A0A077Z7E5_TRITR Loading...

PAX-interacting protein 1

AlphaFold DB , UniProt , Accession A0A077Z7E5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 725 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	60.5	Low	89.4	Confident	234 Å²	234	61.2 Å²	61.2	100%	1.153	31%	0.314	S	S	*	.				0	147.7	0	-68.3	-176.8	-74.1	0	0	107.5
2	A	84.4	Confident	89.8	Confident	39 Å²	39	56.3 Å²	56.3	32%	0.322	29%	0.289	S	S	.	.			trans	-83.2	122	174.9	0	0	0	0	0	108.8	F4 Q5 N31	A2-F4 VanDerWaalsContact C-N 3.29Å; A2-F4 PolarHBondContact O-N 3.33Å; A2-Q5 HydrophobicContact CB-CB 4.09Å; A2-Q5 PolarHBondContact O-N 3.5Å; A2-N31 CarbonylContact C-O 3.55Å; A2-N31 WeakPolarHBondContact CB-O 3.41Å
3	V	90.2	Very high	90	Very high	21 Å²	21	58.2 Å²	58.2	13%	0.127	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-34	-169.4	178	0	0	0	0	112.5	N31 F81	V3-N31 HydrophobicContact CB-CB 3.97Å; V3-N31 HydrophobicContact CG2-CB 4.38Å; V3-N31 VanDerWaalsContact CG2-OD1 3.32Å; V3-N31 WeakPolarHBondContact CG2-OD1 3.44Å; V3-N31 PolarHBondContact N-O 2.92Å; V3-N31 VanDerWaalsContact N-O 3.17Å; V3-F81 VanDerWaalsContact CG1-C 3.49Å
4	F	93.5	Very high	90	Very high	1 Å²	1	58.8 Å²	58.8	0%	0.004	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	26.2	-174	-54.7	-57.9	0	0	0	112.7	A2 N6 L7 L28 N31 A33 W72 V73 V77 A82	A2-F4 VanDerWaalsContact C-N 3.29Å; A2-F4 PolarHBondContact O-N 3.33Å; F4-N6 PolarHBondContact O-N 3.26Å; F4-L7 HydrophobicContact CB-CD1 4.02Å; F4-L7 HydrophobicContact CD1-CD1 4.01Å; F4-L7 HydrophobicContact CG-CD1 4.47Å; F4-L7 WeakPolarHBondContact O-CB 3.33Å; F4-L7 PolarHBondContact O-N 3.5Å; F4-L7 VanDerWaalsContact O-N 3.08Å; F4-L28 HydrophobicContact CD2-CD2 3.83Å; F4-L28 HydrophobicContact CE2-CD2 4.02Å; F4-L28 HydrophobicContact CG-CD2 4.23Å; F4-N31 HydrophobicContact CD2-CB 3.59Å; F4-N31 HydrophobicContact CE2-CB 3.97Å; F4-N31 PolarHBondContact N-O 3.4Å; F4-A33 HydrophobicContact CB-CB 3.73Å; F4-A33 HydrophobicContact CG-CB 4.48Å; F4-W72 AromaticContact CD1-CH2 3.7Å; F4-W72 HydrophobicContact CD1-CH2 3.7Å; F4-W72 AromaticContact CD1-CZ3 3.91Å; F4-W72 HydrophobicContact CD1-CZ3 3.91Å; F4-W72 HydrophobicContact CE1-CE3 4.32Å; F4-W72 AromaticContact CE1-CH2 3.57Å; F4-W72 HydrophobicContact CE1-CH2 3.57Å; F4-W72 HydrophobicContact CE1-CZ2 4.31Å; F4-W72 AromaticContact CE1-CZ3 3.58Å; F4-W72 HydrophobicContact CE1-CZ3 3.58Å; F4-W72 HydrophobicContact CZ-CZ3 4.42Å; F4-V73 HydrophobicContact CE2-CG1 3.94Å; F4-V73 HydrophobicContact CZ-CB 4.38Å; F4-V73 HydrophobicContact CZ-CG1 3.94Å; F4-V77 HydrophobicContact CE2-CG2 3.52Å; F4-V77 HydrophobicContact CZ-CG2 3.77Å; F4-A82 HydrophobicContact CD1-CB 4.34Å
5	Q	89.4	Confident	90.1	Very high	125 Å²	125	55.1 Å²	55.1	58%	0.584	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	131.7	-177	-168.3	172.7	-5.9	0	0	111.3	A2 L7	A2-Q5 HydrophobicContact CB-CB 4.09Å; A2-Q5 PolarHBondContact O-N 3.5Å; Q5-L7 VanDerWaalsContact C-N 3.29Å; Q5-L7 PolarHBondContact O-N 3.36Å
6	N	88.5	Confident	90.3	Very high	136 Å²	136	52.3 Å²	52.3	73%	0.727	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	1	-177.4	-45.8	-42.8	0	0	0	116.4	F4	F4-N6 PolarHBondContact O-N 3.26Å
7	L	93	Very high	90.4	Very high	37 Å²	37	55.5 Å²	55.5	19%	0.194	31%	0.313	C	S	.	.			trans	-79.8	126.2	171.6	-59.4	179.9	0	0	0	110.8	F4 Q5 V9 R34 I45 W72	F4-L7 HydrophobicContact CB-CD1 4.02Å; F4-L7 HydrophobicContact CD1-CD1 4.01Å; F4-L7 HydrophobicContact CG-CD1 4.47Å; F4-L7 WeakPolarHBondContact O-CB 3.33Å; F4-L7 PolarHBondContact O-N 3.5Å; F4-L7 VanDerWaalsContact O-N 3.08Å; Q5-L7 VanDerWaalsContact C-N 3.29Å; Q5-L7 PolarHBondContact O-N 3.36Å; L7-V9 HydrophobicContact CB-CG2 3.96Å; L7-R34 PolarHBondContact O-N 3.28Å; L7-I45 HydrophobicContact CD1-CD1 3.95Å; L7-I45 HydrophobicContact CD2-CD1 4.49Å; L7-W72 HydrophobicContact CD1-CH2 3.83Å
8	K	94.9	Very high	90.5	Very high	51 Å²	51	58.4 Å²	58.4	22%	0.222	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	125.8	161.7	-170.7	-168.9	-178.8	-162.5	0	107.8	R34 S36 T40 S42 I43 S44 I45	K8-R34 CarbonylContact C-O 3.57Å; K8-R34 WeakPolarHBondContact CA-O 3.35Å; K8-S36 VanDerWaalsContact CE-OG 3.29Å; K8-S36 WeakPolarHBondContact CE-OG 3.49Å; K8-T40 PolarHBondContact NZ-OG1 3.46Å; K8-S42 WeakPolarHBondContact CD-O 3.33Å; K8-S42 PolarHBondContact NZ-OG 3.38Å; K8-I43 HydrophobicContact CD-CG1 3.88Å; K8-I43 HydrophobicContact CG-CG1 4.11Å; K8-S44 PolarHBondContact N-OG 3.41Å; K8-S44 WeakPolarHBondContact O-CB 3.26Å; K8-S44 PolarHBondContact O-N 2.74Å; K8-S44 PolarHBondContact O-OG 3.47Å; K8-I45 PolarHBondContact O-N 2.84Å
9	V	96.2	Very high	90.7	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134.3	-168.9	-179.7	0	0	0	0	110.2	L7 L28 A33 R34 L35 S36 I45 I47	L7-V9 HydrophobicContact CB-CG2 3.96Å; V9-L28 HydrophobicContact CG1-CD1 3.95Å; V9-L28 HydrophobicContact CG1-CD2 4.28Å; V9-L28 HydrophobicContact CG2-CD2 4.23Å; V9-A33 HydrophobicContact CG2-CB 4.15Å; V9-R34 PolarHBondContact N-O 3.11Å; V9-L35 CarbonylContact O-C 3.5Å; V9-L35 WeakPolarHBondContact O-CA 3.33Å; V9-S36 PolarHBondContact O-N 2.99Å; V9-I45 WeakPolarHBondContact CA-O 3.49Å; V9-I47 HydrophobicContact CG1-CD1 3.43Å; V9-I47 VanDerWaalsContact CG1-CD1 3.43Å; V9-I47 HydrophobicContact CG1-CG1 3.81Å
10	Y	96.2	Very high	90.8	Very high	20 Å²	20	61.2 Å²	61.2	8%	0.078	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	145	170.5	179.6	-115	0	0	0	109.9	V12 L39 I43 I45 L46 I47 E55	Y10-V12 HydrophobicContact CD1-CG2 4.2Å; Y10-V12 HydrophobicContact CE1-CG2 3.93Å; Y10-L39 HydrophobicContact CD1-CB 4.25Å; Y10-L39 HydrophobicContact CD1-CD1 4.21Å; Y10-L39 HydrophobicContact CE1-CB 4.05Å; Y10-I43 VanDerWaalsContact CB-CD1 3.5Å; Y10-I43 HydrophobicContact CG-CD1 4.16Å; Y10-I45 PolarHBondContact N-O 3.47Å; Y10-I45 VanDerWaalsContact N-O 3.16Å; Y10-L46 HydrophobicContact CD1-CD1 3.88Å; Y10-L46 HydrophobicContact CD1-CG 4.24Å; Y10-L46 HydrophobicContact CE1-CD1 4.39Å; Y10-L46 CarbonylContact O-C 3.49Å; Y10-I47 PolarHBondContact O-N 2.73Å; Y10-E55 HydrophobicContact CE1-CB 4.43Å
11	I	96.3	Very high	91	Very high	9 Å²	9	58.3 Å²	58.3	5%	0.046	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	115.4	179.9	-59.1	166.4	0	0	0	106.2	P13 I16 V24 R25 L28 L35 I47	I11-P13 WeakPolarHBondContact O-CD 3.38Å; I11-I16 HydrophobicContact CG2-CD1 3.68Å; I11-V24 HydrophobicContact CD1-CG1 4.06Å; I11-R25 HydrophobicContact CD1-CB 4.43Å; I11-R25 HydrophobicContact CD1-CG 3.54Å; I11-L28 HydrophobicContact CD1-CD1 3.83Å; I11-L28 HydrophobicContact CG1-CD1 4.32Å; I11-L35 HydrophobicContact CD1-CD2 3.87Å; I11-L35 HydrophobicContact CG1-CD2 4.49Å; I11-I47 HydrophobicContact CG1-CB 4.31Å; I11-I47 HydrophobicContact CG1-CD1 4.27Å
12	V	94.7	Very high	92.7	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.012	29%	0.294	C	S	.	.			trans	-70.3	123.8	-174.9	-174.6	0	0	0	0	110.1	Y10 T15 L46 I47 A48 S53 E55 V56	Y10-V12 HydrophobicContact CD1-CG2 4.2Å; Y10-V12 HydrophobicContact CE1-CG2 3.93Å; V12-T15 HydrophobicContact CB-CG2 3.83Å; V12-T15 HydrophobicContact CG1-CG2 3.55Å; V12-T15 PolarHBondContact O-OG1 2.96Å; V12-L46 HydrophobicContact CG2-CD1 3.62Å; V12-L46 HydrophobicContact CG2-CD2 3.63Å; V12-L46 HydrophobicContact CG2-CG 3.74Å; V12-I47 PolarHBondContact N-O 3Å; V12-A48 HydrophobicContact CB-CB 4.26Å; V12-A48 HydrophobicContact CG2-CB 4.1Å; V12-S53 WeakPolarHBondContact CG1-OG 3.31Å; V12-E55 HydrophobicContact CG1-CB 4.03Å; V12-E55 HydrophobicContact CG1-CG 4.25Å; V12-E55 HydrophobicContact CG2-CB 4.11Å; V12-V56 HydrophobicContact CG2-CG2 4.38Å
13	P	91.9	Very high	93.2	Very high	82 Å²	82	52.1 Å²	52.1	53%	0.532	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	145.6	175.4	-24.1	34.7	0	0	0	112.6	I11 T15	I11-P13 WeakPolarHBondContact O-CD 3.38Å; P13-T15 PolarHBondContact O-N 3.36Å
14	G	90.8	Very high	93.5	Very high	66 Å²	66	51.1 Å²	51.1	68%	0.68	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	-26.3	174.3	0	0	0	0	0	116.6	I16	G14-I16 PolarHBondContact O-N 3.3Å
15	T	91.3	Very high	93.6	Very high	4 Å²	4	54.8 Å²	54.8	3%	0.025	30%	0.304	C	S	.	.	S	Bend	trans	-70.2	-16.1	179.7	64.2	0	0	0	0	114.3	V12 P13 A48 D49 Q50	V12-T15 HydrophobicContact CB-CG2 3.83Å; V12-T15 HydrophobicContact CG1-CG2 3.55Å; V12-T15 PolarHBondContact O-OG1 2.96Å; P13-T15 PolarHBondContact O-N 3.36Å; T15-A48 HydrophobicContact CG2-CB 4.09Å; T15-A48 WeakPolarHBondContact OG1-CA 3.35Å; T15-A48 WeakPolarHBondContact OG1-CB 3.27Å; T15-D49 WeakPolarHBondContact O-CB 3.33Å; T15-Q50 HydrophobicContact CG2-CB 4.35Å
16	I	92.3	Very high	93.9	Very high	9 Å²	9	54.3 Å²	54.3	5%	0.046	30%	0.3	C	S	.	.	S	Bend	trans	-130	137.7	-177.6	-55.8	157.8	0	0	0	107.2	I11 G14 E18 R20 A21 I47 D49	I11-I16 HydrophobicContact CG2-CD1 3.68Å; G14-I16 PolarHBondContact O-N 3.3Å; I16-E18 PolarHBondContact O-N 3.41Å; I16-R20 HydrophobicContact CG2-CB 4Å; I16-R20 HydrophobicContact CG2-CG 3.87Å; I16-A21 HydrophobicContact CB-CB 4.29Å; I16-A21 HydrophobicContact CG2-CB 4.07Å; I16-I47 HydrophobicContact CD1-CG2 3.94Å; I16-D49 HydrophobicContact CG1-CB 3.98Å
17	D	93.2	Very high	94.2	Very high	107 Å²	107	49.1 Å²	49.1	57%	0.572	27%	0.272	S	S	*	.			trans	-50.8	136.2	170.4	166	-93.9	0	0	0	111.4	A19 R20 A21	D17-A19 VanDerWaalsContact C-N 3.33Å; D17-A19 PolarHBondContact O-N 3.05Å; D17-A19 WeakPolarHBondContact OD1-CA 3.25Å; D17-A19 WeakPolarHBondContact OD1-CB 3.44Å; D17-A19 PolarHBondContact OD1-N 3.27Å; D17-R20 HydrophobicContact CB-CB 4.27Å; D17-R20 CarbonylContact O-C 3.52Å; D17-R20 WeakPolarHBondContact O-CA 3.37Å; D17-R20 WeakPolarHBondContact O-CB 3.14Å; D17-R20 PolarHBondContact O-N 3.41Å; D17-R20 VanDerWaalsContact O-N 3.1Å; D17-R20 PolarHBondContact OD1-N 2.94Å; D17-A21 WeakPolarHBondContact O-CB 3.22Å; D17-A21 PolarHBondContact O-N 3.47Å
18	E	92.5	Very high	94.4	Very high	109 Å²	109	47.3 Å²	47.3	51%	0.509	26%	0.263	S	S	.	.	H	α-helix	trans	-69.3	-26.9	-169.2	-171.5	54.5	-137.5	0	0	113.5	I16 A21 S22 R25	I16-E18 PolarHBondContact O-N 3.41Å; E18-A21 PolarHBondContact O-N 2.99Å; E18-S22 VanDerWaalsContact O-CB 3.23Å; E18-S22 WeakPolarHBondContact O-CB 3.34Å; E18-S22 PolarHBondContact O-N 3.25Å; E18-R25 IonicContact OE1-CZ 3.23Å; E18-R25 IonicContact OE1-NE 2.95Å; E18-R25 IonicContact OE1-NH2 3.3Å; E18-R25 PolarHBondContact OE1-NH2 2.99Å; E18-R25 IonicContact OE2-NH2 3.02Å; E18-R25 PolarHBondContact OE2-NH2 3.27Å
19	A	93.4	Very high	94.3	Very high	75 Å²	75	48.3 Å²	48.3	62%	0.62	28%	0.276	S	S	*	.	H	α-helix	trans	-68.5	-40.9	173	0	0	0	0	0	110.7	D17 L23	D17-A19 VanDerWaalsContact C-N 3.33Å; D17-A19 PolarHBondContact O-N 3.05Å; D17-A19 WeakPolarHBondContact OD1-CA 3.25Å; D17-A19 WeakPolarHBondContact OD1-CB 3.44Å; D17-A19 PolarHBondContact OD1-N 3.27Å; A19-L23 PolarHBondContact O-N 3.41Å; A19-L23 VanDerWaalsContact O-N 3.14Å
20	R	93.3	Very high	94.2	Very high	96 Å²	96	54.2 Å²	54.2	36%	0.362	30%	0.304	S	S	.	.	H	α-helix	trans	-67.8	-39.6	172.5	-176.5	168.4	169.1	165.4	-15.1	112.3	I16 D17 L23 V24 D49 S70	I16-R20 HydrophobicContact CG2-CB 4Å; I16-R20 HydrophobicContact CG2-CG 3.87Å; D17-R20 HydrophobicContact CB-CB 4.27Å; D17-R20 CarbonylContact O-C 3.52Å; D17-R20 WeakPolarHBondContact O-CA 3.37Å; D17-R20 WeakPolarHBondContact O-CB 3.14Å; D17-R20 PolarHBondContact O-N 3.41Å; D17-R20 VanDerWaalsContact O-N 3.1Å; D17-R20 PolarHBondContact OD1-N 2.94Å; R20-L23 PolarHBondContact O-N 3.12Å; R20-V24 WeakPolarHBondContact O-CB 3.33Å; R20-V24 WeakPolarHBondContact O-CG2 3.27Å; R20-V24 PolarHBondContact O-N 2.97Å; R20-D49 IonicContact CZ-OD2 3.99Å; R20-D49 VanDerWaalsContact CZ-OD2 3.28Å; R20-D49 IonicContact NE-OD2 3.6Å; R20-D49 PolarHBondContact NE-OD2 2.94Å; R20-D49 IonicContact NH2-OD1 3.19Å; R20-D49 IonicContact NH2-OD2 3.73Å; R20-D49 PolarHBondContact NH2-OD2 2.9Å; R20-D49 VanDerWaalsContact NH2-OD2 3.13Å; R20-S70 VanDerWaalsContact CZ-OG 3.29Å; R20-S70 PolarHBondContact NE-OG 2.73Å; R20-S70 PolarHBondContact NH2-OG 3.38Å
21	A	94.8	Very high	94.2	Very high	2 Å²	2	54.6 Å²	54.6	2%	0.017	31%	0.307	C	S	.	.	H	α-helix	trans	-64.6	-42.1	176.4	0	0	0	0	0	111.4	I16 D17 E18 V24 R25	I16-A21 HydrophobicContact CB-CB 4.29Å; I16-A21 HydrophobicContact CG2-CB 4.07Å; D17-A21 WeakPolarHBondContact O-CB 3.22Å; D17-A21 PolarHBondContact O-N 3.47Å; E18-A21 PolarHBondContact O-N 2.99Å; A21-V24 PolarHBondContact O-N 3.48Å; A21-R25 WeakPolarHBondContact O-CB 3.33Å; A21-R25 VanDerWaalsContact O-CG 3.23Å; A21-R25 WeakPolarHBondContact O-CG 3.36Å; A21-R25 PolarHBondContact O-N 3.24Å
22	S	95.5	Very high	94	Very high	69 Å²	69	55.7 Å²	55.7	48%	0.483	32%	0.321	S	S	.	.	H	α-helix	trans	-59.3	-45.8	173.5	-177.2	0	0	0	0	112.2	E18 V24 R25 K26	E18-S22 VanDerWaalsContact O-CB 3.23Å; E18-S22 WeakPolarHBondContact O-CB 3.34Å; E18-S22 PolarHBondContact O-N 3.25Å; S22-V24 PolarHBondContact O-N 3.36Å; S22-R25 PolarHBondContact O-N 3.34Å; S22-K26 WeakPolarHBondContact O-CB 3.41Å; S22-K26 PolarHBondContact O-N 2.93Å
23	L	95.3	Very high	94.1	Very high	73 Å²	73	56.1 Å²	56.1	38%	0.382	33%	0.325	S	S	.	.	H	α-helix	trans	-58.5	-45.9	172.7	176.3	62.4	0	0	0	111.8	A19 R20 K26 L27	A19-L23 PolarHBondContact O-N 3.41Å; A19-L23 VanDerWaalsContact O-N 3.14Å; R20-L23 PolarHBondContact O-N 3.12Å; L23-K26 WeakPolarHBondContact O-CB 3.29Å; L23-K26 PolarHBondContact O-N 2.9Å; L23-L27 HydrophobicContact CD1-CD1 4.06Å; L23-L27 HydrophobicContact CD1-CG 4.02Å; L23-L27 HydrophobicContact CG-CD1 3.99Å; L23-L27 HydrophobicContact CG-CG 4.35Å; L23-L27 WeakPolarHBondContact O-CB 3.46Å; L23-L27 VanDerWaalsContact O-CG 3.3Å; L23-L27 WeakPolarHBondContact O-CG 3.47Å; L23-L27 PolarHBondContact O-N 3.33Å
24	V	96	Very high	94.2	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-64	-45.9	179.7	170.3	0	0	0	0	111.5	I11 R20 A21 S22 K26 L27 L28 I47 V73	I11-V24 HydrophobicContact CD1-CG1 4.06Å; R20-V24 WeakPolarHBondContact O-CB 3.33Å; R20-V24 WeakPolarHBondContact O-CG2 3.27Å; R20-V24 PolarHBondContact O-N 2.97Å; A21-V24 PolarHBondContact O-N 3.48Å; S22-V24 PolarHBondContact O-N 3.36Å; V24-K26 VanDerWaalsContact C-N 3.3Å; V24-K26 PolarHBondContact O-N 2.96Å; V24-L27 PolarHBondContact O-N 2.95Å; V24-L28 HydrophobicContact CG1-CD1 3.73Å; V24-L28 HydrophobicContact CG1-CG 4.5Å; V24-L28 WeakPolarHBondContact O-CB 3.49Å; V24-L28 WeakPolarHBondContact O-CD1 3.43Å; V24-L28 VanDerWaalsContact O-CG 3.3Å; V24-L28 WeakPolarHBondContact O-CG 3.45Å; V24-L28 PolarHBondContact O-N 3.31Å; V24-I47 HydrophobicContact CG1-CD1 4.2Å; V24-V73 HydrophobicContact CG1-CB 4.39Å; V24-V73 HydrophobicContact CG1-CG1 4.39Å; V24-V73 HydrophobicContact CG1-CG2 4.17Å
25	R	96.2	Very high	94.5	Very high	78 Å²	78	61.5 Å²	61.5	29%	0.294	32%	0.319	S	S	.	.	H	α-helix	trans	-55.7	-44.5	173.8	-70.8	174.3	-140	-71.4	6.3	111.2	I11 E18 A21 S22 S29 L35	I11-R25 HydrophobicContact CD1-CB 4.43Å; I11-R25 HydrophobicContact CD1-CG 3.54Å; E18-R25 IonicContact OE1-CZ 3.23Å; E18-R25 IonicContact OE1-NE 2.95Å; E18-R25 IonicContact OE1-NH2 3.3Å; E18-R25 PolarHBondContact OE1-NH2 2.99Å; E18-R25 IonicContact OE2-NH2 3.02Å; E18-R25 PolarHBondContact OE2-NH2 3.27Å; A21-R25 WeakPolarHBondContact O-CB 3.33Å; A21-R25 VanDerWaalsContact O-CG 3.23Å; A21-R25 WeakPolarHBondContact O-CG 3.36Å; A21-R25 PolarHBondContact O-N 3.24Å; S22-R25 PolarHBondContact O-N 3.34Å; R25-S29 WeakPolarHBondContact O-CB 3.3Å; R25-S29 PolarHBondContact O-N 2.93Å; R25-S29 PolarHBondContact O-OG 3.42Å; R25-L35 HydrophobicContact CB-CD1 4.14Å; R25-L35 HydrophobicContact CG-CD1 4.37Å
26	K	95.4	Very high	94.7	Very high	115 Å²	115	62.5 Å²	62.5	50%	0.5	33%	0.326	S	S	.	.	H	α-helix	trans	-62.5	-55.7	176	180	-176	173.6	-175.5	0	111.6	S22 L23 V24 L28 S29 E30	S22-K26 WeakPolarHBondContact O-CB 3.41Å; S22-K26 PolarHBondContact O-N 2.93Å; L23-K26 WeakPolarHBondContact O-CB 3.29Å; L23-K26 PolarHBondContact O-N 2.9Å; V24-K26 VanDerWaalsContact C-N 3.3Å; V24-K26 PolarHBondContact O-N 2.96Å; K26-L28 VanDerWaalsContact C-N 3.3Å; K26-L28 PolarHBondContact O-N 3.48Å; K26-S29 PolarHBondContact O-N 3.33Å; K26-S29 VanDerWaalsContact O-N 3.11Å; K26-E30 WeakPolarHBondContact CE-OE1 3.19Å; K26-E30 VanDerWaalsContact CE-OE2 3.25Å; K26-E30 WeakPolarHBondContact CE-OE2 3.48Å; K26-E30 HydrophobicContact CG-CG 4.26Å; K26-E30 IonicContact NZ-OE1 3.45Å; K26-E30 WeakPolarHBondContact O-CG 3.47Å; K26-E30 PolarHBondContact O-N 2.91Å
27	L	95.7	Very high	94.7	Very high	27 Å²	27	66.3 Å²	66.3	14%	0.141	35%	0.354	C	S	.	.	H	α-helix	trans	-57.2	-41.8	-177.6	-72.5	177.3	0	0	0	112.4	L23 V24 N31 V73 I74 V77	L23-L27 HydrophobicContact CD1-CD1 4.06Å; L23-L27 HydrophobicContact CD1-CG 4.02Å; L23-L27 HydrophobicContact CG-CD1 3.99Å; L23-L27 HydrophobicContact CG-CG 4.35Å; L23-L27 WeakPolarHBondContact O-CB 3.46Å; L23-L27 VanDerWaalsContact O-CG 3.3Å; L23-L27 WeakPolarHBondContact O-CG 3.47Å; L23-L27 PolarHBondContact O-N 3.33Å; V24-L27 PolarHBondContact O-N 2.95Å; L27-N31 VanDerWaalsContact O-CB 3.29Å; L27-N31 WeakPolarHBondContact O-CB 3.25Å; L27-N31 PolarHBondContact O-N 2.97Å; L27-N31 VanDerWaalsContact O-N 3.16Å; L27-N31 PolarHBondContact O-ND2 3.32Å; L27-V73 HydrophobicContact CB-CG1 3.94Å; L27-V73 HydrophobicContact CD1-CG1 4.45Å; L27-I74 HydrophobicContact CD1-CG1 4.07Å; L27-V77 HydrophobicContact CB-CG2 4.37Å; L27-V77 HydrophobicContact CD2-CG1 4.22Å
28	L	95.9	Very high	94.7	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-61.7	-47.2	175.6	-76.8	163.6	0	0	0	112	F4 V9 I11 V24 K26 N31 G32 A33 L35 I47 V73	F4-L28 HydrophobicContact CD2-CD2 3.83Å; F4-L28 HydrophobicContact CE2-CD2 4.02Å; F4-L28 HydrophobicContact CG-CD2 4.23Å; V9-L28 HydrophobicContact CG1-CD1 3.95Å; V9-L28 HydrophobicContact CG1-CD2 4.28Å; V9-L28 HydrophobicContact CG2-CD2 4.23Å; I11-L28 HydrophobicContact CD1-CD1 3.83Å; I11-L28 HydrophobicContact CG1-CD1 4.32Å; V24-L28 HydrophobicContact CG1-CD1 3.73Å; V24-L28 HydrophobicContact CG1-CG 4.5Å; V24-L28 WeakPolarHBondContact O-CB 3.49Å; V24-L28 WeakPolarHBondContact O-CD1 3.43Å; V24-L28 VanDerWaalsContact O-CG 3.3Å; V24-L28 WeakPolarHBondContact O-CG 3.45Å; V24-L28 PolarHBondContact O-N 3.31Å; K26-L28 VanDerWaalsContact C-N 3.3Å; K26-L28 PolarHBondContact O-N 3.48Å; L28-N31 CarbonylContact O-C 3.55Å; L28-N31 PolarHBondContact O-N 2.91Å; L28-G32 PolarHBondContact O-N 2.96Å; L28-G32 VanDerWaalsContact O-N 3.17Å; L28-A33 HydrophobicContact CB-CB 3.96Å; L28-A33 HydrophobicContact CD2-CB 3.82Å; L28-A33 WeakPolarHBondContact O-CB 3.15Å; L28-A33 PolarHBondContact O-N 3.5Å; L28-L35 HydrophobicContact CB-CD2 4.05Å; L28-L35 HydrophobicContact CD1-CD2 3.73Å; L28-I47 HydrophobicContact CD1-CD1 3.71Å; L28-I47 HydrophobicContact CD2-CD1 4.48Å; L28-V73 HydrophobicContact CD1-CG2 4.29Å; L28-V73 HydrophobicContact CD2-CG1 4.12Å; L28-V73 HydrophobicContact CD2-CG2 3.9Å; L28-V73 HydrophobicContact CG-CG1 3.88Å; L28-V73 HydrophobicContact CG-CG2 4.14Å
29	S	93.5	Very high	94.8	Very high	72 Å²	72	65.4 Å²	65.4	50%	0.503	34%	0.34	S	S	.	.	H	α-helix	trans	-65.9	-46.8	-178.3	-55.6	0	0	0	0	111.9	R25 K26 N31 G32	R25-S29 WeakPolarHBondContact O-CB 3.3Å; R25-S29 PolarHBondContact O-N 2.93Å; R25-S29 PolarHBondContact O-OG 3.42Å; K26-S29 PolarHBondContact O-N 3.33Å; K26-S29 VanDerWaalsContact O-N 3.11Å; S29-N31 PolarHBondContact O-N 3.02Å; S29-G32 PolarHBondContact O-N 3.03Å
30	E	94.2	Very high	94.8	Very high	124 Å²	124	63.7 Å²	63.7	58%	0.579	32%	0.322	S	S	*	.	H	α-helix	trans	-63.9	-25.2	177.6	-70	179.3	153.5	0	0	112.7	K26	K26-E30 WeakPolarHBondContact CE-OE1 3.19Å; K26-E30 VanDerWaalsContact CE-OE2 3.25Å; K26-E30 WeakPolarHBondContact CE-OE2 3.48Å; K26-E30 HydrophobicContact CG-CG 4.26Å; K26-E30 IonicContact NZ-OE1 3.45Å; K26-E30 WeakPolarHBondContact O-CG 3.47Å; K26-E30 PolarHBondContact O-N 2.91Å
31	N	95.1	Very high	94.8	Very high	27 Å²	27	64.8 Å²	64.8	14%	0.144	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	17	179.9	-70.8	-86.7	0	0	0	114.1	A2 V3 F4 L27 L28 S29 V77	A2-N31 CarbonylContact C-O 3.55Å; A2-N31 WeakPolarHBondContact CB-O 3.41Å; V3-N31 HydrophobicContact CB-CB 3.97Å; V3-N31 HydrophobicContact CG2-CB 4.38Å; V3-N31 VanDerWaalsContact CG2-OD1 3.32Å; V3-N31 WeakPolarHBondContact CG2-OD1 3.44Å; V3-N31 PolarHBondContact N-O 2.92Å; V3-N31 VanDerWaalsContact N-O 3.17Å; F4-N31 HydrophobicContact CD2-CB 3.59Å; F4-N31 HydrophobicContact CE2-CB 3.97Å; F4-N31 PolarHBondContact N-O 3.4Å; L27-N31 VanDerWaalsContact O-CB 3.29Å; L27-N31 WeakPolarHBondContact O-CB 3.25Å; L27-N31 PolarHBondContact O-N 2.97Å; L27-N31 VanDerWaalsContact O-N 3.16Å; L27-N31 PolarHBondContact O-ND2 3.32Å; L28-N31 CarbonylContact O-C 3.55Å; L28-N31 PolarHBondContact O-N 2.91Å; S29-N31 PolarHBondContact O-N 3.02Å; N31-V77 HydrophobicContact CB-CG2 4.5Å
32	G	94	Very high	94.8	Very high	32 Å²	32	67.9 Å²	67.9	33%	0.33	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	16.5	165.4	0	0	0	0	0	116.8	L28 S29	L28-G32 PolarHBondContact O-N 2.96Å; L28-G32 VanDerWaalsContact O-N 3.17Å; S29-G32 PolarHBondContact O-N 3.03Å
33	A	95.3	Very high	94.8	Very high	12 Å²	12	65 Å²	65	10%	0.099	34%	0.336	C	S	.	.			trans	-71.9	157.1	166.1	0	0	0	0	0	111.1	F4 V9 L28	F4-A33 HydrophobicContact CB-CB 3.73Å; F4-A33 HydrophobicContact CG-CB 4.48Å; V9-A33 HydrophobicContact CG2-CB 4.15Å; L28-A33 HydrophobicContact CB-CB 3.96Å; L28-A33 HydrophobicContact CD2-CB 3.82Å; L28-A33 WeakPolarHBondContact O-CB 3.15Å; L28-A33 PolarHBondContact O-N 3.5Å
34	R	95.3	Very high	94.6	Very high	188 Å²	188	63.9 Å²	63.9	71%	0.709	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	107.4	170.8	-64.7	-178.3	179.3	-129	1.2	109.7	L7 K8 V9	L7-R34 PolarHBondContact O-N 3.28Å; K8-R34 CarbonylContact C-O 3.57Å; K8-R34 WeakPolarHBondContact CA-O 3.35Å; V9-R34 PolarHBondContact N-O 3.11Å
35	L	95.9	Very high	94.5	Very high	73 Å²	73	63.9 Å²	63.9	38%	0.382	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	133.1	175.1	-64.8	177.8	0	0	0	111	V9 I11 R25 L28	V9-L35 CarbonylContact O-C 3.5Å; V9-L35 WeakPolarHBondContact O-CA 3.33Å; I11-L35 HydrophobicContact CD1-CD2 3.87Å; I11-L35 HydrophobicContact CG1-CD2 4.49Å; R25-L35 HydrophobicContact CB-CD1 4.14Å; R25-L35 HydrophobicContact CG-CD1 4.37Å; L28-L35 HydrophobicContact CB-CD2 4.05Å; L28-L35 HydrophobicContact CD1-CD2 3.73Å
36	S	95.3	Very high	94.5	Very high	24 Å²	24	60.2 Å²	60.2	17%	0.168	32%	0.32	C	S	.	.			trans	-96.5	143.4	169.8	-158.5	0	0	0	0	110	K8 V9 Y38	K8-S36 VanDerWaalsContact CE-OG 3.29Å; K8-S36 WeakPolarHBondContact CE-OG 3.49Å; V9-S36 PolarHBondContact O-N 2.99Å; S36-Y38 WeakPolarHBondContact CB-O 3.04Å; S36-Y38 PolarHBondContact OG-O 3.19Å
37	S	93.2	Very high	94.4	Very high	90 Å²	90	54.7 Å²	54.7	63%	0.629	30%	0.296	S	S	*	.	S	Bend	trans	-87	-16.6	171.4	53.2	0	0	0	0	113.5
38	Y	93.2	Very high	94.3	Very high	172 Å²	172	53.4 Å²	53.4	68%	0.675	29%	0.29	S	S	*	.	S	Bend	trans	-136.2	151.8	-177	-52.5	-69.9	0	0	0	110.4	S36 I43	S36-Y38 WeakPolarHBondContact CB-O 3.04Å; S36-Y38 PolarHBondContact OG-O 3.19Å; Y38-I43 WeakPolarHBondContact O-CD1 3.49Å
39	L	94.9	Very high	94.1	Very high	24 Å²	24	55.5 Å²	55.5	13%	0.126	30%	0.301	C	S	.	.			trans	-70.9	140.2	167.7	-174	57.1	0	0	0	110.2	Y10 I43 L46 E55 E58 A59 Y63 I65	Y10-L39 HydrophobicContact CD1-CB 4.25Å; Y10-L39 HydrophobicContact CD1-CD1 4.21Å; Y10-L39 HydrophobicContact CE1-CB 4.05Å; L39-I43 HydrophobicContact CD1-CD1 3.95Å; L39-L46 HydrophobicContact CD1-CD1 4.17Å; L39-E55 HydrophobicContact CD2-CB 4.26Å; L39-E55 WeakPolarHBondContact CD2-O 3.32Å; L39-E58 HydrophobicContact CD2-CB 3.88Å; L39-E58 HydrophobicContact CD2-CG 4.12Å; L39-A59 HydrophobicContact CD1-CB 4.12Å; L39-A59 HydrophobicContact CD2-CB 4.16Å; L39-Y63 HydrophobicContact CD1-CD2 4.35Å; L39-Y63 HydrophobicContact CD2-CD2 4.22Å; L39-Y63 HydrophobicContact CD2-CE2 3.98Å; L39-Y63 HydrophobicContact CG-CD2 4.06Å; L39-Y63 HydrophobicContact CG-CE2 3.79Å; L39-I65 HydrophobicContact CD1-CD1 3.81Å
40	T	93.8	Very high	93.9	Very high	39 Å²	39	56.8 Å²	56.8	24%	0.239	30%	0.299	C	S	.	.			trans	-165.8	145.4	-173.4	58.5	0	0	0	0	108.6	K8 S42 I43	K8-T40 PolarHBondContact NZ-OG1 3.46Å; T40-S42 PolarHBondContact O-N 3.02Å; T40-S42 PolarHBondContact OG1-OG 3.26Å; T40-I43 WeakPolarHBondContact O-CB 3.45Å; T40-I43 PolarHBondContact O-N 3.29Å; T40-I43 VanDerWaalsContact O-N 3.09Å
41	D	93.1	Very high	93.4	Very high	120 Å²	120	53 Å²	53	64%	0.642	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-34.6	-40.8	165.1	66.6	-23	0	0	0	116.3	I43 Y63	D41-I43 PolarHBondContact O-N 3.41Å; D41-I43 VanDerWaalsContact O-N 3.16Å; D41-Y63 HydrophobicContact CB-CD1 3.99Å; D41-Y63 HydrophobicContact CB-CE1 4.38Å
42	S	93.5	Very high	93	Very high	66 Å²	66	59 Å²	59	46%	0.462	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	4.1	-174.6	52.8	0	0	0	0	115.3	K8 T40	K8-S42 WeakPolarHBondContact CD-O 3.33Å; K8-S42 PolarHBondContact NZ-OG 3.38Å; T40-S42 PolarHBondContact O-N 3.02Å; T40-S42 PolarHBondContact OG1-OG 3.26Å
43	I	95.2	Very high	92.7	Very high	9 Å²	9	58.1 Å²	58.1	5%	0.046	30%	0.302	C	S	.	.			trans	-81.7	135.4	175.5	-77.6	153.5	0	0	0	110.4	K8 Y10 Y38 L39 T40 D41 I45 I65	K8-I43 HydrophobicContact CD-CG1 3.88Å; K8-I43 HydrophobicContact CG-CG1 4.11Å; Y10-I43 VanDerWaalsContact CB-CD1 3.5Å; Y10-I43 HydrophobicContact CG-CD1 4.16Å; Y38-I43 WeakPolarHBondContact O-CD1 3.49Å; L39-I43 HydrophobicContact CD1-CD1 3.95Å; T40-I43 WeakPolarHBondContact O-CB 3.45Å; T40-I43 PolarHBondContact O-N 3.29Å; T40-I43 VanDerWaalsContact O-N 3.09Å; D41-I43 PolarHBondContact O-N 3.41Å; D41-I43 VanDerWaalsContact O-N 3.16Å; I43-I45 WeakPolarHBondContact CG2-O 3.5Å; I43-I65 HydrophobicContact CB-CD1 3.96Å; I43-I65 HydrophobicContact CG2-CD1 4.23Å; I43-I65 HydrophobicContact CG2-CG2 3.95Å
44	S	92.8	Very high	92.6	Very high	49 Å²	49	62.5 Å²	62.5	34%	0.343	33%	0.329	S	S	.	.	S	Bend	trans	-83.1	-36.4	178.4	-41.6	0	0	0	0	112.4	K8	K8-S44 PolarHBondContact N-OG 3.41Å; K8-S44 WeakPolarHBondContact O-CB 3.26Å; K8-S44 PolarHBondContact O-N 2.74Å; K8-S44 PolarHBondContact O-OG 3.47Å
45	I	93.4	Very high	92.4	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.005	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	132.3	-176.5	-56.2	179.7	0	0	0	109.5	L7 K8 V9 Y10 I43 I47 K66 V68 W72 H85	L7-I45 HydrophobicContact CD1-CD1 3.95Å; L7-I45 HydrophobicContact CD2-CD1 4.49Å; K8-I45 PolarHBondContact O-N 2.84Å; V9-I45 WeakPolarHBondContact CA-O 3.49Å; Y10-I45 PolarHBondContact N-O 3.47Å; Y10-I45 VanDerWaalsContact N-O 3.16Å; I43-I45 WeakPolarHBondContact CG2-O 3.5Å; I45-I47 HydrophobicContact CG2-CG1 4.39Å; I45-K66 WeakPolarHBondContact CA-O 3.45Å; I45-V68 HydrophobicContact CG2-CB 4.41Å; I45-V68 HydrophobicContact CG2-CG1 4.1Å; I45-V68 HydrophobicContact CG2-CG2 3.51Å; I45-W72 HydrophobicContact CD1-CE3 4.46Å; I45-W72 HydrophobicContact CD1-CH2 3.45Å; I45-W72 VanDerWaalsContact CD1-CH2 3.45Å; I45-W72 HydrophobicContact CD1-CZ2 4.01Å; I45-W72 HydrophobicContact CD1-CZ3 3.72Å; I45-H85 WeakPolarHBondContact CD1-NE2 3.37Å
46	L	94.9	Very high	92.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	139.5	165.2	178.5	150.1	0	0	0	109.7	Y10 V12 L39 A48 V56 A59 I65 K66 V67 V68	Y10-L46 HydrophobicContact CD1-CD1 3.88Å; Y10-L46 HydrophobicContact CD1-CG 4.24Å; Y10-L46 HydrophobicContact CE1-CD1 4.39Å; Y10-L46 CarbonylContact O-C 3.49Å; V12-L46 HydrophobicContact CG2-CD1 3.62Å; V12-L46 HydrophobicContact CG2-CD2 3.63Å; V12-L46 HydrophobicContact CG2-CG 3.74Å; L39-L46 HydrophobicContact CD1-CD1 4.17Å; L46-A48 HydrophobicContact CD2-CB 3.93Å; L46-V56 HydrophobicContact CD2-CG2 3.98Å; L46-A59 HydrophobicContact CB-CB 4.27Å; L46-A59 HydrophobicContact CD1-CB 3.42Å; L46-A59 VanDerWaalsContact CD1-CB 3.42Å; L46-A59 HydrophobicContact CG-CB 4.38Å; L46-I65 HydrophobicContact CB-CG2 3.84Å; L46-K66 PolarHBondContact N-O 2.73Å; L46-V67 HydrophobicContact CD2-CB 4.37Å; L46-V67 HydrophobicContact CD2-CG1 3.8Å; L46-V67 HydrophobicContact CD2-CG2 4.12Å; L46-V67 CarbonylContact O-C 3.59Å; L46-V67 WeakPolarHBondContact O-CA 3.37Å; L46-V68 PolarHBondContact O-N 3.26Å
47	I	94.9	Very high	92	Very high	0 Å²	0	53 Å²	53	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.8	176.1	-52.3	176.8	0	0	0	110.6	V9 Y10 I11 V12 I16 V24 L28 I45 V68 V73	V9-I47 HydrophobicContact CG1-CD1 3.43Å; V9-I47 VanDerWaalsContact CG1-CD1 3.43Å; V9-I47 HydrophobicContact CG1-CG1 3.81Å; Y10-I47 PolarHBondContact O-N 2.73Å; I11-I47 HydrophobicContact CG1-CB 4.31Å; I11-I47 HydrophobicContact CG1-CD1 4.27Å; V12-I47 PolarHBondContact N-O 3Å; I16-I47 HydrophobicContact CD1-CG2 3.94Å; V24-I47 HydrophobicContact CG1-CD1 4.2Å; L28-I47 HydrophobicContact CD1-CD1 3.71Å; L28-I47 HydrophobicContact CD2-CD1 4.48Å; I45-I47 HydrophobicContact CG2-CG1 4.39Å; I47-V68 VanDerWaalsContact CA-O 3.26Å; I47-V68 WeakPolarHBondContact CA-O 3.49Å; I47-V68 HydrophobicContact CG1-CG2 3.95Å; I47-V73 HydrophobicContact CD1-CG2 3.48Å; I47-V73 VanDerWaalsContact CD1-CG2 3.48Å
48	A	93.8	Very high	92.1	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.281	C	S	.	.			trans	-151.8	139.9	172.6	0	0	0	0	0	110	V12 T15 L46 V56 V68 A69	V12-A48 HydrophobicContact CB-CB 4.26Å; V12-A48 HydrophobicContact CG2-CB 4.1Å; T15-A48 HydrophobicContact CG2-CB 4.09Å; T15-A48 WeakPolarHBondContact OG1-CA 3.35Å; T15-A48 WeakPolarHBondContact OG1-CB 3.27Å; L46-A48 HydrophobicContact CD2-CB 3.93Å; A48-V56 HydrophobicContact CB-CG2 3.59Å; A48-V68 PolarHBondContact N-O 3.22Å; A48-A69 WeakPolarHBondContact O-CA 3.48Å
49	D	91.4	Very high	92	Very high	43 Å²	43	43.8 Å²	43.8	23%	0.23	25%	0.249	C	C	.	.	S	Bend	trans	-93	-0.6	173.5	-75.2	-17.8	0	0	0	112.7	T15 I16 R20 S70	T15-D49 WeakPolarHBondContact O-CB 3.33Å; I16-D49 HydrophobicContact CG1-CB 3.98Å; R20-D49 IonicContact CZ-OD2 3.99Å; R20-D49 VanDerWaalsContact CZ-OD2 3.28Å; R20-D49 IonicContact NE-OD2 3.6Å; R20-D49 PolarHBondContact NE-OD2 2.94Å; R20-D49 IonicContact NH2-OD1 3.19Å; R20-D49 IonicContact NH2-OD2 3.73Å; R20-D49 PolarHBondContact NH2-OD2 2.9Å; R20-D49 VanDerWaalsContact NH2-OD2 3.13Å; D49-S70 WeakPolarHBondContact OD1-CB 3.43Å; D49-S70 PolarHBondContact OD1-N 3.33Å; D49-S70 PolarHBondContact OD1-OG 2.67Å; D49-S70 PolarHBondContact OD2-OG 3.47Å
50	Q	87.7	Confident	91.7	Very high	99 Å²	99	47.7 Å²	47.7	46%	0.463	26%	0.262	S	S	.	.			trans	-130.4	142.7	178.3	-67.5	169.7	14.2	0	0	108.7	T15	T15-Q50 HydrophobicContact CG2-CB 4.35Å
51	C	84.9	Confident	91.6	Very high	44 Å²	44	51.9 Å²	51.9	30%	0.297	28%	0.283	S	S	.	.	S	Bend	trans	-96	-10.9	-179	56.2	0	0	0	0	113.6	S53 P94 E95	C51-S53 PolarHBondContact O-N 2.88Å; C51-P94 HydrophobicContact CB-CB 4.4Å; C51-P94 HydrophobicContact CB-CG 4.39Å; C51-E95 HydrophobicContact CB-CG 3.95Å
52	E	85.5	Confident	91.6	Very high	153 Å²	153	52 Å²	52	72%	0.715	28%	0.282	S	S	*	.			trans	-79.2	1.5	-173.9	-60.1	85.8	166.4	0	0	114.2
53	S	89.4	Confident	91.5	Very high	15 Å²	15	52.5 Å²	52.5	11%	0.105	27%	0.274	C	S	.	.			trans	-76.6	141	176.3	134.3	0	0	0	0	111.5	V12 C51 E55 V56 G57	V12-S53 WeakPolarHBondContact CG1-OG 3.31Å; C51-S53 PolarHBondContact O-N 2.88Å; S53-E55 VanDerWaalsContact C-N 3.29Å; S53-E55 WeakPolarHBondContact CB-OE2 3.43Å; S53-E55 PolarHBondContact O-N 3.29Å; S53-E55 PolarHBondContact OG-N 2.88Å; S53-E55 VanDerWaalsContact OG-N 3.11Å; S53-E55 PolarHBondContact OG-OE2 3.23Å; S53-V56 WeakPolarHBondContact O-CB 3.44Å; S53-V56 PolarHBondContact O-N 2.96Å; S53-V56 PolarHBondContact OG-N 3.48Å; S53-G57 PolarHBondContact O-N 3.07Å
54	P	92	Very high	91.3	Very high	103 Å²	103	59.1 Å²	59.1	67%	0.669	31%	0.31	S	S	*	.	H	α-helix	trans	-63.8	-33.4	174.2	26.8	-33.6	0	0	0	112.4	V56 G57 E58	P54-V56 VanDerWaalsContact C-N 3.29Å; P54-V56 PolarHBondContact O-N 3.45Å; P54-G57 PolarHBondContact O-N 3.49Å; P54-E58 WeakPolarHBondContact O-CB 3.26Å; P54-E58 PolarHBondContact O-N 2.95Å
55	E	92.4	Very high	91.3	Very high	54 Å²	54	57.3 Å²	57.3	25%	0.252	30%	0.296	S	S	.	.	H	α-helix	trans	-66	-29.1	176.6	-54.5	92.4	152.3	0	0	112.8	Y10 V12 L39 S53 A59	Y10-E55 HydrophobicContact CE1-CB 4.43Å; V12-E55 HydrophobicContact CG1-CB 4.03Å; V12-E55 HydrophobicContact CG1-CG 4.25Å; V12-E55 HydrophobicContact CG2-CB 4.11Å; L39-E55 HydrophobicContact CD2-CB 4.26Å; L39-E55 WeakPolarHBondContact CD2-O 3.32Å; S53-E55 VanDerWaalsContact C-N 3.29Å; S53-E55 WeakPolarHBondContact CB-OE2 3.43Å; S53-E55 PolarHBondContact O-N 3.29Å; S53-E55 PolarHBondContact OG-N 2.88Å; S53-E55 VanDerWaalsContact OG-N 3.11Å; S53-E55 PolarHBondContact OG-OE2 3.23Å; E55-A59 WeakPolarHBondContact O-CB 3.46Å; E55-A59 PolarHBondContact O-N 2.89Å
