463	C	S	.	.			trans	-79.1	145.8	178.9	-69.2	-172.2	169.6	-156	0	111.3	D100 K108 D110 N142 T145 M149	D100-K147 IonicContact OD2-NZ 3.55Å; D100-K147 PolarHBondContact OD2-NZ 3.07Å; K108-K147 PolarHBondContact O-NZ 3.07Å; K108-K147 VanDerWaalsContact O-NZ 3.1Å; D110-K147 VanDerWaalsContact OD1-CD 3.23Å; D110-K147 WeakPolarHBondContact OD1-CD 3.13Å; D110-K147 WeakPolarHBondContact OD1-CE 3.49Å; D110-K147 IonicContact OD1-NZ 2.95Å; D110-K147 PolarHBondContact OD1-NZ 2.76Å; N142-K147 PolarHBondContact N-O 3.09Å; T145-K147 PolarHBondContact O-N 3.12Å; T145-K147 VanDerWaalsContact O-N 3.12Å; K147-M149 PolarHBondContact O-N 2.91Å
148	P	54	Low	48.1	Very low	41 Å²	41	79.4 Å²	79.4	27%	0.266	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	127	173.9	-3.5	16.5	0	0	0	110.1	F139	F139-P148 HydrophobicContact CB-CB 4.11Å; F139-P148 HydrophobicContact CD2-CB 3.84Å; F139-P148 HydrophobicContact CG-CB 4.05Å
149	M	54.3	Low	47.3	Very low	46 Å²	46	84.4 Å²	84.4	23%	0.227	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	145.1	168.8	-70	-156.4	-58.6	0	0	110	S107 F139 S140 N142 K147 A151	S107-M149 VanDerWaalsContact CA-SD 3.6Å; S107-M149 WeakPolarHBondContact CB-SD 3.39Å; F139-M149 CarbonylContact C-O 3.53Å; F139-M149 WeakPolarHBondContact CA-O 3.29Å; F139-M149 WeakPolarHBondContact CB-O 3.25Å; S140-M149 PolarHBondContact N-O 3.32Å; S140-M149 PolarHBondContact O-N 3.21Å; N142-M149 HydrophobicContact CB-CE 4Å; N142-M149 HydrophobicContact CB-CG 4.29Å; N142-M149 HydrophobicContact CB-SD 4.39Å; K147-M149 PolarHBondContact O-N 2.91Å; M149-A151 PolarHBondContact O-N 2.83Å
150	P	60	Low	46.6	Very low	14 Å²	14	83.7 Å²	83.7	9%	0.091	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	133.1	169.9	21.4	-30.4	0	0	0	109.4	F111 V152	F111-P150 HydrophobicContact CD2-CG 4.4Å; F111-P150 HydrophobicContact CE2-CB 4.5Å; F111-P150 HydrophobicContact CE2-CG 4.14Å; F111-P150 HydrophobicContact CZ-CB 4.39Å; P150-V152 PolarHBondContact O-N 3.3Å
151	A	54.7	Low	45.9	Very low	49 Å²	49	87.1 Å²	87.1	41%	0.405	50%	0.503	S	S	.	.			trans	-59.5	114.1	179.8	0	0	0	0	0	109.3	A138 M149 S153	A138-A151 VanDerWaalsContact O-CB 3.29Å; A138-A151 WeakPolarHBondContact O-CB 3.42Å; A138-A151 PolarHBondContact O-N 2.95Å; A138-A151 VanDerWaalsContact O-N 3.17Å; M149-A151 PolarHBondContact O-N 2.83Å; A151-S153 PolarHBondContact O-N 2.94Å
152	V	45.9	Very low	44.9	Very low	109 Å²	109	85 Å²	85	66%	0.661	50%	0.498	S	S	*	.			trans	-70.6	102.9	176.7	-174.1	0	0	0	0	107.4	P150 N154	P150-V152 PolarHBondContact O-N 3.3Å; V152-N154 VanDerWaalsContact C-N 3.27Å; V152-N154 PolarHBondContact O-N 3.06Å
153	S	41.5	Very low	44.1	Very low	81 Å²	81	87 Å²	87	57%	0.566	51%	0.508	S	S	*	.			trans	-73.3	82.9	174.6	64.2	0	0	0	0	109.6	A151 G155	A151-S153 PolarHBondContact O-N 2.94Å; S153-G155 VanDerWaalsContact C-N 3.3Å; S153-G155 PolarHBondContact O-N 3.3Å
154	N	33.5	Very low	43.6	Very low	140 Å²	140	89.3 Å²	89.3	75%	0.749	50%	0.498	S	S	*	.			trans	-73.4	90.2	162.4	-83.6	-6.8	0	0	0	108.7	V152 S156	V152-N154 VanDerWaalsContact C-N 3.27Å; V152-N154 PolarHBondContact O-N 3.06Å; N154-S156 PolarHBondContact O-N 3.02Å
155	G	36.5	Very low	42.6	Very low	70 Å²	70	84 Å²	84	72%	0.722	49%	0.492	S	S	*	.	S	Bend	trans	81.2	0.1	142.7	0	0	0	0	0	120.6	S153	S153-G155 VanDerWaalsContact C-N 3.3Å; S153-G155 PolarHBondContact O-N 3.3Å
156	S	32.9	Very low	41.5	Very low	83 Å²	83	84.6 Å²	84.6	58%	0.58	50%	0.495	S	S	*	.			trans	-105.4	106.2	171.6	59	0	0	0	0	111.6	N154 L158	N154-S156 PolarHBondContact O-N 3.02Å; S156-L158 PolarHBondContact O-N 3.35Å
157	G	38.6	Very low	40.3	Very low	45 Å²	45	85.7 Å²	85.7	46%	0.464	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-0.5	174.9	0	0	0	0	0	115.6	W159 M160 E161	G157-W159 VanDerWaalsContact C-N 3.33Å; G157-W159 PolarHBondContact O-N 2.98Å; G157-M160 PolarHBondContact O-N 2.97Å; G157-E161 PolarHBondContact O-N 2.81Å
158	L	32.9	Very low	38.9	Very low	125 Å²	125	88.6 Å²	88.6	65%	0.654	52%	0.524	S	S	*	.	H	α-helix	trans	-65.6	-28.7	-177.1	-67.5	170.1	0	0	0	113.7	S156 S162	S156-L158 PolarHBondContact O-N 3.35Å; L158-S162 PolarHBondContact O-N 3.03Å; L158-S162 VanDerWaalsContact O-N 3.1Å
159	W	38.5	Very low	37.9	Very low	166 Å²	166	94.7 Å²	94.7	63%	0.629	55%	0.549	S	S	*	.	H	α-helix	trans	-73	-37.8	179	-176.6	66.2	0	0	0	112.6	G157 L163	G157-W159 VanDerWaalsContact C-N 3.33Å; G157-W159 PolarHBondContact O-N 2.98Å; W159-L163 HydrophobicContact CD2-CD1 4.18Å; W159-L163 HydrophobicContact CE3-CD1 4.19Å; W159-L163 HydrophobicContact CH2-CD1 4Å; W159-L163 HydrophobicContact CZ2-CD1 3.97Å; W159-L163 HydrophobicContact CZ3-CD1 4.11Å; W159-L163 PolarHBondContact O-N 3.15Å
160	M	36.4	Very low	36.9	Very low	84 Å²	84	97 Å²	97	41%	0.414	58%	0.575	S	S	.	*	H	α-helix	trans	-72.5	-30.9	173.4	-88.4	-172.4	-74.6	0	0	112.5	G157 L163 R164	G157-M160 PolarHBondContact O-N 2.97Å; M160-L163 PolarHBondContact O-N 3.46Å; M160-R164 PolarHBondContact O-N 3.18Å; M160-R164 VanDerWaalsContact O-N 3.11Å
161	E	34.3	Very low	35.6	Very low	122 Å²	122	100.1 Å²	100.1	57%	0.57	60%	0.598	S	S	*	*	H	α-helix	trans	-69.2	-37.4	177	-148.9	137.2	-146.4	0	0	111.4	G157 L163 R164 T165	G157-E161 PolarHBondContact O-N 2.81Å; E161-L163 VanDerWaalsContact C-N 3.31Å; E161-L163 PolarHBondContact O-N 3.31Å; E161-R164 PolarHBondContact O-N 2.86Å; E161-T165 PolarHBondContact O-N 3.16Å; E161-T165 PolarHBondContact O-OG1 3.14Å
162	S	28.9	Very low	34.5	Very low	70 Å²	70	100.6 Å²	100.6	49%	0.49	61%	0.607	S	S	.	*	H	α-helix	trans	-63.9	-33.2	171.1	-166.5	0	0	0	0	113.1	L158 T165 T166	L158-S162 PolarHBondContact O-N 3.03Å; L158-S162 VanDerWaalsContact O-N 3.1Å; S162-T165 PolarHBondContact O-OG1 3.03Å; S162-T166 WeakPolarHBondContact O-CG2 3.48Å; S162-T166 PolarHBondContact O-OG1 2.85Å
163	L	35.2	Very low	34.2	Very low	59 Å²	59	96.6 Å²	96.6	31%	0.309	59%	0.588	S	S	.	*	H	α-helix	trans	-70.3	-35.2	174.9	-76	163.1	0	0	0	112.1	W159 M160 E161 T166	W159-L163 HydrophobicContact CD2-CD1 4.18Å; W159-L163 HydrophobicContact CE3-CD1 4.19Å; W159-L163 HydrophobicContact CH2-CD1 4Å; W159-L163 HydrophobicContact CZ2-CD1 3.97Å; W159-L163 HydrophobicContact CZ3-CD1 4.11Å; W159-L163 PolarHBondContact O-N 3.15Å; M160-L163 PolarHBondContact O-N 3.46Å; E161-L163 VanDerWaalsContact C-N 3.31Å; E161-L163 PolarHBondContact O-N 3.31Å; L163-T166 PolarHBondContact O-N 2.96Å; L163-T166 PolarHBondContact O-OG1 2.85Å
164	R	35.4	Very low	34.2	Very low	172 Å²	172	97.6 Å²	97.6	65%	0.649	59%	0.59	S	S	*	*	H	α-helix	trans	-68.3	-36.7	176.8	-117.4	-172.9	-78	-130.5	3.2	113.4	M160 E161 T166	M160-R164 PolarHBondContact O-N 3.18Å; M160-R164 VanDerWaalsContact O-N 3.11Å; E161-R164 PolarHBondContact O-N 2.86Å; R164-T166 VanDerWaalsContact C-N 3.32Å; R164-T166 PolarHBondContact O-N 3.47Å
165	T	31.5	Very low	34.6	Very low	122 Å²	122	97 Å²	97	75%	0.748	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-11.9	178	27.8	0	0	0	0	115	E161 S162	E161-T165 PolarHBondContact O-N 3.16Å; E161-T165 PolarHBondContact O-OG1 3.14Å; S162-T165 PolarHBondContact O-OG1 3.03Å
166	T	34.4	Very low	35.2	Very low	76 Å²	76	97.8 Å²	97.8	47%	0.466	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.8	-7.8	-170	47.7	0	0	0	0	115.1	S162 L163 R164 L168	S162-T166 WeakPolarHBondContact O-CG2 3.48Å; S162-T166 PolarHBondContact O-OG1 2.85Å; L163-T166 PolarHBondContact O-N 2.96Å; L163-T166 PolarHBondContact O-OG1 2.85Å; R164-T166 VanDerWaalsContact C-N 3.32Å; R164-T166 PolarHBondContact O-N 3.47Å; T166-L168 PolarHBondContact O-N 3.16Å
167	G	28.1	Very low	36.5	Very low	74 Å²	74	99.5 Å²	99.5	76%	0.763	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	60.3	16.3	178.2	0	0	0	0	0	114.3
168	L	29.7	Very low	38	Very low	112 Å²	112	106.7 Å²	106.7	59%	0.586	62%	0.618	S	S	*	*			trans	-85.8	118.9	172.4	-100.4	79.5	0	0	0	108.3	T166	T166-L168 PolarHBondContact O-N 3.16Å
169	E	32	Very low	40.4	Very low	170 Å²	170	100.9 Å²	100.9	79%	0.794	59%	0.587	S	S	*	*			trans	-46.1	158.3	158.7	-65.6	-176.1	150.7	0	0	110	S171	E169-S171 PolarHBondContact O-N 3.37Å; E169-S171 PolarHBondContact O-OG 3.09Å
170	A	33.7	Very low	42.8	Very low	93 Å²	93	93.4 Å²	93.4	77%	0.769	56%	0.562	S	S	*	*	S	Bend	trans	-65.4	42.3	-179.8	0	0	0	0	0	114.3	G172	A170-G172 VanDerWaalsContact C-N 3.25Å; A170-G172 PolarHBondContact O-N 3.07Å
171	S	33	Very low	45.5	Very low	81 Å²	81	91 Å²	91	57%	0.566	55%	0.551	S	S	*	*			trans	-89.5	44.9	171.2	66	0	0	0	0	111.3	E169 G173	E169-S171 PolarHBondContact O-N 3.37Å; E169-S171 PolarHBondContact O-OG 3.09Å; S171-G173 PolarHBondContact O-N 2.8Å; S171-G173 VanDerWaalsContact O-N 3.15Å
172	G	30.8	Very low	48.4	Very low	58 Å²	58	85.1 Å²	85.1	60%	0.598	52%	0.524	S	S	*	.			trans	-77.8	22.1	172.9	0	0	0	0	0	113.9	A170	A170-G172 VanDerWaalsContact C-N 3.25Å; A170-G172 PolarHBondContact O-N 3.07Å
173	G	39.4	Very low	51.5	Low	25 Å²	25	82 Å²	82	26%	0.258	50%	0.502	S	S	.	.	S	Bend	trans	-88.3	154.1	173.6	0	0	0	0	0	111	I136 S171 P175	I136-G173 WeakPolarHBondContact O-CA 3.39Å; S171-G173 PolarHBondContact O-N 2.8Å; S171-G173 VanDerWaalsContact O-N 3.15Å; G173-P175 VanDerWaalsContact O-CD 3.25Å; G173-P175 WeakPolarHBondContact O-CD 3.43Å; G173-P175 VanDerWaalsContact O-N 3.1Å
174	V	42.3	Very low	54.4	Low	102 Å²	102	79.3 Å²	79.3	62%	0.618	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-54.4	118	167.8	-178.5	0	0	0	0	108.1	G176	V174-G176 PolarHBondContact O-N 2.78Å
175	P	41.1	Very low	57.1	Low	129 Å²	129	72.8 Å²	72.8	84%	0.838	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	125.9	-176.8	-24.9	33.2	0	0	0	111	G173	G173-P175 VanDerWaalsContact O-CD 3.25Å; G173-P175 WeakPolarHBondContact O-CD 3.43Å; G173-P175 VanDerWaalsContact O-N 3.1Å
176	G	50.1	Low	59.9	Low	85 Å²	85	67.2 Å²	67.2	88%	0.876	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.9	-5.6	169.2	0	0	0	0	0	117.7	V174	V174-G176 PolarHBondContact O-N 2.78Å
177	K	61.1	Low	62.4	Low	120 Å²	120	67.9 Å²	67.9	52%	0.522	43%	0.433	S	S	.	.			trans	-97.7	104.2	177.9	-154.9	169.7	-176.4	173.5	0	111.8	L35 I136 C179	L35-K177 HydrophobicContact CD1-CD 4.36Å; L35-K177 HydrophobicContact CD1-CG 4.15Å; I136-K177 HydrophobicContact CD1-CD 4.32Å; K177-C179 PolarHBondContact O-N 3.48Å; K177-C179 PolarHBondContact O-SG 3.21Å
178	K	69.6	Low	65.1	Low	196 Å²	196	66.2 Å²	66.2	85%	0.852	41%	0.405	S	S	*	.			trans	-72.2	117.2	173.5	-65.5	-174.5	178.9	-175.6	0	109.3
179	C	83	Confident	67.3	Low	2 Å²	2	63.8 Å²	63.8	1%	0.014	39%	0.392	C	S	.	.			trans	-101.2	14.6	-176	-54.2	0	0	0	0	112.9	L134 I136 K177	L134-C179 HydrophobicContact CB-CB 3.95Å; L134-C179 WeakPolarHBondContact CD1-O 3.39Å; I136-C179 WeakPolarHBondContact CD1-SG 3.48Å; I136-C179 WeakPolarHBondContact CG1-SG 3.2Å; K177-C179 PolarHBondContact O-N 3.48Å; K177-C179 PolarHBondContact O-SG 3.21Å
180	G	89.8	Confident	68.7	Low	9 Å²	9	58.3 Å²	58.3	9%	0.093	37%	0.373	C	S	.	.			trans	89.9	-174.9	-170.7	0	0	0	0	0	113.2	R32 N33 L134	R32-G180 CarbonylContact O-C 3.58Å; R32-G180 VanDerWaalsContact O-CA 3.28Å; R32-G180 WeakPolarHBondContact O-CA 3.46Å; N33-G180 WeakPolarHBondContact O-CA 3.48Å; N33-G180 PolarHBondContact O-N 3.42Å; L134-G180 WeakPolarHBondContact CB-O 3.34Å; L134-G180 PolarHBondContact N-O 3.33Å
181	T	92.7	Very high	69.8	Low	33 Å²	33	59.1 Å²	59.1	20%	0.202	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	137	-178.2	-57.8	0	0	0	0	108.5	C31 R32 E131 K132	C31-T181 CarbonylContact C-O 3.58Å; C31-T181 WeakPolarHBondContact CA-O 3.26Å; R32-T181 PolarHBondContact N-O 3.15Å; R32-T181 PolarHBondContact O-N 3Å; E131-T181 HydrophobicContact CG-CG2 3.31Å; K132-T181 CarbonylContact O-C 3.57Å; K132-T181 WeakPolarHBondContact O-CA 3.39Å; K132-T181 WeakPolarHBondContact O-CG2 3.28Å
182	I	94.6	Very high	71.2	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	138.4	168.2	-170.5	172.4	0	0	0	109.2	V29 F94 L96 A115 E131 K132 L134 L184	V29-I182 HydrophobicContact CG1-CD1 3.9Å; V29-I182 HydrophobicContact CG1-CG1 3.98Å; F94-I182 HydrophobicContact CB-CD1 3.55Å; F94-I182 HydrophobicContact CD1-CD1 4.18Å; F94-I182 HydrophobicContact CD2-CD1 4.44Å; F94-I182 HydrophobicContact CG-CD1 3.81Å; L96-I182 HydrophobicContact CD2-CD1 4.17Å; A115-I182 HydrophobicContact CB-CG2 3.59Å; E131-I182 WeakPolarHBondContact CA-O 3.38Å; K132-I182 HydrophobicContact CB-CG2 4.04Å; K132-I182 PolarHBondContact N-O 3.23Å; K132-I182 WeakPolarHBondContact O-CG2 3.13Å; K132-I182 PolarHBondContact O-N 3.42Å; L134-I182 HydrophobicContact CD2-CB 4.06Å; L134-I182 HydrophobicContact CD2-CG2 4.16Å; L134-I182 HydrophobicContact CG-CB 4.29Å; I182-L184 HydrophobicContact CD1-CD2 3.68Å; I182-L184 HydrophobicContact CD1-CG 4.27Å; I182-L184 HydrophobicContact CG1-CD2 3.87Å; I182-L184 HydrophobicContact CG1-CG 4.16Å
183	I	94.9	Very high	73.3	Confident	5 Å²	5	57.6 Å²	57.6	3%	0.026	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	120.4	175.7	-61.3	157.8	0	0	0	106.7	S30 R32 R129 L130 E131	S30-I183 PolarHBondContact N-O 2.86Å; S30-I183 PolarHBondContact O-N 2.97Å; S30-I183 WeakPolarHBondContact OG-CB 3.21Å; R32-I183 HydrophobicContact CG-CD1 3.7Å; R129-I183 HydrophobicContact CG-CG2 4.12Å; R129-I183 VanDerWaalsContact CZ-CG2 3.45Å; L130-I183 WeakPolarHBondContact O-CA 3.48Å; E131-I183 HydrophobicContact CG-CG1 3.94Å
184	L	94.8	Very high	75.5	Confident	1 Å²	1	58 Å²	58	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	130.2	-178.9	-58.7	173.6	0	0	0	108.2	I27 T28 V29 F94 I122 R129 L130 I182	I27-L184 HydrophobicContact CG2-CD2 4.49Å; T28-L184 WeakPolarHBondContact O-CA 3.23Å; V29-L184 HydrophobicContact CB-CD2 4.34Å; V29-L184 HydrophobicContact CG1-CD2 4.09Å; V29-L184 HydrophobicContact CG2-CD2 3.78Å; F94-L184 HydrophobicContact CD1-CD2 4.05Å; F94-L184 HydrophobicContact CD2-CD1 3.9Å; F94-L184 HydrophobicContact CD2-CD2 4.33Å; F94-L184 HydrophobicContact CE1-CD2 3.75Å; F94-L184 HydrophobicContact CE2-CD1 3.51Å; F94-L184 HydrophobicContact CE2-CD2 4.07Å; F94-L184 HydrophobicContact CE2-CG 4.46Å; F94-L184 HydrophobicContact CG-CD2 4.33Å; F94-L184 HydrophobicContact CZ-CD1 3.93Å; F94-L184 HydrophobicContact CZ-CD2 3.77Å; F94-L184 HydrophobicContact CZ-CG 4.5Å; I122-L184 HydrophobicContact CD1-CB 4.13Å; I122-L184 HydrophobicContact CD1-CD1 3.84Å; I122-L184 HydrophobicContact CG1-CB 4.27Å; I122-L184 HydrophobicContact CG1-CD1 4.16Å; I122-L184 HydrophobicContact CG2-CB 4.19Å; R129-L184 CarbonylContact C-O 3.3Å; R129-L184 WeakPolarHBondContact CA-O 3.49Å; L130-L184 PolarHBondContact N-O 3.19Å; L130-L184 PolarHBondContact O-N 3.45Å; I182-L184 HydrophobicContact CD1-CD2 3.68Å; I182-L184 HydrophobicContact CD1-CG 4.27Å; I182-L184 HydrophobicContact CG1-CD2 3.87Å; I182-L184 HydrophobicContact CG1-CG 4.16Å
185	S	92.3	Very high	77.6	Confident	36 Å²	36	53.7 Å²	53.7	25%	0.252	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.6	174.1	-55.8	0	0	0	0	109.7	I27 T28 S128	I27-S185 CarbonylContact C-O 3.58Å; I27-S185 WeakPolarHBondContact CA-O 3.29Å; T28-S185 PolarHBondContact N-O 3.35Å; T28-S185 PolarHBondContact O-N 3.22Å; S128-S185 WeakPolarHBondContact O-CA 3.21Å
186	A	91.4	Very high	80	Confident	5 Å²	5	47.5 Å²	47.5	4%	0.041	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	132	178.7	0	0	0	0	0	110.6	V25 E26 I122 V123 S128	V25-A186 HydrophobicContact CG1-CB 3.58Å; E26-A186 WeakPolarHBondContact O-CA 3.03Å; I122-A186 HydrophobicContact CG2-CB 3.66Å; V123-A186 HydrophobicContact CG1-CB 3.84Å; S128-A186 WeakPolarHBondContact CB-O 3.42Å; S128-A186 PolarHBondContact O-N 3.09Å
187	E	86.8	Confident	82.2	Confident	90 Å²	90	45.1 Å²	45.1	42%	0.421	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	133	172.4	-60.4	-161.2	135.7	0	0	110.1	V25 E26 L189 K339	V25-E187 CarbonylContact C-O 3.6Å; V25-E187 WeakPolarHBondContact CA-O 3.44Å; E26-E187 PolarHBondContact N-O 2.89Å; E26-E187 PolarHBondContact O-N 3.3Å; E187-L189 PolarHBondContact O-N 2.8Å; E187-K339 IonicContact OE1-NZ 2.72Å
188	E	84.9	Confident	83.8	Confident	39 Å²	39	39.4 Å²	39.4	18%	0.182	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	126.6	176.1	-172.5	-178.8	142.1	0	0	110.7	T23 S190 R193 T333 L335	T23-E188 HydrophobicContact CG2-CB 4.44Å; T23-E188 HydrophobicContact CG2-CG 3.18Å; T23-E188 WeakPolarHBondContact CG2-OE1 3.45Å; E188-S190 PolarHBondContact O-N 3.21Å; E188-R193 VanDerWaalsContact CG-NH2 3.26Å; E188-R193 IonicContact OE1-CZ 3.52Å; E188-R193 IonicContact OE1-NE 2.89Å; E188-R193 IonicContact OE1-NH2 3.23Å; E188-R193 PolarHBondContact OE1-NH2 2.88Å; E188-R193 IonicContact OE2-CZ 2.72Å; E188-R193 IonicContact OE2-NH2 2.69Å; E188-R193 PolarHBondContact OE2-NH2 2.85Å; E188-T333 WeakPolarHBondContact OE1-CG2 3.35Å; E188-T333 WeakPolarHBondContact OE2-CB 3.47Å; E188-T333 PolarHBondContact OE2-OG1 2.72Å; E188-L335 HydrophobicContact CB-CD1 4.2Å; E188-L335 HydrophobicContact CG-CD1 4.22Å; E188-L335 WeakPolarHBondContact OE2-CB 3.46Å
189	L	74.6	Confident	85.1	Confident	60 Å²	60	32.5 Å²	32.5	31%	0.314	18%	0.18	S	C	.	.			trans	-85.6	88	173	-71.6	171.4	0	0	0	109.5	K24 E26 I81 E187	K24-L189 HydrophobicContact CB-CB 3.96Å; K24-L189 HydrophobicContact CB-CD1 4.24Å; K24-L189 PolarHBondContact O-N 3.37Å; E26-L189 HydrophobicContact CB-CD1 3.91Å; E26-L189 HydrophobicContact CB-CD2 3.94Å; E26-L189 HydrophobicContact CB-CG 3.75Å; I81-L189 HydrophobicContact CB-CD1 4.14Å; I81-L189 HydrophobicContact CD1-CD1 3.81Å; I81-L189 HydrophobicContact CG1-CD1 3.76Å; I81-L189 HydrophobicContact CG2-CD1 3.46Å; I81-L189 VanDerWaalsContact CG2-CD1 3.46Å; E187-L189 PolarHBondContact O-N 2.8Å
190	S	61.1	Low	85.8	Confident	55 Å²	55	32.5 Å²	32.5	39%	0.385	18%	0.18	S	C	.	.			trans	-92.2	117.9	173.8	65.4	0	0	0	0	112	E188 C192 R193	E188-S190 PolarHBondContact O-N 3.21Å; S190-C192 PolarHBondContact O-N 3.09Å; S190-R193 VanDerWaalsContact CB-CG 3.46Å; S190-R193 PolarHBondContact OG-NE 2.78Å
191	N	57.1	Low	86.2	Confident	111 Å²	111	33.2 Å²	33.2	59%	0.594	18%	0.183	S	C	*	.	S	Bend	trans	-64	128.7	153.9	-64.5	-32.7	0	0	0	107.1	R193 R254	N191-R193 PolarHBondContact O-N 2.79Å; N191-R254 PolarHBondContact ND2-NH1 3.22Å
192	C	63.1	Low	86.4	Confident	50 Å²	50	31.8 Å²	31.8	34%	0.338	18%	0.175	S	C	.	.			trans	-0.8	100.6	177.3	-178.2	0	0	0	0	115.1	S190 D194	S190-C192 PolarHBondContact O-N 3.09Å; C192-D194 PolarHBondContact O-N 3.48Å
193	R	74.4	Confident	86.5	Confident	56 Å²	56	35.3 Å²	35.3	21%	0.211	19%	0.194	C	C	.	.			trans	-79.8	5.5	179.1	-58.2	-172.4	178.1	144	7.7	113.8	E188 S190 N191 V195 E331 D336	E188-R193 VanDerWaalsContact CG-NH2 3.26Å; E188-R193 IonicContact OE1-CZ 3.52Å; E188-R193 IonicContact OE1-NE 2.89Å; E188-R193 IonicContact OE1-NH2 3.23Å; E188-R193 PolarHBondContact OE1-NH2 2.88Å; E188-R193 IonicContact OE2-CZ 2.72Å; E188-R193 IonicContact OE2-NH2 2.69Å; E188-R193 PolarHBondContact OE2-NH2 2.85Å; S190-R193 VanDerWaalsContact CB-CG 3.46Å; S190-R193 PolarHBondContact OG-NE 2.78Å; N191-R193 PolarHBondContact O-N 2.79Å; R193-V195 PolarHBondContact O-N 3.33Å; R193-E331 WeakPolarHBondContact CD-O 3.2Å; R193-E331 PolarHBondContact O-N 2.79Å; R193-D336 IonicContact CZ-OD1 3.98Å; R193-D336 IonicContact CZ-OD2 3.38Å; R193-D336 IonicContact NH1-OD1 3Å; R193-D336 PolarHBondContact NH1-OD1 3.18Å; R193-D336 IonicContact NH1-OD2 3.41Å; R193-D336 PolarHBondContact NH1-OD2 3.24Å; R193-D336 IonicContact NH2-OD1 2.82Å
194	D	85	Confident	86.6	Confident	33 Å²	33	42.4 Å²	42.4	18%	0.176	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	132.4	-173.7	-63.4	-25.4	0	0	0	109.3	C192 V253 V328 S330	C192-D194 PolarHBondContact O-N 3.48Å; D194-V253 HydrophobicContact CB-CB 4Å; D194-V253 HydrophobicContact CB-CG2 3.62Å; D194-V253 VanDerWaalsContact O-CB 3.28Å; D194-V253 WeakPolarHBondContact O-CB 3.44Å; D194-V253 VanDerWaalsContact O-CG2 3.26Å; D194-V253 WeakPolarHBondContact O-CG2 3.39Å; D194-V253 PolarHBondContact O-N 3.49Å; D194-V328 HydrophobicContact CB-CG1 3.69Å; D194-S330 WeakPolarHBondContact OD1-CB 3.22Å; D194-S330 PolarHBondContact OD1-OG 3.25Å
195	V	87.9	Confident	86.6	Confident	12 Å²	12	42.5 Å²	42.5	7%	0.073	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	126.6	172.6	173.9	0	0	0	0	108	R193 V328 E329 E331	R193-V195 PolarHBondContact O-N 3.33Å; V195-V328 WeakPolarHBondContact O-CA 3.46Å; V195-E329 PolarHBondContact N-O 3.35Å; V195-E329 PolarHBondContact O-N 3.11Å; V195-E329 VanDerWaalsContact O-N 3.09Å; V195-E331 HydrophobicContact CB-CG 4.21Å; V195-E331 VanDerWaalsContact CG2-CD 3.41Å; V195-E331 HydrophobicContact CG2-CG 3.6Å
196	A	91.8	Very high	86.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	111.5	176.4	0	0	0	0	0	108.8	M198 S250 I251 V253 L256 F326 A327 V328	A196-M198 HydrophobicContact CB-CE 3.52Å; A196-S250 WeakPolarHBondContact O-CA 3.48Å; A196-I251 PolarHBondContact N-O 3.3Å; A196-I251 PolarHBondContact O-N 3.15Å; A196-V253 HydrophobicContact CB-CG2 4.12Å; A196-L256 HydrophobicContact CB-CD2 4.4Å; A196-F326 HydrophobicContact CB-CE2 3.81Å; A196-F326 HydrophobicContact CB-CZ 3.82Å; A196-A327 CarbonylContact C-O 3.58Å; A196-A327 WeakPolarHBondContact CA-O 3.47Å; A196-V328 HydrophobicContact CB-CG2 4.49Å
197	T	94.3	Very high	86.6	Confident	35 Å²	35	48 Å²	48	22%	0.215	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	123.6	174.4	-62.3	0	0	0	0	108.9	T248 F249 S250 F326 A327	T197-T248 HydrophobicContact CG2-CG2 3.36Å; T197-F249 CarbonylContact C-O 3.42Å; T197-F249 WeakPolarHBondContact CA-O 3.31Å; T197-S250 PolarHBondContact OG1-OG 3.07Å; T197-F326 CarbonylContact O-C 3.57Å; T197-F326 WeakPolarHBondContact O-CA 3.46Å; T197-A327 PolarHBondContact N-O 3.23Å; T197-A327 PolarHBondContact O-N 2.81Å
198	M	95.2	Very high	86.8	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	153	-172.3	61.1	-167.1	81.2	0	0	112.4	A196 F200 F220 F249 L256 L323 S325 F326	A196-M198 HydrophobicContact CB-CE 3.52Å; M198-F200 HydrophobicContact CB-CE2 4.19Å; M198-F200 HydrophobicContact CG-CD2 4.34Å; M198-F200 HydrophobicContact CG-CE2 3.81Å; M198-F200 HydrophobicContact SD-CE2 3.63Å; M198-F200 HydrophobicContact SD-CZ 4.32Å; M198-F220 HydrophobicContact SD-CE1 4.5Å; M198-F249 HydrophobicContact CG-CD2 4.04Å; M198-F249 HydrophobicContact CG-CE1 4.27Å; M198-F249 HydrophobicContact CG-CE2 3.39Å; M198-F249 HydrophobicContact CG-CZ 3.53Å; M198-F249 PolarHBondContact N-O 3.44Å; M198-F249 PolarHBondContact O-N 2.96Å; M198-F249 HydrophobicContact SD-CE2 3.76Å; M198-F249 HydrophobicContact SD-CZ 4.01Å; M198-L256 HydrophobicContact CE-CD2 4.17Å; M198-L323 HydrophobicContact CB-CD1 3.96Å; M198-S325 VanDerWaalsContact CA-O 3.24Å; M198-S325 WeakPolarHBondContact CA-O 2.98Å; M198-S325 WeakPolarHBondContact CB-O 3.4Å; M198-F326 HydrophobicContact CB-CD2 4.06Å; M198-F326 HydrophobicContact CE-CD2 4.15Å; M198-F326 HydrophobicContact CE-CE2 3.73Å
199	Q	97.4	Very high	86.6	Confident	51 Å²	51	46.1 Å²	46.1	24%	0.238	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	137.3	173.7	-168.3	-178.8	26.1	0	0	109.6	W246 L324 S325	Q199-W246 WeakPolarHBondContact CG-O 3.29Å; Q199-W246 PolarHBondContact NE2-O 2.65Å; Q199-W246 VanDerWaalsContact NE2-O 3.09Å; Q199-L324 HydrophobicContact CB-CB 4.27Å; Q199-L324 HydrophobicContact CG-CB 4.46Å; Q199-L324 HydrophobicContact CG-CD1 4.29Å; Q199-L324 PolarHBondContact O-N 3.49Å; Q199-S325 VanDerWaalsContact CB-OG 3.29Å; Q199-S325 WeakPolarHBondContact CB-OG 3.28Å; Q199-S325 PolarHBondContact N-O 3.35Å; Q199-S325 VanDerWaalsContact N-O 3.12Å; Q199-S325 PolarHBondContact N-OG 3.19Å; Q199-S325 PolarHBondContact O-N 3.42Å
200	F	97.8	Very high	86.7	Confident	1 Å²	1	52.1 Å²	52.1	0%	0.004	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	153.3	177.2	-73.8	-93.9	0	0	0	111.6	M198 L218 F220 W246 F249 L291 Y301 V321 T322 L323	M198-F200 HydrophobicContact CB-CE2 4.19Å; M198-F200 HydrophobicContact CG-CD2 4.34Å; M198-F200 HydrophobicContact CG-CE2 3.81Å; M198-F200 HydrophobicContact SD-CE2 3.63Å; M198-F200 HydrophobicContact SD-CZ 4.32Å; F200-L218 HydrophobicContact CB-CD1 4.08Å; F200-L218 HydrophobicContact CG-CD1 4.34Å; F200-F220 AromaticContact CD2-CZ 3.98Å; F200-F220 HydrophobicContact CD2-CZ 3.98Å; F200-F220 AromaticContact CE2-CE1 3.94Å; F200-F220 HydrophobicContact CE2-CE1 3.94Å; F200-F220 AromaticContact CE2-CZ 3.62Å; F200-F220 HydrophobicContact CE2-CZ 3.62Å; F200-F220 HydrophobicContact CZ-CE1 4.11Å; F200-F220 HydrophobicContact CZ-CZ 4.1Å; F200-W246 HydrophobicContact CB-CE3 3.95Å; F200-W246 HydrophobicContact CB-CZ3 4.33Å; F200-W246 PolarHBondContact O-N 2.98Å; F200-F249 AromaticContact CD2-CE1 3.98Å; F200-F249 HydrophobicContact CD2-CE1 3.98Å; F200-F249 AromaticContact CD2-CZ 3.79Å; F200-F249 HydrophobicContact CD2-CZ 3.79Å; F200-F249 AromaticContact CE2-CZ 3.97Å; F200-F249 HydrophobicContact CE2-CZ 3.97Å; F200-L291 HydrophobicContact CZ-CD2 3.9Å; F200-Y301 HydrophobicContact CE1-CE2 4.18Å; F200-V321 HydrophobicContact CB-CG1 4.4Å; F200-V321 HydrophobicContact CD1-CG1 3.56Å; F200-V321 HydrophobicContact CE1-CG1 4.23Å; F200-V321 HydrophobicContact CG-CG1 4.35Å; F200-T322 WeakPolarHBondContact CA-O 3.31Å; F200-L323 HydrophobicContact CD1-CB 4.26Å; F200-L323 HydrophobicContact CD1-CD1 4.29Å; F200-L323 HydrophobicContact CD2-CD1 4.17Å; F200-L323 HydrophobicContact CE1-CB 3.88Å; F200-L323 HydrophobicContact CE1-CD1 3.78Å; F200-L323 HydrophobicContact CE1-CG 4.44Å; F200-L323 HydrophobicContact CE2-CD1 3.64Å; F200-L323 HydrophobicContact CG-CD1 4.49Å; F200-L323 HydrophobicContact CZ-CB 4.39Å; F200-L323 HydrophobicContact CZ-CD1 3.44Å; F200-L323 VanDerWaalsContact CZ-CD1 3.44Å; F200-L323 HydrophobicContact CZ-CG 4.47Å
201	C	97.5	Very high	87.4	Confident	24 Å²	24	59.4 Å²	59.4	16%	0.162	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	164.4	159.3	69.1	0	0	0	0	110.3	P244 V245 V321 T322 L324	C201-P244 CarbonylContact C-O 3.5Å; C201-P244 WeakPolarHBondContact CA-O 3.04Å; C201-P244 VanDerWaalsContact CB-O 3.31Å; C201-P244 WeakPolarHBondContact CB-O 3.48Å; C201-V245 HydrophobicContact CB-CB 4.34Å; C201-V245 HydrophobicContact CB-CG1 4.45Å; C201-V245 HydrophobicContact CB-CG2 3.88Å; C201-V321 CarbonylContact O-C 3.58Å; C201-V321 WeakPolarHBondContact O-CA 3.14Å; C201-T322 PolarHBondContact N-O 3.3Å; C201-T322 PolarHBondContact O-N 2.85Å; C201-L324 HydrophobicContact CB-CD1 3.89Å; C201-L324 HydrophobicContact CB-CG 4.24Å
202	A	97.6	Very high	88.6	Confident	4 Å²	4	55.4 Å²	55.4	3%	0.033	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	163.7	167.1	0	0	0	0	0	111.4	L205 N243 P244 W246 T320 V321	A202-L205 HydrophobicContact CB-CD1 3.74Å; A202-L205 HydrophobicContact CB-CD2 3.87Å; A202-L205 HydrophobicContact CB-CG 3.75Å; A202-N243 CarbonylContact O-C 3.55Å; A202-N243 WeakPolarHBondContact O-CA 3.48Å; A202-P244 HydrophobicContact CB-CG 3.77Å; A202-P244 PolarHBondContact N-O 2.75Å; A202-W246 HydrophobicContact CB-CH2 3.7Å; A202-W246 HydrophobicContact CB-CZ3 3.84Å; A202-T320 CarbonylContact C-O 3.54Å; A202-T320 WeakPolarHBondContact CA-O 3.39Å; A202-T320 WeakPolarHBondContact CB-O 3.48Å; A202-V321 HydrophobicContact CB-CG2 3.88Å
203	N	96.8	Very high	89.9	Confident	74 Å²	74	57.7 Å²	57.7	40%	0.396	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	133.2	-178.6	-178.8	46.9	0	0	0	109.8	L205 N243 G319 T320	N203-L205 VanDerWaalsContact C-N 3.3Å; N203-L205 PolarHBondContact O-N 2.65Å; N203-N243 WeakPolarHBondContact CA-OD1 3.44Å; N203-N243 PolarHBondContact OD1-OD1 3.25Å; N203-N243 VanDerWaalsContact OD1-OD1 3.07Å; N203-G319 WeakPolarHBondContact O-CA 3.39Å; N203-T320 PolarHBondContact N-O 2.98Å; N203-T320 PolarHBondContact O-N 2.69Å
204	K	96.1	Very high	90.8	Very high	153 Å²	153	55 Å²	55	67%	0.665	27%	0.266	S	S	*	.	S	Bend	trans	51.9	44.5	177.9	-59.7	176.3	-177.2	175.6	0	113.3	L242 N243 G319	K204-L242 PolarHBondContact N-O 3.48Å; K204-L242 VanDerWaalsContact N-O 3.14Å; K204-N243 PolarHBondContact N-OD1 3.4Å; K204-G319 WeakPolarHBondContact O-CA 3.06Å
205	L	96.4	Very high	91.2	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.016	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-58.6	149.7	171.6	-66.4	-179.2	0	0	0	111.1	A202 N203 K207 P216 L242 P244 V269 I281 V303 S318	A202-L205 HydrophobicContact CB-CD1 3.74Å; A202-L205 HydrophobicContact CB-CD2 3.87Å; A202-L205 HydrophobicContact CB-CG 3.75Å; N203-L205 VanDerWaalsContact C-N 3.3Å; N203-L205 PolarHBondContact O-N 2.65Å; L205-K207 PolarHBondContact O-N 3.14Å; L205-P216 HydrophobicContact CD1-CB 3.59Å; L205-P216 HydrophobicContact CD1-CG 3.91Å; L205-L242 HydrophobicContact CB-CB 4.44Å; L205-L242 PolarHBondContact N-O 2.93Å; L205-L242 WeakPolarHBondContact O-CD1 3.45Å; L205-L242 WeakPolarHBondContact O-CD2 3.28Å; L205-P244 HydrophobicContact CD1-CG 3.89Å; L205-V269 HydrophobicContact CD1-CG1 4.04Å; L205-V269 HydrophobicContact CD2-CG1 4.28Å; L205-I281 HydrophobicContact CD2-CG2 4.48Å; L205-V303 HydrophobicContact CD2-CG2 4.26Å; L205-S318 WeakPolarHBondContact CA-O 3.16Å
206	D	92.3	Very high	91.6	Very high	49 Å²	49	54.1 Å²	54.1	26%	0.262	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-68.7	126.7	175.8	-89.5	-2.7	0	0	0	111	K208 S214 I281 K308 S318	D206-K208 PolarHBondContact O-N 2.56Å; D206-S214 PolarHBondContact O-OG 3.09Å; D206-I281 HydrophobicContact CB-CG2 4.33Å; D206-K308 IonicContact OD2-NZ 2.74Å; D206-K308 PolarHBondContact OD2-NZ 3.42Å; D206-S318 PolarHBondContact N-O 3.07Å; D206-S318 PolarHBondContact OD2-OG 2.94Å
207	K	91.6	Very high	91.9	Very high	109 Å²	109	54.1 Å²	54.1	47%	0.474	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-64.6	127.2	171.5	-172	-165.4	-171.6	-138	0	110.6	L205 D209 F210 G212 S214 L242	L205-K207 PolarHBondContact O-N 3.14Å; K207-D209 WeakPolarHBondContact CE-O 3.41Å; K207-D209 PolarHBondContact NZ-O 2.81Å; K207-F210 PolarHBondContact NZ-O 3.43Å; K207-G212 WeakPolarHBondContact CE-O 3.04Å; K207-G212 PolarHBondContact NZ-O 3.4Å; K207-S214 WeakPolarHBondContact CA-OG 3.3Å; K207-L242 HydrophobicContact CB-CD1 4.37Å; K207-L242 HydrophobicContact CB-CD2 4.16Å
208	K	89	Confident	92	Very high	46 Å²	46	52.5 Å²	52.5	20%	0.2	25%	0.25	C	S	.	.			trans	-107.2	-31.7	168.7	-43.6	-62.6	-137.8	62.9	0	113.9	D206 S214 D271 D279 F280 I281	D206-K208 PolarHBondContact O-N 2.56Å; K208-S214 PolarHBondContact N-OG 2.92Å; K208-D271 HydrophobicContact CB-CB 4.22Å; K208-D271 WeakPolarHBondContact CB-OD2 3.2Å; K208-D271 HydrophobicContact CG-CB 3.97Å; K208-D271 WeakPolarHBondContact CG-OD2 3.32Å; K208-D279 HydrophobicContact CB-CB 4.06Å; K208-D279 WeakPolarHBondContact CB-OD2 3.48Å; K208-D279 HydrophobicContact CG-CB 4.08Å; K208-D279 IonicContact NZ-OD1 3.09Å; K208-D279 PolarHBondContact NZ-OD1 3Å; K208-D279 IonicContact NZ-OD2 3.78Å; K208-F280 VanDerWaalsContact CE-O 3.25Å; K208-F280 WeakPolarHBondContact CE-O 3.15Å; K208-F280 PolarHBondContact NZ-O 3.11Å; K208-I281 HydrophobicContact CG-CG1 4.18Å
209	D	82	Confident	92.1	Very high	42 Å²	42	52.6 Å²	52.6	23%	0.225	25%	0.251	C	S	.	.			trans	-66.2	140.9	178.3	-72.5	-48.5	0	0	0	115.7	K207	K207-D209 WeakPolarHBondContact CE-O 3.41Å; K207-D209 PolarHBondContact NZ-O 2.81Å
210	F	76.9	Confident	92.1	Very high	187 Å²	187	50.1 Å²	50.1	82%	0.82	24%	0.239	S	C	*	.	S	Bend	trans	-70.4	-47.1	172.2	-102.8	-93.4	0	0	0	111.7	K207	K207-F210 PolarHBondContact NZ-O 3.43Å
211	F	75.4	Confident	92	Very high	208 Å²	208	51.1 Å²	51.1	91%	0.912	24%	0.243	S	C	*	.	S	Bend	trans	-117.1	66.5	-175.7	-72.7	-79.7	0	0	0	112.9
212	G	83	Confident	91.8	Very high	27 Å²	27	52.1 Å²	52.1	28%	0.278	24%	0.243	S	C	.	.	S	Bend	trans	155.2	175.4	-178.8	0	0	0	0	0	109.6	K207	K207-G212 WeakPolarHBondContact CE-O 3.04Å; K207-G212 PolarHBondContact NZ-O 3.4Å
213	K	90.4	Very high	91.5	Very high	98 Å²	98	53 Å²	53	43%	0.426	25%	0.249	S	C	.	.			trans	-84.7	167.3	157.8	-63.3	168	-177.9	170.9	0	107.8	N240 L242	K213-N240 WeakPolarHBondContact CB-OD1 3.05Å; K213-N240 PolarHBondContact N-OD1 3.11Å; K213-L242 HydrophobicContact CB-CD2 3.95Å; K213-L242 HydrophobicContact CB-CG 4.06Å; K213-L242 HydrophobicContact CD-CG 4.18Å; K213-L242 HydrophobicContact CG-CD1 4.5Å; K213-L242 HydrophobicContact CG-CD2 4.45Å; K213-L242 HydrophobicContact CG-CG 4.08Å
214	S	92.6	Very high	90.9	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.239	C	C	.	.			trans	-55.3	156.8	172.7	-66.6	0	0	0	0	113.4	D206 K207 K208 P216 N240 T241 D271	D206-S214 PolarHBondContact O-OG 3.09Å; K207-S214 WeakPolarHBondContact CA-OG 3.3Å; K208-S214 PolarHBondContact N-OG 2.92Å; S214-P216 WeakPolarHBondContact O-CD 3.26Å; S214-N240 CarbonylContact O-C 3.57Å; S214-N240 WeakPolarHBondContact O-CA 3.33Å; S214-N240 PolarHBondContact O-N 2.84Å; S214-T241 PolarHBondContact O-N 3.3Å; S214-D271 WeakPolarHBondContact CA-OD1 3.25Å; S214-D271 WeakPolarHBondContact CA-OD2 3.49Å; S214-D271 VanDerWaalsContact CB-OD1 3.26Å; S214-D271 WeakPolarHBondContact CB-OD1 3.36Å; S214-D271 WeakPolarHBondContact CB-OD2 3.15Å; S214-D271 PolarHBondContact OG-OD2 2.97Å
215	D	93.3	Very high	90.2	Very high	25 Å²	25	52.3 Å²	52.3	13%	0.134	25%	0.247	C	C	.	.			trans	-106.3	67	171.1	-68.2	-15.9	0	0	0	110.3	V237 M238 K239 N240 D271 W272	D215-V237 HydrophobicContact CB-CG1 3.82Å; D215-M238 CarbonylContact C-O 3.52Å; D215-M238 VanDerWaalsContact CA-O 3.29Å; D215-M238 WeakPolarHBondContact CA-O 3.38Å; D215-K239 WeakPolarHBondContact OD1-CA 3.41Å; D215-N240 PolarHBondContact OD1-N 2.71Å; D215-D271 WeakPolarHBondContact CA-OD1 3.39Å; D215-D271 PolarHBondContact N-OD1 3.02Å; D215-W272 HydrophobicContact CB-CB 4.02Å; D215-W272 WeakPolarHBondContact O-CB 3.48Å; D215-W272 PolarHBondContact O-N 2.9Å
216	P	96.5	Very high	89.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	144.6	-167.3	28.5	-39.9	0	0	0	115.6	L205 S214 M238 T241 P244 W246 Y270 I281	L205-P216 HydrophobicContact CD1-CB 3.59Å; L205-P216 HydrophobicContact CD1-CG 3.91Å; S214-P216 WeakPolarHBondContact O-CD 3.26Å; P216-M238 WeakPolarHBondContact CD-O 3.41Å; P216-M238 PolarHBondContact O-N 3.08Å; P216-M238 VanDerWaalsContact O-N 3.1Å; P216-T241 WeakPolarHBondContact CD-O 3.16Å; P216-T241 HydrophobicContact CG-CG2 4.2Å; P216-T241 WeakPolarHBondContact CG-O 3.44Å; P216-P244 HydrophobicContact CB-CG 4.2Å; P216-P244 HydrophobicContact CG-CB 3.88Å; P216-P244 HydrophobicContact CG-CG 3.57Å; P216-W246 HydrophobicContact CB-CZ2 4.18Å; P216-W246 PolarHBondContact O-NE1 2.86Å; P216-Y270 CarbonylContact C-O 3.59Å; P216-Y270 WeakPolarHBondContact CA-O 3.38Å; P216-I281 HydrophobicContact CB-CD1 4.44Å
217	F	97.1	Very high	89.1	Confident	1 Å²	1	58.1 Å²	58.1	0%	0.004	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	160.2	166.6	68.7	-84.3	0	0	0	111.8	V219 K234 V237 Y270 W272 H278	F217-V219 HydrophobicContact CD2-CG2 3.87Å; F217-V219 HydrophobicContact CE2-CG2 3.5Å; F217-V219 VanDerWaalsContact CE2-CG2 3.5Å; F217-K234 HydrophobicContact CD2-CD 4.24Å; F217-K234 HydrophobicContact CD2-CG 4.01Å; F217-K234 HydrophobicContact CE2-CD 4.17Å; F217-K234 HydrophobicContact CE2-CG 4.37Å; F217-V237 HydrophobicContact CB-CG2 4.2Å; F217-V237 HydrophobicContact CD1-CG2 4.06Å; F217-V237 HydrophobicContact CG-CG2 4.31Å; F217-Y270 HydrophobicContact CE1-CG 4.39Å; F217-Y270 HydrophobicContact CE2-CD2 4.08Å; F217-Y270 HydrophobicContact CE2-CG 4.24Å; F217-Y270 HydrophobicContact CZ-CD2 4.17Å; F217-Y270 AromaticContact CZ-CG 3.87Å; F217-Y270 HydrophobicContact CZ-CG 3.87Å; F217-Y270 PolarHBondContact N-O 3.28Å; F217-Y270 PolarHBondContact O-N 2.86Å; F217-W272 HydrophobicContact CD1-CB 4.02Å; F217-W272 HydrophobicContact CE1-CB 4Å; F217-H278 HydrophobicContact CE1-CB 4.27Å; F217-H278 HydrophobicContact CZ-CB 4.18Å; F217-H278 AromaticContact CZ-CD2 3.61Å
218	L	98	Very high	89	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	146	177.3	-57.5	179.6	0	0	0	111.3	F200 F220 K234 T235 W246 V267 E268 V269 V321	F200-L218 HydrophobicContact CB-CD1 4.08Å; F200-L218 HydrophobicContact CG-CD1 4.34Å; L218-F220 HydrophobicContact CB-CD2 4.38Å; L218-F220 HydrophobicContact CB-CE2 3.82Å; L218-F220 HydrophobicContact CD1-CE2 3.99Å; L218-F220 HydrophobicContact CD1-CZ 4.1Å; L218-K234 WeakPolarHBondContact O-CA 3.39Å; L218-T235 HydrophobicContact CB-CG2 3.88Å; L218-T235 HydrophobicContact CD1-CG2 4.38Å; L218-T235 HydrophobicContact CG-CG2 4.39Å; L218-T235 PolarHBondContact N-OG1 3.49Å; L218-T235 PolarHBondContact O-N 3.47Å; L218-W246 HydrophobicContact CD1-CD2 4.2Å; L218-W246 HydrophobicContact CD1-CE3 3.75Å; L218-W246 HydrophobicContact CD1-CH2 3.99Å; L218-W246 HydrophobicContact CD1-CZ2 4.41Å; L218-W246 HydrophobicContact CD1-CZ3 3.65Å; L218-W246 HydrophobicContact CD2-CH2 3.57Å; L218-W246 HydrophobicContact CD2-CZ2 3.93Å; L218-W246 HydrophobicContact CD2-CZ3 4.06Å; L218-W246 HydrophobicContact CG-CD2 4.21Å; L218-W246 HydrophobicContact CG-CE3 4.12Å; L218-W246 HydrophobicContact CG-CH2 3.64Å; L218-W246 HydrophobicContact CG-CZ2 3.73Å; L218-W246 HydrophobicContact CG-CZ3 3.86Å; L218-V267 HydrophobicContact CB-CG1 4.26Å; L218-V267 HydrophobicContact CD1-CG1 4.5Å; L218-V267 HydrophobicContact CD2-CG1 4.19Å; L218-E268 CarbonylContact C-O 3.59Å; L218-E268 WeakPolarHBondContact CA-O 2.78Å; L218-V269 HydrophobicContact CD2-CB 4.24Å; L218-V269 HydrophobicContact CD2-CG1 4.1Å; L218-V269 HydrophobicContact CD2-CG2 3.66Å; L218-V321 HydrophobicContact CD2-CG2 4.4Å
