A0A5K4F6B6_SCHMA Loading...

GPS domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F6B6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 731 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.2	Very low	30.9	Very low	247 Å²	247	157.9 Å²	157.9	100%	1.217	83%	0.827	S	S	*	*				0	144.6	0	-105	169.5	154.5	0	0	108.6
2	S	32.6	Very low	31	Very low	109 Å²	109	163.9 Å²	163.9	76%	0.762	83%	0.83	S	S	*	*			trans	88.5	78.2	-179.2	100.8	0	0	0	0	117.8
3	L	28.1	Very low	31.1	Very low	176 Å²	176	167.2 Å²	167.2	92%	0.921	84%	0.836	S	S	*	*			trans	-74.2	119	139.3	-87.8	99.7	0	0	0	107.8
4	N	34.6	Very low	30.9	Very low	157 Å²	157	167.3 Å²	167.3	84%	0.84	84%	0.839	S	S	*	*			trans	-97.3	99.8	161.5	-91.9	-21.2	0	0	0	108.4
5	S	29.6	Very low	30.7	Very low	107 Å²	107	171.6 Å²	171.6	75%	0.748	84%	0.842	S	S	*	*			trans	-86.5	123.3	157.4	174.1	0	0	0	0	107.6
6	M	32.1	Very low	30.9	Very low	141 Å²	141	175.2 Å²	175.2	70%	0.695	85%	0.845	S	S	*	*			trans	-125	92.4	174.9	-147.6	176.5	-177.2	0	0	109.5	Y8	M6-Y8 HydrophobicContact CE-CD2 4.12Å; M6-Y8 HydrophobicContact CE-CE2 3.25Å; M6-Y8 HydrophobicContact CG-CD2 4.09Å; M6-Y8 HydrophobicContact CG-CE2 4.1Å; M6-Y8 PolarHBondContact O-N 3.23Å; M6-Y8 HydrophobicContact SD-CD2 4.02Å; M6-Y8 HydrophobicContact SD-CE2 3.49Å; M6-Y8 WeakPolarHBondContact SD-CE2 3.49Å
7	C	29.4	Very low	30.8	Very low	123 Å²	123	174.7 Å²	174.7	83%	0.831	85%	0.847	S	S	*	*			trans	-71.4	105.9	162.5	-76.4	0	0	0	0	108.7	F9	C7-F9 PolarHBondContact O-N 3.06Å
8	Y	35.6	Very low	30.8	Very low	190 Å²	190	175.9 Å²	175.9	75%	0.745	85%	0.848	S	S	*	*			trans	-83.3	112	172.1	-109.3	-78.1	0	0	0	111.6	M6	M6-Y8 HydrophobicContact CE-CD2 4.12Å; M6-Y8 HydrophobicContact CE-CE2 3.25Å; M6-Y8 HydrophobicContact CG-CD2 4.09Å; M6-Y8 HydrophobicContact CG-CE2 4.1Å; M6-Y8 PolarHBondContact O-N 3.23Å; M6-Y8 HydrophobicContact SD-CD2 4.02Å; M6-Y8 HydrophobicContact SD-CE2 3.49Å; M6-Y8 WeakPolarHBondContact SD-CE2 3.49Å
9	F	28.4	Very low	30.9	Very low	170 Å²	170	171.8 Å²	171.8	75%	0.746	84%	0.835	S	S	*	*			trans	-62.5	128.3	167.7	-145.5	-101.7	0	0	0	109.9	C7 Q11	C7-F9 PolarHBondContact O-N 3.06Å; F9-Q11 HydrophobicContact CD1-CG 3.91Å; F9-Q11 HydrophobicContact CE1-CG 3.77Å
10	N	30.9	Very low	30.9	Very low	161 Å²	161	169.8 Å²	169.8	86%	0.861	84%	0.837	S	S	*	*			trans	-134.7	118.6	158.1	-140.8	-29.7	0	0	0	111.9	R12	N10-R12 PolarHBondContact O-N 3.17Å
11	Q	28.9	Very low	31	Very low	156 Å²	156	169.4 Å²	169.4	73%	0.729	83%	0.831	S	S	*	*			trans	-76.6	99.9	-174.3	-71.6	172.9	-25.6	0	0	110.6	F9	F9-Q11 HydrophobicContact CD1-CG 3.91Å; F9-Q11 HydrophobicContact CE1-CG 3.77Å
12	R	32	Very low	31.2	Very low	230 Å²	230	165 Å²	165	87%	0.868	81%	0.812	S	S	*	*			trans	-178.6	133.5	148.4	-107.3	162.6	177.6	-171.6	-0.3	109	N10	N10-R12 PolarHBondContact O-N 3.17Å
13	F	32.1	Very low	31.3	Very low	207 Å²	207	168.9 Å²	168.9	91%	0.908	82%	0.818	S	S	*	*			trans	96.9	84.8	-178.1	-69.1	-87.1	0	0	0	116.1
14	L	28.1	Very low	31.7	Very low	168 Å²	168	163.8 Å²	163.8	88%	0.88	79%	0.794	S	S	*	*			trans	-56.9	144.1	154.3	-86.1	87.6	0	0	0	110.6
15	R	28.5	Very low	32.1	Very low	232 Å²	232	160.5 Å²	160.5	88%	0.875	78%	0.783	S	S	*	*			trans	98.2	73.8	170.9	-59.3	-179.2	177.2	-155.9	-0.9	114.8
16	Y	34.2	Very low	33.2	Very low	229 Å²	229	157.7 Å²	157.7	90%	0.898	76%	0.76	S	S	*	*			trans	-164	118.8	133.9	-89.5	-68.9	0	0	0	108	F18	Y16-F18 PolarHBondContact O-N 3.21Å
17	L	28.4	Very low	34.4	Very low	167 Å²	167	152.8 Å²	152.8	87%	0.874	74%	0.738	S	S	*	*			trans	-66	119.9	168.5	-80.3	149.2	0	0	0	107.9
18	F	31	Very low	36.2	Very low	196 Å²	196	149.6 Å²	149.6	86%	0.86	71%	0.71	S	S	*	*			trans	-149.8	133.7	154.3	-101.7	-76	0	0	0	112.2	Y16	Y16-F18 PolarHBondContact O-N 3.21Å
19	T	33.2	Very low	37.7	Very low	98 Å²	98	141.9 Å²	141.9	60%	0.601	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-69.3	135.2	-170.3	39.3	0	0	0	0	113.6	F21	T19-F21 PolarHBondContact O-N 3.48Å
20	C	29.4	Very low	39.8	Very low	131 Å²	131	133.9 Å²	133.9	89%	0.885	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-71.6	117.9	159.4	-72.2	0	0	0	0	108.7
21	F	34.9	Very low	41.8	Very low	163 Å²	163	127.9 Å²	127.9	72%	0.715	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-94.1	118.4	167.3	-91.6	-91.1	0	0	0	108.8	T19	T19-F21 PolarHBondContact O-N 3.48Å
22	L	32.8	Very low	44.3	Very low	153 Å²	153	120.5 Å²	120.5	80%	0.801	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-71.8	123.7	156.6	-96	89.1	0	0	0	107.4	V24	L22-V24 PolarHBondContact O-N 2.83Å
23	E	34.8	Very low	46.7	Very low	191 Å²	191	111.6 Å²	111.6	89%	0.893	55%	0.552	S	S	*	*			trans	-73.6	111.4	164.7	-77	-177.3	166.4	0	0	108.7
24	V	36.5	Very low	49.2	Very low	70 Å²	70	101.8 Å²	101.8	42%	0.424	51%	0.509	S	S	.	.			trans	-90.9	115.2	170.9	179.8	0	0	0	0	107.5	L22 L26 T162	L22-V24 PolarHBondContact O-N 2.83Å; V24-L26 PolarHBondContact O-N 3.18Å; V24-T162 HydrophobicContact CG1-CG2 4.26Å
25	S	43.2	Very low	52	Low	87 Å²	87	94.9 Å²	94.9	61%	0.608	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	112.8	170.7	59.8	0	0	0	0	109.6
26	L	53.1	Low	54.8	Low	49 Å²	49	84.1 Å²	84.1	26%	0.257	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.6	171.8	-78.3	144.8	0	0	0	109.3	V24 S109 A160 T162	V24-L26 PolarHBondContact O-N 3.18Å; L26-S109 WeakPolarHBondContact CB-O 3.35Å; L26-S109 WeakPolarHBondContact CB-OG 3.29Å; L26-S109 PolarHBondContact N-O 3.49Å; L26-S109 CarbonylContact O-C 3.55Å; L26-S109 PolarHBondContact O-N 3Å; L26-S109 VanDerWaalsContact O-O 3.08Å; L26-S109 PolarHBondContact O-OG 3.41Å; L26-A160 HydrophobicContact CD2-CB 4.41Å; L26-T162 VanDerWaalsContact CD2-OG1 3.3Å; L26-T162 WeakPolarHBondContact CD2-OG1 3.26Å
27	T	56.9	Low	57.4	Low	38 Å²	38	74.3 Å²	74.3	23%	0.233	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	138.5	169.7	-34.8	0	0	0	0	108	I83 A160 T161	T27-I83 HydrophobicContact CG2-CD1 3.53Å; T27-A160 CarbonylContact O-C 3.57Å; T27-A160 WeakPolarHBondContact O-CA 3.31Å; T27-T161 PolarHBondContact N-O 2.94Å; T27-T161 PolarHBondContact O-N 2.9Å; T27-T161 PolarHBondContact O-OG1 3Å
28	K	67.5	Low	60.2	Low	56 Å²	56	66.4 Å²	66.4	24%	0.243	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	150.4	171.4	-75.7	-166.7	170.2	-159.6	0	110.7	D106 Y107 D158 A159 A160	K28-D106 CarbonylContact O-C 3.54Å; K28-D106 WeakPolarHBondContact O-CA 3.34Å; K28-Y107 HydrophobicContact CB-CD1 3.99Å; K28-Y107 HydrophobicContact CB-CD2 4.13Å; K28-Y107 HydrophobicContact CB-CE1 3.47Å; K28-Y107 VanDerWaalsContact CB-CE1 3.47Å; K28-Y107 HydrophobicContact CB-CE2 3.66Å; K28-Y107 HydrophobicContact CB-CG 4.29Å; K28-Y107 HydrophobicContact CD-CE2 3.81Å; K28-Y107 WeakPolarHBondContact CD-OH 3.28Å; K28-Y107 HydrophobicContact CG-CE2 4.32Å; K28-Y107 PolarHBondContact N-O 2.06Å; K28-Y107 VanDerWaalsContact O-CD1 3.26Å; K28-Y107 WeakPolarHBondContact O-CD1 3.09Å; K28-Y107 PolarHBondContact O-N 3.46Å; K28-D158 IonicContact NZ-OD2 3.62Å; K28-D158 PolarHBondContact NZ-OD2 2.9Å; K28-A159 CarbonylContact C-O 3.55Å; K28-A159 VanDerWaalsContact CA-O 3.25Å; K28-A159 WeakPolarHBondContact CA-O 3.41Å; K28-A160 HydrophobicContact CG-CB 4.02Å
29	T	67.9	Low	63	Low	27 Å²	27	57.9 Å²	57.9	17%	0.166	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	125.1	178.2	-56.9	0	0	0	0	109.7	V104 I105 D106 D158 A159	T29-V104 HydrophobicContact CG2-CG1 3.46Å; T29-V104 VanDerWaalsContact CG2-CG1 3.46Å; T29-I105 CarbonylContact C-O 3.58Å; T29-I105 WeakPolarHBondContact CA-O 3.31Å; T29-D106 WeakPolarHBondContact CB-OD1 3.43Å; T29-D106 VanDerWaalsContact CG2-OD1 3.26Å; T29-D106 WeakPolarHBondContact CG2-OD1 3.39Å; T29-D106 PolarHBondContact OG1-OD1 3.25Å; T29-D158 WeakPolarHBondContact O-CA 3.05Å; T29-A159 PolarHBondContact N-O 2.88Å; T29-A159 PolarHBondContact O-N 2.95Å
30	A	70.8	Confident	65.5	Low	2 Å²	2	58.7 Å²	58.7	2%	0.017	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	127.7	172	0	0	0	0	0	110.4	V104 I105 Y107 V119 I157	A30-V104 WeakPolarHBondContact O-CA 3.37Å; A30-I105 PolarHBondContact N-O 3.09Å; A30-I105 PolarHBondContact O-N 3.38Å; A30-Y107 HydrophobicContact CB-CE1 4Å; A30-V119 HydrophobicContact CB-CB 4.37Å; A30-I157 CarbonylContact C-O 3.31Å; A30-I157 WeakPolarHBondContact CA-O 3.27Å
31	I	73.8	Confident	68.1	Low	36 Å²	36	57 Å²	57	19%	0.185	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	121	173.9	-57.1	-178.7	0	0	0	108.7	M102 L103 V104 T155 V156 I157	I31-M102 HydrophobicContact CG2-CG 3.76Å; I31-M102 HydrophobicContact CG2-SD 3.7Å; I31-L103 CarbonylContact C-O 3.55Å; I31-L103 WeakPolarHBondContact CA-O 3.4Å; I31-V104 HydrophobicContact CG1-CG1 4.39Å; I31-V104 HydrophobicContact CG1-CG2 4.37Å; I31-T155 CarbonylContact O-C 3.56Å; I31-V156 HydrophobicContact CB-CB 4.47Å; I31-V156 HydrophobicContact CG2-CB 4.29Å; I31-V156 PolarHBondContact O-N 3.09Å; I31-I157 HydrophobicContact CB-CB 4.36Å; I31-I157 HydrophobicContact CD1-CB 4.15Å; I31-I157 HydrophobicContact CD1-CD1 4.1Å; I31-I157 HydrophobicContact CD1-CG1 4.36Å; I31-I157 HydrophobicContact CG1-CB 4.32Å; I31-I157 PolarHBondContact N-O 3.06Å
32	I	80.2	Confident	70.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	131.2	-175.3	-63.4	174.2	0	0	0	109.8	V34 M102 L103 I105 V119 V124 I153 E154 T155	I32-V34 HydrophobicContact CG2-CG2 4.49Å; I32-M102 CarbonylContact O-C 3.59Å; I32-M102 WeakPolarHBondContact O-CA 3.25Å; I32-L103 HydrophobicContact CB-CB 4.4Å; I32-L103 PolarHBondContact N-O 2.99Å; I32-L103 PolarHBondContact O-N 2.99Å; I32-I105 HydrophobicContact CD1-CD1 4.04Å; I32-V119 HydrophobicContact CD1-CG1 3.87Å; I32-V124 HydrophobicContact CD1-CB 4.17Å; I32-V124 HydrophobicContact CD1-CG2 3.44Å; I32-V124 VanDerWaalsContact CD1-CG2 3.44Å; I32-V124 HydrophobicContact CG2-CG1 4.19Å; I32-I153 HydrophobicContact CG2-CG2 3.69Å; I32-E154 CarbonylContact C-O 3.55Å; I32-E154 VanDerWaalsContact CA-O 3.29Å; I32-E154 WeakPolarHBondContact CA-O 3.44Å; I32-T155 HydrophobicContact CG1-CG2 4.41Å
33	T	83	Confident	72.6	Confident	43 Å²	43	54.7 Å²	54.7	26%	0.264	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	140.4	173.5	53	0	0	0	0	110.2	A101 I153 E154 V156	T33-A101 CarbonylContact C-O 3.57Å; T33-A101 WeakPolarHBondContact CA-O 3.49Å; T33-I153 VanDerWaalsContact O-CA 3.27Å; T33-I153 WeakPolarHBondContact O-CA 3.45Å; T33-E154 PolarHBondContact N-O 3.3Å; T33-E154 PolarHBondContact O-N 3.39Å; T33-E154 PolarHBondContact OG1-O 3.39Å; T33-V156 HydrophobicContact CG2-CG2 3.67Å
34	V	85.8	Confident	75	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.012	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.5	177.2	-172.6	0	0	0	0	108.8	I32 L70 A101 L103 F145 L151 T152 I153	I32-V34 HydrophobicContact CG2-CG2 4.49Å; V34-L70 HydrophobicContact CB-CD1 4.39Å; V34-L70 HydrophobicContact CB-CD2 4.42Å; V34-L70 HydrophobicContact CG1-CD2 4.16Å; V34-L70 HydrophobicContact CG2-CD1 4.37Å; V34-L70 HydrophobicContact CG2-CD2 4.15Å; V34-A101 PolarHBondContact N-O 3.27Å; V34-A101 PolarHBondContact O-N 2.83Å; V34-L103 HydrophobicContact CG2-CD1 4.11Å; V34-F145 HydrophobicContact CG1-CD2 4.35Å; V34-F145 HydrophobicContact CG1-CE1 4.36Å; V34-F145 HydrophobicContact CG1-CE2 4.03Å; V34-F145 HydrophobicContact CG1-CZ 4.02Å; V34-L151 HydrophobicContact CG1-CD1 3.8Å; V34-T152 WeakPolarHBondContact CA-O 3.31Å; V34-I153 HydrophobicContact CG1-CG1 4.08Å; V34-I153 HydrophobicContact CG2-CG1 4.23Å
35	S	85.2	Confident	77.4	Confident	23 Å²	23	46.5 Å²	46.5	16%	0.161	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	138.5	175.8	-175.2	0	0	0	0	112.6	I98 G99 N100 T152	S35-I98 WeakPolarHBondContact OG-CG2 3.27Å; S35-G99 WeakPolarHBondContact CA-O 3.06Å; S35-G99 PolarHBondContact OG-O 3.05Å; S35-N100 WeakPolarHBondContact CB-OD1 3.43Å; S35-N100 PolarHBondContact OG-OD1 3.43Å; S35-T152 WeakPolarHBondContact CB-OG1 3.48Å; S35-T152 PolarHBondContact N-O 3.47Å; S35-T152 PolarHBondContact O-N 3.14Å; S35-T152 PolarHBondContact O-OG1 2.73Å
