A0A087YJK8_POEFO Loading...

Endoplasmic reticulum membrane sensor NFE2L1

AlphaFold DB , UniProt , Accession A0A087YJK8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 784 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	44.6	Very low	51.3	Low	216 Å²	216	136.7 Å²	136.7	100%	1.064	65%	0.651	S	S	*	*				0	-49.8	0	-72.5	-173.1	175.5	0	0	113.8	Y3 L4 K5	M1-Y3 PolarHBondContact O-N 3.37Å; M1-L4 PolarHBondContact O-N 3.33Å; M1-L4 VanDerWaalsContact O-N 3.08Å; M1-K5 PolarHBondContact O-N 3.49Å
2	L	39.7	Very low	52.9	Low	153 Å²	153	133.5 Å²	133.5	80%	0.801	64%	0.639	S	S	*	*	H	α-helix	trans	-49.7	-46.8	-176.2	-74.2	168.7	0	0	0	115	L4 K5 K6	L2-L4 PolarHBondContact O-N 3.47Å; L2-K5 PolarHBondContact O-N 3.32Å; L2-K6 PolarHBondContact O-N 3.27Å
3	Y	41.5	Very low	54.3	Low	191 Å²	191	131 Å²	131	75%	0.749	63%	0.63	S	S	*	*	H	α-helix	trans	-59.4	-46.4	176.9	-76.4	-89.5	0	0	0	113.2	M1 K5 K6 Y7	M1-Y3 PolarHBondContact O-N 3.37Å; Y3-K5 PolarHBondContact O-N 3.25Å; Y3-K6 WeakPolarHBondContact O-CB 3.34Å; Y3-K6 PolarHBondContact O-N 3.26Å; Y3-Y7 VanDerWaalsContact O-CD2 3.24Å; Y3-Y7 WeakPolarHBondContact O-CD2 3.45Å; Y3-Y7 PolarHBondContact O-N 3.37Å
4	L	46.5	Very low	55.3	Low	139 Å²	139	130.6 Å²	130.6	73%	0.728	63%	0.627	S	S	*	*	H	α-helix	trans	-60.5	-35.3	179.7	-145.1	75.7	0	0	0	111.9	M1 L2 K6 F8	M1-L4 PolarHBondContact O-N 3.33Å; M1-L4 VanDerWaalsContact O-N 3.08Å; L2-L4 PolarHBondContact O-N 3.47Å; L4-K6 VanDerWaalsContact C-N 3.27Å; L4-K6 PolarHBondContact O-N 2.9Å; L4-F8 PolarHBondContact O-N 3.03Å
5	K	46.8	Very low	56.3	Low	149 Å²	149	130 Å²	130	65%	0.648	62%	0.62	S	S	*	*	H	α-helix	trans	-66.4	-28	176.1	-165.4	172.7	-176.6	178.5	0	112.7	M1 L2 Y3 T9	M1-K5 PolarHBondContact O-N 3.49Å; L2-K5 PolarHBondContact O-N 3.32Å; Y3-K5 PolarHBondContact O-N 3.25Å; K5-T9 PolarHBondContact O-N 3.37Å; K5-T9 PolarHBondContact O-OG1 3.29Å
6	K	51.3	Low	56.9	Low	130 Å²	130	127.1 Å²	127.1	57%	0.565	61%	0.614	S	S	*	*	H	α-helix	trans	-76.8	-47.6	178.5	-155.4	-170.7	-178.3	-128.3	0	111.9	L2 Y3 L4 F8 T9 E10	L2-K6 PolarHBondContact O-N 3.27Å; Y3-K6 WeakPolarHBondContact O-CB 3.34Å; Y3-K6 PolarHBondContact O-N 3.26Å; L4-K6 VanDerWaalsContact C-N 3.27Å; L4-K6 PolarHBondContact O-N 2.9Å; K6-F8 VanDerWaalsContact C-N 3.28Å; K6-F8 PolarHBondContact O-N 2.84Å; K6-T9 PolarHBondContact O-N 3.22Å; K6-T9 PolarHBondContact O-OG1 2.96Å; K6-E10 IonicContact NZ-OE2 3.94Å; K6-E10 WeakPolarHBondContact O-CB 3.39Å; K6-E10 PolarHBondContact O-N 3.13Å
7	Y	50.5	Low	57.7	Low	166 Å²	166	125.2 Å²	125.2	65%	0.651	61%	0.606	S	S	*	*	H	α-helix	trans	-58.5	-39.7	175.4	-70.6	-71.8	0	0	0	112.3	Y3 T9 E10 G11	Y3-Y7 VanDerWaalsContact O-CD2 3.24Å; Y3-Y7 WeakPolarHBondContact O-CD2 3.45Å; Y3-Y7 PolarHBondContact O-N 3.37Å; Y7-T9 PolarHBondContact O-N 2.84Å; Y7-E10 PolarHBondContact O-N 3.12Å; Y7-G11 PolarHBondContact O-N 3.4Å
8	F	52.6	Low	58.6	Low	158 Å²	158	124.1 Å²	124.1	69%	0.693	60%	0.603	S	S	*	*	H	α-helix	trans	-64.9	-39.5	179	-152.8	-86.8	0	0	0	112.6	L4 K6 L12	L4-F8 PolarHBondContact O-N 3.03Å; K6-F8 VanDerWaalsContact C-N 3.28Å; K6-F8 PolarHBondContact O-N 2.84Å; F8-L12 VanDerWaalsContact O-CB 3.25Å; F8-L12 WeakPolarHBondContact O-CB 3.46Å; F8-L12 PolarHBondContact O-N 3.33Å
9	T	60.9	Low	59.1	Low	76 Å²	76	119.8 Å²	119.8	47%	0.466	58%	0.583	S	S	.	*	H	α-helix	trans	-70.4	-38.7	174.6	45.8	0	0	0	0	112.9	K5 K6 Y7 I13	K5-T9 PolarHBondContact O-N 3.37Å; K5-T9 PolarHBondContact O-OG1 3.29Å; K6-T9 PolarHBondContact O-N 3.22Å; K6-T9 PolarHBondContact O-OG1 2.96Å; Y7-T9 PolarHBondContact O-N 2.84Å; T9-I13 WeakPolarHBondContact O-CD1 3.41Å; T9-I13 VanDerWaalsContact O-CG1 3.26Å; T9-I13 WeakPolarHBondContact O-CG1 3.23Å; T9-I13 PolarHBondContact O-N 3.21Å; T9-I13 VanDerWaalsContact O-N 3.12Å
10	E	59.6	Low	59.3	Low	90 Å²	90	118.5 Å²	118.5	42%	0.421	59%	0.586	S	S	.	*	H	α-helix	trans	-73	-43.7	-174.3	-157.1	161.5	158.7	0	0	111.2	K6 Y7 I13 Q14	K6-E10 IonicContact NZ-OE2 3.94Å; K6-E10 WeakPolarHBondContact O-CB 3.39Å; K6-E10 PolarHBondContact O-N 3.13Å; Y7-E10 PolarHBondContact O-N 3.12Å; E10-I13 PolarHBondContact O-N 2.68Å; E10-Q14 WeakPolarHBondContact O-CG 3.34Å; E10-Q14 PolarHBondContact O-N 2.79Å; E10-Q14 VanDerWaalsContact O-N 3.11Å
11	G	70.1	Confident	59.5	Low	36 Å²	36	119.6 Å²	119.6	37%	0.371	59%	0.594	S	S	.	*	H	α-helix	trans	-67.4	-36.6	173.8	0	0	0	0	0	113.7	Y7 Q14 F15	Y7-G11 PolarHBondContact O-N 3.4Å; G11-Q14 PolarHBondContact O-N 2.79Å; G11-F15 WeakPolarHBondContact O-CB 3.42Å; G11-F15 PolarHBondContact O-N 3.24Å
12	L	70.3	Confident	60.7	Low	98 Å²	98	115 Å²	115	51%	0.513	57%	0.573	S	S	.	*	H	α-helix	trans	-65.2	-42.5	176.2	-161.4	77.7	0	0	0	111.2	F8 F15 T16	F8-L12 VanDerWaalsContact O-CB 3.25Å; F8-L12 WeakPolarHBondContact O-CB 3.46Å; F8-L12 PolarHBondContact O-N 3.33Å; L12-F15 PolarHBondContact O-N 3.17Å; L12-T16 PolarHBondContact O-N 3.43Å; L12-T16 PolarHBondContact O-OG1 2.74Å
13	I	71.2	Confident	60.8	Low	101 Å²	101	110.7 Å²	110.7	52%	0.518	57%	0.565	S	S	.	*	H	α-helix	trans	-61.3	-45.5	175.5	-72.6	166.3	0	0	0	111.1	T9 E10 F15 T16 I17	T9-I13 WeakPolarHBondContact O-CD1 3.41Å; T9-I13 VanDerWaalsContact O-CG1 3.26Å; T9-I13 WeakPolarHBondContact O-CG1 3.23Å; T9-I13 PolarHBondContact O-N 3.21Å; T9-I13 VanDerWaalsContact O-N 3.12Å; E10-I13 PolarHBondContact O-N 2.68Å; I13-F15 VanDerWaalsContact C-N 3.34Å; I13-F15 PolarHBondContact O-N 2.68Å; I13-T16 PolarHBondContact O-N 2.9Å; I13-I17 HydrophobicContact CG2-CD1 3.75Å; I13-I17 HydrophobicContact CG2-CG1 4.5Å; I13-I17 VanDerWaalsContact O-CG1 3.29Å; I13-I17 WeakPolarHBondContact O-CG1 3.44Å; I13-I17 PolarHBondContact O-N 2.86Å
14	Q	69.1	Low	61.6	Low	125 Å²	125	105.2 Å²	105.2	58%	0.584	55%	0.551	S	S	*	*	H	α-helix	trans	-61	-41.6	176.6	-71.7	171.9	-0.9	0	0	112	E10 G11 I17 L18	E10-Q14 WeakPolarHBondContact O-CG 3.34Å; E10-Q14 PolarHBondContact O-N 2.79Å; E10-Q14 VanDerWaalsContact O-N 3.11Å; G11-Q14 PolarHBondContact O-N 2.79Å; Q14-I17 PolarHBondContact O-N 3.14Å; Q14-L18 WeakPolarHBondContact O-CB 3.42Å; Q14-L18 PolarHBondContact O-N 3.39Å
15	F	69.6	Low	61.7	Low	122 Å²	122	110.4 Å²	110.4	54%	0.535	56%	0.561	S	S	.	*	H	α-helix	trans	-65.1	-41.7	175.8	-176.2	-110.7	0	0	0	112.8	G11 L12 I13 L18 L19	G11-F15 WeakPolarHBondContact O-CB 3.42Å; G11-F15 PolarHBondContact O-N 3.24Å; L12-F15 PolarHBondContact O-N 3.17Å; I13-F15 VanDerWaalsContact C-N 3.34Å; I13-F15 PolarHBondContact O-N 2.68Å; F15-L18 PolarHBondContact O-N 2.82Å; F15-L19 HydrophobicContact CD1-CD1 3.87Å; F15-L19 HydrophobicContact CE1-CD1 3.54Å; F15-L19 HydrophobicContact CE1-CG 4.44Å; F15-L19 HydrophobicContact CZ-CD1 3.94Å; F15-L19 HydrophobicContact CZ-CG 4.43Å; F15-L19 WeakPolarHBondContact O-CG 3.32Å; F15-L19 PolarHBondContact O-N 3.24Å
16	T	65.6	Low	61.9	Low	83 Å²	83	106.7 Å²	106.7	51%	0.509	55%	0.55	S	S	.	*	H	α-helix	trans	-65.3	-39.9	175	-55.6	0	0	0	0	112.2	L12 I13 L19 S20	L12-T16 PolarHBondContact O-N 3.43Å; L12-T16 PolarHBondContact O-OG1 2.74Å; I13-T16 PolarHBondContact O-N 2.9Å; T16-L19 PolarHBondContact O-N 3.31Å; T16-S20 WeakPolarHBondContact O-CB 3.47Å; T16-S20 PolarHBondContact O-N 3.44Å
17	I	71.8	Confident	61.8	Low	95 Å²	95	104.9 Å²	104.9	49%	0.487	55%	0.547	S	S	.	.	H	α-helix	trans	-63.1	-43.5	174.2	-69.5	165.7	0	0	0	110.5	I13 Q14 S20 L21	I13-I17 HydrophobicContact CG2-CD1 3.75Å; I13-I17 HydrophobicContact CG2-CG1 4.5Å; I13-I17 VanDerWaalsContact O-CG1 3.29Å; I13-I17 WeakPolarHBondContact O-CG1 3.44Å; I13-I17 PolarHBondContact O-N 2.86Å; Q14-I17 PolarHBondContact O-N 3.14Å; I17-S20 PolarHBondContact O-N 2.74Å; I17-L21 HydrophobicContact CG2-CD1 3.86Å; I17-L21 HydrophobicContact CG2-CG 4.4Å; I17-L21 WeakPolarHBondContact O-CG 3.34Å; I17-L21 PolarHBondContact O-N 2.97Å
18	L	73	Confident	61.8	Low	105 Å²	105	100.8 Å²	100.8	55%	0.55	54%	0.539	S	S	.	.	H	α-helix	trans	-62.4	-45.2	178.2	-173	64.6	0	0	0	112.1	Q14 F15 S20 L21 I22	Q14-L18 WeakPolarHBondContact O-CB 3.42Å; Q14-L18 PolarHBondContact O-N 3.39Å; F15-L18 PolarHBondContact O-N 2.82Å; L18-S20 VanDerWaalsContact C-N 3.32Å; L18-S20 PolarHBondContact O-N 3.08Å; L18-L21 PolarHBondContact O-N 2.86Å; L18-I22 WeakPolarHBondContact O-CB 3.46Å; L18-I22 PolarHBondContact O-N 3.11Å
19	L	67.6	Low	61.6	Low	44 Å²	44	99.2 Å²	99.2	23%	0.23	54%	0.538	C	S	.	.	H	α-helix	trans	-58.9	-41.7	173.3	-77.7	166.5	0	0	0	112.3	F15 T16 I22 G23 V24 V26	F15-L19 HydrophobicContact CD1-CD1 3.87Å; F15-L19 HydrophobicContact CE1-CD1 3.54Å; F15-L19 HydrophobicContact CE1-CG 4.44Å; F15-L19 HydrophobicContact CZ-CD1 3.94Å; F15-L19 HydrophobicContact CZ-CG 4.43Å; F15-L19 WeakPolarHBondContact O-CG 3.32Å; F15-L19 PolarHBondContact O-N 3.24Å; T16-L19 PolarHBondContact O-N 3.31Å; L19-I22 PolarHBondContact O-N 2.86Å; L19-G23 PolarHBondContact O-N 3.04Å; L19-V24 HydrophobicContact CD2-CB 4.31Å; L19-V24 HydrophobicContact CD2-CG1 4.42Å; L19-V24 PolarHBondContact O-N 3.02Å; L19-V26 HydrophobicContact CD1-CG2 4.1Å; L19-V26 HydrophobicContact CD2-CG2 4.18Å
20	S	63.1	Low	60.9	Low	92 Å²	92	99.4 Å²	99.4	64%	0.643	54%	0.539	S	S	*	.	H	α-helix	trans	-67.5	-36.3	177.6	-169.8	0	0	0	0	112.8	T16 I17 L18 G23	T16-S20 WeakPolarHBondContact O-CB 3.47Å; T16-S20 PolarHBondContact O-N 3.44Å; I17-S20 PolarHBondContact O-N 2.74Å; L18-S20 VanDerWaalsContact C-N 3.32Å; L18-S20 PolarHBondContact O-N 3.08Å; S20-G23 PolarHBondContact O-N 2.86Å
21	L	64.9	Low	60.2	Low	143 Å²	143	103.8 Å²	103.8	75%	0.749	55%	0.553	S	S	*	*	H	α-helix	trans	-71.8	-31	176.1	-73.9	169	0	0	0	112.4	I17 L18 G23	I17-L21 HydrophobicContact CG2-CD1 3.86Å; I17-L21 HydrophobicContact CG2-CG 4.4Å; I17-L21 WeakPolarHBondContact O-CG 3.34Å; I17-L21 PolarHBondContact O-N 2.97Å; L18-L21 PolarHBondContact O-N 2.86Å; L21-G23 PolarHBondContact O-N 2.89Å
22	I	68.9	Low	59.1	Low	120 Å²	120	107.4 Å²	107.4	62%	0.615	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	3.4	175.3	-125.9	166.1	0	0	0	112.7	L18 L19 V24	L18-I22 WeakPolarHBondContact O-CB 3.46Å; L18-I22 PolarHBondContact O-N 3.11Å; L19-I22 PolarHBondContact O-N 2.86Å; I22-V24 VanDerWaalsContact C-N 3.29Å; I22-V24 HydrophobicContact CG2-CB 4.16Å; I22-V24 HydrophobicContact CG2-CG2 3.65Å; I22-V24 PolarHBondContact O-N 3.39Å
23	G	43	Very low	58	Low	61 Å²	61	106.6 Å²	106.6	63%	0.629	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	79.4	1.4	174.1	0	0	0	0	0	115.3	L19 S20 L21 R25	L19-G23 PolarHBondContact O-N 3.04Å; S20-G23 PolarHBondContact O-N 2.86Å; L21-G23 PolarHBondContact O-N 2.89Å; G23-R25 PolarHBondContact O-N 3.08Å
24	V	56.6	Low	56.5	Low	77 Å²	77	108.1 Å²	108.1	47%	0.467	58%	0.575	S	S	.	*			trans	-84.8	95.9	-176.7	-178.5	0	0	0	0	109.6	L19 I22 V26	L19-V24 HydrophobicContact CD2-CB 4.31Å; L19-V24 HydrophobicContact CD2-CG1 4.42Å; L19-V24 PolarHBondContact O-N 3.02Å; I22-V24 VanDerWaalsContact C-N 3.29Å; I22-V24 HydrophobicContact CG2-CB 4.16Å; I22-V24 HydrophobicContact CG2-CG2 3.65Å; I22-V24 PolarHBondContact O-N 3.39Å; V24-V26 VanDerWaalsContact C-N 3.3Å; V24-V26 HydrophobicContact CG1-CG2 3.79Å; V24-V26 PolarHBondContact O-N 2.88Å
25	R	49.3	Very low	55.4	Low	248 Å²	248	110.5 Å²	110.5	94%	0.936	59%	0.586	S	S	*	*			trans	-70.5	84.3	169.7	-67.9	-171	177.3	-145.1	-0.4	110.4	G23 D27	G23-R25 PolarHBondContact O-N 3.08Å; R25-D27 PolarHBondContact O-N 2.84Å
26	V	52.1	Low	53.9	Low	70 Å²	70	110.3 Å²	110.3	42%	0.424	59%	0.59	S	S	.	*			trans	-72.1	110.8	167.9	-174.8	0	0	0	0	108.4	L19 V24 V28	L19-V26 HydrophobicContact CD1-CG2 4.1Å; L19-V26 HydrophobicContact CD2-CG2 4.18Å; V24-V26 VanDerWaalsContact C-N 3.3Å; V24-V26 HydrophobicContact CG1-CG2 3.79Å; V24-V26 PolarHBondContact O-N 2.88Å; V26-V28 HydrophobicContact CG1-CG2 4.36Å; V26-V28 PolarHBondContact O-N 3.2Å; V26-V28 VanDerWaalsContact O-N 3.15Å
27	D	48	Very low	52.7	Low	93 Å²	93	111.7 Å²	111.7	50%	0.497	60%	0.6	S	S	.	*			trans	-78	95.1	173.4	-178	36.1	0	0	0	110.3	R25 D29 T30	R25-D27 PolarHBondContact O-N 2.84Å; D27-D29 PolarHBondContact O-N 3.45Å; D27-T30 WeakPolarHBondContact OD2-CB 3.21Å; D27-T30 PolarHBondContact OD2-OG1 3.39Å
28	V	50.8	Low	51.3	Low	79 Å²	79	112.9 Å²	112.9	48%	0.479	61%	0.614	S	S	.	*	H	α-helix	trans	-68.7	-33.6	-168.6	178.4	0	0	0	0	112.3	V26 T30 Y31 L32	V26-V28 HydrophobicContact CG1-CG2 4.36Å; V26-V28 PolarHBondContact O-N 3.2Å; V26-V28 VanDerWaalsContact O-N 3.15Å; V28-T30 PolarHBondContact O-N 3.04Å; V28-Y31 PolarHBondContact O-N 2.81Å; V28-L32 HydrophobicContact CG1-CD1 3.62Å; V28-L32 HydrophobicContact CG1-CG 3.99Å; V28-L32 PolarHBondContact O-N 3.43Å
29	D	47.4	Very low	49.8	Very low	125 Å²	125	114 Å²	114	67%	0.668	62%	0.62	S	S	*	*	H	α-helix	trans	-68.8	-35	-177.1	-68.8	-51.5	0	0	0	112.4	D27 Y31 S33	D27-D29 PolarHBondContact O-N 3.45Å; D29-Y31 VanDerWaalsContact C-N 3.28Å; D29-Y31 PolarHBondContact O-N 3.2Å; D29-S33 VanDerWaalsContact O-CB 3.31Å; D29-S33 WeakPolarHBondContact O-CB 3.49Å; D29-S33 PolarHBondContact O-N 3.08Å; D29-S33 PolarHBondContact O-OG 3.26Å
30	T	46.8	Very low	48.7	Very low	80 Å²	80	123 Å²	123	49%	0.491	65%	0.651	S	S	.	*	H	α-helix	trans	-65	-29.7	173.7	-70.2	0	0	0	0	112.7	D27 V28 S33 N34	D27-T30 WeakPolarHBondContact OD2-CB 3.21Å; D27-T30 PolarHBondContact OD2-OG1 3.39Å; V28-T30 PolarHBondContact O-N 3.04Å; T30-S33 PolarHBondContact O-OG 2.92Å; T30-N34 PolarHBondContact O-ND2 2.83Å
31	Y	45.3	Very low	47.7	Very low	182 Å²	182	127.1 Å²	127.1	71%	0.714	66%	0.66	S	S	*	*	H	α-helix	trans	-86.4	-40	177.9	-86.9	-88.6	0	0	0	113.8	V28 D29	V28-Y31 PolarHBondContact O-N 2.81Å; D29-Y31 VanDerWaalsContact C-N 3.28Å; D29-Y31 PolarHBondContact O-N 3.2Å
32	L	47.8	Very low	46.7	Very low	112 Å²	112	127.1 Å²	127.1	59%	0.586	66%	0.66	S	S	*	*	H	α-helix	trans	-74	-30.2	-177.1	-71.1	-179.9	0	0	0	113.7	V28 N34	V28-L32 HydrophobicContact CG1-CD1 3.62Å; V28-L32 HydrophobicContact CG1-CG 3.99Å; V28-L32 PolarHBondContact O-N 3.43Å; L32-N34 VanDerWaalsContact C-N 3.28Å; L32-N34 PolarHBondContact O-N 3.21Å
33	S	45.9	Very low	45.3	Very low	82 Å²	82	128.6 Å²	128.6	57%	0.573	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-22	-174.8	48.4	0	0	0	0	115.1	D29 T30	D29-S33 VanDerWaalsContact O-CB 3.31Å; D29-S33 WeakPolarHBondContact O-CB 3.49Å; D29-S33 PolarHBondContact O-N 3.08Å; D29-S33 PolarHBondContact O-OG 3.26Å; T30-S33 PolarHBondContact O-OG 2.92Å
34	N	40.4	Very low	45.1	Very low	132 Å²	132	132.9 Å²	132.9	71%	0.706	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-3	-168	-77.3	-60.9	0	0	0	116	T30 L32	T30-N34 PolarHBondContact O-ND2 2.83Å; L32-N34 VanDerWaalsContact C-N 3.28Å; L32-N34 PolarHBondContact O-N 3.21Å
35	Q	45.7	Very low	44.3	Very low	175 Å²	175	131.7 Å²	131.7	82%	0.818	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.1	-4.3	-175.1	-68.6	-163.9	1.7	0	0	117.5
36	L	37.7	Very low	43.9	Very low	118 Å²	118	126.5 Å²	126.5	62%	0.618	68%	0.677	S	S	*	*	S	Bend	trans	-135.3	143.6	171.7	-76.8	95.5	0	0	0	112.8
37	P	41.1	Very low	43.1	Very low	112 Å²	112	128.6 Å²	128.6	73%	0.727	69%	0.694	S	S	*	*			trans	-65.3	153.8	166.4	30.1	-34.6	0	0	0	110.8	L39	P37-L39 PolarHBondContact O-N 2.94Å
38	P	42.3	Very low	42.8	Very low	120 Å²	120	130.2 Å²	130.2	78%	0.779	71%	0.713	S	S	*	*			trans	-61.8	125.2	-168.1	22.8	-33.9	0	0	0	113	R40	P38-R40 PolarHBondContact O-N 3.44Å
39	L	40.2	Very low	42.1	Very low	128 Å²	128	130.6 Å²	130.6	67%	0.67	72%	0.724	S	S	*	*	S	Bend	trans	-78.3	43.1	-167.1	-132.4	171.4	0	0	0	114	P37 I42	P37-L39 PolarHBondContact O-N 2.94Å; L39-I42 HydrophobicContact CD2-CD1 3.81Å; L39-I42 HydrophobicContact CD2-CG1 4.3Å
40	R	45.6	Very low	41.4	Very low	235 Å²	235	133.9 Å²	133.9	89%	0.887	73%	0.729	S	S	*	*			trans	-107	1.7	-174.3	-81.2	-169.5	175.9	-111.3	3.1	116.3	P38	P38-R40 PolarHBondContact O-N 3.44Å
41	E	42.3	Very low	41.3	Very low	177 Å²	177	136.7 Å²	136.7	83%	0.827	75%	0.746	S	S	*	*	S	Bend	trans	-94.9	-13.1	178.7	-64.3	-166.4	142.6	0	0	115	I43	E41-I43 VanDerWaalsContact C-N 3.34Å; E41-I43 PolarHBondContact O-N 3.26Å
42	I	42.5	Very low	40.9	Very low	144 Å²	144	134.4 Å²	134.4	74%	0.738	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-7.5	-171.8	-59.6	-174.6	0	0	0	113.8	L39	L39-I42 HydrophobicContact CD2-CD1 3.81Å; L39-I42 HydrophobicContact CD2-CG1 4.3Å
43	I	40.4	Very low	40.2	Very low	151 Å²	151	134.1 Å²	134.1	77%	0.774	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	-15.6	-175.5	-63.9	-179.7	0	0	0	113.4	E41	E41-I43 VanDerWaalsContact C-N 3.34Å; E41-I43 PolarHBondContact O-N 3.26Å
44	L	39.7	Very low	39.9	Very low	150 Å²	150	138.2 Å²	138.2	79%	0.785	76%	0.755	S	S	*	*	S	Bend	trans	-98.9	126.6	172.6	-112.2	65.4	0	0	0	110.8
45	G	39	Very low	39.7	Very low	52 Å²	52	140.2 Å²	140.2	54%	0.536	76%	0.758	S	S	.	*			trans	-66	165.4	169.2	0	0	0	0	0	112	S47	G45-S47 PolarHBondContact O-N 2.72Å
46	P	41.2	Very low	39.6	Very low	140 Å²	140	140.4 Å²	140.4	91%	0.909	76%	0.758	S	S	*	*			trans	-61.2	113.9	-172.6	25.1	-34.6	0	0	0	111.8
47	S	35.3	Very low	39.6	Very low	113 Å²	113	140.6 Å²	140.6	79%	0.79	76%	0.76	S	S	*	*			trans	-132.7	83.1	173	-78.5	0	0	0	0	110.5	G45 A49	G45-S47 PolarHBondContact O-N 2.72Å; S47-A49 PolarHBondContact O-N 3.27Å; S47-A49 VanDerWaalsContact O-N 3.11Å
48	S	40.7	Very low	39.7	Very low	128 Å²	128	142.7 Å²	142.7	90%	0.895	76%	0.764	S	S	*	*			trans	-80.7	75.6	177.4	56	0	0	0	0	112.1
49	A	37.7	Very low	39.9	Very low	87 Å²	87	146.3 Å²	146.3	72%	0.719	76%	0.762	S	S	*	*			trans	-166.7	112.7	160.6	0	0	0	0	0	112.5	S47	S47-A49 PolarHBondContact O-N 3.27Å; S47-A49 VanDerWaalsContact O-N 3.11Å
50	Y	32.8	Very low	40.3	Very low	194 Å²	194	142.7 Å²	142.7	76%	0.761	74%	0.743	S	S	*	*				163.4	107.4	104.9	-155.6	-99	0	0	0	111	Q52	Y50-Q52 HydrophobicContact CD1-CB 4.25Å; Y50-Q52 HydrophobicContact CE1-CB 3.87Å; Y50-Q52 PolarHBondContact OH-OE1 2.7Å
51	T	43.6	Very low	40.5	Very low	139 Å²	139	135 Å²	135	85%	0.853	72%	0.722	S	S	*	*			trans	-98.5	114.2	174.9	49.5	0	0	0	0	110.5
52	Q	36.2	Very low	40.6	Very low	134 Å²	134	131.5 Å²	131.5	63%	0.626	71%	0.709	S	S	*	*			trans	-148.7	117.4	165.5	-156.1	149	-12.6	0	0	115.4	Y50	Y50-Q52 HydrophobicContact CD1-CB 4.25Å; Y50-Q52 HydrophobicContact CE1-CB 3.87Å; Y50-Q52 PolarHBondContact OH-OE1 2.7Å
53	T	33.2	Very low	41	Very low	106 Å²	106	131.9 Å²	131.9	65%	0.65	71%	0.713	S	S	*	*			trans	50	99.3	156.1	53.3	0	0	0	0	119.9	F55	T53-F55 HydrophobicContact CG2-CD2 4.39Å; T53-F55 PolarHBondContact O-N 3.18Å
54	Q	41.2	Very low	41.7	Very low	168 Å²	168	128 Å²	128	79%	0.785	71%	0.709	S	S	*	*			trans	-80.9	100.5	158.3	-67.2	-177.7	-8.2	0	0	111.1
55	F	35.4	Very low	42.2	Very low	174 Å²	174	130 Å²	130	76%	0.763	71%	0.708	S	S	*	*			trans	-135.3	-4.3	172.6	-83	-68.7	0	0	0	117.2	T53	T53-F55 HydrophobicContact CG2-CD2 4.39Å; T53-F55 PolarHBondContact O-N 3.18Å
56	H	42.9	Very low	42.9	Very low	179 Å²	179	130.4 Å²	130.4	83%	0.829	71%	0.713	S	S	*	*	S	Bend	trans	-126.6	-5.2	179.5	-67.2	-48.3	0	0	0	116.7
57	N	39.1	Very low	43.7	Very low	121 Å²	121	125.4 Å²	125.4	65%	0.647	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-6.7	-176	-78	-42.1	0	0	0	115.9	R59	N57-R59 VanDerWaalsContact C-N 3.29Å; N57-R59 PolarHBondContact O-N 2.86Å
58	L	42.6	Very low	44.9	Very low	156 Å²	156	125.8 Å²	125.8	82%	0.817	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-0.2	-172.5	-100.1	76.3	0	0	0	116.1
59	R	46.7	Very low	45.7	Very low	197 Å²	197	124.8 Å²	124.8	74%	0.743	66%	0.657	S	S	*	*	S	Bend	trans	-118.3	-17.4	-172.1	-159.8	164.3	-179.3	143.7	-1.4	115.4	N57 R81	N57-R59 VanDerWaalsContact C-N 3.29Å; N57-R59 PolarHBondContact O-N 2.86Å; R59-R81 PolarHBondContact O-NH1 3.46Å; R59-R81 PolarHBondContact O-NH2 3.08Å
60	N	49.2	Very low	46.5	Very low	51 Å²	51	129.1 Å²	129.1	27%	0.273	66%	0.66	S	S	.	*			trans	-121	64.9	-175.5	-71.7	4.9	0	0	0	111.2	I67 F77	N60-I67 PolarHBondContact O-N 2.86Å; N60-F77 HydrophobicContact CB-CE1 4.22Å; N60-F77 HydrophobicContact CB-CZ 4.39Å
61	T	48.5	Very low	48.1	Very low	73 Å²	73	121.3 Å²	121.3	45%	0.448	63%	0.634	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114	131.3	173.2	-31.7	0	0	0	0	108.6	Y65	T61-Y65 WeakPolarHBondContact CG2-O 3.45Å
62	L	44.8	Very low	48.8	Very low	105 Å²	105	120.5 Å²	120.5	55%	0.55	63%	0.628	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.4	122.1	163.8	-172.1	68.6	0	0	0	105.8	G64 Y65 I67 F77	L62-G64 VanDerWaalsContact C-N 3.27Å; L62-G64 PolarHBondContact O-N 3.28Å; L62-G64 VanDerWaalsContact O-N 3.08Å; L62-Y65 PolarHBondContact N-O 2.98Å; L62-Y65 PolarHBondContact O-N 3.18Å; L62-I67 HydrophobicContact CB-CD1 3.98Å; L62-F77 HydrophobicContact CB-CE2 4.32Å
63	D	51.8	Low	49.9	Very low	152 Å²	152	119.3 Å²	119.3	81%	0.813	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	40.1	48.4	-178.8	-62.4	-8.6	0	0	0	115.7	Y65	D63-Y65 VanDerWaalsContact C-N 3.3Å; D63-Y65 VanDerWaalsContact O-CD2 3.28Å; D63-Y65 WeakPolarHBondContact O-CD2 3.42Å; D63-Y65 PolarHBondContact O-N 2.67Å
64	G	54.4	Low	51.6	Low	68 Å²	68	115.6 Å²	115.6	70%	0.701	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	84.4	-12.7	175.6	0	0	0	0	0	115.7	L62	L62-G64 VanDerWaalsContact C-N 3.27Å; L62-G64 PolarHBondContact O-N 3.28Å; L62-G64 VanDerWaalsContact O-N 3.08Å
65	Y	50.2	Low	52.7	Low	192 Å²	192	113.4 Å²	113.4	75%	0.753	60%	0.596	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.9	135.1	179.2	-64.3	-85.4	0	0	0	111.8	T61 L62 D63	T61-Y65 WeakPolarHBondContact CG2-O 3.45Å; L62-Y65 PolarHBondContact N-O 2.98Å; L62-Y65 PolarHBondContact O-N 3.18Å; D63-Y65 VanDerWaalsContact C-N 3.3Å; D63-Y65 VanDerWaalsContact O-CD2 3.28Å; D63-Y65 WeakPolarHBondContact O-CD2 3.42Å; D63-Y65 PolarHBondContact O-N 2.67Å
66	G	52.9	Low	54.3	Low	62 Å²	62	111.1 Å²	111.1	64%	0.639	59%	0.587	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.7	115.2	179.3	0	0	0	0	0	111.7	H68	G66-H68 PolarHBondContact O-N 2.84Å
67	I	58.8	Low	55.7	Low	34 Å²	34	103.4 Å²	103.4	17%	0.174	55%	0.551	C	S	.	*			trans	-78.4	122	-176	-58	174.8	0	0	0	110	N60 L62 S71 L74 F77	N60-I67 PolarHBondContact O-N 2.86Å; L62-I67 HydrophobicContact CB-CD1 3.98Å; I67-S71 VanDerWaalsContact CG2-OG 3.23Å; I67-S71 WeakPolarHBondContact CG2-OG 3.12Å; I67-L74 HydrophobicContact CG2-CD2 3.74Å; I67-L74 HydrophobicContact CG2-CG 4.24Å; I67-F77 HydrophobicContact CD1-CB 4.29Å; I67-F77 HydrophobicContact CD1-CD1 4.45Å; I67-F77 HydrophobicContact CD1-CD2 3.5Å; I67-F77 VanDerWaalsContact CD1-CD2 3.5Å; I67-F77 HydrophobicContact CD1-CE2 3.81Å; I67-F77 HydrophobicContact CD1-CG 3.85Å; I67-F77 HydrophobicContact CD1-CZ 4.41Å
68	H	61.1	Low	57.4	Low	122 Å²	122	102.8 Å²	102.8	57%	0.565	54%	0.543	S	S	*	.			trans	-73	139.1	-177.6	-179.5	-96	0	0	0	111.5	G66 K70 S71	G66-H68 PolarHBondContact O-N 2.84Å; H68-K70 PolarHBondContact ND1-N 2.99Å; H68-K70 PolarHBondContact O-N 2.83Å; H68-S71 PolarHBondContact O-N 3.09Å; H68-S71 PolarHBondContact O-OG 2.98Å; H68-S71 VanDerWaalsContact O-OG 3.05Å
69	P	56.1	Low	58.9	Low	106 Å²	106	98.4 Å²	98.4	69%	0.688	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	22.8	-176.3	29.3	-38.4	0	0	0	116
70	K	54.8	Low	60.2	Low	179 Å²	179	92.3 Å²	92.3	78%	0.778	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.4	12.3	171	-60	-169.7	176.3	-173.4	0	113.7	H68	H68-K70 PolarHBondContact ND1-N 2.99Å; H68-K70 PolarHBondContact O-N 2.83Å
71	S	66.4	Low	61.3	Low	30 Å²	30	95.5 Å²	95.5	21%	0.21	52%	0.516	C	S	.	.			trans	-75.1	140.1	172.6	52.3	0	0	0	0	110.4	I67 H68 D73 L74	I67-S71 VanDerWaalsContact CG2-OG 3.23Å; I67-S71 WeakPolarHBondContact CG2-OG 3.12Å; H68-S71 PolarHBondContact O-N 3.09Å; H68-S71 PolarHBondContact O-OG 2.98Å; H68-S71 VanDerWaalsContact O-OG 3.05Å; S71-D73 PolarHBondContact O-N 2.89Å; S71-L74 WeakPolarHBondContact O-CB 3.33Å; S71-L74 WeakPolarHBondContact O-CD1 3.3Å; S71-L74 VanDerWaalsContact O-CG 3.31Å; S71-L74 WeakPolarHBondContact O-CG 3.46Å; S71-L74 PolarHBondContact O-N 2.65Å; S71-L74 VanDerWaalsContact O-N 3.16Å
72	V	59.3	Low	62.5	Low	121 Å²	121	99.9 Å²	99.9	73%	0.733	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-30.3	177.9	-177.5	0	0	0	0	111.3	L74	V72-L74 PolarHBondContact O-N 2.86Å
73	D	59.8	Low	64	Low	109 Å²	109	99.7 Å²	99.7	58%	0.583	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-4.9	179.5	-40.6	-70.6	0	0	0	114.6	S71 D75 Q76 F77	S71-D73 PolarHBondContact O-N 2.89Å; D73-D75 VanDerWaalsContact C-N 3.31Å; D73-D75 PolarHBondContact O-N 2.89Å; D73-Q76 PolarHBondContact O-N 2.7Å; D73-F77 WeakPolarHBondContact O-CB 3.28Å; D73-F77 PolarHBondContact O-N 3.42Å
74	L	67.9	Low	65.1	Low	28 Å²	28	97 Å²	97	15%	0.147	51%	0.509	C	S	.	.	H	α-helix	trans	-60.5	-40.5	175.8	-76.9	166	0	0	0	111.9	I67 S71 V72 Q76 F77 F78	I67-L74 HydrophobicContact CG2-CD2 3.74Å; I67-L74 HydrophobicContact CG2-CG 4.24Å; S71-L74 WeakPolarHBondContact O-CB 3.33Å; S71-L74 WeakPolarHBondContact O-CD1 3.3Å; S71-L74 VanDerWaalsContact O-CG 3.31Å; S71-L74 WeakPolarHBondContact O-CG 3.46Å; S71-L74 PolarHBondContact O-N 2.65Å; S71-L74 VanDerWaalsContact O-N 3.16Å; V72-L74 PolarHBondContact O-N 2.86Å; L74-Q76 VanDerWaalsContact C-N 3.34Å; L74-F77 PolarHBondContact O-N 3.41Å; L74-F78 HydrophobicContact CB-CD2 4.42Å; L74-F78 HydrophobicContact CB-CE2 4.35Å; L74-F78 HydrophobicContact CD2-CE2 4.11Å; L74-F78 WeakPolarHBondContact O-CD2 3.29Å; L74-F78 PolarHBondContact O-N 2.99Å
75	D	64.7	Low	65.7	Low	122 Å²	122	98.2 Å²	98.2	65%	0.652	50%	0.499	S	S	*	.	H	α-helix	trans	-68	-37.1	177.6	-75.9	-18	0	0	0	111	D73 F78 T79	D73-D75 VanDerWaalsContact C-N 3.31Å; D73-D75 PolarHBondContact O-N 2.89Å; D75-F78 PolarHBondContact O-N 2.74Å; D75-T79 VanDerWaalsContact O-CB 3.31Å; D75-T79 WeakPolarHBondContact O-CB 3.41Å; D75-T79 VanDerWaalsContact O-CG2 3.24Å; D75-T79 WeakPolarHBondContact O-CG2 3.28Å; D75-T79 PolarHBondContact O-N 3.4Å; D75-T79 PolarHBondContact O-OG1 3.35Å
76	Q	68.7	Low	66.5	Low	126 Å²	126	92.4 Å²	92.4	59%	0.589	48%	0.479	S	S	*	.	H	α-helix	trans	-66.3	-38.9	173.5	-166.2	67	0.6	0	0	111.5	D73 L74 T79 T80	D73-Q76 PolarHBondContact O-N 2.7Å; L74-Q76 VanDerWaalsContact C-N 3.34Å; Q76-T79 WeakPolarHBondContact CA-OG1 3.2Å; Q76-T79 PolarHBondContact O-OG1 3.07Å; Q76-T80 WeakPolarHBondContact O-CB 3.14Å; Q76-T80 VanDerWaalsContact O-CG2 3.26Å; Q76-T80 WeakPolarHBondContact O-CG2 3.46Å; Q76-T80 PolarHBondContact O-N 3.45Å; Q76-T80 PolarHBondContact O-OG1 3.24Å
77	F	72.6	Confident	67.3	Low	17 Å²	17	93.9 Å²	93.9	8%	0.075	48%	0.475	C	S	.	.	H	α-helix	trans	-66.5	-42.6	175.2	-179.2	-102.6	0	0	0	112.5	N60 L62 I67 D73 L74 T80 R81	N60-F77 HydrophobicContact CB-CE1 4.22Å; N60-F77 HydrophobicContact CB-CZ 4.39Å; L62-F77 HydrophobicContact CB-CE2 4.32Å; I67-F77 HydrophobicContact CD1-CB 4.29Å; I67-F77 HydrophobicContact CD1-CD1 4.45Å; I67-F77 HydrophobicContact CD1-CD2 3.5Å; I67-F77 VanDerWaalsContact CD1-CD2 3.5Å; I67-F77 HydrophobicContact CD1-CE2 3.81Å; I67-F77 HydrophobicContact CD1-CG 3.85Å; I67-F77 HydrophobicContact CD1-CZ 4.41Å; D73-F77 WeakPolarHBondContact O-CB 3.28Å; D73-F77 PolarHBondContact O-N 3.42Å; L74-F77 PolarHBondContact O-N 3.41Å; F77-T80 PolarHBondContact O-OG1 3.33Å; F77-R81 VanDerWaalsContact CZ-NH1 3.29Å; F77-R81 WeakPolarHBondContact O-CB 3.07Å; F77-R81 PolarHBondContact O-N 3.34Å; F77-R81 VanDerWaalsContact O-N 3.08Å
78	F	74.8	Confident	67.8	Low	108 Å²	108	100.1 Å²	100.1	47%	0.474	50%	0.496	S	S	.	.	H	α-helix	trans	-75	-36.4	178.5	-71.7	-58.6	0	0	0	112.8	L74 D75 R82	L74-F78 HydrophobicContact CB-CD2 4.42Å; L74-F78 HydrophobicContact CB-CE2 4.35Å; L74-F78 HydrophobicContact CD2-CE2 4.11Å; L74-F78 WeakPolarHBondContact O-CD2 3.29Å; L74-F78 PolarHBondContact O-N 2.99Å; D75-F78 PolarHBondContact O-N 2.74Å; F78-R82 WeakPolarHBondContact O-CB 3.46Å; F78-R82 PolarHBondContact O-N 2.95Å
79	T	74.3	Confident	67.8	Low	65 Å²	65	100.2 Å²	100.2	40%	0.399	50%	0.497	S	S	.	.	H	α-helix	trans	-69	-47.4	175.5	51.7	0	0	0	0	112	D75 Q76 R81 R82 L83	D75-T79 VanDerWaalsContact O-CB 3.31Å; D75-T79 WeakPolarHBondContact O-CB 3.41Å; D75-T79 VanDerWaalsContact O-CG2 3.24Å; D75-T79 WeakPolarHBondContact O-CG2 3.28Å; D75-T79 PolarHBondContact O-N 3.4Å; D75-T79 PolarHBondContact O-OG1 3.35Å; Q76-T79 WeakPolarHBondContact CA-OG1 3.2Å; Q76-T79 PolarHBondContact O-OG1 3.07Å; T79-R81 VanDerWaalsContact C-N 3.34Å; T79-R81 PolarHBondContact O-N 3.08Å; T79-R82 WeakPolarHBondContact O-CB 3.4Å; T79-R82 PolarHBondContact O-N 3.1Å; T79-L83 WeakPolarHBondContact O-CB 3.24Å; T79-L83 WeakPolarHBondContact O-CG 3.31Å; T79-L83 PolarHBondContact O-N 2.83Å
80	T	73.7	Confident	67.9	Low	68 Å²	68	101.4 Å²	101.4	42%	0.417	50%	0.497	S	S	.	.	H	α-helix	trans	-60	-43	174.1	52	0	0	0	0	111.7	Q76 F77 R82 L83 L84	Q76-T80 WeakPolarHBondContact O-CB 3.14Å; Q76-T80 VanDerWaalsContact O-CG2 3.26Å; Q76-T80 WeakPolarHBondContact O-CG2 3.46Å; Q76-T80 PolarHBondContact O-N 3.45Å; Q76-T80 PolarHBondContact O-OG1 3.24Å; F77-T80 PolarHBondContact O-OG1 3.33Å; T80-R82 VanDerWaalsContact C-N 3.33Å; T80-R82 PolarHBondContact O-N 2.98Å; T80-L83 PolarHBondContact O-N 2.84Å; T80-L84 VanDerWaalsContact O-CB 3.32Å; T80-L84 WeakPolarHBondContact O-CB 2.98Å; T80-L84 PolarHBondContact O-N 2.62Å
81	R	71.1	Confident	67.8	Low	118 Å²	118	99.7 Å²	99.7	45%	0.445	50%	0.496	S	S	.	.	H	α-helix	trans	-69	-29.1	177.6	-162.8	172.1	-164.3	168.7	6.2	113.3	R59 F77 T79 N85	R59-R81 PolarHBondContact O-NH1 3.46Å; R59-R81 PolarHBondContact O-NH2 3.08Å; F77-R81 VanDerWaalsContact CZ-NH1 3.29Å; F77-R81 WeakPolarHBondContact O-CB 3.07Å; F77-R81 PolarHBondContact O-N 3.34Å; F77-R81 VanDerWaalsContact O-N 3.08Å; T79-R81 VanDerWaalsContact C-N 3.34Å; T79-R81 PolarHBondContact O-N 3.08Å; R81-N85 WeakPolarHBondContact O-CB 3.36Å; R81-N85 PolarHBondContact O-N 3.3Å
82	R	74.6	Confident	67.2	Low	166 Å²	166	108.9 Å²	108.9	63%	0.626	53%	0.526	S	S	*	.	H	α-helix	trans	-69.2	-52.3	170.2	175.8	178.4	171	165.5	0.8	110.9	F78 T79 T80 L84 N85 E86	F78-R82 WeakPolarHBondContact O-CB 3.46Å; F78-R82 PolarHBondContact O-N 2.95Å; T79-R82 WeakPolarHBondContact O-CB 3.4Å; T79-R82 PolarHBondContact O-N 3.1Å; T80-R82 VanDerWaalsContact C-N 3.33Å; T80-R82 PolarHBondContact O-N 2.98Å; R82-L84 VanDerWaalsContact C-N 3.33Å; R82-L84 PolarHBondContact O-N 3.35Å; R82-N85 CarbonylContact O-C 3.59Å; R82-N85 WeakPolarHBondContact O-CA 3.26Å; R82-N85 WeakPolarHBondContact O-CB 3.46Å; R82-N85 PolarHBondContact O-N 2.85Å; R82-E86 HydrophobicContact CG-CG 4.49Å; R82-E86 IonicContact CZ-OE1 2.61Å; R82-E86 VanDerWaalsContact CZ-OE1 3.28Å; R82-E86 IonicContact NE-OE1 2.75Å; R82-E86 PolarHBondContact NE-OE1 3.26Å; R82-E86 IonicContact NE-OE2 3.49Å; R82-E86 IonicContact NH2-OE1 3.29Å; R82-E86 PolarHBondContact NH2-OE1 2.99Å; R82-E86 PolarHBondContact O-N 2.97Å