219	V	97.3	Very high	89	Confident	2 Å²	2	58 Å²	58	1%	0.012	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	123.2	168.1	-169.1	0	0	0	0	109.1	F217 Y221 I231 K234 V267 E268 Y270	F217-V219 HydrophobicContact CD2-CG2 3.87Å; F217-V219 HydrophobicContact CE2-CG2 3.5Å; F217-V219 VanDerWaalsContact CE2-CG2 3.5Å; V219-Y221 HydrophobicContact CB-CE2 3.7Å; V219-Y221 HydrophobicContact CG1-CD2 4.19Å; V219-Y221 HydrophobicContact CG1-CE1 4.37Å; V219-Y221 HydrophobicContact CG1-CE2 3.43Å; V219-Y221 VanDerWaalsContact CG1-CE2 3.43Å; V219-Y221 WeakPolarHBondContact CG1-OH 3.37Å; V219-I231 HydrophobicContact CG1-CD1 4.31Å; V219-I231 HydrophobicContact CG1-CG1 4.13Å; V219-I231 HydrophobicContact CG1-CG2 4.04Å; V219-K234 HydrophobicContact CG2-CG 4.37Å; V219-V267 WeakPolarHBondContact O-CA 3.44Å; V219-E268 PolarHBondContact N-O 3.34Å; V219-E268 PolarHBondContact O-N 2.83Å; V219-Y270 HydrophobicContact CG2-CD2 3.96Å; V219-Y270 HydrophobicContact CG2-CE2 4.14Å
220	F	97.3	Very high	89.2	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	134.5	179.4	-70.3	-104.2	0	0	0	110	M198 F200 L218 I231 C232 H233 T235 F249 I251 I265 V267	M198-F220 HydrophobicContact SD-CE1 4.5Å; F200-F220 AromaticContact CD2-CZ 3.98Å; F200-F220 HydrophobicContact CD2-CZ 3.98Å; F200-F220 AromaticContact CE2-CE1 3.94Å; F200-F220 HydrophobicContact CE2-CE1 3.94Å; F200-F220 AromaticContact CE2-CZ 3.62Å; F200-F220 HydrophobicContact CE2-CZ 3.62Å; F200-F220 HydrophobicContact CZ-CE1 4.11Å; F200-F220 HydrophobicContact CZ-CZ 4.1Å; L218-F220 HydrophobicContact CB-CD2 4.38Å; L218-F220 HydrophobicContact CB-CE2 3.82Å; L218-F220 HydrophobicContact CD1-CE2 3.99Å; L218-F220 HydrophobicContact CD1-CZ 4.1Å; F220-I231 WeakPolarHBondContact O-CA 3.22Å; F220-C232 VanDerWaalsContact C-SG 3.59Å; F220-C232 WeakPolarHBondContact CB-SG 3.4Å; F220-C232 PolarHBondContact O-N 3.12Å; F220-C232 PolarHBondContact O-SG 2.79Å; F220-C232 VanDerWaalsContact O-SG 3.4Å; F220-H233 HydrophobicContact CB-CB 4.25Å; F220-H233 HydrophobicContact CD2-CB 4.37Å; F220-H233 PolarHBondContact N-O 2.92Å; F220-T235 HydrophobicContact CE2-CG2 4.33Å; F220-F249 HydrophobicContact CD2-CZ 4.4Å; F220-F249 HydrophobicContact CE1-CZ 4.42Å; F220-F249 HydrophobicContact CE2-CE1 4.36Å; F220-F249 HydrophobicContact CE2-CE2 4.1Å; F220-F249 AromaticContact CE2-CZ 3.54Å; F220-F249 HydrophobicContact CE2-CZ 3.54Å; F220-F249 HydrophobicContact CZ-CE2 4.24Å; F220-F249 AromaticContact CZ-CZ 3.57Å; F220-F249 HydrophobicContact CZ-CZ 3.57Å; F220-I251 HydrophobicContact CB-CD1 4.42Å; F220-I251 HydrophobicContact CD1-CD1 4.45Å; F220-I251 HydrophobicContact CG-CD1 4.29Å; F220-I265 HydrophobicContact CD1-CG2 4.2Å; F220-V267 HydrophobicContact CD1-CG1 4.43Å; F220-V267 HydrophobicContact CD1-CG2 3.56Å; F220-V267 HydrophobicContact CD2-CG1 4.5Å; F220-V267 HydrophobicContact CE1-CG1 4.21Å; F220-V267 HydrophobicContact CE1-CG2 3.57Å; F220-V267 HydrophobicContact CE2-CG1 4.27Å; F220-V267 HydrophobicContact CG-CG2 4.28Å; F220-V267 HydrophobicContact CZ-CG1 4.1Å; F220-V267 HydrophobicContact CZ-CG2 4.3Å
221	Y	94.9	Very high	89.7	Confident	22 Å²	22	52.5 Å²	52.5	9%	0.086	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135.7	178.6	-60.8	-98.6	0	0	0	110.9	V219 F229 T230 I231 I265 K266 E268	V219-Y221 HydrophobicContact CB-CE2 3.7Å; V219-Y221 HydrophobicContact CG1-CD2 4.19Å; V219-Y221 HydrophobicContact CG1-CE1 4.37Å; V219-Y221 HydrophobicContact CG1-CE2 3.43Å; V219-Y221 VanDerWaalsContact CG1-CE2 3.43Å; V219-Y221 WeakPolarHBondContact CG1-OH 3.37Å; Y221-F229 HydrophobicContact CD1-CB 3.98Å; Y221-F229 HydrophobicContact CG-CB 4.34Å; Y221-T230 CarbonylContact C-O 3.59Å; Y221-T230 VanDerWaalsContact CA-O 3.22Å; Y221-T230 WeakPolarHBondContact CA-O 3.41Å; Y221-I231 HydrophobicContact CD1-CG1 3.66Å; Y221-I231 HydrophobicContact CE1-CB 4.47Å; Y221-I231 HydrophobicContact CE1-CD1 3.98Å; Y221-I231 HydrophobicContact CE1-CG1 3.24Å; Y221-I265 CarbonylContact O-C 2.99Å; Y221-I265 VanDerWaalsContact O-CA 3.27Å; Y221-I265 WeakPolarHBondContact O-CA 3.25Å; Y221-K266 PolarHBondContact N-O 3.16Å; Y221-K266 PolarHBondContact O-N 3.45Å; Y221-E268 HydrophobicContact CD2-CG 4.25Å; Y221-E268 HydrophobicContact CE2-CB 4.1Å; Y221-E268 HydrophobicContact CE2-CG 3.79Å; Y221-E268 WeakPolarHBondContact CE2-OE2 3.31Å; Y221-E268 PolarHBondContact OH-OE2 2.87Å
222	R	93.1	Very high	90.3	Very high	45 Å²	45	43.4 Å²	43.4	17%	0.17	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	135.6	166.2	-178.9	-164.6	66.9	-140.4	-1.1	109.6	N224 F229 T230 A255 L256 R263	R222-N224 PolarHBondContact NH2-OD1 2.76Å; R222-N224 VanDerWaalsContact NH2-OD1 3.09Å; R222-F229 WeakPolarHBondContact O-CA 3.46Å; R222-T230 PolarHBondContact N-O 2.87Å; R222-T230 PolarHBondContact O-N 3.4Å; R222-A255 WeakPolarHBondContact CD-O 3.49Å; R222-A255 PolarHBondContact NH1-O 3.01Å; R222-L256 WeakPolarHBondContact CG-O 2.86Å; R222-R263 HydrophobicContact CG-CG 4.36Å
223	S	91.6	Very high	90.9	Very high	21 Å²	21	44.1 Å²	44.1	15%	0.147	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	138.7	168.9	67.2	0	0	0	0	112.4	T228 R263 T264	S223-T228 CarbonylContact C-O 3.47Å; S223-R263 VanDerWaalsContact O-CD 3.27Å; S223-R263 WeakPolarHBondContact O-CD 3.46Å; S223-R263 PolarHBondContact O-NH1 3.38Å; S223-R263 VanDerWaalsContact OG-CG 3.3Å; S223-R263 WeakPolarHBondContact OG-CG 3.42Å; S223-T264 PolarHBondContact N-O 3.04Å; S223-T264 PolarHBondContact OG-O 3.06Å
224	N	85.3	Confident	91.1	Very high	36 Å²	36	43.4 Å²	43.4	19%	0.193	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-96.1	167.7	174.1	-68	-30.7	0	0	0	110.7	R222 D226 G227 T228 T230	R222-N224 PolarHBondContact NH2-OD1 2.76Å; R222-N224 VanDerWaalsContact NH2-OD1 3.09Å; N224-D226 WeakPolarHBondContact CB-OD1 3.22Å; N224-D226 PolarHBondContact O-N 3.26Å; N224-G227 PolarHBondContact O-N 2.88Å; N224-G227 VanDerWaalsContact O-N 3.1Å; N224-T228 WeakPolarHBondContact CB-OG1 3.34Å; N224-T228 PolarHBondContact N-O 3.38Å; N224-T228 PolarHBondContact ND2-OG1 3.38Å; N224-T230 PolarHBondContact ND2-OG1 3.35Å; N224-T230 PolarHBondContact OD1-OG1 3.22Å
225	E	81.1	Confident	91.2	Very high	177 Å²	177	43.8 Å²	43.8	83%	0.827	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-27.8	-179	-67.3	179.7	-179.8	0	0	113.1	G227 R263	E225-G227 PolarHBondContact O-N 3.15Å; E225-R263 IonicContact OE1-NH2 3.84Å
226	D	83.1	Confident	91.3	Very high	118 Å²	118	45.6 Å²	45.6	63%	0.631	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	2.7	174.9	63.2	0.5	0	0	0	113.3	N224 T228	N224-D226 WeakPolarHBondContact CB-OD1 3.22Å; N224-D226 PolarHBondContact O-N 3.26Å; D226-T228 VanDerWaalsContact C-N 3.27Å; D226-T228 VanDerWaalsContact CG-OG1 3.31Å; D226-T228 PolarHBondContact O-N 3.19Å; D226-T228 WeakPolarHBondContact OD1-CB 3.33Å; D226-T228 WeakPolarHBondContact OD1-CG2 3.49Å; D226-T228 PolarHBondContact OD1-N 3.49Å; D226-T228 PolarHBondContact OD1-OG1 3.43Å; D226-T228 PolarHBondContact OD2-OG1 3.44Å
227	G	81.2	Confident	91.3	Very high	56 Å²	56	47.8 Å²	47.8	58%	0.577	26%	0.256	S	S	*	.	S	Bend	trans	81.1	-0.4	-178.1	0	0	0	0	0	114.6	N224 E225	N224-G227 PolarHBondContact O-N 2.88Å; N224-G227 VanDerWaalsContact O-N 3.1Å; E225-G227 PolarHBondContact O-N 3.15Å
228	T	89.1	Confident	91.1	Very high	68 Å²	68	50.4 Å²	50.4	42%	0.417	27%	0.269	S	S	.	.			trans	-75	170.3	172.8	68.1	0	0	0	0	111.2	S223 N224 D226	S223-T228 CarbonylContact C-O 3.47Å; N224-T228 WeakPolarHBondContact CB-OG1 3.34Å; N224-T228 PolarHBondContact N-O 3.38Å; N224-T228 PolarHBondContact ND2-OG1 3.38Å; D226-T228 VanDerWaalsContact C-N 3.27Å; D226-T228 VanDerWaalsContact CG-OG1 3.31Å; D226-T228 PolarHBondContact O-N 3.19Å; D226-T228 WeakPolarHBondContact OD1-CB 3.33Å; D226-T228 WeakPolarHBondContact OD1-CG2 3.49Å; D226-T228 PolarHBondContact OD1-N 3.49Å; D226-T228 PolarHBondContact OD1-OG1 3.43Å; D226-T228 PolarHBondContact OD2-OG1 3.44Å
229	F	89.7	Confident	90.9	Very high	85 Å²	85	57.9 Å²	57.9	37%	0.373	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	136.2	179.4	-76.3	-83.6	0	0	0	110.9	Y221 R222 K266	Y221-F229 HydrophobicContact CD1-CB 3.98Å; Y221-F229 HydrophobicContact CG-CB 4.34Å; R222-F229 WeakPolarHBondContact O-CA 3.46Å; F229-K266 HydrophobicContact CD1-CB 4.03Å; F229-K266 HydrophobicContact CE1-CB 3.63Å; F229-K266 HydrophobicContact CE1-CD 4.44Å; F229-K266 HydrophobicContact CZ-CB 4.27Å; F229-K266 HydrophobicContact CZ-CD 4.39Å
230	T	86.3	Confident	90.6	Very high	57 Å²	57	62.3 Å²	62.3	35%	0.35	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131.6	174.5	-52.7	0	0	0	0	109.9	Y221 R222 N224 C232	Y221-T230 CarbonylContact C-O 3.59Å; Y221-T230 VanDerWaalsContact CA-O 3.22Å; Y221-T230 WeakPolarHBondContact CA-O 3.41Å; R222-T230 PolarHBondContact N-O 2.87Å; R222-T230 PolarHBondContact O-N 3.4Å; N224-T230 PolarHBondContact ND2-OG1 3.35Å; N224-T230 PolarHBondContact OD1-OG1 3.22Å; T230-C232 PolarHBondContact O-N 3.17Å
231	I	87.6	Confident	90.5	Very high	56 Å²	56	63.7 Å²	63.7	29%	0.287	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	129.1	174.2	-63.7	171.8	0	0	0	108.9	L10 F13 V219 F220 Y221	L10-I231 HydrophobicContact CD2-CD1 4.37Å; F13-I231 HydrophobicContact CD2-CG2 4.05Å; F13-I231 HydrophobicContact CE2-CB 4.45Å; F13-I231 HydrophobicContact CE2-CG2 3.87Å; V219-I231 HydrophobicContact CG1-CD1 4.31Å; V219-I231 HydrophobicContact CG1-CG1 4.13Å; V219-I231 HydrophobicContact CG1-CG2 4.04Å; F220-I231 WeakPolarHBondContact O-CA 3.22Å; Y221-I231 HydrophobicContact CD1-CG1 3.66Å; Y221-I231 HydrophobicContact CE1-CB 4.47Å; Y221-I231 HydrophobicContact CE1-CD1 3.98Å; Y221-I231 HydrophobicContact CE1-CG1 3.24Å
232	C	88.8	Confident	90.5	Very high	18 Å²	18	64.3 Å²	64.3	12%	0.122	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-23	173.5	58.2	0	0	0	0	113.4	F220 T230 I251 A255	F220-C232 VanDerWaalsContact C-SG 3.59Å; F220-C232 WeakPolarHBondContact CB-SG 3.4Å; F220-C232 PolarHBondContact O-N 3.12Å; F220-C232 PolarHBondContact O-SG 2.79Å; F220-C232 VanDerWaalsContact O-SG 3.4Å; T230-C232 PolarHBondContact O-N 3.17Å; C232-I251 HydrophobicContact CB-CG2 4.31Å; C232-A255 HydrophobicContact CB-CB 4.39Å
233	H	93.9	Very high	90.7	Very high	42 Å²	42	65.7 Å²	65.7	19%	0.194	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	155.3	176.8	-167.7	74.3	0	0	0	112.8	F220 F249 I251	F220-H233 HydrophobicContact CB-CB 4.25Å; F220-H233 HydrophobicContact CD2-CB 4.37Å; F220-H233 PolarHBondContact N-O 2.92Å; H233-F249 AromaticContact CD2-CD2 3.42Å; H233-F249 VanDerWaalsContact CD2-CD2 3.42Å; H233-F249 WeakPolarHBondContact CD2-CD2 3.46Å; H233-F249 AromaticContact CD2-CE2 3.73Å; H233-F249 AromaticContact CD2-CG 3.81Å; H233-F249 WeakPolarHBondContact NE2-CB 3.42Å; H233-F249 AromaticContact NE2-CD2 3.42Å; H233-F249 WeakPolarHBondContact NE2-CD2 3.42Å; H233-F249 AromaticContact NE2-CG 3.37Å; H233-F249 WeakPolarHBondContact NE2-CG 3.48Å; H233-I251 HydrophobicContact CB-CD1 3.43Å; H233-I251 VanDerWaalsContact CB-CD1 3.43Å; H233-I251 HydrophobicContact CB-CG1 3.8Å
234	K	94.8	Very high	91	Very high	83 Å²	83	64.7 Å²	64.7	36%	0.361	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	130.1	170.6	178.2	176.5	174.7	175	0	109.4	F217 L218 V219	F217-K234 HydrophobicContact CD2-CD 4.24Å; F217-K234 HydrophobicContact CD2-CG 4.01Å; F217-K234 HydrophobicContact CE2-CD 4.17Å; F217-K234 HydrophobicContact CE2-CG 4.37Å; L218-K234 WeakPolarHBondContact O-CA 3.39Å; V219-K234 HydrophobicContact CG2-CG 4.37Å
235	T	96.6	Very high	91.5	Very high	7 Å²	7	66.5 Å²	66.5	4%	0.043	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-79.1	170.7	178.2	66.2	0	0	0	0	111.7	L218 F220 W246 F249	L218-T235 HydrophobicContact CB-CG2 3.88Å; L218-T235 HydrophobicContact CD1-CG2 4.38Å; L218-T235 HydrophobicContact CG-CG2 4.39Å; L218-T235 PolarHBondContact N-OG1 3.49Å; L218-T235 PolarHBondContact O-N 3.47Å; F220-T235 HydrophobicContact CE2-CG2 4.33Å; T235-W246 HydrophobicContact CG2-CB 4.48Å; T235-W246 HydrophobicContact CG2-CG 4.36Å; T235-W246 PolarHBondContact OG1-NE1 2.96Å; T235-F249 HydrophobicContact CG2-CD1 4.05Å; T235-F249 HydrophobicContact CG2-CE1 3.77Å; T235-F249 HydrophobicContact CG2-CZ 4.37Å
236	E	95.1	Very high	92.3	Very high	63 Å²	63	58.1 Å²	58.1	29%	0.294	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-64.6	159.6	167	79.5	-74.7	-173.7	0	0	112.5	M238 W246 Q247	E236-M238 HydrophobicContact CG-SD 4.4Å; E236-W246 PolarHBondContact O-NE1 3.3Å; E236-W246 VanDerWaalsContact OE1-CA 3.22Å; E236-W246 WeakPolarHBondContact OE1-CA 3.31Å; E236-Q247 PolarHBondContact OE1-N 3.42Å
237	V	95.7	Very high	92.9	Very high	46 Å²	46	59.3 Å²	59.3	28%	0.279	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-87.4	120.6	175.9	176.2	0	0	0	0	109.6	D215 F217 W272	D215-V237 HydrophobicContact CB-CG1 3.82Å; F217-V237 HydrophobicContact CB-CG2 4.2Å; F217-V237 HydrophobicContact CD1-CG2 4.06Å; F217-V237 HydrophobicContact CG-CG2 4.31Å; V237-W272 HydrophobicContact CB-CB 4.43Å; V237-W272 HydrophobicContact CG1-CB 3.56Å; V237-W272 HydrophobicContact CG1-CG 3.97Å; V237-W272 HydrophobicContact CG2-CB 3.92Å; V237-W272 HydrophobicContact CG2-CG 3.89Å
238	M	93.9	Very high	93.6	Very high	57 Å²	57	60.3 Å²	60.3	28%	0.281	31%	0.312	S	S	.	.			trans	-97.4	105.3	178.9	-74	-64.7	-72.9	0	0	110.6	D215 P216 E236 T241 P244 V245 W246	D215-M238 CarbonylContact C-O 3.52Å; D215-M238 VanDerWaalsContact CA-O 3.29Å; D215-M238 WeakPolarHBondContact CA-O 3.38Å; P216-M238 WeakPolarHBondContact CD-O 3.41Å; P216-M238 PolarHBondContact O-N 3.08Å; P216-M238 VanDerWaalsContact O-N 3.1Å; E236-M238 HydrophobicContact CG-SD 4.4Å; M238-T241 HydrophobicContact CB-CG2 3.92Å; M238-P244 HydrophobicContact CB-CB 3.77Å; M238-P244 HydrophobicContact CG-CB 3.94Å; M238-V245 WeakPolarHBondContact CE-O 3.41Å; M238-W246 HydrophobicContact CG-CG 4.48Å
239	K	91.9	Very high	93.8	Very high	156 Å²	156	58 Å²	58	68%	0.678	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	139.5	-170.9	-63.1	-174.9	179.1	-179	0	114.3	D215 T241	D215-K239 WeakPolarHBondContact OD1-CA 3.41Å; K239-T241 PolarHBondContact O-N 3.38Å
240	N	92.3	Very high	93.9	Very high	96 Å²	96	56.8 Å²	56.8	51%	0.513	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	49.9	167.8	-169.7	20.3	0	0	0	113.2	K213 S214 D215	K213-N240 WeakPolarHBondContact CB-OD1 3.05Å; K213-N240 PolarHBondContact N-OD1 3.11Å; S214-N240 CarbonylContact O-C 3.57Å; S214-N240 WeakPolarHBondContact O-CA 3.33Å; S214-N240 PolarHBondContact O-N 2.84Å; D215-N240 PolarHBondContact OD1-N 2.71Å
241	T	94.8	Very high	94.1	Very high	28 Å²	28	54.1 Å²	54.1	17%	0.172	28%	0.282	C	S	.	.			trans	-144.4	145.2	178.6	-171.5	0	0	0	0	113	S214 P216 M238 K239 N243 P244	S214-T241 PolarHBondContact O-N 3.3Å; P216-T241 WeakPolarHBondContact CD-O 3.16Å; P216-T241 HydrophobicContact CG-CG2 4.2Å; P216-T241 WeakPolarHBondContact CG-O 3.44Å; M238-T241 HydrophobicContact CB-CG2 3.92Å; K239-T241 PolarHBondContact O-N 3.38Å; T241-N243 PolarHBondContact OG1-N 2.62Å; T241-N243 VanDerWaalsContact OG1-N 3.1Å; T241-P244 HydrophobicContact CG2-CB 3.94Å
242	L	95.3	Very high	94.1	Very high	35 Å²	35	54.8 Å²	54.8	18%	0.183	29%	0.29	C	S	.	.	S	Bend	trans	-103.5	0.1	169.7	-54	-179.4	0	0	0	111.7	K204 L205 K207 K213 P244	K204-L242 PolarHBondContact N-O 3.48Å; K204-L242 VanDerWaalsContact N-O 3.14Å; L205-L242 HydrophobicContact CB-CB 4.44Å; L205-L242 PolarHBondContact N-O 2.93Å; L205-L242 WeakPolarHBondContact O-CD1 3.45Å; L205-L242 WeakPolarHBondContact O-CD2 3.28Å; K207-L242 HydrophobicContact CB-CD1 4.37Å; K207-L242 HydrophobicContact CB-CD2 4.16Å; K213-L242 HydrophobicContact CB-CD2 3.95Å; K213-L242 HydrophobicContact CB-CG 4.06Å; K213-L242 HydrophobicContact CD-CG 4.18Å; K213-L242 HydrophobicContact CG-CD1 4.5Å; K213-L242 HydrophobicContact CG-CD2 4.45Å; K213-L242 HydrophobicContact CG-CG 4.08Å; L242-P244 VanDerWaalsContact C-CD 3.43Å
243	N	97.3	Very high	94.1	Very high	74 Å²	74	54 Å²	54	40%	0.396	28%	0.284	S	S	.	.	S	Bend	trans	-132.3	60.1	-179.6	-43.6	-71.7	0	0	0	109.8	A202 N203 K204 T241	A202-N243 CarbonylContact O-C 3.55Å; A202-N243 WeakPolarHBondContact O-CA 3.48Å; N203-N243 WeakPolarHBondContact CA-OD1 3.44Å; N203-N243 PolarHBondContact OD1-OD1 3.25Å; N203-N243 VanDerWaalsContact OD1-OD1 3.07Å; K204-N243 PolarHBondContact N-OD1 3.4Å; T241-N243 PolarHBondContact OG1-N 2.62Å; T241-N243 VanDerWaalsContact OG1-N 3.1Å
244	P	97.2	Very high	93.6	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.297	C	S	.	.			trans	-63.8	145.4	179.8	29.8	-38.2	0	0	0	111.1	C201 A202 L205 P216 M238 T241 L242 W246	C201-P244 CarbonylContact C-O 3.5Å; C201-P244 WeakPolarHBondContact CA-O 3.04Å; C201-P244 VanDerWaalsContact CB-O 3.31Å; C201-P244 WeakPolarHBondContact CB-O 3.48Å; A202-P244 HydrophobicContact CB-CG 3.77Å; A202-P244 PolarHBondContact N-O 2.75Å; L205-P244 HydrophobicContact CD1-CG 3.89Å; P216-P244 HydrophobicContact CB-CG 4.2Å; P216-P244 HydrophobicContact CG-CB 3.88Å; P216-P244 HydrophobicContact CG-CG 3.57Å; M238-P244 HydrophobicContact CB-CB 3.77Å; M238-P244 HydrophobicContact CG-CB 3.94Å; T241-P244 HydrophobicContact CG2-CB 3.94Å; L242-P244 VanDerWaalsContact C-CD 3.43Å; P244-W246 HydrophobicContact CB-CD2 4.22Å; P244-W246 HydrophobicContact CB-CH2 4.2Å; P244-W246 HydrophobicContact CB-CZ2 3.83Å; P244-W246 HydrophobicContact CG-CD2 4.43Å; P244-W246 HydrophobicContact CG-CE3 4.41Å; P244-W246 HydrophobicContact CG-CH2 3.38Å; P244-W246 HydrophobicContact CG-CZ2 3.36Å; P244-W246 HydrophobicContact CG-CZ3 3.93Å
245	V	97.1	Very high	93.2	Very high	75 Å²	75	55.4 Å²	55.4	46%	0.455	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-118.2	109.4	161.3	-178.5	0	0	0	0	104.8	C201 M238 L324	C201-V245 HydrophobicContact CB-CB 4.34Å; C201-V245 HydrophobicContact CB-CG1 4.45Å; C201-V245 HydrophobicContact CB-CG2 3.88Å; M238-V245 WeakPolarHBondContact CE-O 3.41Å; V245-L324 HydrophobicContact CG1-CD1 4.05Å
246	W	97.6	Very high	92.8	Very high	1 Å²	1	55 Å²	55	0%	0.004	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-78.9	155.9	179.3	-63.3	-80.8	0	0	0	110.2	Q199 F200 A202 P216 L218 T235 E236 M238 P244	Q199-W246 WeakPolarHBondContact CG-O 3.29Å; Q199-W246 PolarHBondContact NE2-O 2.65Å; Q199-W246 VanDerWaalsContact NE2-O 3.09Å; F200-W246 HydrophobicContact CB-CE3 3.95Å; F200-W246 HydrophobicContact CB-CZ3 4.33Å; F200-W246 PolarHBondContact O-N 2.98Å; A202-W246 HydrophobicContact CB-CH2 3.7Å; A202-W246 HydrophobicContact CB-CZ3 3.84Å; P216-W246 HydrophobicContact CB-CZ2 4.18Å; P216-W246 PolarHBondContact O-NE1 2.86Å; L218-W246 HydrophobicContact CD1-CD2 4.2Å; L218-W246 HydrophobicContact CD1-CE3 3.75Å; L218-W246 HydrophobicContact CD1-CH2 3.99Å; L218-W246 HydrophobicContact CD1-CZ2 4.41Å; L218-W246 HydrophobicContact CD1-CZ3 3.65Å; L218-W246 HydrophobicContact CD2-CH2 3.57Å; L218-W246 HydrophobicContact CD2-CZ2 3.93Å; L218-W246 HydrophobicContact CD2-CZ3 4.06Å; L218-W246 HydrophobicContact CG-CD2 4.21Å; L218-W246 HydrophobicContact CG-CE3 4.12Å; L218-W246 HydrophobicContact CG-CH2 3.64Å; L218-W246 HydrophobicContact CG-CZ2 3.73Å; L218-W246 HydrophobicContact CG-CZ3 3.86Å; T235-W246 HydrophobicContact CG2-CB 4.48Å; T235-W246 HydrophobicContact CG2-CG 4.36Å; T235-W246 PolarHBondContact OG1-NE1 2.96Å; E236-W246 PolarHBondContact O-NE1 3.3Å; E236-W246 VanDerWaalsContact OE1-CA 3.22Å; E236-W246 WeakPolarHBondContact OE1-CA 3.31Å; M238-W246 HydrophobicContact CG-CG 4.48Å; P244-W246 HydrophobicContact CB-CD2 4.22Å; P244-W246 HydrophobicContact CB-CH2 4.2Å; P244-W246 HydrophobicContact CB-CZ2 3.83Å; P244-W246 HydrophobicContact CG-CD2 4.43Å; P244-W246 HydrophobicContact CG-CE3 4.41Å; P244-W246 HydrophobicContact CG-CH2 3.38Å; P244-W246 HydrophobicContact CG-CZ2 3.36Å; P244-W246 HydrophobicContact CG-CZ3 3.93Å
247	Q	95.9	Very high	92.5	Very high	143 Å²	143	52 Å²	52	67%	0.668	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-61.6	153.7	172.6	-67.4	-170.5	4.4	0	0	110.3	E236 F249	E236-Q247 PolarHBondContact OE1-N 3.42Å; Q247-F249 WeakPolarHBondContact O-CD1 3.33Å; Q247-F249 PolarHBondContact O-N 3.35Å
248	T	94.6	Very high	91.8	Very high	77 Å²	77	53.4 Å²	53.4	47%	0.472	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-63.3	133.3	171.5	-56	0	0	0	0	109.3	T197	T197-T248 HydrophobicContact CG2-CG2 3.36Å
249	F	94.3	Very high	91	Very high	18 Å²	18	53.5 Å²	53.5	8%	0.079	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	164.9	177.9	62.4	-93.5	0	0	0	111.1	T197 M198 F200 F220 H233 T235 Q247 I251	T197-F249 CarbonylContact C-O 3.42Å; T197-F249 WeakPolarHBondContact CA-O 3.31Å; M198-F249 HydrophobicContact CG-CD2 4.04Å; M198-F249 HydrophobicContact CG-CE1 4.27Å; M198-F249 HydrophobicContact CG-CE2 3.39Å; M198-F249 HydrophobicContact CG-CZ 3.53Å; M198-F249 PolarHBondContact N-O 3.44Å; M198-F249 PolarHBondContact O-N 2.96Å; M198-F249 HydrophobicContact SD-CE2 3.76Å; M198-F249 HydrophobicContact SD-CZ 4.01Å; F200-F249 AromaticContact CD2-CE1 3.98Å; F200-F249 HydrophobicContact CD2-CE1 3.98Å; F200-F249 AromaticContact CD2-CZ 3.79Å; F200-F249 HydrophobicContact CD2-CZ 3.79Å; F200-F249 AromaticContact CE2-CZ 3.97Å; F200-F249 HydrophobicContact CE2-CZ 3.97Å; F220-F249 HydrophobicContact CD2-CZ 4.4Å; F220-F249 HydrophobicContact CE1-CZ 4.42Å; F220-F249 HydrophobicContact CE2-CE1 4.36Å; F220-F249 HydrophobicContact CE2-CE2 4.1Å; F220-F249 AromaticContact CE2-CZ 3.54Å; F220-F249 HydrophobicContact CE2-CZ 3.54Å; F220-F249 HydrophobicContact CZ-CE2 4.24Å; F220-F249 AromaticContact CZ-CZ 3.57Å; F220-F249 HydrophobicContact CZ-CZ 3.57Å; H233-F249 AromaticContact CD2-CD2 3.42Å; H233-F249 VanDerWaalsContact CD2-CD2 3.42Å; H233-F249 WeakPolarHBondContact CD2-CD2 3.46Å; H233-F249 AromaticContact CD2-CE2 3.73Å; H233-F249 AromaticContact CD2-CG 3.81Å; H233-F249 WeakPolarHBondContact NE2-CB 3.42Å; H233-F249 AromaticContact NE2-CD2 3.42Å; H233-F249 WeakPolarHBondContact NE2-CD2 3.42Å; H233-F249 AromaticContact NE2-CG 3.37Å; H233-F249 WeakPolarHBondContact NE2-CG 3.48Å; T235-F249 HydrophobicContact CG2-CD1 4.05Å; T235-F249 HydrophobicContact CG2-CE1 3.77Å; T235-F249 HydrophobicContact CG2-CZ 4.37Å; Q247-F249 WeakPolarHBondContact O-CD1 3.33Å; Q247-F249 PolarHBondContact O-N 3.35Å; F249-I251 HydrophobicContact CD2-CD1 4.22Å; F249-I251 HydrophobicContact CD2-CG1 3.98Å; F249-I251 HydrophobicContact CE2-CD1 3.76Å; F249-I251 HydrophobicContact CE2-CG1 4.01Å
250	S	91.2	Very high	90.8	Very high	61 Å²	61	49.3 Å²	49.3	43%	0.427	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	136.4	-175.4	-64.4	0	0	0	0	110.8	A196 T197	A196-S250 WeakPolarHBondContact O-CA 3.48Å; T197-S250 PolarHBondContact OG1-OG 3.07Å
251	I	90	Very high	90.8	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.7	174.9	-52	179.2	0	0	0	108.4	A196 F220 C232 H233 F249 V253 A255 L256	A196-I251 PolarHBondContact N-O 3.3Å; A196-I251 PolarHBondContact O-N 3.15Å; F220-I251 HydrophobicContact CB-CD1 4.42Å; F220-I251 HydrophobicContact CD1-CD1 4.45Å; F220-I251 HydrophobicContact CG-CD1 4.29Å; C232-I251 HydrophobicContact CB-CG2 4.31Å; H233-I251 HydrophobicContact CB-CD1 3.43Å; H233-I251 VanDerWaalsContact CB-CD1 3.43Å; H233-I251 HydrophobicContact CB-CG1 3.8Å; F249-I251 HydrophobicContact CD2-CD1 4.22Å; F249-I251 HydrophobicContact CD2-CG1 3.98Å; F249-I251 HydrophobicContact CE2-CD1 3.76Å; F249-I251 HydrophobicContact CE2-CG1 4.01Å; I251-V253 PolarHBondContact O-N 3.34Å; I251-A255 HydrophobicContact CG2-CB 4.13Å; I251-L256 HydrophobicContact CD1-CD1 4.03Å; I251-L256 HydrophobicContact CG2-CB 4.1Å; I251-L256 HydrophobicContact CG2-CD1 4.25Å
252	P	87.9	Confident	90.7	Very high	70 Å²	70	51.5 Å²	51.5	46%	0.455	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	130.7	170.2	-24.4	33.9	0	0	0	110.8	R254 A255 L256	P252-R254 PolarHBondContact O-N 3.02Å; P252-R254 VanDerWaalsContact O-N 3.15Å; P252-A255 HydrophobicContact CB-CB 4.12Å; P252-A255 HydrophobicContact CG-CB 4.44Å; P252-A255 WeakPolarHBondContact O-CA 3.45Å; P252-A255 WeakPolarHBondContact O-CB 3.24Å; P252-A255 PolarHBondContact O-N 3.32Å; P252-L256 PolarHBondContact O-N 3.07Å
253	V	88.3	Confident	90.6	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.006	28%	0.284	C	S	.	.	H	α-helix	trans	-57.4	-35.2	-178.7	170.5	0	0	0	0	110.5	D194 A196 I251 A255 L256 C257 Y261 Y288 V328	D194-V253 HydrophobicContact CB-CB 4Å; D194-V253 HydrophobicContact CB-CG2 3.62Å; D194-V253 VanDerWaalsContact O-CB 3.28Å; D194-V253 WeakPolarHBondContact O-CB 3.44Å; D194-V253 VanDerWaalsContact O-CG2 3.26Å; D194-V253 WeakPolarHBondContact O-CG2 3.39Å; D194-V253 PolarHBondContact O-N 3.49Å; A196-V253 HydrophobicContact CB-CG2 4.12Å; I251-V253 PolarHBondContact O-N 3.34Å; V253-A255 PolarHBondContact O-N 3.49Å; V253-L256 PolarHBondContact O-N 2.72Å; V253-C257 VanDerWaalsContact CG1-SG 3.58Å; V253-C257 PolarHBondContact O-N 3.23Å; V253-C257 PolarHBondContact O-SG 2.76Å; V253-Y261 HydrophobicContact CG1-CE1 4.09Å; V253-Y288 HydrophobicContact CG1-CD2 4.23Å; V253-Y288 HydrophobicContact CG1-CE2 3.99Å; V253-Y288 HydrophobicContact CG2-CD2 4.35Å; V253-Y288 HydrophobicContact CG2-CE2 3.69Å; V253-V328 HydrophobicContact CG2-CG1 4.44Å
254	R	84.9	Confident	90.6	Very high	124 Å²	124	50.7 Å²	50.7	47%	0.468	28%	0.283	S	S	.	.	H	α-helix	trans	-60.4	-42.9	171.6	-172.7	-179	-178.8	-168.1	-0.3	113.4	N191 P252 L256 N258	N191-R254 PolarHBondContact ND2-NH1 3.22Å; P252-R254 PolarHBondContact O-N 3.02Å; P252-R254 VanDerWaalsContact O-N 3.15Å; R254-L256 VanDerWaalsContact C-N 3.26Å; R254-L256 PolarHBondContact O-N 3.23Å; R254-N258 WeakPolarHBondContact O-CA 3.39Å; R254-N258 WeakPolarHBondContact O-CB 3.5Å; R254-N258 PolarHBondContact O-N 3.15Å
255	A	85.6	Confident	90.6	Very high	30 Å²	30	50.7 Å²	50.7	25%	0.248	28%	0.283	C	S	.	.	H	α-helix	trans	-65.9	-35.8	176.4	0	0	0	0	0	110.9	R222 C232 I251 P252 V253	R222-A255 WeakPolarHBondContact CD-O 3.49Å; R222-A255 PolarHBondContact NH1-O 3.01Å; C232-A255 HydrophobicContact CB-CB 4.39Å; I251-A255 HydrophobicContact CG2-CB 4.13Å; P252-A255 HydrophobicContact CB-CB 4.12Å; P252-A255 HydrophobicContact CG-CB 4.44Å; P252-A255 WeakPolarHBondContact O-CA 3.45Å; P252-A255 WeakPolarHBondContact O-CB 3.24Å; P252-A255 PolarHBondContact O-N 3.32Å; V253-A255 PolarHBondContact O-N 3.49Å
256	L	88.4	Confident	90.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-74.2	-41	-177.6	-165	67.3	0	0	0	113.5	A196 M198 R222 I251 P252 V253 R254 I265 Y288 L291	A196-L256 HydrophobicContact CB-CD2 4.4Å; M198-L256 HydrophobicContact CE-CD2 4.17Å; R222-L256 WeakPolarHBondContact CG-O 2.86Å; I251-L256 HydrophobicContact CD1-CD1 4.03Å; I251-L256 HydrophobicContact CG2-CB 4.1Å; I251-L256 HydrophobicContact CG2-CD1 4.25Å; P252-L256 PolarHBondContact O-N 3.07Å; V253-L256 PolarHBondContact O-N 2.72Å; R254-L256 VanDerWaalsContact C-N 3.26Å; R254-L256 PolarHBondContact O-N 3.23Å; L256-I265 HydrophobicContact CD1-CD1 3.76Å; L256-I265 HydrophobicContact CD1-CG1 4.16Å; L256-I265 HydrophobicContact CD1-CG2 4.18Å; L256-I265 HydrophobicContact CD2-CD1 3.92Å; L256-I265 HydrophobicContact CG-CD1 3.52Å; L256-I265 HydrophobicContact CG-CG1 4.17Å; L256-Y288 HydrophobicContact CD2-CD2 4.14Å; L256-L291 HydrophobicContact CD2-CD1 4.3Å
257	C	87.6	Confident	90.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-142.3	-7.4	-170.2	75.3	0	0	0	0	115.2	V253 G259 D260 R263	V253-C257 VanDerWaalsContact CG1-SG 3.58Å; V253-C257 PolarHBondContact O-N 3.23Å; V253-C257 PolarHBondContact O-SG 2.76Å; C257-G259 PolarHBondContact O-N 3.24Å; C257-G259 VanDerWaalsContact O-N 3.16Å; C257-D260 VanDerWaalsContact CB-O 3.29Å; C257-D260 WeakPolarHBondContact CB-O 3.45Å; C257-D260 PolarHBondContact O-N 2.83Å; C257-R263 HydrophobicContact CB-CB 4.48Å; C257-R263 WeakPolarHBondContact O-CD 3.34Å; C257-R263 PolarHBondContact O-NE 3.05Å
258	N	81.9	Confident	90.7	Very high	74 Å²	74	42.6 Å²	42.6	40%	0.396	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	39.1	177.5	-162.2	44.1	0	0	0	114.4	R254 D260	R254-N258 WeakPolarHBondContact O-CA 3.39Å; R254-N258 WeakPolarHBondContact O-CB 3.5Å; R254-N258 PolarHBondContact O-N 3.15Å; N258-D260 VanDerWaalsContact C-N 3.33Å; N258-D260 PolarHBondContact O-N 3.34Å
259	G	77.8	Confident	90.9	Very high	59 Å²	59	39 Å²	39	61%	0.608	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.6	-10.1	178.7	0	0	0	0	0	115.3	C257	C257-G259 PolarHBondContact O-N 3.24Å; C257-G259 VanDerWaalsContact O-N 3.16Å
260	D	86.2	Confident	91	Very high	69 Å²	69	39.3 Å²	39.3	37%	0.369	22%	0.218	S	C	.	.			trans	-100.9	98.9	172.9	175.9	4	0	0	0	109.8	C257 N258 D262 R263	C257-D260 VanDerWaalsContact CB-O 3.29Å; C257-D260 WeakPolarHBondContact CB-O 3.45Å; C257-D260 PolarHBondContact O-N 2.83Å; N258-D260 VanDerWaalsContact C-N 3.33Å; N258-D260 PolarHBondContact O-N 3.34Å; D260-D262 PolarHBondContact O-N 2.85Å; D260-D262 VanDerWaalsContact O-N 3.14Å; D260-D262 PolarHBondContact OD1-N 3.33Å; D260-D262 VanDerWaalsContact OD1-N 3.09Å; D260-R263 HydrophobicContact CB-CB 4.01Å; D260-R263 WeakPolarHBondContact O-CB 3.33Å; D260-R263 PolarHBondContact O-N 3.05Å; D260-R263 PolarHBondContact OD1-N 2.89Å; D260-R263 IonicContact OD2-NE 2.58Å
261	Y	92.1	Very high	91.1	Very high	84 Å²	84	36.4 Å²	36.4	33%	0.329	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-13	-174.1	-66	-8.6	0	0	0	114.5	V253 Y288 R289	V253-Y261 HydrophobicContact CG1-CE1 4.09Å; Y261-Y288 AromaticContact CD1-CD1 3.71Å; Y261-Y288 HydrophobicContact CD1-CD1 3.71Å; Y261-Y288 HydrophobicContact CD1-CE1 4.02Å; Y261-Y288 HydrophobicContact CD1-CG 4.39Å; Y261-Y288 HydrophobicContact CD2-CD1 4.08Å; Y261-Y288 AromaticContact CD2-CE1 3.98Å; Y261-Y288 HydrophobicContact CD2-CE1 3.98Å; Y261-Y288 HydrophobicContact CE1-CD1 4.3Å; Y261-Y288 HydrophobicContact CE1-CE1 4.19Å; Y261-Y288 HydrophobicContact CE2-CE1 4.15Å; Y261-Y288 AromaticContact CG-CD1 3.58Å; Y261-Y288 HydrophobicContact CG-CD1 3.58Å; Y261-Y288 AromaticContact CG-CE1 3.92Å; Y261-Y288 HydrophobicContact CG-CE1 3.92Å; Y261-Y288 PolarHBondContact O-N 3.27Å; Y261-R289 WeakPolarHBondContact O-CB 3.01Å; Y261-R289 PolarHBondContact O-N 3.14Å
262	D	94.4	Very high	91.3	Very high	86 Å²	86	40.3 Å²	40.3	46%	0.46	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-2.6	176.5	-65.5	-69.2	0	0	0	112	D260 T264 R289	D260-D262 PolarHBondContact O-N 2.85Å; D260-D262 VanDerWaalsContact O-N 3.14Å; D260-D262 PolarHBondContact OD1-N 3.33Å; D260-D262 VanDerWaalsContact OD1-N 3.09Å; D262-T264 PolarHBondContact O-N 3.19Å; D262-R289 VanDerWaalsContact CG-NE 3.31Å; D262-R289 VanDerWaalsContact OD1-CD 3.25Å; D262-R289 WeakPolarHBondContact OD1-CD 3.03Å; D262-R289 IonicContact OD1-CZ 2.68Å; D262-R289 IonicContact OD1-NE 3.82Å; D262-R289 PolarHBondContact OD1-NE 3.15Å; D262-R289 IonicContact OD1-NH2 3.98Å; D262-R289 IonicContact OD2-CZ 3.05Å; D262-R289 IonicContact OD2-NE 3.37Å; D262-R289 PolarHBondContact OD2-NE 3.49Å; D262-R289 IonicContact OD2-NH2 3.99Å; D262-R289 PolarHBondContact OD2-NH2 3.22Å
263	R	93	Very high	91.2	Very high	30 Å²	30	38.5 Å²	38.5	11%	0.113	20%	0.199	C	C	.	.			trans	-56.1	135.7	175.8	-172.4	169.5	-71.4	-111.7	1	111.4	R222 S223 E225 C257 D260 I265	R222-R263 HydrophobicContact CG-CG 4.36Å; S223-R263 VanDerWaalsContact O-CD 3.27Å; S223-R263 WeakPolarHBondContact O-CD 3.46Å; S223-R263 PolarHBondContact O-NH1 3.38Å; S223-R263 VanDerWaalsContact OG-CG 3.3Å; S223-R263 WeakPolarHBondContact OG-CG 3.42Å; E225-R263 IonicContact OE1-NH2 3.84Å; C257-R263 HydrophobicContact CB-CB 4.48Å; C257-R263 WeakPolarHBondContact O-CD 3.34Å; C257-R263 PolarHBondContact O-NE 3.05Å; D260-R263 HydrophobicContact CB-CB 4.01Å; D260-R263 WeakPolarHBondContact O-CB 3.33Å; D260-R263 PolarHBondContact O-N 3.05Å; D260-R263 PolarHBondContact OD1-N 2.89Å; D260-R263 IonicContact OD2-NE 2.58Å; R263-I265 PolarHBondContact O-N 3.41Å
264	T	96.2	Very high	90.7	Very high	61 Å²	61	49.4 Å²	49.4	37%	0.374	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	125.5	-178.8	-53.5	0	0	0	0	111.1	S223 D262 T285	S223-T264 PolarHBondContact N-O 3.04Å; S223-T264 PolarHBondContact OG-O 3.06Å; D262-T264 PolarHBondContact O-N 3.19Å; T264-T285 HydrophobicContact CG2-CG2 3.93Å
265	I	97.3	Very high	90.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	117.5	167.8	-58.2	159.2	0	0	0	106.4	F220 Y221 L256 R263 V267 T285 T286 L291	F220-I265 HydrophobicContact CD1-CG2 4.2Å; Y221-I265 CarbonylContact O-C 2.99Å; Y221-I265 VanDerWaalsContact O-CA 3.27Å; Y221-I265 WeakPolarHBondContact O-CA 3.25Å; L256-I265 HydrophobicContact CD1-CD1 3.76Å; L256-I265 HydrophobicContact CD1-CG1 4.16Å; L256-I265 HydrophobicContact CD1-CG2 4.18Å; L256-I265 HydrophobicContact CD2-CD1 3.92Å; L256-I265 HydrophobicContact CG-CD1 3.52Å; L256-I265 HydrophobicContact CG-CG1 4.17Å; R263-I265 PolarHBondContact O-N 3.41Å; I265-V267 HydrophobicContact CG2-CG2 4.25Å; I265-T285 CarbonylContact O-C 3.49Å; I265-T285 VanDerWaalsContact O-CA 3.28Å; I265-T285 WeakPolarHBondContact O-CA 3.3Å; I265-T286 HydrophobicContact CB-CG2 3.96Å; I265-T286 HydrophobicContact CD1-CG2 4.42Å; I265-T286 HydrophobicContact CG2-CG2 4.26Å; I265-T286 PolarHBondContact N-O 2.91Å; I265-T286 PolarHBondContact O-N 3.4Å; I265-L291 HydrophobicContact CD1-CD1 3.89Å
266	K	97.6	Very high	89.9	Confident	34 Å²	34	50.1 Å²	50.1	15%	0.148	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	134.5	172.8	-179.9	179	61.3	152.3	0	108.6	Y221 F229 E268 T285	Y221-K266 PolarHBondContact N-O 3.16Å; Y221-K266 PolarHBondContact O-N 3.45Å; F229-K266 HydrophobicContact CD1-CB 4.03Å; F229-K266 HydrophobicContact CE1-CB 3.63Å; F229-K266 HydrophobicContact CE1-CD 4.44Å; F229-K266 HydrophobicContact CZ-CB 4.27Å; F229-K266 HydrophobicContact CZ-CD 4.39Å; K266-E268 HydrophobicContact CD-CG 4.42Å; K266-E268 WeakPolarHBondContact CE-OE1 3.35Å; K266-E268 HydrophobicContact CG-CG 4.39Å; K266-E268 IonicContact NZ-OE1 2.69Å; K266-E268 PolarHBondContact NZ-OE1 3.21Å; K266-T285 HydrophobicContact CB-CG2 4.38Å; K266-T285 HydrophobicContact CG-CG2 4.48Å
267	V	98.1	Very high	89.7	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.9	176.1	-172.6	0	0	0	0	108.5	L218 V219 F220 I265 E283 F284	L218-V267 HydrophobicContact CB-CG1 4.26Å; L218-V267 HydrophobicContact CD1-CG1 4.5Å; L218-V267 HydrophobicContact CD2-CG1 4.19Å; V219-V267 WeakPolarHBondContact O-CA 3.44Å; F220-V267 HydrophobicContact CD1-CG1 4.43Å; F220-V267 HydrophobicContact CD1-CG2 3.56Å; F220-V267 HydrophobicContact CD2-CG1 4.5Å; F220-V267 HydrophobicContact CE1-CG1 4.21Å; F220-V267 HydrophobicContact CE1-CG2 3.57Å; F220-V267 HydrophobicContact CE2-CG1 4.27Å; F220-V267 HydrophobicContact CG-CG2 4.28Å; F220-V267 HydrophobicContact CZ-CG1 4.1Å; F220-V267 HydrophobicContact CZ-CG2 4.3Å; I265-V267 HydrophobicContact CG2-CG2 4.25Å; V267-E283 CarbonylContact O-C 3.49Å; V267-E283 VanDerWaalsContact O-CA 3.24Å; V267-E283 WeakPolarHBondContact O-CA 3.29Å; V267-F284 HydrophobicContact CB-CD1 4.08Å; V267-F284 HydrophobicContact CB-CD2 4.28Å; V267-F284 HydrophobicContact CB-CE1 3.57Å; V267-F284 HydrophobicContact CB-CE2 3.81Å; V267-F284 HydrophobicContact CB-CG 4.42Å; V267-F284 HydrophobicContact CB-CZ 3.43Å; V267-F284 VanDerWaalsContact CB-CZ 3.43Å; V267-F284 HydrophobicContact CG1-CD1 4.49Å; V267-F284 HydrophobicContact CG1-CE1 3.62Å; V267-F284 HydrophobicContact CG1-CE2 4.46Å; V267-F284 HydrophobicContact CG1-CZ 3.62Å; V267-F284 HydrophobicContact CG2-CD2 4.42Å; V267-F284 HydrophobicContact CG2-CE1 4.36Å; V267-F284 HydrophobicContact CG2-CE2 3.73Å; V267-F284 HydrophobicContact CG2-CZ 3.7Å; V267-F284 PolarHBondContact N-O 2.7Å; V267-F284 PolarHBondContact O-N 3.48Å