56	V	91.9	Very high	91.1	Very high	4 Å²	4	62 Å²	62	2%	0.024	32%	0.316	C	S	.	.	H	α-helix	trans	-67.7	-43.8	172.9	171.9	0	0	0	0	110.7	V12 L46 A48 S53 P54 R60 V67	V12-V56 HydrophobicContact CG2-CG2 4.38Å; L46-V56 HydrophobicContact CD2-CG2 3.98Å; A48-V56 HydrophobicContact CB-CG2 3.59Å; S53-V56 WeakPolarHBondContact O-CB 3.44Å; S53-V56 PolarHBondContact O-N 2.96Å; S53-V56 PolarHBondContact OG-N 3.48Å; P54-V56 VanDerWaalsContact C-N 3.29Å; P54-V56 PolarHBondContact O-N 3.45Å; V56-R60 WeakPolarHBondContact O-CB 3.38Å; V56-R60 PolarHBondContact O-N 3.33Å; V56-R60 VanDerWaalsContact O-N 3.14Å; V56-V67 HydrophobicContact CG1-CG1 4.08Å; V56-V67 HydrophobicContact CG1-CG2 4.21Å
57	G	90.7	Very high	90.9	Very high	27 Å²	27	63.3 Å²	63.3	28%	0.278	33%	0.325	S	S	.	.	H	α-helix	trans	-63.3	-48.3	172.7	0	0	0	0	0	112.2	S53 P54 A59 R60 D61	S53-G57 PolarHBondContact O-N 3.07Å; P54-G57 PolarHBondContact O-N 3.49Å; G57-A59 VanDerWaalsContact C-N 3.34Å; G57-A59 PolarHBondContact O-N 3.45Å; G57-R60 PolarHBondContact O-N 2.88Å; G57-D61 WeakPolarHBondContact O-CB 3.35Å; G57-D61 PolarHBondContact O-N 3.34Å
58	E	93.5	Very high	90.8	Very high	70 Å²	70	63.4 Å²	63.4	33%	0.327	33%	0.325	S	S	.	.	H	α-helix	trans	-58.3	-44.9	178.5	-162	-167	155.5	0	0	111.8	L39 P54 I62 Y63	L39-E58 HydrophobicContact CD2-CB 3.88Å; L39-E58 HydrophobicContact CD2-CG 4.12Å; P54-E58 WeakPolarHBondContact O-CB 3.26Å; P54-E58 PolarHBondContact O-N 2.95Å; E58-I62 HydrophobicContact CG-CB 4.46Å; E58-I62 HydrophobicContact CG-CD1 3.85Å; E58-I62 HydrophobicContact CG-CG1 4.29Å; E58-I62 VanDerWaalsContact O-CB 3.31Å; E58-I62 WeakPolarHBondContact O-CB 3.4Å; E58-I62 PolarHBondContact O-N 2.99Å; E58-Y63 HydrophobicContact CG-CD2 4.42Å; E58-Y63 HydrophobicContact CG-CE2 3.8Å; E58-Y63 PolarHBondContact O-N 3.49Å; E58-Y63 WeakPolarHBondContact OE1-CE2 3.41Å; E58-Y63 PolarHBondContact OE1-OH 3.1Å
59	A	92.8	Very high	90.8	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-60.8	-45.3	176.9	0	0	0	0	0	113	L39 L46 E55 G57 Y63 D64 I65	L39-A59 HydrophobicContact CD1-CB 4.12Å; L39-A59 HydrophobicContact CD2-CB 4.16Å; L46-A59 HydrophobicContact CB-CB 4.27Å; L46-A59 HydrophobicContact CD1-CB 3.42Å; L46-A59 VanDerWaalsContact CD1-CB 3.42Å; L46-A59 HydrophobicContact CG-CB 4.38Å; E55-A59 WeakPolarHBondContact O-CB 3.46Å; E55-A59 PolarHBondContact O-N 2.89Å; G57-A59 VanDerWaalsContact C-N 3.34Å; G57-A59 PolarHBondContact O-N 3.45Å; A59-Y63 CarbonylContact O-C 3.4Å; A59-D64 PolarHBondContact O-N 3.15Å; A59-I65 HydrophobicContact CB-CB 4.08Å; A59-I65 HydrophobicContact CB-CG2 4.37Å; A59-I65 PolarHBondContact O-N 3.33Å
60	R	88.9	Confident	90.9	Very high	105 Å²	105	61.8 Å²	61.8	40%	0.396	32%	0.318	S	S	.	.	H	α-helix	trans	-71.6	-48.1	-178.6	-175.3	-175.2	-171.7	145	-3.6	112.4	V56 G57 E95	V56-R60 WeakPolarHBondContact O-CB 3.38Å; V56-R60 PolarHBondContact O-N 3.33Å; V56-R60 VanDerWaalsContact O-N 3.14Å; G57-R60 PolarHBondContact O-N 2.88Å; R60-E95 IonicContact CZ-OE1 2.66Å; R60-E95 IonicContact CZ-OE2 3.91Å; R60-E95 IonicContact NH1-OE1 3.49Å; R60-E95 PolarHBondContact NH1-OE1 3.17Å; R60-E95 IonicContact NH1-OE2 2.73Å; R60-E95 PolarHBondContact NH1-OE2 3.04Å; R60-E95 IonicContact NH2-OE2 3.92Å; R60-E95 PolarHBondContact NH2-OE2 3.4Å
61	D	91	Very high	91	Very high	128 Å²	128	58.5 Å²	58.5	68%	0.684	31%	0.306	S	S	*	.	H	α-helix	trans	-95	-24.9	-164.6	-61.6	-15.4	0	0	0	113.3	G57	G57-D61 WeakPolarHBondContact O-CB 3.35Å; G57-D61 PolarHBondContact O-N 3.34Å
62	I	93.1	Very high	91.4	Very high	121 Å²	121	56.4 Å²	56.4	62%	0.621	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-40.1	179.5	-52.4	-168.3	0	0	0	112	E58	E58-I62 HydrophobicContact CG-CB 4.46Å; E58-I62 HydrophobicContact CG-CD1 3.85Å; E58-I62 HydrophobicContact CG-CG1 4.29Å; E58-I62 VanDerWaalsContact O-CB 3.31Å; E58-I62 WeakPolarHBondContact O-CB 3.4Å; E58-I62 PolarHBondContact O-N 2.99Å
63	Y	92.3	Very high	91.8	Very high	77 Å²	77	49.1 Å²	49.1	30%	0.302	26%	0.257	S	S	.	.	S	Bend	trans	-108.3	-4.9	-172	-55.9	-63.6	0	0	0	115.2	L39 D41 E58 A59 I65	L39-Y63 HydrophobicContact CD1-CD2 4.35Å; L39-Y63 HydrophobicContact CD2-CD2 4.22Å; L39-Y63 HydrophobicContact CD2-CE2 3.98Å; L39-Y63 HydrophobicContact CG-CD2 4.06Å; L39-Y63 HydrophobicContact CG-CE2 3.79Å; D41-Y63 HydrophobicContact CB-CD1 3.99Å; D41-Y63 HydrophobicContact CB-CE1 4.38Å; E58-Y63 HydrophobicContact CG-CD2 4.42Å; E58-Y63 HydrophobicContact CG-CE2 3.8Å; E58-Y63 PolarHBondContact O-N 3.49Å; E58-Y63 WeakPolarHBondContact OE1-CE2 3.41Å; E58-Y63 PolarHBondContact OE1-OH 3.1Å; A59-Y63 CarbonylContact O-C 3.4Å; Y63-I65 VanDerWaalsContact CB-CD1 3.43Å; Y63-I65 HydrophobicContact CD2-CD1 4.09Å; Y63-I65 HydrophobicContact CG-CD1 4.01Å; Y63-I65 PolarHBondContact O-N 3.41Å
64	D	90.5	Very high	92	Very high	149 Å²	149	50.2 Å²	50.2	80%	0.797	26%	0.262	S	S	*	.			trans	51.6	32.6	-172.6	-163.4	27.5	0	0	0	113.3	A59	A59-D64 PolarHBondContact O-N 3.15Å
65	I	91.9	Very high	91.9	Very high	11 Å²	11	45.6 Å²	45.6	6%	0.056	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-80.5	130.3	-179.9	-68.4	166.2	0	0	0	109.3	L39 I43 L46 A59 Y63 V67	L39-I65 HydrophobicContact CD1-CD1 3.81Å; I43-I65 HydrophobicContact CB-CD1 3.96Å; I43-I65 HydrophobicContact CG2-CD1 4.23Å; I43-I65 HydrophobicContact CG2-CG2 3.95Å; L46-I65 HydrophobicContact CB-CG2 3.84Å; A59-I65 HydrophobicContact CB-CB 4.08Å; A59-I65 HydrophobicContact CB-CG2 4.37Å; A59-I65 PolarHBondContact O-N 3.33Å; Y63-I65 VanDerWaalsContact CB-CD1 3.43Å; Y63-I65 HydrophobicContact CD2-CD1 4.09Å; Y63-I65 HydrophobicContact CG-CD1 4.01Å; Y63-I65 PolarHBondContact O-N 3.41Å; I65-V67 PolarHBondContact O-N 2.92Å
66	K	89.8	Confident	91.9	Very high	98 Å²	98	43 Å²	43	43%	0.426	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	122.4	174.2	-63.5	-166.5	177.9	-164.4	0	111.3	I45 L46 H85 G86	I45-K66 WeakPolarHBondContact CA-O 3.45Å; L46-K66 PolarHBondContact N-O 2.73Å; K66-H85 PolarHBondContact NZ-O 2.67Å; K66-G86 WeakPolarHBondContact CE-O 3.33Å; K66-G86 PolarHBondContact NZ-O 3.47Å
67	V	91.4	Very high	91.9	Very high	29 Å²	29	44.1 Å²	44.1	18%	0.176	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	132.1	173.3	-177.9	0	0	0	0	109.5	L46 V56 I65 P94	L46-V67 HydrophobicContact CD2-CB 4.37Å; L46-V67 HydrophobicContact CD2-CG1 3.8Å; L46-V67 HydrophobicContact CD2-CG2 4.12Å; L46-V67 CarbonylContact O-C 3.59Å; L46-V67 WeakPolarHBondContact O-CA 3.37Å; V56-V67 HydrophobicContact CG1-CG1 4.08Å; V56-V67 HydrophobicContact CG1-CG2 4.21Å; I65-V67 PolarHBondContact O-N 2.92Å; V67-P94 HydrophobicContact CG1-CG 3.64Å
68	V	92.7	Very high	91.8	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.8	172.6	-54.8	0	0	0	0	112.6	I45 L46 I47 A48 W72 H85 F92	I45-V68 HydrophobicContact CG2-CB 4.41Å; I45-V68 HydrophobicContact CG2-CG1 4.1Å; I45-V68 HydrophobicContact CG2-CG2 3.51Å; L46-V68 PolarHBondContact O-N 3.26Å; I47-V68 VanDerWaalsContact CA-O 3.26Å; I47-V68 WeakPolarHBondContact CA-O 3.49Å; I47-V68 HydrophobicContact CG1-CG2 3.95Å; A48-V68 PolarHBondContact N-O 3.22Å; V68-W72 HydrophobicContact CB-CB 4.12Å; V68-W72 HydrophobicContact CB-CG 4.37Å; V68-W72 HydrophobicContact CG2-CB 3.98Å; V68-W72 HydrophobicContact CG2-CD2 4.24Å; V68-W72 HydrophobicContact CG2-CE3 4.08Å; V68-W72 HydrophobicContact CG2-CG 4.21Å; V68-H85 HydrophobicContact CG1-CB 3.76Å; V68-F92 CarbonylContact C-O 3.6Å; V68-F92 WeakPolarHBondContact CA-O 3.38Å; V68-F92 WeakPolarHBondContact CB-O 3.28Å
69	A	92.4	Very high	91.5	Very high	9 Å²	9	40.5 Å²	40.5	7%	0.074	21%	0.205	C	C	.	.			trans	-68	149.6	165.8	0	0	0	0	0	110.9	A48 S71 W72 F92	A48-A69 WeakPolarHBondContact O-CA 3.48Å; A69-S71 WeakPolarHBondContact CB-OG 3.36Å; A69-S71 PolarHBondContact O-N 2.98Å; A69-S71 VanDerWaalsContact O-N 3.12Å; A69-W72 VanDerWaalsContact O-CB 3.22Å; A69-W72 WeakPolarHBondContact O-CB 3.33Å; A69-W72 PolarHBondContact O-N 2.84Å; A69-F92 PolarHBondContact N-O 2.92Å
70	S	93.3	Very high	91.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-19.5	-179.8	69.9	0	0	0	0	113.9	R20 D49 W72 V73	R20-S70 VanDerWaalsContact CZ-OG 3.29Å; R20-S70 PolarHBondContact NE-OG 2.73Å; R20-S70 PolarHBondContact NH2-OG 3.38Å; D49-S70 WeakPolarHBondContact OD1-CB 3.43Å; D49-S70 PolarHBondContact OD1-N 3.33Å; D49-S70 PolarHBondContact OD1-OG 2.67Å; D49-S70 PolarHBondContact OD2-OG 3.47Å; S70-W72 PolarHBondContact O-N 3.46Å; S70-V73 PolarHBondContact O-N 2.88Å
71	S	90.8	Very high	91.3	Very high	29 Å²	29	40.9 Å²	40.9	20%	0.203	22%	0.217	C	C	.	.	H	α-helix	trans	-56.6	-31.1	169.5	53	0	0	0	0	112.4	A69 V73 I74 A75	A69-S71 WeakPolarHBondContact CB-OG 3.36Å; A69-S71 PolarHBondContact O-N 2.98Å; A69-S71 VanDerWaalsContact O-N 3.12Å; S71-V73 VanDerWaalsContact C-N 3.32Å; S71-V73 PolarHBondContact O-N 3.34Å; S71-I74 PolarHBondContact O-N 2.75Å; S71-A75 WeakPolarHBondContact O-CB 3.29Å; S71-A75 PolarHBondContact O-N 3.33Å
72	W	93.2	Very high	91.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-57.3	-42.6	175.6	-178.2	74.6	0	0	0	112.8	F4 L7 I45 V68 A69 S70 S76 A82 L83 H85 F92	F4-W72 AromaticContact CD1-CH2 3.7Å; F4-W72 HydrophobicContact CD1-CH2 3.7Å; F4-W72 AromaticContact CD1-CZ3 3.91Å; F4-W72 HydrophobicContact CD1-CZ3 3.91Å; F4-W72 HydrophobicContact CE1-CE3 4.32Å; F4-W72 AromaticContact CE1-CH2 3.57Å; F4-W72 HydrophobicContact CE1-CH2 3.57Å; F4-W72 HydrophobicContact CE1-CZ2 4.31Å; F4-W72 AromaticContact CE1-CZ3 3.58Å; F4-W72 HydrophobicContact CE1-CZ3 3.58Å; F4-W72 HydrophobicContact CZ-CZ3 4.42Å; L7-W72 HydrophobicContact CD1-CH2 3.83Å; I45-W72 HydrophobicContact CD1-CE3 4.46Å; I45-W72 HydrophobicContact CD1-CH2 3.45Å; I45-W72 VanDerWaalsContact CD1-CH2 3.45Å; I45-W72 HydrophobicContact CD1-CZ2 4.01Å; I45-W72 HydrophobicContact CD1-CZ3 3.72Å; V68-W72 HydrophobicContact CB-CB 4.12Å; V68-W72 HydrophobicContact CB-CG 4.37Å; V68-W72 HydrophobicContact CG2-CB 3.98Å; V68-W72 HydrophobicContact CG2-CD2 4.24Å; V68-W72 HydrophobicContact CG2-CE3 4.08Å; V68-W72 HydrophobicContact CG2-CG 4.21Å; A69-W72 VanDerWaalsContact O-CB 3.22Å; A69-W72 WeakPolarHBondContact O-CB 3.33Å; A69-W72 PolarHBondContact O-N 2.84Å; S70-W72 PolarHBondContact O-N 3.46Å; W72-S76 WeakPolarHBondContact O-CB 3.34Å; W72-S76 PolarHBondContact O-N 2.8Å; W72-S76 PolarHBondContact O-OG 3.27Å; W72-A82 HydrophobicContact CH2-CB 4.36Å; W72-A82 HydrophobicContact CZ2-CB 4.07Å; W72-L83 PolarHBondContact NE1-O 3.17Å; W72-H85 AromaticContact CE2-ND1 3.63Å; W72-H85 AromaticContact CZ2-CE1 3.77Å; W72-H85 AromaticContact CZ2-ND1 3.51Å; W72-H85 AromaticContact NE1-CG 3.93Å; W72-H85 AromaticContact NE1-ND1 3.52Å; W72-F92 HydrophobicContact CB-CB 3.74Å; W72-F92 HydrophobicContact CB-CD1 4.01Å; W72-F92 HydrophobicContact CB-CG 3.9Å; W72-F92 AromaticContact CD1-CD2 3.72Å; W72-F92 AromaticContact CD1-CG 3.82Å; W72-F92 HydrophobicContact CG-CB 4.26Å; W72-F92 HydrophobicContact CG-CG 4.29Å
73	V	94.2	Very high	91	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-67.1	-49.8	-179.5	175.1	0	0	0	0	110.2	F4 V24 L27 L28 I47 S70 S71 A75 S76 V77	F4-V73 HydrophobicContact CE2-CG1 3.94Å; F4-V73 HydrophobicContact CZ-CB 4.38Å; F4-V73 HydrophobicContact CZ-CG1 3.94Å; V24-V73 HydrophobicContact CG1-CB 4.39Å; V24-V73 HydrophobicContact CG1-CG1 4.39Å; V24-V73 HydrophobicContact CG1-CG2 4.17Å; L27-V73 HydrophobicContact CB-CG1 3.94Å; L27-V73 HydrophobicContact CD1-CG1 4.45Å; L28-V73 HydrophobicContact CD1-CG2 4.29Å; L28-V73 HydrophobicContact CD2-CG1 4.12Å; L28-V73 HydrophobicContact CD2-CG2 3.9Å; L28-V73 HydrophobicContact CG-CG1 3.88Å; L28-V73 HydrophobicContact CG-CG2 4.14Å; I47-V73 HydrophobicContact CD1-CG2 3.48Å; I47-V73 VanDerWaalsContact CD1-CG2 3.48Å; S70-V73 PolarHBondContact O-N 2.88Å; S71-V73 VanDerWaalsContact C-N 3.32Å; S71-V73 PolarHBondContact O-N 3.34Å; V73-A75 VanDerWaalsContact C-N 3.32Å; V73-A75 PolarHBondContact O-N 2.78Å; V73-S76 PolarHBondContact O-N 2.85Å; V73-V77 WeakPolarHBondContact O-CG2 3.42Å; V73-V77 PolarHBondContact O-N 2.81Å
74	I	92.6	Very high	90.4	Very high	39 Å²	39	32.4 Å²	32.4	20%	0.2	19%	0.189	C	C	.	.	H	α-helix	trans	-60.5	-45.6	-178.6	-58.7	172.7	0	0	0	109.6	L27 S71 A78 P273	L27-I74 HydrophobicContact CD1-CG1 4.07Å; S71-I74 PolarHBondContact O-N 2.75Å; I74-A78 WeakPolarHBondContact O-CB 3.33Å; I74-A78 PolarHBondContact O-N 2.94Å; I74-P273 HydrophobicContact CG2-CG 3.93Å
75	A	90.3	Very high	89.7	Confident	6 Å²	6	27.3 Å²	27.3	5%	0.05	16%	0.16	C	C	.	.	H	α-helix	trans	-67.9	-39.5	179.5	0	0	0	0	0	113.3	S71 V73 A78 C79 L83 F92 W119 A120	S71-A75 WeakPolarHBondContact O-CB 3.29Å; S71-A75 PolarHBondContact O-N 3.33Å; V73-A75 VanDerWaalsContact C-N 3.32Å; V73-A75 PolarHBondContact O-N 2.78Å; A75-A78 WeakPolarHBondContact O-CB 3.19Å; A75-A78 PolarHBondContact O-N 2.82Å; A75-C79 PolarHBondContact O-N 3.46Å; A75-C79 PolarHBondContact O-SG 3.49Å; A75-L83 HydrophobicContact CB-CD1 3.63Å; A75-F92 HydrophobicContact CB-CE1 3.8Å; A75-F92 HydrophobicContact CB-CZ 4.14Å; A75-W119 HydrophobicContact CB-CZ3 4.32Å; A75-A120 HydrophobicContact CB-CB 3.88Å
76	S	92.2	Very high	88.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.9	-40.5	176.5	-65.5	0	0	0	0	112.4	W72 V73 A78 C79 G80 F81 L83	W72-S76 WeakPolarHBondContact O-CB 3.34Å; W72-S76 PolarHBondContact O-N 2.8Å; W72-S76 PolarHBondContact O-OG 3.27Å; V73-S76 PolarHBondContact O-N 2.85Å; S76-A78 VanDerWaalsContact C-N 3.35Å; S76-C79 PolarHBondContact O-N 3.45Å; S76-G80 PolarHBondContact O-N 3.05Å; S76-F81 CarbonylContact C-O 3.58Å; S76-F81 WeakPolarHBondContact CA-O 3.14Å; S76-F81 WeakPolarHBondContact CB-O 3.36Å; S76-F81 PolarHBondContact O-N 3.28Å; S76-F81 VanDerWaalsContact O-O 3.04Å; S76-L83 PolarHBondContact OG-N 3.39Å
77	V	92.5	Very high	86.7	Confident	27 Å²	27	30.4 Å²	30.4	16%	0.164	19%	0.185	C	C	.	.	H	α-helix	trans	-68.4	-35.3	174.8	179	0	0	0	0	111.4	F4 L27 N31 V73 G80	F4-V77 HydrophobicContact CE2-CG2 3.52Å; F4-V77 HydrophobicContact CZ-CG2 3.77Å; L27-V77 HydrophobicContact CB-CG2 4.37Å; L27-V77 HydrophobicContact CD2-CG1 4.22Å; N31-V77 HydrophobicContact CB-CG2 4.5Å; V73-V77 WeakPolarHBondContact O-CG2 3.42Å; V73-V77 PolarHBondContact O-N 2.81Å; V77-G80 PolarHBondContact O-N 2.9Å
78	A	88	Confident	84.2	Confident	7 Å²	7	33.2 Å²	33.2	6%	0.058	21%	0.212	C	C	.	.	H	α-helix	trans	-58.7	-51.3	173.3	0	0	0	0	0	111.9	I74 A75 S76 G80 W119 P273	I74-A78 WeakPolarHBondContact O-CB 3.33Å; I74-A78 PolarHBondContact O-N 2.94Å; A75-A78 WeakPolarHBondContact O-CB 3.19Å; A75-A78 PolarHBondContact O-N 2.82Å; S76-A78 VanDerWaalsContact C-N 3.35Å; A78-G80 PolarHBondContact O-N 2.84Å; A78-W119 HydrophobicContact CB-CE3 4.42Å; A78-W119 HydrophobicContact CB-CH2 3.99Å; A78-W119 HydrophobicContact CB-CZ3 3.52Å; A78-P273 HydrophobicContact CB-CB 3.74Å; A78-P273 HydrophobicContact CB-CG 4.31Å
79	C	87.2	Confident	82.4	Confident	14 Å²	14	33.8 Å²	33.8	10%	0.095	22%	0.218	C	C	.	.	H	α-helix	trans	-68.7	-22.3	177.4	-59.6	0	0	0	0	112.7	A75 S76 F81 L83	A75-C79 PolarHBondContact O-N 3.46Å; A75-C79 PolarHBondContact O-SG 3.49Å; S76-C79 PolarHBondContact O-N 3.45Å; C79-F81 VanDerWaalsContact C-N 3.34Å; C79-F81 HydrophobicContact CB-CD1 3.9Å; C79-F81 HydrophobicContact CB-CE1 3.74Å; C79-F81 HydrophobicContact CB-CZ 4.39Å; C79-F81 WeakPolarHBondContact O-CD1 3.27Å; C79-L83 HydrophobicContact CB-CD2 4.41Å
80	G	89.6	Confident	81.1	Confident	25 Å²	25	36.4 Å²	36.4	26%	0.258	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	14.4	-177.6	0	0	0	0	0	114.7	S76 V77 A78	S76-G80 PolarHBondContact O-N 3.05Å; V77-G80 PolarHBondContact O-N 2.9Å; A78-G80 PolarHBondContact O-N 2.84Å
81	F	89.2	Confident	80.3	Confident	88 Å²	88	37.8 Å²	37.8	39%	0.386	24%	0.236	S	C	.	.	S	Bend	trans	-151.1	152.5	174.1	69.6	-89	0	0	0	110.1	V3 S76 C79 L83 V117	V3-F81 VanDerWaalsContact CG1-C 3.49Å; S76-F81 CarbonylContact C-O 3.58Å; S76-F81 WeakPolarHBondContact CA-O 3.14Å; S76-F81 WeakPolarHBondContact CB-O 3.36Å; S76-F81 PolarHBondContact O-N 3.28Å; S76-F81 VanDerWaalsContact O-O 3.04Å; C79-F81 VanDerWaalsContact C-N 3.34Å; C79-F81 HydrophobicContact CB-CD1 3.9Å; C79-F81 HydrophobicContact CB-CE1 3.74Å; C79-F81 HydrophobicContact CB-CZ 4.39Å; C79-F81 WeakPolarHBondContact O-CD1 3.27Å; F81-L83 HydrophobicContact CE2-CD2 3.93Å; F81-L83 HydrophobicContact CZ-CD2 4.03Å; F81-L83 PolarHBondContact O-N 2.83Å; F81-V117 HydrophobicContact CE1-CG2 4.03Å; F81-V117 HydrophobicContact CZ-CG2 3.56Å
82	A	90	Very high	80	Confident	40 Å²	40	36.6 Å²	36.6	33%	0.331	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-66.5	121.5	-179.9	0	0	0	0	0	110.8	F4 W72	F4-A82 HydrophobicContact CD1-CB 4.34Å; W72-A82 HydrophobicContact CH2-CB 4.36Å; W72-A82 HydrophobicContact CZ2-CB 4.07Å
83	L	87	Confident	79.6	Confident	7 Å²	7	37.4 Å²	37.4	4%	0.037	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-75.2	152	-178.6	-69.2	168.5	0	0	0	111.8	W72 A75 S76 C79 F81 H85 F92 V117 A120	W72-L83 PolarHBondContact NE1-O 3.17Å; A75-L83 HydrophobicContact CB-CD1 3.63Å; S76-L83 PolarHBondContact OG-N 3.39Å; C79-L83 HydrophobicContact CB-CD2 4.41Å; F81-L83 HydrophobicContact CE2-CD2 3.93Å; F81-L83 HydrophobicContact CZ-CD2 4.03Å; F81-L83 PolarHBondContact O-N 2.83Å; L83-H85 PolarHBondContact O-ND1 3.17Å; L83-F92 HydrophobicContact CB-CE2 4.31Å; L83-F92 HydrophobicContact CD1-CE2 4.11Å; L83-F92 HydrophobicContact CD1-CZ 3.74Å; L83-V117 HydrophobicContact CD2-CG2 4.31Å; L83-A120 HydrophobicContact CD1-CB 3.69Å
84	P	80.4	Confident	79.1	Confident	100 Å²	100	38.8 Å²	38.8	65%	0.649	24%	0.242	S	C	*	.	P	Polyproline II helix	trans	-56.2	145.6	170.7	-23.7	34.5	0	0	0	112.5
85	H	74.8	Confident	78.6	Confident	42 Å²	42	41.1 Å²	41.1	19%	0.194	25%	0.252	C	S	.	.			trans	-152.4	121.4	-178.6	51.3	-81.1	0	0	0	110.8	I45 K66 V68 W72 L83	I45-H85 WeakPolarHBondContact CD1-NE2 3.37Å; K66-H85 PolarHBondContact NZ-O 2.67Å; V68-H85 HydrophobicContact CG1-CB 3.76Å; W72-H85 AromaticContact CE2-ND1 3.63Å; W72-H85 AromaticContact CZ2-CE1 3.77Å; W72-H85 AromaticContact CZ2-ND1 3.51Å; W72-H85 AromaticContact NE1-CG 3.93Å; W72-H85 AromaticContact NE1-ND1 3.52Å; L83-H85 PolarHBondContact O-ND1 3.17Å
86	G	62.8	Low	78.2	Confident	34 Å²	34	41.8 Å²	41.8	35%	0.351	25%	0.254	S	S	.	.	S	Bend	trans	48.8	130.6	170.7	0	0	0	0	0	119.2	K66	K66-G86 WeakPolarHBondContact CE-O 3.33Å; K66-G86 PolarHBondContact NZ-O 3.47Å
87	Q	56.2	Low	77.9	Confident	140 Å²	140	47.5 Å²	47.5	65%	0.654	28%	0.279	S	S	*	.	S	Bend	cis	-137.7	174.7	-15.1	-40.8	-170.4	16.3	0	0	106.6	Q90	Q87-Q90 HydrophobicContact CB-CG 4.32Å; Q87-Q90 VanDerWaalsContact CD-NE2 3.28Å; Q87-Q90 HydrophobicContact CG-CG 4.05Å
88	A	39	Very low	77.7	Confident	88 Å²	88	50.8 Å²	50.8	73%	0.727	29%	0.293	S	S	*	.	S	Bend	cis	-77.7	169.5	-5.2	0	0	0	0	0	112.4
89	G	54.5	Low	77.8	Confident	15 Å²	15	52 Å²	52	16%	0.155	30%	0.298	C	S	.	.	S	Bend	trans	70.1	79.6	-165.1	0	0	0	0	0	110.2	L91 A182 L183	G89-L91 PolarHBondContact O-N 3.06Å; G89-A182 VanDerWaalsContact CA-O 3.24Å; G89-A182 WeakPolarHBondContact CA-O 3.32Å; G89-L183 VanDerWaalsContact CA-O 3.26Å; G89-L183 WeakPolarHBondContact CA-O 3.35Å; G89-L183 PolarHBondContact N-O 3.03Å
90	Q	65.8	Low	78	Confident	63 Å²	63	51.4 Å²	51.4	29%	0.294	29%	0.294	S	S	.	.			trans	-76.3	60.7	-170.5	-65.2	-173.6	12.4	0	0	113	Q87 F92 S93	Q87-Q90 HydrophobicContact CB-CG 4.32Å; Q87-Q90 VanDerWaalsContact CD-NE2 3.28Å; Q87-Q90 HydrophobicContact CG-CG 4.05Å; Q90-F92 PolarHBondContact O-N 3.37Å; Q90-S93 PolarHBondContact O-N 3.45Å
91	L	75.5	Confident	78.1	Confident	30 Å²	30	59.1 Å²	59.1	16%	0.157	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	133.5	169.4	-73.6	175.8	0	0	0	110.8	G89 S93 V121 S124 L125 A182	G89-L91 PolarHBondContact O-N 3.06Å; L91-S93 VanDerWaalsContact C-N 3.33Å; L91-S93 PolarHBondContact O-N 3.36Å; L91-V121 HydrophobicContact CD1-CG2 4.05Å; L91-V121 HydrophobicContact CD2-CG1 4.06Å; L91-S124 WeakPolarHBondContact CD2-OG 3.22Å; L91-L125 HydrophobicContact CD2-CD1 4.29Å; L91-L125 HydrophobicContact CD2-CG 4.32Å; L91-A182 HydrophobicContact CD1-CB 4.09Å; L91-A182 HydrophobicContact CD2-CB 3.76Å; L91-A182 HydrophobicContact CG-CB 4.09Å
92	F	85.9	Confident	78.3	Confident	4 Å²	4	61.4 Å²	61.4	2%	0.018	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	30.8	-176.7	-44.8	-90.2	0	0	0	115.3	V68 A69 W72 A75 L83 Q90 A120 S124	V68-F92 CarbonylContact C-O 3.6Å; V68-F92 WeakPolarHBondContact CA-O 3.38Å; V68-F92 WeakPolarHBondContact CB-O 3.28Å; A69-F92 PolarHBondContact N-O 2.92Å; W72-F92 HydrophobicContact CB-CB 3.74Å; W72-F92 HydrophobicContact CB-CD1 4.01Å; W72-F92 HydrophobicContact CB-CG 3.9Å; W72-F92 AromaticContact CD1-CD2 3.72Å; W72-F92 AromaticContact CD1-CG 3.82Å; W72-F92 HydrophobicContact CG-CB 4.26Å; W72-F92 HydrophobicContact CG-CG 4.29Å; A75-F92 HydrophobicContact CB-CE1 3.8Å; A75-F92 HydrophobicContact CB-CZ 4.14Å; L83-F92 HydrophobicContact CB-CE2 4.31Å; L83-F92 HydrophobicContact CD1-CE2 4.11Å; L83-F92 HydrophobicContact CD1-CZ 3.74Å; Q90-F92 PolarHBondContact O-N 3.37Å; F92-A120 HydrophobicContact CZ-CB 4.29Å; F92-S124 VanDerWaalsContact CE1-CB 3.43Å
93	S	84.7	Confident	78.5	Confident	17 Å²	17	60.9 Å²	60.9	12%	0.119	32%	0.323	C	S	.	.			trans	-81.4	147.5	166.4	179.5	0	0	0	0	110.9	Q90 L91 E95 Q96	Q90-S93 PolarHBondContact O-N 3.45Å; L91-S93 VanDerWaalsContact C-N 3.33Å; L91-S93 PolarHBondContact O-N 3.36Å; S93-E95 PolarHBondContact O-N 3.33Å; S93-E95 PolarHBondContact OG-N 2.89Å; S93-E95 VanDerWaalsContact OG-N 3.11Å; S93-Q96 WeakPolarHBondContact O-CB 3.37Å; S93-Q96 PolarHBondContact O-N 2.92Å; S93-Q96 VanDerWaalsContact O-N 3.09Å
94	P	83.2	Confident	78.9	Confident	29 Å²	29	61.2 Å²	61.2	19%	0.188	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.3	165.1	25.8	-33.7	0	0	0	112.3	C51 V67 Q96	C51-P94 HydrophobicContact CB-CB 4.4Å; C51-P94 HydrophobicContact CB-CG 4.39Å; V67-P94 HydrophobicContact CG1-CG 3.64Å; P94-Q96 PolarHBondContact O-N 2.92Å
95	E	82	Confident	79.5	Confident	87 Å²	87	56.4 Å²	56.4	41%	0.407	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	6.4	175.3	-62.7	171.8	-177.4	0	0	112.8	C51 R60 S93 K97	C51-E95 HydrophobicContact CB-CG 3.95Å; R60-E95 IonicContact CZ-OE1 2.66Å; R60-E95 IonicContact CZ-OE2 3.91Å; R60-E95 IonicContact NH1-OE1 3.49Å; R60-E95 PolarHBondContact NH1-OE1 3.17Å; R60-E95 IonicContact NH1-OE2 2.73Å; R60-E95 PolarHBondContact NH1-OE2 3.04Å; R60-E95 IonicContact NH2-OE2 3.92Å; R60-E95 PolarHBondContact NH2-OE2 3.4Å; S93-E95 PolarHBondContact O-N 3.33Å; S93-E95 PolarHBondContact OG-N 2.89Å; S93-E95 VanDerWaalsContact OG-N 3.11Å; E95-K97 PolarHBondContact O-N 3.02Å
96	Q	82.7	Confident	80.3	Confident	21 Å²	21	54.4 Å²	54.4	10%	0.098	29%	0.285	C	S	.	.			trans	-70	115.5	-173.2	-177.1	179.4	2.8	0	0	112.7	S93 P94 Q98 S124 L125	S93-Q96 WeakPolarHBondContact O-CB 3.37Å; S93-Q96 PolarHBondContact O-N 2.92Å; S93-Q96 VanDerWaalsContact O-N 3.09Å; P94-Q96 PolarHBondContact O-N 2.92Å; Q96-Q98 PolarHBondContact O-N 3.35Å; Q96-Q98 PolarHBondContact O-NE2 3.02Å; Q96-S124 VanDerWaalsContact CD-O 3.3Å; Q96-S124 PolarHBondContact NE2-O 3.45Å; Q96-S124 PolarHBondContact NE2-OG 2.81Å; Q96-S124 PolarHBondContact OE1-O 2.84Å; Q96-L125 HydrophobicContact CG-CD2 4.02Å
97	K	83.9	Confident	81.6	Confident	119 Å²	119	53.9 Å²	53.9	52%	0.517	28%	0.275	S	S	.	.			trans	-50.9	127.5	169.5	-61.5	-175.6	-163.1	165.1	0	110.6	E95 L99 L125 G185 E186	E95-K97 PolarHBondContact O-N 3.02Å; K97-L99 HydrophobicContact CB-CD2 3.91Å; K97-L99 HydrophobicContact CB-CG 4.23Å; K97-L99 HydrophobicContact CD-CD2 4.11Å; K97-L99 PolarHBondContact O-N 3.05Å; K97-L125 WeakPolarHBondContact O-CD2 3.42Å; K97-G185 WeakPolarHBondContact CD-O 3.43Å; K97-G185 WeakPolarHBondContact CE-O 3.39Å; K97-G185 PolarHBondContact NZ-O 3.44Å; K97-E186 IonicContact NZ-OE1 3.73Å
98	Q	88.5	Confident	83	Confident	97 Å²	97	47.9 Å²	47.9	45%	0.453	25%	0.249	S	C	.	.			trans	-81.2	65.5	177.7	-60.3	-62.5	-73.4	0	0	110.9	Q96 F100 R101 S124 L125	Q96-Q98 PolarHBondContact O-N 3.35Å; Q96-Q98 PolarHBondContact O-NE2 3.02Å; Q98-F100 PolarHBondContact O-N 3.35Å; Q98-R101 HydrophobicContact CB-CB 4.35Å; Q98-R101 WeakPolarHBondContact O-CB 3.17Å; Q98-R101 PolarHBondContact O-N 3.46Å; Q98-S124 PolarHBondContact NE2-O 3.39Å; Q98-S124 VanDerWaalsContact NE2-O 3.09Å; Q98-L125 CarbonylContact C-O 3.41Å; Q98-L125 VanDerWaalsContact CA-O 3.27Å; Q98-L125 WeakPolarHBondContact CA-O 3.47Å
99	L	90.5	Very high	85	Confident	33 Å²	33	46.8 Å²	46.8	17%	0.173	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-31.9	-172.3	-62.8	179.8	0	0	0	114	K97 L125 C181 M187	K97-L99 HydrophobicContact CB-CD2 3.91Å; K97-L99 HydrophobicContact CB-CG 4.23Å; K97-L99 HydrophobicContact CD-CD2 4.11Å; K97-L99 PolarHBondContact O-N 3.05Å; L99-L125 HydrophobicContact CB-CD2 4.19Å; L99-L125 HydrophobicContact CD1-CD2 3.95Å; L99-L125 HydrophobicContact CG-CD2 3.98Å; L99-L125 PolarHBondContact N-O 3.33Å; L99-C181 WeakPolarHBondContact CD1-O 3.44Å; L99-M187 HydrophobicContact CB-SD 4.1Å
100	F	92.9	Very high	86.5	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	13.9	-173.2	-58.2	-26	0	0	0	113.3	Q98 D102 L103 I105 V122 L125 G127 W177 V178 C181 M187	Q98-F100 PolarHBondContact O-N 3.35Å; F100-D102 PolarHBondContact O-N 3.48Å; F100-L103 HydrophobicContact CB-CB 4.22Å; F100-L103 HydrophobicContact CB-CD1 4.17Å; F100-L103 HydrophobicContact CB-CG 4.39Å; F100-L103 HydrophobicContact CD1-CD1 3.71Å; F100-L103 HydrophobicContact CG-CD1 4.24Å; F100-L103 WeakPolarHBondContact O-CA 3.42Å; F100-L103 WeakPolarHBondContact O-CB 3.26Å; F100-L103 PolarHBondContact O-N 2.95Å; F100-I105 HydrophobicContact CD2-CD1 4.21Å; F100-I105 HydrophobicContact CE2-CD1 4.47Å; F100-I105 HydrophobicContact CG-CD1 4.47Å; F100-V122 HydrophobicContact CD2-CB 4.33Å; F100-V122 HydrophobicContact CD2-CG1 4.28Å; F100-V122 HydrophobicContact CD2-CG2 4.15Å; F100-V122 HydrophobicContact CE2-CG2 4.1Å; F100-L125 HydrophobicContact CB-CB 4.22Å; F100-L125 HydrophobicContact CD2-CB 3.51Å; F100-L125 HydrophobicContact CD2-CD1 3.78Å; F100-L125 HydrophobicContact CD2-CG 4.28Å; F100-L125 HydrophobicContact CE2-CB 4.03Å; F100-L125 HydrophobicContact CE2-CD1 3.33Å; F100-L125 HydrophobicContact CE2-CG 4.31Å; F100-L125 HydrophobicContact CG-CB 3.94Å; F100-L125 HydrophobicContact CZ-CD1 3.8Å; F100-L125 PolarHBondContact N-O 3.41Å; F100-G127 WeakPolarHBondContact O-CA 3.29Å; F100-W177 HydrophobicContact CE1-CH2 4.08Å; F100-W177 HydrophobicContact CE1-CZ2 4.48Å; F100-W177 HydrophobicContact CE1-CZ3 4.39Å; F100-W177 HydrophobicContact CZ-CZ3 4.48Å; F100-V178 HydrophobicContact CE2-CG1 4.01Å; F100-V178 HydrophobicContact CZ-CG1 4.34Å; F100-C181 HydrophobicContact CE1-CB 3.78Å; F100-C181 HydrophobicContact CZ-CB 3.65Å; F100-M187 HydrophobicContact CD1-SD 3.77Å; F100-M187 HydrophobicContact CE1-SD 3.76Å
101	R	90.8	Very high	87.4	Confident	188 Å²	188	47.6 Å²	47.6	71%	0.709	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-42.7	-42.8	-173.1	179.9	178.1	179.8	150.8	4.5	115.5	Q98 G126	Q98-R101 HydrophobicContact CB-CB 4.35Å; Q98-R101 WeakPolarHBondContact O-CB 3.17Å; Q98-R101 PolarHBondContact O-N 3.46Å; R101-G126 WeakPolarHBondContact CA-O 3.44Å
102	D	92.9	Very high	87.7	Confident	136 Å²	136	48.4 Å²	48.4	73%	0.727	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.6	14.8	-176.1	-54.5	-64.5	0	0	0	112.5	F100	F100-D102 PolarHBondContact O-N 3.48Å
103	L	95.1	Very high	87.7	Confident	29 Å²	29	53 Å²	53	15%	0.152	26%	0.263	C	S	.	.			trans	-106	131.4	-176.6	-52.5	-173.9	0	0	0	111.8	F100 E128 W177 M187	F100-L103 HydrophobicContact CB-CB 4.22Å; F100-L103 HydrophobicContact CB-CD1 4.17Å; F100-L103 HydrophobicContact CB-CG 4.39Å; F100-L103 HydrophobicContact CD1-CD1 3.71Å; F100-L103 HydrophobicContact CG-CD1 4.24Å; F100-L103 WeakPolarHBondContact O-CA 3.42Å; F100-L103 WeakPolarHBondContact O-CB 3.26Å; F100-L103 PolarHBondContact O-N 2.95Å; L103-E128 PolarHBondContact O-N 3.05Å; L103-W177 HydrophobicContact CD1-CH2 3.93Å; L103-M187 HydrophobicContact CD1-CE 3.84Å
104	V	93.9	Very high	87.9	Confident	13 Å²	13	56.5 Å²	56.5	8%	0.079	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	115.1	173.3	-173.7	0	0	0	0	108	E128 E130 R136 T138 H139	V104-E128 HydrophobicContact CB-CB 4.42Å; V104-E128 HydrophobicContact CG1-CB 4.22Å; V104-E128 HydrophobicContact CG2-CB 4.17Å; V104-E130 HydrophobicContact CG1-CB 4.26Å; V104-E130 HydrophobicContact CG1-CG 3.49Å; V104-E130 VanDerWaalsContact CG1-CG 3.49Å; V104-E130 WeakPolarHBondContact CG1-OE2 3.5Å; V104-R136 WeakPolarHBondContact CB-O 3.28Å; V104-R136 HydrophobicContact CG2-CB 4.34Å; V104-R136 WeakPolarHBondContact CG2-O 3.48Å; V104-T138 PolarHBondContact N-OG1 3.18Å; V104-T138 PolarHBondContact O-N 3.47Å; V104-T138 PolarHBondContact O-OG1 3.41Å; V104-H139 PolarHBondContact O-N 3.44Å; V104-H139 VanDerWaalsContact O-N 3.17Å
105	I	93.7	Very high	88.2	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.8	-170.2	-69.9	171.8	0	0	0	110.7	F100 L118 V122 E128 C129 E130 H139 V141 W177	F100-I105 HydrophobicContact CD2-CD1 4.21Å; F100-I105 HydrophobicContact CE2-CD1 4.47Å; F100-I105 HydrophobicContact CG-CD1 4.47Å; I105-L118 HydrophobicContact CG2-CD2 4.46Å; I105-V122 HydrophobicContact CB-CG1 4.37Å; I105-V122 HydrophobicContact CD1-CB 4.33Å; I105-V122 HydrophobicContact CD1-CG1 3.77Å; I105-V122 HydrophobicContact CD1-CG2 3.54Å; I105-V122 HydrophobicContact CG1-CG1 4.45Å; I105-V122 HydrophobicContact CG2-CG2 4.38Å; I105-E128 PolarHBondContact N-O 2.85Å; I105-C129 CarbonylContact O-C 3.56Å; I105-C129 VanDerWaalsContact O-CA 3.26Å; I105-C129 WeakPolarHBondContact O-CA 3.37Å; I105-E130 PolarHBondContact O-N 2.83Å; I105-H139 HydrophobicContact CG1-CB 4.01Å; I105-V141 HydrophobicContact CG2-CB 4.4Å; I105-V141 HydrophobicContact CG2-CG2 3.61Å; I105-W177 HydrophobicContact CD1-CZ3 3.97Å
106	C	91.7	Very high	88.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	102.4	-180	-168.4	0	0	0	0	111.2	E130 L133 T137 H139 L140 V141 K160	C106-E130 WeakPolarHBondContact CA-O 3.41Å; C106-E130 PolarHBondContact SG-O 3.45Å; C106-L133 HydrophobicContact CB-CD1 4.33Å; C106-T137 HydrophobicContact CB-CG2 3.48Å; C106-T137 VanDerWaalsContact CB-CG2 3.48Å; C106-H139 PolarHBondContact N-O 3.01Å; C106-L140 HydrophobicContact CB-CD1 4.27Å; C106-L140 WeakPolarHBondContact O-CD1 3.43Å; C106-V141 PolarHBondContact O-N 3.48Å; C106-K160 PolarHBondContact SG-NZ 2.8Å
107	P	90.3	Very high	88.8	Confident	23 Å²	23	53.5 Å²	53.5	15%	0.149	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	145.2	175.3	25.3	-31.8	0	0	0	112.7	L110 L118 V141 K160	P107-L110 HydrophobicContact CB-CD1 3.93Å; P107-L118 HydrophobicContact CB-CD2 4.02Å; P107-V141 CarbonylContact C-O 3.6Å; P107-K160 PolarHBondContact O-NZ 3.42Å
108	S	86.2	Confident	89.2	Confident	14 Å²	14	48.3 Å²	48.3	10%	0.098	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	148.4	172.8	-156	0	0	0	0	111.6	L110 V141 C142 A157	S108-L110 PolarHBondContact O-N 3.3Å; S108-V141 PolarHBondContact N-O 3.41Å; S108-C142 VanDerWaalsContact O-CA 3.27Å; S108-C142 WeakPolarHBondContact O-CA 3.46Å; S108-C142 VanDerWaalsContact O-CB 3.25Å; S108-C142 WeakPolarHBondContact O-CB 3.04Å; S108-A157 WeakPolarHBondContact OG-CB 3.39Å
109	Q	81.5	Confident	89.4	Confident	64 Å²	64	45.5 Å²	45.5	30%	0.299	23%	0.233	S	C	.	.	S	Bend	trans	63.8	23.1	178.6	-48.5	-173.6	106.8	0	0	114.9	T143 S144 A157	Q109-T143 PolarHBondContact O-OG1 3.05Å; Q109-S144 PolarHBondContact NE2-O 2.92Å; Q109-A157 HydrophobicContact CG-CB 3.46Å; Q109-A157 VanDerWaalsContact CG-CB 3.46Å