83	L	76	Confident	66.5	Low	101 Å²	101	110.4 Å²	110.4	53%	0.529	53%	0.529	S	S	.	.	H	α-helix	trans	-57.1	-44.5	177.5	-76.1	166.1	0	0	0	111.5	T79 T80 N85 E86 V87	T79-L83 WeakPolarHBondContact O-CB 3.24Å; T79-L83 WeakPolarHBondContact O-CG 3.31Å; T79-L83 PolarHBondContact O-N 2.83Å; T80-L83 PolarHBondContact O-N 2.84Å; L83-N85 PolarHBondContact O-N 3.3Å; L83-E86 PolarHBondContact O-N 3.43Å; L83-E86 VanDerWaalsContact O-N 3.14Å; L83-V87 WeakPolarHBondContact O-CG2 3.35Å; L83-V87 PolarHBondContact O-N 3.45Å
84	L	74.4	Confident	65.9	Low	96 Å²	96	110.7 Å²	110.7	50%	0.503	54%	0.54	S	S	.	.	H	α-helix	trans	-60.7	-31.1	175.6	-158.6	82.7	0	0	0	112.3	T80 R82 R88	T80-L84 VanDerWaalsContact O-CB 3.32Å; T80-L84 WeakPolarHBondContact O-CB 2.98Å; T80-L84 PolarHBondContact O-N 2.62Å; R82-L84 VanDerWaalsContact C-N 3.33Å; R82-L84 PolarHBondContact O-N 3.35Å; L84-R88 VanDerWaalsContact O-CG 3.23Å; L84-R88 WeakPolarHBondContact O-CG 3.42Å; L84-R88 PolarHBondContact O-N 3.01Å; L84-R88 VanDerWaalsContact O-N 3.17Å
85	N	68.1	Low	65	Low	92 Å²	92	115.2 Å²	115.2	49%	0.492	57%	0.569	S	S	.	*	H	α-helix	trans	-82.8	-29.7	177.3	-157.8	57.6	0	0	0	112.3	R81 R82 L83 Q89	R81-N85 WeakPolarHBondContact O-CB 3.36Å; R81-N85 PolarHBondContact O-N 3.3Å; R82-N85 CarbonylContact O-C 3.59Å; R82-N85 WeakPolarHBondContact O-CA 3.26Å; R82-N85 WeakPolarHBondContact O-CB 3.46Å; R82-N85 PolarHBondContact O-N 2.85Å; L83-N85 PolarHBondContact O-N 3.3Å; N85-Q89 WeakPolarHBondContact O-CG 3.3Å; N85-Q89 PolarHBondContact O-N 3.16Å; N85-Q89 PolarHBondContact O-NE2 3.28Å
86	E	67.5	Low	64	Low	71 Å²	71	114.9 Å²	114.9	33%	0.332	57%	0.573	S	S	.	*	H	α-helix	trans	-69.7	-43	170	-72.2	170	171.5	0	0	110.6	R82 L83 R88 Q89 L90	R82-E86 HydrophobicContact CG-CG 4.49Å; R82-E86 IonicContact CZ-OE1 2.61Å; R82-E86 VanDerWaalsContact CZ-OE1 3.28Å; R82-E86 IonicContact NE-OE1 2.75Å; R82-E86 PolarHBondContact NE-OE1 3.26Å; R82-E86 IonicContact NE-OE2 3.49Å; R82-E86 IonicContact NH2-OE1 3.29Å; R82-E86 PolarHBondContact NH2-OE1 2.99Å; R82-E86 PolarHBondContact O-N 2.97Å; L83-E86 PolarHBondContact O-N 3.43Å; L83-E86 VanDerWaalsContact O-N 3.14Å; E86-R88 VanDerWaalsContact C-N 3.34Å; E86-R88 PolarHBondContact O-N 3.32Å; E86-Q89 WeakPolarHBondContact O-CA 3.48Å; E86-Q89 WeakPolarHBondContact O-CB 3.17Å; E86-Q89 PolarHBondContact O-N 3.25Å; E86-L90 PolarHBondContact O-N 3.45Å; E86-L90 VanDerWaalsContact O-N 3.12Å
87	V	69.9	Low	62.7	Low	92 Å²	92	114 Å²	114	56%	0.558	58%	0.581	S	S	*	*	H	α-helix	trans	-58.7	-42.4	171.4	171.2	0	0	0	0	111.8	L83 Q89 L90 D91	L83-V87 WeakPolarHBondContact O-CG2 3.35Å; L83-V87 PolarHBondContact O-N 3.45Å; V87-Q89 PolarHBondContact O-N 3.2Å; V87-L90 WeakPolarHBondContact O-CB 3.48Å; V87-L90 PolarHBondContact O-N 2.84Å; V87-L90 VanDerWaalsContact O-N 3.13Å; V87-D91 PolarHBondContact O-N 3.4Å
88	R	67.6	Low	61.3	Low	166 Å²	166	119.9 Å²	119.9	63%	0.626	62%	0.618	S	S	*	*	H	α-helix	trans	-68.3	-14.9	173.1	-72.9	171.8	-172.4	-169.2	1.5	114.6	L84 E86	L84-R88 VanDerWaalsContact O-CG 3.23Å; L84-R88 WeakPolarHBondContact O-CG 3.42Å; L84-R88 PolarHBondContact O-N 3.01Å; L84-R88 VanDerWaalsContact O-N 3.17Å; E86-R88 VanDerWaalsContact C-N 3.34Å; E86-R88 PolarHBondContact O-N 3.32Å
89	Q	61	Low	59.7	Low	124 Å²	124	122.7 Å²	122.7	58%	0.579	63%	0.633	S	S	*	*	H	α-helix	trans	-86.3	-25.8	171.2	-74.7	165.4	89.9	0	0	111.9	N85 E86 V87 D91	N85-Q89 WeakPolarHBondContact O-CG 3.3Å; N85-Q89 PolarHBondContact O-N 3.16Å; N85-Q89 PolarHBondContact O-NE2 3.28Å; E86-Q89 WeakPolarHBondContact O-CA 3.48Å; E86-Q89 WeakPolarHBondContact O-CB 3.17Å; E86-Q89 PolarHBondContact O-N 3.25Å; V87-Q89 PolarHBondContact O-N 3.2Å; Q89-D91 VanDerWaalsContact C-N 3.28Å
90	L	59.2	Low	58.3	Low	131 Å²	131	126.7 Å²	126.7	69%	0.686	65%	0.651	S	S	*	*	H	α-helix	trans	-69.9	-25	170.2	-61.7	174.4	0	0	0	112.4	E86 V87 R92	E86-L90 PolarHBondContact O-N 3.45Å; E86-L90 VanDerWaalsContact O-N 3.12Å; V87-L90 WeakPolarHBondContact O-CB 3.48Å; V87-L90 PolarHBondContact O-N 2.84Å; V87-L90 VanDerWaalsContact O-N 3.13Å; L90-R92 PolarHBondContact O-N 2.91Å
91	D	52.7	Low	56.8	Low	142 Å²	142	129.1 Å²	129.1	76%	0.759	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	29	174.7	-159	32.5	0	0	0	114.1	V87 Q89	V87-D91 PolarHBondContact O-N 3.4Å; Q89-D91 VanDerWaalsContact C-N 3.28Å
92	R	52.6	Low	55.8	Low	223 Å²	223	129.3 Å²	129.3	84%	0.842	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115	23.7	172.5	-81.8	-174	165.4	-104.8	-2.1	113	L90 S94	L90-R92 PolarHBondContact O-N 2.91Å; R92-S94 PolarHBondContact O-N 3.44Å
93	L	45.5	Very low	54.4	Low	153 Å²	153	132.2 Å²	132.2	80%	0.801	69%	0.687	S	S	*	*			trans	-67.7	99	165.3	-69.5	176.6	0	0	0	109.9	V95	L93-V95 PolarHBondContact O-N 3.03Å
94	S	46.9	Very low	52.6	Low	115 Å²	115	135.1 Å²	135.1	80%	0.804	70%	0.702	S	S	*	*			trans	-68	87.7	178	177.2	0	0	0	0	111.6	R92 P96	R92-S94 PolarHBondContact O-N 3.44Å; S94-P96 WeakPolarHBondContact O-CD 3.28Å
95	V	50.1	Low	51.1	Low	124 Å²	124	136.9 Å²	136.9	75%	0.752	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-60.4	125.1	172.3	-177.7	0	0	0	0	109.7	L93 S97	L93-V95 PolarHBondContact O-N 3.03Å; V95-S97 PolarHBondContact O-N 2.91Å
96	P	44	Very low	49.6	Very low	114 Å²	114	139.3 Å²	139.3	74%	0.74	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-63.8	127.7	174.8	-21.8	33.7	0	0	0	111.2	S94 T98	S94-P96 WeakPolarHBondContact O-CD 3.28Å; P96-T98 PolarHBondContact O-N 3.4Å
97	S	39.4	Very low	48.3	Very low	109 Å²	109	147 Å²	147	76%	0.762	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-67.6	123	177.2	53.2	0	0	0	0	111.3	V95 E99	V95-S97 PolarHBondContact O-N 2.91Å; S97-E99 PolarHBondContact O-N 3.31Å
98	T	45	Very low	46.5	Very low	139 Å²	139	149.5 Å²	149.5	85%	0.853	76%	0.761	S	S	*	*			trans	-75.6	104.8	175.5	41.9	0	0	0	0	111.3	P96 L100	P96-T98 PolarHBondContact O-N 3.4Å; T98-L100 PolarHBondContact O-N 3.29Å
99	E	41.2	Very low	45.1	Very low	168 Å²	168	147.2 Å²	147.2	79%	0.785	77%	0.77	S	S	*	*			trans	-67.7	116.9	173.9	-68	-170.3	164.9	0	0	111.6	S97 N101	S97-E99 PolarHBondContact O-N 3.31Å; E99-N101 PolarHBondContact O-N 2.96Å
100	L	43.4	Very low	43.9	Very low	149 Å²	149	150 Å²	150	78%	0.78	78%	0.783	S	S	*	*			trans	-100.5	85.4	-176.6	-157.7	164.6	0	0	0	110.7	T98 T102	T98-L100 PolarHBondContact O-N 3.29Å; L100-T102 HydrophobicContact CD2-CG2 3.5Å; L100-T102 VanDerWaalsContact CD2-CG2 3.5Å; L100-T102 PolarHBondContact O-N 3.24Å
101	N	42.2	Very low	42.6	Very low	119 Å²	119	149.3 Å²	149.3	64%	0.636	79%	0.785	S	S	*	*			trans	-75	110.5	178.5	-77.6	-72.6	0	0	0	111.7	E99	E99-N101 PolarHBondContact O-N 2.96Å
102	T	51.5	Low	41.5	Very low	121 Å²	121	148.8 Å²	148.8	74%	0.742	79%	0.786	S	S	*	*			trans	-98.5	138.8	174.2	63.1	0	0	0	0	111.3	L100	L100-T102 HydrophobicContact CD2-CG2 3.5Å; L100-T102 VanDerWaalsContact CD2-CG2 3.5Å; L100-T102 PolarHBondContact O-N 3.24Å
103	W	45	Very low	40.6	Very low	228 Å²	228	144.2 Å²	144.2	86%	0.864	78%	0.783	S	S	*	*			trans	-118.4	117.9	179.2	-67	86.9	0	0	0	110	V105	W103-V105 PolarHBondContact O-N 2.74Å
104	L	38.3	Very low	39.9	Very low	161 Å²	161	142.3 Å²	142.3	84%	0.843	78%	0.783	S	S	*	*			trans	-89.4	106.3	-178.1	-159.7	83.1	0	0	0	110.8	H106	L104-H106 PolarHBondContact O-N 3.06Å
105	V	42	Very low	39.3	Very low	133 Å²	133	141.6 Å²	141.6	81%	0.806	78%	0.784	S	S	*	*			trans	-81.3	107.2	177.4	-179.1	0	0	0	0	110	W103	W103-V105 PolarHBondContact O-N 2.74Å
106	H	36.5	Very low	38.5	Very low	144 Å²	144	139.4 Å²	139.4	67%	0.667	79%	0.786	S	S	*	*			trans	-69.2	143	170.8	-117.1	66.5	0	0	0	111.3	L104 D108	L104-H106 PolarHBondContact O-N 3.06Å; H106-D108 IonicContact CD2-OD1 2.74Å
107	R	39.8	Very low	37.9	Very low	231 Å²	231	137.5 Å²	137.5	87%	0.872	79%	0.787	S	S	*	*			trans	-122.6	113	156.2	-66.5	-169	75.3	124.7	3.8	107.4
108	D	32.1	Very low	37.5	Very low	146 Å²	146	141.9 Å²	141.9	78%	0.781	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-66.5	137.4	178.9	-56.9	-52.8	0	0	0	110.6	H106	H106-D108 IonicContact CD2-OD1 2.74Å
109	S	39	Very low	36.8	Very low	118 Å²	118	141 Å²	141	83%	0.825	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-97.1	140.6	168.3	-66.3	0	0	0	0	109.7
110	E	36	Very low	36.4	Very low	182 Å²	182	138.5 Å²	138.5	85%	0.85	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-72.3	135.3	-170.7	-70.2	-173.1	133.6	0	0	114
111	T	30.9	Very low	36.4	Very low	117 Å²	117	137.6 Å²	137.6	72%	0.718	80%	0.799	S	S	*	*			trans	68.9	120.1	144.1	56.6	0	0	0	0	121.5
112	V	30.4	Very low	35.9	Very low	130 Å²	130	135 Å²	135	79%	0.788	80%	0.801	S	S	*	*				66.4	127.4	122.9	174.5	0	0	0	0	117.1
113	V	33.6	Very low	35	Very low	128 Å²	128	137.1 Å²	137.1	78%	0.776	81%	0.806	S	S	*	*			cis	-135.4	153.8	35.7	-156.9	0	0	0	0	113.2
114	S	30.9	Very low	34.3	Very low	113 Å²	113	132 Å²	132	79%	0.79	80%	0.8	S	S	*	*			trans	-47.7	170.1	151.5	-29.1	0	0	0	0	113.4
115	A	33.6	Very low	34	Very low	100 Å²	100	132.3 Å²	132.3	83%	0.826	80%	0.802	S	S	*	*			cis	-143.8	165	1.5	0	0	0	0	0	106.3
116	G	33.3	Very low	33.4	Very low	78 Å²	78	132 Å²	132	80%	0.804	80%	0.796	S	S	*	*			cis	114.5	115.3	34.8	0	0	0	0	0	108.8
117	G	32.1	Very low	33.2	Very low	74 Å²	74	131.9 Å²	131.9	76%	0.763	80%	0.8	S	S	*	*			trans	95.7	92	170.8	0	0	0	0	0	117.4
118	Q	31.3	Very low	32.8	Very low	200 Å²	200	123.8 Å²	123.8	94%	0.935	79%	0.789	S	S	*	*			trans	63	113	149.5	-57.7	-177.2	-2.4	0	0	120.1
119	S	30.4	Very low	32.6	Very low	120 Å²	120	121.9 Å²	121.9	84%	0.839	79%	0.793	S	S	*	*			trans	-141.5	120.6	152.4	60.3	0	0	0	0	110.9
120	S	33.2	Very low	32.1	Very low	116 Å²	116	119.9 Å²	119.9	81%	0.811	79%	0.791	S	S	*	*			trans	-72.2	-177.3	172.6	-47.3	0	0	0	0	111.4
121	P	42.4	Very low	31.8	Very low	130 Å²	130	119.5 Å²	119.5	84%	0.844	79%	0.794	S	S	*	*			cis	-139.7	-173	8.8	43.5	-24.2	0	0	0	116.7
122	G	31.7	Very low	31.8	Very low	66 Å²	66	122.2 Å²	122.2	68%	0.68	80%	0.798	S	S	*	*			trans	119.4	73.2	173.1	0	0	0	0	0	112.7
123	I	31.8	Very low	31.6	Very low	165 Å²	165	122.5 Å²	122.5	85%	0.846	80%	0.796	S	S	*	*				72.8	115	82.8	-62.9	175.2	0	0	0	113.1
124	T	30.7	Very low	31.3	Very low	120 Å²	120	122.4 Å²	122.4	74%	0.736	79%	0.789	S	S	*	*			trans	-93	-176.1	168.3	51.1	0	0	0	0	111.4
125	L	31.8	Very low	31.1	Very low	167 Å²	167	123.5 Å²	123.5	87%	0.874	79%	0.787	S	S	*	*			trans	84.8	147.4	-169.8	-48.9	169	0	0	0	111.6
126	D	30.7	Very low	30.8	Very low	128 Å²	128	125.1 Å²	125.1	68%	0.684	78%	0.781	S	S	*	*			cis	-148.8	166.8	8.9	-171.5	32.1	0	0	0	112.2
127	N	31.7	Very low	30.6	Very low	140 Å²	140	128.3 Å²	128.3	75%	0.749	78%	0.778	S	S	*	*			trans	29.3	143.4	161.1	-84	-57.3	0	0	0	122.5
128	G	30.3	Very low	30.3	Very low	62 Å²	62	131.3 Å²	131.3	64%	0.639	78%	0.777	S	S	*	*			cis	-152.1	164.5	2.7	0	0	0	0	0	110.4
129	A	29.5	Very low	30.2	Very low	106 Å²	106	126.4 Å²	126.4	88%	0.876	77%	0.771	S	S	*	*				58	129.4	63.9	0	0	0	0	0	112.6
130	G	28.1	Very low	30.5	Very low	76 Å²	76	126.8 Å²	126.8	78%	0.784	77%	0.768	S	S	*	*			cis	-173.2	-172.7	0.2	0	0	0	0	0	107.2
131	L	30.3	Very low	31	Very low	173 Å²	173	126.8 Å²	126.8	91%	0.906	77%	0.765	S	S	*	*			cis	-157.7	170	5.7	-157.9	77.9	0	0	0	107.9
132	E	29.2	Very low	30.4	Very low	174 Å²	174	124.4 Å²	124.4	81%	0.813	76%	0.756	S	S	*	*			trans	-86.2	-172.6	160.6	-65.5	-175.3	122.5	0	0	111.1
133	D	27.4	Very low	30.2	Very low	137 Å²	137	129.8 Å²	129.8	73%	0.733	77%	0.766	S	S	*	*			trans	84.6	117	157.3	-87	-7.5	0	0	0	123.3
134	I	27.3	Very low	30.1	Very low	125 Å²	125	133.2 Å²	133.2	64%	0.641	77%	0.768	S	S	*	*				83.7	130.7	123.3	-68.7	171	0	0	0	121.6
135	N	26.3	Very low	29.9	Very low	137 Å²	137	131.1 Å²	131.1	73%	0.733	77%	0.77	S	S	*	*			trans	63.5	130.8	164.8	-67.9	-22.3	0	0	0	117.7
136	N	27.7	Very low	29.7	Very low	133 Å²	133	127.1 Å²	127.1	71%	0.711	77%	0.77	S	S	*	*			cis	70.8	103.9	37.2	-169.9	26.1	0	0	0	115
137	I	29.1	Very low	29.5	Very low	146 Å²	146	125.1 Å²	125.1	75%	0.749	78%	0.779	S	S	*	*				177.1	157.7	129.7	-93.3	159.6	0	0	0	111.1
138	D	25.4	Very low	29.3	Very low	137 Å²	137	122.4 Å²	122.4	73%	0.733	78%	0.784	S	S	*	*			trans	-27.7	146.6	178	-73	-69.6	0	0	0	120.4
139	A	28.3	Very low	29.1	Very low	97 Å²	97	124.1 Å²	124.1	80%	0.802	79%	0.792	S	S	*	*				-157	90.8	117.6	0	0	0	0	0	112.8
140	T	38.1	Very low	29.9	Very low	127 Å²	127	124.4 Å²	124.4	78%	0.779	79%	0.785	S	S	*	*			trans	-84.3	135.2	147	57.5	0	0	0	0	108.2
141	P	42.8	Very low	29.9	Very low	117 Å²	117	129 Å²	129	76%	0.76	79%	0.786	S	S	*	*				-151.9	176.7	106.4	35.8	-17.7	0	0	0	113.5
142	A	30.3	Very low	29.6	Very low	79 Å²	79	125.4 Å²	125.4	65%	0.653	78%	0.776	S	S	*	*			cis	-178.8	165.4	-30.9	0	0	0	0	0	108.3
143	M	27.5	Very low	29.5	Very low	179 Å²	179	122.3 Å²	122.3	88%	0.882	77%	0.769	S	S	*	*			trans	66.3	153.2	167.3	-44.9	175.5	83.3	0	0	115.7
144	R	30.6	Very low	29.4	Very low	238 Å²	238	125 Å²	125	90%	0.898	77%	0.77	S	S	*	*			cis	-127.7	167.4	0	-67.8	175.4	170	-178.9	-4.8	108.7
145	G	26.4	Very low	29.4	Very low	75 Å²	75	126 Å²	126	77%	0.773	78%	0.777	S	S	*	*			cis	130.7	107.8	-2.8	0	0	0	0	0	113
146	G	26.7	Very low	29.6	Very low	84 Å²	84	126.8 Å²	126.8	87%	0.866	78%	0.78	S	S	*	*			trans	80.5	151	178.6	0	0	0	0	0	114.6
147	G	26.1	Very low	29.6	Very low	85 Å²	85	128.5 Å²	128.5	88%	0.876	79%	0.789	S	S	*	*			cis	133.3	118.1	-5.3	0	0	0	0	0	112.6
148	G	26.9	Very low	29.7	Very low	83 Å²	83	125.9 Å²	125.9	86%	0.856	79%	0.789	S	S	*	*			trans	162.1	105.9	175.9	0	0	0	0	0	115.5
149	A	27.7	Very low	30	Very low	98 Å²	98	124.2 Å²	124.2	81%	0.81	80%	0.795	S	S	*	*			trans	-100.1	179.9	147.1	0	0	0	0	0	106.9
150	P	46.7	Very low	30.2	Very low	113 Å²	113	126.6 Å²	126.6	73%	0.734	79%	0.794	S	S	*	*			cis	-142.8	-144.5	18.2	37.2	-11.3	0	0	0	114.1
151	E	26.7	Very low	29.9	Very low	171 Å²	171	126 Å²	126	80%	0.799	80%	0.795	S	S	*	*			trans	78.1	102.9	169.3	-52.6	-156.8	134.4	0	0	115.1
152	S	25.1	Very low	29.3	Very low	99 Å²	99	125.9 Å²	125.9	69%	0.692	80%	0.797	S	S	*	*				70.6	138.7	81.5	71.9	0	0	0	0	113.6
153	T	25.5	Very low	29.6	Very low	108 Å²	108	130.6 Å²	130.6	66%	0.663	81%	0.81	S	S	*	*			cis	-159	169.7	33.6	-29.4	0	0	0	0	110.5
154	Y	26.4	Very low	29.7	Very low	195 Å²	195	125.4 Å²	125.4	77%	0.765	80%	0.803	S	S	*	*			trans	26.3	139.2	164	67	-106.2	0	0	0	120.3
155	D	26.8	Very low	29.8	Very low	145 Å²	145	119.1 Å²	119.1	78%	0.775	80%	0.802	S	S	*	*			cis	-155.5	169.9	49.8	-130.7	-34.1	0	0	0	114.3
156	L	30.4	Very low	30.1	Very low	153 Å²	153	122.2 Å²	122.2	80%	0.801	81%	0.805	S	S	*	*			trans	-96.1	135.3	179.4	-75.3	165.4	0	0	0	112.6
157	N	28.7	Very low	30.2	Very low	170 Å²	170	122.4 Å²	122.4	91%	0.909	80%	0.798	S	S	*	*			trans	-163	155.6	132.2	-104.1	-60.7	0	0	0	110.7
158	A	30.5	Very low	30.7	Very low	91 Å²	91	124 Å²	124	75%	0.752	79%	0.794	S	S	*	*			trans	-140.8	162.4	-164.7	0	0	0	0	0	113.6
159	A	32.6	Very low	30.9	Very low	102 Å²	102	126.9 Å²	126.9	84%	0.843	79%	0.789	S	S	*	*			trans	66.2	155.2	-178.9	0	0	0	0	0	114.9
160	D	31.6	Very low	31.1	Very low	146 Å²	146	125.7 Å²	125.7	78%	0.781	79%	0.786	S	S	*	*			cis	-133.9	160.2	8.9	-170.5	21.9	0	0	0	112.2
161	S	31.7	Very low	30.4	Very low	116 Å²	116	128.5 Å²	128.5	81%	0.811	80%	0.795	S	S	*	*			trans	-125.3	99.1	-179.5	-69.2	0	0	0	0	111.1
162	S	30.2	Very low	30.9	Very low	113 Å²	113	129.1 Å²	129.1	79%	0.79	80%	0.798	S	S	*	*			trans	-123.9	76.6	179.2	179.4	0	0	0	0	111.6	G164	S162-G164 PolarHBondContact O-N 3.05Å
163	L	37	Very low	31.3	Very low	178 Å²	178	133.2 Å²	133.2	93%	0.932	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-74.1	117.2	169.7	-82.3	163.2	0	0	0	110.4
164	G	29.2	Very low	31.8	Very low	71 Å²	71	137.8 Å²	137.8	73%	0.732	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-78.9	122.9	168.5	0	0	0	0	0	110.8	S162	S162-G164 PolarHBondContact O-N 3.05Å
165	A	32.8	Very low	31.9	Very low	106 Å²	106	131.7 Å²	131.7	88%	0.876	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-79.1	131.9	174.5	0	0	0	0	0	111.1
166	V	33.8	Very low	32.4	Very low	140 Å²	140	130.9 Å²	130.9	85%	0.848	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-102.8	132.6	170	175.1	0	0	0	0	108
167	A	27.6	Very low	32.6	Very low	87 Å²	87	134.9 Å²	134.9	72%	0.719	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-91	132.5	173.9	0	0	0	0	0	110.4
168	P	36	Very low	33.3	Very low	120 Å²	120	131.2 Å²	131.2	78%	0.779	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-81.8	147.8	164.3	33.6	-31.8	0	0	0	110.7
169	D	31.8	Very low	33.6	Very low	142 Å²	142	129.3 Å²	129.3	76%	0.759	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-70.9	156.9	174.9	-60.9	-86.2	0	0	0	112.2	K683	D169-K683 IonicContact OD1-NZ 2.64Å
170	G	32.5	Very low	34.1	Very low	73 Å²	73	132 Å²	132	75%	0.753	82%	0.819	S	S	*	*			trans	-130	118.4	172	0	0	0	0	0	111.1
171	N	32.3	Very low	35.1	Very low	172 Å²	172	133 Å²	133	92%	0.92	82%	0.824	S	S	*	*			trans	-78.8	141.5	158	-72.8	-5.4	0	0	0	108.1
172	Q	37.2	Very low	36.5	Very low	184 Å²	184	134.1 Å²	134.1	86%	0.86	82%	0.821	S	S	*	*			trans	-143.6	138.7	163.2	-169.1	158.3	63.7	0	0	110.2
173	E	33.2	Very low	38.6	Very low	185 Å²	185	133.5 Å²	133.5	86%	0.864	81%	0.808	S	S	*	*			trans	-83.1	156.6	-175.8	-62.8	161.9	128.3	0	0	111.2	G175	E173-G175 PolarHBondContact O-N 3.32Å
174	Q	36.2	Very low	40.6	Very low	204 Å²	204	128.6 Å²	128.6	95%	0.953	79%	0.786	S	S	*	*			trans	-78	102.5	178.8	-71.9	-175.6	-17.4	0	0	111.5
175	G	28.9	Very low	42.8	Very low	68 Å²	68	132.4 Å²	132.4	70%	0.701	78%	0.782	S	S	*	*			trans	-100.7	113.8	163	0	0	0	0	0	110.6	E173 R177	E173-G175 PolarHBondContact O-N 3.32Å; G175-R177 PolarHBondContact O-N 2.87Å; G175-R177 VanDerWaalsContact O-N 3.11Å
176	S	36.3	Very low	44.8	Very low	128 Å²	128	135.1 Å²	135.1	90%	0.895	78%	0.777	S	S	*	*			trans	-65.4	112.5	-175.4	-172.2	0	0	0	0	112.4
177	R	35.3	Very low	47.1	Very low	236 Å²	236	131.6 Å²	131.6	89%	0.891	75%	0.754	S	S	*	*			trans	-135.9	119.4	165.5	-94.2	-174.2	165.6	-175.5	-2.7	108.9	G175 G179	G175-R177 PolarHBondContact O-N 2.87Å; G175-R177 VanDerWaalsContact O-N 3.11Å; R177-G179 VanDerWaalsContact C-N 3.3Å; R177-G179 PolarHBondContact O-N 2.93Å
178	G	42.5	Very low	49.8	Very low	94 Å²	94	131.5 Å²	131.5	97%	0.969	74%	0.74	S	S	*	*			trans	-69.2	88	164.9	0	0	0	0	0	110.3
179	G	36.2	Very low	51.8	Low	50 Å²	50	129.4 Å²	129.4	52%	0.515	72%	0.722	S	S	.	*			trans	-104.1	150.6	162.4	0	0	0	0	0	109.4	R177 D181	R177-G179 VanDerWaalsContact C-N 3.3Å; R177-G179 PolarHBondContact O-N 2.93Å; G179-D181 PolarHBondContact O-N 3.46Å
180	N	44.6	Very low	54.2	Low	159 Å²	159	126.9 Å²	126.9	85%	0.85	71%	0.708	S	S	*	*			trans	-78.1	102.4	177.3	-65.3	-31.1	0	0	0	109.7	D182	N180-D182 HydrophobicContact CB-CB 4.29Å; N180-D182 PolarHBondContact O-N 3.48Å
181	D	51.2	Low	56.5	Low	166 Å²	166	127.8 Å²	127.8	89%	0.888	70%	0.695	S	S	*	*			trans	-73.4	48.1	164.5	-66.9	-39.8	0	0	0	111	G179 L183	G179-D181 PolarHBondContact O-N 3.46Å; D181-L183 PolarHBondContact O-N 3.23Å; D181-L183 VanDerWaalsContact O-N 3.17Å
182	D	61.4	Low	58.5	Low	140 Å²	140	123.1 Å²	123.1	75%	0.749	67%	0.67	S	S	*	*			trans	-79.5	98.7	179.8	-157.2	21.3	0	0	0	107.7	N180 T184	N180-D182 HydrophobicContact CB-CB 4.29Å; N180-D182 PolarHBondContact O-N 3.48Å; D182-T184 PolarHBondContact O-N 2.89Å
183	L	73.9	Confident	60.6	Low	100 Å²	100	119 Å²	119	52%	0.524	65%	0.653	S	S	.	*			trans	-46	126.3	-177.4	-75	168	0	0	0	110.1	D181 D187 I188 I191	D181-L183 PolarHBondContact O-N 3.23Å; D181-L183 VanDerWaalsContact O-N 3.17Å; L183-D187 HydrophobicContact CD2-CB 4.25Å; L183-I188 HydrophobicContact CB-CD1 4.22Å; L183-I188 HydrophobicContact CB-CG1 3.85Å; L183-I191 HydrophobicContact CD1-CD1 4.18Å
184	T	80.1	Confident	62.9	Low	76 Å²	76	114.4 Å²	114.4	47%	0.466	63%	0.634	S	S	.	*			trans	-64	153.4	-178.6	78.6	0	0	0	0	109	D182 E186 D187 I188	D182-T184 PolarHBondContact O-N 2.89Å; T184-E186 PolarHBondContact O-N 2.75Å; T184-E186 VanDerWaalsContact O-N 3.08Å; T184-E186 PolarHBondContact OG1-N 3.41Å; T184-D187 VanDerWaalsContact CB-OD2 3.26Å; T184-D187 WeakPolarHBondContact CB-OD2 3.41Å; T184-D187 WeakPolarHBondContact CG2-OD2 3.43Å; T184-D187 PolarHBondContact N-OD2 3.18Å; T184-D187 VanDerWaalsContact N-OD2 3.09Å; T184-D187 WeakPolarHBondContact O-CA 3.44Å; T184-D187 WeakPolarHBondContact O-CB 3.44Å; T184-D187 PolarHBondContact O-N 2.57Å; T184-D187 VanDerWaalsContact OG1-CG 3.28Å; T184-D187 PolarHBondContact OG1-N 2.96Å; T184-D187 PolarHBondContact OG1-OD2 3.15Å; T184-I188 WeakPolarHBondContact O-CG1 3.41Å; T184-I188 PolarHBondContact O-N 3.26Å
185	K	75.9	Confident	64.5	Low	150 Å²	150	111.2 Å²	111.2	65%	0.652	61%	0.613	S	S	*	*	H	α-helix	trans	-56.1	-31.4	177.6	-164.6	-163.8	167.8	-149.9	0	111.9	I188 D189	K185-I188 PolarHBondContact O-N 3Å; K185-D189 WeakPolarHBondContact CE-OD2 3.5Å; K185-D189 IonicContact NZ-OD2 2.9Å; K185-D189 VanDerWaalsContact O-CB 3.32Å; K185-D189 WeakPolarHBondContact O-CB 3.31Å; K185-D189 VanDerWaalsContact O-CG 3.3Å; K185-D189 PolarHBondContact O-N 3.11Å
186	E	73.9	Confident	66.5	Low	164 Å²	164	115.2 Å²	115.2	77%	0.766	61%	0.607	S	S	*	*	H	α-helix	trans	-69.6	-35.1	177.6	-62.1	177	-168.8	0	0	111.7	T184 L190	T184-E186 PolarHBondContact O-N 2.75Å; T184-E186 VanDerWaalsContact O-N 3.08Å; T184-E186 PolarHBondContact OG1-N 3.41Å; E186-L190 WeakPolarHBondContact O-CB 3.26Å; E186-L190 PolarHBondContact O-N 3.39Å
187	D	81.8	Confident	67.9	Low	66 Å²	66	114.4 Å²	114.4	35%	0.353	59%	0.589	S	S	.	*	H	α-helix	trans	-68.4	-41.8	170.7	-56.9	-60.2	0	0	0	111.8	L183 T184 L190 I191	L183-D187 HydrophobicContact CD2-CB 4.25Å; T184-D187 VanDerWaalsContact CB-OD2 3.26Å; T184-D187 WeakPolarHBondContact CB-OD2 3.41Å; T184-D187 WeakPolarHBondContact CG2-OD2 3.43Å; T184-D187 PolarHBondContact N-OD2 3.18Å; T184-D187 VanDerWaalsContact N-OD2 3.09Å; T184-D187 WeakPolarHBondContact O-CA 3.44Å; T184-D187 WeakPolarHBondContact O-CB 3.44Å; T184-D187 PolarHBondContact O-N 2.57Å; T184-D187 VanDerWaalsContact OG1-CG 3.28Å; T184-D187 PolarHBondContact OG1-N 2.96Å; T184-D187 PolarHBondContact OG1-OD2 3.15Å; D187-L190 PolarHBondContact O-N 3.21Å; D187-I191 WeakPolarHBondContact O-CB 3.23Å; D187-I191 WeakPolarHBondContact O-CD1 3.4Å; D187-I191 WeakPolarHBondContact O-CG1 3.23Å; D187-I191 PolarHBondContact O-N 3.49Å
188	I	85.1	Confident	69.1	Low	85 Å²	85	105.7 Å²	105.7	44%	0.436	56%	0.56	S	S	.	*	H	α-helix	trans	-64.4	-49.2	177.5	-62.5	170.9	0	0	0	110.4	L183 T184 K185 L190 I191 D192	L183-I188 HydrophobicContact CB-CD1 4.22Å; L183-I188 HydrophobicContact CB-CG1 3.85Å; T184-I188 WeakPolarHBondContact O-CG1 3.41Å; T184-I188 PolarHBondContact O-N 3.26Å; K185-I188 PolarHBondContact O-N 3Å; I188-L190 PolarHBondContact O-N 3.28Å; I188-I191 PolarHBondContact O-N 2.93Å; I188-D192 PolarHBondContact O-N 3.45Å
189	D	77.1	Confident	70.3	Confident	75 Å²	75	105.2 Å²	105.2	40%	0.401	54%	0.535	S	S	.	.	H	α-helix	trans	-61	-35.1	176.5	-73.4	-23.3	0	0	0	110.4	K185 I193	K185-D189 WeakPolarHBondContact CE-OD2 3.5Å; K185-D189 IonicContact NZ-OD2 2.9Å; K185-D189 VanDerWaalsContact O-CB 3.32Å; K185-D189 WeakPolarHBondContact O-CB 3.31Å; K185-D189 VanDerWaalsContact O-CG 3.3Å; K185-D189 PolarHBondContact O-N 3.11Å; D189-I193 WeakPolarHBondContact O-CD1 3.44Å; D189-I193 WeakPolarHBondContact O-CG1 3.36Å; D189-I193 PolarHBondContact O-N 3.06Å
190	L	83.6	Confident	71.4	Confident	90 Å²	90	109.8 Å²	109.8	47%	0.471	55%	0.547	S	S	.	.	H	α-helix	trans	-70.1	-43	174.5	178.6	61.7	0	0	0	113	E186 D187 I188 D192 I193 L194	E186-L190 WeakPolarHBondContact O-CB 3.26Å; E186-L190 PolarHBondContact O-N 3.39Å; D187-L190 PolarHBondContact O-N 3.21Å; I188-L190 PolarHBondContact O-N 3.28Å; L190-D192 VanDerWaalsContact C-N 3.3Å; L190-D192 PolarHBondContact O-N 2.91Å; L190-I193 PolarHBondContact O-N 3.44Å; L190-L194 HydrophobicContact CD1-CD1 4.16Å; L190-L194 HydrophobicContact CD1-CG 4.25Å; L190-L194 HydrophobicContact CG-CD1 4.02Å; L190-L194 WeakPolarHBondContact O-CB 3.47Å; L190-L194 VanDerWaalsContact O-CG 3.3Å; L190-L194 WeakPolarHBondContact O-CG 3.32Å; L190-L194 PolarHBondContact O-N 3.44Å
191	I	80.3	Confident	72.3	Confident	92 Å²	92	108.1 Å²	108.1	47%	0.472	54%	0.538	S	S	.	.	H	α-helix	trans	-59.4	-44.2	174.2	-72.8	161.8	0	0	0	109.7	L183 D187 I188 I193 L194 W195	L183-I191 HydrophobicContact CD1-CD1 4.18Å; D187-I191 WeakPolarHBondContact O-CB 3.23Å; D187-I191 WeakPolarHBondContact O-CD1 3.4Å; D187-I191 WeakPolarHBondContact O-CG1 3.23Å; D187-I191 PolarHBondContact O-N 3.49Å; I188-I191 PolarHBondContact O-N 2.93Å; I191-I193 PolarHBondContact O-N 3.48Å; I191-L194 PolarHBondContact O-N 2.99Å; I191-W195 VanDerWaalsContact O-CB 3.26Å; I191-W195 WeakPolarHBondContact O-CB 3.48Å; I191-W195 PolarHBondContact O-N 3.48Å
192	D	74.4	Confident	72.3	Confident	74 Å²	74	103.2 Å²	103.2	40%	0.396	53%	0.526	S	S	.	.	H	α-helix	trans	-64.6	-40.9	178.9	-142.4	55.7	0	0	0	111.5	I188 L190 R196	I188-D192 PolarHBondContact O-N 3.45Å; L190-D192 VanDerWaalsContact C-N 3.3Å; L190-D192 PolarHBondContact O-N 2.91Å; D192-R196 VanDerWaalsContact O-CB 3.31Å; D192-R196 WeakPolarHBondContact O-CB 3.28Å; D192-R196 VanDerWaalsContact O-CD 3.23Å; D192-R196 WeakPolarHBondContact O-CD 3.46Å; D192-R196 WeakPolarHBondContact O-CG 3.31Å; D192-R196 PolarHBondContact O-N 3.08Å; D192-R196 IonicContact OD2-NE 3.51Å; D192-R196 PolarHBondContact OD2-NE 3.38Å
193	I	80.8	Confident	72	Confident	98 Å²	98	97.9 Å²	97.9	50%	0.503	50%	0.501	S	S	.	.	H	α-helix	trans	-62.9	-43.9	173.9	-72.5	164.4	0	0	0	111.9	D189 L190 I191 Q197	D189-I193 WeakPolarHBondContact O-CD1 3.44Å; D189-I193 WeakPolarHBondContact O-CG1 3.36Å; D189-I193 PolarHBondContact O-N 3.06Å; L190-I193 PolarHBondContact O-N 3.44Å; I191-I193 PolarHBondContact O-N 3.48Å; I193-Q197 PolarHBondContact O-N 2.89Å
194	L	80.8	Confident	71	Confident	87 Å²	87	94.3 Å²	94.3	46%	0.455	49%	0.489	S	S	.	.	H	α-helix	trans	-68.1	-44.2	179.1	-72	169.2	0	0	0	111.6	L190 I191 R196 Q197 D198	L190-L194 HydrophobicContact CD1-CD1 4.16Å; L190-L194 HydrophobicContact CD1-CG 4.25Å; L190-L194 HydrophobicContact CG-CD1 4.02Å; L190-L194 WeakPolarHBondContact O-CB 3.47Å; L190-L194 VanDerWaalsContact O-CG 3.3Å; L190-L194 WeakPolarHBondContact O-CG 3.32Å; L190-L194 PolarHBondContact O-N 3.44Å; I191-L194 PolarHBondContact O-N 2.99Å; L194-R196 PolarHBondContact O-N 3.48Å; L194-Q197 WeakPolarHBondContact O-CA 3.48Å; L194-Q197 VanDerWaalsContact O-CB 3.27Å; L194-Q197 WeakPolarHBondContact O-CB 3.39Å; L194-Q197 PolarHBondContact O-N 3.18Å; L194-D198 PolarHBondContact O-N 2.64Å
195	W	71.4	Confident	69.3	Low	138 Å²	138	100.1 Å²	100.1	52%	0.523	50%	0.502	S	S	.	.	H	α-helix	trans	-62.4	-41.9	177.4	-178	59.1	0	0	0	112	I191 Q197 D198 I199	I191-W195 VanDerWaalsContact O-CB 3.26Å; I191-W195 WeakPolarHBondContact O-CB 3.48Å; I191-W195 PolarHBondContact O-N 3.48Å; W195-Q197 VanDerWaalsContact C-N 3.3Å; W195-Q197 PolarHBondContact O-N 2.99Å; W195-D198 PolarHBondContact O-N 2.88Å; W195-I199 HydrophobicContact CD2-CD1 3.88Å; W195-I199 HydrophobicContact CE3-CD1 4.19Å; W195-I199 HydrophobicContact CG-CD1 4.44Å; W195-I199 HydrophobicContact CH2-CD1 4.1Å; W195-I199 HydrophobicContact CZ2-CD1 3.79Å; W195-I199 HydrophobicContact CZ3-CD1 4.29Å; W195-I199 WeakPolarHBondContact O-CG1 3.48Å; W195-I199 PolarHBondContact O-N 3.27Å
196	R	69.6	Low	68.3	Low	151 Å²	151	100 Å²	100	57%	0.57	50%	0.504	S	S	*	.	H	α-helix	trans	-59.2	-40	169.9	-74.4	163.5	166.9	-84.3	0.9	112.3	D192 L194 I199 D200	D192-R196 VanDerWaalsContact O-CB 3.31Å; D192-R196 WeakPolarHBondContact O-CB 3.28Å; D192-R196 VanDerWaalsContact O-CD 3.23Å; D192-R196 WeakPolarHBondContact O-CD 3.46Å; D192-R196 WeakPolarHBondContact O-CG 3.31Å; D192-R196 PolarHBondContact O-N 3.08Å; D192-R196 IonicContact OD2-NE 3.51Å; D192-R196 PolarHBondContact OD2-NE 3.38Å; L194-R196 PolarHBondContact O-N 3.48Å; R196-I199 PolarHBondContact O-N 3.48Å; R196-D200 WeakPolarHBondContact O-CB 3.2Å; R196-D200 PolarHBondContact O-N 3.01Å
197	Q	66.3	Low	67.3	Low	112 Å²	112	96.7 Å²	96.7	52%	0.523	50%	0.495	S	S	.	.	H	α-helix	trans	-64.1	-42.2	176.2	-120	178.5	53.7	0	0	112.4	I193 L194 W195 D200 L201	I193-Q197 PolarHBondContact O-N 2.89Å; L194-Q197 WeakPolarHBondContact O-CA 3.48Å; L194-Q197 VanDerWaalsContact O-CB 3.27Å; L194-Q197 WeakPolarHBondContact O-CB 3.39Å; L194-Q197 PolarHBondContact O-N 3.18Å; W195-Q197 VanDerWaalsContact C-N 3.3Å; W195-Q197 PolarHBondContact O-N 2.99Å; Q197-D200 PolarHBondContact O-N 2.92Å; Q197-L201 WeakPolarHBondContact O-CB 3.41Å; Q197-L201 WeakPolarHBondContact O-CD1 3.5Å; Q197-L201 WeakPolarHBondContact O-CG 3.49Å; Q197-L201 PolarHBondContact O-N 3.34Å
198	D	61.4	Low	65.8	Low	52 Å²	52	99.7 Å²	99.7	28%	0.278	51%	0.505	S	S	.	.	H	α-helix	trans	-68.4	-35.9	177.8	-79.9	-22.9	0	0	0	111.9	L194 W195 L201 G202 A203	L194-D198 PolarHBondContact O-N 2.64Å; W195-D198 PolarHBondContact O-N 2.88Å; D198-L201 PolarHBondContact O-N 3.04Å; D198-G202 PolarHBondContact O-N 3.33Å; D198-A203 HydrophobicContact CB-CB 4.21Å; D198-A203 WeakPolarHBondContact O-CB 3.32Å; D198-A203 PolarHBondContact O-N 3.33Å
199	I	66.1	Low	63.6	Low	85 Å²	85	98 Å²	98	44%	0.436	50%	0.501	S	S	.	.	H	α-helix	trans	-60.8	-50.1	169.5	-68.4	165.6	0	0	0	111.1	W195 R196 L201 G202	W195-I199 HydrophobicContact CD2-CD1 3.88Å; W195-I199 HydrophobicContact CE3-CD1 4.19Å; W195-I199 HydrophobicContact CG-CD1 4.44Å; W195-I199 HydrophobicContact CH2-CD1 4.1Å; W195-I199 HydrophobicContact CZ2-CD1 3.79Å; W195-I199 HydrophobicContact CZ3-CD1 4.29Å; W195-I199 WeakPolarHBondContact O-CG1 3.48Å; W195-I199 PolarHBondContact O-N 3.27Å; R196-I199 PolarHBondContact O-N 3.48Å; I199-L201 PolarHBondContact O-N 3.48Å; I199-G202 PolarHBondContact O-N 2.9Å
200	D	59.8	Low	62.3	Low	145 Å²	145	102.6 Å²	102.6	78%	0.775	51%	0.514	S	S	*	.	H	α-helix	trans	-64.8	-23	178.3	-81.7	-19.4	0	0	0	112.9	R196 Q197 G202	R196-D200 WeakPolarHBondContact O-CB 3.2Å; R196-D200 PolarHBondContact O-N 3.01Å; Q197-D200 PolarHBondContact O-N 2.92Å; D200-G202 VanDerWaalsContact C-N 3.33Å
201	L	63	Low	60.4	Low	125 Å²	125	102.8 Å²	102.8	65%	0.654	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-6.1	172.6	-73.7	168.4	0	0	0	113.7	Q197 D198 I199	Q197-L201 WeakPolarHBondContact O-CB 3.41Å; Q197-L201 WeakPolarHBondContact O-CD1 3.5Å; Q197-L201 WeakPolarHBondContact O-CG 3.49Å; Q197-L201 PolarHBondContact O-N 3.34Å; D198-L201 PolarHBondContact O-N 3.04Å; I199-L201 PolarHBondContact O-N 3.48Å