36	S	88.1	Confident	79.5	Confident	5 Å²	5	50.7 Å²	50.7	4%	0.035	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	172.1	167.2	-152.1	0	0	0	0	111.9	L38 I98 G99 G146 S149	S36-L38 PolarHBondContact O-N 3.3Å; S36-I98 WeakPolarHBondContact O-CA 3.36Å; S36-G99 PolarHBondContact N-O 2.73Å; S36-G99 PolarHBondContact O-N 3.13Å; S36-G146 PolarHBondContact OG-O 2.78Å; S36-S149 PolarHBondContact OG-OG 3.4Å
37	T	88.1	Confident	81	Confident	24 Å²	24	50.8 Å²	50.8	15%	0.147	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	130	168.5	-61.8	0	0	0	0	110	P44 G146 S149	T37-P44 HydrophobicContact CG2-CB 4.13Å; T37-G146 PolarHBondContact O-N 3.35Å; T37-S149 WeakPolarHBondContact CB-OG 3.32Å
38	L	89.1	Confident	82.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	135.1	177.1	-59.5	179.9	0	0	0	111	S36 L45 Y62 I66 F92 V97 I143 Y144 F145	S36-L38 PolarHBondContact O-N 3.3Å; L38-L45 HydrophobicContact CB-CD1 3.77Å; L38-L45 HydrophobicContact CB-CG 4.42Å; L38-L45 PolarHBondContact O-N 3.24Å; L38-Y62 HydrophobicContact CD1-CD2 4.32Å; L38-I66 HydrophobicContact CD1-CD1 3.73Å; L38-I66 HydrophobicContact CD2-CD1 3.84Å; L38-I66 HydrophobicContact CD2-CG1 4.1Å; L38-I66 HydrophobicContact CG-CD1 4.42Å; L38-F92 HydrophobicContact CD1-CD1 3.96Å; L38-F92 HydrophobicContact CD1-CE1 3.76Å; L38-V97 WeakPolarHBondContact CB-O 3.23Å; L38-V97 HydrophobicContact CD1-CG1 3.82Å; L38-V97 HydrophobicContact CG-CG1 4.45Å; L38-V97 WeakPolarHBondContact CG-O 3.23Å; L38-V97 PolarHBondContact N-O 2.82Å; L38-I143 HydrophobicContact CB-CG2 3.92Å; L38-I143 HydrophobicContact CD1-CG2 4.1Å; L38-I143 HydrophobicContact CD2-CG2 4.13Å; L38-I143 HydrophobicContact CG-CG2 4.27Å; L38-Y144 WeakPolarHBondContact CA-O 3.39Å; L38-F145 HydrophobicContact CD2-CD1 3.86Å; L38-F145 HydrophobicContact CD2-CE1 3.97Å
39	T	88	Confident	83.4	Confident	17 Å²	17	54.4 Å²	54.4	10%	0.104	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	146.2	-175.2	-56	0	0	0	0	109.2	K43 Y144	T39-K43 WeakPolarHBondContact CA-O 3.48Å; T39-K43 WeakPolarHBondContact CG2-O 3.39Å; T39-Y144 HydrophobicContact CG2-CE1 4.41Å; T39-Y144 HydrophobicContact CG2-CE2 3.85Å; T39-Y144 WeakPolarHBondContact CG2-OH 3.34Å; T39-Y144 PolarHBondContact N-O 2.78Å; T39-Y144 WeakPolarHBondContact O-CD1 3.36Å; T39-Y144 PolarHBondContact O-N 2.94Å
40	R	87.1	Confident	84.3	Confident	115 Å²	115	55.4 Å²	55.4	43%	0.434	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	129.3	170	178.3	170.5	59.2	177.9	-3.2	108.5	N42 K43 L45 D141	R40-N42 VanDerWaalsContact C-N 3.25Å; R40-N42 PolarHBondContact O-N 3.27Å; R40-K43 PolarHBondContact N-O 2.76Å; R40-K43 PolarHBondContact O-N 3.09Å; R40-L45 HydrophobicContact CB-CD2 3.72Å; R40-D141 WeakPolarHBondContact CD-O 3.42Å; R40-D141 VanDerWaalsContact CG-O 3.23Å; R40-D141 WeakPolarHBondContact CG-O 3.44Å
41	L	83.1	Confident	85	Confident	97 Å²	97	55.4 Å²	55.4	51%	0.508	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	45.4	-176.7	-60.6	170.7	0	0	0	112.8	K43 S140 D141	L41-K43 PolarHBondContact O-N 2.97Å; L41-K43 VanDerWaalsContact O-N 3.16Å; L41-S140 WeakPolarHBondContact CD2-O 3.41Å; L41-D141 HydrophobicContact CD1-CB 4.45Å; L41-D141 HydrophobicContact CD2-CB 4.45Å; L41-D141 HydrophobicContact CG-CB 4.47Å
42	N	79.2	Confident	85.4	Confident	112 Å²	112	59.3 Å²	59.3	60%	0.599	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	20	-177.3	-63.6	-45.7	0	0	0	115.5	R40 Y144	R40-N42 VanDerWaalsContact C-N 3.25Å; R40-N42 PolarHBondContact O-N 3.27Å; N42-Y144 VanDerWaalsContact CA-OH 3.29Å; N42-Y144 WeakPolarHBondContact CA-OH 3.42Å; N42-Y144 PolarHBondContact N-OH 3.37Å; N42-Y144 PolarHBondContact OD1-OH 3.34Å
43	K	84.1	Confident	85.4	Confident	154 Å²	154	62.9 Å²	62.9	67%	0.67	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	131.5	173	-66.7	-177.7	179.8	178.7	0	110.7	T39 R40 L41	T39-K43 WeakPolarHBondContact CA-O 3.48Å; T39-K43 WeakPolarHBondContact CG2-O 3.39Å; R40-K43 PolarHBondContact N-O 2.76Å; R40-K43 PolarHBondContact O-N 3.09Å; L41-K43 PolarHBondContact O-N 2.97Å; L41-K43 VanDerWaalsContact O-N 3.16Å
44	P	84.4	Confident	85.2	Confident	77 Å²	77	64.3 Å²	64.3	50%	0.5	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	142	174.8	26.2	-32.9	0	0	0	109.8	T37	T37-P44 HydrophobicContact CG2-CB 4.13Å
45	L	87.6	Confident	85.1	Confident	12 Å²	12	70.5 Å²	70.5	6%	0.063	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-73.8	143.2	178	-64.4	175.9	0	0	0	111	L38 R40 Y62 V97 I143	L38-L45 HydrophobicContact CB-CD1 3.77Å; L38-L45 HydrophobicContact CB-CG 4.42Å; L38-L45 PolarHBondContact O-N 3.24Å; R40-L45 HydrophobicContact CB-CD2 3.72Å; L45-Y62 HydrophobicContact CD1-CD2 4.37Å; L45-Y62 HydrophobicContact CD1-CE2 3.61Å; L45-V97 HydrophobicContact CB-CB 4.14Å; L45-V97 HydrophobicContact CB-CG2 4Å; L45-V97 PolarHBondContact O-N 3.01Å; L45-I143 HydrophobicContact CD1-CD1 3.94Å; L45-I143 HydrophobicContact CD1-CG1 3.96Å; L45-I143 HydrophobicContact CD1-CG2 3.86Å
46	E	85.8	Confident	85.2	Confident	176 Å²	176	70.3 Å²	70.3	82%	0.822	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-81.7	146	173.9	-65.5	-170.1	168.7	0	0	111.3	V97	E46-V97 WeakPolarHBondContact O-CG2 3.4Å
47	W	85.7	Confident	85.3	Confident	51 Å²	51	76 Å²	76	19%	0.193	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-67.7	134.5	180	179.7	-97.3	0	0	0	112.4	D49 L51 L52 F92 S93 R94 V97	W47-D49 PolarHBondContact NE1-OD1 3.43Å; W47-L51 HydrophobicContact CE3-CD1 4.33Å; W47-L51 HydrophobicContact CH2-CB 4.28Å; W47-L51 HydrophobicContact CZ3-CB 4.33Å; W47-L51 HydrophobicContact CZ3-CD1 4.33Å; W47-L52 HydrophobicContact CH2-CD2 3.95Å; W47-L52 HydrophobicContact CH2-CG 4.31Å; W47-L52 HydrophobicContact CZ2-CD1 4.23Å; W47-L52 HydrophobicContact CZ2-CD2 3.72Å; W47-L52 HydrophobicContact CZ2-CG 3.75Å; W47-F92 HydrophobicContact CZ3-CB 4.19Å; W47-S93 WeakPolarHBondContact CZ3-O 3.3Å; W47-R94 HydrophobicContact CD2-CB 4.12Å; W47-R94 HydrophobicContact CD2-CG 3.78Å; W47-R94 HydrophobicContact CE3-CB 4.22Å; W47-R94 HydrophobicContact CE3-CG 4.32Å; W47-R94 HydrophobicContact CG-CG 3.96Å; W47-R94 HydrophobicContact CH2-CB 4.18Å; W47-R94 HydrophobicContact CZ2-CB 4.08Å; W47-R94 HydrophobicContact CZ2-CG 4.24Å; W47-R94 HydrophobicContact CZ3-CB 4.26Å; W47-V97 HydrophobicContact CE3-CG2 4.23Å
48	N	87	Confident	85.3	Confident	75 Å²	75	76.8 Å²	76.8	40%	0.401	40%	0.398	S	S	.	.			trans	-129.3	129.5	171.6	-174	-39.8	0	0	0	108.9	S50 L51 L58	N48-S50 PolarHBondContact O-N 3.23Å; N48-S50 VanDerWaalsContact OD1-CB 3.3Å; N48-S50 WeakPolarHBondContact OD1-CB 3.49Å; N48-S50 PolarHBondContact OD1-N 3.26Å; N48-S50 PolarHBondContact OD1-OG 3.46Å; N48-L51 WeakPolarHBondContact O-CB 3.32Å; N48-L51 WeakPolarHBondContact O-CG 3.42Å; N48-L51 PolarHBondContact O-N 3.24Å; N48-L58 HydrophobicContact CB-CD2 3.6Å
49	D	86.8	Confident	85.3	Confident	95 Å²	95	78.2 Å²	78.2	51%	0.508	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-62.5	-16.4	-177.7	-68.6	-26.1	0	0	0	113.2	W47 L51 L52	W47-D49 PolarHBondContact NE1-OD1 3.43Å; D49-L51 PolarHBondContact O-N 2.9Å; D49-L52 HydrophobicContact CB-CD1 4.5Å; D49-L52 VanDerWaalsContact O-CB 3.31Å; D49-L52 WeakPolarHBondContact O-CB 3.29Å; D49-L52 PolarHBondContact O-N 3.29Å
50	S	87.5	Confident	85.3	Confident	48 Å²	48	84.3 Å²	84.3	34%	0.336	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-60.1	-26.6	171.1	-49.2	0	0	0	0	112.2	N48 L52 D53 S56	N48-S50 PolarHBondContact O-N 3.23Å; N48-S50 VanDerWaalsContact OD1-CB 3.3Å; N48-S50 WeakPolarHBondContact OD1-CB 3.49Å; N48-S50 PolarHBondContact OD1-N 3.26Å; N48-S50 PolarHBondContact OD1-OG 3.46Å; S50-L52 PolarHBondContact O-N 2.92Å; S50-L52 VanDerWaalsContact O-N 3.13Å; S50-D53 PolarHBondContact O-N 3.46Å; S50-S56 PolarHBondContact O-OG 3.03Å
51	L	85.7	Confident	85.4	Confident	2 Å²	2	82.5 Å²	82.5	1%	0.01	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-68.9	-4.8	175	-62.8	174.8	0	0	0	113.9	W47 N48 D49 L58 Y59 Y62 F92 V97	W47-L51 HydrophobicContact CE3-CD1 4.33Å; W47-L51 HydrophobicContact CH2-CB 4.28Å; W47-L51 HydrophobicContact CZ3-CB 4.33Å; W47-L51 HydrophobicContact CZ3-CD1 4.33Å; N48-L51 WeakPolarHBondContact O-CB 3.32Å; N48-L51 WeakPolarHBondContact O-CG 3.42Å; N48-L51 PolarHBondContact O-N 3.24Å; D49-L51 PolarHBondContact O-N 2.9Å; L51-L58 HydrophobicContact CD2-CD2 4.02Å; L51-L58 HydrophobicContact CD2-CG 3.91Å; L51-L58 HydrophobicContact CG-CD2 4.02Å; L51-L58 HydrophobicContact CG-CG 4.46Å; L51-Y59 VanDerWaalsContact O-CD2 3.29Å; L51-Y59 WeakPolarHBondContact O-CD2 3.42Å; L51-Y62 HydrophobicContact CD1-CD2 4.23Å; L51-Y62 HydrophobicContact CD1-CE2 4.13Å; L51-Y62 HydrophobicContact CD2-CD2 3.63Å; L51-Y62 HydrophobicContact CD2-CE2 4.1Å; L51-Y62 HydrophobicContact CD2-CG 4.08Å; L51-F92 HydrophobicContact CB-CB 4.14Å; L51-F92 HydrophobicContact CB-CD2 4.16Å; L51-F92 HydrophobicContact CB-CG 4.3Å; L51-F92 HydrophobicContact CD2-CD2 4.03Å; L51-F92 HydrophobicContact CD2-CE2 4.17Å; L51-F92 HydrophobicContact CD2-CG 4.31Å; L51-V97 HydrophobicContact CD1-CB 4.47Å; L51-V97 HydrophobicContact CD1-CG1 3.58Å; L51-V97 HydrophobicContact CD1-CG2 3.95Å
52	L	81.1	Confident	85.8	Confident	117 Å²	117	78.7 Å²	78.7	61%	0.613	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-86.6	-17.4	170.3	-63	170.8	0	0	0	112.8	W47 D49 S50 P54	W47-L52 HydrophobicContact CH2-CD2 3.95Å; W47-L52 HydrophobicContact CH2-CG 4.31Å; W47-L52 HydrophobicContact CZ2-CD1 4.23Å; W47-L52 HydrophobicContact CZ2-CD2 3.72Å; W47-L52 HydrophobicContact CZ2-CG 3.75Å; D49-L52 HydrophobicContact CB-CD1 4.5Å; D49-L52 VanDerWaalsContact O-CB 3.31Å; D49-L52 WeakPolarHBondContact O-CB 3.29Å; D49-L52 PolarHBondContact O-N 3.29Å; S50-L52 PolarHBondContact O-N 2.92Å; S50-L52 VanDerWaalsContact O-N 3.13Å; L52-P54 WeakPolarHBondContact O-CD 3.45Å
53	D	80.6	Confident	86.2	Confident	76 Å²	76	74.2 Å²	74.2	41%	0.406	38%	0.38	S	S	.	.			trans	-105.5	108.7	179.7	-180	8.7	0	0	0	110.2	S50 N55 S56 Y59	S50-D53 PolarHBondContact O-N 3.46Å; D53-N55 PolarHBondContact O-N 3.35Å; D53-N55 WeakPolarHBondContact OD1-CB 3.34Å; D53-N55 PolarHBondContact OD1-N 3.2Å; D53-N55 PolarHBondContact OD1-ND2 3.38Å; D53-S56 WeakPolarHBondContact O-CB 3.31Å; D53-S56 PolarHBondContact O-N 2.93Å; D53-S56 PolarHBondContact O-OG 2.91Å; D53-Y59 WeakPolarHBondContact O-CB 3.15Å
54	P	79.3	Confident	86.4	Confident	72 Å²	72	70.6 Å²	70.6	47%	0.468	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-20.8	176.8	-26.6	35.9	0	0	0	115	L52 Y59	L52-P54 WeakPolarHBondContact O-CD 3.45Å; P54-Y59 HydrophobicContact CB-CD1 4.19Å; P54-Y59 HydrophobicContact CB-CE1 4.04Å; P54-Y59 HydrophobicContact CG-CE2 4.33Å
55	N	83.2	Confident	86.7	Confident	132 Å²	132	68.9 Å²	68.9	71%	0.706	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-9.2	178.9	-55.1	-67.5	0	0	0	113.2	D53	D53-N55 PolarHBondContact O-N 3.35Å; D53-N55 WeakPolarHBondContact OD1-CB 3.34Å; D53-N55 PolarHBondContact OD1-N 3.2Å; D53-N55 PolarHBondContact OD1-ND2 3.38Å
56	S	88.4	Confident	86.8	Confident	19 Å²	19	68.4 Å²	68.4	13%	0.133	35%	0.353	C	S	.	.	S	Bend	trans	-68.1	146.7	178.1	76.2	0	0	0	0	110.8	S50 D53 L58 Y59 R60	S50-S56 PolarHBondContact O-OG 3.03Å; D53-S56 WeakPolarHBondContact O-CB 3.31Å; D53-S56 PolarHBondContact O-N 2.93Å; D53-S56 PolarHBondContact O-OG 2.91Å; S56-L58 PolarHBondContact O-N 3.46Å; S56-Y59 PolarHBondContact O-N 3.45Å; S56-Y59 VanDerWaalsContact OG-CB 3.24Å; S56-Y59 WeakPolarHBondContact OG-CB 3.22Å; S56-Y59 PolarHBondContact OG-N 3.14Å; S56-R60 PolarHBondContact O-N 3.48Å