268	E	98.1	Very high	89.7	Confident	16 Å²	16	55.3 Å²	55.3	8%	0.075	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	140.5	177.8	-64	-177.2	173.2	0	0	110	L218 V219 Y221 K266 Y270 F280 E283	L218-E268 CarbonylContact C-O 3.59Å; L218-E268 WeakPolarHBondContact CA-O 2.78Å; V219-E268 PolarHBondContact N-O 3.34Å; V219-E268 PolarHBondContact O-N 2.83Å; Y221-E268 HydrophobicContact CD2-CG 4.25Å; Y221-E268 HydrophobicContact CE2-CB 4.1Å; Y221-E268 HydrophobicContact CE2-CG 3.79Å; Y221-E268 WeakPolarHBondContact CE2-OE2 3.31Å; Y221-E268 PolarHBondContact OH-OE2 2.87Å; K266-E268 HydrophobicContact CD-CG 4.42Å; K266-E268 WeakPolarHBondContact CE-OE1 3.35Å; K266-E268 HydrophobicContact CG-CG 4.39Å; K266-E268 IonicContact NZ-OE1 2.69Å; K266-E268 PolarHBondContact NZ-OE1 3.21Å; E268-Y270 HydrophobicContact CB-CD2 4.11Å; E268-Y270 HydrophobicContact CB-CE2 3.47Å; E268-Y270 VanDerWaalsContact CB-CE2 3.47Å; E268-Y270 HydrophobicContact CG-CE2 4.43Å; E268-Y270 WeakPolarHBondContact OE2-CE2 3.47Å; E268-Y270 VanDerWaalsContact OE2-CZ 3.26Å; E268-Y270 PolarHBondContact OE2-OH 3.3Å; E268-F280 HydrophobicContact CB-CE2 4.08Å; E268-F280 HydrophobicContact CG-CE2 4.09Å; E268-E283 HydrophobicContact CG-CB 4.16Å
269	V	98.1	Very high	90.1	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.1	178	-165.3	0	0	0	0	108	L205 L218 I281 G282 V303 V321	L205-V269 HydrophobicContact CD1-CG1 4.04Å; L205-V269 HydrophobicContact CD2-CG1 4.28Å; L218-V269 HydrophobicContact CD2-CB 4.24Å; L218-V269 HydrophobicContact CD2-CG1 4.1Å; L218-V269 HydrophobicContact CD2-CG2 3.66Å; V269-I281 HydrophobicContact CB-CB 4.22Å; V269-I281 HydrophobicContact CG1-CB 4.26Å; V269-I281 HydrophobicContact CG1-CD1 4.19Å; V269-I281 WeakPolarHBondContact O-CA 3.04Å; V269-I281 WeakPolarHBondContact O-CB 3.48Å; V269-I281 PolarHBondContact O-N 2.82Å; V269-G282 PolarHBondContact N-O 2.89Å; V269-G282 PolarHBondContact O-N 2.89Å; V269-V303 HydrophobicContact CB-CG1 4.31Å; V269-V303 HydrophobicContact CG2-CG1 3.88Å; V269-V303 HydrophobicContact CG2-CG2 4.11Å; V269-V321 HydrophobicContact CG2-CG2 4.19Å
270	Y	96.6	Very high	90.9	Very high	26 Å²	26	54.4 Å²	54.4	10%	0.102	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	152.5	-178.7	-74	-86.9	0	0	0	111.1	P216 F217 V219 E268 H278 F280	P216-Y270 CarbonylContact C-O 3.59Å; P216-Y270 WeakPolarHBondContact CA-O 3.38Å; F217-Y270 HydrophobicContact CE1-CG 4.39Å; F217-Y270 HydrophobicContact CE2-CD2 4.08Å; F217-Y270 HydrophobicContact CE2-CG 4.24Å; F217-Y270 HydrophobicContact CZ-CD2 4.17Å; F217-Y270 AromaticContact CZ-CG 3.87Å; F217-Y270 HydrophobicContact CZ-CG 3.87Å; F217-Y270 PolarHBondContact N-O 3.28Å; F217-Y270 PolarHBondContact O-N 2.86Å; V219-Y270 HydrophobicContact CG2-CD2 3.96Å; V219-Y270 HydrophobicContact CG2-CE2 4.14Å; E268-Y270 HydrophobicContact CB-CD2 4.11Å; E268-Y270 HydrophobicContact CB-CE2 3.47Å; E268-Y270 VanDerWaalsContact CB-CE2 3.47Å; E268-Y270 HydrophobicContact CG-CE2 4.43Å; E268-Y270 WeakPolarHBondContact OE2-CE2 3.47Å; E268-Y270 VanDerWaalsContact OE2-CZ 3.26Å; E268-Y270 PolarHBondContact OE2-OH 3.3Å; Y270-H278 HydrophobicContact CD1-CB 4.14Å; Y270-F280 HydrophobicContact CD1-CB 4.18Å; Y270-F280 HydrophobicContact CD1-CD2 4.27Å; Y270-F280 HydrophobicContact CE1-CB 3.91Å; Y270-F280 AromaticContact CE1-CD2 3.73Å; Y270-F280 HydrophobicContact CE1-CD2 3.73Å; Y270-F280 HydrophobicContact CE1-CG 4.32Å; Y270-F280 HydrophobicContact CE2-CD2 4.33Å; Y270-F280 AromaticContact CZ-CD2 3.75Å
271	D	94	Very high	91.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	130.7	162.6	-155	-4.9	0	0	0	108.9	K208 S214 D215 H278 D279 I281	K208-D271 HydrophobicContact CB-CB 4.22Å; K208-D271 WeakPolarHBondContact CB-OD2 3.2Å; K208-D271 HydrophobicContact CG-CB 3.97Å; K208-D271 WeakPolarHBondContact CG-OD2 3.32Å; S214-D271 WeakPolarHBondContact CA-OD1 3.25Å; S214-D271 WeakPolarHBondContact CA-OD2 3.49Å; S214-D271 VanDerWaalsContact CB-OD1 3.26Å; S214-D271 WeakPolarHBondContact CB-OD1 3.36Å; S214-D271 WeakPolarHBondContact CB-OD2 3.15Å; S214-D271 PolarHBondContact OG-OD2 2.97Å; D215-D271 WeakPolarHBondContact CA-OD1 3.39Å; D215-D271 PolarHBondContact N-OD1 3.02Å; D271-H278 CarbonylContact O-C 3.49Å; D271-H278 WeakPolarHBondContact O-CA 3.43Å; D271-H278 WeakPolarHBondContact O-CB 3.44Å; D271-D279 HydrophobicContact CB-CB 3.75Å; D271-D279 WeakPolarHBondContact CB-O 3.3Å; D271-D279 PolarHBondContact N-O 3.28Å; D271-D279 PolarHBondContact O-N 3.06Å; D271-I281 HydrophobicContact CB-CD1 4.21Å; D271-I281 HydrophobicContact CB-CG1 4.31Å
272	W	93.4	Very high	91.7	Very high	83 Å²	83	47.1 Å²	47.1	31%	0.314	24%	0.238	S	C	.	.			trans	-81.9	125.3	-179.7	-178.9	88.9	0	0	0	111.3	D215 F217 V237 R274 H278	D215-W272 HydrophobicContact CB-CB 4.02Å; D215-W272 WeakPolarHBondContact O-CB 3.48Å; D215-W272 PolarHBondContact O-N 2.9Å; F217-W272 HydrophobicContact CD1-CB 4.02Å; F217-W272 HydrophobicContact CE1-CB 4Å; V237-W272 HydrophobicContact CB-CB 4.43Å; V237-W272 HydrophobicContact CG1-CB 3.56Å; V237-W272 HydrophobicContact CG1-CG 3.97Å; V237-W272 HydrophobicContact CG2-CB 3.92Å; V237-W272 HydrophobicContact CG2-CG 3.89Å; W272-R274 HydrophobicContact CH2-CB 3.83Å; W272-R274 HydrophobicContact CH2-CG 3.97Å; W272-R274 HydrophobicContact CZ3-CB 4.08Å; W272-H278 AromaticContact CD1-CE1 3.15Å; W272-H278 AromaticContact CD1-ND1 3.79Å; W272-H278 AromaticContact CD1-NE2 3.61Å; W272-H278 AromaticContact CG-CE1 3.91Å; W272-H278 AromaticContact NE1-CE1 3.34Å; W272-H278 PolarHBondContact NE1-CE1 3.04Å; W272-H278 VanDerWaalsContact NE1-CE1 3.34Å; W272-H278 AromaticContact NE1-NE2 3.89Å
273	D	85.1	Confident	91.8	Very high	31 Å²	31	45.8 Å²	45.8	17%	0.166	23%	0.229	C	C	.	.			trans	-113.2	141.3	174.2	-67.5	-65.4	0	0	0	111.9	D275 G276 H278 D279	D273-D275 WeakPolarHBondContact CB-OD1 3.42Å; D273-D275 PolarHBondContact O-N 3.02Å; D273-G276 PolarHBondContact O-N 2.63Å; D273-G276 VanDerWaalsContact O-N 3.14Å; D273-H278 PolarHBondContact N-ND1 3.34Å; D273-H278 VanDerWaalsContact N-ND1 3.14Å; D273-H278 PolarHBondContact O-CE1 2.9Å; D273-H278 VanDerWaalsContact O-CE1 3.23Å; D273-H278 PolarHBondContact O-ND1 2.85Å; D273-H278 WeakPolarHBondContact OD2-CA 3.49Å; D273-D279 WeakPolarHBondContact OD2-CB 3.18Å; D273-D279 PolarHBondContact OD2-N 3.13Å
274	R	77.4	Confident	92.1	Very high	230 Å²	230	45.1 Å²	45.1	87%	0.868	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-24.4	-175.7	-167.3	175.6	-171	-166.9	3	114	W272 G276	W272-R274 HydrophobicContact CH2-CB 3.83Å; W272-R274 HydrophobicContact CH2-CG 3.97Å; W272-R274 HydrophobicContact CZ3-CB 4.08Å; R274-G276 VanDerWaalsContact C-N 3.32Å
275	D	78.3	Confident	92.1	Very high	123 Å²	123	46.4 Å²	46.4	66%	0.658	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	0.7	-179.7	65.9	4.2	0	0	0	113.5	D273 S277	D273-D275 WeakPolarHBondContact CB-OD1 3.42Å; D273-D275 PolarHBondContact O-N 3.02Å; D275-S277 VanDerWaalsContact C-N 3.29Å; D275-S277 WeakPolarHBondContact OD1-CB 3.37Å; D275-S277 PolarHBondContact OD1-N 3.09Å; D275-S277 PolarHBondContact OD1-OG 3.31Å; D275-S277 PolarHBondContact OD2-OG 3.37Å; D275-S277 VanDerWaalsContact OD2-OG 3.11Å
276	G	76.2	Confident	92.1	Very high	46 Å²	46	46.6 Å²	46.6	47%	0.474	24%	0.236	S	C	.	.	S	Bend	trans	83.6	-3.4	-178.5	0	0	0	0	0	114.5	D273 R274 H278	D273-G276 PolarHBondContact O-N 2.63Å; D273-G276 VanDerWaalsContact O-N 3.14Å; R274-G276 VanDerWaalsContact C-N 3.32Å; G276-H278 PolarHBondContact O-N 3.07Å
277	S	83.6	Confident	92	Very high	77 Å²	77	45.5 Å²	45.5	54%	0.538	23%	0.233	S	C	.	.			trans	-85.8	46.4	180	71.9	0	0	0	0	113.2	D275 D279	D275-S277 VanDerWaalsContact C-N 3.29Å; D275-S277 WeakPolarHBondContact OD1-CB 3.37Å; D275-S277 PolarHBondContact OD1-N 3.09Å; D275-S277 PolarHBondContact OD1-OG 3.31Å; D275-S277 PolarHBondContact OD2-OG 3.37Å; D275-S277 VanDerWaalsContact OD2-OG 3.11Å; S277-D279 PolarHBondContact O-N 3.14Å
278	H	87.9	Confident	91.8	Very high	32 Å²	32	46.6 Å²	46.6	15%	0.148	24%	0.237	C	C	.	.			trans	-45.2	126.2	-171.3	-58.1	-26.7	0	0	0	114.1	F217 Y270 D271 W272 D273 G276 F280	F217-H278 HydrophobicContact CE1-CB 4.27Å; F217-H278 HydrophobicContact CZ-CB 4.18Å; F217-H278 AromaticContact CZ-CD2 3.61Å; Y270-H278 HydrophobicContact CD1-CB 4.14Å; D271-H278 CarbonylContact O-C 3.49Å; D271-H278 WeakPolarHBondContact O-CA 3.43Å; D271-H278 WeakPolarHBondContact O-CB 3.44Å; W272-H278 AromaticContact CD1-CE1 3.15Å; W272-H278 AromaticContact CD1-ND1 3.79Å; W272-H278 AromaticContact CD1-NE2 3.61Å; W272-H278 AromaticContact CG-CE1 3.91Å; W272-H278 AromaticContact NE1-CE1 3.34Å; W272-H278 PolarHBondContact NE1-CE1 3.04Å; W272-H278 VanDerWaalsContact NE1-CE1 3.34Å; W272-H278 AromaticContact NE1-NE2 3.89Å; D273-H278 PolarHBondContact N-ND1 3.34Å; D273-H278 VanDerWaalsContact N-ND1 3.14Å; D273-H278 PolarHBondContact O-CE1 2.9Å; D273-H278 VanDerWaalsContact O-CE1 3.23Å; D273-H278 PolarHBondContact O-ND1 2.85Å; D273-H278 WeakPolarHBondContact OD2-CA 3.49Å; G276-H278 PolarHBondContact O-N 3.07Å; H278-F280 PolarHBondContact O-N 3.15Å
279	D	90.8	Very high	91.6	Very high	66 Å²	66	51.4 Å²	51.4	35%	0.353	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	109.8	-169	-133.1	-26.6	0	0	0	112.2	K208 D271 D273 S277 I281	K208-D279 HydrophobicContact CB-CB 4.06Å; K208-D279 WeakPolarHBondContact CB-OD2 3.48Å; K208-D279 HydrophobicContact CG-CB 4.08Å; K208-D279 IonicContact NZ-OD1 3.09Å; K208-D279 PolarHBondContact NZ-OD1 3Å; K208-D279 IonicContact NZ-OD2 3.78Å; D271-D279 HydrophobicContact CB-CB 3.75Å; D271-D279 WeakPolarHBondContact CB-O 3.3Å; D271-D279 PolarHBondContact N-O 3.28Å; D271-D279 PolarHBondContact O-N 3.06Å; D273-D279 WeakPolarHBondContact OD2-CB 3.18Å; D273-D279 PolarHBondContact OD2-N 3.13Å; S277-D279 PolarHBondContact O-N 3.14Å; D279-I281 PolarHBondContact O-N 2.79Å
280	F	95.4	Very high	91.5	Very high	49 Å²	49	55.1 Å²	55.1	22%	0.215	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	121.5	-177.5	-178.9	-106.3	0	0	0	112.6	K208 E268 Y270 H278 G282 E283 N305	K208-F280 VanDerWaalsContact CE-O 3.25Å; K208-F280 WeakPolarHBondContact CE-O 3.15Å; K208-F280 PolarHBondContact NZ-O 3.11Å; E268-F280 HydrophobicContact CB-CE2 4.08Å; E268-F280 HydrophobicContact CG-CE2 4.09Å; Y270-F280 HydrophobicContact CD1-CB 4.18Å; Y270-F280 HydrophobicContact CD1-CD2 4.27Å; Y270-F280 HydrophobicContact CE1-CB 3.91Å; Y270-F280 AromaticContact CE1-CD2 3.73Å; Y270-F280 HydrophobicContact CE1-CD2 3.73Å; Y270-F280 HydrophobicContact CE1-CG 4.32Å; Y270-F280 HydrophobicContact CE2-CD2 4.33Å; Y270-F280 AromaticContact CZ-CD2 3.75Å; H278-F280 PolarHBondContact O-N 3.15Å; F280-G282 WeakPolarHBondContact CE2-O 3.42Å; F280-G282 VanDerWaalsContact CZ-CA 3.45Å; F280-E283 HydrophobicContact CE2-CB 4.33Å; F280-E283 HydrophobicContact CZ-CB 3.91Å; F280-E283 HydrophobicContact CZ-CG 4.13Å; F280-N305 PolarHBondContact O-ND2 3.29Å
281	I	96.3	Very high	91.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-54.9	177.6	-62.1	178	0	0	0	109.4	L205 D206 K208 P216 V269 D271 D279 V303 N305 S318	L205-I281 HydrophobicContact CD2-CG2 4.48Å; D206-I281 HydrophobicContact CB-CG2 4.33Å; K208-I281 HydrophobicContact CG-CG1 4.18Å; P216-I281 HydrophobicContact CB-CD1 4.44Å; V269-I281 HydrophobicContact CB-CB 4.22Å; V269-I281 HydrophobicContact CG1-CB 4.26Å; V269-I281 HydrophobicContact CG1-CD1 4.19Å; V269-I281 WeakPolarHBondContact O-CA 3.04Å; V269-I281 WeakPolarHBondContact O-CB 3.48Å; V269-I281 PolarHBondContact O-N 2.82Å; D271-I281 HydrophobicContact CB-CD1 4.21Å; D271-I281 HydrophobicContact CB-CG1 4.31Å; D279-I281 PolarHBondContact O-N 2.79Å; I281-V303 HydrophobicContact CG2-CG1 4.4Å; I281-N305 VanDerWaalsContact O-CB 3.31Å; I281-N305 WeakPolarHBondContact O-CB 3.38Å; I281-N305 PolarHBondContact O-ND2 3.23Å; I281-S318 PolarHBondContact O-OG 2.77Å
282	G	97.4	Very high	91.3	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.8	-175.2	177.3	0	0	0	0	0	112.4	V269 F280 V304	V269-G282 PolarHBondContact N-O 2.89Å; V269-G282 PolarHBondContact O-N 2.89Å; F280-G282 WeakPolarHBondContact CE2-O 3.42Å; F280-G282 VanDerWaalsContact CZ-CA 3.45Å; G282-V304 CarbonylContact C-O 3.51Å; G282-V304 VanDerWaalsContact CA-O 3.28Å; G282-V304 WeakPolarHBondContact CA-O 3.43Å
283	E	98.1	Very high	91.2	Very high	58 Å²	58	59.3 Å²	59.3	27%	0.271	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	162.1	-177.3	63.8	-175.3	-172.9	0	0	111.8	V267 E268 F280 V304 P306	V267-E283 CarbonylContact O-C 3.49Å; V267-E283 VanDerWaalsContact O-CA 3.24Å; V267-E283 WeakPolarHBondContact O-CA 3.29Å; E268-E283 HydrophobicContact CG-CB 4.16Å; F280-E283 HydrophobicContact CE2-CB 4.33Å; F280-E283 HydrophobicContact CZ-CB 3.91Å; F280-E283 HydrophobicContact CZ-CG 4.13Å; E283-V304 PolarHBondContact N-O 2.75Å; E283-V304 PolarHBondContact O-N 3.13Å; E283-P306 WeakPolarHBondContact OE1-CG 3.47Å
284	F	97.8	Very high	91.3	Very high	15 Å²	15	58.5 Å²	58.5	7%	0.066	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	168	165.3	66	-87.6	0	0	0	110.2	V267 Y301 V321	V267-F284 HydrophobicContact CB-CD1 4.08Å; V267-F284 HydrophobicContact CB-CD2 4.28Å; V267-F284 HydrophobicContact CB-CE1 3.57Å; V267-F284 HydrophobicContact CB-CE2 3.81Å; V267-F284 HydrophobicContact CB-CG 4.42Å; V267-F284 HydrophobicContact CB-CZ 3.43Å; V267-F284 VanDerWaalsContact CB-CZ 3.43Å; V267-F284 HydrophobicContact CG1-CD1 4.49Å; V267-F284 HydrophobicContact CG1-CE1 3.62Å; V267-F284 HydrophobicContact CG1-CE2 4.46Å; V267-F284 HydrophobicContact CG1-CZ 3.62Å; V267-F284 HydrophobicContact CG2-CD2 4.42Å; V267-F284 HydrophobicContact CG2-CE1 4.36Å; V267-F284 HydrophobicContact CG2-CE2 3.73Å; V267-F284 HydrophobicContact CG2-CZ 3.7Å; V267-F284 PolarHBondContact N-O 2.7Å; V267-F284 PolarHBondContact O-N 3.48Å; F284-Y301 VanDerWaalsContact CD2-CB 3.43Å; F284-Y301 AromaticContact CD2-CD1 3.49Å; F284-Y301 HydrophobicContact CD2-CD1 3.49Å; F284-Y301 VanDerWaalsContact CD2-CD1 3.49Å; F284-Y301 AromaticContact CD2-CD2 3.89Å; F284-Y301 HydrophobicContact CD2-CD2 3.89Å; F284-Y301 HydrophobicContact CD2-CE1 4.18Å; F284-Y301 AromaticContact CD2-CG 3.31Å; F284-Y301 HydrophobicContact CD2-CG 3.31Å; F284-Y301 AromaticContact CE2-CD1 3.84Å; F284-Y301 HydrophobicContact CE2-CD1 3.84Å; F284-Y301 AromaticContact CE2-CD2 3.44Å; F284-Y301 HydrophobicContact CE2-CD2 3.44Å; F284-Y301 VanDerWaalsContact CE2-CD2 3.44Å; F284-Y301 HydrophobicContact CE2-CE1 4.24Å; F284-Y301 AromaticContact CE2-CE2 3.89Å; F284-Y301 HydrophobicContact CE2-CE2 3.89Å; F284-Y301 AromaticContact CE2-CG 3.4Å; F284-Y301 HydrophobicContact CE2-CG 3.4Å; F284-Y301 HydrophobicContact CG-CD1 4.36Å; F284-Y301 AromaticContact CG-CG 3.98Å; F284-Y301 HydrophobicContact CG-CG 3.98Å; F284-Y301 AromaticContact CZ-CD2 3.92Å; F284-Y301 HydrophobicContact CZ-CD2 3.92Å; F284-Y301 HydrophobicContact CZ-CG 4.13Å; F284-V321 HydrophobicContact CD1-CB 4.47Å; F284-V321 HydrophobicContact CE1-CB 3.73Å; F284-V321 HydrophobicContact CE1-CG1 3.81Å; F284-V321 HydrophobicContact CE1-CG2 3.93Å; F284-V321 HydrophobicContact CZ-CB 4.11Å; F284-V321 HydrophobicContact CZ-CG1 3.76Å
285	T	97.1	Very high	91.7	Very high	88 Å²	88	54.3 Å²	54.3	54%	0.54	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	149.6	176.6	56.9	0	0	0	0	110.9	T264 I265 K266	T264-T285 HydrophobicContact CG2-CG2 3.93Å; I265-T285 CarbonylContact O-C 3.49Å; I265-T285 VanDerWaalsContact O-CA 3.28Å; I265-T285 WeakPolarHBondContact O-CA 3.3Å; K266-T285 HydrophobicContact CB-CG2 4.38Å; K266-T285 HydrophobicContact CG-CG2 4.48Å
286	T	96.5	Very high	91.8	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.031	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	-179	175	-171.7	0	0	0	0	109.4	I265 E290 L291 Y301	I265-T286 HydrophobicContact CB-CG2 3.96Å; I265-T286 HydrophobicContact CD1-CG2 4.42Å; I265-T286 HydrophobicContact CG2-CG2 4.26Å; I265-T286 PolarHBondContact N-O 2.91Å; I265-T286 PolarHBondContact O-N 3.4Å; T286-E290 VanDerWaalsContact CA-OE2 3.31Å; T286-E290 WeakPolarHBondContact CA-OE2 3.43Å; T286-E290 PolarHBondContact OG1-OE2 2.77Å; T286-L291 HydrophobicContact CG2-CD1 4.03Å; T286-L291 HydrophobicContact CG2-CD2 4.12Å; T286-L291 HydrophobicContact CG2-CG 4Å; T286-Y301 PolarHBondContact OG1-OH 2.64Å
287	S	96.2	Very high	92	Very high	10 Å²	10	55.3 Å²	55.3	7%	0.07	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	168.2	164.3	71.3	0	0	0	0	112.2	R289 E290 L291	S287-R289 PolarHBondContact O-N 3.01Å; S287-R289 PolarHBondContact OG-N 3.18Å; S287-E290 PolarHBondContact N-OE2 2.58Å; S287-E290 PolarHBondContact O-N 2.98Å; S287-E290 PolarHBondContact OG-N 3.38Å; S287-L291 WeakPolarHBondContact O-CG 3.28Å; S287-L291 PolarHBondContact O-N 3.37Å
288	Y	94.4	Very high	91.8	Very high	23 Å²	23	57.8 Å²	57.8	9%	0.09	28%	0.282	C	S	.	.	H	α-helix	trans	-57.5	-41.4	172.7	170.9	-93.9	0	0	0	111	V253 L256 Y261 E290 L291 A292 F326 V328	V253-Y288 HydrophobicContact CG1-CD2 4.23Å; V253-Y288 HydrophobicContact CG1-CE2 3.99Å; V253-Y288 HydrophobicContact CG2-CD2 4.35Å; V253-Y288 HydrophobicContact CG2-CE2 3.69Å; L256-Y288 HydrophobicContact CD2-CD2 4.14Å; Y261-Y288 AromaticContact CD1-CD1 3.71Å; Y261-Y288 HydrophobicContact CD1-CD1 3.71Å; Y261-Y288 HydrophobicContact CD1-CE1 4.02Å; Y261-Y288 HydrophobicContact CD1-CG 4.39Å; Y261-Y288 HydrophobicContact CD2-CD1 4.08Å; Y261-Y288 AromaticContact CD2-CE1 3.98Å; Y261-Y288 HydrophobicContact CD2-CE1 3.98Å; Y261-Y288 HydrophobicContact CE1-CD1 4.3Å; Y261-Y288 HydrophobicContact CE1-CE1 4.19Å; Y261-Y288 HydrophobicContact CE2-CE1 4.15Å; Y261-Y288 AromaticContact CG-CD1 3.58Å; Y261-Y288 HydrophobicContact CG-CD1 3.58Å; Y261-Y288 AromaticContact CG-CE1 3.92Å; Y261-Y288 HydrophobicContact CG-CE1 3.92Å; Y261-Y288 PolarHBondContact O-N 3.27Å; Y288-E290 VanDerWaalsContact C-N 3.27Å; Y288-E290 PolarHBondContact O-N 2.97Å; Y288-L291 PolarHBondContact O-N 2.89Å; Y288-A292 HydrophobicContact CE1-CB 4.39Å; Y288-A292 WeakPolarHBondContact O-CB 3.44Å; Y288-A292 PolarHBondContact O-N 2.81Å; Y288-F326 AromaticContact CD2-CZ 3.96Å; Y288-F326 HydrophobicContact CD2-CZ 3.96Å; Y288-F326 HydrophobicContact CE2-CE1 4.3Å; Y288-F326 AromaticContact CE2-CZ 3.76Å; Y288-F326 HydrophobicContact CE2-CZ 3.76Å; Y288-V328 HydrophobicContact CE2-CG2 4.04Å; Y288-V328 WeakPolarHBondContact OH-CG2 3.35Å
289	R	94.2	Very high	92	Very high	118 Å²	118	56.2 Å²	56.2	45%	0.445	27%	0.274	S	S	.	.	H	α-helix	trans	-59.5	-36.3	177.8	-173.4	-179.9	-58.4	-78.2	-0.4	112.8	Y261 D262 S287	Y261-R289 WeakPolarHBondContact O-CB 3.01Å; Y261-R289 PolarHBondContact O-N 3.14Å; D262-R289 VanDerWaalsContact CG-NE 3.31Å; D262-R289 VanDerWaalsContact OD1-CD 3.25Å; D262-R289 WeakPolarHBondContact OD1-CD 3.03Å; D262-R289 IonicContact OD1-CZ 2.68Å; D262-R289 IonicContact OD1-NE 3.82Å; D262-R289 PolarHBondContact OD1-NE 3.15Å; D262-R289 IonicContact OD1-NH2 3.98Å; D262-R289 IonicContact OD2-CZ 3.05Å; D262-R289 IonicContact OD2-NE 3.37Å; D262-R289 PolarHBondContact OD2-NE 3.49Å; D262-R289 IonicContact OD2-NH2 3.99Å; D262-R289 PolarHBondContact OD2-NH2 3.22Å; S287-R289 PolarHBondContact O-N 3.01Å; S287-R289 PolarHBondContact OG-N 3.18Å
290	E	94.4	Very high	92.3	Very high	77 Å²	77	57.1 Å²	57.1	36%	0.36	28%	0.278	S	S	.	.	H	α-helix	trans	-73.3	-48	176.5	-70.3	-179.7	148.2	0	0	111.6	T286 S287 Y288 A292 R293 N299	T286-E290 VanDerWaalsContact CA-OE2 3.31Å; T286-E290 WeakPolarHBondContact CA-OE2 3.43Å; T286-E290 PolarHBondContact OG1-OE2 2.77Å; S287-E290 PolarHBondContact N-OE2 2.58Å; S287-E290 PolarHBondContact O-N 2.98Å; S287-E290 PolarHBondContact OG-N 3.38Å; Y288-E290 VanDerWaalsContact C-N 3.27Å; Y288-E290 PolarHBondContact O-N 2.97Å; E290-A292 VanDerWaalsContact C-N 3.25Å; E290-A292 PolarHBondContact O-N 2.85Å; E290-R293 VanDerWaalsContact O-CB 3.3Å; E290-R293 WeakPolarHBondContact O-CB 3.25Å; E290-R293 PolarHBondContact O-N 2.97Å; E290-N299 PolarHBondContact O-ND2 3.49Å; E290-N299 PolarHBondContact O-OD1 3.34Å
291	L	95	Very high	92.3	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-57	-41	176.1	-67.4	172.6	0	0	0	111.6	F200 L256 I265 T286 S287 Y288 R293 G294 Y301 L323 F326	F200-L291 HydrophobicContact CZ-CD2 3.9Å; L256-L291 HydrophobicContact CD2-CD1 4.3Å; I265-L291 HydrophobicContact CD1-CD1 3.89Å; T286-L291 HydrophobicContact CG2-CD1 4.03Å; T286-L291 HydrophobicContact CG2-CD2 4.12Å; T286-L291 HydrophobicContact CG2-CG 4Å; S287-L291 WeakPolarHBondContact O-CG 3.28Å; S287-L291 PolarHBondContact O-N 3.37Å; Y288-L291 PolarHBondContact O-N 2.89Å; L291-R293 PolarHBondContact O-N 3.28Å; L291-G294 PolarHBondContact O-N 3.48Å; L291-Y301 WeakPolarHBondContact CD2-OH 3.41Å; L291-L323 HydrophobicContact CB-CD2 4.48Å; L291-L323 HydrophobicContact CD2-CD1 4.3Å; L291-L323 HydrophobicContact CD2-CD2 3.88Å; L291-F326 HydrophobicContact CB-CD2 3.77Å; L291-F326 HydrophobicContact CB-CE2 3.49Å; L291-F326 VanDerWaalsContact CB-CE2 3.49Å; L291-F326 HydrophobicContact CB-CG 4.48Å; L291-F326 HydrophobicContact CB-CZ 3.99Å; L291-F326 HydrophobicContact CD1-CE2 4.27Å; L291-F326 HydrophobicContact CG-CE2 4.46Å; L291-F326 WeakPolarHBondContact O-CG 3.46Å
292	A	92.7	Very high	92.4	Very high	50 Å²	50	60 Å²	60	41%	0.413	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-10.7	178.2	0	0	0	0	0	114.8	Y288 E290 G294 F326	Y288-A292 HydrophobicContact CE1-CB 4.39Å; Y288-A292 WeakPolarHBondContact O-CB 3.44Å; Y288-A292 PolarHBondContact O-N 2.81Å; E290-A292 VanDerWaalsContact C-N 3.25Å; E290-A292 PolarHBondContact O-N 2.85Å; A292-G294 PolarHBondContact O-N 3.29Å; A292-F326 VanDerWaalsContact CA-CE1 3.4Å; A292-F326 HydrophobicContact CB-CD1 4.46Å; A292-F326 HydrophobicContact CB-CE1 3.82Å; A292-F326 HydrophobicContact CB-CZ 4.44Å
293	R	91.1	Very high	92.4	Very high	147 Å²	147	60 Å²	60	56%	0.555	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-6.3	169.4	-61.4	177.6	179.5	169.6	1.5	112.9	E290 L291	E290-R293 VanDerWaalsContact O-CB 3.3Å; E290-R293 WeakPolarHBondContact O-CB 3.25Å; E290-R293 PolarHBondContact O-N 2.97Å; L291-R293 PolarHBondContact O-N 3.28Å
294	G	87.5	Confident	92.3	Very high	15 Å²	15	59 Å²	59	16%	0.155	29%	0.29	C	S	.	.			trans	71.9	-160.5	175.8	0	0	0	0	0	113.4	L291 A292 S296 N299	L291-G294 PolarHBondContact O-N 3.48Å; A292-G294 PolarHBondContact O-N 3.29Å; G294-S296 PolarHBondContact O-N 3.41Å; G294-N299 PolarHBondContact O-ND2 2.97Å
295	Q	84.3	Confident	92.3	Very high	142 Å²	142	58.7 Å²	58.7	66%	0.664	29%	0.289	S	S	*	.	S	Bend	trans	-67.4	109.8	-179.7	-166.8	179.3	18.1	0	0	110.1	L324	Q295-L324 PolarHBondContact OE1-O 2.96Å
296	S	81.4	Confident	92.1	Very high	38 Å²	38	57 Å²	57	27%	0.266	28%	0.279	S	S	.	.	S	Bend	trans	-156.1	166.8	178.8	74.7	0	0	0	0	111	G294 F298 N299	G294-S296 PolarHBondContact O-N 3.41Å; S296-F298 PolarHBondContact O-N 2.92Å; S296-F298 WeakPolarHBondContact OG-CB 3.46Å; S296-F298 PolarHBondContact OG-N 3.46Å; S296-N299 PolarHBondContact O-N 3Å
297	Q	80.8	Confident	91.9	Very high	151 Å²	151	64.3 Å²	64.3	71%	0.706	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-56.9	-18.6	171.9	66.5	-175.3	0.5	0	0	113.5
298	F	79.2	Confident	91.7	Very high	129 Å²	129	65.6 Å²	65.6	57%	0.566	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-81	-15.6	178.4	-58.4	-74.2	0	0	0	113.3	S296	S296-F298 PolarHBondContact O-N 2.92Å; S296-F298 WeakPolarHBondContact OG-CB 3.46Å; S296-F298 PolarHBondContact OG-N 3.46Å
299	N	92.5	Very high	91.5	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-109.1	39	177.5	-67.7	-30.3	0	0	0	111.4	E290 G294 S296 Y301 T322 L323	E290-N299 PolarHBondContact O-ND2 3.49Å; E290-N299 PolarHBondContact O-OD1 3.34Å; G294-N299 PolarHBondContact O-ND2 2.97Å; S296-N299 PolarHBondContact O-N 3Å; N299-Y301 HydrophobicContact CB-CE2 4.2Å; N299-Y301 PolarHBondContact OD1-OH 3.35Å; N299-T322 WeakPolarHBondContact O-CA 3.39Å; N299-L323 HydrophobicContact CB-CB 3.71Å; N299-L323 HydrophobicContact CB-CD2 3.87Å; N299-L323 HydrophobicContact CB-CG 4.47Å; N299-L323 WeakPolarHBondContact ND2-CD2 3.45Å; N299-L323 PolarHBondContact O-N 2.84Å
300	I	95.5	Very high	91.3	Very high	84 Å²	84	74 Å²	74	43%	0.431	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	114.2	167.4	-57.7	175	0	0	0	106.9	T322	I300-T322 HydrophobicContact CG1-CG2 3.99Å
301	Y	96.9	Very high	91.1	Very high	18 Å²	18	78.8 Å²	78.8	7%	0.071	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.2	-172.3	-51.3	-82.4	0	0	0	110.9	F200 F284 T286 L291 N299 V303 T320 V321	F200-Y301 HydrophobicContact CE1-CE2 4.18Å; F284-Y301 VanDerWaalsContact CD2-CB 3.43Å; F284-Y301 AromaticContact CD2-CD1 3.49Å; F284-Y301 HydrophobicContact CD2-CD1 3.49Å; F284-Y301 VanDerWaalsContact CD2-CD1 3.49Å; F284-Y301 AromaticContact CD2-CD2 3.89Å; F284-Y301 HydrophobicContact CD2-CD2 3.89Å; F284-Y301 HydrophobicContact CD2-CE1 4.18Å; F284-Y301 AromaticContact CD2-CG 3.31Å; F284-Y301 HydrophobicContact CD2-CG 3.31Å; F284-Y301 AromaticContact CE2-CD1 3.84Å; F284-Y301 HydrophobicContact CE2-CD1 3.84Å; F284-Y301 AromaticContact CE2-CD2 3.44Å; F284-Y301 HydrophobicContact CE2-CD2 3.44Å; F284-Y301 VanDerWaalsContact CE2-CD2 3.44Å; F284-Y301 HydrophobicContact CE2-CE1 4.24Å; F284-Y301 AromaticContact CE2-CE2 3.89Å; F284-Y301 HydrophobicContact CE2-CE2 3.89Å; F284-Y301 AromaticContact CE2-CG 3.4Å; F284-Y301 HydrophobicContact CE2-CG 3.4Å; F284-Y301 HydrophobicContact CG-CD1 4.36Å; F284-Y301 AromaticContact CG-CG 3.98Å; F284-Y301 HydrophobicContact CG-CG 3.98Å; F284-Y301 AromaticContact CZ-CD2 3.92Å; F284-Y301 HydrophobicContact CZ-CD2 3.92Å; F284-Y301 HydrophobicContact CZ-CG 4.13Å; T286-Y301 PolarHBondContact OG1-OH 2.64Å; L291-Y301 WeakPolarHBondContact CD2-OH 3.41Å; N299-Y301 HydrophobicContact CB-CE2 4.2Å; N299-Y301 PolarHBondContact OD1-OH 3.35Å; Y301-V303 PolarHBondContact O-N 3.4Å; Y301-T320 CarbonylContact O-C 3.57Å; Y301-T320 WeakPolarHBondContact O-CA 3.26Å; Y301-V321 PolarHBondContact N-O 3.02Å; Y301-V321 PolarHBondContact O-N 3.22Å
302	E	96.8	Very high	90.8	Very high	92 Å²	92	84.6 Å²	84.6	43%	0.43	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	121.8	171.3	-65.5	-80.3	125.6	0	0	109.1	V304 N317 T320	E302-V304 PolarHBondContact O-N 2.93Å; E302-N317 HydrophobicContact CB-CB 4.41Å; E302-N317 WeakPolarHBondContact OE2-CB 3.31Å; E302-N317 PolarHBondContact OE2-ND2 3.37Å; E302-T320 VanDerWaalsContact OE1-CG2 3.3Å; E302-T320 WeakPolarHBondContact OE1-CG2 3.14Å
303	V	97.3	Very high	90.4	Very high	0 Å²	0	92.9 Å²	92.9	0%	0	43%	0.431	C	S	.	.			trans	-80.6	114	179.6	-178.8	0	0	0	0	108.9	L205 V269 I281 Y301 Y315 N317 S318 G319 V321	L205-V303 HydrophobicContact CD2-CG2 4.26Å; V269-V303 HydrophobicContact CB-CG1 4.31Å; V269-V303 HydrophobicContact CG2-CG1 3.88Å; V269-V303 HydrophobicContact CG2-CG2 4.11Å; I281-V303 HydrophobicContact CG2-CG1 4.4Å; Y301-V303 PolarHBondContact O-N 3.4Å; V303-Y315 PolarHBondContact O-OH 2.74Å; V303-Y315 VanDerWaalsContact O-OH 3.13Å; V303-N317 CarbonylContact O-C 3.58Å; V303-N317 WeakPolarHBondContact O-CA 3.45Å; V303-S318 PolarHBondContact O-N 2.82Å; V303-G319 WeakPolarHBondContact CB-O 3.24Å; V303-G319 PolarHBondContact N-O 3.09Å; V303-V321 HydrophobicContact CG2-CB 4.36Å; V303-V321 HydrophobicContact CG2-CG2 3.63Å
304	V	97.4	Very high	90.3	Very high	37 Å²	37	95.6 Å²	95.6	22%	0.224	45%	0.447	C	S	.	.	B	Isolated β-bridge	trans	-107.5	125.6	-174	178.8	0	0	0	0	110.6	G282 E283 E302 P306 K309 Y315	G282-V304 CarbonylContact C-O 3.51Å; G282-V304 VanDerWaalsContact CA-O 3.28Å; G282-V304 WeakPolarHBondContact CA-O 3.43Å; E283-V304 PolarHBondContact N-O 2.75Å; E283-V304 PolarHBondContact O-N 3.13Å; E302-V304 PolarHBondContact O-N 2.93Å; V304-P306 WeakPolarHBondContact O-CD 3.2Å; V304-K309 HydrophobicContact CG1-CD 3.92Å; V304-Y315 HydrophobicContact CG1-CE1 4.4Å
305	N	96.3	Very high	90.5	Very high	9 Å²	9	96.8 Å²	96.8	5%	0.048	45%	0.447	C	S	.	.			trans	-97.4	110.2	168.6	-171.6	-61.7	0	0	0	109.3	F280 I281 K307 K308 K309 Y315	F280-N305 PolarHBondContact O-ND2 3.29Å; I281-N305 VanDerWaalsContact O-CB 3.31Å; I281-N305 WeakPolarHBondContact O-CB 3.38Å; I281-N305 PolarHBondContact O-ND2 3.23Å; N305-K307 VanDerWaalsContact C-N 3.29Å; N305-K307 PolarHBondContact O-N 3.44Å; N305-K307 WeakPolarHBondContact OD1-CB 3.29Å; N305-K307 PolarHBondContact OD1-N 3.37Å; N305-K308 HydrophobicContact CB-CB 3.99Å; N305-K308 HydrophobicContact CB-CD 3.91Å; N305-K308 HydrophobicContact CB-CG 4.02Å; N305-K308 PolarHBondContact O-N 3.35Å; N305-K308 VanDerWaalsContact O-N 3.13Å; N305-K308 PolarHBondContact OD1-N 3.34Å; N305-K309 PolarHBondContact O-N 2.79Å; N305-Y315 PolarHBondContact N-OH 2.76Å
306	P	93.4	Very high	90.8	Very high	51 Å²	51	95.4 Å²	95.4	33%	0.331	45%	0.448	S	S	.	.	H	α-helix	trans	-58	-40.8	-176.1	-26.4	35.9	0	0	0	112.5	E283 V304 K308 K309 M310	E283-P306 WeakPolarHBondContact OE1-CG 3.47Å; V304-P306 WeakPolarHBondContact O-CD 3.2Å; P306-K308 PolarHBondContact O-N 2.95Å; P306-K309 PolarHBondContact O-N 3.07Å; P306-M310 WeakPolarHBondContact O-CG 3.48Å; P306-M310 PolarHBondContact O-N 2.87Å
307	K	92.5	Very high	91.4	Very high	160 Å²	160	95.8 Å²	95.8	70%	0.696	45%	0.447	S	S	*	.	H	α-helix	trans	-63.5	-40.3	178.8	-64	177.9	-179.4	171.6	0	111.8	N305 K311	N305-K307 VanDerWaalsContact C-N 3.29Å; N305-K307 PolarHBondContact O-N 3.44Å; N305-K307 WeakPolarHBondContact OD1-CB 3.29Å; N305-K307 PolarHBondContact OD1-N 3.37Å; K307-K311 WeakPolarHBondContact O-CB 3.3Å; K307-K311 VanDerWaalsContact O-CG 3.29Å; K307-K311 WeakPolarHBondContact O-CG 3.39Å; K307-K311 PolarHBondContact O-N 3.36Å
308	K	91.4	Very high	92.2	Very high	36 Å²	36	88.6 Å²	88.6	16%	0.157	41%	0.414	C	S	.	.	H	α-helix	trans	-70.9	-41.3	175.9	-67.4	177.5	-177.1	165.7	0	111.7	D206 N305 P306 M310 K311 K312 Y315	D206-K308 IonicContact OD2-NZ 2.74Å; D206-K308 PolarHBondContact OD2-NZ 3.42Å; N305-K308 HydrophobicContact CB-CB 3.99Å; N305-K308 HydrophobicContact CB-CD 3.91Å; N305-K308 HydrophobicContact CB-CG 4.02Å; N305-K308 PolarHBondContact O-N 3.35Å; N305-K308 VanDerWaalsContact O-N 3.13Å; N305-K308 PolarHBondContact OD1-N 3.34Å; P306-K308 PolarHBondContact O-N 2.95Å; K308-M310 VanDerWaalsContact C-N 3.29Å; K308-M310 PolarHBondContact O-N 2.74Å; K308-K311 PolarHBondContact O-N 3.34Å; K308-K311 VanDerWaalsContact O-N 3.13Å; K308-K312 WeakPolarHBondContact O-CB 3.16Å; K308-K312 PolarHBondContact O-N 3Å; K308-Y315 HydrophobicContact CB-CD2 3.79Å; K308-Y315 HydrophobicContact CB-CE2 3.79Å; K308-Y315 HydrophobicContact CB-CG 4.24Å; K308-Y315 HydrophobicContact CD-CD2 4.4Å; K308-Y315 HydrophobicContact CD-CE2 3.94Å
309	K	90.7	Very high	93	Very high	144 Å²	144	82.6 Å²	82.6	63%	0.626	39%	0.388	S	S	*	.	H	α-helix	trans	-59	-39.3	178.4	-169.7	175.2	-177	177.4	0	112	V304 N305 P306 Y315	V304-K309 HydrophobicContact CG1-CD 3.92Å; N305-K309 PolarHBondContact O-N 2.79Å; P306-K309 PolarHBondContact O-N 3.07Å; K309-Y315 HydrophobicContact CB-CD1 3.9Å; K309-Y315 HydrophobicContact CB-CE1 4.13Å; K309-Y315 HydrophobicContact CG-CD1 4.29Å
310	M	89.6	Confident	93.2	Very high	173 Å²	173	83.6 Å²	83.6	85%	0.852	39%	0.394	S	S	*	.	H	α-helix	trans	-71.9	-35	175.6	-65.6	178.6	94.9	0	0	113.2	P306 K308	P306-M310 WeakPolarHBondContact O-CG 3.48Å; P306-M310 PolarHBondContact O-N 2.87Å; K308-M310 VanDerWaalsContact C-N 3.29Å; K308-M310 PolarHBondContact O-N 2.74Å
311	K	91.3	Very high	93.4	Very high	178 Å²	178	79.6 Å²	79.6	77%	0.774	37%	0.374	S	S	*	.	H	α-helix	trans	-90.1	-29.7	-172.6	-70.8	-180	-179	-176.6	0	114.6	K307 K308	K307-K311 WeakPolarHBondContact O-CB 3.3Å; K307-K311 VanDerWaalsContact O-CG 3.29Å; K307-K311 WeakPolarHBondContact O-CG 3.39Å; K307-K311 PolarHBondContact O-N 3.36Å; K308-K311 PolarHBondContact O-N 3.34Å; K308-K311 VanDerWaalsContact O-N 3.13Å
312	K	89.3	Confident	93.4	Very high	122 Å²	122	80.1 Å²	80.1	53%	0.53	38%	0.379	S	S	.	.			trans	-115.5	108.8	-169.8	-68.3	-175.7	-179.7	-176.1	0	111.3	K308 K314 Y315	K308-K312 WeakPolarHBondContact O-CB 3.16Å; K308-K312 PolarHBondContact O-N 3Å; K312-K314 PolarHBondContact O-N 3.24Å; K312-K314 VanDerWaalsContact O-N 3.11Å; K312-Y315 VanDerWaalsContact O-CB 3.32Å; K312-Y315 WeakPolarHBondContact O-CB 3.3Å; K312-Y315 PolarHBondContact O-N 3.09Å; K312-Y315 VanDerWaalsContact O-N 3.08Å
313	K	83.5	Confident	93.4	Very high	224 Å²	224	75.8 Å²	75.8	97%	0.974	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-24.8	-179.8	-75.7	-173.3	176	-179	0	115.7
314	K	89.4	Confident	93.3	Very high	205 Å²	205	78 Å²	78	89%	0.891	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	16.7	179.2	-66.3	-173.2	177.6	-177.3	0	113.3	K312	K312-K314 PolarHBondContact O-N 3.24Å; K312-K314 VanDerWaalsContact O-N 3.11Å
315	Y	91.4	Very high	93.2	Very high	40 Å²	40	78.3 Å²	78.3	16%	0.157	37%	0.374	C	S	.	.			trans	-70.7	130.5	177.2	176.1	-97.5	0	0	0	110.6	V303 V304 N305 K308 K309 K312 N317 S318	V303-Y315 PolarHBondContact O-OH 2.74Å; V303-Y315 VanDerWaalsContact O-OH 3.13Å; V304-Y315 HydrophobicContact CG1-CE1 4.4Å; N305-Y315 PolarHBondContact N-OH 2.76Å; K308-Y315 HydrophobicContact CB-CD2 3.79Å; K308-Y315 HydrophobicContact CB-CE2 3.79Å; K308-Y315 HydrophobicContact CB-CG 4.24Å; K308-Y315 HydrophobicContact CD-CD2 4.4Å; K308-Y315 HydrophobicContact CD-CE2 3.94Å; K309-Y315 HydrophobicContact CB-CD1 3.9Å; K309-Y315 HydrophobicContact CB-CE1 4.13Å; K309-Y315 HydrophobicContact CG-CD1 4.29Å; K312-Y315 VanDerWaalsContact O-CB 3.32Å; K312-Y315 WeakPolarHBondContact O-CB 3.3Å; K312-Y315 PolarHBondContact O-N 3.09Å; K312-Y315 VanDerWaalsContact O-N 3.08Å; Y315-N317 VanDerWaalsContact CE2-C 3.47Å; Y315-N317 VanDerWaalsContact CE2-O 3.26Å; Y315-N317 WeakPolarHBondContact CE2-O 3.09Å; Y315-N317 VanDerWaalsContact CZ-C 3.4Å; Y315-N317 WeakPolarHBondContact OH-CA 3.41Å; Y315-S318 WeakPolarHBondContact CE2-OG 3.27Å; Y315-S318 PolarHBondContact OH-N 2.79Å; Y315-S318 PolarHBondContact OH-OG 2.9Å
316	V	89.6	Confident	93.1	Very high	113 Å²	113	79.4 Å²	79.4	69%	0.685	38%	0.378	S	S	*	.			trans	-103.8	-68	175.3	-178.1	0	0	0	0	108.6
317	N	95.2	Very high	93	Very high	46 Å²	46	79 Å²	79	25%	0.246	38%	0.379	C	S	.	.			trans	-152.3	178.2	178.6	64.1	45.6	0	0	0	110.2	E302 V303 Y315 G319	E302-N317 HydrophobicContact CB-CB 4.41Å; E302-N317 WeakPolarHBondContact OE2-CB 3.31Å; E302-N317 PolarHBondContact OE2-ND2 3.37Å; V303-N317 CarbonylContact O-C 3.58Å; V303-N317 WeakPolarHBondContact O-CA 3.45Å; Y315-N317 VanDerWaalsContact CE2-C 3.47Å; Y315-N317 VanDerWaalsContact CE2-O 3.26Å; Y315-N317 WeakPolarHBondContact CE2-O 3.09Å; Y315-N317 VanDerWaalsContact CZ-C 3.4Å; Y315-N317 WeakPolarHBondContact OH-CA 3.41Å; N317-G319 WeakPolarHBondContact OD1-CA 3.18Å; N317-G319 PolarHBondContact OD1-N 2.77Å
318	S	96.4	Very high	92.9	Very high	0 Å²	0	73.9 Å²	73.9	0%	0	36%	0.361	C	S	.	.	S	Bend	trans	-110.2	36.4	171.9	-58.8	0	0	0	0	110.3	L205 D206 I281 V303 Y315	L205-S318 WeakPolarHBondContact CA-O 3.16Å; D206-S318 PolarHBondContact N-O 3.07Å; D206-S318 PolarHBondContact OD2-OG 2.94Å; I281-S318 PolarHBondContact O-OG 2.77Å; V303-S318 PolarHBondContact O-N 2.82Å; Y315-S318 WeakPolarHBondContact CE2-OG 3.27Å; Y315-S318 PolarHBondContact OH-N 2.79Å; Y315-S318 PolarHBondContact OH-OG 2.9Å
319	G	96.8	Very high	92.6	Very high	2 Å²	2	77 Å²	77	2%	0.021	38%	0.377	C	S	.	.			trans	102.8	-176.1	-170.8	0	0	0	0	0	113.6	N203 K204 V303 N317	N203-G319 WeakPolarHBondContact O-CA 3.39Å; K204-G319 WeakPolarHBondContact O-CA 3.06Å; V303-G319 WeakPolarHBondContact CB-O 3.24Å; V303-G319 PolarHBondContact N-O 3.09Å; N317-G319 WeakPolarHBondContact OD1-CA 3.18Å; N317-G319 PolarHBondContact OD1-N 2.77Å
320	T	97.4	Very high	92.2	Very high	22 Å²	22	73.5 Å²	73.5	14%	0.135	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.2	177.9	58.6	0	0	0	0	111	A202 N203 Y301 E302	A202-T320 CarbonylContact C-O 3.54Å; A202-T320 WeakPolarHBondContact CA-O 3.39Å; A202-T320 WeakPolarHBondContact CB-O 3.48Å; N203-T320 PolarHBondContact N-O 2.98Å; N203-T320 PolarHBondContact O-N 2.69Å; Y301-T320 CarbonylContact O-C 3.57Å; Y301-T320 WeakPolarHBondContact O-CA 3.26Å; E302-T320 VanDerWaalsContact OE1-CG2 3.3Å; E302-T320 WeakPolarHBondContact OE1-CG2 3.14Å