110	L	84.2	Confident	89.4	Confident	38 Å²	38	44 Å²	44	20%	0.199	23%	0.225	C	C	.	.			trans	-103.5	158	175.2	-48.3	-173.5	0	0	0	110.2	P107 S108 D114 A115 L118 V141 T143 P175	P107-L110 HydrophobicContact CB-CD1 3.93Å; S108-L110 PolarHBondContact O-N 3.3Å; L110-D114 HydrophobicContact CB-CB 4.12Å; L110-A115 HydrophobicContact CB-CB 4.35Å; L110-L118 HydrophobicContact CD1-CD2 3.95Å; L110-V141 HydrophobicContact CD1-CG1 4.45Å; L110-T143 HydrophobicContact CD2-CG2 3.64Å; L110-P175 HydrophobicContact CD1-CG 4.38Å; L110-P175 HydrophobicContact CD2-CG 3.5Å
111	S	85.8	Confident	89.3	Confident	58 Å²	58	44.9 Å²	44.9	41%	0.406	23%	0.231	S	C	.	.			trans	-71.7	173.8	168.5	84.9	0	0	0	0	111	N113 D114 A115	S111-N113 PolarHBondContact OG-N 3.31Å; S111-D114 WeakPolarHBondContact CB-OD2 3.47Å; S111-D114 PolarHBondContact N-OD2 2.97Å; S111-D114 VanDerWaalsContact N-OD2 3.15Å; S111-D114 PolarHBondContact OG-N 3.49Å; S111-D114 PolarHBondContact OG-OD2 2.87Å; S111-A115 WeakPolarHBondContact O-CB 3.41Å; S111-A115 PolarHBondContact O-N 3.29Å
112	K	82.5	Confident	89.4	Confident	46 Å²	46	36 Å²	36	20%	0.2	20%	0.197	C	C	.	.	H	α-helix	trans	-53.4	-61.2	172.7	178.6	167.1	-168.1	173.3	0	110.4	D114 A115 D116 R277 V280 D281	K112-D114 VanDerWaalsContact C-N 3.26Å; K112-D114 PolarHBondContact O-N 3.41Å; K112-A115 PolarHBondContact O-N 3.25Å; K112-D116 WeakPolarHBondContact CG-OD2 3.29Å; K112-D116 WeakPolarHBondContact O-CB 3.35Å; K112-D116 PolarHBondContact O-N 2.94Å; K112-R277 PolarHBondContact NZ-O 3.37Å; K112-V280 HydrophobicContact CB-CG1 3.74Å; K112-V280 HydrophobicContact CD-CB 3.85Å; K112-V280 HydrophobicContact CD-CG1 3.81Å; K112-V280 HydrophobicContact CD-CG2 4.36Å; K112-V280 HydrophobicContact CG-CB 4.02Å; K112-V280 HydrophobicContact CG-CG1 3.71Å; K112-V280 HydrophobicContact CG-CG2 4.12Å; K112-D281 IonicContact NZ-OD1 3.13Å; K112-D281 PolarHBondContact NZ-OD1 3.22Å; K112-D281 IonicContact NZ-OD2 2.71Å; K112-D281 PolarHBondContact NZ-OD2 2.99Å
113	N	85.9	Confident	89.2	Confident	101 Å²	101	32.5 Å²	32.5	54%	0.54	18%	0.181	S	C	.	.	H	α-helix	trans	-58.8	-38.9	-174.2	-58.9	13.3	0	0	0	111.8	S111 D116 V117	S111-N113 PolarHBondContact OG-N 3.31Å; N113-D116 PolarHBondContact O-N 3.45Å; N113-V117 WeakPolarHBondContact O-CB 3.39Å; N113-V117 VanDerWaalsContact O-CG2 3.25Å; N113-V117 WeakPolarHBondContact O-CG2 3.23Å; N113-V117 PolarHBondContact O-N 2.93Å
114	D	88.4	Confident	88.9	Confident	90 Å²	90	31.4 Å²	31.4	48%	0.481	18%	0.175	S	C	.	.	H	α-helix	trans	-69.2	-38.3	179.1	-47.3	-41.1	0	0	0	111.6	L110 S111 K112 L118	L110-D114 HydrophobicContact CB-CB 4.12Å; S111-D114 WeakPolarHBondContact CB-OD2 3.47Å; S111-D114 PolarHBondContact N-OD2 2.97Å; S111-D114 VanDerWaalsContact N-OD2 3.15Å; S111-D114 PolarHBondContact OG-N 3.49Å; S111-D114 PolarHBondContact OG-OD2 2.87Å; K112-D114 VanDerWaalsContact C-N 3.26Å; K112-D114 PolarHBondContact O-N 3.41Å; D114-L118 VanDerWaalsContact O-CB 3.23Å; D114-L118 WeakPolarHBondContact O-CB 3.36Å; D114-L118 PolarHBondContact O-N 2.89Å
115	A	89.3	Confident	88.7	Confident	18 Å²	18	31 Å²	31	15%	0.149	17%	0.173	C	C	.	.	H	α-helix	trans	-71.1	-35.7	175.2	0	0	0	0	0	112.4	L110 S111 K112 W119	L110-A115 HydrophobicContact CB-CB 4.35Å; S111-A115 WeakPolarHBondContact O-CB 3.41Å; S111-A115 PolarHBondContact O-N 3.29Å; K112-A115 PolarHBondContact O-N 3.25Å; A115-W119 VanDerWaalsContact O-CB 3.25Å; A115-W119 WeakPolarHBondContact O-CB 3.46Å; A115-W119 PolarHBondContact O-N 3.46Å
116	D	88.6	Confident	88.5	Confident	8 Å²	8	32.3 Å²	32.3	4%	0.043	19%	0.186	C	C	.	.	H	α-helix	trans	-65.1	-43.9	174.3	-62.4	5	0	0	0	110.2	K112 N113 A120 F276	K112-D116 WeakPolarHBondContact CG-OD2 3.29Å; K112-D116 WeakPolarHBondContact O-CB 3.35Å; K112-D116 PolarHBondContact O-N 2.94Å; N113-D116 PolarHBondContact O-N 3.45Å; D116-A120 PolarHBondContact O-N 2.88Å; D116-F276 HydrophobicContact CB-CE1 4.33Å; D116-F276 WeakPolarHBondContact OD1-CE1 3.28Å
117	V	88.9	Confident	88.5	Confident	48 Å²	48	32.6 Å²	32.6	29%	0.291	19%	0.189	S	C	.	.	H	α-helix	trans	-69	-43.4	174.9	170.6	0	0	0	0	112.2	F81 L83 N113 W119 A120 V121	F81-V117 HydrophobicContact CE1-CG2 4.03Å; F81-V117 HydrophobicContact CZ-CG2 3.56Å; L83-V117 HydrophobicContact CD2-CG2 4.31Å; N113-V117 WeakPolarHBondContact O-CB 3.39Å; N113-V117 VanDerWaalsContact O-CG2 3.25Å; N113-V117 WeakPolarHBondContact O-CG2 3.23Å; N113-V117 PolarHBondContact O-N 2.93Å; V117-W119 VanDerWaalsContact C-N 3.31Å; V117-W119 PolarHBondContact O-N 2.76Å; V117-A120 WeakPolarHBondContact O-CB 3.43Å; V117-A120 PolarHBondContact O-N 3.17Å; V117-A120 VanDerWaalsContact O-N 3.17Å; V117-V121 HydrophobicContact CG1-CG2 4.48Å; V117-V121 WeakPolarHBondContact O-CG2 3.43Å; V117-V121 PolarHBondContact O-N 2.87Å
118	L	91.6	Very high	88.6	Confident	11 Å²	11	35.9 Å²	35.9	6%	0.058	20%	0.203	C	C	.	.	H	α-helix	trans	-60.2	-43.8	176.9	-165.1	90.4	0	0	0	110.7	I105 P107 L110 D114 A120 V121 V122 V141 P175 V178	I105-L118 HydrophobicContact CG2-CD2 4.46Å; P107-L118 HydrophobicContact CB-CD2 4.02Å; L110-L118 HydrophobicContact CD1-CD2 3.95Å; D114-L118 VanDerWaalsContact O-CB 3.23Å; D114-L118 WeakPolarHBondContact O-CB 3.36Å; D114-L118 PolarHBondContact O-N 2.89Å; L118-A120 PolarHBondContact O-N 3.36Å; L118-V121 PolarHBondContact O-N 2.93Å; L118-V122 WeakPolarHBondContact O-CB 3.35Å; L118-V122 VanDerWaalsContact O-CG2 3.26Å; L118-V122 WeakPolarHBondContact O-CG2 3.37Å; L118-V122 PolarHBondContact O-N 2.84Å; L118-V141 HydrophobicContact CD1-CG1 4.34Å; L118-V141 HydrophobicContact CD2-CB 4.09Å; L118-V141 HydrophobicContact CD2-CG1 3.78Å; L118-V141 HydrophobicContact CD2-CG2 4.35Å; L118-P175 HydrophobicContact CD1-CB 4.27Å; L118-V178 HydrophobicContact CD1-CB 3.72Å; L118-V178 HydrophobicContact CD1-CG1 3.76Å; L118-V178 HydrophobicContact CD1-CG2 3.83Å; L118-V178 HydrophobicContact CG-CG1 4.29Å; L118-V178 HydrophobicContact CG-CG2 4.43Å
119	W	93.1	Very high	88.7	Confident	38 Å²	38	37 Å²	37	14%	0.144	21%	0.21	C	C	.	.	H	α-helix	trans	-57.1	-47.5	173.3	167.4	85.3	0	0	0	111.5	A75 A78 A115 V117 V121 V122 V123 F276	A75-W119 HydrophobicContact CB-CZ3 4.32Å; A78-W119 HydrophobicContact CB-CE3 4.42Å; A78-W119 HydrophobicContact CB-CH2 3.99Å; A78-W119 HydrophobicContact CB-CZ3 3.52Å; A115-W119 VanDerWaalsContact O-CB 3.25Å; A115-W119 WeakPolarHBondContact O-CB 3.46Å; A115-W119 PolarHBondContact O-N 3.46Å; V117-W119 VanDerWaalsContact C-N 3.31Å; V117-W119 PolarHBondContact O-N 2.76Å; W119-V121 PolarHBondContact O-N 2.85Å; W119-V122 PolarHBondContact O-N 3.29Å; W119-V123 HydrophobicContact CG-CG2 4.49Å; W119-V123 HydrophobicContact CZ2-CG2 4.48Å; W119-V123 WeakPolarHBondContact O-CB 3.34Å; W119-V123 WeakPolarHBondContact O-CG2 3.43Å; W119-V123 PolarHBondContact O-N 2.84Å; W119-F276 HydrophobicContact CB-CE1 4.42Å; W119-F276 HydrophobicContact CB-CE2 4.44Å; W119-F276 HydrophobicContact CB-CZ 3.82Å; W119-F276 AromaticContact CD1-CE2 3.84Å; W119-F276 HydrophobicContact CD2-CZ 4.44Å; W119-F276 HydrophobicContact CG-CE1 4.42Å; W119-F276 HydrophobicContact CG-CE2 4.03Å; W119-F276 AromaticContact CG-CZ 3.82Å; W119-F276 HydrophobicContact CG-CZ 3.82Å
120	A	91	Very high	88.9	Confident	1 Å²	1	35 Å²	35	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-60.4	-44.8	179.4	0	0	0	0	0	112.6	A75 L83 F92 D116 V117 L118 S124	A75-A120 HydrophobicContact CB-CB 3.88Å; L83-A120 HydrophobicContact CD1-CB 3.69Å; F92-A120 HydrophobicContact CZ-CB 4.29Å; D116-A120 PolarHBondContact O-N 2.88Å; V117-A120 WeakPolarHBondContact O-CB 3.43Å; V117-A120 PolarHBondContact O-N 3.17Å; V117-A120 VanDerWaalsContact O-N 3.17Å; L118-A120 PolarHBondContact O-N 3.36Å; A120-S124 WeakPolarHBondContact O-CB 3.4Å; A120-S124 PolarHBondContact O-N 3.48Å; A120-S124 VanDerWaalsContact O-N 3.11Å
121	V	90.7	Very high	88.5	Confident	19 Å²	19	35.7 Å²	35.7	12%	0.115	20%	0.2	C	C	.	.	H	α-helix	trans	-62.4	-49.4	175.8	170.9	0	0	0	0	110.7	L91 V117 L118 W119 V123 S124 L125 V178 A182	L91-V121 HydrophobicContact CD1-CG2 4.05Å; L91-V121 HydrophobicContact CD2-CG1 4.06Å; V117-V121 HydrophobicContact CG1-CG2 4.48Å; V117-V121 WeakPolarHBondContact O-CG2 3.43Å; V117-V121 PolarHBondContact O-N 2.87Å; L118-V121 PolarHBondContact O-N 2.93Å; W119-V121 PolarHBondContact O-N 2.85Å; V121-V123 PolarHBondContact O-N 3.45Å; V121-S124 PolarHBondContact O-N 2.94Å; V121-S124 PolarHBondContact O-OG 2.85Å; V121-L125 HydrophobicContact CG1-CD1 4.12Å; V121-L125 PolarHBondContact O-N 3.44Å; V121-V178 HydrophobicContact CB-CG1 4.35Å; V121-V178 HydrophobicContact CG1-CG1 3.68Å; V121-A182 HydrophobicContact CG1-CB 3.87Å
122	V	92.1	Very high	88.2	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.1	-46.7	-177.3	166.6	0	0	0	0	111.9	F100 I105 L118 W119 S124 L125 G126 G127 C129 V178	F100-V122 HydrophobicContact CD2-CB 4.33Å; F100-V122 HydrophobicContact CD2-CG1 4.28Å; F100-V122 HydrophobicContact CD2-CG2 4.15Å; F100-V122 HydrophobicContact CE2-CG2 4.1Å; I105-V122 HydrophobicContact CB-CG1 4.37Å; I105-V122 HydrophobicContact CD1-CB 4.33Å; I105-V122 HydrophobicContact CD1-CG1 3.77Å; I105-V122 HydrophobicContact CD1-CG2 3.54Å; I105-V122 HydrophobicContact CG1-CG1 4.45Å; I105-V122 HydrophobicContact CG2-CG2 4.38Å; L118-V122 WeakPolarHBondContact O-CB 3.35Å; L118-V122 VanDerWaalsContact O-CG2 3.26Å; L118-V122 WeakPolarHBondContact O-CG2 3.37Å; L118-V122 PolarHBondContact O-N 2.84Å; W119-V122 PolarHBondContact O-N 3.29Å; V122-S124 VanDerWaalsContact C-N 3.33Å; V122-S124 PolarHBondContact O-N 2.92Å; V122-L125 CarbonylContact O-C 3.44Å; V122-L125 PolarHBondContact O-N 3.42Å; V122-G126 PolarHBondContact O-N 3.36Å; V122-G127 PolarHBondContact O-N 2.93Å; V122-C129 VanDerWaalsContact CG1-SG 3.59Å; V122-V178 HydrophobicContact CG2-CG1 3.84Å; V122-V178 HydrophobicContact CG2-CG2 4.48Å
123	V	89.6	Confident	88	Confident	64 Å²	64	37.2 Å²	37.2	39%	0.388	21%	0.209	S	C	.	.	H	α-helix	trans	-67.4	-32.2	179.6	173.3	0	0	0	0	111.8	W119 V121 L125 G126	W119-V123 HydrophobicContact CG-CG2 4.49Å; W119-V123 HydrophobicContact CZ2-CG2 4.48Å; W119-V123 WeakPolarHBondContact O-CB 3.34Å; W119-V123 WeakPolarHBondContact O-CG2 3.43Å; W119-V123 PolarHBondContact O-N 2.84Å; V121-V123 PolarHBondContact O-N 3.45Å; V123-L125 VanDerWaalsContact C-N 3.26Å; V123-L125 PolarHBondContact O-N 3.45Å; V123-G126 PolarHBondContact O-N 3.34Å; V123-G126 VanDerWaalsContact O-N 3.13Å
124	S	88	Confident	87.8	Confident	5 Å²	5	34.7 Å²	34.7	4%	0.035	20%	0.198	C	C	.	.	H	α-helix	trans	-64.4	-32.2	173.7	80	0	0	0	0	113.2	L91 F92 Q96 Q98 A120 V121 V122 G126	L91-S124 WeakPolarHBondContact CD2-OG 3.22Å; F92-S124 VanDerWaalsContact CE1-CB 3.43Å; Q96-S124 VanDerWaalsContact CD-O 3.3Å; Q96-S124 PolarHBondContact NE2-O 3.45Å; Q96-S124 PolarHBondContact NE2-OG 2.81Å; Q96-S124 PolarHBondContact OE1-O 2.84Å; Q98-S124 PolarHBondContact NE2-O 3.39Å; Q98-S124 VanDerWaalsContact NE2-O 3.09Å; A120-S124 WeakPolarHBondContact O-CB 3.4Å; A120-S124 PolarHBondContact O-N 3.48Å; A120-S124 VanDerWaalsContact O-N 3.11Å; V121-S124 PolarHBondContact O-N 2.94Å; V121-S124 PolarHBondContact O-OG 2.85Å; V122-S124 VanDerWaalsContact C-N 3.33Å; V122-S124 PolarHBondContact O-N 2.92Å; S124-G126 VanDerWaalsContact C-N 3.27Å
125	L	90.2	Very high	87.6	Confident	6 Å²	6	36 Å²	36	3%	0.031	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	9.8	176.6	-68.8	166.6	0	0	0	112.5	L91 Q96 K97 Q98 L99 F100 V121 V122 V123 A182	L91-L125 HydrophobicContact CD2-CD1 4.29Å; L91-L125 HydrophobicContact CD2-CG 4.32Å; Q96-L125 HydrophobicContact CG-CD2 4.02Å; K97-L125 WeakPolarHBondContact O-CD2 3.42Å; Q98-L125 CarbonylContact C-O 3.41Å; Q98-L125 VanDerWaalsContact CA-O 3.27Å; Q98-L125 WeakPolarHBondContact CA-O 3.47Å; L99-L125 HydrophobicContact CB-CD2 4.19Å; L99-L125 HydrophobicContact CD1-CD2 3.95Å; L99-L125 HydrophobicContact CG-CD2 3.98Å; L99-L125 PolarHBondContact N-O 3.33Å; F100-L125 HydrophobicContact CB-CB 4.22Å; F100-L125 HydrophobicContact CD2-CB 3.51Å; F100-L125 HydrophobicContact CD2-CD1 3.78Å; F100-L125 HydrophobicContact CD2-CG 4.28Å; F100-L125 HydrophobicContact CE2-CB 4.03Å; F100-L125 HydrophobicContact CE2-CD1 3.33Å; F100-L125 HydrophobicContact CE2-CG 4.31Å; F100-L125 HydrophobicContact CG-CB 3.94Å; F100-L125 HydrophobicContact CZ-CD1 3.8Å; F100-L125 PolarHBondContact N-O 3.41Å; V121-L125 HydrophobicContact CG1-CD1 4.12Å; V121-L125 PolarHBondContact O-N 3.44Å; V122-L125 CarbonylContact O-C 3.44Å; V122-L125 PolarHBondContact O-N 3.42Å; V123-L125 VanDerWaalsContact C-N 3.26Å; V123-L125 PolarHBondContact O-N 3.45Å; L125-A182 HydrophobicContact CD1-CB 4.03Å
126	G	89	Confident	87.6	Confident	27 Å²	27	41 Å²	41	28%	0.278	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	2.8	173.6	0	0	0	0	0	116	R101 V122 V123 S124	R101-G126 WeakPolarHBondContact CA-O 3.44Å; V122-G126 PolarHBondContact O-N 3.36Å; V123-G126 PolarHBondContact O-N 3.34Å; V123-G126 VanDerWaalsContact O-N 3.13Å; S124-G126 VanDerWaalsContact C-N 3.27Å
127	G	91.8	Very high	87.6	Confident	6 Å²	6	40.6 Å²	40.6	6%	0.062	23%	0.227	C	C	.	.			trans	-87.2	155.9	-175.6	0	0	0	0	0	115	F100 V122	F100-G127 WeakPolarHBondContact O-CA 3.29Å; V122-G127 PolarHBondContact O-N 2.93Å
128	E	91.4	Very high	87.8	Confident	92 Å²	92	39.9 Å²	39.9	43%	0.43	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	155.6	172.1	-73.5	-165.8	-141	0	0	112	L103 V104 I105 R136	L103-E128 PolarHBondContact O-N 3.05Å; V104-E128 HydrophobicContact CB-CB 4.42Å; V104-E128 HydrophobicContact CG1-CB 4.22Å; V104-E128 HydrophobicContact CG2-CB 4.17Å; I105-E128 PolarHBondContact N-O 2.85Å; E128-R136 IonicContact OE1-NH1 3.4Å; E128-R136 PolarHBondContact OE1-NH1 3.19Å; E128-R136 IonicContact OE2-CZ 3.28Å; E128-R136 VanDerWaalsContact OE2-CZ 3.23Å; E128-R136 IonicContact OE2-NH1 3.18Å; E128-R136 PolarHBondContact OE2-NH1 2.82Å; E128-R136 IonicContact OE2-NH2 3.87Å; E128-R136 PolarHBondContact OE2-NH2 3.25Å
129	C	90.1	Very high	88	Confident	36 Å²	36	39.7 Å²	39.7	24%	0.243	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	119.3	175.4	-89.7	0	0	0	0	112.8	I105 V122	I105-C129 CarbonylContact O-C 3.56Å; I105-C129 VanDerWaalsContact O-CA 3.26Å; I105-C129 WeakPolarHBondContact O-CA 3.37Å; V122-C129 VanDerWaalsContact CG1-SG 3.59Å
130	E	85.8	Confident	87.9	Confident	22 Å²	22	38 Å²	38	10%	0.103	22%	0.215	C	C	.	.			trans	-108.5	125.8	179.9	-71.4	-174.8	147.3	0	0	112	V104 I105 C106 V132 T134 R136 T137	V104-E130 HydrophobicContact CG1-CB 4.26Å; V104-E130 HydrophobicContact CG1-CG 3.49Å; V104-E130 VanDerWaalsContact CG1-CG 3.49Å; V104-E130 WeakPolarHBondContact CG1-OE2 3.5Å; I105-E130 PolarHBondContact O-N 2.83Å; C106-E130 WeakPolarHBondContact CA-O 3.41Å; C106-E130 PolarHBondContact SG-O 3.45Å; E130-V132 VanDerWaalsContact C-N 3.34Å; E130-V132 WeakPolarHBondContact CB-O 3.48Å; E130-T134 VanDerWaalsContact CD-OG1 3.27Å; E130-T134 PolarHBondContact OE1-OG1 3.46Å; E130-T134 WeakPolarHBondContact OE2-CB 3.41Å; E130-T134 WeakPolarHBondContact OE2-CG2 3.45Å; E130-T134 PolarHBondContact OE2-OG1 2.95Å; E130-R136 IonicContact OE1-CZ 2.64Å; E130-R136 VanDerWaalsContact OE1-CZ 3.3Å; E130-R136 IonicContact OE1-NE 3.59Å; E130-R136 PolarHBondContact OE1-NE 3.02Å; E130-R136 IonicContact OE1-NH2 3.62Å; E130-R136 PolarHBondContact OE1-NH2 3.48Å; E130-T137 PolarHBondContact OE2-OG1 3.18Å
131	R	75.4	Confident	88	Confident	54 Å²	54	37.9 Å²	37.9	20%	0.204	22%	0.215	C	C	.	.	S	Bend	trans	-76.2	-21.2	177.1	-72.8	179.6	170.3	-130.1	1.7	113.7	K160 F276 M279 V280	R131-K160 WeakPolarHBondContact O-CE 3.47Å; R131-K160 PolarHBondContact O-NZ 3.12Å; R131-F276 VanDerWaalsContact NE-CE2 3.34Å; R131-F276 PolarHBondContact NH2-O 3.3Å; R131-M279 VanDerWaalsContact CD-CE 3.46Å; R131-V280 VanDerWaalsContact NH1-CG2 3.3Å
132	V	78	Confident	87.8	Confident	103 Å²	103	37 Å²	37	62%	0.624	21%	0.209	S	C	*	.	S	Bend	trans	-110.9	143.6	174	-178.8	0	0	0	0	107.7	E130 T134	E130-V132 VanDerWaalsContact C-N 3.34Å; E130-V132 WeakPolarHBondContact CB-O 3.48Å; V132-T134 PolarHBondContact O-N 3.22Å
133	L	79.7	Confident	87.2	Confident	32 Å²	32	40.5 Å²	40.5	17%	0.168	23%	0.231	C	C	.	.			trans	-74	120.4	174.8	-173.6	65.8	0	0	0	108.8	C106 T137 K160 V163 A164 I170	C106-L133 HydrophobicContact CB-CD1 4.33Å; L133-T137 HydrophobicContact CD1-CG2 3.65Å; L133-K160 HydrophobicContact CB-CG 4.22Å; L133-K160 HydrophobicContact CD2-CB 4.38Å; L133-K160 WeakPolarHBondContact CD2-O 3.34Å; L133-V163 HydrophobicContact CD2-CB 3.71Å; L133-V163 HydrophobicContact CD2-CG1 3.66Å; L133-A164 HydrophobicContact CD2-CB 4.37Å; L133-I170 HydrophobicContact CD1-CD1 3.98Å; L133-I170 HydrophobicContact CD1-CG2 4.41Å; L133-I170 HydrophobicContact CG-CD1 4.39Å
134	T	81.1	Confident	86.1	Confident	49 Å²	49	39.9 Å²	39.9	30%	0.301	23%	0.229	S	C	.	.			trans	-119.5	174.1	179.9	84.1	0	0	0	0	111.2	E130 V132 R136 T137	E130-T134 VanDerWaalsContact CD-OG1 3.27Å; E130-T134 PolarHBondContact OE1-OG1 3.46Å; E130-T134 WeakPolarHBondContact OE2-CB 3.41Å; E130-T134 WeakPolarHBondContact OE2-CG2 3.45Å; E130-T134 PolarHBondContact OE2-OG1 2.95Å; V132-T134 PolarHBondContact O-N 3.22Å; T134-R136 PolarHBondContact O-N 2.82Å; T134-R136 WeakPolarHBondContact OG1-CB 3.43Å; T134-R136 PolarHBondContact OG1-N 3.27Å; T134-T137 PolarHBondContact N-OG1 2.92Å; T134-T137 WeakPolarHBondContact O-CB 3.41Å; T134-T137 PolarHBondContact O-N 3.48Å; T134-T137 PolarHBondContact O-OG1 3.48Å; T134-T137 PolarHBondContact OG1-N 2.79Å
135	S	84.6	Confident	84.9	Confident	117 Å²	117	41.6 Å²	41.6	82%	0.818	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-13.8	169.8	51.4	0	0	0	0	114
136	R	88.1	Confident	83.1	Confident	122 Å²	122	42.4 Å²	42.4	46%	0.46	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-23.6	171.2	-51.1	-164.8	-53.5	140.2	5	112.4	V104 E128 E130 T134 T138	V104-R136 WeakPolarHBondContact CB-O 3.28Å; V104-R136 HydrophobicContact CG2-CB 4.34Å; V104-R136 WeakPolarHBondContact CG2-O 3.48Å; E128-R136 IonicContact OE1-NH1 3.4Å; E128-R136 PolarHBondContact OE1-NH1 3.19Å; E128-R136 IonicContact OE2-CZ 3.28Å; E128-R136 VanDerWaalsContact OE2-CZ 3.23Å; E128-R136 IonicContact OE2-NH1 3.18Å; E128-R136 PolarHBondContact OE2-NH1 2.82Å; E128-R136 IonicContact OE2-NH2 3.87Å; E128-R136 PolarHBondContact OE2-NH2 3.25Å; E130-R136 IonicContact OE1-CZ 2.64Å; E130-R136 VanDerWaalsContact OE1-CZ 3.3Å; E130-R136 IonicContact OE1-NE 3.59Å; E130-R136 PolarHBondContact OE1-NE 3.02Å; E130-R136 IonicContact OE1-NH2 3.62Å; E130-R136 PolarHBondContact OE1-NH2 3.48Å; T134-R136 PolarHBondContact O-N 2.82Å; T134-R136 WeakPolarHBondContact OG1-CB 3.43Å; T134-R136 PolarHBondContact OG1-N 3.27Å; R136-T138 PolarHBondContact O-N 3.34Å
137	T	90	Very high	81	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.264	C	S	.	.			trans	-61.2	120.7	-176.3	-52.9	0	0	0	0	110.5	C106 E130 L133 T134 H139 I170	C106-T137 HydrophobicContact CB-CG2 3.48Å; C106-T137 VanDerWaalsContact CB-CG2 3.48Å; E130-T137 PolarHBondContact OE2-OG1 3.18Å; L133-T137 HydrophobicContact CD1-CG2 3.65Å; T134-T137 PolarHBondContact N-OG1 2.92Å; T134-T137 WeakPolarHBondContact O-CB 3.41Å; T134-T137 PolarHBondContact O-N 3.48Å; T134-T137 PolarHBondContact O-OG1 3.48Å; T134-T137 PolarHBondContact OG1-N 2.79Å; T137-H139 VanDerWaalsContact CG2-O 3.25Å; T137-H139 WeakPolarHBondContact CG2-O 3.49Å; T137-I170 WeakPolarHBondContact O-CG1 3.47Å
138	T	93.3	Very high	78.9	Confident	33 Å²	33	48.5 Å²	48.5	20%	0.202	28%	0.28	C	S	.	.			trans	-89.7	-30.7	176.6	62.2	0	0	0	0	112.6	V104 R136 I170 K171	V104-T138 PolarHBondContact N-OG1 3.18Å; V104-T138 PolarHBondContact O-N 3.47Å; V104-T138 PolarHBondContact O-OG1 3.41Å; R136-T138 PolarHBondContact O-N 3.34Å; T138-I170 WeakPolarHBondContact O-CA 3.19Å; T138-K171 PolarHBondContact O-N 2.93Å
139	H	94.5	Very high	76.6	Confident	8 Å²	8	48.4 Å²	48.4	4%	0.037	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	132.2	-172.4	-71.4	81.1	0	0	0	111.4	V104 I105 C106 T137 K171 W177 E190	V104-H139 PolarHBondContact O-N 3.44Å; V104-H139 VanDerWaalsContact O-N 3.17Å; I105-H139 HydrophobicContact CG1-CB 4.01Å; C106-H139 PolarHBondContact N-O 3.01Å; T137-H139 VanDerWaalsContact CG2-O 3.25Å; T137-H139 WeakPolarHBondContact CG2-O 3.49Å; H139-K171 CarbonylContact C-O 3.59Å; H139-K171 VanDerWaalsContact CA-O 3.29Å; H139-K171 WeakPolarHBondContact CA-O 3.45Å; H139-W177 AromaticContact CD2-CH2 3.54Å; H139-W177 AromaticContact CD2-CZ2 3.9Å; H139-W177 AromaticContact CD2-CZ3 3.88Å; H139-W177 AromaticContact CE1-CH2 3.9Å; H139-W177 AromaticContact CG-CH2 3.95Å; H139-W177 AromaticContact NE2-CH2 3.54Å; H139-W177 AromaticContact NE2-CZ2 3.6Å; H139-E190 IonicContact NE2-OE1 3.36Å
140	L	92.2	Very high	74.3	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	113	166.7	179.9	73.7	0	0	0	108.6	C106 K160 A164 I170 K171 I172 V173	C106-L140 HydrophobicContact CB-CD1 4.27Å; C106-L140 WeakPolarHBondContact O-CD1 3.43Å; L140-K160 HydrophobicContact CD1-CB 3.89Å; L140-K160 HydrophobicContact CD1-CD 3.9Å; L140-K160 HydrophobicContact CD2-CB 4.35Å; L140-A164 HydrophobicContact CB-CB 4.01Å; L140-A164 HydrophobicContact CD2-CB 3.68Å; L140-A164 HydrophobicContact CG-CB 4.44Å; L140-I170 HydrophobicContact CB-CG2 4.31Å; L140-K171 PolarHBondContact N-O 3.42Å; L140-I172 HydrophobicContact CB-CG1 4.4Å; L140-I172 HydrophobicContact CB-CG2 4.5Å; L140-I172 HydrophobicContact CD2-CD1 4.49Å; L140-I172 HydrophobicContact CD2-CG1 4.44Å; L140-I172 HydrophobicContact CD2-CG2 4.23Å; L140-I172 WeakPolarHBondContact O-CA 3.42Å; L140-V173 PolarHBondContact O-N 3.28Å
141	V	92.5	Very high	72.3	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	115.6	177.2	174.5	0	0	0	0	109.3	I105 C106 P107 S108 L110 L118 V173 P175 V178	I105-V141 HydrophobicContact CG2-CB 4.4Å; I105-V141 HydrophobicContact CG2-CG2 3.61Å; C106-V141 PolarHBondContact O-N 3.48Å; P107-V141 CarbonylContact C-O 3.6Å; S108-V141 PolarHBondContact N-O 3.41Å; L110-V141 HydrophobicContact CD1-CG1 4.45Å; L118-V141 HydrophobicContact CD1-CG1 4.34Å; L118-V141 HydrophobicContact CD2-CB 4.09Å; L118-V141 HydrophobicContact CD2-CG1 3.78Å; L118-V141 HydrophobicContact CD2-CG2 4.35Å; V141-V173 CarbonylContact C-O 3.51Å; V141-V173 VanDerWaalsContact CA-O 3.3Å; V141-V173 WeakPolarHBondContact CA-O 3.2Å; V141-V173 HydrophobicContact CG2-CG2 3.85Å; V141-P175 HydrophobicContact CG1-CB 4.13Å; V141-P175 HydrophobicContact CG1-CG 3.82Å; V141-V178 HydrophobicContact CG2-CG2 4.04Å
142	C	86.5	Confident	71	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.007	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	152.9	177	72.2	0	0	0	0	114.6	S108 V173 I174 P195	S108-C142 VanDerWaalsContact O-CA 3.27Å; S108-C142 WeakPolarHBondContact O-CA 3.46Å; S108-C142 VanDerWaalsContact O-CB 3.25Å; S108-C142 WeakPolarHBondContact O-CB 3.04Å; C142-V173 PolarHBondContact N-O 3.24Å; C142-I174 WeakPolarHBondContact O-CA 3.38Å; C142-P195 WeakPolarHBondContact O-CG 3.27Å
143	T	79	Confident	69.4	Low	73 Å²	73	61.5 Å²	61.5	45%	0.448	35%	0.353	S	S	.	.	S	Bend	trans	-91.9	-17.5	-170.2	41.4	0	0	0	0	115.7	Q109 L110 P175	Q109-T143 PolarHBondContact O-OG1 3.05Å; L110-T143 HydrophobicContact CD2-CG2 3.64Å; T143-P175 HydrophobicContact CG2-CG 3.71Å
144	S	67.9	Low	68.2	Low	51 Å²	51	70.5 Å²	70.5	36%	0.357	38%	0.384	S	S	.	.			trans	-136.3	131.8	-168.2	172.7	0	0	0	0	111.9	Q109 A146	Q109-S144 PolarHBondContact NE2-O 2.92Å; S144-A146 PolarHBondContact O-N 3.22Å; S144-A146 VanDerWaalsContact O-N 3.07Å
145	L	62.7	Low	67.2	Low	40 Å²	40	71.6 Å²	71.6	21%	0.209	39%	0.391	C	S	.	.			trans	-64.7	102.6	150.2	-64.6	-168	0	0	0	108.7	S147 Y161 P195 R196 T199	L145-S147 PolarHBondContact O-N 3.44Å; L145-Y161 HydrophobicContact CD2-CE1 4.36Å; L145-Y161 HydrophobicContact CD2-CE2 3.75Å; L145-Y161 WeakPolarHBondContact CD2-OH 3.48Å; L145-P195 HydrophobicContact CD2-CB 4.25Å; L145-R196 HydrophobicContact CD1-CB 4.35Å; L145-R196 HydrophobicContact CD1-CG 3.92Å; L145-R196 HydrophobicContact CD2-CG 3.72Å; L145-R196 HydrophobicContact CG-CG 4.3Å; L145-T199 HydrophobicContact CB-CG2 4.17Å; L145-T199 HydrophobicContact CD1-CG2 3.99Å; L145-T199 HydrophobicContact CG-CG2 4.26Å; L145-T199 WeakPolarHBondContact CG-OG1 3.29Å
146	A	51.9	Low	66.2	Low	23 Å²	23	70.4 Å²	70.4	19%	0.19	38%	0.379	C	S	.	.			trans	-73.8	69.6	166.3	0	0	0	0	0	109.5	S144 V148 Q158	S144-A146 PolarHBondContact O-N 3.22Å; S144-A146 VanDerWaalsContact O-N 3.07Å; A146-V148 PolarHBondContact O-N 2.91Å; A146-Q158 HydrophobicContact CB-CG 3.46Å; A146-Q158 VanDerWaalsContact CB-CG 3.46Å
147	S	45.6	Very low	65.2	Low	96 Å²	96	65.4 Å²	65.4	67%	0.671	36%	0.364	S	S	*	.			trans	-46.6	119.9	-174.1	55.9	0	0	0	0	110.9	L145 P149	L145-S147 PolarHBondContact O-N 3.44Å; S147-P149 WeakPolarHBondContact O-CD 3.2Å
148	V	47.3	Very low	64	Low	65 Å²	65	66.7 Å²	66.7	39%	0.394	37%	0.37	S	S	.	.			trans	-80.1	105.9	-159.2	-178.8	0	0	0	0	111.1	A146 H150 F153	A146-V148 PolarHBondContact O-N 2.91Å; V148-H150 PolarHBondContact O-N 2.94Å; V148-H150 PolarHBondContact O-ND1 3.24Å; V148-F153 HydrophobicContact CB-CZ 4.09Å; V148-F153 HydrophobicContact CG1-CE1 4.08Å; V148-F153 HydrophobicContact CG1-CE2 3.6Å; V148-F153 HydrophobicContact CG1-CZ 3.32Å; V148-F153 HydrophobicContact CG2-CE1 3.84Å; V148-F153 HydrophobicContact CG2-CZ 3.53Å
149	P	41.9	Very low	62.9	Low	91 Å²	91	68.5 Å²	68.5	59%	0.591	38%	0.381	S	S	*	.			trans	-71.3	124.1	171.4	-6.6	27.6	0	0	0	106.3	S147 G151	S147-P149 WeakPolarHBondContact O-CD 3.2Å; P149-G151 PolarHBondContact O-N 3.25Å; P149-G151 VanDerWaalsContact O-N 3.08Å
150	H	42.3	Very low	62.3	Low	191 Å²	191	69.1 Å²	69.1	88%	0.884	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	118.7	-165.5	-68.7	13.6	0	0	0	111.9	V148	V148-H150 PolarHBondContact O-N 2.94Å; V148-H150 PolarHBondContact O-ND1 3.24Å
151	G	44.4	Very low	61.8	Low	76 Å²	76	70.9 Å²	70.9	78%	0.784	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.2	-3.3	167.7	0	0	0	0	0	118.2	P149	P149-G151 PolarHBondContact O-N 3.25Å; P149-G151 VanDerWaalsContact O-N 3.08Å
152	R	48.5	Very low	61.1	Low	154 Å²	154	77.6 Å²	77.6	58%	0.581	42%	0.415	S	S	*	.			trans	-138.1	85.8	175.2	-66.3	-172.8	-173	164.8	7.6	113.9	R154	R152-R154 PolarHBondContact O-N 3.41Å
153	F	42.9	Very low	60.8	Low	68 Å²	68	80.9 Å²	80.9	30%	0.298	44%	0.435	S	S	.	.			trans	-67.4	116.4	158.9	-80.4	-78.8	0	0	0	109.2	V148 Q158 R162	V148-F153 HydrophobicContact CB-CZ 4.09Å; V148-F153 HydrophobicContact CG1-CE1 4.08Å; V148-F153 HydrophobicContact CG1-CE2 3.6Å; V148-F153 HydrophobicContact CG1-CZ 3.32Å; V148-F153 HydrophobicContact CG2-CE1 3.84Å; V148-F153 HydrophobicContact CG2-CZ 3.53Å; F153-Q158 HydrophobicContact CD1-CB 3.68Å; F153-Q158 HydrophobicContact CE1-CB 3.97Å; F153-R162 HydrophobicContact CD1-CG 4.08Å; F153-R162 HydrophobicContact CE1-CG 3.32Å; F153-R162 HydrophobicContact CE2-CG 4.34Å; F153-R162 HydrophobicContact CZ-CG 3.47Å; F153-R162 VanDerWaalsContact CZ-CG 3.47Å
154	R	54.3	Low	61	Low	221 Å²	221	77.5 Å²	77.5	83%	0.834	41%	0.414	S	S	*	.			trans	-139.6	3	-171.4	-139.2	-178.1	-178.1	-144.7	-2.5	115.8	R152	R152-R154 PolarHBondContact O-N 3.41Å
155	T	60.6	Low	61.7	Low	72 Å²	72	78.2 Å²	78.2	44%	0.442	42%	0.42	S	S	.	.	S	Bend	trans	-123.4	148.5	166.9	73.6	0	0	0	0	111.2	A157 Q158 V159	T155-A157 PolarHBondContact O-N 2.96Å; T155-Q158 PolarHBondContact O-N 3.41Å; T155-Q158 WeakPolarHBondContact OG1-CG 3.49Å; T155-Q158 PolarHBondContact OG1-N 3.48Å; T155-V159 PolarHBondContact O-N 2.93Å
156	V	64.5	Low	62.6	Low	93 Å²	93	80.2 Å²	80.2	56%	0.564	44%	0.442	S	S	*	.	H	α-helix	trans	-59.2	-32.2	175.5	179.1	0	0	0	0	111	V159 K160	V156-V159 PolarHBondContact O-N 3.19Å; V156-K160 PolarHBondContact O-N 2.9Å
157	A	66.1	Low	64	Low	17 Å²	17	81.1 Å²	81.1	14%	0.14	45%	0.446	C	S	.	.	H	α-helix	trans	-64.1	-46.5	178.2	0	0	0	0	0	112.8	S108 Q109 T155 V159 K160 Y161	S108-A157 WeakPolarHBondContact OG-CB 3.39Å; Q109-A157 HydrophobicContact CG-CB 3.46Å; Q109-A157 VanDerWaalsContact CG-CB 3.46Å; T155-A157 PolarHBondContact O-N 2.96Å; A157-V159 VanDerWaalsContact C-N 3.25Å; A157-V159 PolarHBondContact O-N 2.8Å; A157-K160 PolarHBondContact O-N 3.27Å; A157-Y161 PolarHBondContact O-N 3.5Å
158	Q	64.5	Low	65.8	Low	26 Å²	26	83.8 Å²	83.8	12%	0.121	45%	0.453	C	S	.	.	H	α-helix	trans	-58.4	-39.2	173.9	-73	171.2	-33.2	0	0	111.7	A146 F153 T155 Y161 R162	A146-Q158 HydrophobicContact CB-CG 3.46Å; A146-Q158 VanDerWaalsContact CB-CG 3.46Å; F153-Q158 HydrophobicContact CD1-CB 3.68Å; F153-Q158 HydrophobicContact CE1-CB 3.97Å; T155-Q158 PolarHBondContact O-N 3.41Å; T155-Q158 WeakPolarHBondContact OG1-CG 3.49Å; T155-Q158 PolarHBondContact OG1-N 3.48Å; Q158-Y161 PolarHBondContact O-N 2.96Å; Q158-R162 WeakPolarHBondContact O-CG 3.18Å; Q158-R162 PolarHBondContact O-N 3.34Å
159	V	71.3	Confident	67.7	Low	72 Å²	72	85.4 Å²	85.4	44%	0.436	46%	0.459	S	S	.	.	H	α-helix	trans	-66.1	-45.4	177.9	179	0	0	0	0	111.2	T155 V156 A157 Y161 R162 V163	T155-V159 PolarHBondContact O-N 2.93Å; V156-V159 PolarHBondContact O-N 3.19Å; A157-V159 VanDerWaalsContact C-N 3.25Å; A157-V159 PolarHBondContact O-N 2.8Å; V159-Y161 VanDerWaalsContact C-N 3.35Å; V159-Y161 PolarHBondContact O-N 2.95Å; V159-R162 PolarHBondContact O-N 3.23Å; V159-V163 WeakPolarHBondContact O-CG2 3.42Å; V159-V163 PolarHBondContact O-N 3.38Å; V159-V163 VanDerWaalsContact O-N 3.16Å
160	K	81.5	Confident	70	Confident	21 Å²	21	81.7 Å²	81.7	9%	0.091	43%	0.434	C	S	.	.	H	α-helix	trans	-55.8	-49.4	173.2	-70.8	-166.9	-176.4	-172.1	0	111.3	C106 P107 R131 L133 L140 V156 A157 R162 V163 A164	C106-K160 PolarHBondContact SG-NZ 2.8Å; P107-K160 PolarHBondContact O-NZ 3.42Å; R131-K160 WeakPolarHBondContact O-CE 3.47Å; R131-K160 PolarHBondContact O-NZ 3.12Å; L133-K160 HydrophobicContact CB-CG 4.22Å; L133-K160 HydrophobicContact CD2-CB 4.38Å; L133-K160 WeakPolarHBondContact CD2-O 3.34Å; L140-K160 HydrophobicContact CD1-CB 3.89Å; L140-K160 HydrophobicContact CD1-CD 3.9Å; L140-K160 HydrophobicContact CD2-CB 4.35Å; V156-K160 PolarHBondContact O-N 2.9Å; A157-K160 PolarHBondContact O-N 3.27Å; K160-R162 PolarHBondContact O-N 2.91Å; K160-V163 PolarHBondContact O-N 3.47Å; K160-A164 PolarHBondContact O-N 3.12Å
161	Y	82	Confident	72.5	Confident	37 Å²	37	77.3 Å²	77.3	15%	0.145	41%	0.413	C	S	.	.	H	α-helix	trans	-58.2	-46	-178.7	-174.7	-84.2	0	0	0	112.1	L145 A157 Q158 V159 V163 S165 I172	L145-Y161 HydrophobicContact CD2-CE1 4.36Å; L145-Y161 HydrophobicContact CD2-CE2 3.75Å; L145-Y161 WeakPolarHBondContact CD2-OH 3.48Å; A157-Y161 PolarHBondContact O-N 3.5Å; Q158-Y161 PolarHBondContact O-N 2.96Å; V159-Y161 VanDerWaalsContact C-N 3.35Å; V159-Y161 PolarHBondContact O-N 2.95Å; Y161-V163 PolarHBondContact O-N 2.71Å; Y161-S165 WeakPolarHBondContact CD1-OG 3.39Å; Y161-S165 WeakPolarHBondContact CE1-OG 3.5Å; Y161-S165 VanDerWaalsContact O-CB 3.27Å; Y161-S165 WeakPolarHBondContact O-CB 3.38Å; Y161-S165 PolarHBondContact O-N 3.05Å; Y161-S165 PolarHBondContact O-OG 3.42Å; Y161-I172 HydrophobicContact CD2-CD1 4.26Å; Y161-I172 HydrophobicContact CD2-CG2 4.2Å; Y161-I172 HydrophobicContact CE2-CD1 3.98Å; Y161-I172 HydrophobicContact CE2-CG2 3.91Å
162	R	77.2	Confident	74.7	Confident	142 Å²	142	74.8 Å²	74.8	54%	0.536	38%	0.381	S	S	.	.	H	α-helix	trans	-56.1	-48.9	174.9	-70.6	-170.1	90.4	172.1	-1.4	112.8	F153 Q158 V159 K160 S165 A166	F153-R162 HydrophobicContact CD1-CG 4.08Å; F153-R162 HydrophobicContact CE1-CG 3.32Å; F153-R162 HydrophobicContact CE2-CG 4.34Å; F153-R162 HydrophobicContact CZ-CG 3.47Å; F153-R162 VanDerWaalsContact CZ-CG 3.47Å; Q158-R162 WeakPolarHBondContact O-CG 3.18Å; Q158-R162 PolarHBondContact O-N 3.34Å; V159-R162 PolarHBondContact O-N 3.23Å; K160-R162 PolarHBondContact O-N 2.91Å; R162-S165 CarbonylContact O-C 3.59Å; R162-S165 PolarHBondContact O-N 3.46Å; R162-A166 WeakPolarHBondContact O-CB 3.41Å; R162-A166 PolarHBondContact O-N 3.44Å; R162-A166 VanDerWaalsContact O-N 3.09Å
163	V	80.8	Confident	76.9	Confident	69 Å²	69	67.4 Å²	67.4	42%	0.418	35%	0.353	S	S	.	.	H	α-helix	trans	-69.6	-44	-169.9	171.6	0	0	0	0	109.3	L133 V159 K160 Y161 S165 A166 C167	L133-V163 HydrophobicContact CD2-CB 3.71Å; L133-V163 HydrophobicContact CD2-CG1 3.66Å; V159-V163 WeakPolarHBondContact O-CG2 3.42Å; V159-V163 PolarHBondContact O-N 3.38Å; V159-V163 VanDerWaalsContact O-N 3.16Å; K160-V163 PolarHBondContact O-N 3.47Å; Y161-V163 PolarHBondContact O-N 2.71Å; V163-S165 VanDerWaalsContact C-N 3.32Å; V163-S165 PolarHBondContact O-N 2.97Å; V163-A166 PolarHBondContact O-N 3.36Å; V163-A166 VanDerWaalsContact O-N 3.15Å; V163-C167 WeakPolarHBondContact O-CB 3.44Å; V163-C167 PolarHBondContact O-N 2.99Å; V163-C167 PolarHBondContact O-SG 3.49Å