57	D	88.6	Confident	87	Confident	124 Å²	124	60.8 Å²	60.8	66%	0.663	32%	0.32	S	S	*	.	H	α-helix	trans	-59.4	-35.5	176.4	-67.5	-36.4	0	0	0	111.5	R60 D61	D57-R60 PolarHBondContact O-N 2.93Å; D57-R60 IonicContact OD1-NH1 2.78Å; D57-D61 VanDerWaalsContact O-CB 3.24Å; D57-D61 WeakPolarHBondContact O-CB 3.38Å; D57-D61 PolarHBondContact O-N 3.23Å
58	L	88.8	Confident	87.2	Confident	42 Å²	42	62 Å²	62	22%	0.22	33%	0.33	C	S	.	.	H	α-helix	trans	-67.3	-42.6	178.4	-168.8	70.2	0	0	0	112.1	N48 L51 S56 Y62	N48-L58 HydrophobicContact CB-CD2 3.6Å; L51-L58 HydrophobicContact CD2-CD2 4.02Å; L51-L58 HydrophobicContact CD2-CG 3.91Å; L51-L58 HydrophobicContact CG-CD2 4.02Å; L51-L58 HydrophobicContact CG-CG 4.46Å; S56-L58 PolarHBondContact O-N 3.46Å; L58-Y62 HydrophobicContact CD1-CD1 4Å; L58-Y62 HydrophobicContact CD1-CE1 3.45Å; L58-Y62 VanDerWaalsContact CD1-CE1 3.45Å; L58-Y62 HydrophobicContact CG-CD1 4.36Å; L58-Y62 HydrophobicContact CG-CE1 4.15Å; L58-Y62 WeakPolarHBondContact O-CB 3.34Å; L58-Y62 WeakPolarHBondContact O-CD1 3.44Å; L58-Y62 PolarHBondContact O-N 2.95Å
59	Y	88.3	Confident	87.4	Confident	30 Å²	30	58.7 Å²	58.7	12%	0.118	31%	0.312	C	S	.	.	H	α-helix	trans	-62.9	-45.8	176.5	-174.8	-75.5	0	0	0	110.8	L51 D53 P54 S56 S63 F92	L51-Y59 VanDerWaalsContact O-CD2 3.29Å; L51-Y59 WeakPolarHBondContact O-CD2 3.42Å; D53-Y59 WeakPolarHBondContact O-CB 3.15Å; P54-Y59 HydrophobicContact CB-CD1 4.19Å; P54-Y59 HydrophobicContact CB-CE1 4.04Å; P54-Y59 HydrophobicContact CG-CE2 4.33Å; S56-Y59 PolarHBondContact O-N 3.45Å; S56-Y59 VanDerWaalsContact OG-CB 3.24Å; S56-Y59 WeakPolarHBondContact OG-CB 3.22Å; S56-Y59 PolarHBondContact OG-N 3.14Å; Y59-S63 WeakPolarHBondContact CD1-OG 3.23Å; Y59-S63 VanDerWaalsContact CE1-OG 3.26Å; Y59-S63 WeakPolarHBondContact CE1-OG 3.15Å; Y59-S63 VanDerWaalsContact O-CB 3.22Å; Y59-S63 WeakPolarHBondContact O-CB 3.44Å; Y59-S63 PolarHBondContact O-N 3.41Å; Y59-S63 PolarHBondContact O-OG 3.47Å; Y59-F92 HydrophobicContact CD1-CE2 4.28Å; Y59-F92 AromaticContact CD2-CD2 3.6Å; Y59-F92 HydrophobicContact CD2-CD2 3.6Å; Y59-F92 AromaticContact CD2-CE2 3.57Å; Y59-F92 HydrophobicContact CD2-CE2 3.57Å; Y59-F92 HydrophobicContact CE1-CE2 4.29Å; Y59-F92 AromaticContact CE2-CD2 3.52Å; Y59-F92 HydrophobicContact CE2-CD2 3.52Å; Y59-F92 AromaticContact CE2-CE2 3.6Å; Y59-F92 HydrophobicContact CE2-CE2 3.6Å; Y59-F92 HydrophobicContact CG-CD2 4.37Å; Y59-F92 AromaticContact CG-CE2 3.91Å; Y59-F92 HydrophobicContact CG-CE2 3.91Å; Y59-F92 AromaticContact CZ-CE2 3.96Å
60	R	88.1	Confident	87.6	Confident	145 Å²	145	54.1 Å²	54.1	55%	0.547	29%	0.288	S	S	.	.	H	α-helix	trans	-63.7	-46.9	179.9	-75.2	177.2	56.2	-127.3	-5.7	111.8	S56 D57 S63 T64	S56-R60 PolarHBondContact O-N 3.48Å; D57-R60 PolarHBondContact O-N 2.93Å; D57-R60 IonicContact OD1-NH1 2.78Å; R60-S63 PolarHBondContact O-N 3.13Å; R60-T64 WeakPolarHBondContact O-CB 3.18Å; R60-T64 PolarHBondContact O-N 3.14Å; R60-T64 PolarHBondContact O-OG1 3.19Å; R60-T64 VanDerWaalsContact O-OG1 3.08Å
61	D	90.1	Very high	87.6	Confident	76 Å²	76	54 Å²	54	41%	0.406	28%	0.283	S	S	.	.	H	α-helix	trans	-58.8	-50.8	177.6	177.1	47.1	0	0	0	111.8	D57 S63 T64 Q65	D57-D61 VanDerWaalsContact O-CB 3.24Å; D57-D61 WeakPolarHBondContact O-CB 3.38Å; D57-D61 PolarHBondContact O-N 3.23Å; D61-S63 VanDerWaalsContact C-N 3.29Å; D61-S63 PolarHBondContact O-N 3.37Å; D61-T64 PolarHBondContact O-N 2.81Å; D61-Q65 VanDerWaalsContact CG-NE2 3.25Å; D61-Q65 WeakPolarHBondContact O-CG 3.43Å; D61-Q65 PolarHBondContact O-N 3.47Å; D61-Q65 PolarHBondContact OD1-NE2 2.97Å; D61-Q65 PolarHBondContact OD2-NE2 3.37Å; D61-Q65 VanDerWaalsContact OD2-NE2 3.08Å
62	Y	91.2	Very high	87.7	Confident	18 Å²	18	58.5 Å²	58.5	7%	0.071	30%	0.304	C	S	.	.	H	α-helix	trans	-64	-37.8	179.3	-79	27.9	0	0	0	111.3	L38 L45 L51 L58 I66 F92 I143	L38-Y62 HydrophobicContact CD1-CD2 4.32Å; L45-Y62 HydrophobicContact CD1-CD2 4.37Å; L45-Y62 HydrophobicContact CD1-CE2 3.61Å; L51-Y62 HydrophobicContact CD1-CD2 4.23Å; L51-Y62 HydrophobicContact CD1-CE2 4.13Å; L51-Y62 HydrophobicContact CD2-CD2 3.63Å; L51-Y62 HydrophobicContact CD2-CE2 4.1Å; L51-Y62 HydrophobicContact CD2-CG 4.08Å; L58-Y62 HydrophobicContact CD1-CD1 4Å; L58-Y62 HydrophobicContact CD1-CE1 3.45Å; L58-Y62 VanDerWaalsContact CD1-CE1 3.45Å; L58-Y62 HydrophobicContact CG-CD1 4.36Å; L58-Y62 HydrophobicContact CG-CE1 4.15Å; L58-Y62 WeakPolarHBondContact O-CB 3.34Å; L58-Y62 WeakPolarHBondContact O-CD1 3.44Å; L58-Y62 PolarHBondContact O-N 2.95Å; Y62-I66 WeakPolarHBondContact O-CB 3.37Å; Y62-I66 WeakPolarHBondContact O-CD1 3.34Å; Y62-I66 VanDerWaalsContact O-CG1 3.26Å; Y62-I66 WeakPolarHBondContact O-CG1 3.46Å; Y62-I66 PolarHBondContact O-N 3.05Å; Y62-F92 HydrophobicContact CD2-CE1 4.31Å; Y62-I143 HydrophobicContact CD1-CD1 3.23Å; Y62-I143 HydrophobicContact CD2-CD1 4.02Å; Y62-I143 HydrophobicContact CE1-CD1 3.27Å; Y62-I143 HydrophobicContact CE2-CD1 4.06Å; Y62-I143 HydrophobicContact CG-CD1 3.63Å
63	S	87.4	Confident	87.9	Confident	17 Å²	17	53 Å²	53	12%	0.119	28%	0.275	C	S	.	.	H	α-helix	trans	-66.5	-42.7	178.2	-61.1	0	0	0	0	112.2	Y59 R60 D61 I66 C67	Y59-S63 WeakPolarHBondContact CD1-OG 3.23Å; Y59-S63 VanDerWaalsContact CE1-OG 3.26Å; Y59-S63 WeakPolarHBondContact CE1-OG 3.15Å; Y59-S63 VanDerWaalsContact O-CB 3.22Å; Y59-S63 WeakPolarHBondContact O-CB 3.44Å; Y59-S63 PolarHBondContact O-N 3.41Å; Y59-S63 PolarHBondContact O-OG 3.47Å; R60-S63 PolarHBondContact O-N 3.13Å; D61-S63 VanDerWaalsContact C-N 3.29Å; D61-S63 PolarHBondContact O-N 3.37Å; S63-I66 PolarHBondContact O-N 3.29Å; S63-C67 PolarHBondContact O-N 2.72Å
64	T	89	Confident	87.9	Confident	78 Å²	78	49.4 Å²	49.4	48%	0.479	26%	0.256	S	S	.	.	H	α-helix	trans	-61.3	-50.5	175.4	-66.4	0	0	0	0	110.6	R60 D61 I66 C67 D68	R60-T64 WeakPolarHBondContact O-CB 3.18Å; R60-T64 PolarHBondContact O-N 3.14Å; R60-T64 PolarHBondContact O-OG1 3.19Å; R60-T64 VanDerWaalsContact O-OG1 3.08Å; D61-T64 PolarHBondContact O-N 2.81Å; T64-I66 VanDerWaalsContact C-N 3.33Å; T64-I66 PolarHBondContact O-N 2.9Å; T64-C67 PolarHBondContact O-N 2.91Å; T64-D68 WeakPolarHBondContact CG2-OD2 3.18Å; T64-D68 WeakPolarHBondContact O-CB 3.31Å; T64-D68 PolarHBondContact O-N 3.18Å
65	Q	90.6	Very high	87.7	Confident	42 Å²	42	51.7 Å²	51.7	20%	0.196	26%	0.264	C	S	.	.	H	α-helix	trans	-60.9	-39.3	180	-71.1	-177.3	57.3	0	0	112.9	D61 L69 I143	D61-Q65 VanDerWaalsContact CG-NE2 3.25Å; D61-Q65 WeakPolarHBondContact O-CG 3.43Å; D61-Q65 PolarHBondContact O-N 3.47Å; D61-Q65 PolarHBondContact OD1-NE2 2.97Å; D61-Q65 PolarHBondContact OD2-NE2 3.37Å; D61-Q65 VanDerWaalsContact OD2-NE2 3.08Å; Q65-L69 WeakPolarHBondContact O-CB 3.28Å; Q65-L69 PolarHBondContact O-N 3.46Å; Q65-I143 HydrophobicContact CB-CB 4.39Å
66	I	90.4	Very high	87	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-64.7	-46.5	176	-73.1	167.6	0	0	0	111.3	L38 Y62 S63 T64 L69 L70 V89 F92 A101 F145	L38-I66 HydrophobicContact CD1-CD1 3.73Å; L38-I66 HydrophobicContact CD2-CD1 3.84Å; L38-I66 HydrophobicContact CD2-CG1 4.1Å; L38-I66 HydrophobicContact CG-CD1 4.42Å; Y62-I66 WeakPolarHBondContact O-CB 3.37Å; Y62-I66 WeakPolarHBondContact O-CD1 3.34Å; Y62-I66 VanDerWaalsContact O-CG1 3.26Å; Y62-I66 WeakPolarHBondContact O-CG1 3.46Å; Y62-I66 PolarHBondContact O-N 3.05Å; S63-I66 PolarHBondContact O-N 3.29Å; T64-I66 VanDerWaalsContact C-N 3.33Å; T64-I66 PolarHBondContact O-N 2.9Å; I66-L69 WeakPolarHBondContact O-CB 3.43Å; I66-L69 PolarHBondContact O-N 2.73Å; I66-L70 HydrophobicContact CG2-CD1 4.12Å; I66-L70 WeakPolarHBondContact O-CG 3.45Å; I66-L70 PolarHBondContact O-N 3.39Å; I66-V89 HydrophobicContact CB-CG2 4.03Å; I66-V89 HydrophobicContact CG2-CG2 3.82Å; I66-F92 HydrophobicContact CD1-CE1 3.59Å; I66-F92 HydrophobicContact CD1-CZ 4.13Å; I66-A101 HydrophobicContact CG2-CB 3.91Å; I66-F145 HydrophobicContact CG2-CE2 3.95Å; I66-F145 HydrophobicContact CG2-CZ 3.55Å
67	C	89.8	Confident	85.9	Confident	17 Å²	17	49 Å²	49	12%	0.115	25%	0.254	C	S	.	.	H	α-helix	trans	-70.5	-36.2	-179.2	-82.2	0	0	0	0	112.5	S63 T64 L69 L70 L71 C87	S63-C67 PolarHBondContact O-N 2.72Å; T64-C67 PolarHBondContact O-N 2.91Å; C67-L69 VanDerWaalsContact C-N 3.34Å; C67-L70 PolarHBondContact O-N 2.93Å; C67-L71 VanDerWaalsContact O-CB 3.3Å; C67-L71 WeakPolarHBondContact O-CB 3.45Å; C67-L71 WeakPolarHBondContact O-CG 3.24Å; C67-L71 PolarHBondContact O-N 3.36Å; C67-C87 WeakPolarHBondContact CA-SG 3.36Å; C67-C87 HydrophobicContact CB-CB 3.64Å; C67-C87 WeakPolarHBondContact CB-SG 3.5Å; C67-C87 WeakPolarHBondContact SG-CB 3.47Å; C67-C87 CovalentContact SG-SG 2.06Å; C67-C87 PolarHBondContact SG-SG 3.32Å
68	D	89.6	Confident	84.4	Confident	75 Å²	75	50.3 Å²	50.3	40%	0.401	25%	0.251	S	S	.	.	H	α-helix	trans	-59	-49	171.1	-70.2	-16.9	0	0	0	109.7	T64 L70 L71 H72	T64-D68 WeakPolarHBondContact CG2-OD2 3.18Å; T64-D68 WeakPolarHBondContact O-CB 3.31Å; T64-D68 PolarHBondContact O-N 3.18Å; D68-L70 VanDerWaalsContact C-N 3.34Å; D68-L70 PolarHBondContact O-N 2.76Å; D68-L71 PolarHBondContact O-N 2.8Å; D68-H72 WeakPolarHBondContact O-CB 3.4Å; D68-H72 PolarHBondContact O-N 3.43Å; D68-H72 PolarHBondContact O-ND1 3.45Å
69	L	91.3	Very high	83.1	Confident	6 Å²	6	49.4 Å²	49.4	3%	0.031	25%	0.246	C	C	.	.	H	α-helix	trans	-54.5	-48.9	176.4	179.4	157.6	0	0	0	112.1	Q65 I66 C67 S73 V128 Y131 I132 I135 Y144 F145	Q65-L69 WeakPolarHBondContact O-CB 3.28Å; Q65-L69 PolarHBondContact O-N 3.46Å; I66-L69 WeakPolarHBondContact O-CB 3.43Å; I66-L69 PolarHBondContact O-N 2.73Å; C67-L69 VanDerWaalsContact C-N 3.34Å; L69-S73 WeakPolarHBondContact O-CB 3.27Å; L69-S73 PolarHBondContact O-N 3.3Å; L69-S73 PolarHBondContact O-OG 2.77Å; L69-V128 HydrophobicContact CD2-CG1 4.47Å; L69-Y131 HydrophobicContact CG-CD1 4Å; L69-Y131 HydrophobicContact CG-CE1 4.18Å; L69-I132 HydrophobicContact CD1-CG1 4.29Å; L69-I132 HydrophobicContact CD2-CG1 4.48Å; L69-I135 HydrophobicContact CD1-CD1 3.73Å; L69-I135 HydrophobicContact CG-CD1 4.19Å; L69-Y144 VanDerWaalsContact CD1-CA 3.5Å; L69-Y144 VanDerWaalsContact CD1-CB 3.43Å; L69-F145 HydrophobicContact CD2-CD2 3.94Å; L69-F145 HydrophobicContact CD2-CE2 4.15Å
70	L	90.1	Very high	81.3	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-69.3	-45.1	-177	-68.6	175.4	0	0	0	112.3	V34 I66 C67 D68 H72 S73 I74 A101 L103 V128 F145	V34-L70 HydrophobicContact CB-CD1 4.39Å; V34-L70 HydrophobicContact CB-CD2 4.42Å; V34-L70 HydrophobicContact CG1-CD2 4.16Å; V34-L70 HydrophobicContact CG2-CD1 4.37Å; V34-L70 HydrophobicContact CG2-CD2 4.15Å; I66-L70 HydrophobicContact CG2-CD1 4.12Å; I66-L70 WeakPolarHBondContact O-CG 3.45Å; I66-L70 PolarHBondContact O-N 3.39Å; C67-L70 PolarHBondContact O-N 2.93Å; D68-L70 VanDerWaalsContact C-N 3.34Å; D68-L70 PolarHBondContact O-N 2.76Å; L70-H72 VanDerWaalsContact C-N 3.35Å; L70-H72 PolarHBondContact O-N 2.8Å; L70-S73 WeakPolarHBondContact CA-OG 3.43Å; L70-S73 PolarHBondContact O-N 2.78Å; L70-S73 PolarHBondContact O-OG 2.85Å; L70-I74 WeakPolarHBondContact O-CG1 3.48Å; L70-I74 PolarHBondContact O-N 3.07Å; L70-A101 HydrophobicContact CD1-CB 3.52Å; L70-L103 HydrophobicContact CB-CD1 4.33Å; L70-L103 HydrophobicContact CB-CD2 4.01Å; L70-L103 HydrophobicContact CB-CG 4.49Å; L70-L103 HydrophobicContact CD1-CD1 4.44Å; L70-L103 HydrophobicContact CD1-CD2 4.49Å; L70-L103 HydrophobicContact CD1-CG 4.33Å; L70-L103 HydrophobicContact CD2-CD1 4.4Å; L70-V128 HydrophobicContact CD2-CG1 4.34Å; L70-V128 HydrophobicContact CD2-CG2 3.72Å; L70-F145 HydrophobicContact CD1-CE2 4.13Å; L70-F145 HydrophobicContact CD1-CZ 4.35Å; L70-F145 HydrophobicContact CD2-CD2 4.42Å; L70-F145 HydrophobicContact CD2-CE2 3.77Å; L70-F145 HydrophobicContact CG-CE2 3.95Å