321	V	97.9	Very high	91.8	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138.6	170.8	170.5	0	0	0	0	108.8	F200 C201 A202 L218 V269 F284 Y301 V303	F200-V321 HydrophobicContact CB-CG1 4.4Å; F200-V321 HydrophobicContact CD1-CG1 3.56Å; F200-V321 HydrophobicContact CE1-CG1 4.23Å; F200-V321 HydrophobicContact CG-CG1 4.35Å; C201-V321 CarbonylContact O-C 3.58Å; C201-V321 WeakPolarHBondContact O-CA 3.14Å; A202-V321 HydrophobicContact CB-CG2 3.88Å; L218-V321 HydrophobicContact CD2-CG2 4.4Å; V269-V321 HydrophobicContact CG2-CG2 4.19Å; F284-V321 HydrophobicContact CD1-CB 4.47Å; F284-V321 HydrophobicContact CE1-CB 3.73Å; F284-V321 HydrophobicContact CE1-CG1 3.81Å; F284-V321 HydrophobicContact CE1-CG2 3.93Å; F284-V321 HydrophobicContact CZ-CB 4.11Å; F284-V321 HydrophobicContact CZ-CG1 3.76Å; Y301-V321 PolarHBondContact N-O 3.02Å; Y301-V321 PolarHBondContact O-N 3.22Å; V303-V321 HydrophobicContact CG2-CB 4.36Å; V303-V321 HydrophobicContact CG2-CG2 3.63Å
322	T	97.4	Very high	91.6	Very high	28 Å²	28	62.6 Å²	62.6	17%	0.172	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	132.4	-177.5	-59.1	0	0	0	0	110.4	F200 C201 N299 I300 L324	F200-T322 WeakPolarHBondContact CA-O 3.31Å; C201-T322 PolarHBondContact N-O 3.3Å; C201-T322 PolarHBondContact O-N 2.85Å; N299-T322 WeakPolarHBondContact O-CA 3.39Å; I300-T322 HydrophobicContact CG1-CG2 3.99Å; T322-L324 PolarHBondContact O-N 2.92Å
323	L	97.3	Very high	91.5	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	114.2	169.8	-176	68.4	0	0	0	109.2	M198 F200 L291 N299 S325 F326	M198-L323 HydrophobicContact CB-CD1 3.96Å; F200-L323 HydrophobicContact CD1-CB 4.26Å; F200-L323 HydrophobicContact CD1-CD1 4.29Å; F200-L323 HydrophobicContact CD2-CD1 4.17Å; F200-L323 HydrophobicContact CE1-CB 3.88Å; F200-L323 HydrophobicContact CE1-CD1 3.78Å; F200-L323 HydrophobicContact CE1-CG 4.44Å; F200-L323 HydrophobicContact CE2-CD1 3.64Å; F200-L323 HydrophobicContact CG-CD1 4.49Å; F200-L323 HydrophobicContact CZ-CB 4.39Å; F200-L323 HydrophobicContact CZ-CD1 3.44Å; F200-L323 VanDerWaalsContact CZ-CD1 3.44Å; F200-L323 HydrophobicContact CZ-CG 4.47Å; L291-L323 HydrophobicContact CB-CD2 4.48Å; L291-L323 HydrophobicContact CD2-CD1 4.3Å; L291-L323 HydrophobicContact CD2-CD2 3.88Å; N299-L323 HydrophobicContact CB-CB 3.71Å; N299-L323 HydrophobicContact CB-CD2 3.87Å; N299-L323 HydrophobicContact CB-CG 4.47Å; N299-L323 WeakPolarHBondContact ND2-CD2 3.45Å; N299-L323 PolarHBondContact O-N 2.84Å; L323-S325 WeakPolarHBondContact CD1-O 3.44Å; L323-F326 HydrophobicContact CD1-CB 4.38Å; L323-F326 HydrophobicContact CD2-CB 3.94Å; L323-F326 HydrophobicContact CG-CB 4.4Å
324	L	95.6	Very high	91.9	Very high	46 Å²	46	48.2 Å²	48.2	24%	0.241	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-38.5	178.2	-66.5	-177.4	0	0	0	112	Q199 C201 V245 Q295 T322	Q199-L324 HydrophobicContact CB-CB 4.27Å; Q199-L324 HydrophobicContact CG-CB 4.46Å; Q199-L324 HydrophobicContact CG-CD1 4.29Å; Q199-L324 PolarHBondContact O-N 3.49Å; C201-L324 HydrophobicContact CB-CD1 3.89Å; C201-L324 HydrophobicContact CB-CG 4.24Å; V245-L324 HydrophobicContact CG1-CD1 4.05Å; Q295-L324 PolarHBondContact OE1-O 2.96Å; T322-L324 PolarHBondContact O-N 2.92Å
325	S	94.6	Very high	91.9	Very high	45 Å²	45	39 Å²	39	32%	0.315	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	149.1	178.9	65.7	0	0	0	0	110.8	M198 Q199 L323	M198-S325 VanDerWaalsContact CA-O 3.24Å; M198-S325 WeakPolarHBondContact CA-O 2.98Å; M198-S325 WeakPolarHBondContact CB-O 3.4Å; Q199-S325 VanDerWaalsContact CB-OG 3.29Å; Q199-S325 WeakPolarHBondContact CB-OG 3.28Å; Q199-S325 PolarHBondContact N-O 3.35Å; Q199-S325 VanDerWaalsContact N-O 3.12Å; Q199-S325 PolarHBondContact N-OG 3.19Å; Q199-S325 PolarHBondContact O-N 3.42Å; L323-S325 WeakPolarHBondContact CD1-O 3.44Å
326	F	94.1	Very high	91.8	Very high	31 Å²	31	39 Å²	39	14%	0.136	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	120.2	171.8	-172.8	-90.4	0	0	0	108.4	A196 T197 M198 Y288 L291 A292 L323 V328	A196-F326 HydrophobicContact CB-CE2 3.81Å; A196-F326 HydrophobicContact CB-CZ 3.82Å; T197-F326 CarbonylContact O-C 3.57Å; T197-F326 WeakPolarHBondContact O-CA 3.46Å; M198-F326 HydrophobicContact CB-CD2 4.06Å; M198-F326 HydrophobicContact CE-CD2 4.15Å; M198-F326 HydrophobicContact CE-CE2 3.73Å; Y288-F326 AromaticContact CD2-CZ 3.96Å; Y288-F326 HydrophobicContact CD2-CZ 3.96Å; Y288-F326 HydrophobicContact CE2-CE1 4.3Å; Y288-F326 AromaticContact CE2-CZ 3.76Å; Y288-F326 HydrophobicContact CE2-CZ 3.76Å; L291-F326 HydrophobicContact CB-CD2 3.77Å; L291-F326 HydrophobicContact CB-CE2 3.49Å; L291-F326 VanDerWaalsContact CB-CE2 3.49Å; L291-F326 HydrophobicContact CB-CG 4.48Å; L291-F326 HydrophobicContact CB-CZ 3.99Å; L291-F326 HydrophobicContact CD1-CE2 4.27Å; L291-F326 HydrophobicContact CG-CE2 4.46Å; L291-F326 WeakPolarHBondContact O-CG 3.46Å; A292-F326 VanDerWaalsContact CA-CE1 3.4Å; A292-F326 HydrophobicContact CB-CD1 4.46Å; A292-F326 HydrophobicContact CB-CE1 3.82Å; A292-F326 HydrophobicContact CB-CZ 4.44Å; L323-F326 HydrophobicContact CD1-CB 4.38Å; L323-F326 HydrophobicContact CD2-CB 3.94Å; L323-F326 HydrophobicContact CG-CB 4.4Å; F326-V328 HydrophobicContact CD1-CG2 4.1Å; F326-V328 HydrophobicContact CE1-CG2 3.28Å; F326-V328 HydrophobicContact CZ-CG2 3.79Å
327	A	92.7	Very high	92	Very high	42 Å²	42	33.9 Å²	33.9	35%	0.347	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.9	175.3	0	0	0	0	0	108.3	A196 T197	A196-A327 CarbonylContact C-O 3.58Å; A196-A327 WeakPolarHBondContact CA-O 3.47Å; T197-A327 PolarHBondContact N-O 3.23Å; T197-A327 PolarHBondContact O-N 2.81Å
328	V	89.8	Confident	91.8	Very high	53 Å²	53	32 Å²	32	32%	0.321	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123	173.9	-178.7	0	0	0	0	107	D194 V195 A196 V253 Y288 F326	D194-V328 HydrophobicContact CB-CG1 3.69Å; V195-V328 WeakPolarHBondContact O-CA 3.46Å; A196-V328 HydrophobicContact CB-CG2 4.49Å; V253-V328 HydrophobicContact CG2-CG1 4.44Å; Y288-V328 HydrophobicContact CE2-CG2 4.04Å; Y288-V328 WeakPolarHBondContact OH-CG2 3.35Å; F326-V328 HydrophobicContact CD1-CG2 4.1Å; F326-V328 HydrophobicContact CE1-CG2 3.28Å; F326-V328 HydrophobicContact CZ-CG2 3.79Å
329	E	85.1	Confident	91.5	Very high	103 Å²	103	34.5 Å²	34.5	48%	0.481	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	129.8	177.2	-62.1	-175.5	175.8	0	0	107.9	V195 E331	V195-E329 PolarHBondContact N-O 3.35Å; V195-E329 PolarHBondContact O-N 3.11Å; V195-E329 VanDerWaalsContact O-N 3.09Å; E329-E331 PolarHBondContact O-N 2.94Å
330	S	82.8	Confident	91.2	Very high	70 Å²	70	34.6 Å²	34.6	49%	0.49	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	122.2	167.3	-50.6	0	0	0	0	108.2	D194 C332	D194-S330 WeakPolarHBondContact OD1-CB 3.22Å; D194-S330 PolarHBondContact OD1-OG 3.25Å; S330-C332 PolarHBondContact O-N 3.38Å
331	E	80.9	Confident	90.9	Very high	92 Å²	92	34.7 Å²	34.7	43%	0.43	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-67.2	131.1	173.6	-71.6	-166.2	144.9	0	0	109.9	R193 V195 E329 K576	R193-E331 WeakPolarHBondContact CD-O 3.2Å; R193-E331 PolarHBondContact O-N 2.79Å; V195-E331 HydrophobicContact CB-CG 4.21Å; V195-E331 VanDerWaalsContact CG2-CD 3.41Å; V195-E331 HydrophobicContact CG2-CG 3.6Å; E329-E331 PolarHBondContact O-N 2.94Å; E331-K576 IonicContact OE1-NZ 3.36Å
332	C	86.4	Confident	90.8	Very high	30 Å²	30	35 Å²	35	20%	0.203	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-82.8	128.2	174.3	-60.5	0	0	0	0	108.1	S330 Y337 P582	S330-C332 PolarHBondContact O-N 3.38Å; C332-Y337 HydrophobicContact CB-CE2 3.7Å; C332-P582 HydrophobicContact CB-CG 3.71Å; C332-P582 WeakPolarHBondContact SG-CD 3.39Å
333	T	87.7	Confident	90.6	Very high	28 Å²	28	36.4 Å²	36.4	17%	0.172	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-91	165.4	179.8	69.6	0	0	0	0	110.9	E188 L335 D336 Y337	E188-T333 WeakPolarHBondContact OE1-CG2 3.35Å; E188-T333 WeakPolarHBondContact OE2-CB 3.47Å; E188-T333 PolarHBondContact OE2-OG1 2.72Å; T333-L335 VanDerWaalsContact C-N 3.27Å; T333-L335 PolarHBondContact O-N 3.34Å; T333-L335 PolarHBondContact OG1-N 3.48Å; T333-D336 PolarHBondContact N-OD2 3.27Å; T333-D336 WeakPolarHBondContact O-CB 3.16Å; T333-D336 PolarHBondContact O-N 3.38Å; T333-D336 VanDerWaalsContact O-N 3.13Å; T333-D336 PolarHBondContact OG1-N 2.79Å; T333-D336 PolarHBondContact OG1-OD2 3.44Å; T333-Y337 WeakPolarHBondContact O-CD2 3.42Å; T333-Y337 PolarHBondContact O-N 3.41Å
334	F	90.9	Very high	90.5	Very high	15 Å²	15	36.4 Å²	36.4	7%	0.066	21%	0.208	C	C	.	.	H	α-helix	trans	-51.7	-46.9	170.8	171.7	-101.6	0	0	0	112.1	F86 D336 Y337 I338 I344 Y390 P568 L571 V572	F86-F334 AromaticContact CD2-CE1 3.62Å; F86-F334 HydrophobicContact CD2-CE1 3.62Å; F86-F334 AromaticContact CD2-CZ 3.55Å; F86-F334 HydrophobicContact CD2-CZ 3.55Å; F86-F334 HydrophobicContact CE2-CE1 4.17Å; F86-F334 HydrophobicContact CE2-CE2 4.48Å; F86-F334 AromaticContact CE2-CZ 3.62Å; F86-F334 HydrophobicContact CE2-CZ 3.62Å; F86-F334 HydrophobicContact CG-CE1 4.34Å; F86-F334 HydrophobicContact CG-CZ 4.41Å; F334-D336 VanDerWaalsContact C-N 3.3Å; F334-D336 PolarHBondContact O-N 2.72Å; F334-Y337 PolarHBondContact O-N 2.99Å; F334-Y337 VanDerWaalsContact O-N 3.15Å; F334-I338 HydrophobicContact CD1-CG1 4.17Å; F334-I338 HydrophobicContact CD2-CG1 4.46Å; F334-I338 HydrophobicContact CE1-CD1 4.38Å; F334-I338 HydrophobicContact CE1-CG1 3.7Å; F334-I338 HydrophobicContact CE2-CD1 4.01Å; F334-I338 HydrophobicContact CE2-CG1 4.04Å; F334-I338 HydrophobicContact CZ-CD1 3.8Å; F334-I338 HydrophobicContact CZ-CG1 3.63Å; F334-I338 WeakPolarHBondContact O-CG1 3.11Å; F334-I338 PolarHBondContact O-N 2.66Å; F334-I338 VanDerWaalsContact O-N 3.11Å; F334-I344 HydrophobicContact CE2-CD1 3.87Å; F334-I344 HydrophobicContact CZ-CD1 3.79Å; F334-Y390 HydrophobicContact CE1-CD1 4.49Å; F334-Y390 HydrophobicContact CE1-CE1 4.13Å; F334-Y390 HydrophobicContact CZ-CD1 4.29Å; F334-Y390 HydrophobicContact CZ-CE1 4.33Å; F334-P568 HydrophobicContact CB-CB 3.94Å; F334-P568 HydrophobicContact CD1-CB 4.44Å; F334-P568 HydrophobicContact CD2-CB 3.92Å; F334-P568 HydrophobicContact CD2-CG 4.45Å; F334-P568 HydrophobicContact CG-CB 3.85Å; F334-P568 HydrophobicContact CG-CG 4.43Å; F334-L571 HydrophobicContact CD2-CD1 4.22Å; F334-L571 HydrophobicContact CD2-CD2 4.44Å; F334-L571 HydrophobicContact CE2-CD1 3.99Å; F334-V572 HydrophobicContact CB-CG2 4.1Å
335	L	89.6	Confident	90.5	Very high	13 Å²	13	36 Å²	36	7%	0.068	21%	0.206	C	C	.	.	H	α-helix	trans	-66.5	-28.8	-179.9	-68.4	-177.8	0	0	0	113.1	T23 V25 Y84 V123 E188 T333 Y337 I338 K339	T23-L335 HydrophobicContact CG2-CD1 4.02Å; V25-L335 HydrophobicContact CG2-CD1 3.86Å; Y84-L335 HydrophobicContact CD1-CD1 3.86Å; Y84-L335 HydrophobicContact CD1-CD2 4.21Å; Y84-L335 HydrophobicContact CD1-CG 4.27Å; Y84-L335 HydrophobicContact CE1-CD1 4.06Å; Y84-L335 HydrophobicContact CE1-CD2 3.57Å; Y84-L335 HydrophobicContact CE1-CG 3.96Å; V123-L335 HydrophobicContact CB-CD2 4.07Å; V123-L335 HydrophobicContact CG1-CD2 4.45Å; V123-L335 HydrophobicContact CG2-CD2 4.22Å; E188-L335 HydrophobicContact CB-CD1 4.2Å; E188-L335 HydrophobicContact CG-CD1 4.22Å; E188-L335 WeakPolarHBondContact OE2-CB 3.46Å; T333-L335 VanDerWaalsContact C-N 3.27Å; T333-L335 PolarHBondContact O-N 3.34Å; T333-L335 PolarHBondContact OG1-N 3.48Å; L335-Y337 VanDerWaalsContact C-N 3.32Å; L335-Y337 PolarHBondContact O-N 2.99Å; L335-I338 PolarHBondContact O-N 2.92Å; L335-K339 WeakPolarHBondContact O-CB 3.25Å; L335-K339 PolarHBondContact O-N 3.21Å
336	D	89.6	Confident	90.5	Very high	38 Å²	38	33.8 Å²	33.8	20%	0.203	19%	0.191	C	C	.	.	H	α-helix	trans	-60.8	-44	172.9	-66.4	-33.5	0	0	0	110.9	R193 T333 F334 G340 P582	R193-D336 IonicContact CZ-OD1 3.98Å; R193-D336 IonicContact CZ-OD2 3.38Å; R193-D336 IonicContact NH1-OD1 3Å; R193-D336 PolarHBondContact NH1-OD1 3.18Å; R193-D336 IonicContact NH1-OD2 3.41Å; R193-D336 PolarHBondContact NH1-OD2 3.24Å; R193-D336 IonicContact NH2-OD1 2.82Å; T333-D336 PolarHBondContact N-OD2 3.27Å; T333-D336 WeakPolarHBondContact O-CB 3.16Å; T333-D336 PolarHBondContact O-N 3.38Å; T333-D336 VanDerWaalsContact O-N 3.13Å; T333-D336 PolarHBondContact OG1-N 2.79Å; T333-D336 PolarHBondContact OG1-OD2 3.44Å; F334-D336 VanDerWaalsContact C-N 3.3Å; F334-D336 PolarHBondContact O-N 2.72Å; D336-G340 PolarHBondContact O-N 3.46Å; D336-P582 HydrophobicContact CB-CB 3.98Å; D336-P582 HydrophobicContact CB-CG 3.63Å
337	Y	93.2	Very high	90.7	Very high	7 Å²	7	32.8 Å²	32.8	3%	0.027	19%	0.187	C	C	.	.	H	α-helix	trans	-65.7	-44	177.4	-71.3	-76.5	0	0	0	112	C332 T333 F334 L335 G340 G341 T342 L571 V572 M575 I580 P582	C332-Y337 HydrophobicContact CB-CE2 3.7Å; T333-Y337 WeakPolarHBondContact O-CD2 3.42Å; T333-Y337 PolarHBondContact O-N 3.41Å; F334-Y337 PolarHBondContact O-N 2.99Å; F334-Y337 VanDerWaalsContact O-N 3.15Å; L335-Y337 VanDerWaalsContact C-N 3.32Å; L335-Y337 PolarHBondContact O-N 2.99Å; Y337-G340 CarbonylContact O-C 3.54Å; Y337-G340 PolarHBondContact O-N 3.03Å; Y337-G341 PolarHBondContact O-N 3.09Å; Y337-T342 WeakPolarHBondContact O-CB 3.25Å; Y337-T342 PolarHBondContact O-N 2.88Å; Y337-T342 PolarHBondContact O-OG1 3.26Å; Y337-L571 HydrophobicContact CD2-CD2 4.06Å; Y337-L571 HydrophobicContact CG-CD2 4.14Å; Y337-V572 HydrophobicContact CD2-CG2 4.38Å; Y337-V572 HydrophobicContact CE2-CG2 4.4Å; Y337-M575 HydrophobicContact CD1-CB 4.41Å; Y337-M575 HydrophobicContact CD1-CE 4.21Å; Y337-M575 HydrophobicContact CD1-CG 3.89Å; Y337-M575 HydrophobicContact CD1-SD 4.23Å; Y337-M575 HydrophobicContact CD2-CG 4.4Å; Y337-M575 HydrophobicContact CE1-CB 3.58Å; Y337-M575 HydrophobicContact CE1-CG 3.55Å; Y337-M575 HydrophobicContact CE1-SD 4.06Å; Y337-M575 HydrophobicContact CE2-CB 3.96Å; Y337-M575 HydrophobicContact CE2-CG 4.12Å; Y337-M575 HydrophobicContact CG-CG 4.32Å; Y337-M575 VanDerWaalsContact OH-CB 3.25Å; Y337-M575 WeakPolarHBondContact OH-CB 3.49Å; Y337-I580 HydrophobicContact CE1-CG2 4.38Å; Y337-I580 PolarHBondContact OH-O 2.71Å; Y337-P582 HydrophobicContact CD1-CB 4.25Å; Y337-P582 HydrophobicContact CD1-CG 3.93Å; Y337-P582 HydrophobicContact CD2-CG 4.26Å; Y337-P582 HydrophobicContact CE1-CB 4.43Å; Y337-P582 HydrophobicContact CE1-CG 3.78Å; Y337-P582 HydrophobicContact CE2-CG 4.11Å; Y337-P582 HydrophobicContact CG-CG 4.15Å
338	I	92.5	Very high	91	Very high	7 Å²	7	30.8 Å²	30.8	4%	0.036	17%	0.17	C	C	.	.	H	α-helix	trans	-62.7	-46.7	176.8	-61.2	-55	0	0	0	110.9	V123 F334 L335 G340 G341 I344 Y390	V123-I338 WeakPolarHBondContact O-CG2 3.44Å; F334-I338 HydrophobicContact CD1-CG1 4.17Å; F334-I338 HydrophobicContact CD2-CG1 4.46Å; F334-I338 HydrophobicContact CE1-CD1 4.38Å; F334-I338 HydrophobicContact CE1-CG1 3.7Å; F334-I338 HydrophobicContact CE2-CD1 4.01Å; F334-I338 HydrophobicContact CE2-CG1 4.04Å; F334-I338 HydrophobicContact CZ-CD1 3.8Å; F334-I338 HydrophobicContact CZ-CG1 3.63Å; F334-I338 WeakPolarHBondContact O-CG1 3.11Å; F334-I338 PolarHBondContact O-N 2.66Å; F334-I338 VanDerWaalsContact O-N 3.11Å; L335-I338 PolarHBondContact O-N 2.92Å; I338-G340 VanDerWaalsContact C-N 3.25Å; I338-G340 PolarHBondContact O-N 2.87Å; I338-G341 WeakPolarHBondContact O-CA 3.07Å; I338-G341 PolarHBondContact O-N 3.23Å; I338-I344 HydrophobicContact CD1-CD1 4.21Å; I338-I344 HydrophobicContact CD1-CG1 4.21Å; I338-Y390 HydrophobicContact CD1-CD1 4.09Å; I338-Y390 HydrophobicContact CG1-CD1 4.18Å; I338-Y390 HydrophobicContact CG2-CD1 4.05Å
339	K	89.4	Confident	91.4	Very high	52 Å²	52	28.2 Å²	28.2	23%	0.226	16%	0.155	C	C	.	.	H	α-helix	trans	-61.4	-34.5	176.6	-172.3	174.6	-178.1	170.4	0	112.1	E187 L335 G341 P585 P586	E187-K339 IonicContact OE1-NZ 2.72Å; L335-K339 WeakPolarHBondContact O-CB 3.25Å; L335-K339 PolarHBondContact O-N 3.21Å; K339-G341 PolarHBondContact O-N 2.99Å; K339-P585 HydrophobicContact CD-CG 4.4Å; K339-P585 HydrophobicContact CG-CB 4.36Å; K339-P585 HydrophobicContact CG-CG 4.14Å; K339-P586 WeakPolarHBondContact O-CD 3.32Å
340	G	90.6	Very high	92	Very high	4 Å²	4	23.3 Å²	23.3	4%	0.041	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	2.1	171.4	0	0	0	0	0	115	D336 Y337 I338 R583	D336-G340 PolarHBondContact O-N 3.46Å; Y337-G340 CarbonylContact O-C 3.54Å; Y337-G340 PolarHBondContact O-N 3.03Å; I338-G340 VanDerWaalsContact C-N 3.25Å; I338-G340 PolarHBondContact O-N 2.87Å; G340-R583 WeakPolarHBondContact CA-O 3.25Å; G340-R583 WeakPolarHBondContact O-CB 3.12Å; G340-R583 PolarHBondContact O-NE 3.44Å
341	G	92	Very high	92.7	Very high	24 Å²	24	20 Å²	20	25%	0.247	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	28.4	176.7	0	0	0	0	0	114.2	Y337 I338 K339 R583	Y337-G341 PolarHBondContact O-N 3.09Å; I338-G341 WeakPolarHBondContact O-CA 3.07Å; I338-G341 PolarHBondContact O-N 3.23Å; K339-G341 PolarHBondContact O-N 2.99Å; G341-R583 PolarHBondContact O-NH2 3.49Å
342	T	94.6	Very high	93.5	Very high	7 Å²	7	15.6 Å²	15.6	4%	0.043	9%	0.088	C	C	.	.			trans	-70.8	127.1	164.5	-54.4	0	0	0	0	108.5	Y337 G468 S469 L571 M575	Y337-T342 WeakPolarHBondContact O-CB 3.25Å; Y337-T342 PolarHBondContact O-N 2.88Å; Y337-T342 PolarHBondContact O-OG1 3.26Å; T342-G468 WeakPolarHBondContact CG2-O 3.49Å; T342-G468 PolarHBondContact OG1-O 2.91Å; T342-S469 WeakPolarHBondContact CA-O 3.34Å; T342-L571 HydrophobicContact CG2-CD1 4.44Å; T342-M575 HydrophobicContact CG2-CE 3.79Å
343	Q	93.9	Very high	94	Very high	57 Å²	57	14.3 Å²	14.3	27%	0.266	8%	0.079	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	143.7	177.7	-56.3	-166.8	27	0	0	110.8	S392 S469 Q470 Y471	Q343-S392 PolarHBondContact NE2-OG 3.1Å; Q343-S392 PolarHBondContact OE1-OG 3.37Å; Q343-S469 PolarHBondContact N-O 2.84Å; Q343-Q470 CarbonylContact O-C 3.57Å; Q343-Q470 WeakPolarHBondContact O-CA 3.19Å; Q343-Y471 PolarHBondContact O-N 3.3Å
344	I	94.8	Very high	94.3	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	101.2	172.3	-58.7	-176.6	0	0	0	108.1	F86 F334 I338 F346 I387 Y390 D391 Y471 V473	F86-I344 HydrophobicContact CE2-CD1 4.05Å; F86-I344 HydrophobicContact CZ-CD1 4.29Å; F334-I344 HydrophobicContact CE2-CD1 3.87Å; F334-I344 HydrophobicContact CZ-CD1 3.79Å; I338-I344 HydrophobicContact CD1-CD1 4.21Å; I338-I344 HydrophobicContact CD1-CG1 4.21Å; I344-F346 PolarHBondContact O-N 3.09Å; I344-I387 HydrophobicContact CG2-CD1 3.89Å; I344-I387 HydrophobicContact CG2-CG1 3.9Å; I344-Y390 HydrophobicContact CD1-CG 4.05Å; I344-Y390 PolarHBondContact N-O 3.49Å; I344-D391 WeakPolarHBondContact O-CB 3.36Å; I344-Y471 CarbonylContact C-O 3.55Å; I344-Y471 VanDerWaalsContact CA-O 3.31Å; I344-Y471 WeakPolarHBondContact CA-O 3.26Å; I344-V473 HydrophobicContact CG2-CB 4.23Å; I344-V473 HydrophobicContact CG2-CG2 3.58Å
345	N	94.6	Very high	94.5	Very high	37 Å²	37	18.7 Å²	18.7	20%	0.198	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	109.2	179.8	-65.2	5.6	0	0	0	109.2	Q470 Y471 S472 V473	N345-Q470 PolarHBondContact ND2-OE1 2.62Å; N345-Y471 PolarHBondContact N-O 3.17Å; N345-S472 WeakPolarHBondContact O-CA 3.29Å; N345-V473 PolarHBondContact O-N 2.83Å
346	F	95.9	Very high	94.8	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	123.2	-176	-175.7	-123.2	0	0	0	111.9	I344 V348 V383 I387 F396 P397 I429 V473 L475	I344-F346 PolarHBondContact O-N 3.09Å; F346-V348 HydrophobicContact CD1-CG2 4.08Å; F346-V348 HydrophobicContact CE1-CG2 3.46Å; F346-V348 VanDerWaalsContact CE1-CG2 3.46Å; F346-V348 HydrophobicContact CZ-CG2 3.77Å; F346-V383 HydrophobicContact CE2-CG1 4.1Å; F346-V383 HydrophobicContact CZ-CG1 3.96Å; F346-I387 HydrophobicContact CB-CG2 4.18Å; F346-I387 HydrophobicContact CD1-CG2 3.69Å; F346-I387 HydrophobicContact CD2-CD1 3.75Å; F346-I387 HydrophobicContact CD2-CG1 4.43Å; F346-I387 HydrophobicContact CD2-CG2 3.72Å; F346-I387 HydrophobicContact CE1-CG2 3.86Å; F346-I387 HydrophobicContact CE2-CD1 4.19Å; F346-I387 HydrophobicContact CE2-CG2 3.88Å; F346-I387 HydrophobicContact CG-CD1 4.42Å; F346-I387 HydrophobicContact CG-CG2 3.6Å; F346-I387 HydrophobicContact CZ-CG2 3.94Å; F346-F396 HydrophobicContact CB-CD1 3.71Å; F346-F396 HydrophobicContact CB-CE1 3.9Å; F346-F396 HydrophobicContact CD1-CD1 4.17Å; F346-F396 HydrophobicContact CD1-CG 4.33Å; F346-F396 HydrophobicContact CG-CD1 4.45Å; F346-F396 WeakPolarHBondContact O-CD1 3.45Å; F346-P397 WeakPolarHBondContact O-CD 3.47Å; F346-I429 HydrophobicContact CE1-CD1 4.27Å; F346-V473 HydrophobicContact CD2-CB 4.28Å; F346-V473 HydrophobicContact CD2-CG1 4.17Å; F346-V473 HydrophobicContact CE2-CG1 4.39Å; F346-L475 HydrophobicContact CE2-CB 3.64Å; F346-L475 HydrophobicContact CE2-CD2 4.37Å; F346-L475 HydrophobicContact CZ-CB 3.78Å; F346-L475 HydrophobicContact CZ-CD2 3.72Å; F346-L475 HydrophobicContact CZ-CG 4.4Å
347	T	97.6	Very high	95	Very high	9 Å²	9	17.8 Å²	17.8	6%	0.055	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	138.3	175.4	-63.7	0	0	0	0	109.9	P397 L399 V458 V473 L474 L475	T347-P397 WeakPolarHBondContact CA-O 3.4Å; T347-P397 HydrophobicContact CG2-CB 4Å; T347-L399 HydrophobicContact CG2-CD1 4.29Å; T347-V458 HydrophobicContact CG2-CG2 3.73Å; T347-V473 PolarHBondContact N-O 2.93Å; T347-L474 HydrophobicContact CG2-CD1 4.01Å; T347-L474 CarbonylContact O-C 3.5Å; T347-L474 WeakPolarHBondContact O-CA 3.41Å; T347-L475 PolarHBondContact O-N 3.15Å
348	V	98.1	Very high	95	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	132.7	178.6	-176.4	0	0	0	0	109.7	F346 I350 L380 P397 L399 I432 L475	F346-V348 HydrophobicContact CD1-CG2 4.08Å; F346-V348 HydrophobicContact CE1-CG2 3.46Å; F346-V348 VanDerWaalsContact CE1-CG2 3.46Å; F346-V348 HydrophobicContact CZ-CG2 3.77Å; V348-I350 HydrophobicContact CG1-CD1 4.25Å; V348-I350 HydrophobicContact CG1-CG1 3.8Å; V348-L380 HydrophobicContact CB-CD1 4.45Å; V348-L380 HydrophobicContact CG1-CD1 3.95Å; V348-L380 HydrophobicContact CG2-CD1 3.71Å; V348-P397 PolarHBondContact N-O 3.25Å; V348-L399 PolarHBondContact O-N 2.81Å; V348-I432 HydrophobicContact CG2-CD1 3.85Å; V348-L475 CarbonylContact C-O 3.56Å; V348-L475 WeakPolarHBondContact CA-O 3.45Å
349	A	98.3	Very high	95	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	116.9	170.8	0	0	0	0	0	109.6	L399 F401 V454 L474 L475 I476 I477	A349-L399 CarbonylContact C-O 3.58Å; A349-L399 VanDerWaalsContact CA-O 3.31Å; A349-L399 WeakPolarHBondContact CA-O 3.33Å; A349-F401 HydrophobicContact CB-CD1 4.17Å; A349-F401 HydrophobicContact CB-CE1 4.11Å; A349-V454 HydrophobicContact CB-CB 4.15Å; A349-V454 HydrophobicContact CB-CG1 4.15Å; A349-V454 HydrophobicContact CB-CG2 4.14Å; A349-L474 HydrophobicContact CB-CD1 3.89Å; A349-L475 PolarHBondContact N-O 3.22Å; A349-I476 HydrophobicContact CB-CG1 4.35Å; A349-I476 WeakPolarHBondContact O-CA 3.46Å; A349-I477 PolarHBondContact O-N 3.21Å
350	I	98.3	Very high	95.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	131.8	-178.3	-58.5	-177.4	0	0	0	109.4	V348 F352 Y376 L399 G400 F401 L417 Y436	V348-I350 HydrophobicContact CG1-CD1 4.25Å; V348-I350 HydrophobicContact CG1-CG1 3.8Å; I350-F352 HydrophobicContact CB-CD2 4.25Å; I350-F352 HydrophobicContact CB-CE2 3.83Å; I350-F352 HydrophobicContact CG2-CD2 3.93Å; I350-F352 HydrophobicContact CG2-CE2 3.6Å; I350-F352 WeakPolarHBondContact O-CD2 3.41Å; I350-Y376 HydrophobicContact CG2-CD1 3.74Å; I350-Y376 HydrophobicContact CG2-CE1 4.06Å; I350-L399 PolarHBondContact N-O 2.9Å; I350-G400 CarbonylContact O-C 3.54Å; I350-G400 VanDerWaalsContact O-CA 3.27Å; I350-G400 WeakPolarHBondContact O-CA 3.32Å; I350-F401 VanDerWaalsContact C-CE1 3.41Å; I350-F401 VanDerWaalsContact O-CD1 3.28Å; I350-F401 WeakPolarHBondContact O-CD1 3.15Å; I350-F401 PolarHBondContact O-N 3.05Å; I350-L417 HydrophobicContact CD1-CD1 3.81Å; I350-L417 HydrophobicContact CG1-CD1 4.28Å; I350-Y436 HydrophobicContact CD1-CD2 3.63Å; I350-Y436 HydrophobicContact CD1-CE2 4.25Å; I350-Y436 HydrophobicContact CD1-CG 3.95Å; I350-Y436 HydrophobicContact CG2-CD2 4.03Å; I350-Y436 HydrophobicContact CG2-CE2 3.83Å
351	D	97.6	Very high	95.2	Very high	0 Å²	0	29 Å²	29	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	127.3	172.7	-168	-20.2	0	0	0	110.7	T353 H366 Y376 F401 T449 I477 T478	D351-T353 WeakPolarHBondContact OD1-CB 3.4Å; D351-T353 WeakPolarHBondContact OD1-CG2 3.39Å; D351-T353 PolarHBondContact OD1-N 2.8Å; D351-T353 PolarHBondContact OD1-OG1 2.76Å; D351-T353 PolarHBondContact OD2-OG1 2.61Å; D351-H366 PolarHBondContact O-CE1 3.36Å; D351-H366 PolarHBondContact O-NE2 2.88Å; D351-Y376 HydrophobicContact CB-CE1 4.18Å; D351-F401 VanDerWaalsContact CA-CZ 3.48Å; D351-F401 HydrophobicContact CB-CE1 4.15Å; D351-F401 HydrophobicContact CB-CE2 3.78Å; D351-F401 HydrophobicContact CB-CZ 3.49Å; D351-F401 VanDerWaalsContact CB-CZ 3.49Å; D351-T449 WeakPolarHBondContact OD2-CG2 3.39Å; D351-I477 WeakPolarHBondContact CB-O 3.19Å; D351-I477 PolarHBondContact N-O 2.83Å; D351-T478 WeakPolarHBondContact OD2-CB 3.5Å; D351-T478 PolarHBondContact OD2-OG1 3.23Å
352	F	97.5	Very high	95.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	21%	0.205	C	C	.	.			trans	-119.6	31.2	174.8	-81.3	-111.3	0	0	0	111	I350 F401 G402 A403 F415 L417 Y436 L440 V443 L445 Y446	I350-F352 HydrophobicContact CB-CD2 4.25Å; I350-F352 HydrophobicContact CB-CE2 3.83Å; I350-F352 HydrophobicContact CG2-CD2 3.93Å; I350-F352 HydrophobicContact CG2-CE2 3.6Å; I350-F352 WeakPolarHBondContact O-CD2 3.41Å; F352-F401 PolarHBondContact N-O 3.04Å; F352-G402 VanDerWaalsContact O-O 3.14Å; F352-A403 HydrophobicContact CB-CB 3.85Å; F352-F415 HydrophobicContact CB-CZ 4.26Å; F352-F415 HydrophobicContact CD1-CZ 4.38Å; F352-F415 HydrophobicContact CD2-CZ 4.08Å; F352-F415 HydrophobicContact CG-CZ 4.01Å; F352-L417 HydrophobicContact CE2-CD2 3.58Å; F352-L417 HydrophobicContact CZ-CD2 3.8Å; F352-Y436 HydrophobicContact CE2-CD2 4.08Å; F352-Y436 HydrophobicContact CE2-CE2 4.36Å; F352-Y436 AromaticContact CZ-CD2 3.7Å; F352-Y436 HydrophobicContact CZ-CD2 3.7Å; F352-Y436 HydrophobicContact CZ-CE2 4.07Å; F352-L440 HydrophobicContact CD1-CD2 3.74Å; F352-L440 HydrophobicContact CD1-CG 4.44Å; F352-L440 HydrophobicContact CE1-CB 4.3Å; F352-L440 HydrophobicContact CE1-CD2 3.41Å; F352-L440 VanDerWaalsContact CE1-CD2 3.41Å; F352-L440 HydrophobicContact CE1-CG 3.62Å; F352-L440 HydrophobicContact CZ-CD2 4.18Å; F352-L440 HydrophobicContact CZ-CG 4.09Å; F352-V443 HydrophobicContact CD1-CG2 3.43Å; F352-V443 VanDerWaalsContact CD1-CG2 3.43Å; F352-V443 HydrophobicContact CE1-CG2 3.84Å; F352-V443 HydrophobicContact CG-CG2 4.37Å; F352-L445 HydrophobicContact CB-CD2 3.77Å; F352-L445 HydrophobicContact CD1-CD2 3.69Å; F352-L445 HydrophobicContact CG-CD2 4.13Å; F352-L445 WeakPolarHBondContact O-CA 3.38Å; F352-L445 WeakPolarHBondContact O-CB 3.38Å; F352-L445 WeakPolarHBondContact O-CD2 3.33Å; F352-Y446 PolarHBondContact O-N 3.22Å
353	T	96.6	Very high	95.1	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.018	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-77.9	156.6	179.6	59.5	0	0	0	0	112.3	D351 S355 N356 Y446 T449	D351-T353 WeakPolarHBondContact OD1-CB 3.4Å; D351-T353 WeakPolarHBondContact OD1-CG2 3.39Å; D351-T353 PolarHBondContact OD1-N 2.8Å; D351-T353 PolarHBondContact OD1-OG1 2.76Å; D351-T353 PolarHBondContact OD2-OG1 2.61Å; T353-S355 PolarHBondContact O-N 2.76Å; T353-S355 PolarHBondContact OG1-OG 2.94Å; T353-N356 WeakPolarHBondContact O-CB 3.32Å; T353-N356 PolarHBondContact O-N 3.36Å; T353-N356 PolarHBondContact O-ND2 3Å; T353-N356 VanDerWaalsContact O-ND2 3.09Å; T353-N356 PolarHBondContact OG1-ND2 3.36Å; T353-Y446 CarbonylContact C-O 3.41Å; T353-Y446 WeakPolarHBondContact CA-O 3.28Å; T353-Y446 VanDerWaalsContact CB-O 3.3Å; T353-Y446 WeakPolarHBondContact CB-O 3.09Å; T353-T449 HydrophobicContact CG2-CG2 4.38Å; T353-T449 WeakPolarHBondContact CG2-OG1 3.39Å
354	A	95.3	Very high	95.2	Very high	58 Å²	58	35.2 Å²	35.2	48%	0.479	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-68.7	-17.4	-173.9	0	0	0	0	0	113.6	N356 G357 Y446	A354-N356 PolarHBondContact O-N 2.96Å; A354-G357 PolarHBondContact O-N 2.98Å; A354-G357 VanDerWaalsContact O-N 3.09Å; A354-Y446 PolarHBondContact N-O 3.05Å
355	S	94.3	Very high	95.2	Very high	77 Å²	77	37.6 Å²	37.6	54%	0.538	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-57.9	-27.5	172.7	42.5	0	0	0	0	112.4	T353 G357 D479	T353-S355 PolarHBondContact O-N 2.76Å; T353-S355 PolarHBondContact OG1-OG 2.94Å; S355-G357 PolarHBondContact O-N 2.83Å; S355-G357 VanDerWaalsContact O-N 3.14Å; S355-D479 WeakPolarHBondContact CB-OD2 3.3Å; S355-D479 VanDerWaalsContact OG-CG 3.27Å; S355-D479 PolarHBondContact OG-OD1 3.23Å; S355-D479 PolarHBondContact OG-OD2 2.89Å
356	N	95.3	Very high	95.3	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.016	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-68	-10.7	176.5	-71	-79.1	0	0	0	114.7	T353 A354 S364 L365 H366 Y376 L445 D479	T353-N356 WeakPolarHBondContact O-CB 3.32Å; T353-N356 PolarHBondContact O-N 3.36Å; T353-N356 PolarHBondContact O-ND2 3Å; T353-N356 VanDerWaalsContact O-ND2 3.09Å; T353-N356 PolarHBondContact OG1-ND2 3.36Å; A354-N356 PolarHBondContact O-N 2.96Å; N356-S364 CarbonylContact O-C 3.59Å; N356-S364 VanDerWaalsContact O-CA 3.22Å; N356-S364 WeakPolarHBondContact O-CA 3.49Å; N356-S364 WeakPolarHBondContact O-CB 3.5Å; N356-S364 PolarHBondContact O-OG 2.87Å; N356-L365 HydrophobicContact CB-CB 4.43Å; N356-L365 PolarHBondContact O-N 2.83Å; N356-H366 WeakPolarHBondContact CB-CD2 3.33Å; N356-Y376 VanDerWaalsContact CG-OH 3.29Å; N356-Y376 PolarHBondContact ND2-OH 2.7Å; N356-Y376 WeakPolarHBondContact OD1-CE2 3.48Å; N356-Y376 VanDerWaalsContact OD1-CZ 3.28Å; N356-Y376 PolarHBondContact OD1-OH 3.12Å; N356-L445 HydrophobicContact CB-CD1 4.41Å; N356-D479 VanDerWaalsContact CG-CG 3.48Å; N356-D479 PolarHBondContact N-OD2 3.13Å; N356-D479 VanDerWaalsContact N-OD2 3.15Å; N356-D479 VanDerWaalsContact ND2-CG 3.29Å; N356-D479 PolarHBondContact ND2-OD1 2.95Å; N356-D479 VanDerWaalsContact OD1-CB 3.29Å; N356-D479 WeakPolarHBondContact OD1-CB 3.3Å
357	G	94.2	Very high	95.2	Very high	29 Å²	29	39.7 Å²	39.7	30%	0.299	25%	0.245	S	C	.	.			trans	73.5	171.5	-176.9	0	0	0	0	0	113.6	A354 S355 P359 S364 L445	A354-G357 PolarHBondContact O-N 2.98Å; A354-G357 VanDerWaalsContact O-N 3.09Å; S355-G357 PolarHBondContact O-N 2.83Å; S355-G357 VanDerWaalsContact O-N 3.14Å; G357-P359 WeakPolarHBondContact O-CD 3.42Å; G357-S364 PolarHBondContact O-OG 3.06Å; G357-S364 VanDerWaalsContact O-OG 3.07Å; G357-L445 WeakPolarHBondContact O-CD1 3.22Å
358	N	92.9	Very high	94.8	Very high	82 Å²	82	41.8 Å²	41.8	44%	0.439	26%	0.255	S	S	.	.			trans	-69.8	123	-175.9	-176.6	-34.5	0	0	0	111.3	S360 Q361 S364	N358-S360 PolarHBondContact O-N 3Å; N358-S360 WeakPolarHBondContact OD1-CB 3.27Å; N358-S360 PolarHBondContact OD1-N 3.09Å; N358-S360 PolarHBondContact OD1-OG 3.33Å; N358-Q361 HydrophobicContact CB-CG 4.14Å; N358-Q361 WeakPolarHBondContact O-CB 3.48Å; N358-Q361 PolarHBondContact O-N 3.38Å; N358-S364 WeakPolarHBondContact O-CB 3.46Å
359	P	93.8	Very high	94.2	Very high	17 Å²	17	43.5 Å²	43.5	11%	0.11	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-17.4	-177.5	-25.6	34.4	0	0	0	115.4	G357 Q361 H366 M368 L440 L445	G357-P359 WeakPolarHBondContact O-CD 3.42Å; P359-Q361 VanDerWaalsContact C-N 3.31Å; P359-H366 HydrophobicContact CB-CB 4.17Å; P359-H366 HydrophobicContact CG-CB 4.1Å; P359-M368 HydrophobicContact CB-CE 4.33Å; P359-L440 HydrophobicContact CG-CD2 4Å; P359-L445 HydrophobicContact CG-CD1 3.89Å; P359-L445 HydrophobicContact CG-CG 4.38Å
360	S	90.2	Very high	93.5	Very high	101 Å²	101	48.4 Å²	48.4	71%	0.706	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-14.3	175.4	-50.9	0	0	0	0	113.3	N358	N358-S360 PolarHBondContact O-N 3Å; N358-S360 WeakPolarHBondContact OD1-CB 3.27Å; N358-S360 PolarHBondContact OD1-N 3.09Å; N358-S360 PolarHBondContact OD1-OG 3.33Å
361	Q	93.3	Very high	92.7	Very high	106 Å²	106	58.6 Å²	58.6	50%	0.495	34%	0.339	S	S	.	.	S	Bend	trans	-99.1	137.9	-178.1	-64.9	-179.7	-19.4	0	0	110.5	N358 P359 T363 S364 Y367	N358-Q361 HydrophobicContact CB-CG 4.14Å; N358-Q361 WeakPolarHBondContact O-CB 3.48Å; N358-Q361 PolarHBondContact O-N 3.38Å; P359-Q361 VanDerWaalsContact C-N 3.31Å; Q361-T363 PolarHBondContact O-N 3.27Å; Q361-T363 VanDerWaalsContact O-N 3.12Å; Q361-S364 WeakPolarHBondContact O-CB 3.24Å; Q361-S364 PolarHBondContact O-N 3.49Å; Q361-Y367 VanDerWaalsContact C-CD2 3.48Å; Q361-Y367 WeakPolarHBondContact O-CB 3.38Å; Q361-Y367 VanDerWaalsContact O-CD2 3.25Å; Q361-Y367 WeakPolarHBondContact O-CD2 3.21Å
362	S	92.2	Very high	92	Very high	93 Å²	93	65 Å²	65	65%	0.65	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-15.6	179.7	54.5	0	0	0	0	114.5	S364	S362-S364 VanDerWaalsContact C-N 3.34Å
363	T	92.5	Very high	91.5	Very high	117 Å²	117	68.8 Å²	68.8	72%	0.718	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-10.9	174.9	52.1	0	0	0	0	113.2	Q361	Q361-T363 PolarHBondContact O-N 3.27Å; Q361-T363 VanDerWaalsContact O-N 3.12Å
364	S	95.3	Very high	91.3	Very high	8 Å²	8	69.6 Å²	69.6	6%	0.056	39%	0.393	C	S	.	.	S	Bend	trans	-74.8	142.3	179.3	174.7	0	0	0	0	111.6	N356 G357 N358 Q361 S362 H366 Y367	N356-S364 CarbonylContact O-C 3.59Å; N356-S364 VanDerWaalsContact O-CA 3.22Å; N356-S364 WeakPolarHBondContact O-CA 3.49Å; N356-S364 WeakPolarHBondContact O-CB 3.5Å; N356-S364 PolarHBondContact O-OG 2.87Å; G357-S364 PolarHBondContact O-OG 3.06Å; G357-S364 VanDerWaalsContact O-OG 3.07Å; N358-S364 WeakPolarHBondContact O-CB 3.46Å; Q361-S364 WeakPolarHBondContact O-CB 3.24Å; Q361-S364 PolarHBondContact O-N 3.49Å; S362-S364 VanDerWaalsContact C-N 3.34Å; S364-H366 PolarHBondContact O-N 3.45Å; S364-H366 PolarHBondContact OG-N 3.05Å; S364-Y367 VanDerWaalsContact O-CB 3.25Å; S364-Y367 WeakPolarHBondContact O-CB 3.36Å; S364-Y367 PolarHBondContact O-N 2.88Å; S364-Y367 VanDerWaalsContact O-N 3.09Å
365	L	95.1	Very high	91.2	Very high	49 Å²	49	67.8 Å²	67.8	26%	0.257	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.3	171.8	-61.4	176	0	0	0	112.2	N356 N374 Y376 D479 V507	N356-L365 HydrophobicContact CB-CB 4.43Å; N356-L365 PolarHBondContact O-N 2.83Å; L365-N374 WeakPolarHBondContact O-CB 3.41Å; L365-Y376 HydrophobicContact CB-CD2 4.45Å; L365-Y376 HydrophobicContact CB-CE2 3.88Å; L365-D479 HydrophobicContact CD1-CB 3.4Å; L365-D479 VanDerWaalsContact CD1-CB 3.4Å; L365-V507 HydrophobicContact CD1-CG2 4.39Å
366	H	96.6	Very high	91.2	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	10.6	172	-69.8	-54.1	0	0	0	113.8	D351 N356 P359 S364 M368 N374 Y376 Y436 L440	D351-H366 PolarHBondContact O-CE1 3.36Å; D351-H366 PolarHBondContact O-NE2 2.88Å; N356-H366 WeakPolarHBondContact CB-CD2 3.33Å; P359-H366 HydrophobicContact CB-CB 4.17Å; P359-H366 HydrophobicContact CG-CB 4.1Å; S364-H366 PolarHBondContact O-N 3.45Å; S364-H366 PolarHBondContact OG-N 3.05Å; H366-M368 PolarHBondContact O-N 3.15Å; H366-M368 VanDerWaalsContact O-N 3.14Å; H366-N374 PolarHBondContact O-ND2 2.92Å; H366-Y376 AromaticContact CE1-CD1 3.99Å; H366-Y376 AromaticContact CE1-CD2 3.54Å; H366-Y376 AromaticContact CE1-CE1 3.84Å; H366-Y376 AromaticContact CE1-CE2 3.35Å; H366-Y376 WeakPolarHBondContact CE1-CE2 3.38Å; H366-Y376 AromaticContact CE1-CG 3.86Å; H366-Y376 AromaticContact CE1-CZ 3.53Å; H366-Y376 AromaticContact ND1-CD2 3.45Å; H366-Y376 WeakPolarHBondContact ND1-CD2 3.44Å; H366-Y376 AromaticContact ND1-CE2 3.62Å; H366-Y376 AromaticContact ND1-CG 3.93Å; H366-Y376 AromaticContact NE2-CE2 3.94Å; H366-Y436 AromaticContact ND1-CE2 3.72Å; H366-Y436 AromaticContact ND1-CZ 3.7Å; H366-Y436 PolarHBondContact ND1-OH 3.47Å; H366-L440 HydrophobicContact CB-CD1 4.03Å; H366-L440 HydrophobicContact CB-CD2 3.8Å
367	Y	95.1	Very high	91.2	Very high	81 Å²	81	64 Å²	64	32%	0.318	35%	0.352	S	S	.	.			trans	-53.7	125.2	-177.1	-179.9	-122.2	0	0	0	111.5	Q361 S364 S369 N374	Q361-Y367 VanDerWaalsContact C-CD2 3.48Å; Q361-Y367 WeakPolarHBondContact O-CB 3.38Å; Q361-Y367 VanDerWaalsContact O-CD2 3.25Å; Q361-Y367 WeakPolarHBondContact O-CD2 3.21Å; S364-Y367 VanDerWaalsContact O-CB 3.25Å; S364-Y367 WeakPolarHBondContact O-CB 3.36Å; S364-Y367 PolarHBondContact O-N 2.88Å; S364-Y367 VanDerWaalsContact O-N 3.09Å; Y367-S369 PolarHBondContact O-N 3.48Å; Y367-N374 PolarHBondContact O-ND2 3.47Å; Y367-N374 VanDerWaalsContact O-ND2 3.09Å
368	M	88.6	Confident	91	Very high	53 Å²	53	64.5 Å²	64.5	26%	0.261	35%	0.347	S	S	.	.			trans	-91.2	76.7	179	-72.3	-176.7	-82.9	0	0	109.9	P359 H366 H437 L440 R441	P359-M368 HydrophobicContact CB-CE 4.33Å; H366-M368 PolarHBondContact O-N 3.15Å; H366-M368 VanDerWaalsContact O-N 3.14Å; M368-H437 HydrophobicContact SD-CB 4.35Å; M368-L440 HydrophobicContact CE-CB 3.98Å; M368-L440 HydrophobicContact CE-CD1 4.49Å; M368-L440 HydrophobicContact CG-CD1 4.31Å; M368-L440 HydrophobicContact SD-CB 4.37Å; M368-L440 HydrophobicContact SD-CD1 4.28Å; M368-R441 HydrophobicContact CE-CG 4.01Å