164	A	83.8	Confident	79.2	Confident	2 Å²	2	65.1 Å²	65.1	2%	0.017	34%	0.344	C	S	.	.	H	α-helix	trans	-59.7	-41.8	169.9	0	0	0	0	0	112.1	L133 L140 K160 A166 C167 I170 I172	L133-A164 HydrophobicContact CD2-CB 4.37Å; L140-A164 HydrophobicContact CB-CB 4.01Å; L140-A164 HydrophobicContact CD2-CB 3.68Å; L140-A164 HydrophobicContact CG-CB 4.44Å; K160-A164 PolarHBondContact O-N 3.12Å; A164-A166 PolarHBondContact O-N 3.5Å; A164-A166 VanDerWaalsContact O-N 3.09Å; A164-C167 PolarHBondContact O-N 3.3Å; A164-C167 VanDerWaalsContact O-N 3.07Å; A164-I170 HydrophobicContact CB-CB 4.12Å; A164-I170 HydrophobicContact CB-CG2 3.74Å; A164-I172 HydrophobicContact CB-CD1 3.76Å; A164-I172 HydrophobicContact CB-CG1 3.79Å
165	S	82.6	Confident	81	Confident	67 Å²	67	55.7 Å²	55.7	47%	0.469	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-10.6	178.2	-58.8	0	0	0	0	114.3	Y161 R162 V163 I172	Y161-S165 WeakPolarHBondContact CD1-OG 3.39Å; Y161-S165 WeakPolarHBondContact CE1-OG 3.5Å; Y161-S165 VanDerWaalsContact O-CB 3.27Å; Y161-S165 WeakPolarHBondContact O-CB 3.38Å; Y161-S165 PolarHBondContact O-N 3.05Å; Y161-S165 PolarHBondContact O-OG 3.42Å; R162-S165 CarbonylContact O-C 3.59Å; R162-S165 PolarHBondContact O-N 3.46Å; V163-S165 VanDerWaalsContact C-N 3.32Å; V163-S165 PolarHBondContact O-N 2.97Å; S165-I172 VanDerWaalsContact OG-CD1 3.29Å; S165-I172 WeakPolarHBondContact OG-CD1 3.43Å
166	A	80.1	Confident	82.4	Confident	82 Å²	82	56 Å²	56	68%	0.678	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	8.5	177.6	0	0	0	0	0	112.5	R162 V163 A164	R162-A166 WeakPolarHBondContact O-CB 3.41Å; R162-A166 PolarHBondContact O-N 3.44Å; R162-A166 VanDerWaalsContact O-N 3.09Å; V163-A166 PolarHBondContact O-N 3.36Å; V163-A166 VanDerWaalsContact O-N 3.15Å; A164-A166 PolarHBondContact O-N 3.5Å; A164-A166 VanDerWaalsContact O-N 3.09Å
167	C	82.6	Confident	83.8	Confident	41 Å²	41	51.5 Å²	51.5	28%	0.277	28%	0.281	S	S	.	.			trans	-131.8	101.7	-176	-70.8	0	0	0	0	110.2	V163 A164 N169 I170	V163-C167 WeakPolarHBondContact O-CB 3.44Å; V163-C167 PolarHBondContact O-N 2.99Å; V163-C167 PolarHBondContact O-SG 3.49Å; A164-C167 PolarHBondContact O-N 3.3Å; A164-C167 VanDerWaalsContact O-N 3.07Å; C167-N169 WeakPolarHBondContact CB-OD1 3.41Å; C167-N169 PolarHBondContact O-N 2.94Å; C167-I170 HydrophobicContact CB-CB 4.48Å; C167-I170 HydrophobicContact CB-CD1 4.01Å; C167-I170 HydrophobicContact CB-CG1 3.88Å; C167-I170 PolarHBondContact O-N 3.35Å
168	D	83.8	Confident	85	Confident	153 Å²	153	50.8 Å²	50.8	82%	0.818	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-22.5	-176.2	-57.8	-51	0	0	0	114.2	I170 K171	D168-I170 VanDerWaalsContact C-N 3.32Å; D168-K171 PolarHBondContact O-NZ 3.5Å
169	N	86.2	Confident	86.2	Confident	98 Å²	98	52.9 Å²	52.9	52%	0.524	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-5.5	176.7	71.9	-79.1	0	0	0	114.6	C167	C167-N169 WeakPolarHBondContact CB-OD1 3.41Å; C167-N169 PolarHBondContact O-N 2.94Å
170	I	90.8	Very high	87.1	Confident	13 Å²	13	51.7 Å²	51.7	7%	0.067	28%	0.277	C	S	.	.	S	Bend	trans	-115.5	114.2	180	-46.4	-170.4	0	0	0	109.2	L133 T137 T138 L140 A164 C167 D168	L133-I170 HydrophobicContact CD1-CD1 3.98Å; L133-I170 HydrophobicContact CD1-CG2 4.41Å; L133-I170 HydrophobicContact CG-CD1 4.39Å; T137-I170 WeakPolarHBondContact O-CG1 3.47Å; T138-I170 WeakPolarHBondContact O-CA 3.19Å; L140-I170 HydrophobicContact CB-CG2 4.31Å; A164-I170 HydrophobicContact CB-CB 4.12Å; A164-I170 HydrophobicContact CB-CG2 3.74Å; C167-I170 HydrophobicContact CB-CB 4.48Å; C167-I170 HydrophobicContact CB-CD1 4.01Å; C167-I170 HydrophobicContact CB-CG1 3.88Å; C167-I170 PolarHBondContact O-N 3.35Å; D168-I170 VanDerWaalsContact C-N 3.32Å
171	K	93.3	Very high	87.5	Confident	100 Å²	100	50.7 Å²	50.7	44%	0.435	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	140.1	175.2	-52.4	-48.4	177.8	-161.8	0	109.9	T138 H139 L140 D168 E190	T138-K171 PolarHBondContact O-N 2.93Å; H139-K171 CarbonylContact C-O 3.59Å; H139-K171 VanDerWaalsContact CA-O 3.29Å; H139-K171 WeakPolarHBondContact CA-O 3.45Å; L140-K171 PolarHBondContact N-O 3.42Å; D168-K171 PolarHBondContact O-NZ 3.5Å; K171-E190 HydrophobicContact CB-CB 4.48Å; K171-E190 HydrophobicContact CB-CG 4.44Å; K171-E190 HydrophobicContact CG-CG 4.47Å
172	I	91.6	Very high	87.7	Confident	22 Å²	22	49.2 Å²	49.2	11%	0.113	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	123.1	177.6	-49.2	-179.3	0	0	0	108.1	L140 Y161 A164 S165 P195	L140-I172 HydrophobicContact CB-CG1 4.4Å; L140-I172 HydrophobicContact CB-CG2 4.5Å; L140-I172 HydrophobicContact CD2-CD1 4.49Å; L140-I172 HydrophobicContact CD2-CG1 4.44Å; L140-I172 HydrophobicContact CD2-CG2 4.23Å; L140-I172 WeakPolarHBondContact O-CA 3.42Å; Y161-I172 HydrophobicContact CD2-CD1 4.26Å; Y161-I172 HydrophobicContact CD2-CG2 4.2Å; Y161-I172 HydrophobicContact CE2-CD1 3.98Å; Y161-I172 HydrophobicContact CE2-CG2 3.91Å; A164-I172 HydrophobicContact CB-CD1 3.76Å; A164-I172 HydrophobicContact CB-CG1 3.79Å; S165-I172 VanDerWaalsContact OG-CD1 3.29Å; S165-I172 WeakPolarHBondContact OG-CD1 3.43Å; I172-P195 HydrophobicContact CG2-CG 3.91Å
173	V	94.1	Very high	88	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	154.6	-175	-62.4	0	0	0	0	111.4	L140 V141 C142 W177 E190 Y193	L140-V173 PolarHBondContact O-N 3.28Å; V141-V173 CarbonylContact C-O 3.51Å; V141-V173 VanDerWaalsContact CA-O 3.3Å; V141-V173 WeakPolarHBondContact CA-O 3.2Å; V141-V173 HydrophobicContact CG2-CG2 3.85Å; C142-V173 PolarHBondContact N-O 3.24Å; V173-W177 HydrophobicContact CB-CB 3.97Å; V173-W177 HydrophobicContact CB-CD2 4.47Å; V173-W177 HydrophobicContact CB-CG 4.2Å; V173-W177 HydrophobicContact CG1-CB 4.45Å; V173-W177 HydrophobicContact CG1-CD2 4.41Å; V173-W177 HydrophobicContact CG1-CG 4.23Å; V173-W177 HydrophobicContact CG2-CB 4.08Å; V173-W177 HydrophobicContact CG2-CD2 4Å; V173-W177 HydrophobicContact CG2-CE3 3.7Å; V173-W177 HydrophobicContact CG2-CG 4.18Å; V173-W177 HydrophobicContact CG2-CZ3 4.44Å; V173-E190 HydrophobicContact CG1-CB 3.95Å; V173-E190 HydrophobicContact CG1-CG 4.42Å; V173-Y193 CarbonylContact C-O 3.54Å; V173-Y193 VanDerWaalsContact CA-O 3.28Å; V173-Y193 WeakPolarHBondContact CA-O 3.44Å
174	I	92	Very high	88.2	Confident	20 Å²	20	47.2 Å²	47.2	10%	0.103	27%	0.271	C	S	.	.			trans	-75.2	157.9	167.3	62.3	162	0	0	0	111.2	C142 Q176 W177 Y193 P195 F198	C142-I174 WeakPolarHBondContact O-CA 3.38Å; I174-Q176 HydrophobicContact CD1-CB 3.53Å; I174-Q176 HydrophobicContact CG1-CB 3.9Å; I174-Q176 PolarHBondContact O-N 3.2Å; I174-W177 WeakPolarHBondContact O-CB 3.21Å; I174-W177 PolarHBondContact O-N 2.93Å; I174-W177 VanDerWaalsContact O-N 3.11Å; I174-Y193 HydrophobicContact CD1-CD1 4.5Å; I174-Y193 HydrophobicContact CG1-CD1 4.19Å; I174-Y193 PolarHBondContact N-O 3.41Å; I174-P195 HydrophobicContact CG2-CB 3.95Å; I174-P195 HydrophobicContact CG2-CG 3.82Å; I174-F198 HydrophobicContact CD1-CD1 4.05Å; I174-F198 HydrophobicContact CD1-CD2 3.77Å; I174-F198 HydrophobicContact CD1-CE1 3.8Å; I174-F198 HydrophobicContact CD1-CE2 3.54Å; I174-F198 HydrophobicContact CD1-CG 4.05Å; I174-F198 HydrophobicContact CD1-CZ 3.55Å; I174-F198 HydrophobicContact CG1-CD2 4.28Å; I174-F198 HydrophobicContact CG1-CE2 3.99Å; I174-F198 HydrophobicContact CG1-CZ 4.37Å; I174-F198 HydrophobicContact CG2-CD2 3.93Å; I174-F198 HydrophobicContact CG2-CE2 4.41Å
175	P	91.5	Very high	88.2	Confident	23 Å²	23	48.1 Å²	48.1	15%	0.149	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-26.8	177.9	-28.3	36.2	0	0	0	114.9	L110 L118 V141 T143 W177 V178 I179	L110-P175 HydrophobicContact CD1-CG 4.38Å; L110-P175 HydrophobicContact CD2-CG 3.5Å; L118-P175 HydrophobicContact CD1-CB 4.27Å; V141-P175 HydrophobicContact CG1-CB 4.13Å; V141-P175 HydrophobicContact CG1-CG 3.82Å; T143-P175 HydrophobicContact CG2-CG 3.71Å; P175-W177 PolarHBondContact O-N 3.43Å; P175-V178 WeakPolarHBondContact O-CB 3.28Å; P175-V178 PolarHBondContact O-N 3.37Å; P175-I179 PolarHBondContact O-N 3.11Å
176	Q	89.5	Confident	88.5	Confident	77 Å²	77	51 Å²	51	36%	0.36	29%	0.287	S	S	.	.	H	α-helix	trans	-57	-31.6	178.4	-166	61.5	35.1	0	0	112.6	I174 V178 I179 D180 Y193	I174-Q176 HydrophobicContact CD1-CB 3.53Å; I174-Q176 HydrophobicContact CG1-CB 3.9Å; I174-Q176 PolarHBondContact O-N 3.2Å; Q176-V178 VanDerWaalsContact C-N 3.35Å; Q176-V178 PolarHBondContact O-N 3.46Å; Q176-I179 CarbonylContact O-C 3.56Å; Q176-I179 PolarHBondContact O-N 2.96Å; Q176-I179 VanDerWaalsContact O-N 3.14Å; Q176-D180 WeakPolarHBondContact CG-OD2 3.27Å; Q176-D180 PolarHBondContact NE2-OD1 3.47Å; Q176-D180 PolarHBondContact NE2-OD2 2.89Å; Q176-D180 WeakPolarHBondContact O-CB 3.49Å; Q176-D180 PolarHBondContact O-N 3.37Å; Q176-Y193 HydrophobicContact CB-CD1 4.29Å; Q176-Y193 HydrophobicContact CB-CE1 4.47Å; Q176-Y193 HydrophobicContact CG-CE1 4.29Å
177	W	94.4	Very high	89.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57.6	-45.4	174.5	175.5	74.9	0	0	0	112.5	F100 L103 I105 H139 V173 I174 P175 I179 D180 C181 M187 A188 E190 Y193	F100-W177 HydrophobicContact CE1-CH2 4.08Å; F100-W177 HydrophobicContact CE1-CZ2 4.48Å; F100-W177 HydrophobicContact CE1-CZ3 4.39Å; F100-W177 HydrophobicContact CZ-CZ3 4.48Å; L103-W177 HydrophobicContact CD1-CH2 3.93Å; I105-W177 HydrophobicContact CD1-CZ3 3.97Å; H139-W177 AromaticContact CD2-CH2 3.54Å; H139-W177 AromaticContact CD2-CZ2 3.9Å; H139-W177 AromaticContact CD2-CZ3 3.88Å; H139-W177 AromaticContact CE1-CH2 3.9Å; H139-W177 AromaticContact CG-CH2 3.95Å; H139-W177 AromaticContact NE2-CH2 3.54Å; H139-W177 AromaticContact NE2-CZ2 3.6Å; V173-W177 HydrophobicContact CB-CB 3.97Å; V173-W177 HydrophobicContact CB-CD2 4.47Å; V173-W177 HydrophobicContact CB-CG 4.2Å; V173-W177 HydrophobicContact CG1-CB 4.45Å; V173-W177 HydrophobicContact CG1-CD2 4.41Å; V173-W177 HydrophobicContact CG1-CG 4.23Å; V173-W177 HydrophobicContact CG2-CB 4.08Å; V173-W177 HydrophobicContact CG2-CD2 4Å; V173-W177 HydrophobicContact CG2-CE3 3.7Å; V173-W177 HydrophobicContact CG2-CG 4.18Å; V173-W177 HydrophobicContact CG2-CZ3 4.44Å; I174-W177 WeakPolarHBondContact O-CB 3.21Å; I174-W177 PolarHBondContact O-N 2.93Å; I174-W177 VanDerWaalsContact O-N 3.11Å; P175-W177 PolarHBondContact O-N 3.43Å; W177-I179 VanDerWaalsContact C-N 3.28Å; W177-I179 PolarHBondContact O-N 3.38Å; W177-D180 PolarHBondContact O-N 3.5Å; W177-C181 WeakPolarHBondContact O-CB 3.35Å; W177-C181 PolarHBondContact O-N 3.32Å; W177-C181 PolarHBondContact O-SG 3.04Å; W177-M187 HydrophobicContact CH2-CE 4.33Å; W177-M187 HydrophobicContact CZ2-CE 3.68Å; W177-A188 PolarHBondContact NE1-O 3.3Å; W177-E190 HydrophobicContact CZ2-CG 4.05Å; W177-Y193 HydrophobicContact CB-CD1 3.93Å; W177-Y193 HydrophobicContact CB-CD2 3.98Å; W177-Y193 HydrophobicContact CB-CG 3.61Å; W177-Y193 AromaticContact CD1-CD2 3.5Å; W177-Y193 AromaticContact CD1-CE2 3.86Å; W177-Y193 HydrophobicContact CG-CD2 4.12Å; W177-Y193 HydrophobicContact CG-CG 4.23Å
178	V	92.3	Very high	89.5	Confident	1 Å²	1	50 Å²	50	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-64.1	-38	177.9	177.3	0	0	0	0	110.7	F100 L118 V121 V122 V141 P175 Q176 A182	F100-V178 HydrophobicContact CE2-CG1 4.01Å; F100-V178 HydrophobicContact CZ-CG1 4.34Å; L118-V178 HydrophobicContact CD1-CB 3.72Å; L118-V178 HydrophobicContact CD1-CG1 3.76Å; L118-V178 HydrophobicContact CD1-CG2 3.83Å; L118-V178 HydrophobicContact CG-CG1 4.29Å; L118-V178 HydrophobicContact CG-CG2 4.43Å; V121-V178 HydrophobicContact CB-CG1 4.35Å; V121-V178 HydrophobicContact CG1-CG1 3.68Å; V122-V178 HydrophobicContact CG2-CG1 3.84Å; V122-V178 HydrophobicContact CG2-CG2 4.48Å; V141-V178 HydrophobicContact CG2-CG2 4.04Å; P175-V178 WeakPolarHBondContact O-CB 3.28Å; P175-V178 PolarHBondContact O-N 3.37Å; Q176-V178 VanDerWaalsContact C-N 3.35Å; Q176-V178 PolarHBondContact O-N 3.46Å; V178-A182 VanDerWaalsContact O-CB 3.31Å; V178-A182 WeakPolarHBondContact O-CB 3.29Å; V178-A182 PolarHBondContact O-N 3.3Å; V178-A182 VanDerWaalsContact O-N 3.13Å
179	I	88.9	Confident	89.9	Confident	71 Å²	71	46.1 Å²	46.1	36%	0.364	25%	0.247	S	C	.	.	H	α-helix	trans	-69.7	-46.1	179.7	-62.1	170.8	0	0	0	110.6	P175 Q176 W177 A182 L183	P175-I179 PolarHBondContact O-N 3.11Å; Q176-I179 CarbonylContact O-C 3.56Å; Q176-I179 PolarHBondContact O-N 2.96Å; Q176-I179 VanDerWaalsContact O-N 3.14Å; W177-I179 VanDerWaalsContact C-N 3.28Å; W177-I179 PolarHBondContact O-N 3.38Å; I179-A182 CarbonylContact O-C 3.58Å; I179-A182 WeakPolarHBondContact O-CB 3.12Å; I179-A182 PolarHBondContact O-N 3Å; I179-L183 HydrophobicContact CG2-CD1 3.73Å; I179-L183 HydrophobicContact CG2-CG 4.21Å; I179-L183 WeakPolarHBondContact O-CB 3.49Å; I179-L183 VanDerWaalsContact O-CG 3.31Å; I179-L183 WeakPolarHBondContact O-CG 3.29Å; I179-L183 PolarHBondContact O-N 2.98Å
180	D	89.5	Confident	90.2	Very high	46 Å²	46	44.4 Å²	44.4	25%	0.246	24%	0.236	C	C	.	.	H	α-helix	trans	-73.4	-33.4	-176.8	-69.1	-15.3	0	0	0	112	Q176 W177 L183 S184 Y193	Q176-D180 WeakPolarHBondContact CG-OD2 3.27Å; Q176-D180 PolarHBondContact NE2-OD1 3.47Å; Q176-D180 PolarHBondContact NE2-OD2 2.89Å; Q176-D180 WeakPolarHBondContact O-CB 3.49Å; Q176-D180 PolarHBondContact O-N 3.37Å; W177-D180 PolarHBondContact O-N 3.5Å; D180-L183 PolarHBondContact O-N 3.49Å; D180-S184 VanDerWaalsContact O-CB 3.27Å; D180-S184 WeakPolarHBondContact O-CB 3.35Å; D180-S184 PolarHBondContact O-N 3.3Å; D180-S184 PolarHBondContact O-OG 2.95Å; D180-Y193 HydrophobicContact CB-CE1 4.45Å; D180-Y193 WeakPolarHBondContact OD2-CE1 3.36Å; D180-Y193 PolarHBondContact OD2-OH 2.94Å
181	C	90.9	Very high	90.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59	-45.8	166	-72.2	0	0	0	0	111.7	L99 F100 W177 S184 G185 E186 A188	L99-C181 WeakPolarHBondContact CD1-O 3.44Å; F100-C181 HydrophobicContact CE1-CB 3.78Å; F100-C181 HydrophobicContact CZ-CB 3.65Å; W177-C181 WeakPolarHBondContact O-CB 3.35Å; W177-C181 PolarHBondContact O-N 3.32Å; W177-C181 PolarHBondContact O-SG 3.04Å; C181-S184 PolarHBondContact O-OG 3.4Å; C181-G185 PolarHBondContact O-N 3.09Å; C181-E186 VanDerWaalsContact CA-O 3.28Å; C181-E186 WeakPolarHBondContact CA-O 3.49Å; C181-A188 PolarHBondContact SG-N 2.91Å
182	A	86	Confident	90	Very high	6 Å²	6	48.3 Å²	48.3	5%	0.05	27%	0.266	C	S	.	.	H	α-helix	trans	-66	-38.3	178.1	0	0	0	0	0	113.7	G89 L91 V121 L125 V178 I179	G89-A182 VanDerWaalsContact CA-O 3.24Å; G89-A182 WeakPolarHBondContact CA-O 3.32Å; L91-A182 HydrophobicContact CD1-CB 4.09Å; L91-A182 HydrophobicContact CD2-CB 3.76Å; L91-A182 HydrophobicContact CG-CB 4.09Å; V121-A182 HydrophobicContact CG1-CB 3.87Å; L125-A182 HydrophobicContact CD1-CB 4.03Å; V178-A182 VanDerWaalsContact O-CB 3.31Å; V178-A182 WeakPolarHBondContact O-CB 3.29Å; V178-A182 PolarHBondContact O-N 3.3Å; V178-A182 VanDerWaalsContact O-N 3.13Å; I179-A182 CarbonylContact O-C 3.58Å; I179-A182 WeakPolarHBondContact O-CB 3.12Å; I179-A182 PolarHBondContact O-N 3Å
183	L	83.6	Confident	89.9	Confident	96 Å²	96	49 Å²	49	50%	0.503	27%	0.267	S	S	.	.	H	α-helix	trans	-77.6	-39.4	-178.4	-71.4	177	0	0	0	112.9	G89 I179 D180	G89-L183 VanDerWaalsContact CA-O 3.26Å; G89-L183 WeakPolarHBondContact CA-O 3.35Å; G89-L183 PolarHBondContact N-O 3.03Å; I179-L183 HydrophobicContact CG2-CD1 3.73Å; I179-L183 HydrophobicContact CG2-CG 4.21Å; I179-L183 WeakPolarHBondContact O-CB 3.49Å; I179-L183 VanDerWaalsContact O-CG 3.31Å; I179-L183 WeakPolarHBondContact O-CG 3.29Å; I179-L183 PolarHBondContact O-N 2.98Å; D180-L183 PolarHBondContact O-N 3.49Å
184	S	84	Confident	89.6	Confident	74 Å²	74	50.1 Å²	50.1	52%	0.517	27%	0.273	S	S	.	.	H	α-helix	trans	-75	-31.2	175.8	60.5	0	0	0	0	113	D180 C181 E186	D180-S184 VanDerWaalsContact O-CB 3.27Å; D180-S184 WeakPolarHBondContact O-CB 3.35Å; D180-S184 PolarHBondContact O-N 3.3Å; D180-S184 PolarHBondContact O-OG 2.95Å; C181-S184 PolarHBondContact O-OG 3.4Å; S184-E186 VanDerWaalsContact C-N 3.28Å; S184-E186 PolarHBondContact OG-N 3.32Å; S184-E186 PolarHBondContact OG-O 3.07Å
185	G	84.8	Confident	89.2	Confident	21 Å²	21	49.2 Å²	49.2	22%	0.216	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	23.3	-169.1	0	0	0	0	0	112.8	K97 C181	K97-G185 WeakPolarHBondContact CD-O 3.43Å; K97-G185 WeakPolarHBondContact CE-O 3.39Å; K97-G185 PolarHBondContact NZ-O 3.44Å; C181-G185 PolarHBondContact O-N 3.09Å
186	E	88.2	Confident	88.7	Confident	128 Å²	128	54.5 Å²	54.5	60%	0.598	29%	0.285	S	S	*	.	S	Bend	trans	-139.3	164.9	178.1	-57.9	-159.5	139.9	0	0	110.6	K97 C181 S184 A188	K97-E186 IonicContact NZ-OE1 3.73Å; C181-E186 VanDerWaalsContact CA-O 3.28Å; C181-E186 WeakPolarHBondContact CA-O 3.49Å; S184-E186 VanDerWaalsContact C-N 3.28Å; S184-E186 PolarHBondContact OG-N 3.32Å; S184-E186 PolarHBondContact OG-O 3.07Å; E186-A188 PolarHBondContact O-N 2.99Å
187	M	92.3	Very high	88.1	Confident	84 Å²	84	55.8 Å²	55.8	41%	0.414	29%	0.294	S	S	.	.			trans	-81.3	116.1	177.1	-77	-65	-66.5	0	0	110.6	L99 F100 L103 W177	L99-M187 HydrophobicContact CB-SD 4.1Å; F100-M187 HydrophobicContact CD1-SD 3.77Å; F100-M187 HydrophobicContact CE1-SD 3.76Å; L103-M187 HydrophobicContact CD1-CE 3.84Å; W177-M187 HydrophobicContact CH2-CE 4.33Å; W177-M187 HydrophobicContact CZ2-CE 3.68Å
188	A	92.2	Very high	87	Confident	18 Å²	18	60.8 Å²	60.8	15%	0.149	32%	0.316	C	S	.	.			trans	-80.7	137.5	175.6	0	0	0	0	0	111.4	W177 C181 E186 E190 Y193	W177-A188 PolarHBondContact NE1-O 3.3Å; C181-A188 PolarHBondContact SG-N 2.91Å; E186-A188 PolarHBondContact O-N 2.99Å; A188-E190 PolarHBondContact O-N 3.47Å; A188-Y193 HydrophobicContact CB-CE2 3.76Å
189	D	92.5	Very high	85.4	Confident	71 Å²	71	62.2 Å²	62.2	38%	0.38	33%	0.325	S	S	.	.			trans	-55.8	112.4	176.6	165.6	14.1	0	0	0	112.1	A191 K192 Y193	D189-A191 PolarHBondContact O-N 2.96Å; D189-A191 WeakPolarHBondContact OD1-CB 3.49Å; D189-A191 PolarHBondContact OD1-N 3.4Å; D189-A191 VanDerWaalsContact OD1-N 3.09Å; D189-K192 HydrophobicContact CB-CD 4.38Å; D189-K192 PolarHBondContact O-N 3.02Å; D189-K192 WeakPolarHBondContact OD2-CE 3.46Å; D189-K192 IonicContact OD2-NZ 3Å; D189-K192 PolarHBondContact OD2-NZ 2.84Å; D189-Y193 WeakPolarHBondContact O-CD2 3.3Å; D189-Y193 WeakPolarHBondContact O-CE2 3.25Å
190	E	92.7	Very high	83.5	Confident	61 Å²	61	66.1 Å²	66.1	29%	0.285	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-59.8	-31	-172.7	-60.1	79.5	-177.8	0	0	112.6	H139 K171 V173 W177 A188 K192 Y193	H139-E190 IonicContact NE2-OE1 3.36Å; K171-E190 HydrophobicContact CB-CB 4.48Å; K171-E190 HydrophobicContact CB-CG 4.44Å; K171-E190 HydrophobicContact CG-CG 4.47Å; V173-E190 HydrophobicContact CG1-CB 3.95Å; V173-E190 HydrophobicContact CG1-CG 4.42Å; W177-E190 HydrophobicContact CZ2-CG 4.05Å; A188-E190 PolarHBondContact O-N 3.47Å; E190-K192 PolarHBondContact O-N 3.06Å; E190-Y193 PolarHBondContact O-N 3.27Å
191	A	88.8	Confident	81.4	Confident	70 Å²	70	71.8 Å²	71.8	58%	0.579	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-64.6	-25	-174.9	0	0	0	0	0	112.7	D189 Y193 L197	D189-A191 PolarHBondContact O-N 2.96Å; D189-A191 WeakPolarHBondContact OD1-CB 3.49Å; D189-A191 PolarHBondContact OD1-N 3.4Å; D189-A191 VanDerWaalsContact OD1-N 3.09Å; A191-Y193 VanDerWaalsContact C-N 3.26Å; A191-Y193 PolarHBondContact O-N 3.16Å; A191-L197 WeakPolarHBondContact O-CD1 3.42Å
192	K	89.8	Confident	79	Confident	126 Å²	126	78 Å²	78	55%	0.548	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-74.4	-14.9	176.3	-63.7	-179.6	176.1	97	0	113.6	D189 E190	D189-K192 HydrophobicContact CB-CD 4.38Å; D189-K192 PolarHBondContact O-N 3.02Å; D189-K192 WeakPolarHBondContact OD2-CE 3.46Å; D189-K192 IonicContact OD2-NZ 3Å; D189-K192 PolarHBondContact OD2-NZ 2.84Å; E190-K192 PolarHBondContact O-N 3.06Å
193	Y	90.8	Very high	76.9	Confident	35 Å²	35	82.6 Å²	82.6	14%	0.137	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-112.4	11.2	-173.5	-58	-88	0	0	0	113	V173 I174 Q176 W177 D180 A188 D189 E190 A191	V173-Y193 CarbonylContact C-O 3.54Å; V173-Y193 VanDerWaalsContact CA-O 3.28Å; V173-Y193 WeakPolarHBondContact CA-O 3.44Å; I174-Y193 HydrophobicContact CD1-CD1 4.5Å; I174-Y193 HydrophobicContact CG1-CD1 4.19Å; I174-Y193 PolarHBondContact N-O 3.41Å; Q176-Y193 HydrophobicContact CB-CD1 4.29Å; Q176-Y193 HydrophobicContact CB-CE1 4.47Å; Q176-Y193 HydrophobicContact CG-CE1 4.29Å; W177-Y193 HydrophobicContact CB-CD1 3.93Å; W177-Y193 HydrophobicContact CB-CD2 3.98Å; W177-Y193 HydrophobicContact CB-CG 3.61Å; W177-Y193 AromaticContact CD1-CD2 3.5Å; W177-Y193 AromaticContact CD1-CE2 3.86Å; W177-Y193 HydrophobicContact CG-CD2 4.12Å; W177-Y193 HydrophobicContact CG-CG 4.23Å; D180-Y193 HydrophobicContact CB-CE1 4.45Å; D180-Y193 WeakPolarHBondContact OD2-CE1 3.36Å; D180-Y193 PolarHBondContact OD2-OH 2.94Å; A188-Y193 HydrophobicContact CB-CE2 3.76Å; D189-Y193 WeakPolarHBondContact O-CD2 3.3Å; D189-Y193 WeakPolarHBondContact O-CE2 3.25Å; E190-Y193 PolarHBondContact O-N 3.27Å; A191-Y193 VanDerWaalsContact C-N 3.26Å; A191-Y193 PolarHBondContact O-N 3.16Å
194	D	86.1	Confident	75.1	Confident	25 Å²	25	82.8 Å²	82.8	13%	0.134	42%	0.424	C	S	.	.			trans	-57.9	125	175.2	-172	-49.8	0	0	0	110.5	R196 L197 F198	D194-R196 VanDerWaalsContact CG-NE 3.33Å; D194-R196 PolarHBondContact O-N 3.21Å; D194-R196 WeakPolarHBondContact OD1-CB 3.44Å; D194-R196 WeakPolarHBondContact OD1-CG 3.27Å; D194-R196 IonicContact OD1-CZ 3.2Å; D194-R196 PolarHBondContact OD1-N 2.97Å; D194-R196 IonicContact OD1-NE 2.97Å; D194-R196 PolarHBondContact OD1-NE 2.89Å; D194-R196 IonicContact OD2-CZ 3.96Å; D194-R196 IonicContact OD2-NE 3.97Å; D194-R196 PolarHBondContact OD2-NE 2.94Å; D194-R196 IonicContact OD2-NH2 2.75Å; D194-R196 PolarHBondContact OD2-NH2 3.08Å; D194-L197 HydrophobicContact CB-CD1 4.35Å; D194-L197 HydrophobicContact CB-CG 4.32Å; D194-L197 WeakPolarHBondContact O-CB 3.44Å; D194-L197 PolarHBondContact O-N 3.28Å; D194-F198 WeakPolarHBondContact O-CD2 3.38Å
195	P	84.6	Confident	73.2	Confident	0 Å²	0	83.7 Å²	83.7	0%	0	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-18.3	-178.4	-26.1	34.6	0	0	0	115	C142 L145 I172 I174 T199	C142-P195 WeakPolarHBondContact O-CG 3.27Å; L145-P195 HydrophobicContact CD2-CB 4.25Å; I172-P195 HydrophobicContact CG2-CG 3.91Å; I174-P195 HydrophobicContact CG2-CB 3.95Å; I174-P195 HydrophobicContact CG2-CG 3.82Å; P195-T199 PolarHBondContact O-OG1 3Å
196	R	79.7	Confident	71.5	Confident	135 Å²	135	89.3 Å²	89.3	51%	0.509	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-43.9	172.2	-65.9	177.4	-85.3	-168.9	-2.1	112.3	L145 D194 F198 T199	L145-R196 HydrophobicContact CD1-CB 4.35Å; L145-R196 HydrophobicContact CD1-CG 3.92Å; L145-R196 HydrophobicContact CD2-CG 3.72Å; L145-R196 HydrophobicContact CG-CG 4.3Å; D194-R196 VanDerWaalsContact CG-NE 3.33Å; D194-R196 PolarHBondContact O-N 3.21Å; D194-R196 WeakPolarHBondContact OD1-CB 3.44Å; D194-R196 WeakPolarHBondContact OD1-CG 3.27Å; D194-R196 IonicContact OD1-CZ 3.2Å; D194-R196 PolarHBondContact OD1-N 2.97Å; D194-R196 IonicContact OD1-NE 2.97Å; D194-R196 PolarHBondContact OD1-NE 2.89Å; D194-R196 IonicContact OD2-CZ 3.96Å; D194-R196 IonicContact OD2-NE 3.97Å; D194-R196 PolarHBondContact OD2-NE 2.94Å; D194-R196 IonicContact OD2-NH2 2.75Å; D194-R196 PolarHBondContact OD2-NH2 3.08Å; R196-F198 PolarHBondContact O-N 3.45Å; R196-T199 PolarHBondContact O-N 2.97Å
197	L	78.1	Confident	69.6	Low	104 Å²	104	89.6 Å²	89.6	55%	0.545	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-30.9	-175.8	-59.6	176	0	0	0	112.5	A191 D194	A191-L197 WeakPolarHBondContact O-CD1 3.42Å; D194-L197 HydrophobicContact CB-CD1 4.35Å; D194-L197 HydrophobicContact CB-CG 4.32Å; D194-L197 WeakPolarHBondContact O-CB 3.44Å; D194-L197 PolarHBondContact O-N 3.28Å
198	F	70.7	Confident	67.7	Low	104 Å²	104	93.7 Å²	93.7	46%	0.456	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-0.9	-178.6	-55.8	-88.3	0	0	0	113.5	I174 D194 R196	I174-F198 HydrophobicContact CD1-CD1 4.05Å; I174-F198 HydrophobicContact CD1-CD2 3.77Å; I174-F198 HydrophobicContact CD1-CE1 3.8Å; I174-F198 HydrophobicContact CD1-CE2 3.54Å; I174-F198 HydrophobicContact CD1-CG 4.05Å; I174-F198 HydrophobicContact CD1-CZ 3.55Å; I174-F198 HydrophobicContact CG1-CD2 4.28Å; I174-F198 HydrophobicContact CG1-CE2 3.99Å; I174-F198 HydrophobicContact CG1-CZ 4.37Å; I174-F198 HydrophobicContact CG2-CD2 3.93Å; I174-F198 HydrophobicContact CG2-CE2 4.41Å; D194-F198 WeakPolarHBondContact O-CD2 3.38Å; R196-F198 PolarHBondContact O-N 3.45Å
199	T	59.3	Low	66.1	Low	31 Å²	31	97.2 Å²	97.2	19%	0.19	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-25.3	-177.9	-55	0	0	0	0	113.1	L145 P195 R196 E201 Q202 N203	L145-T199 HydrophobicContact CB-CG2 4.17Å; L145-T199 HydrophobicContact CD1-CG2 3.99Å; L145-T199 HydrophobicContact CG-CG2 4.26Å; L145-T199 WeakPolarHBondContact CG-OG1 3.29Å; P195-T199 PolarHBondContact O-OG1 3Å; R196-T199 PolarHBondContact O-N 2.97Å; T199-E201 PolarHBondContact O-N 3.14Å; T199-Q202 PolarHBondContact O-N 3.34Å; T199-N203 PolarHBondContact O-ND2 3.12Å
200	E	49.5	Very low	64.9	Low	154 Å²	154	98 Å²	98	72%	0.72	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-28.7	-172.8	-64.7	-163.9	165.4	0	0	113.7
201	E	44.2	Very low	63.7	Low	164 Å²	164	99.5 Å²	99.5	77%	0.766	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-36.2	176.7	-62.4	-166.4	144.1	0	0	113.1	T199 N203 V204	T199-E201 PolarHBondContact O-N 3.14Å; E201-N203 VanDerWaalsContact C-N 3.26Å; E201-N203 PolarHBondContact O-N 3.36Å; E201-V204 PolarHBondContact O-N 3.01Å
202	Q	41.3	Very low	62.8	Low	132 Å²	132	98.1 Å²	98.1	62%	0.617	48%	0.479	S	S	*	.	H	α-helix	trans	-69	-19.9	-176.4	-70.5	-169.3	-25.8	0	0	114.1	T199 V204 D205 E206	T199-Q202 PolarHBondContact O-N 3.34Å; Q202-V204 VanDerWaalsContact C-N 3.26Å; Q202-V204 PolarHBondContact O-N 3.02Å; Q202-D205 PolarHBondContact O-N 3.5Å; Q202-E206 PolarHBondContact O-N 3.01Å
203	N	42.3	Very low	62	Low	101 Å²	101	94.2 Å²	94.2	54%	0.54	47%	0.469	S	S	.	.	H	α-helix	trans	-67.1	-28.2	177.9	-78.4	-95.6	0	0	0	112.3	T199 E201 E207	T199-N203 PolarHBondContact O-ND2 3.12Å; E201-N203 VanDerWaalsContact C-N 3.26Å; E201-N203 PolarHBondContact O-N 3.36Å; N203-E207 VanDerWaalsContact O-CB 3.29Å; N203-E207 WeakPolarHBondContact O-CB 3.49Å; N203-E207 PolarHBondContact O-N 3.19Å; N203-E207 VanDerWaalsContact O-N 3.12Å
204	V	45.2	Very low	61.1	Low	101 Å²	101	96.7 Å²	96.7	61%	0.612	48%	0.482	S	S	*	.	H	α-helix	trans	-72.4	-38.8	179.2	-170.5	0	0	0	0	111.1	E201 Q202 R208	E201-V204 PolarHBondContact O-N 3.01Å; Q202-V204 VanDerWaalsContact C-N 3.26Å; Q202-V204 PolarHBondContact O-N 3.02Å; V204-R208 VanDerWaalsContact O-CB 3.28Å; V204-R208 WeakPolarHBondContact O-CB 3.49Å; V204-R208 PolarHBondContact O-N 2.93Å
205	D	44.5	Very low	60.6	Low	93 Å²	93	98.3 Å²	98.3	50%	0.497	50%	0.499	S	S	.	.	H	α-helix	trans	-84.7	-33.7	179.6	-76.9	-38.5	0	0	0	113.1	Q202 R208 D209	Q202-D205 PolarHBondContact O-N 3.5Å; D205-R208 WeakPolarHBondContact O-CB 3.5Å; D205-R208 PolarHBondContact O-N 3.33Å; D205-R208 IonicContact OD1-NH1 3.99Å; D205-D209 WeakPolarHBondContact O-CB 3.21Å; D205-D209 PolarHBondContact O-N 2.85Å
206	E	48	Very low	60.2	Low	139 Å²	139	103.4 Å²	103.4	65%	0.65	53%	0.525	S	S	*	.	H	α-helix	trans	-68.8	-36.2	171.3	-74.5	-153	157.5	0	0	112.5	Q202 R208 T210	Q202-E206 PolarHBondContact O-N 3.01Å; E206-R208 VanDerWaalsContact C-N 3.29Å; E206-R208 PolarHBondContact O-N 2.96Å; E206-T210 WeakPolarHBondContact O-CB 3.35Å; E206-T210 WeakPolarHBondContact O-CG2 3.44Å; E206-T210 PolarHBondContact O-N 3.49Å; E206-T210 PolarHBondContact O-OG1 2.95Å
207	E	49.5	Very low	60	Low	133 Å²	133	103.5 Å²	103.5	62%	0.621	53%	0.531	S	S	*	.	H	α-helix	trans	-65.6	-35.2	170.9	-176.2	165.4	-153.9	0	0	111	N203 T210 N211	N203-E207 VanDerWaalsContact O-CB 3.29Å; N203-E207 WeakPolarHBondContact O-CB 3.49Å; N203-E207 PolarHBondContact O-N 3.19Å; N203-E207 VanDerWaalsContact O-N 3.12Å; E207-T210 WeakPolarHBondContact CA-OG1 3.39Å; E207-T210 PolarHBondContact O-OG1 3.49Å; E207-N211 WeakPolarHBondContact CG-ND2 3.5Å; E207-N211 VanDerWaalsContact O-CB 3.29Å; E207-N211 WeakPolarHBondContact O-CB 3.11Å; E207-N211 PolarHBondContact O-N 3.41Å; E207-N211 PolarHBondContact O-ND2 2.89Å
208	R	52.8	Low	59.9	Low	171 Å²	171	102.7 Å²	102.7	65%	0.645	53%	0.528	S	S	*	.	H	α-helix	trans	-69.5	-44.6	175.9	-174	179.9	-176.7	-177.4	0.7	112.9	V204 D205 E206 N211 A212	V204-R208 VanDerWaalsContact O-CB 3.28Å; V204-R208 WeakPolarHBondContact O-CB 3.49Å; V204-R208 PolarHBondContact O-N 2.93Å; D205-R208 WeakPolarHBondContact O-CB 3.5Å; D205-R208 PolarHBondContact O-N 3.33Å; D205-R208 IonicContact OD1-NH1 3.99Å; E206-R208 VanDerWaalsContact C-N 3.29Å; E206-R208 PolarHBondContact O-N 2.96Å; R208-N211 PolarHBondContact O-N 3.37Å; R208-A212 VanDerWaalsContact O-CB 3.26Å; R208-A212 WeakPolarHBondContact O-CB 3.44Å; R208-A212 PolarHBondContact O-N 3.49Å
209	D	57.1	Low	60.2	Low	92 Å²	92	103.1 Å²	103.1	49%	0.492	53%	0.534	S	S	.	.	H	α-helix	trans	-70.3	-34.2	178.4	-98	15.2	0	0	0	111.7	D205 A212 A213	D205-D209 WeakPolarHBondContact O-CB 3.21Å; D205-D209 PolarHBondContact O-N 2.85Å; D209-A212 PolarHBondContact O-N 2.97Å; D209-A213 VanDerWaalsContact O-CB 3.23Å; D209-A213 WeakPolarHBondContact O-CB 3.4Å; D209-A213 PolarHBondContact O-N 3.43Å
210	T	67.4	Low	61.1	Low	87 Å²	87	105.9 Å²	105.9	53%	0.534	55%	0.551	S	S	.	*	H	α-helix	trans	-71.7	-41.1	172.6	50.8	0	0	0	0	112.3	E206 E207 A212 A213 E214	E206-T210 WeakPolarHBondContact O-CB 3.35Å; E206-T210 WeakPolarHBondContact O-CG2 3.44Å; E206-T210 PolarHBondContact O-N 3.49Å; E206-T210 PolarHBondContact O-OG1 2.95Å; E207-T210 WeakPolarHBondContact CA-OG1 3.39Å; E207-T210 PolarHBondContact O-OG1 3.49Å; T210-A212 VanDerWaalsContact C-N 3.32Å; T210-A212 PolarHBondContact O-N 3.27Å; T210-A213 PolarHBondContact O-N 3.45Å; T210-E214 PolarHBondContact O-N 3.01Å
211	N	67.5	Low	62.4	Low	93 Å²	93	100.7 Å²	100.7	50%	0.497	53%	0.534	S	S	.	.	H	α-helix	trans	-62.8	-38	170.3	-84.6	-76.2	0	0	0	111.8	E207 R208 A215	E207-N211 WeakPolarHBondContact CG-ND2 3.5Å; E207-N211 VanDerWaalsContact O-CB 3.29Å; E207-N211 WeakPolarHBondContact O-CB 3.11Å; E207-N211 PolarHBondContact O-N 3.41Å; E207-N211 PolarHBondContact O-ND2 2.89Å; R208-N211 PolarHBondContact O-N 3.37Å; N211-A215 WeakPolarHBondContact O-CB 3.37Å; N211-A215 PolarHBondContact O-N 3.22Å
212	A	70.6	Confident	64	Low	41 Å²	41	96.4 Å²	96.4	34%	0.339	52%	0.519	S	S	.	.	H	α-helix	trans	-66.7	-40	174.1	0	0	0	0	0	111.7	R208 D209 T210 A215 I216	R208-A212 VanDerWaalsContact O-CB 3.26Å; R208-A212 WeakPolarHBondContact O-CB 3.44Å; R208-A212 PolarHBondContact O-N 3.49Å; D209-A212 PolarHBondContact O-N 2.97Å; T210-A212 VanDerWaalsContact C-N 3.32Å; T210-A212 PolarHBondContact O-N 3.27Å; A212-A215 PolarHBondContact O-N 2.94Å; A212-I216 WeakPolarHBondContact O-CB 3.35Å; A212-I216 WeakPolarHBondContact O-CD1 3.31Å; A212-I216 WeakPolarHBondContact O-CG1 3.25Å; A212-I216 PolarHBondContact O-N 3.36Å
213	A	72	Confident	65.7	Low	43 Å²	43	94.5 Å²	94.5	36%	0.355	51%	0.513	S	S	.	.	H	α-helix	trans	-68.6	-40.6	176	0	0	0	0	0	112.5	D209 T210 I216 Q217	D209-A213 VanDerWaalsContact O-CB 3.23Å; D209-A213 WeakPolarHBondContact O-CB 3.4Å; D209-A213 PolarHBondContact O-N 3.43Å; T210-A213 PolarHBondContact O-N 3.45Å; A213-I216 PolarHBondContact O-N 3.44Å; A213-Q217 WeakPolarHBondContact O-CB 3.5Å; A213-Q217 VanDerWaalsContact O-CG 3.28Å; A213-Q217 WeakPolarHBondContact O-CG 3.37Å; A213-Q217 PolarHBondContact O-N 3Å
214	E	73.4	Confident	67.4	Low	88 Å²	88	96.2 Å²	96.2	41%	0.411	52%	0.515	S	S	.	.	H	α-helix	trans	-67.6	-38.4	172.6	-169.5	172.4	179.7	0	0	110.5	T210 Q217 N218 R594	T210-E214 PolarHBondContact O-N 3.01Å; E214-Q217 PolarHBondContact O-N 3.45Å; E214-N218 VanDerWaalsContact O-CB 3.27Å; E214-N218 WeakPolarHBondContact O-CB 3.49Å; E214-N218 PolarHBondContact O-N 2.91Å; E214-N218 PolarHBondContact O-ND2 3.07Å; E214-R594 IonicContact OE1-NH1 3.05Å; E214-R594 IonicContact OE1-NH2 3.94Å