71	L	88.7	Confident	79.8	Confident	45 Å²	45	47.7 Å²	47.7	24%	0.236	25%	0.25	C	S	.	.	H	α-helix	trans	-62.5	-43.1	178.1	-69.6	172.6	0	0	0	111.2	C67 D68 S73 I74 N75 V85 C87	C67-L71 VanDerWaalsContact O-CB 3.3Å; C67-L71 WeakPolarHBondContact O-CB 3.45Å; C67-L71 WeakPolarHBondContact O-CG 3.24Å; C67-L71 PolarHBondContact O-N 3.36Å; D68-L71 PolarHBondContact O-N 2.8Å; L71-S73 VanDerWaalsContact C-N 3.35Å; L71-I74 PolarHBondContact O-N 3.44Å; L71-N75 VanDerWaalsContact O-CB 3.26Å; L71-N75 WeakPolarHBondContact O-CB 3.36Å; L71-N75 PolarHBondContact O-N 2.87Å; L71-N75 PolarHBondContact O-ND2 3.24Å; L71-V85 HydrophobicContact CD2-CB 4.11Å; L71-V85 HydrophobicContact CD2-CG1 3.77Å; L71-C87 HydrophobicContact CD1-CB 4.44Å; L71-C87 HydrophobicContact CD2-CB 4.19Å; L71-C87 HydrophobicContact CG-CB 4.07Å
72	H	86.2	Confident	78.7	Confident	97 Å²	97	46.3 Å²	46.3	45%	0.449	24%	0.242	S	C	.	.	H	α-helix	trans	-65.9	-38.5	174.9	-71.9	87.5	0	0	0	111.6	D68 L70 I74 N75 S76 Y131	D68-H72 WeakPolarHBondContact O-CB 3.4Å; D68-H72 PolarHBondContact O-N 3.43Å; D68-H72 PolarHBondContact O-ND1 3.45Å; L70-H72 VanDerWaalsContact C-N 3.35Å; L70-H72 PolarHBondContact O-N 2.8Å; H72-I74 PolarHBondContact O-N 3Å; H72-N75 PolarHBondContact O-N 3.16Å; H72-S76 WeakPolarHBondContact O-CB 3.24Å; H72-S76 PolarHBondContact O-N 3.4Å; H72-S76 PolarHBondContact O-OG 3.34Å; H72-Y131 HydrophobicContact CB-CD2 4.38Å; H72-Y131 HydrophobicContact CB-CE1 4.07Å; H72-Y131 HydrophobicContact CB-CE2 3.54Å; H72-Y131 WeakPolarHBondContact CB-OH 3.49Å
73	S	86.2	Confident	77.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.6	-45.4	176.5	74.6	0	0	0	0	111.9	L69 L70 L71 S76 T77 V128	L69-S73 WeakPolarHBondContact O-CB 3.27Å; L69-S73 PolarHBondContact O-N 3.3Å; L69-S73 PolarHBondContact O-OG 2.77Å; L70-S73 WeakPolarHBondContact CA-OG 3.43Å; L70-S73 PolarHBondContact O-N 2.78Å; L70-S73 PolarHBondContact O-OG 2.85Å; L71-S73 VanDerWaalsContact C-N 3.35Å; S73-S76 PolarHBondContact O-OG 2.72Å; S73-T77 PolarHBondContact O-N 2.95Å; S73-T77 PolarHBondContact O-OG1 2.61Å; S73-V128 WeakPolarHBondContact OG-CG2 3.4Å
74	I	80.7	Confident	76.7	Confident	2 Å²	2	53 Å²	53	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-70.5	-46.1	178.2	-59.9	-58.1	0	0	0	111.4	L70 L71 H72 S76 T77 I79 I82 V85 L103 V124 A127	L70-I74 WeakPolarHBondContact O-CG1 3.48Å; L70-I74 PolarHBondContact O-N 3.07Å; L71-I74 PolarHBondContact O-N 3.44Å; H72-I74 PolarHBondContact O-N 3Å; I74-S76 VanDerWaalsContact C-N 3.26Å; I74-S76 PolarHBondContact O-N 3.31Å; I74-T77 PolarHBondContact O-N 3.47Å; I74-I79 HydrophobicContact CG2-CD1 4.33Å; I74-I82 HydrophobicContact CG2-CD1 3.66Å; I74-V85 HydrophobicContact CG2-CG2 3.86Å; I74-L103 HydrophobicContact CG1-CD1 4.33Å; I74-V124 HydrophobicContact CD1-CB 4.32Å; I74-V124 HydrophobicContact CD1-CG1 4.03Å; I74-V124 HydrophobicContact CD1-CG2 3.89Å; I74-A127 HydrophobicContact CD1-CB 4.22Å
75	N	75.5	Confident	76.4	Confident	120 Å²	120	50.2 Å²	50.2	64%	0.642	26%	0.26	S	S	*	.	H	α-helix	trans	-66.3	-28.1	-179.9	-70.6	-16.4	0	0	0	113	L71 H72	L71-N75 VanDerWaalsContact O-CB 3.26Å; L71-N75 WeakPolarHBondContact O-CB 3.36Å; L71-N75 PolarHBondContact O-N 2.87Å; L71-N75 PolarHBondContact O-ND2 3.24Å; H72-N75 PolarHBondContact O-N 3.16Å
76	S	67.7	Low	76	Confident	61 Å²	61	51 Å²	51	43%	0.427	27%	0.267	S	S	.	.	H	α-helix	trans	-74.6	-16.2	174.3	70.6	0	0	0	0	113.2	H72 S73 I74	H72-S76 WeakPolarHBondContact O-CB 3.24Å; H72-S76 PolarHBondContact O-N 3.4Å; H72-S76 PolarHBondContact O-OG 3.34Å; S73-S76 PolarHBondContact O-OG 2.72Å; I74-S76 VanDerWaalsContact C-N 3.26Å; I74-S76 PolarHBondContact O-N 3.31Å
77	T	65.1	Low	75.9	Confident	34 Å²	34	52 Å²	52	21%	0.209	27%	0.274	C	S	.	.	S	Bend	trans	-101.5	123.1	180	-43.7	0	0	0	0	108.5	S73 I74 I79 A127	S73-T77 PolarHBondContact O-N 2.95Å; S73-T77 PolarHBondContact O-OG1 2.61Å; I74-T77 PolarHBondContact O-N 3.47Å; T77-I79 VanDerWaalsContact C-N 3.28Å; T77-I79 HydrophobicContact CG2-CG1 4.18Å; T77-I79 PolarHBondContact O-N 3.17Å; T77-A127 HydrophobicContact CG2-CB 4.23Å; T77-A127 WeakPolarHBondContact OG1-CB 3.3Å
78	Y	56.8	Low	75.4	Confident	151 Å²	151	54.8 Å²	54.8	59%	0.592	29%	0.291	S	S	*	.			trans	-72.5	82.3	179	-171	-95.4	0	0	0	111	K80	Y78-K80 HydrophobicContact CE1-CB 3.96Å; Y78-K80 HydrophobicContact CE1-CG 4.34Å
79	I	61.9	Low	75.2	Confident	23 Å²	23	52 Å²	52	12%	0.118	28%	0.277	C	S	.	.			trans	-94.2	98.5	171.8	-53	175.6	0	0	0	107.6	I74 T77 G81 I82 V119 T123	I74-I79 HydrophobicContact CG2-CD1 4.33Å; T77-I79 VanDerWaalsContact C-N 3.28Å; T77-I79 HydrophobicContact CG2-CG1 4.18Å; T77-I79 PolarHBondContact O-N 3.17Å; I79-G81 PolarHBondContact O-N 2.95Å; I79-I82 HydrophobicContact CB-CD1 3.56Å; I79-I82 HydrophobicContact CB-CG1 3.97Å; I79-I82 HydrophobicContact CD1-CD1 3.95Å; I79-I82 HydrophobicContact CG1-CD1 4.28Å; I79-I82 HydrophobicContact CG2-CD1 3.75Å; I79-I82 HydrophobicContact CG2-CG1 3.81Å; I79-I82 PolarHBondContact O-N 3.5Å; I79-V119 HydrophobicContact CG2-CG2 4.1Å; I79-T123 HydrophobicContact CD1-CG2 3.62Å; I79-T123 HydrophobicContact CG1-CG2 3.87Å
80	K	51	Low	74.4	Confident	113 Å²	113	56.4 Å²	56.4	49%	0.491	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	131.5	-176.8	-168.6	178.9	-178.7	-177.7	0	110.7	Y78	Y78-K80 HydrophobicContact CE1-CB 3.96Å; Y78-K80 HydrophobicContact CE1-CG 4.34Å
81	G	56.9	Low	73.7	Confident	25 Å²	25	57.1 Å²	57.1	26%	0.258	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.6	-2	174.7	0	0	0	0	0	114.8	I79 I83 Y107 S108	I79-G81 PolarHBondContact O-N 2.95Å; G81-I83 PolarHBondContact O-N 3.47Å; G81-Y107 CarbonylContact O-C 3.54Å; G81-Y107 WeakPolarHBondContact O-CA 3.39Å; G81-Y107 WeakPolarHBondContact O-CB 3.43Å; G81-S108 PolarHBondContact O-N 3.47Å
82	I	66.5	Low	73.5	Confident	47 Å²	47	55.8 Å²	55.8	24%	0.241	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	123.4	167.2	-67.3	-173.2	0	0	0	108.9	I74 I79 V85 I105 D106	I74-I82 HydrophobicContact CG2-CD1 3.66Å; I79-I82 HydrophobicContact CB-CD1 3.56Å; I79-I82 HydrophobicContact CB-CG1 3.97Å; I79-I82 HydrophobicContact CD1-CD1 3.95Å; I79-I82 HydrophobicContact CG1-CD1 4.28Å; I79-I82 HydrophobicContact CG2-CD1 3.75Å; I79-I82 HydrophobicContact CG2-CG1 3.81Å; I79-I82 PolarHBondContact O-N 3.5Å; I82-V85 HydrophobicContact CD1-CG2 4.28Å; I82-V85 HydrophobicContact CG2-CG2 3.44Å; I82-V85 VanDerWaalsContact CG2-CG2 3.44Å; I82-I105 HydrophobicContact CD1-CG2 3.81Å; I82-I105 HydrophobicContact CG1-CG2 3.85Å; I82-I105 HydrophobicContact CG2-CG2 4.27Å; I82-D106 CarbonylContact C-O 3.59Å; I82-D106 WeakPolarHBondContact CA-O 3.27Å
83	I	62.7	Low	73.1	Confident	102 Å²	102	53.7 Å²	53.7	52%	0.523	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-43.7	176.1	-62.9	164.8	0	0	0	109.3	T27 G81 D106	T27-I83 HydrophobicContact CG2-CD1 3.53Å; G81-I83 PolarHBondContact O-N 3.47Å; I83-D106 HydrophobicContact CB-CB 4.25Å; I83-D106 PolarHBondContact N-O 2.87Å
84	N	74.8	Confident	72.2	Confident	75 Å²	75	62.6 Å²	62.6	40%	0.401	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	148.5	-175.9	-172.5	26.8	0	0	0	110.8	I105 D106	N84-I105 WeakPolarHBondContact O-CA 3.17Å; N84-D106 HydrophobicContact CB-CB 4.19Å; N84-D106 PolarHBondContact N-O 2.98Å; N84-D106 PolarHBondContact O-N 3.2Å
85	V	81.7	Confident	71.5	Confident	18 Å²	18	64.6 Å²	64.6	11%	0.109	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	125.2	172.5	-173.5	0	0	0	0	108.2	L71 I74 I82 L103 V104 I105	L71-V85 HydrophobicContact CD2-CB 4.11Å; L71-V85 HydrophobicContact CD2-CG1 3.77Å; I74-V85 HydrophobicContact CG2-CG2 3.86Å; I82-V85 HydrophobicContact CD1-CG2 4.28Å; I82-V85 HydrophobicContact CG2-CG2 3.44Å; I82-V85 VanDerWaalsContact CG2-CG2 3.44Å; V85-L103 HydrophobicContact CG1-CD2 3.95Å; V85-V104 CarbonylContact C-O 3.32Å; V85-V104 WeakPolarHBondContact CA-O 3.37Å; V85-I105 HydrophobicContact CG1-CG1 3.95Å; V85-I105 HydrophobicContact CG2-CG1 4.23Å; V85-I105 HydrophobicContact CG2-CG2 4.3Å
86	T	82.2	Confident	71	Confident	58 Å²	58	61.9 Å²	61.9	36%	0.356	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	141.6	172.4	64.6	0	0	0	0	109.8	L103 V104	T86-L103 CarbonylContact O-C 3.59Å; T86-L103 WeakPolarHBondContact O-CA 3.35Å; T86-V104 PolarHBondContact N-O 2.66Å; T86-V104 PolarHBondContact O-N 2.99Å; T86-V104 WeakPolarHBondContact OG1-CB 3.43Å
87	C	87.5	Confident	71.8	Confident	22 Å²	22	59 Å²	59	15%	0.149	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	137.5	175.7	172.6	0	0	0	0	110	C67 L71 M102 L103	C67-C87 WeakPolarHBondContact CA-SG 3.36Å; C67-C87 HydrophobicContact CB-CB 3.64Å; C67-C87 WeakPolarHBondContact CB-SG 3.5Å; C67-C87 WeakPolarHBondContact SG-CB 3.47Å; C67-C87 CovalentContact SG-SG 2.06Å; C67-C87 PolarHBondContact SG-SG 3.32Å; L71-C87 HydrophobicContact CD1-CB 4.44Å; L71-C87 HydrophobicContact CD2-CB 4.19Å; L71-C87 HydrophobicContact CG-CB 4.07Å; C87-M102 CarbonylContact C-O 3.59Å; C87-M102 WeakPolarHBondContact CA-O 3.44Å; C87-L103 HydrophobicContact CB-CD2 3.87Å
88	T	80.8	Confident	72.6	Confident	76 Å²	76	60 Å²	60	47%	0.466	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	126.7	171.8	-58.9	0	0	0	0	109.8	V90 A101 M102	T88-V90 PolarHBondContact O-N 3.28Å; T88-A101 CarbonylContact O-C 3.58Å; T88-A101 WeakPolarHBondContact O-CA 3.41Å; T88-M102 PolarHBondContact N-O 3.37Å; T88-M102 PolarHBondContact O-N 3.45Å
89	V	85.1	Confident	73.9	Confident	17 Å²	17	52.8 Å²	52.8	10%	0.103	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	115.8	171	176.5	0	0	0	0	109.3	I66 G91 F92 N100 A101	I66-V89 HydrophobicContact CB-CG2 4.03Å; I66-V89 HydrophobicContact CG2-CG2 3.82Å; V89-G91 VanDerWaalsContact C-N 3.35Å; V89-F92 HydrophobicContact CG1-CE1 4.41Å; V89-F92 HydrophobicContact CG1-CE2 4.16Å; V89-F92 HydrophobicContact CG1-CZ 3.92Å; V89-N100 CarbonylContact C-O 3.44Å; V89-A101 HydrophobicContact CG2-CB 4.4Å
90	V	75.1	Confident	74.9	Confident	99 Å²	99	53.6 Å²	53.6	60%	0.6	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	-34.4	-179.3	-178.1	0	0	0	0	110.8	T88 N100 M102	T88-V90 PolarHBondContact O-N 3.28Å; V90-N100 HydrophobicContact CB-CB 4.23Å; V90-N100 PolarHBondContact N-O 2.72Å; V90-M102 HydrophobicContact CG2-CB 4.06Å
91	G	75.3	Confident	76.5	Confident	14 Å²	14	48.3 Å²	48.3	14%	0.144	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.6	-179.8	174.5	0	0	0	0	0	113.3	V89 N100	V89-G91 VanDerWaalsContact C-N 3.35Å; G91-N100 PolarHBondContact N-O 2.89Å; G91-N100 PolarHBondContact O-N 2.84Å; G91-N100 PolarHBondContact O-ND2 2.86Å
92	F	83.8	Confident	77.8	Confident	18 Å²	18	50 Å²	50	8%	0.079	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	137.8	-179.4	-55.9	-82.6	0	0	0	111.4	L38 W47 L51 Y59 Y62 I66 V89 V97 I98	L38-F92 HydrophobicContact CD1-CD1 3.96Å; L38-F92 HydrophobicContact CD1-CE1 3.76Å; W47-F92 HydrophobicContact CZ3-CB 4.19Å; L51-F92 HydrophobicContact CB-CB 4.14Å; L51-F92 HydrophobicContact CB-CD2 4.16Å; L51-F92 HydrophobicContact CB-CG 4.3Å; L51-F92 HydrophobicContact CD2-CD2 4.03Å; L51-F92 HydrophobicContact CD2-CE2 4.17Å; L51-F92 HydrophobicContact CD2-CG 4.31Å; Y59-F92 HydrophobicContact CD1-CE2 4.28Å; Y59-F92 AromaticContact CD2-CD2 3.6Å; Y59-F92 HydrophobicContact CD2-CD2 3.6Å; Y59-F92 AromaticContact CD2-CE2 3.57Å; Y59-F92 HydrophobicContact CD2-CE2 3.57Å; Y59-F92 HydrophobicContact CE1-CE2 4.29Å; Y59-F92 AromaticContact CE2-CD2 3.52Å; Y59-F92 HydrophobicContact CE2-CD2 3.52Å; Y59-F92 AromaticContact CE2-CE2 3.6Å; Y59-F92 HydrophobicContact CE2-CE2 3.6Å; Y59-F92 HydrophobicContact CG-CD2 4.37Å; Y59-F92 AromaticContact CG-CE2 3.91Å; Y59-F92 HydrophobicContact CG-CE2 3.91Å; Y59-F92 AromaticContact CZ-CE2 3.96Å; Y62-F92 HydrophobicContact CD2-CE1 4.31Å; I66-F92 HydrophobicContact CD1-CE1 3.59Å; I66-F92 HydrophobicContact CD1-CZ 4.13Å; V89-F92 HydrophobicContact CG1-CE1 4.41Å; V89-F92 HydrophobicContact CG1-CE2 4.16Å; V89-F92 HydrophobicContact CG1-CZ 3.92Å; F92-V97 HydrophobicContact CB-CG1 4.48Å; F92-V97 HydrophobicContact CD1-CG1 4.02Å; F92-I98 CarbonylContact C-O 3.36Å; F92-I98 VanDerWaalsContact CA-O 3.27Å; F92-I98 WeakPolarHBondContact CA-O 3.36Å