369	S	86.2	Confident	91	Very high	37 Å²	37	60.6 Å²	60.6	26%	0.259	33%	0.327	S	S	.	.			trans	-67.9	138.3	173	173	0	0	0	0	110.6	Y367 Y371 Q372	Y367-S369 PolarHBondContact O-N 3.48Å; S369-Y371 PolarHBondContact O-N 3.33Å; S369-Y371 PolarHBondContact OG-N 3.13Å; S369-Q372 WeakPolarHBondContact CB-O 3.28Å; S369-Q372 PolarHBondContact OG-N 2.96Å
370	P	83	Confident	91	Very high	103 Å²	103	59.8 Å²	59.8	67%	0.669	32%	0.322	S	S	*	.	S	Bend	trans	-72.8	-10.1	174.3	28.8	-33.1	0	0	0	113.4
371	Y	80.7	Confident	91.1	Very high	213 Å²	213	56.2 Å²	56.2	84%	0.835	30%	0.295	S	S	*	.	S	Bend	trans	-117.3	-21.6	-173.4	-56.7	-66	0	0	0	114.2	S369	S369-Y371 PolarHBondContact O-N 3.33Å; S369-Y371 PolarHBondContact OG-N 3.13Å
372	Q	83.8	Confident	90.9	Very high	135 Å²	135	51.6 Å²	51.6	63%	0.631	28%	0.276	S	S	*	.	S	Bend	trans	-140.4	140.8	-173.2	-68.9	-177.7	2.8	0	0	110.9	S369	S369-Q372 WeakPolarHBondContact CB-O 3.28Å; S369-Q372 PolarHBondContact OG-N 2.96Å
373	L	87	Confident	90.9	Very high	80 Å²	80	47.2 Å²	47.2	42%	0.419	25%	0.245	S	C	.	.			trans	-71.5	141.6	170.8	-64.2	-179	0	0	0	109.8	A377 L378	L373-A377 HydrophobicContact CB-CB 3.97Å; L373-A377 HydrophobicContact CD1-CB 4.48Å; L373-A377 HydrophobicContact CD2-CB 4.02Å; L373-A377 HydrophobicContact CG-CB 4.37Å; L373-L378 HydrophobicContact CB-CD2 3.88Å; L373-L378 HydrophobicContact CB-CG 3.8Å; L373-L378 HydrophobicContact CD1-CD2 4.22Å
374	N	92.3	Very high	90.9	Very high	19 Å²	19	41.6 Å²	41.6	10%	0.102	21%	0.21	C	C	.	.			trans	-77.6	171.8	170.5	61.4	43.6	0	0	0	111.5	L365 H366 Y367 Y376 A377 L378 Y436	L365-N374 WeakPolarHBondContact O-CB 3.41Å; H366-N374 PolarHBondContact O-ND2 2.92Å; Y367-N374 PolarHBondContact O-ND2 3.47Å; Y367-N374 VanDerWaalsContact O-ND2 3.09Å; N374-Y376 VanDerWaalsContact C-N 3.28Å; N374-Y376 PolarHBondContact O-N 2.99Å; N374-Y376 WeakPolarHBondContact OD1-CB 3.4Å; N374-Y376 PolarHBondContact OD1-N 2.82Å; N374-A377 PolarHBondContact O-N 3.44Å; N374-A377 VanDerWaalsContact O-N 3.15Å; N374-A377 PolarHBondContact OD1-N 3.14Å; N374-L378 WeakPolarHBondContact O-CB 3.34Å; N374-L378 WeakPolarHBondContact O-CG 3.44Å; N374-L378 PolarHBondContact O-N 3.34Å; N374-Y436 PolarHBondContact ND2-OH 2.85Å; N374-Y436 PolarHBondContact OD1-OH 2.83Å
375	A	92.1	Very high	90.6	Very high	20 Å²	20	43.7 Å²	43.7	17%	0.165	22%	0.219	C	C	.	.	H	α-helix	trans	-58.1	-38.4	-175.1	0	0	0	0	0	112.9	L378 A379 V507 F542	A375-L378 PolarHBondContact O-N 3.11Å; A375-A379 WeakPolarHBondContact O-CB 3.49Å; A375-A379 PolarHBondContact O-N 2.88Å; A375-V507 HydrophobicContact CB-CB 3.94Å; A375-V507 HydrophobicContact CB-CG1 3.79Å; A375-F542 HydrophobicContact CB-CD1 3.99Å; A375-F542 HydrophobicContact CB-CE1 3.82Å; A375-F542 HydrophobicContact CB-CZ 4.37Å
376	Y	95.6	Very high	90.5	Very high	1 Å²	1	41.9 Å²	41.9	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-61.2	-50.1	175.2	-74.2	-89.1	0	0	0	112.3	I350 D351 N356 L365 H366 N374 A379 L380 Y436 I477 D479 V507	I350-Y376 HydrophobicContact CG2-CD1 3.74Å; I350-Y376 HydrophobicContact CG2-CE1 4.06Å; D351-Y376 HydrophobicContact CB-CE1 4.18Å; N356-Y376 VanDerWaalsContact CG-OH 3.29Å; N356-Y376 PolarHBondContact ND2-OH 2.7Å; N356-Y376 WeakPolarHBondContact OD1-CE2 3.48Å; N356-Y376 VanDerWaalsContact OD1-CZ 3.28Å; N356-Y376 PolarHBondContact OD1-OH 3.12Å; L365-Y376 HydrophobicContact CB-CD2 4.45Å; L365-Y376 HydrophobicContact CB-CE2 3.88Å; H366-Y376 AromaticContact CE1-CD1 3.99Å; H366-Y376 AromaticContact CE1-CD2 3.54Å; H366-Y376 AromaticContact CE1-CE1 3.84Å; H366-Y376 AromaticContact CE1-CE2 3.35Å; H366-Y376 WeakPolarHBondContact CE1-CE2 3.38Å; H366-Y376 AromaticContact CE1-CG 3.86Å; H366-Y376 AromaticContact CE1-CZ 3.53Å; H366-Y376 AromaticContact ND1-CD2 3.45Å; H366-Y376 WeakPolarHBondContact ND1-CD2 3.44Å; H366-Y376 AromaticContact ND1-CE2 3.62Å; H366-Y376 AromaticContact ND1-CG 3.93Å; H366-Y376 AromaticContact NE2-CE2 3.94Å; N374-Y376 VanDerWaalsContact C-N 3.28Å; N374-Y376 PolarHBondContact O-N 2.99Å; N374-Y376 WeakPolarHBondContact OD1-CB 3.4Å; N374-Y376 PolarHBondContact OD1-N 2.82Å; Y376-A379 PolarHBondContact O-N 3.15Å; Y376-L380 VanDerWaalsContact O-CB 3.3Å; Y376-L380 WeakPolarHBondContact O-CB 2.99Å; Y376-L380 PolarHBondContact O-N 2.95Å; Y376-Y436 WeakPolarHBondContact CB-OH 3.31Å; Y376-I477 HydrophobicContact CD1-CB 3.75Å; Y376-I477 HydrophobicContact CD1-CG2 3.31Å; Y376-I477 HydrophobicContact CE1-CB 3.99Å; Y376-I477 HydrophobicContact CE1-CG2 3.61Å; Y376-I477 WeakPolarHBondContact CE1-O 3.32Å; Y376-I477 HydrophobicContact CG-CG2 4.13Å; Y376-D479 PolarHBondContact OH-N 3.03Å; Y376-V507 HydrophobicContact CD2-CG2 4.07Å; Y376-V507 HydrophobicContact CE1-CG2 4.05Å; Y376-V507 HydrophobicContact CE2-CG2 3.5Å; Y376-V507 VanDerWaalsContact CE2-CG2 3.5Å; Y376-V507 VanDerWaalsContact CZ-CG2 3.47Å
377	A	94	Very high	90.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.6	-39.2	179.2	0	0	0	0	0	111.8	L373 N374 L380 T381 L433 Y436	L373-A377 HydrophobicContact CB-CB 3.97Å; L373-A377 HydrophobicContact CD1-CB 4.48Å; L373-A377 HydrophobicContact CD2-CB 4.02Å; L373-A377 HydrophobicContact CG-CB 4.37Å; N374-A377 PolarHBondContact O-N 3.44Å; N374-A377 VanDerWaalsContact O-N 3.15Å; N374-A377 PolarHBondContact OD1-N 3.14Å; A377-L380 PolarHBondContact O-N 2.96Å; A377-T381 WeakPolarHBondContact O-CB 3.29Å; A377-T381 PolarHBondContact O-N 3.36Å; A377-T381 PolarHBondContact O-OG1 3.21Å; A377-L433 HydrophobicContact CB-CD2 3.73Å; A377-Y436 HydrophobicContact CB-CE1 4.48Å
378	L	91.5	Very high	90.1	Very high	39 Å²	39	39.8 Å²	39.8	20%	0.204	20%	0.203	C	C	.	.	H	α-helix	trans	-62.8	-47.8	175.8	-74.9	171.8	0	0	0	112.3	L373 N374 A375 T381 A382 F542 M556	L373-L378 HydrophobicContact CB-CD2 3.88Å; L373-L378 HydrophobicContact CB-CG 3.8Å; L373-L378 HydrophobicContact CD1-CD2 4.22Å; N374-L378 WeakPolarHBondContact O-CB 3.34Å; N374-L378 WeakPolarHBondContact O-CG 3.44Å; N374-L378 PolarHBondContact O-N 3.34Å; A375-L378 PolarHBondContact O-N 3.11Å; L378-T381 PolarHBondContact O-N 2.62Å; L378-A382 VanDerWaalsContact O-CB 3.32Å; L378-A382 WeakPolarHBondContact O-CB 3.02Å; L378-A382 PolarHBondContact O-N 3.41Å; L378-F542 HydrophobicContact CB-CE2 4.01Å; L378-F542 HydrophobicContact CB-CZ 3.7Å; L378-F542 HydrophobicContact CD1-CZ 4Å; L378-M556 HydrophobicContact CB-SD 3.9Å; L378-M556 HydrophobicContact CD2-SD 4.27Å
379	A	92.7	Very high	90.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61	-46.3	176.7	0	0	0	0	0	111.5	A375 Y376 T381 A382 V383 I477 V505 F542	A375-A379 WeakPolarHBondContact O-CB 3.49Å; A375-A379 PolarHBondContact O-N 2.88Å; Y376-A379 PolarHBondContact O-N 3.15Å; A379-T381 PolarHBondContact O-N 2.69Å; A379-A382 PolarHBondContact O-N 3.48Å; A379-V383 WeakPolarHBondContact O-CG2 3.31Å; A379-V383 PolarHBondContact O-N 3.36Å; A379-V383 VanDerWaalsContact O-N 3.13Å; A379-I477 HydrophobicContact CB-CD1 4.12Å; A379-I477 HydrophobicContact CB-CG2 4.47Å; A379-V505 HydrophobicContact CB-CG1 3.86Å; A379-F542 HydrophobicContact CB-CD2 3.96Å; A379-F542 HydrophobicContact CB-CE2 4.05Å
380	L	94.3	Very high	90.5	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-58.2	-47.7	175.7	173.9	58.8	0	0	0	111.9	V348 Y376 A377 G384 I429 I432 L433 L475 I477	V348-L380 HydrophobicContact CB-CD1 4.45Å; V348-L380 HydrophobicContact CG1-CD1 3.95Å; V348-L380 HydrophobicContact CG2-CD1 3.71Å; Y376-L380 VanDerWaalsContact O-CB 3.3Å; Y376-L380 WeakPolarHBondContact O-CB 2.99Å; Y376-L380 PolarHBondContact O-N 2.95Å; A377-L380 PolarHBondContact O-N 2.96Å; L380-G384 WeakPolarHBondContact O-CA 3.45Å; L380-G384 PolarHBondContact O-N 3.35Å; L380-I429 HydrophobicContact CG-CG2 4.29Å; L380-I432 HydrophobicContact CD1-CD1 4.34Å; L380-I432 HydrophobicContact CD1-CG2 4.25Å; L380-I432 HydrophobicContact CD2-CB 4.13Å; L380-I432 HydrophobicContact CD2-CG2 3.51Å; L380-L433 HydrophobicContact CD2-CD2 3.76Å; L380-L433 HydrophobicContact CD2-CG 4.05Å; L380-L475 HydrophobicContact CD1-CD2 4.42Å; L380-I477 HydrophobicContact CB-CD1 4.05Å
381	T	91.6	Very high	90.8	Very high	25 Å²	25	32.9 Å²	32.9	15%	0.153	16%	0.157	C	C	.	.	H	α-helix	trans	-64.3	-43.4	178.3	-62	0	0	0	0	111.6	A377 L378 A379 V383 E385	A377-T381 WeakPolarHBondContact O-CB 3.29Å; A377-T381 PolarHBondContact O-N 3.36Å; A377-T381 PolarHBondContact O-OG1 3.21Å; L378-T381 PolarHBondContact O-N 2.62Å; A379-T381 PolarHBondContact O-N 2.69Å; T381-V383 PolarHBondContact O-N 2.88Å; T381-E385 HydrophobicContact CG2-CG 3.9Å; T381-E385 WeakPolarHBondContact CG2-OE1 3.08Å; T381-E385 VanDerWaalsContact O-CB 3.22Å; T381-E385 WeakPolarHBondContact O-CB 3.4Å; T381-E385 VanDerWaalsContact O-CG 3.27Å; T381-E385 WeakPolarHBondContact O-CG 3.44Å; T381-E385 PolarHBondContact O-N 3.41Å
382	A	89.1	Confident	91	Very high	10 Å²	10	26.5 Å²	26.5	8%	0.083	14%	0.143	C	C	.	.	H	α-helix	trans	-60.3	-45.8	-177.8	0	0	0	0	0	112.4	L378 A379 M556 L559 A560	L378-A382 VanDerWaalsContact O-CB 3.32Å; L378-A382 WeakPolarHBondContact O-CB 3.02Å; L378-A382 PolarHBondContact O-N 3.41Å; A379-A382 PolarHBondContact O-N 3.48Å; A382-M556 HydrophobicContact CB-CB 4.22Å; A382-M556 HydrophobicContact CB-SD 4.01Å; A382-L559 HydrophobicContact CB-CD2 3.99Å; A382-A560 HydrophobicContact CB-CB 4.4Å; A382-A560 WeakPolarHBondContact O-CB 3.37Å
383	V	91.4	Very high	91.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-77.7	-49.1	179.7	-178.8	0	0	0	0	110.8	F346 A379 T381 E385 I386 I387 L475 V563 L564	F346-V383 HydrophobicContact CE2-CG1 4.1Å; F346-V383 HydrophobicContact CZ-CG1 3.96Å; A379-V383 WeakPolarHBondContact O-CG2 3.31Å; A379-V383 PolarHBondContact O-N 3.36Å; A379-V383 VanDerWaalsContact O-N 3.13Å; T381-V383 PolarHBondContact O-N 2.88Å; V383-E385 VanDerWaalsContact C-N 3.32Å; V383-E385 PolarHBondContact O-N 3.01Å; V383-I386 PolarHBondContact O-N 3.07Å; V383-I387 WeakPolarHBondContact O-CG2 3.31Å; V383-I387 PolarHBondContact O-N 3.31Å; V383-I387 VanDerWaalsContact O-N 3.14Å; V383-L475 HydrophobicContact CB-CD2 4.11Å; V383-L475 HydrophobicContact CG1-CD2 4.21Å; V383-L475 HydrophobicContact CG2-CD2 4.37Å; V383-V563 HydrophobicContact CG1-CG1 4.24Å; V383-V563 HydrophobicContact CG2-CB 4.21Å; V383-V563 HydrophobicContact CG2-CG1 3.48Å; V383-V563 VanDerWaalsContact CG2-CG1 3.48Å; V383-V563 HydrophobicContact CG2-CG2 4.49Å; V383-L564 HydrophobicContact CG1-CD2 3.98Å; V383-L564 HydrophobicContact CG1-CG 4.4Å
384	G	92.4	Very high	91.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61	-37.9	-174.9	0	0	0	0	0	113.3	L380 I386 Q388	L380-G384 WeakPolarHBondContact O-CA 3.45Å; L380-G384 PolarHBondContact O-N 3.35Å; G384-I386 PolarHBondContact O-N 2.89Å; G384-Q388 VanDerWaalsContact O-CB 3.25Å; G384-Q388 WeakPolarHBondContact O-CB 3.5Å; G384-Q388 WeakPolarHBondContact O-CG 3.24Å; G384-Q388 PolarHBondContact O-N 2.8Å
385	E	90.1	Very high	91.7	Very high	52 Å²	52	26.5 Å²	26.5	24%	0.243	14%	0.144	C	C	.	.	H	α-helix	trans	-62.4	-25.8	-178.7	-82.9	-168.5	-178.7	0	0	113.4	K89 T381 V383 Q388	K89-E385 IonicContact NZ-OE1 3.72Å; K89-E385 IonicContact NZ-OE2 3.61Å; K89-E385 PolarHBondContact NZ-OE2 2.89Å; T381-E385 HydrophobicContact CG2-CG 3.9Å; T381-E385 WeakPolarHBondContact CG2-OE1 3.08Å; T381-E385 VanDerWaalsContact O-CB 3.22Å; T381-E385 WeakPolarHBondContact O-CB 3.4Å; T381-E385 VanDerWaalsContact O-CG 3.27Å; T381-E385 WeakPolarHBondContact O-CG 3.44Å; T381-E385 PolarHBondContact O-N 3.41Å; V383-E385 VanDerWaalsContact C-N 3.32Å; V383-E385 PolarHBondContact O-N 3.01Å; E385-Q388 PolarHBondContact O-NE2 3.25Å
386	I	91.7	Very high	91.9	Very high	11 Å²	11	25.6 Å²	25.6	6%	0.056	14%	0.136	C	C	.	.	H	α-helix	trans	-93.4	-54.6	-177.6	-57.6	-175.7	0	0	0	110.1	F86 E87 K89 V383 G384 Q388 H389 A560 L564	F86-I386 WeakPolarHBondContact O-CG2 3.22Å; E87-I386 WeakPolarHBondContact O-CD1 3.49Å; K89-I386 HydrophobicContact CB-CG1 4.21Å; V383-I386 PolarHBondContact O-N 3.07Å; G384-I386 PolarHBondContact O-N 2.89Å; I386-Q388 VanDerWaalsContact C-N 3.29Å; I386-Q388 PolarHBondContact O-N 2.79Å; I386-H389 PolarHBondContact O-N 2.83Å; I386-A560 HydrophobicContact CD1-CB 3.58Å; I386-L564 HydrophobicContact CB-CD1 3.77Å; I386-L564 HydrophobicContact CD1-CD1 4.08Å; I386-L564 HydrophobicContact CG1-CD1 4.46Å; I386-L564 HydrophobicContact CG2-CD1 3.71Å
387	I	91.8	Very high	92	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-67.9	-27.2	-171.6	-159.4	164	0	0	0	113.2	I344 F346 V383 H389 Y390 V473 L564	I344-I387 HydrophobicContact CG2-CD1 3.89Å; I344-I387 HydrophobicContact CG2-CG1 3.9Å; F346-I387 HydrophobicContact CB-CG2 4.18Å; F346-I387 HydrophobicContact CD1-CG2 3.69Å; F346-I387 HydrophobicContact CD2-CD1 3.75Å; F346-I387 HydrophobicContact CD2-CG1 4.43Å; F346-I387 HydrophobicContact CD2-CG2 3.72Å; F346-I387 HydrophobicContact CE1-CG2 3.86Å; F346-I387 HydrophobicContact CE2-CD1 4.19Å; F346-I387 HydrophobicContact CE2-CG2 3.88Å; F346-I387 HydrophobicContact CG-CD1 4.42Å; F346-I387 HydrophobicContact CG-CG2 3.6Å; F346-I387 HydrophobicContact CZ-CG2 3.94Å; V383-I387 WeakPolarHBondContact O-CG2 3.31Å; V383-I387 PolarHBondContact O-N 3.31Å; V383-I387 VanDerWaalsContact O-N 3.14Å; I387-H389 PolarHBondContact O-N 2.81Å; I387-Y390 WeakPolarHBondContact O-CD2 3.41Å; I387-Y390 PolarHBondContact O-N 3.03Å; I387-V473 HydrophobicContact CD1-CB 3.88Å; I387-V473 HydrophobicContact CD1-CG1 3.74Å; I387-V473 HydrophobicContact CD1-CG2 4.07Å; I387-L564 HydrophobicContact CD1-CD2 4.11Å
388	Q	92.4	Very high	92.2	Very high	36 Å²	36	26.8 Å²	26.8	17%	0.168	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-14.5	179.5	68.4	175.4	-42	0	0	114.8	G384 E385 I386 Y390 K394 F396	G384-Q388 VanDerWaalsContact O-CB 3.25Å; G384-Q388 WeakPolarHBondContact O-CB 3.5Å; G384-Q388 WeakPolarHBondContact O-CG 3.24Å; G384-Q388 PolarHBondContact O-N 2.8Å; E385-Q388 PolarHBondContact O-NE2 3.25Å; I386-Q388 VanDerWaalsContact C-N 3.29Å; I386-Q388 PolarHBondContact O-N 2.79Å; Q388-Y390 VanDerWaalsContact C-N 3.28Å; Q388-K394 PolarHBondContact O-NZ 3.02Å; Q388-F396 HydrophobicContact CB-CE2 3.88Å; Q388-F396 HydrophobicContact CB-CZ 3.53Å
389	H	90.6	Very high	92.5	Very high	30 Å²	30	25.1 Å²	25.1	14%	0.139	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-13.7	178.5	-70	-62.5	0	0	0	113	T118 I386 I387	T118-H389 PolarHBondContact OG1-NE2 3.03Å; I386-H389 PolarHBondContact O-N 2.83Å; I387-H389 PolarHBondContact O-N 2.81Å
390	Y	91.8	Very high	92.8	Very high	9 Å²	9	25.1 Å²	25.1	4%	0.035	14%	0.135	C	C	.	.	S	Bend	trans	-103.9	4.5	-179.7	-53.2	-87.9	0	0	0	112.6	Y84 F86 V123 F334 I338 I344 I387 Q388	Y84-Y390 WeakPolarHBondContact CE2-OH 3.15Å; Y84-Y390 WeakPolarHBondContact OH-CE1 3.47Å; Y84-Y390 VanDerWaalsContact OH-CZ 3.31Å; Y84-Y390 PolarHBondContact OH-OH 2.82Å; F86-Y390 HydrophobicContact CD2-CD2 4.39Å; F86-Y390 HydrophobicContact CD2-CE1 4.21Å; F86-Y390 AromaticContact CD2-CE2 3.77Å; F86-Y390 HydrophobicContact CD2-CE2 3.77Å; F86-Y390 AromaticContact CD2-CZ 3.67Å; F86-Y390 AromaticContact CE2-CD2 3.74Å; F86-Y390 HydrophobicContact CE2-CD2 3.74Å; F86-Y390 HydrophobicContact CE2-CE1 4.35Å; F86-Y390 AromaticContact CE2-CE2 3.53Å; F86-Y390 HydrophobicContact CE2-CE2 3.53Å; F86-Y390 HydrophobicContact CE2-CG 4.26Å; F86-Y390 AromaticContact CE2-CZ 3.87Å; V123-Y390 HydrophobicContact CG2-CE1 3.96Å; F334-Y390 HydrophobicContact CE1-CD1 4.49Å; F334-Y390 HydrophobicContact CE1-CE1 4.13Å; F334-Y390 HydrophobicContact CZ-CD1 4.29Å; F334-Y390 HydrophobicContact CZ-CE1 4.33Å; I338-Y390 HydrophobicContact CD1-CD1 4.09Å; I338-Y390 HydrophobicContact CG1-CD1 4.18Å; I338-Y390 HydrophobicContact CG2-CD1 4.05Å; I344-Y390 HydrophobicContact CD1-CG 4.05Å; I344-Y390 PolarHBondContact N-O 3.49Å; I387-Y390 WeakPolarHBondContact O-CD2 3.41Å; I387-Y390 PolarHBondContact O-N 3.03Å; Q388-Y390 VanDerWaalsContact C-N 3.28Å
391	D	89.7	Confident	92.9	Very high	9 Å²	9	25 Å²	25	5%	0.048	14%	0.135	C	C	.	.			trans	-109.8	126.9	170.1	-169.6	-53.4	0	0	0	108.4	I344 D393 K394 F396	I344-D391 WeakPolarHBondContact O-CB 3.36Å; D391-D393 PolarHBondContact OD1-N 3Å; D391-D393 VanDerWaalsContact OD1-N 3.09Å; D391-K394 PolarHBondContact OD1-N 2.84Å; D391-F396 HydrophobicContact CB-CE1 3.6Å; D391-F396 HydrophobicContact CB-CZ 4.13Å
392	S	85.6	Confident	93.1	Very high	79 Å²	79	23.9 Å²	23.9	55%	0.552	13%	0.127	S	C	*	.	S	Bend	trans	-80	-32.3	-171.7	70.3	0	0	0	0	113.9	Q343	Q343-S392 PolarHBondContact NE2-OG 3.1Å; Q343-S392 PolarHBondContact OE1-OG 3.37Å
393	D	88.2	Confident	93.5	Very high	98 Å²	98	23.4 Å²	23.4	52%	0.524	12%	0.123	S	C	.	.	S	Bend	trans	-96	-18.5	-177.5	70.3	21.1	0	0	0	112.4	D391 M395	D391-D393 PolarHBondContact OD1-N 3Å; D391-D393 VanDerWaalsContact OD1-N 3.09Å; D393-M395 HydrophobicContact CB-CG 4.33Å; D393-M395 PolarHBondContact O-N 3.4Å; D393-M395 WeakPolarHBondContact OD1-CB 3.16Å; D393-M395 PolarHBondContact OD1-N 2.89Å
394	K	93	Very high	93.8	Very high	70 Å²	70	25.9 Å²	25.9	30%	0.304	13%	0.134	S	C	.	.			trans	58	29.8	-179.8	-55.5	175.9	175.5	-70.4	0	112.3	Q388 D391 F396 G428	Q388-K394 PolarHBondContact O-NZ 3.02Å; D391-K394 PolarHBondContact OD1-N 2.84Å; K394-F396 HydrophobicContact CB-CE2 4.12Å; K394-F396 HydrophobicContact CB-CZ 4.04Å; K394-F396 HydrophobicContact CG-CZ 4.46Å; K394-G428 PolarHBondContact O-N 3.04Å
395	M	95.5	Very high	93.9	Very high	67 Å²	67	28 Å²	28	33%	0.33	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	88	179.9	-68.4	-60.5	-58.8	0	0	110.3	D393 P397 S425 C426 C427	D393-M395 HydrophobicContact CB-CG 4.33Å; D393-M395 PolarHBondContact O-N 3.4Å; D393-M395 WeakPolarHBondContact OD1-CB 3.16Å; D393-M395 PolarHBondContact OD1-N 2.89Å; M395-P397 WeakPolarHBondContact O-CD 3.24Å; M395-S425 PolarHBondContact O-OG 3.42Å; M395-C426 CarbonylContact C-O 3.58Å; M395-C426 WeakPolarHBondContact CA-O 3.3Å; M395-C427 HydrophobicContact SD-CB 3.92Å
396	F	96.7	Very high	93.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	120	-169.1	-55.2	-55.9	0	0	0	112.4	F346 Q388 D391 K394 A398 S425 C426 I429 I432	F346-F396 HydrophobicContact CB-CD1 3.71Å; F346-F396 HydrophobicContact CB-CE1 3.9Å; F346-F396 HydrophobicContact CD1-CD1 4.17Å; F346-F396 HydrophobicContact CD1-CG 4.33Å; F346-F396 HydrophobicContact CG-CD1 4.45Å; F346-F396 WeakPolarHBondContact O-CD1 3.45Å; Q388-F396 HydrophobicContact CB-CE2 3.88Å; Q388-F396 HydrophobicContact CB-CZ 3.53Å; D391-F396 HydrophobicContact CB-CE1 3.6Å; D391-F396 HydrophobicContact CB-CZ 4.13Å; K394-F396 HydrophobicContact CB-CE2 4.12Å; K394-F396 HydrophobicContact CB-CZ 4.04Å; K394-F396 HydrophobicContact CG-CZ 4.46Å; F396-A398 PolarHBondContact O-N 2.96Å; F396-S425 CarbonylContact O-C 3.57Å; F396-S425 WeakPolarHBondContact O-CA 3.19Å; F396-C426 PolarHBondContact N-O 2.91Å; F396-C426 PolarHBondContact O-N 2.99Å; F396-I429 HydrophobicContact CD2-CD1 4.12Å; F396-I429 HydrophobicContact CE2-CD1 4.07Å; F396-I432 HydrophobicContact CB-CD1 3.66Å; F396-I432 HydrophobicContact CB-CG1 4.24Å; F396-I432 HydrophobicContact CD2-CD1 4.05Å; F396-I432 HydrophobicContact CG-CD1 4.2Å
397	P	97.6	Very high	93.8	Very high	26 Å²	26	35.2 Å²	35.2	17%	0.169	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	125.9	169.3	-25.4	36.3	0	0	0	111	F346 T347 V348 M395 P424	F346-P397 WeakPolarHBondContact O-CD 3.47Å; T347-P397 WeakPolarHBondContact CA-O 3.4Å; T347-P397 HydrophobicContact CG2-CB 4Å; V348-P397 PolarHBondContact N-O 3.25Å; M395-P397 WeakPolarHBondContact O-CD 3.24Å; P397-P424 HydrophobicContact CB-CB 4.47Å; P397-P424 HydrophobicContact CB-CG 4.07Å
398	A	98.1	Very high	93.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	114.7	179.7	0	0	0	0	0	110.1	F396 L417 P424 I432	F396-A398 PolarHBondContact O-N 2.96Å; A398-L417 HydrophobicContact CB-CB 4.18Å; A398-L417 HydrophobicContact CB-CD1 4.06Å; A398-L417 HydrophobicContact CB-CG 4.24Å; A398-L417 PolarHBondContact O-N 3.45Å; A398-P424 PolarHBondContact N-O 2.69Å; A398-I432 HydrophobicContact CB-CG1 4.29Å; A398-I432 HydrophobicContact CB-CG2 3.93Å
399	L	98.4	Very high	93.7	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.021	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	147.2	-175	-57	174.8	0	0	0	110.6	T347 V348 A349 I350 E414 F415 P424 V454	T347-L399 HydrophobicContact CG2-CD1 4.29Å; V348-L399 PolarHBondContact O-N 2.81Å; A349-L399 CarbonylContact C-O 3.58Å; A349-L399 VanDerWaalsContact CA-O 3.31Å; A349-L399 WeakPolarHBondContact CA-O 3.33Å; I350-L399 PolarHBondContact N-O 2.9Å; L399-E414 HydrophobicContact CD1-CG 4.28Å; L399-E414 HydrophobicContact CD2-CG 4.37Å; L399-F415 CarbonylContact C-O 3.57Å; L399-F415 VanDerWaalsContact CA-O 3.28Å; L399-F415 WeakPolarHBondContact CA-O 3.14Å; L399-P424 HydrophobicContact CD2-CB 4.01Å; L399-V454 HydrophobicContact CD1-CG1 4.44Å
400	G	97.9	Very high	93.8	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	157.2	165.5	0	0	0	0	0	110.6	I350 E414 F415	I350-G400 CarbonylContact O-C 3.54Å; I350-G400 VanDerWaalsContact O-CA 3.27Å; I350-G400 WeakPolarHBondContact O-CA 3.32Å; G400-E414 CarbonylContact O-C 3.31Å; G400-E414 VanDerWaalsContact O-CA 3.27Å; G400-E414 WeakPolarHBondContact O-CA 3.44Å; G400-F415 PolarHBondContact N-O 2.89Å; G400-F415 WeakPolarHBondContact O-CD1 3.35Å; G400-F415 WeakPolarHBondContact O-CE1 3.37Å; G400-F415 PolarHBondContact O-N 3.48Å
401	F	97.6	Very high	94	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	152.8	174.3	62.6	-89.2	0	0	0	112.4	A349 I350 D351 F352 H413 T449 F451 V454 I476	A349-F401 HydrophobicContact CB-CD1 4.17Å; A349-F401 HydrophobicContact CB-CE1 4.11Å; I350-F401 VanDerWaalsContact C-CE1 3.41Å; I350-F401 VanDerWaalsContact O-CD1 3.28Å; I350-F401 WeakPolarHBondContact O-CD1 3.15Å; I350-F401 PolarHBondContact O-N 3.05Å; D351-F401 VanDerWaalsContact CA-CZ 3.48Å; D351-F401 HydrophobicContact CB-CE1 4.15Å; D351-F401 HydrophobicContact CB-CE2 3.78Å; D351-F401 HydrophobicContact CB-CZ 3.49Å; D351-F401 VanDerWaalsContact CB-CZ 3.49Å; F352-F401 PolarHBondContact N-O 3.04Å; F401-H413 WeakPolarHBondContact CB-O 3.33Å; F401-T449 HydrophobicContact CE2-CG2 3.94Å; F401-F451 AromaticContact CE2-CD1 3.82Å; F401-F451 HydrophobicContact CE2-CD1 3.82Å; F401-F451 AromaticContact CE2-CE1 3.61Å; F401-F451 HydrophobicContact CE2-CE1 3.61Å; F401-F451 AromaticContact CZ-CD1 3.87Å; F401-F451 HydrophobicContact CZ-CD1 3.87Å; F401-F451 AromaticContact CZ-CE1 3.52Å; F401-F451 HydrophobicContact CZ-CE1 3.52Å; F401-V454 HydrophobicContact CB-CG1 4.4Å; F401-V454 HydrophobicContact CD1-CG1 4.35Å; F401-I476 HydrophobicContact CE1-CG2 4.06Å; F401-I476 HydrophobicContact CZ-CG2 3.99Å
402	G	96.4	Very high	94.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.28	C	S	.	.	S	Bend	trans	84	24.5	174.8	0	0	0	0	0	114.9	F352 S412 Y446 G447	F352-G402 VanDerWaalsContact O-O 3.14Å; G402-S412 PolarHBondContact N-O 3.32Å; G402-Y446 CarbonylContact O-C 3.44Å; G402-Y446 VanDerWaalsContact O-CA 3.3Å; G402-Y446 WeakPolarHBondContact O-CA 3.48Å; G402-Y446 PolarHBondContact O-N 3.29Å; G402-G447 PolarHBondContact O-N 2.98Å
403	A	96.9	Very high	94.7	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	160.7	-179.9	0	0	0	0	0	112.5	F352 V411 S412 F415 V443 Q444	F352-A403 HydrophobicContact CB-CB 3.85Å; A403-V411 WeakPolarHBondContact O-CA 3.38Å; A403-S412 PolarHBondContact N-O 3.24Å; A403-S412 PolarHBondContact O-N 2.93Å; A403-F415 HydrophobicContact CB-CE1 3.63Å; A403-F415 HydrophobicContact CB-CZ 3.83Å; A403-V443 HydrophobicContact CB-CB 4Å; A403-V443 HydrophobicContact CB-CG2 3.89Å; A403-Q444 CarbonylContact C-O 3.58Å; A403-Q444 WeakPolarHBondContact CA-O 3.16Å
404	K	97.1	Very high	95.1	Very high	53 Å²	53	46.5 Å²	46.5	23%	0.23	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	127.1	162.9	-73.4	178.6	177	177.1	0	109.7	G409 R410 V411 Q444 Y446	K404-G409 WeakPolarHBondContact CD-O 3.22Å; K404-G409 VanDerWaalsContact CG-O 3.28Å; K404-G409 WeakPolarHBondContact CG-O 3.48Å; K404-R410 WeakPolarHBondContact CA-O 3.42Å; K404-V411 HydrophobicContact CG-CG2 3.86Å; K404-Q444 HydrophobicContact CB-CB 4.15Å; K404-Q444 PolarHBondContact N-O 2.88Å; K404-Q444 PolarHBondContact O-N 3.09Å; K404-Y446 HydrophobicContact CD-CD1 4.43Å; K404-Y446 HydrophobicContact CD-CD2 4.14Å; K404-Y446 HydrophobicContact CD-CG 4.08Å; K404-Y446 HydrophobicContact CG-CD1 4.09Å; K404-Y446 HydrophobicContact CG-CD2 4.46Å; K404-Y446 HydrophobicContact CG-CG 3.9Å
405	L	94.5	Very high	95.3	Very high	44 Å²	44	43.5 Å²	43.5	23%	0.23	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	143.5	-178.5	-55.9	-178.4	0	0	0	111.5	G409 R410 F415 V443	L405-G409 WeakPolarHBondContact O-CA 3.28Å; L405-G409 PolarHBondContact O-N 3.08Å; L405-R410 PolarHBondContact N-O 3.09Å; L405-R410 PolarHBondContact O-N 2.69Å; L405-F415 HydrophobicContact CD1-CB 3.72Å; L405-F415 HydrophobicContact CD1-CG 4.18Å; L405-F415 HydrophobicContact CD2-CB 4.12Å; L405-F415 HydrophobicContact CD2-CD1 3.8Å; L405-F415 HydrophobicContact CD2-CD2 3.84Å; L405-F415 HydrophobicContact CD2-CE1 4.12Å; L405-F415 HydrophobicContact CD2-CE2 4.17Å; L405-F415 HydrophobicContact CD2-CG 3.65Å; L405-F415 HydrophobicContact CD2-CZ 4.29Å; L405-F415 HydrophobicContact CG-CG 4.47Å; L405-V443 HydrophobicContact CD2-CB 4.4Å; L405-V443 HydrophobicContact CD2-CG1 3.67Å
406	P	91.1	Very high	95.4	Very high	79 Å²	79	40.8 Å²	40.8	51%	0.513	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	158.7	168.1	31.3	-34.5	0	0	0	111.2
407	P	90	Very high	95.5	Very high	136 Å²	136	41 Å²	41	88%	0.883	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	cis	-89.1	-14.9	-2.7	35	-34.9	0	0	0	114.1
408	D	89.8	Confident	95.4	Very high	119 Å²	119	41.8 Å²	41.8	64%	0.636	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-8	-170.4	64.9	-12.7	0	0	0	113.8	R410	D408-R410 VanDerWaalsContact C-N 3.25Å; D408-R410 PolarHBondContact O-N 3.48Å; D408-R410 WeakPolarHBondContact OD1-CB 3.48Å; D408-R410 PolarHBondContact OD1-N 3.05Å
409	G	90.9	Very high	95.2	Very high	32 Å²	32	44.9 Å²	44.9	33%	0.33	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	23.2	-179.3	0	0	0	0	0	112.6	K404 L405 V411	K404-G409 WeakPolarHBondContact CD-O 3.22Å; K404-G409 VanDerWaalsContact CG-O 3.28Å; K404-G409 WeakPolarHBondContact CG-O 3.48Å; L405-G409 WeakPolarHBondContact O-CA 3.28Å; L405-G409 PolarHBondContact O-N 3.08Å; G409-V411 PolarHBondContact O-N 3.33Å
410	R	93.4	Very high	94.9	Very high	182 Å²	182	48 Å²	48	69%	0.687	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.6	131	178.6	-179.5	176.7	175.1	-175.8	-1.5	110.3	K404 L405 D408 S412	K404-R410 WeakPolarHBondContact CA-O 3.42Å; L405-R410 PolarHBondContact N-O 3.09Å; L405-R410 PolarHBondContact O-N 2.69Å; D408-R410 VanDerWaalsContact C-N 3.25Å; D408-R410 PolarHBondContact O-N 3.48Å; D408-R410 WeakPolarHBondContact OD1-CB 3.48Å; D408-R410 PolarHBondContact OD1-N 3.05Å; R410-S412 PolarHBondContact O-N 3.34Å
411	V	95.3	Very high	94.6	Very high	49 Å²	49	54.9 Å²	54.9	30%	0.297	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	127.2	172.9	-176.2	0	0	0	0	109	A403 K404 G409 Y446	A403-V411 WeakPolarHBondContact O-CA 3.38Å; K404-V411 HydrophobicContact CG-CG2 3.86Å; G409-V411 PolarHBondContact O-N 3.33Å; V411-Y446 HydrophobicContact CB-CD1 4.33Å; V411-Y446 HydrophobicContact CG1-CD1 3.92Å; V411-Y446 HydrophobicContact CG1-CE1 4.39Å; V411-Y446 HydrophobicContact CG2-CD1 3.45Å; V411-Y446 VanDerWaalsContact CG2-CD1 3.45Å; V411-Y446 HydrophobicContact CG2-CE1 3.49Å; V411-Y446 VanDerWaalsContact CG2-CE1 3.49Å
412	S	95.9	Very high	94.4	Very high	25 Å²	25	63.8 Å²	63.8	18%	0.175	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.4	174	-165.4	0	0	0	0	111.3	G402 A403 R410 E414	G402-S412 PolarHBondContact N-O 3.32Å; A403-S412 PolarHBondContact N-O 3.24Å; A403-S412 PolarHBondContact O-N 2.93Å; R410-S412 PolarHBondContact O-N 3.34Å; S412-E414 PolarHBondContact OG-N 3.3Å; S412-E414 PolarHBondContact OG-O 3.24Å
413	H	95.3	Very high	94.3	Very high	45 Å²	45	67.3 Å²	67.3	21%	0.208	37%	0.369	C	S	.	.	S	Bend	trans	-101.8	10.6	172.1	-60.6	-68.5	0	0	0	112.2	F401 P448 N450 P453	F401-H413 WeakPolarHBondContact CB-O 3.33Å; H413-P448 PolarHBondContact CE1-O 2.87Å; H413-P448 PolarHBondContact ND1-O 2.94Å; H413-N450 HydrophobicContact CB-CB 4.26Å; H413-N450 PolarHBondContact CE1-ND2 3.31Å; H413-N450 VanDerWaalsContact CE1-ND2 3.34Å; H413-N450 PolarHBondContact ND1-ND2 3.27Å; H413-N450 PolarHBondContact NE2-ND2 3.28Å; H413-P453 HydrophobicContact CB-CB 4.36Å; H413-P453 HydrophobicContact CB-CG 3.81Å
414	E	96.2	Very high	94.3	Very high	46 Å²	46	68.5 Å²	68.5	22%	0.215	38%	0.377	C	S	.	.	S	Bend	trans	-165.6	122.7	171.5	-180	-176.8	112.5	0	0	108.9	L399 G400 S412 P453 V454 H457	L399-E414 HydrophobicContact CD1-CG 4.28Å; L399-E414 HydrophobicContact CD2-CG 4.37Å; G400-E414 CarbonylContact O-C 3.31Å; G400-E414 VanDerWaalsContact O-CA 3.27Å; G400-E414 WeakPolarHBondContact O-CA 3.44Å; S412-E414 PolarHBondContact OG-N 3.3Å; S412-E414 PolarHBondContact OG-O 3.24Å; E414-P453 HydrophobicContact CB-CB 4.4Å; E414-V454 HydrophobicContact CB-CG1 4.31Å; E414-V454 HydrophobicContact CG-CG1 4.24Å; E414-H457 VanDerWaalsContact CD-ND1 3.33Å; E414-H457 IonicContact OE1-CE1 3.97Å; E414-H457 IonicContact OE1-CG 3.31Å; E414-H457 IonicContact OE1-ND1 2.88Å; E414-H457 PolarHBondContact OE1-ND1 2.91Å; E414-H457 WeakPolarHBondContact OE2-CB 3.42Å; E414-H457 IonicContact OE2-CG 3.46Å; E414-H457 IonicContact OE2-ND1 2.76Å
415	F	97.1	Very high	94.3	Very high	6 Å²	6	67.2 Å²	67.2	3%	0.026	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	146.7	174.3	59.8	-89.9	0	0	0	111.6	F352 L399 G400 A403 L405 L417 S439 V443	F352-F415 HydrophobicContact CB-CZ 4.26Å; F352-F415 HydrophobicContact CD1-CZ 4.38Å; F352-F415 HydrophobicContact CD2-CZ 4.08Å; F352-F415 HydrophobicContact CG-CZ 4.01Å; L399-F415 CarbonylContact C-O 3.57Å; L399-F415 VanDerWaalsContact CA-O 3.28Å; L399-F415 WeakPolarHBondContact CA-O 3.14Å; G400-F415 PolarHBondContact N-O 2.89Å; G400-F415 WeakPolarHBondContact O-CD1 3.35Å; G400-F415 WeakPolarHBondContact O-CE1 3.37Å; G400-F415 PolarHBondContact O-N 3.48Å; A403-F415 HydrophobicContact CB-CE1 3.63Å; A403-F415 HydrophobicContact CB-CZ 3.83Å; L405-F415 HydrophobicContact CD1-CB 3.72Å; L405-F415 HydrophobicContact CD1-CG 4.18Å; L405-F415 HydrophobicContact CD2-CB 4.12Å; L405-F415 HydrophobicContact CD2-CD1 3.8Å; L405-F415 HydrophobicContact CD2-CD2 3.84Å; L405-F415 HydrophobicContact CD2-CE1 4.12Å; L405-F415 HydrophobicContact CD2-CE2 4.17Å; L405-F415 HydrophobicContact CD2-CG 3.65Å; L405-F415 HydrophobicContact CD2-CZ 4.29Å; L405-F415 HydrophobicContact CG-CG 4.47Å; F415-L417 HydrophobicContact CD2-CD2 4.4Å; F415-L417 HydrophobicContact CE2-CD2 3.82Å; F415-L417 PolarHBondContact O-N 3.21Å; F415-S439 WeakPolarHBondContact CE2-OG 3.31Å; F415-V443 HydrophobicContact CE2-CG1 4.05Å; F415-V443 HydrophobicContact CZ-CG1 4.31Å
416	P	97.4	Very high	94.4	Very high	11 Å²	11	65.5 Å²	65.5	7%	0.071	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	127	177.4	29.6	-36.7	0	0	0	110.9	N418 G419 N420 Q421 P424	P416-N418 PolarHBondContact O-N 2.96Å; P416-G419 PolarHBondContact O-N 3.44Å; P416-N420 VanDerWaalsContact CB-O 3.31Å; P416-N420 WeakPolarHBondContact CB-O 3.45Å; P416-N420 WeakPolarHBondContact CG-O 3.42Å; P416-Q421 VanDerWaalsContact CD-OE1 3.31Å; P416-P424 HydrophobicContact CB-CB 3.96Å
417	L	97.8	Very high	94.6	Very high	5 Å²	5	66.1 Å²	66.1	3%	0.026	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-31.4	178.4	-63.5	-171.9	0	0	0	112.1	I350 F352 A398 F415 G419 A435	I350-L417 HydrophobicContact CD1-CD1 3.81Å; I350-L417 HydrophobicContact CG1-CD1 4.28Å; F352-L417 HydrophobicContact CE2-CD2 3.58Å; F352-L417 HydrophobicContact CZ-CD2 3.8Å; A398-L417 HydrophobicContact CB-CB 4.18Å; A398-L417 HydrophobicContact CB-CD1 4.06Å; A398-L417 HydrophobicContact CB-CG 4.24Å; A398-L417 PolarHBondContact O-N 3.45Å; F415-L417 HydrophobicContact CD2-CD2 4.4Å; F415-L417 HydrophobicContact CE2-CD2 3.82Å; F415-L417 PolarHBondContact O-N 3.21Å; L417-G419 PolarHBondContact O-N 3.34Å; L417-A435 HydrophobicContact CB-CB 3.92Å
418	N	95.8	Very high	94.8	Very high	41 Å²	41	60.2 Å²	60.2	22%	0.219	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-6.3	177	71.7	3.2	0	0	0	113.2	P416 N420 N423 S425 A435	P416-N418 PolarHBondContact O-N 2.96Å; N418-N420 VanDerWaalsContact C-N 3.31Å; N418-N420 PolarHBondContact O-N 3.36Å; N418-N420 WeakPolarHBondContact OD1-CB 3.4Å; N418-N420 PolarHBondContact OD1-N 2.92Å; N418-N423 PolarHBondContact ND2-O 2.86Å; N418-S425 PolarHBondContact ND2-O 3.49Å; N418-S425 VanDerWaalsContact ND2-O 3.12Å; N418-A435 HydrophobicContact CB-CB 4.3Å
419	G	94	Very high	95.1	Very high	66 Å²	66	55 Å²	55	68%	0.68	31%	0.306	S	S	*	.	S	Bend	trans	78.8	3.3	-178.7	0	0	0	0	0	115.5	P416 L417	P416-G419 PolarHBondContact O-N 3.44Å; L417-G419 PolarHBondContact O-N 3.34Å
420	N	93.7	Very high	95.3	Very high	70 Å²	70	59.8 Å²	59.8	37%	0.374	33%	0.325	S	S	.	.			trans	-101.6	108	179.6	-176.2	-11.6	0	0	0	111	P416 N418 E422 N423	P416-N420 VanDerWaalsContact CB-O 3.31Å; P416-N420 WeakPolarHBondContact CB-O 3.45Å; P416-N420 WeakPolarHBondContact CG-O 3.42Å; N418-N420 VanDerWaalsContact C-N 3.31Å; N418-N420 PolarHBondContact O-N 3.36Å; N418-N420 WeakPolarHBondContact OD1-CB 3.4Å; N418-N420 PolarHBondContact OD1-N 2.92Å; N420-E422 VanDerWaalsContact C-N 3.31Å; N420-E422 PolarHBondContact O-N 3.44Å; N420-E422 PolarHBondContact OD1-N 3.42Å; N420-N423 WeakPolarHBondContact CB-O 3.45Å; N420-N423 CarbonylContact O-C 3.59Å; N420-N423 VanDerWaalsContact O-C 3.3Å; N420-N423 PolarHBondContact O-N 3.16Å; N420-N423 PolarHBondContact OD1-N 2.88Å; N420-N423 VanDerWaalsContact OD1-N 3.12Å
421	Q	91	Very high	95.4	Very high	143 Å²	143	52 Å²	52	67%	0.668	30%	0.301	S	S	*	.	S	Bend	trans	-69.8	-26.3	-178.4	-162.7	66.6	36.1	0	0	113.5	P416	P416-Q421 VanDerWaalsContact CD-OE1 3.31Å
422	E	93.1	Very high	95.5	Very high	188 Å²	188	49.7 Å²	49.7	88%	0.879	29%	0.287	S	S	*	.	S	Bend	trans	-82.5	-30.1	179	-62.3	-177.1	172.4	0	0	111.7	N420	N420-E422 VanDerWaalsContact C-N 3.31Å; N420-E422 PolarHBondContact O-N 3.44Å; N420-E422 PolarHBondContact OD1-N 3.42Å
423	N	94.1	Very high	95.6	Very high	74 Å²	74	49.4 Å²	49.4	40%	0.396	28%	0.283	S	S	.	.			trans	-142.1	95.6	-179.8	-175.4	8	0	0	0	111.7	N418 N420 S425	N418-N423 PolarHBondContact ND2-O 2.86Å; N420-N423 WeakPolarHBondContact CB-O 3.45Å; N420-N423 CarbonylContact O-C 3.59Å; N420-N423 VanDerWaalsContact O-C 3.3Å; N420-N423 PolarHBondContact O-N 3.16Å; N420-N423 PolarHBondContact OD1-N 2.88Å; N420-N423 VanDerWaalsContact OD1-N 3.12Å; N423-S425 PolarHBondContact O-N 3.04Å; N423-S425 VanDerWaalsContact OD1-CB 3.29Å; N423-S425 WeakPolarHBondContact OD1-CB 3.31Å; N423-S425 PolarHBondContact OD1-N 3.33Å; N423-S425 VanDerWaalsContact OD1-N 3.1Å; N423-S425 PolarHBondContact OD1-OG 2.84Å
424	P	96.2	Very high	95.6	Very high	25 Å²	25	52.9 Å²	52.9	16%	0.162	30%	0.3	C	S	.	.			trans	-74.8	-2.4	178.7	31.8	-36.4	0	0	0	113.8	P397 A398 L399 P416	P397-P424 HydrophobicContact CB-CB 4.47Å; P397-P424 HydrophobicContact CB-CG 4.07Å; A398-P424 PolarHBondContact N-O 2.69Å; L399-P424 HydrophobicContact CD2-CB 4.01Å; P416-P424 HydrophobicContact CB-CB 3.96Å
425	S	96.8	Very high	95.7	Very high	25 Å²	25	50.8 Å²	50.8	18%	0.175	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	140.3	-172.6	-62.8	0	0	0	0	113.6	M395 F396 N418 N423	M395-S425 PolarHBondContact O-OG 3.42Å; F396-S425 CarbonylContact O-C 3.57Å; F396-S425 WeakPolarHBondContact O-CA 3.19Å; N418-S425 PolarHBondContact ND2-O 3.49Å; N418-S425 VanDerWaalsContact ND2-O 3.12Å; N423-S425 PolarHBondContact O-N 3.04Å; N423-S425 VanDerWaalsContact OD1-CB 3.29Å; N423-S425 WeakPolarHBondContact OD1-CB 3.31Å; N423-S425 PolarHBondContact OD1-N 3.33Å; N423-S425 VanDerWaalsContact OD1-N 3.1Å; N423-S425 PolarHBondContact OD1-OG 2.84Å
426	C	97	Very high	95.7	Very high	8 Å²	8	50.5 Å²	50.5	5%	0.054	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	143.5	176.2	-62	0	0	0	0	109.9	M395 F396 G428 I432	M395-C426 CarbonylContact C-O 3.58Å; M395-C426 WeakPolarHBondContact CA-O 3.3Å; F396-C426 PolarHBondContact N-O 2.91Å; F396-C426 PolarHBondContact O-N 2.99Å; C426-G428 PolarHBondContact O-N 3.11Å; C426-I432 HydrophobicContact CB-CG1 3.85Å