202	G	50.8	Low	58.7	Low	63 Å²	63	103.4 Å²	103.4	65%	0.649	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	85	21.9	178.4	0	0	0	0	0	114.8	D198 I199 D200 G204	D198-G202 PolarHBondContact O-N 3.33Å; I199-G202 PolarHBondContact O-N 2.9Å; D200-G202 VanDerWaalsContact C-N 3.33Å; G202-G204 PolarHBondContact O-N 3.32Å
203	A	55.6	Low	57.4	Low	27 Å²	27	109.2 Å²	109.2	22%	0.223	54%	0.543	C	S	.	.			trans	-78.5	95.5	167.8	0	0	0	0	0	109.4	D198 V207 F208	D198-A203 HydrophobicContact CB-CB 4.21Å; D198-A203 WeakPolarHBondContact O-CB 3.32Å; D198-A203 PolarHBondContact O-N 3.33Å; A203-V207 HydrophobicContact CB-CG2 4.35Å; A203-F208 HydrophobicContact CB-CE2 4.34Å
204	G	52.8	Low	55.4	Low	25 Å²	25	109.4 Å²	109.4	26%	0.258	54%	0.542	S	S	.	.			trans	-70.8	171.9	174.1	0	0	0	0	0	112.8	G202 E206 V207	G202-G204 PolarHBondContact O-N 3.32Å; G204-E206 VanDerWaalsContact C-CD 3.47Å; G204-E206 VanDerWaalsContact CA-CD 3.48Å; G204-E206 VanDerWaalsContact CA-OE1 3.22Å; G204-E206 WeakPolarHBondContact CA-OE1 3.28Å; G204-E206 VanDerWaalsContact CA-OE2 3.27Å; G204-E206 WeakPolarHBondContact CA-OE2 3.37Å; G204-E206 PolarHBondContact N-OE1 3.2Å; G204-E206 PolarHBondContact O-N 3Å; G204-E206 VanDerWaalsContact O-N 3.11Å; G204-V207 PolarHBondContact O-N 2.81Å
205	R	46.1	Very low	53.6	Low	199 Å²	199	110.5 Å²	110.5	75%	0.751	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-57.2	-28.3	-176.4	178.3	175	-77.1	-96.1	0.3	112.6	V207 F208 S209	R205-V207 PolarHBondContact O-N 3.11Å; R205-F208 PolarHBondContact O-N 2.82Å; R205-F208 VanDerWaalsContact O-N 3.11Å; R205-S209 PolarHBondContact O-N 3.46Å; R205-S209 VanDerWaalsContact O-N 3.08Å; R205-S209 PolarHBondContact O-OG 3.3Å
206	E	54.5	Low	52	Low	146 Å²	146	110 Å²	110	68%	0.682	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-58.8	-22.2	175.3	66.1	-76.8	175.9	0	0	114.6	G204	G204-E206 VanDerWaalsContact C-CD 3.47Å; G204-E206 VanDerWaalsContact CA-CD 3.48Å; G204-E206 VanDerWaalsContact CA-OE1 3.22Å; G204-E206 WeakPolarHBondContact CA-OE1 3.28Å; G204-E206 VanDerWaalsContact CA-OE2 3.27Å; G204-E206 WeakPolarHBondContact CA-OE2 3.37Å; G204-E206 PolarHBondContact N-OE1 3.2Å; G204-E206 PolarHBondContact O-N 3Å; G204-E206 VanDerWaalsContact O-N 3.11Å
207	V	52	Low	50.6	Low	96 Å²	96	108 Å²	108	58%	0.582	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-75.6	-26.4	176	-177.4	0	0	0	0	112	A203 G204 R205	A203-V207 HydrophobicContact CB-CG2 4.35Å; G204-V207 PolarHBondContact O-N 2.81Å; R205-V207 PolarHBondContact O-N 3.11Å
208	F	50.2	Low	49.3	Very low	129 Å²	129	108.3 Å²	108.3	57%	0.566	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-12.1	-174.2	-63	-85.3	0	0	0	113.8	A203 R205 Y210	A203-F208 HydrophobicContact CB-CE2 4.34Å; R205-F208 PolarHBondContact O-N 2.82Å; R205-F208 VanDerWaalsContact O-N 3.11Å; F208-Y210 PolarHBondContact O-N 3.15Å; F208-Y210 VanDerWaalsContact O-N 3.11Å
209	S	39.7	Very low	48.4	Very low	50 Å²	50	112.5 Å²	112.5	35%	0.35	58%	0.575	S	S	.	*			trans	-85.4	74.6	179.6	-67.6	0	0	0	0	112.8	R205 S211 N212	R205-S209 PolarHBondContact O-N 3.46Å; R205-S209 VanDerWaalsContact O-N 3.08Å; R205-S209 PolarHBondContact O-OG 3.3Å; S209-S211 PolarHBondContact O-N 3.18Å; S209-S211 VanDerWaalsContact O-N 3.13Å; S209-N212 PolarHBondContact O-N 3.29Å
210	Y	50	Low	47.3	Very low	170 Å²	170	117.4 Å²	117.4	67%	0.667	60%	0.595	S	S	*	*	H	α-helix	trans	-53.8	-32.4	178.2	-156.9	-93.2	0	0	0	113.3	F208 N212 R213	F208-Y210 PolarHBondContact O-N 3.15Å; F208-Y210 VanDerWaalsContact O-N 3.11Å; Y210-N212 PolarHBondContact O-N 3.18Å; Y210-R213 PolarHBondContact O-N 2.92Å; Y210-R213 VanDerWaalsContact O-N 3.1Å
211	S	43.8	Very low	46.3	Very low	94 Å²	94	118.8 Å²	118.8	66%	0.657	60%	0.595	S	S	*	*	H	α-helix	trans	-59	-19	-176.4	-167.7	0	0	0	0	115.9	S209	S209-S211 PolarHBondContact O-N 3.18Å; S209-S211 VanDerWaalsContact O-N 3.13Å
212	N	44.2	Very low	44.9	Very low	105 Å²	105	118.7 Å²	118.7	56%	0.561	60%	0.602	S	S	*	*	H	α-helix	trans	-84.7	-32.7	176.6	-77.9	29.8	0	0	0	112.4	S209 Y210 Q214 K215 D216	S209-N212 PolarHBondContact O-N 3.29Å; Y210-N212 PolarHBondContact O-N 3.18Å; N212-Q214 VanDerWaalsContact C-N 3.31Å; N212-Q214 PolarHBondContact O-N 2.95Å; N212-K215 PolarHBondContact O-N 3.47Å; N212-K215 VanDerWaalsContact O-N 3.08Å; N212-D216 PolarHBondContact O-N 3.15Å
213	R	46.4	Very low	44	Very low	197 Å²	197	119.7 Å²	119.7	74%	0.743	60%	0.599	S	S	*	*	H	α-helix	trans	-70.4	-29.6	-177.3	-117.6	178	180	-82.1	-6.7	113	Y210 T217	Y210-R213 PolarHBondContact O-N 2.92Å; Y210-R213 VanDerWaalsContact O-N 3.1Å; R213-T217 PolarHBondContact O-OG1 2.89Å
214	Q	40.2	Very low	43.4	Very low	101 Å²	101	124 Å²	124	47%	0.472	62%	0.624	S	S	.	*	H	α-helix	trans	-61.9	-48.8	168	-153.7	83.3	10.9	0	0	110.1	N212 T217 E218	N212-Q214 VanDerWaalsContact C-N 3.31Å; N212-Q214 PolarHBondContact O-N 2.95Å; Q214-T217 CarbonylContact O-C 3.22Å; Q214-T217 WeakPolarHBondContact O-CA 3.38Å; Q214-T217 WeakPolarHBondContact O-CB 3.47Å; Q214-T217 PolarHBondContact O-N 3.35Å; Q214-E218 PolarHBondContact O-N 3.39Å
215	K	42.4	Very low	42.8	Very low	111 Å²	111	131 Å²	131	48%	0.483	65%	0.65	S	S	.	*	H	α-helix	trans	-69.5	-40.3	-171.3	-153.8	166.4	-168.9	-84.3	0	113.4	N212 T217 E218 E219	N212-K215 PolarHBondContact O-N 3.47Å; N212-K215 VanDerWaalsContact O-N 3.08Å; K215-T217 PolarHBondContact O-N 3.37Å; K215-T217 VanDerWaalsContact O-N 3.08Å; K215-E218 PolarHBondContact O-N 3.31Å; K215-E218 VanDerWaalsContact O-N 3.1Å; K215-E219 HydrophobicContact CG-CG 4.36Å; K215-E219 IonicContact NZ-OE1 2.76Å; K215-E219 PolarHBondContact NZ-OE1 3Å; K215-E219 PolarHBondContact O-N 2.91Å
216	D	37.6	Very low	42.4	Very low	128 Å²	128	128.2 Å²	128.2	68%	0.684	65%	0.65	S	S	*	*	H	α-helix	trans	-61.1	-14.6	171.5	-63.8	-19.4	0	0	0	112.9	N212	N212-D216 PolarHBondContact O-N 3.15Å
217	T	39.1	Very low	41.7	Very low	108 Å²	108	125.5 Å²	125.5	66%	0.663	65%	0.648	S	S	*	*	H	α-helix	trans	-103.2	-20.1	177.2	-44.2	0	0	0	0	112.6	R213 Q214 K215	R213-T217 PolarHBondContact O-OG1 2.89Å; Q214-T217 CarbonylContact O-C 3.22Å; Q214-T217 WeakPolarHBondContact O-CA 3.38Å; Q214-T217 WeakPolarHBondContact O-CB 3.47Å; Q214-T217 PolarHBondContact O-N 3.35Å; K215-T217 PolarHBondContact O-N 3.37Å; K215-T217 VanDerWaalsContact O-N 3.08Å
218	E	40.5	Very low	40.9	Very low	119 Å²	119	129.4 Å²	129.4	56%	0.556	66%	0.657	S	S	*	*	H	α-helix	trans	-95.4	-22.7	179.5	-72.8	-179.9	160.9	0	0	113.3	Q214 K215 E220 K221	Q214-E218 PolarHBondContact O-N 3.39Å; K215-E218 PolarHBondContact O-N 3.31Å; K215-E218 VanDerWaalsContact O-N 3.1Å; E218-E220 PolarHBondContact O-N 3.04Å; E218-K221 PolarHBondContact O-N 2.95Å; E218-K221 VanDerWaalsContact O-N 3.14Å
219	E	41.9	Very low	40.2	Very low	140 Å²	140	129.7 Å²	129.7	65%	0.654	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-3.8	175.6	-71.5	-174.8	-170.7	0	0	113.8	K215	K215-E219 HydrophobicContact CG-CG 4.36Å; K215-E219 IonicContact NZ-OE1 2.76Å; K215-E219 PolarHBondContact NZ-OE1 3Å; K215-E219 PolarHBondContact O-N 2.91Å
220	E	42.1	Very low	40.2	Very low	187 Å²	187	130.4 Å²	130.4	87%	0.874	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	29.8	166.6	-151.3	-175.7	160.4	0	0	112.9	E218	E218-E220 PolarHBondContact O-N 3.04Å
221	K	40.3	Very low	39.5	Very low	174 Å²	174	128 Å²	128	76%	0.757	67%	0.671	S	S	*	*	S	Bend	trans	-136.7	132.6	173	-138.5	172.5	-173.9	-179.6	0	111.8	E218	E218-K221 PolarHBondContact O-N 2.95Å; E218-K221 VanDerWaalsContact O-N 3.14Å
222	P	33.2	Very low	39.2	Very low	124 Å²	124	129.8 Å²	129.8	81%	0.805	67%	0.674	S	S	*	*			trans	-65.8	145	-177.6	25.4	-34.1	0	0	0	112.6
223	S	31.8	Very low	38.9	Very low	84 Å²	84	131.1 Å²	131.1	59%	0.587	68%	0.677	S	S	*	*			trans	-69.5	140.1	-171.8	48.8	0	0	0	0	114	Q225	S223-Q225 VanDerWaalsContact C-N 3.29Å; S223-Q225 PolarHBondContact O-N 3.41Å
224	P	43.3	Very low	38.5	Very low	116 Å²	116	128.3 Å²	128.3	75%	0.753	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	55.4	-170.5	36	-39	0	0	0	114
225	Q	39.3	Very low	38.4	Very low	172 Å²	172	131.2 Å²	131.2	80%	0.804	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	-22.6	173.5	-80.5	-170.6	-55.3	0	0	114.6	S223 S227	S223-Q225 VanDerWaalsContact C-N 3.29Å; S223-Q225 PolarHBondContact O-N 3.41Å; Q225-S227 VanDerWaalsContact C-N 3.33Å; Q225-S227 PolarHBondContact O-N 3.02Å
226	D	38.5	Very low	37.9	Very low	142 Å²	142	130 Å²	130	76%	0.759	69%	0.691	S	S	*	*	S	Bend	trans	-87.6	0.8	-179.1	-53.7	-46.9	0	0	0	113.9	K228	D226-K228 PolarHBondContact O-N 3.19Å; D226-K228 VanDerWaalsContact O-N 3.15Å
227	S	38.7	Very low	37.7	Very low	89 Å²	89	133.9 Å²	133.9	62%	0.622	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	9	-172.8	61.8	0	0	0	0	115.5	Q225	Q225-S227 VanDerWaalsContact C-N 3.33Å; Q225-S227 PolarHBondContact O-N 3.02Å
228	K	36.8	Very low	37.6	Very low	177 Å²	177	139.4 Å²	139.4	77%	0.77	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	-24.2	-172.2	-154.1	159.7	-169.4	169	0	115.7	D226	D226-K228 PolarHBondContact O-N 3.19Å; D226-K228 VanDerWaalsContact O-N 3.15Å
229	D	35.4	Very low	37.5	Very low	135 Å²	135	140.9 Å²	140.9	72%	0.722	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-18.6	176.8	-62	-23.4	0	0	0	112.2	N231	D229-N231 VanDerWaalsContact C-N 3.27Å; D229-N231 PolarHBondContact O-N 2.7Å
230	A	38.8	Very low	36.9	Very low	65 Å²	65	137.8 Å²	137.8	54%	0.537	72%	0.722	S	S	.	*	H	α-helix	trans	-69.1	-15	-175.1	0	0	0	0	0	115.4
231	N	35.9	Very low	36.9	Very low	119 Å²	119	136.7 Å²	136.7	64%	0.636	72%	0.721	S	S	*	*	H	α-helix	trans	-85.6	-30.4	-177	-162.7	68.8	0	0	0	112.8	D229 Q234	D229-N231 VanDerWaalsContact C-N 3.27Å; D229-N231 PolarHBondContact O-N 2.7Å; N231-Q234 WeakPolarHBondContact O-CB 3.42Å; N231-Q234 PolarHBondContact O-N 2.9Å
232	D	36.9	Very low	36.4	Very low	133 Å²	133	135.9 Å²	135.9	71%	0.711	73%	0.725	S	S	*	*	H	α-helix	trans	-79.2	-29.4	-177.5	-70	0.1	0	0	0	111.9	Q234	D232-Q234 VanDerWaalsContact C-N 3.3Å; D232-Q234 PolarHBondContact O-N 2.68Å
233	E	37.4	Very low	36.9	Very low	132 Å²	132	136.8 Å²	136.8	62%	0.617	72%	0.722	S	S	*	*	H	α-helix	trans	-68.6	-29.2	172.9	-66.1	-157.9	123.8	0	0	112.6	E235 S236	E233-E235 VanDerWaalsContact C-N 3.27Å; E233-E235 PolarHBondContact O-N 3.18Å; E233-S236 WeakPolarHBondContact O-CB 3.3Å; E233-S236 PolarHBondContact O-N 3.02Å; E233-S236 VanDerWaalsContact O-N 3.15Å
234	Q	37.5	Very low	37	Very low	138 Å²	138	142 Å²	142	65%	0.645	74%	0.737	S	S	*	*	H	α-helix	trans	-63.1	-30.9	-175.4	-169.7	68	92.4	0	0	112.8	N231 D232	N231-Q234 WeakPolarHBondContact O-CB 3.42Å; N231-Q234 PolarHBondContact O-N 2.9Å; D232-Q234 VanDerWaalsContact C-N 3.3Å; D232-Q234 PolarHBondContact O-N 2.68Å
235	E	38.1	Very low	36.8	Very low	162 Å²	162	139.9 Å²	139.9	76%	0.757	74%	0.737	S	S	*	*	H	α-helix	trans	-79.8	-29	176.6	-61.6	-153.8	142.6	0	0	113.2	E233 W237	E233-E235 VanDerWaalsContact C-N 3.27Å; E233-E235 PolarHBondContact O-N 3.18Å; E235-W237 VanDerWaalsContact C-N 3.32Å; E235-W237 PolarHBondContact O-N 3.43Å
236	S	32.8	Very low	36.5	Very low	86 Å²	86	137.4 Å²	137.4	60%	0.601	74%	0.738	S	S	*	*	H	α-helix	trans	-64.2	-34.9	-177.6	-170	0	0	0	0	112.9	E233 R238 N239	E233-S236 WeakPolarHBondContact O-CB 3.3Å; E233-S236 PolarHBondContact O-N 3.02Å; E233-S236 VanDerWaalsContact O-N 3.15Å; S236-R238 PolarHBondContact O-N 3Å; S236-N239 PolarHBondContact O-N 3.33Å; S236-N239 VanDerWaalsContact O-N 3.11Å
237	W	32.8	Very low	36.6	Very low	210 Å²	210	137.3 Å²	137.3	80%	0.795	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-5.7	-175.2	-71.8	107.1	0	0	0	115.8	E235	E235-W237 VanDerWaalsContact C-N 3.32Å; E235-W237 PolarHBondContact O-N 3.43Å
238	R	36.9	Very low	36.7	Very low	223 Å²	223	139.2 Å²	139.2	84%	0.842	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-13.8	173.2	-69.1	-169.2	177.8	-81.2	-0.4	114.6	S236	S236-R238 PolarHBondContact O-N 3Å
239	N	38.1	Very low	37.1	Very low	151 Å²	151	135.8 Å²	135.8	81%	0.807	74%	0.737	S	S	*	*	S	Bend	trans	-131.3	70	-169.4	-74.6	-39.7	0	0	0	113.6	S236	S236-N239 PolarHBondContact O-N 3.33Å; S236-N239 VanDerWaalsContact O-N 3.11Å
240	G	31.2	Very low	37.4	Very low	74 Å²	74	133.2 Å²	133.2	76%	0.763	72%	0.723	S	S	*	*			trans	-174.5	118.6	171.1	0	0	0	0	0	114.9
241	I	41.8	Very low	38.1	Very low	165 Å²	165	134.4 Å²	134.4	85%	0.846	74%	0.742	S	S	*	*			trans	-115.4	107.9	173.3	-47.9	170	0	0	0	108.6
242	N	29.8	Very low	39.1	Very low	156 Å²	156	137.7 Å²	137.7	83%	0.834	75%	0.754	S	S	*	*			trans	-160.5	163.1	159	-128.9	-77.7	0	0	0	113.7
243	L	43.1	Very low	40.1	Very low	143 Å²	143	136.6 Å²	136.6	75%	0.749	75%	0.752	S	S	*	*			trans	-101.8	140.5	175.2	-66.2	71.1	0	0	0	109
244	Q	33.3	Very low	40.9	Very low	193 Å²	193	132.8 Å²	132.8	90%	0.902	75%	0.749	S	S	*	*				-169	133.9	123.7	-156.8	59.9	46.6	0	0	110.1
245	G	39.9	Very low	41.5	Very low	73 Å²	73	133.4 Å²	133.4	75%	0.753	75%	0.751	S	S	*	*			trans	-73	162.7	-158.7	0	0	0	0	0	119.8
246	S	32.5	Very low	41.9	Very low	120 Å²	120	130.6 Å²	130.6	84%	0.839	75%	0.749	S	S	*	*			trans	-149.4	137.1	152.9	-174.2	0	0	0	0	107.8
247	Q	39.8	Very low	42.5	Very low	140 Å²	140	131.6 Å²	131.6	65%	0.654	75%	0.747	S	S	*	*			trans	-97.7	135.9	176.4	-73.8	-173.2	-71.3	0	0	110.8
248	P	41.9	Very low	43.4	Very low	128 Å²	128	125 Å²	125	83%	0.831	73%	0.732	S	S	*	*			trans	-75.2	149.3	164.1	32.7	-32.8	0	0	0	110.8
249	V	45.2	Very low	43.7	Very low	106 Å²	106	121.5 Å²	121.5	64%	0.642	73%	0.725	S	S	*	*			trans	-118	145.9	175.9	179.9	0	0	0	0	108.2
250	D	42.2	Very low	44.2	Very low	80 Å²	80	121.5 Å²	121.5	43%	0.428	72%	0.72	S	S	.	*			trans	-73.3	158.6	178.4	87.1	34.8	0	0	0	113.2	E252 T253 G254	D250-E252 PolarHBondContact OD1-N 3.34Å; D250-E252 VanDerWaalsContact OD1-N 3.15Å; D250-T253 PolarHBondContact OD1-N 3Å; D250-G254 PolarHBondContact OD1-N 3.42Å
251	G	53.8	Low	45	Very low	91 Å²	91	121.9 Å²	121.9	94%	0.938	70%	0.702	S	S	*	*	S	Bend	trans	-100.7	5.7	-174.9	0	0	0	0	0	115.3
252	E	55.3	Low	45.2	Very low	188 Å²	188	117.2 Å²	117.2	88%	0.879	68%	0.683	S	S	*	*	S	Bend	trans	-126.8	-27.3	-169.8	-165.8	166	-168.7	0	0	113.9	D250	D250-E252 PolarHBondContact OD1-N 3.34Å; D250-E252 VanDerWaalsContact OD1-N 3.15Å
253	T	58	Low	46.3	Very low	109 Å²	109	115.4 Å²	115.4	67%	0.669	67%	0.672	S	S	*	*	S	Bend	trans	-122.6	-33.6	175.3	-49.5	0	0	0	0	112.9	D250 E255	D250-T253 PolarHBondContact OD1-N 3Å; T253-E255 VanDerWaalsContact C-N 3.34Å; T253-E255 PolarHBondContact O-N 3.39Å
254	G	54.5	Low	46.8	Very low	53 Å²	53	114.6 Å²	114.6	55%	0.546	66%	0.66	S	S	.	*			trans	74.5	14.9	171.2	0	0	0	0	0	116	D250	D250-G254 PolarHBondContact OD1-N 3.42Å
255	E	50.9	Low	47.6	Very low	151 Å²	151	110.9 Å²	110.9	71%	0.706	65%	0.645	S	S	*	*			trans	-96.4	136.3	169.5	-66.3	-163.9	143.8	0	0	110.9	T253 I257	T253-E255 VanDerWaalsContact C-N 3.34Å; T253-E255 PolarHBondContact O-N 3.39Å; E255-I257 PolarHBondContact O-N 2.97Å
256	S	45.6	Very low	47.9	Very low	102 Å²	102	113.2 Å²	113.2	71%	0.713	64%	0.64	S	S	*	*			trans	-84.9	97.6	-177	59.4	0	0	0	0	111.9	P258	S256-P258 WeakPolarHBondContact O-CD 3.5Å
257	I	45.8	Very low	48.5	Very low	107 Å²	107	113.8 Å²	113.8	55%	0.549	63%	0.629	S	S	.	*			trans	-72.8	126	175.8	-58	175.2	0	0	0	110.3	E255 E261	E255-I257 PolarHBondContact O-N 2.97Å; I257-E261 HydrophobicContact CG2-CB 4.03Å
258	P	52.2	Low	49	Very low	73 Å²	73	111.1 Å²	111.1	47%	0.474	63%	0.631	S	S	.	*			trans	-71.8	141.5	173.6	-17	31.8	0	0	0	112.3	S256 Q260 E261	S256-P258 WeakPolarHBondContact O-CD 3.5Å; P258-Q260 PolarHBondContact O-N 3.46Å; P258-E261 WeakPolarHBondContact O-CB 3.48Å; P258-E261 PolarHBondContact O-N 3.35Å
259	E	43.7	Very low	49.3	Very low	149 Å²	149	109.6 Å²	109.6	70%	0.696	62%	0.62	S	S	*	*	H	α-helix	trans	-54.4	-27.1	179.9	-61	177	129.9	0	0	113.6	E261 C262 L263	E259-E261 PolarHBondContact O-N 2.89Å; E259-E261 VanDerWaalsContact O-N 3.15Å; E259-C262 PolarHBondContact O-N 2.96Å; E259-L263 PolarHBondContact O-N 3.38Å; E259-L263 VanDerWaalsContact O-N 3.17Å
260	Q	47.3	Very low	49.1	Very low	151 Å²	151	111.8 Å²	111.8	71%	0.706	62%	0.621	S	S	*	*	H	α-helix	trans	-66.4	-5.1	175.2	-63.5	-178.5	-9.4	0	0	114.5	P258 R264	P258-Q260 PolarHBondContact O-N 3.46Å; Q260-R264 PolarHBondContact O-NE 3.49Å; Q260-R264 VanDerWaalsContact O-NE 3.14Å; Q260-R264 PolarHBondContact O-NH2 3.06Å
261	E	48.9	Very low	48.8	Very low	82 Å²	82	113.6 Å²	113.6	38%	0.383	64%	0.637	S	S	.	*	H	α-helix	trans	-98.1	-42.1	172	-165	124.2	-105.1	0	0	111.5	I257 P258 E259 L263 R264 L265	I257-E261 HydrophobicContact CG2-CB 4.03Å; P258-E261 WeakPolarHBondContact O-CB 3.48Å; P258-E261 PolarHBondContact O-N 3.35Å; E259-E261 PolarHBondContact O-N 2.89Å; E259-E261 VanDerWaalsContact O-N 3.15Å; E261-L263 VanDerWaalsContact C-N 3.33Å; E261-L263 PolarHBondContact O-N 3.26Å; E261-R264 WeakPolarHBondContact O-CB 3.42Å; E261-R264 PolarHBondContact O-N 3.07Å; E261-R264 VanDerWaalsContact O-N 3.11Å; E261-R264 IonicContact OE1-CZ 2.68Å; E261-R264 IonicContact OE1-NH1 2.77Å; E261-R264 PolarHBondContact OE1-NH1 3.19Å; E261-R264 IonicContact OE1-NH2 3.55Å; E261-R264 PolarHBondContact OE1-NH2 3.37Å; E261-L265 WeakPolarHBondContact O-CG 3.44Å; E261-L265 PolarHBondContact O-N 3.34Å
262	C	45.8	Very low	47.9	Very low	66 Å²	66	118.8 Å²	118.8	45%	0.446	63%	0.634	S	S	.	*	H	α-helix	trans	-58.4	-44.7	173.7	-60	0	0	0	0	111.6	E259 R264 L265 L266	E259-C262 PolarHBondContact O-N 2.96Å; C262-R264 VanDerWaalsContact C-N 3.32Å; C262-R264 PolarHBondContact O-N 3.09Å; C262-L265 PolarHBondContact O-N 3.07Å; C262-L266 VanDerWaalsContact O-CD1 3.22Å; C262-L266 WeakPolarHBondContact O-CD1 3.31Å; C262-L266 PolarHBondContact O-N 3.49Å; C262-L266 VanDerWaalsContact O-N 3.15Å
263	L	51.7	Low	46.8	Very low	118 Å²	118	113.6 Å²	113.6	62%	0.618	63%	0.631	S	S	*	*	H	α-helix	trans	-61.8	-39.2	175.2	-67.6	173.1	0	0	0	112.1	E259 E261 L265 L266 E267	E259-L263 PolarHBondContact O-N 3.38Å; E259-L263 VanDerWaalsContact O-N 3.17Å; E261-L263 VanDerWaalsContact C-N 3.33Å; E261-L263 PolarHBondContact O-N 3.26Å; L263-L265 VanDerWaalsContact C-N 3.32Å; L263-L265 PolarHBondContact O-N 3.42Å; L263-L266 PolarHBondContact O-N 3.2Å; L263-E267 WeakPolarHBondContact O-CB 3.21Å; L263-E267 PolarHBondContact O-N 3.38Å
264	R	55.4	Low	45.6	Very low	127 Å²	127	117.5 Å²	117.5	48%	0.479	64%	0.642	S	S	.	*	H	α-helix	trans	-66.2	-31.9	177.6	-128.2	-176.4	-54.3	131.5	11.4	112.7	Q260 E261 C262 A268	Q260-R264 PolarHBondContact O-NE 3.49Å; Q260-R264 VanDerWaalsContact O-NE 3.14Å; Q260-R264 PolarHBondContact O-NH2 3.06Å; E261-R264 WeakPolarHBondContact O-CB 3.42Å; E261-R264 PolarHBondContact O-N 3.07Å; E261-R264 VanDerWaalsContact O-N 3.11Å; E261-R264 IonicContact OE1-CZ 2.68Å; E261-R264 IonicContact OE1-NH1 2.77Å; E261-R264 PolarHBondContact OE1-NH1 3.19Å; E261-R264 IonicContact OE1-NH2 3.55Å; E261-R264 PolarHBondContact OE1-NH2 3.37Å; C262-R264 VanDerWaalsContact C-N 3.32Å; C262-R264 PolarHBondContact O-N 3.09Å; R264-A268 WeakPolarHBondContact O-CB 3.26Å; R264-A268 PolarHBondContact O-N 3.37Å
265	L	49.5	Very low	44.5	Very low	115 Å²	115	123.8 Å²	123.8	60%	0.602	66%	0.657	S	S	*	*	H	α-helix	trans	-74.1	-35.9	175.5	-71.7	168.3	0	0	0	112.1	E261 C262 L263 T269	E261-L265 WeakPolarHBondContact O-CG 3.44Å; E261-L265 PolarHBondContact O-N 3.34Å; C262-L265 PolarHBondContact O-N 3.07Å; L263-L265 VanDerWaalsContact C-N 3.32Å; L263-L265 PolarHBondContact O-N 3.42Å; L265-T269 PolarHBondContact O-N 3.17Å; L265-T269 PolarHBondContact O-OG1 2.92Å
266	L	45.4	Very low	43.6	Very low	122 Å²	122	120.5 Å²	120.5	64%	0.639	66%	0.656	S	S	*	*	H	α-helix	trans	-64.7	-47.2	169.2	-88.3	83.6	0	0	0	111.1	C262 L263 T269 F270	C262-L266 VanDerWaalsContact O-CD1 3.22Å; C262-L266 WeakPolarHBondContact O-CD1 3.31Å; C262-L266 PolarHBondContact O-N 3.49Å; C262-L266 VanDerWaalsContact O-N 3.15Å; L263-L266 PolarHBondContact O-N 3.2Å; L266-T269 WeakPolarHBondContact O-CB 3.47Å; L266-T269 PolarHBondContact O-N 3.2Å; L266-F270 PolarHBondContact O-N 3.25Å; L266-F270 VanDerWaalsContact O-N 3.16Å
267	E	46.4	Very low	42.7	Very low	132 Å²	132	125 Å²	125	62%	0.617	67%	0.665	S	S	*	*	H	α-helix	trans	-61.3	-43.7	179.6	-175.4	174.1	-144.2	0	0	112.4	L263 T269 F270	L263-E267 WeakPolarHBondContact O-CB 3.21Å; L263-E267 PolarHBondContact O-N 3.38Å; E267-T269 PolarHBondContact O-N 3.37Å; E267-F270 CarbonylContact O-C 3.57Å; E267-F270 VanDerWaalsContact O-C 3.22Å; E267-F270 PolarHBondContact O-N 3.09Å; E267-F270 VanDerWaalsContact O-N 3.13Å
268	A	50.3	Low	41.9	Very low	84 Å²	84	128.6 Å²	128.6	69%	0.694	68%	0.677	S	S	*	*	H	α-helix	trans	-64.4	-17.3	173.8	0	0	0	0	0	113.9	R264	R264-A268 WeakPolarHBondContact O-CB 3.26Å; R264-A268 PolarHBondContact O-N 3.37Å
269	T	48.3	Very low	40.9	Very low	96 Å²	96	131.2 Å²	131.2	59%	0.589	69%	0.694	S	S	*	*	H	α-helix	trans	-89.4	-26.3	175.3	-52.8	0	0	0	0	112	L265 L266 E267	L265-T269 PolarHBondContact O-N 3.17Å; L265-T269 PolarHBondContact O-OG1 2.92Å; L266-T269 WeakPolarHBondContact O-CB 3.47Å; L266-T269 PolarHBondContact O-N 3.2Å; E267-T269 PolarHBondContact O-N 3.37Å
270	F	40.3	Very low	40.1	Very low	152 Å²	152	129.7 Å²	129.7	67%	0.667	70%	0.695	S	S	*	*	S	Bend	trans	-139.9	85.4	-178.6	-68.4	-79.3	0	0	0	112	L266 E267 F272	L266-F270 PolarHBondContact O-N 3.25Å; L266-F270 VanDerWaalsContact O-N 3.16Å; E267-F270 CarbonylContact O-C 3.57Å; E267-F270 VanDerWaalsContact O-C 3.22Å; E267-F270 PolarHBondContact O-N 3.09Å; E267-F270 VanDerWaalsContact O-N 3.13Å; F270-F272 PolarHBondContact O-N 3.03Å
271	P	36	Very low	39.5	Very low	118 Å²	118	127.7 Å²	127.7	77%	0.766	70%	0.695	S	S	*	*			trans	-71.4	114.3	-179.5	28.1	-34.2	0	0	0	111.7
272	F	33.8	Very low	38.4	Very low	199 Å²	199	130.7 Å²	130.7	87%	0.873	72%	0.719	S	S	*	*			trans	-82.7	141.3	161.3	-80	-94.5	0	0	0	109.8	F270	F270-F272 PolarHBondContact O-N 3.03Å
273	G	32.3	Very low	37.3	Very low	79 Å²	79	131.1 Å²	131.1	81%	0.814	73%	0.734	S	S	*	*			trans	-88.2	127.1	175.6	0	0	0	0	0	111.8
274	E	34.3	Very low	36.1	Very low	192 Å²	192	132.1 Å²	132.1	90%	0.897	74%	0.74	S	S	*	*			trans	-85.6	-163.2	168.3	-105	-163.9	132.7	0	0	112.1
275	E	31.5	Very low	34.7	Very low	184 Å²	184	133 Å²	133	86%	0.86	75%	0.75	S	S	*	*			trans	84.3	124.7	-175.8	-46	-62.1	176.9	0	0	115.5
276	A	31.2	Very low	33.6	Very low	83 Å²	83	135 Å²	135	69%	0.686	76%	0.756	S	S	*	*			cis	-160.4	155.7	-11.5	0	0	0	0	0	112.3
277	E	26.6	Very low	32.7	Very low	195 Å²	195	133.3 Å²	133.3	91%	0.911	76%	0.76	S	S	*	*			trans	26.1	140	148.7	-146.7	166.6	-169.3	0	0	123.8
278	F	28.5	Very low	31.6	Very low	183 Å²	183	132 Å²	132	80%	0.803	77%	0.765	S	S	*	*			trans	-73.2	154.8	174.1	-91.5	-89.6	0	0	0	113.7	V280	F278-V280 HydrophobicContact CD1-CG2 4.32Å
279	P	30.7	Very low	30.4	Very low	128 Å²	128	135.4 Å²	135.4	83%	0.831	77%	0.77	S	S	*	*				-148.6	162.7	98.4	37.1	-19.6	0	0	0	117.4
280	V	27.3	Very low	29.2	Very low	117 Å²	117	135.6 Å²	135.6	71%	0.709	78%	0.775	S	S	*	*			trans	-110.2	140.8	173.1	166.5	0	0	0	0	107	F278	F278-V280 HydrophobicContact CD1-CG2 4.32Å
281	P	36.2	Very low	28.4	Very low	109 Å²	109	135.2 Å²	135.2	71%	0.708	78%	0.78	S	S	*	*				-167.4	173.2	93.8	46.1	-24.2	0	0	0	121.4
282	V	24.2	Very low	28	Very low	146 Å²	146	137.6 Å²	137.6	89%	0.885	78%	0.781	S	S	*	*			trans	68.6	134.5	158.3	-163.5	0	0	0	0	120.5
283	G	24.5	Very low	27.6	Very low	74 Å²	74	136.4 Å²	136.4	76%	0.763	78%	0.778	S	S	*	*			trans	166.7	93.5	157.5	0	0	0	0	0	116.7
284	N	24.7	Very low	27.4	Very low	139 Å²	139	138.5 Å²	138.5	74%	0.743	78%	0.775	S	S	*	*			trans	-80.2	156.8	179.4	-87.1	11.9	0	0	0	115.4
285	Q	27.8	Very low	27.7	Very low	147 Å²	147	134.4 Å²	134.4	69%	0.687	77%	0.765	S	S	*	*			trans	66.3	159.6	143.8	-72.9	165.6	-68.3	0	0	117.7
286	E	24.6	Very low	27.4	Very low	156 Å²	156	130.4 Å²	130.4	73%	0.729	76%	0.757	S	S	*	*			cis	-158.5	155.4	-4.4	-132.3	162.1	-148.3	0	0	112.5
287	A	26.7	Very low	27.1	Very low	87 Å²	87	132.5 Å²	132.5	72%	0.719	76%	0.762	S	S	*	*			trans	58.5	173.5	153.1	0	0	0	0	0	118.5
288	S	23.5	Very low	27.3	Very low	105 Å²	105	128.2 Å²	128.2	73%	0.734	75%	0.753	S	S	*	*			cis	-147.8	151.4	4.3	-40.6	0	0	0	0	112.9
289	I	25.5	Very low	27.3	Very low	154 Å²	154	129 Å²	129	79%	0.79	76%	0.759	S	S	*	*			trans	-14.6	142.4	149.8	48.6	167.4	0	0	0	117.5
290	S	22.7	Very low	27.1	Very low	100 Å²	100	126.5 Å²	126.5	70%	0.699	76%	0.757	S	S	*	*				158.9	165.4	72.6	34.4	0	0	0	0	108.1
291	N	24.1	Very low	27.1	Very low	145 Å²	145	129.6 Å²	129.6	78%	0.775	77%	0.769	S	S	*	*			cis	-159.2	-168	-4.5	-111.7	22.6	0	0	0	110.7
292	E	27	Very low	26.6	Very low	167 Å²	167	128.7 Å²	128.7	78%	0.78	77%	0.77	S	S	*	*			trans	-57	179.9	177.1	-51.8	174.5	106.2	0	0	115
293	E	26.6	Very low	26.6	Very low	174 Å²	174	130.1 Å²	130.1	81%	0.813	77%	0.772	S	S	*	*			cis	-158.1	-147.4	25.1	-150.7	-173.6	147	0	0	113.6
294	V	27.8	Very low	27	Very low	124 Å²	124	130.8 Å²	130.8	75%	0.752	77%	0.771	S	S	*	*			trans	-156.8	171.2	-151.3	136.9	0	0	0	0	109.1
295	P	39.2	Very low	27.3	Very low	105 Å²	105	129.2 Å²	129.2	68%	0.682	77%	0.768	S	S	*	*			cis	-139.7	177.9	13.1	40.1	-18.8	0	0	0	119.9
296	S	25.7	Very low	27.1	Very low	101 Å²	101	131 Å²	131	71%	0.706	78%	0.776	S	S	*	*			trans	76.2	139	133	-81.8	0	0	0	0	128.1
297	T	26	Very low	27.3	Very low	126 Å²	126	131.5 Å²	131.5	77%	0.773	78%	0.781	S	S	*	*			trans	67	127.7	141.7	54.8	0	0	0	0	121.5
298	S	30.7	Very low	27.7	Very low	105 Å²	105	132.5 Å²	132.5	73%	0.734	78%	0.78	S	S	*	*				-178.1	143.9	74.7	-68.4	0	0	0	0	116.1
299	Q	28.9	Very low	28.3	Very low	199 Å²	199	133.4 Å²	133.4	93%	0.93	78%	0.783	S	S	*	*			trans	30.7	137.3	140.4	-53.3	-179.7	8.8	0	0	123.7
300	G	26.6	Very low	29.2	Very low	77 Å²	77	130.5 Å²	130.5	79%	0.794	78%	0.783	S	S	*	*			trans	-170.2	156.2	164.5	0	0	0	0	0	112.8
301	L	25.5	Very low	29.5	Very low	181 Å²	181	134.8 Å²	134.8	95%	0.948	79%	0.791	S	S	*	*			trans	-124.1	146.4	-168.1	-90.6	167.2	0	0	0	116.3
302	A	25.9	Very low	30.4	Very low	90 Å²	90	133.2 Å²	133.2	74%	0.744	79%	0.789	S	S	*	*			trans	-2.9	140.5	162.3	0	0	0	0	0	122.6
303	L	25.3	Very low	30.9	Very low	176 Å²	176	134.2 Å²	134.2	92%	0.921	79%	0.794	S	S	*	*			trans	-155.4	160.3	136.6	-142.3	75.3	0	0	0	111.5
304	A	31.8	Very low	31.5	Very low	88 Å²	88	134.2 Å²	134.2	73%	0.727	80%	0.799	S	S	*	*			trans	-135.6	148.2	169.7	0	0	0	0	0	109.9
305	P	32.4	Very low	32.7	Very low	106 Å²	106	133.6 Å²	133.6	69%	0.688	79%	0.791	S	S	*	*			trans	-149.2	146.1	141.2	36.3	-19.1	0	0	0	117
306	Q	22.9	Very low	33.3	Very low	184 Å²	184	133.8 Å²	133.8	86%	0.86	79%	0.785	S	S	*	*			trans	62.5	119.1	135.5	-68.2	178.1	61.1	0	0	123
307	M	28.3	Very low	35.1	Very low	167 Å²	167	134 Å²	134	82%	0.823	78%	0.775	S	S	*	*			trans	-63.8	157	134.1	-72.3	-87.7	-74.1	0	0	109.8
308	P	35.9	Very low	36.4	Very low	108 Å²	108	133 Å²	133	70%	0.701	76%	0.762	S	S	*	*			cis	-143.4	-152.9	39.7	45.8	-25.8	0	0	0	112
309	P	36.6	Very low	37.8	Very low	124 Å²	124	133.7 Å²	133.7	81%	0.805	75%	0.754	S	S	*	*			cis	-121.3	-163.3	-15.2	42.2	-25.8	0	0	0	112.8
310	A	42.8	Very low	39.1	Very low	94 Å²	94	130.7 Å²	130.7	78%	0.777	73%	0.734	S	S	*	*			trans	-120.3	134	179.1	0	0	0	0	0	112.7
311	E	29.5	Very low	40.4	Very low	189 Å²	189	131.8 Å²	131.8	88%	0.883	72%	0.718	S	S	*	*			trans	-165.3	164.1	158.2	-81.3	-152.8	161.8	0	0	108
312	P	43.4	Very low	41.7	Very low	112 Å²	112	127.7 Å²	127.7	73%	0.727	70%	0.697	S	S	*	*			cis	-119	179.6	-35.1	37.4	-24.5	0	0	0	111
313	Q	36.7	Very low	43.4	Very low	189 Å²	189	126.7 Å²	126.7	88%	0.883	68%	0.679	S	S	*	*			trans	-70.9	135.3	164.2	-73	-178.5	-105.3	0	0	110	D315	Q313-D315 PolarHBondContact O-N 3.25Å
314	L	39.8	Very low	44.6	Very low	174 Å²	174	123 Å²	123	91%	0.911	66%	0.658	S	S	*	*			trans	-65	129.2	166.7	-82.7	155.8	0	0	0	109.3	L316	L314-L316 PolarHBondContact O-N 2.58Å
315	D	52.4	Low	45.8	Very low	110 Å²	110	121.1 Å²	121.1	59%	0.588	64%	0.643	S	S	*	*			trans	-75.6	115.7	-178.6	-170.2	-1.6	0	0	0	110.6	Q313 E317 Q318	Q313-D315 PolarHBondContact O-N 3.25Å; D315-E317 PolarHBondContact O-N 3.46Å; D315-E317 WeakPolarHBondContact OD1-CB 3.27Å; D315-E317 PolarHBondContact OD1-N 3.24Å; D315-Q318 PolarHBondContact O-N 3.06Å
316	L	51.8	Low	46.6	Very low	109 Å²	109	121.8 Å²	121.8	57%	0.571	64%	0.639	S	S	*	*	H	α-helix	trans	-65.9	-28.9	-178.8	-170.7	64.6	0	0	0	111.6	L314 Q319 W320	L314-L316 PolarHBondContact O-N 2.58Å; L316-Q319 PolarHBondContact O-N 3.39Å; L316-W320 PolarHBondContact O-N 3.37Å; L316-W320 VanDerWaalsContact O-N 3.11Å
317	E	63.4	Low	47.8	Very low	106 Å²	106	118.9 Å²	118.9	50%	0.495	63%	0.627	S	S	.	*	H	α-helix	trans	-62.8	-43.7	177.5	-179.8	61.3	-154.4	0	0	111.2	D315 Q319 W320 Q321	D315-E317 PolarHBondContact O-N 3.46Å; D315-E317 WeakPolarHBondContact OD1-CB 3.27Å; D315-E317 PolarHBondContact OD1-N 3.24Å; E317-Q319 VanDerWaalsContact C-N 3.31Å; E317-Q319 PolarHBondContact O-N 2.88Å; E317-W320 PolarHBondContact O-N 2.96Å; E317-W320 VanDerWaalsContact O-N 3.16Å; E317-Q321 WeakPolarHBondContact O-CG 3.04Å; E317-Q321 PolarHBondContact O-N 3.19Å; E317-Q321 PolarHBondContact OE1-NE2 2.85Å
318	Q	54.9	Low	48.6	Very low	105 Å²	105	118.3 Å²	118.3	49%	0.491	62%	0.622	S	S	.	*	H	α-helix	trans	-63.4	-38.5	178.7	-172.1	61.8	72.1	0	0	111.7	D315 W320 Q321 D322	D315-Q318 PolarHBondContact O-N 3.06Å; Q318-W320 VanDerWaalsContact C-N 3.35Å; Q318-Q321 PolarHBondContact O-N 3.43Å; Q318-D322 PolarHBondContact NE2-OD1 2.91Å; Q318-D322 PolarHBondContact O-N 3.48Å
319	Q	59.8	Low	49	Very low	120 Å²	120	120.1 Å²	120.1	56%	0.561	63%	0.625	S	S	*	*	H	α-helix	trans	-67.2	-34.7	176.1	-171.8	176.4	-24.3	0	0	112.1	L316 E317 I323	L316-Q319 PolarHBondContact O-N 3.39Å; E317-Q319 VanDerWaalsContact C-N 3.31Å; E317-Q319 PolarHBondContact O-N 2.88Å; Q319-I323 HydrophobicContact CG-CD1 4.38Å; Q319-I323 WeakPolarHBondContact O-CD1 3.37Å; Q319-I323 VanDerWaalsContact O-CG1 3.25Å; Q319-I323 WeakPolarHBondContact O-CG1 3.42Å; Q319-I323 PolarHBondContact O-N 2.89Å
320	W	54.8	Low	49.3	Very low	136 Å²	136	122.7 Å²	122.7	52%	0.515	63%	0.626	S	S	.	*	H	α-helix	trans	-71	-35.9	172.5	-74.7	116.4	0	0	0	112.8	L316 E317 Q318 I323 M324	L316-W320 PolarHBondContact O-N 3.37Å; L316-W320 VanDerWaalsContact O-N 3.11Å; E317-W320 PolarHBondContact O-N 2.96Å; E317-W320 VanDerWaalsContact O-N 3.16Å; Q318-W320 VanDerWaalsContact C-N 3.35Å; W320-I323 HydrophobicContact CE3-CD1 3.98Å; W320-I323 HydrophobicContact CE3-CG2 4.43Å; W320-I323 HydrophobicContact CZ3-CD1 4.14Å; W320-I323 PolarHBondContact O-N 3.14Å; W320-M324 WeakPolarHBondContact O-CG 3.23Å; W320-M324 PolarHBondContact O-N 3.02Å