215	A	74.1	Confident	68.9	Low	58 Å²	58	96.3 Å²	96.3	48%	0.479	51%	0.512	S	S	.	.	H	α-helix	trans	-62.9	-42.1	172.5	0	0	0	0	0	112.5	N211 A212 N218 L219	N211-A215 WeakPolarHBondContact O-CB 3.37Å; N211-A215 PolarHBondContact O-N 3.22Å; A212-A215 PolarHBondContact O-N 2.94Å; A215-N218 PolarHBondContact O-N 3.09Å; A215-L219 WeakPolarHBondContact O-CB 3.34Å; A215-L219 PolarHBondContact O-N 3.32Å
216	I	77.9	Confident	70.2	Confident	108 Å²	108	96.7 Å²	96.7	55%	0.554	51%	0.511	S	S	*	.	H	α-helix	trans	-66.2	-43.7	174.7	-73.2	161.1	0	0	0	110.8	A212 A213 N218 L219 V220	A212-I216 WeakPolarHBondContact O-CB 3.35Å; A212-I216 WeakPolarHBondContact O-CD1 3.31Å; A212-I216 WeakPolarHBondContact O-CG1 3.25Å; A212-I216 PolarHBondContact O-N 3.36Å; A213-I216 PolarHBondContact O-N 3.44Å; I216-N218 VanDerWaalsContact C-N 3.34Å; I216-N218 PolarHBondContact O-N 3.46Å; I216-L219 PolarHBondContact O-N 3.01Å; I216-V220 HydrophobicContact CG2-CG2 4.4Å; I216-V220 WeakPolarHBondContact O-CB 3.28Å; I216-V220 VanDerWaalsContact O-CG2 3.27Å; I216-V220 WeakPolarHBondContact O-CG2 3.31Å; I216-V220 PolarHBondContact O-N 3.28Å
217	Q	75.6	Confident	71.5	Confident	136 Å²	136	92.6 Å²	92.6	64%	0.636	50%	0.501	S	S	*	.	H	α-helix	trans	-62.7	-40.9	175.7	-75.7	179.4	29.3	0	0	111.8	A213 E214 V220 A221	A213-Q217 WeakPolarHBondContact O-CB 3.5Å; A213-Q217 VanDerWaalsContact O-CG 3.28Å; A213-Q217 WeakPolarHBondContact O-CG 3.37Å; A213-Q217 PolarHBondContact O-N 3Å; E214-Q217 PolarHBondContact O-N 3.45Å; Q217-V220 PolarHBondContact O-N 3.19Å; Q217-A221 WeakPolarHBondContact O-CB 3.43Å; Q217-A221 PolarHBondContact O-N 2.65Å
218	N	74.2	Confident	72.5	Confident	88 Å²	88	91.6 Å²	91.6	47%	0.471	50%	0.496	S	S	.	.	H	α-helix	trans	-65.1	-43.5	174	-74.6	-36.7	0	0	0	111.5	E214 A215 I216 V220 A221 T222	E214-N218 VanDerWaalsContact O-CB 3.27Å; E214-N218 WeakPolarHBondContact O-CB 3.49Å; E214-N218 PolarHBondContact O-N 2.91Å; E214-N218 PolarHBondContact O-ND2 3.07Å; A215-N218 PolarHBondContact O-N 3.09Å; I216-N218 VanDerWaalsContact C-N 3.34Å; I216-N218 PolarHBondContact O-N 3.46Å; N218-V220 PolarHBondContact O-N 3.25Å; N218-A221 WeakPolarHBondContact O-CB 3.48Å; N218-A221 PolarHBondContact O-N 2.78Å; N218-A221 VanDerWaalsContact O-N 3.17Å; N218-T222 PolarHBondContact O-N 2.72Å; N218-T222 PolarHBondContact O-OG1 3.09Å
219	L	77.1	Confident	73.4	Confident	113 Å²	113	89 Å²	89	59%	0.592	49%	0.492	S	S	*	.	H	α-helix	trans	-63.4	-41.5	176.4	-155.2	82.7	0	0	0	111.5	A215 I216 A221 T222 L223	A215-L219 WeakPolarHBondContact O-CB 3.34Å; A215-L219 PolarHBondContact O-N 3.32Å; I216-L219 PolarHBondContact O-N 3.01Å; L219-A221 VanDerWaalsContact C-N 3.34Å; L219-T222 PolarHBondContact O-N 2.66Å; L219-L223 HydrophobicContact CD2-CD1 4.36Å; L219-L223 HydrophobicContact CG-CD1 4.26Å; L219-L223 WeakPolarHBondContact O-CB 3.25Å; L219-L223 VanDerWaalsContact O-CG 3.26Å; L219-L223 WeakPolarHBondContact O-CG 3.42Å; L219-L223 PolarHBondContact O-N 3.2Å
220	V	79.1	Confident	73.9	Confident	88 Å²	88	90.4 Å²	90.4	53%	0.533	50%	0.498	S	S	.	.	H	α-helix	trans	-64.5	-37.3	173.6	168	0	0	0	0	111.3	I216 Q217 N218 K224	I216-V220 HydrophobicContact CG2-CG2 4.4Å; I216-V220 WeakPolarHBondContact O-CB 3.28Å; I216-V220 VanDerWaalsContact O-CG2 3.27Å; I216-V220 WeakPolarHBondContact O-CG2 3.31Å; I216-V220 PolarHBondContact O-N 3.28Å; Q217-V220 PolarHBondContact O-N 3.19Å; N218-V220 PolarHBondContact O-N 3.25Å; V220-K224 WeakPolarHBondContact O-CB 3.23Å; V220-K224 PolarHBondContact O-N 3.44Å
221	A	76.9	Confident	74	Confident	46 Å²	46	91.2 Å²	91.2	38%	0.38	50%	0.499	S	S	.	.	H	α-helix	trans	-68	-43	174.7	0	0	0	0	0	112.2	Q217 N218 L219 K224 L225	Q217-A221 WeakPolarHBondContact O-CB 3.43Å; Q217-A221 PolarHBondContact O-N 2.65Å; N218-A221 WeakPolarHBondContact O-CB 3.48Å; N218-A221 PolarHBondContact O-N 2.78Å; N218-A221 VanDerWaalsContact O-N 3.17Å; L219-A221 VanDerWaalsContact C-N 3.34Å; A221-K224 PolarHBondContact O-N 3.22Å; A221-L225 WeakPolarHBondContact O-CB 3.36Å; A221-L225 PolarHBondContact O-N 3.09Å
222	T	78.3	Confident	74	Confident	73 Å²	73	93.4 Å²	93.4	45%	0.448	51%	0.506	S	S	.	.	H	α-helix	trans	-62.6	-50.5	174.2	-61.9	0	0	0	0	111.2	N218 L219 K224 L225 E226	N218-T222 PolarHBondContact O-N 2.72Å; N218-T222 PolarHBondContact O-OG1 3.09Å; L219-T222 PolarHBondContact O-N 2.66Å; T222-K224 PolarHBondContact O-N 3.17Å; T222-L225 CarbonylContact O-C 3.57Å; T222-L225 WeakPolarHBondContact O-CA 3.4Å; T222-L225 WeakPolarHBondContact O-CB 3.35Å; T222-L225 PolarHBondContact O-N 3.15Å; T222-E226 PolarHBondContact O-N 2.83Å
223	L	76.9	Confident	73.7	Confident	93 Å²	93	96 Å²	96	49%	0.487	51%	0.512	S	S	.	.	H	α-helix	trans	-62.4	-31.4	177.4	-71.6	168.9	0	0	0	112.1	L219 A227	L219-L223 HydrophobicContact CD2-CD1 4.36Å; L219-L223 HydrophobicContact CG-CD1 4.26Å; L219-L223 WeakPolarHBondContact O-CB 3.25Å; L219-L223 VanDerWaalsContact O-CG 3.26Å; L219-L223 WeakPolarHBondContact O-CG 3.42Å; L219-L223 PolarHBondContact O-N 3.2Å; L223-A227 WeakPolarHBondContact O-CB 3.49Å; L223-A227 PolarHBondContact O-N 3.31Å
224	K	76.9	Confident	73.6	Confident	136 Å²	136	98.3 Å²	98.3	59%	0.591	52%	0.515	S	S	*	.	H	α-helix	trans	-72	-36.4	172.7	-173	172.3	-178.5	179	0	112.5	V220 A221 T222 Q228	V220-K224 WeakPolarHBondContact O-CB 3.23Å; V220-K224 PolarHBondContact O-N 3.44Å; A221-K224 PolarHBondContact O-N 3.22Å; T222-K224 PolarHBondContact O-N 3.17Å; K224-Q228 WeakPolarHBondContact O-CB 3.26Å; K224-Q228 WeakPolarHBondContact O-CG 3.43Å; K224-Q228 PolarHBondContact O-N 2.91Å
225	L	77	Confident	73.3	Confident	103 Å²	103	99.1 Å²	99.1	54%	0.539	52%	0.519	S	S	.	.	H	α-helix	trans	-69.4	-37.3	172.2	-83.8	162.3	0	0	0	112.4	A221 T222 Q228 Q229	A221-L225 WeakPolarHBondContact O-CB 3.36Å; A221-L225 PolarHBondContact O-N 3.09Å; T222-L225 CarbonylContact O-C 3.57Å; T222-L225 WeakPolarHBondContact O-CA 3.4Å; T222-L225 WeakPolarHBondContact O-CB 3.35Å; T222-L225 PolarHBondContact O-N 3.15Å; L225-Q228 PolarHBondContact O-N 3.09Å; L225-Q229 WeakPolarHBondContact O-CB 3.43Å; L225-Q229 WeakPolarHBondContact O-CG 3.26Å; L225-Q229 PolarHBondContact O-N 3.49Å; L225-Q229 PolarHBondContact O-NE2 3.36Å
226	E	72.7	Confident	72.8	Confident	102 Å²	102	100.6 Å²	100.6	48%	0.477	52%	0.521	S	S	.	.	H	α-helix	trans	-67.8	-42.6	171.8	-71.7	-175.7	161.9	0	0	111	T222 Q228 Q229 L230	T222-E226 PolarHBondContact O-N 2.83Å; E226-Q228 VanDerWaalsContact C-N 3.34Å; E226-Q228 PolarHBondContact O-N 3.12Å; E226-Q229 PolarHBondContact O-N 2.94Å; E226-L230 WeakPolarHBondContact O-CB 3.4Å; E226-L230 WeakPolarHBondContact O-CG 3.25Å; E226-L230 PolarHBondContact O-N 2.9Å
227	A	74.4	Confident	72.1	Confident	53 Å²	53	100.9 Å²	100.9	44%	0.438	52%	0.519	S	S	.	.	H	α-helix	trans	-61.4	-39.8	173.2	0	0	0	0	0	112.1	L223 L230 D231	L223-A227 WeakPolarHBondContact O-CB 3.49Å; L223-A227 PolarHBondContact O-N 3.31Å; A227-L230 PolarHBondContact O-N 2.9Å; A227-D231 VanDerWaalsContact O-CB 3.29Å; A227-D231 WeakPolarHBondContact O-CB 3.24Å; A227-D231 PolarHBondContact O-N 3.37Å
228	Q	71.2	Confident	71.2	Confident	112 Å²	112	97 Å²	97	52%	0.523	50%	0.501	S	S	.	.	H	α-helix	trans	-68.6	-37.9	174.2	-76.9	-173	-102.7	0	0	112.7	K224 L225 E226 D231 E232	K224-Q228 WeakPolarHBondContact O-CB 3.26Å; K224-Q228 WeakPolarHBondContact O-CG 3.43Å; K224-Q228 PolarHBondContact O-N 2.91Å; L225-Q228 PolarHBondContact O-N 3.09Å; E226-Q228 VanDerWaalsContact C-N 3.34Å; E226-Q228 PolarHBondContact O-N 3.12Å; Q228-D231 CarbonylContact O-C 3.57Å; Q228-D231 PolarHBondContact O-N 3.04Å; Q228-E232 WeakPolarHBondContact O-CG 3.44Å; Q228-E232 PolarHBondContact O-N 3.32Å
229	Q	72.2	Confident	70.3	Confident	117 Å²	117	96.1 Å²	96.1	55%	0.547	51%	0.506	S	S	.	.	H	α-helix	trans	-69.9	-34.9	173.9	-75.8	166.6	94	0	0	112.3	L225 E226 H233	L225-Q229 WeakPolarHBondContact O-CB 3.43Å; L225-Q229 WeakPolarHBondContact O-CG 3.26Å; L225-Q229 PolarHBondContact O-N 3.49Å; L225-Q229 PolarHBondContact O-NE2 3.36Å; E226-Q229 PolarHBondContact O-N 2.94Å; Q229-H233 VanDerWaalsContact O-CB 3.27Å; Q229-H233 WeakPolarHBondContact O-CB 3.35Å; Q229-H233 PolarHBondContact O-N 3.27Å
230	L	66.7	Low	69	Low	120 Å²	120	100.8 Å²	100.8	63%	0.628	52%	0.517	S	S	*	.	H	α-helix	trans	-66.9	-38.3	171.1	-76.8	168.6	0	0	0	111.1	E226 A227 H233 H234	E226-L230 WeakPolarHBondContact O-CB 3.4Å; E226-L230 WeakPolarHBondContact O-CG 3.25Å; E226-L230 PolarHBondContact O-N 2.9Å; A227-L230 PolarHBondContact O-N 2.9Å; L230-H233 PolarHBondContact O-N 3.32Å; L230-H234 WeakPolarHBondContact O-CB 3.26Å; L230-H234 PolarHBondContact O-N 3.48Å
231	D	70	Confident	67.7	Low	104 Å²	104	102.8 Å²	102.8	56%	0.556	52%	0.52	S	S	*	.	H	α-helix	trans	-71.4	-37.7	174.7	-163.8	49.2	0	0	0	111.7	A227 Q228 H234 Q235	A227-D231 VanDerWaalsContact O-CB 3.29Å; A227-D231 WeakPolarHBondContact O-CB 3.24Å; A227-D231 PolarHBondContact O-N 3.37Å; Q228-D231 CarbonylContact O-C 3.57Å; Q228-D231 PolarHBondContact O-N 3.04Å; D231-H234 CarbonylContact O-C 3.51Å; D231-H234 PolarHBondContact O-N 3.1Å; D231-Q235 WeakPolarHBondContact O-CA 3.4Å; D231-Q235 WeakPolarHBondContact O-CB 3.38Å; D231-Q235 PolarHBondContact O-N 2.77Å
232	E	67.9	Low	66.4	Low	139 Å²	139	105.1 Å²	105.1	65%	0.65	52%	0.523	S	S	*	.	H	α-helix	trans	-65.4	-39.6	170.5	-76.4	-173	147	0	0	111.9	Q228 T236	Q228-E232 WeakPolarHBondContact O-CG 3.44Å; Q228-E232 PolarHBondContact O-N 3.32Å; E232-T236 WeakPolarHBondContact O-CB 3.27Å; E232-T236 PolarHBondContact O-N 3.32Å; E232-T236 PolarHBondContact O-OG1 3.31Å
233	H	63.6	Low	65	Low	97 Å²	97	110.1 Å²	110.1	45%	0.449	54%	0.544	S	S	.	.	H	α-helix	trans	-69.9	-35.4	174.9	-174.1	47.5	0	0	0	112.1	Q229 L230 T236 K237	Q229-H233 VanDerWaalsContact O-CB 3.27Å; Q229-H233 WeakPolarHBondContact O-CB 3.35Å; Q229-H233 PolarHBondContact O-N 3.27Å; L230-H233 PolarHBondContact O-N 3.32Å; H233-T236 PolarHBondContact O-N 2.92Å; H233-K237 VanDerWaalsContact NE2-CE 3.33Å; H233-K237 WeakPolarHBondContact NE2-CE 3.14Å; H233-K237 PolarHBondContact NE2-NZ 3.14Å; H233-K237 PolarHBondContact O-N 2.77Å
234	H	68.9	Low	63.3	Low	91 Å²	91	112.5 Å²	112.5	42%	0.421	56%	0.555	S	S	.	*	H	α-helix	trans	-73.6	-38	174.8	-161.4	72	0	0	0	111.2	L230 D231 T236 K237 Q238	L230-H234 WeakPolarHBondContact O-CB 3.26Å; L230-H234 PolarHBondContact O-N 3.48Å; D231-H234 CarbonylContact O-C 3.51Å; D231-H234 PolarHBondContact O-N 3.1Å; H234-T236 VanDerWaalsContact C-N 3.3Å; H234-T236 PolarHBondContact O-N 2.93Å; H234-K237 CarbonylContact O-C 3.53Å; H234-K237 PolarHBondContact O-N 3.2Å; H234-Q238 PolarHBondContact CD2-NE2 3.05Å; H234-Q238 PolarHBondContact NE2-NE2 3.02Å; H234-Q238 WeakPolarHBondContact O-CA 3.39Å; H234-Q238 WeakPolarHBondContact O-CB 3.5Å; H234-Q238 WeakPolarHBondContact O-CG 3.36Å; H234-Q238 PolarHBondContact O-N 3.4Å
235	Q	67.6	Low	61.4	Low	105 Å²	105	110 Å²	110	49%	0.491	56%	0.555	S	S	.	*	H	α-helix	trans	-65.6	-32.3	171.8	-175.5	67.4	98	0	0	111.2	D231 Q238 A239	D231-Q235 WeakPolarHBondContact O-CA 3.4Å; D231-Q235 WeakPolarHBondContact O-CB 3.38Å; D231-Q235 PolarHBondContact O-N 2.77Å; Q235-Q238 CarbonylContact O-C 3.07Å; Q235-A239 VanDerWaalsContact O-CB 3.25Å; Q235-A239 WeakPolarHBondContact O-CB 3.35Å; Q235-A239 PolarHBondContact O-N 2.8Å
236	T	63.8	Low	60	Low	88 Å²	88	109.9 Å²	109.9	54%	0.54	56%	0.56	S	S	.	*	H	α-helix	trans	-69.3	-43.9	170.5	-59.2	0	0	0	0	111.2	E232 H233 H234 A239 Y240	E232-T236 WeakPolarHBondContact O-CB 3.27Å; E232-T236 PolarHBondContact O-N 3.32Å; E232-T236 PolarHBondContact O-OG1 3.31Å; H233-T236 PolarHBondContact O-N 2.92Å; H234-T236 VanDerWaalsContact C-N 3.3Å; H234-T236 PolarHBondContact O-N 2.93Å; T236-A239 PolarHBondContact O-N 3.24Å; T236-Y240 PolarHBondContact O-N 3.48Å
237	K	62.4	Low	58.3	Low	114 Å²	114	116.2 Å²	116.2	50%	0.496	58%	0.582	S	S	.	*	H	α-helix	trans	-67	-35.1	173	-79.3	169.2	165.9	163.2	0	112.4	H233 H234 Y240 Q241	H233-K237 VanDerWaalsContact NE2-CE 3.33Å; H233-K237 WeakPolarHBondContact NE2-CE 3.14Å; H233-K237 PolarHBondContact NE2-NZ 3.14Å; H233-K237 PolarHBondContact O-N 2.77Å; H234-K237 CarbonylContact O-C 3.53Å; H234-K237 PolarHBondContact O-N 3.2Å; K237-Y240 CarbonylContact O-C 3.56Å; K237-Y240 WeakPolarHBondContact O-CA 3.44Å; K237-Y240 VanDerWaalsContact O-CB 3.22Å; K237-Y240 WeakPolarHBondContact O-CB 3.34Å; K237-Y240 PolarHBondContact O-N 3.11Å; K237-Q241 PolarHBondContact O-N 3.33Å
238	Q	58.4	Low	56.5	Low	55 Å²	55	117.3 Å²	117.3	26%	0.257	60%	0.598	S	S	.	*	H	α-helix	trans	-79.3	-26.3	177.4	-79	-163.3	6.8	0	0	112.4	H234 Q235 Y240 Q241 H242	H234-Q238 PolarHBondContact CD2-NE2 3.05Å; H234-Q238 PolarHBondContact NE2-NE2 3.02Å; H234-Q238 WeakPolarHBondContact O-CA 3.39Å; H234-Q238 WeakPolarHBondContact O-CB 3.5Å; H234-Q238 WeakPolarHBondContact O-CG 3.36Å; H234-Q238 PolarHBondContact O-N 3.4Å; Q235-Q238 CarbonylContact O-C 3.07Å; Q238-Y240 PolarHBondContact O-N 2.92Å; Q238-Q241 CarbonylContact O-C 3.6Å; Q238-Q241 PolarHBondContact O-N 3.32Å; Q238-H242 WeakPolarHBondContact O-CB 3.45Å; Q238-H242 PolarHBondContact O-CD2 2.8Å; Q238-H242 PolarHBondContact O-N 3.05Å; Q238-H242 PolarHBondContact OE1-NE2 3.44Å
239	A	54.3	Low	54.9	Low	70 Å²	70	117.5 Å²	117.5	58%	0.579	61%	0.612	S	S	*	*	H	α-helix	trans	-62.7	-28.7	166.1	0	0	0	0	0	110.9	Q235 T236 Q241	Q235-A239 VanDerWaalsContact O-CB 3.25Å; Q235-A239 WeakPolarHBondContact O-CB 3.35Å; Q235-A239 PolarHBondContact O-N 2.8Å; T236-A239 PolarHBondContact O-N 3.24Å; A239-Q241 VanDerWaalsContact C-N 3.34Å
240	Y	49.4	Very low	53.1	Low	210 Å²	210	114.8 Å²	114.8	82%	0.824	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-7.8	168.9	-108	-87.2	0	0	0	114.8	T236 K237 Q238	T236-Y240 PolarHBondContact O-N 3.48Å; K237-Y240 CarbonylContact O-C 3.56Å; K237-Y240 WeakPolarHBondContact O-CA 3.44Å; K237-Y240 VanDerWaalsContact O-CB 3.22Å; K237-Y240 WeakPolarHBondContact O-CB 3.34Å; K237-Y240 PolarHBondContact O-N 3.11Å; Q238-Y240 PolarHBondContact O-N 2.92Å
241	Q	52.6	Low	51.7	Low	130 Å²	130	119.3 Å²	119.3	61%	0.607	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	-28.5	-172.1	-156.1	152.7	71.6	0	0	113.2	K237 Q238 A239 M243 I244	K237-Q241 PolarHBondContact O-N 3.33Å; Q238-Q241 CarbonylContact O-C 3.6Å; Q238-Q241 PolarHBondContact O-N 3.32Å; A239-Q241 VanDerWaalsContact C-N 3.34Å; Q241-M243 PolarHBondContact O-N 3.27Å; Q241-M243 VanDerWaalsContact O-N 3.15Å; Q241-I244 PolarHBondContact O-N 3.27Å
242	H	50	Low	50	Low	96 Å²	96	120.3 Å²	120.3	44%	0.444	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.5	22.7	175.1	-70.5	-46.1	0	0	0	114.1	Q238 I244	Q238-H242 WeakPolarHBondContact O-CB 3.45Å; Q238-H242 PolarHBondContact O-CD2 2.8Å; Q238-H242 PolarHBondContact O-N 3.05Å; Q238-H242 PolarHBondContact OE1-NE2 3.44Å; H242-I244 PolarHBondContact O-N 3.24Å
243	M	47.9	Very low	48.2	Very low	178 Å²	178	119.6 Å²	119.6	88%	0.877	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	0.7	147.3	-64	-150.7	-57.5	0	0	111.9	Q241	Q241-M243 PolarHBondContact O-N 3.27Å; Q241-M243 VanDerWaalsContact O-N 3.15Å
244	I	42.4	Very low	46.9	Very low	142 Å²	142	120.1 Å²	120.1	73%	0.728	65%	0.652	S	S	*	*	S	Bend	trans	-127	119	173.2	-51.7	176.6	0	0	0	107.5	Q241 H242	Q241-I244 PolarHBondContact O-N 3.27Å; H242-I244 PolarHBondContact O-N 3.24Å
245	S	36.1	Very low	45	Very low	84 Å²	84	120.2 Å²	120.2	59%	0.587	67%	0.669	S	S	*	*			trans	-162.4	173.5	-168.1	-137	0	0	0	0	112.4
246	P	47.3	Very low	43.7	Very low	100 Å²	100	120.3 Å²	120.3	65%	0.649	68%	0.678	S	S	*	*				-140	179.5	-83.7	43.8	-27.5	0	0	0	115.9
247	Y	38.2	Very low	42	Very low	236 Å²	236	124.1 Å²	124.1	93%	0.925	69%	0.692	S	S	*	*			trans	-150.6	155.6	160.5	-56	-79	0	0	0	109.3
248	G	36.3	Very low	40.4	Very low	75 Å²	75	122.4 Å²	122.4	77%	0.773	69%	0.691	S	S	*	*			cis	133.9	134	-8.7	0	0	0	0	0	113.2
249	S	38	Very low	38.9	Very low	117 Å²	117	122.3 Å²	122.3	82%	0.818	70%	0.7	S	S	*	*			cis	-169	154.7	-11.5	-164	0	0	0	0	112.2
250	G	34.2	Very low	37.7	Very low	59 Å²	59	123.3 Å²	123.3	61%	0.608	70%	0.698	S	S	*	*			trans	116.2	176.9	164.3	0	0	0	0	0	116.7
251	Y	37.6	Very low	36.7	Very low	215 Å²	215	117.2 Å²	117.2	84%	0.843	68%	0.683	S	S	*	*			cis	178.5	156	-26.9	-81.7	-35.2	0	0	0	106.5
252	V	34.1	Very low	35.6	Very low	126 Å²	126	117.4 Å²	117.4	76%	0.764	68%	0.684	S	S	*	*			cis	-157	175.5	-6	129.1	0	0	0	0	108.7
253	T	28.9	Very low	34.8	Very low	123 Å²	123	115.8 Å²	115.8	76%	0.755	68%	0.676	S	S	*	*			trans	-96.4	-150.5	-177.8	60.9	0	0	0	0	112.2
254	P	36.4	Very low	34.3	Very low	108 Å²	108	110.9 Å²	110.9	70%	0.701	66%	0.658	S	S	*	*			cis	-141.3	149.2	-23.8	33.6	-12.4	0	0	0	118.3
255	A	29.6	Very low	34	Very low	94 Å²	94	108.3 Å²	108.3	78%	0.777	65%	0.645	S	S	*	*				66.3	-167.2	127.3	0	0	0	0	0	121.8
256	P	40.1	Very low	34.2	Very low	107 Å²	107	107.1 Å²	107.1	70%	0.695	64%	0.637	S	S	*	*				-143.6	-159.9	-109.5	42.6	-19.2	0	0	0	118.1
257	M	28.1	Very low	33.7	Very low	167 Å²	167	107.2 Å²	107.2	82%	0.823	64%	0.638	S	S	*	*			trans	83	158.3	157.7	-62.7	-97.2	177.5	0	0	119.5
258	V	28.3	Very low	33.2	Very low	79 Å²	79	102.7 Å²	102.7	48%	0.479	63%	0.629	S	S	.	*			cis	-175.9	168.3	-42.1	117	0	0	0	0	109.6
259	A	28	Very low	33.2	Very low	53 Å²	53	104.8 Å²	104.8	44%	0.438	62%	0.619	S	S	.	*			trans	75.8	165.9	158.5	0	0	0	0	0	120.1	S364	A259-S364 PolarHBondContact O-OG 2.83Å
260	V	29	Very low	33.1	Very low	90 Å²	90	104.8 Å²	104.8	55%	0.545	62%	0.616	S	S	.	*			cis	-169.9	141.3	-41.6	117.9	0	0	0	0	111.1	F363	V260-F363 HydrophobicContact CG2-CB 4.32Å; V260-F363 HydrophobicContact CG2-CD1 3.77Å; V260-F363 HydrophobicContact CG2-CD2 3.49Å; V260-F363 VanDerWaalsContact CG2-CD2 3.49Å; V260-F363 HydrophobicContact CG2-CE1 3.8Å; V260-F363 HydrophobicContact CG2-CE2 3.51Å; V260-F363 HydrophobicContact CG2-CG 3.63Å; V260-F363 HydrophobicContact CG2-CZ 3.67Å
261	V	28.5	Very low	33.3	Very low	82 Å²	82	104.8 Å²	104.8	50%	0.497	60%	0.601	S	S	.	*			trans	49.1	139.1	147.1	176.1	0	0	0	0	122.1	V285 F363	V261-V285 HydrophobicContact CG1-CG1 3.76Å; V261-F363 HydrophobicContact CG2-CZ 4.46Å
262	Q	28.9	Very low	33.8	Very low	135 Å²	135	101 Å²	101	63%	0.631	59%	0.592	S	S	*	*				-179.1	151.9	111.2	-147.1	129.7	-0.2	0	0	115.1	V285 Q289	Q262-V285 HydrophobicContact CG-CG1 4.22Å; Q262-Q289 VanDerWaalsContact NE2-CD 3.32Å
263	E	34	Very low	34.5	Very low	62 Å²	62	96.4 Å²	96.4	29%	0.29	56%	0.564	S	S	.	*			trans	-110.8	-172.5	168.2	-64.4	-173	142.6	0	0	111	K282 V285	E263-K282 WeakPolarHBondContact OE1-CA 3.34Å; E263-K282 VanDerWaalsContact OE2-CA 3.29Å; E263-K282 WeakPolarHBondContact OE2-CA 3.18Å; E263-V285 HydrophobicContact CB-CB 4.04Å; E263-V285 HydrophobicContact CB-CG1 4.01Å; E263-V285 HydrophobicContact CG-CB 3.79Å; E263-V285 HydrophobicContact CG-CG1 4.14Å; E263-V285 HydrophobicContact CG-CG2 3.86Å
264	P	36	Very low	35.2	Very low	75 Å²	75	92.6 Å²	92.6	49%	0.487	55%	0.549	S	S	.	.				-156.7	-179.8	93.7	39.9	-20	0	0	0	118.9	V286	P264-V286 HydrophobicContact CB-CG2 4.27Å
265	N	36.1	Very low	35.6	Very low	87 Å²	87	92.5 Å²	92.5	47%	0.465	54%	0.535	S	S	.	.			trans	90.3	112.6	146.9	-73.6	-37.2	0	0	0	122.6	K282 V286	N265-K282 PolarHBondContact O-NZ 3.32Å; N265-V286 VanDerWaalsContact N-CG2 3.31Å
266	S	40.2	Very low	36.1	Very low	59 Å²	59	88.7 Å²	88.7	41%	0.413	50%	0.501	S	S	.	.				47.6	152.8	104.8	-51.4	0	0	0	0	121.8
267	P	37.6	Very low	36.5	Very low	102 Å²	102	89.1 Å²	89.1	66%	0.662	49%	0.488	S	S	*	.			cis	-139.2	167.1	-29.1	39	-21.8	0	0	0	116
268	L	28.3	Very low	37.4	Very low	142 Å²	142	86.1 Å²	86.1	74%	0.743	48%	0.476	S	S	*	.			trans	34.4	106.7	146.5	-63.1	170.6	0	0	0	120.5
269	E	35.9	Very low	37.8	Very low	119 Å²	119	84 Å²	84	56%	0.556	46%	0.461	S	S	*	.			trans	-143.9	171	142.4	-80.3	-148.6	120	0	0	108.2	L271 R275	E269-L271 PolarHBondContact O-N 2.97Å; E269-R275 IonicContact OE2-CZ 2.87Å; E269-R275 IonicContact OE2-NH1 2.67Å; E269-R275 IonicContact OE2-NH2 2.73Å; E269-R275 PolarHBondContact OE2-NH2 3.02Å
270	P	36.4	Very low	38.5	Very low	117 Å²	117	82.9 Å²	82.9	76%	0.76	45%	0.449	S	S	*	.			trans	-48.9	134.3	168.6	-28.4	37.3	0	0	0	111.7	E272	P270-E272 PolarHBondContact O-N 3.25Å; P270-E272 VanDerWaalsContact O-N 3.14Å
271	L	37.3	Very low	39	Very low	58 Å²	58	82.3 Å²	82.3	30%	0.304	44%	0.443	S	S	.	.			trans	-91.8	85.2	-160.7	-64.1	171.8	0	0	0	112.3	E269 R275 F276 M279	E269-L271 PolarHBondContact O-N 2.97Å; L271-R275 HydrophobicContact CD2-CB 3.71Å; L271-F276 HydrophobicContact CB-CB 4.29Å; L271-F276 HydrophobicContact CB-CD2 4.26Å; L271-F276 HydrophobicContact CD1-CD2 3.87Å; L271-M279 HydrophobicContact CD1-CE 3.59Å; L271-M279 HydrophobicContact CD2-CE 3.81Å; L271-M279 HydrophobicContact CD2-SD 4.45Å; L271-M279 HydrophobicContact CG-CE 4.32Å
272	E	47.7	Very low	39.8	Very low	137 Å²	137	82.5 Å²	82.5	64%	0.64	44%	0.437	S	S	*	.			trans	-44.1	141.9	149.7	-83.4	-64.7	134.8	0	0	110.6	P270 G274 R275 F276	P270-E272 PolarHBondContact O-N 3.25Å; P270-E272 VanDerWaalsContact O-N 3.14Å; E272-G274 PolarHBondContact O-N 2.93Å; E272-R275 PolarHBondContact O-N 3.45Å; E272-F276 PolarHBondContact O-N 3.2Å; E272-F276 VanDerWaalsContact O-N 3.09Å
273	P	48.5	Very low	40.5	Very low	28 Å²	28	80.8 Å²	80.8	18%	0.182	43%	0.429	C	S	.	.	H	α-helix	trans	-45.1	-38.9	-178.5	-36.1	39.3	0	0	0	115.6	I74 A78 F276 R277	I74-P273 HydrophobicContact CG2-CG 3.93Å; A78-P273 HydrophobicContact CB-CB 3.74Å; A78-P273 HydrophobicContact CB-CG 4.31Å; P273-F276 WeakPolarHBondContact O-CB 3.46Å; P273-F276 PolarHBondContact O-N 3.02Å; P273-R277 PolarHBondContact O-N 3.42Å; P273-R277 VanDerWaalsContact O-N 3.14Å
274	G	44.6	Very low	40.6	Very low	43 Å²	43	86 Å²	86	44%	0.443	45%	0.453	S	S	.	.	H	α-helix	trans	-61.8	-48.2	175.3	0	0	0	0	0	113.3	E272 F276 R277 D278	E272-G274 PolarHBondContact O-N 2.93Å; G274-F276 VanDerWaalsContact C-N 3.3Å; G274-F276 PolarHBondContact O-N 3.44Å; G274-R277 WeakPolarHBondContact O-CB 3.46Å; G274-R277 PolarHBondContact O-N 3.16Å; G274-D278 PolarHBondContact O-N 3.39Å
275	R	45.5	Very low	40.7	Very low	107 Å²	107	83.8 Å²	83.8	40%	0.404	44%	0.438	S	S	.	.	H	α-helix	trans	-66.1	-33.3	177.4	-70.4	-167.7	-175.6	-134.9	15.8	112.2	E269 L271 E272 R277 M279	E269-R275 IonicContact OE2-CZ 2.87Å; E269-R275 IonicContact OE2-NH1 2.67Å; E269-R275 IonicContact OE2-NH2 2.73Å; E269-R275 PolarHBondContact OE2-NH2 3.02Å; L271-R275 HydrophobicContact CD2-CB 3.71Å; E272-R275 PolarHBondContact O-N 3.45Å; R275-R277 VanDerWaalsContact C-N 3.3Å; R275-M279 VanDerWaalsContact O-CB 3.24Å; R275-M279 WeakPolarHBondContact O-CB 3.5Å; R275-M279 PolarHBondContact O-N 3.45Å
276	F	39.9	Very low	40.8	Very low	14 Å²	14	80.7 Å²	80.7	6%	0.061	42%	0.422	C	S	.	.	H	α-helix	trans	-60	-44.5	174.5	-167	-91.2	0	0	0	110.6	D116 W119 R131 L271 E272 P273 G274 V280	D116-F276 HydrophobicContact CB-CE1 4.33Å; D116-F276 WeakPolarHBondContact OD1-CE1 3.28Å; W119-F276 HydrophobicContact CB-CE1 4.42Å; W119-F276 HydrophobicContact CB-CE2 4.44Å; W119-F276 HydrophobicContact CB-CZ 3.82Å; W119-F276 AromaticContact CD1-CE2 3.84Å; W119-F276 HydrophobicContact CD2-CZ 4.44Å; W119-F276 HydrophobicContact CG-CE1 4.42Å; W119-F276 HydrophobicContact CG-CE2 4.03Å; W119-F276 AromaticContact CG-CZ 3.82Å; W119-F276 HydrophobicContact CG-CZ 3.82Å; R131-F276 VanDerWaalsContact NE-CE2 3.34Å; R131-F276 PolarHBondContact NH2-O 3.3Å; L271-F276 HydrophobicContact CB-CB 4.29Å; L271-F276 HydrophobicContact CB-CD2 4.26Å; L271-F276 HydrophobicContact CD1-CD2 3.87Å; E272-F276 PolarHBondContact O-N 3.2Å; E272-F276 VanDerWaalsContact O-N 3.09Å; P273-F276 WeakPolarHBondContact O-CB 3.46Å; P273-F276 PolarHBondContact O-N 3.02Å; G274-F276 VanDerWaalsContact C-N 3.3Å; G274-F276 PolarHBondContact O-N 3.44Å; F276-V280 PolarHBondContact O-N 2.91Å
277	R	47.2	Very low	40.6	Very low	115 Å²	115	81 Å²	81	43%	0.434	42%	0.422	S	S	.	.	H	α-helix	trans	-62.5	-53.3	177.7	-155.7	178.3	-160.2	175.3	8.1	112.1	K112 P273 G274 R275 M279 V280	K112-R277 PolarHBondContact NZ-O 3.37Å; P273-R277 PolarHBondContact O-N 3.42Å; P273-R277 VanDerWaalsContact O-N 3.14Å; G274-R277 WeakPolarHBondContact O-CB 3.46Å; G274-R277 PolarHBondContact O-N 3.16Å; R275-R277 VanDerWaalsContact C-N 3.3Å; R277-M279 VanDerWaalsContact C-N 3.31Å; R277-M279 PolarHBondContact O-N 2.8Å; R277-V280 PolarHBondContact O-N 3.07Å
278	D	47.7	Very low	40.5	Very low	104 Å²	104	83.6 Å²	83.6	56%	0.556	43%	0.429	S	S	*	.	H	α-helix	trans	-62.6	-35.3	-178.4	-68.9	-14.7	0	0	0	112.8	G274 D281 K282	G274-D278 PolarHBondContact O-N 3.39Å; D278-D281 PolarHBondContact O-N 2.9Å; D278-K282 PolarHBondContact O-N 3.37Å; D278-K282 VanDerWaalsContact O-N 3.15Å
279	M	37	Very low	41	Very low	36 Å²	36	82.2 Å²	82.2	18%	0.177	42%	0.419	C	S	.	.	H	α-helix	trans	-80.3	-15.8	-174.6	-164.3	173.3	65.7	0	0	113.8	R131 L271 R275 R277 Q283	R131-M279 VanDerWaalsContact CD-CE 3.46Å; L271-M279 HydrophobicContact CD1-CE 3.59Å; L271-M279 HydrophobicContact CD2-CE 3.81Å; L271-M279 HydrophobicContact CD2-SD 4.45Å; L271-M279 HydrophobicContact CG-CE 4.32Å; R275-M279 VanDerWaalsContact O-CB 3.24Å; R275-M279 WeakPolarHBondContact O-CB 3.5Å; R275-M279 PolarHBondContact O-N 3.45Å; R277-M279 VanDerWaalsContact C-N 3.31Å; R277-M279 PolarHBondContact O-N 2.8Å; M279-Q283 VanDerWaalsContact O-CG 3.29Å; M279-Q283 WeakPolarHBondContact O-CG 3.49Å
280	V	41.5	Very low	40.9	Very low	28 Å²	28	85.2 Å²	85.2	17%	0.17	43%	0.425	C	S	.	.	H	α-helix	trans	-72.1	-45.4	167.5	-173.5	0	0	0	0	110.3	K112 R131 F276 R277 K282 Q283	K112-V280 HydrophobicContact CB-CG1 3.74Å; K112-V280 HydrophobicContact CD-CB 3.85Å; K112-V280 HydrophobicContact CD-CG1 3.81Å; K112-V280 HydrophobicContact CD-CG2 4.36Å; K112-V280 HydrophobicContact CG-CB 4.02Å; K112-V280 HydrophobicContact CG-CG1 3.71Å; K112-V280 HydrophobicContact CG-CG2 4.12Å; R131-V280 VanDerWaalsContact NH1-CG2 3.3Å; F276-V280 PolarHBondContact O-N 2.91Å; R277-V280 PolarHBondContact O-N 3.07Å; V280-K282 PolarHBondContact O-N 3.27Å; V280-Q283 PolarHBondContact O-N 3.36Å
281	D	41.4	Very low	40.9	Very low	79 Å²	79	87.2 Å²	87.2	42%	0.422	42%	0.424	S	S	.	.	H	α-helix	trans	-61.9	-48.2	-177	-58.4	-30.9	0	0	0	109.6	K112 D278 Q283 Q284	K112-D281 IonicContact NZ-OD1 3.13Å; K112-D281 PolarHBondContact NZ-OD1 3.22Å; K112-D281 IonicContact NZ-OD2 2.71Å; K112-D281 PolarHBondContact NZ-OD2 2.99Å; D278-D281 PolarHBondContact O-N 2.9Å; D281-Q283 PolarHBondContact O-N 2.97Å; D281-Q284 PolarHBondContact O-N 3.26Å; D281-Q284 VanDerWaalsContact O-N 3.16Å
282	K	45.1	Very low	41	Very low	86 Å²	86	92.6 Å²	92.6	37%	0.374	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-9.3	175.5	-71.3	-169.8	173	-167.6	0	116	E263 N265 D278 V280 V286	E263-K282 WeakPolarHBondContact OE1-CA 3.34Å; E263-K282 VanDerWaalsContact OE2-CA 3.29Å; E263-K282 WeakPolarHBondContact OE2-CA 3.18Å; N265-K282 PolarHBondContact O-NZ 3.32Å; D278-K282 PolarHBondContact O-N 3.37Å; D278-K282 VanDerWaalsContact O-N 3.15Å; V280-K282 PolarHBondContact O-N 3.27Å; K282-V286 WeakPolarHBondContact O-CB 3.4Å; K282-V286 WeakPolarHBondContact O-CG2 3.21Å
283	Q	42.4	Very low	40.1	Very low	99 Å²	99	95 Å²	95	46%	0.463	46%	0.456	S	S	.	.	H	α-helix	trans	-95.6	-12.3	177.6	-78.8	-174.9	3.1	0	0	114.3	M279 V280 D281 V285	M279-Q283 VanDerWaalsContact O-CG 3.29Å; M279-Q283 WeakPolarHBondContact O-CG 3.49Å; V280-Q283 PolarHBondContact O-N 3.36Å; D281-Q283 PolarHBondContact O-N 2.97Å; Q283-V285 VanDerWaalsContact C-N 3.32Å
284	Q	37.2	Very low	39.2	Very low	171 Å²	171	103 Å²	103	80%	0.799	49%	0.491	S	S	*	.	H	α-helix	trans	-72.6	-22.5	171.3	-75.9	-163.2	-12.4	0	0	113.4	D281	D281-Q284 PolarHBondContact O-N 3.26Å; D281-Q284 VanDerWaalsContact O-N 3.16Å
285	V	37.2	Very low	38.6	Very low	29 Å²	29	105.6 Å²	105.6	18%	0.176	51%	0.509	C	S	.	.	H	α-helix	trans	-114.6	-36	-174.4	-170.5	0	0	0	0	113.8	V261 Q262 E263 Q283 V287	V261-V285 HydrophobicContact CG1-CG1 3.76Å; Q262-V285 HydrophobicContact CG-CG1 4.22Å; E263-V285 HydrophobicContact CB-CB 4.04Å; E263-V285 HydrophobicContact CB-CG1 4.01Å; E263-V285 HydrophobicContact CG-CB 3.79Å; E263-V285 HydrophobicContact CG-CG1 4.14Å; E263-V285 HydrophobicContact CG-CG2 3.86Å; Q283-V285 VanDerWaalsContact C-N 3.32Å; V285-V287 PolarHBondContact O-N 2.84Å
286	V	37.8	Very low	38	Very low	21 Å²	21	106.7 Å²	106.7	13%	0.127	53%	0.527	C	S	.	.	H	α-helix	trans	-71.4	-23.5	-173.4	177	0	0	0	0	114.3	P264 N265 K282 Q289	P264-V286 HydrophobicContact CB-CG2 4.27Å; N265-V286 VanDerWaalsContact N-CG2 3.31Å; K282-V286 WeakPolarHBondContact O-CB 3.4Å; K282-V286 WeakPolarHBondContact O-CG2 3.21Å; V286-Q289 PolarHBondContact O-N 2.85Å
287	V	36.3	Very low	37.4	Very low	67 Å²	67	114.2 Å²	114.2	41%	0.406	56%	0.564	S	S	.	*	H	α-helix	trans	-74.4	-27.6	-174.8	-178.1	0	0	0	0	113.2	V285 Q289 H291	V285-V287 PolarHBondContact O-N 2.84Å; V287-Q289 VanDerWaalsContact C-N 3.31Å; V287-Q289 PolarHBondContact O-N 2.88Å; V287-H291 PolarHBondContact O-ND1 3.41Å; V287-H291 VanDerWaalsContact O-ND1 3.17Å
288	L	35.7	Very low	36.7	Very low	156 Å²	156	111.8 Å²	111.8	82%	0.817	58%	0.575	S	S	*	*	H	α-helix	trans	-68.7	-28.5	176.1	-83.9	166.5	0	0	0	112.9
289	Q	38	Very low	35.9	Very low	113 Å²	113	115.3 Å²	115.3	53%	0.528	59%	0.588	S	S	.	*	H	α-helix	trans	-94.9	-11.8	-169.3	-158.9	159.5	6.2	0	0	114	Q262 V286 V287	Q262-Q289 VanDerWaalsContact NE2-CD 3.32Å; V286-Q289 PolarHBondContact O-N 2.85Å; V287-Q289 VanDerWaalsContact C-N 3.31Å; V287-Q289 PolarHBondContact O-N 2.88Å
290	R	35.1	Very low	35.5	Very low	182 Å²	182	118.7 Å²	118.7	69%	0.687	61%	0.611	S	S	*	*	S	Bend	trans	-90.5	-0.5	-174	-157.5	164.8	178.3	144.5	-0.1	115	Q292	R290-Q292 PolarHBondContact O-N 3.29Å
291	H	36.1	Very low	35	Very low	159 Å²	159	126.6 Å²	126.6	74%	0.736	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	24.8	-177.2	-75.1	93.6	0	0	0	114.7	V287	V287-H291 PolarHBondContact O-ND1 3.41Å; V287-H291 VanDerWaalsContact O-ND1 3.17Å
292	Q	38.9	Very low	34.5	Very low	170 Å²	170	126.4 Å²	126.4	79%	0.794	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.3	-3.5	-178.7	-124.9	-179.3	13.7	0	0	115.6	R290	R290-Q292 PolarHBondContact O-N 3.29Å
293	F	29.3	Very low	33.8	Very low	187 Å²	187	128.1 Å²	128.1	82%	0.82	69%	0.685	S	S	*	*			trans	-141.6	94.1	-178.5	-83.7	-91	0	0	0	112.4
294	Q	30.1	Very low	33.5	Very low	197 Å²	197	128.9 Å²	128.9	92%	0.921	70%	0.699	S	S	*	*			trans	-168.5	102.7	144.2	-112.8	171.4	7.4	0	0	114.1
295	A	32.4	Very low	33.3	Very low	98 Å²	98	127 Å²	127	81%	0.81	70%	0.699	S	S	*	*			trans	-167.5	134.5	158.1	0	0	0	0	0	105.9
296	V	31.1	Very low	33.1	Very low	130 Å²	130	129.6 Å²	129.6	79%	0.788	72%	0.724	S	S	*	*			cis	-146.2	124.1	-5.9	136.1	0	0	0	0	104.7
297	M	28.7	Very low	33	Very low	172 Å²	172	133.2 Å²	133.2	85%	0.847	75%	0.748	S	S	*	*				62.5	117.6	89.5	-95.4	-78.8	-84.3	0	0	115.9
298	G	31.6	Very low	32.8	Very low	63 Å²	63	137.9 Å²	137.9	65%	0.649	77%	0.765	S	S	*	*			trans	137.3	96.2	-179.8	0	0	0	0	0	111.3
299	Q	31.4	Very low	32.3	Very low	178 Å²	178	135.9 Å²	135.9	83%	0.832	76%	0.759	S	S	*	*				66.6	130.8	76.8	-66.3	-163.4	29.6	0	0	113.3
300	T	29.1	Very low	31.9	Very low	107 Å²	107	136.1 Å²	136.1	66%	0.656	77%	0.772	S	S	*	*			cis	-147.2	156.7	12.2	47.9	0	0	0	0	114
301	Q	30	Very low	31.7	Very low	195 Å²	195	133.6 Å²	133.6	91%	0.911	78%	0.777	S	S	*	*			trans	32.4	143.6	139.5	-54.4	177.4	16.8	0	0	121.6
302	G	31.6	Very low	31.6	Very low	75 Å²	75	131.9 Å²	131.9	77%	0.773	78%	0.78	S	S	*	*			cis	-175.1	-173.7	6.3	0	0	0	0	0	114.2
303	S	29.1	Very low	31.3	Very low	121 Å²	121	128.7 Å²	128.7	85%	0.846	78%	0.776	S	S	*	*			trans	-96.2	-169.3	-176.7	-42.1	0	0	0	0	112.3
304	P	37.9	Very low	31.8	Very low	116 Å²	116	125.3 Å²	125.3	75%	0.753	77%	0.773	S	S	*	*			cis	-120.8	-165	-9.9	29.3	-4.3	0	0	0	111.6
305	T	32.5	Very low	31.9	Very low	130 Å²	130	122.9 Å²	122.9	80%	0.798	77%	0.766	S	S	*	*				-175.7	166.2	55.5	-44.2	0	0	0	0	111.1
306	A	32	Very low	32.1	Very low	85 Å²	85	122.9 Å²	122.9	70%	0.702	76%	0.756	S	S	*	*			trans	-82.8	-159.2	173.2	0	0	0	0	0	111.4
307	P	36.6	Very low	32.2	Very low	96 Å²	96	122.9 Å²	122.9	62%	0.623	75%	0.751	S	S	*	*			cis	-146.4	-167	7.3	26.5	3.3	0	0	0	117.6