427	C	95.8	Very high	95.6	Very high	93 Å²	93	52.3 Å²	52.3	63%	0.628	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	110	178.3	-176.5	0	0	0	0	110.4	M395 G431	M395-C427 HydrophobicContact SD-CB 3.92Å; C427-G431 WeakPolarHBondContact O-CA 3.45Å; C427-G431 PolarHBondContact O-N 3.19Å; C427-G431 VanDerWaalsContact O-N 3.16Å
428	G	94.9	Very high	95.5	Very high	12 Å²	12	57.8 Å²	57.8	12%	0.124	32%	0.317	C	S	.	.	H	α-helix	trans	65.8	177.6	178.7	0	0	0	0	0	114.2	K394 C426 D430 G431 I432	K394-G428 PolarHBondContact O-N 3.04Å; C426-G428 PolarHBondContact O-N 3.11Å; G428-D430 VanDerWaalsContact C-N 3.32Å; G428-D430 PolarHBondContact O-N 3.44Å; G428-G431 PolarHBondContact O-N 2.87Å; G428-I432 WeakPolarHBondContact O-CG1 3.49Å; G428-I432 PolarHBondContact O-N 3.33Å
429	I	94.9	Very high	95.5	Very high	8 Å²	8	56.1 Å²	56.1	4%	0.041	31%	0.308	C	S	.	.	H	α-helix	trans	-66.1	-36.1	177.5	-55.9	-51.7	0	0	0	111.6	F346 L380 F396 G431 I432 L433	F346-I429 HydrophobicContact CE1-CD1 4.27Å; L380-I429 HydrophobicContact CG-CG2 4.29Å; F396-I429 HydrophobicContact CD2-CD1 4.12Å; F396-I429 HydrophobicContact CE2-CD1 4.07Å; I429-G431 VanDerWaalsContact C-N 3.3Å; I429-G431 PolarHBondContact O-N 3.11Å; I429-I432 HydrophobicContact CD1-CD1 4.04Å; I429-I432 PolarHBondContact O-N 3.44Å; I429-I432 VanDerWaalsContact O-N 3.16Å; I429-L433 HydrophobicContact CG2-CD1 4.3Å; I429-L433 WeakPolarHBondContact O-CG 3.37Å; I429-L433 PolarHBondContact O-N 3.23Å
430	D	94.7	Very high	95.6	Very high	134 Å²	134	53.4 Å²	53.4	72%	0.717	28%	0.279	S	S	*	.	H	α-helix	trans	-61.2	-39.1	176.1	-67	-31.6	0	0	0	111.7	G428 L433 E434	G428-D430 VanDerWaalsContact C-N 3.32Å; G428-D430 PolarHBondContact O-N 3.44Å; D430-L433 PolarHBondContact O-N 2.93Å; D430-E434 PolarHBondContact O-N 3.07Å
431	G	96.8	Very high	95.6	Very high	18 Å²	18	59.1 Å²	59.1	19%	0.186	30%	0.295	C	S	.	.	H	α-helix	trans	-64.9	-38.6	174.5	0	0	0	0	0	112.9	C427 G428 I429 E434 A435	C427-G431 WeakPolarHBondContact O-CA 3.45Å; C427-G431 PolarHBondContact O-N 3.19Å; C427-G431 VanDerWaalsContact O-N 3.16Å; G428-G431 PolarHBondContact O-N 2.87Å; I429-G431 VanDerWaalsContact C-N 3.3Å; I429-G431 PolarHBondContact O-N 3.11Å; G431-E434 PolarHBondContact O-N 2.94Å; G431-A435 WeakPolarHBondContact O-CB 3.16Å; G431-A435 PolarHBondContact O-N 3.07Å
432	I	97.7	Very high	95.7	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64.1	-45.6	174.2	-56.6	173.2	0	0	0	110.2	V348 L380 F396 A398 C426 G428 I429 E434 A435 Y436	V348-I432 HydrophobicContact CG2-CD1 3.85Å; L380-I432 HydrophobicContact CD1-CD1 4.34Å; L380-I432 HydrophobicContact CD1-CG2 4.25Å; L380-I432 HydrophobicContact CD2-CB 4.13Å; L380-I432 HydrophobicContact CD2-CG2 3.51Å; F396-I432 HydrophobicContact CB-CD1 3.66Å; F396-I432 HydrophobicContact CB-CG1 4.24Å; F396-I432 HydrophobicContact CD2-CD1 4.05Å; F396-I432 HydrophobicContact CG-CD1 4.2Å; A398-I432 HydrophobicContact CB-CG1 4.29Å; A398-I432 HydrophobicContact CB-CG2 3.93Å; C426-I432 HydrophobicContact CB-CG1 3.85Å; G428-I432 WeakPolarHBondContact O-CG1 3.49Å; G428-I432 PolarHBondContact O-N 3.33Å; I429-I432 HydrophobicContact CD1-CD1 4.04Å; I429-I432 PolarHBondContact O-N 3.44Å; I429-I432 VanDerWaalsContact O-N 3.16Å; I432-E434 VanDerWaalsContact C-N 3.35Å; I432-E434 PolarHBondContact O-N 3.3Å; I432-A435 PolarHBondContact O-N 3.2Å; I432-Y436 VanDerWaalsContact O-CB 3.31Å; I432-Y436 WeakPolarHBondContact O-CB 3.45Å; I432-Y436 PolarHBondContact O-N 2.85Å
433	L	96.4	Very high	95.7	Very high	19 Å²	19	48.1 Å²	48.1	10%	0.099	25%	0.25	C	S	.	.	H	α-helix	trans	-60.9	-43.2	178.5	-74.4	169.5	0	0	0	111.6	A377 L380 I429 D430 Y436 H437	A377-L433 HydrophobicContact CB-CD2 3.73Å; L380-L433 HydrophobicContact CD2-CD2 3.76Å; L380-L433 HydrophobicContact CD2-CG 4.05Å; I429-L433 HydrophobicContact CG2-CD1 4.3Å; I429-L433 WeakPolarHBondContact O-CG 3.37Å; I429-L433 PolarHBondContact O-N 3.23Å; D430-L433 PolarHBondContact O-N 2.93Å; L433-Y436 PolarHBondContact O-N 2.77Å; L433-H437 WeakPolarHBondContact O-CB 3.48Å; L433-H437 PolarHBondContact O-CD2 3.4Å; L433-H437 PolarHBondContact O-N 2.85Å
434	E	96.1	Very high	95.9	Very high	118 Å²	118	50.2 Å²	50.2	55%	0.551	26%	0.258	S	S	*	.	H	α-helix	trans	-61.7	-46.6	175.5	-165.6	-168.2	163	0	0	111.5	D430 G431 I432 H437 R438	D430-E434 PolarHBondContact O-N 3.07Å; G431-E434 PolarHBondContact O-N 2.94Å; I432-E434 VanDerWaalsContact C-N 3.35Å; I432-E434 PolarHBondContact O-N 3.3Å; E434-H437 PolarHBondContact O-N 2.93Å; E434-R438 WeakPolarHBondContact O-CB 3.19Å; E434-R438 PolarHBondContact O-N 3.14Å; E434-R438 IonicContact OE1-CZ 2.87Å; E434-R438 IonicContact OE1-NH2 3.64Å; E434-R438 PolarHBondContact OE1-NH2 3.37Å
435	A	97.8	Very high	95.9	Very high	3 Å²	3	50.2 Å²	50.2	3%	0.025	26%	0.256	C	S	.	.	H	α-helix	trans	-62	-43.7	177.8	0	0	0	0	0	112	L417 N418 G431 I432 R438 S439	L417-A435 HydrophobicContact CB-CB 3.92Å; N418-A435 HydrophobicContact CB-CB 4.3Å; G431-A435 WeakPolarHBondContact O-CB 3.16Å; G431-A435 PolarHBondContact O-N 3.07Å; I432-A435 PolarHBondContact O-N 3.2Å; A435-R438 PolarHBondContact O-N 3.25Å; A435-S439 VanDerWaalsContact O-CB 3.29Å; A435-S439 WeakPolarHBondContact O-CB 3.47Å; A435-S439 PolarHBondContact O-N 3.27Å
436	Y	97.8	Very high	95.8	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-57.3	-51.5	174.2	164.5	-116.8	0	0	0	111.9	I350 F352 H366 N374 Y376 A377 I432 L433 R438 S439 L440	I350-Y436 HydrophobicContact CD1-CD2 3.63Å; I350-Y436 HydrophobicContact CD1-CE2 4.25Å; I350-Y436 HydrophobicContact CD1-CG 3.95Å; I350-Y436 HydrophobicContact CG2-CD2 4.03Å; I350-Y436 HydrophobicContact CG2-CE2 3.83Å; F352-Y436 HydrophobicContact CE2-CD2 4.08Å; F352-Y436 HydrophobicContact CE2-CE2 4.36Å; F352-Y436 AromaticContact CZ-CD2 3.7Å; F352-Y436 HydrophobicContact CZ-CD2 3.7Å; F352-Y436 HydrophobicContact CZ-CE2 4.07Å; H366-Y436 AromaticContact ND1-CE2 3.72Å; H366-Y436 AromaticContact ND1-CZ 3.7Å; H366-Y436 PolarHBondContact ND1-OH 3.47Å; N374-Y436 PolarHBondContact ND2-OH 2.85Å; N374-Y436 PolarHBondContact OD1-OH 2.83Å; Y376-Y436 WeakPolarHBondContact CB-OH 3.31Å; A377-Y436 HydrophobicContact CB-CE1 4.48Å; I432-Y436 VanDerWaalsContact O-CB 3.31Å; I432-Y436 WeakPolarHBondContact O-CB 3.45Å; I432-Y436 PolarHBondContact O-N 2.85Å; L433-Y436 PolarHBondContact O-N 2.77Å; Y436-R438 VanDerWaalsContact C-N 3.3Å; Y436-R438 PolarHBondContact O-N 2.94Å; Y436-S439 PolarHBondContact O-N 2.87Å; Y436-L440 HydrophobicContact CD1-CD1 4.48Å; Y436-L440 HydrophobicContact CD2-CD1 4.14Å; Y436-L440 HydrophobicContact CD2-CG 4.24Å; Y436-L440 HydrophobicContact CE1-CD1 3.95Å; Y436-L440 HydrophobicContact CE2-CD1 3.52Å; Y436-L440 HydrophobicContact CE2-CD2 4.33Å; Y436-L440 HydrophobicContact CE2-CG 3.87Å; Y436-L440 VanDerWaalsContact CZ-CD1 3.44Å; Y436-L440 PolarHBondContact O-N 2.81Å
437	H	95.2	Very high	95.6	Very high	49 Å²	49	54.4 Å²	54.4	23%	0.227	27%	0.272	C	S	.	.	H	α-helix	trans	-65	-32.4	178.9	-72.1	-47.5	0	0	0	113.5	M368 L433 E434 R441	M368-H437 HydrophobicContact SD-CB 4.35Å; L433-H437 WeakPolarHBondContact O-CB 3.48Å; L433-H437 PolarHBondContact O-CD2 3.4Å; L433-H437 PolarHBondContact O-N 2.85Å; E434-H437 PolarHBondContact O-N 2.93Å; H437-R441 WeakPolarHBondContact O-CG 3.25Å; H437-R441 PolarHBondContact O-NE 2.83Å
438	R	95.4	Very high	95.5	Very high	119 Å²	119	53 Å²	53	45%	0.449	26%	0.262	S	S	.	.	H	α-helix	trans	-69.3	-47.2	174	-171	-176	-59.4	147.6	1.3	110.5	E434 A435 Y436 L440 R441	E434-R438 WeakPolarHBondContact O-CB 3.19Å; E434-R438 PolarHBondContact O-N 3.14Å; E434-R438 IonicContact OE1-CZ 2.87Å; E434-R438 IonicContact OE1-NH2 3.64Å; E434-R438 PolarHBondContact OE1-NH2 3.37Å; A435-R438 PolarHBondContact O-N 3.25Å; Y436-R438 VanDerWaalsContact C-N 3.3Å; Y436-R438 PolarHBondContact O-N 2.94Å; R438-L440 VanDerWaalsContact C-N 3.35Å; R438-L440 PolarHBondContact O-N 3.35Å; R438-R441 PolarHBondContact O-N 3.25Å; R438-R441 VanDerWaalsContact O-N 3.13Å
439	S	96.1	Very high	95.5	Very high	6 Å²	6	52.9 Å²	52.9	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-41.6	-179.2	-166.5	0	0	0	0	112.2	F415 A435 Y436 R441 T442 V443	F415-S439 WeakPolarHBondContact CE2-OG 3.31Å; A435-S439 VanDerWaalsContact O-CB 3.29Å; A435-S439 WeakPolarHBondContact O-CB 3.47Å; A435-S439 PolarHBondContact O-N 3.27Å; Y436-S439 PolarHBondContact O-N 2.87Å; S439-R441 PolarHBondContact O-N 2.83Å; S439-T442 PolarHBondContact O-N 2.89Å; S439-T442 PolarHBondContact O-OG1 2.87Å; S439-T442 VanDerWaalsContact O-OG1 3.05Å; S439-V443 WeakPolarHBondContact O-CG2 3.43Å; S439-V443 PolarHBondContact O-N 3.18Å
440	L	95.3	Very high	95.5	Very high	10 Å²	10	53.6 Å²	53.6	5%	0.052	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.9	176.1	-81.7	175.4	0	0	0	114.5	F352 P359 H366 M368 Y436 R438 L445	F352-L440 HydrophobicContact CD1-CD2 3.74Å; F352-L440 HydrophobicContact CD1-CG 4.44Å; F352-L440 HydrophobicContact CE1-CB 4.3Å; F352-L440 HydrophobicContact CE1-CD2 3.41Å; F352-L440 VanDerWaalsContact CE1-CD2 3.41Å; F352-L440 HydrophobicContact CE1-CG 3.62Å; F352-L440 HydrophobicContact CZ-CD2 4.18Å; F352-L440 HydrophobicContact CZ-CG 4.09Å; P359-L440 HydrophobicContact CG-CD2 4Å; H366-L440 HydrophobicContact CB-CD1 4.03Å; H366-L440 HydrophobicContact CB-CD2 3.8Å; M368-L440 HydrophobicContact CE-CB 3.98Å; M368-L440 HydrophobicContact CE-CD1 4.49Å; M368-L440 HydrophobicContact CG-CD1 4.31Å; M368-L440 HydrophobicContact SD-CB 4.37Å; M368-L440 HydrophobicContact SD-CD1 4.28Å; Y436-L440 HydrophobicContact CD1-CD1 4.48Å; Y436-L440 HydrophobicContact CD2-CD1 4.14Å; Y436-L440 HydrophobicContact CD2-CG 4.24Å; Y436-L440 HydrophobicContact CE1-CD1 3.95Å; Y436-L440 HydrophobicContact CE2-CD1 3.52Å; Y436-L440 HydrophobicContact CE2-CD2 4.33Å; Y436-L440 HydrophobicContact CE2-CG 3.87Å; Y436-L440 VanDerWaalsContact CZ-CD1 3.44Å; Y436-L440 PolarHBondContact O-N 2.81Å; R438-L440 VanDerWaalsContact C-N 3.35Å; R438-L440 PolarHBondContact O-N 3.35Å; L440-L445 HydrophobicContact CD2-CD2 4.26Å
441	R	93.8	Very high	95.7	Very high	190 Å²	190	47.3 Å²	47.3	72%	0.717	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-16.2	178.4	-60.4	176	-155.6	-136.6	3.3	113	M368 H437 R438 S439	M368-R441 HydrophobicContact CE-CG 4.01Å; H437-R441 WeakPolarHBondContact O-CG 3.25Å; H437-R441 PolarHBondContact O-NE 2.83Å; R438-R441 PolarHBondContact O-N 3.25Å; R438-R441 VanDerWaalsContact O-N 3.13Å; S439-R441 PolarHBondContact O-N 2.83Å
442	T	92.9	Very high	95.7	Very high	81 Å²	81	47 Å²	47	50%	0.497	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-33.5	-171.3	57.9	0	0	0	0	112.8	S439	S439-T442 PolarHBondContact O-N 2.89Å; S439-T442 PolarHBondContact O-OG1 2.87Å; S439-T442 VanDerWaalsContact O-OG1 3.05Å
443	V	95.1	Very high	95.7	Very high	18 Å²	18	49 Å²	49	11%	0.109	24%	0.238	C	C	.	.	S	Bend	trans	-89.4	156.1	-180	-49.9	0	0	0	0	111.6	F352 A403 L405 F415 S439	F352-V443 HydrophobicContact CD1-CG2 3.43Å; F352-V443 VanDerWaalsContact CD1-CG2 3.43Å; F352-V443 HydrophobicContact CE1-CG2 3.84Å; F352-V443 HydrophobicContact CG-CG2 4.37Å; A403-V443 HydrophobicContact CB-CB 4Å; A403-V443 HydrophobicContact CB-CG2 3.89Å; L405-V443 HydrophobicContact CD2-CB 4.4Å; L405-V443 HydrophobicContact CD2-CG1 3.67Å; F415-V443 HydrophobicContact CE2-CG1 4.05Å; F415-V443 HydrophobicContact CZ-CG1 4.31Å; S439-V443 WeakPolarHBondContact O-CG2 3.43Å; S439-V443 PolarHBondContact O-N 3.18Å
444	Q	96.5	Very high	95.8	Very high	119 Å²	119	48.1 Å²	48.1	56%	0.556	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101	120.2	170.5	173.9	-178.7	26.8	0	0	109.3	A403 K404 Y446	A403-Q444 CarbonylContact C-O 3.58Å; A403-Q444 WeakPolarHBondContact CA-O 3.16Å; K404-Q444 HydrophobicContact CB-CB 4.15Å; K404-Q444 PolarHBondContact N-O 2.88Å; K404-Q444 PolarHBondContact O-N 3.09Å; Q444-Y446 PolarHBondContact O-N 3.19Å
445	L	96.4	Very high	95.9	Very high	25 Å²	25	42.6 Å²	42.6	13%	0.131	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	134.2	176.8	-52.7	-175	0	0	0	111	F352 N356 G357 P359 L440	F352-L445 HydrophobicContact CB-CD2 3.77Å; F352-L445 HydrophobicContact CD1-CD2 3.69Å; F352-L445 HydrophobicContact CG-CD2 4.13Å; F352-L445 WeakPolarHBondContact O-CA 3.38Å; F352-L445 WeakPolarHBondContact O-CB 3.38Å; F352-L445 WeakPolarHBondContact O-CD2 3.33Å; N356-L445 HydrophobicContact CB-CD1 4.41Å; G357-L445 WeakPolarHBondContact O-CD1 3.22Å; P359-L445 HydrophobicContact CG-CD1 3.89Å; P359-L445 HydrophobicContact CG-CG 4.38Å; L440-L445 HydrophobicContact CD2-CD2 4.26Å
446	Y	95.6	Very high	95.9	Very high	105 Å²	105	45.3 Å²	45.3	41%	0.412	22%	0.224	S	C	.	.	B	Isolated β-bridge	trans	-149.5	-138.1	-173	-163.6	-112	0	0	0	112.5	F352 T353 A354 G402 K404 V411 Q444	F352-Y446 PolarHBondContact O-N 3.22Å; T353-Y446 CarbonylContact C-O 3.41Å; T353-Y446 WeakPolarHBondContact CA-O 3.28Å; T353-Y446 VanDerWaalsContact CB-O 3.3Å; T353-Y446 WeakPolarHBondContact CB-O 3.09Å; A354-Y446 PolarHBondContact N-O 3.05Å; G402-Y446 CarbonylContact O-C 3.44Å; G402-Y446 VanDerWaalsContact O-CA 3.3Å; G402-Y446 WeakPolarHBondContact O-CA 3.48Å; G402-Y446 PolarHBondContact O-N 3.29Å; K404-Y446 HydrophobicContact CD-CD1 4.43Å; K404-Y446 HydrophobicContact CD-CD2 4.14Å; K404-Y446 HydrophobicContact CD-CG 4.08Å; K404-Y446 HydrophobicContact CG-CD1 4.09Å; K404-Y446 HydrophobicContact CG-CD2 4.46Å; K404-Y446 HydrophobicContact CG-CG 3.9Å; V411-Y446 HydrophobicContact CB-CD1 4.33Å; V411-Y446 HydrophobicContact CG1-CD1 3.92Å; V411-Y446 HydrophobicContact CG1-CE1 4.39Å; V411-Y446 HydrophobicContact CG2-CD1 3.45Å; V411-Y446 VanDerWaalsContact CG2-CD1 3.45Å; V411-Y446 HydrophobicContact CG2-CE1 3.49Å; V411-Y446 VanDerWaalsContact CG2-CE1 3.49Å; Q444-Y446 PolarHBondContact O-N 3.19Å
447	G	92.4	Very high	95.8	Very high	15 Å²	15	47 Å²	47	16%	0.155	23%	0.232	C	C	.	.			trans	179	-175.5	177.3	0	0	0	0	0	111.5	G402	G402-G447 PolarHBondContact O-N 2.98Å
448	P	94.6	Very high	95.9	Very high	63 Å²	63	44.7 Å²	44.7	41%	0.409	22%	0.221	S	C	.	.			cis	-71.9	174	-2.1	29.2	-37.5	0	0	0	115	H413 N450 S483	H413-P448 PolarHBondContact CE1-O 2.87Å; H413-P448 PolarHBondContact ND1-O 2.94Å; P448-N450 PolarHBondContact O-N 3.32Å; P448-S483 WeakPolarHBondContact CB-OG 3.24Å
449	T	94.1	Very high	96.1	Very high	10 Å²	10	39.6 Å²	39.6	6%	0.061	21%	0.205	C	C	.	.			trans	-83.9	101.7	174.8	-45	0	0	0	0	109.7	D351 T353 F401 F451 V481 S483	D351-T449 WeakPolarHBondContact OD2-CG2 3.39Å; T353-T449 HydrophobicContact CG2-CG2 4.38Å; T353-T449 WeakPolarHBondContact CG2-OG1 3.39Å; F401-T449 HydrophobicContact CE2-CG2 3.94Å; T449-F451 HydrophobicContact CG2-CE1 3.84Å; T449-V481 WeakPolarHBondContact CB-O 3.5Å; T449-V481 WeakPolarHBondContact CG2-O 3.3Å; T449-V481 PolarHBondContact OG1-O 3.41Å; T449-S483 PolarHBondContact N-OG 3.42Å; T449-S483 WeakPolarHBondContact O-CB 3.29Å; T449-S483 PolarHBondContact O-N 2.97Å
450	N	95.8	Very high	96.1	Very high	24 Å²	24	46.9 Å²	46.9	13%	0.128	23%	0.231	C	C	.	.			trans	-121.9	120.7	-173.8	-71.1	-9.9	0	0	0	110.9	H413 P448 D484	H413-N450 HydrophobicContact CB-CB 4.26Å; H413-N450 PolarHBondContact CE1-ND2 3.31Å; H413-N450 VanDerWaalsContact CE1-ND2 3.34Å; H413-N450 PolarHBondContact ND1-ND2 3.27Å; H413-N450 PolarHBondContact NE2-ND2 3.28Å; P448-N450 PolarHBondContact O-N 3.32Å; N450-D484 VanDerWaalsContact CA-CG 3.45Å; N450-D484 VanDerWaalsContact CA-OD1 3.31Å; N450-D484 WeakPolarHBondContact CA-OD1 3.35Å; N450-D484 WeakPolarHBondContact CA-OD2 3.28Å; N450-D484 HydrophobicContact CB-CB 4.29Å; N450-D484 VanDerWaalsContact CB-OD2 3.27Å; N450-D484 WeakPolarHBondContact CB-OD2 3.48Å
451	F	97.3	Very high	96	Very high	1 Å²	1	50 Å²	50	0%	0.004	25%	0.248	C	C	.	.			trans	-95.1	-25.6	-180	-66.3	-4.5	0	0	0	113	F401 T449 P453 V454 V455 I476 T478 I482 D484 T488 I504 M515	F401-F451 AromaticContact CE2-CD1 3.82Å; F401-F451 HydrophobicContact CE2-CD1 3.82Å; F401-F451 AromaticContact CE2-CE1 3.61Å; F401-F451 HydrophobicContact CE2-CE1 3.61Å; F401-F451 AromaticContact CZ-CD1 3.87Å; F401-F451 HydrophobicContact CZ-CD1 3.87Å; F401-F451 AromaticContact CZ-CE1 3.52Å; F401-F451 HydrophobicContact CZ-CE1 3.52Å; T449-F451 HydrophobicContact CG2-CE1 3.84Å; F451-P453 VanDerWaalsContact C-N 3.28Å; F451-P453 VanDerWaalsContact O-N 3.15Å; F451-V454 WeakPolarHBondContact O-CG2 3.3Å; F451-V454 PolarHBondContact O-N 2.83Å; F451-V455 HydrophobicContact CB-CG2 4.39Å; F451-V455 WeakPolarHBondContact O-CG2 3.42Å; F451-V455 PolarHBondContact O-N 3.22Å; F451-I476 HydrophobicContact CB-CD1 4.36Å; F451-I476 HydrophobicContact CD1-CG2 4.19Å; F451-I476 HydrophobicContact CD2-CD1 4.09Å; F451-I476 HydrophobicContact CD2-CG2 4.45Å; F451-I476 HydrophobicContact CE1-CG2 3.86Å; F451-I476 HydrophobicContact CE2-CG2 4.11Å; F451-I476 HydrophobicContact CG-CD1 4.16Å; F451-I476 HydrophobicContact CZ-CG2 3.83Å; F451-T478 HydrophobicContact CE1-CG2 4.45Å; F451-T478 HydrophobicContact CE2-CG2 4.46Å; F451-T478 HydrophobicContact CZ-CG2 3.62Å; F451-I482 HydrophobicContact CD2-CD1 3.66Å; F451-I482 HydrophobicContact CD2-CG1 4.04Å; F451-I482 HydrophobicContact CE2-CD1 3.42Å; F451-I482 VanDerWaalsContact CE2-CD1 3.42Å; F451-I482 HydrophobicContact CE2-CG1 3.62Å; F451-I482 HydrophobicContact CZ-CD1 4.23Å; F451-I482 HydrophobicContact CZ-CG1 3.93Å; F451-D484 PolarHBondContact N-OD1 3.45Å; F451-D484 PolarHBondContact N-OD2 2.93Å; F451-T488 HydrophobicContact CB-CG2 3.98Å; F451-T488 HydrophobicContact CD2-CG2 4.42Å; F451-I504 HydrophobicContact CD2-CD1 4.48Å; F451-I504 HydrophobicContact CE2-CD1 4.26Å; F451-I504 HydrophobicContact CE2-CG2 4.3Å; F451-M515 HydrophobicContact CE2-CE 4.48Å; F451-M515 HydrophobicContact CZ-CE 4.31Å
452	A	97.7	Very high	96.2	Very high	11 Å²	11	41.1 Å²	41.1	9%	0.091	22%	0.215	C	C	.	.	H	α-helix	trans	-54.1	-38.7	-174.9	0	0	0	0	0	113.4	T456 D484 Q487 T488 A491	A452-T456 WeakPolarHBondContact O-CB 3.37Å; A452-T456 PolarHBondContact O-N 3.33Å; A452-T456 PolarHBondContact O-OG1 3.31Å; A452-D484 WeakPolarHBondContact CB-OD2 3.34Å; A452-D484 PolarHBondContact N-OD2 3.41Å; A452-Q487 HydrophobicContact CB-CB 3.66Å; A452-T488 PolarHBondContact N-OG1 2.99Å; A452-A491 HydrophobicContact CB-CB 4.48Å
453	P	97.9	Very high	96.4	Very high	44 Å²	44	39.2 Å²	39.2	29%	0.286	21%	0.207	S	C	.	.	H	α-helix	trans	-59.7	-53.8	177.3	-26.3	38.1	0	0	0	113.1	H413 E414 F451 V455 T456 H457	H413-P453 HydrophobicContact CB-CB 4.36Å; H413-P453 HydrophobicContact CB-CG 3.81Å; E414-P453 HydrophobicContact CB-CB 4.4Å; F451-P453 VanDerWaalsContact C-N 3.28Å; F451-P453 VanDerWaalsContact O-N 3.15Å; P453-V455 PolarHBondContact O-N 3.21Å; P453-T456 PolarHBondContact O-N 2.82Å; P453-H457 PolarHBondContact O-N 3.5Å
454	V	97.6	Very high	96.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.8	-39.1	-177.7	-65.4	0	0	0	0	112.2	A349 L399 F401 E414 F451 T456 H457 V458 I476	A349-V454 HydrophobicContact CB-CB 4.15Å; A349-V454 HydrophobicContact CB-CG1 4.15Å; A349-V454 HydrophobicContact CB-CG2 4.14Å; L399-V454 HydrophobicContact CD1-CG1 4.44Å; F401-V454 HydrophobicContact CB-CG1 4.4Å; F401-V454 HydrophobicContact CD1-CG1 4.35Å; E414-V454 HydrophobicContact CB-CG1 4.31Å; E414-V454 HydrophobicContact CG-CG1 4.24Å; F451-V454 WeakPolarHBondContact O-CG2 3.3Å; F451-V454 PolarHBondContact O-N 2.83Å; V454-T456 VanDerWaalsContact C-N 3.35Å; V454-T456 PolarHBondContact O-N 3.21Å; V454-H457 PolarHBondContact O-N 2.79Å; V454-V458 PolarHBondContact O-N 3.46Å; V454-V458 VanDerWaalsContact O-N 3.11Å; V454-I476 HydrophobicContact CG2-CD1 4.31Å
455	V	98.3	Very high	96.3	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-45.3	174.1	175.5	0	0	0	0	110.3	F451 P453 H457 V458 A459 L474 I476 A491 I492 I502	F451-V455 HydrophobicContact CB-CG2 4.39Å; F451-V455 WeakPolarHBondContact O-CG2 3.42Å; F451-V455 PolarHBondContact O-N 3.22Å; P453-V455 PolarHBondContact O-N 3.21Å; V455-H457 VanDerWaalsContact C-N 3.34Å; V455-H457 PolarHBondContact O-N 3.32Å; V455-V458 PolarHBondContact O-N 2.89Å; V455-A459 VanDerWaalsContact O-CB 3.24Å; V455-A459 WeakPolarHBondContact O-CB 3.47Å; V455-A459 PolarHBondContact O-N 3.38Å; V455-L474 HydrophobicContact CG2-CD2 4.08Å; V455-I476 HydrophobicContact CG2-CD1 4.07Å; V455-A491 HydrophobicContact CB-CB 4.14Å; V455-A491 HydrophobicContact CG1-CB 3.74Å; V455-I492 HydrophobicContact CG1-CG1 4.37Å; V455-I502 HydrophobicContact CG1-CD1 3.79Å; V455-I502 HydrophobicContact CG2-CD1 4.19Å
456	T	98.1	Very high	96.2	Very high	61 Å²	61	41.3 Å²	41.3	37%	0.374	23%	0.232	S	C	.	.	H	α-helix	trans	-65.2	-37.1	179.3	-58.7	0	0	0	0	112.1	A452 P453 V454 R460	A452-T456 WeakPolarHBondContact O-CB 3.37Å; A452-T456 PolarHBondContact O-N 3.33Å; A452-T456 PolarHBondContact O-OG1 3.31Å; P453-T456 PolarHBondContact O-N 2.82Å; V454-T456 VanDerWaalsContact C-N 3.35Å; V454-T456 PolarHBondContact O-N 3.21Å; T456-R460 WeakPolarHBondContact O-CB 3.49Å; T456-R460 PolarHBondContact O-N 2.99Å
457	H	96.5	Very high	96.1	Very high	35 Å²	35	41.1 Å²	41.1	16%	0.162	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-53.8	175.9	-177.7	122.3	0	0	0	111.1	E414 P453 V454 V455 A459 R460 N461	E414-H457 VanDerWaalsContact CD-ND1 3.33Å; E414-H457 IonicContact OE1-CE1 3.97Å; E414-H457 IonicContact OE1-CG 3.31Å; E414-H457 IonicContact OE1-ND1 2.88Å; E414-H457 PolarHBondContact OE1-ND1 2.91Å; E414-H457 WeakPolarHBondContact OE2-CB 3.42Å; E414-H457 IonicContact OE2-CG 3.46Å; E414-H457 IonicContact OE2-ND1 2.76Å; P453-H457 PolarHBondContact O-N 3.5Å; V454-H457 PolarHBondContact O-N 2.79Å; V455-H457 VanDerWaalsContact C-N 3.34Å; V455-H457 PolarHBondContact O-N 3.32Å; H457-A459 VanDerWaalsContact C-N 3.32Å; H457-A459 PolarHBondContact O-N 2.91Å; H457-R460 WeakPolarHBondContact O-CB 3.48Å; H457-R460 PolarHBondContact O-N 2.65Å; H457-R460 VanDerWaalsContact O-N 3.16Å; H457-N461 PolarHBondContact CD2-ND2 3.12Å; H457-N461 VanDerWaalsContact CD2-ND2 3.28Å; H457-N461 PolarHBondContact NE2-ND2 2.97Å; H457-N461 PolarHBondContact O-N 3.19Å
458	V	97.6	Very high	96.2	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-39.4	-179.1	179.2	0	0	0	0	110.9	T347 V454 V455 R460 N461 A462 L474 M500	T347-V458 HydrophobicContact CG2-CG2 3.73Å; V454-V458 PolarHBondContact O-N 3.46Å; V454-V458 VanDerWaalsContact O-N 3.11Å; V455-V458 PolarHBondContact O-N 2.89Å; V458-R460 VanDerWaalsContact C-N 3.3Å; V458-R460 PolarHBondContact O-N 3.33Å; V458-N461 PolarHBondContact O-N 3.24Å; V458-N461 VanDerWaalsContact O-N 3.11Å; V458-A462 WeakPolarHBondContact O-CB 3.39Å; V458-A462 PolarHBondContact O-N 2.82Å; V458-L474 HydrophobicContact CB-CB 4.47Å; V458-L474 HydrophobicContact CB-CD2 4.33Å; V458-L474 HydrophobicContact CG1-CB 4.25Å; V458-L474 HydrophobicContact CG2-CB 4.26Å; V458-L474 HydrophobicContact CG2-CD1 4.03Å; V458-L474 HydrophobicContact CG2-CD2 4.07Å; V458-L474 HydrophobicContact CG2-CG 4.34Å; V458-M500 HydrophobicContact CG1-CE 4.31Å
459	A	98.1	Very high	96.2	Very high	12 Å²	12	38.6 Å²	38.6	10%	0.099	22%	0.22	C	C	.	.	H	α-helix	trans	-58.2	-40.8	173.7	0	0	0	0	0	112.5	V455 H457 N461 A462 A463 A495 L498 M500	V455-A459 VanDerWaalsContact O-CB 3.24Å; V455-A459 WeakPolarHBondContact O-CB 3.47Å; V455-A459 PolarHBondContact O-N 3.38Å; H457-A459 VanDerWaalsContact C-N 3.32Å; H457-A459 PolarHBondContact O-N 2.91Å; A459-N461 VanDerWaalsContact C-N 3.32Å; A459-N461 PolarHBondContact O-N 2.98Å; A459-A462 PolarHBondContact O-N 3.14Å; A459-A463 WeakPolarHBondContact O-CB 3.37Å; A459-A463 PolarHBondContact O-N 3.31Å; A459-A495 HydrophobicContact CB-CB 4.12Å; A459-L498 HydrophobicContact CB-CD1 3.9Å; A459-L498 VanDerWaalsContact O-CD1 3.26Å; A459-L498 WeakPolarHBondContact O-CD1 3.41Å; A459-M500 WeakPolarHBondContact CA-SD 3.48Å; A459-M500 HydrophobicContact CB-CE 4.38Å; A459-M500 HydrophobicContact CB-SD 3.64Å
460	R	96.8	Very high	96.2	Very high	158 Å²	158	41.3 Å²	41.3	60%	0.596	23%	0.232	S	C	*	.	H	α-helix	trans	-61.8	-41.3	175.8	-171.5	-173.8	-60.3	123.3	3.2	111.7	T456 H457 V458 A463 A464	T456-R460 WeakPolarHBondContact O-CB 3.49Å; T456-R460 PolarHBondContact O-N 2.99Å; H457-R460 WeakPolarHBondContact O-CB 3.48Å; H457-R460 PolarHBondContact O-N 2.65Å; H457-R460 VanDerWaalsContact O-N 3.16Å; V458-R460 VanDerWaalsContact C-N 3.3Å; V458-R460 PolarHBondContact O-N 3.33Å; R460-A463 PolarHBondContact O-N 3.19Å; R460-A464 PolarHBondContact O-N 3.11Å
461	N	93.8	Very high	96.3	Very high	76 Å²	76	40.1 Å²	40.1	41%	0.406	23%	0.226	S	C	.	.	H	α-helix	trans	-68.3	-45.5	178.6	-62.7	-12.9	0	0	0	110.9	H457 V458 A459 A463 A464	H457-N461 PolarHBondContact CD2-ND2 3.12Å; H457-N461 VanDerWaalsContact CD2-ND2 3.28Å; H457-N461 PolarHBondContact NE2-ND2 2.97Å; H457-N461 PolarHBondContact O-N 3.19Å; V458-N461 PolarHBondContact O-N 3.24Å; V458-N461 VanDerWaalsContact O-N 3.11Å; A459-N461 VanDerWaalsContact C-N 3.32Å; A459-N461 PolarHBondContact O-N 2.98Å; N461-A463 VanDerWaalsContact C-N 3.26Å; N461-A463 PolarHBondContact O-N 2.9Å; N461-A464 VanDerWaalsContact O-CB 3.27Å; N461-A464 WeakPolarHBondContact O-CB 3.4Å; N461-A464 PolarHBondContact O-N 3.29Å
462	A	96.9	Very high	96.3	Very high	3 Å²	3	40.4 Å²	40.4	3%	0.025	23%	0.228	C	C	.	.	H	α-helix	trans	-60.8	-34.6	175.3	0	0	0	0	0	112.4	V458 A459 A464 V465 L498 P499 M500	V458-A462 WeakPolarHBondContact O-CB 3.39Å; V458-A462 PolarHBondContact O-N 2.82Å; A459-A462 PolarHBondContact O-N 3.14Å; A462-A464 PolarHBondContact O-N 3.37Å; A462-V465 PolarHBondContact O-N 3.1Å; A462-L498 HydrophobicContact CB-CB 4.37Å; A462-P499 HydrophobicContact CB-CG 4.25Å; A462-P499 WeakPolarHBondContact O-CG 3.43Å; A462-M500 HydrophobicContact CB-CB 4.11Å; A462-M500 HydrophobicContact CB-SD 4.37Å
463	A	97.1	Very high	96.3	Very high	41 Å²	41	39.9 Å²	39.9	34%	0.339	22%	0.224	S	C	.	.	H	α-helix	trans	-67.1	-20.7	175.6	0	0	0	0	0	113.7	A459 R460 N461 Q466 L498	A459-A463 WeakPolarHBondContact O-CB 3.37Å; A459-A463 PolarHBondContact O-N 3.31Å; R460-A463 PolarHBondContact O-N 3.19Å; N461-A463 VanDerWaalsContact C-N 3.26Å; N461-A463 PolarHBondContact O-N 2.9Å; A463-Q466 PolarHBondContact O-NE2 2.9Å; A463-L498 HydrophobicContact CB-CD1 4.04Å; A463-L498 HydrophobicContact CB-CD2 3.88Å
464	A	95.5	Very high	96.3	Very high	82 Å²	82	37.8 Å²	37.8	68%	0.678	21%	0.21	S	C	*	.	H	α-helix	trans	-76.1	-25.6	-178.9	0	0	0	0	0	113	R460 N461 A462	R460-A464 PolarHBondContact O-N 3.11Å; N461-A464 VanDerWaalsContact O-CB 3.27Å; N461-A464 WeakPolarHBondContact O-CB 3.4Å; N461-A464 PolarHBondContact O-N 3.29Å; A462-A464 PolarHBondContact O-N 3.37Å
465	V	93.4	Very high	96.3	Very high	41 Å²	41	37.8 Å²	37.8	25%	0.248	21%	0.21	C	C	.	.			trans	-134.4	99.2	-177.1	-175.3	0	0	0	0	109.4	A462 D467 S469 Q470 P499	A462-V465 PolarHBondContact O-N 3.1Å; V465-D467 WeakPolarHBondContact CG1-OD1 3.37Å; V465-S469 WeakPolarHBondContact CG1-OG 3.16Å; V465-Q470 HydrophobicContact CG1-CB 4.17Å; V465-Q470 HydrophobicContact CG1-CG 4.19Å; V465-P499 WeakPolarHBondContact O-CG 3.1Å
466	Q	94.9	Very high	96.3	Very high	83 Å²	83	37.8 Å²	37.8	39%	0.388	21%	0.21	S	C	.	.			trans	-118.1	9.8	-175.8	-63.3	-179	51.8	0	0	113.3	A463 G468 P499 I580	A463-Q466 PolarHBondContact O-NE2 2.9Å; Q466-G468 PolarHBondContact O-N 3.41Å; Q466-P499 HydrophobicContact CG-CG 4.27Å; Q466-I580 WeakPolarHBondContact O-CD1 3.23Å
467	D	94.6	Very high	96.3	Very high	101 Å²	101	34.9 Å²	34.9	54%	0.54	19%	0.192	S	C	.	.	S	Bend	trans	-77	4.4	-179.4	73	-19	0	0	0	113.9	V465 S469 R583	V465-D467 WeakPolarHBondContact CG1-OD1 3.37Å; D467-S469 VanDerWaalsContact C-N 3.32Å; D467-S469 WeakPolarHBondContact OD1-CB 3.29Å; D467-S469 PolarHBondContact OD1-N 3.15Å; D467-S469 PolarHBondContact OD1-OG 3.02Å; D467-R583 IonicContact OD2-NH1 3.86Å
468	G	93.8	Very high	96.3	Very high	3 Å²	3	33.2 Å²	33.2	3%	0.031	18%	0.184	C	C	.	.	S	Bend	trans	80.8	6.3	-175.5	0	0	0	0	0	114.5	T342 Q466 Q470	T342-G468 WeakPolarHBondContact CG2-O 3.49Å; T342-G468 PolarHBondContact OG1-O 2.91Å; Q466-G468 PolarHBondContact O-N 3.41Å; G468-Q470 VanDerWaalsContact C-N 3.34Å
469	S	94	Very high	96	Very high	22 Å²	22	33.8 Å²	33.8	15%	0.154	19%	0.188	C	C	.	.	S	Bend	trans	-72.9	-27	174.8	60	0	0	0	0	114.7	T342 Q343 V465 D467 R583	T342-S469 WeakPolarHBondContact CA-O 3.34Å; Q343-S469 PolarHBondContact N-O 2.84Å; V465-S469 WeakPolarHBondContact CG1-OG 3.16Å; D467-S469 VanDerWaalsContact C-N 3.32Å; D467-S469 WeakPolarHBondContact OD1-CB 3.29Å; D467-S469 PolarHBondContact OD1-N 3.15Å; D467-S469 PolarHBondContact OD1-OG 3.02Å; S469-R583 VanDerWaalsContact CA-NH1 3.33Å; S469-R583 VanDerWaalsContact CB-NH2 3.33Å
470	Q	95.1	Very high	94.9	Very high	67 Å²	67	33.3 Å²	33.3	31%	0.313	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	139.4	-174.9	-64.4	-179.1	10.8	0	0	109.1	Q343 N345 V465 G468	Q343-Q470 CarbonylContact O-C 3.57Å; Q343-Q470 WeakPolarHBondContact O-CA 3.19Å; N345-Q470 PolarHBondContact ND2-OE1 2.62Å; V465-Q470 HydrophobicContact CG1-CB 4.17Å; V465-Q470 HydrophobicContact CG1-CG 4.19Å; G468-Q470 VanDerWaalsContact C-N 3.34Å
471	Y	97.3	Very high	94.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	122.2	172.2	-166.5	-89.4	0	0	0	108.4	Q343 I344 N345 V473 P499 S501 Q570 L571 Y574	Q343-Y471 PolarHBondContact O-N 3.3Å; I344-Y471 CarbonylContact C-O 3.55Å; I344-Y471 VanDerWaalsContact CA-O 3.31Å; I344-Y471 WeakPolarHBondContact CA-O 3.26Å; N345-Y471 PolarHBondContact N-O 3.17Å; Y471-V473 HydrophobicContact CD1-CG2 4.24Å; Y471-V473 HydrophobicContact CE1-CG2 4.45Å; Y471-P499 HydrophobicContact CD2-CB 3.87Å; Y471-P499 HydrophobicContact CE2-CB 4.35Å; Y471-S501 WeakPolarHBondContact CE1-OG 3.31Å; Y471-S501 PolarHBondContact OH-OG 2.97Å; Y471-Q570 VanDerWaalsContact OH-C 3.25Å; Y471-Q570 PolarHBondContact OH-O 2.8Å; Y471-L571 HydrophobicContact CD1-CB 4.38Å; Y471-L571 HydrophobicContact CD1-CD1 4.08Å; Y471-L571 HydrophobicContact CD1-CG 4.36Å; Y471-L571 HydrophobicContact CD2-CB 4.22Å; Y471-L571 HydrophobicContact CD2-CD1 4.16Å; Y471-L571 HydrophobicContact CD2-CG 3.8Å; Y471-L571 HydrophobicContact CE1-CB 4.22Å; Y471-L571 HydrophobicContact CE2-CB 4.06Å; Y471-L571 HydrophobicContact CE2-CG 4.12Å; Y471-L571 HydrophobicContact CG-CB 4.36Å; Y471-L571 HydrophobicContact CG-CD1 3.74Å; Y471-L571 HydrophobicContact CG-CG 3.91Å; Y471-L571 PolarHBondContact OH-N 2.81Å; Y471-Y574 HydrophobicContact CD2-CD1 4.31Å; Y471-Y574 HydrophobicContact CE2-CD1 4.16Å; Y471-Y574 HydrophobicContact CE2-CG 4.12Å
472	S	97.7	Very high	93.9	Very high	7 Å²	7	27.4 Å²	27.4	5%	0.049	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	133.7	-173.3	-59.8	0	0	0	0	111.4	N345 P499 M500 S501	N345-S472 WeakPolarHBondContact O-CA 3.29Å; S472-P499 PolarHBondContact N-O 3.13Å; S472-M500 CarbonylContact O-C 3.48Å; S472-M500 WeakPolarHBondContact O-CA 3.18Å; S472-S501 PolarHBondContact O-N 3.3Å
473	V	97.6	Very high	93.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	116.3	171.7	177.9	0	0	0	0	108.6	I344 N345 F346 T347 I387 Y471 I503 I567	I344-V473 HydrophobicContact CG2-CB 4.23Å; I344-V473 HydrophobicContact CG2-CG2 3.58Å; N345-V473 PolarHBondContact O-N 2.83Å; F346-V473 HydrophobicContact CD2-CB 4.28Å; F346-V473 HydrophobicContact CD2-CG1 4.17Å; F346-V473 HydrophobicContact CE2-CG1 4.39Å; T347-V473 PolarHBondContact N-O 2.93Å; I387-V473 HydrophobicContact CD1-CB 3.88Å; I387-V473 HydrophobicContact CD1-CG1 3.74Å; I387-V473 HydrophobicContact CD1-CG2 4.07Å; Y471-V473 HydrophobicContact CD1-CG2 4.24Å; Y471-V473 HydrophobicContact CE1-CG2 4.45Å; V473-I503 HydrophobicContact CG1-CD1 3.7Å; V473-I503 HydrophobicContact CG1-CG1 4.28Å; V473-I567 HydrophobicContact CG1-CD1 4.19Å; V473-I567 HydrophobicContact CG2-CD1 4.21Å; V473-I567 HydrophobicContact CG2-CG2 4.13Å
474	L	98.3	Very high	93.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	113.6	175.6	170.1	57.4	0	0	0	109.8	T347 A349 V455 V458 I476 S501 I502 I503	T347-L474 HydrophobicContact CG2-CD1 4.01Å; T347-L474 CarbonylContact O-C 3.5Å; T347-L474 WeakPolarHBondContact O-CA 3.41Å; A349-L474 HydrophobicContact CB-CD1 3.89Å; V455-L474 HydrophobicContact CG2-CD2 4.08Å; V458-L474 HydrophobicContact CB-CB 4.47Å; V458-L474 HydrophobicContact CB-CD2 4.33Å; V458-L474 HydrophobicContact CG1-CB 4.25Å; V458-L474 HydrophobicContact CG2-CB 4.26Å; V458-L474 HydrophobicContact CG2-CD1 4.03Å; V458-L474 HydrophobicContact CG2-CD2 4.07Å; V458-L474 HydrophobicContact CG2-CG 4.34Å; L474-I476 HydrophobicContact CD1-CG1 4.19Å; L474-I476 HydrophobicContact CD2-CD1 4.06Å; L474-I476 HydrophobicContact CD2-CG1 4.08Å; L474-I476 HydrophobicContact CG-CD1 4.37Å; L474-I476 HydrophobicContact CG-CG1 3.86Å; L474-S501 PolarHBondContact N-O 3.38Å; L474-I502 CarbonylContact O-C 3.47Å; L474-I502 WeakPolarHBondContact O-CA 3.49Å; L474-I503 PolarHBondContact O-N 3.25Å
475	L	98	Very high	93.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	116.3	167.9	173	64.1	0	0	0	110.2	F346 T347 V348 A349 L380 V383 I477 I503 V505	F346-L475 HydrophobicContact CE2-CB 3.64Å; F346-L475 HydrophobicContact CE2-CD2 4.37Å; F346-L475 HydrophobicContact CZ-CB 3.78Å; F346-L475 HydrophobicContact CZ-CD2 3.72Å; F346-L475 HydrophobicContact CZ-CG 4.4Å; T347-L475 PolarHBondContact O-N 3.15Å; V348-L475 CarbonylContact C-O 3.56Å; V348-L475 WeakPolarHBondContact CA-O 3.45Å; A349-L475 PolarHBondContact N-O 3.22Å; L380-L475 HydrophobicContact CD1-CD2 4.42Å; V383-L475 HydrophobicContact CB-CD2 4.11Å; V383-L475 HydrophobicContact CG1-CD2 4.21Å; V383-L475 HydrophobicContact CG2-CD2 4.37Å; L475-I477 HydrophobicContact CD1-CG1 4.2Å; L475-I477 HydrophobicContact CD2-CD1 4.08Å; L475-I477 HydrophobicContact CD2-CG1 4.19Å; L475-I477 HydrophobicContact CG-CD1 4.4Å; L475-I477 HydrophobicContact CG-CG1 3.96Å; L475-I503 CarbonylContact C-O 3.55Å; L475-I503 WeakPolarHBondContact CA-O 3.34Å; L475-I503 HydrophobicContact CD1-CB 4.08Å; L475-I503 HydrophobicContact CD1-CG2 3.53Å; L475-V505 HydrophobicContact CD1-CG2 3.75Å
476	I	98.1	Very high	93.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	126.6	170.1	-53.5	-177.7	0	0	0	108.4	A349 F401 F451 V454 V455 L474 I502 I503 I504 V505	A349-I476 HydrophobicContact CB-CG1 4.35Å; A349-I476 WeakPolarHBondContact O-CA 3.46Å; F401-I476 HydrophobicContact CE1-CG2 4.06Å; F401-I476 HydrophobicContact CZ-CG2 3.99Å; F451-I476 HydrophobicContact CB-CD1 4.36Å; F451-I476 HydrophobicContact CD1-CG2 4.19Å; F451-I476 HydrophobicContact CD2-CD1 4.09Å; F451-I476 HydrophobicContact CD2-CG2 4.45Å; F451-I476 HydrophobicContact CE1-CG2 3.86Å; F451-I476 HydrophobicContact CE2-CG2 4.11Å; F451-I476 HydrophobicContact CG-CD1 4.16Å; F451-I476 HydrophobicContact CZ-CG2 3.83Å; V454-I476 HydrophobicContact CG2-CD1 4.31Å; V455-I476 HydrophobicContact CG2-CD1 4.07Å; L474-I476 HydrophobicContact CD1-CG1 4.19Å; L474-I476 HydrophobicContact CD2-CD1 4.06Å; L474-I476 HydrophobicContact CD2-CG1 4.08Å; L474-I476 HydrophobicContact CG-CD1 4.37Å; L474-I476 HydrophobicContact CG-CG1 3.86Å; I476-I502 HydrophobicContact CD1-CG2 4.02Å; I476-I502 HydrophobicContact CG1-CG2 4.39Å; I476-I503 PolarHBondContact N-O 3.37Å; I476-I504 HydrophobicContact CB-CG1 4.39Å; I476-I504 CarbonylContact O-C 3.53Å; I476-I504 WeakPolarHBondContact O-CA 3.5Å; I476-V505 PolarHBondContact O-N 2.82Å
477	I	97.6	Very high	93.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	125.9	172.1	-45.3	174.4	0	0	0	108	A349 D351 Y376 A379 L380 L475 V505 V507	A349-I477 PolarHBondContact O-N 3.21Å; D351-I477 WeakPolarHBondContact CB-O 3.19Å; D351-I477 PolarHBondContact N-O 2.83Å; Y376-I477 HydrophobicContact CD1-CB 3.75Å; Y376-I477 HydrophobicContact CD1-CG2 3.31Å; Y376-I477 HydrophobicContact CE1-CB 3.99Å; Y376-I477 HydrophobicContact CE1-CG2 3.61Å; Y376-I477 WeakPolarHBondContact CE1-O 3.32Å; Y376-I477 HydrophobicContact CG-CG2 4.13Å; A379-I477 HydrophobicContact CB-CD1 4.12Å; A379-I477 HydrophobicContact CB-CG2 4.47Å; L380-I477 HydrophobicContact CB-CD1 4.05Å; L475-I477 HydrophobicContact CD1-CG1 4.2Å; L475-I477 HydrophobicContact CD2-CD1 4.08Å; L475-I477 HydrophobicContact CD2-CG1 4.19Å; L475-I477 HydrophobicContact CG-CD1 4.4Å; L475-I477 HydrophobicContact CG-CG1 3.96Å; I477-V505 WeakPolarHBondContact CA-O 3.19Å; I477-V505 HydrophobicContact CG2-CB 4.46Å; I477-V507 HydrophobicContact CG2-CG1 3.81Å