321	Q	54.4	Low	49.3	Very low	100 Å²	100	121.9 Å²	121.9	47%	0.467	62%	0.62	S	S	.	*	H	α-helix	trans	-66.1	-40	175.2	-70.5	-176.9	21.3	0	0	112.1	E317 Q318 I323 M324 A325	E317-Q321 WeakPolarHBondContact O-CG 3.04Å; E317-Q321 PolarHBondContact O-N 3.19Å; E317-Q321 PolarHBondContact OE1-NE2 2.85Å; Q318-Q321 PolarHBondContact O-N 3.43Å; Q321-I323 VanDerWaalsContact C-N 3.34Å; Q321-I323 PolarHBondContact O-N 3.35Å; Q321-M324 PolarHBondContact O-N 2.91Å; Q321-A325 WeakPolarHBondContact O-CB 3.47Å; Q321-A325 PolarHBondContact O-N 3.01Å
322	D	53.7	Low	49.5	Very low	94 Å²	94	120.9 Å²	120.9	50%	0.503	62%	0.618	S	S	.	*	H	α-helix	trans	-61.5	-41	172.6	-75	9.2	0	0	0	111.7	Q318 M324 A325 I326	Q318-D322 PolarHBondContact NE2-OD1 2.91Å; Q318-D322 PolarHBondContact O-N 3.48Å; D322-M324 VanDerWaalsContact C-N 3.35Å; D322-M324 PolarHBondContact O-N 3.32Å; D322-A325 PolarHBondContact O-N 3.44Å; D322-I326 WeakPolarHBondContact O-CG1 3.45Å; D322-I326 PolarHBondContact O-N 3.49Å; D322-I326 VanDerWaalsContact O-N 3.09Å
323	I	61.4	Low	49.1	Very low	69 Å²	69	122 Å²	122	35%	0.354	62%	0.618	S	S	.	*	H	α-helix	trans	-64.3	-37.1	176	-69.9	165.6	0	0	0	111.7	Q319 W320 Q321	Q319-I323 HydrophobicContact CG-CD1 4.38Å; Q319-I323 WeakPolarHBondContact O-CD1 3.37Å; Q319-I323 VanDerWaalsContact O-CG1 3.25Å; Q319-I323 WeakPolarHBondContact O-CG1 3.42Å; Q319-I323 PolarHBondContact O-N 2.89Å; W320-I323 HydrophobicContact CE3-CD1 3.98Å; W320-I323 HydrophobicContact CE3-CG2 4.43Å; W320-I323 HydrophobicContact CZ3-CD1 4.14Å; W320-I323 PolarHBondContact O-N 3.14Å; Q321-I323 VanDerWaalsContact C-N 3.34Å; Q321-I323 PolarHBondContact O-N 3.35Å
324	M	50.6	Low	48.9	Very low	99 Å²	99	122.1 Å²	122.1	49%	0.488	62%	0.62	S	S	.	*	H	α-helix	trans	-70.2	-40.7	174.3	-67.6	-63.8	96.1	0	0	112.4	W320 Q321 D322 I326 M327 E328	W320-M324 WeakPolarHBondContact O-CG 3.23Å; W320-M324 PolarHBondContact O-N 3.02Å; Q321-M324 PolarHBondContact O-N 2.91Å; D322-M324 VanDerWaalsContact C-N 3.35Å; D322-M324 PolarHBondContact O-N 3.32Å; M324-I326 VanDerWaalsContact C-N 3.31Å; M324-I326 PolarHBondContact O-N 3.3Å; M324-M327 HydrophobicContact CE-CE 4.08Å; M324-M327 PolarHBondContact O-N 2.97Å; M324-M327 HydrophobicContact SD-CE 4.16Å; M324-E328 PolarHBondContact O-N 3.23Å
325	A	55.5	Low	48.6	Very low	49 Å²	49	120.5 Å²	120.5	41%	0.405	61%	0.613	S	S	.	*	H	α-helix	trans	-62.7	-35.7	178.1	0	0	0	0	0	112.8	Q321 D322 M327 E328 L329	Q321-A325 WeakPolarHBondContact O-CB 3.47Å; Q321-A325 PolarHBondContact O-N 3.01Å; D322-A325 PolarHBondContact O-N 3.44Å; A325-M327 VanDerWaalsContact C-N 3.27Å; A325-M327 PolarHBondContact O-N 2.95Å; A325-E328 PolarHBondContact O-N 3.33Å; A325-L329 PolarHBondContact O-N 3.42Å
326	I	50.1	Low	47.3	Very low	119 Å²	119	121.3 Å²	121.3	61%	0.61	62%	0.617	S	S	*	*	H	α-helix	trans	-62.2	-35.3	172.8	-69.8	164.2	0	0	0	111.4	D322 M324	D322-I326 WeakPolarHBondContact O-CG1 3.45Å; D322-I326 PolarHBondContact O-N 3.49Å; D322-I326 VanDerWaalsContact O-N 3.09Å; M324-I326 VanDerWaalsContact C-N 3.31Å; M324-I326 PolarHBondContact O-N 3.3Å
327	M	47.8	Very low	46.2	Very low	124 Å²	124	121.9 Å²	121.9	61%	0.611	63%	0.63	S	S	*	*	H	α-helix	trans	-79.9	-30.5	-178.7	-159.7	169.6	66.7	0	0	112.7	M324 A325 L329 Q330	M324-M327 HydrophobicContact CE-CE 4.08Å; M324-M327 PolarHBondContact O-N 2.97Å; M324-M327 HydrophobicContact SD-CE 4.16Å; A325-M327 VanDerWaalsContact C-N 3.27Å; A325-M327 PolarHBondContact O-N 2.95Å; M327-L329 VanDerWaalsContact C-N 3.3Å; M327-L329 PolarHBondContact O-N 2.93Å; M327-Q330 PolarHBondContact O-N 2.98Å
328	E	46.6	Very low	44.5	Very low	155 Å²	155	122.7 Å²	122.7	72%	0.724	64%	0.642	S	S	*	*	H	α-helix	trans	-68.5	-28.5	175.5	-166.3	166.5	-150.5	0	0	112.5	M324 A325 Q330 A331	M324-E328 PolarHBondContact O-N 3.23Å; A325-E328 PolarHBondContact O-N 3.33Å; E328-Q330 PolarHBondContact O-N 3.27Å; E328-Q330 VanDerWaalsContact O-N 3.14Å; E328-A331 WeakPolarHBondContact O-CB 3.49Å; E328-A331 PolarHBondContact O-N 2.91Å; E328-A331 VanDerWaalsContact O-N 3.11Å
329	L	42.8	Very low	43.2	Very low	146 Å²	146	123.3 Å²	123.3	76%	0.764	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-7	176.3	-84.7	164	0	0	0	115.3	A325 M327	A325-L329 PolarHBondContact O-N 3.42Å; M327-L329 VanDerWaalsContact C-N 3.3Å; M327-L329 PolarHBondContact O-N 2.93Å
330	Q	44	Very low	41.7	Very low	177 Å²	177	125.2 Å²	125.2	83%	0.827	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	9	171.2	-69	-168.5	-44.8	0	0	113.7	M327 E328	M327-Q330 PolarHBondContact O-N 2.98Å; E328-Q330 PolarHBondContact O-N 3.27Å; E328-Q330 VanDerWaalsContact O-N 3.14Å
331	A	41.2	Very low	40.3	Very low	78 Å²	78	124.4 Å²	124.4	65%	0.645	69%	0.687	S	S	*	*	S	Bend	trans	-111.1	0.2	-171.2	0	0	0	0	0	117	E328	E328-A331 WeakPolarHBondContact O-CB 3.49Å; E328-A331 PolarHBondContact O-N 2.91Å; E328-A331 VanDerWaalsContact O-N 3.11Å
332	M	34.5	Very low	39	Very low	168 Å²	168	123 Å²	123	83%	0.828	70%	0.7	S	S	*	*			trans	-145.4	147	162.9	-66.8	-164.7	-178.4	0	0	108
333	D	34.4	Very low	37.8	Very low	136 Å²	136	126.5 Å²	126.5	73%	0.727	72%	0.719	S	S	*	*			cis	-130	132	24.9	-93.6	-55.6	0	0	0	114.5
334	M	33.7	Very low	36.2	Very low	191 Å²	191	128.3 Å²	128.3	94%	0.941	74%	0.743	S	S	*	*			trans	-147	73.9	143.7	-80.5	-156	79.7	0	0	109	N336	M334-N336 PolarHBondContact O-N 3.2Å
335	N	32.2	Very low	35.3	Very low	140 Å²	140	129.2 Å²	129.2	75%	0.749	76%	0.76	S	S	*	*			trans	-71.6	93.7	-178.8	-169.8	13.4	0	0	0	112.5
336	N	26.7	Very low	34.1	Very low	126 Å²	126	133.1 Å²	133.1	67%	0.674	78%	0.784	S	S	*	*			trans	13.4	117.6	145.9	-174.4	18.8	0	0	0	117.5	M334	M334-N336 PolarHBondContact O-N 3.2Å
337	S	28.6	Very low	33.1	Very low	121 Å²	121	130.3 Å²	130.3	85%	0.846	79%	0.785	S	S	*	*			trans	-147.9	49.7	167.1	-78.1	0	0	0	0	113.3
338	T	26.5	Very low	32.2	Very low	123 Å²	123	131.4 Å²	131.4	76%	0.755	80%	0.798	S	S	*	*			trans	-129.2	104.5	164	-50.1	0	0	0	0	110.5
339	S	28.1	Very low	31.4	Very low	118 Å²	118	129.2 Å²	129.2	83%	0.825	81%	0.807	S	S	*	*			trans	-69.6	130.5	170.3	46.3	0	0	0	0	110.4
340	N	27.2	Very low	30.7	Very low	161 Å²	161	130.9 Å²	130.9	86%	0.861	81%	0.811	S	S	*	*			trans	-117.9	91.2	169.9	-163.1	22.3	0	0	0	109.7
341	S	26.8	Very low	31.2	Very low	119 Å²	119	126.7 Å²	126.7	83%	0.832	80%	0.799	S	S	*	*			trans	-104.7	109.1	172.5	-171.7	0	0	0	0	108.7
342	G	26.6	Very low	30.6	Very low	71 Å²	71	129.4 Å²	129.4	73%	0.732	81%	0.807	S	S	*	*			trans	-136.3	51.9	-168.9	0	0	0	0	0	112.8
343	N	27.6	Very low	30.4	Very low	167 Å²	167	125.6 Å²	125.6	89%	0.893	80%	0.803	S	S	*	*			trans	-137.4	90	180	-140.1	15.8	0	0	0	111.1
344	A	28.4	Very low	30.1	Very low	106 Å²	106	124.2 Å²	124.2	88%	0.876	81%	0.81	S	S	*	*			trans	-150.2	119.6	171.1	0	0	0	0	0	110.4
345	S	32.3	Very low	29.9	Very low	119 Å²	119	118.2 Å²	118.2	83%	0.832	80%	0.798	S	S	*	*			trans	-93.2	159.5	167.8	54.1	0	0	0	0	110.6
346	S	30.4	Very low	29.7	Very low	130 Å²	130	117.1 Å²	117.1	91%	0.909	80%	0.796	S	S	*	*			trans	85.4	136.2	172.2	-163.3	0	0	0	0	118.3
347	G	27.7	Very low	29.8	Very low	61 Å²	61	121 Å²	121	63%	0.629	81%	0.807	S	S	*	*			trans	120.5	81	143.4	0	0	0	0	0	119.2
348	T	28.9	Very low	29.8	Very low	146 Å²	146	118.6 Å²	118.6	90%	0.896	80%	0.802	S	S	*	*			trans	20.3	119.4	137.8	53.7	0	0	0	0	121
349	A	30.2	Very low	29.9	Very low	109 Å²	109	121.1 Å²	121.1	90%	0.901	81%	0.81	S	S	*	*				177.5	156.9	122.1	0	0	0	0	0	113.5
350	E	28.5	Very low	29.8	Very low	182 Å²	182	120.8 Å²	120.8	85%	0.85	81%	0.808	S	S	*	*			trans	-118.8	177.3	173.2	-111	-156.1	-177.1	0	0	109.4
351	P	54.2	Low	29.9	Very low	89 Å²	89	122 Å²	122	58%	0.578	81%	0.808	S	S	*	*			cis	-136.4	-153.4	-26.7	32.1	-9.2	0	0	0	112.4
352	T	29.3	Very low	29.9	Very low	134 Å²	134	127.8 Å²	127.8	82%	0.822	81%	0.812	S	S	*	*			trans	82.3	148.8	163.7	73.5	0	0	0	0	119
353	A	30.3	Very low	29.9	Very low	88 Å²	88	129 Å²	129	73%	0.727	82%	0.815	S	S	*	*			cis	-168.1	150.9	-26.4	0	0	0	0	0	113.3
354	A	28.3	Very low	30.3	Very low	107 Å²	107	126.7 Å²	126.7	88%	0.884	81%	0.807	S	S	*	*			trans	67.5	141.7	151.6	0	0	0	0	0	122.7
355	G	29.4	Very low	30.6	Very low	66 Å²	66	127.2 Å²	127.2	68%	0.68	80%	0.801	S	S	*	*			trans	102	100.3	175.6	0	0	0	0	0	112.5
356	T	27.5	Very low	30.5	Very low	116 Å²	116	128.4 Å²	128.4	71%	0.712	80%	0.797	S	S	*	*			cis	63.2	113.7	35.8	-31	0	0	0	0	110.4
357	F	29.5	Very low	30.5	Very low	207 Å²	207	129.6 Å²	129.6	91%	0.908	79%	0.793	S	S	*	*			cis	-132	173.2	22.9	-52.2	-106.5	0	0	0	109.8
358	G	27.9	Very low	30.7	Very low	72 Å²	72	135.5 Å²	135.5	74%	0.742	80%	0.804	S	S	*	*			cis	-177.1	178	2.3	0	0	0	0	0	111.3
359	L	28.4	Very low	30.9	Very low	176 Å²	176	136.3 Å²	136.3	92%	0.921	80%	0.803	S	S	*	*			trans	-52.8	155.5	-177.8	-56	170.2	0	0	0	113.2
360	S	26.5	Very low	31.4	Very low	111 Å²	111	137.7 Å²	137.7	78%	0.776	80%	0.8	S	S	*	*			cis	-159.7	-167.5	45	-155	0	0	0	0	115.1
361	E	28.9	Very low	31.6	Very low	186 Å²	186	133.5 Å²	133.5	87%	0.869	79%	0.791	S	S	*	*			trans	-80.4	163.4	-161.7	-63	173.1	117.8	0	0	117
362	R	26.5	Very low	31	Very low	241 Å²	241	137.2 Å²	137.2	91%	0.909	81%	0.805	S	S	*	*			trans	-94	107.9	179.7	-179.7	-174.6	-168.8	161.2	4	110.9
363	A	27.9	Very low	31.1	Very low	96 Å²	96	138.9 Å²	138.9	79%	0.793	80%	0.803	S	S	*	*			trans	-97.3	154.7	170.9	0	0	0	0	0	112.2
364	T	35.6	Very low	31.2	Very low	118 Å²	118	143.6 Å²	143.6	72%	0.724	81%	0.81	S	S	*	*			trans	-125.3	136.5	179.3	51.4	0	0	0	0	111.9
365	P	35.4	Very low	31.4	Very low	117 Å²	117	143.8 Å²	143.8	76%	0.76	81%	0.812	S	S	*	*			trans	-107.5	145.2	141.1	34.8	-27	0	0	0	109.3
366	I	28.8	Very low	31.4	Very low	144 Å²	144	145.3 Å²	145.3	74%	0.738	81%	0.812	S	S	*	*			cis	74.6	115.4	38.3	-65	-178.5	0	0	0	113.4
367	N	30.2	Very low	31.7	Very low	155 Å²	155	148 Å²	148	83%	0.829	82%	0.821	S	S	*	*			trans	33.9	125.3	159.6	-59.2	-12.1	0	0	0	120.2
368	Q	33.5	Very low	31.9	Very low	186 Å²	186	144.2 Å²	144.2	87%	0.869	82%	0.817	S	S	*	*			trans	-149.4	137.1	150.7	-138.4	168.6	30.4	0	0	110.3
369	D	32.6	Very low	31.8	Very low	162 Å²	162	146.5 Å²	146.5	87%	0.866	82%	0.822	S	S	*	*			trans	-76.6	151.3	-177.2	-53.9	-83.5	0	0	0	112.4
370	V	40.8	Very low	31.7	Very low	139 Å²	139	143.7 Å²	143.7	84%	0.842	82%	0.816	S	S	*	*			trans	-114	109.7	-179.1	-175.7	0	0	0	0	110.1
371	S	33	Very low	31.7	Very low	94 Å²	94	143.4 Å²	143.4	66%	0.657	81%	0.813	S	S	*	*			trans	-83.5	130.9	179.1	-174.9	0	0	0	0	112.4	H373	S371-H373 PolarHBondContact O-N 3.11Å; S371-H373 VanDerWaalsContact O-N 3.09Å
372	L	41.3	Very low	31.7	Very low	166 Å²	166	142.8 Å²	142.8	87%	0.869	81%	0.811	S	S	*	*			trans	-85.4	66.9	-177.5	-85.1	169.2	0	0	0	112.8
373	H	30.7	Very low	31.7	Very low	170 Å²	170	138 Å²	138	79%	0.787	80%	0.803	S	S	*	*			trans	-126.8	43.4	-178.9	-72.7	-23.1	0	0	0	114.8	S371	S371-H373 PolarHBondContact O-N 3.11Å; S371-H373 VanDerWaalsContact O-N 3.09Å
374	Q	33.2	Very low	31.9	Very low	186 Å²	186	143.3 Å²	143.3	87%	0.869	81%	0.809	S	S	*	*			trans	-151.6	53	162.9	-134	168.1	1.9	0	0	115.2
375	A	31.1	Very low	31.5	Very low	112 Å²	112	143.1 Å²	143.1	93%	0.926	81%	0.81	S	S	*	*			trans	-99.4	84.8	167.2	0	0	0	0	0	110.5
376	S	29.8	Very low	31.3	Very low	98 Å²	98	147 Å²	147	69%	0.685	82%	0.817	S	S	*	*			trans	-136.4	130.5	177.2	57.5	0	0	0	0	111.3
377	L	33.9	Very low	31.3	Very low	172 Å²	172	146.9 Å²	146.9	90%	0.901	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-68.8	137.6	-169.6	-60.6	165.6	0	0	0	113.4
378	P	33	Very low	31.2	Very low	127 Å²	127	148.6 Å²	148.6	83%	0.825	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-69	128	157.6	-14.7	30.3	0	0	0	110.1
379	S	27.6	Very low	30.9	Very low	120 Å²	120	144.9 Å²	144.9	84%	0.839	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-79.4	151.3	173.4	-170.2	0	0	0	0	111.6
380	C	25.9	Very low	31.1	Very low	118 Å²	118	142.5 Å²	142.5	80%	0.797	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89.3	123.9	179.3	174.9	0	0	0	0	112.2
381	S	25.1	Very low	30.3	Very low	104 Å²	104	143.8 Å²	143.8	73%	0.727	80%	0.802	S	S	*	*			trans	-174.5	141.2	151.8	-82.8	0	0	0	0	111.7
382	Q	29.6	Very low	30.2	Very low	173 Å²	173	145.7 Å²	145.7	81%	0.808	80%	0.804	S	S	*	*			trans	66.2	137.7	168	-62.9	176	-12.4	0	0	116.6
383	D	27.3	Very low	29.5	Very low	141 Å²	141	144.1 Å²	144.1	75%	0.754	80%	0.797	S	S	*	*			cis	-153.9	159.3	-9.5	-102.7	-29.8	0	0	0	111.1
384	F	30.7	Very low	29.3	Very low	207 Å²	207	141 Å²	141	91%	0.908	79%	0.794	S	S	*	*			trans	-81.6	145.3	170.9	-86	-90.6	0	0	0	112.3
385	P	28.5	Very low	29	Very low	115 Å²	115	139.1 Å²	139.1	75%	0.747	80%	0.795	S	S	*	*			trans	-105.7	145.6	148.2	34.7	-28.3	0	0	0	112
386	Q	30.8	Very low	28.8	Very low	197 Å²	197	137 Å²	137	92%	0.921	78%	0.784	S	S	*	*			trans	-81.8	164.4	173.7	-70.9	-174.4	-19.6	0	0	112.6
387	I	29.1	Very low	28.8	Very low	143 Å²	143	139 Å²	139	73%	0.733	79%	0.792	S	S	*	*			trans	-99.9	142.4	180	-41.1	-179.5	0	0	0	110
388	F	27.9	Very low	28.6	Very low	190 Å²	190	135 Å²	135	83%	0.833	78%	0.784	S	S	*	*			trans	70.1	146.7	178.1	-57.8	-75	0	0	0	115
389	S	26.5	Very low	28.9	Very low	108 Å²	108	134.6 Å²	134.6	76%	0.755	78%	0.781	S	S	*	*			cis	-130.6	-141.9	9.8	-56.6	0	0	0	0	112.2
390	P	36.9	Very low	28.9	Very low	112 Å²	112	140 Å²	140	73%	0.727	78%	0.783	S	S	*	*				-128.7	171.8	-126.5	40.7	-19.9	0	0	0	118.1
391	Q	25	Very low	29	Very low	166 Å²	166	140.5 Å²	140.5	78%	0.776	78%	0.783	S	S	*	*			trans	78.8	120.8	143.7	-167.2	170.8	-15	0	0	121.2
392	L	31	Very low	29.1	Very low	134 Å²	134	139 Å²	139	70%	0.702	78%	0.784	S	S	*	*			trans	69.9	127.8	155.7	-70.6	167.7	0	0	0	122.6
393	D	26.2	Very low	28.9	Very low	134 Å²	134	139 Å²	139	72%	0.717	79%	0.786	S	S	*	*			trans	59.1	113.1	140.1	-68.3	-26.5	0	0	0	124.8
394	S	26.3	Very low	28.9	Very low	103 Å²	103	138.8 Å²	138.8	72%	0.72	78%	0.784	S	S	*	*				75	121	122.3	-68.4	0	0	0	0	123.9
395	V	27.3	Very low	28.6	Very low	147 Å²	147	139.4 Å²	139.4	89%	0.891	78%	0.781	S	S	*	*			trans	71.7	129.3	139.8	177.9	0	0	0	0	119.6
396	G	26.8	Very low	28.3	Very low	68 Å²	68	140.7 Å²	140.7	70%	0.701	78%	0.78	S	S	*	*			trans	158.5	61.6	156.2	0	0	0	0	0	122.4
397	V	29.6	Very low	27.9	Very low	140 Å²	140	137.5 Å²	137.5	85%	0.848	78%	0.78	S	S	*	*			trans	25.8	100.6	145.8	-171.2	0	0	0	0	121
398	A	30.1	Very low	27.7	Very low	89 Å²	89	136.7 Å²	136.7	74%	0.736	79%	0.787	S	S	*	*				66.3	-179.9	122.7	0	0	0	0	0	120.7
399	P	39.6	Very low	27.5	Very low	117 Å²	117	131 Å²	131	76%	0.76	78%	0.782	S	S	*	*				-136.1	173.3	-113.1	38.6	-17.9	0	0	0	117.5
400	R	27.6	Very low	27.4	Very low	233 Å²	233	133.4 Å²	133.4	88%	0.879	79%	0.786	S	S	*	*			trans	-173.3	144.1	146.9	-113.7	169.1	169.4	-174.2	-7.2	118.2
401	T	27.4	Very low	26.9	Very low	130 Å²	130	133.1 Å²	133.1	80%	0.798	79%	0.786	S	S	*	*			trans	9.2	148	145.3	55.8	0	0	0	0	122.1
402	G	27.6	Very low	27.1	Very low	73 Å²	73	131.5 Å²	131.5	75%	0.753	79%	0.788	S	S	*	*			cis	151.5	139.8	-8	0	0	0	0	0	116.8
403	M	25.3	Very low	27.1	Very low	171 Å²	171	131.8 Å²	131.8	84%	0.842	79%	0.791	S	S	*	*			trans	70.5	150	151.7	-143.8	170.8	68.8	0	0	123.2
404	L	26.9	Very low	27.3	Very low	138 Å²	138	133.7 Å²	133.7	72%	0.723	80%	0.799	S	S	*	*			trans	78	124.3	171.7	-52.5	178.6	0	0	0	116.1
405	R	24.4	Very low	27.8	Very low	220 Å²	220	136.1 Å²	136.1	83%	0.83	80%	0.804	S	S	*	*			cis	72.4	123.4	38.4	-142.7	-156.3	-172.1	174.3	2.8	110.5
406	L	23	Very low	28	Very low	142 Å²	142	134.6 Å²	134.6	74%	0.743	80%	0.799	S	S	*	*			cis	-149	164.3	30.6	-68.8	148.2	0	0	0	111.9
407	S	22	Very low	28.3	Very low	130 Å²	130	137.6 Å²	137.6	91%	0.909	81%	0.805	S	S	*	*			trans	179.4	164.4	131.6	-83.9	0	0	0	0	113.7
408	S	24.6	Very low	28.3	Very low	126 Å²	126	141 Å²	141	88%	0.881	81%	0.808	S	S	*	*			trans	-96.6	157.3	-174	-172.8	0	0	0	0	113.8
409	G	23.1	Very low	28.3	Very low	70 Å²	70	140 Å²	140	72%	0.722	81%	0.806	S	S	*	*			trans	-167.9	132.2	172.7	0	0	0	0	0	113.5
410	N	25.6	Very low	28	Very low	159 Å²	159	139.3 Å²	139.3	85%	0.85	81%	0.811	S	S	*	*			trans	-64.9	143.6	-179.5	-68.3	-20.1	0	0	0	113.1
411	S	25.4	Very low	28.3	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	80%	0.799	S	S	*	*				161.8	149.6	100.8	52.7	0	0	0	0	114.7
412	T	30.4	Very low	29.1	Very low	133 Å²	133	134.2 Å²	134.2	82%	0.816	80%	0.8	S	S	*	*			trans	23.9	115.6	151.5	55.2	0	0	0	0	120.4
413	N	29.1	Very low	29.7	Very low	140 Å²	140	135.3 Å²	135.3	75%	0.749	79%	0.788	S	S	*	*				-178	119	100.5	-172.4	-5.2	0	0	0	110.4	N415	N413-N415 PolarHBondContact OD1-N 3.16Å
414	I	31.6	Very low	30.5	Very low	173 Å²	173	132.4 Å²	132.4	89%	0.887	78%	0.78	S	S	*	*			trans	-128.6	69	171.7	46.1	167.1	0	0	0	110.4
415	N	36.2	Very low	31	Very low	155 Å²	155	128.3 Å²	128.3	83%	0.829	77%	0.771	S	S	*	*			trans	-142.7	60.2	173.3	-121.6	-7.8	0	0	0	112.2	N413	N413-N415 PolarHBondContact OD1-N 3.16Å
416	S	32.7	Very low	32	Very low	114 Å²	114	121.6 Å²	121.6	80%	0.797	75%	0.754	S	S	*	*	S	Bend	trans	177.5	102.6	151.5	-177	0	0	0	0	110
417	T	31.7	Very low	32.7	Very low	132 Å²	132	118.2 Å²	118.2	81%	0.81	73%	0.734	S	S	*	*			trans	166.8	70.8	148.4	-66.3	0	0	0	0	108.1
418	F	29.5	Very low	33.6	Very low	212 Å²	212	117 Å²	117	93%	0.93	72%	0.716	S	S	*	*			trans	-156.5	107.7	154.9	-112	-74.9	0	0	0	107.1
419	G	29.8	Very low	34	Very low	66 Å²	66	115.3 Å²	115.3	68%	0.68	70%	0.702	S	S	*	*			trans	-68.9	140.4	178.6	0	0	0	0	0	110.7	T421	G419-T421 PolarHBondContact O-N 3.36Å; G419-T421 VanDerWaalsContact O-N 3.09Å
420	A	33.2	Very low	34.3	Very low	104 Å²	104	117.2 Å²	117.2	86%	0.86	70%	0.702	S	S	*	*			trans	-63.9	111.2	-180	0	0	0	0	0	110.9
421	T	35.8	Very low	35	Very low	103 Å²	103	117.5 Å²	117.5	63%	0.632	70%	0.702	S	S	*	*			trans	-70.1	142.6	164.9	51	0	0	0	0	109.1	G419 L423	G419-T421 PolarHBondContact O-N 3.36Å; G419-T421 VanDerWaalsContact O-N 3.09Å; T421-L423 PolarHBondContact O-N 2.82Å
422	N	43.1	Very low	35.2	Very low	152 Å²	152	119.6 Å²	119.6	81%	0.813	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	36.6	-164.8	-147	-17.2	0	0	0	113.9
423	L	40.9	Very low	35.5	Very low	96 Å²	96	119.2 Å²	119.2	50%	0.503	71%	0.708	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.4	-23.6	-177.3	-61	176.6	0	0	0	112.5	T421 G425 V426 F427	T421-L423 PolarHBondContact O-N 2.82Å; L423-G425 PolarHBondContact O-N 2.92Å; L423-V426 WeakPolarHBondContact O-CA 3.31Å; L423-V426 WeakPolarHBondContact O-CB 3.49Å; L423-V426 PolarHBondContact O-N 3.39Å; L423-F427 HydrophobicContact CB-CD2 4.33Å; L423-F427 HydrophobicContact CB-CE2 3.95Å; L423-F427 WeakPolarHBondContact O-CD2 3.48Å; L423-F427 PolarHBondContact O-N 3.35Å
424	T	41.6	Very low	35.4	Very low	111 Å²	111	118.3 Å²	118.3	68%	0.681	71%	0.712	S	S	*	*	H	α-helix	trans	-58.3	-34.7	-176.9	-35.2	0	0	0	0	112.7	V426 L428	T424-V426 VanDerWaalsContact C-N 3.34Å; T424-L428 PolarHBondContact O-N 3.38Å
425	G	38.1	Very low	35.6	Very low	51 Å²	51	115.9 Å²	115.9	53%	0.526	71%	0.71	S	S	.	*	H	α-helix	trans	-78.8	-10.6	174.9	0	0	0	0	0	115.2	L423	L423-G425 PolarHBondContact O-N 2.92Å
426	V	44.8	Very low	35.3	Very low	80 Å²	80	114 Å²	114	49%	0.485	71%	0.709	S	S	.	*	H	α-helix	trans	-86.4	-30.6	172.2	-174.8	0	0	0	0	110.5	L423 T424 L451	L423-V426 WeakPolarHBondContact O-CA 3.31Å; L423-V426 WeakPolarHBondContact O-CB 3.49Å; L423-V426 PolarHBondContact O-N 3.39Å; T424-V426 VanDerWaalsContact C-N 3.34Å; V426-L451 HydrophobicContact CG1-CD1 4.27Å
427	F	37.3	Very low	35.4	Very low	71 Å²	71	116.3 Å²	116.3	31%	0.311	71%	0.713	S	S	.	*	H	α-helix	trans	-79.2	-28.7	178.7	-69.6	-68.1	0	0	0	114.2	L423 F448 L718 M722	L423-F427 HydrophobicContact CB-CD2 4.33Å; L423-F427 HydrophobicContact CB-CE2 3.95Å; L423-F427 WeakPolarHBondContact O-CD2 3.48Å; L423-F427 PolarHBondContact O-N 3.35Å; F427-F448 HydrophobicContact CB-CZ 4.31Å; F427-F448 AromaticContact CD1-CE1 3.6Å; F427-F448 HydrophobicContact CD1-CE1 3.6Å; F427-F448 AromaticContact CD1-CZ 3.81Å; F427-F448 HydrophobicContact CD1-CZ 3.81Å; F427-F448 HydrophobicContact CE1-CE1 4.28Å; F427-F448 HydrophobicContact CG-CE1 4.46Å; F427-F448 VanDerWaalsContact O-CZ 3.28Å; F427-F448 WeakPolarHBondContact O-CZ 3.26Å; F427-L718 HydrophobicContact CZ-CD2 4.11Å; F427-M722 HydrophobicContact CD1-CE 3.87Å; F427-M722 HydrophobicContact CD1-SD 4.04Å; F427-M722 HydrophobicContact CE1-CE 4.3Å; F427-M722 HydrophobicContact CE1-SD 4.39Å
428	L	41.1	Very low	35.4	Very low	103 Å²	103	117 Å²	117	54%	0.539	72%	0.717	S	S	.	*	S	Bend	trans	-146.2	126.8	178.4	-73.2	170.2	0	0	0	110.9	T424	T424-L428 PolarHBondContact O-N 3.38Å
429	P	32.7	Very low	35.5	Very low	92 Å²	92	113.5 Å²	113.5	60%	0.597	71%	0.713	S	S	*	*			trans	-80.4	144.7	179.8	31.6	-34.7	0	0	0	112.8
430	P	30.8	Very low	35.5	Very low	109 Å²	109	115.7 Å²	115.7	71%	0.708	72%	0.718	S	S	*	*			trans	-76.6	136.6	172.6	31.5	-34	0	0	0	111.6	N432	P430-N432 PolarHBondContact O-N 3.34Å
431	I	39.8	Very low	35.1	Very low	166 Å²	166	115.3 Å²	115.3	85%	0.851	71%	0.714	S	S	*	*			trans	-84.4	99.2	178.1	-58	175.8	0	0	0	109.9
432	N	28.5	Very low	35.1	Very low	148 Å²	148	116 Å²	116	79%	0.791	72%	0.721	S	S	*	*			trans	-84.5	128.6	164.6	-85.6	-10.9	0	0	0	110.6	P430 S434	P430-N432 PolarHBondContact O-N 3.34Å; N432-S434 PolarHBondContact O-N 2.84Å
433	S	37.3	Very low	34.5	Very low	126 Å²	126	114.1 Å²	114.1	88%	0.881	72%	0.719	S	S	*	*			trans	-83.4	109.1	-176.4	40.8	0	0	0	0	112.8
434	S	26	Very low	34.3	Very low	120 Å²	120	117.5 Å²	117.5	84%	0.839	74%	0.737	S	S	*	*			trans	-146.7	147.5	164.1	61.2	0	0	0	0	110.4	N432	N432-S434 PolarHBondContact O-N 2.84Å
435	S	37	Very low	34.1	Very low	122 Å²	122	116.1 Å²	116.1	85%	0.853	73%	0.73	S	S	*	*			trans	-114.7	128	-165.7	53.6	0	0	0	0	113.8
436	S	29.4	Very low	34.5	Very low	116 Å²	116	116.7 Å²	116.7	81%	0.811	72%	0.721	S	S	*	*			trans	-154.1	146.2	153.2	59.1	0	0	0	0	110
437	N	34.5	Very low	34.7	Very low	162 Å²	162	115.9 Å²	115.9	87%	0.866	72%	0.718	S	S	*	*			trans	-111	122.6	-174.9	-65.3	-32.1	0	0	0	110.6
438	V	32.1	Very low	35.2	Very low	147 Å²	147	114.2 Å²	114.2	89%	0.891	71%	0.71	S	S	*	*			trans	-139	149.6	158.4	-172.6	0	0	0	0	108.2
439	T	32.2	Very low	35.6	Very low	138 Å²	138	111.5 Å²	111.5	85%	0.847	70%	0.698	S	S	*	*			trans	-117.1	104.9	-162.5	-53.9	0	0	0	0	113.7
440	S	29.6	Very low	36.4	Very low	113 Å²	113	110.6 Å²	110.6	79%	0.79	69%	0.691	S	S	*	*			trans	-168.2	130.7	155.8	51.6	0	0	0	0	111.1
441	A	25.6	Very low	37.5	Very low	95 Å²	95	109.8 Å²	109.8	79%	0.785	68%	0.68	S	S	*	*			trans	-92.1	151.8	161.4	0	0	0	0	0	108.4
442	P	35.7	Very low	38.2	Very low	119 Å²	119	103.1 Å²	103.1	77%	0.773	65%	0.646	S	S	*	*	S	Bend		-119.8	-179.1	65.5	32.9	-21.5	0	0	0	114.8
443	S	29.8	Very low	39.5	Very low	111 Å²	111	101.9 Å²	101.9	78%	0.776	64%	0.635	S	S	*	*			trans	-12.7	118.9	174.3	49.4	0	0	0	0	117.9
444	L	36.2	Very low	40.1	Very low	168 Å²	168	103.4 Å²	103.4	88%	0.88	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-58.3	132.6	159.8	-83	163.7	0	0	0	110
445	P	37.8	Very low	41.1	Very low	82 Å²	82	101.3 Å²	101.3	53%	0.532	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-67.8	158.1	172.6	29.1	-34.1	0	0	0	111.4	T450	P445-T450 HydrophobicContact CG-CG2 4.39Å
446	D	45.5	Very low	41.6	Very low	62 Å²	62	98.6 Å²	98.6	33%	0.332	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-61.6	132.5	171.7	175.9	59	0	0	0	110	F448 T449 K719	D446-F448 PolarHBondContact O-N 3.44Å; D446-T449 PolarHBondContact O-N 3.37Å; D446-T449 PolarHBondContact O-OG1 2.99Å; D446-K719 WeakPolarHBondContact OD2-CE 3.4Å; D446-K719 IonicContact OD2-NZ 3.45Å; D446-K719 PolarHBondContact OD2-NZ 3.08Å
447	P	49	Very low	42.7	Very low	64 Å²	64	96.2 Å²	96.2	42%	0.416	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62	-9.6	-173.2	23.9	-35.7	0	0	0	114.6
448	F	47.8	Very low	43.4	Very low	35 Å²	35	95.7 Å²	95.7	15%	0.154	56%	0.564	C	S	.	*	T	Hydrogen-bonded Turn	trans	-95.2	-7.7	176.2	-55.9	-77.4	0	0	0	114.6	F427 D446 L452 K719 M722	F427-F448 HydrophobicContact CB-CZ 4.31Å; F427-F448 AromaticContact CD1-CE1 3.6Å; F427-F448 HydrophobicContact CD1-CE1 3.6Å; F427-F448 AromaticContact CD1-CZ 3.81Å; F427-F448 HydrophobicContact CD1-CZ 3.81Å; F427-F448 HydrophobicContact CE1-CE1 4.28Å; F427-F448 HydrophobicContact CG-CE1 4.46Å; F427-F448 VanDerWaalsContact O-CZ 3.28Å; F427-F448 WeakPolarHBondContact O-CZ 3.26Å; D446-F448 PolarHBondContact O-N 3.44Å; F448-L452 WeakPolarHBondContact O-CB 3.38Å; F448-K719 HydrophobicContact CB-CD 3.69Å; F448-K719 HydrophobicContact CB-CG 4.26Å; F448-K719 HydrophobicContact CG-CD 4.34Å; F448-K719 HydrophobicContact CG-CG 4.39Å; F448-M722 HydrophobicContact CE1-CE 4.32Å; F448-M722 HydrophobicContact CE2-CE 3.79Å; F448-M722 HydrophobicContact CZ-CE 3.58Å
449	T	49.8	Very low	44.3	Very low	46 Å²	46	95.5 Å²	95.5	28%	0.282	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.3	-48.9	172.8	5.7	0	0	0	0	110.8	D446 L451 L452 E453	D446-T449 PolarHBondContact O-N 3.37Å; D446-T449 PolarHBondContact O-OG1 2.99Å; T449-L451 PolarHBondContact O-N 2.96Å; T449-L451 VanDerWaalsContact O-N 3.09Å; T449-L452 WeakPolarHBondContact O-CA 3.23Å; T449-L452 PolarHBondContact O-N 2.94Å; T449-E453 VanDerWaalsContact CB-OE2 3.28Å; T449-E453 WeakPolarHBondContact CB-OE2 3.37Å; T449-E453 WeakPolarHBondContact CG2-OE2 3.41Å; T449-E453 WeakPolarHBondContact O-CB 3.4Å; T449-E453 PolarHBondContact O-N 2.81Å
450	T	50.9	Low	45.3	Very low	73 Å²	73	90.7 Å²	90.7	45%	0.448	52%	0.522	S	S	.	.	H	α-helix	trans	-58.7	-26	178.4	35.9	0	0	0	0	114.7	P445	P445-T450 HydrophobicContact CG-CG2 4.39Å
451	L	53	Low	46.1	Very low	93 Å²	93	88.3 Å²	88.3	49%	0.487	51%	0.505	S	S	.	.	H	α-helix	trans	-80.6	-14	173.8	-170.5	132.5	0	0	0	113.8	V426 T449	V426-L451 HydrophobicContact CG1-CD1 4.27Å; T449-L451 PolarHBondContact O-N 2.96Å; T449-L451 VanDerWaalsContact O-N 3.09Å
452	L	54.2	Low	47.5	Very low	25 Å²	25	90.3 Å²	90.3	13%	0.131	50%	0.502	C	S	.	.	H	α-helix	trans	-113.2	-17.9	-171.3	-119.9	159.4	0	0	0	113.5	F448 T449 L457 I712 I715 R716	F448-L452 WeakPolarHBondContact O-CB 3.38Å; T449-L452 WeakPolarHBondContact O-CA 3.23Å; T449-L452 PolarHBondContact O-N 2.94Å; L452-L457 WeakPolarHBondContact O-CD1 3.48Å; L452-L457 WeakPolarHBondContact O-CG 3.04Å; L452-I712 HydrophobicContact CD2-CG2 3.94Å; L452-I715 HydrophobicContact CD1-CG2 4.48Å; L452-R716 HydrophobicContact CD1-CG 3.96Å; L452-R716 HydrophobicContact CD2-CG 3.9Å; L452-R716 VanDerWaalsContact CD2-NE 3.35Å
453	E	55.7	Low	48.1	Very low	122 Å²	122	90.2 Å²	90.2	57%	0.57	49%	0.494	S	S	*	.	H	α-helix	trans	-112.3	-39.7	-159.7	-165.9	166.6	-171.5	0	0	113.5	T449	T449-E453 VanDerWaalsContact CB-OE2 3.28Å; T449-E453 WeakPolarHBondContact CB-OE2 3.37Å; T449-E453 WeakPolarHBondContact CG2-OE2 3.41Å; T449-E453 WeakPolarHBondContact O-CB 3.4Å; T449-E453 PolarHBondContact O-N 2.81Å
454	E	49.8	Very low	49.2	Very low	159 Å²	159	88.1 Å²	88.1	74%	0.743	47%	0.474	S	S	*	.	S	Bend	trans	-112.9	-1.7	-163.8	-155.2	174.4	-178.4	0	0	115.5
455	S	47.4	Very low	49.9	Very low	75 Å²	75	82 Å²	82	52%	0.524	44%	0.442	S	S	.	.	S	Bend	trans	-136.8	-32.8	179.5	61.1	0	0	0	0	114.8
456	M	47.3	Very low	50.5	Low	66 Å²	66	81.8 Å²	81.8	33%	0.325	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-13.9	-178.1	-78	-77.4	-78.4	0	0	114.2	I460 K708 I712	M456-I460 VanDerWaalsContact O-CD1 3.28Å; M456-I460 WeakPolarHBondContact O-CD1 3.43Å; M456-I460 WeakPolarHBondContact O-CG1 3.49Å; M456-K708 HydrophobicContact CE-CG 4.28Å; M456-I712 HydrophobicContact CE-CD1 4.07Å; M456-I712 HydrophobicContact CE-CG1 4.08Å
457	L	52	Low	50.5	Low	66 Å²	66	86 Å²	86	35%	0.346	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-49	-175.1	-60.7	-179.7	0	0	0	112.6	L452 E459 I460	L452-L457 WeakPolarHBondContact O-CD1 3.48Å; L452-L457 WeakPolarHBondContact O-CG 3.04Å; L457-E459 PolarHBondContact O-N 3.31Å; L457-I460 CarbonylContact O-C 3.45Å; L457-I460 WeakPolarHBondContact O-CA 3.5Å; L457-I460 PolarHBondContact O-N 2.84Å
458	D	51.2	Low	50.7	Low	151 Å²	151	87 Å²	87	81%	0.807	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-30.6	174.6	-89.1	17.9	0	0	0	112.9	I460	D458-I460 VanDerWaalsContact C-N 3.29Å; D458-I460 PolarHBondContact O-N 3.12Å
459	E	50.5	Low	50.7	Low	142 Å²	142	95.2 Å²	95.2	66%	0.664	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-17.3	175.8	-160	-169.4	-121.8	0	0	113	L457 S461 K708	L457-E459 PolarHBondContact O-N 3.31Å; E459-S461 PolarHBondContact O-N 3.07Å; E459-K708 IonicContact OE2-NZ 3.28Å; E459-K708 PolarHBondContact OE2-NZ 2.88Å
460	I	52.3	Low	50.5	Low	38 Å²	38	96.4 Å²	96.4	20%	0.195	53%	0.527	C	S	.	.	S	Bend	trans	-98.8	74.5	174.2	-53.5	172.5	0	0	0	108	M456 L457 D458 L462 L465 K708 I712	M456-I460 VanDerWaalsContact O-CD1 3.28Å; M456-I460 WeakPolarHBondContact O-CD1 3.43Å; M456-I460 WeakPolarHBondContact O-CG1 3.49Å; L457-I460 CarbonylContact O-C 3.45Å; L457-I460 WeakPolarHBondContact O-CA 3.5Å; L457-I460 PolarHBondContact O-N 2.84Å; D458-I460 VanDerWaalsContact C-N 3.29Å; D458-I460 PolarHBondContact O-N 3.12Å; I460-L462 PolarHBondContact O-N 3.09Å; I460-L462 VanDerWaalsContact O-N 3.08Å; I460-L465 HydrophobicContact CG2-CD1 4.06Å; I460-K708 HydrophobicContact CD1-CD 3.94Å; I460-K708 HydrophobicContact CD1-CG 4.39Å; I460-K708 HydrophobicContact CG1-CD 4.21Å; I460-I712 HydrophobicContact CD1-CD1 3.92Å
461	S	47.2	Very low	49.8	Very low	63 Å²	63	97.9 Å²	97.9	44%	0.441	53%	0.527	S	S	.	.			trans	-61.2	115.9	177.6	-167.9	0	0	0	0	110.5	E459 L463 D464	E459-S461 PolarHBondContact O-N 3.07Å; S461-L463 PolarHBondContact O-N 3.36Å; S461-D464 VanDerWaalsContact O-CB 3.27Å; S461-D464 WeakPolarHBondContact O-CB 3.45Å; S461-D464 PolarHBondContact O-N 3.36Å
462	L	53.8	Low	49.4	Very low	137 Å²	137	96 Å²	96	72%	0.717	52%	0.522	S	S	*	.	H	α-helix	trans	-53.3	-27.1	175.2	-85.1	153.3	0	0	0	112.9	I460 D464 L465 A466	I460-L462 PolarHBondContact O-N 3.09Å; I460-L462 VanDerWaalsContact O-N 3.08Å; L462-D464 VanDerWaalsContact C-N 3.34Å; L462-L465 PolarHBondContact O-N 3.23Å; L462-A466 VanDerWaalsContact O-CB 3.31Å; L462-A466 WeakPolarHBondContact O-CB 3.32Å; L462-A466 PolarHBondContact O-N 3.14Å
463	L	49.5	Very low	49.1	Very low	116 Å²	116	101.9 Å²	101.9	61%	0.607	55%	0.549	S	S	*	.	H	α-helix	trans	-65.2	-35.6	175.4	-171.6	64.4	0	0	0	112.7	S461 L465 A466 M467	S461-L463 PolarHBondContact O-N 3.36Å; L463-L465 VanDerWaalsContact C-N 3.33Å; L463-A466 PolarHBondContact O-N 2.86Å; L463-M467 HydrophobicContact CD1-SD 4.46Å; L463-M467 HydrophobicContact CG-SD 4.19Å; L463-M467 WeakPolarHBondContact O-CB 3.25Å; L463-M467 VanDerWaalsContact O-CG 3.26Å; L463-M467 WeakPolarHBondContact O-CG 3.39Å; L463-M467 PolarHBondContact O-N 3.38Å; L463-M467 VanDerWaalsContact O-N 3.15Å