93	S	76.7	Confident	78.7	Confident	53 Å²	53	47.7 Å²	47.7	37%	0.371	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	143.8	177.9	-54.3	0	0	0	0	112	W47 I98 N100	W47-S93 WeakPolarHBondContact CZ3-O 3.3Å; S93-I98 PolarHBondContact N-O 2.77Å; S93-I98 PolarHBondContact O-N 3.23Å; S93-N100 PolarHBondContact OG-ND2 2.78Å
94	R	69.4	Low	79.5	Confident	187 Å²	187	44.2 Å²	44.2	71%	0.706	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	133.1	-177.9	-165	170.7	-171.2	166.8	8	111.6	W47	W47-R94 HydrophobicContact CD2-CB 4.12Å; W47-R94 HydrophobicContact CD2-CG 3.78Å; W47-R94 HydrophobicContact CE3-CB 4.22Å; W47-R94 HydrophobicContact CE3-CG 4.32Å; W47-R94 HydrophobicContact CG-CG 3.96Å; W47-R94 HydrophobicContact CH2-CB 4.18Å; W47-R94 HydrophobicContact CZ2-CB 4.08Å; W47-R94 HydrophobicContact CZ2-CG 4.24Å; W47-R94 HydrophobicContact CZ3-CB 4.26Å
95	G	65.6	Low	79.7	Confident	44 Å²	44	40.7 Å²	40.7	45%	0.454	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	146.7	-145.3	-172.9	0	0	0	0	0	109.7	V97	G95-V97 PolarHBondContact O-N 2.78Å; G95-V97 VanDerWaalsContact O-N 3.14Å
96	S	65.3	Low	79.2	Confident	63 Å²	63	41.6 Å²	41.6	44%	0.441	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	101.3	156.3	-51.4	0	0	0	0	106.2	I98	S96-I98 VanDerWaalsContact O-CG1 3.26Å; S96-I98 WeakPolarHBondContact O-CG1 3.05Å; S96-I98 PolarHBondContact O-N 2.66Å
97	V	83.1	Confident	78.7	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-29.1	107	-164.3	-179.5	0	0	0	0	112.1	L38 L45 E46 W47 L51 F92 G95	L38-V97 WeakPolarHBondContact CB-O 3.23Å; L38-V97 HydrophobicContact CD1-CG1 3.82Å; L38-V97 HydrophobicContact CG-CG1 4.45Å; L38-V97 WeakPolarHBondContact CG-O 3.23Å; L38-V97 PolarHBondContact N-O 2.82Å; L45-V97 HydrophobicContact CB-CB 4.14Å; L45-V97 HydrophobicContact CB-CG2 4Å; L45-V97 PolarHBondContact O-N 3.01Å; E46-V97 WeakPolarHBondContact O-CG2 3.4Å; W47-V97 HydrophobicContact CE3-CG2 4.23Å; L51-V97 HydrophobicContact CD1-CB 4.47Å; L51-V97 HydrophobicContact CD1-CG1 3.58Å; L51-V97 HydrophobicContact CD1-CG2 3.95Å; F92-V97 HydrophobicContact CB-CG1 4.48Å; F92-V97 HydrophobicContact CD1-CG1 4.02Å; G95-V97 PolarHBondContact O-N 2.78Å; G95-V97 VanDerWaalsContact O-N 3.14Å
98	I	82.5	Confident	77.3	Confident	54 Å²	54	41.1 Å²	41.1	28%	0.277	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	119.8	-178.3	-56.2	177.6	0	0	0	107.8	S35 S36 F92 S93 S96	S35-I98 WeakPolarHBondContact OG-CG2 3.27Å; S36-I98 WeakPolarHBondContact O-CA 3.36Å; F92-I98 CarbonylContact C-O 3.36Å; F92-I98 VanDerWaalsContact CA-O 3.27Å; F92-I98 WeakPolarHBondContact CA-O 3.36Å; S93-I98 PolarHBondContact N-O 2.77Å; S93-I98 PolarHBondContact O-N 3.23Å; S96-I98 VanDerWaalsContact O-CG1 3.26Å; S96-I98 WeakPolarHBondContact O-CG1 3.05Å; S96-I98 PolarHBondContact O-N 2.66Å
99	G	83.9	Confident	76	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	131.6	173.6	0	0	0	0	0	110.2	S35 S36	S35-G99 WeakPolarHBondContact CA-O 3.06Å; S35-G99 PolarHBondContact OG-O 3.05Å; S36-G99 PolarHBondContact N-O 2.73Å; S36-G99 PolarHBondContact O-N 3.13Å
100	N	82.4	Confident	74.1	Confident	40 Å²	40	42.3 Å²	42.3	21%	0.214	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	121.2	173.7	-51.8	-78.5	0	0	0	108.6	S35 V89 V90 G91 S93	S35-N100 WeakPolarHBondContact CB-OD1 3.43Å; S35-N100 PolarHBondContact OG-OD1 3.43Å; V89-N100 CarbonylContact C-O 3.44Å; V90-N100 HydrophobicContact CB-CB 4.23Å; V90-N100 PolarHBondContact N-O 2.72Å; G91-N100 PolarHBondContact N-O 2.89Å; G91-N100 PolarHBondContact O-N 2.84Å; G91-N100 PolarHBondContact O-ND2 2.86Å; S93-N100 PolarHBondContact OG-ND2 2.78Å
101	A	86.2	Confident	72.2	Confident	2 Å²	2	40.9 Å²	40.9	2%	0.017	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	155.7	-179	0	0	0	0	0	111.2	T33 V34 I66 L70 T88 V89 F145	T33-A101 CarbonylContact C-O 3.57Å; T33-A101 WeakPolarHBondContact CA-O 3.49Å; V34-A101 PolarHBondContact N-O 3.27Å; V34-A101 PolarHBondContact O-N 2.83Å; I66-A101 HydrophobicContact CG2-CB 3.91Å; L70-A101 HydrophobicContact CD1-CB 3.52Å; T88-A101 CarbonylContact O-C 3.58Å; T88-A101 WeakPolarHBondContact O-CA 3.41Å; V89-A101 HydrophobicContact CG2-CB 4.4Å; A101-F145 HydrophobicContact CB-CZ 4.46Å
102	M	83.1	Confident	70.2	Confident	60 Å²	60	48 Å²	48	30%	0.296	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	128.3	177	-175.5	176.8	74.2	0	0	108.8	I31 I32 C87 T88 V90 V104	I31-M102 HydrophobicContact CG2-CG 3.76Å; I31-M102 HydrophobicContact CG2-SD 3.7Å; I32-M102 CarbonylContact O-C 3.59Å; I32-M102 WeakPolarHBondContact O-CA 3.25Å; C87-M102 CarbonylContact C-O 3.59Å; C87-M102 WeakPolarHBondContact CA-O 3.44Å; T88-M102 PolarHBondContact N-O 3.37Å; T88-M102 PolarHBondContact O-N 3.45Å; V90-M102 HydrophobicContact CG2-CB 4.06Å; M102-V104 HydrophobicContact CE-CG2 4.19Å
103	L	85	Confident	67.7	Low	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	131	172.3	-72.3	167.2	0	0	0	109.1	I31 I32 V34 L70 I74 V85 T86 C87 I105 V124	I31-L103 CarbonylContact C-O 3.55Å; I31-L103 WeakPolarHBondContact CA-O 3.4Å; I32-L103 HydrophobicContact CB-CB 4.4Å; I32-L103 PolarHBondContact N-O 2.99Å; I32-L103 PolarHBondContact O-N 2.99Å; V34-L103 HydrophobicContact CG2-CD1 4.11Å; L70-L103 HydrophobicContact CB-CD1 4.33Å; L70-L103 HydrophobicContact CB-CD2 4.01Å; L70-L103 HydrophobicContact CB-CG 4.49Å; L70-L103 HydrophobicContact CD1-CD1 4.44Å; L70-L103 HydrophobicContact CD1-CD2 4.49Å; L70-L103 HydrophobicContact CD1-CG 4.33Å; L70-L103 HydrophobicContact CD2-CD1 4.4Å; I74-L103 HydrophobicContact CG1-CD1 4.33Å; V85-L103 HydrophobicContact CG1-CD2 3.95Å; T86-L103 CarbonylContact O-C 3.59Å; T86-L103 WeakPolarHBondContact O-CA 3.35Å; C87-L103 HydrophobicContact CB-CD2 3.87Å; L103-I105 HydrophobicContact CB-CG1 4.48Å; L103-V124 HydrophobicContact CD1-CG1 4.17Å
104	V	79	Confident	65.6	Low	29 Å²	29	56.7 Å²	56.7	18%	0.176	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	117.4	169.2	-175.3	0	0	0	0	107	T29 A30 I31 V85 T86 M102	T29-V104 HydrophobicContact CG2-CG1 3.46Å; T29-V104 VanDerWaalsContact CG2-CG1 3.46Å; A30-V104 WeakPolarHBondContact O-CA 3.37Å; I31-V104 HydrophobicContact CG1-CG1 4.39Å; I31-V104 HydrophobicContact CG1-CG2 4.37Å; V85-V104 CarbonylContact C-O 3.32Å; V85-V104 WeakPolarHBondContact CA-O 3.37Å; T86-V104 PolarHBondContact N-O 2.66Å; T86-V104 PolarHBondContact O-N 2.99Å; T86-V104 WeakPolarHBondContact OG1-CB 3.43Å; M102-V104 HydrophobicContact CE-CG2 4.19Å
105	I	79.7	Confident	63.8	Low	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	111.4	-173.5	-59.8	166.9	0	0	0	108.1	T29 A30 I32 I82 N84 V85 L103 V119 V124	T29-I105 CarbonylContact C-O 3.58Å; T29-I105 WeakPolarHBondContact CA-O 3.31Å; A30-I105 PolarHBondContact N-O 3.09Å; A30-I105 PolarHBondContact O-N 3.38Å; I32-I105 HydrophobicContact CD1-CD1 4.04Å; I82-I105 HydrophobicContact CD1-CG2 3.81Å; I82-I105 HydrophobicContact CG1-CG2 3.85Å; I82-I105 HydrophobicContact CG2-CG2 4.27Å; N84-I105 WeakPolarHBondContact O-CA 3.17Å; V85-I105 HydrophobicContact CG1-CG1 3.95Å; V85-I105 HydrophobicContact CG2-CG1 4.23Å; V85-I105 HydrophobicContact CG2-CG2 4.3Å; L103-I105 HydrophobicContact CB-CG1 4.48Å; I105-V119 HydrophobicContact CD1-CG1 3.66Å; I105-V119 HydrophobicContact CG2-CG1 4.38Å; I105-V119 HydrophobicContact CG2-CG2 3.91Å; I105-V124 HydrophobicContact CD1-CG2 4.14Å
106	D	71.6	Confident	62.3	Low	37 Å²	37	51.8 Å²	51.8	20%	0.198	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	133.9	172.2	-61.1	-42.6	0	0	0	109	K28 T29 I82 I83 N84	K28-D106 CarbonylContact O-C 3.54Å; K28-D106 WeakPolarHBondContact O-CA 3.34Å; T29-D106 WeakPolarHBondContact CB-OD1 3.43Å; T29-D106 VanDerWaalsContact CG2-OD1 3.26Å; T29-D106 WeakPolarHBondContact CG2-OD1 3.39Å; T29-D106 PolarHBondContact OG1-OD1 3.25Å; I82-D106 CarbonylContact C-O 3.59Å; I82-D106 WeakPolarHBondContact CA-O 3.27Å; I83-D106 HydrophobicContact CB-CB 4.25Å; I83-D106 PolarHBondContact N-O 2.87Å; N84-D106 HydrophobicContact CB-CB 4.19Å; N84-D106 PolarHBondContact N-O 2.98Å; N84-D106 PolarHBondContact O-N 3.2Å
107	Y	71	Confident	61.5	Low	10 Å²	10	51.1 Å²	51.1	4%	0.039	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	145.6	-178.1	66.6	-79.5	0	0	0	112.9	K28 A30 G81 V119 D158	K28-Y107 HydrophobicContact CB-CD1 3.99Å; K28-Y107 HydrophobicContact CB-CD2 4.13Å; K28-Y107 HydrophobicContact CB-CE1 3.47Å; K28-Y107 VanDerWaalsContact CB-CE1 3.47Å; K28-Y107 HydrophobicContact CB-CE2 3.66Å; K28-Y107 HydrophobicContact CB-CG 4.29Å; K28-Y107 HydrophobicContact CD-CE2 3.81Å; K28-Y107 WeakPolarHBondContact CD-OH 3.28Å; K28-Y107 HydrophobicContact CG-CE2 4.32Å; K28-Y107 PolarHBondContact N-O 2.06Å; K28-Y107 VanDerWaalsContact O-CD1 3.26Å; K28-Y107 WeakPolarHBondContact O-CD1 3.09Å; K28-Y107 PolarHBondContact O-N 3.46Å; A30-Y107 HydrophobicContact CB-CE1 4Å; G81-Y107 CarbonylContact O-C 3.54Å; G81-Y107 WeakPolarHBondContact O-CA 3.39Å; G81-Y107 WeakPolarHBondContact O-CB 3.43Å; Y107-V119 HydrophobicContact CD1-CG2 4.19Å; Y107-V119 HydrophobicContact CG-CG2 4.29Å; Y107-D158 VanDerWaalsContact OH-CG 3.31Å; Y107-D158 PolarHBondContact OH-OD1 3.45Å; Y107-D158 PolarHBondContact OH-OD2 3.01Å
108	S	59.1	Low	60.2	Low	61 Å²	61	55 Å²	55	43%	0.427	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	127.4	179.8	64.1	0	0	0	0	111.2	G81	G81-S108 PolarHBondContact O-N 3.47Å
109	S	53.1	Low	59.3	Low	31 Å²	31	52.7 Å²	52.7	22%	0.217	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	97.2	166.2	71.2	0	0	0	0	109.9	L26	L26-S109 WeakPolarHBondContact CB-O 3.35Å; L26-S109 WeakPolarHBondContact CB-OG 3.29Å; L26-S109 PolarHBondContact N-O 3.49Å; L26-S109 CarbonylContact O-C 3.55Å; L26-S109 PolarHBondContact O-N 3Å; L26-S109 VanDerWaalsContact O-O 3.08Å; L26-S109 PolarHBondContact O-OG 3.41Å
110	T	45.8	Very low	58.7	Low	86 Å²	86	55.3 Å²	55.3	53%	0.528	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	133.3	169.8	49	0	0	0	0	110
111	S	34.2	Very low	58.2	Low	70 Å²	70	57.1 Å²	57.1	49%	0.49	33%	0.329	S	S	.	.	S	Bend	trans	-62.1	144.7	-169.3	55.4	0	0	0	0	114.8
112	E	34.7	Very low	57.7	Low	163 Å²	163	62 Å²	62	76%	0.762	36%	0.355	S	S	*	.	S	Bend	trans	93.2	-14.2	156.8	-55.9	-157.6	161.5	0	0	122
113	N	30.6	Very low	57.4	Low	127 Å²	127	61.2 Å²	61.2	68%	0.679	35%	0.354	S	S	*	.	S	Bend	trans	-154.3	21.6	179.1	-93.3	-43.4	0	0	0	118.9
114	F	31.4	Very low	57.2	Low	127 Å²	127	61.2 Å²	61.2	56%	0.557	35%	0.354	S	S	*	.			trans	-119.9	108.8	177	-75.4	-79.1	0	0	0	112.4	E620	F114-E620 WeakPolarHBondContact CE1-OE1 3.48Å
115	S	31.8	Very low	57.4	Low	98 Å²	98	63.5 Å²	63.5	69%	0.685	36%	0.359	S	S	*	.			trans	-100.5	27.3	172.4	73.7	0	0	0	0	113.2	I543	S115-I543 WeakPolarHBondContact OG-CD1 2.85Å
116	S	34.8	Very low	57.6	Low	29 Å²	29	68.4 Å²	68.4	20%	0.203	39%	0.385	C	S	.	.	S	Bend	trans	-139	21	-163	57.9	0	0	0	0	118.3
117	A	48	Very low	58.1	Low	49 Å²	49	66.7 Å²	66.7	41%	0.405	38%	0.376	S	S	.	.			trans	-149.2	61.5	162.1	0	0	0	0	0	111.4
118	V	56.7	Low	58.8	Low	81 Å²	81	66.2 Å²	66.2	49%	0.491	37%	0.374	S	S	.	.			trans	-83.5	128.5	165.3	-178.6	0	0	0	0	106.9	T120	V118-T120 HydrophobicContact CB-CG2 4.31Å; V118-T120 HydrophobicContact CG1-CG2 4.24Å; V118-T120 WeakPolarHBondContact O-CG2 3.47Å; V118-T120 PolarHBondContact O-N 2.82Å