308	H	31.6	Very low	32.4	Very low	165 Å²	165	123.4 Å²	123.4	76%	0.764	74%	0.744	S	S	*	*			trans	86.8	117.5	155.4	-62.8	-44.4	0	0	0	121
309	T	26.3	Very low	32.7	Very low	115 Å²	115	125.8 Å²	125.8	71%	0.706	74%	0.742	S	S	*	*				73.3	134.6	91.1	-14	0	0	0	0	112.7
310	C	29.6	Very low	33	Very low	118 Å²	118	121 Å²	121	80%	0.797	73%	0.732	S	S	*	*			cis	-147.5	167.9	33.6	-61	0	0	0	0	116.9
311	V	30.1	Very low	33.3	Very low	129 Å²	129	126.7 Å²	126.7	78%	0.782	74%	0.743	S	S	*	*			trans	-57.6	168.9	156.8	-105	0	0	0	0	112.9
312	P	33.6	Very low	33.6	Very low	123 Å²	123	120.7 Å²	120.7	80%	0.799	73%	0.734	S	S	*	*			cis	-146.3	174.3	35.1	44.6	-24.8	0	0	0	119.9
313	S	33.9	Very low	33.6	Very low	103 Å²	103	124.1 Å²	124.1	72%	0.72	74%	0.74	S	S	*	*			trans	-72.2	176.5	158	-26.8	0	0	0	0	111.4
314	P	39.4	Very low	33.9	Very low	115 Å²	115	121.6 Å²	121.6	75%	0.747	73%	0.733	S	S	*	*				-156.3	-172.8	56.5	40.5	-17.1	0	0	0	118.2
315	N	30.9	Very low	33.5	Very low	146 Å²	146	122.6 Å²	122.6	78%	0.781	73%	0.732	S	S	*	*			trans	73.3	155.8	147.2	-107.4	3.7	0	0	0	119.5
316	V	36.8	Very low	33.4	Very low	99 Å²	99	123.7 Å²	123.7	60%	0.6	73%	0.728	S	S	*	*			cis	-146.5	158.1	2.3	-142.4	0	0	0	0	110.8
317	D	33.4	Very low	33.4	Very low	129 Å²	129	127.2 Å²	127.2	69%	0.69	73%	0.734	S	S	*	*			trans	57.7	151.8	141.7	-74.9	2.7	0	0	0	122.7
318	R	33.7	Very low	33.3	Very low	184 Å²	184	127.5 Å²	127.5	69%	0.694	74%	0.744	S	S	*	*			cis	-164.4	159.5	-5.9	-117.6	166.8	80.5	164.3	11.8	113.7
319	D	38	Very low	33.2	Very low	112 Å²	112	125.9 Å²	125.9	60%	0.599	75%	0.747	S	S	*	*			trans	56.3	149.9	144.5	-65.4	-5.6	0	0	0	121.1
320	A	38	Very low	33.6	Very low	77 Å²	77	125.7 Å²	125.7	64%	0.636	75%	0.747	S	S	*	*			cis	-166.8	146.5	-1.6	0	0	0	0	0	115.3
321	Y	35.3	Very low	33.6	Very low	227 Å²	227	125.8 Å²	125.8	89%	0.89	74%	0.744	S	S	*	*			trans	53	140.7	144.8	-62.4	-62.8	0	0	0	126.6
322	G	35.3	Very low	33.6	Very low	70 Å²	70	128.4 Å²	128.4	72%	0.722	75%	0.747	S	S	*	*			trans	114	90.3	154.1	0	0	0	0	0	115.9
323	V	32.1	Very low	33.5	Very low	147 Å²	147	126.2 Å²	126.2	89%	0.891	75%	0.748	S	S	*	*			cis	87.3	123.3	40.3	-177.5	0	0	0	0	114.9
324	G	34.1	Very low	33.4	Very low	68 Å²	68	131.5 Å²	131.5	70%	0.701	75%	0.753	S	S	*	*			trans	114.4	94.3	167.4	0	0	0	0	0	114.2
325	N	30.8	Very low	33	Very low	136 Å²	136	130.7 Å²	130.7	73%	0.727	76%	0.756	S	S	*	*				89.1	117.2	67.8	-91.8	37.8	0	0	0	116.7
326	E	30.6	Very low	33	Very low	154 Å²	154	129.1 Å²	129.1	72%	0.72	76%	0.757	S	S	*	*			trans	88.2	132.3	131.6	-69	175.7	123	0	0	124.3
327	L	30.9	Very low	32.9	Very low	159 Å²	159	129.7 Å²	129.7	83%	0.832	77%	0.765	S	S	*	*			trans	33.9	121.2	149	-74.6	78.7	0	0	0	121.3
328	A	34	Very low	32.7	Very low	101 Å²	101	132.2 Å²	132.2	84%	0.835	77%	0.772	S	S	*	*				-172.6	135.1	110.9	0	0	0	0	0	114
329	T	30	Very low	32.9	Very low	132 Å²	132	129.7 Å²	129.7	81%	0.81	78%	0.778	S	S	*	*			trans	-87.8	162.5	149.6	42	0	0	0	0	108.1
330	P	36	Very low	32.4	Very low	110 Å²	110	130.7 Å²	130.7	71%	0.714	78%	0.783	S	S	*	*			cis	-155.2	169.3	42.8	45.7	-24.3	0	0	0	120.1
331	V	29.3	Very low	32	Very low	120 Å²	120	135.8 Å²	135.8	73%	0.727	80%	0.796	S	S	*	*			trans	42.3	142.3	130.3	-178.1	0	0	0	0	122.7
332	Q	30.2	Very low	31.8	Very low	184 Å²	184	132 Å²	132	86%	0.86	79%	0.791	S	S	*	*			trans	84.9	131.7	157	-91	159.4	-22.8	0	0	120.9
333	G	31.6	Very low	31.5	Very low	78 Å²	78	134.2 Å²	134.2	80%	0.804	80%	0.795	S	S	*	*			trans	160.4	111.9	170.8	0	0	0	0	0	112.1
334	Y	30.1	Very low	31.6	Very low	214 Å²	214	133.2 Å²	133.2	84%	0.839	79%	0.792	S	S	*	*			trans	-105.7	137.7	-174.8	-78.6	-99	0	0	0	113.6
335	A	32.4	Very low	31.4	Very low	98 Å²	98	138.7 Å²	138.7	81%	0.81	80%	0.799	S	S	*	*			trans	176	127.7	137.1	0	0	0	0	0	108.6
336	S	29.6	Very low	31.3	Very low	113 Å²	113	139.8 Å²	139.8	79%	0.79	80%	0.802	S	S	*	*			cis	100.1	83.9	26.2	-63.9	0	0	0	0	115.2
337	S	35.6	Very low	31.3	Very low	110 Å²	110	135.5 Å²	135.5	77%	0.769	79%	0.789	S	S	*	*			trans	-160.5	95.6	155.7	57	0	0	0	0	109
338	H	29.9	Very low	31.5	Very low	183 Å²	183	132.3 Å²	132.3	85%	0.847	78%	0.777	S	S	*	*				75.7	87.7	75.4	-144.2	-60	0	0	0	114.4
339	T	36.4	Very low	31.5	Very low	131 Å²	131	137.3 Å²	137.3	80%	0.804	78%	0.775	S	S	*	*			trans	-155.8	152.2	155.2	17.2	0	0	0	0	110
340	D	28.4	Very low	31.9	Very low	133 Å²	133	136.8 Å²	136.8	71%	0.711	77%	0.766	S	S	*	*			trans	-70.1	141.1	-160.5	-50.9	-90	0	0	0	115.6
341	M	30.2	Very low	31.9	Very low	184 Å²	184	139.1 Å²	139.1	91%	0.906	77%	0.768	S	S	*	*			trans	-123.5	106.4	163.3	-84.3	-69.5	132.4	0	0	110
342	N	31	Very low	32.1	Very low	148 Å²	148	143.8 Å²	143.8	79%	0.791	77%	0.772	S	S	*	*			trans	-61.2	144.4	178.6	-85	-72.3	0	0	0	112.3	P344	N342-P344 WeakPolarHBondContact O-CD 3.29Å
343	S	28	Very low	32.2	Very low	116 Å²	116	143.8 Å²	143.8	81%	0.811	77%	0.77	S	S	*	*			trans	-68.8	123.9	168.1	-48.1	0	0	0	0	110.9	Q345	S343-Q345 PolarHBondContact O-N 3.05Å; S343-Q345 VanDerWaalsContact O-N 3.14Å
344	P	34.9	Very low	32.2	Very low	126 Å²	126	150.5 Å²	150.5	82%	0.818	77%	0.771	S	S	*	*			trans	-82.5	91.4	168.1	31.4	-29	0	0	0	109.9	N342	N342-P344 WeakPolarHBondContact O-CD 3.29Å
345	Q	30.1	Very low	32.2	Very low	182 Å²	182	150 Å²	150	85%	0.85	77%	0.769	S	S	*	*			trans	-40	144.9	153.6	-176.1	-177.5	24.2	0	0	110.7	S343 S347	S343-Q345 PolarHBondContact O-N 3.05Å; S343-Q345 VanDerWaalsContact O-N 3.14Å; Q345-S347 PolarHBondContact O-N 3.38Å
346	M	27.8	Very low	31.9	Very low	160 Å²	160	150.6 Å²	150.6	79%	0.788	77%	0.767	S	S	*	*			trans	-46.5	123.4	-171	-66.4	-164.9	80.2	0	0	112.8	L350	M346-L350 HydrophobicContact CE-CD2 4.21Å
347	S	30.6	Very low	31.9	Very low	63 Å²	63	151.9 Å²	151.9	44%	0.441	76%	0.761	S	S	.	*			trans	-63.4	137.5	-174.5	80.8	0	0	0	0	111.3	Q345 R349 L350	Q345-S347 PolarHBondContact O-N 3.38Å; S347-R349 PolarHBondContact O-N 3.14Å; S347-R349 WeakPolarHBondContact OG-CB 3.47Å; S347-L350 PolarHBondContact O-N 3.19Å
348	P	35.1	Very low	31.5	Very low	92 Å²	92	153 Å²	153	60%	0.597	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-3.9	173.3	-26.8	35.7	0	0	0	114.9	L350 Q351	P348-L350 VanDerWaalsContact C-N 3.34Å; P348-Q351 PolarHBondContact O-N 2.56Å
349	R	34.3	Very low	31.3	Very low	206 Å²	206	148.7 Å²	148.7	78%	0.777	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-24.9	178	-147.2	170.2	-174.4	164.8	-0.1	113	S347	S347-R349 PolarHBondContact O-N 3.14Å; S347-R349 WeakPolarHBondContact OG-CB 3.47Å
350	L	37.7	Very low	31	Very low	122 Å²	122	152 Å²	152	64%	0.639	76%	0.755	S	S	*	*	S	Bend	trans	-76.2	-28.4	171.3	-98.7	75.2	0	0	0	112.8	M346 S347 P348 R352	M346-L350 HydrophobicContact CE-CD2 4.21Å; S347-L350 PolarHBondContact O-N 3.19Å; P348-L350 VanDerWaalsContact C-N 3.34Å; L350-R352 VanDerWaalsContact C-N 3.27Å; L350-R352 PolarHBondContact O-N 3.15Å
351	Q	36.7	Very low	31	Very low	159 Å²	159	154.5 Å²	154.5	74%	0.743	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-8	-178.1	-72.9	177.4	-30	0	0	114	P348	P348-Q351 PolarHBondContact O-N 2.56Å
352	R	33.2	Very low	31.1	Very low	217 Å²	217	150 Å²	150	82%	0.819	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-2.3	-178.5	-77.4	-170.8	169.5	-161.2	-3.8	115.4	L350 W354	L350-R352 VanDerWaalsContact C-N 3.27Å; L350-R352 PolarHBondContact O-N 3.15Å; R352-W354 VanDerWaalsContact C-N 3.25Å; R352-W354 PolarHBondContact O-N 3.32Å
353	F	31.4	Very low	31	Very low	184 Å²	184	148.6 Å²	148.6	81%	0.807	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-4.5	-176.5	-113.3	-86.9	0	0	0	115
354	W	32.3	Very low	31.5	Very low	219 Å²	219	146.6 Å²	146.6	83%	0.83	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	-0.9	-170.4	-79	94.6	0	0	0	115.5	R352	R352-W354 VanDerWaalsContact C-N 3.25Å; R352-W354 PolarHBondContact O-N 3.32Å
355	Y	30.9	Very low	31.4	Very low	203 Å²	203	146.3 Å²	146.3	80%	0.796	73%	0.726	S	S	*	*			trans	-136.6	100	-175.3	-72.3	-75.5	0	0	0	114
356	S	25.8	Very low	31.6	Very low	111 Å²	111	144.5 Å²	144.5	78%	0.776	72%	0.722	S	S	*	*			trans	35.4	157	138.6	-147.5	0	0	0	0	123.8
357	Q	29.4	Very low	31.9	Very low	141 Å²	141	142.6 Å²	142.6	66%	0.659	72%	0.721	S	S	*	*			trans	77.5	92.7	161.1	-60.8	-124.2	-5.4	0	0	119.9
358	N	26.6	Very low	32.2	Very low	134 Å²	134	146.6 Å²	146.6	72%	0.717	74%	0.738	S	S	*	*				61.9	113.9	106.9	-157.2	5.3	0	0	0	120.3
359	S	27.3	Very low	32.2	Very low	92 Å²	92	151.3 Å²	151.3	64%	0.643	75%	0.752	S	S	*	*			trans	50	96.5	149.3	-61.3	0	0	0	0	120.8
360	Q	29.6	Very low	32.3	Very low	200 Å²	200	146.4 Å²	146.4	94%	0.935	75%	0.747	S	S	*	*				-174.3	170.8	107	-101.1	165.9	90.8	0	0	115
361	Q	28.8	Very low	32	Very low	185 Å²	185	145.7 Å²	145.7	86%	0.864	75%	0.752	S	S	*	*			trans	-90.4	145.8	-162.4	-53.6	163.4	6	0	0	114
362	A	30.9	Very low	32.1	Very low	89 Å²	89	144.1 Å²	144.1	74%	0.736	76%	0.756	S	S	*	*			trans	-163.2	126.3	146.3	0	0	0	0	0	113.6
363	F	30.3	Very low	32	Very low	120 Å²	120	139.2 Å²	139.2	53%	0.526	75%	0.749	S	S	.	*			trans	-105	164.7	157.3	-83.9	-106.4	0	0	0	107.1	V260 V261	V260-F363 HydrophobicContact CG2-CB 4.32Å; V260-F363 HydrophobicContact CG2-CD1 3.77Å; V260-F363 HydrophobicContact CG2-CD2 3.49Å; V260-F363 VanDerWaalsContact CG2-CD2 3.49Å; V260-F363 HydrophobicContact CG2-CE1 3.8Å; V260-F363 HydrophobicContact CG2-CE2 3.51Å; V260-F363 HydrophobicContact CG2-CG 3.63Å; V260-F363 HydrophobicContact CG2-CZ 3.67Å; V261-F363 HydrophobicContact CG2-CZ 4.46Å
364	S	37.9	Very low	32.1	Very low	73 Å²	73	139.2 Å²	139.2	51%	0.51	75%	0.752	S	S	.	*			cis	-161.3	177.4	21.6	-124	0	0	0	0	110.2	A259	A259-S364 PolarHBondContact O-OG 2.83Å
365	P	32.8	Very low	32.1	Very low	121 Å²	121	133.4 Å²	133.4	79%	0.786	74%	0.74	S	S	*	*			trans	-94.5	-177	179.7	39.3	-36.1	0	0	0	114.6
366	N	34.3	Very low	32.1	Very low	143 Å²	143	129.7 Å²	129.7	77%	0.765	74%	0.738	S	S	*	*			trans	-137.2	123.5	174.5	173	24.2	0	0	0	112
367	P	33.9	Very low	32.3	Very low	120 Å²	120	131.7 Å²	131.7	78%	0.779	74%	0.735	S	S	*	*			trans	-132.4	145.8	148.3	37.2	-25.1	0	0	0	112.5
368	N	36.3	Very low	32.3	Very low	148 Å²	148	129.4 Å²	129.4	79%	0.791	74%	0.735	S	S	*	*			trans	-156.8	101.9	-179	-161.9	4.6	0	0	0	113.9
369	Q	36.7	Very low	32.4	Very low	190 Å²	190	128.4 Å²	128.4	89%	0.888	74%	0.738	S	S	*	*			trans	-171.1	159.7	149.1	-100.3	-157.6	-22.1	0	0	111.1
370	P	36.4	Very low	32.5	Very low	103 Å²	103	128.5 Å²	128.5	67%	0.669	74%	0.739	S	S	*	*			trans	-137.4	160.7	-147.8	41.8	-24.5	0	0	0	119.6
371	S	31	Very low	32.4	Very low	108 Å²	108	127.1 Å²	127.1	76%	0.755	73%	0.734	S	S	*	*			trans	68.8	169.6	144.8	-69.3	0	0	0	0	119.1
372	P	38.2	Very low	32.4	Very low	126 Å²	126	122 Å²	122	82%	0.818	72%	0.719	S	S	*	*			cis	-126.1	-159.7	7.8	43.2	-26.2	0	0	0	116.1
373	V	30.7	Very low	32.3	Very low	113 Å²	113	126 Å²	126	69%	0.685	72%	0.722	S	S	*	*			trans	-147.3	149.4	-157.1	-157.7	0	0	0	0	113.4	V375	V373-V375 HydrophobicContact CG1-CG2 4.22Å
374	H	35.1	Very low	32.2	Very low	185 Å²	185	125.9 Å²	125.9	86%	0.856	73%	0.731	S	S	*	*			trans	-147.5	129.2	154.1	-80.4	-86.7	0	0	0	107.4
375	V	31.5	Very low	31.7	Very low	97 Å²	97	128.2 Å²	128.2	59%	0.588	74%	0.742	S	S	*	*			cis	74.5	118.8	29.7	-165	0	0	0	0	110.9	V373	V373-V375 HydrophobicContact CG1-CG2 4.22Å
376	V	31.7	Very low	31.5	Very low	124 Å²	124	127.5 Å²	127.5	75%	0.752	74%	0.74	S	S	*	*				-158.4	143.8	80.4	163.9	0	0	0	0	114.2
377	H	29	Very low	31.4	Very low	153 Å²	153	125.4 Å²	125.4	71%	0.708	74%	0.737	S	S	*	*			trans	-13.5	173.9	150.1	-49.6	115.8	0	0	0	122.4
378	S	28.5	Very low	31.2	Very low	94 Å²	94	126.6 Å²	126.6	66%	0.657	74%	0.736	S	S	*	*			cis	176.8	178.9	-26.6	-78.8	0	0	0	0	109.5
379	S	29.1	Very low	30.9	Very low	112 Å²	112	129.3 Å²	129.3	78%	0.783	74%	0.741	S	S	*	*			trans	84.1	151.5	151.3	-53.1	0	0	0	0	118.6
380	S	29.2	Very low	30.5	Very low	94 Å²	94	127.2 Å²	127.2	66%	0.657	74%	0.737	S	S	*	*			cis	-178.4	167.5	-20	54.9	0	0	0	0	112.2
381	M	29.2	Very low	30.6	Very low	171 Å²	171	126.9 Å²	126.9	84%	0.842	73%	0.734	S	S	*	*			trans	76.2	155.5	159.2	-59.7	-170.7	95.3	0	0	118.8
382	S	28.7	Very low	30.5	Very low	77 Å²	77	126.6 Å²	126.6	54%	0.538	73%	0.732	S	S	.	*			cis	-172.8	138.6	-23.7	-94.1	0	0	0	0	113.3
383	Q	28.4	Very low	30.2	Very low	174 Å²	174	126.2 Å²	126.2	81%	0.813	73%	0.728	S	S	*	*			trans	63.7	175.3	150.7	-58.6	176.8	10.2	0	0	117.7
384	V	28.9	Very low	30.3	Very low	117 Å²	117	129.2 Å²	129.2	71%	0.709	74%	0.736	S	S	*	*			cis	-153.4	163.6	8.2	-133.5	0	0	0	0	112.6
385	V	27.2	Very low	30.1	Very low	122 Å²	122	131.8 Å²	131.8	74%	0.739	74%	0.738	S	S	*	*			trans	81	113.8	139.8	158.6	0	0	0	0	123.5
386	S	28.8	Very low	30.7	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	75%	0.745	S	S	*	*			trans	70.5	156.5	132.5	-69.3	0	0	0	0	123.1
387	S	31.1	Very low	30.9	Very low	99 Å²	99	132.2 Å²	132.2	69%	0.692	75%	0.749	S	S	*	*			cis	-163.1	153.6	-7.1	40	0	0	0	0	114
388	N	28.9	Very low	31	Very low	144 Å²	144	131.1 Å²	131.1	77%	0.77	76%	0.758	S	S	*	*			trans	31.4	135.5	143.8	-57.7	1.8	0	0	0	121.7
389	F	30.4	Very low	31.4	Very low	205 Å²	205	129.8 Å²	129.8	90%	0.899	76%	0.759	S	S	*	*				-160.8	164.6	94.7	-118.4	-93.7	0	0	0	112.8
390	N	28.8	Very low	31.9	Very low	147 Å²	147	133.2 Å²	133.2	79%	0.786	76%	0.763	S	S	*	*			trans	-139.2	-162.9	-177.1	-145.1	5.9	0	0	0	106.1
391	P	37.5	Very low	32.1	Very low	95 Å²	95	135.7 Å²	135.7	62%	0.617	77%	0.767	S	S	*	*			cis	-138.8	-158.3	-1.8	36.6	-12.1	0	0	0	114.8
392	S	30.8	Very low	32.4	Very low	103 Å²	103	131.3 Å²	131.3	72%	0.72	76%	0.758	S	S	*	*			trans	86.4	144.2	144.6	-77.3	0	0	0	0	120.1
393	V	31.4	Very low	32.8	Very low	118 Å²	118	138.2 Å²	138.2	72%	0.715	77%	0.772	S	S	*	*			cis	-165.2	170.9	-11	111.6	0	0	0	0	112.9
394	M	33.3	Very low	32.9	Very low	175 Å²	175	137.5 Å²	137.5	86%	0.862	77%	0.771	S	S	*	*			trans	90.2	161.7	164.5	-81.4	-31.4	155.6	0	0	122.2
395	R	30.8	Very low	33.3	Very low	239 Å²	239	136.2 Å²	136.2	90%	0.902	77%	0.772	S	S	*	*			trans	-145.3	-179.1	-153.7	-114.3	-166.7	127.7	-169.3	0.2	111.7
396	P	43.9	Very low	33.7	Very low	113 Å²	113	135.8 Å²	135.8	73%	0.734	78%	0.775	S	S	*	*			trans	-108.1	-173	-158.6	43.1	-38.8	0	0	0	115.8
397	S	34.5	Very low	34.4	Very low	118 Å²	118	136.7 Å²	136.7	83%	0.825	78%	0.778	S	S	*	*			trans	-142	177.2	170.8	61	0	0	0	0	112.4
398	S	32.6	Very low	34.7	Very low	129 Å²	129	139.8 Å²	139.8	90%	0.902	78%	0.782	S	S	*	*			trans	-143	160.6	-162.9	-50	0	0	0	0	114.5
399	G	35.6	Very low	35.1	Very low	67 Å²	67	136.1 Å²	136.1	69%	0.691	78%	0.778	S	S	*	*			trans	-162	125.1	164.1	0	0	0	0	0	109.5
400	Q	39.2	Very low	35.4	Very low	183 Å²	183	134.2 Å²	134.2	86%	0.855	77%	0.772	S	S	*	*				72.7	141.3	66.7	-72.8	-158.6	4.8	0	0	113.9
401	I	33.5	Very low	35.7	Very low	147 Å²	147	131.8 Å²	131.8	75%	0.754	77%	0.766	S	S	*	*			cis	-171.7	167.9	-19	-115	168	0	0	0	106.9
402	A	36.3	Very low	35.7	Very low	78 Å²	78	134.4 Å²	134.4	65%	0.645	77%	0.774	S	S	*	*			trans	114.3	117.7	159.4	0	0	0	0	0	116.3
403	R	36.5	Very low	35.8	Very low	223 Å²	223	134.3 Å²	134.3	84%	0.842	77%	0.773	S	S	*	*				84.8	146.2	79.6	-76.3	-175.9	180	-168.6	1.5	114
404	M	31.9	Very low	35.9	Very low	158 Å²	158	133.2 Å²	133.2	78%	0.778	77%	0.771	S	S	*	*			cis	-170.8	177.8	-24.4	-125.1	-160.1	-66.9	0	0	109.8
405	A	36.9	Very low	35.7	Very low	90 Å²	90	133.2 Å²	133.2	74%	0.744	77%	0.769	S	S	*	*			trans	74.1	151.6	167.2	0	0	0	0	0	118.3
406	S	34.8	Very low	35.9	Very low	114 Å²	114	127.2 Å²	127.2	80%	0.797	76%	0.763	S	S	*	*			cis	-163.5	159.8	-19.9	-94.5	0	0	0	0	111.3
407	P	44.4	Very low	35.6	Very low	125 Å²	125	127.3 Å²	127.3	81%	0.812	77%	0.766	S	S	*	*			trans	-124	163.6	-176.1	42.1	-31.1	0	0	0	118
408	E	36.6	Very low	35.5	Very low	164 Å²	164	129.5 Å²	129.5	77%	0.766	77%	0.768	S	S	*	*			trans	-159.8	173.5	157.6	-101.2	-145.6	-113	0	0	108.1	Q410	E408-Q410 WeakPolarHBondContact OE2-CG 3.34Å; E408-Q410 PolarHBondContact OE2-NE2 3.47Å
409	G	37.9	Very low	35.7	Very low	67 Å²	67	131.6 Å²	131.6	69%	0.691	77%	0.768	S	S	*	*			cis	168.4	164.7	0.5	0	0	0	0	0	108.8
410	Q	36.6	Very low	35.6	Very low	165 Å²	165	133.5 Å²	133.5	77%	0.771	77%	0.771	S	S	*	*			cis	-141.6	-78.3	-2.4	-67.1	-173	-3.7	0	0	114	E408	E408-Q410 WeakPolarHBondContact OE2-CG 3.34Å; E408-Q410 PolarHBondContact OE2-NE2 3.47Å
411	S	34.1	Very low	35.7	Very low	96 Å²	96	130.2 Å²	130.2	67%	0.671	77%	0.766	S	S	*	*			trans	-162.7	-174.2	-162.1	64.1	0	0	0	0	113
412	I	37.7	Very low	35.7	Very low	150 Å²	150	134 Å²	134	77%	0.769	77%	0.771	S	S	*	*			cis	-150.9	149.5	12.8	15.8	170.5	0	0	0	113.6
413	S	32.9	Very low	35.5	Very low	101 Å²	101	137.3 Å²	137.3	71%	0.706	78%	0.777	S	S	*	*			trans	34.3	123.2	135.7	-48.1	0	0	0	0	126.8
414	S	33.6	Very low	35.3	Very low	96 Å²	96	136.3 Å²	136.3	67%	0.671	78%	0.782	S	S	*	*				76.8	119.1	119.3	-59.7	0	0	0	0	126.3
415	E	30	Very low	35.3	Very low	175 Å²	175	134 Å²	134	82%	0.818	78%	0.78	S	S	*	*				54.2	126.7	127.1	-58.2	-179.5	108.5	0	0	123.6
416	S	33.7	Very low	35.3	Very low	112 Å²	112	135.3 Å²	135.3	78%	0.783	78%	0.784	S	S	*	*				170.4	163.3	111.8	-78	0	0	0	0	116.2
417	S	37.3	Very low	35.3	Very low	115 Å²	115	136 Å²	136	80%	0.804	79%	0.786	S	S	*	*			trans	75.9	88.1	151.3	-61.5	0	0	0	0	122.2
418	L	33.2	Very low	35.2	Very low	165 Å²	165	137.8 Å²	137.8	86%	0.864	79%	0.787	S	S	*	*			trans	-18	137.7	137.2	-55.8	162.3	0	0	0	117.2
419	L	36.2	Very low	35.2	Very low	172 Å²	172	132.5 Å²	132.5	90%	0.901	78%	0.777	S	S	*	*				-179.9	170.8	112.8	-94.6	166.7	0	0	0	111.9
420	S	33.7	Very low	35.2	Very low	107 Å²	107	132.6 Å²	132.6	75%	0.748	77%	0.767	S	S	*	*			trans	-138.3	-170.1	-164.3	-50.4	0	0	0	0	111.2
421	P	41.2	Very low	35.7	Very low	115 Å²	115	129.4 Å²	129.4	75%	0.747	76%	0.761	S	S	*	*				-128.6	176.2	-56.4	34.2	-19.6	0	0	0	112.4
422	R	33.2	Very low	36.3	Very low	226 Å²	226	128 Å²	128	85%	0.853	76%	0.755	S	S	*	*			trans	-171	134.8	133	-109.6	175.7	-177.3	-144.3	-1	115.1
423	L	32.2	Very low	36.7	Very low	148 Å²	148	127.2 Å²	127.2	78%	0.775	75%	0.748	S	S	*	*			trans	33.8	108.8	140.7	-61.3	166.3	0	0	0	119.6
424	E	32.7	Very low	37.3	Very low	202 Å²	202	126.2 Å²	126.2	94%	0.944	74%	0.738	S	S	*	*				-157.4	165.2	110.5	-118.8	175.2	-178.2	0	0	111.6
425	S	31.9	Very low	38.2	Very low	108 Å²	108	130 Å²	130	76%	0.755	74%	0.738	S	S	*	*			trans	-114.9	123.7	-163.7	56.8	0	0	0	0	114.1
426	S	36.4	Very low	39.8	Very low	118 Å²	118	124.4 Å²	124.4	83%	0.825	72%	0.722	S	S	*	*			trans	-158.9	138.3	158.3	-84.5	0	0	0	0	111.9
427	P	36.1	Very low	41	Very low	129 Å²	129	125 Å²	125	84%	0.838	71%	0.714	S	S	*	*			trans	-102	96	-173.6	36.5	-30.6	0	0	0	112.8
428	I	41.2	Very low	42.5	Very low	162 Å²	162	124.5 Å²	124.5	83%	0.831	70%	0.699	S	S	*	*			trans	-130.7	125.7	166.2	-62.9	-177.4	0	0	0	108.4	S430	I428-S430 PolarHBondContact O-N 3.45Å
429	G	36.5	Very low	44.4	Very low	54 Å²	54	122.8 Å²	122.8	56%	0.557	69%	0.686	S	S	*	*			trans	-63.4	118.2	-174.6	0	0	0	0	0	111.9
430	S	39.6	Very low	46.1	Very low	69 Å²	69	120.6 Å²	120.6	48%	0.483	67%	0.672	S	S	.	*			trans	-72.7	151.1	173.2	59	0	0	0	0	110.5	I428 A432 Q433	I428-S430 PolarHBondContact O-N 3.45Å; S430-A432 PolarHBondContact O-N 3.17Å; S430-Q433 PolarHBondContact O-N 3.41Å
431	P	46.8	Very low	47.7	Very low	97 Å²	97	119.7 Å²	119.7	63%	0.63	66%	0.655	S	S	*	*	H	α-helix	trans	-54.8	-22.4	-175.7	-29.2	36.1	0	0	0	115	Q433 V434 Y435	P431-Q433 VanDerWaalsContact C-N 3.27Å; P431-Q433 PolarHBondContact O-N 3.06Å; P431-V434 PolarHBondContact O-N 2.98Å; P431-Y435 PolarHBondContact O-N 3.33Å
432	A	46.4	Very low	49.1	Very low	66 Å²	66	120.2 Å²	120.2	55%	0.545	65%	0.648	S	S	.	*	H	α-helix	trans	-55.5	-35.6	173.3	0	0	0	0	0	113.5	S430 A436	S430-A432 PolarHBondContact O-N 3.17Å; A432-A436 VanDerWaalsContact O-CB 3.25Å; A432-A436 WeakPolarHBondContact O-CB 3.47Å; A432-A436 PolarHBondContact O-N 2.99Å
433	Q	45.8	Very low	51	Low	134 Å²	134	115 Å²	115	63%	0.626	63%	0.633	S	S	*	*	H	α-helix	trans	-69.7	-39.3	177	-75.5	-172.9	-30.8	0	0	112.2	S430 P431 A436 M437	S430-Q433 PolarHBondContact O-N 3.41Å; P431-Q433 VanDerWaalsContact C-N 3.27Å; P431-Q433 PolarHBondContact O-N 3.06Å; Q433-A436 PolarHBondContact O-N 2.84Å; Q433-M437 WeakPolarHBondContact O-CB 3.45Å; Q433-M437 PolarHBondContact O-N 2.84Å
434	V	46.8	Very low	52.8	Low	81 Å²	81	114.1 Å²	114.1	49%	0.491	63%	0.625	S	S	.	*	H	α-helix	trans	-66	-43.3	176.3	-178.8	0	0	0	0	110.5	P431 Q438	P431-V434 PolarHBondContact O-N 2.98Å; V434-Q438 VanDerWaalsContact O-CB 3.3Å; V434-Q438 WeakPolarHBondContact O-CB 3.03Å; V434-Q438 PolarHBondContact O-N 3.37Å
435	Y	52	Low	54.4	Low	175 Å²	175	109.1 Å²	109.1	69%	0.686	60%	0.602	S	S	*	*	H	α-helix	trans	-64	-42.3	174.2	-92.5	-85.2	0	0	0	112.8	P431 Q438 Q439	P431-Y435 PolarHBondContact O-N 3.33Å; Y435-Q438 PolarHBondContact O-N 2.68Å; Y435-Q439 VanDerWaalsContact O-CB 3.28Å; Y435-Q439 WeakPolarHBondContact O-CB 3.38Å; Y435-Q439 PolarHBondContact O-N 3.13Å
436	A	62.4	Low	56.3	Low	57 Å²	57	110.2 Å²	110.2	47%	0.471	60%	0.595	S	S	.	*	H	α-helix	trans	-63.3	-46.4	176.7	0	0	0	0	0	111.9	A432 Q433 Q438 Q439 Q440	A432-A436 VanDerWaalsContact O-CB 3.25Å; A432-A436 WeakPolarHBondContact O-CB 3.47Å; A432-A436 PolarHBondContact O-N 2.99Å; Q433-A436 PolarHBondContact O-N 2.84Å; A436-Q438 PolarHBondContact O-N 2.93Å; A436-Q439 PolarHBondContact O-N 3.22Å; A436-Q440 WeakPolarHBondContact O-CB 3.45Å; A436-Q440 PolarHBondContact O-N 3.3Å
437	M	59.9	Low	58	Low	124 Å²	124	111.3 Å²	111.3	61%	0.611	59%	0.587	S	S	*	*	H	α-helix	trans	-63.5	-41.5	177.4	-172.2	172.3	69.1	0	0	111.8	Q433 Q440 Q441	Q433-M437 WeakPolarHBondContact O-CB 3.45Å; Q433-M437 PolarHBondContact O-N 2.84Å; M437-Q440 PolarHBondContact O-N 3.19Å; M437-Q441 WeakPolarHBondContact O-CB 3.29Å; M437-Q441 PolarHBondContact O-N 2.8Å
438	Q	68.7	Low	59.4	Low	105 Å²	105	108.9 Å²	108.9	49%	0.491	57%	0.565	S	S	.	*	H	α-helix	trans	-66.6	-39.6	176.2	-179.2	149.6	88.8	0	0	112.4	V434 Y435 A436 Q441 Q442	V434-Q438 VanDerWaalsContact O-CB 3.3Å; V434-Q438 WeakPolarHBondContact O-CB 3.03Å; V434-Q438 PolarHBondContact O-N 3.37Å; Y435-Q438 PolarHBondContact O-N 2.68Å; A436-Q438 PolarHBondContact O-N 2.93Å; Q438-Q441 PolarHBondContact O-N 2.82Å; Q438-Q442 WeakPolarHBondContact O-CB 3.36Å; Q438-Q442 PolarHBondContact O-N 3Å
439	Q	73.2	Confident	60.7	Low	129 Å²	129	107.4 Å²	107.4	60%	0.603	55%	0.554	S	S	*	*	H	α-helix	trans	-66.8	-39.5	175.4	-170.9	177	95.8	0	0	111.7	Y435 A436 Q442 Q443	Y435-Q439 VanDerWaalsContact O-CB 3.28Å; Y435-Q439 WeakPolarHBondContact O-CB 3.38Å; Y435-Q439 PolarHBondContact O-N 3.13Å; A436-Q439 PolarHBondContact O-N 3.22Å; Q439-Q442 PolarHBondContact O-N 2.88Å; Q439-Q443 PolarHBondContact O-N 3Å
440	Q	71.3	Confident	62.3	Low	127 Å²	127	110.5 Å²	110.5	59%	0.593	55%	0.554	S	S	*	*	H	α-helix	trans	-65.4	-41.7	175.2	-169.2	176.7	21.3	0	0	111.9	A436 M437 Q442 Q443 Q444	A436-Q440 WeakPolarHBondContact O-CB 3.45Å; A436-Q440 PolarHBondContact O-N 3.3Å; M437-Q440 PolarHBondContact O-N 3.19Å; Q440-Q442 VanDerWaalsContact C-N 3.31Å; Q440-Q442 PolarHBondContact O-N 3.22Å; Q440-Q443 PolarHBondContact O-N 2.95Å; Q440-Q444 PolarHBondContact O-N 2.8Å
441	Q	68.1	Low	63.6	Low	88 Å²	88	112.7 Å²	112.7	41%	0.411	56%	0.557	S	S	.	*	H	α-helix	trans	-63.6	-36.7	174.4	-167	177.4	48.3	0	0	111.7	M437 Q438 Q444 Q445	M437-Q441 WeakPolarHBondContact O-CB 3.29Å; M437-Q441 PolarHBondContact O-N 2.8Å; Q438-Q441 PolarHBondContact O-N 2.82Å; Q441-Q444 PolarHBondContact O-N 3.37Å; Q441-Q445 PolarHBondContact O-N 3.34Å
442	Q	70.1	Confident	64.3	Low	125 Å²	125	111.3 Å²	111.3	58%	0.584	54%	0.542	S	S	*	.	H	α-helix	trans	-70.2	-36.7	176.2	-166.5	169.9	80.5	0	0	112.6	Q438 Q439 Q440 Q445 Q446	Q438-Q442 WeakPolarHBondContact O-CB 3.36Å; Q438-Q442 PolarHBondContact O-N 3Å; Q439-Q442 PolarHBondContact O-N 2.88Å; Q440-Q442 VanDerWaalsContact C-N 3.31Å; Q440-Q442 PolarHBondContact O-N 3.22Å; Q442-Q445 PolarHBondContact O-N 3.12Å; Q442-Q446 PolarHBondContact O-N 3.17Å
443	Q	73.4	Confident	65.1	Low	116 Å²	116	113.5 Å²	113.5	54%	0.542	54%	0.541	S	S	.	.	H	α-helix	trans	-64	-40.6	170.4	-77	-171.3	-2.1	0	0	112.6	Q439 Q440 Q445 Q446 Q447	Q439-Q443 PolarHBondContact O-N 3Å; Q440-Q443 PolarHBondContact O-N 2.95Å; Q443-Q445 VanDerWaalsContact C-N 3.33Å; Q443-Q445 PolarHBondContact O-N 2.84Å; Q443-Q446 PolarHBondContact O-N 2.84Å; Q443-Q447 PolarHBondContact O-N 3.19Å
444	Q	68.8	Low	66	Low	130 Å²	130	113.1 Å²	113.1	61%	0.607	54%	0.539	S	S	*	.	H	α-helix	trans	-61	-40.5	175.5	-83	-170.1	-4.6	0	0	112.3	Q440 Q441 Q446 Q447 Q448	Q440-Q444 PolarHBondContact O-N 2.8Å; Q441-Q444 PolarHBondContact O-N 3.37Å; Q444-Q446 PolarHBondContact O-N 3.2Å; Q444-Q447 PolarHBondContact O-N 3.34Å; Q444-Q448 WeakPolarHBondContact O-CB 3.48Å; Q444-Q448 PolarHBondContact O-N 3.18Å
445	Q	66.9	Low	66.5	Low	97 Å²	97	112.7 Å²	112.7	45%	0.453	53%	0.531	S	S	.	.	H	α-helix	trans	-60.9	-42.6	174.3	-74.4	-169.6	0.1	0	0	112.4	Q441 Q442 Q443 Q448 Q449	Q441-Q445 PolarHBondContact O-N 3.34Å; Q442-Q445 PolarHBondContact O-N 3.12Å; Q443-Q445 VanDerWaalsContact C-N 3.33Å; Q443-Q445 PolarHBondContact O-N 2.84Å; Q445-Q448 PolarHBondContact O-N 3.49Å; Q445-Q449 WeakPolarHBondContact O-CB 3.4Å; Q445-Q449 PolarHBondContact O-N 3.34Å
446	Q	72.2	Confident	66.3	Low	132 Å²	132	109.7 Å²	109.7	62%	0.617	53%	0.525	S	S	*	.	H	α-helix	trans	-64.1	-43.6	177.4	-76.7	-169.8	-3.3	0	0	112.9	Q442 Q443 Q444 Q448 Q449 Q450	Q442-Q446 PolarHBondContact O-N 3.17Å; Q443-Q446 PolarHBondContact O-N 2.84Å; Q444-Q446 PolarHBondContact O-N 3.2Å; Q446-Q448 PolarHBondContact O-N 3.45Å; Q446-Q449 PolarHBondContact O-N 3.05Å; Q446-Q450 PolarHBondContact O-N 3.49Å
447	Q	72.1	Confident	65.9	Low	141 Å²	141	113.6 Å²	113.6	66%	0.659	53%	0.533	S	S	*	.	H	α-helix	trans	-62.5	-43.4	176.1	-74.5	-169	-0.6	0	0	112	Q443 Q444 Q449 Q450 Q451	Q443-Q447 PolarHBondContact O-N 3.19Å; Q444-Q447 PolarHBondContact O-N 3.34Å; Q447-Q449 VanDerWaalsContact C-N 3.31Å; Q447-Q449 PolarHBondContact O-N 3.04Å; Q447-Q450 PolarHBondContact O-N 3.37Å; Q447-Q451 WeakPolarHBondContact O-CB 3.37Å; Q447-Q451 PolarHBondContact O-N 3.43Å
448	Q	66.1	Low	65.5	Low	78 Å²	78	113 Å²	113	36%	0.364	53%	0.531	S	S	.	.	H	α-helix	trans	-64.2	-37.6	179.3	-165.8	167.9	90.5	0	0	111.5	Q444 Q445 Q446 Q451 Q452	Q444-Q448 WeakPolarHBondContact O-CB 3.48Å; Q444-Q448 PolarHBondContact O-N 3.18Å; Q445-Q448 PolarHBondContact O-N 3.49Å; Q446-Q448 PolarHBondContact O-N 3.45Å; Q448-Q451 PolarHBondContact O-N 2.9Å; Q448-Q452 PolarHBondContact O-N 3.17Å
449	Q	67	Low	64.6	Low	130 Å²	130	111.9 Å²	111.9	61%	0.607	52%	0.522	S	S	*	.	H	α-helix	trans	-70.4	-40.4	175.5	-167.4	172.4	89.1	0	0	112.8	Q445 Q446 Q447 Q452 Q453	Q445-Q449 WeakPolarHBondContact O-CB 3.4Å; Q445-Q449 PolarHBondContact O-N 3.34Å; Q446-Q449 PolarHBondContact O-N 3.05Å; Q447-Q449 VanDerWaalsContact C-N 3.31Å; Q447-Q449 PolarHBondContact O-N 3.04Å; Q449-Q452 PolarHBondContact O-N 3.41Å; Q449-Q453 PolarHBondContact O-N 2.85Å
450	Q	70.8	Confident	63.6	Low	120 Å²	120	108.3 Å²	108.3	56%	0.561	52%	0.515	S	S	*	.	H	α-helix	trans	-61.5	-42.5	171.2	-85.7	-168.6	3.1	0	0	112.2	Q446 Q447 Q452 Q453 Q454	Q446-Q450 PolarHBondContact O-N 3.49Å; Q447-Q450 PolarHBondContact O-N 3.37Å; Q450-Q452 VanDerWaalsContact C-N 3.27Å; Q450-Q452 PolarHBondContact O-N 2.78Å; Q450-Q453 WeakPolarHBondContact O-CB 3.19Å; Q450-Q453 PolarHBondContact O-N 3.22Å; Q450-Q453 VanDerWaalsContact O-N 3.16Å; Q450-Q454 WeakPolarHBondContact O-CG 3.35Å; Q450-Q454 PolarHBondContact O-N 3.35Å
451	Q	66.8	Low	62.6	Low	114 Å²	114	106.4 Å²	106.4	53%	0.533	52%	0.515	S	S	.	.	H	α-helix	trans	-65.3	-33.7	179.1	-164.3	172.3	95.7	0	0	111.6	Q447 Q448 Q454 Q455	Q447-Q451 WeakPolarHBondContact O-CB 3.37Å; Q447-Q451 PolarHBondContact O-N 3.43Å; Q448-Q451 PolarHBondContact O-N 2.9Å; Q451-Q454 PolarHBondContact O-N 3.43Å; Q451-Q455 WeakPolarHBondContact O-CG 3.48Å; Q451-Q455 PolarHBondContact O-N 2.84Å; Q451-Q455 VanDerWaalsContact O-N 3.09Å
452	Q	61.5	Low	61.7	Low	68 Å²	68	108.1 Å²	108.1	32%	0.318	52%	0.524	S	S	.	.	H	α-helix	trans	-67.6	-38.9	172.2	-160.7	167.1	108.6	0	0	112.1	Q448 Q449 Q450 Q455 M456	Q448-Q452 PolarHBondContact O-N 3.17Å; Q449-Q452 PolarHBondContact O-N 3.41Å; Q450-Q452 VanDerWaalsContact C-N 3.27Å; Q450-Q452 PolarHBondContact O-N 2.78Å; Q452-Q455 PolarHBondContact O-N 3.43Å; Q452-M456 WeakPolarHBondContact O-CG 3.38Å; Q452-M456 PolarHBondContact O-N 2.79Å
453	Q	63.5	Low	60.6	Low	112 Å²	112	105.3 Å²	105.3	52%	0.523	52%	0.522	S	S	.	.	H	α-helix	trans	-64.9	-40.9	171.7	-72.1	-179.3	-1.6	0	0	112.7	Q449 Q450 Q455 M456 H457	Q449-Q453 PolarHBondContact O-N 2.85Å; Q450-Q453 WeakPolarHBondContact O-CB 3.19Å; Q450-Q453 PolarHBondContact O-N 3.22Å; Q450-Q453 VanDerWaalsContact O-N 3.16Å; Q453-Q455 VanDerWaalsContact C-N 3.33Å; Q453-Q455 PolarHBondContact O-N 2.97Å; Q453-M456 WeakPolarHBondContact O-CB 3.24Å; Q453-M456 PolarHBondContact O-N 3.08Å; Q453-H457 PolarHBondContact O-CD2 3.46Å; Q453-H457 VanDerWaalsContact O-CD2 3.25Å; Q453-H457 PolarHBondContact O-N 3.24Å
454	Q	64.9	Low	59.3	Low	127 Å²	127	106.7 Å²	106.7	59%	0.593	53%	0.533	S	S	*	.	H	α-helix	trans	-63.5	-38.5	176.4	-71.2	-179.5	20.2	0	0	112.1	Q450 Q451 H457 M458	Q450-Q454 WeakPolarHBondContact O-CG 3.35Å; Q450-Q454 PolarHBondContact O-N 3.35Å; Q451-Q454 PolarHBondContact O-N 3.43Å; Q454-H457 PolarHBondContact O-N 2.95Å; Q454-M458 WeakPolarHBondContact O-CB 3.13Å; Q454-M458 PolarHBondContact O-N 3.17Å
455	Q	57.4	Low	58.2	Low	71 Å²	71	108.6 Å²	108.6	33%	0.332	54%	0.535	S	S	.	.	H	α-helix	trans	-63.6	-46	171.6	-71	-179.9	41.7	0	0	111.5	Q451 Q452 Q453 H457 M458 Y459	Q451-Q455 WeakPolarHBondContact O-CG 3.48Å; Q451-Q455 PolarHBondContact O-N 2.84Å; Q451-Q455 VanDerWaalsContact O-N 3.09Å; Q452-Q455 PolarHBondContact O-N 3.43Å; Q453-Q455 VanDerWaalsContact C-N 3.33Å; Q453-Q455 PolarHBondContact O-N 2.97Å; Q455-H457 VanDerWaalsContact C-N 3.32Å; Q455-H457 PolarHBondContact O-N 3.49Å; Q455-M458 PolarHBondContact O-N 3.39Å; Q455-M458 VanDerWaalsContact O-N 3.09Å; Q455-Y459 HydrophobicContact CB-CD2 4.49Å; Q455-Y459 HydrophobicContact CB-CE2 4.44Å; Q455-Y459 WeakPolarHBondContact O-CD2 3.49Å; Q455-Y459 PolarHBondContact O-N 2.91Å
456	M	47.2	Very low	56.9	Low	112 Å²	112	114.2 Å²	114.2	55%	0.552	55%	0.554	S	S	*	*	H	α-helix	trans	-55.3	-44.6	174.9	-78.7	-69.6	-68	0	0	112.4	Q452 Q453 Y459 A460 M481	Q452-M456 WeakPolarHBondContact O-CG 3.38Å; Q452-M456 PolarHBondContact O-N 2.79Å; Q453-M456 WeakPolarHBondContact O-CB 3.24Å; Q453-M456 PolarHBondContact O-N 3.08Å; M456-Y459 PolarHBondContact O-N 2.7Å; M456-A460 VanDerWaalsContact O-CB 3.29Å; M456-A460 WeakPolarHBondContact O-CB 3.44Å; M456-A460 PolarHBondContact O-N 2.88Å; M456-M481 HydrophobicContact SD-CE 4.37Å; M456-M481 HydrophobicContact SD-SD 4.41Å
457	H	54.6	Low	55.4	Low	140 Å²	140	111.4 Å²	111.4	65%	0.648	56%	0.56	S	S	*	*	H	α-helix	trans	-66.1	-36.3	175.6	-79	-67.7	0	0	0	113.3	Q453 Q454 Q455 S461	Q453-H457 PolarHBondContact O-CD2 3.46Å; Q453-H457 VanDerWaalsContact O-CD2 3.25Å; Q453-H457 PolarHBondContact O-N 3.24Å; Q454-H457 PolarHBondContact O-N 2.95Å; Q455-H457 VanDerWaalsContact C-N 3.32Å; Q455-H457 PolarHBondContact O-N 3.49Å; H457-S461 PolarHBondContact O-N 3.25Å; H457-S461 VanDerWaalsContact O-N 3.1Å; H457-S461 PolarHBondContact O-OG 3.42Å
458	M	49.8	Very low	54	Low	112 Å²	112	112.4 Å²	112.4	55%	0.552	57%	0.565	S	S	*	*	H	α-helix	trans	-70.3	-33.5	178.1	-163.2	-166.6	-49.5	0	0	113	Q454 Q455 S461	Q454-M458 WeakPolarHBondContact O-CB 3.13Å; Q454-M458 PolarHBondContact O-N 3.17Å; Q455-M458 PolarHBondContact O-N 3.39Å; Q455-M458 VanDerWaalsContact O-N 3.09Å; M458-S461 PolarHBondContact O-OG 3.08Å
459	Y	51.1	Low	52.9	Low	81 Å²	81	112.1 Å²	112.1	32%	0.318	58%	0.583	S	S	.	*	H	α-helix	trans	-78.8	-35.7	173.5	-74	-65.7	0	0	0	112.2	Q455 M456 Q462 A463 M481	Q455-Y459 HydrophobicContact CB-CD2 4.49Å; Q455-Y459 HydrophobicContact CB-CE2 4.44Å; Q455-Y459 WeakPolarHBondContact O-CD2 3.49Å; Q455-Y459 PolarHBondContact O-N 2.91Å; M456-Y459 PolarHBondContact O-N 2.7Å; Y459-Q462 PolarHBondContact O-N 2.92Å; Y459-A463 PolarHBondContact O-N 2.89Å; Y459-M481 HydrophobicContact CD2-CE 4.23Å