464	D	51.3	Low	48.7	Very low	68 Å²	68	99.4 Å²	99.4	36%	0.364	55%	0.549	S	S	.	.	H	α-helix	trans	-71.3	-28.7	-180	-166.2	49.6	0	0	0	111.8	S461 L462 K701	S461-D464 VanDerWaalsContact O-CB 3.27Å; S461-D464 WeakPolarHBondContact O-CB 3.45Å; S461-D464 PolarHBondContact O-N 3.36Å; L462-D464 VanDerWaalsContact C-N 3.34Å; D464-K701 IonicContact OD1-NZ 3.41Å; D464-K701 PolarHBondContact OD1-NZ 2.98Å; D464-K701 WeakPolarHBondContact OD2-CE 3.34Å; D464-K701 IonicContact OD2-NZ 2.73Å; D464-K701 PolarHBondContact OD2-NZ 3.38Å
465	L	52.5	Low	48.5	Very low	38 Å²	38	97.1 Å²	97.1	20%	0.199	54%	0.538	C	S	.	.	H	α-helix	trans	-83	-35.3	171.5	-69.5	169.5	0	0	0	112.7	I460 L462 L463 M467 F471 L705	I460-L465 HydrophobicContact CG2-CD1 4.06Å; L462-L465 PolarHBondContact O-N 3.23Å; L463-L465 VanDerWaalsContact C-N 3.33Å; L465-M467 PolarHBondContact O-N 3.47Å; L465-F471 HydrophobicContact CD2-CE2 4.16Å; L465-L705 HydrophobicContact CD2-CD1 4.31Å
466	A	50.8	Low	48.6	Very low	79 Å²	79	95.4 Å²	95.4	65%	0.653	53%	0.529	S	S	*	.	H	α-helix	trans	-73.5	-13.4	179	0	0	0	0	0	113.9	L462 L463	L462-A466 VanDerWaalsContact O-CB 3.31Å; L462-A466 WeakPolarHBondContact O-CB 3.32Å; L462-A466 PolarHBondContact O-N 3.14Å; L463-A466 PolarHBondContact O-N 2.86Å
467	M	45.6	Very low	48.5	Very low	151 Å²	151	94.5 Å²	94.5	74%	0.744	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-5.8	179.6	-78.9	-178.8	62.3	0	0	114.8	L463 L465	L463-M467 HydrophobicContact CD1-SD 4.46Å; L463-M467 HydrophobicContact CG-SD 4.19Å; L463-M467 WeakPolarHBondContact O-CB 3.25Å; L463-M467 VanDerWaalsContact O-CG 3.26Å; L463-M467 WeakPolarHBondContact O-CG 3.39Å; L463-M467 PolarHBondContact O-N 3.38Å; L463-M467 VanDerWaalsContact O-N 3.15Å; L465-M467 PolarHBondContact O-N 3.47Å
468	E	52.3	Low	48.2	Very low	84 Å²	84	97.9 Å²	97.9	39%	0.393	54%	0.543	S	S	.	.	S	Bend	trans	-109	137.3	179.2	-159.4	156.6	-140.8	0	0	112.5	G470 A702	E468-G470 PolarHBondContact O-N 3.47Å; E468-A702 WeakPolarHBondContact OE2-CB 3.5Å
469	E	48.5	Very low	48.1	Very low	207 Å²	207	93.6 Å²	93.6	97%	0.967	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	77.4	-158.4	-167.2	173.4	-174.2	0	0	113.2
470	G	44.5	Very low	48	Very low	72 Å²	72	93.2 Å²	93.2	74%	0.742	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	176.4	-18.1	174.9	0	0	0	0	0	117.4	E468 S472	E468-G470 PolarHBondContact O-N 3.47Å; G470-S472 PolarHBondContact O-N 2.95Å; G470-S472 VanDerWaalsContact O-N 3.12Å
471	F	36.8	Very low	47.9	Very low	103 Å²	103	98.1 Å²	98.1	45%	0.452	54%	0.54	S	S	.	.			trans	-73.2	105.1	179.3	-106.7	-89	0	0	0	111.7	L465	L465-F471 HydrophobicContact CD2-CE2 4.16Å
472	S	45.2	Very low	47.9	Very low	54 Å²	54	101.5 Å²	101.5	38%	0.378	55%	0.549	S	S	.	.			trans	-70.4	134.7	175.8	72	0	0	0	0	111.4	G470 A474 Q475	G470-S472 PolarHBondContact O-N 2.95Å; G470-S472 VanDerWaalsContact O-N 3.12Å; S472-A474 PolarHBondContact O-N 2.9Å; S472-Q475 PolarHBondContact O-N 2.93Å
473	Q	46.8	Very low	47.6	Very low	148 Å²	148	100.2 Å²	100.2	69%	0.692	54%	0.542	S	S	*	.	H	α-helix	trans	-47.9	-36.9	178.6	-176	68.5	38.4	0	0	113.1	Q475 A476 S477	Q473-Q475 VanDerWaalsContact C-N 3.32Å; Q473-Q475 PolarHBondContact O-N 2.76Å; Q473-A476 PolarHBondContact O-N 3.25Å; Q473-S477 PolarHBondContact O-N 2.81Å; Q473-S477 PolarHBondContact O-OG 3.45Å
474	A	47.7	Very low	46.9	Very low	70 Å²	70	102 Å²	102	58%	0.579	55%	0.552	S	S	*	*	H	α-helix	trans	-60.7	-35.9	179.1	0	0	0	0	0	113.4	S472 Q478	S472-A474 PolarHBondContact O-N 2.9Å; A474-Q478 VanDerWaalsContact O-CB 3.23Å; A474-Q478 WeakPolarHBondContact O-CB 3.41Å; A474-Q478 PolarHBondContact O-N 3.46Å
475	Q	44.6	Very low	46.1	Very low	111 Å²	111	103.3 Å²	103.3	52%	0.519	57%	0.567	S	S	.	*	H	α-helix	trans	-76	-25.9	178.3	-70.4	177.2	1.2	0	0	112.6	S472 Q473	S472-Q475 PolarHBondContact O-N 2.93Å; Q473-Q475 VanDerWaalsContact C-N 3.32Å; Q473-Q475 PolarHBondContact O-N 2.76Å
476	A	50.1	Low	45.5	Very low	39 Å²	39	108.6 Å²	108.6	32%	0.322	60%	0.596	S	S	.	*	H	α-helix	trans	-72.1	-50.9	170.4	0	0	0	0	0	110.6	Q473 Q478 L479 E480	Q473-A476 PolarHBondContact O-N 3.25Å; A476-Q478 VanDerWaalsContact C-N 3.31Å; A476-Q478 PolarHBondContact O-N 3.46Å; A476-L479 WeakPolarHBondContact O-CB 3.47Å; A476-L479 PolarHBondContact O-N 2.94Å; A476-E480 PolarHBondContact O-N 2.99Å
477	S	45.4	Very low	45.4	Very low	47 Å²	47	110.9 Å²	110.9	33%	0.329	61%	0.606	S	S	.	*	H	α-helix	trans	-64.6	-31.9	179.3	-63.9	0	0	0	0	113.4	Q473 L479 E480 E481	Q473-S477 PolarHBondContact O-N 2.81Å; Q473-S477 PolarHBondContact O-OG 3.45Å; S477-L479 PolarHBondContact O-N 3.12Å; S477-E480 WeakPolarHBondContact O-CB 3.21Å; S477-E480 PolarHBondContact O-N 3.4Å; S477-E481 WeakPolarHBondContact O-CB 3.48Å; S477-E481 PolarHBondContact O-N 3.11Å
478	Q	45.8	Very low	45.6	Very low	138 Å²	138	106.9 Å²	106.9	65%	0.645	60%	0.604	S	S	*	*	H	α-helix	trans	-68.8	-21.8	173.6	-171.2	166.8	44.5	0	0	113.1	A474 A476	A474-Q478 VanDerWaalsContact O-CB 3.23Å; A474-Q478 WeakPolarHBondContact O-CB 3.41Å; A474-Q478 PolarHBondContact O-N 3.46Å; A476-Q478 VanDerWaalsContact C-N 3.31Å; A476-Q478 PolarHBondContact O-N 3.46Å
479	L	48	Very low	44.7	Very low	60 Å²	60	111.4 Å²	111.4	31%	0.314	63%	0.63	S	S	.	*	H	α-helix	trans	-88.7	-28.9	174.3	-161.4	147.4	0	0	0	111.5	A476 S477 L483 M709	A476-L479 WeakPolarHBondContact O-CB 3.47Å; A476-L479 PolarHBondContact O-N 2.94Å; S477-L479 PolarHBondContact O-N 3.12Å; L479-L483 HydrophobicContact CD2-CD1 4.09Å; L479-L483 WeakPolarHBondContact O-CD1 3.46Å; L479-L483 VanDerWaalsContact O-CG 3.32Å; L479-L483 WeakPolarHBondContact O-CG 3.17Å; L479-L483 PolarHBondContact O-N 3.35Å; L479-M709 HydrophobicContact CD1-CE 4.29Å; L479-M709 HydrophobicContact CD1-SD 3.63Å
480	E	50.3	Low	44	Very low	134 Å²	134	106.2 Å²	106.2	63%	0.626	62%	0.617	S	S	*	*	H	α-helix	trans	-65.8	-43.4	168.8	-165.5	172.8	-161.9	0	0	111.3	A476 S477 E482 L483 D484	A476-E480 PolarHBondContact O-N 2.99Å; S477-E480 WeakPolarHBondContact O-CB 3.21Å; S477-E480 PolarHBondContact O-N 3.4Å; E480-E482 VanDerWaalsContact C-N 3.35Å; E480-E482 PolarHBondContact O-N 3.49Å; E480-L483 WeakPolarHBondContact O-CB 3.34Å; E480-L483 PolarHBondContact O-N 3.23Å; E480-D484 PolarHBondContact O-N 3.2Å
481	E	49.3	Very low	43.5	Very low	141 Å²	141	110.7 Å²	110.7	66%	0.659	62%	0.623	S	S	*	*	H	α-helix	trans	-66.4	-30.6	176.6	-169.1	173.8	-163.7	0	0	113.1	S477 L483 S485	S477-E481 WeakPolarHBondContact O-CB 3.48Å; S477-E481 PolarHBondContact O-N 3.11Å; E481-L483 VanDerWaalsContact C-N 3.26Å; E481-L483 PolarHBondContact O-N 3.34Å; E481-S485 PolarHBondContact O-OG 3.24Å
482	E	46.6	Very low	43.1	Very low	134 Å²	134	113 Å²	113	63%	0.626	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-18.7	172.2	-164.5	179.3	-163.6	0	0	112.4	E480	E480-E482 VanDerWaalsContact C-N 3.35Å; E480-E482 PolarHBondContact O-N 3.49Å
483	L	48.3	Very low	42.4	Very low	111 Å²	111	114.6 Å²	114.6	58%	0.581	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-29.5	-179.1	-69.9	168.6	0	0	0	114	L479 E480 E481 S485	L479-L483 HydrophobicContact CD2-CD1 4.09Å; L479-L483 WeakPolarHBondContact O-CD1 3.46Å; L479-L483 VanDerWaalsContact O-CG 3.32Å; L479-L483 WeakPolarHBondContact O-CG 3.17Å; L479-L483 PolarHBondContact O-N 3.35Å; E480-L483 WeakPolarHBondContact O-CB 3.34Å; E480-L483 PolarHBondContact O-N 3.23Å; E481-L483 VanDerWaalsContact C-N 3.26Å; E481-L483 PolarHBondContact O-N 3.34Å; L483-S485 VanDerWaalsContact C-N 3.27Å; L483-S485 PolarHBondContact O-N 2.99Å
484	D	35.5	Very low	41.8	Very low	152 Å²	152	112.7 Å²	112.7	81%	0.813	65%	0.654	S	S	*	*	S	Bend	trans	-84.1	1.3	-179.3	-155.3	36.1	0	0	0	113.4	E480 D486	E480-D484 PolarHBondContact O-N 3.2Å; D484-D486 PolarHBondContact O-N 2.96Å
485	S	33.5	Very low	41.3	Very low	96 Å²	96	120.4 Å²	120.4	67%	0.671	67%	0.668	S	S	*	*			trans	-94.9	51.5	-169.9	-69.7	0	0	0	0	115.1	E481 L483	E481-S485 PolarHBondContact O-OG 3.24Å; L483-S485 VanDerWaalsContact C-N 3.27Å; L483-S485 PolarHBondContact O-N 2.99Å
486	D	39.8	Very low	40.7	Very low	150 Å²	150	119.8 Å²	119.8	80%	0.802	68%	0.676	S	S	*	*			trans	-123	91.8	165	-169	9.1	0	0	0	112.7	D484	D484-D486 PolarHBondContact O-N 2.96Å
487	S	49.4	Very low	40.4	Very low	126 Å²	126	123.6 Å²	123.6	88%	0.881	70%	0.697	S	S	*	*			trans	-162.8	110.3	163.9	-88.2	0	0	0	0	112.3
488	G	49	Very low	39.6	Very low	68 Å²	68	126 Å²	126	70%	0.701	72%	0.72	S	S	*	*			trans	-151.2	94.2	174	0	0	0	0	0	114.5
489	L	33.4	Very low	39	Very low	179 Å²	179	124.7 Å²	124.7	94%	0.937	73%	0.726	S	S	*	*			trans	-152.1	167.5	154.5	-84	-168.3	0	0	0	110
490	S	33.9	Very low	38.9	Very low	97 Å²	97	127.8 Å²	127.8	68%	0.678	75%	0.75	S	S	*	*			trans	-132.6	145.3	-140.7	53.5	0	0	0	0	118.2
491	L	33.6	Very low	37.9	Very low	166 Å²	166	126.6 Å²	126.6	87%	0.869	76%	0.756	S	S	*	*			trans	59	122.3	146.5	-62.4	165	0	0	0	121.1
492	D	29	Very low	36.8	Very low	153 Å²	153	125.7 Å²	125.7	82%	0.818	77%	0.766	S	S	*	*				-162.2	-167.5	101.2	-163.5	11.5	0	0	0	110.8
493	S	31.1	Very low	36.3	Very low	87 Å²	87	124.1 Å²	124.1	61%	0.608	77%	0.769	S	S	*	*			trans	-126.1	150.7	-143.6	-48.1	0	0	0	0	114.8
494	S	33.5	Very low	35.6	Very low	107 Å²	107	126.8 Å²	126.8	75%	0.748	78%	0.779	S	S	*	*				172	134.4	106.6	47.8	0	0	0	0	116.2
495	R	36.7	Very low	35.5	Very low	233 Å²	233	126.1 Å²	126.1	88%	0.879	78%	0.781	S	S	*	*			trans	33.5	138.2	135.5	-60.6	175.6	-179.1	-95.1	-0.8	120.1
496	S	31.6	Very low	35.5	Very low	97 Å²	97	127 Å²	127	68%	0.678	79%	0.787	S	S	*	*			cis	-171.6	-156.2	-1.6	-87.2	0	0	0	0	107.5
497	P	44.8	Very low	34.9	Very low	119 Å²	119	125.7 Å²	125.7	77%	0.773	79%	0.788	S	S	*	*				-128.4	-174.4	-81.2	41.9	-26.8	0	0	0	115.1
498	A	28.2	Very low	33.9	Very low	98 Å²	98	124.8 Å²	124.8	81%	0.81	78%	0.782	S	S	*	*			trans	83.3	95.7	151.9	0	0	0	0	0	120.3
499	S	34	Very low	33.1	Very low	111 Å²	111	127 Å²	127	78%	0.776	79%	0.787	S	S	*	*			trans	-74.4	170.8	145.6	-44.8	0	0	0	0	110.7
500	P	45.2	Very low	32.9	Very low	125 Å²	125	122.9 Å²	122.9	81%	0.812	78%	0.778	S	S	*	*				-145.9	137.5	93.6	36.6	-20.5	0	0	0	117.2
501	S	28.9	Very low	32.5	Very low	109 Å²	109	122.6 Å²	122.6	76%	0.762	78%	0.781	S	S	*	*				49.1	115.1	128.9	-159.5	0	0	0	0	121.8
502	S	27.8	Very low	32.2	Very low	122 Å²	122	120.1 Å²	120.1	85%	0.853	78%	0.778	S	S	*	*				-155.2	157	122.4	-64.3	0	0	0	0	109.7
503	S	35.6	Very low	32.3	Very low	101 Å²	101	118.2 Å²	118.2	71%	0.706	78%	0.777	S	S	*	*			trans	-72.7	172.5	175.5	42.9	0	0	0	0	112
504	E	33.3	Very low	32	Very low	166 Å²	166	120.3 Å²	120.3	78%	0.776	79%	0.792	S	S	*	*			cis	-149.7	149.1	33.7	-30.8	-163.6	98.6	0	0	116
505	T	33.3	Very low	31.8	Very low	139 Å²	139	120.4 Å²	120.4	85%	0.853	79%	0.792	S	S	*	*			trans	45.9	133	151.2	54.8	0	0	0	0	123.7
506	S	32.7	Very low	31.5	Very low	114 Å²	114	115.8 Å²	115.8	80%	0.797	79%	0.79	S	S	*	*			trans	-65	176.2	165.9	-28.3	0	0	0	0	113.7
507	C	27.2	Very low	31.3	Very low	122 Å²	122	116.9 Å²	116.9	82%	0.824	80%	0.797	S	S	*	*			cis	-153.8	162.6	9.4	24.2	0	0	0	0	113.5
508	S	29.3	Very low	30.6	Very low	108 Å²	108	115 Å²	115	76%	0.755	79%	0.792	S	S	*	*			trans	-44.7	155.6	162.2	-52.8	0	0	0	0	114.8
509	S	31.5	Very low	30.9	Very low	115 Å²	115	117.3 Å²	117.3	80%	0.804	79%	0.791	S	S	*	*			cis	-163	-145.3	-9.1	-91.6	0	0	0	0	106.9
510	A	29.6	Very low	30.6	Very low	91 Å²	91	121.3 Å²	121.3	75%	0.752	79%	0.794	S	S	*	*			cis	-164.7	-178.1	7.2	0	0	0	0	0	112.6
511	A	26.6	Very low	30.1	Very low	91 Å²	91	120 Å²	120	75%	0.752	79%	0.789	S	S	*	*			trans	56.4	109.7	155.9	0	0	0	0	0	121.2
512	S	27.2	Very low	30.3	Very low	115 Å²	115	123.8 Å²	123.8	80%	0.804	79%	0.794	S	S	*	*			trans	-165.3	135.8	131.5	-86.6	0	0	0	0	112.8
513	S	29.8	Very low	30.9	Very low	113 Å²	113	126.8 Å²	126.8	79%	0.79	80%	0.795	S	S	*	*			trans	53.7	126.6	147.4	-53.1	0	0	0	0	121.6
514	S	25.2	Very low	30.8	Very low	131 Å²	131	125.5 Å²	125.5	92%	0.916	80%	0.797	S	S	*	*			trans	-140.2	137.3	143.2	-79.4	0	0	0	0	109.9
515	S	29.8	Very low	30.9	Very low	108 Å²	108	122.5 Å²	122.5	76%	0.755	80%	0.801	S	S	*	*			trans	-150.9	145.7	177.7	60.3	0	0	0	0	109.5
516	T	29.1	Very low	31	Very low	136 Å²	136	122.5 Å²	122.5	83%	0.834	80%	0.8	S	S	*	*			trans	174.1	156.1	144.5	23.6	0	0	0	0	112.6
517	S	27.5	Very low	31.1	Very low	120 Å²	120	120 Å²	120	84%	0.839	79%	0.793	S	S	*	*			trans	75.9	151.5	161.2	77.9	0	0	0	0	120
518	A	30	Very low	31.5	Very low	80 Å²	80	125.2 Å²	125.2	66%	0.661	80%	0.797	S	S	*	*			cis	-169.9	130.5	-34.7	0	0	0	0	0	112.5
519	N	36	Very low	32	Very low	146 Å²	146	125 Å²	125	78%	0.781	80%	0.795	S	S	*	*			trans	62.7	159.4	145.6	-69.4	11.6	0	0	0	124.2
520	F	27.9	Very low	32.3	Very low	195 Å²	195	126 Å²	126	86%	0.855	80%	0.796	S	S	*	*			trans	91.9	141.4	171	-59.3	-72.9	0	0	0	116.7
521	S	33	Very low	32.3	Very low	99 Å²	99	128.6 Å²	128.6	69%	0.692	80%	0.798	S	S	*	*			cis	175.9	174.2	-29.8	-100.9	0	0	0	0	108.2
522	E	34.1	Very low	33	Very low	187 Å²	187	129.5 Å²	129.5	87%	0.874	80%	0.798	S	S	*	*			trans	73.9	147.6	159.3	-153.9	175.2	155.1	0	0	117.1
523	E	41.1	Very low	33.3	Very low	186 Å²	186	132.8 Å²	132.8	87%	0.869	80%	0.801	S	S	*	*			cis	-160.3	153.2	-37.4	178.1	166.6	138.4	0	0	110.4
524	G	33.4	Very low	33.5	Very low	73 Å²	73	131.7 Å²	131.7	75%	0.753	80%	0.799	S	S	*	*			trans	88.1	158.7	163	0	0	0	0	0	117.5
525	A	33.7	Very low	33.8	Very low	103 Å²	103	130.1 Å²	130.1	85%	0.851	79%	0.794	S	S	*	*			cis	-156.5	176.9	-4.5	0	0	0	0	0	112.5
526	V	36.7	Very low	33.9	Very low	139 Å²	139	129.9 Å²	129.9	84%	0.842	80%	0.798	S	S	*	*			trans	-58.3	161.8	179.6	-66.2	0	0	0	0	115.2
527	G	35	Very low	34.2	Very low	62 Å²	62	127.8 Å²	127.8	64%	0.639	80%	0.795	S	S	*	*			cis	116.3	115.4	1.6	0	0	0	0	0	114.2
528	Y	34.4	Very low	34.7	Very low	232 Å²	232	130.4 Å²	130.4	91%	0.91	79%	0.794	S	S	*	*			trans	-160.9	163.1	168.1	-104.9	-73.2	0	0	0	113
529	S	40.2	Very low	34.8	Very low	104 Å²	104	132 Å²	132	73%	0.727	80%	0.796	S	S	*	*			trans	-161.3	-172.6	176.6	-73.1	0	0	0	0	110.2
530	T	37.8	Very low	34.8	Very low	134 Å²	134	133.6 Å²	133.6	82%	0.822	80%	0.798	S	S	*	*			trans	84.5	142.8	-178.7	-42.9	0	0	0	0	111.6
531	D	29.6	Very low	35.2	Very low	147 Å²	147	133.5 Å²	133.5	79%	0.786	80%	0.8	S	S	*	*			cis	-140.7	-174.4	28.5	-151.6	-4.9	0	0	0	115.9
532	S	42.2	Very low	35.2	Very low	109 Å²	109	132.4 Å²	132.4	76%	0.762	81%	0.805	S	S	*	*			trans	-134.8	148.5	-170.7	-44.4	0	0	0	0	114.5
533	E	33.2	Very low	35.2	Very low	185 Å²	185	128.3 Å²	128.3	86%	0.864	80%	0.803	S	S	*	*			trans	-155.9	133.2	156.9	-147.5	174.7	169	0	0	107.9
534	A	33.1	Very low	34.9	Very low	89 Å²	89	126.5 Å²	126.5	74%	0.736	81%	0.805	S	S	*	*			cis	102	155.6	17.5	0	0	0	0	0	115.1
535	A	32	Very low	34.9	Very low	99 Å²	99	127 Å²	127	82%	0.818	81%	0.81	S	S	*	*			trans	67.5	147.2	-173.1	0	0	0	0	0	116.7
536	A	31.8	Very low	34.9	Very low	103 Å²	103	125.7 Å²	125.7	85%	0.851	81%	0.806	S	S	*	*			cis	-157.9	173.2	-18.7	0	0	0	0	0	110
537	A	35.9	Very low	34.5	Very low	92 Å²	92	130.1 Å²	130.1	76%	0.76	81%	0.809	S	S	*	*			trans	-110.3	-147.4	-172.1	0	0	0	0	0	113.7
538	E	36.9	Very low	34.2	Very low	174 Å²	174	134.7 Å²	134.7	81%	0.813	81%	0.814	S	S	*	*			trans	88	137.1	-176.5	-52.8	-69.2	134.1	0	0	115.8
539	T	33.1	Very low	34.4	Very low	114 Å²	114	129 Å²	129	70%	0.699	81%	0.805	S	S	*	*			cis	-160.7	173.7	-16.9	-105.7	0	0	0	0	110.6
540	E	36.3	Very low	33.8	Very low	179 Å²	179	131.6 Å²	131.6	84%	0.836	81%	0.806	S	S	*	*			trans	-51.6	171.7	-173.9	-53.6	-172.9	129.7	0	0	116.4
541	E	35.1	Very low	33.4	Very low	193 Å²	193	134.4 Å²	134.4	90%	0.902	80%	0.803	S	S	*	*			cis	-160.3	153.1	30.9	-172.1	-174.1	-166.1	0	0	112.2
542	G	32.8	Very low	33.4	Very low	77 Å²	77	132.8 Å²	132.8	79%	0.794	80%	0.803	S	S	*	*			trans	152.5	120.5	165.5	0	0	0	0	0	115.6
543	A	33.7	Very low	33.2	Very low	100 Å²	100	136.9 Å²	136.9	83%	0.826	81%	0.807	S	S	*	*			trans	-112.9	144	-170.5	0	0	0	0	0	115.2
544	V	35.6	Very low	33.1	Very low	149 Å²	149	135.4 Å²	135.4	90%	0.903	80%	0.804	S	S	*	*				-175	137.7	128.2	144.1	0	0	0	0	110.3
545	G	33.5	Very low	32.9	Very low	84 Å²	84	137.8 Å²	137.8	87%	0.866	81%	0.814	S	S	*	*			trans	-59.5	137.9	-160.5	0	0	0	0	0	119.4
546	G	34.3	Very low	32.7	Very low	74 Å²	74	144.7 Å²	144.7	76%	0.763	82%	0.819	S	S	*	*			trans	-140.6	112.7	159.3	0	0	0	0	0	109.4
547	Y	28.7	Very low	32.6	Very low	232 Å²	232	148.4 Å²	148.4	91%	0.91	82%	0.821	S	S	*	*			trans	-85.8	122.4	-174.2	-133.6	-92.6	0	0	0	110.8
548	Q	27.4	Very low	32.4	Very low	159 Å²	159	148.3 Å²	148.3	74%	0.743	81%	0.814	S	S	*	*			trans	-119.2	126.6	172.6	-88.1	-74.1	8.6	0	0	109.5	E550	Q548-E550 PolarHBondContact O-N 3.23Å
549	P	40.1	Very low	32.1	Very low	112 Å²	112	150.2 Å²	150.2	73%	0.727	82%	0.821	S	S	*	*			trans	-80.9	104.5	169.2	-9.8	27.6	0	0	0	110.2
550	E	26.6	Very low	32.1	Very low	159 Å²	159	152.3 Å²	152.3	74%	0.743	82%	0.822	S	S	*	*			trans	-74.3	155.7	175.6	-70.7	-176.7	118.7	0	0	113.4	Q548 S552	Q548-E550 PolarHBondContact O-N 3.23Å; E550-S552 PolarHBondContact O-N 3.47Å
551	Y	30.3	Very low	31.6	Very low	192 Å²	192	150 Å²	150	75%	0.753	82%	0.816	S	S	*	*			trans	-73.7	106.8	-178.5	15.1	-96.4	0	0	0	111.4	K553	Y551-K553 PolarHBondContact O-N 3.31Å
552	S	28.2	Very low	31.4	Very low	113 Å²	113	148.7 Å²	148.7	79%	0.79	81%	0.814	S	S	*	*			trans	-70	110.2	179.4	-173.4	0	0	0	0	112.6	E550	E550-S552 PolarHBondContact O-N 3.47Å
553	K	39.6	Very low	31.3	Very low	196 Å²	196	149.3 Å²	149.3	85%	0.852	81%	0.806	S	S	*	*			trans	-103.5	81.2	168.8	-77.3	-174.8	175	178.8	0	111	Y551	Y551-K553 PolarHBondContact O-N 3.31Å
554	L	30.2	Very low	31.4	Very low	154 Å²	154	152.5 Å²	152.5	81%	0.806	80%	0.804	S	S	*	*			trans	-140.9	106.6	169.3	-75.1	178.6	0	0	0	112
555	C	29.3	Very low	31.1	Very low	139 Å²	139	155.3 Å²	155.3	94%	0.939	80%	0.804	S	S	*	*			trans	-172.1	91.5	143.7	-111.9	0	0	0	0	110.3
556	R	28.3	Very low	30.9	Very low	244 Å²	244	159.3 Å²	159.3	92%	0.921	81%	0.806	S	S	*	*			trans	-125.2	106.9	165.2	-178.3	-177.2	-175.9	177.3	2.7	107.7
557	M	29	Very low	30.8	Very low	181 Å²	181	159.3 Å²	159.3	89%	0.892	81%	0.806	S	S	*	*			trans	-127	155.7	167.9	-77.8	-174	65.7	0	0	109.8
558	S	31.2	Very low	30.9	Very low	89 Å²	89	156.3 Å²	156.3	62%	0.622	81%	0.805	S	S	*	*			trans	-82.9	148.9	-164	42.5	0	0	0	0	113.8
559	F	31.5	Very low	31.5	Very low	215 Å²	215	154.4 Å²	154.4	94%	0.943	81%	0.806	S	S	*	*			trans	-59.1	134.9	156.8	-70.3	-92.5	0	0	0	109.6
560	Q	32.2	Very low	31.1	Very low	158 Å²	158	156.8 Å²	156.8	74%	0.738	81%	0.808	S	S	*	*			trans	-139.8	133.8	171.4	-146.9	104.9	59.3	0	0	107.7
561	D	26.9	Very low	31.5	Very low	130 Å²	130	156 Å²	156	70%	0.695	81%	0.808	S	S	*	*			trans	-73.5	134.1	-176.3	-177.5	-9	0	0	0	111.3	S563	D561-S563 VanDerWaalsContact CG-OG 3.3Å; D561-S563 VanDerWaalsContact OD1-CB 3.23Å; D561-S563 WeakPolarHBondContact OD1-CB 3.37Å; D561-S563 PolarHBondContact OD1-N 3.2Å; D561-S563 PolarHBondContact OD1-OG 3.46Å; D561-S563 PolarHBondContact OD2-OG 3.31Å
562	L	29.9	Very low	31.5	Very low	166 Å²	166	153.8 Å²	153.8	87%	0.869	81%	0.809	S	S	*	*			trans	-124.1	59.4	173.9	-86	88.7	0	0	0	111.3
563	S	31.9	Very low	31.7	Very low	89 Å²	89	151.5 Å²	151.5	62%	0.622	80%	0.804	S	S	*	*			trans	-96.3	14.7	174.5	52.5	0	0	0	0	114.7	D561	D561-S563 VanDerWaalsContact CG-OG 3.3Å; D561-S563 VanDerWaalsContact OD1-CB 3.23Å; D561-S563 WeakPolarHBondContact OD1-CB 3.37Å; D561-S563 PolarHBondContact OD1-N 3.2Å; D561-S563 PolarHBondContact OD1-OG 3.46Å; D561-S563 PolarHBondContact OD2-OG 3.31Å
564	Q	34.8	Very low	31.6	Very low	168 Å²	168	149.1 Å²	149.1	79%	0.785	80%	0.799	S	S	*	*			trans	-134.6	97.2	176.9	-66.8	-175.9	48.4	0	0	112.9
565	F	29.6	Very low	31.6	Very low	207 Å²	207	146.3 Å²	146.3	91%	0.908	79%	0.792	S	S	*	*				-179.4	125.8	121.3	-110.4	-78.2	0	0	0	111
566	N	29.8	Very low	32	Very low	168 Å²	168	147.2 Å²	147.2	90%	0.898	78%	0.782	S	S	*	*			trans	-88.9	130.5	168	-88	-39.9	0	0	0	109.9
567	G	31	Very low	32.3	Very low	75 Å²	75	141.8 Å²	141.8	77%	0.773	77%	0.771	S	S	*	*			trans	164.5	85.5	173.8	0	0	0	0	0	114.8
568	L	32	Very low	32.6	Very low	169 Å²	169	141.5 Å²	141.5	89%	0.885	77%	0.767	S	S	*	*			trans	-74.9	153.3	166.3	-69.5	172.5	0	0	0	110.6
569	P	39.7	Very low	32.8	Very low	118 Å²	118	142.7 Å²	142.7	77%	0.766	77%	0.771	S	S	*	*				-141.8	125.3	99.3	35	-20.3	0	0	0	116.2
570	Q	31.3	Very low	32.9	Very low	163 Å²	163	142.9 Å²	142.9	76%	0.762	77%	0.767	S	S	*	*				68.3	120	125.1	-164.5	170.5	4.4	0	0	122.3
571	L	34.4	Very low	33.1	Very low	142 Å²	142	142.9 Å²	142.9	74%	0.743	77%	0.772	S	S	*	*			trans	66.7	152.3	163.1	-96.2	68.9	0	0	0	117.3
572	D	31.4	Very low	33.4	Very low	145 Å²	145	142.1 Å²	142.1	78%	0.775	77%	0.772	S	S	*	*			cis	-136.9	159.5	4	-150.4	-10.8	0	0	0	112.3
573	G	32.1	Very low	33.9	Very low	66 Å²	66	140 Å²	140	68%	0.68	77%	0.768	S	S	*	*			trans	-101.6	122.1	-168.2	0	0	0	0	0	115.2
574	I	37.8	Very low	34	Very low	146 Å²	146	143.5 Å²	143.5	75%	0.749	78%	0.779	S	S	*	*			trans	-105.9	103.1	168.2	-59.5	178.2	0	0	0	109.1
575	S	30.4	Very low	33.7	Very low	95 Å²	95	141.6 Å²	141.6	66%	0.664	78%	0.784	S	S	*	*			trans	-86.5	121.3	177	56.2	0	0	0	0	111.8
576	H	36.8	Very low	33.7	Very low	158 Å²	158	137.4 Å²	137.4	73%	0.731	78%	0.781	S	S	*	*			trans	-91.1	102.3	169.3	-71.9	-64.8	0	0	0	110.6
577	N	34.9	Very low	33.7	Very low	129 Å²	129	134.5 Å²	134.5	69%	0.69	77%	0.774	S	S	*	*			trans	-77	126.7	173.1	-70.4	-65.9	0	0	0	110.6
578	H	35.4	Very low	33.5	Very low	175 Å²	175	140.4 Å²	140.4	81%	0.81	78%	0.778	S	S	*	*			trans	-107.5	64.4	166.1	-73.3	-61.7	0	0	0	110.7
579	T	35	Very low	33.8	Very low	114 Å²	114	138.2 Å²	138.2	70%	0.699	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-73.2	122.9	169.3	-51.8	0	0	0	0	109.4	N581	T579-N581 PolarHBondContact O-N 3.29Å
580	Y	33.3	Very low	33.2	Very low	219 Å²	219	141.8 Å²	141.8	86%	0.859	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-65	129.4	172.7	-89.9	-111.2	0	0	0	110.5
581	N	37.9	Very low	33.3	Very low	158 Å²	158	144.9 Å²	144.9	85%	0.845	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-92.8	117.7	170.9	-94.6	-29.2	0	0	0	110.4	T579	T579-N581 PolarHBondContact O-N 3.29Å
582	V	32.5	Very low	33.7	Very low	115 Å²	115	143.6 Å²	143.6	70%	0.697	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-88.4	123.8	170	177.9	0	0	0	0	108.9
583	P	40.4	Very low	33.6	Very low	122 Å²	122	143.4 Å²	143.4	79%	0.792	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-76	122.1	169.5	-11.6	28.3	0	0	0	110.3
584	L	33.5	Very low	33.6	Very low	161 Å²	161	147.6 Å²	147.6	84%	0.843	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-83	145.6	166.1	-77.7	87.6	0	0	0	110.6
585	S	29.6	Very low	33.2	Very low	128 Å²	128	147.8 Å²	147.8	90%	0.895	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-71.6	143.2	172.5	-52.6	0	0	0	0	112.2
586	S	29	Very low	33.3	Very low	120 Å²	120	150.8 Å²	150.8	84%	0.839	80%	0.8	S	S	*	*			trans	-149	148.9	164	64.3	0	0	0	0	111.7
587	S	29	Very low	33	Very low	107 Å²	107	149.2 Å²	149.2	75%	0.748	81%	0.807	S	S	*	*			trans	-77.9	168.3	-166.4	54.2	0	0	0	0	116.8
588	F	27.4	Very low	32.8	Very low	198 Å²	198	147.9 Å²	147.9	87%	0.868	81%	0.813	S	S	*	*			trans	-23	145.8	158.1	-64.2	-84.5	0	0	0	116.4
589	P	37.8	Very low	32.7	Very low	123 Å²	123	143 Å²	143	80%	0.799	81%	0.811	S	S	*	*				-141.6	-170.1	85.1	40.5	-24.7	0	0	0	116.9
590	E	28.5	Very low	33.1	Very low	193 Å²	193	147 Å²	147	90%	0.902	82%	0.818	S	S	*	*			trans	-64.6	167.9	-159.1	-61.8	164.1	100.5	0	0	120
591	R	33.3	Very low	33.4	Very low	229 Å²	229	146.1 Å²	146.1	86%	0.864	82%	0.819	S	S	*	*			trans	-79.2	154.1	161.7	-97.3	179.9	-178.2	155.6	1.6	110.4
592	P	41	Very low	33.3	Very low	114 Å²	114	142.6 Å²	142.6	74%	0.74	81%	0.811	S	S	*	*				-153.3	154.8	69.8	39.1	-18.4	0	0	0	119.9
593	D	31	Very low	33.4	Very low	142 Å²	142	142.4 Å²	142.4	76%	0.759	82%	0.816	S	S	*	*			trans	54	157	139.5	-59.1	-13.9	0	0	0	126.1
594	L	30.6	Very low	33.3	Very low	154 Å²	154	147.8 Å²	147.8	81%	0.806	82%	0.82	S	S	*	*			trans	86.7	90.9	160.1	-52.6	-171.1	0	0	0	121.4
595	L	30.2	Very low	33.6	Very low	149 Å²	149	147.2 Å²	147.2	78%	0.78	82%	0.818	S	S	*	*				41.8	136.3	119	-76.3	174.8	0	0	0	123.3
596	L	32.2	Very low	34.3	Very low	159 Å²	159	151 Å²	151	83%	0.832	82%	0.818	S	S	*	*			trans	73.7	123.1	150.8	-64	159.9	0	0	0	119.8
597	S	31.2	Very low	34.6	Very low	125 Å²	125	154.9 Å²	154.9	87%	0.874	82%	0.82	S	S	*	*				-171.2	156.5	101.3	-161.2	0	0	0	0	114.6
598	A	30	Very low	35.4	Very low	100 Å²	100	157.8 Å²	157.8	83%	0.826	83%	0.826	S	S	*	*			trans	-78.3	159.3	-163.8	0	0	0	0	0	118.2
599	G	33.1	Very low	36	Very low	73 Å²	73	155.6 Å²	155.6	75%	0.753	82%	0.818	S	S	*	*			trans	-157.7	69.3	174.7	0	0	0	0	0	117.2
600	K	43.1	Very low	36.2	Very low	199 Å²	199	153.3 Å²	153.3	87%	0.865	80%	0.804	S	S	*	*			trans	16.8	139.4	148.4	-59.6	159.4	-173.6	165.1	0	118.3
601	K	39.5	Very low	37	Very low	200 Å²	200	148.5 Å²	148.5	87%	0.87	79%	0.791	S	S	*	*			cis	-177.7	175.7	8.3	-105.2	-175	173.4	-174.2	0	106.2
602	A	37	Very low	37.8	Very low	83 Å²	83	143.8 Å²	143.8	69%	0.686	78%	0.779	S	S	*	*			cis	178.9	165	-35.3	0	0	0	0	0	109.4
603	S	34	Very low	38.2	Very low	112 Å²	112	142.6 Å²	142.6	78%	0.783	77%	0.767	S	S	*	*			trans	76.3	145	-177.9	-138	0	0	0	0	115
604	R	38.2	Very low	39.1	Very low	234 Å²	234	142.4 Å²	142.4	88%	0.883	77%	0.765	S	S	*	*			cis	-142	153.9	10.5	-162.9	170.5	-176.2	172.9	1.8	112.8
605	D	40	Very low	40.1	Very low	149 Å²	149	141.4 Å²	141.4	80%	0.797	76%	0.76	S	S	*	*			trans	-67.3	139.6	-165.9	-49	-103	0	0	0	116.4
606	K	44.8	Very low	41.1	Very low	207 Å²	207	136 Å²	136	90%	0.9	73%	0.732	S	S	*	*			trans	-149.1	98.9	152.7	-106.6	176.4	-176.2	176	0	111.2
607	K	35.8	Very low	42.1	Very low	202 Å²	202	135.1 Å²	135.1	88%	0.878	72%	0.721	S	S	*	*			trans	43.3	123.1	152	-148	174.4	-173.5	-178.4	0	119.5
608	L	45.1	Very low	43.1	Very low	168 Å²	168	137.6 Å²	137.6	88%	0.88	72%	0.718	S	S	*	*			trans	-38.3	148	175.1	-64.2	157.6	0	0	0	116.9
609	Q	39.7	Very low	44.7	Very low	152 Å²	152	133.6 Å²	133.6	71%	0.71	69%	0.685	S	S	*	*			trans	73.4	145.7	-179	-60.8	-63.8	-11.6	0	0	114.9
610	P	42.8	Very low	47	Very low	75 Å²	75	133.1 Å²	133.1	49%	0.487	67%	0.67	S	S	.	*			cis	-120.4	138.1	17.6	38	-24.6	0	0	0	116.2	Q612 D613	P610-Q612 HydrophobicContact CB-CB 4.33Å; P610-Q612 PolarHBondContact O-N 3.01Å; P610-D613 HydrophobicContact CG-CB 4.05Å; P610-D613 VanDerWaalsContact CG-OD2 3.24Å; P610-D613 WeakPolarHBondContact CG-OD2 3.49Å
611	S	43.5	Very low	49.1	Very low	92 Å²	92	132.6 Å²	132.6	64%	0.643	66%	0.662	S	S	*	*	S	Bend	trans	-78.8	-0.4	161.7	49.2	0	0	0	0	113.7
612	Q	51.3	Low	51.6	Low	130 Å²	130	124 Å²	124	61%	0.607	63%	0.626	S	S	*	*	S	Bend	trans	-79.8	-34.8	-179.4	-140.2	76.2	24.1	0	0	113.5	P610 L614 L615 D616	P610-Q612 HydrophobicContact CB-CB 4.33Å; P610-Q612 PolarHBondContact O-N 3.01Å; Q612-L614 PolarHBondContact O-N 3.06Å; Q612-L614 VanDerWaalsContact O-N 3.17Å; Q612-L615 PolarHBondContact O-N 3.25Å; Q612-D616 PolarHBondContact O-N 3.35Å
613	D	48.5	Very low	54.2	Low	89 Å²	89	122 Å²	122	48%	0.476	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.6	-9.3	-168.8	-91.2	-23.7	0	0	0	115.2	P610 K617	P610-D613 HydrophobicContact CG-CB 4.05Å; P610-D613 VanDerWaalsContact CG-OD2 3.24Å; P610-D613 WeakPolarHBondContact CG-OD2 3.49Å; D613-K617 WeakPolarHBondContact O-CD 2.97Å; D613-K617 PolarHBondContact O-NZ 3.32Å
614	L	50	Low	56.9	Low	139 Å²	139	122.9 Å²	122.9	73%	0.728	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-44.8	172.7	-158.2	82.6	0	0	0	110.8	Q612 D616 K617	Q612-L614 PolarHBondContact O-N 3.06Å; Q612-L614 VanDerWaalsContact O-N 3.17Å; L614-D616 PolarHBondContact O-N 2.94Å; L614-K617 PolarHBondContact O-N 3.48Å
615	L	52.4	Low	59.4	Low	133 Å²	133	116.1 Å²	116.1	70%	0.696	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-63.9	-32.1	173.9	-97.4	67.9	0	0	0	111.8	Q612 K617 H618	Q612-L615 PolarHBondContact O-N 3.25Å; L615-K617 PolarHBondContact O-N 2.96Å; L615-H618 PolarHBondContact O-N 3.05Å
616	D	51	Low	61.9	Low	35 Å²	35	109.1 Å²	109.1	19%	0.187	53%	0.526	C	S	.	.	G	3₁₀ helix	trans	-76.3	-0.9	-178.4	-130.3	-18.7	0	0	0	114.5	Q612 L614 S619 R624 R627	Q612-D616 PolarHBondContact O-N 3.35Å; L614-D616 PolarHBondContact O-N 2.94Å; D616-S619 PolarHBondContact O-OG 2.91Å; D616-S619 WeakPolarHBondContact OD1-CB 3.45Å; D616-S619 PolarHBondContact OD1-OG 3.33Å; D616-R624 PolarHBondContact O-NH2 3.28Å; D616-R624 IonicContact OD1-NE 3.52Å; D616-R627 IonicContact OD1-CZ 3.46Å; D616-R627 IonicContact OD1-NH1 3.39Å; D616-R627 PolarHBondContact OD1-NH1 3.06Å; D616-R627 IonicContact OD2-NH1 2.6Å; D616-R627 PolarHBondContact OD2-NH1 2.83Å; D616-R627 VanDerWaalsContact OD2-NH1 3.12Å
617	K	52.1	Low	64	Low	140 Å²	140	104.6 Å²	104.6	61%	0.609	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-68.2	-34.8	168.4	-97.8	65.8	173.2	179.8	0	112.7	D613 L614 L615	D613-K617 WeakPolarHBondContact O-CD 2.97Å; D613-K617 PolarHBondContact O-NZ 3.32Å; L614-K617 PolarHBondContact O-N 3.48Å; L615-K617 PolarHBondContact O-N 2.96Å
618	H	52.8	Low	66.7	Low	177 Å²	177	98.8 Å²	98.8	82%	0.819	49%	0.493	S	S	*	.	S	Bend	trans	-101.9	9.2	-175.1	-59.7	-81	0	0	0	113.2	L615	L615-H618 PolarHBondContact O-N 3.05Å
619	S	63.5	Low	68.8	Low	17 Å²	17	94.4 Å²	94.4	12%	0.119	47%	0.469	C	S	.	.			trans	-72.8	133	172.8	65.1	0	0	0	0	110.9	D616 R624	D616-S619 PolarHBondContact O-OG 2.91Å; D616-S619 WeakPolarHBondContact OD1-CB 3.45Å; D616-S619 PolarHBondContact OD1-OG 3.33Å; S619-R624 PolarHBondContact OG-NE 3.46Å
620	S	80.9	Confident	71.2	Confident	63 Å²	63	95.7 Å²	95.7	44%	0.441	47%	0.472	S	S	.	.			trans	-60.8	152.5	172.6	74.3	0	0	0	0	110.9	D622 E623 R624	S620-D622 PolarHBondContact O-N 3.42Å; S620-D622 VanDerWaalsContact O-N 3.07Å; S620-E623 WeakPolarHBondContact O-CB 3.28Å; S620-E623 PolarHBondContact O-N 2.91Å; S620-E623 VanDerWaalsContact OG-CB 3.24Å; S620-E623 WeakPolarHBondContact OG-CB 3.27Å; S620-E623 PolarHBondContact OG-N 3.29Å; S620-R624 PolarHBondContact O-N 3.05Å
621	R	88.6	Confident	73.5	Confident	188 Å²	188	92.9 Å²	92.9	71%	0.709	45%	0.453	S	S	*	.	H	α-helix	trans	-48.2	-39.8	176.8	-179	-176.9	-177.4	-170.9	3.9	112.6	R625	R621-R625 WeakPolarHBondContact O-CD 3.42Å; R621-R625 VanDerWaalsContact O-CG 3.28Å; R621-R625 WeakPolarHBondContact O-CG 3.38Å; R621-R625 PolarHBondContact O-N 3.48Å