119	V	63.9	Low	60.2	Low	6 Å²	6	66.1 Å²	66.1	4%	0.036	37%	0.371	C	S	.	.			trans	-64.9	104.4	168.6	-177.5	0	0	0	0	107.2	A30 I32 I79 I105 Y107 V124	A30-V119 HydrophobicContact CB-CB 4.37Å; I32-V119 HydrophobicContact CD1-CG1 3.87Å; I79-V119 HydrophobicContact CG2-CG2 4.1Å; I105-V119 HydrophobicContact CD1-CG1 3.66Å; I105-V119 HydrophobicContact CG2-CG1 4.38Å; I105-V119 HydrophobicContact CG2-CG2 3.91Å; Y107-V119 HydrophobicContact CD1-CG2 4.19Å; Y107-V119 HydrophobicContact CG-CG2 4.29Å; V119-V124 HydrophobicContact CG1-CG2 3.9Å
120	T	70.7	Confident	61.6	Low	55 Å²	55	68.3 Å²	68.3	34%	0.337	38%	0.378	S	S	.	.			trans	-103.1	164	178.1	69.4	0	0	0	0	111.6	V118 D122 T123 V124	V118-T120 HydrophobicContact CB-CG2 4.31Å; V118-T120 HydrophobicContact CG1-CG2 4.24Å; V118-T120 WeakPolarHBondContact O-CG2 3.47Å; V118-T120 PolarHBondContact O-N 2.82Å; T120-D122 PolarHBondContact O-N 2.92Å; T120-D122 PolarHBondContact OG1-N 2.86Å; T120-T123 PolarHBondContact O-N 2.75Å; T120-T123 PolarHBondContact OG1-N 2.84Å; T120-T123 PolarHBondContact OG1-OG1 2.77Å; T120-V124 PolarHBondContact O-N 2.79Å; T120-V124 VanDerWaalsContact O-N 3.12Å
121	E	72.7	Confident	63.5	Low	78 Å²	78	65.1 Å²	65.1	36%	0.364	36%	0.356	S	S	.	.	H	α-helix	trans	-52.9	-39.6	171.2	-63	-179.3	176.3	0	0	111.8	V124 R125 I153 E154 T155	E121-V124 PolarHBondContact O-N 2.78Å; E121-R125 WeakPolarHBondContact O-CB 3.49Å; E121-R125 PolarHBondContact O-N 3.45Å; E121-I153 HydrophobicContact CB-CG2 4.43Å; E121-E154 WeakPolarHBondContact OE1-CA 3.31Å; E121-T155 WeakPolarHBondContact CG-OG1 3.27Å; E121-T155 PolarHBondContact OE1-N 3.39Å
122	D	75.5	Confident	66	Low	104 Å²	104	61.9 Å²	61.9	56%	0.556	33%	0.333	S	S	*	.	H	α-helix	trans	-69.8	-40.5	-179.8	-71.3	-29.5	0	0	0	112	T120 V124 R125 N126	T120-D122 PolarHBondContact O-N 2.92Å; T120-D122 PolarHBondContact OG1-N 2.86Å; D122-V124 VanDerWaalsContact C-N 3.33Å; D122-V124 PolarHBondContact O-N 3.06Å; D122-R125 PolarHBondContact O-N 3.07Å; D122-N126 WeakPolarHBondContact O-CB 3.33Å; D122-N126 PolarHBondContact O-N 3.39Å; D122-N126 PolarHBondContact O-ND2 2.9Å
123	T	76.4	Confident	68.4	Low	45 Å²	45	57 Å²	57	28%	0.276	32%	0.321	S	S	.	.	H	α-helix	trans	-60.7	-45.4	176.1	-51.7	0	0	0	0	110.7	I79 T120 A127	I79-T123 HydrophobicContact CD1-CG2 3.62Å; I79-T123 HydrophobicContact CG1-CG2 3.87Å; T120-T123 PolarHBondContact O-N 2.75Å; T120-T123 PolarHBondContact OG1-N 2.84Å; T120-T123 PolarHBondContact OG1-OG1 2.77Å; T123-A127 WeakPolarHBondContact O-CB 3.5Å; T123-A127 PolarHBondContact O-N 2.92Å; T123-A127 VanDerWaalsContact O-N 3.12Å
124	V	79.7	Confident	70.9	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-69.9	-39	177.6	173.4	0	0	0	0	111.8	I32 I74 L103 I105 V119 T120 E121 D122 N126 A127 V128 I153	I32-V124 HydrophobicContact CD1-CB 4.17Å; I32-V124 HydrophobicContact CD1-CG2 3.44Å; I32-V124 VanDerWaalsContact CD1-CG2 3.44Å; I32-V124 HydrophobicContact CG2-CG1 4.19Å; I74-V124 HydrophobicContact CD1-CB 4.32Å; I74-V124 HydrophobicContact CD1-CG1 4.03Å; I74-V124 HydrophobicContact CD1-CG2 3.89Å; L103-V124 HydrophobicContact CD1-CG1 4.17Å; I105-V124 HydrophobicContact CD1-CG2 4.14Å; V119-V124 HydrophobicContact CG1-CG2 3.9Å; T120-V124 PolarHBondContact O-N 2.79Å; T120-V124 VanDerWaalsContact O-N 3.12Å; E121-V124 PolarHBondContact O-N 2.78Å; D122-V124 VanDerWaalsContact C-N 3.33Å; D122-V124 PolarHBondContact O-N 3.06Å; V124-N126 PolarHBondContact O-N 2.85Å; V124-A127 PolarHBondContact O-N 2.99Å; V124-V128 HydrophobicContact CG1-CG2 4.23Å; V124-V128 WeakPolarHBondContact O-CB 3.31Å; V124-V128 VanDerWaalsContact O-CG2 3.26Å; V124-V128 WeakPolarHBondContact O-CG2 3.49Å; V124-V128 PolarHBondContact O-N 3.46Å; V124-I153 HydrophobicContact CB-CG2 4.29Å; V124-I153 HydrophobicContact CG1-CD1 4.46Å; V124-I153 HydrophobicContact CG1-CG2 4.07Å
125	R	85	Confident	73.2	Confident	76 Å²	76	45.7 Å²	45.7	29%	0.287	27%	0.266	S	S	.	.	H	α-helix	trans	-60.7	-45.6	175.9	-179.6	-176.7	-63.3	-80.4	0.3	112.6	E121 D122 V128 V129 L151 I153	E121-R125 WeakPolarHBondContact O-CB 3.49Å; E121-R125 PolarHBondContact O-N 3.45Å; D122-R125 PolarHBondContact O-N 3.07Å; R125-V128 PolarHBondContact O-N 3.36Å; R125-V129 HydrophobicContact CG-CG2 4.36Å; R125-V129 WeakPolarHBondContact O-CB 3.29Å; R125-V129 VanDerWaalsContact O-CG2 3.24Å; R125-V129 WeakPolarHBondContact O-CG2 3.46Å; R125-V129 PolarHBondContact O-N 3.33Å; R125-L151 PolarHBondContact NH1-O 2.92Å; R125-I153 HydrophobicContact CB-CD1 3.69Å; R125-I153 HydrophobicContact CG-CD1 4.1Å; R125-I153 PolarHBondContact NH2-O 2.89Å
126	N	83.2	Confident	75.7	Confident	104 Å²	104	43.6 Å²	43.6	56%	0.556	25%	0.249	S	C	*	.	H	α-helix	trans	-63.7	-47.4	178.2	-68.5	-20.7	0	0	0	110.6	D122 V124 V128 V129 E130	D122-N126 WeakPolarHBondContact O-CB 3.33Å; D122-N126 PolarHBondContact O-N 3.39Å; D122-N126 PolarHBondContact O-ND2 2.9Å; V124-N126 PolarHBondContact O-N 2.85Å; N126-V128 PolarHBondContact O-N 3.31Å; N126-V129 PolarHBondContact O-N 2.98Å; N126-E130 VanDerWaalsContact O-CB 3.22Å; N126-E130 WeakPolarHBondContact O-CB 3.29Å; N126-E130 PolarHBondContact O-N 2.9Å
127	A	82.7	Confident	77.8	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.008	27%	0.271	C	S	.	.	H	α-helix	trans	-53.2	-49.9	175.8	0	0	0	0	0	112.7	I74 T77 T123 V124 Y131	I74-A127 HydrophobicContact CD1-CB 4.22Å; T77-A127 HydrophobicContact CG2-CB 4.23Å; T77-A127 WeakPolarHBondContact OG1-CB 3.3Å; T123-A127 WeakPolarHBondContact O-CB 3.5Å; T123-A127 PolarHBondContact O-N 2.92Å; T123-A127 VanDerWaalsContact O-N 3.12Å; V124-A127 PolarHBondContact O-N 2.99Å; A127-Y131 WeakPolarHBondContact O-CB 3.25Å; A127-Y131 PolarHBondContact O-N 2.86Å; A127-Y131 VanDerWaalsContact O-N 3.1Å
128	V	85.9	Confident	79.4	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66.8	-48.1	-178.5	173.2	0	0	0	0	111.7	L69 L70 S73 V124 R125 N126 E130 Y131 I132 L151 I153	L69-V128 HydrophobicContact CD2-CG1 4.47Å; L70-V128 HydrophobicContact CD2-CG1 4.34Å; L70-V128 HydrophobicContact CD2-CG2 3.72Å; S73-V128 WeakPolarHBondContact OG-CG2 3.4Å; V124-V128 HydrophobicContact CG1-CG2 4.23Å; V124-V128 WeakPolarHBondContact O-CB 3.31Å; V124-V128 VanDerWaalsContact O-CG2 3.26Å; V124-V128 WeakPolarHBondContact O-CG2 3.49Å; V124-V128 PolarHBondContact O-N 3.46Å; R125-V128 PolarHBondContact O-N 3.36Å; N126-V128 PolarHBondContact O-N 3.31Å; V128-E130 VanDerWaalsContact C-N 3.31Å; V128-E130 PolarHBondContact O-N 2.75Å; V128-Y131 PolarHBondContact O-N 3.14Å; V128-I132 HydrophobicContact CG1-CD1 3.59Å; V128-I132 HydrophobicContact CG1-CG1 4.45Å; V128-I132 WeakPolarHBondContact O-CD1 3.5Å; V128-I132 WeakPolarHBondContact O-CG1 3.31Å; V128-I132 PolarHBondContact O-N 3Å; V128-L151 HydrophobicContact CG1-CD2 3.97Å; V128-I153 HydrophobicContact CB-CD1 4.31Å; V128-I153 HydrophobicContact CG2-CD1 4.39Å
129	V	86.5	Confident	80.5	Confident	58 Å²	58	46.7 Å²	46.7	35%	0.352	28%	0.278	S	S	.	.	H	α-helix	trans	-62.5	-40.6	-179.2	170.3	0	0	0	0	111.2	R125 N126 I132 A133 T147 L151	R125-V129 HydrophobicContact CG-CG2 4.36Å; R125-V129 WeakPolarHBondContact O-CB 3.29Å; R125-V129 VanDerWaalsContact O-CG2 3.24Å; R125-V129 WeakPolarHBondContact O-CG2 3.46Å; R125-V129 PolarHBondContact O-N 3.33Å; N126-V129 PolarHBondContact O-N 2.98Å; V129-I132 PolarHBondContact O-N 2.87Å; V129-A133 PolarHBondContact O-N 2.67Å; V129-T147 HydrophobicContact CG1-CG2 4.5Å; V129-T147 HydrophobicContact CG2-CG2 4.41Å; V129-L151 HydrophobicContact CG2-CD2 3.65Å
130	E	84.1	Confident	81.3	Confident	77 Å²	77	47.8 Å²	47.8	36%	0.36	29%	0.285	S	S	.	.	H	α-helix	trans	-68.9	-39.1	-179.3	-157	-162.1	123.4	0	0	111.9	N126 V128 A133 E134 K568	N126-E130 VanDerWaalsContact O-CB 3.22Å; N126-E130 WeakPolarHBondContact O-CB 3.29Å; N126-E130 PolarHBondContact O-N 2.9Å; V128-E130 VanDerWaalsContact C-N 3.31Å; V128-E130 PolarHBondContact O-N 2.75Å; E130-A133 PolarHBondContact O-N 2.96Å; E130-E134 PolarHBondContact O-N 3.48Å; E130-K568 VanDerWaalsContact CD-NZ 3.3Å; E130-K568 HydrophobicContact CG-CD 4.48Å; E130-K568 VanDerWaalsContact CG-NZ 3.26Å; E130-K568 PolarHBondContact O-NZ 2.85Å; E130-K568 VanDerWaalsContact O-NZ 3.16Å; E130-K568 WeakPolarHBondContact OE1-CD 3.1Å; E130-K568 IonicContact OE1-NZ 3.89Å; E130-K568 PolarHBondContact OE1-NZ 2.88Å
131	Y	86.1	Confident	81.9	Confident	19 Å²	19	50.6 Å²	50.6	8%	0.075	30%	0.298	C	S	.	.	H	α-helix	trans	-67.1	-40.1	174.9	-168.3	-97	0	0	0	111.6	L69 H72 A127 V128 A133 E134 I135 F569	L69-Y131 HydrophobicContact CG-CD1 4Å; L69-Y131 HydrophobicContact CG-CE1 4.18Å; H72-Y131 HydrophobicContact CB-CD2 4.38Å; H72-Y131 HydrophobicContact CB-CE1 4.07Å; H72-Y131 HydrophobicContact CB-CE2 3.54Å; H72-Y131 WeakPolarHBondContact CB-OH 3.49Å; A127-Y131 WeakPolarHBondContact O-CB 3.25Å; A127-Y131 PolarHBondContact O-N 2.86Å; A127-Y131 VanDerWaalsContact O-N 3.1Å; V128-Y131 PolarHBondContact O-N 3.14Å; Y131-A133 PolarHBondContact O-N 2.98Å; Y131-E134 WeakPolarHBondContact O-CB 3.22Å; Y131-E134 PolarHBondContact O-N 3.3Å; Y131-I135 HydrophobicContact CD1-CD1 3.83Å; Y131-I135 HydrophobicContact CD1-CG1 4.27Å; Y131-I135 HydrophobicContact CE1-CD1 3.7Å; Y131-I135 HydrophobicContact CE1-CG1 4.11Å; Y131-I135 PolarHBondContact O-N 3.45Å; Y131-I135 VanDerWaalsContact O-N 3.13Å; Y131-F569 AromaticContact CD2-CE1 3.9Å; Y131-F569 HydrophobicContact CD2-CE1 3.9Å; Y131-F569 AromaticContact CD2-CZ 3.65Å; Y131-F569 HydrophobicContact CD2-CZ 3.65Å; Y131-F569 AromaticContact CE2-CE1 3.51Å; Y131-F569 HydrophobicContact CE2-CE1 3.51Å; Y131-F569 HydrophobicContact CE2-CE2 4.44Å; Y131-F569 AromaticContact CE2-CZ 3.21Å; Y131-F569 HydrophobicContact CE2-CZ 3.21Å; Y131-F569 AromaticContact CZ-CZ 3.9Å
132	I	86.3	Confident	82.5	Confident	2 Å²	2	51 Å²	51	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-63.1	-41.9	175.4	-67.4	161	0	0	0	111.5	L69 V128 V129 E134 I135 V136 Y144 F145 T147	L69-I132 HydrophobicContact CD1-CG1 4.29Å; L69-I132 HydrophobicContact CD2-CG1 4.48Å; V128-I132 HydrophobicContact CG1-CD1 3.59Å; V128-I132 HydrophobicContact CG1-CG1 4.45Å; V128-I132 WeakPolarHBondContact O-CD1 3.5Å; V128-I132 WeakPolarHBondContact O-CG1 3.31Å; V128-I132 PolarHBondContact O-N 3Å; V129-I132 PolarHBondContact O-N 2.87Å; I132-E134 PolarHBondContact O-N 3.31Å; I132-I135 PolarHBondContact O-N 2.94Å; I132-V136 HydrophobicContact CG2-CG2 4.26Å; I132-V136 WeakPolarHBondContact O-CG2 3.46Å; I132-V136 PolarHBondContact O-N 2.86Å; I132-Y144 HydrophobicContact CG2-CD2 3.55Å; I132-Y144 HydrophobicContact CG2-CE2 4.13Å; I132-Y144 HydrophobicContact CG2-CG 4.25Å; I132-F145 HydrophobicContact CD1-CB 3.95Å; I132-F145 WeakPolarHBondContact CD1-O 3.11Å; I132-T147 HydrophobicContact CB-CG2 4.31Å; I132-T147 HydrophobicContact CD1-CG2 4.07Å; I132-T147 HydrophobicContact CG2-CG2 3.88Å
133	A	84	Confident	83.1	Confident	60 Å²	60	46.1 Å²	46.1	50%	0.496	27%	0.274	S	S	.	.	H	α-helix	trans	-56.5	-34.2	177.7	0	0	0	0	0	111.8	V129 E130 Y131 A137	V129-A133 PolarHBondContact O-N 2.67Å; E130-A133 PolarHBondContact O-N 2.96Å; Y131-A133 PolarHBondContact O-N 2.98Å; A133-A137 VanDerWaalsContact O-CB 3.3Å; A133-A137 WeakPolarHBondContact O-CB 3.31Å; A133-A137 PolarHBondContact O-N 2.78Å