478	T	96.1	Very high	93.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	157.3	-172.9	-178.9	0	0	0	0	112.4	D351 F451 G480 I504 V505 G506 V507 M515	D351-T478 WeakPolarHBondContact OD2-CB 3.5Å; D351-T478 PolarHBondContact OD2-OG1 3.23Å; F451-T478 HydrophobicContact CE1-CG2 4.45Å; F451-T478 HydrophobicContact CE2-CG2 4.46Å; F451-T478 HydrophobicContact CZ-CG2 3.62Å; T478-G480 PolarHBondContact OG1-N 2.85Å; T478-I504 HydrophobicContact CG2-CG2 4.18Å; T478-V505 PolarHBondContact N-O 3.26Å; T478-V505 VanDerWaalsContact N-O 3.11Å; T478-G506 CarbonylContact O-C 3.58Å; T478-G506 WeakPolarHBondContact O-CA 3.46Å; T478-V507 VanDerWaalsContact O-CG2 3.31Å; T478-V507 WeakPolarHBondContact O-CG2 3.36Å; T478-V507 PolarHBondContact O-N 3.03Å; T478-M515 HydrophobicContact CG2-CE 3.85Å
479	D	91.3	Very high	94	Very high	14 Å²	14	26 Å²	26	8%	0.075	15%	0.151	C	C	.	.	S	Bend	trans	-96.9	5.3	174.2	74.9	-39.3	0	0	0	115.5	S355 N356 L365 Y376 V507 A510	S355-D479 WeakPolarHBondContact CB-OD2 3.3Å; S355-D479 VanDerWaalsContact OG-CG 3.27Å; S355-D479 PolarHBondContact OG-OD1 3.23Å; S355-D479 PolarHBondContact OG-OD2 2.89Å; N356-D479 VanDerWaalsContact CG-CG 3.48Å; N356-D479 PolarHBondContact N-OD2 3.13Å; N356-D479 VanDerWaalsContact N-OD2 3.15Å; N356-D479 VanDerWaalsContact ND2-CG 3.29Å; N356-D479 PolarHBondContact ND2-OD1 2.95Å; N356-D479 VanDerWaalsContact OD1-CB 3.29Å; N356-D479 WeakPolarHBondContact OD1-CB 3.3Å; L365-D479 HydrophobicContact CD1-CB 3.4Å; L365-D479 VanDerWaalsContact CD1-CB 3.4Å; Y376-D479 PolarHBondContact OH-N 3.03Å; D479-V507 WeakPolarHBondContact CA-O 3.42Å; D479-V507 HydrophobicContact CB-CG2 4.19Å; D479-A510 WeakPolarHBondContact O-CB 3.49Å
480	G	74.4	Confident	94.2	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.01	16%	0.156	C	C	.	.	S	Bend	trans	114.7	32.1	146.6	0	0	0	0	0	120.3	T478	T478-G480 PolarHBondContact OG1-N 2.85Å
481	V	79.8	Confident	94.4	Very high	96 Å²	96	24.9 Å²	24.9	58%	0.582	15%	0.145	S	C	*	.			trans	-140.1	108.6	163.9	-178.2	0	0	0	0	110.6	T449 S483	T449-V481 WeakPolarHBondContact CB-O 3.5Å; T449-V481 WeakPolarHBondContact CG2-O 3.3Å; T449-V481 PolarHBondContact OG1-O 3.41Å; V481-S483 PolarHBondContact O-N 3.15Å
482	I	89.8	Confident	94.4	Very high	15 Å²	15	25 Å²	25	8%	0.077	15%	0.146	C	C	.	.			trans	-76.4	123.8	176.2	-52.3	179.3	0	0	0	109.4	F451 D484 M485 M515 L518	F451-I482 HydrophobicContact CD2-CD1 3.66Å; F451-I482 HydrophobicContact CD2-CG1 4.04Å; F451-I482 HydrophobicContact CE2-CD1 3.42Å; F451-I482 VanDerWaalsContact CE2-CD1 3.42Å; F451-I482 HydrophobicContact CE2-CG1 3.62Å; F451-I482 HydrophobicContact CZ-CD1 4.23Å; F451-I482 HydrophobicContact CZ-CG1 3.93Å; I482-D484 WeakPolarHBondContact CG2-OD1 3.4Å; I482-M485 HydrophobicContact CB-CE 4.37Å; I482-M485 HydrophobicContact CD1-CE 4.14Å; I482-M515 HydrophobicContact CD1-CE 4Å; I482-M515 HydrophobicContact CD1-CG 4.32Å; I482-M515 HydrophobicContact CD1-SD 4.2Å; I482-M515 HydrophobicContact CG1-CE 3.51Å; I482-M515 HydrophobicContact CG1-SD 4.14Å; I482-L518 HydrophobicContact CD1-CD1 3.35Å; I482-L518 HydrophobicContact CD1-CG 4.42Å
483	S	93.2	Very high	94.4	Very high	71 Å²	71	24.9 Å²	24.9	50%	0.497	15%	0.145	S	C	.	.	S	Bend	trans	-91.6	-26.9	-179.7	-59.2	0	0	0	0	113.2	P448 T449 V481	P448-S483 WeakPolarHBondContact CB-OG 3.24Å; T449-S483 PolarHBondContact N-OG 3.42Å; T449-S483 WeakPolarHBondContact O-CB 3.29Å; T449-S483 PolarHBondContact O-N 2.97Å; V481-S483 PolarHBondContact O-N 3.15Å
484	D	95.4	Very high	94.3	Very high	13 Å²	13	28.6 Å²	28.6	7%	0.07	17%	0.165	C	C	.	.			trans	-108.1	42	-177.5	69.8	-16.2	0	0	0	113	N450 F451 A452 I482 A486 Q487 T488	N450-D484 VanDerWaalsContact CA-CG 3.45Å; N450-D484 VanDerWaalsContact CA-OD1 3.31Å; N450-D484 WeakPolarHBondContact CA-OD1 3.35Å; N450-D484 WeakPolarHBondContact CA-OD2 3.28Å; N450-D484 HydrophobicContact CB-CB 4.29Å; N450-D484 VanDerWaalsContact CB-OD2 3.27Å; N450-D484 WeakPolarHBondContact CB-OD2 3.48Å; F451-D484 PolarHBondContact N-OD1 3.45Å; F451-D484 PolarHBondContact N-OD2 2.93Å; A452-D484 WeakPolarHBondContact CB-OD2 3.34Å; A452-D484 PolarHBondContact N-OD2 3.41Å; I482-D484 WeakPolarHBondContact CG2-OD1 3.4Å; D484-A486 VanDerWaalsContact C-N 3.29Å; D484-A486 PolarHBondContact O-N 3.46Å; D484-A486 VanDerWaalsContact O-N 3.15Å; D484-Q487 HydrophobicContact CB-CB 4.25Å; D484-Q487 PolarHBondContact O-N 3.1Å; D484-Q487 PolarHBondContact O-OE1 2.76Å; D484-T488 WeakPolarHBondContact O-CB 3.44Å; D484-T488 PolarHBondContact O-N 3.49Å; D484-T488 PolarHBondContact O-OG1 3.3Å; D484-T488 PolarHBondContact OD1-OG1 3.42Å
485	M	94.1	Very high	94.3	Very high	36 Å²	36	28.6 Å²	28.6	18%	0.177	17%	0.165	C	C	.	.	H	α-helix	trans	-50.6	-44.1	-173.4	-179.5	56.7	84.8	0	0	113.6	I482 T488 K489 A514 L518	I482-M485 HydrophobicContact CB-CE 4.37Å; I482-M485 HydrophobicContact CD1-CE 4.14Å; M485-T488 PolarHBondContact O-N 3.45Å; M485-K489 HydrophobicContact CG-CD 4.42Å; M485-K489 WeakPolarHBondContact O-CG 3.27Å; M485-K489 PolarHBondContact O-N 2.81Å; M485-K489 HydrophobicContact SD-CD 4.34Å; M485-K489 HydrophobicContact SD-CG 4.15Å; M485-A514 HydrophobicContact CE-CB 3.33Å; M485-A514 VanDerWaalsContact CE-O 3.29Å; M485-A514 WeakPolarHBondContact CE-O 3.42Å; M485-L518 HydrophobicContact CE-CG 4.36Å; M485-L518 HydrophobicContact SD-CD1 4.44Å; M485-L518 HydrophobicContact SD-CD2 3.8Å; M485-L518 HydrophobicContact SD-CG 4.13Å
486	A	95.8	Very high	94.2	Very high	64 Å²	64	28.6 Å²	28.6	53%	0.529	17%	0.165	S	C	.	.	H	α-helix	trans	-64.6	-42.8	-179.2	0	0	0	0	0	112.3	D484 E490	D484-A486 VanDerWaalsContact C-N 3.29Å; D484-A486 PolarHBondContact O-N 3.46Å; D484-A486 VanDerWaalsContact O-N 3.15Å; A486-E490 WeakPolarHBondContact O-CB 3.44Å; A486-E490 PolarHBondContact O-N 2.8Å
487	Q	97.6	Very high	94.1	Very high	104 Å²	104	33.1 Å²	33.1	49%	0.486	19%	0.185	S	C	.	.	H	α-helix	trans	-69.4	-37.1	177	-63.1	81.4	-9.8	0	0	111.1	A452 D484 E490 A491	A452-Q487 HydrophobicContact CB-CB 3.66Å; D484-Q487 HydrophobicContact CB-CB 4.25Å; D484-Q487 PolarHBondContact O-N 3.1Å; D484-Q487 PolarHBondContact O-OE1 2.76Å; Q487-E490 PolarHBondContact O-N 2.69Å; Q487-A491 WeakPolarHBondContact O-CB 3.47Å; Q487-A491 PolarHBondContact O-N 3.28Å
488	T	97.2	Very high	94.2	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	19%	0.188	C	C	.	.	H	α-helix	trans	-65.6	-46.3	176.8	-69.7	0	0	0	0	111	F451 A452 D484 M485 E490 A491 I492 L518	F451-T488 HydrophobicContact CB-CG2 3.98Å; F451-T488 HydrophobicContact CD2-CG2 4.42Å; A452-T488 PolarHBondContact N-OG1 2.99Å; D484-T488 WeakPolarHBondContact O-CB 3.44Å; D484-T488 PolarHBondContact O-N 3.49Å; D484-T488 PolarHBondContact O-OG1 3.3Å; D484-T488 PolarHBondContact OD1-OG1 3.42Å; M485-T488 PolarHBondContact O-N 3.45Å; T488-E490 VanDerWaalsContact C-N 3.33Å; T488-E490 PolarHBondContact O-N 3.03Å; T488-A491 PolarHBondContact O-N 3Å; T488-I492 HydrophobicContact CG2-CD1 3.76Å; T488-I492 VanDerWaalsContact O-CG1 3.28Å; T488-I492 WeakPolarHBondContact O-CG1 3.38Å; T488-I492 PolarHBondContact O-N 3.44Å; T488-L518 HydrophobicContact CG2-CD1 3.82Å; T488-L518 HydrophobicContact CG2-CD2 4.44Å
489	K	96.9	Very high	94.3	Very high	34 Å²	34	33.8 Å²	33.8	15%	0.148	19%	0.188	C	C	.	.	H	α-helix	trans	-58.5	-43.1	171.3	-73.7	-179.4	-178.7	165.8	0	112.3	M485 I492 V493 E517 L518 I525	M485-K489 HydrophobicContact CG-CD 4.42Å; M485-K489 WeakPolarHBondContact O-CG 3.27Å; M485-K489 PolarHBondContact O-N 2.81Å; M485-K489 HydrophobicContact SD-CD 4.34Å; M485-K489 HydrophobicContact SD-CG 4.15Å; K489-I492 PolarHBondContact O-N 2.77Å; K489-V493 WeakPolarHBondContact O-CB 3.12Å; K489-V493 VanDerWaalsContact O-CG2 3.23Å; K489-V493 WeakPolarHBondContact O-CG2 3.42Å; K489-V493 PolarHBondContact O-N 2.86Å; K489-E517 IonicContact NZ-OE1 2.78Å; K489-E517 PolarHBondContact NZ-OE1 3.25Å; K489-E517 IonicContact NZ-OE2 3.07Å; K489-E517 PolarHBondContact NZ-OE2 3.28Å; K489-L518 HydrophobicContact CG-CD2 3.83Å; K489-I525 HydrophobicContact CB-CG2 4.13Å; K489-I525 HydrophobicContact CG-CG2 3.97Å
490	E	97.6	Very high	94.6	Very high	57 Å²	57	33.1 Å²	33.1	27%	0.266	19%	0.185	S	C	.	.	H	α-helix	trans	-61.5	-43	175.6	-175.1	169.9	-170.1	0	0	112	A486 Q487 T488 N494 R528	A486-E490 WeakPolarHBondContact O-CB 3.44Å; A486-E490 PolarHBondContact O-N 2.8Å; Q487-E490 PolarHBondContact O-N 2.69Å; T488-E490 VanDerWaalsContact C-N 3.33Å; T488-E490 PolarHBondContact O-N 3.03Å; E490-N494 WeakPolarHBondContact O-CB 3.28Å; E490-N494 VanDerWaalsContact O-CG 3.24Å; E490-N494 PolarHBondContact O-N 3.44Å; E490-N494 PolarHBondContact O-ND2 2.99Å; E490-R528 IonicContact OE1-CZ 3.68Å; E490-R528 VanDerWaalsContact OE1-CZ 3.23Å; E490-R528 IonicContact OE1-NE 3.51Å; E490-R528 IonicContact OE1-NH1 2.56Å; E490-R528 IonicContact OE1-NH2 2.81Å; E490-R528 PolarHBondContact OE1-NH2 3.09Å; E490-R528 IonicContact OE2-CZ 3.51Å; E490-R528 VanDerWaalsContact OE2-CZ 3.31Å; E490-R528 IonicContact OE2-NE 3.57Å; E490-R528 IonicContact OE2-NH2 2.65Å; E490-R528 PolarHBondContact OE2-NH2 2.96Å
491	A	98.1	Very high	95.7	Very high	10 Å²	10	33.1 Å²	33.1	8%	0.083	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-44.5	176.5	0	0	0	0	0	111.7	A452 V455 Q487 T488 N494 A495	A452-A491 HydrophobicContact CB-CB 4.48Å; V455-A491 HydrophobicContact CB-CB 4.14Å; V455-A491 HydrophobicContact CG1-CB 3.74Å; Q487-A491 WeakPolarHBondContact O-CB 3.47Å; Q487-A491 PolarHBondContact O-N 3.28Å; T488-A491 PolarHBondContact O-N 3Å; A491-N494 PolarHBondContact O-N 3.03Å; A491-A495 VanDerWaalsContact O-CB 3.24Å; A491-A495 WeakPolarHBondContact O-CB 3.27Å; A491-A495 PolarHBondContact O-N 3.05Å
492	I	97.8	Very high	96.5	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.015	16%	0.157	C	C	.	.	H	α-helix	trans	-64.9	-46.2	178.5	-65.7	161.5	0	0	0	111.3	V455 T488 K489 N494 A495 A496 I502 L518 I525 I536 V537	V455-I492 HydrophobicContact CG1-CG1 4.37Å; T488-I492 HydrophobicContact CG2-CD1 3.76Å; T488-I492 VanDerWaalsContact O-CG1 3.28Å; T488-I492 WeakPolarHBondContact O-CG1 3.38Å; T488-I492 PolarHBondContact O-N 3.44Å; K489-I492 PolarHBondContact O-N 2.77Å; I492-N494 PolarHBondContact O-N 2.86Å; I492-A495 CarbonylContact O-C 3.52Å; I492-A495 WeakPolarHBondContact O-CB 3.27Å; I492-A495 PolarHBondContact O-N 2.96Å; I492-A496 PolarHBondContact O-N 3.28Å; I492-I502 HydrophobicContact CG1-CD1 3.9Å; I492-L518 HydrophobicContact CD1-CD1 4.16Å; I492-L518 HydrophobicContact CD1-CD2 3.74Å; I492-L518 HydrophobicContact CD1-CG 4.41Å; I492-I525 HydrophobicContact CD1-CD1 4.39Å; I492-I525 HydrophobicContact CG2-CD1 3.64Å; I492-I536 HydrophobicContact CG2-CD1 4.09Å; I492-I536 HydrophobicContact CG2-CG1 3.96Å; I492-V537 HydrophobicContact CD1-CG2 4.01Å; I492-V537 HydrophobicContact CG1-CG2 4.31Å; I492-V537 HydrophobicContact CG2-CG2 3.84Å
493	V	97.4	Very high	96.9	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.024	15%	0.153	C	C	.	.	H	α-helix	trans	-60.2	-35.9	176.6	169.5	0	0	0	0	111.7	K489 I525 K530 A532	K489-V493 WeakPolarHBondContact O-CB 3.12Å; K489-V493 VanDerWaalsContact O-CG2 3.23Å; K489-V493 WeakPolarHBondContact O-CG2 3.42Å; K489-V493 PolarHBondContact O-N 2.86Å; V493-I525 HydrophobicContact CG2-CG2 3.99Å; V493-K530 HydrophobicContact CG1-CB 4.23Å; V493-K530 HydrophobicContact CG1-CD 3.95Å; V493-K530 HydrophobicContact CG1-CG 3.99Å; V493-A532 HydrophobicContact CG2-CB 4.2Å
494	N	96.7	Very high	97	Very high	78 Å²	78	24.6 Å²	24.6	42%	0.417	13%	0.13	S	C	.	.	H	α-helix	trans	-74.3	-32.9	175.4	-72.8	-33.6	0	0	0	112.9	E490 A491 I492	E490-N494 WeakPolarHBondContact O-CB 3.28Å; E490-N494 VanDerWaalsContact O-CG 3.24Å; E490-N494 PolarHBondContact O-N 3.44Å; E490-N494 PolarHBondContact O-ND2 2.99Å; A491-N494 PolarHBondContact O-N 3.03Å; I492-N494 PolarHBondContact O-N 2.86Å
495	A	97.7	Very high	97	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-75.2	-27.1	177.3	0	0	0	0	0	113.5	A459 A491 I492 K497 L498 M500 I536	A459-A495 HydrophobicContact CB-CB 4.12Å; A491-A495 VanDerWaalsContact O-CB 3.24Å; A491-A495 WeakPolarHBondContact O-CB 3.27Å; A491-A495 PolarHBondContact O-N 3.05Å; I492-A495 CarbonylContact O-C 3.52Å; I492-A495 WeakPolarHBondContact O-CB 3.27Å; I492-A495 PolarHBondContact O-N 2.96Å; A495-K497 PolarHBondContact O-N 2.83Å; A495-L498 VanDerWaalsContact O-CB 3.28Å; A495-L498 WeakPolarHBondContact O-CB 3.29Å; A495-L498 PolarHBondContact O-N 3.06Å; A495-M500 HydrophobicContact CB-CE 3.92Å; A495-M500 HydrophobicContact CB-CG 4.25Å; A495-M500 HydrophobicContact CB-SD 3.5Å; A495-M500 VanDerWaalsContact CB-SD 3.5Å; A495-I536 HydrophobicContact CB-CD1 3.73Å
496	A	96.9	Very high	97	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.4	-174.2	0	0	0	0	0	115.2	I492 A532 R534	I492-A496 PolarHBondContact O-N 3.28Å; A496-A532 HydrophobicContact CB-CB 3.8Å; A496-R534 VanDerWaalsContact O-CZ 3.26Å; A496-R534 PolarHBondContact O-NE 2.82Å; A496-R534 VanDerWaalsContact O-NE 3.13Å; A496-R534 PolarHBondContact O-NH2 3.27Å
497	K	95.8	Very high	96.9	Very high	95 Å²	95	19.2 Å²	19.2	41%	0.413	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-6.7	175.1	67.7	176.6	180	172.3	0	114.7	A495 E533	A495-K497 PolarHBondContact O-N 2.83Å; K497-E533 WeakPolarHBondContact CB-OE2 3.48Å
498	L	98.1	Very high	96.5	Very high	13 Å²	13	15 Å²	15	7%	0.068	8%	0.077	C	C	.	.	S	Bend	trans	-99	161.5	-173.8	-58.3	179.1	0	0	0	110.9	A459 A462 A463 A495 M500 R534 Y574	A459-L498 HydrophobicContact CB-CD1 3.9Å; A459-L498 VanDerWaalsContact O-CD1 3.26Å; A459-L498 WeakPolarHBondContact O-CD1 3.41Å; A462-L498 HydrophobicContact CB-CB 4.37Å; A463-L498 HydrophobicContact CB-CD1 4.04Å; A463-L498 HydrophobicContact CB-CD2 3.88Å; A495-L498 VanDerWaalsContact O-CB 3.28Å; A495-L498 WeakPolarHBondContact O-CB 3.29Å; A495-L498 PolarHBondContact O-N 3.06Å; L498-M500 HydrophobicContact CB-CG 4.25Å; L498-M500 PolarHBondContact O-N 2.59Å; L498-R534 PolarHBondContact O-NH2 3.02Å; L498-Y574 VanDerWaalsContact C-CE2 3.42Å
499	P	97.9	Very high	96	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.006	11%	0.111	C	C	.	.	S	Bend	trans	-74.1	67.4	176.8	29.4	-33.4	0	0	0	110.6	A462 V465 Q466 Y471 S472 Y574	A462-P499 HydrophobicContact CB-CG 4.25Å; A462-P499 WeakPolarHBondContact O-CG 3.43Å; V465-P499 WeakPolarHBondContact O-CG 3.1Å; Q466-P499 HydrophobicContact CG-CG 4.27Å; Y471-P499 HydrophobicContact CD2-CB 3.87Å; Y471-P499 HydrophobicContact CE2-CB 4.35Å; S472-P499 PolarHBondContact N-O 3.13Å; P499-Y574 HydrophobicContact CB-CD1 4Å; P499-Y574 HydrophobicContact CB-CE1 3.51Å; P499-Y574 HydrophobicContact CB-CE2 4.08Å; P499-Y574 WeakPolarHBondContact CD-OH 3.41Å; P499-Y574 HydrophobicContact CG-CE1 4.38Å
500	M	97.8	Very high	95.4	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	151.5	178.6	68.9	-179.5	-80.7	0	0	114.5	V458 A459 A462 S472 A495 L498 I502 I536	V458-M500 HydrophobicContact CG1-CE 4.31Å; A459-M500 WeakPolarHBondContact CA-SD 3.48Å; A459-M500 HydrophobicContact CB-CE 4.38Å; A459-M500 HydrophobicContact CB-SD 3.64Å; A462-M500 HydrophobicContact CB-CB 4.11Å; A462-M500 HydrophobicContact CB-SD 4.37Å; S472-M500 CarbonylContact O-C 3.48Å; S472-M500 WeakPolarHBondContact O-CA 3.18Å; A495-M500 HydrophobicContact CB-CE 3.92Å; A495-M500 HydrophobicContact CB-CG 4.25Å; A495-M500 HydrophobicContact CB-SD 3.5Å; A495-M500 VanDerWaalsContact CB-SD 3.5Å; L498-M500 HydrophobicContact CB-CG 4.25Å; L498-M500 PolarHBondContact O-N 2.59Å; M500-I502 HydrophobicContact CE-CD1 3.96Å; M500-I502 HydrophobicContact CE-CG1 3.78Å; M500-I536 HydrophobicContact CG-CD1 4.47Å; M500-I536 WeakPolarHBondContact O-CG2 3.33Å
501	S	97.9	Very high	94.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	156.4	167.7	-64.7	0	0	0	0	110.5	Y471 S472 L474 I536 I567 Q570	Y471-S501 WeakPolarHBondContact CE1-OG 3.31Å; Y471-S501 PolarHBondContact OH-OG 2.97Å; S472-S501 PolarHBondContact O-N 3.3Å; L474-S501 PolarHBondContact N-O 3.38Å; S501-I536 CarbonylContact C-O 3.51Å; S501-I536 WeakPolarHBondContact CA-O 3.38Å; S501-I567 VanDerWaalsContact CB-CD1 3.45Å; S501-Q570 PolarHBondContact OG-OE1 3.05Å
502	I	97.9	Very high	94.4	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	126.6	179.6	-55.6	169.3	0	0	0	106.9	V455 L474 I476 I492 M500 I504 I536 V537 Q538	V455-I502 HydrophobicContact CG1-CD1 3.79Å; V455-I502 HydrophobicContact CG2-CD1 4.19Å; L474-I502 CarbonylContact O-C 3.47Å; L474-I502 WeakPolarHBondContact O-CA 3.49Å; I476-I502 HydrophobicContact CD1-CG2 4.02Å; I476-I502 HydrophobicContact CG1-CG2 4.39Å; I492-I502 HydrophobicContact CG1-CD1 3.9Å; M500-I502 HydrophobicContact CE-CD1 3.96Å; M500-I502 HydrophobicContact CE-CG1 3.78Å; I502-I504 HydrophobicContact CG2-CG1 4.04Å; I502-I536 HydrophobicContact CD1-CD1 4Å; I502-I536 HydrophobicContact CG1-CD1 4.43Å; I502-I536 PolarHBondContact N-O 3.25Å; I502-V537 HydrophobicContact CB-CG2 4.32Å; I502-V537 HydrophobicContact CD1-CG2 4.36Å; I502-V537 CarbonylContact O-C 3.29Å; I502-V537 VanDerWaalsContact O-CA 3.24Å; I502-V537 WeakPolarHBondContact O-CA 3.5Å; I502-Q538 PolarHBondContact O-N 3.43Å
503	I	96.4	Very high	93.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	131.3	172.7	-66.2	170.5	0	0	0	106.8	V473 L474 L475 I476 V505 Q538 V563 L564 I567	V473-I503 HydrophobicContact CG1-CD1 3.7Å; V473-I503 HydrophobicContact CG1-CG1 4.28Å; L474-I503 PolarHBondContact O-N 3.25Å; L475-I503 CarbonylContact C-O 3.55Å; L475-I503 WeakPolarHBondContact CA-O 3.34Å; L475-I503 HydrophobicContact CD1-CB 4.08Å; L475-I503 HydrophobicContact CD1-CG2 3.53Å; I476-I503 PolarHBondContact N-O 3.37Å; I503-V505 HydrophobicContact CG2-CG2 4.14Å; I503-Q538 CarbonylContact C-O 3.51Å; I503-Q538 WeakPolarHBondContact CA-O 3.3Å; I503-V563 HydrophobicContact CB-CG1 4.48Å; I503-V563 HydrophobicContact CD1-CG1 3.93Å; I503-V563 HydrophobicContact CG1-CG1 4.44Å; I503-V563 HydrophobicContact CG2-CG1 3.35Å; I503-L564 HydrophobicContact CD1-CD2 4Å; I503-I567 HydrophobicContact CD1-CD1 4.01Å; I503-I567 HydrophobicContact CD1-CG1 4.2Å; I503-I567 HydrophobicContact CG1-CD1 4.15Å
504	I	95.4	Very high	93.5	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	115.6	175.9	-53.6	178	0	0	0	108.4	F451 I476 T478 I502 M515 L518 V537 Q538 F539 V540	F451-I504 HydrophobicContact CD2-CD1 4.48Å; F451-I504 HydrophobicContact CE2-CD1 4.26Å; F451-I504 HydrophobicContact CE2-CG2 4.3Å; I476-I504 HydrophobicContact CB-CG1 4.39Å; I476-I504 CarbonylContact O-C 3.53Å; I476-I504 WeakPolarHBondContact O-CA 3.5Å; T478-I504 HydrophobicContact CG2-CG2 4.18Å; I502-I504 HydrophobicContact CG2-CG1 4.04Å; I504-M515 HydrophobicContact CG2-CG 4.1Å; I504-L518 HydrophobicContact CD1-CD1 4.08Å; I504-V537 HydrophobicContact CD1-CG1 3.82Å; I504-V537 HydrophobicContact CG1-CG1 4.24Å; I504-Q538 PolarHBondContact N-O 3.33Å; I504-F539 HydrophobicContact CB-CD2 4.08Å; I504-F539 HydrophobicContact CG2-CD2 3.95Å; I504-F539 HydrophobicContact CG2-CE2 4.44Å; I504-F539 WeakPolarHBondContact O-CA 3.29Å; I504-F539 VanDerWaalsContact O-CD2 3.3Å; I504-F539 WeakPolarHBondContact O-CD2 3.42Å; I504-V540 PolarHBondContact O-N 3.43Å
505	V	95.4	Very high	93.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	114	173.3	-179.4	0	0	0	0	109.6	A379 L475 I476 I477 T478 I503 V507 V540 F542 V563	A379-V505 HydrophobicContact CB-CG1 3.86Å; L475-V505 HydrophobicContact CD1-CG2 3.75Å; I476-V505 PolarHBondContact O-N 2.82Å; I477-V505 WeakPolarHBondContact CA-O 3.19Å; I477-V505 HydrophobicContact CG2-CB 4.46Å; T478-V505 PolarHBondContact N-O 3.26Å; T478-V505 VanDerWaalsContact N-O 3.11Å; I503-V505 HydrophobicContact CG2-CG2 4.14Å; V505-V507 HydrophobicContact CG1-CG1 4.45Å; V505-V540 WeakPolarHBondContact CA-O 3.43Å; V505-F542 HydrophobicContact CG1-CB 3.98Å; V505-F542 HydrophobicContact CG1-CD2 4.27Å; V505-V563 HydrophobicContact CG2-CG2 3.98Å
506	G	94.9	Very high	92.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	116.9	177	0	0	0	0	0	111.7	T478 V540 F542	T478-G506 CarbonylContact O-C 3.58Å; T478-G506 WeakPolarHBondContact O-CA 3.46Å; G506-V540 PolarHBondContact N-O 3.46Å; G506-F542 VanDerWaalsContact O-CB 3.25Å; G506-F542 WeakPolarHBondContact O-CB 3.33Å; G506-F542 PolarHBondContact O-N 2.82Å
507	V	93.5	Very high	92.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.199	C	C	.	.			trans	-103.6	159.4	176.3	-60.1	0	0	0	0	111.8	L365 A375 Y376 I477 T478 D479 V505 F542	L365-V507 HydrophobicContact CD1-CG2 4.39Å; A375-V507 HydrophobicContact CB-CB 3.94Å; A375-V507 HydrophobicContact CB-CG1 3.79Å; Y376-V507 HydrophobicContact CD2-CG2 4.07Å; Y376-V507 HydrophobicContact CE1-CG2 4.05Å; Y376-V507 HydrophobicContact CE2-CG2 3.5Å; Y376-V507 VanDerWaalsContact CE2-CG2 3.5Å; Y376-V507 VanDerWaalsContact CZ-CG2 3.47Å; I477-V507 HydrophobicContact CG2-CG1 3.81Å; T478-V507 VanDerWaalsContact O-CG2 3.31Å; T478-V507 WeakPolarHBondContact O-CG2 3.36Å; T478-V507 PolarHBondContact O-N 3.03Å; D479-V507 WeakPolarHBondContact CA-O 3.42Å; D479-V507 HydrophobicContact CB-CG2 4.19Å; V505-V507 HydrophobicContact CG1-CG1 4.45Å; V507-F542 HydrophobicContact CG1-CB 3.97Å; V507-F542 HydrophobicContact CG1-CG 4.19Å
508	G	89.7	Confident	92.2	Very high	14 Å²	14	33.7 Å²	33.7	14%	0.144	18%	0.18	C	C	.	.	S	Bend	trans	82.4	-155.5	179.5	0	0	0	0	0	113.8
509	Q	85.3	Confident	91.7	Very high	157 Å²	157	34 Å²	34	73%	0.734	18%	0.181	S	C	*	.	S	Bend	trans	-119.8	13.7	-168.8	-61.6	-61.1	-36	0	0	113.3
510	A	85.1	Confident	90.9	Very high	27 Å²	27	34 Å²	34	22%	0.223	18%	0.182	C	C	.	.			trans	-65.9	166.9	177.4	0	0	0	0	0	112.6	D479 F512 R543	D479-A510 WeakPolarHBondContact O-CB 3.49Å; A510-F512 HydrophobicContact CB-CE1 4.46Å; A510-R543 PolarHBondContact O-NH1 2.9Å
511	E	85.5	Confident	90	Very high	155 Å²	155	38.6 Å²	38.6	72%	0.724	21%	0.207	S	C	*	.			trans	-84.3	129	169.7	-65.8	-169.4	156.2	0	0	109.4
512	F	88.6	Confident	89.1	Confident	6 Å²	6	46.1 Å²	46.1	3%	0.026	25%	0.247	C	C	.	.			trans	-107.3	20.5	-170.8	-64	-64.9	0	0	0	113.4	A510 A514 M515 V516 F539 P541	A510-F512 HydrophobicContact CB-CE1 4.46Å; F512-A514 PolarHBondContact O-N 3.03Å; F512-A514 VanDerWaalsContact O-N 3.15Å; F512-M515 HydrophobicContact CB-CB 4.45Å; F512-M515 HydrophobicContact CB-SD 4.46Å; F512-M515 HydrophobicContact CD1-CE 4.44Å; F512-M515 HydrophobicContact CD1-SD 4.03Å; F512-M515 WeakPolarHBondContact O-CA 3.45Å; F512-M515 PolarHBondContact O-N 2.89Å; F512-V516 PolarHBondContact O-N 2.92Å; F512-F539 HydrophobicContact CB-CE1 3.72Å; F512-F539 HydrophobicContact CB-CE2 4.35Å; F512-F539 HydrophobicContact CB-CZ 3.4Å; F512-F539 HydrophobicContact CD1-CE2 4.23Å; F512-F539 AromaticContact CD1-CZ 3.89Å; F512-F539 HydrophobicContact CD1-CZ 3.89Å; F512-F539 AromaticContact CD2-CZ 3.9Å; F512-F539 HydrophobicContact CD2-CZ 3.9Å; F512-F539 HydrophobicContact CG-CE1 4.27Å; F512-F539 HydrophobicContact CG-CE2 4.27Å; F512-F539 AromaticContact CG-CZ 3.48Å; F512-F539 HydrophobicContact CG-CZ 3.48Å; F512-F539 VanDerWaalsContact CG-CZ 3.48Å; F512-P541 HydrophobicContact CD2-CB 4.16Å; F512-P541 HydrophobicContact CE2-CB 4.24Å
513	D	89	Confident	88.5	Confident	121 Å²	121	51.4 Å²	51.4	65%	0.647	28%	0.279	S	S	*	.	H	α-helix	trans	-54.2	-38.3	-177.8	-62.3	-13.2	0	0	0	112.4	M515 V516 E517	D513-M515 VanDerWaalsContact C-N 3.31Å; D513-M515 PolarHBondContact O-N 2.74Å; D513-V516 PolarHBondContact O-N 3.33Å; D513-E517 PolarHBondContact O-N 3Å
514	A	88	Confident	88.3	Confident	27 Å²	27	56 Å²	56	22%	0.223	30%	0.297	C	S	.	.	H	α-helix	trans	-58.8	-39.8	174.1	0	0	0	0	0	112.8	M485 F512 L518	M485-A514 HydrophobicContact CE-CB 3.33Å; M485-A514 VanDerWaalsContact CE-O 3.29Å; M485-A514 WeakPolarHBondContact CE-O 3.42Å; F512-A514 PolarHBondContact O-N 3.03Å; F512-A514 VanDerWaalsContact O-N 3.15Å; A514-L518 WeakPolarHBondContact O-CG 3.37Å; A514-L518 PolarHBondContact O-N 3.49Å
515	M	89.6	Confident	88.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-79.2	-35.7	-178.6	-66.4	68.8	176.8	0	0	111.4	F451 T478 I482 I504 F512 D513 E517 L518 D519 F539	F451-M515 HydrophobicContact CE2-CE 4.48Å; F451-M515 HydrophobicContact CZ-CE 4.31Å; T478-M515 HydrophobicContact CG2-CE 3.85Å; I482-M515 HydrophobicContact CD1-CE 4Å; I482-M515 HydrophobicContact CD1-CG 4.32Å; I482-M515 HydrophobicContact CD1-SD 4.2Å; I482-M515 HydrophobicContact CG1-CE 3.51Å; I482-M515 HydrophobicContact CG1-SD 4.14Å; I504-M515 HydrophobicContact CG2-CG 4.1Å; F512-M515 HydrophobicContact CB-CB 4.45Å; F512-M515 HydrophobicContact CB-SD 4.46Å; F512-M515 HydrophobicContact CD1-CE 4.44Å; F512-M515 HydrophobicContact CD1-SD 4.03Å; F512-M515 WeakPolarHBondContact O-CA 3.45Å; F512-M515 PolarHBondContact O-N 2.89Å; D513-M515 VanDerWaalsContact C-N 3.31Å; D513-M515 PolarHBondContact O-N 2.74Å; M515-E517 VanDerWaalsContact C-N 3.27Å; M515-E517 PolarHBondContact O-N 3.28Å; M515-L518 CarbonylContact O-C 3.54Å; M515-L518 WeakPolarHBondContact O-CA 3.29Å; M515-L518 WeakPolarHBondContact O-CB 3.07Å; M515-L518 PolarHBondContact O-N 3.4Å; M515-D519 PolarHBondContact O-N 3.16Å; M515-D519 VanDerWaalsContact O-N 3.09Å; M515-F539 HydrophobicContact CB-CB 4.34Å; M515-F539 HydrophobicContact CB-CD1 3.9Å; M515-F539 HydrophobicContact CB-CD2 3.35Å; M515-F539 HydrophobicContact CB-CE1 4.05Å; M515-F539 HydrophobicContact CB-CE2 3.52Å; M515-F539 HydrophobicContact CB-CG 3.57Å; M515-F539 HydrophobicContact CB-CZ 3.89Å; M515-F539 HydrophobicContact CG-CD2 3.93Å; M515-F539 HydrophobicContact CG-CE2 3.84Å; M515-F539 HydrophobicContact CG-CZ 4.45Å
516	V	88.9	Confident	88.1	Confident	76 Å²	76	59.3 Å²	59.3	46%	0.461	32%	0.319	S	S	.	.	H	α-helix	trans	-60.9	-39.2	171.1	176.7	0	0	0	0	110.5	F512 D513 L518 D519 F539	F512-V516 PolarHBondContact O-N 2.92Å; D513-V516 PolarHBondContact O-N 3.33Å; V516-L518 PolarHBondContact O-N 2.94Å; V516-D519 WeakPolarHBondContact O-CB 3.42Å; V516-D519 PolarHBondContact O-N 3.16Å; V516-F539 HydrophobicContact CG2-CD1 4.01Å; V516-F539 HydrophobicContact CG2-CE1 4.04Å
517	E	90	Very high	88.1	Confident	106 Å²	106	60.2 Å²	60.2	50%	0.495	33%	0.325	S	S	.	.	H	α-helix	trans	-63.9	-30.2	173.1	-169.1	-176.2	-172	0	0	112.7	K489 D513 M515	K489-E517 IonicContact NZ-OE1 2.78Å; K489-E517 PolarHBondContact NZ-OE1 3.25Å; K489-E517 IonicContact NZ-OE2 3.07Å; K489-E517 PolarHBondContact NZ-OE2 3.28Å; D513-E517 PolarHBondContact O-N 3Å; M515-E517 VanDerWaalsContact C-N 3.27Å; M515-E517 PolarHBondContact O-N 3.28Å
518	L	91	Very high	88	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-80	-17.5	176.7	-68.8	-175.8	0	0	0	113.6	I482 M485 T488 K489 I492 I504 A514 M515 V516 G520 I525 V537	I482-L518 HydrophobicContact CD1-CD1 3.35Å; I482-L518 HydrophobicContact CD1-CG 4.42Å; M485-L518 HydrophobicContact CE-CG 4.36Å; M485-L518 HydrophobicContact SD-CD1 4.44Å; M485-L518 HydrophobicContact SD-CD2 3.8Å; M485-L518 HydrophobicContact SD-CG 4.13Å; T488-L518 HydrophobicContact CG2-CD1 3.82Å; T488-L518 HydrophobicContact CG2-CD2 4.44Å; K489-L518 HydrophobicContact CG-CD2 3.83Å; I492-L518 HydrophobicContact CD1-CD1 4.16Å; I492-L518 HydrophobicContact CD1-CD2 3.74Å; I492-L518 HydrophobicContact CD1-CG 4.41Å; I504-L518 HydrophobicContact CD1-CD1 4.08Å; A514-L518 WeakPolarHBondContact O-CG 3.37Å; A514-L518 PolarHBondContact O-N 3.49Å; M515-L518 CarbonylContact O-C 3.54Å; M515-L518 WeakPolarHBondContact O-CA 3.29Å; M515-L518 WeakPolarHBondContact O-CB 3.07Å; M515-L518 PolarHBondContact O-N 3.4Å; V516-L518 PolarHBondContact O-N 2.94Å; L518-G520 PolarHBondContact O-N 3.3Å; L518-I525 HydrophobicContact CD2-CD1 4.49Å; L518-I525 WeakPolarHBondContact O-CD1 3.38Å; L518-V537 HydrophobicContact CB-CG1 4.26Å; L518-V537 WeakPolarHBondContact O-CB 3.02Å; L518-V537 VanDerWaalsContact O-CG1 3.31Å; L518-V537 WeakPolarHBondContact O-CG1 3.14Å; L518-V537 WeakPolarHBondContact O-CG2 3.4Å
519	D	88	Confident	88	Confident	19 Å²	19	73.3 Å²	73.3	10%	0.102	40%	0.396	C	S	.	.	H	α-helix	trans	-64.7	-26.3	-176.5	-146.8	12.9	0	0	0	112.7	M515 V516 D521 Q538 F539	M515-D519 PolarHBondContact O-N 3.16Å; M515-D519 VanDerWaalsContact O-N 3.09Å; V516-D519 WeakPolarHBondContact O-CB 3.42Å; V516-D519 PolarHBondContact O-N 3.16Å; D519-D521 PolarHBondContact O-N 3.48Å; D519-D521 VanDerWaalsContact O-N 3.09Å; D519-Q538 WeakPolarHBondContact OD1-CA 3.12Å; D519-F539 HydrophobicContact CB-CB 4.25Å; D519-F539 PolarHBondContact OD1-N 2.84Å
520	G	80.2	Confident	88.4	Confident	3 Å²	3	70 Å²	70	3%	0.031	38%	0.379	C	S	.	.			trans	77.2	-11	171.4	0	0	0	0	0	116.1	L518 V523 D535	L518-G520 PolarHBondContact O-N 3.3Å; G520-V523 CarbonylContact O-C 3.55Å; G520-D535 WeakPolarHBondContact CA-OD2 3.34Å; G520-D535 VanDerWaalsContact O-OD2 3.13Å
521	D	80.3	Confident	88.9	Confident	95 Å²	95	73.8 Å²	73.8	51%	0.508	40%	0.395	S	S	.	.	S	Bend	trans	-53	-53.7	179.2	-79.6	-10	0	0	0	113.9	D519	D519-D521 PolarHBondContact O-N 3.48Å; D519-D521 VanDerWaalsContact O-N 3.09Å
522	D	79.2	Confident	89.3	Confident	159 Å²	159	66.8 Å²	66.8	85%	0.85	36%	0.364	S	S	*	.	S	Bend	trans	-79.7	-42.7	-179	-73.3	-39.3	0	0	0	111.9
523	V	85.3	Confident	89.6	Confident	113 Å²	113	71.9 Å²	71.9	69%	0.685	39%	0.388	S	S	*	.	S	Bend	trans	-140.1	116.3	-173.4	-177.3	0	0	0	0	109.8	G520 I525	G520-V523 CarbonylContact O-C 3.55Å; V523-I525 PolarHBondContact O-N 3.3Å
524	R	91.6	Very high	89.8	Confident	97 Å²	97	67 Å²	67	37%	0.366	36%	0.36	S	S	.	.			trans	-54.8	124.9	176.2	-167	54.4	41.2	122.5	-13.5	111	S526 L531 A532 D535	R524-S526 PolarHBondContact O-N 2.84Å; R524-L531 HydrophobicContact CB-CD2 4.22Å; R524-L531 HydrophobicContact CG-CD2 4.4Å; R524-A532 HydrophobicContact CG-CB 4.33Å; R524-A532 WeakPolarHBondContact CG-O 3.43Å; R524-D535 IonicContact CZ-OD2 3.52Å; R524-D535 IonicContact NE-OD2 2.79Å; R524-D535 IonicContact NH2-OD2 3.48Å; R524-D535 PolarHBondContact NH2-OD2 3.25Å
525	I	93.1	Very high	90.1	Very high	8 Å²	8	66.7 Å²	66.7	4%	0.041	36%	0.355	C	S	.	.			trans	-56.4	137.1	-178.1	-56.9	169.3	0	0	0	110.3	K489 I492 V493 L518 V523 A532 V537	K489-I525 HydrophobicContact CB-CG2 4.13Å; K489-I525 HydrophobicContact CG-CG2 3.97Å; I492-I525 HydrophobicContact CD1-CD1 4.39Å; I492-I525 HydrophobicContact CG2-CD1 3.64Å; V493-I525 HydrophobicContact CG2-CG2 3.99Å; L518-I525 HydrophobicContact CD2-CD1 4.49Å; L518-I525 WeakPolarHBondContact O-CD1 3.38Å; V523-I525 PolarHBondContact O-N 3.3Å; I525-A532 HydrophobicContact CB-CB 4.42Å; I525-A532 WeakPolarHBondContact O-CB 3.19Å; I525-A532 PolarHBondContact O-N 3.45Å; I525-V537 HydrophobicContact CD1-CG2 4.12Å
526	S	93.3	Very high	90.4	Very high	62 Å²	62	66.7 Å²	66.7	43%	0.434	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	152.1	174.3	68.1	0	0	0	0	112.1	R524 K530	R524-S526 PolarHBondContact O-N 2.84Å; S526-K530 CarbonylContact C-O 3.49Å; S526-K530 WeakPolarHBondContact CA-O 3.45Å; S526-K530 WeakPolarHBondContact CB-O 3.42Å
527	S	94.9	Very high	90.7	Very high	19 Å²	19	63.1 Å²	63.1	13%	0.133	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	131.6	172.8	-174.8	0	0	0	0	109.4	G529 K530	S527-G529 PolarHBondContact O-N 3.38Å; S527-G529 VanDerWaalsContact O-N 3.14Å; S527-K530 PolarHBondContact N-O 2.95Å; S527-K530 PolarHBondContact O-N 3.42Å
528	R	92.1	Very high	90.9	Very high	207 Å²	207	59 Å²	59	78%	0.781	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	38	179.7	-53.7	-178.3	-172.4	-177.3	7.5	113.9	E490 K530	E490-R528 IonicContact OE1-CZ 3.68Å; E490-R528 VanDerWaalsContact OE1-CZ 3.23Å; E490-R528 IonicContact OE1-NE 3.51Å; E490-R528 IonicContact OE1-NH1 2.56Å; E490-R528 IonicContact OE1-NH2 2.81Å; E490-R528 PolarHBondContact OE1-NH2 3.09Å; E490-R528 IonicContact OE2-CZ 3.51Å; E490-R528 VanDerWaalsContact OE2-CZ 3.31Å; E490-R528 IonicContact OE2-NE 3.57Å; E490-R528 IonicContact OE2-NH2 2.65Å; E490-R528 PolarHBondContact OE2-NH2 2.96Å; R528-K530 VanDerWaalsContact C-N 3.28Å; R528-K530 PolarHBondContact O-N 3.34Å
529	G	89.1	Confident	91	Very high	83 Å²	83	59.7 Å²	59.7	86%	0.856	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	2.1	179.8	0	0	0	0	0	115.3	S527	S527-G529 PolarHBondContact O-N 3.38Å; S527-G529 VanDerWaalsContact O-N 3.14Å
530	K	93.6	Very high	91.2	Very high	88 Å²	88	59 Å²	59	38%	0.383	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127.5	172	-171.8	-176.8	177.4	-164.8	0	109.9	V493 S526 S527 R528	V493-K530 HydrophobicContact CG1-CB 4.23Å; V493-K530 HydrophobicContact CG1-CD 3.95Å; V493-K530 HydrophobicContact CG1-CG 3.99Å; S526-K530 CarbonylContact C-O 3.49Å; S526-K530 WeakPolarHBondContact CA-O 3.45Å; S526-K530 WeakPolarHBondContact CB-O 3.42Å; S527-K530 PolarHBondContact N-O 2.95Å; S527-K530 PolarHBondContact O-N 3.42Å; R528-K530 VanDerWaalsContact C-N 3.28Å; R528-K530 PolarHBondContact O-N 3.34Å
531	L	94.9	Very high	91.8	Very high	106 Å²	106	59.9 Å²	59.9	56%	0.555	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	146.3	172.6	-74	159.4	0	0	0	110.7	R524	R524-L531 HydrophobicContact CB-CD2 4.22Å; R524-L531 HydrophobicContact CG-CD2 4.4Å
532	A	95.1	Very high	92.3	Very high	8 Å²	8	55.8 Å²	55.8	7%	0.066	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-62.7	133.3	167.9	0	0	0	0	0	110	V493 A496 R524 I525 R534	V493-A532 HydrophobicContact CG2-CB 4.2Å; A496-A532 HydrophobicContact CB-CB 3.8Å; R524-A532 HydrophobicContact CG-CB 4.33Å; R524-A532 WeakPolarHBondContact CG-O 3.43Å; I525-A532 HydrophobicContact CB-CB 4.42Å; I525-A532 WeakPolarHBondContact O-CB 3.19Å; I525-A532 PolarHBondContact O-N 3.45Å; A532-R534 VanDerWaalsContact C-N 3.27Å; A532-R534 PolarHBondContact O-N 2.76Å
533	E	94	Very high	92.6	Very high	112 Å²	112	52.5 Å²	52.5	52%	0.523	27%	0.272	S	S	.	.	S	Bend	trans	-68.5	-27.9	-176.2	-69.5	176.2	-148.9	0	0	112.7	K497	K497-E533 WeakPolarHBondContact CB-OE2 3.48Å
534	R	94	Very high	92.6	Very high	20 Å²	20	52.3 Å²	52.3	8%	0.075	27%	0.267	C	S	.	.	S	Bend	trans	-144.7	165.4	179.5	-65.5	-176.2	-58.4	102.3	6.4	109.5	A496 L498 A532 I536 Q570	A496-R534 VanDerWaalsContact O-CZ 3.26Å; A496-R534 PolarHBondContact O-NE 2.82Å; A496-R534 VanDerWaalsContact O-NE 3.13Å; A496-R534 PolarHBondContact O-NH2 3.27Å; L498-R534 PolarHBondContact O-NH2 3.02Å; A532-R534 VanDerWaalsContact C-N 3.27Å; A532-R534 PolarHBondContact O-N 2.76Å; R534-I536 HydrophobicContact CB-CG2 4.37Å; R534-Q570 PolarHBondContact NH1-O 3.28Å
535	D	94.1	Very high	92.1	Very high	19 Å²	19	49.5 Å²	49.5	10%	0.102	26%	0.257	C	S	.	.			trans	-82.9	134.9	165.9	-134.4	-36.9	0	0	0	108.8	G520 R524	G520-D535 WeakPolarHBondContact CA-OD2 3.34Å; G520-D535 VanDerWaalsContact O-OD2 3.13Å; R524-D535 IonicContact CZ-OD2 3.52Å; R524-D535 IonicContact NE-OD2 2.79Å; R524-D535 IonicContact NH2-OD2 3.48Å; R524-D535 PolarHBondContact NH2-OD2 3.25Å
536	I	96	Very high	91	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	28%	0.277	C	S	.	.			trans	-141.5	4.3	-177	66.3	158	0	0	0	112.2	I492 A495 M500 S501 I502 R534	I492-I536 HydrophobicContact CG2-CD1 4.09Å; I492-I536 HydrophobicContact CG2-CG1 3.96Å; A495-I536 HydrophobicContact CB-CD1 3.73Å; M500-I536 HydrophobicContact CG-CD1 4.47Å; M500-I536 WeakPolarHBondContact O-CG2 3.33Å; S501-I536 CarbonylContact C-O 3.51Å; S501-I536 WeakPolarHBondContact CA-O 3.38Å; I502-I536 HydrophobicContact CD1-CD1 4Å; I502-I536 HydrophobicContact CG1-CD1 4.43Å; I502-I536 PolarHBondContact N-O 3.25Å; R534-I536 HydrophobicContact CB-CG2 4.37Å
537	V	95.8	Very high	89.5	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.5	-179.3	-177.8	0	0	0	0	107.7	I492 I502 I504 L518 I525	I492-V537 HydrophobicContact CD1-CG2 4.01Å; I492-V537 HydrophobicContact CG1-CG2 4.31Å; I492-V537 HydrophobicContact CG2-CG2 3.84Å; I502-V537 HydrophobicContact CB-CG2 4.32Å; I502-V537 HydrophobicContact CD1-CG2 4.36Å; I502-V537 CarbonylContact O-C 3.29Å; I502-V537 VanDerWaalsContact O-CA 3.24Å; I502-V537 WeakPolarHBondContact O-CA 3.5Å; I504-V537 HydrophobicContact CD1-CG1 3.82Å; I504-V537 HydrophobicContact CG1-CG1 4.24Å; L518-V537 HydrophobicContact CB-CG1 4.26Å; L518-V537 WeakPolarHBondContact O-CB 3.02Å; L518-V537 VanDerWaalsContact O-CG1 3.31Å; L518-V537 WeakPolarHBondContact O-CG1 3.14Å; L518-V537 WeakPolarHBondContact O-CG2 3.4Å; I525-V537 HydrophobicContact CD1-CG2 4.12Å
538	Q	94.3	Very high	87.5	Confident	21 Å²	21	65 Å²	65	10%	0.098	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.2	163.8	176.3	66.7	63.5	0	0	108.3	I502 I503 I504 D519 V540 E566	I502-Q538 PolarHBondContact O-N 3.43Å; I503-Q538 CarbonylContact C-O 3.51Å; I503-Q538 WeakPolarHBondContact CA-O 3.3Å; I504-Q538 PolarHBondContact N-O 3.33Å; D519-Q538 WeakPolarHBondContact OD1-CA 3.12Å; Q538-V540 HydrophobicContact CG-CG2 4.03Å; Q538-E566 PolarHBondContact OE1-OE1 3.12Å