622	D	91.1	Very high	75.6	Confident	20 Å²	20	92 Å²	92	11%	0.107	45%	0.445	C	S	.	.	H	α-helix	trans	-79.3	-28.9	179.8	-78.1	-32	0	0	0	113.4	S620 R625 A626 N635 I666 R669	S620-D622 PolarHBondContact O-N 3.42Å; S620-D622 VanDerWaalsContact O-N 3.07Å; D622-R625 WeakPolarHBondContact O-CB 3.45Å; D622-R625 PolarHBondContact O-N 3.49Å; D622-R625 WeakPolarHBondContact OD1-CD 3.26Å; D622-R625 IonicContact OD1-NH1 2.68Å; D622-R625 PolarHBondContact OD1-NH1 3.41Å; D622-A626 WeakPolarHBondContact O-CB 3.38Å; D622-A626 PolarHBondContact O-N 3.23Å; D622-N635 VanDerWaalsContact CB-ND2 3.34Å; D622-N635 WeakPolarHBondContact CB-ND2 3.43Å; D622-I666 HydrophobicContact CB-CD1 4Å; D622-I666 HydrophobicContact CB-CG1 3.79Å; D622-I666 HydrophobicContact CB-CG2 4.23Å; D622-R669 IonicContact OD1-CZ 3.84Å; D622-R669 IonicContact OD1-NE 2.77Å; D622-R669 PolarHBondContact OD1-NE 3.09Å; D622-R669 IonicContact OD1-NH2 3.12Å; D622-R669 PolarHBondContact OD1-NH2 3.35Å; D622-R669 IonicContact OD2-CZ 2.8Å; D622-R669 IonicContact OD2-NE 3.24Å; D622-R669 PolarHBondContact OD2-NE 2.7Å; D622-R669 IonicContact OD2-NH2 2.84Å; D622-R669 PolarHBondContact OD2-NH2 2.88Å
623	E	91.3	Very high	77.4	Confident	40 Å²	40	86.9 Å²	86.9	19%	0.187	42%	0.421	C	S	.	.	H	α-helix	trans	-68.7	-43.3	176.1	168.1	70.1	-159.6	0	0	109.6	S620 R625 A626 R627 N635	S620-E623 WeakPolarHBondContact O-CB 3.28Å; S620-E623 PolarHBondContact O-N 2.91Å; S620-E623 VanDerWaalsContact OG-CB 3.24Å; S620-E623 WeakPolarHBondContact OG-CB 3.27Å; S620-E623 PolarHBondContact OG-N 3.29Å; E623-R625 VanDerWaalsContact C-N 3.3Å; E623-R625 PolarHBondContact O-N 3.37Å; E623-A626 PolarHBondContact O-N 3.19Å; E623-R627 WeakPolarHBondContact O-CG 3.26Å; E623-R627 PolarHBondContact O-N 3.03Å; E623-R627 IonicContact OE1-CZ 2.64Å; E623-R627 VanDerWaalsContact OE1-CZ 3.24Å; E623-R627 IonicContact OE1-NE 3.11Å; E623-R627 PolarHBondContact OE1-NE 3.28Å; E623-R627 IonicContact OE1-NH2 3.79Å; E623-R627 PolarHBondContact OE1-NH2 3.03Å; E623-N635 WeakPolarHBondContact CA-ND2 3.4Å; E623-N635 PolarHBondContact N-ND2 2.84Å; E623-N635 PolarHBondContact OE2-N 2.98Å
624	R	90.7	Very high	79.5	Confident	130 Å²	130	85.1 Å²	85.1	49%	0.491	42%	0.416	S	S	.	.	H	α-helix	trans	-62	-37.8	172.8	-162.6	179.2	-64.2	163	3.4	112	D616 S619 S620 A628	D616-R624 PolarHBondContact O-NH2 3.28Å; D616-R624 IonicContact OD1-NE 3.52Å; S619-R624 PolarHBondContact OG-NE 3.46Å; S620-R624 PolarHBondContact O-N 3.05Å; R624-A628 WeakPolarHBondContact O-CB 3.41Å; R624-A628 PolarHBondContact O-N 2.68Å
625	R	90.7	Very high	81.5	Confident	92 Å²	92	79.2 Å²	79.2	35%	0.347	39%	0.385	S	S	.	.	H	α-helix	trans	-65.2	-42.4	172.4	-75.1	165.6	157.3	-168.7	-13	112.4	R621 D622 E623 A628 M629 L662	R621-R625 WeakPolarHBondContact O-CD 3.42Å; R621-R625 VanDerWaalsContact O-CG 3.28Å; R621-R625 WeakPolarHBondContact O-CG 3.38Å; R621-R625 PolarHBondContact O-N 3.48Å; D622-R625 WeakPolarHBondContact O-CB 3.45Å; D622-R625 PolarHBondContact O-N 3.49Å; D622-R625 WeakPolarHBondContact OD1-CD 3.26Å; D622-R625 IonicContact OD1-NH1 2.68Å; D622-R625 PolarHBondContact OD1-NH1 3.41Å; E623-R625 VanDerWaalsContact C-N 3.3Å; E623-R625 PolarHBondContact O-N 3.37Å; R625-A628 PolarHBondContact O-N 3.27Å; R625-M629 PolarHBondContact O-N 2.99Å; R625-L662 HydrophobicContact CB-CD1 4.36Å; R625-L662 HydrophobicContact CB-CD2 4.21Å
626	A	92.6	Very high	83.4	Confident	3 Å²	3	77.9 Å²	77.9	3%	0.025	38%	0.378	C	S	.	.	H	α-helix	trans	-64.4	-42.3	-179.5	0	0	0	0	0	112	D622 E623 M629 K630 I631 N635 I666	D622-A626 WeakPolarHBondContact O-CB 3.38Å; D622-A626 PolarHBondContact O-N 3.23Å; E623-A626 PolarHBondContact O-N 3.19Å; A626-M629 CarbonylContact O-C 3.52Å; A626-M629 PolarHBondContact O-N 3.42Å; A626-K630 PolarHBondContact O-N 3.04Å; A626-K630 VanDerWaalsContact O-N 3.12Å; A626-I631 HydrophobicContact CB-CB 4.3Å; A626-I631 HydrophobicContact CB-CD1 4.01Å; A626-I631 PolarHBondContact O-N 3.08Å; A626-N635 WeakPolarHBondContact CB-OD1 3.29Å; A626-I666 HydrophobicContact CB-CD1 4.11Å
627	R	90.4	Very high	85.4	Confident	112 Å²	112	81.7 Å²	81.7	42%	0.423	39%	0.393	S	S	.	.	H	α-helix	trans	-65.9	-40.1	173	-64	-173.7	-146.7	143.7	0.3	112.9	D616 E623 M629 K630	D616-R627 IonicContact OD1-CZ 3.46Å; D616-R627 IonicContact OD1-NH1 3.39Å; D616-R627 PolarHBondContact OD1-NH1 3.06Å; D616-R627 IonicContact OD2-NH1 2.6Å; D616-R627 PolarHBondContact OD2-NH1 2.83Å; D616-R627 VanDerWaalsContact OD2-NH1 3.12Å; E623-R627 WeakPolarHBondContact O-CG 3.26Å; E623-R627 PolarHBondContact O-N 3.03Å; E623-R627 IonicContact OE1-CZ 2.64Å; E623-R627 VanDerWaalsContact OE1-CZ 3.24Å; E623-R627 IonicContact OE1-NE 3.11Å; E623-R627 PolarHBondContact OE1-NE 3.28Å; E623-R627 IonicContact OE1-NH2 3.79Å; E623-R627 PolarHBondContact OE1-NH2 3.03Å; R627-M629 VanDerWaalsContact C-N 3.27Å; R627-M629 PolarHBondContact O-N 2.91Å; R627-K630 WeakPolarHBondContact O-CA 3.43Å; R627-K630 PolarHBondContact O-N 3.39Å
628	A	92.4	Very high	87.3	Confident	80 Å²	80	75 Å²	75	66%	0.661	36%	0.364	S	S	*	.	H	α-helix	trans	-59.7	-39.1	175.3	0	0	0	0	0	112	R624 R625 K630	R624-A628 WeakPolarHBondContact O-CB 3.41Å; R624-A628 PolarHBondContact O-N 2.68Å; R625-A628 PolarHBondContact O-N 3.27Å; A628-K630 VanDerWaalsContact C-N 3.26Å; A628-K630 PolarHBondContact O-N 3.09Å
629	M	89.3	Confident	89.3	Confident	76 Å²	76	67.5 Å²	67.5	37%	0.374	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	9.9	172.8	-65.9	-62.2	-71.5	0	0	113.9	R625 A626 R627 I631 A658 Q659 L662	R625-M629 PolarHBondContact O-N 2.99Å; A626-M629 CarbonylContact O-C 3.52Å; A626-M629 PolarHBondContact O-N 3.42Å; R627-M629 VanDerWaalsContact C-N 3.27Å; R627-M629 PolarHBondContact O-N 2.91Å; M629-I631 VanDerWaalsContact C-N 3.27Å; M629-I631 HydrophobicContact CB-CD1 4.48Å; M629-I631 HydrophobicContact CB-CG1 4.35Å; M629-I631 PolarHBondContact O-N 3.33Å; M629-A658 HydrophobicContact CE-CB 3.93Å; M629-Q659 HydrophobicContact CB-CG 4.24Å; M629-Q659 HydrophobicContact CE-CG 4.08Å; M629-Q659 PolarHBondContact O-NE2 3.15Å; M629-L662 HydrophobicContact CB-CD2 3.94Å; M629-L662 HydrophobicContact CG-CD2 3.59Å
630	K	89.3	Confident	90.7	Very high	179 Å²	179	71 Å²	71	78%	0.778	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	40.4	178.9	-59	-178.2	179.4	177.8	0	114.4	A626 R627 A628	A626-K630 PolarHBondContact O-N 3.04Å; A626-K630 VanDerWaalsContact O-N 3.12Å; R627-K630 WeakPolarHBondContact O-CA 3.43Å; R627-K630 PolarHBondContact O-N 3.39Å; A628-K630 VanDerWaalsContact C-N 3.26Å; A628-K630 PolarHBondContact O-N 3.09Å
631	I	90.9	Very high	91.4	Very high	16 Å²	16	69.8 Å²	69.8	8%	0.082	34%	0.336	C	S	.	.			trans	-68.2	130.3	175.4	-67.2	171.8	0	0	0	108.9	A626 M629 F633 I638 Q659 L662 I663	A626-I631 HydrophobicContact CB-CB 4.3Å; A626-I631 HydrophobicContact CB-CD1 4.01Å; A626-I631 PolarHBondContact O-N 3.08Å; M629-I631 VanDerWaalsContact C-N 3.27Å; M629-I631 HydrophobicContact CB-CD1 4.48Å; M629-I631 HydrophobicContact CB-CG1 4.35Å; M629-I631 PolarHBondContact O-N 3.33Å; I631-F633 HydrophobicContact CG2-CD1 4.49Å; I631-F633 HydrophobicContact CG2-CD2 3.55Å; I631-F633 HydrophobicContact CG2-CE1 4.32Å; I631-F633 HydrophobicContact CG2-CE2 3.34Å; I631-F633 HydrophobicContact CG2-CG 4.14Å; I631-F633 HydrophobicContact CG2-CZ 3.78Å; I631-F633 PolarHBondContact O-N 3.47Å; I631-I638 HydrophobicContact CG2-CD1 4.37Å; I631-Q659 HydrophobicContact CG1-CG 4.4Å; I631-L662 HydrophobicContact CD1-CD2 3.99Å; I631-L662 HydrophobicContact CD1-CG 4.36Å; I631-I663 HydrophobicContact CD1-CD1 4.06Å; I631-I663 HydrophobicContact CD1-CG1 3.49Å; I631-I663 VanDerWaalsContact CD1-CG1 3.49Å; I631-I663 HydrophobicContact CG1-CD1 4.32Å; I631-I663 HydrophobicContact CG1-CG1 4.27Å; I631-I663 HydrophobicContact CG2-CD1 4.28Å; I631-I663 HydrophobicContact CG2-CG1 4.31Å
632	P	87.6	Confident	91.6	Very high	74 Å²	74	63.6 Å²	63.6	48%	0.481	32%	0.32	S	S	.	.	S	Bend	trans	-82.4	12.7	-169.3	32.4	-35.5	0	0	0	114.9	H653	P632-H653 HydrophobicContact CG-CB 4.33Å
633	F	90.1	Very high	91.7	Very high	21 Å²	21	66 Å²	66	9%	0.092	34%	0.335	C	S	.	.	S	Bend	trans	-147.6	155.2	-178.3	42.4	-104.9	0	0	0	111.3	I631 I638 L649 L650 H653 L655 I663	I631-F633 HydrophobicContact CG2-CD1 4.49Å; I631-F633 HydrophobicContact CG2-CD2 3.55Å; I631-F633 HydrophobicContact CG2-CE1 4.32Å; I631-F633 HydrophobicContact CG2-CE2 3.34Å; I631-F633 HydrophobicContact CG2-CG 4.14Å; I631-F633 HydrophobicContact CG2-CZ 3.78Å; I631-F633 PolarHBondContact O-N 3.47Å; F633-I638 HydrophobicContact CD2-CD1 3.95Å; F633-I638 HydrophobicContact CD2-CG1 3.65Å; F633-I638 HydrophobicContact CE2-CD1 3.82Å; F633-I638 HydrophobicContact CE2-CG1 3.61Å; F633-L649 HydrophobicContact CB-CD2 4.41Å; F633-L649 HydrophobicContact CD1-CD1 3.98Å; F633-L649 HydrophobicContact CD1-CD2 3.84Å; F633-L649 HydrophobicContact CD1-CG 3.86Å; F633-L649 HydrophobicContact CD2-CD2 4.09Å; F633-L649 HydrophobicContact CE1-CD1 4.4Å; F633-L649 HydrophobicContact CE1-CD2 4.08Å; F633-L649 HydrophobicContact CE1-CG 3.89Å; F633-L649 HydrophobicContact CE2-CD2 4.3Å; F633-L649 HydrophobicContact CG-CD2 3.85Å; F633-L649 HydrophobicContact CG-CG 4.38Å; F633-L649 HydrophobicContact CZ-CD2 4.29Å; F633-L649 HydrophobicContact CZ-CG 4.43Å; F633-L650 HydrophobicContact CZ-CD2 4.1Å; F633-H653 AromaticContact CD1-CD2 3.62Å; F633-H653 AromaticContact CD1-NE2 3.78Å; F633-H653 AromaticContact CE1-CD2 3.49Å; F633-H653 VanDerWaalsContact CE1-CD2 3.49Å; F633-H653 WeakPolarHBondContact CE1-CD2 3.39Å; F633-L655 HydrophobicContact CE1-CD1 4.24Å; F633-L655 HydrophobicContact CZ-CD1 4.04Å; F633-I663 HydrophobicContact CE2-CD1 4.06Å; F633-I663 HydrophobicContact CE2-CG1 4.26Å; F633-I663 HydrophobicContact CE2-CG2 4.33Å; F633-I663 HydrophobicContact CZ-CD1 3.78Å; F633-I663 HydrophobicContact CZ-CG1 4.48Å
634	S	91.7	Very high	91.8	Very high	53 Å²	53	70 Å²	70	37%	0.371	35%	0.354	S	S	.	.			trans	-74.7	156.8	-175	56.4	0	0	0	0	113.6	D636 K637 I638	S634-D636 PolarHBondContact O-N 3.3Å; S634-K637 PolarHBondContact O-N 3.14Å; S634-I638 PolarHBondContact O-N 3.45Å
635	N	92.5	Very high	91.9	Very high	15 Å²	15	68.8 Å²	68.8	8%	0.08	35%	0.354	C	S	.	.	H	α-helix	trans	-57.8	-33.4	175.3	-85.6	17	0	0	0	114.2	D622 E623 A626 K637 I638 V639	D622-N635 VanDerWaalsContact CB-ND2 3.34Å; D622-N635 WeakPolarHBondContact CB-ND2 3.43Å; E623-N635 WeakPolarHBondContact CA-ND2 3.4Å; E623-N635 PolarHBondContact N-ND2 2.84Å; E623-N635 PolarHBondContact OE2-N 2.98Å; A626-N635 WeakPolarHBondContact CB-OD1 3.29Å; N635-K637 VanDerWaalsContact C-N 3.34Å; N635-K637 PolarHBondContact O-N 3.31Å; N635-I638 WeakPolarHBondContact O-CB 3.49Å; N635-I638 PolarHBondContact O-N 3.49Å; N635-I638 VanDerWaalsContact O-N 3.13Å; N635-V639 WeakPolarHBondContact O-CG2 3.21Å; N635-V639 PolarHBondContact O-N 2.98Å
636	D	91.5	Very high	92.1	Very high	105 Å²	105	64.8 Å²	64.8	56%	0.561	34%	0.339	S	S	*	.	H	α-helix	trans	-58.5	-47.4	178.9	-168.1	85.1	0	0	0	111.4	S634 I638 V639 N640	S634-D636 PolarHBondContact O-N 3.3Å; D636-I638 VanDerWaalsContact C-N 3.33Å; D636-I638 PolarHBondContact O-N 3.05Å; D636-V639 PolarHBondContact O-N 2.94Å; D636-N640 WeakPolarHBondContact O-CB 3.25Å; D636-N640 PolarHBondContact O-N 3.04Å; D636-N640 PolarHBondContact O-ND2 2.93Å; D636-N640 PolarHBondContact OD1-ND2 2.78Å; D636-N640 PolarHBondContact OD2-ND2 3.07Å
637	K	92.8	Very high	92.1	Very high	115 Å²	115	68.9 Å²	68.9	50%	0.5	36%	0.361	S	S	.	.	H	α-helix	trans	-61	-39.9	174.1	-67.2	-173.8	175.9	-171.1	0	112.2	S634 N635 V639 L641	S634-K637 PolarHBondContact O-N 3.14Å; N635-K637 VanDerWaalsContact C-N 3.34Å; N635-K637 PolarHBondContact O-N 3.31Å; K637-V639 VanDerWaalsContact C-N 3.28Å; K637-V639 PolarHBondContact O-N 3.49Å; K637-L641 HydrophobicContact CB-CD1 4.02Å; K637-L641 HydrophobicContact CB-CG 4.44Å; K637-L641 WeakPolarHBondContact O-CB 3.38Å; K637-L641 WeakPolarHBondContact O-CD1 3.3Å; K637-L641 VanDerWaalsContact O-CG 3.25Å; K637-L641 WeakPolarHBondContact O-CG 3.44Å; K637-L641 PolarHBondContact O-N 3.36Å
638	I	93.4	Very high	92.2	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-58.7	-41.4	177.3	-66.4	174.6	0	0	0	111.3	I631 F633 S634 N635 D636 F646 I663 I666 R667	I631-I638 HydrophobicContact CG2-CD1 4.37Å; F633-I638 HydrophobicContact CD2-CD1 3.95Å; F633-I638 HydrophobicContact CD2-CG1 3.65Å; F633-I638 HydrophobicContact CE2-CD1 3.82Å; F633-I638 HydrophobicContact CE2-CG1 3.61Å; S634-I638 PolarHBondContact O-N 3.45Å; N635-I638 WeakPolarHBondContact O-CB 3.49Å; N635-I638 PolarHBondContact O-N 3.49Å; N635-I638 VanDerWaalsContact O-N 3.13Å; D636-I638 VanDerWaalsContact C-N 3.33Å; D636-I638 PolarHBondContact O-N 3.05Å; I638-F646 HydrophobicContact CG2-CE2 4.35Å; I638-I663 HydrophobicContact CD1-CG1 4.28Å; I638-I663 HydrophobicContact CD1-CG2 4.1Å; I638-I663 HydrophobicContact CG1-CG2 4.03Å; I638-I663 HydrophobicContact CG2-CG2 3.79Å; I638-I663 WeakPolarHBondContact CG2-O 3.45Å; I638-I666 HydrophobicContact CB-CG2 4.36Å; I638-I666 HydrophobicContact CD1-CG2 4.38Å; I638-I666 HydrophobicContact CG2-CB 4.08Å; I638-I666 HydrophobicContact CG2-CG2 3.76Å; I638-R667 HydrophobicContact CG2-CB 3.75Å; I638-R667 WeakPolarHBondContact O-CD 3.5Å; I638-R667 WeakPolarHBondContact O-CG 3.5Å; I638-R667 PolarHBondContact O-NE 3.34Å
639	V	93.6	Very high	92.1	Very high	19 Å²	19	66.3 Å²	66.3	12%	0.115	34%	0.341	C	S	.	.	H	α-helix	trans	-82.7	-49	-175.4	179.2	0	0	0	0	111.9	N635 D636 K637 K671	N635-V639 WeakPolarHBondContact O-CG2 3.21Å; N635-V639 PolarHBondContact O-N 2.98Å; D636-V639 PolarHBondContact O-N 2.94Å; K637-V639 VanDerWaalsContact C-N 3.28Å; K637-V639 PolarHBondContact O-N 3.49Å; V639-K671 HydrophobicContact CG1-CG 4.46Å; V639-K671 VanDerWaalsContact O-CE 3.32Å; V639-K671 WeakPolarHBondContact O-CE 3.42Å
640	N	94.3	Very high	92.3	Very high	91 Å²	91	63.9 Å²	63.9	49%	0.487	33%	0.329	S	S	.	.	H	α-helix	trans	-89	-24.8	-162.7	-63	-20.7	0	0	0	114.8	D636	D636-N640 WeakPolarHBondContact O-CB 3.25Å; D636-N640 PolarHBondContact O-N 3.04Å; D636-N640 PolarHBondContact O-ND2 2.93Å; D636-N640 PolarHBondContact OD1-ND2 2.78Å; D636-N640 PolarHBondContact OD2-ND2 3.07Å
641	L	94.4	Very high	92.3	Very high	36 Å²	36	59.2 Å²	59.2	19%	0.188	32%	0.324	C	S	.	.	S	Bend	trans	-58.2	149	179.7	-78.8	170	0	0	0	111.8	K637 E645 F646 L649 R667	K637-L641 HydrophobicContact CB-CD1 4.02Å; K637-L641 HydrophobicContact CB-CG 4.44Å; K637-L641 WeakPolarHBondContact O-CB 3.38Å; K637-L641 WeakPolarHBondContact O-CD1 3.3Å; K637-L641 VanDerWaalsContact O-CG 3.25Å; K637-L641 WeakPolarHBondContact O-CG 3.44Å; K637-L641 PolarHBondContact O-N 3.36Å; L641-E645 HydrophobicContact CD2-CB 4.05Å; L641-E645 VanDerWaalsContact CD2-OE2 3.28Å; L641-E645 WeakPolarHBondContact CD2-OE2 3.47Å; L641-F646 HydrophobicContact CB-CB 4.13Å; L641-L649 HydrophobicContact CD1-CD2 3.7Å; L641-R667 PolarHBondContact O-NH2 2.87Å
642	P	93.4	Very high	92.2	Very high	58 Å²	58	65.1 Å²	65.1	38%	0.377	35%	0.349	S	S	.	.			trans	-54.3	168.6	163.9	-28.9	39.1	0	0	0	113	E645 F646 R667	P642-E645 HydrophobicContact CG-CG 4.48Å; P642-E645 WeakPolarHBondContact CG-OE1 3.28Å; P642-F646 WeakPolarHBondContact O-CB 3.36Å; P642-F646 PolarHBondContact O-N 3Å; P642-R667 VanDerWaalsContact C-NH2 3.31Å; P642-R667 PolarHBondContact O-NH2 2.86Å
643	V	92.3	Very high	92.2	Very high	70 Å²	70	64.8 Å²	64.8	42%	0.424	34%	0.341	S	S	.	.	H	α-helix	trans	-75.7	-31.4	-177	65.6	0	0	0	0	111.7	N647	V643-N647 WeakPolarHBondContact O-CB 3.27Å; V643-N647 PolarHBondContact O-N 3.49Å; V643-N647 PolarHBondContact O-ND2 2.9Å; V643-N647 PolarHBondContact O-OD1 3.49Å
644	E	93.8	Very high	92.1	Very high	125 Å²	125	73.3 Å²	73.3	58%	0.584	38%	0.381	S	S	*	.	H	α-helix	trans	-63.9	-63.4	176.1	-60.9	66.3	-148	0	0	110.5	F646 N647 E648	E644-F646 VanDerWaalsContact C-N 3.26Å; E644-F646 PolarHBondContact O-N 2.93Å; E644-N647 WeakPolarHBondContact O-CB 3.32Å; E644-N647 PolarHBondContact O-N 3.45Å; E644-E648 PolarHBondContact O-N 3.4Å
645	E	93.7	Very high	92	Very high	105 Å²	105	72.1 Å²	72.1	49%	0.491	37%	0.37	S	S	.	.	H	α-helix	trans	-60.2	-34.9	179.5	-65.3	177.8	-134.3	0	0	112.7	L641 P642 E648 L649	L641-E645 HydrophobicContact CD2-CB 4.05Å; L641-E645 VanDerWaalsContact CD2-OE2 3.28Å; L641-E645 WeakPolarHBondContact CD2-OE2 3.47Å; P642-E645 HydrophobicContact CG-CG 4.48Å; P642-E645 WeakPolarHBondContact CG-OE1 3.28Å; E645-E648 PolarHBondContact O-N 2.68Å; E645-L649 WeakPolarHBondContact O-CB 3.26Å; E645-L649 PolarHBondContact O-N 3.26Å
646	F	93.8	Very high	92.1	Very high	8 Å²	8	74 Å²	74	4%	0.035	39%	0.385	C	S	.	.	H	α-helix	trans	-66.5	-42.2	173.6	172.2	-90.1	0	0	0	112	I638 L641 P642 E644 E648 L649 L650 I663 R667	I638-F646 HydrophobicContact CG2-CE2 4.35Å; L641-F646 HydrophobicContact CB-CB 4.13Å; P642-F646 WeakPolarHBondContact O-CB 3.36Å; P642-F646 PolarHBondContact O-N 3Å; E644-F646 VanDerWaalsContact C-N 3.26Å; E644-F646 PolarHBondContact O-N 2.93Å; F646-E648 VanDerWaalsContact C-N 3.33Å; F646-L649 WeakPolarHBondContact O-CB 3.49Å; F646-L649 PolarHBondContact O-N 3.3Å; F646-L650 HydrophobicContact CD1-CD1 4.05Å; F646-L650 HydrophobicContact CD1-CG 4.32Å; F646-L650 HydrophobicContact CE1-CD1 3.38Å; F646-L650 HydrophobicContact CE1-CG 4Å; F646-L650 HydrophobicContact CZ-CD1 3.72Å; F646-L650 HydrophobicContact CZ-CD2 4.39Å; F646-L650 HydrophobicContact CZ-CG 4.14Å; F646-L650 WeakPolarHBondContact O-CG 3.44Å; F646-L650 PolarHBondContact O-N 3.4Å; F646-I663 HydrophobicContact CE2-CG2 3.67Å; F646-I663 HydrophobicContact CZ-CG2 3.72Å; F646-R667 VanDerWaalsContact CG-CZ 3.41Å
647	N	92.2	Very high	92.1	Very high	88 Å²	88	77 Å²	77	47%	0.471	40%	0.395	S	S	.	.	H	α-helix	trans	-66.2	-37.8	176.3	-72.4	-18.2	0	0	0	111	V643 E644 L650 A651	V643-N647 WeakPolarHBondContact O-CB 3.27Å; V643-N647 PolarHBondContact O-N 3.49Å; V643-N647 PolarHBondContact O-ND2 2.9Å; V643-N647 PolarHBondContact O-OD1 3.49Å; E644-N647 WeakPolarHBondContact O-CB 3.32Å; E644-N647 PolarHBondContact O-N 3.45Å; N647-L650 PolarHBondContact O-N 3.06Å; N647-A651 WeakPolarHBondContact O-CB 3.34Å; N647-A651 PolarHBondContact O-N 3.47Å
648	E	93.2	Very high	92.1	Very high	107 Å²	107	74.2 Å²	74.2	50%	0.5	39%	0.394	S	S	.	.	H	α-helix	trans	-61.1	-44.4	169.3	-79.3	-166.1	-149.5	0	0	112.6	E644 E645 F646 L650 A651 K652	E644-E648 PolarHBondContact O-N 3.4Å; E645-E648 PolarHBondContact O-N 2.68Å; F646-E648 VanDerWaalsContact C-N 3.33Å; E648-L650 VanDerWaalsContact C-N 3.3Å; E648-L650 PolarHBondContact O-N 3.14Å; E648-A651 PolarHBondContact O-N 3.39Å; E648-K652 WeakPolarHBondContact O-CB 3.38Å; E648-K652 WeakPolarHBondContact O-CD 3.33Å; E648-K652 WeakPolarHBondContact O-CG 3.24Å; E648-K652 PolarHBondContact O-N 3.11Å; E648-K652 WeakPolarHBondContact OE2-CE 3.23Å; E648-K652 IonicContact OE2-NZ 2.99Å; E648-K652 PolarHBondContact OE2-NZ 3.45Å
649	L	91.3	Very high	92.2	Very high	31 Å²	31	75.7 Å²	75.7	16%	0.162	40%	0.401	C	S	.	.	H	α-helix	trans	-60.3	-41.4	176.9	-175.7	69	0	0	0	111.1	F633 L641 E645 F646 H653	F633-L649 HydrophobicContact CB-CD2 4.41Å; F633-L649 HydrophobicContact CD1-CD1 3.98Å; F633-L649 HydrophobicContact CD1-CD2 3.84Å; F633-L649 HydrophobicContact CD1-CG 3.86Å; F633-L649 HydrophobicContact CD2-CD2 4.09Å; F633-L649 HydrophobicContact CE1-CD1 4.4Å; F633-L649 HydrophobicContact CE1-CD2 4.08Å; F633-L649 HydrophobicContact CE1-CG 3.89Å; F633-L649 HydrophobicContact CE2-CD2 4.3Å; F633-L649 HydrophobicContact CG-CD2 3.85Å; F633-L649 HydrophobicContact CG-CG 4.38Å; F633-L649 HydrophobicContact CZ-CD2 4.29Å; F633-L649 HydrophobicContact CZ-CG 4.43Å; L641-L649 HydrophobicContact CD1-CD2 3.7Å; E645-L649 WeakPolarHBondContact O-CB 3.26Å; E645-L649 PolarHBondContact O-N 3.26Å; F646-L649 WeakPolarHBondContact O-CB 3.49Å; F646-L649 PolarHBondContact O-N 3.3Å; L649-H653 PolarHBondContact O-CD2 3.43Å; L649-H653 VanDerWaalsContact O-CD2 3.22Å
650	L	91.8	Very high	92.2	Very high	25 Å²	25	76.7 Å²	76.7	13%	0.131	41%	0.405	C	S	.	.	H	α-helix	trans	-66.5	-38.9	173.8	-67.5	-171.5	0	0	0	112.6	F633 F646 N647 E648 H653 L655 L660 I663	F633-L650 HydrophobicContact CZ-CD2 4.1Å; F646-L650 HydrophobicContact CD1-CD1 4.05Å; F646-L650 HydrophobicContact CD1-CG 4.32Å; F646-L650 HydrophobicContact CE1-CD1 3.38Å; F646-L650 HydrophobicContact CE1-CG 4Å; F646-L650 HydrophobicContact CZ-CD1 3.72Å; F646-L650 HydrophobicContact CZ-CD2 4.39Å; F646-L650 HydrophobicContact CZ-CG 4.14Å; F646-L650 WeakPolarHBondContact O-CG 3.44Å; F646-L650 PolarHBondContact O-N 3.4Å; N647-L650 PolarHBondContact O-N 3.06Å; E648-L650 VanDerWaalsContact C-N 3.3Å; E648-L650 PolarHBondContact O-N 3.14Å; L650-H653 PolarHBondContact O-N 3.42Å; L650-L655 HydrophobicContact CD2-CD1 3.65Å; L650-L660 HydrophobicContact CB-CD2 4.49Å; L650-L660 HydrophobicContact CD1-CD2 4.07Å; L650-L660 HydrophobicContact CD2-CD2 3.86Å; L650-L660 HydrophobicContact CG-CD2 4.37Å; L650-I663 HydrophobicContact CD2-CD1 4Å; L650-I663 HydrophobicContact CD2-CG2 4.18Å
651	A	90	Very high	92.2	Very high	82 Å²	82	75 Å²	75	68%	0.678	40%	0.403	S	S	*	.	H	α-helix	trans	-69.7	-32.2	178.4	0	0	0	0	0	113	N647 E648 H653	N647-A651 WeakPolarHBondContact O-CB 3.34Å; N647-A651 PolarHBondContact O-N 3.47Å; E648-A651 PolarHBondContact O-N 3.39Å; A651-H653 VanDerWaalsContact C-N 3.27Å; A651-H653 PolarHBondContact O-N 2.95Å
652	K	89.3	Confident	92.2	Very high	140 Å²	140	74.5 Å²	74.5	61%	0.609	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-10.1	178.4	-70.7	163.4	-169.8	172.4	0	113.7	E648	E648-K652 WeakPolarHBondContact O-CB 3.38Å; E648-K652 WeakPolarHBondContact O-CD 3.33Å; E648-K652 WeakPolarHBondContact O-CG 3.24Å; E648-K652 PolarHBondContact O-N 3.11Å; E648-K652 WeakPolarHBondContact OE2-CE 3.23Å; E648-K652 IonicContact OE2-NZ 2.99Å; E648-K652 PolarHBondContact OE2-NZ 3.45Å
653	H	87.8	Confident	92.2	Very high	66 Å²	66	71.7 Å²	71.7	31%	0.306	38%	0.383	S	S	.	.	S	Bend	trans	-123.3	125.7	-179.4	-71.2	-63.8	0	0	0	112	P632 F633 L649 L650 A651 L655	P632-H653 HydrophobicContact CG-CB 4.33Å; F633-H653 AromaticContact CD1-CD2 3.62Å; F633-H653 AromaticContact CD1-NE2 3.78Å; F633-H653 AromaticContact CE1-CD2 3.49Å; F633-H653 VanDerWaalsContact CE1-CD2 3.49Å; F633-H653 WeakPolarHBondContact CE1-CD2 3.39Å; L649-H653 PolarHBondContact O-CD2 3.43Å; L649-H653 VanDerWaalsContact O-CD2 3.22Å; L650-H653 PolarHBondContact O-N 3.42Å; A651-H653 VanDerWaalsContact C-N 3.27Å; A651-H653 PolarHBondContact O-N 2.95Å; H653-L655 VanDerWaalsContact C-N 3.31Å; H653-L655 HydrophobicContact CB-CD1 3.99Å; H653-L655 HydrophobicContact CB-CD2 4.47Å; H653-L655 HydrophobicContact CB-CG 3.9Å; H653-L655 PolarHBondContact O-N 3.48Å
654	H	87.3	Confident	92.3	Very high	200 Å²	200	76 Å²	76	93%	0.926	39%	0.391	S	S	*	.			trans	-71.4	84.7	174	-58.6	-46.8	0	0	0	111.1
655	L	90.8	Very high	92.3	Very high	28 Å²	28	72.1 Å²	72.1	15%	0.147	38%	0.375	C	S	.	.			trans	-99.9	136.8	-177.3	-65.4	162.6	0	0	0	110.8	F633 L650 H653 Q659 L660 I663	F633-L655 HydrophobicContact CE1-CD1 4.24Å; F633-L655 HydrophobicContact CZ-CD1 4.04Å; L650-L655 HydrophobicContact CD2-CD1 3.65Å; H653-L655 VanDerWaalsContact C-N 3.31Å; H653-L655 HydrophobicContact CB-CD1 3.99Å; H653-L655 HydrophobicContact CB-CD2 4.47Å; H653-L655 HydrophobicContact CB-CG 3.9Å; H653-L655 PolarHBondContact O-N 3.48Å; L655-Q659 HydrophobicContact CB-CB 4.35Å; L655-Q659 HydrophobicContact CD2-CB 4.19Å; L655-L660 HydrophobicContact CB-CD2 3.86Å; L655-L660 HydrophobicContact CB-CG 3.93Å; L655-L660 HydrophobicContact CD1-CD2 3.89Å; L655-I663 HydrophobicContact CD1-CD1 3.73Å; L655-I663 HydrophobicContact CD2-CD1 4.3Å
656	S	92.9	Very high	92.4	Very high	55 Å²	55	67.2 Å²	67.2	39%	0.385	35%	0.352	S	S	.	.			trans	-68.6	157	170.8	62.7	0	0	0	0	111.9	A658 Q659 L660	S656-A658 VanDerWaalsContact C-N 3.26Å; S656-A658 PolarHBondContact O-N 3.01Å; S656-Q659 WeakPolarHBondContact O-CA 3.31Å; S656-Q659 WeakPolarHBondContact O-CB 3.26Å; S656-Q659 PolarHBondContact O-N 3.44Å; S656-Q659 VanDerWaalsContact OG-CD 3.3Å; S656-Q659 WeakPolarHBondContact OG-CG 3.43Å; S656-Q659 PolarHBondContact OG-N 3.18Å; S656-Q659 PolarHBondContact OG-OE1 3.49Å; S656-L660 WeakPolarHBondContact O-CG 3.12Å; S656-L660 PolarHBondContact O-N 3.22Å
657	E	92.9	Very high	92.4	Very high	168 Å²	168	68 Å²	68	79%	0.785	36%	0.355	S	S	*	.	H	α-helix	trans	-54.5	-40.6	177.2	-175.2	172.8	-160.9	0	0	112.7	Q659 L660 A661	E657-Q659 PolarHBondContact O-N 3.13Å; E657-L660 PolarHBondContact O-N 3.47Å; E657-A661 WeakPolarHBondContact O-CB 3.46Å; E657-A661 PolarHBondContact O-N 2.92Å
658	A	93.1	Very high	92.6	Very high	57 Å²	57	70.5 Å²	70.5	47%	0.471	36%	0.357	S	S	.	.	H	α-helix	trans	-64.9	-35.9	176.1	0	0	0	0	0	113.1	M629 S656 L662	M629-A658 HydrophobicContact CE-CB 3.93Å; S656-A658 VanDerWaalsContact C-N 3.26Å; S656-A658 PolarHBondContact O-N 3.01Å; A658-L662 PolarHBondContact O-N 3.29Å; A658-L662 VanDerWaalsContact O-N 3.14Å
659	Q	94.3	Very high	92.6	Very high	31 Å²	31	68.9 Å²	68.9	15%	0.145	35%	0.347	C	S	.	.	H	α-helix	trans	-68.1	-45.1	171.6	-73	161.9	-50	0	0	110.7	M629 I631 L655 S656 E657 A661 L662 I663	M629-Q659 HydrophobicContact CB-CG 4.24Å; M629-Q659 HydrophobicContact CE-CG 4.08Å; M629-Q659 PolarHBondContact O-NE2 3.15Å; I631-Q659 HydrophobicContact CG1-CG 4.4Å; L655-Q659 HydrophobicContact CB-CB 4.35Å; L655-Q659 HydrophobicContact CD2-CB 4.19Å; S656-Q659 WeakPolarHBondContact O-CA 3.31Å; S656-Q659 WeakPolarHBondContact O-CB 3.26Å; S656-Q659 PolarHBondContact O-N 3.44Å; S656-Q659 VanDerWaalsContact OG-CD 3.3Å; S656-Q659 WeakPolarHBondContact OG-CG 3.43Å; S656-Q659 PolarHBondContact OG-N 3.18Å; S656-Q659 PolarHBondContact OG-OE1 3.49Å; E657-Q659 PolarHBondContact O-N 3.13Å; Q659-A661 VanDerWaalsContact C-N 3.35Å; Q659-A661 PolarHBondContact O-N 3.35Å; Q659-L662 PolarHBondContact O-N 3.1Å; Q659-I663 WeakPolarHBondContact O-CD1 3.27Å; Q659-I663 WeakPolarHBondContact O-CG1 3.43Å; Q659-I663 PolarHBondContact O-N 3.36Å
660	L	93.9	Very high	92.8	Very high	40 Å²	40	68.2 Å²	68.2	21%	0.209	35%	0.347	C	S	.	.	H	α-helix	trans	-61.7	-40.7	178.4	-68.1	172.4	0	0	0	112.3	L650 L655 S656 E657 I663 R664	L650-L660 HydrophobicContact CB-CD2 4.49Å; L650-L660 HydrophobicContact CD1-CD2 4.07Å; L650-L660 HydrophobicContact CD2-CD2 3.86Å; L650-L660 HydrophobicContact CG-CD2 4.37Å; L655-L660 HydrophobicContact CB-CD2 3.86Å; L655-L660 HydrophobicContact CB-CG 3.93Å; L655-L660 HydrophobicContact CD1-CD2 3.89Å; S656-L660 WeakPolarHBondContact O-CG 3.12Å; S656-L660 PolarHBondContact O-N 3.22Å; E657-L660 PolarHBondContact O-N 3.47Å; L660-I663 PolarHBondContact O-N 3.11Å; L660-R664 WeakPolarHBondContact O-CB 3.37Å; L660-R664 VanDerWaalsContact O-CG 3.27Å; L660-R664 WeakPolarHBondContact O-CG 3.38Å; L660-R664 PolarHBondContact O-N 3.44Å
661	A	93.8	Very high	92.9	Very high	54 Å²	54	71.5 Å²	71.5	45%	0.446	36%	0.36	S	S	.	.	H	α-helix	trans	-61	-47.6	173.3	0	0	0	0	0	111.5	E657 Q659 R664 D665	E657-A661 WeakPolarHBondContact O-CB 3.46Å; E657-A661 PolarHBondContact O-N 2.92Å; Q659-A661 VanDerWaalsContact C-N 3.35Å; Q659-A661 PolarHBondContact O-N 3.35Å; A661-R664 PolarHBondContact O-N 3.11Å; A661-D665 WeakPolarHBondContact O-CB 3.4Å; A661-D665 PolarHBondContact O-N 2.98Å
662	L	94.4	Very high	93.2	Very high	26 Å²	26	72.4 Å²	72.4	14%	0.136	35%	0.354	C	S	.	.	H	α-helix	trans	-60.8	-45.8	175.5	178.3	61.5	0	0	0	111.7	R625 M629 I631 A658 Q659 R664 D665 I666	R625-L662 HydrophobicContact CB-CD1 4.36Å; R625-L662 HydrophobicContact CB-CD2 4.21Å; M629-L662 HydrophobicContact CB-CD2 3.94Å; M629-L662 HydrophobicContact CG-CD2 3.59Å; I631-L662 HydrophobicContact CD1-CD2 3.99Å; I631-L662 HydrophobicContact CD1-CG 4.36Å; A658-L662 PolarHBondContact O-N 3.29Å; A658-L662 VanDerWaalsContact O-N 3.14Å; Q659-L662 PolarHBondContact O-N 3.1Å; L662-R664 PolarHBondContact O-N 3.27Å; L662-D665 PolarHBondContact O-N 3.15Å; L662-I666 HydrophobicContact CD1-CD1 3.85Å; L662-I666 HydrophobicContact CD1-CG1 3.92Å; L662-I666 HydrophobicContact CD2-CD1 4.34Å; L662-I666 HydrophobicContact CG-CD1 3.76Å; L662-I666 HydrophobicContact CG-CG1 4.21Å; L662-I666 VanDerWaalsContact O-CG1 3.26Å; L662-I666 WeakPolarHBondContact O-CG1 3.49Å; L662-I666 PolarHBondContact O-N 2.99Å
663	I	94.7	Very high	93.5	Very high	0 Å²	0	72.7 Å²	72.7	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-61.6	-43.4	-179.4	-64.6	156.5	0	0	0	111.1	I631 F633 I638 F646 L650 L655 Q659 L660 D665 I666 R667	I631-I663 HydrophobicContact CD1-CD1 4.06Å; I631-I663 HydrophobicContact CD1-CG1 3.49Å; I631-I663 VanDerWaalsContact CD1-CG1 3.49Å; I631-I663 HydrophobicContact CG1-CD1 4.32Å; I631-I663 HydrophobicContact CG1-CG1 4.27Å; I631-I663 HydrophobicContact CG2-CD1 4.28Å; I631-I663 HydrophobicContact CG2-CG1 4.31Å; F633-I663 HydrophobicContact CE2-CD1 4.06Å; F633-I663 HydrophobicContact CE2-CG1 4.26Å; F633-I663 HydrophobicContact CE2-CG2 4.33Å; F633-I663 HydrophobicContact CZ-CD1 3.78Å; F633-I663 HydrophobicContact CZ-CG1 4.48Å; I638-I663 HydrophobicContact CD1-CG1 4.28Å; I638-I663 HydrophobicContact CD1-CG2 4.1Å; I638-I663 HydrophobicContact CG1-CG2 4.03Å; I638-I663 HydrophobicContact CG2-CG2 3.79Å; I638-I663 WeakPolarHBondContact CG2-O 3.45Å; F646-I663 HydrophobicContact CE2-CG2 3.67Å; F646-I663 HydrophobicContact CZ-CG2 3.72Å; L650-I663 HydrophobicContact CD2-CD1 4Å; L650-I663 HydrophobicContact CD2-CG2 4.18Å; L655-I663 HydrophobicContact CD1-CD1 3.73Å; L655-I663 HydrophobicContact CD2-CD1 4.3Å; Q659-I663 WeakPolarHBondContact O-CD1 3.27Å; Q659-I663 WeakPolarHBondContact O-CG1 3.43Å; Q659-I663 PolarHBondContact O-N 3.36Å; L660-I663 PolarHBondContact O-N 3.11Å; I663-D665 VanDerWaalsContact C-N 3.34Å; I663-D665 PolarHBondContact O-N 3.3Å; I663-I666 PolarHBondContact O-N 2.96Å; I663-R667 WeakPolarHBondContact O-CB 3.37Å; I663-R667 PolarHBondContact O-N 2.94Å
664	R	93.6	Very high	93.8	Very high	160 Å²	160	73.3 Å²	73.3	60%	0.604	36%	0.359	S	S	*	.	H	α-helix	trans	-60.5	-43.2	175.2	-72.5	167.8	179.2	165.6	-0.1	111.6	L660 A661 L662 R667 R668	L660-R664 WeakPolarHBondContact O-CB 3.37Å; L660-R664 VanDerWaalsContact O-CG 3.27Å; L660-R664 WeakPolarHBondContact O-CG 3.38Å; L660-R664 PolarHBondContact O-N 3.44Å; A661-R664 PolarHBondContact O-N 3.11Å; L662-R664 PolarHBondContact O-N 3.27Å; R664-R667 PolarHBondContact O-N 3.43Å; R664-R668 VanDerWaalsContact O-CB 3.32Å; R664-R668 WeakPolarHBondContact O-CB 3.18Å; R664-R668 PolarHBondContact O-N 3.38Å