134	E	83.3	Confident	83.7	Confident	13 Å²	13	44.3 Å²	44.3	6%	0.061	26%	0.262	C	S	.	.	H	α-helix	trans	-76.9	-41	177.8	-168.6	166.2	29.8	0	0	113.8	E130 Y131 I132 V136 A137 N138 N567 K568 F569	E130-E134 PolarHBondContact O-N 3.48Å; Y131-E134 WeakPolarHBondContact O-CB 3.22Å; Y131-E134 PolarHBondContact O-N 3.3Å; I132-E134 PolarHBondContact O-N 3.31Å; E134-V136 PolarHBondContact O-N 3.46Å; E134-A137 PolarHBondContact O-N 2.98Å; E134-N138 WeakPolarHBondContact O-CB 3.31Å; E134-N138 VanDerWaalsContact O-CG 3.32Å; E134-N138 PolarHBondContact O-N 3.49Å; E134-N138 PolarHBondContact O-ND2 2.82Å; E134-N567 PolarHBondContact OE2-OD1 3.17Å; E134-K568 WeakPolarHBondContact OE1-CD 3.42Å; E134-K568 WeakPolarHBondContact OE1-CE 3.41Å; E134-K568 WeakPolarHBondContact OE1-CG 3.34Å; E134-K568 IonicContact OE1-NZ 2.97Å; E134-K568 WeakPolarHBondContact OE2-CG 3.08Å; E134-K568 PolarHBondContact OE2-N 3.31Å; E134-K568 VanDerWaalsContact OE2-N 3.14Å; E134-F569 HydrophobicContact CB-CE2 4.08Å; E134-F569 HydrophobicContact CB-CZ 4.35Å; E134-F569 HydrophobicContact CG-CD2 3.59Å; E134-F569 HydrophobicContact CG-CE2 3.29Å; E134-F569 HydrophobicContact CG-CG 4.47Å; E134-F569 HydrophobicContact CG-CZ 3.94Å; E134-F569 WeakPolarHBondContact OE1-CD1 3.37Å; E134-F569 VanDerWaalsContact OE1-CD2 3.23Å; E134-F569 WeakPolarHBondContact OE1-CD2 3.3Å; E134-F569 WeakPolarHBondContact OE1-CE1 3.44Å; E134-F569 WeakPolarHBondContact OE1-CE2 3.39Å; E134-F569 WeakPolarHBondContact OE1-CG 3.18Å; E134-F569 WeakPolarHBondContact OE1-CZ 3.12Å; E134-F569 WeakPolarHBondContact OE2-CD2 3.32Å; E134-F569 WeakPolarHBondContact OE2-CE2 3.33Å; E134-F569 WeakPolarHBondContact OE2-CG 3.36Å; E134-F569 PolarHBondContact OE2-N 3.42Å
135	I	80.9	Confident	84	Confident	4 Å²	4	44.3 Å²	44.3	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-54	-45.5	170.2	-65.9	175.1	0	0	0	109.8	L69 Y131 I132 N138 G139 S140 Q142 Y144	L69-I135 HydrophobicContact CD1-CD1 3.73Å; L69-I135 HydrophobicContact CG-CD1 4.19Å; Y131-I135 HydrophobicContact CD1-CD1 3.83Å; Y131-I135 HydrophobicContact CD1-CG1 4.27Å; Y131-I135 HydrophobicContact CE1-CD1 3.7Å; Y131-I135 HydrophobicContact CE1-CG1 4.11Å; Y131-I135 PolarHBondContact O-N 3.45Å; Y131-I135 VanDerWaalsContact O-N 3.13Å; I132-I135 PolarHBondContact O-N 2.94Å; I135-N138 PolarHBondContact O-N 3.04Å; I135-G139 PolarHBondContact O-N 3.39Å; I135-S140 PolarHBondContact O-N 3.42Å; I135-S140 VanDerWaalsContact O-N 3.16Å; I135-Q142 HydrophobicContact CG2-CB 4.5Å; I135-Y144 HydrophobicContact CG2-CD1 3.72Å; I135-Y144 HydrophobicContact CG2-CE1 4.24Å; I135-Y144 HydrophobicContact CG2-CG 4.33Å
136	V	82.8	Confident	83.9	Confident	54 Å²	54	40.9 Å²	40.9	33%	0.327	25%	0.25	S	S	.	.	H	α-helix	trans	-67	-43.7	179.4	175	0	0	0	0	111.4	I132 E134 N138 G139 Y144	I132-V136 HydrophobicContact CG2-CG2 4.26Å; I132-V136 WeakPolarHBondContact O-CG2 3.46Å; I132-V136 PolarHBondContact O-N 2.86Å; E134-V136 PolarHBondContact O-N 3.46Å; V136-N138 VanDerWaalsContact C-N 3.32Å; V136-N138 PolarHBondContact O-N 3.36Å; V136-G139 PolarHBondContact O-N 2.62Å; V136-Y144 HydrophobicContact CG2-CD2 4.39Å; V136-Y144 HydrophobicContact CG2-CE1 4.31Å; V136-Y144 HydrophobicContact CG2-CE2 3.68Å
137	A	79.8	Confident	83.8	Confident	82 Å²	82	39.4 Å²	39.4	68%	0.678	25%	0.245	S	C	*	.	H	α-helix	trans	-63.6	-37.6	178.4	0	0	0	0	0	112.5	A133 E134 G139	A133-A137 VanDerWaalsContact O-CB 3.3Å; A133-A137 WeakPolarHBondContact O-CB 3.31Å; A133-A137 PolarHBondContact O-N 2.78Å; E134-A137 PolarHBondContact O-N 2.98Å; A137-G139 PolarHBondContact O-N 3.47Å
138	N	81.4	Confident	83.2	Confident	90 Å²	90	45.3 Å²	45.3	48%	0.481	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-5.2	179.5	-70.2	-23.4	0	0	0	113.6	E134 I135 V136 S140	E134-N138 WeakPolarHBondContact O-CB 3.31Å; E134-N138 VanDerWaalsContact O-CG 3.32Å; E134-N138 PolarHBondContact O-N 3.49Å; E134-N138 PolarHBondContact O-ND2 2.82Å; I135-N138 PolarHBondContact O-N 3.04Å; V136-N138 VanDerWaalsContact C-N 3.32Å; V136-N138 PolarHBondContact O-N 3.36Å; N138-S140 PolarHBondContact O-N 3Å
139	G	79.5	Confident	82	Confident	53 Å²	53	47.8 Å²	47.8	55%	0.546	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	27.9	-177.2	0	0	0	0	0	113.2	I135 V136 A137	I135-G139 PolarHBondContact O-N 3.39Å; V136-G139 PolarHBondContact O-N 2.62Å; A137-G139 PolarHBondContact O-N 3.47Å
140	S	80.5	Confident	81.2	Confident	29 Å²	29	47.3 Å²	47.3	20%	0.203	31%	0.311	C	S	.	.			trans	-64.6	142.4	-178.6	176.9	0	0	0	0	111.3	L41 I135 N138 Q142	L41-S140 WeakPolarHBondContact CD2-O 3.41Å; I135-S140 PolarHBondContact O-N 3.42Å; I135-S140 VanDerWaalsContact O-N 3.16Å; N138-S140 PolarHBondContact O-N 3Å; S140-Q142 VanDerWaalsContact C-N 3.27Å; S140-Q142 WeakPolarHBondContact OG-CB 3.23Å; S140-Q142 WeakPolarHBondContact OG-CG 3.22Å; S140-Q142 PolarHBondContact OG-N 3.11Å
141	D	83.4	Confident	81.2	Confident	114 Å²	114	44.3 Å²	44.3	61%	0.61	30%	0.297	S	S	*	.			trans	-87.4	6.4	176.1	68.8	-25	0	0	0	113.4	R40 L41	R40-D141 WeakPolarHBondContact CD-O 3.42Å; R40-D141 VanDerWaalsContact CG-O 3.23Å; R40-D141 WeakPolarHBondContact CG-O 3.44Å; L41-D141 HydrophobicContact CD1-CB 4.45Å; L41-D141 HydrophobicContact CD2-CB 4.45Å; L41-D141 HydrophobicContact CG-CB 4.47Å
142	Q	85.1	Confident	81.1	Confident	87 Å²	87	46.3 Å²	46.3	41%	0.407	31%	0.311	S	S	.	.	S	Bend	trans	-63.5	152.1	173	-70.9	177.8	-12.7	0	0	112.3	I135 S140 Y144	I135-Q142 HydrophobicContact CG2-CB 4.5Å; S140-Q142 VanDerWaalsContact C-N 3.27Å; S140-Q142 WeakPolarHBondContact OG-CB 3.23Å; S140-Q142 WeakPolarHBondContact OG-CG 3.22Å; S140-Q142 PolarHBondContact OG-N 3.11Å; Q142-Y144 WeakPolarHBondContact O-CD1 3.46Å
143	I	88.1	Confident	80.9	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	31%	0.311	C	S	.	.			trans	-78	133.2	172.6	-61.6	171.2	0	0	0	109.7	L38 L45 Y62 Q65	L38-I143 HydrophobicContact CB-CG2 3.92Å; L38-I143 HydrophobicContact CD1-CG2 4.1Å; L38-I143 HydrophobicContact CD2-CG2 4.13Å; L38-I143 HydrophobicContact CG-CG2 4.27Å; L45-I143 HydrophobicContact CD1-CD1 3.94Å; L45-I143 HydrophobicContact CD1-CG1 3.96Å; L45-I143 HydrophobicContact CD1-CG2 3.86Å; Y62-I143 HydrophobicContact CD1-CD1 3.23Å; Y62-I143 HydrophobicContact CD2-CD1 4.02Å; Y62-I143 HydrophobicContact CE1-CD1 3.27Å; Y62-I143 HydrophobicContact CE2-CD1 4.06Å; Y62-I143 HydrophobicContact CG-CD1 3.63Å; Q65-I143 HydrophobicContact CB-CB 4.39Å
144	Y	88.8	Confident	80.6	Confident	7 Å²	7	48.9 Å²	48.9	3%	0.027	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	163	176.9	59.8	-88.6	0	0	0	113.1	L38 T39 N42 L69 I132 I135 V136 Q142	L38-Y144 WeakPolarHBondContact CA-O 3.39Å; T39-Y144 HydrophobicContact CG2-CE1 4.41Å; T39-Y144 HydrophobicContact CG2-CE2 3.85Å; T39-Y144 WeakPolarHBondContact CG2-OH 3.34Å; T39-Y144 PolarHBondContact N-O 2.78Å; T39-Y144 WeakPolarHBondContact O-CD1 3.36Å; T39-Y144 PolarHBondContact O-N 2.94Å; N42-Y144 VanDerWaalsContact CA-OH 3.29Å; N42-Y144 WeakPolarHBondContact CA-OH 3.42Å; N42-Y144 PolarHBondContact N-OH 3.37Å; N42-Y144 PolarHBondContact OD1-OH 3.34Å; L69-Y144 VanDerWaalsContact CD1-CA 3.5Å; L69-Y144 VanDerWaalsContact CD1-CB 3.43Å; I132-Y144 HydrophobicContact CG2-CD2 3.55Å; I132-Y144 HydrophobicContact CG2-CE2 4.13Å; I132-Y144 HydrophobicContact CG2-CG 4.25Å; I135-Y144 HydrophobicContact CG2-CD1 3.72Å; I135-Y144 HydrophobicContact CG2-CE1 4.24Å; I135-Y144 HydrophobicContact CG2-CG 4.33Å; V136-Y144 HydrophobicContact CG2-CD2 4.39Å; V136-Y144 HydrophobicContact CG2-CE1 4.31Å; V136-Y144 HydrophobicContact CG2-CE2 3.68Å; Q142-Y144 WeakPolarHBondContact O-CD1 3.46Å
145	F	87.5	Confident	80	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	129.9	174.9	-64	-76.6	0	0	0	111.1	V34 L38 I66 L69 L70 A101 I132 T147 L151	V34-F145 HydrophobicContact CG1-CD2 4.35Å; V34-F145 HydrophobicContact CG1-CE1 4.36Å; V34-F145 HydrophobicContact CG1-CE2 4.03Å; V34-F145 HydrophobicContact CG1-CZ 4.02Å; L38-F145 HydrophobicContact CD2-CD1 3.86Å; L38-F145 HydrophobicContact CD2-CE1 3.97Å; I66-F145 HydrophobicContact CG2-CE2 3.95Å; I66-F145 HydrophobicContact CG2-CZ 3.55Å; L69-F145 HydrophobicContact CD2-CD2 3.94Å; L69-F145 HydrophobicContact CD2-CE2 4.15Å; L70-F145 HydrophobicContact CD1-CE2 4.13Å; L70-F145 HydrophobicContact CD1-CZ 4.35Å; L70-F145 HydrophobicContact CD2-CD2 4.42Å; L70-F145 HydrophobicContact CD2-CE2 3.77Å; L70-F145 HydrophobicContact CG-CE2 3.95Å; A101-F145 HydrophobicContact CB-CZ 4.46Å; I132-F145 HydrophobicContact CD1-CB 3.95Å; I132-F145 WeakPolarHBondContact CD1-O 3.11Å; F145-T147 PolarHBondContact O-N 2.74Å; F145-L151 HydrophobicContact CB-CD1 3.93Å; F145-L151 HydrophobicContact CG-CD1 4.18Å
146	G	83	Confident	78.8	Confident	3 Å²	3	54.6 Å²	54.6	3%	0.031	35%	0.349	C	S	.	.			trans	-68	116.8	175	0	0	0	0	0	111	S36 T37 S149	S36-G146 PolarHBondContact OG-O 2.78Å; T37-G146 PolarHBondContact O-N 3.35Å; G146-S149 VanDerWaalsContact C-OG 3.3Å; G146-S149 VanDerWaalsContact CA-OG 3.31Å; G146-S149 WeakPolarHBondContact CA-OG 3.45Å; G146-S149 PolarHBondContact O-N 2.84Å; G146-S149 PolarHBondContact O-OG 3.29Å
147	T	79.4	Confident	77.5	Confident	74 Å²	74	56.2 Å²	56.2	45%	0.454	36%	0.355	S	S	.	.	S	Bend	trans	-73.9	-30	179.9	53.1	0	0	0	0	112.4	V129 I132 F145	V129-T147 HydrophobicContact CG1-CG2 4.5Å; V129-T147 HydrophobicContact CG2-CG2 4.41Å; I132-T147 HydrophobicContact CB-CG2 4.31Å; I132-T147 HydrophobicContact CD1-CG2 4.07Å; I132-T147 HydrophobicContact CG2-CG2 3.88Å; F145-T147 PolarHBondContact O-N 2.74Å
148	S	71	Confident	76.2	Confident	124 Å²	124	56.1 Å²	56.1	87%	0.867	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-15.4	176.6	50.4	0	0	0	0	114	G150	S148-G150 VanDerWaalsContact C-N 3.34Å
149	S	61.2	Low	74.5	Confident	52 Å²	52	54 Å²	54	36%	0.364	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	16	-179.1	45.9	0	0	0	0	114.2	S36 T37 G146	S36-S149 PolarHBondContact OG-OG 3.4Å; T37-S149 WeakPolarHBondContact CB-OG 3.32Å; G146-S149 VanDerWaalsContact C-OG 3.3Å; G146-S149 VanDerWaalsContact CA-OG 3.31Å; G146-S149 WeakPolarHBondContact CA-OG 3.45Å; G146-S149 PolarHBondContact O-N 2.84Å; G146-S149 PolarHBondContact O-OG 3.29Å
150	G	68.5	Low	72.8	Confident	49 Å²	49	54.4 Å²	54.4	51%	0.505	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	62.1	177.9	0	0	0	0	0	112.6	S148 T152	S148-G150 VanDerWaalsContact C-N 3.34Å; G150-T152 PolarHBondContact O-N 3.17Å; G150-T152 VanDerWaalsContact O-N 3.12Å
151	L	83.8	Confident	71	Confident	13 Å²	13	56.7 Å²	56.7	7%	0.068	35%	0.349	C	S	.	.			trans	-52.2	115.1	168	176	66.1	0	0	0	110.3	V34 R125 V128 V129 F145 I153	V34-L151 HydrophobicContact CG1-CD1 3.8Å; R125-L151 PolarHBondContact NH1-O 2.92Å; V128-L151 HydrophobicContact CG1-CD2 3.97Å; V129-L151 HydrophobicContact CG2-CD2 3.65Å; F145-L151 HydrophobicContact CB-CD1 3.93Å; F145-L151 HydrophobicContact CG-CD1 4.18Å; L151-I153 HydrophobicContact CD1-CD1 4.45Å; L151-I153 HydrophobicContact CD1-CG1 4.43Å; L151-I153 HydrophobicContact CD2-CD1 4.01Å; L151-I153 HydrophobicContact CG-CD1 4.11Å; L151-I153 HydrophobicContact CG-CG1 4.26Å
152	T	83.9	Confident	68.7	Low	61 Å²	61	55.2 Å²	55.2	37%	0.374	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	133.5	175.3	62	0	0	0	0	109.8	V34 S35 G150	V34-T152 WeakPolarHBondContact CA-O 3.31Å; S35-T152 WeakPolarHBondContact CB-OG1 3.48Å; S35-T152 PolarHBondContact N-O 3.47Å; S35-T152 PolarHBondContact O-N 3.14Å; S35-T152 PolarHBondContact O-OG1 2.73Å; G150-T152 PolarHBondContact O-N 3.17Å; G150-T152 VanDerWaalsContact O-N 3.12Å
153	I	82.8	Confident	66.3	Low	2 Å²	2	58.8 Å²	58.8	1%	0.01	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	118.8	178.3	-67.8	174.6	0	0	0	105.6	I32 T33 V34 E121 V124 R125 V128 L151	I32-I153 HydrophobicContact CG2-CG2 3.69Å; T33-I153 VanDerWaalsContact O-CA 3.27Å; T33-I153 WeakPolarHBondContact O-CA 3.45Å; V34-I153 HydrophobicContact CG1-CG1 4.08Å; V34-I153 HydrophobicContact CG2-CG1 4.23Å; E121-I153 HydrophobicContact CB-CG2 4.43Å; V124-I153 HydrophobicContact CB-CG2 4.29Å; V124-I153 HydrophobicContact CG1-CD1 4.46Å; V124-I153 HydrophobicContact CG1-CG2 4.07Å; R125-I153 HydrophobicContact CB-CD1 3.69Å; R125-I153 HydrophobicContact CG-CD1 4.1Å; R125-I153 PolarHBondContact NH2-O 2.89Å; V128-I153 HydrophobicContact CB-CD1 4.31Å; V128-I153 HydrophobicContact CG2-CD1 4.39Å; L151-I153 HydrophobicContact CD1-CD1 4.45Å; L151-I153 HydrophobicContact CD1-CG1 4.43Å; L151-I153 HydrophobicContact CD2-CD1 4.01Å; L151-I153 HydrophobicContact CG-CD1 4.11Å; L151-I153 HydrophobicContact CG-CG1 4.26Å