460	A	51	Low	51.9	Low	54 Å²	54	114.6 Å²	114.6	45%	0.446	59%	0.587	S	S	.	*	H	α-helix	trans	-59.6	-45.9	173.9	0	0	0	0	0	111.7	M456 Q462 A463	M456-A460 VanDerWaalsContact O-CB 3.29Å; M456-A460 WeakPolarHBondContact O-CB 3.44Å; M456-A460 PolarHBondContact O-N 2.88Å; A460-Q462 PolarHBondContact O-N 3.21Å; A460-Q462 VanDerWaalsContact O-N 3.14Å; A460-A463 WeakPolarHBondContact O-CB 3.22Å; A460-A463 PolarHBondContact O-N 3.01Å
461	S	51.3	Low	50.9	Low	86 Å²	86	113.5 Å²	113.5	60%	0.601	59%	0.585	S	S	*	*	H	α-helix	trans	-71.2	-3.6	178.4	65.8	0	0	0	0	115.1	H457 M458	H457-S461 PolarHBondContact O-N 3.25Å; H457-S461 VanDerWaalsContact O-N 3.1Å; H457-S461 PolarHBondContact O-OG 3.42Å; M458-S461 PolarHBondContact O-OG 3.08Å
462	Q	49.2	Very low	50.1	Low	125 Å²	125	113.3 Å²	113.3	58%	0.584	59%	0.587	S	S	*	*	H	α-helix	trans	-99.5	-10.3	169.3	-70.7	-175.8	35.9	0	0	113.4	Y459 A460	Y459-Q462 PolarHBondContact O-N 2.92Å; A460-Q462 PolarHBondContact O-N 3.21Å; A460-Q462 VanDerWaalsContact O-N 3.14Å
463	A	46.2	Very low	49.5	Very low	66 Å²	66	114.8 Å²	114.8	55%	0.545	60%	0.596	S	S	.	*	H	α-helix	trans	-77.3	-27	-178.9	0	0	0	0	0	113.4	Y459 A460 Y465	Y459-A463 PolarHBondContact O-N 2.89Å; A460-A463 WeakPolarHBondContact O-CB 3.22Å; A460-A463 PolarHBondContact O-N 3.01Å; A463-Y465 VanDerWaalsContact C-N 3.26Å; A463-Y465 PolarHBondContact O-N 2.83Å
464	D	46	Very low	49.1	Very low	144 Å²	144	114.5 Å²	114.5	77%	0.77	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	2.6	-177.8	-67	-44.4	0	0	0	114.3
465	Y	47.5	Very low	48.9	Very low	170 Å²	170	114.3 Å²	114.3	67%	0.667	59%	0.59	S	S	*	*	S	Bend	trans	-130.7	142	177.2	-89.9	-107.2	0	0	0	111.3	A463	A463-Y465 VanDerWaalsContact C-N 3.26Å; A463-Y465 PolarHBondContact O-N 2.83Å
466	Y	39.8	Very low	49.2	Very low	216 Å²	216	117.4 Å²	117.4	85%	0.847	60%	0.604	S	S	*	*			trans	72.2	97.9	177.5	-47.6	-71.6	0	0	0	116.4
467	G	39.8	Very low	49.8	Very low	72 Å²	72	115.4 Å²	115.4	74%	0.742	60%	0.596	S	S	*	*			trans	-80.9	160.2	-179.9	0	0	0	0	0	116	G469	G467-G469 PolarHBondContact O-N 2.87Å
468	Q	42.8	Very low	50.4	Low	162 Å²	162	113.8 Å²	113.8	76%	0.757	59%	0.589	S	S	*	*	S	Bend	trans	55.4	-17.6	158.3	-93.1	171.3	-35	0	0	121.1	Y661	Q468-Y661 PolarHBondContact OE1-OH 3.2Å
469	G	43.8	Very low	51.2	Low	72 Å²	72	111.3 Å²	111.3	74%	0.742	59%	0.586	S	S	*	*	S	Bend	trans	-105.2	2.6	-172.1	0	0	0	0	0	117.7	G467	G467-G469 PolarHBondContact O-N 2.87Å
470	R	45	Very low	51.9	Low	183 Å²	183	111.7 Å²	111.7	69%	0.691	59%	0.593	S	S	*	*			trans	-138.6	18.1	-169.4	-102.4	-174.1	-175.2	-175.6	2.2	116.8	D472 M473 F474	R470-D472 PolarHBondContact O-N 2.93Å; R470-D472 VanDerWaalsContact O-N 3.12Å; R470-M473 PolarHBondContact O-N 2.73Å; R470-F474 PolarHBondContact O-N 2.97Å
471	N	50.5	Low	52.5	Low	96 Å²	96	112 Å²	112	51%	0.513	59%	0.586	S	S	.	*	H	α-helix	trans	-53.4	-36.7	-175.9	-84.2	-48.5	0	0	0	114	F474 K475	N471-F474 PolarHBondContact O-N 3.45Å; N471-K475 WeakPolarHBondContact O-CG 3.33Å; N471-K475 PolarHBondContact O-N 2.64Å
472	D	49.2	Very low	53.1	Low	111 Å²	111	115.3 Å²	115.3	59%	0.594	59%	0.586	S	S	*	*	H	α-helix	trans	-76.7	-29.8	-173.9	-51.1	-60.4	0	0	0	112.9	R470 F474 K475 Q476	R470-D472 PolarHBondContact O-N 2.93Å; R470-D472 VanDerWaalsContact O-N 3.12Å; D472-F474 VanDerWaalsContact C-N 3.34Å; D472-K475 IonicContact OD1-NZ 2.65Å; D472-K475 PolarHBondContact OD1-NZ 2.95Å; D472-Q476 WeakPolarHBondContact O-CB 3.38Å; D472-Q476 PolarHBondContact O-N 3.29Å
473	M	48.3	Very low	54.3	Low	99 Å²	99	115.8 Å²	115.8	49%	0.488	59%	0.588	S	S	.	*	H	α-helix	trans	-68.2	-35.5	170.2	-171.2	-176.3	-68.1	0	0	111.5	R470 N477	R470-M473 PolarHBondContact O-N 2.73Å; M473-N477 PolarHBondContact O-N 3.43Å
474	F	56.7	Low	55.3	Low	106 Å²	106	115.2 Å²	115.2	47%	0.465	58%	0.575	S	S	.	*	H	α-helix	trans	-68.9	-47.5	174.4	-173.4	-94	0	0	0	111.4	R470 N471 D472 Q476 N477 Q478	R470-F474 PolarHBondContact O-N 2.97Å; N471-F474 PolarHBondContact O-N 3.45Å; D472-F474 VanDerWaalsContact C-N 3.34Å; F474-Q476 VanDerWaalsContact C-N 3.32Å; F474-Q476 PolarHBondContact O-N 3.14Å; F474-N477 PolarHBondContact O-N 2.73Å; F474-Q478 WeakPolarHBondContact O-CB 3.19Å; F474-Q478 PolarHBondContact O-N 3.46Å
475	K	59.7	Low	56.4	Low	122 Å²	122	111.9 Å²	111.9	53%	0.53	55%	0.554	S	S	.	*	H	α-helix	trans	-57.8	-42.3	172.8	-72.5	172.2	-175.9	169.2	0	112	N471 D472 Q478 A479	N471-K475 WeakPolarHBondContact O-CG 3.33Å; N471-K475 PolarHBondContact O-N 2.64Å; D472-K475 IonicContact OD1-NZ 2.65Å; D472-K475 PolarHBondContact OD1-NZ 2.95Å; K475-Q478 PolarHBondContact O-N 3.05Å; K475-A479 WeakPolarHBondContact O-CB 3.49Å; K475-A479 PolarHBondContact O-N 3.17Å
476	Q	63.2	Low	57.3	Low	137 Å²	137	108.7 Å²	108.7	64%	0.64	55%	0.547	S	S	*	.	H	α-helix	trans	-66.1	-45.3	179.6	-169.7	175.7	37.5	0	0	111.6	D472 F474 Q478 A479 L480	D472-Q476 WeakPolarHBondContact O-CB 3.38Å; D472-Q476 PolarHBondContact O-N 3.29Å; F474-Q476 VanDerWaalsContact C-N 3.32Å; F474-Q476 PolarHBondContact O-N 3.14Å; Q476-Q478 PolarHBondContact O-N 3.16Å; Q476-A479 PolarHBondContact O-N 2.77Å; Q476-L480 WeakPolarHBondContact O-CB 3.43Å; Q476-L480 PolarHBondContact O-N 3Å
477	N	61.5	Low	58.7	Low	69 Å²	69	103.8 Å²	103.8	37%	0.369	53%	0.532	S	S	.	.	H	α-helix	trans	-62.2	-40.9	173.3	-97.2	-34.2	0	0	0	112.2	M473 F474 L480 M481	M473-N477 PolarHBondContact O-N 3.43Å; F474-N477 PolarHBondContact O-N 2.73Å; N477-L480 PolarHBondContact O-N 3.34Å; N477-M481 WeakPolarHBondContact O-CB 3.42Å; N477-M481 PolarHBondContact O-N 3.44Å
478	Q	65.9	Low	59.9	Low	107 Å²	107	102.6 Å²	102.6	50%	0.5	51%	0.507	S	S	.	.	H	α-helix	trans	-63.8	-40.7	176.4	-174.6	174.6	79.4	0	0	111.8	F474 K475 Q476 M481 Y482	F474-Q478 WeakPolarHBondContact O-CB 3.19Å; F474-Q478 PolarHBondContact O-N 3.46Å; K475-Q478 PolarHBondContact O-N 3.05Å; Q476-Q478 PolarHBondContact O-N 3.16Å; Q478-M481 PolarHBondContact O-N 2.74Å; Q478-Y482 PolarHBondContact O-N 2.91Å
479	A	67.2	Low	61.1	Low	60 Å²	60	99 Å²	99	50%	0.496	49%	0.49	S	S	.	.	H	α-helix	trans	-65.8	-39.8	174.2	0	0	0	0	0	112.3	K475 Q476 Y482 Q483	K475-A479 WeakPolarHBondContact O-CB 3.49Å; K475-A479 PolarHBondContact O-N 3.17Å; Q476-A479 PolarHBondContact O-N 2.77Å; A479-Y482 PolarHBondContact O-N 2.84Å; A479-Q483 WeakPolarHBondContact O-CB 3.18Å; A479-Q483 PolarHBondContact O-N 3.07Å
480	L	66.5	Low	62	Low	88 Å²	88	99 Å²	99	46%	0.461	48%	0.478	S	S	.	.	H	α-helix	trans	-64.1	-41.1	175.3	-123.8	159.9	0	0	0	111.7	Q476 N477 Q483 Q484	Q476-L480 WeakPolarHBondContact O-CB 3.43Å; Q476-L480 PolarHBondContact O-N 3Å; N477-L480 PolarHBondContact O-N 3.34Å; L480-Q483 PolarHBondContact O-N 3.01Å; L480-Q484 WeakPolarHBondContact O-CB 3.39Å; L480-Q484 PolarHBondContact O-N 3.46Å
481	M	62.7	Low	62.9	Low	62 Å²	62	93.6 Å²	93.6	31%	0.305	46%	0.461	S	S	.	.	H	α-helix	trans	-61.4	-45.9	172.1	-170.6	-160.1	-62.7	0	0	111.2	M456 Y459 N477 Q478 Q483 Q484 Q485	M456-M481 HydrophobicContact SD-CE 4.37Å; M456-M481 HydrophobicContact SD-SD 4.41Å; Y459-M481 HydrophobicContact CD2-CE 4.23Å; N477-M481 WeakPolarHBondContact O-CB 3.42Å; N477-M481 PolarHBondContact O-N 3.44Å; Q478-M481 PolarHBondContact O-N 2.74Å; M481-Q483 PolarHBondContact O-N 3.42Å; M481-Q484 PolarHBondContact O-N 3.11Å; M481-Q485 WeakPolarHBondContact O-CB 3.43Å; M481-Q485 PolarHBondContact O-N 3.31Å
482	Y	64.7	Low	63.6	Low	155 Å²	155	92.6 Å²	92.6	61%	0.608	45%	0.453	S	S	*	.	H	α-helix	trans	-64	-40	178.4	-125.9	-86.5	0	0	0	112.5	Q478 A479 Q485 M486	Q478-Y482 PolarHBondContact O-N 2.91Å; A479-Y482 PolarHBondContact O-N 2.84Å; Y482-Q485 PolarHBondContact O-N 3Å; Y482-M486 WeakPolarHBondContact O-CB 3.45Å; Y482-M486 WeakPolarHBondContact O-CG 3.32Å; Y482-M486 PolarHBondContact O-N 3.22Å
483	Q	72.7	Confident	64.3	Low	134 Å²	134	93.6 Å²	93.6	63%	0.626	45%	0.454	S	S	*	.	H	α-helix	trans	-63.7	-45.3	175.1	-173.9	179.6	47.7	0	0	111.2	A479 L480 M481 Q485 M486 Q487	A479-Q483 WeakPolarHBondContact O-CB 3.18Å; A479-Q483 PolarHBondContact O-N 3.07Å; L480-Q483 PolarHBondContact O-N 3.01Å; M481-Q483 PolarHBondContact O-N 3.42Å; Q483-Q485 PolarHBondContact O-N 3.49Å; Q483-M486 PolarHBondContact O-N 3.47Å; Q483-Q487 WeakPolarHBondContact O-CB 3.44Å; Q483-Q487 PolarHBondContact O-N 3.4Å
484	Q	68.9	Low	65	Low	55 Å²	55	94 Å²	94	26%	0.257	46%	0.455	S	S	.	.	H	α-helix	trans	-64.2	-39.5	176.5	-167	-175.4	102.1	0	0	111.8	L480 M481 Q487 Q488	L480-Q484 WeakPolarHBondContact O-CB 3.39Å; L480-Q484 PolarHBondContact O-N 3.46Å; M481-Q484 PolarHBondContact O-N 3.11Å; Q484-Q487 PolarHBondContact O-N 2.71Å; Q484-Q488 WeakPolarHBondContact O-CG 3.43Å; Q484-Q488 PolarHBondContact O-N 2.94Å
485	Q	69.1	Low	65.2	Low	73 Å²	73	93.8 Å²	93.8	34%	0.341	46%	0.455	S	S	.	.	H	α-helix	trans	-65.6	-41.8	176.3	-169.3	178.9	66.3	0	0	111.9	M481 Y482 Q483 Q487 Q488 Q489	M481-Q485 WeakPolarHBondContact O-CB 3.43Å; M481-Q485 PolarHBondContact O-N 3.31Å; Y482-Q485 PolarHBondContact O-N 3Å; Q483-Q485 PolarHBondContact O-N 3.49Å; Q485-Q487 VanDerWaalsContact C-N 3.34Å; Q485-Q487 PolarHBondContact O-N 2.87Å; Q485-Q488 PolarHBondContact O-N 3.48Å; Q485-Q489 WeakPolarHBondContact O-CB 3.31Å; Q485-Q489 PolarHBondContact O-N 3.32Å
486	M	66.2	Low	65.2	Low	104 Å²	104	93.9 Å²	93.9	51%	0.512	46%	0.458	S	S	.	.	H	α-helix	trans	-61.2	-40.8	172.5	-77.7	-71.2	-66.4	0	0	112	Y482 Q483 Q489 S490	Y482-M486 WeakPolarHBondContact O-CB 3.45Å; Y482-M486 WeakPolarHBondContact O-CG 3.32Å; Y482-M486 PolarHBondContact O-N 3.22Å; Q483-M486 PolarHBondContact O-N 3.47Å; M486-Q489 PolarHBondContact O-N 3.35Å; M486-S490 PolarHBondContact O-N 3.09Å
487	Q	68.5	Low	64.9	Low	113 Å²	113	94 Å²	94	53%	0.528	46%	0.459	S	S	.	.	H	α-helix	trans	-67.7	-38.7	178.6	-163.1	170.8	48.2	0	0	112.2	Q483 Q484 Q485 S490 Q491	Q483-Q487 WeakPolarHBondContact O-CB 3.44Å; Q483-Q487 PolarHBondContact O-N 3.4Å; Q484-Q487 PolarHBondContact O-N 2.71Å; Q485-Q487 VanDerWaalsContact C-N 3.34Å; Q485-Q487 PolarHBondContact O-N 2.87Å; Q487-S490 PolarHBondContact O-N 3.11Å; Q487-Q491 PolarHBondContact O-N 3.41Å; Q487-Q491 VanDerWaalsContact O-N 3.12Å
488	Q	65.6	Low	64.7	Low	47 Å²	47	92.8 Å²	92.8	22%	0.22	45%	0.454	C	S	.	.	H	α-helix	trans	-64.2	-41	171	-71.9	172.7	19.1	0	0	112.1	Q484 Q485 S490 Q491 Q492	Q484-Q488 WeakPolarHBondContact O-CG 3.43Å; Q484-Q488 PolarHBondContact O-N 2.94Å; Q485-Q488 PolarHBondContact O-N 3.48Å; Q488-S490 VanDerWaalsContact C-N 3.33Å; Q488-S490 PolarHBondContact O-N 2.94Å; Q488-Q491 PolarHBondContact O-N 3.13Å; Q488-Q492 PolarHBondContact O-N 3.29Å
489	Q	68.1	Low	64.3	Low	85 Å²	85	90 Å²	90	40%	0.397	45%	0.448	S	S	.	.	H	α-helix	trans	-65.2	-36.7	178.9	-160.5	167.3	107.1	0	0	111.7	Q485 M486 Q492 Q493	Q485-Q489 WeakPolarHBondContact O-CB 3.31Å; Q485-Q489 PolarHBondContact O-N 3.32Å; M486-Q489 PolarHBondContact O-N 3.35Å; Q489-Q492 PolarHBondContact O-N 3.26Å; Q489-Q493 PolarHBondContact O-N 3.02Å
490	S	62.6	Low	63.4	Low	72 Å²	72	94.2 Å²	94.2	50%	0.503	45%	0.453	S	S	.	.	H	α-helix	trans	-63.8	-47.7	171.7	177.8	0	0	0	0	112.3	M486 Q487 Q488 Q492 Q493 Q494	M486-S490 PolarHBondContact O-N 3.09Å; Q487-S490 PolarHBondContact O-N 3.11Å; Q488-S490 VanDerWaalsContact C-N 3.33Å; Q488-S490 PolarHBondContact O-N 2.94Å; S490-Q492 VanDerWaalsContact C-N 3.32Å; S490-Q492 PolarHBondContact O-N 3.4Å; S490-Q493 PolarHBondContact O-N 3.18Å; S490-Q494 PolarHBondContact O-N 3.45Å
491	Q	63.9	Low	62.6	Low	71 Å²	71	92.9 Å²	92.9	33%	0.332	45%	0.45	S	S	.	.	H	α-helix	trans	-61.8	-37.1	176.4	-73.4	-172.6	5.4	0	0	112.7	Q487 Q488 Q494 Q495	Q487-Q491 PolarHBondContact O-N 3.41Å; Q487-Q491 VanDerWaalsContact O-N 3.12Å; Q488-Q491 PolarHBondContact O-N 3.13Å; Q491-Q494 PolarHBondContact O-N 2.96Å; Q491-Q495 WeakPolarHBondContact O-CG 3.18Å; Q491-Q495 PolarHBondContact O-N 3.41Å
492	Q	64	Low	62.2	Low	75 Å²	75	93.7 Å²	93.7	35%	0.35	45%	0.453	S	S	.	.	H	α-helix	trans	-64.3	-41.4	175.2	-78.9	-165.7	6.6	0	0	112.8	Q488 Q489 S490 Q494 Q495 Q496	Q488-Q492 PolarHBondContact O-N 3.29Å; Q489-Q492 PolarHBondContact O-N 3.26Å; S490-Q492 VanDerWaalsContact C-N 3.32Å; S490-Q492 PolarHBondContact O-N 3.4Å; Q492-Q494 VanDerWaalsContact C-N 3.34Å; Q492-Q495 PolarHBondContact O-N 2.67Å; Q492-Q496 WeakPolarHBondContact O-CB 3.26Å; Q492-Q496 WeakPolarHBondContact O-CG 3.49Å; Q492-Q496 PolarHBondContact O-N 2.73Å
493	Q	64.4	Low	61.6	Low	131 Å²	131	93.2 Å²	93.2	61%	0.612	45%	0.451	S	S	*	.	H	α-helix	trans	-63.5	-41.2	174.5	-78.2	-169.8	-30	0	0	111.7	Q489 S490 Q496 Q497	Q489-Q493 PolarHBondContact O-N 3.02Å; S490-Q493 PolarHBondContact O-N 3.18Å; Q493-Q496 PolarHBondContact O-N 3.28Å; Q493-Q497 PolarHBondContact O-N 2.95Å
494	Q	63.2	Low	60.5	Low	109 Å²	109	93 Å²	93	51%	0.509	45%	0.45	S	S	.	.	H	α-helix	trans	-65.9	-41	179.1	-153.3	170.5	55.3	0	0	111.9	S490 Q491 Q492 Q497 V498	S490-Q494 PolarHBondContact O-N 3.45Å; Q491-Q494 PolarHBondContact O-N 2.96Å; Q492-Q494 VanDerWaalsContact C-N 3.34Å; Q494-Q497 PolarHBondContact O-N 3.02Å; Q494-V498 WeakPolarHBondContact O-CG2 3.49Å; Q494-V498 PolarHBondContact O-N 3.19Å
495	Q	59.8	Low	59.3	Low	100 Å²	100	93.7 Å²	93.7	47%	0.467	45%	0.454	S	S	.	.	H	α-helix	trans	-64.5	-39.2	171.8	-72.3	-175.9	25.4	0	0	112.6	Q491 Q492 V498 A499	Q491-Q495 WeakPolarHBondContact O-CG 3.18Å; Q491-Q495 PolarHBondContact O-N 3.41Å; Q492-Q495 PolarHBondContact O-N 2.67Å; Q495-V498 PolarHBondContact O-N 3.23Å; Q495-A499 WeakPolarHBondContact O-CB 3.5Å; Q495-A499 PolarHBondContact O-N 2.75Å
496	Q	61.3	Low	58	Low	124 Å²	124	96.3 Å²	96.3	58%	0.579	47%	0.466	S	S	*	.	H	α-helix	trans	-65.4	-41.1	176.1	-76.3	-177.1	30.8	0	0	112.2	Q492 Q493 A499 Y500	Q492-Q496 WeakPolarHBondContact O-CB 3.26Å; Q492-Q496 WeakPolarHBondContact O-CG 3.49Å; Q492-Q496 PolarHBondContact O-N 2.73Å; Q493-Q496 PolarHBondContact O-N 3.28Å; Q496-A499 PolarHBondContact O-N 3.15Å; Q496-Y500 WeakPolarHBondContact O-CB 3.45Å; Q496-Y500 PolarHBondContact O-N 3.19Å
497	Q	56.5	Low	57	Low	141 Å²	141	99 Å²	99	66%	0.659	48%	0.477	S	S	*	.	H	α-helix	trans	-62.8	-43.8	174.4	-76.1	-179.5	-18.2	0	0	112	Q493 Q494 A499 Y500 S501	Q493-Q497 PolarHBondContact O-N 2.95Å; Q494-Q497 PolarHBondContact O-N 3.02Å; Q497-A499 PolarHBondContact O-N 3.05Å; Q497-Y500 PolarHBondContact O-N 2.98Å; Q497-S501 WeakPolarHBondContact O-CB 3.5Å; Q497-S501 PolarHBondContact O-N 3.31Å
498	V	57.4	Low	55.6	Low	43 Å²	43	97.8 Å²	97.8	26%	0.261	48%	0.481	S	S	.	.	H	α-helix	trans	-59.4	-46.5	174.5	168	0	0	0	0	111.2	Q494 Q495 Y500 S501 Q502	Q494-V498 WeakPolarHBondContact O-CG2 3.49Å; Q494-V498 PolarHBondContact O-N 3.19Å; Q495-V498 PolarHBondContact O-N 3.23Å; V498-Y500 PolarHBondContact O-N 3.36Å; V498-S501 PolarHBondContact O-N 2.91Å; V498-Q502 WeakPolarHBondContact O-CG 3.21Å; V498-Q502 PolarHBondContact O-N 2.85Å
499	A	57.2	Low	54.3	Low	47 Å²	47	99.4 Å²	99.4	39%	0.388	49%	0.494	S	S	.	.	H	α-helix	trans	-65.9	-35.2	177.8	0	0	0	0	0	113.1	Q495 Q496 Q497 R503	Q495-A499 WeakPolarHBondContact O-CB 3.5Å; Q495-A499 PolarHBondContact O-N 2.75Å; Q496-A499 PolarHBondContact O-N 3.15Å; Q497-A499 PolarHBondContact O-N 3.05Å; A499-R503 PolarHBondContact O-N 3.02Å; A499-R503 VanDerWaalsContact O-N 3.1Å
500	Y	47.7	Very low	52.8	Low	150 Å²	150	106 Å²	106	59%	0.588	52%	0.515	S	S	*	.	H	α-helix	trans	-67.2	-43.5	174.7	-126.7	-82.2	0	0	0	111.6	Q496 Q497 V498 R503 Q504	Q496-Y500 WeakPolarHBondContact O-CB 3.45Å; Q496-Y500 PolarHBondContact O-N 3.19Å; Q497-Y500 PolarHBondContact O-N 2.98Å; V498-Y500 PolarHBondContact O-N 3.36Å; Y500-R503 PolarHBondContact O-N 2.77Å; Y500-Q504 WeakPolarHBondContact O-CG 3.36Å; Y500-Q504 PolarHBondContact O-N 3.48Å
501	S	50.5	Low	51.7	Low	59 Å²	59	108 Å²	108	41%	0.413	53%	0.527	S	S	.	.	H	α-helix	trans	-63.8	-45.2	177.4	-176.6	0	0	0	0	111.9	Q497 V498 R503 Q504 M505	Q497-S501 WeakPolarHBondContact O-CB 3.5Å; Q497-S501 PolarHBondContact O-N 3.31Å; V498-S501 PolarHBondContact O-N 2.91Å; S501-R503 PolarHBondContact O-N 3Å; S501-Q504 PolarHBondContact O-N 3.34Å; S501-M505 PolarHBondContact O-N 3.02Å
502	Q	53.8	Low	50.1	Low	79 Å²	79	116.5 Å²	116.5	37%	0.369	56%	0.557	S	S	.	*	H	α-helix	trans	-58.9	-48.4	174.2	-73.1	-177.4	1.7	0	0	111.7	V498 Q504 M505 E506	V498-Q502 WeakPolarHBondContact O-CG 3.21Å; V498-Q502 PolarHBondContact O-N 2.85Å; Q502-Q504 PolarHBondContact O-N 2.9Å; Q502-M505 PolarHBondContact O-N 3.31Å; Q502-M505 VanDerWaalsContact O-N 3.17Å; Q502-E506 PolarHBondContact O-N 3.19Å
503	R	53.2	Low	48.6	Very low	145 Å²	145	116 Å²	116	55%	0.547	57%	0.572	S	S	.	*	H	α-helix	trans	-64.9	-34.5	178.6	-72.7	-155.1	-62.2	-169.4	1.5	113.9	A499 Y500 S501 E506 H507	A499-R503 PolarHBondContact O-N 3.02Å; A499-R503 VanDerWaalsContact O-N 3.1Å; Y500-R503 PolarHBondContact O-N 2.77Å; S501-R503 PolarHBondContact O-N 3Å; R503-E506 PolarHBondContact O-N 3.4Å; R503-H507 PolarHBondContact O-N 3.37Å; R503-H507 PolarHBondContact O-ND1 3.06Å
504	Q	49.1	Very low	47.1	Very low	130 Å²	130	117.6 Å²	117.6	61%	0.607	58%	0.58	S	S	*	*	H	α-helix	trans	-67.5	-36.6	173.7	-74.4	-170.3	9.6	0	0	112.1	Y500 S501 Q502 H507 S508	Y500-Q504 WeakPolarHBondContact O-CG 3.36Å; Y500-Q504 PolarHBondContact O-N 3.48Å; S501-Q504 PolarHBondContact O-N 3.34Å; Q502-Q504 PolarHBondContact O-N 2.9Å; Q504-H507 PolarHBondContact O-N 3.04Å; Q504-S508 PolarHBondContact O-N 3.18Å
505	M	43.7	Very low	45.5	Very low	70 Å²	70	119.9 Å²	119.9	35%	0.345	59%	0.59	S	S	.	*	H	α-helix	trans	-67.3	-40.6	174.3	-71.5	-143.7	-73.5	0	0	112.8	S501 Q502 H507 S508 M587	S501-M505 PolarHBondContact O-N 3.02Å; Q502-M505 PolarHBondContact O-N 3.31Å; Q502-M505 VanDerWaalsContact O-N 3.17Å; M505-H507 PolarHBondContact O-N 3.04Å; M505-S508 PolarHBondContact O-N 3.14Å; M505-S508 VanDerWaalsContact O-N 3.11Å; M505-M587 HydrophobicContact CE-SD 4.19Å
506	E	41.7	Very low	44.3	Very low	127 Å²	127	124 Å²	124	59%	0.593	61%	0.61	S	S	*	*	H	α-helix	trans	-60.4	-31.6	175.7	-71.6	-177	144.8	0	0	113.1	Q502 R503 S508	Q502-E506 PolarHBondContact O-N 3.19Å; R503-E506 PolarHBondContact O-N 3.4Å; E506-S508 VanDerWaalsContact C-N 3.35Å
507	H	43.8	Very low	42.8	Very low	161 Å²	161	128.3 Å²	128.3	75%	0.745	63%	0.627	S	S	*	*	H	α-helix	trans	-84.2	-8.7	179.2	-71	32	0	0	0	113.6	R503 Q504 M505	R503-H507 PolarHBondContact O-N 3.37Å; R503-H507 PolarHBondContact O-ND1 3.06Å; Q504-H507 PolarHBondContact O-N 3.04Å; M505-H507 PolarHBondContact O-N 3.04Å
508	S	40	Very low	41.9	Very low	88 Å²	88	125.2 Å²	125.2	62%	0.615	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	-2.5	179.7	-160.3	0	0	0	0	113.6	Q504 M505 E506	Q504-S508 PolarHBondContact O-N 3.18Å; M505-S508 PolarHBondContact O-N 3.14Å; M505-S508 VanDerWaalsContact O-N 3.11Å; E506-S508 VanDerWaalsContact C-N 3.35Å
509	V	39	Very low	40.9	Very low	81 Å²	81	131.5 Å²	131.5	49%	0.491	66%	0.663	S	S	.	*			trans	-129.5	65.6	-176.4	-166.1	0	0	0	0	111.8
510	R	35.4	Very low	39.8	Very low	223 Å²	223	132.6 Å²	132.6	84%	0.842	68%	0.679	S	S	*	*			trans	-87.7	120	158	-82.9	-168	171.9	-158.8	-2	109.7	Y512	R510-Y512 PolarHBondContact O-N 3.27Å
511	P	40.8	Very low	39.4	Very low	115 Å²	115	131.2 Å²	131.2	75%	0.747	69%	0.688	S	S	*	*			trans	-67.7	126.4	171.6	-15.5	29.8	0	0	0	110.1	G513	P511-G513 PolarHBondContact O-N 3.02Å; P511-G513 VanDerWaalsContact O-N 3.12Å
512	Y	29.2	Very low	38.8	Very low	248 Å²	248	136.9 Å²	136.9	97%	0.973	71%	0.708	S	S	*	*			trans	-73.9	97.9	161.9	-93.2	-92.8	0	0	0	108.2	R510	R510-Y512 PolarHBondContact O-N 3.27Å
513	G	33.1	Very low	38	Very low	64 Å²	64	137 Å²	137	66%	0.66	72%	0.718	S	S	*	*			trans	-164.2	117.7	-178.2	0	0	0	0	0	113.4	P511	P511-G513 PolarHBondContact O-N 3.02Å; P511-G513 VanDerWaalsContact O-N 3.12Å
514	Q	32.7	Very low	37.2	Very low	166 Å²	166	140.7 Å²	140.7	78%	0.776	73%	0.733	S	S	*	*			trans	74.9	108.8	153.5	-154.7	149.7	13.6	0	0	119.7
515	E	29.3	Very low	36.6	Very low	157 Å²	157	138.3 Å²	138.3	73%	0.734	74%	0.744	S	S	*	*			trans	42.1	129.7	134.3	-56.6	172.8	133.8	0	0	119.2
516	Q	34.6	Very low	36.3	Very low	186 Å²	186	142.3 Å²	142.3	87%	0.869	77%	0.765	S	S	*	*				-157.8	158.2	70.3	-85.4	173.3	-0.3	0	0	113.4
517	F	30.5	Very low	36.1	Very low	214 Å²	214	141.9 Å²	141.9	94%	0.939	78%	0.776	S	S	*	*			trans	-83.1	131.7	170.4	-82.7	-104.9	0	0	0	111.2
518	G	36.6	Very low	35.8	Very low	77 Å²	77	142.1 Å²	142.1	79%	0.794	78%	0.778	S	S	*	*			trans	-129.6	128.2	169.2	0	0	0	0	0	110.6
519	I	36.4	Very low	35.6	Very low	175 Å²	175	146.9 Å²	146.9	90%	0.897	79%	0.79	S	S	*	*			trans	-102.8	131.9	-172	-62.5	162.5	0	0	0	110.4
520	G	34.4	Very low	35.6	Very low	70 Å²	70	149 Å²	149	72%	0.722	81%	0.805	S	S	*	*			trans	-169.7	121.9	173.3	0	0	0	0	0	111.4
521	P	39.5	Very low	35.8	Very low	120 Å²	120	145.8 Å²	145.8	78%	0.779	81%	0.81	S	S	*	*			trans	-108	168.9	-167.3	40.1	-35.9	0	0	0	115.2
522	Q	38.4	Very low	35.6	Very low	178 Å²	178	144.6 Å²	144.6	83%	0.832	81%	0.81	S	S	*	*			trans	145.1	143.9	157	-74.3	-104.6	26.3	0	0	108.6
523	S	36.1	Very low	35.9	Very low	81 Å²	81	144 Å²	144	57%	0.566	81%	0.806	S	S	*	*			cis	-161.6	143.8	-21.3	-110.6	0	0	0	0	110.6
524	Y	36.1	Very low	36.1	Very low	223 Å²	223	152.3 Å²	152.3	88%	0.875	82%	0.818	S	S	*	*			trans	23.7	125.9	162.5	-62.1	-85	0	0	0	122.5
525	G	37	Very low	36.4	Very low	80 Å²	80	153 Å²	153	83%	0.825	82%	0.821	S	S	*	*			trans	-165.3	90.1	167.3	0	0	0	0	0	113.2
526	I	38.1	Very low	37.3	Very low	154 Å²	154	151.4 Å²	151.4	79%	0.79	82%	0.824	S	S	*	*			trans	-75.5	132.9	-165.3	-63	162.6	0	0	0	114.3
527	S	37.9	Very low	37.7	Very low	118 Å²	118	148 Å²	148	83%	0.825	82%	0.818	S	S	*	*			trans	-163.7	169.9	131.8	-158.3	0	0	0	0	111.9
528	Q	37.4	Very low	38.3	Very low	167 Å²	167	144 Å²	144	78%	0.78	81%	0.813	S	S	*	*			trans	-124.2	143.1	-162.9	-51.4	177.3	18.2	0	0	114.2
529	Q	35.6	Very low	38.6	Very low	188 Å²	188	145.4 Å²	145.4	88%	0.879	82%	0.818	S	S	*	*				168.4	129.1	120.6	-93.6	-177.3	11.4	0	0	112.1
530	P	37.8	Very low	38.6	Very low	124 Å²	124	142.4 Å²	142.4	81%	0.805	82%	0.819	S	S	*	*			trans	-116.7	146.1	172.4	37.9	-28.1	0	0	0	114.1
531	V	40	Very low	38.8	Very low	157 Å²	157	142.1 Å²	142.1	95%	0.952	82%	0.816	S	S	*	*			trans	-133.4	134.2	162.3	-178	0	0	0	0	108.4
532	A	36.1	Very low	38.8	Very low	90 Å²	90	144.4 Å²	144.4	74%	0.744	82%	0.82	S	S	*	*			trans	-127	148.1	-165.7	0	0	0	0	0	114
533	R	36.2	Very low	38.8	Very low	236 Å²	236	139.4 Å²	139.4	89%	0.891	81%	0.809	S	S	*	*			trans	-157.2	99.5	156.4	-114	173.9	-169	-148.9	2.4	115
534	R	37.4	Very low	38.9	Very low	238 Å²	238	143.8 Å²	143.8	90%	0.898	82%	0.821	S	S	*	*			trans	52.8	116.7	138.2	-60.2	-178.3	178	-127.6	-0.8	121.5
535	Q	39.2	Very low	38.9	Very low	180 Å²	180	139.3 Å²	139.3	84%	0.841	81%	0.808	S	S	*	*			trans	-88.1	179.6	134.6	-66.5	-179	-20.9	0	0	109.8
536	P	47.8	Very low	38.9	Very low	123 Å²	123	144.5 Å²	144.5	80%	0.799	80%	0.803	S	S	*	*				-148.8	-147.9	93	46.7	-26.9	0	0	0	113
537	P	44.1	Very low	38.9	Very low	115 Å²	115	145 Å²	145	75%	0.747	80%	0.799	S	S	*	*				-129.3	179.2	-122.9	32.4	-7	0	0	0	117.1
538	P	41.3	Very low	38.8	Very low	129 Å²	129	146.4 Å²	146.4	84%	0.838	80%	0.797	S	S	*	*			trans	-96.6	168	174.8	37.7	-35	0	0	0	114.9
539	A	44	Very low	38.9	Very low	108 Å²	108	142.8 Å²	142.8	89%	0.893	79%	0.79	S	S	*	*			trans	-137.8	169.5	175	0	0	0	0	0	111.8
540	A	36.3	Very low	39	Very low	111 Å²	111	139.2 Å²	139.2	92%	0.917	79%	0.786	S	S	*	*			trans	-137.1	161.6	-161	0	0	0	0	0	116.5
541	G	38.7	Very low	38.9	Very low	65 Å²	65	142 Å²	142	67%	0.67	79%	0.788	S	S	*	*			trans	142.6	159.6	165.4	0	0	0	0	0	114.1
542	I	39.7	Very low	38.8	Very low	168 Å²	168	137.5 Å²	137.5	86%	0.862	77%	0.773	S	S	*	*			cis	-168.7	139.2	-35.6	-116	159.8	0	0	0	108.9
543	A	38.5	Very low	39.1	Very low	73 Å²	73	144.1 Å²	144.1	60%	0.603	78%	0.78	S	S	*	*			trans	62.2	136.6	154.5	0	0	0	0	0	125.4
544	Q	38.1	Very low	39.8	Very low	172 Å²	172	138.3 Å²	138.3	80%	0.804	77%	0.773	S	S	*	*			trans	68.6	154.1	131.5	-72.8	167.6	4.5	0	0	121.3
545	Q	35.9	Very low	39.9	Very low	130 Å²	130	132 Å²	132	61%	0.607	77%	0.772	S	S	*	*			cis	-165.3	156.4	-25.2	-126	-177.9	26.9	0	0	111.8
546	R	37	Very low	39.7	Very low	189 Å²	189	127.2 Å²	127.2	71%	0.713	77%	0.771	S	S	*	*			trans	73.7	122.9	150.2	-69.8	-177.8	-143.5	-147.6	4.4	124.8
547	F	37.9	Very low	39.2	Very low	163 Å²	163	126.6 Å²	126.6	72%	0.715	77%	0.769	S	S	*	*				80.3	125.8	122.6	-74.4	-38.7	0	0	0	126.3
548	L	36.8	Very low	38.8	Very low	149 Å²	149	128.9 Å²	128.9	78%	0.78	77%	0.774	S	S	*	*			trans	71.2	150.9	133.2	-63.4	175.2	0	0	0	119.6
549	S	39.1	Very low	38.5	Very low	90 Å²	90	127.9 Å²	127.9	63%	0.629	77%	0.769	S	S	*	*			cis	-170.4	157.3	-7.3	42.6	0	0	0	0	114
550	S	37.5	Very low	38.1	Very low	113 Å²	113	126.8 Å²	126.8	79%	0.79	77%	0.769	S	S	*	*			trans	70.1	162	158.6	85.9	0	0	0	0	117
551	Q	36.3	Very low	38.1	Very low	184 Å²	184	126.3 Å²	126.3	86%	0.86	76%	0.755	S	S	*	*			cis	-166.7	143	-21.1	-112.3	-89.7	22.4	0	0	106.4
552	G	38	Very low	37.9	Very low	61 Å²	61	134.3 Å²	134.3	63%	0.629	77%	0.766	S	S	*	*			trans	155.8	129.8	174.1	0	0	0	0	0	117
553	Y	40.9	Very low	37.9	Very low	230 Å²	230	129.5 Å²	129.5	90%	0.902	76%	0.758	S	S	*	*			trans	-159.3	171.2	-179.4	-88.4	-69.1	0	0	0	107.7
554	P	50.7	Low	37.8	Very low	113 Å²	113	133.9 Å²	133.9	73%	0.734	77%	0.772	S	S	*	*			cis	-134.5	-171	-9.3	32.8	-10.8	0	0	0	114.9
555	A	39.6	Very low	37.9	Very low	107 Å²	107	129.3 Å²	129.3	88%	0.884	77%	0.771	S	S	*	*			trans	77.5	122.4	146.5	0	0	0	0	0	121
556	G	36.8	Very low	37.9	Very low	79 Å²	79	129.9 Å²	129.9	81%	0.814	78%	0.783	S	S	*	*			trans	168.4	109.2	170.4	0	0	0	0	0	112.7
557	S	36.5	Very low	37.9	Very low	109 Å²	109	125.4 Å²	125.4	76%	0.762	79%	0.786	S	S	*	*			trans	-45.8	146.2	-173.3	-77.8	0	0	0	0	119.7
558	I	36.5	Very low	38.1	Very low	164 Å²	164	122.9 Å²	122.9	84%	0.841	78%	0.784	S	S	*	*			trans	58.3	95.3	141.8	-53.6	160.3	0	0	0	117.5
559	S	34.8	Very low	38.3	Very low	107 Å²	107	124.5 Å²	124.5	75%	0.748	79%	0.788	S	S	*	*				-176.7	129.2	116.5	-171.4	0	0	0	0	110.5
560	G	34.4	Very low	38.5	Very low	85 Å²	85	128.7 Å²	128.7	88%	0.876	80%	0.799	S	S	*	*			trans	-98.4	90.9	-178	0	0	0	0	0	112.5
561	T	36.2	Very low	39	Very low	101 Å²	101	131.1 Å²	131.1	62%	0.62	80%	0.798	S	S	*	*			trans	-143.2	164.7	170.7	-33.7	0	0	0	0	109
562	Y	35.4	Very low	39.4	Very low	233 Å²	233	127.8 Å²	127.8	91%	0.914	78%	0.782	S	S	*	*			trans	66.1	158.8	-168.1	-47.6	-83.4	0	0	0	112.9
563	G	38.5	Very low	39.9	Very low	67 Å²	67	128.9 Å²	128.9	69%	0.691	78%	0.779	S	S	*	*			cis	166.4	156.3	-6.5	0	0	0	0	0	111.3
564	N	37.9	Very low	40	Very low	166 Å²	166	127.9 Å²	127.9	89%	0.888	77%	0.773	S	S	*	*			trans	-15.7	123.5	179.1	-70.1	-42.5	0	0	0	118.8
565	G	38.5	Very low	39.9	Very low	76 Å²	76	132.3 Å²	132.3	78%	0.784	78%	0.775	S	S	*	*			trans	-135.5	77	170.2	0	0	0	0	0	112.9	A567	G565-A567 PolarHBondContact O-N 2.86Å
566	V	37.3	Very low	40.2	Very low	142 Å²	142	133.6 Å²	133.6	86%	0.861	77%	0.765	S	S	*	*			trans	-88.9	91.8	-174.4	-175.9	0	0	0	0	111.4
567	A	37	Very low	41.1	Very low	94 Å²	94	134.6 Å²	134.6	78%	0.777	75%	0.75	S	S	*	*			trans	-158.3	19.7	177.2	0	0	0	0	0	119.2	G565	G565-A567 PolarHBondContact O-N 2.86Å
568	T	42.5	Very low	42	Very low	111 Å²	111	135.4 Å²	135.4	68%	0.681	75%	0.746	S	S	*	*			trans	-137.2	20	-170.5	-19.6	0	0	0	0	117.7	M570	T568-M570 PolarHBondContact O-N 3.14Å
569	Q	40.8	Very low	43.2	Very low	183 Å²	183	132.3 Å²	132.3	86%	0.855	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	44	-170.1	-152.9	-179.6	19.3	0	0	115.8
570	M	41.9	Very low	44.5	Very low	178 Å²	178	134 Å²	134	88%	0.877	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.7	0.9	173.5	-140.3	-173.9	-70.5	0	0	117.4	T568	T568-M570 PolarHBondContact O-N 3.14Å
571	Q	47.9	Very low	46.1	Very low	163 Å²	163	133.8 Å²	133.8	76%	0.762	70%	0.7	S	S	*	*	S	Bend	trans	-111.3	-11.8	173	-71.7	-168.9	-3.8	0	0	114.6	P573	Q571-P573 VanDerWaalsContact C-CD 3.48Å
572	Q	45.1	Very low	47.7	Very low	114 Å²	114	131.3 Å²	131.3	53%	0.533	69%	0.689	S	S	.	*	H	α-helix	trans	-57	-40.9	-176.1	-63.7	-179.4	-6.7	0	0	114.3	R574 R575 M576	Q572-R574 PolarHBondContact O-N 3.24Å; Q572-R575 PolarHBondContact O-N 2.89Å; Q572-M576 WeakPolarHBondContact O-CB 3.29Å; Q572-M576 PolarHBondContact O-N 2.97Å
573	P	48.3	Very low	49.3	Very low	85 Å²	85	124.2 Å²	124.2	55%	0.552	67%	0.667	S	S	*	*	H	α-helix	trans	-60.3	-45.6	-177.3	-25.9	35.5	0	0	0	113.9	Q571 R575 M576 I577	Q571-P573 VanDerWaalsContact C-CD 3.48Å; P573-R575 PolarHBondContact O-N 2.88Å; P573-M576 PolarHBondContact O-N 3.28Å; P573-I577 WeakPolarHBondContact O-CG1 3.34Å; P573-I577 PolarHBondContact O-N 3.12Å
574	R	44.3	Very low	50.8	Low	209 Å²	209	123.9 Å²	123.9	79%	0.789	65%	0.648	S	S	*	*	H	α-helix	trans	-66.5	-39	180	-94.1	-173	170.5	-177.1	-2.2	112.4	Q572 I577 L578	Q572-R574 PolarHBondContact O-N 3.24Å; R574-I577 PolarHBondContact O-N 2.91Å; R574-L578 PolarHBondContact O-N 2.83Å
575	R	48.3	Very low	52.4	Low	205 Å²	205	122.6 Å²	122.6	77%	0.774	64%	0.637	S	S	*	*	H	α-helix	trans	-66.1	-38.2	175.1	-112.6	-176.9	170.8	-175.8	-3.9	111.9	Q572 P573 N579	Q572-R575 PolarHBondContact O-N 2.89Å; P573-R575 PolarHBondContact O-N 2.88Å; R575-N579 WeakPolarHBondContact O-CB 3.38Å; R575-N579 PolarHBondContact O-N 2.76Å
576	M	45.7	Very low	54.2	Low	134 Å²	134	124.7 Å²	124.7	66%	0.66	63%	0.626	S	S	*	*	H	α-helix	trans	-66.1	-40.9	176.9	-162.8	-177.3	-65.5	0	0	112.2	Q572 P573 N579 R580	Q572-M576 WeakPolarHBondContact O-CB 3.29Å; Q572-M576 PolarHBondContact O-N 2.97Å; P573-M576 PolarHBondContact O-N 3.28Å; M576-N579 PolarHBondContact O-N 3.4Å; M576-R580 WeakPolarHBondContact O-CB 3.36Å; M576-R580 PolarHBondContact O-N 3.34Å
577	I	56.4	Low	55.9	Low	101 Å²	101	122.4 Å²	122.4	52%	0.518	61%	0.607	S	S	.	*	H	α-helix	trans	-65.8	-46.3	175.9	-67.1	163.2	0	0	0	111.3	P573 R574 N579 R580 N581	P573-I577 WeakPolarHBondContact O-CG1 3.34Å; P573-I577 PolarHBondContact O-N 3.12Å; R574-I577 PolarHBondContact O-N 2.91Å; I577-N579 PolarHBondContact O-N 3.32Å; I577-R580 PolarHBondContact O-N 3.38Å; I577-N581 PolarHBondContact O-N 3.38Å; I577-N581 PolarHBondContact O-OD1 3.09Å
578	L	53.6	Low	57.6	Low	126 Å²	126	123.3 Å²	123.3	66%	0.66	60%	0.595	S	S	*	*	H	α-helix	trans	-60.6	-42.8	176.4	-92.9	150	0	0	0	112.2	R574 N581 A582	R574-L578 PolarHBondContact O-N 2.83Å; L578-N581 PolarHBondContact O-N 3.31Å; L578-A582 PolarHBondContact O-N 3.09Å
579	N	63.4	Low	59.3	Low	98 Å²	98	123 Å²	123	52%	0.524	59%	0.586	S	S	.	*	H	α-helix	trans	-66.4	-39.2	176.6	-160.9	29.3	0	0	0	112	R575 M576 I577 N581 A582 N583	R575-N579 WeakPolarHBondContact O-CB 3.38Å; R575-N579 PolarHBondContact O-N 2.76Å; M576-N579 PolarHBondContact O-N 3.4Å; I577-N579 PolarHBondContact O-N 3.32Å; N579-N581 VanDerWaalsContact C-N 3.35Å; N579-N581 PolarHBondContact O-N 3.42Å; N579-A582 PolarHBondContact O-N 3.49Å; N579-N583 WeakPolarHBondContact O-CB 3.29Å; N579-N583 PolarHBondContact O-N 3.17Å
580	R	62.2	Low	61	Low	142 Å²	142	117.9 Å²	117.9	54%	0.536	56%	0.564	S	S	.	*	H	α-helix	trans	-62.8	-40.2	174.8	-171.2	171.3	-176.4	160.4	-1.1	111.9	M576 I577 M584	M576-R580 WeakPolarHBondContact O-CB 3.36Å; M576-R580 PolarHBondContact O-N 3.34Å; I577-R580 PolarHBondContact O-N 3.38Å; R580-M584 WeakPolarHBondContact O-CB 3.48Å; R580-M584 PolarHBondContact O-N 3.16Å
581	N	66.9	Low	62.5	Low	82 Å²	82	111.5 Å²	111.5	44%	0.439	53%	0.532	S	S	.	.	H	α-helix	trans	-68.3	-40.9	176.4	-70.3	1.4	0	0	0	112.1	I577 L578 N579 M584 Q585	I577-N581 PolarHBondContact O-N 3.38Å; I577-N581 PolarHBondContact O-OD1 3.09Å; L578-N581 PolarHBondContact O-N 3.31Å; N579-N581 VanDerWaalsContact C-N 3.35Å; N579-N581 PolarHBondContact O-N 3.42Å; N581-M584 PolarHBondContact O-N 3.05Å; N581-Q585 PolarHBondContact O-N 3.48Å
582	A	69.5	Low	64	Low	48 Å²	48	108.5 Å²	108.5	40%	0.397	52%	0.518	S	S	.	.	H	α-helix	trans	-61.8	-47.8	175.3	0	0	0	0	0	111.8	L578 N579 M584 Q585 Q586	L578-A582 PolarHBondContact O-N 3.09Å; N579-A582 PolarHBondContact O-N 3.49Å; A582-M584 VanDerWaalsContact C-N 3.27Å; A582-M584 PolarHBondContact O-N 3.08Å; A582-Q585 PolarHBondContact O-N 2.97Å; A582-Q586 PolarHBondContact O-N 3.39Å
583	N	69.8	Low	65.7	Low	84 Å²	84	107.9 Å²	107.9	45%	0.449	52%	0.515	S	S	.	.	H	α-helix	trans	-60.6	-36	175	-72.6	-15.3	0	0	0	112.3	N579 Q586 M587	N579-N583 WeakPolarHBondContact O-CB 3.29Å; N579-N583 PolarHBondContact O-N 3.17Å; N583-Q586 PolarHBondContact O-N 2.79Å; N583-M587 WeakPolarHBondContact O-CB 3.39Å; N583-M587 PolarHBondContact O-N 3.41Å