539	F	93.2	Very high	85.7	Confident	13 Å²	13	60.2 Å²	60.2	6%	0.057	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133.7	171.6	173.7	-114.9	0	0	0	111.5	I504 F512 M515 V516 D519 P541	I504-F539 HydrophobicContact CB-CD2 4.08Å; I504-F539 HydrophobicContact CG2-CD2 3.95Å; I504-F539 HydrophobicContact CG2-CE2 4.44Å; I504-F539 WeakPolarHBondContact O-CA 3.29Å; I504-F539 VanDerWaalsContact O-CD2 3.3Å; I504-F539 WeakPolarHBondContact O-CD2 3.42Å; F512-F539 HydrophobicContact CB-CE1 3.72Å; F512-F539 HydrophobicContact CB-CE2 4.35Å; F512-F539 HydrophobicContact CB-CZ 3.4Å; F512-F539 HydrophobicContact CD1-CE2 4.23Å; F512-F539 AromaticContact CD1-CZ 3.89Å; F512-F539 HydrophobicContact CD1-CZ 3.89Å; F512-F539 AromaticContact CD2-CZ 3.9Å; F512-F539 HydrophobicContact CD2-CZ 3.9Å; F512-F539 HydrophobicContact CG-CE1 4.27Å; F512-F539 HydrophobicContact CG-CE2 4.27Å; F512-F539 AromaticContact CG-CZ 3.48Å; F512-F539 HydrophobicContact CG-CZ 3.48Å; F512-F539 VanDerWaalsContact CG-CZ 3.48Å; M515-F539 HydrophobicContact CB-CB 4.34Å; M515-F539 HydrophobicContact CB-CD1 3.9Å; M515-F539 HydrophobicContact CB-CD2 3.35Å; M515-F539 HydrophobicContact CB-CE1 4.05Å; M515-F539 HydrophobicContact CB-CE2 3.52Å; M515-F539 HydrophobicContact CB-CG 3.57Å; M515-F539 HydrophobicContact CB-CZ 3.89Å; M515-F539 HydrophobicContact CG-CD2 3.93Å; M515-F539 HydrophobicContact CG-CE2 3.84Å; M515-F539 HydrophobicContact CG-CZ 4.45Å; V516-F539 HydrophobicContact CG2-CD1 4.01Å; V516-F539 HydrophobicContact CG2-CE1 4.04Å; D519-F539 HydrophobicContact CB-CB 4.25Å; D519-F539 PolarHBondContact OD1-N 2.84Å; F539-P541 HydrophobicContact CE1-CB 4.3Å; F539-P541 HydrophobicContact CE1-CG 4.33Å; F539-P541 HydrophobicContact CZ-CB 4.01Å; F539-P541 HydrophobicContact CZ-CG 4.5Å
540	V	92.1	Very high	84	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.024	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	119.7	173.4	-175.5	0	0	0	0	111.3	I504 V505 G506 Q538 F542 Y545 L559 V563	I504-V540 PolarHBondContact O-N 3.43Å; V505-V540 WeakPolarHBondContact CA-O 3.43Å; G506-V540 PolarHBondContact N-O 3.46Å; Q538-V540 HydrophobicContact CG-CG2 4.03Å; V540-F542 PolarHBondContact O-N 3.46Å; V540-Y545 HydrophobicContact CG1-CD2 4.31Å; V540-Y545 HydrophobicContact CG1-CE2 3.4Å; V540-Y545 VanDerWaalsContact CG1-CE2 3.4Å; V540-L559 HydrophobicContact CG1-CD1 3.79Å; V540-V563 HydrophobicContact CB-CG2 3.7Å; V540-V563 HydrophobicContact CG1-CG2 3.96Å; V540-V563 HydrophobicContact CG2-CB 4.33Å; V540-V563 HydrophobicContact CG2-CG2 3.61Å
541	P	92.4	Very high	82.6	Confident	22 Å²	22	57.3 Å²	57.3	14%	0.143	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	116.1	171.9	30.4	-34.2	0	0	0	110.9	F512 F539 R543 D544 Y545	F512-P541 HydrophobicContact CD2-CB 4.16Å; F512-P541 HydrophobicContact CE2-CB 4.24Å; F539-P541 HydrophobicContact CE1-CB 4.3Å; F539-P541 HydrophobicContact CE1-CG 4.33Å; F539-P541 HydrophobicContact CZ-CB 4.01Å; F539-P541 HydrophobicContact CZ-CG 4.5Å; P541-R543 HydrophobicContact CB-CG 4.43Å; P541-R543 PolarHBondContact O-N 2.83Å; P541-R543 VanDerWaalsContact O-N 3.16Å; P541-D544 HydrophobicContact CG-CB 4.45Å; P541-D544 WeakPolarHBondContact CG-OD2 3.12Å; P541-D544 PolarHBondContact O-N 3.32Å; P541-Y545 WeakPolarHBondContact O-CE2 3.34Å
542	F	89.9	Confident	81.2	Confident	9 Å²	9	56.8 Å²	56.8	4%	0.039	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-58	-33.1	-178.7	-174.6	-94.4	0	0	0	113.1	A375 L378 A379 V505 G506 V507 V540 D544 Y545 V546 M556 L559	A375-F542 HydrophobicContact CB-CD1 3.99Å; A375-F542 HydrophobicContact CB-CE1 3.82Å; A375-F542 HydrophobicContact CB-CZ 4.37Å; L378-F542 HydrophobicContact CB-CE2 4.01Å; L378-F542 HydrophobicContact CB-CZ 3.7Å; L378-F542 HydrophobicContact CD1-CZ 4Å; A379-F542 HydrophobicContact CB-CD2 3.96Å; A379-F542 HydrophobicContact CB-CE2 4.05Å; V505-F542 HydrophobicContact CG1-CB 3.98Å; V505-F542 HydrophobicContact CG1-CD2 4.27Å; G506-F542 VanDerWaalsContact O-CB 3.25Å; G506-F542 WeakPolarHBondContact O-CB 3.33Å; G506-F542 PolarHBondContact O-N 2.82Å; V507-F542 HydrophobicContact CG1-CB 3.97Å; V507-F542 HydrophobicContact CG1-CG 4.19Å; V540-F542 PolarHBondContact O-N 3.46Å; F542-D544 PolarHBondContact O-N 2.88Å; F542-D544 VanDerWaalsContact O-N 3.17Å; F542-Y545 PolarHBondContact O-N 2.94Å; F542-Y545 VanDerWaalsContact O-N 3.12Å; F542-V546 HydrophobicContact CD1-CG2 3.56Å; F542-V546 HydrophobicContact CE1-CG2 3.31Å; F542-V546 HydrophobicContact CZ-CG2 4.26Å; F542-M556 HydrophobicContact CE2-CE 3.76Å; F542-M556 HydrophobicContact CE2-SD 4.15Å; F542-M556 HydrophobicContact CZ-CE 3.68Å; F542-M556 HydrophobicContact CZ-SD 4.33Å; F542-L559 HydrophobicContact CD2-CD1 4.23Å; F542-L559 HydrophobicContact CD2-CD2 3.45Å; F542-L559 VanDerWaalsContact CD2-CD2 3.45Å; F542-L559 HydrophobicContact CD2-CG 4.48Å; F542-L559 HydrophobicContact CE2-CD2 3.44Å; F542-L559 VanDerWaalsContact CE2-CD2 3.44Å
543	R	86.8	Confident	79.9	Confident	90 Å²	90	59 Å²	59	34%	0.34	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-60.6	-25.3	-176.4	70.7	-175.4	173.9	-153.6	-5.7	113.6	A510 P541 Y545 V546	A510-R543 PolarHBondContact O-NH1 2.9Å; P541-R543 HydrophobicContact CB-CG 4.43Å; P541-R543 PolarHBondContact O-N 2.83Å; P541-R543 VanDerWaalsContact O-N 3.16Å; R543-Y545 PolarHBondContact O-N 2.85Å; R543-V546 PolarHBondContact O-N 2.8Å
544	D	84.9	Confident	78.7	Confident	110 Å²	110	55.2 Å²	55.2	59%	0.588	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-71.5	-13.9	-178.2	-66.3	4.4	0	0	0	112	P541 F542	P541-D544 HydrophobicContact CG-CB 4.45Å; P541-D544 WeakPolarHBondContact CG-OD2 3.12Å; P541-D544 PolarHBondContact O-N 3.32Å; F542-D544 PolarHBondContact O-N 2.88Å; F542-D544 VanDerWaalsContact O-N 3.17Å
545	Y	80.4	Confident	77.8	Confident	38 Å²	38	54.7 Å²	54.7	15%	0.149	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-107.8	-10.9	-178.7	-54.8	-83.5	0	0	0	112.6	V540 P541 F542 R543 D547 S555 R558 L559 D562	V540-Y545 HydrophobicContact CG1-CD2 4.31Å; V540-Y545 HydrophobicContact CG1-CE2 3.4Å; V540-Y545 VanDerWaalsContact CG1-CE2 3.4Å; P541-Y545 WeakPolarHBondContact O-CE2 3.34Å; F542-Y545 PolarHBondContact O-N 2.94Å; F542-Y545 VanDerWaalsContact O-N 3.12Å; R543-Y545 PolarHBondContact O-N 2.85Å; Y545-D547 PolarHBondContact O-N 3.31Å; Y545-S555 WeakPolarHBondContact O-CB 3.08Å; Y545-R558 HydrophobicContact CD1-CB 3.63Å; Y545-R558 HydrophobicContact CE1-CB 3.94Å; Y545-L559 HydrophobicContact CD1-CB 4.26Å; Y545-L559 HydrophobicContact CD2-CB 4.19Å; Y545-L559 HydrophobicContact CD2-CD1 3.7Å; Y545-L559 HydrophobicContact CE2-CD1 4.03Å; Y545-L559 HydrophobicContact CG-CB 3.91Å; Y545-L559 HydrophobicContact CG-CD1 4.3Å; Y545-D562 WeakPolarHBondContact CE1-OD2 3.44Å; Y545-D562 WeakPolarHBondContact OH-CB 3.23Å; Y545-D562 PolarHBondContact OH-OD2 2.88Å
546	V	70.2	Confident	77	Confident	76 Å²	76	55.2 Å²	55.2	46%	0.461	28%	0.282	S	S	.	.			trans	-79.1	90.6	179.4	-174.3	0	0	0	0	109.8	F542 R543	F542-V546 HydrophobicContact CD1-CG2 3.56Å; F542-V546 HydrophobicContact CE1-CG2 3.31Å; F542-V546 HydrophobicContact CZ-CG2 4.26Å; R543-V546 PolarHBondContact O-N 2.8Å
547	D	61.3	Low	76.1	Confident	87 Å²	87	56.8 Å²	56.8	47%	0.465	30%	0.295	S	S	.	.			trans	-72.3	137.9	177.3	-163.2	-1.3	0	0	0	111.7	Y545 T549	Y545-D547 PolarHBondContact O-N 3.31Å; D547-T549 PolarHBondContact O-N 2.72Å; D547-T549 PolarHBondContact OD1-N 2.78Å; D547-T549 PolarHBondContact OD2-OG1 3.3Å
548	R	52.8	Low	75.5	Confident	251 Å²	251	62.6 Å²	62.6	95%	0.947	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-12.9	176.4	-73.8	179.8	167	179.7	-3.3	112.8
549	T	55.4	Low	75.1	Confident	106 Å²	106	61.6 Å²	61.6	65%	0.65	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-10.3	-177.5	66.2	0	0	0	0	114.3	D547	D547-T549 PolarHBondContact O-N 2.72Å; D547-T549 PolarHBondContact OD1-N 2.78Å; D547-T549 PolarHBondContact OD2-OG1 3.3Å
550	G	53.7	Low	74.8	Confident	43 Å²	43	61.1 Å²	61.1	44%	0.443	31%	0.311	S	S	.	.			trans	82.2	7.6	173.9	0	0	0	0	0	116.1	H552	G550-H552 VanDerWaalsContact C-N 3.27Å; G550-H552 PolarHBondContact O-CD2 2.88Å; G550-H552 PolarHBondContact O-N 3.17Å
551	N	63.8	Low	74.5	Confident	68 Å²	68	65.6 Å²	65.6	36%	0.364	33%	0.327	S	S	.	.			trans	-82.1	72.6	172.5	-166.5	-5.4	0	0	0	111.6	V553 L554 S555	N551-V553 PolarHBondContact O-N 2.82Å; N551-L554 PolarHBondContact O-N 2.91Å; N551-S555 PolarHBondContact O-OG 2.8Å
552	H	65.6	Low	74.2	Confident	95 Å²	95	66.6 Å²	66.6	44%	0.44	33%	0.331	S	S	.	.	H	α-helix	trans	-57.1	-21.6	-176.7	-66.8	-69.6	0	0	0	114.4	G550 S555 M556	G550-H552 VanDerWaalsContact C-N 3.27Å; G550-H552 PolarHBondContact O-CD2 2.88Å; G550-H552 PolarHBondContact O-N 3.17Å; H552-S555 WeakPolarHBondContact CA-OG 3.42Å; H552-S555 PolarHBondContact O-OG 3.42Å; H552-M556 WeakPolarHBondContact O-CG 3.15Å; H552-M556 PolarHBondContact O-N 2.75Å
553	V	66.6	Low	74.1	Confident	55 Å²	55	66.2 Å²	66.2	33%	0.333	33%	0.33	S	S	.	.	H	α-helix	trans	-73.9	-47.9	-177.1	179.3	0	0	0	0	111	K57 N551 S555 M556 A557	K57-V553 VanDerWaalsContact CE-CG1 3.5Å; N551-V553 PolarHBondContact O-N 2.82Å; V553-S555 VanDerWaalsContact C-N 3.32Å; V553-S555 PolarHBondContact O-N 3.09Å; V553-M556 PolarHBondContact O-N 3.28Å; V553-A557 PolarHBondContact O-N 2.64Å
554	L	70	Confident	74.3	Confident	32 Å²	32	62 Å²	62	17%	0.168	31%	0.314	C	S	.	.	H	α-helix	trans	-68.2	-36.4	-178.1	-166.6	67.4	0	0	0	111.3	E55 N551 A557 R558	E55-L554 HydrophobicContact CG-CD1 3.73Å; E55-L554 HydrophobicContact CG-CD2 4.4Å; N551-L554 PolarHBondContact O-N 2.91Å; L554-A557 PolarHBondContact O-N 2.74Å; L554-R558 WeakPolarHBondContact O-CG 3.31Å; L554-R558 PolarHBondContact O-N 2.89Å
555	S	74	Confident	74.2	Confident	9 Å²	9	57.9 Å²	57.9	6%	0.063	30%	0.295	C	S	.	.	H	α-helix	trans	-61.2	-42.8	173.4	47	0	0	0	0	112.9	Y545 N551 H552 V553 R558 L559	Y545-S555 WeakPolarHBondContact O-CB 3.08Å; N551-S555 PolarHBondContact O-OG 2.8Å; H552-S555 WeakPolarHBondContact CA-OG 3.42Å; H552-S555 PolarHBondContact O-OG 3.42Å; V553-S555 VanDerWaalsContact C-N 3.32Å; V553-S555 PolarHBondContact O-N 3.09Å; S555-R558 PolarHBondContact O-N 2.85Å; S555-L559 WeakPolarHBondContact O-CB 3.42Å; S555-L559 PolarHBondContact O-N 3.42Å
556	M	77.8	Confident	74.7	Confident	29 Å²	29	58.5 Å²	58.5	14%	0.143	30%	0.299	C	S	.	.	H	α-helix	trans	-71.3	-35.6	-179.7	-69.2	-55.9	96	0	0	111.7	L378 A382 F542 H552 V553 L559 A560	L378-M556 HydrophobicContact CB-SD 3.9Å; L378-M556 HydrophobicContact CD2-SD 4.27Å; A382-M556 HydrophobicContact CB-CB 4.22Å; A382-M556 HydrophobicContact CB-SD 4.01Å; F542-M556 HydrophobicContact CE2-CE 3.76Å; F542-M556 HydrophobicContact CE2-SD 4.15Å; F542-M556 HydrophobicContact CZ-CE 3.68Å; F542-M556 HydrophobicContact CZ-SD 4.33Å; H552-M556 WeakPolarHBondContact O-CG 3.15Å; H552-M556 PolarHBondContact O-N 2.75Å; V553-M556 PolarHBondContact O-N 3.28Å; M556-L559 HydrophobicContact CE-CD2 4.22Å; M556-L559 PolarHBondContact O-N 3.38Å; M556-L559 HydrophobicContact SD-CD2 4.15Å; M556-A560 WeakPolarHBondContact O-CB 3.33Å; M556-A560 PolarHBondContact O-N 2.74Å
557	A	77.8	Confident	75.8	Confident	34 Å²	34	54.9 Å²	54.9	28%	0.281	28%	0.278	S	S	.	.	H	α-helix	trans	-62.3	-43.6	173.6	0	0	0	0	0	111.7	M54 V553 L554 A560 R561	M54-A557 HydrophobicContact SD-CB 4.36Å; V553-A557 PolarHBondContact O-N 2.64Å; L554-A557 PolarHBondContact O-N 2.74Å; A557-A560 PolarHBondContact O-N 3.12Å; A557-R561 WeakPolarHBondContact O-CB 3.43Å; A557-R561 PolarHBondContact O-N 2.7Å
558	R	82.3	Confident	77.3	Confident	123 Å²	123	51.7 Å²	51.7	46%	0.464	26%	0.262	S	S	.	.	H	α-helix	trans	-65.9	-42.4	176.1	-70.4	176.6	-174.8	178.9	1.6	112.7	Y545 L554 S555 R561 D562	Y545-R558 HydrophobicContact CD1-CB 3.63Å; Y545-R558 HydrophobicContact CE1-CB 3.94Å; L554-R558 WeakPolarHBondContact O-CG 3.31Å; L554-R558 PolarHBondContact O-N 2.89Å; S555-R558 PolarHBondContact O-N 2.85Å; R558-R561 WeakPolarHBondContact O-CB 3.49Å; R558-R561 PolarHBondContact O-N 2.65Å; R558-D562 PolarHBondContact O-N 3.2Å; R558-D562 VanDerWaalsContact O-N 3.08Å
559	L	85.6	Confident	79.1	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.1	-51.4	174.4	173.5	70.6	0	0	0	110.7	A382 V540 F542 Y545 S555 M556 R561 D562 V563	A382-L559 HydrophobicContact CB-CD2 3.99Å; V540-L559 HydrophobicContact CG1-CD1 3.79Å; F542-L559 HydrophobicContact CD2-CD1 4.23Å; F542-L559 HydrophobicContact CD2-CD2 3.45Å; F542-L559 VanDerWaalsContact CD2-CD2 3.45Å; F542-L559 HydrophobicContact CD2-CG 4.48Å; F542-L559 HydrophobicContact CE2-CD2 3.44Å; F542-L559 VanDerWaalsContact CE2-CD2 3.44Å; Y545-L559 HydrophobicContact CD1-CB 4.26Å; Y545-L559 HydrophobicContact CD2-CB 4.19Å; Y545-L559 HydrophobicContact CD2-CD1 3.7Å; Y545-L559 HydrophobicContact CE2-CD1 4.03Å; Y545-L559 HydrophobicContact CG-CB 3.91Å; Y545-L559 HydrophobicContact CG-CD1 4.3Å; S555-L559 WeakPolarHBondContact O-CB 3.42Å; S555-L559 PolarHBondContact O-N 3.42Å; M556-L559 HydrophobicContact CE-CD2 4.22Å; M556-L559 PolarHBondContact O-N 3.38Å; M556-L559 HydrophobicContact SD-CD2 4.15Å; L559-R561 VanDerWaalsContact C-N 3.27Å; L559-R561 PolarHBondContact O-N 3.4Å; L559-D562 PolarHBondContact O-N 3.49Å; L559-V563 HydrophobicContact CD1-CG2 3.79Å; L559-V563 HydrophobicContact CG-CG2 4.13Å; L559-V563 VanDerWaalsContact O-CB 3.26Å; L559-V563 WeakPolarHBondContact O-CB 3.29Å; L559-V563 WeakPolarHBondContact O-CG2 3.37Å; L559-V563 PolarHBondContact O-N 3.38Å
560	A	86.8	Confident	81	Confident	2 Å²	2	40.6 Å²	40.6	2%	0.017	22%	0.217	C	C	.	.	H	α-helix	trans	-62.3	-38.4	-178.4	0	0	0	0	0	111.7	A382 I386 M556 A557 V563 L564	A382-A560 HydrophobicContact CB-CB 4.4Å; A382-A560 WeakPolarHBondContact O-CB 3.37Å; I386-A560 HydrophobicContact CD1-CB 3.58Å; M556-A560 WeakPolarHBondContact O-CB 3.33Å; M556-A560 PolarHBondContact O-N 2.74Å; A557-A560 PolarHBondContact O-N 3.12Å; A560-V563 PolarHBondContact O-N 3.07Å; A560-L564 VanDerWaalsContact O-CB 3.3Å; A560-L564 WeakPolarHBondContact O-CB 3.33Å; A560-L564 PolarHBondContact O-N 3.34Å
561	R	85.6	Confident	83.1	Confident	99 Å²	99	38.5 Å²	38.5	37%	0.374	20%	0.196	S	C	.	.	H	α-helix	trans	-54.9	-55.5	174.3	-173.2	-163.8	64.6	-170.8	-2	111.4	E87 A557 R558 L559 V563 L564 A565	E87-R561 HydrophobicContact CG-CB 3.96Å; E87-R561 HydrophobicContact CG-CG 3.5Å; A557-R561 WeakPolarHBondContact O-CB 3.43Å; A557-R561 PolarHBondContact O-N 2.7Å; R558-R561 WeakPolarHBondContact O-CB 3.49Å; R558-R561 PolarHBondContact O-N 2.65Å; L559-R561 VanDerWaalsContact C-N 3.27Å; L559-R561 PolarHBondContact O-N 3.4Å; R561-V563 VanDerWaalsContact C-N 3.35Å; R561-V563 PolarHBondContact O-N 2.87Å; R561-L564 PolarHBondContact O-N 3.45Å; R561-A565 WeakPolarHBondContact O-CB 3.42Å; R561-A565 PolarHBondContact O-N 3.26Å; R561-A565 VanDerWaalsContact O-N 3.11Å
562	D	86.4	Confident	84.5	Confident	43 Å²	43	36.8 Å²	36.8	23%	0.23	19%	0.188	C	C	.	.	H	α-helix	trans	-74.6	-29.1	-173.6	-62.6	-11.6	0	0	0	111.5	Y545 R558 L559	Y545-D562 WeakPolarHBondContact CE1-OD2 3.44Å; Y545-D562 WeakPolarHBondContact OH-CB 3.23Å; Y545-D562 PolarHBondContact OH-OD2 2.88Å; R558-D562 PolarHBondContact O-N 3.2Å; R558-D562 VanDerWaalsContact O-N 3.08Å; L559-D562 PolarHBondContact O-N 3.49Å
563	V	87.6	Confident	85.8	Confident	1 Å²	1	35 Å²	35	1%	0.006	19%	0.186	C	C	.	.	H	α-helix	trans	-70.6	-37.5	175.9	166.6	0	0	0	0	113.3	V383 I503 V505 V540 L559 A560 R561	V383-V563 HydrophobicContact CG1-CG1 4.24Å; V383-V563 HydrophobicContact CG2-CB 4.21Å; V383-V563 HydrophobicContact CG2-CG1 3.48Å; V383-V563 VanDerWaalsContact CG2-CG1 3.48Å; V383-V563 HydrophobicContact CG2-CG2 4.49Å; I503-V563 HydrophobicContact CB-CG1 4.48Å; I503-V563 HydrophobicContact CD1-CG1 3.93Å; I503-V563 HydrophobicContact CG1-CG1 4.44Å; I503-V563 HydrophobicContact CG2-CG1 3.35Å; V505-V563 HydrophobicContact CG2-CG2 3.98Å; V540-V563 HydrophobicContact CB-CG2 3.7Å; V540-V563 HydrophobicContact CG1-CG2 3.96Å; V540-V563 HydrophobicContact CG2-CB 4.33Å; V540-V563 HydrophobicContact CG2-CG2 3.61Å; L559-V563 HydrophobicContact CD1-CG2 3.79Å; L559-V563 HydrophobicContact CG-CG2 4.13Å; L559-V563 VanDerWaalsContact O-CB 3.26Å; L559-V563 WeakPolarHBondContact O-CB 3.29Å; L559-V563 WeakPolarHBondContact O-CG2 3.37Å; L559-V563 PolarHBondContact O-N 3.38Å; A560-V563 PolarHBondContact O-N 3.07Å; R561-V563 VanDerWaalsContact C-N 3.35Å; R561-V563 PolarHBondContact O-N 2.87Å
564	L	91	Very high	87.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-99.5	-6	-172.8	-71	173.3	0	0	0	113.5	F86 E87 V383 I386 I387 I503 A560 R561 E566 I567	F86-L564 HydrophobicContact CD1-CB 4.09Å; F86-L564 WeakPolarHBondContact CD1-O 3.33Å; F86-L564 HydrophobicContact CE1-CB 3.76Å; F86-L564 HydrophobicContact CE1-CD2 4Å; F86-L564 HydrophobicContact CE1-CG 4.31Å; F86-L564 WeakPolarHBondContact CE1-O 3.19Å; F86-L564 HydrophobicContact CZ-CD2 4.36Å; E87-L564 HydrophobicContact CB-CB 3.69Å; V383-L564 HydrophobicContact CG1-CD2 3.98Å; V383-L564 HydrophobicContact CG1-CG 4.4Å; I386-L564 HydrophobicContact CB-CD1 3.77Å; I386-L564 HydrophobicContact CD1-CD1 4.08Å; I386-L564 HydrophobicContact CG1-CD1 4.46Å; I386-L564 HydrophobicContact CG2-CD1 3.71Å; I387-L564 HydrophobicContact CD1-CD2 4.11Å; I503-L564 HydrophobicContact CD1-CD2 4Å; A560-L564 VanDerWaalsContact O-CB 3.3Å; A560-L564 WeakPolarHBondContact O-CB 3.33Å; A560-L564 PolarHBondContact O-N 3.34Å; R561-L564 PolarHBondContact O-N 3.45Å; L564-E566 VanDerWaalsContact C-N 3.28Å; L564-E566 PolarHBondContact O-N 3.1Å; L564-I567 HydrophobicContact CD2-CG1 4.35Å; L564-I567 PolarHBondContact O-N 3.44Å
565	A	84.6	Confident	88.4	Confident	25 Å²	25	30.9 Å²	30.9	21%	0.207	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-40.1	-171.5	0	0	0	0	0	113.8	I20 R561	I20-A565 HydrophobicContact CD1-CB 4.26Å; R561-A565 WeakPolarHBondContact O-CB 3.42Å; R561-A565 PolarHBondContact O-N 3.26Å; R561-A565 VanDerWaalsContact O-N 3.11Å
566	E	89.7	Confident	89.2	Confident	50 Å²	50	36.9 Å²	36.9	23%	0.234	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-15.9	-172.5	-61.9	-160.9	163.8	0	0	115.1	Q538 L564 D569 Q570	Q538-E566 PolarHBondContact OE1-OE1 3.12Å; L564-E566 VanDerWaalsContact C-N 3.28Å; L564-E566 PolarHBondContact O-N 3.1Å; E566-D569 PolarHBondContact O-N 2.86Å; E566-D569 VanDerWaalsContact O-N 3.15Å; E566-Q570 HydrophobicContact CB-CG 4.18Å; E566-Q570 WeakPolarHBondContact O-CB 3.39Å; E566-Q570 VanDerWaalsContact O-CG 3.32Å; E566-Q570 WeakPolarHBondContact O-CG 3.37Å; E566-Q570 PolarHBondContact O-N 3.43Å; E566-Q570 PolarHBondContact OE2-NE2 3.12Å
567	I	94	Very high	89.8	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-57.5	-43.5	-173.3	-60.3	-61.3	0	0	0	112.5	F86 V473 S501 I503 L564 D569 Q570 L571	F86-I567 HydrophobicContact CE1-CB 3.75Å; F86-I567 HydrophobicContact CE1-CG1 4.33Å; F86-I567 HydrophobicContact CE1-CG2 4.05Å; F86-I567 HydrophobicContact CZ-CB 4.21Å; F86-I567 HydrophobicContact CZ-CG2 3.99Å; V473-I567 HydrophobicContact CG1-CD1 4.19Å; V473-I567 HydrophobicContact CG2-CD1 4.21Å; V473-I567 HydrophobicContact CG2-CG2 4.13Å; S501-I567 VanDerWaalsContact CB-CD1 3.45Å; I503-I567 HydrophobicContact CD1-CD1 4.01Å; I503-I567 HydrophobicContact CD1-CG1 4.2Å; I503-I567 HydrophobicContact CG1-CD1 4.15Å; L564-I567 HydrophobicContact CD2-CG1 4.35Å; L564-I567 PolarHBondContact O-N 3.44Å; I567-D569 PolarHBondContact O-N 2.86Å; I567-Q570 PolarHBondContact O-N 3Å; I567-L571 WeakPolarHBondContact O-CB 3.49Å; I567-L571 PolarHBondContact O-N 3.31Å
568	P	93.1	Very high	90.6	Very high	20 Å²	20	41.6 Å²	41.6	13%	0.13	22%	0.215	C	C	.	.	H	α-helix	trans	-57.1	-46.4	176.4	-27	37.5	0	0	0	113.1	F86 F334 L571 V572	F86-P568 HydrophobicContact CB-CG 3.83Å; F86-P568 HydrophobicContact CD1-CG 3.59Å; F86-P568 HydrophobicContact CE1-CG 4.3Å; F86-P568 HydrophobicContact CG-CG 3.72Å; F334-P568 HydrophobicContact CB-CB 3.94Å; F334-P568 HydrophobicContact CD1-CB 4.44Å; F334-P568 HydrophobicContact CD2-CB 3.92Å; F334-P568 HydrophobicContact CD2-CG 4.45Å; F334-P568 HydrophobicContact CG-CB 3.85Å; F334-P568 HydrophobicContact CG-CG 4.43Å; P568-L571 PolarHBondContact O-N 3.47Å; P568-V572 VanDerWaalsContact O-CG2 3.31Å; P568-V572 WeakPolarHBondContact O-CG2 3.43Å; P568-V572 PolarHBondContact O-N 3.15Å
569	D	90.8	Very high	91.1	Very high	113 Å²	113	38.8 Å²	38.8	60%	0.604	22%	0.224	S	C	*	.	H	α-helix	trans	-72.3	-40.9	-177.4	-75.1	-14.7	0	0	0	111.8	E566 I567 L571 V572 S573	E566-D569 PolarHBondContact O-N 2.86Å; E566-D569 VanDerWaalsContact O-N 3.15Å; I567-D569 PolarHBondContact O-N 2.86Å; D569-L571 VanDerWaalsContact C-N 3.28Å; D569-L571 PolarHBondContact O-N 3.32Å; D569-V572 PolarHBondContact O-N 2.94Å; D569-S573 WeakPolarHBondContact O-CB 3.28Å; D569-S573 PolarHBondContact O-N 2.89Å
570	Q	94.9	Very high	91.6	Very high	10 Å²	10	40.2 Å²	40.2	5%	0.047	23%	0.232	C	C	.	.	H	α-helix	trans	-61.6	-36.7	174.8	-68.7	-179	4.4	0	0	111.6	Y471 S501 R534 E566 I567 Y574	Y471-Q570 VanDerWaalsContact OH-C 3.25Å; Y471-Q570 PolarHBondContact OH-O 2.8Å; S501-Q570 PolarHBondContact OG-OE1 3.05Å; R534-Q570 PolarHBondContact NH1-O 3.28Å; E566-Q570 HydrophobicContact CB-CG 4.18Å; E566-Q570 WeakPolarHBondContact O-CB 3.39Å; E566-Q570 VanDerWaalsContact O-CG 3.32Å; E566-Q570 WeakPolarHBondContact O-CG 3.37Å; E566-Q570 PolarHBondContact O-N 3.43Å; E566-Q570 PolarHBondContact OE2-NE2 3.12Å; I567-Q570 PolarHBondContact O-N 3Å; Q570-Y574 PolarHBondContact O-N 3.02Å; Q570-Y574 VanDerWaalsContact O-N 3.15Å
571	L	96.3	Very high	91.9	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-68	-53.6	174.3	-174.6	157.8	0	0	0	111.4	F334 Y337 T342 Y471 I567 P568 D569 S573 Y574 M575	F334-L571 HydrophobicContact CD2-CD1 4.22Å; F334-L571 HydrophobicContact CD2-CD2 4.44Å; F334-L571 HydrophobicContact CE2-CD1 3.99Å; Y337-L571 HydrophobicContact CD2-CD2 4.06Å; Y337-L571 HydrophobicContact CG-CD2 4.14Å; T342-L571 HydrophobicContact CG2-CD1 4.44Å; Y471-L571 HydrophobicContact CD1-CB 4.38Å; Y471-L571 HydrophobicContact CD1-CD1 4.08Å; Y471-L571 HydrophobicContact CD1-CG 4.36Å; Y471-L571 HydrophobicContact CD2-CB 4.22Å; Y471-L571 HydrophobicContact CD2-CD1 4.16Å; Y471-L571 HydrophobicContact CD2-CG 3.8Å; Y471-L571 HydrophobicContact CE1-CB 4.22Å; Y471-L571 HydrophobicContact CE2-CB 4.06Å; Y471-L571 HydrophobicContact CE2-CG 4.12Å; Y471-L571 HydrophobicContact CG-CB 4.36Å; Y471-L571 HydrophobicContact CG-CD1 3.74Å; Y471-L571 HydrophobicContact CG-CG 3.91Å; Y471-L571 PolarHBondContact OH-N 2.81Å; I567-L571 WeakPolarHBondContact O-CB 3.49Å; I567-L571 PolarHBondContact O-N 3.31Å; P568-L571 PolarHBondContact O-N 3.47Å; D569-L571 VanDerWaalsContact C-N 3.28Å; D569-L571 PolarHBondContact O-N 3.32Å; L571-S573 VanDerWaalsContact C-N 3.29Å; L571-S573 PolarHBondContact O-N 2.65Å; L571-Y574 WeakPolarHBondContact O-CB 3.25Å; L571-Y574 PolarHBondContact O-N 3.04Å; L571-M575 WeakPolarHBondContact O-CG 3.48Å; L571-M575 PolarHBondContact O-N 3.32Å; L571-M575 HydrophobicContact CG-CE 4.34Å; L571-M575 HydrophobicContact CD2-CG 3.85Å; L571-M575 HydrophobicContact CD2-CE 4Å
572	V	93.4	Very high	92.1	Very high	32 Å²	32	45 Å²	45	19%	0.194	25%	0.254	C	S	.	.	H	α-helix	trans	-61.5	-40.8	-178.5	172.8	0	0	0	0	110.7	F334 Y337 P568 D569 Y574 M575 K576	F334-V572 HydrophobicContact CB-CG2 4.1Å; Y337-V572 HydrophobicContact CD2-CG2 4.38Å; Y337-V572 HydrophobicContact CE2-CG2 4.4Å; P568-V572 VanDerWaalsContact O-CG2 3.31Å; P568-V572 WeakPolarHBondContact O-CG2 3.43Å; P568-V572 PolarHBondContact O-N 3.15Å; D569-V572 PolarHBondContact O-N 2.94Å; V572-Y574 PolarHBondContact O-N 2.84Å; V572-M575 PolarHBondContact O-N 2.87Å; V572-K576 VanDerWaalsContact O-CB 3.3Å; V572-K576 WeakPolarHBondContact O-CB 3.02Å; V572-K576 PolarHBondContact O-N 3.39Å
573	S	92.5	Very high	92.4	Very high	57 Å²	57	47.3 Å²	47.3	40%	0.399	26%	0.259	S	S	.	.	H	α-helix	trans	-58.7	-45.6	175.1	179.1	0	0	0	0	112.1	D569 L571 A577	D569-S573 WeakPolarHBondContact O-CB 3.28Å; D569-S573 PolarHBondContact O-N 2.89Å; L571-S573 VanDerWaalsContact C-N 3.29Å; L571-S573 PolarHBondContact O-N 2.65Å; S573-A577 VanDerWaalsContact O-CB 3.31Å; S573-A577 WeakPolarHBondContact O-CB 3.22Å; S573-A577 PolarHBondContact O-N 3.08Å
574	Y	96.3	Very high	92.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60	-51.4	173.8	169.2	-94.8	0	0	0	111.8	Y471 L498 P499 Q570 L571 V572 K576 A577 Q578 I580	Y471-Y574 HydrophobicContact CD2-CD1 4.31Å; Y471-Y574 HydrophobicContact CE2-CD1 4.16Å; Y471-Y574 HydrophobicContact CE2-CG 4.12Å; L498-Y574 VanDerWaalsContact C-CE2 3.42Å; P499-Y574 HydrophobicContact CB-CD1 4Å; P499-Y574 HydrophobicContact CB-CE1 3.51Å; P499-Y574 HydrophobicContact CB-CE2 4.08Å; P499-Y574 WeakPolarHBondContact CD-OH 3.41Å; P499-Y574 HydrophobicContact CG-CE1 4.38Å; Q570-Y574 PolarHBondContact O-N 3.02Å; Q570-Y574 VanDerWaalsContact O-N 3.15Å; L571-Y574 WeakPolarHBondContact O-CB 3.25Å; L571-Y574 PolarHBondContact O-N 3.04Å; V572-Y574 PolarHBondContact O-N 2.84Å; Y574-K576 VanDerWaalsContact C-N 3.3Å; Y574-K576 PolarHBondContact O-N 2.96Å; Y574-A577 PolarHBondContact O-N 3.32Å; Y574-Q578 PolarHBondContact O-N 2.91Å; Y574-Q578 WeakPolarHBondContact O-CG 3.42Å; Y574-Q578 HydrophobicContact CE1-CG 4.22Å; Y574-Q578 HydrophobicContact CE2-CG 3.6Å; Y574-Q578 HydrophobicContact CD2-CG 4.11Å; Y574-I580 HydrophobicContact CE1-CD1 3.87Å
575	M	95.9	Very high	91.7	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.1	-42.4	-176.5	-63.5	-65.3	-171.9	0	0	111.2	Y337 T342 L571 V572 Q578 G579 I580	Y337-M575 HydrophobicContact CD1-CB 4.41Å; Y337-M575 HydrophobicContact CD1-CE 4.21Å; Y337-M575 HydrophobicContact CD1-CG 3.89Å; Y337-M575 HydrophobicContact CD1-SD 4.23Å; Y337-M575 HydrophobicContact CD2-CG 4.4Å; Y337-M575 HydrophobicContact CE1-CB 3.58Å; Y337-M575 HydrophobicContact CE1-CG 3.55Å; Y337-M575 HydrophobicContact CE1-SD 4.06Å; Y337-M575 HydrophobicContact CE2-CB 3.96Å; Y337-M575 HydrophobicContact CE2-CG 4.12Å; Y337-M575 HydrophobicContact CG-CG 4.32Å; Y337-M575 VanDerWaalsContact OH-CB 3.25Å; Y337-M575 WeakPolarHBondContact OH-CB 3.49Å; T342-M575 HydrophobicContact CG2-CE 3.79Å; L571-M575 WeakPolarHBondContact O-CG 3.48Å; L571-M575 PolarHBondContact O-N 3.32Å; L571-M575 HydrophobicContact CG-CE 4.34Å; L571-M575 HydrophobicContact CD2-CG 3.85Å; L571-M575 HydrophobicContact CD2-CE 4Å; V572-M575 PolarHBondContact O-N 2.87Å; M575-Q578 PolarHBondContact O-N 3.09Å; M575-G579 PolarHBondContact O-N 3.31Å; M575-G579 VanDerWaalsContact O-N 3.09Å; M575-I580 HydrophobicContact CB-CB 4.28Å; M575-I580 PolarHBondContact O-N 3.28Å; M575-I580 HydrophobicContact SD-CB 3.95Å; M575-I580 HydrophobicContact SD-CD1 3.89Å; M575-I580 HydrophobicContact SD-CG2 3.71Å
576	K	90.8	Very high	91.3	Very high	135 Å²	135	57.8 Å²	57.8	59%	0.587	33%	0.326	S	S	*	.	H	α-helix	trans	-62.3	-47.5	176.1	-172.8	173.6	-175.9	172.2	0	111.6	E331 V572 Y574 Q578 G579	E331-K576 IonicContact OE1-NZ 3.36Å; V572-K576 VanDerWaalsContact O-CB 3.3Å; V572-K576 WeakPolarHBondContact O-CB 3.02Å; V572-K576 PolarHBondContact O-N 3.39Å; Y574-K576 VanDerWaalsContact C-N 3.3Å; Y574-K576 PolarHBondContact O-N 2.96Å; K576-Q578 PolarHBondContact O-N 3.36Å; K576-G579 PolarHBondContact O-N 2.97Å; K576-G579 VanDerWaalsContact O-N 3.07Å
577	A	91.5	Very high	90.1	Very high	71 Å²	71	60 Å²	60	59%	0.587	35%	0.353	S	S	*	.	H	α-helix	trans	-61.8	-32.4	179.1	0	0	0	0	0	112.9	S573 Y574	S573-A577 VanDerWaalsContact O-CB 3.31Å; S573-A577 WeakPolarHBondContact O-CB 3.22Å; S573-A577 PolarHBondContact O-N 3.08Å; Y574-A577 PolarHBondContact O-N 3.32Å
578	Q	94.4	Very high	88.4	Confident	91 Å²	91	63.3 Å²	63.3	43%	0.425	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-0.4	176.7	-61.8	-53.9	-49.3	0	0	113.9	Y574 M575 K576 I580	Y574-Q578 PolarHBondContact O-N 2.91Å; Y574-Q578 WeakPolarHBondContact O-CG 3.42Å; Y574-Q578 HydrophobicContact CE1-CG 4.22Å; Y574-Q578 HydrophobicContact CE2-CG 3.6Å; Y574-Q578 HydrophobicContact CD2-CG 4.11Å; M575-Q578 PolarHBondContact O-N 3.09Å; K576-Q578 PolarHBondContact O-N 3.36Å; Q578-I580 PolarHBondContact O-N 3.36Å; Q578-I580 HydrophobicContact CG-CD1 4.44Å; Q578-I580 HydrophobicContact CB-CD1 3.69Å; Q578-I580 HydrophobicContact CB-CG1 3.8Å
579	G	92.7	Very high	86.7	Confident	65 Å²	65	66.5 Å²	66.5	67%	0.67	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	22.9	-177	0	0	0	0	0	114.1	M575 K576	M575-G579 PolarHBondContact O-N 3.31Å; M575-G579 VanDerWaalsContact O-N 3.09Å; K576-G579 PolarHBondContact O-N 2.97Å; K576-G579 VanDerWaalsContact O-N 3.07Å
580	I	94.8	Very high	84.3	Confident	29 Å²	29	67.8 Å²	67.8	15%	0.149	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-83.7	123.3	-179.1	-60.7	169.2	0	0	0	109.2	Y337 Q466 Y574 M575 Q578	Y337-I580 HydrophobicContact CE1-CG2 4.38Å; Y337-I580 PolarHBondContact OH-O 2.71Å; Q466-I580 WeakPolarHBondContact O-CD1 3.23Å; Y574-I580 HydrophobicContact CE1-CD1 3.87Å; M575-I580 HydrophobicContact CB-CB 4.28Å; M575-I580 PolarHBondContact O-N 3.28Å; M575-I580 HydrophobicContact SD-CB 3.95Å; M575-I580 HydrophobicContact SD-CD1 3.89Å; M575-I580 HydrophobicContact SD-CG2 3.71Å; Q578-I580 PolarHBondContact O-N 3.36Å; Q578-I580 HydrophobicContact CG-CD1 4.44Å; Q578-I580 HydrophobicContact CB-CD1 3.69Å; Q578-I580 HydrophobicContact CB-CG1 3.8Å
581	R	92.8	Very high	82.1	Confident	165 Å²	165	73.1 Å²	73.1	62%	0.623	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-97.3	150	174.3	-67.4	-168.5	178.7	-93.6	-1.7	111.4	R583	R581-R583 PolarHBondContact O-N 2.97Å
582	P	91.1	Very high	79.1	Confident	36 Å²	36	78.1 Å²	78.1	23%	0.234	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-54.4	138.8	172	-24.2	33.1	0	0	0	111.5	C332 D336 Y337	C332-P582 HydrophobicContact CB-CG 3.71Å; C332-P582 WeakPolarHBondContact SG-CD 3.39Å; D336-P582 HydrophobicContact CB-CB 3.98Å; D336-P582 HydrophobicContact CB-CG 3.63Å; Y337-P582 HydrophobicContact CD1-CB 4.25Å; Y337-P582 HydrophobicContact CD1-CG 3.93Å; Y337-P582 HydrophobicContact CD2-CG 4.26Å; Y337-P582 HydrophobicContact CE1-CB 4.43Å; Y337-P582 HydrophobicContact CE1-CG 3.78Å; Y337-P582 HydrophobicContact CE2-CG 4.11Å; Y337-P582 HydrophobicContact CG-CG 4.15Å
583	R	91.4	Very high	76.2	Confident	92 Å²	92	82.3 Å²	82.3	35%	0.347	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-76.7	157.4	175	-70.2	-175.9	-68.5	-121.5	8.2	110.9	G340 G341 D467 S469 R581	G340-R583 WeakPolarHBondContact CA-O 3.25Å; G340-R583 WeakPolarHBondContact O-CB 3.12Å; G340-R583 PolarHBondContact O-NE 3.44Å; G341-R583 PolarHBondContact O-NH2 3.49Å; D467-R583 IonicContact OD2-NH1 3.86Å; S469-R583 VanDerWaalsContact CA-NH1 3.33Å; S469-R583 VanDerWaalsContact CB-NH2 3.33Å; R581-R583 PolarHBondContact O-N 2.97Å
584	P	86.5	Confident	73.6	Confident	111 Å²	111	85 Å²	85	72%	0.721	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-55.5	144.6	168.2	-22.5	33.2	0	0	0	110.8
585	P	79.4	Confident	70.6	Confident	71 Å²	71	94 Å²	94	46%	0.461	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-56	142.7	174.6	-20.9	30.5	0	0	0	110.7	K339 A587	K339-P585 HydrophobicContact CD-CG 4.4Å; K339-P585 HydrophobicContact CG-CB 4.36Å; K339-P585 HydrophobicContact CG-CG 4.14Å; P585-A587 PolarHBondContact O-N 2.69Å
586	P	74.7	Confident	67.6	Low	65 Å²	65	99 Å²	99	42%	0.422	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-52.3	137.6	171.6	-23	31.8	0	0	0	110.7	P126 K339 A588	P126-P586 HydrophobicContact CB-CG 4.37Å; K339-P586 WeakPolarHBondContact O-CD 3.32Å; P586-A588 PolarHBondContact O-N 3.12Å
587	A	65.3	Low	65.1	Low	97 Å²	97	98.7 Å²	98.7	80%	0.802	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-58.8	133	177.8	0	0	0	0	0	110	P585	P585-A587 PolarHBondContact O-N 2.69Å
588	A	58.1	Low	62.4	Low	69 Å²	69	99.8 Å²	99.8	57%	0.57	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-58.1	138.7	175.5	0	0	0	0	0	109.6	P586 T590	P586-A588 PolarHBondContact O-N 3.12Å; A588-T590 PolarHBondContact O-N 3.13Å; A588-T590 VanDerWaalsContact O-N 3.12Å
589	P	56.6	Low	59.8	Low	87 Å²	87	107 Å²	107	57%	0.565	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-56.5	123	173.4	21.1	-29.4	0	0	0	108.9	H591	P589-H591 PolarHBondContact O-N 3.21Å
590	T	40.6	Very low	57.2	Low	140 Å²	140	110.2 Å²	110.2	86%	0.859	65%	0.647	S	S	*	*			trans	-68.6	102.4	177.9	39.4	0	0	0	0	108.9	A588 S592	A588-T590 PolarHBondContact O-N 3.13Å; A588-T590 VanDerWaalsContact O-N 3.12Å; T590-S592 VanDerWaalsContact O-N 3.13Å; T590-S592 PolarHBondContact O-N 3.21Å
591	H	50	Low	54.4	Low	122 Å²	122	114.2 Å²	114.2	57%	0.565	68%	0.675	S	S	*	*			trans	-68.8	109.5	166.9	-66.8	-77.4	0	0	0	108.2	E131 P589	E131-H591 IonicContact OE2-NE2 2.69Å; P589-H591 PolarHBondContact O-N 3.21Å
592	S	31.5	Very low	51.7	Low	106 Å²	106	112.2 Å²	112.2	74%	0.741	68%	0.683	S	S	*	*			trans	-59.7	134.2	166.1	29.2	0	0	0	0	109	T590 S594	T590-S592 VanDerWaalsContact O-N 3.13Å; T590-S592 PolarHBondContact O-N 3.21Å; S592-S594 PolarHBondContact O-N 3.39Å
593	P	34.3	Very low	49.3	Very low	120 Å²	120	115.4 Å²	115.4	78%	0.779	71%	0.713	S	S	*	*			trans	-58	127.9	174.9	-17	28.2	0	0	0	108.5	Q595	P593-Q595 PolarHBondContact O-N 3.02Å
594	S	36.6	Very low	46.7	Very low	114 Å²	114	116.3 Å²	116.3	80%	0.797	73%	0.734	S	S	*	*			trans	-53.6	114.5	173.6	52.8	0	0	0	0	108.9	S592 S596	S592-S594 PolarHBondContact O-N 3.39Å; S594-S596 PolarHBondContact O-N 3.22Å
595	Q	33.5	Very low	44.5	Very low	187 Å²	187	116.9 Å²	116.9	87%	0.874	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-57.5	125.3	171.6	-73	-177.3	-0.1	0	0	108.3	P593	P593-Q595 PolarHBondContact O-N 3.02Å
596	S	34.1	Very low	42.5	Very low	105 Å²	105	122 Å²	122	73%	0.734	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-47.9	137	170.6	-38.5	0	0	0	0	109.3	S594 A598	S594-S596 PolarHBondContact O-N 3.22Å; S596-A598 PolarHBondContact O-N 3.26Å
597	P	37.7	Very low	40.7	Very low	129 Å²	129	127.2 Å²	127.2	84%	0.838	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-58.3	119.9	-179.9	21.8	-30	0	0	0	109.2	R599	P597-R599 PolarHBondContact O-N 3.03Å
598	A	35.6	Very low	39.5	Very low	95 Å²	95	128.4 Å²	128.4	79%	0.785	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-55.9	126.1	176.2	0	0	0	0	0	108.9	S596 T600	S596-A598 PolarHBondContact O-N 3.26Å; A598-T600 PolarHBondContact O-N 3.13Å; A598-T600 VanDerWaalsContact O-N 3.13Å
599	R	38.9	Very low	38.7	Very low	241 Å²	241	133 Å²	133	91%	0.909	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-52.1	119.6	169.4	-89.8	178.3	161.8	-160.6	-4.1	108.6	P597	P597-R599 PolarHBondContact O-N 3.03Å
600	T	38	Very low	37.8	Very low	133 Å²	133	140.2 Å²	140.2	82%	0.816	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-54.7	124.5	166.4	33.7	0	0	0	0	109.7	A598	A598-T600 PolarHBondContact O-N 3.13Å; A598-T600 VanDerWaalsContact O-N 3.13Å
601	P	35.5	Very low	37.7	Very low	113 Å²	113	140.2 Å²	140.2	73%	0.734	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-72.9	153.4	173.6	30.1	-32.2	0	0	0	110.3
602	P	36.7	Very low	37.1	Very low	123 Å²	123	141.2 Å²	141.2	80%	0.799	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-69	141.8	-179.5	29.2	-33.4	0	0	0	111
603	A	39.8	Very low	37.4	Very low	104 Å²	104	143.1 Å²	143.1	86%	0.86	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-61.4	134.2	178.1	0	0	0	0	0	111.5
604	S	37.1	Very low	37.5	Very low	111 Å²	111	144.5 Å²	144.5	78%	0.776	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-86.2	152.7	172.5	-64.8	0	0	0	0	110.8
605	P	41.2	Very low	37.6	Very low	123 Å²	123	146.4 Å²	146.4	80%	0.799	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-79.2	143.5	-170.3	12.1	2.2	0	0	0	112.4	H607	P605-H607 PolarHBondContact O-N 3.34Å
606	L	36.9	Very low	37.9	Very low	177 Å²	177	143.7 Å²	143.7	93%	0.927	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-63	119.3	171.9	-87.9	130	0	0	0	110.8
607	H	36.1	Very low	38.2	Very low	175 Å²	175	146.4 Å²	146.4	81%	0.81	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-79.4	116.3	163.1	-102.1	-58.4	0	0	0	109.7	P605	P605-H607 PolarHBondContact O-N 3.34Å
608	T	40.5	Very low	38.2	Very low	123 Å²	123	147.8 Å²	147.8	76%	0.755	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-66.8	131.6	159.9	36.6	0	0	0	0	110.7
609	H	41.3	Very low	38.4	Very low	166 Å²	166	152.2 Å²	152.2	77%	0.769	85%	0.847	S	S	*	*			trans	-146.4	115.9	150.3	-90.7	-64.3	0	0	0	111.5
610	I	39	Very low	38.4	Very low	237 Å²	237	144.1 Å²	144.1	100%	1.215	84%	0.842	S	S	*	*			trans	69	0	158	-46.5	-179	0	0	0	117.3

Retrieved 610 of 610 residues in 172 ms (Link to these results)

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