665	D	94.7	Very high	94.2	Very high	44 Å²	44	66.5 Å²	66.5	24%	0.235	34%	0.337	C	S	.	.	H	α-helix	trans	-69.7	-37.8	179.9	-177.1	44.7	0	0	0	112.9	A661 L662 I663 R668 R669	A661-D665 WeakPolarHBondContact O-CB 3.4Å; A661-D665 PolarHBondContact O-N 2.98Å; L662-D665 PolarHBondContact O-N 3.15Å; I663-D665 VanDerWaalsContact C-N 3.34Å; I663-D665 PolarHBondContact O-N 3.3Å; D665-R668 IonicContact OD1-CZ 3.49Å; D665-R668 IonicContact OD1-NE 3.8Å; D665-R668 PolarHBondContact OD1-NE 3.4Å; D665-R668 IonicContact OD1-NH2 2.75Å; D665-R668 PolarHBondContact OD1-NH2 2.95Å; D665-R669 PolarHBondContact O-N 3.48Å; D665-R669 IonicContact OD1-CZ 3.65Å; D665-R669 IonicContact OD1-NH1 2.7Å; D665-R669 PolarHBondContact OD1-NH1 2.64Å; D665-R669 IonicContact OD2-CZ 3.8Å; D665-R669 IonicContact OD2-NH1 3.92Å; D665-R669 PolarHBondContact OD2-NH1 3.47Å; D665-R669 IonicContact OD2-NH2 3.45Å; D665-R669 PolarHBondContact OD2-NH2 2.9Å
666	I	94	Very high	94.5	Very high	2 Å²	2	67.6 Å²	67.6	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-62.7	-48.6	170.2	-66.9	177.3	0	0	0	110.4	D622 A626 I638 L662 I663 R668 R669 G670	D622-I666 HydrophobicContact CB-CD1 4Å; D622-I666 HydrophobicContact CB-CG1 3.79Å; D622-I666 HydrophobicContact CB-CG2 4.23Å; A626-I666 HydrophobicContact CB-CD1 4.11Å; I638-I666 HydrophobicContact CB-CG2 4.36Å; I638-I666 HydrophobicContact CD1-CG2 4.38Å; I638-I666 HydrophobicContact CG2-CB 4.08Å; I638-I666 HydrophobicContact CG2-CG2 3.76Å; L662-I666 HydrophobicContact CD1-CD1 3.85Å; L662-I666 HydrophobicContact CD1-CG1 3.92Å; L662-I666 HydrophobicContact CD2-CD1 4.34Å; L662-I666 HydrophobicContact CG-CD1 3.76Å; L662-I666 HydrophobicContact CG-CG1 4.21Å; L662-I666 VanDerWaalsContact O-CG1 3.26Å; L662-I666 WeakPolarHBondContact O-CG1 3.49Å; L662-I666 PolarHBondContact O-N 2.99Å; I663-I666 PolarHBondContact O-N 2.96Å; I666-R668 VanDerWaalsContact C-N 3.32Å; I666-R668 PolarHBondContact O-N 3.36Å; I666-R669 PolarHBondContact O-N 2.96Å; I666-G670 PolarHBondContact O-N 3.36Å
667	R	95.1	Very high	94.7	Very high	24 Å²	24	70.1 Å²	70.1	9%	0.091	36%	0.356	C	S	.	.	H	α-helix	trans	-59.2	-43.2	178.1	-172.2	166.6	-158.2	-151.3	5.6	111.7	I638 L641 P642 F646 I663 R664 G670 K671	I638-R667 HydrophobicContact CG2-CB 3.75Å; I638-R667 WeakPolarHBondContact O-CD 3.5Å; I638-R667 WeakPolarHBondContact O-CG 3.5Å; I638-R667 PolarHBondContact O-NE 3.34Å; L641-R667 PolarHBondContact O-NH2 2.87Å; P642-R667 VanDerWaalsContact C-NH2 3.31Å; P642-R667 PolarHBondContact O-NH2 2.86Å; F646-R667 VanDerWaalsContact CG-CZ 3.41Å; I663-R667 WeakPolarHBondContact O-CB 3.37Å; I663-R667 PolarHBondContact O-N 2.94Å; R664-R667 PolarHBondContact O-N 3.43Å; R667-G670 PolarHBondContact O-N 2.96Å; R667-K671 HydrophobicContact CG-CD 4.37Å; R667-K671 WeakPolarHBondContact O-CB 3.47Å; R667-K671 WeakPolarHBondContact O-CG 3.37Å; R667-K671 PolarHBondContact O-N 3.11Å
668	R	95.4	Very high	94.9	Very high	140 Å²	140	66.1 Å²	66.1	53%	0.528	34%	0.34	S	S	.	.	H	α-helix	trans	-61.6	-48.4	175.5	-174.9	-174.1	67	98.8	0.2	111.6	R664 D665 I666 K671 N672	R664-R668 VanDerWaalsContact O-CB 3.32Å; R664-R668 WeakPolarHBondContact O-CB 3.18Å; R664-R668 PolarHBondContact O-N 3.38Å; D665-R668 IonicContact OD1-CZ 3.49Å; D665-R668 IonicContact OD1-NE 3.8Å; D665-R668 PolarHBondContact OD1-NE 3.4Å; D665-R668 IonicContact OD1-NH2 2.75Å; D665-R668 PolarHBondContact OD1-NH2 2.95Å; I666-R668 VanDerWaalsContact C-N 3.32Å; I666-R668 PolarHBondContact O-N 3.36Å; R668-K671 PolarHBondContact O-N 3.24Å; R668-N672 WeakPolarHBondContact O-CB 3.25Å; R668-N672 PolarHBondContact O-N 3.08Å; R668-N672 PolarHBondContact O-OD1 3.06Å
669	R	94.5	Very high	95.1	Very high	74 Å²	74	67.4 Å²	67.4	28%	0.279	35%	0.345	S	S	.	.	H	α-helix	trans	-61.3	-45.4	176.1	-88.4	-163.7	-71.5	-75	-6.1	112.6	D622 D665 I666 N672 K673	D622-R669 IonicContact OD1-CZ 3.84Å; D622-R669 IonicContact OD1-NE 2.77Å; D622-R669 PolarHBondContact OD1-NE 3.09Å; D622-R669 IonicContact OD1-NH2 3.12Å; D622-R669 PolarHBondContact OD1-NH2 3.35Å; D622-R669 IonicContact OD2-CZ 2.8Å; D622-R669 IonicContact OD2-NE 3.24Å; D622-R669 PolarHBondContact OD2-NE 2.7Å; D622-R669 IonicContact OD2-NH2 2.84Å; D622-R669 PolarHBondContact OD2-NH2 2.88Å; D665-R669 PolarHBondContact O-N 3.48Å; D665-R669 IonicContact OD1-CZ 3.65Å; D665-R669 IonicContact OD1-NH1 2.7Å; D665-R669 PolarHBondContact OD1-NH1 2.64Å; D665-R669 IonicContact OD2-CZ 3.8Å; D665-R669 IonicContact OD2-NH1 3.92Å; D665-R669 PolarHBondContact OD2-NH1 3.47Å; D665-R669 IonicContact OD2-NH2 3.45Å; D665-R669 PolarHBondContact OD2-NH2 2.9Å; I666-R669 PolarHBondContact O-N 2.96Å; R669-N672 PolarHBondContact O-N 2.85Å; R669-K673 PolarHBondContact O-N 3.38Å
670	G	94.3	Very high	95.3	Very high	16 Å²	16	74.9 Å²	74.9	17%	0.165	37%	0.371	C	S	.	.	H	α-helix	trans	-62	-47.5	177.9	0	0	0	0	0	112.5	I666 R667 N672 K673 M674	I666-G670 PolarHBondContact O-N 3.36Å; R667-G670 PolarHBondContact O-N 2.96Å; G670-N672 VanDerWaalsContact C-N 3.33Å; G670-N672 PolarHBondContact O-N 3.27Å; G670-K673 WeakPolarHBondContact O-CB 3.37Å; G670-K673 PolarHBondContact O-N 3.01Å; G670-K673 VanDerWaalsContact O-N 3.14Å; G670-M674 WeakPolarHBondContact O-CG 3.35Å; G670-M674 PolarHBondContact O-N 3.08Å
671	K	94.4	Very high	95.5	Very high	95 Å²	95	78.6 Å²	78.6	41%	0.413	39%	0.386	S	S	.	.	H	α-helix	trans	-62.9	-37.6	175.9	-71.9	-168.4	176.4	-162.9	0	112.4	V639 R667 R668 M674 A675	V639-K671 HydrophobicContact CG1-CG 4.46Å; V639-K671 VanDerWaalsContact O-CE 3.32Å; V639-K671 WeakPolarHBondContact O-CE 3.42Å; R667-K671 HydrophobicContact CG-CD 4.37Å; R667-K671 WeakPolarHBondContact O-CB 3.47Å; R667-K671 WeakPolarHBondContact O-CG 3.37Å; R667-K671 PolarHBondContact O-N 3.11Å; R668-K671 PolarHBondContact O-N 3.24Å; K671-M674 PolarHBondContact O-N 3.1Å; K671-A675 VanDerWaalsContact O-CB 3.3Å; K671-A675 WeakPolarHBondContact O-CB 3.39Å; K671-A675 PolarHBondContact O-N 3.23Å
672	N	96.3	Very high	95.7	Very high	100 Å²	100	84 Å²	84	54%	0.535	40%	0.395	S	S	.	.	H	α-helix	trans	-65.7	-37.6	172.8	-76.5	26.7	0	0	0	112.6	R668 R669 G670 A675 A676	R668-N672 WeakPolarHBondContact O-CB 3.25Å; R668-N672 PolarHBondContact O-N 3.08Å; R668-N672 PolarHBondContact O-OD1 3.06Å; R669-N672 PolarHBondContact O-N 2.85Å; G670-N672 VanDerWaalsContact C-N 3.33Å; G670-N672 PolarHBondContact O-N 3.27Å; N672-A675 PolarHBondContact O-N 3.11Å; N672-A676 WeakPolarHBondContact O-CB 3.27Å; N672-A676 PolarHBondContact O-N 3Å
673	K	94.7	Very high	95.9	Very high	146 Å²	146	88 Å²	88	64%	0.635	41%	0.411	S	S	*	.	H	α-helix	trans	-61.1	-48.4	173	-174.8	-178.2	177.6	-177.3	0	111	R669 G670 A675 A676 Q677	R669-K673 PolarHBondContact O-N 3.38Å; G670-K673 WeakPolarHBondContact O-CB 3.37Å; G670-K673 PolarHBondContact O-N 3.01Å; G670-K673 VanDerWaalsContact O-N 3.14Å; K673-A675 PolarHBondContact O-N 3.03Å; K673-A676 PolarHBondContact O-N 3.08Å; K673-Q677 WeakPolarHBondContact O-CB 3.22Å; K673-Q677 PolarHBondContact O-N 3.07Å
674	M	94.4	Very high	96	Very high	80 Å²	80	92.9 Å²	92.9	39%	0.394	44%	0.436	S	S	.	.	H	α-helix	trans	-64.2	-38.4	177.6	-62.7	-53.9	-66.8	0	0	112.3	G670 K671 Q677 N678	G670-M674 WeakPolarHBondContact O-CG 3.35Å; G670-M674 PolarHBondContact O-N 3.08Å; K671-M674 PolarHBondContact O-N 3.1Å; M674-Q677 PolarHBondContact O-N 3.02Å; M674-N678 WeakPolarHBondContact O-CB 3.38Å; M674-N678 VanDerWaalsContact O-CG 3.31Å; M674-N678 PolarHBondContact O-N 3.31Å; M674-N678 PolarHBondContact O-ND2 2.93Å
675	A	96.3	Very high	96.3	Very high	57 Å²	57	89 Å²	89	47%	0.471	43%	0.425	S	S	.	.	H	α-helix	trans	-64.9	-43.1	175.9	0	0	0	0	0	112.1	K671 N672 K673 N678 C679	K671-A675 VanDerWaalsContact O-CB 3.3Å; K671-A675 WeakPolarHBondContact O-CB 3.39Å; K671-A675 PolarHBondContact O-N 3.23Å; N672-A675 PolarHBondContact O-N 3.11Å; K673-A675 PolarHBondContact O-N 3.03Å; A675-N678 PolarHBondContact O-N 3.44Å; A675-C679 VanDerWaalsContact O-CB 3.25Å; A675-C679 WeakPolarHBondContact O-CB 3.29Å; A675-C679 PolarHBondContact O-N 3.22Å
676	A	97.5	Very high	96.4	Very high	50 Å²	50	89.8 Å²	89.8	41%	0.413	43%	0.432	S	S	.	.	H	α-helix	trans	-63.7	-42.2	174.3	0	0	0	0	0	112	N672 K673 C679 R680	N672-A676 WeakPolarHBondContact O-CB 3.27Å; N672-A676 PolarHBondContact O-N 3Å; K673-A676 PolarHBondContact O-N 3.08Å; A676-C679 PolarHBondContact O-N 3.42Å; A676-R680 WeakPolarHBondContact O-CG 3.46Å; A676-R680 PolarHBondContact O-N 2.92Å
677	Q	95.9	Very high	96.6	Very high	109 Å²	109	92.8 Å²	92.8	51%	0.509	45%	0.447	S	S	.	.	H	α-helix	trans	-62.3	-45.7	175.2	-174.9	175.3	-1.6	0	0	111.9	K673 M674 C679 R680 K681	K673-Q677 WeakPolarHBondContact O-CB 3.22Å; K673-Q677 PolarHBondContact O-N 3.07Å; M674-Q677 PolarHBondContact O-N 3.02Å; Q677-C679 VanDerWaalsContact C-N 3.34Å; Q677-C679 PolarHBondContact O-N 3.19Å; Q677-R680 PolarHBondContact O-N 2.74Å; Q677-K681 WeakPolarHBondContact O-CB 3.37Å; Q677-K681 PolarHBondContact O-N 2.91Å
678	N	97.3	Very high	96.7	Very high	84 Å²	84	95.3 Å²	95.3	45%	0.449	46%	0.461	S	S	.	.	H	α-helix	trans	-68	-31.9	177.3	-73.4	-17.4	0	0	0	112.8	M674 A675 R682	M674-N678 WeakPolarHBondContact O-CB 3.38Å; M674-N678 VanDerWaalsContact O-CG 3.31Å; M674-N678 PolarHBondContact O-N 3.31Å; M674-N678 PolarHBondContact O-ND2 2.93Å; A675-N678 PolarHBondContact O-N 3.44Å; N678-R682 WeakPolarHBondContact O-CB 3.39Å; N678-R682 PolarHBondContact O-N 3.14Å
679	C	98.1	Very high	96.9	Very high	84 Å²	84	94.2 Å²	94.2	57%	0.568	47%	0.466	S	S	*	.	H	α-helix	trans	-65.9	-48.6	172.8	179.7	0	0	0	0	111.3	A675 A676 Q677 R682 K683	A675-C679 VanDerWaalsContact O-CB 3.25Å; A675-C679 WeakPolarHBondContact O-CB 3.29Å; A675-C679 PolarHBondContact O-N 3.22Å; A676-C679 PolarHBondContact O-N 3.42Å; Q677-C679 VanDerWaalsContact C-N 3.34Å; Q677-C679 PolarHBondContact O-N 3.19Å; C679-R682 PolarHBondContact O-N 2.99Å; C679-K683 PolarHBondContact O-N 2.68Å
680	R	98.1	Very high	97.1	Very high	187 Å²	187	96 Å²	96	71%	0.706	48%	0.481	S	S	*	.	H	α-helix	trans	-58.7	-47.8	173.5	-70.7	175.3	179.9	-167.2	-2.3	111.5	A676 Q677 R682 K683 L684	A676-R680 WeakPolarHBondContact O-CG 3.46Å; A676-R680 PolarHBondContact O-N 2.92Å; Q677-R680 PolarHBondContact O-N 2.74Å; R680-R682 PolarHBondContact O-N 3.49Å; R680-K683 PolarHBondContact O-N 3.24Å; R680-L684 PolarHBondContact O-N 2.94Å
681	K	97.8	Very high	97.2	Very high	118 Å²	118	100.6 Å²	100.6	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-55.8	-49.5	176.6	-171.5	176.6	-170.2	-81.6	0	111.3	Q677 K683 L684 E685	Q677-K681 WeakPolarHBondContact O-CB 3.37Å; Q677-K681 PolarHBondContact O-N 2.91Å; K681-K683 PolarHBondContact O-N 2.85Å; K681-L684 PolarHBondContact O-N 3.39Å; K681-E685 HydrophobicContact CG-CG 4.47Å; K681-E685 IonicContact NZ-OE1 3.13Å; K681-E685 PolarHBondContact NZ-OE1 3.41Å; K681-E685 VanDerWaalsContact O-CG 3.29Å; K681-E685 WeakPolarHBondContact O-CG 3.48Å; K681-E685 PolarHBondContact O-N 3.14Å
682	R	98.4	Very high	97.4	Very high	168 Å²	168	100.8 Å²	100.8	63%	0.634	50%	0.5	S	S	*	.	H	α-helix	trans	-64.1	-40.6	179.2	-171.2	-178.2	-63	143.4	0.9	113.2	N678 C679 R680 L684 E685 T686	N678-R682 WeakPolarHBondContact O-CB 3.39Å; N678-R682 PolarHBondContact O-N 3.14Å; C679-R682 PolarHBondContact O-N 2.99Å; R680-R682 PolarHBondContact O-N 3.49Å; R682-L684 VanDerWaalsContact C-N 3.33Å; R682-E685 WeakPolarHBondContact CA-OE2 3.32Å; R682-E685 PolarHBondContact O-N 3.34Å; R682-T686 WeakPolarHBondContact O-CB 3.46Å; R682-T686 PolarHBondContact O-N 3.49Å; R682-T686 PolarHBondContact O-OG1 2.75Å
683	K	98.3	Very high	97.5	Very high	109 Å²	109	97.4 Å²	97.4	47%	0.474	49%	0.489	S	S	.	.	H	α-helix	trans	-66.4	-37.6	176.7	-173.3	63.1	175	-177.9	0	110.8	D169 C679 R680 K681 T686 I687	D169-K683 IonicContact OD1-NZ 2.64Å; C679-K683 PolarHBondContact O-N 2.68Å; R680-K683 PolarHBondContact O-N 3.24Å; K681-K683 PolarHBondContact O-N 2.85Å; K683-T686 WeakPolarHBondContact O-CB 3.42Å; K683-T686 PolarHBondContact O-N 3.48Å; K683-I687 HydrophobicContact CG-CD1 4.16Å; K683-I687 VanDerWaalsContact O-CG1 3.28Å; K683-I687 WeakPolarHBondContact O-CG1 3.3Å; K683-I687 PolarHBondContact O-N 2.88Å
684	L	98.1	Very high	97.7	Very high	103 Å²	103	93.9 Å²	93.9	54%	0.539	48%	0.479	S	S	.	.	H	α-helix	trans	-65.9	-45.3	173.8	-175.5	63.3	0	0	0	112.4	R680 K681 R682 T686 I687 I688	R680-L684 PolarHBondContact O-N 2.94Å; K681-L684 PolarHBondContact O-N 3.39Å; R682-L684 VanDerWaalsContact C-N 3.33Å; L684-T686 PolarHBondContact O-N 2.97Å; L684-I687 PolarHBondContact O-N 2.61Å; L684-I687 VanDerWaalsContact O-N 3.14Å; L684-I688 HydrophobicContact CD1-CD1 4.29Å; L684-I688 HydrophobicContact CG-CD1 4Å; L684-I688 WeakPolarHBondContact O-CG1 3.41Å; L684-I688 PolarHBondContact O-N 3.44Å
685	E	98.1	Very high	97.8	Very high	80 Å²	80	93.8 Å²	93.8	37%	0.374	48%	0.478	S	S	.	.	H	α-helix	trans	-56.9	-38.9	171.7	-71.5	165.3	161.3	0	0	111.7	K681 R682 N689	K681-E685 HydrophobicContact CG-CG 4.47Å; K681-E685 IonicContact NZ-OE1 3.13Å; K681-E685 PolarHBondContact NZ-OE1 3.41Å; K681-E685 VanDerWaalsContact O-CG 3.29Å; K681-E685 WeakPolarHBondContact O-CG 3.48Å; K681-E685 PolarHBondContact O-N 3.14Å; R682-E685 WeakPolarHBondContact CA-OE2 3.32Å; R682-E685 PolarHBondContact O-N 3.34Å; E685-N689 WeakPolarHBondContact O-CB 3.36Å; E685-N689 PolarHBondContact O-N 3.21Å; E685-N689 PolarHBondContact O-ND2 2.94Å; E685-N689 PolarHBondContact O-OD1 3.09Å
686	T	98.2	Very high	97.9	Very high	60 Å²	60	94.2 Å²	94.2	37%	0.368	47%	0.473	S	S	.	.	H	α-helix	trans	-67.3	-41.4	176.2	-51.3	0	0	0	0	111.5	R682 K683 L684 N689 L690	R682-T686 WeakPolarHBondContact O-CB 3.46Å; R682-T686 PolarHBondContact O-N 3.49Å; R682-T686 PolarHBondContact O-OG1 2.75Å; K683-T686 WeakPolarHBondContact O-CB 3.42Å; K683-T686 PolarHBondContact O-N 3.48Å; L684-T686 PolarHBondContact O-N 2.97Å; T686-N689 PolarHBondContact O-N 3.29Å; T686-L690 HydrophobicContact CG2-CD1 4.11Å; T686-L690 WeakPolarHBondContact O-CB 3.28Å; T686-L690 VanDerWaalsContact O-CG 3.26Å; T686-L690 WeakPolarHBondContact O-CG 3.34Å; T686-L690 PolarHBondContact O-N 3.42Å
687	I	98	Very high	98	Very high	65 Å²	65	97.8 Å²	97.8	33%	0.333	48%	0.484	S	S	.	.	H	α-helix	trans	-63.1	-50.5	177.3	-71.7	161.7	0	0	0	110.2	K683 L684 N689 L690 E691	K683-I687 HydrophobicContact CG-CD1 4.16Å; K683-I687 VanDerWaalsContact O-CG1 3.28Å; K683-I687 WeakPolarHBondContact O-CG1 3.3Å; K683-I687 PolarHBondContact O-N 2.88Å; L684-I687 PolarHBondContact O-N 2.61Å; L684-I687 VanDerWaalsContact O-N 3.14Å; I687-N689 VanDerWaalsContact C-N 3.31Å; I687-N689 PolarHBondContact O-N 3.41Å; I687-L690 PolarHBondContact O-N 3.29Å; I687-E691 HydrophobicContact CG2-CG 4.25Å; I687-E691 VanDerWaalsContact CG2-OE1 3.27Å; I687-E691 WeakPolarHBondContact CG2-OE1 3.44Å; I687-E691 WeakPolarHBondContact O-CG 3.41Å; I687-E691 PolarHBondContact O-N 2.73Å
688	I	97.8	Very high	98	Very high	76 Å²	76	98.3 Å²	98.3	39%	0.39	48%	0.481	S	S	.	.	H	α-helix	trans	-59.2	-41.6	179.1	-66.4	165.6	0	0	0	111.3	L684 L690 E691 Q692	L684-I688 HydrophobicContact CD1-CD1 4.29Å; L684-I688 HydrophobicContact CG-CD1 4Å; L684-I688 WeakPolarHBondContact O-CG1 3.41Å; L684-I688 PolarHBondContact O-N 3.44Å; I688-L690 VanDerWaalsContact C-N 3.35Å; I688-L690 PolarHBondContact O-N 2.75Å; I688-E691 PolarHBondContact O-N 3.39Å; I688-Q692 WeakPolarHBondContact O-CB 3.49Å; I688-Q692 PolarHBondContact O-N 2.91Å
689	N	98.1	Very high	98.1	Very high	118 Å²	118	100.5 Å²	100.5	63%	0.631	48%	0.483	S	S	*	.	H	α-helix	trans	-66.2	-35.3	176.7	-70.5	-6.9	0	0	0	112.7	E685 T686 I687 G693	E685-N689 WeakPolarHBondContact O-CB 3.36Å; E685-N689 PolarHBondContact O-N 3.21Å; E685-N689 PolarHBondContact O-ND2 2.94Å; E685-N689 PolarHBondContact O-OD1 3.09Å; T686-N689 PolarHBondContact O-N 3.29Å; I687-N689 VanDerWaalsContact C-N 3.31Å; I687-N689 PolarHBondContact O-N 3.41Å; N689-G693 PolarHBondContact O-N 3.04Å
690	L	98.3	Very high	98	Very high	111 Å²	111	99.6 Å²	99.6	58%	0.581	47%	0.473	S	S	*	.	H	α-helix	trans	-72.2	-40.9	175	-72.7	169.2	0	0	0	111.7	T686 I687 I688 G693 V694	T686-L690 HydrophobicContact CG2-CD1 4.11Å; T686-L690 WeakPolarHBondContact O-CB 3.28Å; T686-L690 VanDerWaalsContact O-CG 3.26Å; T686-L690 WeakPolarHBondContact O-CG 3.34Å; T686-L690 PolarHBondContact O-N 3.42Å; I687-L690 PolarHBondContact O-N 3.29Å; I688-L690 VanDerWaalsContact C-N 3.35Å; I688-L690 PolarHBondContact O-N 2.75Å; L690-G693 PolarHBondContact O-N 3.18Å; L690-V694 WeakPolarHBondContact O-CG2 3.41Å; L690-V694 PolarHBondContact O-N 2.84Å
691	E	97.7	Very high	97.9	Very high	113 Å²	113	95.2 Å²	95.2	53%	0.528	46%	0.459	S	S	.	.	H	α-helix	trans	-59.2	-48.2	174.6	-73.1	168.3	169.7	0	0	110.8	I687 I688 V694 Q695	I687-E691 HydrophobicContact CG2-CG 4.25Å; I687-E691 VanDerWaalsContact CG2-OE1 3.27Å; I687-E691 WeakPolarHBondContact CG2-OE1 3.44Å; I687-E691 WeakPolarHBondContact O-CG 3.41Å; I687-E691 PolarHBondContact O-N 2.73Å; I688-E691 PolarHBondContact O-N 3.39Å; E691-V694 PolarHBondContact O-N 2.87Å; E691-Q695 WeakPolarHBondContact O-CG 3.26Å; E691-Q695 PolarHBondContact O-N 3.44Å
692	Q	98.3	Very high	97.8	Very high	99 Å²	99	91.2 Å²	91.2	46%	0.463	45%	0.448	S	S	.	.	H	α-helix	trans	-59.1	-48.2	174.3	-179.4	61	41.3	0	0	111.5	I688 V694 Q695 D696	I688-Q692 WeakPolarHBondContact O-CB 3.49Å; I688-Q692 PolarHBondContact O-N 2.91Å; Q692-V694 VanDerWaalsContact C-N 3.31Å; Q692-V694 PolarHBondContact O-N 3.49Å; Q692-Q695 PolarHBondContact O-N 2.92Å; Q692-Q695 VanDerWaalsContact O-N 3.09Å; Q692-D696 PolarHBondContact NE2-OD1 3.42Å; Q692-D696 PolarHBondContact NE2-OD2 3.48Å; Q692-D696 PolarHBondContact O-N 3.42Å
693	G	98.4	Very high	97.8	Very high	29 Å²	29	89 Å²	89	30%	0.299	44%	0.44	S	S	.	.	H	α-helix	trans	-60.3	-36.4	178.2	0	0	0	0	0	113.8	N689 L690 D696 L697	N689-G693 PolarHBondContact O-N 3.04Å; L690-G693 PolarHBondContact O-N 3.18Å; G693-D696 PolarHBondContact O-N 2.9Å; G693-L697 WeakPolarHBondContact O-CB 3.39Å; G693-L697 VanDerWaalsContact O-CG 3.28Å; G693-L697 WeakPolarHBondContact O-CG 3.39Å; G693-L697 PolarHBondContact O-N 3.48Å
694	V	98.4	Very high	97.7	Very high	71 Å²	71	88.6 Å²	88.6	43%	0.43	44%	0.442	S	S	.	.	H	α-helix	trans	-66.8	-39.9	173.4	167.4	0	0	0	0	111.5	L690 E691 Q692 R698	L690-V694 WeakPolarHBondContact O-CG2 3.41Å; L690-V694 PolarHBondContact O-N 2.84Å; E691-V694 PolarHBondContact O-N 2.87Å; Q692-V694 VanDerWaalsContact C-N 3.31Å; Q692-V694 PolarHBondContact O-N 3.49Å; V694-R698 WeakPolarHBondContact O-CG 3.49Å; V694-R698 PolarHBondContact O-N 3.42Å; V694-R698 VanDerWaalsContact O-N 3.07Å
695	Q	97.6	Very high	97.5	Very high	78 Å²	78	85.4 Å²	85.4	36%	0.364	43%	0.425	S	S	.	.	H	α-helix	trans	-69.6	-34.8	176.9	-61.5	-71.3	27	0	0	112.2	E691 Q692 R698 R699	E691-Q695 WeakPolarHBondContact O-CG 3.26Å; E691-Q695 PolarHBondContact O-N 3.44Å; Q692-Q695 PolarHBondContact O-N 2.92Å; Q692-Q695 VanDerWaalsContact O-N 3.09Å; Q695-R698 PolarHBondContact O-N 2.91Å; Q695-R699 WeakPolarHBondContact O-CG 3.32Å; Q695-R699 PolarHBondContact O-N 3.25Å; Q695-R699 VanDerWaalsContact O-N 3.09Å
696	D	98.3	Very high	97.3	Very high	67 Å²	67	87.4 Å²	87.4	36%	0.358	43%	0.433	S	S	.	.	H	α-helix	trans	-70.7	-39.5	175	-67.2	-31.8	0	0	0	112	Q692 G693 R698 R699 D700	Q692-D696 PolarHBondContact NE2-OD1 3.42Å; Q692-D696 PolarHBondContact NE2-OD2 3.48Å; Q692-D696 PolarHBondContact O-N 3.42Å; G693-D696 PolarHBondContact O-N 2.9Å; D696-R698 VanDerWaalsContact C-N 3.28Å; D696-R698 PolarHBondContact O-N 2.86Å; D696-R699 PolarHBondContact O-N 3.17Å; D696-R699 IonicContact OD1-CZ 3.73Å; D696-R699 IonicContact OD1-NH1 2.7Å; D696-R699 PolarHBondContact OD1-NH1 3.06Å; D696-D700 PolarHBondContact O-N 3.04Å
697	L	98.3	Very high	97.1	Very high	124 Å²	124	88 Å²	88	65%	0.649	43%	0.431	S	S	*	.	H	α-helix	trans	-61.5	-32.9	171.4	-75.1	168.6	0	0	0	113	G693 K701	G693-L697 WeakPolarHBondContact O-CB 3.39Å; G693-L697 VanDerWaalsContact O-CG 3.28Å; G693-L697 WeakPolarHBondContact O-CG 3.39Å; G693-L697 PolarHBondContact O-N 3.48Å; L697-K701 WeakPolarHBondContact O-CB 3.39Å; L697-K701 PolarHBondContact O-N 2.91Å
698	R	97	Very high	96.7	Very high	121 Å²	121	86.8 Å²	86.8	46%	0.457	42%	0.424	S	S	.	.	H	α-helix	trans	-67.3	-47.5	172.3	-74.7	170	177	176.7	-5.4	111.9	V694 Q695 D696 D700 K701 A702	V694-R698 WeakPolarHBondContact O-CG 3.49Å; V694-R698 PolarHBondContact O-N 3.42Å; V694-R698 VanDerWaalsContact O-N 3.07Å; Q695-R698 PolarHBondContact O-N 2.91Å; D696-R698 VanDerWaalsContact C-N 3.28Å; D696-R698 PolarHBondContact O-N 2.86Å; R698-D700 VanDerWaalsContact C-N 3.3Å; R698-D700 PolarHBondContact O-N 2.75Å; R698-K701 WeakPolarHBondContact O-CB 3.13Å; R698-K701 PolarHBondContact O-N 3.5Å; R698-K701 VanDerWaalsContact O-N 3.14Å; R698-A702 PolarHBondContact O-N 3.4Å
699	R	98	Very high	96.3	Very high	130 Å²	130	85.9 Å²	85.9	49%	0.491	42%	0.418	S	S	.	.	H	α-helix	trans	-58.1	-41.9	175.1	-67.6	165.5	-173.1	123.8	10	112	Q695 D696 A702 R703	Q695-R699 WeakPolarHBondContact O-CG 3.32Å; Q695-R699 PolarHBondContact O-N 3.25Å; Q695-R699 VanDerWaalsContact O-N 3.09Å; D696-R699 PolarHBondContact O-N 3.17Å; D696-R699 IonicContact OD1-CZ 3.73Å; D696-R699 IonicContact OD1-NH1 2.7Å; D696-R699 PolarHBondContact OD1-NH1 3.06Å; R699-A702 PolarHBondContact O-N 3.02Å; R699-R703 WeakPolarHBondContact O-CB 3.4Å; R699-R703 PolarHBondContact O-N 3.41Å
700	D	97.6	Very high	96	Very high	65 Å²	65	84.7 Å²	84.7	35%	0.348	41%	0.409	S	S	.	.	H	α-helix	trans	-65.2	-43.2	175	-82.5	-14.7	0	0	0	112	D696 R698 R703 L704	D696-D700 PolarHBondContact O-N 3.04Å; R698-D700 VanDerWaalsContact C-N 3.3Å; R698-D700 PolarHBondContact O-N 2.75Å; D700-R703 PolarHBondContact O-N 3.35Å; D700-R703 IonicContact OD1-CZ 2.7Å; D700-R703 IonicContact OD1-NH1 2.68Å; D700-R703 PolarHBondContact OD1-NH1 3.02Å; D700-R703 IonicContact OD1-NH2 2.74Å; D700-R703 PolarHBondContact OD1-NH2 2.97Å; D700-L704 WeakPolarHBondContact O-CB 3.1Å; D700-L704 VanDerWaalsContact O-CG 3.27Å; D700-L704 WeakPolarHBondContact O-CG 3.41Å; D700-L704 PolarHBondContact O-N 3.17Å
701	K	95.9	Very high	95.6	Very high	94 Å²	94	85.9 Å²	85.9	41%	0.409	41%	0.41	S	S	.	.	H	α-helix	trans	-58.3	-48.7	173.1	179.4	-168.7	171.5	-166.1	0	111.4	D464 L697 R698 R703 L704 L705	D464-K701 IonicContact OD1-NZ 3.41Å; D464-K701 PolarHBondContact OD1-NZ 2.98Å; D464-K701 WeakPolarHBondContact OD2-CE 3.34Å; D464-K701 IonicContact OD2-NZ 2.73Å; D464-K701 PolarHBondContact OD2-NZ 3.38Å; L697-K701 WeakPolarHBondContact O-CB 3.39Å; L697-K701 PolarHBondContact O-N 2.91Å; R698-K701 WeakPolarHBondContact O-CB 3.13Å; R698-K701 PolarHBondContact O-N 3.5Å; R698-K701 VanDerWaalsContact O-N 3.14Å; K701-R703 PolarHBondContact O-N 3.07Å; K701-L704 PolarHBondContact O-N 3.19Å; K701-L705 HydrophobicContact CG-CD1 4.16Å; K701-L705 WeakPolarHBondContact O-CG 3.38Å; K701-L705 PolarHBondContact O-N 2.83Å
702	A	94.9	Very high	95.1	Very high	35 Å²	35	81.2 Å²	81.2	29%	0.289	39%	0.388	S	S	.	.	H	α-helix	trans	-61.1	-42.3	179	0	0	0	0	0	112.1	E468 R698 R699 L705 K706	E468-A702 WeakPolarHBondContact OE2-CB 3.5Å; R698-A702 PolarHBondContact O-N 3.4Å; R699-A702 PolarHBondContact O-N 3.02Å; A702-L705 PolarHBondContact O-N 3.3Å; A702-K706 PolarHBondContact O-N 3.39Å
703	R	97.6	Very high	94.6	Very high	122 Å²	122	80.7 Å²	80.7	46%	0.46	38%	0.382	S	S	.	.	H	α-helix	trans	-60.5	-49.2	173.2	-175.4	-177.1	65.1	-111.3	-9.1	111.4	R699 D700 K701 L705 K706 E707	R699-R703 WeakPolarHBondContact O-CB 3.4Å; R699-R703 PolarHBondContact O-N 3.41Å; D700-R703 PolarHBondContact O-N 3.35Å; D700-R703 IonicContact OD1-CZ 2.7Å; D700-R703 IonicContact OD1-NH1 2.68Å; D700-R703 PolarHBondContact OD1-NH1 3.02Å; D700-R703 IonicContact OD1-NH2 2.74Å; D700-R703 PolarHBondContact OD1-NH2 2.97Å; K701-R703 PolarHBondContact O-N 3.07Å; R703-L705 VanDerWaalsContact C-N 3.34Å; R703-L705 PolarHBondContact O-N 2.88Å; R703-K706 WeakPolarHBondContact O-CB 3.48Å; R703-K706 PolarHBondContact O-N 3.48Å; R703-E707 WeakPolarHBondContact CD-OE1 3.37Å; R703-E707 VanDerWaalsContact CG-OE1 3.26Å; R703-E707 WeakPolarHBondContact CG-OE1 3.47Å; R703-E707 IonicContact NE-OE1 2.86Å; R703-E707 WeakPolarHBondContact O-CG 3.46Å; R703-E707 PolarHBondContact O-N 3.26Å
704	L	97.2	Very high	94.3	Very high	100 Å²	100	82.7 Å²	82.7	52%	0.524	39%	0.391	S	S	.	.	H	α-helix	trans	-65.3	-34	-179.2	-70.9	169.3	0	0	0	112.8	D700 K701 E707 K708	D700-L704 WeakPolarHBondContact O-CB 3.1Å; D700-L704 VanDerWaalsContact O-CG 3.27Å; D700-L704 WeakPolarHBondContact O-CG 3.41Å; D700-L704 PolarHBondContact O-N 3.17Å; K701-L704 PolarHBondContact O-N 3.19Å; L704-E707 PolarHBondContact O-N 3.44Å; L704-K708 WeakPolarHBondContact O-CB 3.24Å; L704-K708 PolarHBondContact O-N 3.05Å
705	L	92.9	Very high	93.9	Very high	35 Å²	35	83.5 Å²	83.5	18%	0.183	39%	0.392	C	S	.	.	H	α-helix	trans	-66.5	-41.1	172.3	-75	173.6	0	0	0	111.9	L465 K701 A702 R703 K708 M709	L465-L705 HydrophobicContact CD2-CD1 4.31Å; K701-L705 HydrophobicContact CG-CD1 4.16Å; K701-L705 WeakPolarHBondContact O-CG 3.38Å; K701-L705 PolarHBondContact O-N 2.83Å; A702-L705 PolarHBondContact O-N 3.3Å; R703-L705 VanDerWaalsContact C-N 3.34Å; R703-L705 PolarHBondContact O-N 2.88Å; L705-K708 WeakPolarHBondContact O-CB 3.41Å; L705-K708 PolarHBondContact O-N 3.19Å; L705-M709 PolarHBondContact O-N 2.91Å
706	K	94.8	Very high	93.5	Very high	123 Å²	123	84.2 Å²	84.2	54%	0.535	39%	0.392	S	S	.	.	H	α-helix	trans	-62	-46.4	173.3	-177.9	-178.5	170.4	-176.8	0	111.4	A702 R703 M709 E710	A702-K706 PolarHBondContact O-N 3.39Å; R703-K706 WeakPolarHBondContact O-CB 3.48Å; R703-K706 PolarHBondContact O-N 3.48Å; K706-M709 PolarHBondContact O-N 2.83Å; K706-E710 WeakPolarHBondContact CE-OE1 3.37Å; K706-E710 IonicContact NZ-OE1 3.44Å; K706-E710 PolarHBondContact O-N 3.46Å
707	E	94.2	Very high	93.2	Very high	71 Å²	71	85.4 Å²	85.4	33%	0.332	40%	0.395	S	S	.	.	H	α-helix	trans	-60.5	-44.2	175.2	-71.5	172.3	-159.9	0	0	111.4	R703 L704 M709 E710 F711	R703-E707 WeakPolarHBondContact CD-OE1 3.37Å; R703-E707 VanDerWaalsContact CG-OE1 3.26Å; R703-E707 WeakPolarHBondContact CG-OE1 3.47Å; R703-E707 IonicContact NE-OE1 2.86Å; R703-E707 WeakPolarHBondContact O-CG 3.46Å; R703-E707 PolarHBondContact O-N 3.26Å; L704-E707 PolarHBondContact O-N 3.44Å; E707-M709 VanDerWaalsContact C-N 3.29Å; E707-M709 PolarHBondContact O-N 3.44Å; E707-E710 PolarHBondContact O-N 3.41Å; E707-E710 VanDerWaalsContact O-N 3.14Å; E707-F711 HydrophobicContact CB-CD2 4.47Å; E707-F711 HydrophobicContact CB-CE2 4.16Å; E707-F711 WeakPolarHBondContact O-CD2 3.5Å; E707-F711 PolarHBondContact O-N 3Å
708	K	90.1	Very high	93	Very high	41 Å²	41	84 Å²	84	18%	0.178	39%	0.388	C	S	.	.	H	α-helix	trans	-53.6	-45.3	172.7	-173.1	-178.9	-179.1	-173.9	0	111	M456 E459 I460 L704 L705 F711 I712	M456-K708 HydrophobicContact CE-CG 4.28Å; E459-K708 IonicContact OE2-NZ 3.28Å; E459-K708 PolarHBondContact OE2-NZ 2.88Å; I460-K708 HydrophobicContact CD1-CD 3.94Å; I460-K708 HydrophobicContact CD1-CG 4.39Å; I460-K708 HydrophobicContact CG1-CD 4.21Å; L704-K708 WeakPolarHBondContact O-CB 3.24Å; L704-K708 PolarHBondContact O-N 3.05Å; L705-K708 WeakPolarHBondContact O-CB 3.41Å; L705-K708 PolarHBondContact O-N 3.19Å; K708-F711 PolarHBondContact O-N 3.13Å; K708-I712 HydrophobicContact CG-CD1 4.12Å; K708-I712 WeakPolarHBondContact O-CD1 3.27Å; K708-I712 VanDerWaalsContact O-CG1 3.23Å; K708-I712 WeakPolarHBondContact O-CG1 3.19Å; K708-I712 PolarHBondContact O-N 3.14Å
709	M	88.1	Confident	92.5	Very high	56 Å²	56	80 Å²	80	28%	0.276	37%	0.374	S	S	.	.	H	α-helix	trans	-67.1	-38.3	177.8	-169.9	172.5	70	0	0	113.2	L479 L705 K706 E707 I712 R713	L479-M709 HydrophobicContact CD1-CE 4.29Å; L479-M709 HydrophobicContact CD1-SD 3.63Å; L705-M709 PolarHBondContact O-N 2.91Å; K706-M709 PolarHBondContact O-N 2.83Å; E707-M709 VanDerWaalsContact C-N 3.29Å; E707-M709 PolarHBondContact O-N 3.44Å; M709-I712 PolarHBondContact O-N 3.24Å; M709-R713 PolarHBondContact O-N 2.92Å
710	E	91.7	Very high	92.1	Very high	94 Å²	94	80.2 Å²	80.2	44%	0.439	38%	0.381	S	S	.	.	H	α-helix	trans	-67.4	-39.5	175.7	-72.3	177.7	-167.1	0	0	112.1	K706 E707 R713 S714	K706-E710 WeakPolarHBondContact CE-OE1 3.37Å; K706-E710 IonicContact NZ-OE1 3.44Å; K706-E710 PolarHBondContact O-N 3.46Å; E707-E710 PolarHBondContact O-N 3.41Å; E707-E710 VanDerWaalsContact O-N 3.14Å; E710-R713 PolarHBondContact O-N 3.25Å; E710-S714 WeakPolarHBondContact O-CB 3.39Å; E710-S714 PolarHBondContact O-N 3.22Å
711	F	89.8	Confident	91.9	Very high	136 Å²	136	83.7 Å²	83.7	60%	0.596	39%	0.392	S	S	*	.	H	α-helix	trans	-64.3	-43.4	171.7	-69.7	-57.2	0	0	0	112.4	E707 K708 R713 S714 I715	E707-F711 HydrophobicContact CB-CD2 4.47Å; E707-F711 HydrophobicContact CB-CE2 4.16Å; E707-F711 WeakPolarHBondContact O-CD2 3.5Å; E707-F711 PolarHBondContact O-N 3Å; K708-F711 PolarHBondContact O-N 3.13Å; F711-R713 VanDerWaalsContact C-N 3.33Å; F711-R713 PolarHBondContact O-N 3.02Å; F711-S714 WeakPolarHBondContact O-CB 3.13Å; F711-S714 PolarHBondContact O-N 3.38Å; F711-I715 VanDerWaalsContact O-CG1 3.31Å; F711-I715 WeakPolarHBondContact O-CG1 3.32Å; F711-I715 PolarHBondContact O-N 3.32Å
712	I	87.9	Confident	91.5	Very high	15 Å²	15	82.2 Å²	82.2	8%	0.077	39%	0.388	C	S	.	.	H	α-helix	trans	-57.2	-46	174.4	-71.4	164.1	0	0	0	110.7	L452 M456 I460 K708 M709 S714 I715 R716	L452-I712 HydrophobicContact CD2-CG2 3.94Å; M456-I712 HydrophobicContact CE-CD1 4.07Å; M456-I712 HydrophobicContact CE-CG1 4.08Å; I460-I712 HydrophobicContact CD1-CD1 3.92Å; K708-I712 HydrophobicContact CG-CD1 4.12Å; K708-I712 WeakPolarHBondContact O-CD1 3.27Å; K708-I712 VanDerWaalsContact O-CG1 3.23Å; K708-I712 WeakPolarHBondContact O-CG1 3.19Å; K708-I712 PolarHBondContact O-N 3.14Å; M709-I712 PolarHBondContact O-N 3.24Å; I712-S714 PolarHBondContact O-N 3.18Å; I712-I715 PolarHBondContact O-N 2.85Å; I712-R716 WeakPolarHBondContact O-CG 3.34Å; I712-R716 PolarHBondContact O-N 3.19Å
713	R	89	Confident	91	Very high	87 Å²	87	85.5 Å²	85.5	33%	0.328	40%	0.397	S	S	.	.	H	α-helix	trans	-61.1	-43.9	176.3	-171.7	-176.7	-67.2	107.1	-1.2	111.8	M709 E710 F711 R716 Q717	M709-R713 PolarHBondContact O-N 2.92Å; E710-R713 PolarHBondContact O-N 3.25Å; F711-R713 VanDerWaalsContact C-N 3.33Å; F711-R713 PolarHBondContact O-N 3.02Å; R713-R716 PolarHBondContact O-N 3.42Å; R713-Q717 WeakPolarHBondContact O-CG 3.36Å; R713-Q717 PolarHBondContact O-N 2.85Å