584	M	69.3	Low	66.9	Low	60 Å²	60	111.1 Å²	111.1	30%	0.296	52%	0.516	S	S	.	.	H	α-helix	trans	-67.4	-42.4	176.9	-160.5	-171	-50.2	0	0	112	R580 N581 A582 M587 Q588	R580-M584 WeakPolarHBondContact O-CB 3.48Å; R580-M584 PolarHBondContact O-N 3.16Å; N581-M584 PolarHBondContact O-N 3.05Å; A582-M584 VanDerWaalsContact C-N 3.27Å; A582-M584 PolarHBondContact O-N 3.08Å; M584-M587 PolarHBondContact O-N 3Å; M584-Q588 WeakPolarHBondContact O-CG 3.4Å; M584-Q588 PolarHBondContact O-N 3.09Å
585	Q	72.7	Confident	68.4	Low	139 Å²	139	107.2 Å²	107.2	65%	0.65	51%	0.507	S	S	*	.	H	α-helix	trans	-65.1	-41.5	173.9	-72.8	179.5	-17.5	0	0	112	N581 A582 Q588 H589	N581-Q585 PolarHBondContact O-N 3.48Å; A582-Q585 PolarHBondContact O-N 2.97Å; Q585-Q588 PolarHBondContact O-N 3.16Å; Q585-H589 PolarHBondContact O-N 2.8Å
586	Q	75.5	Confident	69.8	Low	120 Å²	120	101.7 Å²	101.7	56%	0.561	49%	0.49	S	S	*	.	H	α-helix	trans	-63	-42.3	175.5	-170.8	176.5	6.2	0	0	111.6	A582 N583 H589 I590	A582-Q586 PolarHBondContact O-N 3.39Å; N583-Q586 PolarHBondContact O-N 2.79Å; Q586-H589 PolarHBondContact O-N 3.43Å; Q586-I590 HydrophobicContact CG-CD1 4.02Å; Q586-I590 VanDerWaalsContact O-CG1 3.31Å; Q586-I590 WeakPolarHBondContact O-CG1 3.3Å; Q586-I590 PolarHBondContact O-N 2.89Å
587	M	72.1	Confident	71.3	Confident	95 Å²	95	100.8 Å²	100.8	47%	0.468	48%	0.484	S	S	.	.	H	α-helix	trans	-63.3	-41.8	175.3	-173.5	-176.1	-68.3	0	0	112.1	M505 N583 M584 I590 Q591	M505-M587 HydrophobicContact CE-SD 4.19Å; N583-M587 WeakPolarHBondContact O-CB 3.39Å; N583-M587 PolarHBondContact O-N 3.41Å; M584-M587 PolarHBondContact O-N 3Å; M587-I590 PolarHBondContact O-N 3.19Å; M587-Q591 WeakPolarHBondContact O-CG 3.48Å; M587-Q591 PolarHBondContact O-N 2.85Å
588	Q	73.7	Confident	72.4	Confident	113 Å²	113	99 Å²	99	53%	0.528	48%	0.475	S	S	.	.	H	α-helix	trans	-61.8	-44.5	173.6	-77.1	179.9	-14	0	0	111.8	M584 Q585 I590 Q591 Q592	M584-Q588 WeakPolarHBondContact O-CG 3.4Å; M584-Q588 PolarHBondContact O-N 3.09Å; Q585-Q588 PolarHBondContact O-N 3.16Å; Q588-I590 PolarHBondContact O-N 3.14Å; Q588-Q591 PolarHBondContact O-N 3.38Å; Q588-Q592 WeakPolarHBondContact O-CB 3.38Å; Q588-Q592 PolarHBondContact O-N 3.24Å
589	H	79	Confident	73.8	Confident	104 Å²	104	99 Å²	99	48%	0.481	47%	0.471	S	S	.	.	H	α-helix	trans	-65.4	-39	178.9	-166.2	56.6	0	0	0	112.3	Q585 Q586 Q592 Q593	Q585-H589 PolarHBondContact O-N 2.8Å; Q586-H589 PolarHBondContact O-N 3.43Å; H589-Q592 PolarHBondContact O-N 3.43Å; H589-Q593 PolarHBondContact CD2-NE2 3.43Å; H589-Q593 VanDerWaalsContact CD2-NE2 3.33Å; H589-Q593 PolarHBondContact NE2-NE2 2.81Å; H589-Q593 WeakPolarHBondContact O-CG 3.19Å; H589-Q593 PolarHBondContact O-N 3.23Å
590	I	74.7	Confident	74.5	Confident	75 Å²	75	100.3 Å²	100.3	39%	0.385	48%	0.475	S	S	.	.	H	α-helix	trans	-65.4	-38.8	173.7	-69.2	165.8	0	0	0	111.4	Q586 M587 Q588 R594	Q586-I590 HydrophobicContact CG-CD1 4.02Å; Q586-I590 VanDerWaalsContact O-CG1 3.31Å; Q586-I590 WeakPolarHBondContact O-CG1 3.3Å; Q586-I590 PolarHBondContact O-N 2.89Å; M587-I590 PolarHBondContact O-N 3.19Å; Q588-I590 PolarHBondContact O-N 3.14Å; I590-R594 WeakPolarHBondContact O-CG 3.25Å; I590-R594 PolarHBondContact O-N 2.65Å
591	Q	75	Confident	75.3	Confident	44 Å²	44	97.9 Å²	97.9	21%	0.206	47%	0.472	C	S	.	.	H	α-helix	trans	-64.2	-41.9	172.9	-77	-176.2	-2.5	0	0	111.8	M587 Q588 R594 Q595	M587-Q591 WeakPolarHBondContact O-CG 3.48Å; M587-Q591 PolarHBondContact O-N 2.85Å; Q588-Q591 PolarHBondContact O-N 3.38Å; Q591-R594 PolarHBondContact O-N 2.84Å; Q591-Q595 WeakPolarHBondContact O-CG 3.3Å; Q591-Q595 PolarHBondContact O-N 2.96Å
592	Q	79.7	Confident	75.9	Confident	101 Å²	101	98.9 Å²	98.9	47%	0.472	47%	0.474	S	S	.	.	H	α-helix	trans	-62.3	-48.7	176.7	-177	174.6	-1.4	0	0	111.6	Q588 H589 R594 Q595 E596	Q588-Q592 WeakPolarHBondContact O-CB 3.38Å; Q588-Q592 PolarHBondContact O-N 3.24Å; H589-Q592 PolarHBondContact O-N 3.43Å; Q592-R594 VanDerWaalsContact C-N 3.33Å; Q592-R594 PolarHBondContact O-N 2.92Å; Q592-Q595 PolarHBondContact O-N 3.41Å; Q592-Q595 VanDerWaalsContact O-N 3.07Å; Q592-E596 HydrophobicContact CG-CG 4.44Å; Q592-E596 VanDerWaalsContact CG-OE1 3.29Å; Q592-E596 WeakPolarHBondContact CG-OE1 3.41Å; Q592-E596 PolarHBondContact NE2-OE1 3.15Å; Q592-E596 WeakPolarHBondContact O-CG 3.48Å; Q592-E596 PolarHBondContact O-N 3.18Å
593	Q	79.1	Confident	76.4	Confident	101 Å²	101	100.3 Å²	100.3	47%	0.472	47%	0.474	S	S	.	.	H	α-helix	trans	-59	-40.3	175.9	-71.9	-176.6	6.7	0	0	112.4	H589 E596 H597	H589-Q593 PolarHBondContact CD2-NE2 3.43Å; H589-Q593 VanDerWaalsContact CD2-NE2 3.33Å; H589-Q593 PolarHBondContact NE2-NE2 2.81Å; H589-Q593 WeakPolarHBondContact O-CG 3.19Å; H589-Q593 PolarHBondContact O-N 3.23Å; Q593-E596 PolarHBondContact O-N 3.18Å; Q593-H597 WeakPolarHBondContact O-CB 3.48Å; Q593-H597 PolarHBondContact O-N 3.02Å
594	R	74.4	Confident	77	Confident	152 Å²	152	101.9 Å²	101.9	57%	0.574	48%	0.478	S	S	*	.	H	α-helix	trans	-63	-40.2	173.7	-72.1	-167.1	-155.6	-136.6	4.6	111.9	E214 I590 Q591 Q592 L598	E214-R594 IonicContact OE1-NH1 3.05Å; E214-R594 IonicContact OE1-NH2 3.94Å; I590-R594 WeakPolarHBondContact O-CG 3.25Å; I590-R594 PolarHBondContact O-N 2.65Å; Q591-R594 PolarHBondContact O-N 2.84Å; Q592-R594 VanDerWaalsContact C-N 3.33Å; Q592-R594 PolarHBondContact O-N 2.92Å; R594-L598 WeakPolarHBondContact O-CB 3.49Å; R594-L598 VanDerWaalsContact O-CG 3.26Å; R594-L598 WeakPolarHBondContact O-CG 3.46Å; R594-L598 PolarHBondContact O-N 2.83Å
595	Q	76.6	Confident	77.6	Confident	127 Å²	127	102.9 Å²	102.9	59%	0.593	48%	0.482	S	S	*	.	H	α-helix	trans	-66.3	-44.4	176.3	-72	-175.7	12.6	0	0	112.3	Q591 Q592 L598 Q599	Q591-Q595 WeakPolarHBondContact O-CG 3.3Å; Q591-Q595 PolarHBondContact O-N 2.96Å; Q592-Q595 PolarHBondContact O-N 3.41Å; Q592-Q595 VanDerWaalsContact O-N 3.07Å; Q595-L598 PolarHBondContact O-N 2.73Å; Q595-Q599 WeakPolarHBondContact O-CB 3.15Å; Q595-Q599 PolarHBondContact O-N 3.13Å
596	E	76.1	Confident	78	Confident	89 Å²	89	101 Å²	101	42%	0.416	47%	0.473	S	S	.	.	H	α-helix	trans	-62.8	-41.6	177.1	-71.5	171.7	-173.7	0	0	111.5	Q592 Q593 Q599 Q600	Q592-E596 HydrophobicContact CG-CG 4.44Å; Q592-E596 VanDerWaalsContact CG-OE1 3.29Å; Q592-E596 WeakPolarHBondContact CG-OE1 3.41Å; Q592-E596 PolarHBondContact NE2-OE1 3.15Å; Q592-E596 WeakPolarHBondContact O-CG 3.48Å; Q592-E596 PolarHBondContact O-N 3.18Å; Q593-E596 PolarHBondContact O-N 3.18Å; E596-Q599 PolarHBondContact O-N 3.29Å; E596-Q600 WeakPolarHBondContact O-CG 3.48Å; E596-Q600 PolarHBondContact O-N 2.83Å
597	H	78.2	Confident	78.2	Confident	115 Å²	115	103.5 Å²	103.5	53%	0.532	48%	0.478	S	S	.	.	H	α-helix	trans	-65	-43	175.4	-173.7	75.1	0	0	0	112.7	Q593 Q599 Q600 L601	Q593-H597 WeakPolarHBondContact O-CB 3.48Å; Q593-H597 PolarHBondContact O-N 3.02Å; H597-Q599 VanDerWaalsContact C-N 3.32Å; H597-Q599 PolarHBondContact O-N 2.85Å; H597-Q600 PolarHBondContact O-N 2.99Å; H597-L601 PolarHBondContact O-N 2.97Å
598	L	78.8	Confident	78.4	Confident	65 Å²	65	104 Å²	104	34%	0.34	48%	0.48	S	S	.	.	H	α-helix	trans	-62.6	-38	174.2	-74.1	170	0	0	0	112.1	R594 Q595 L601 Q602	R594-L598 WeakPolarHBondContact O-CB 3.49Å; R594-L598 VanDerWaalsContact O-CG 3.26Å; R594-L598 WeakPolarHBondContact O-CG 3.46Å; R594-L598 PolarHBondContact O-N 2.83Å; Q595-L598 PolarHBondContact O-N 2.73Å; L598-L601 PolarHBondContact O-N 3.17Å; L598-Q602 PolarHBondContact O-N 2.82Å
599	Q	82.6	Confident	78.7	Confident	124 Å²	124	103 Å²	103	58%	0.579	48%	0.475	S	S	*	.	H	α-helix	trans	-67.1	-41.6	175.2	-172.2	174.9	100.4	0	0	111.7	Q595 E596 H597 Q602 I603	Q595-Q599 WeakPolarHBondContact O-CB 3.15Å; Q595-Q599 PolarHBondContact O-N 3.13Å; E596-Q599 PolarHBondContact O-N 3.29Å; H597-Q599 VanDerWaalsContact C-N 3.32Å; H597-Q599 PolarHBondContact O-N 2.85Å; Q599-Q602 PolarHBondContact O-N 3.25Å; Q599-I603 HydrophobicContact CG-CD1 4.05Å; Q599-I603 WeakPolarHBondContact O-CG1 3.35Å; Q599-I603 PolarHBondContact O-N 3.33Å
600	Q	79.2	Confident	78.8	Confident	127 Å²	127	103.4 Å²	103.4	59%	0.593	48%	0.477	S	S	*	.	H	α-helix	trans	-61.9	-42.4	173.8	-72.8	178.4	46.4	0	0	112.2	E596 H597 Q602 I603 H604	E596-Q600 WeakPolarHBondContact O-CG 3.48Å; E596-Q600 PolarHBondContact O-N 2.83Å; H597-Q600 PolarHBondContact O-N 2.99Å; Q600-Q602 VanDerWaalsContact C-N 3.33Å; Q600-Q602 PolarHBondContact O-N 2.85Å; Q600-I603 PolarHBondContact O-N 2.84Å; Q600-H604 WeakPolarHBondContact O-CB 3.5Å; Q600-H604 PolarHBondContact O-N 2.92Å
601	L	79.4	Confident	79	Confident	91 Å²	91	105 Å²	105	48%	0.476	48%	0.484	S	S	.	.	H	α-helix	trans	-58.6	-42	172.5	-86.9	163.1	0	0	0	112.3	H597 L598 H604 Q605	H597-L601 PolarHBondContact O-N 2.97Å; L598-L601 PolarHBondContact O-N 3.17Å; L601-H604 PolarHBondContact O-N 2.81Å; L601-Q605 WeakPolarHBondContact O-CB 3.47Å; L601-Q605 PolarHBondContact O-N 3.11Å
602	Q	79.4	Confident	79.1	Confident	102 Å²	102	108.6 Å²	108.6	48%	0.477	50%	0.5	S	S	.	.	H	α-helix	trans	-67.4	-42.3	177.5	-166.5	177.1	30.5	0	0	112.2	L598 Q599 Q600 Q605 Q606	L598-Q602 PolarHBondContact O-N 2.82Å; Q599-Q602 PolarHBondContact O-N 3.25Å; Q600-Q602 VanDerWaalsContact C-N 3.33Å; Q600-Q602 PolarHBondContact O-N 2.85Å; Q602-Q605 PolarHBondContact O-N 2.97Å; Q602-Q606 PolarHBondContact O-N 3.31Å
603	I	79.3	Confident	78.9	Confident	79 Å²	79	108.7 Å²	108.7	41%	0.405	50%	0.501	S	S	.	.	H	α-helix	trans	-63.7	-41.4	174.9	-68.9	166	0	0	0	110.8	Q599 Q600 Q606 R607	Q599-I603 HydrophobicContact CG-CD1 4.05Å; Q599-I603 WeakPolarHBondContact O-CG1 3.35Å; Q599-I603 PolarHBondContact O-N 3.33Å; Q600-I603 PolarHBondContact O-N 2.84Å; I603-Q606 PolarHBondContact O-N 3.16Å; I603-R607 PolarHBondContact O-N 3.26Å
604	H	82.8	Confident	78.8	Confident	116 Å²	116	109.2 Å²	109.2	54%	0.537	50%	0.503	S	S	.	.	H	α-helix	trans	-61.8	-46.2	174.7	-178.8	93.1	0	0	0	111.3	Q600 L601 Q606 R607 M608	Q600-H604 WeakPolarHBondContact O-CB 3.5Å; Q600-H604 PolarHBondContact O-N 2.92Å; L601-H604 PolarHBondContact O-N 2.81Å; H604-Q606 VanDerWaalsContact C-N 3.34Å; H604-Q606 PolarHBondContact O-N 2.88Å; H604-R607 PolarHBondContact O-N 3.19Å; H604-M608 WeakPolarHBondContact O-CG 3.46Å; H604-M608 PolarHBondContact O-N 3.43Å
605	Q	81.5	Confident	78.7	Confident	81 Å²	81	107.3 Å²	107.3	38%	0.379	50%	0.501	S	S	.	.	H	α-helix	trans	-60.6	-41	176.2	-167.3	-177.1	106.4	0	0	112	L601 Q602 M608 Q609	L601-Q605 WeakPolarHBondContact O-CB 3.47Å; L601-Q605 PolarHBondContact O-N 3.11Å; Q602-Q605 PolarHBondContact O-N 2.97Å; Q605-M608 PolarHBondContact O-N 3.46Å; Q605-Q609 WeakPolarHBondContact O-CG 3.48Å; Q605-Q609 PolarHBondContact O-N 3.23Å
606	Q	81.9	Confident	78.2	Confident	99 Å²	99	107.1 Å²	107.1	46%	0.463	50%	0.5	S	S	.	.	H	α-helix	trans	-64.6	-41.6	173.7	-76.5	-169.3	-4.1	0	0	112.8	Q602 I603 H604 M608 Q609 Q610	Q602-Q606 PolarHBondContact O-N 3.31Å; I603-Q606 PolarHBondContact O-N 3.16Å; H604-Q606 VanDerWaalsContact C-N 3.34Å; H604-Q606 PolarHBondContact O-N 2.88Å; Q606-M608 VanDerWaalsContact C-N 3.35Å; Q606-M608 PolarHBondContact O-N 2.94Å; Q606-Q609 PolarHBondContact O-N 2.64Å; Q606-Q610 WeakPolarHBondContact O-CG 2.83Å; Q606-Q610 PolarHBondContact O-N 3.11Å
607	R	79.4	Confident	77.5	Confident	173 Å²	173	111.1 Å²	111.1	65%	0.653	51%	0.511	S	S	*	.	H	α-helix	trans	-60.3	-43.8	174.7	-76.4	-172.3	-178.2	-167.1	3.1	111.8	I603 H604 Q609 Q610 Q611	I603-R607 PolarHBondContact O-N 3.26Å; H604-R607 PolarHBondContact O-N 3.19Å; R607-Q609 PolarHBondContact O-N 3.34Å; R607-Q610 PolarHBondContact O-N 2.87Å; R607-Q611 PolarHBondContact O-N 2.83Å
608	M	76.9	Confident	76.4	Confident	106 Å²	106	113.1 Å²	113.1	52%	0.522	52%	0.522	S	S	.	.	H	α-helix	trans	-60.1	-45.1	176.3	-72.4	-66.8	-75	0	0	111.8	H604 Q605 Q606 Q611 Q612	H604-M608 WeakPolarHBondContact O-CG 3.46Å; H604-M608 PolarHBondContact O-N 3.43Å; Q605-M608 PolarHBondContact O-N 3.46Å; Q606-M608 VanDerWaalsContact C-N 3.35Å; Q606-M608 PolarHBondContact O-N 2.94Å; M608-Q611 PolarHBondContact O-N 2.94Å; M608-Q612 WeakPolarHBondContact O-CB 3.43Å; M608-Q612 PolarHBondContact O-N 3.1Å
609	Q	79.3	Confident	75	Confident	91 Å²	91	117.9 Å²	117.9	43%	0.425	55%	0.545	S	S	.	.	H	α-helix	trans	-64.5	-40.5	175.3	-70.8	177	14.9	0	0	112.5	Q605 Q606 R607 Q612 Q613	Q605-Q609 WeakPolarHBondContact O-CG 3.48Å; Q605-Q609 PolarHBondContact O-N 3.23Å; Q606-Q609 PolarHBondContact O-N 2.64Å; R607-Q609 PolarHBondContact O-N 3.34Å; Q609-Q612 PolarHBondContact O-N 2.58Å; Q609-Q613 WeakPolarHBondContact O-CG 3.47Å; Q609-Q613 PolarHBondContact O-N 3.41Å
610	Q	80.2	Confident	73.3	Confident	113 Å²	113	121.6 Å²	121.6	53%	0.528	55%	0.554	S	S	.	*	H	α-helix	trans	-64.8	-43.6	176.4	-74.4	-173.7	21.6	0	0	112.3	Q606 R607 Q612 Q613 Q614	Q606-Q610 WeakPolarHBondContact O-CG 2.83Å; Q606-Q610 PolarHBondContact O-N 3.11Å; R607-Q610 PolarHBondContact O-N 2.87Å; Q610-Q612 VanDerWaalsContact C-N 3.35Å; Q610-Q612 PolarHBondContact O-N 2.93Å; Q610-Q613 PolarHBondContact O-N 2.99Å; Q610-Q614 WeakPolarHBondContact O-CG 3.23Å; Q610-Q614 PolarHBondContact O-N 3.29Å
611	Q	78.7	Confident	71.8	Confident	110 Å²	110	121 Å²	121	51%	0.514	56%	0.561	S	S	.	*	H	α-helix	trans	-61.3	-43.7	174.5	-75.8	-173.5	-8.5	0	0	111.5	R607 M608 Q613 Q614 Q615	R607-Q611 PolarHBondContact O-N 2.83Å; M608-Q611 PolarHBondContact O-N 2.94Å; Q611-Q613 VanDerWaalsContact C-N 3.34Å; Q611-Q613 PolarHBondContact O-N 3.46Å; Q611-Q614 PolarHBondContact O-N 2.74Å; Q611-Q614 VanDerWaalsContact O-N 3.11Å; Q611-Q615 WeakPolarHBondContact O-CG 3.23Å; Q611-Q615 PolarHBondContact O-N 3.03Å
612	Q	77.3	Confident	70.1	Confident	119 Å²	119	125.7 Å²	125.7	56%	0.556	58%	0.58	S	S	*	*	H	α-helix	trans	-63.1	-39	177.5	-160.6	-179.5	88.9	0	0	111.8	M608 Q609 Q610 Q615 Q616	M608-Q612 WeakPolarHBondContact O-CB 3.43Å; M608-Q612 PolarHBondContact O-N 3.1Å; Q609-Q612 PolarHBondContact O-N 2.58Å; Q610-Q612 VanDerWaalsContact C-N 3.35Å; Q610-Q612 PolarHBondContact O-N 2.93Å; Q612-Q615 PolarHBondContact O-N 3.49Å; Q612-Q616 WeakPolarHBondContact O-CG 3.45Å; Q612-Q616 PolarHBondContact O-N 2.71Å
613	Q	76.8	Confident	68.2	Low	102 Å²	102	128.8 Å²	128.8	48%	0.477	60%	0.6	S	S	.	*	H	α-helix	trans	-67.5	-31.5	171.7	-75.6	-169.7	14.1	0	0	113.9	Q609 Q610 Q611 R617	Q609-Q613 WeakPolarHBondContact O-CG 3.47Å; Q609-Q613 PolarHBondContact O-N 3.41Å; Q610-Q613 PolarHBondContact O-N 2.99Å; Q611-Q613 VanDerWaalsContact C-N 3.34Å; Q611-Q613 PolarHBondContact O-N 3.46Å; Q613-R617 WeakPolarHBondContact O-CB 3.48Å; Q613-R617 WeakPolarHBondContact O-CG 3.43Å; Q613-R617 PolarHBondContact O-N 3.39Å
614	Q	75.9	Confident	66.1	Low	112 Å²	112	136.1 Å²	136.1	52%	0.523	62%	0.623	S	S	.	*	H	α-helix	trans	-70.3	-43.4	174.9	-75.2	178.7	4.6	0	0	110.9	Q610 Q611 Q616 R617 M618	Q610-Q614 WeakPolarHBondContact O-CG 3.23Å; Q610-Q614 PolarHBondContact O-N 3.29Å; Q611-Q614 PolarHBondContact O-N 2.74Å; Q611-Q614 VanDerWaalsContact O-N 3.11Å; Q614-Q616 PolarHBondContact O-N 2.74Å; Q614-R617 PolarHBondContact O-N 3Å; Q614-R617 VanDerWaalsContact O-N 3.12Å; Q614-M618 PolarHBondContact O-N 3.29Å
615	Q	72.4	Confident	64	Low	112 Å²	112	139.2 Å²	139.2	52%	0.523	64%	0.64	S	S	.	*	H	α-helix	trans	-60.3	-45.5	173.7	-68	174.3	15.1	0	0	111.6	Q611 Q612 R617 M618 M619	Q611-Q615 WeakPolarHBondContact O-CG 3.23Å; Q611-Q615 PolarHBondContact O-N 3.03Å; Q612-Q615 PolarHBondContact O-N 3.49Å; Q615-R617 VanDerWaalsContact C-N 3.27Å; Q615-R617 PolarHBondContact O-N 3.3Å; Q615-M618 PolarHBondContact O-N 2.99Å; Q615-M619 PolarHBondContact O-N 3.35Å
616	Q	65.6	Low	61.8	Low	124 Å²	124	144.3 Å²	144.3	58%	0.579	66%	0.664	S	S	*	*	H	α-helix	trans	-63.1	-29.7	174	-72.1	179.1	31.7	0	0	113.4	Q612 Q614	Q612-Q616 WeakPolarHBondContact O-CG 3.45Å; Q612-Q616 PolarHBondContact O-N 2.71Å; Q614-Q616 PolarHBondContact O-N 2.74Å
617	R	61.4	Low	59.5	Low	173 Å²	173	145.7 Å²	145.7	65%	0.653	68%	0.684	S	S	*	*	H	α-helix	trans	-74.1	-35.7	172.8	-86.4	-174.5	-100.2	-169.2	-10.3	112.9	Q613 Q614 Q615	Q613-R617 WeakPolarHBondContact O-CB 3.48Å; Q613-R617 WeakPolarHBondContact O-CG 3.43Å; Q613-R617 PolarHBondContact O-N 3.39Å; Q614-R617 PolarHBondContact O-N 3Å; Q614-R617 VanDerWaalsContact O-N 3.12Å; Q615-R617 VanDerWaalsContact C-N 3.27Å; Q615-R617 PolarHBondContact O-N 3.3Å
618	M	56.2	Low	57.7	Low	156 Å²	156	141.4 Å²	141.4	77%	0.768	68%	0.681	S	S	*	*	H	α-helix	trans	-75.2	-31.5	177.9	-68.9	-165.9	-64.5	0	0	113.2	Q614 Q615 R620	Q614-M618 PolarHBondContact O-N 3.29Å; Q615-M618 PolarHBondContact O-N 2.99Å; M618-R620 VanDerWaalsContact C-N 3.28Å; M618-R620 PolarHBondContact O-N 3.14Å
619	M	48.8	Very low	55.9	Low	166 Å²	166	147.4 Å²	147.4	82%	0.818	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	18.4	176.2	-64.9	-145.1	-62.2	0	0	114.7	Q615	Q615-M619 PolarHBondContact O-N 3.35Å
620	R	47.2	Very low	53.9	Low	202 Å²	202	146.6 Å²	146.6	76%	0.762	72%	0.715	S	S	*	*	S	Bend	trans	-97	115.4	179.8	-150	174.7	-169.9	-177.2	3.4	110.5	M618	M618-R620 VanDerWaalsContact C-N 3.28Å; M618-R620 PolarHBondContact O-N 3.14Å
621	P	48.5	Very low	51.9	Low	114 Å²	114	146.3 Å²	146.3	74%	0.74	73%	0.725	S	S	*	*			trans	-60.1	137.5	-177	-25.4	34.9	0	0	0	113.3	N623	P621-N623 VanDerWaalsContact C-N 3.27Å; P621-N623 PolarHBondContact O-N 3.19Å
622	Q	42.3	Very low	50.1	Low	189 Å²	189	149.3 Å²	149.3	88%	0.883	74%	0.742	S	S	*	*			trans	-78.6	64.2	-179.8	-68.3	-169.8	-4.6	0	0	113.3	R624	Q622-R624 VanDerWaalsContact C-N 3.34Å; Q622-R624 PolarHBondContact O-N 3.45Å; Q622-R624 VanDerWaalsContact O-N 3.12Å
623	N	39.5	Very low	48.3	Very low	167 Å²	167	149.3 Å²	149.3	89%	0.893	75%	0.752	S	S	*	*			trans	-81.8	84.2	163.6	-85.8	-12	0	0	0	109.9	P621	P621-N623 VanDerWaalsContact C-N 3.27Å; P621-N623 PolarHBondContact O-N 3.19Å
624	R	35.6	Very low	46.5	Very low	233 Å²	233	150.2 Å²	150.2	88%	0.879	77%	0.769	S	S	*	*			trans	-136.2	80.7	176.3	-168.3	-166.6	-150.8	-150.7	5.2	112	Q622	Q622-R624 VanDerWaalsContact C-N 3.34Å; Q622-R624 PolarHBondContact O-N 3.45Å; Q622-R624 VanDerWaalsContact O-N 3.12Å
625	M	39	Very low	44.8	Very low	181 Å²	181	148.8 Å²	148.8	89%	0.892	78%	0.777	S	S	*	*			trans	-158.9	159.6	156.5	-93.8	-116.8	-90.8	0	0	110.1
626	Q	34.9	Very low	43.2	Very low	189 Å²	189	149.6 Å²	149.6	88%	0.883	79%	0.789	S	S	*	*			trans	64.6	89.4	175.7	-55.5	-173.8	20.4	0	0	117
627	S	33.2	Very low	41.9	Very low	128 Å²	128	149.1 Å²	149.1	90%	0.895	80%	0.798	S	S	*	*			trans	-154.8	108.2	145.5	-176.5	0	0	0	0	109.6
628	S	41.4	Very low	41	Very low	83 Å²	83	146 Å²	146	58%	0.58	80%	0.8	S	S	*	*			trans	-166.4	132.1	172.8	55.3	0	0	0	0	109.4
629	Y	40	Very low	40.1	Very low	232 Å²	232	144 Å²	144	91%	0.91	80%	0.802	S	S	*	*			trans	65.3	136.4	-178.9	-33.4	-71.8	0	0	0	114.3
630	G	37.1	Very low	40	Very low	73 Å²	73	141.6 Å²	141.6	75%	0.753	80%	0.798	S	S	*	*			cis	174.5	149.3	-6.1	0	0	0	0	0	110.7
631	S	38	Very low	39.6	Very low	107 Å²	107	139.7 Å²	139.7	75%	0.748	80%	0.8	S	S	*	*			trans	-48.4	154.6	-179.7	-37.7	0	0	0	0	114.6
632	M	40.6	Very low	39.2	Very low	174 Å²	174	141 Å²	141	86%	0.857	80%	0.801	S	S	*	*			cis	-153.4	167.3	37	-75.3	-71.1	-179.6	0	0	112.7
633	P	40	Very low	39.2	Very low	119 Å²	119	136.8 Å²	136.8	77%	0.773	79%	0.793	S	S	*	*			trans	-106.3	145.6	176.6	37.8	-30.7	0	0	0	115.3
634	S	39.9	Very low	39.3	Very low	120 Å²	120	133.6 Å²	133.6	84%	0.839	78%	0.783	S	S	*	*			trans	-166.6	135.7	155.4	-161.4	0	0	0	0	115.5
635	A	38.9	Very low	39.6	Very low	82 Å²	82	126.8 Å²	126.8	68%	0.678	78%	0.777	S	S	*	*			trans	63.7	114.6	144.2	0	0	0	0	0	125.6
636	V	39.7	Very low	39.7	Very low	129 Å²	129	124.8 Å²	124.8	78%	0.782	77%	0.77	S	S	*	*				76.5	95.9	118.8	-178.4	0	0	0	0	122
637	C	37.1	Very low	40.1	Very low	114 Å²	114	120.9 Å²	120.9	77%	0.77	76%	0.763	S	S	*	*				69	174.4	124.1	-51.5	0	0	0	0	120.6
638	P	42.3	Very low	40.5	Very low	108 Å²	108	118.4 Å²	118.4	70%	0.701	75%	0.751	S	S	*	*				-142.5	156.8	-84.4	41.6	-23.1	0	0	0	118.7
639	S	37.8	Very low	40.4	Very low	114 Å²	114	122.2 Å²	122.2	80%	0.797	76%	0.759	S	S	*	*			trans	65.7	177.6	146.8	-61.8	0	0	0	0	119
640	P	46.1	Very low	40.2	Very low	115 Å²	115	119.5 Å²	119.5	75%	0.747	76%	0.755	S	S	*	*				-133.9	175.8	-58.6	39.6	-25.9	0	0	0	113.4
641	M	39.4	Very low	40.1	Very low	162 Å²	162	120.1 Å²	120.1	80%	0.798	75%	0.753	S	S	*	*			trans	174	146.9	140.2	-95.9	-82.9	165.9	0	0	113.8
642	N	39.8	Very low	39.9	Very low	141 Å²	141	124.6 Å²	124.6	75%	0.754	76%	0.762	S	S	*	*			trans	14	153	149	-68	-4.4	0	0	0	122.5
643	S	42.5	Very low	39.6	Very low	102 Å²	102	120 Å²	120	71%	0.713	76%	0.76	S	S	*	*			cis	-172.3	-158.3	-10.9	56.1	0	0	0	0	107.8
644	S	41.5	Very low	39.2	Very low	99 Å²	99	122.7 Å²	122.7	69%	0.692	77%	0.768	S	S	*	*			cis	-172	158.6	1.8	20.9	0	0	0	0	110.3
645	A	43.4	Very low	38.8	Very low	91 Å²	91	119.9 Å²	119.9	75%	0.752	76%	0.757	S	S	*	*			trans	70.2	156.8	162.3	0	0	0	0	0	117.7
646	D	40.9	Very low	38.4	Very low	139 Å²	139	125.6 Å²	125.6	74%	0.743	77%	0.77	S	S	*	*			cis	-153.9	159.5	-0.4	-146.6	-46.2	0	0	0	112.5
647	S	42.1	Very low	38	Very low	106 Å²	106	123.7 Å²	123.7	74%	0.741	77%	0.768	S	S	*	*			trans	57.4	148.4	150.9	-72.9	0	0	0	0	122.3
648	A	41.8	Very low	37.7	Very low	77 Å²	77	126.2 Å²	126.2	64%	0.636	77%	0.774	S	S	*	*			cis	-165.6	160.6	-15.6	0	0	0	0	0	112.7
649	Q	38.7	Very low	37	Very low	162 Å²	162	124.6 Å²	124.6	76%	0.757	78%	0.776	S	S	*	*			trans	66.4	112.9	154.2	-73.3	168.9	-83.8	0	0	123.5
650	Q	36.1	Very low	36.6	Very low	176 Å²	176	128.1 Å²	128.1	82%	0.822	78%	0.78	S	S	*	*				63.7	139.2	126.9	-69.1	168.9	-31.3	0	0	120.7
651	A	36.1	Very low	35.7	Very low	86 Å²	86	131.1 Å²	131.1	71%	0.711	78%	0.778	S	S	*	*			cis	-144.2	141.7	7.2	0	0	0	0	0	114.6
652	Q	33.6	Very low	35.2	Very low	200 Å²	200	130.4 Å²	130.4	94%	0.935	78%	0.782	S	S	*	*			trans	24.4	120.4	148.8	-64	175	-25.3	0	0	120.8
653	G	33.6	Very low	34.6	Very low	79 Å²	79	128.1 Å²	128.1	81%	0.814	78%	0.783	S	S	*	*			trans	166.1	61.6	165.6	0	0	0	0	0	116.6
654	N	31.6	Very low	34	Very low	175 Å²	175	128.3 Å²	128.3	94%	0.936	79%	0.79	S	S	*	*			trans	-60.4	152.5	175.7	-59.6	-6.8	0	0	0	111.7
655	G	31.4	Very low	33.4	Very low	60 Å²	60	127.9 Å²	127.9	62%	0.619	79%	0.793	S	S	*	*			cis	178.1	136.7	-2.7	0	0	0	0	0	107.8
656	Q	31.6	Very low	33	Very low	202 Å²	202	133.3 Å²	133.3	94%	0.944	80%	0.802	S	S	*	*				57.6	133.4	91.8	-79.9	-169.5	-29.9	0	0	115.6
657	A	31.4	Very low	32.4	Very low	89 Å²	89	136 Å²	136	74%	0.736	80%	0.802	S	S	*	*			cis	-158	168.5	-2.4	0	0	0	0	0	112.8
658	N	29.6	Very low	32	Very low	168 Å²	168	137.7 Å²	137.7	90%	0.898	81%	0.808	S	S	*	*			trans	-64.2	151.7	163.7	-80.7	-47.2	0	0	0	111.2
659	G	28.7	Very low	31.4	Very low	73 Å²	73	140 Å²	140	75%	0.753	81%	0.806	S	S	*	*			trans	-81.3	169.7	177.3	0	0	0	0	0	114.3
660	Q	29.7	Very low	31	Very low	188 Å²	188	139.5 Å²	139.5	88%	0.879	80%	0.803	S	S	*	*			trans	-150.1	148	162.1	-115.3	173.5	9.4	0	0	112.6
661	Y	26.4	Very low	30.7	Very low	179 Å²	179	139.4 Å²	139.4	70%	0.702	80%	0.803	S	S	*	*			trans	-30.5	146.7	165	-63.1	-113.7	0	0	0	116.2	Q468	Q468-Y661 PolarHBondContact OE1-OH 3.2Å
662	V	29	Very low	30.3	Very low	146 Å²	146	143.8 Å²	143.8	89%	0.885	81%	0.809	S	S	*	*				-143.3	141.8	115.3	169.8	0	0	0	0	108.3
663	A	28	Very low	30	Very low	93 Å²	93	141.2 Å²	141.2	77%	0.769	81%	0.806	S	S	*	*			trans	-104.1	146.9	170.6	0	0	0	0	0	110.8
664	A	29.9	Very low	29.8	Very low	106 Å²	106	142.7 Å²	142.7	88%	0.876	80%	0.801	S	S	*	*			trans	-128.3	116.7	169.5	0	0	0	0	0	109.3
665	A	28.6	Very low	29.6	Very low	91 Å²	91	142.7 Å²	142.7	75%	0.752	79%	0.793	S	S	*	*			trans	-100.4	149.6	178.1	0	0	0	0	0	110.8
666	H	33.8	Very low	29.5	Very low	204 Å²	204	147.1 Å²	147.1	94%	0.944	80%	0.798	S	S	*	*			trans	-134.8	156.4	158.7	-109.6	-91.8	0	0	0	111.4
667	R	28.6	Very low	29.2	Very low	196 Å²	196	143.1 Å²	143.1	74%	0.74	79%	0.792	S	S	*	*			trans	-146.3	114.7	-145.8	169.2	-160.1	176.7	-168.1	1.6	112
668	V	33.4	Very low	29.2	Very low	142 Å²	142	144.7 Å²	144.7	86%	0.861	80%	0.798	S	S	*	*			trans	-149.8	106.6	157.9	-171.9	0	0	0	0	104.7
669	Q	30	Very low	29.2	Very low	126 Å²	126	143.8 Å²	143.8	59%	0.589	80%	0.799	S	S	*	*			cis	84.3	125.7	39.3	-153.1	-168.4	1.1	0	0	113.7
670	Q	30.2	Very low	29.3	Very low	151 Å²	151	144 Å²	144	71%	0.706	80%	0.8	S	S	*	*			trans	84.8	141.2	172.8	-46.2	-163.3	54	0	0	115.3
671	Q	30.4	Very low	29.3	Very low	173 Å²	173	138.1 Å²	138.1	81%	0.808	79%	0.79	S	S	*	*			cis	-145.2	171.8	2.8	-135.6	170.8	58.1	0	0	111.9
672	Q	26.5	Very low	29.4	Very low	179 Å²	179	141.2 Å²	141.2	84%	0.836	80%	0.802	S	S	*	*			trans	-94.8	146.5	-174.1	-59.8	166.1	-9.4	0	0	112.5
673	V	28.9	Very low	29.6	Very low	146 Å²	146	140 Å²	140	89%	0.885	80%	0.795	S	S	*	*				-162.9	142	128.4	-99.6	0	0	0	0	110.5
674	P	29.1	Very low	29.7	Very low	110 Å²	110	144.2 Å²	144.2	71%	0.714	80%	0.801	S	S	*	*			trans	-99.5	161	174.1	37.7	-32.6	0	0	0	112.4
675	F	27.7	Very low	29.8	Very low	174 Å²	174	147.5 Å²	147.5	76%	0.763	80%	0.801	S	S	*	*			trans	-167.2	143.8	132.7	-120.9	-141.4	0	0	0	116.7
676	Q	29.2	Very low	30.1	Very low	153 Å²	153	152 Å²	152	72%	0.715	81%	0.806	S	S	*	*			trans	40	111.9	146.6	-68.4	-178.5	-12.1	0	0	121.5
677	S	25.3	Very low	30.1	Very low	119 Å²	119	148.8 Å²	148.8	83%	0.832	80%	0.803	S	S	*	*			trans	-63.8	135	144.5	52.9	0	0	0	0	111.7
678	S	30.5	Very low	30.3	Very low	121 Å²	121	142.9 Å²	142.9	85%	0.846	80%	0.804	S	S	*	*			trans	-116.2	142.4	164.3	57.5	0	0	0	0	110.5
679	T	28.9	Very low	30.4	Very low	150 Å²	150	144.2 Å²	144.2	92%	0.92	80%	0.8	S	S	*	*			trans	-103	133.5	-171.5	-53	0	0	0	0	110.7
680	G	31.6	Very low	30.5	Very low	76 Å²	76	146.3 Å²	146.3	78%	0.784	81%	0.81	S	S	*	*			trans	-153.6	144.8	166.2	0	0	0	0	0	110.2
681	G	29.7	Very low	30.8	Very low	65 Å²	65	143.8 Å²	143.8	67%	0.67	82%	0.815	S	S	*	*			cis	151.3	74.4	1.2	0	0	0	0	0	110.1	V683	G681-V683 PolarHBondContact O-N 2.87Å; G681-V683 VanDerWaalsContact O-N 3.14Å
682	Y	28.3	Very low	31.3	Very low	244 Å²	244	139.9 Å²	139.9	96%	0.957	81%	0.812	S	S	*	*			trans	-64.8	112.7	179.8	-84.6	-91.5	0	0	0	110.6
683	V	33.2	Very low	32	Very low	121 Å²	121	137.4 Å²	137.4	73%	0.733	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-95.6	121	169.9	178	0	0	0	0	108.3	G681	G681-V683 PolarHBondContact O-N 2.87Å; G681-V683 VanDerWaalsContact O-N 3.14Å
684	M	29.6	Very low	32.6	Very low	182 Å²	182	135.4 Å²	135.4	90%	0.897	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-78.8	135.7	165.3	-66.6	-145.4	-56	0	0	109.8
685	M	33.6	Very low	33.1	Very low	175 Å²	175	140.8 Å²	140.8	86%	0.862	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-103.7	147	164.4	-78.8	-69.2	-170.1	0	0	109.7
686	Q	33.2	Very low	33.6	Very low	185 Å²	185	136.5 Å²	136.5	86%	0.864	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-92.2	158.6	180	-67.5	178.7	-11.1	0	0	111.5
687	P	33.5	Very low	33.9	Very low	136 Å²	136	135.3 Å²	135.3	88%	0.883	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-93.3	150.1	-177.7	35.9	-34.8	0	0	0	114.7
688	G	33.1	Very low	34.5	Very low	73 Å²	73	141.9 Å²	141.9	75%	0.753	82%	0.819	S	S	*	*			trans	136.4	143.1	176.1	0	0	0	0	0	111
689	Q	35.9	Very low	34.9	Very low	169 Å²	169	139.5 Å²	139.5	79%	0.79	81%	0.813	S	S	*	*			cis	-145.6	156.8	-0.4	-73.9	169.6	-121	0	0	109.8
690	E	33.2	Very low	35	Very low	171 Å²	171	144 Å²	144	80%	0.799	81%	0.814	S	S	*	*			trans	61	155.2	152.7	-75.9	160.6	92.3	0	0	119.2
691	A	36.5	Very low	35.3	Very low	98 Å²	98	145.1 Å²	145.1	81%	0.81	82%	0.817	S	S	*	*			cis	-140.9	174.4	-0.6	0	0	0	0	0	111.3
692	A	39.8	Very low	35.5	Very low	90 Å²	90	148.3 Å²	148.3	74%	0.744	82%	0.823	S	S	*	*			trans	-122.1	165.1	176.7	0	0	0	0	0	112.6
693	P	41.2	Very low	36	Very low	128 Å²	128	141.6 Å²	141.6	83%	0.831	81%	0.812	S	S	*	*				-135.1	168.5	128.5	17.5	4.2	0	0	0	114.5
694	P	42.2	Very low	35.9	Very low	104 Å²	104	144.8 Å²	144.8	68%	0.675	82%	0.819	S	S	*	*			trans	-126.1	-157.4	-154.9	43.7	-28.8	0	0	0	116
695	Y	39.1	Very low	36.2	Very low	222 Å²	222	144.8 Å²	144.8	87%	0.871	82%	0.817	S	S	*	*			trans	89.8	138.1	179	-65.9	-80.1	0	0	0	116.3
696	A	38.7	Very low	36.3	Very low	84 Å²	84	143.6 Å²	143.6	69%	0.694	81%	0.809	S	S	*	*			cis	-157	156	-8.8	0	0	0	0	0	112
697	P	34	Very low	36.2	Very low	129 Å²	129	141.8 Å²	141.8	84%	0.838	80%	0.801	S	S	*	*			trans	-106	151	177.7	38.2	-32.5	0	0	0	115.6
698	R	39.8	Very low	36.4	Very low	257 Å²	257	143.5 Å²	143.5	97%	0.97	80%	0.797	S	S	*	*			trans	-147.9	148.2	157.2	-89.3	-176	169.2	-176.2	-4.2	107.4
699	G	36.9	Very low	36.5	Very low	70 Å²	70	151.1 Å²	151.1	72%	0.722	80%	0.804	S	S	*	*			cis	149	105.4	-2.4	0	0	0	0	0	110.1
700	Y	32.1	Very low	36.4	Very low	244 Å²	244	147.4 Å²	147.4	96%	0.957	80%	0.803	S	S	*	*			trans	-67.9	144.8	-179.2	-73.9	-92.7	0	0	0	112.4
701	A	37.7	Very low	36.4	Very low	101 Å²	101	144.8 Å²	144.8	84%	0.835	80%	0.803	S	S	*	*			trans	-149	143.8	163.3	0	0	0	0	0	109.7
702	T	34.7	Very low	36.4	Very low	131 Å²	131	146 Å²	146	80%	0.804	80%	0.8	S	S	*	*			trans	-124.2	175.2	-179.2	50.9	0	0	0	0	110.6
703	S	38	Very low	36.3	Very low	104 Å²	104	149.3 Å²	149.3	73%	0.727	81%	0.806	S	S	*	*			trans	96.3	110.4	164.2	-32.7	0	0	0	0	117
704	E	31	Very low	36	Very low	187 Å²	187	152.5 Å²	152.5	87%	0.874	81%	0.809	S	S	*	*			trans	4.6	128.6	147.9	-59	164.3	93.3	0	0	120.8
705	Q	35.2	Very low	35.7	Very low	182 Å²	182	151.7 Å²	151.7	85%	0.85	81%	0.811	S	S	*	*				-161.2	103.7	125	-116.2	179.9	1.8	0	0	115.2
706	Q	35.8	Very low	35.7	Very low	150 Å²	150	148.9 Å²	148.9	70%	0.701	81%	0.81	S	S	*	*				47.5	103.6	122.8	-158.7	159.3	14.2	0	0	123.3
707	Q	33	Very low	35.7	Very low	148 Å²	148	148.5 Å²	148.5	69%	0.692	81%	0.807	S	S	*	*			trans	66	151.4	134.4	-65.8	174	-41.5	0	0	123
708	H	36.7	Very low	35.9	Very low	172 Å²	172	151 Å²	151	80%	0.796	81%	0.808	S	S	*	*			trans	65.7	133	-179.4	-56.6	-84.1	0	0	0	114.3
709	Y	34.1	Very low	35.9	Very low	232 Å²	232	144.5 Å²	144.5	91%	0.91	80%	0.797	S	S	*	*			cis	-134.8	168.4	46.6	-96.3	-100.9	0	0	0	114.5
710	A	34.8	Very low	36.2	Very low	92 Å²	92	147.8 Å²	147.8	76%	0.76	80%	0.803	S	S	*	*			trans	-141.4	154.2	175.8	0	0	0	0	0	112.7
711	S	33.9	Very low	36.4	Very low	116 Å²	116	143.8 Å²	143.8	81%	0.811	80%	0.798	S	S	*	*			trans	67	126.7	173.1	-159.2	0	0	0	0	117.6
712	V	35.7	Very low	36.8	Very low	122 Å²	122	144.1 Å²	144.1	74%	0.739	79%	0.791	S	S	*	*				-171.2	124.3	103	153.3	0	0	0	0	108.9
713	N	37.5	Very low	37.1	Very low	161 Å²	161	145.9 Å²	145.9	86%	0.861	79%	0.787	S	S	*	*			trans	-171.5	135.6	138.3	-95.5	-34.3	0	0	0	108.4
714	Q	35.1	Very low	37.3	Very low	194 Å²	194	148.2 Å²	148.2	91%	0.907	79%	0.787	S	S	*	*			trans	-152.3	174.9	-167.5	-156.1	-178.7	18.1	0	0	109.7
715	A	37.1	Very low	38	Very low	87 Å²	87	149.7 Å²	149.7	72%	0.719	81%	0.808	S	S	*	*			trans	89.7	139.1	-173.5	0	0	0	0	0	113.7
716	L	37.5	Very low	38.2	Very low	163 Å²	163	148.1 Å²	148.1	85%	0.853	81%	0.806	S	S	*	*			cis	-157.3	142	9.2	-131.2	160.5	0	0	0	111.3
717	A	40.4	Very low	38.3	Very low	76 Å²	76	148 Å²	148	63%	0.628	81%	0.812	S	S	*	*			trans	55.2	132.3	165.2	0	0	0	0	0	118.4
718	E	36.3	Very low	38.6	Very low	182 Å²	182	148 Å²	148	85%	0.85	82%	0.819	S	S	*	*				60.5	127.5	53.1	-55.8	-172.7	142.4	0	0	112.3
719	T	40	Very low	38.7	Very low	120 Å²	120	146.6 Å²	146.6	74%	0.736	82%	0.82	S	S	*	*			cis	-159.3	153.4	30.4	-33.5	0	0	0	0	113
720	T	43.2	Very low	39	Very low	139 Å²	139	141.3 Å²	141.3	85%	0.853	81%	0.814	S	S	*	*			trans	69.3	134.8	153.5	28.1	0	0	0	0	124
721	L	37	Very low	39.3	Very low	161 Å²	161	144.5 Å²	144.5	84%	0.843	82%	0.818	S	S	*	*			trans	-81.7	-175.1	167.1	-75.6	162.6	0	0	0	112.6
722	P	45.6	Very low	39.7	Very low	107 Å²	107	146.6 Å²	146.6	70%	0.695	82%	0.818	S	S	*	*			cis	-137.8	-171.2	-30.5	31.2	-9.7	0	0	0	115
723	K	42.4	Very low	40	Very low	168 Å²	168	148.5 Å²	148.5	73%	0.73	82%	0.824	S	S	*	*			trans	104.6	139.2	145.1	-87.1	-173.3	160.6	-131.4	0	121.7
724	E	40.3	Very low	40.2	Very low	154 Å²	154	147.4 Å²	147.4	72%	0.72	82%	0.821	S	S	*	*			trans	57.7	99.3	150.9	-71	163.7	-161.6	0	0	119.3
725	V	47.7	Very low	40.7	Very low	218 Å²	218	143.2 Å²	143.2	100%	1.321	81%	0.814	S	S	*	*				-132.1	0	94.1	171.7	0	0	0	0	108.3

Retrieved 725 of 725 residues in 183.6 ms (Link to these results)

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