714	S	91.6	Very high	90.6	Very high	71 Å²	71	83.2 Å²	83.2	50%	0.497	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-42.8	177.3	-169.7	0	0	0	0	112.4	E710 F711 I712 Q717 L718	E710-S714 WeakPolarHBondContact O-CB 3.39Å; E710-S714 PolarHBondContact O-N 3.22Å; F711-S714 WeakPolarHBondContact O-CB 3.13Å; F711-S714 PolarHBondContact O-N 3.38Å; I712-S714 PolarHBondContact O-N 3.18Å; S714-Q717 PolarHBondContact O-N 3.26Å; S714-L718 WeakPolarHBondContact O-CB 3.06Å; S714-L718 PolarHBondContact O-N 3.33Å
715	I	89.8	Confident	90.3	Very high	88 Å²	88	83.3 Å²	83.3	45%	0.451	40%	0.4	S	S	.	.	H	α-helix	trans	-63.1	-44.3	175.8	-68.6	164.3	0	0	0	111.1	L452 F711 I712 Q717 L718 K719	L452-I715 HydrophobicContact CD1-CG2 4.48Å; F711-I715 VanDerWaalsContact O-CG1 3.31Å; F711-I715 WeakPolarHBondContact O-CG1 3.32Å; F711-I715 PolarHBondContact O-N 3.32Å; I712-I715 PolarHBondContact O-N 2.85Å; I715-Q717 PolarHBondContact O-N 2.66Å; I715-L718 PolarHBondContact O-N 3.2Å; I715-K719 WeakPolarHBondContact O-CB 3.41Å; I715-K719 PolarHBondContact O-N 3.47Å
716	R	88	Confident	89.8	Confident	93 Å²	93	84 Å²	84	35%	0.351	41%	0.407	S	S	.	.	H	α-helix	trans	-58.5	-46.5	174.6	-71	175.5	-177	-172.6	-0.7	111.6	L452 I712 R713 L718 K719 Q720	L452-R716 HydrophobicContact CD1-CG 3.96Å; L452-R716 HydrophobicContact CD2-CG 3.9Å; L452-R716 VanDerWaalsContact CD2-NE 3.35Å; I712-R716 WeakPolarHBondContact O-CG 3.34Å; I712-R716 PolarHBondContact O-N 3.19Å; R713-R716 PolarHBondContact O-N 3.42Å; R716-L718 PolarHBondContact O-N 3.17Å; R716-K719 PolarHBondContact O-N 2.5Å; R716-Q720 PolarHBondContact O-N 3.43Å
717	Q	92.6	Very high	89.3	Confident	93 Å²	93	83.1 Å²	83.1	44%	0.435	41%	0.405	S	S	.	.	H	α-helix	trans	-64.7	-37.4	177.1	-70.7	-178	7.8	0	0	112.9	R713 S714 I715 K721	R713-Q717 WeakPolarHBondContact O-CG 3.36Å; R713-Q717 PolarHBondContact O-N 2.85Å; S714-Q717 PolarHBondContact O-N 3.26Å; I715-Q717 PolarHBondContact O-N 2.66Å; Q717-K721 WeakPolarHBondContact O-CB 3.24Å; Q717-K721 VanDerWaalsContact O-CG 3.3Å; Q717-K721 WeakPolarHBondContact O-CG 3.13Å; Q717-K721 PolarHBondContact O-N 3.38Å
718	L	94.1	Very high	89	Confident	94 Å²	94	84.5 Å²	84.5	49%	0.492	41%	0.412	S	S	.	.	H	α-helix	trans	-68.2	-42.9	176.2	-177.5	59.7	0	0	0	111.5	F427 S714 I715 R716 Q720 K721 M722	F427-L718 HydrophobicContact CZ-CD2 4.11Å; S714-L718 WeakPolarHBondContact O-CB 3.06Å; S714-L718 PolarHBondContact O-N 3.33Å; I715-L718 PolarHBondContact O-N 3.2Å; R716-L718 PolarHBondContact O-N 3.17Å; L718-Q720 PolarHBondContact O-N 2.93Å; L718-K721 PolarHBondContact O-N 3.12Å; L718-M722 WeakPolarHBondContact O-CB 3.46Å; L718-M722 PolarHBondContact O-N 2.77Å
719	K	86.2	Confident	88.9	Confident	37 Å²	37	85 Å²	85	16%	0.161	42%	0.418	C	S	.	.	H	α-helix	trans	-54.4	-51.4	172	-179.7	-169.4	176.6	169.6	0	110.7	D446 F448 I715 R716 K721 M722 Q723	D446-K719 WeakPolarHBondContact OD2-CE 3.4Å; D446-K719 IonicContact OD2-NZ 3.45Å; D446-K719 PolarHBondContact OD2-NZ 3.08Å; F448-K719 HydrophobicContact CB-CD 3.69Å; F448-K719 HydrophobicContact CB-CG 4.26Å; F448-K719 HydrophobicContact CG-CD 4.34Å; F448-K719 HydrophobicContact CG-CG 4.39Å; I715-K719 WeakPolarHBondContact O-CB 3.41Å; I715-K719 PolarHBondContact O-N 3.47Å; R716-K719 PolarHBondContact O-N 2.5Å; K719-K721 PolarHBondContact O-N 3.19Å; K719-M722 PolarHBondContact O-N 2.84Å; K719-Q723 VanDerWaalsContact O-CB 3.32Å; K719-Q723 WeakPolarHBondContact O-CB 3.36Å; K719-Q723 PolarHBondContact O-N 2.8Å
720	Q	89.6	Confident	88.7	Confident	135 Å²	135	82.8 Å²	82.8	63%	0.631	41%	0.407	S	S	*	.	H	α-helix	trans	-60.2	-44.7	-179.5	-169.8	-173.8	19.7	0	0	112.1	R716 L718 Q723 S724	R716-Q720 PolarHBondContact O-N 3.43Å; L718-Q720 PolarHBondContact O-N 2.93Å; Q720-Q723 PolarHBondContact O-N 3.38Å; Q720-S724 WeakPolarHBondContact O-CB 3.43Å; Q720-S724 PolarHBondContact O-N 2.97Å
721	K	94.2	Very high	88.2	Confident	137 Å²	137	81.4 Å²	81.4	60%	0.596	41%	0.408	S	S	*	.	H	α-helix	trans	-62.3	-44.3	176.4	-74.3	168	-177.6	169.6	0	112.1	Q717 L718 K719 S724 L725	Q717-K721 WeakPolarHBondContact O-CB 3.24Å; Q717-K721 VanDerWaalsContact O-CG 3.3Å; Q717-K721 WeakPolarHBondContact O-CG 3.13Å; Q717-K721 PolarHBondContact O-N 3.38Å; L718-K721 PolarHBondContact O-N 3.12Å; K719-K721 PolarHBondContact O-N 3.19Å; K721-S724 PolarHBondContact O-N 3.46Å; K721-L725 WeakPolarHBondContact O-CB 3.48Å; K721-L725 PolarHBondContact O-N 3.22Å
722	M	88.4	Confident	88	Confident	64 Å²	64	81.1 Å²	81.1	32%	0.315	41%	0.408	S	S	.	.	H	α-helix	trans	-64.6	-44.1	176.7	-174.5	177.3	66	0	0	111.7	F427 F448 L718 K719 S724 L725 C726	F427-M722 HydrophobicContact CD1-CE 3.87Å; F427-M722 HydrophobicContact CD1-SD 4.04Å; F427-M722 HydrophobicContact CE1-CE 4.3Å; F427-M722 HydrophobicContact CE1-SD 4.39Å; F448-M722 HydrophobicContact CE1-CE 4.32Å; F448-M722 HydrophobicContact CE2-CE 3.79Å; F448-M722 HydrophobicContact CZ-CE 3.58Å; L718-M722 WeakPolarHBondContact O-CB 3.46Å; L718-M722 PolarHBondContact O-N 2.77Å; K719-M722 PolarHBondContact O-N 2.84Å; M722-S724 VanDerWaalsContact C-N 3.34Å; M722-S724 PolarHBondContact O-N 2.79Å; M722-L725 PolarHBondContact O-N 3.25Å; M722-C726 PolarHBondContact O-N 3.12Å; M722-C726 PolarHBondContact O-SG 3.18Å; M722-C726 VanDerWaalsContact O-SG 3.32Å
723	Q	84.4	Confident	87.8	Confident	104 Å²	104	83 Å²	83	49%	0.486	42%	0.418	S	S	.	.	H	α-helix	trans	-60.7	-41.7	176	-177.4	179.5	-4.3	0	0	111.8	K719 Q720 Q727	K719-Q723 VanDerWaalsContact O-CB 3.32Å; K719-Q723 WeakPolarHBondContact O-CB 3.36Å; K719-Q723 PolarHBondContact O-N 2.8Å; Q720-Q723 PolarHBondContact O-N 3.38Å; Q723-Q727 WeakPolarHBondContact O-CG 3.49Å; Q723-Q727 PolarHBondContact O-N 3.36Å
724	S	88.6	Confident	87.5	Confident	73 Å²	73	84.7 Å²	84.7	51%	0.51	43%	0.425	S	S	.	.	H	α-helix	trans	-62.8	-45.3	174.2	-169.7	0	0	0	0	111.9	Q720 K721 M722 Q727 E728	Q720-S724 WeakPolarHBondContact O-CB 3.43Å; Q720-S724 PolarHBondContact O-N 2.97Å; K721-S724 PolarHBondContact O-N 3.46Å; M722-S724 VanDerWaalsContact C-N 3.34Å; M722-S724 PolarHBondContact O-N 2.79Å; S724-Q727 PolarHBondContact O-N 2.9Å; S724-E728 PolarHBondContact O-N 3.38Å
725	L	89.7	Confident	86.8	Confident	103 Å²	103	82.9 Å²	82.9	54%	0.539	41%	0.409	S	S	.	.	H	α-helix	trans	-65.4	-40.2	178.5	-177.1	63.4	0	0	0	111.9	K721 M722 E728 V729	K721-L725 WeakPolarHBondContact O-CB 3.48Å; K721-L725 PolarHBondContact O-N 3.22Å; M722-L725 PolarHBondContact O-N 3.25Å; L725-E728 PolarHBondContact O-N 3.02Å; L725-V729 WeakPolarHBondContact O-CG2 3.34Å; L725-V729 PolarHBondContact O-N 3.29Å
726	C	84	Confident	86.2	Confident	49 Å²	49	87.8 Å²	87.8	33%	0.331	43%	0.43	S	S	.	.	H	α-helix	trans	-62.3	-42.9	173.6	-69.5	0	0	0	0	111.8	M722 V729 F730	M722-C726 PolarHBondContact O-N 3.12Å; M722-C726 PolarHBondContact O-SG 3.18Å; M722-C726 VanDerWaalsContact O-SG 3.32Å; C726-V729 PolarHBondContact O-N 2.72Å; C726-F730 WeakPolarHBondContact O-CD2 3.28Å; C726-F730 PolarHBondContact O-N 3.45Å
727	Q	84.6	Confident	85.8	Confident	104 Å²	104	89.7 Å²	89.7	49%	0.486	44%	0.443	S	S	.	.	H	α-helix	trans	-61.8	-43	174.4	-74.4	178.4	44.6	0	0	111.7	Q723 S724 F730 S731	Q723-Q727 WeakPolarHBondContact O-CG 3.49Å; Q723-Q727 PolarHBondContact O-N 3.36Å; S724-Q727 PolarHBondContact O-N 2.9Å; Q727-F730 PolarHBondContact O-N 2.93Å; Q727-S731 WeakPolarHBondContact O-CB 3.48Å; Q727-S731 PolarHBondContact O-N 3.43Å
728	E	87.1	Confident	84.9	Confident	101 Å²	101	87.7 Å²	87.7	47%	0.472	45%	0.447	S	S	.	.	H	α-helix	trans	-60	-49.2	176	-177.5	175.3	-171.1	0	0	111.4	S724 L725 F730 S731 Q732	S724-E728 PolarHBondContact O-N 3.38Å; L725-E728 PolarHBondContact O-N 3.02Å; E728-F730 PolarHBondContact O-N 3.24Å; E728-S731 WeakPolarHBondContact O-CA 3.41Å; E728-S731 WeakPolarHBondContact O-CB 3.39Å; E728-S731 PolarHBondContact O-N 3.27Å; E728-S731 VanDerWaalsContact O-N 3.07Å; E728-S731 PolarHBondContact O-OG 2.92Å; E728-Q732 WeakPolarHBondContact O-CG 3.34Å; E728-Q732 PolarHBondContact O-N 3.46Å; E728-Q732 VanDerWaalsContact O-N 3.1Å; E728-Q732 PolarHBondContact OE1-NE2 2.97Å
729	V	87.3	Confident	84.1	Confident	52 Å²	52	89.4 Å²	89.4	32%	0.315	45%	0.447	S	S	.	.	H	α-helix	trans	-58.5	-48	177.6	170.4	0	0	0	0	111.2	L725 C726 S731 Q732 L733 L748	L725-V729 WeakPolarHBondContact O-CG2 3.34Å; L725-V729 PolarHBondContact O-N 3.29Å; C726-V729 PolarHBondContact O-N 2.72Å; V729-S731 VanDerWaalsContact C-N 3.28Å; V729-S731 PolarHBondContact O-N 2.87Å; V729-Q732 PolarHBondContact O-N 3.19Å; V729-Q732 VanDerWaalsContact O-N 3.08Å; V729-L733 HydrophobicContact CG1-CD1 3.67Å; V729-L733 HydrophobicContact CG1-CG 4.17Å; V729-L733 VanDerWaalsContact O-CG 3.3Å; V729-L733 WeakPolarHBondContact O-CG 3.25Å; V729-L733 PolarHBondContact O-N 3.17Å; V729-L748 HydrophobicContact CB-CD1 4.31Å; V729-L748 HydrophobicContact CG1-CD1 3.8Å; V729-L748 HydrophobicContact CG1-CD2 4.3Å
730	F	85.1	Confident	83.6	Confident	9 Å²	9	91.3 Å²	91.3	4%	0.039	46%	0.464	C	S	.	.	H	α-helix	trans	-62.9	-32.1	175	-80.6	-61.2	0	0	0	113.4	C726 Q727 E728 Q732 L733 F741 P743 L748 I758	C726-F730 WeakPolarHBondContact O-CD2 3.28Å; C726-F730 PolarHBondContact O-N 3.45Å; Q727-F730 PolarHBondContact O-N 2.93Å; E728-F730 PolarHBondContact O-N 3.24Å; F730-Q732 VanDerWaalsContact C-N 3.25Å; F730-Q732 PolarHBondContact O-N 3.3Å; F730-L733 HydrophobicContact CD1-CD1 4.32Å; F730-F741 HydrophobicContact CD1-CB 3.84Å; F730-F741 HydrophobicContact CE1-CB 4.31Å; F730-P743 HydrophobicContact CB-CG 3.77Å; F730-P743 HydrophobicContact CD2-CB 3.85Å; F730-P743 HydrophobicContact CD2-CG 3.93Å; F730-P743 HydrophobicContact CE2-CB 4.34Å; F730-P743 HydrophobicContact CG-CB 4.31Å; F730-P743 HydrophobicContact CG-CG 3.98Å; F730-L748 HydrophobicContact CE1-CD2 4.41Å; F730-L748 HydrophobicContact CE2-CG 4.12Å; F730-L748 HydrophobicContact CZ-CD2 4.18Å; F730-L748 HydrophobicContact CZ-CG 3.93Å; F730-I758 HydrophobicContact CE1-CG2 4.42Å
731	S	81.3	Confident	83	Confident	65 Å²	65	86.7 Å²	86.7	46%	0.455	44%	0.442	S	S	.	.	H	α-helix	trans	-69.7	-19.2	174.2	85	0	0	0	0	113.8	Q727 E728 V729 R734	Q727-S731 WeakPolarHBondContact O-CB 3.48Å; Q727-S731 PolarHBondContact O-N 3.43Å; E728-S731 WeakPolarHBondContact O-CA 3.41Å; E728-S731 WeakPolarHBondContact O-CB 3.39Å; E728-S731 PolarHBondContact O-N 3.27Å; E728-S731 VanDerWaalsContact O-N 3.07Å; E728-S731 PolarHBondContact O-OG 2.92Å; V729-S731 VanDerWaalsContact C-N 3.28Å; V729-S731 PolarHBondContact O-N 2.87Å; S731-R734 VanDerWaalsContact O-CZ 3.28Å; S731-R734 PolarHBondContact O-NH1 3.47Å; S731-R734 PolarHBondContact O-NH2 3.15Å
732	Q	83.8	Confident	82.1	Confident	129 Å²	129	82.4 Å²	82.4	60%	0.603	43%	0.428	S	S	*	.	H	α-helix	trans	-96.5	-36.4	176.3	-65.4	-177	28.4	0	0	112.6	E728 V729 F730 R734	E728-Q732 WeakPolarHBondContact O-CG 3.34Å; E728-Q732 PolarHBondContact O-N 3.46Å; E728-Q732 VanDerWaalsContact O-N 3.1Å; E728-Q732 PolarHBondContact OE1-NE2 2.97Å; V729-Q732 PolarHBondContact O-N 3.19Å; V729-Q732 VanDerWaalsContact O-N 3.08Å; F730-Q732 VanDerWaalsContact C-N 3.25Å; F730-Q732 PolarHBondContact O-N 3.3Å; Q732-R734 PolarHBondContact O-NH1 3.42Å
733	L	83.7	Confident	81.3	Confident	55 Å²	55	82.1 Å²	82.1	29%	0.288	43%	0.43	S	S	.	.			trans	-63.5	143.1	177.3	-68.5	168.7	0	0	0	112.2	V729 F730 P740 F741 L748 I758	V729-L733 HydrophobicContact CG1-CD1 3.67Å; V729-L733 HydrophobicContact CG1-CG 4.17Å; V729-L733 VanDerWaalsContact O-CG 3.3Å; V729-L733 WeakPolarHBondContact O-CG 3.25Å; V729-L733 PolarHBondContact O-N 3.17Å; F730-L733 HydrophobicContact CD1-CD1 4.32Å; L733-P740 WeakPolarHBondContact O-CA 3.37Å; L733-F741 HydrophobicContact CB-CD2 3.92Å; L733-L748 HydrophobicContact CD1-CD2 4.11Å; L733-I758 HydrophobicContact CD1-CD1 3.74Å; L733-I758 HydrophobicContact CD1-CG1 4.12Å; L733-I758 HydrophobicContact CD2-CD1 4.09Å; L733-I758 HydrophobicContact CG-CD1 4.35Å
734	R	82.8	Confident	80.9	Confident	123 Å²	123	81.4 Å²	81.4	46%	0.464	44%	0.437	S	S	.	.	B	Isolated β-bridge	trans	-132	142.5	-178.5	-64.5	-68.2	175	-85.4	-1.4	111.4	S731 Q732 G738 R739 F741	S731-R734 VanDerWaalsContact O-CZ 3.28Å; S731-R734 PolarHBondContact O-NH1 3.47Å; S731-R734 PolarHBondContact O-NH2 3.15Å; Q732-R734 PolarHBondContact O-NH1 3.42Å; R734-G738 WeakPolarHBondContact CD-O 3.4Å; R734-R739 CarbonylContact C-O 3.47Å; R734-R739 VanDerWaalsContact CA-O 3.28Å; R734-R739 WeakPolarHBondContact CA-O 3.22Å; R734-F741 VanDerWaalsContact C-CE2 3.42Å; R734-F741 VanDerWaalsContact O-CE2 3.29Å; R734-F741 WeakPolarHBondContact O-CE2 3.39Å
735	D	78.6	Confident	80.3	Confident	32 Å²	32	83.7 Å²	83.7	17%	0.171	44%	0.44	C	S	.	.			trans	-75.7	171.7	167.7	65.7	24.6	0	0	0	112	E737 G738 R739 F741	D735-E737 PolarHBondContact O-N 3.3Å; D735-E737 VanDerWaalsContact O-N 3.08Å; D735-E737 WeakPolarHBondContact OD1-CA 3.49Å; D735-E737 PolarHBondContact OD1-N 3.22Å; D735-E737 VanDerWaalsContact OD1-N 3.11Å; D735-G738 PolarHBondContact O-N 3.25Å; D735-G738 PolarHBondContact OD1-N 3.15Å; D735-R739 PolarHBondContact N-O 3.11Å; D735-R739 IonicContact OD1-CZ 3.13Å; D735-R739 PolarHBondContact OD1-N 3.44Å; D735-R739 IonicContact OD1-NE 3.98Å; D735-R739 IonicContact OD1-NH2 2.68Å; D735-R739 IonicContact OD2-CZ 3.14Å; D735-R739 IonicContact OD2-NE 2.79Å; D735-R739 PolarHBondContact OD2-NE 2.94Å; D735-R739 IonicContact OD2-NH2 2.68Å; D735-R739 PolarHBondContact OD2-NH2 2.85Å; D735-F741 HydrophobicContact CB-CE1 4.3Å; D735-F741 HydrophobicContact CB-CE2 4.25Å; D735-F741 HydrophobicContact CB-CZ 3.96Å
736	E	77.1	Confident	79.7	Confident	192 Å²	192	82 Å²	82	90%	0.897	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-17.3	179.9	-63.4	-70.5	134.7	0	0	113.3
737	E	77.8	Confident	79.6	Confident	132 Å²	132	81.1 Å²	81.1	62%	0.617	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	7.3	174.9	-68.1	107.4	-123.3	0	0	113.4	D735 R739	D735-E737 PolarHBondContact O-N 3.3Å; D735-E737 VanDerWaalsContact O-N 3.08Å; D735-E737 WeakPolarHBondContact OD1-CA 3.49Å; D735-E737 PolarHBondContact OD1-N 3.22Å; D735-E737 VanDerWaalsContact OD1-N 3.11Å; E737-R739 IonicContact OE2-CZ 3.62Å; E737-R739 IonicContact OE2-NH1 3.81Å; E737-R739 PolarHBondContact OE2-NH1 3.44Å; E737-R739 IonicContact OE2-NH2 3.91Å; E737-R739 PolarHBondContact OE2-NH2 3.41Å
738	G	75.3	Confident	79.4	Confident	51 Å²	51	77.5 Å²	77.5	53%	0.526	41%	0.405	S	S	.	.	S	Bend	trans	79.6	17.7	173.6	0	0	0	0	0	115.4	R734 D735	R734-G738 WeakPolarHBondContact CD-O 3.4Å; D735-G738 PolarHBondContact O-N 3.25Å; D735-G738 PolarHBondContact OD1-N 3.15Å
739	R	75.8	Confident	79.1	Confident	130 Å²	130	77.3 Å²	77.3	49%	0.491	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-96.1	150	176.8	-49.6	173.3	-62.1	-112.6	-2.8	110.7	R734 D735 E737	R734-R739 CarbonylContact C-O 3.47Å; R734-R739 VanDerWaalsContact CA-O 3.28Å; R734-R739 WeakPolarHBondContact CA-O 3.22Å; D735-R739 PolarHBondContact N-O 3.11Å; D735-R739 IonicContact OD1-CZ 3.13Å; D735-R739 PolarHBondContact OD1-N 3.44Å; D735-R739 IonicContact OD1-NE 3.98Å; D735-R739 IonicContact OD1-NH2 2.68Å; D735-R739 IonicContact OD2-CZ 3.14Å; D735-R739 IonicContact OD2-NE 2.79Å; D735-R739 PolarHBondContact OD2-NE 2.94Å; D735-R739 IonicContact OD2-NH2 2.68Å; D735-R739 PolarHBondContact OD2-NH2 2.85Å; E737-R739 IonicContact OE2-CZ 3.62Å; E737-R739 IonicContact OE2-NH1 3.81Å; E737-R739 PolarHBondContact OE2-NH1 3.44Å; E737-R739 IonicContact OE2-NH2 3.91Å; E737-R739 PolarHBondContact OE2-NH2 3.41Å
740	P	76.1	Confident	78.6	Confident	78 Å²	78	82.7 Å²	82.7	51%	0.506	42%	0.419	S	S	.	.	B	Isolated β-bridge	trans	-67.9	143.9	173.7	28.8	-34.5	0	0	0	111.7	L733	L733-P740 WeakPolarHBondContact O-CA 3.37Å
741	F	76.6	Confident	78.5	Confident	38 Å²	38	83.4 Å²	83.4	17%	0.167	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-73.1	126	174.1	-80.2	-81.6	0	0	0	111	F730 L733 R734 D735 P743 Y746 I758	F730-F741 HydrophobicContact CD1-CB 3.84Å; F730-F741 HydrophobicContact CE1-CB 4.31Å; L733-F741 HydrophobicContact CB-CD2 3.92Å; R734-F741 VanDerWaalsContact C-CE2 3.42Å; R734-F741 VanDerWaalsContact O-CE2 3.29Å; R734-F741 WeakPolarHBondContact O-CE2 3.39Å; D735-F741 HydrophobicContact CB-CE1 4.3Å; D735-F741 HydrophobicContact CB-CE2 4.25Å; D735-F741 HydrophobicContact CB-CZ 3.96Å; F741-P743 WeakPolarHBondContact O-CD 3.18Å; F741-Y746 HydrophobicContact CD1-CD1 4.17Å; F741-Y746 AromaticContact CD1-CD2 3.89Å; F741-Y746 HydrophobicContact CD1-CD2 3.89Å; F741-Y746 HydrophobicContact CD1-CE1 4.15Å; F741-Y746 AromaticContact CD1-CE2 3.91Å; F741-Y746 HydrophobicContact CD1-CE2 3.91Å; F741-Y746 HydrophobicContact CD1-CG 4.04Å; F741-Y746 HydrophobicContact CE1-CD1 4.44Å; F741-Y746 HydrophobicContact CE1-CE1 4.12Å; F741-Y746 HydrophobicContact CE1-CE2 4.48Å; F741-I758 HydrophobicContact CD1-CG2 4.35Å; F741-I758 HydrophobicContact CD2-CD1 4.17Å; F741-I758 HydrophobicContact CE1-CG2 4.45Å; F741-I758 HydrophobicContact CE2-CD1 3.91Å; F741-I758 HydrophobicContact CZ-CD1 4.36Å
742	P	75.7	Confident	78.3	Confident	47 Å²	47	86.1 Å²	86.1	31%	0.305	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-73.9	124	-179.8	26.4	-32	0	0	0	112.2	S744 E745 Y746	P742-S744 PolarHBondContact O-N 2.89Å; P742-E745 HydrophobicContact CG-CB 4.08Å; P742-E745 HydrophobicContact CG-CG 4.05Å; P742-E745 PolarHBondContact O-N 2.6Å; P742-E745 VanDerWaalsContact O-N 3.08Å; P742-Y746 HydrophobicContact CG-CD2 4.15Å; P742-Y746 HydrophobicContact CG-CE2 4.27Å; P742-Y746 PolarHBondContact O-N 3.04Å
743	P	72.3	Confident	78	Confident	57 Å²	57	86 Å²	86	37%	0.37	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-15.6	-179.3	-22.7	31.6	0	0	0	115.7	F730 F741 Y746 R761	F730-P743 HydrophobicContact CB-CG 3.77Å; F730-P743 HydrophobicContact CD2-CB 3.85Å; F730-P743 HydrophobicContact CD2-CG 3.93Å; F730-P743 HydrophobicContact CE2-CB 4.34Å; F730-P743 HydrophobicContact CG-CB 4.31Å; F730-P743 HydrophobicContact CG-CG 3.98Å; F741-P743 WeakPolarHBondContact O-CD 3.18Å; P743-Y746 VanDerWaalsContact O-O 3.13Å; P743-R761 PolarHBondContact O-NH2 2.86Å
744	S	74.8	Confident	77.7	Confident	90 Å²	90	86.3 Å²	86.3	63%	0.629	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-33.2	176.2	48.1	0	0	0	0	113	P742	P742-S744 PolarHBondContact O-N 2.89Å
745	E	77.3	Confident	77.5	Confident	120 Å²	120	82.2 Å²	82.2	56%	0.561	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-15.6	-174.2	-53.4	-176.6	162.7	0	0	112.7	P742 P760 R761	P742-E745 HydrophobicContact CG-CB 4.08Å; P742-E745 HydrophobicContact CG-CG 4.05Å; P742-E745 PolarHBondContact O-N 2.6Å; P742-E745 VanDerWaalsContact O-N 3.08Å; E745-P760 CarbonylContact O-C 3.52Å; E745-P760 WeakPolarHBondContact O-CA 3.39Å; E745-R761 WeakPolarHBondContact O-CB 3.21Å; E745-R761 PolarHBondContact O-N 2.79Å
746	Y	77.1	Confident	77.6	Confident	67 Å²	67	84.2 Å²	84.2	26%	0.263	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	154.2	-178.5	-64.2	-90.9	0	0	0	111.9	F741 P742 P743 I758 A759 P760	F741-Y746 HydrophobicContact CD1-CD1 4.17Å; F741-Y746 AromaticContact CD1-CD2 3.89Å; F741-Y746 HydrophobicContact CD1-CD2 3.89Å; F741-Y746 HydrophobicContact CD1-CE1 4.15Å; F741-Y746 AromaticContact CD1-CE2 3.91Å; F741-Y746 HydrophobicContact CD1-CE2 3.91Å; F741-Y746 HydrophobicContact CD1-CG 4.04Å; F741-Y746 HydrophobicContact CE1-CD1 4.44Å; F741-Y746 HydrophobicContact CE1-CE1 4.12Å; F741-Y746 HydrophobicContact CE1-CE2 4.48Å; P742-Y746 HydrophobicContact CG-CD2 4.15Å; P742-Y746 HydrophobicContact CG-CE2 4.27Å; P742-Y746 PolarHBondContact O-N 3.04Å; P743-Y746 VanDerWaalsContact O-O 3.13Å; Y746-I758 HydrophobicContact CD1-CG2 3.79Å; Y746-I758 HydrophobicContact CG-CG2 4.17Å; Y746-A759 CarbonylContact C-O 3.57Å; Y746-A759 VanDerWaalsContact CA-O 3.3Å; Y746-A759 WeakPolarHBondContact CA-O 3.39Å; Y746-P760 HydrophobicContact CD1-CB 4.16Å; Y746-P760 HydrophobicContact CE1-CB 3.98Å
747	C	81.2	Confident	77.8	Confident	31 Å²	31	79.8 Å²	79.8	21%	0.209	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	155.5	170.6	62.4	0	0	0	0	110.7	A759	C747-A759 PolarHBondContact N-O 2.9Å; C747-A759 PolarHBondContact O-N 3.35Å
748	L	81.6	Confident	78	Confident	28 Å²	28	76.6 Å²	76.6	15%	0.147	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	124.7	170.2	-60.6	171.9	0	0	0	108.1	V729 F730 L733 V756 I758	V729-L748 HydrophobicContact CB-CD1 4.31Å; V729-L748 HydrophobicContact CG1-CD1 3.8Å; V729-L748 HydrophobicContact CG1-CD2 4.3Å; F730-L748 HydrophobicContact CE1-CD2 4.41Å; F730-L748 HydrophobicContact CE2-CG 4.12Å; F730-L748 HydrophobicContact CZ-CD2 4.18Å; F730-L748 HydrophobicContact CZ-CG 3.93Å; L733-L748 HydrophobicContact CD1-CD2 4.11Å; L748-V756 HydrophobicContact CB-CG1 4.24Å; L748-V756 HydrophobicContact CD2-CG1 4.13Å; L748-I758 HydrophobicContact CD2-CG1 4.29Å
749	Q	79.1	Confident	78.2	Confident	97 Å²	97	74.9 Å²	74.9	45%	0.453	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	136.8	172.7	-65.3	-173.8	-4.2	0	0	109.2	V756 L757 A759	Q749-V756 WeakPolarHBondContact O-CA 3.38Å; Q749-L757 PolarHBondContact N-O 3.18Å; Q749-L757 PolarHBondContact O-N 3.16Å; Q749-A759 VanDerWaalsContact CD-CB 3.43Å; Q749-A759 HydrophobicContact CG-CB 3.89Å; Q749-A759 VanDerWaalsContact NE2-CB 3.32Å
750	Y	78.1	Confident	78.4	Confident	165 Å²	165	72.2 Å²	72.2	65%	0.647	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	124.3	173.3	-75.4	-96.8	0	0	0	109.6	S755 V756	Y750-S755 CarbonylContact C-O 3.6Å; Y750-S755 WeakPolarHBondContact CA-O 3.48Å; Y750-V756 HydrophobicContact CD1-CG2 3.82Å; Y750-V756 HydrophobicContact CE1-CG2 3.49Å; Y750-V756 VanDerWaalsContact CE1-CG2 3.49Å
751	G	82.6	Confident	78.1	Confident	25 Å²	25	75.7 Å²	75.7	26%	0.258	43%	0.431	S	S	.	.			trans	-73.8	155.7	170.7	0	0	0	0	0	111.6	D753 G754 S755	G751-D753 WeakPolarHBondContact CA-OD1 3.46Å; G751-D753 PolarHBondContact O-N 3.22Å; G751-D753 VanDerWaalsContact O-N 3.15Å; G751-G754 PolarHBondContact O-N 2.9Å; G751-S755 PolarHBondContact N-O 3.13Å
752	A	76.1	Confident	77.4	Confident	121 Å²	121	76.8 Å²	76.8	100%	1	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-10.4	175.8	0	0	0	0	0	113.6
753	D	79.3	Confident	76.1	Confident	128 Å²	128	77.7 Å²	77.7	68%	0.684	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-1.4	171.5	64.3	-19.9	0	0	0	113.4	G751 S755	G751-D753 WeakPolarHBondContact CA-OD1 3.46Å; G751-D753 PolarHBondContact O-N 3.22Å; G751-D753 VanDerWaalsContact O-N 3.15Å; D753-S755 VanDerWaalsContact C-N 3.34Å; D753-S755 VanDerWaalsContact OD1-CB 3.26Å; D753-S755 WeakPolarHBondContact OD1-CB 3.48Å; D753-S755 PolarHBondContact OD1-N 2.85Å; D753-S755 PolarHBondContact OD1-OG 3.15Å; D753-S755 WeakPolarHBondContact OD2-CB 3.39Å; D753-S755 PolarHBondContact OD2-OG 3.27Å
754	G	76.4	Confident	74.7	Confident	60 Å²	60	79.8 Å²	79.8	62%	0.619	49%	0.493	S	S	*	.	S	Bend	trans	82.1	5.5	-173.9	0	0	0	0	0	114.5	G751	G751-G754 PolarHBondContact O-N 2.9Å
755	S	79.5	Confident	73.2	Confident	38 Å²	38	79.7 Å²	79.7	27%	0.266	50%	0.498	S	S	.	.			trans	-67.6	153.7	171.8	65.7	0	0	0	0	111.5	Y750 G751 D753	Y750-S755 CarbonylContact C-O 3.6Å; Y750-S755 WeakPolarHBondContact CA-O 3.48Å; G751-S755 PolarHBondContact N-O 3.13Å; D753-S755 VanDerWaalsContact C-N 3.34Å; D753-S755 VanDerWaalsContact OD1-CB 3.26Å; D753-S755 WeakPolarHBondContact OD1-CB 3.48Å; D753-S755 PolarHBondContact OD1-N 2.85Å; D753-S755 PolarHBondContact OD1-OG 3.15Å; D753-S755 WeakPolarHBondContact OD2-CB 3.39Å; D753-S755 PolarHBondContact OD2-OG 3.27Å
756	V	79.5	Confident	71.4	Confident	74 Å²	74	78.5 Å²	78.5	45%	0.448	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	120.4	174.2	-172.4	0	0	0	0	108.8	L748 Q749 Y750	L748-V756 HydrophobicContact CB-CG1 4.24Å; L748-V756 HydrophobicContact CD2-CG1 4.13Å; Q749-V756 WeakPolarHBondContact O-CA 3.38Å; Y750-V756 HydrophobicContact CD1-CG2 3.82Å; Y750-V756 HydrophobicContact CE1-CG2 3.49Å; Y750-V756 VanDerWaalsContact CE1-CG2 3.49Å
757	L	81.8	Confident	69.6	Low	99 Å²	99	80.4 Å²	80.4	52%	0.518	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	142	-176	-60	177.3	0	0	0	110.4	Q749	Q749-L757 PolarHBondContact N-O 3.18Å; Q749-L757 PolarHBondContact O-N 3.16Å
758	I	82.6	Confident	67.6	Low	64 Å²	64	83.4 Å²	83.4	33%	0.328	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93	116.7	174.7	-53.8	166.8	0	0	0	107.8	F730 L733 F741 Y746 L748	F730-I758 HydrophobicContact CE1-CG2 4.42Å; L733-I758 HydrophobicContact CD1-CD1 3.74Å; L733-I758 HydrophobicContact CD1-CG1 4.12Å; L733-I758 HydrophobicContact CD2-CD1 4.09Å; L733-I758 HydrophobicContact CG-CD1 4.35Å; F741-I758 HydrophobicContact CD1-CG2 4.35Å; F741-I758 HydrophobicContact CD2-CD1 4.17Å; F741-I758 HydrophobicContact CE1-CG2 4.45Å; F741-I758 HydrophobicContact CE2-CD1 3.91Å; F741-I758 HydrophobicContact CZ-CD1 4.36Å; Y746-I758 HydrophobicContact CD1-CG2 3.79Å; Y746-I758 HydrophobicContact CG-CG2 4.17Å; L748-I758 HydrophobicContact CD2-CG1 4.29Å
759	A	79.8	Confident	65.6	Low	15 Å²	15	90.7 Å²	90.7	12%	0.124	60%	0.598	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.9	139	-178.8	0	0	0	0	0	111.5	Y746 C747 Q749 R761	Y746-A759 CarbonylContact C-O 3.57Å; Y746-A759 VanDerWaalsContact CA-O 3.3Å; Y746-A759 WeakPolarHBondContact CA-O 3.39Å; C747-A759 PolarHBondContact N-O 2.9Å; C747-A759 PolarHBondContact O-N 3.35Å; Q749-A759 VanDerWaalsContact CD-CB 3.43Å; Q749-A759 HydrophobicContact CG-CB 3.89Å; Q749-A759 VanDerWaalsContact NE2-CB 3.32Å; A759-R761 PolarHBondContact O-N 2.98Å
760	P	79.8	Confident	63.4	Low	74 Å²	74	95.1 Å²	95.1	48%	0.481	62%	0.619	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.3	123.3	175.9	28	-33	0	0	0	111.1	E745 Y746 G762 G763	E745-P760 CarbonylContact O-C 3.52Å; E745-P760 WeakPolarHBondContact O-CA 3.39Å; Y746-P760 HydrophobicContact CD1-CB 4.16Å; Y746-P760 HydrophobicContact CE1-CB 3.98Å; P760-G762 PolarHBondContact O-N 3.39Å; P760-G763 PolarHBondContact O-N 3.14Å
761	R	69.5	Low	61.5	Low	151 Å²	151	92.9 Å²	92.9	57%	0.57	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-12.4	-175.8	-161.2	-171.9	-81	-123.7	7.6	113.7	P743 E745 A759	P743-R761 PolarHBondContact O-NH2 2.86Å; E745-R761 WeakPolarHBondContact O-CB 3.21Å; E745-R761 PolarHBondContact O-N 2.79Å; A759-R761 PolarHBondContact O-N 2.98Å
762	G	61.1	Low	59.1	Low	61 Å²	61	97.5 Å²	97.5	63%	0.629	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.1	24	179.9	0	0	0	0	0	115.6	P760 A764	P760-G762 PolarHBondContact O-N 3.39Å; G762-A764 PolarHBondContact O-N 2.97Å
763	G	49.5	Very low	57.3	Low	66 Å²	66	103.4 Å²	103.4	68%	0.68	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	28.8	-165.6	0	0	0	0	0	120.1	P760	P760-G763 PolarHBondContact O-N 3.14Å
764	A	42.6	Very low	55	Low	101 Å²	101	106.9 Å²	106.9	84%	0.835	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	-26.7	-179.9	0	0	0	0	0	115.2	G762	G762-A764 PolarHBondContact O-N 2.97Å
765	A	43.3	Very low	53.3	Low	89 Å²	89	110 Å²	110	74%	0.736	67%	0.667	S	S	*	*	S	Bend	trans	-96.5	-23.7	-168.3	0	0	0	0	0	115.5
766	A	39.8	Very low	51.2	Low	94 Å²	94	116.2 Å²	116.2	78%	0.777	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-79.9	-20.5	-164.8	0	0	0	0	0	115.5	A768	A766-A768 VanDerWaalsContact C-N 3.27Å; A766-A768 PolarHBondContact O-N 2.9Å
767	A	38.3	Very low	49.1	Very low	108 Å²	108	122.9 Å²	122.9	89%	0.893	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-74.7	-8.1	-169.5	0	0	0	0	0	115.2
768	A	40.3	Very low	47	Very low	94 Å²	94	126.1 Å²	126.1	78%	0.777	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-89.7	-2.3	-166.3	0	0	0	0	0	116	A766	A766-A768 VanDerWaalsContact C-N 3.27Å; A766-A768 PolarHBondContact O-N 2.9Å
769	Q	39.3	Very low	44.8	Very low	181 Å²	181	130.8 Å²	130.8	85%	0.846	75%	0.746	S	S	*	*			trans	-120.1	80.2	-172.7	-63.9	-165.2	28.9	0	0	114.5
770	Q	31.4	Very low	42.6	Very low	189 Å²	189	139.5 Å²	139.5	88%	0.883	78%	0.781	S	S	*	*			trans	-115.6	106.1	151.6	-76.9	-151.4	18.2	0	0	110.8	S772	Q770-S772 PolarHBondContact O-N 2.77Å
771	P	38.6	Very low	40.9	Very low	119 Å²	119	142.1 Å²	142.1	77%	0.773	79%	0.791	S	S	*	*			trans	-77	108.6	176.6	29.8	-32.6	0	0	0	111	R773	P771-R773 PolarHBondContact O-N 3.41Å
772	S	31.8	Very low	39.4	Very low	121 Å²	121	144 Å²	144	85%	0.846	80%	0.803	S	S	*	*			trans	-66.9	124.8	178.9	67.7	0	0	0	0	112.5	Q770	Q770-S772 PolarHBondContact O-N 2.77Å
773	R	39	Very low	38.7	Very low	246 Å²	246	150.6 Å²	150.6	93%	0.928	82%	0.815	S	S	*	*			trans	-81.2	125.4	179.2	-74.9	177.8	166.3	173.7	-4	111.9	P771	P771-R773 PolarHBondContact O-N 3.41Å
774	K	31.4	Very low	38.4	Very low	201 Å²	201	160.3 Å²	160.3	87%	0.874	84%	0.838	S	S	*	*			trans	-137.6	156.8	158.8	-78.6	-168.2	177.3	174	0	111.5
775	P	40.2	Very low	38.2	Very low	124 Å²	124	163.3 Å²	163.3	81%	0.805	84%	0.838	S	S	*	*			trans	-103.4	178.7	-148.6	39.6	-37.2	0	0	0	116.8
776	E	35.3	Very low	37.9	Very low	169 Å²	169	167.2 Å²	167.2	79%	0.79	84%	0.844	S	S	*	*			trans	-44.5	154.3	-172.9	-53.2	174.1	83.5	0	0	118.8
777	K	36.1	Very low	37.8	Very low	215 Å²	215	171.3 Å²	171.3	94%	0.935	85%	0.847	S	S	*	*				-149.5	127.2	129.9	-117.4	166.3	-172.5	173.5	0	114.6
778	K	36.8	Very low	37.8	Very low	167 Å²	167	175 Å²	175	73%	0.726	85%	0.845	S	S	*	*			trans	-40	145	-176.7	-72.4	176.7	172.2	178.7	0	119.5
779	Q	36.2	Very low	37.6	Very low	162 Å²	162	180.1 Å²	180.1	76%	0.757	85%	0.849	S	S	*	*			trans	51.2	133.9	132.5	-63	177.9	-59.8	0	0	120.4
780	K	35.4	Very low	37.5	Very low	197 Å²	197	180 Å²	180	86%	0.857	85%	0.849	S	S	*	*				-170.4	139.2	92	-166.4	170	-179	177.5	0	113.2
781	D	42.3	Very low	38	Very low	130 Å²	130	179.4 Å²	179.4	70%	0.695	85%	0.847	S	S	*	*			trans	-62.4	144.8	170.3	-53.7	-108.9	0	0	0	113.4
782	K	39.7	Very low	37.9	Very low	191 Å²	191	184 Å²	184	83%	0.83	85%	0.852	S	S	*	*				-178.4	105.4	101.5	-96.7	173.8	-178	-176.3	0	114.2
783	K	46.4	Very low	38.4	Very low	199 Å²	199	189.3 Å²	189.3	87%	0.865	85%	0.853	S	S	*	*				18.8	117.4	125.5	-178.2	174.4	-174.5	170.8	0	117.2
784	K	42.5	Very low	38.4	Very low	270 Å²	270	184.1 Å²	184.1	100%	1.174	85%	0.846	S	S	*	*				-142.7	0	109	-138	-177.6	-177.8	-172.2	0	111.7

Retrieved 784 of 784 residues in 808.8 ms (Link to these results)

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