154	E	77.4	Confident	63.4	Low	115 Å²	115	65.9 Å²	65.9	54%	0.537	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	137	-173.7	-62.4	178.8	173.3	0	0	110.1	I32 T33 E121	I32-E154 CarbonylContact C-O 3.55Å; I32-E154 VanDerWaalsContact CA-O 3.29Å; I32-E154 WeakPolarHBondContact CA-O 3.44Å; T33-E154 PolarHBondContact N-O 3.3Å; T33-E154 PolarHBondContact O-N 3.39Å; T33-E154 PolarHBondContact OG1-O 3.39Å; E121-E154 WeakPolarHBondContact OE1-CA 3.31Å
155	T	72.2	Confident	60.5	Low	50 Å²	50	73 Å²	73	31%	0.307	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	125.7	174.7	-55.8	0	0	0	0	109.6	I31 I32 E121	I31-T155 CarbonylContact O-C 3.56Å; I32-T155 HydrophobicContact CG1-CG2 4.41Å; E121-T155 WeakPolarHBondContact CG-OG1 3.27Å; E121-T155 PolarHBondContact OE1-N 3.39Å
156	V	54.1	Low	57.8	Low	86 Å²	86	78 Å²	78	52%	0.521	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-39.2	-175.8	-169.8	0	0	0	0	111.8	I31 T33	I31-V156 HydrophobicContact CB-CB 4.47Å; I31-V156 HydrophobicContact CG2-CB 4.29Å; I31-V156 PolarHBondContact O-N 3.09Å; T33-V156 HydrophobicContact CG2-CG2 3.67Å
157	I	55.8	Low	55.1	Low	88 Å²	88	86.7 Å²	86.7	45%	0.451	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	134.4	-176.4	-55	-174.9	0	0	0	110.2	A30 I31 A159	A30-I157 CarbonylContact C-O 3.31Å; A30-I157 WeakPolarHBondContact CA-O 3.27Å; I31-I157 HydrophobicContact CB-CB 4.36Å; I31-I157 HydrophobicContact CD1-CB 4.15Å; I31-I157 HydrophobicContact CD1-CD1 4.1Å; I31-I157 HydrophobicContact CD1-CG1 4.36Å; I31-I157 HydrophobicContact CG1-CB 4.32Å; I31-I157 PolarHBondContact N-O 3.06Å; I157-A159 HydrophobicContact CG2-CB 4.06Å
158	D	53.9	Low	52.9	Low	81 Å²	81	88 Å²	88	43%	0.433	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	108.9	161.1	-179.5	30	0	0	0	108.1	K28 T29 Y107	K28-D158 IonicContact NZ-OD2 3.62Å; K28-D158 PolarHBondContact NZ-OD2 2.9Å; T29-D158 WeakPolarHBondContact O-CA 3.05Å; Y107-D158 VanDerWaalsContact OH-CG 3.31Å; Y107-D158 PolarHBondContact OH-OD1 3.45Å; Y107-D158 PolarHBondContact OH-OD2 3.01Å
159	A	44.1	Very low	50.9	Low	44 Å²	44	90.4 Å²	90.4	36%	0.364	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	136.3	-177.2	0	0	0	0	0	111.2	K28 T29 I157	K28-A159 CarbonylContact C-O 3.55Å; K28-A159 VanDerWaalsContact CA-O 3.25Å; K28-A159 WeakPolarHBondContact CA-O 3.41Å; T29-A159 PolarHBondContact N-O 2.88Å; T29-A159 PolarHBondContact O-N 2.95Å; I157-A159 HydrophobicContact CG2-CB 4.06Å
160	A	44.6	Very low	49.4	Very low	62 Å²	62	94.4 Å²	94.4	51%	0.512	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	127.8	171.2	0	0	0	0	0	110.5	L26 T27 K28	L26-A160 HydrophobicContact CD2-CB 4.41Å; T27-A160 CarbonylContact O-C 3.57Å; T27-A160 WeakPolarHBondContact O-CA 3.31Å; K28-A160 HydrophobicContact CG-CB 4.02Å
161	T	42.3	Very low	47.7	Very low	78 Å²	78	97.9 Å²	97.9	48%	0.479	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	118.9	172.7	16.4	0	0	0	0	109.2	T27	T27-T161 PolarHBondContact N-O 2.94Å; T27-T161 PolarHBondContact O-N 2.9Å; T27-T161 PolarHBondContact O-OG1 3Å
162	T	35	Very low	45.2	Very low	83 Å²	83	105.9 Å²	105.9	51%	0.509	58%	0.578	S	S	.	*			trans	-97.7	110.6	172.5	-49.7	0	0	0	0	108.8	V24 L26 M164	V24-T162 HydrophobicContact CG1-CG2 4.26Å; L26-T162 VanDerWaalsContact CD2-OG1 3.3Å; L26-T162 WeakPolarHBondContact CD2-OG1 3.26Å; T162-M164 HydrophobicContact CG2-CG 4.07Å
163	E	35.2	Very low	42.7	Very low	161 Å²	161	106.8 Å²	106.8	75%	0.752	59%	0.592	S	S	*	*			trans	-85.4	107.6	163.5	-78.2	-167.6	156.3	0	0	109.1
164	M	27.4	Very low	40.1	Very low	150 Å²	150	116.7 Å²	116.7	74%	0.739	63%	0.631	S	S	*	*			trans	-90.1	104.6	167.3	-73	-123.6	-59.1	0	0	109.2	T162 T166	T162-M164 HydrophobicContact CG2-CG 4.07Å; M164-T166 PolarHBondContact O-N 3.25Å
165	I	27.4	Very low	38	Very low	156 Å²	156	119 Å²	119	80%	0.8	64%	0.639	S	S	*	*			trans	-90.9	92	161	-54.7	176.3	0	0	0	106.2
166	T	31.1	Very low	36	Very low	105 Å²	105	122.1 Å²	122.1	64%	0.644	66%	0.659	S	S	*	*			trans	-109.6	102.9	169.4	-32.7	0	0	0	0	108.8	M164	M164-T166 PolarHBondContact O-N 3.25Å
167	E	27	Very low	35	Very low	187 Å²	187	124.7 Å²	124.7	87%	0.874	68%	0.675	S	S	*	*			trans	-96.9	101.7	168.1	-166.8	176.9	-144.9	0	0	107.7
168	S	31.7	Very low	34	Very low	101 Å²	101	123.2 Å²	123.2	71%	0.706	68%	0.681	S	S	*	*			trans	-175.9	106.1	152	58.7	0	0	0	0	112.1
169	Q	30.5	Very low	33	Very low	174 Å²	174	128 Å²	128	81%	0.813	70%	0.701	S	S	*	*			trans	34.8	128.1	134	-63.1	-166.8	-40.9	0	0	121.8
170	D	28.8	Very low	32.5	Very low	136 Å²	136	133.2 Å²	133.2	73%	0.727	72%	0.718	S	S	*	*			trans	67	107.9	141.7	-59.3	-18.5	0	0	0	119.1
171	T	32	Very low	32	Very low	122 Å²	122	135.6 Å²	135.6	75%	0.748	73%	0.726	S	S	*	*				169.2	120	83.8	-50.8	0	0	0	0	109.4
172	E	31.3	Very low	31.7	Very low	181 Å²	181	137.4 Å²	137.4	85%	0.846	74%	0.737	S	S	*	*			trans	32.3	130.1	150.5	-54.6	-171.9	156.4	0	0	121.5
173	A	31.5	Very low	31.6	Very low	80 Å²	80	140.2 Å²	140.2	66%	0.661	75%	0.749	S	S	*	*				159	110.5	98.9	0	0	0	0	0	113.4
174	Y	29.8	Very low	31.6	Very low	210 Å²	210	138.2 Å²	138.2	82%	0.824	75%	0.748	S	S	*	*			trans	63.7	130.9	147.8	-68.8	-92.4	0	0	0	117.7
175	K	32.2	Very low	31.9	Very low	163 Å²	163	137.3 Å²	137.3	71%	0.709	75%	0.751	S	S	*	*			cis	-174.5	130.7	29.3	-140.9	155.8	-176.8	-178.4	0	109.2
176	T	31.5	Very low	32	Very low	117 Å²	117	137.9 Å²	137.9	72%	0.718	75%	0.75	S	S	*	*			trans	52.7	129.6	136.1	58.3	0	0	0	0	118.8
177	T	32.7	Very low	31.9	Very low	140 Å²	140	139.5 Å²	139.5	86%	0.859	76%	0.76	S	S	*	*			cis	179.5	148.9	47	-27.3	0	0	0	0	110.8
178	G	33.1	Very low	32	Very low	57 Å²	57	136.4 Å²	136.4	59%	0.588	75%	0.754	S	S	*	*			trans	103.1	94	150.6	0	0	0	0	0	116
179	E	33.5	Very low	32.1	Very low	181 Å²	181	137.9 Å²	137.9	85%	0.846	76%	0.759	S	S	*	*				78.1	128.9	97.6	-82.7	177.8	147.4	0	0	112
180	E	34.8	Very low	32.1	Very low	154 Å²	154	138.4 Å²	138.4	72%	0.72	76%	0.761	S	S	*	*			cis	-168.7	137.7	23.7	-125.5	177.8	170.5	0	0	109.1
181	T	33.4	Very low	32.3	Very low	112 Å²	112	139.5 Å²	139.5	69%	0.687	77%	0.765	S	S	*	*			trans	41.8	138.4	136.1	55.2	0	0	0	0	121.3
182	T	35.5	Very low	32.1	Very low	116 Å²	116	140.3 Å²	140.3	71%	0.712	77%	0.765	S	S	*	*				-177.6	139.4	50.8	-16.2	0	0	0	0	111.3
183	D	33.6	Very low	32.2	Very low	141 Å²	141	139 Å²	139	75%	0.754	76%	0.762	S	S	*	*			trans	31.3	141.8	142	-66.5	-29.4	0	0	0	121.2
184	T	34.3	Very low	32.3	Very low	120 Å²	120	140.6 Å²	140.6	74%	0.736	76%	0.764	S	S	*	*				-177.8	145.5	50.2	-22.5	0	0	0	0	112.5
185	T	34.3	Very low	32.3	Very low	130 Å²	130	139.1 Å²	139.1	80%	0.798	76%	0.764	S	S	*	*			trans	82.9	110.8	145.3	9.5	0	0	0	0	123.4
186	E	29.1	Very low	32.3	Very low	169 Å²	169	138 Å²	138	79%	0.79	77%	0.772	S	S	*	*			trans	-70.1	152.7	156.7	-64.2	171.6	137.2	0	0	113.1
187	V	30.3	Very low	32.2	Very low	139 Å²	139	139.6 Å²	139.6	84%	0.842	78%	0.776	S	S	*	*			trans	-141.7	107.4	143.2	-178.9	0	0	0	0	108.6
188	T	28	Very low	32.3	Very low	121 Å²	121	141 Å²	141	74%	0.742	78%	0.776	S	S	*	*			trans	-110.7	135.4	162.3	25.9	0	0	0	0	108.5
189	T	34	Very low	32.1	Very low	132 Å²	132	143.7 Å²	143.7	81%	0.81	78%	0.782	S	S	*	*			trans	-129.8	108.3	164.4	42.1	0	0	0	0	108.6
190	E	30.6	Very low	31.9	Very low	185 Å²	185	143.7 Å²	143.7	86%	0.864	78%	0.781	S	S	*	*			trans	-75.4	143.6	161.8	-72.3	176.9	148.2	0	0	110
191	I	32.3	Very low	31.8	Very low	159 Å²	159	141.8 Å²	141.8	82%	0.815	78%	0.781	S	S	*	*			trans	-125.2	116.7	155	-65.1	177.9	0	0	0	106.5	I193	I191-I193 HydrophobicContact CG2-CG1 4.29Å
192	D	27.5	Very low	31.7	Very low	139 Å²	139	144.9 Å²	144.9	74%	0.743	79%	0.787	S	S	*	*			trans	-104.8	130.5	177.8	-165.1	12.4	0	0	0	107.6
193	I	33.6	Very low	31.5	Very low	153 Å²	153	144.5 Å²	144.5	79%	0.785	78%	0.784	S	S	*	*			trans	-141.2	122.6	164.8	-48	178.4	0	0	0	109.1	I191	I191-I193 HydrophobicContact CG2-CG1 4.29Å
194	T	33.9	Very low	31.3	Very low	114 Å²	114	145.1 Å²	145.1	70%	0.699	79%	0.785	S	S	*	*			trans	-85.7	163.8	-168.7	32.4	0	0	0	0	115.5
195	E	29.6	Very low	31	Very low	179 Å²	179	147.6 Å²	147.6	84%	0.836	79%	0.788	S	S	*	*			trans	-39.3	153.1	172.9	-67.9	168.6	138.1	0	0	117.7
196	T	33.4	Very low	30.8	Very low	141 Å²	141	148.5 Å²	148.5	87%	0.865	79%	0.793	S	S	*	*			trans	-156.4	120.3	135.7	-11.9	0	0	0	0	112.7
197	D	28.6	Very low	30.7	Very low	150 Å²	150	149 Å²	149	80%	0.802	80%	0.796	S	S	*	*			trans	-65.2	143.2	163.4	-90.5	-40.2	0	0	0	112.2
198	I	34.9	Very low	30.7	Very low	168 Å²	168	153.6 Å²	153.6	86%	0.862	80%	0.798	S	S	*	*			trans	-143.1	118.6	153.5	-51.7	179	0	0	0	109.7
199	T	29.4	Very low	30.7	Very low	115 Å²	115	153.3 Å²	153.3	71%	0.706	80%	0.796	S	S	*	*			trans	-91	151	174.2	31.7	0	0	0	0	113.4
200	E	29.3	Very low	30.4	Very low	180 Å²	180	154 Å²	154	84%	0.841	80%	0.8	S	S	*	*			trans	68.8	149.2	145	-73.7	-174.1	164.6	0	0	123.3
201	T	32.2	Very low	30.2	Very low	115 Å²	115	148.7 Å²	148.7	71%	0.706	80%	0.796	S	S	*	*			trans	112.9	89.5	144.6	-36.2	0	0	0	0	117.5
202	E	31.4	Very low	29.8	Very low	176 Å²	176	144.8 Å²	144.8	82%	0.822	80%	0.795	S	S	*	*				73.7	139	112	-124.7	-177	-152.1	0	0	122.6
203	V	32	Very low	29.8	Very low	108 Å²	108	145 Å²	145	66%	0.655	79%	0.794	S	S	*	*			trans	105.5	102.4	146	-165.5	0	0	0	0	120.7
204	M	28.6	Very low	29.3	Very low	154 Å²	154	147.5 Å²	147.5	76%	0.759	80%	0.8	S	S	*	*			trans	48.2	125.9	132.1	-58.3	-159.8	-44.3	0	0	124.7
205	E	28	Very low	29	Very low	172 Å²	172	148 Å²	148	80%	0.804	80%	0.798	S	S	*	*			trans	45.2	119.1	130.7	-64.5	-175.8	160.5	0	0	120.6
206	T	29.8	Very low	29	Very low	149 Å²	149	149.3 Å²	149.3	91%	0.914	80%	0.797	S	S	*	*				-154.5	122.4	127.1	-47.7	0	0	0	0	110.7
207	E	28.4	Very low	28.6	Very low	180 Å²	180	150.6 Å²	150.6	84%	0.841	80%	0.798	S	S	*	*			trans	-62.9	147.2	173.3	-57.8	177.6	137.8	0	0	113.5
208	R	28.9	Very low	28.6	Very low	235 Å²	235	148.5 Å²	148.5	89%	0.887	80%	0.795	S	S	*	*			trans	-166.4	99.4	135.8	-115.1	-175.1	168.4	107.7	-2.1	112.6
209	T	27.5	Very low	28.5	Very low	115 Å²	115	147.5 Å²	147.5	71%	0.706	79%	0.787	S	S	*	*			trans	31.4	125.7	130.1	52	0	0	0	0	119
210	T	28.1	Very low	28.6	Very low	146 Å²	146	146.5 Å²	146.5	90%	0.896	78%	0.78	S	S	*	*				168.7	120.4	97.7	-54.3	0	0	0	0	109.8
211	G	27.2	Very low	29	Very low	75 Å²	75	142 Å²	142	77%	0.773	77%	0.769	S	S	*	*			trans	134.3	69.6	164.3	0	0	0	0	0	115.1
212	G	24.2	Very low	29.7	Very low	77 Å²	77	139 Å²	139	79%	0.794	75%	0.749	S	S	*	*			trans	-76	133.5	169.3	0	0	0	0	0	111.6
213	I	26.7	Very low	30.7	Very low	142 Å²	142	132.7 Å²	132.7	73%	0.728	72%	0.722	S	S	*	*			trans	-136.9	104.6	159.6	-68.7	-175.5	0	0	0	106.5	L215	I213-L215 HydrophobicContact CG2-CB 4.25Å; I213-L215 HydrophobicContact CG2-CD1 3.38Å; I213-L215 HydrophobicContact CG2-CD2 4.49Å; I213-L215 HydrophobicContact CG2-CG 3.42Å; I213-L215 VanDerWaalsContact CG2-CG 3.42Å
214	F	24.1	Very low	32	Very low	206 Å²	206	129.8 Å²	129.8	90%	0.904	70%	0.701	S	S	*	*			trans	-70.5	117.6	160.2	-82.6	-98.1	0	0	0	107.5
215	L	27.3	Very low	33.6	Very low	126 Å²	126	123.8 Å²	123.8	66%	0.66	67%	0.672	S	S	*	*			trans	-145.8	103.8	166.7	-71.6	177	0	0	0	111.6	I213	I213-L215 HydrophobicContact CG2-CB 4.25Å; I213-L215 HydrophobicContact CG2-CD1 3.38Å; I213-L215 HydrophobicContact CG2-CD2 4.49Å; I213-L215 HydrophobicContact CG2-CG 3.42Å; I213-L215 VanDerWaalsContact CG2-CG 3.42Å
216	Y	28.4	Very low	35.2	Very low	206 Å²	206	115.6 Å²	115.6	81%	0.808	63%	0.634	S	S	*	*			trans	63.1	122.1	143	-63.6	-80.5	0	0	0	120.6	S218	Y216-S218 PolarHBondContact O-N 3Å
217	D	25.8	Very low	36.8	Very low	167 Å²	167	110.2 Å²	110.2	89%	0.893	60%	0.599	S	S	*	*			trans	-43.3	108.7	148.4	-107.2	-31.6	0	0	0	108.7
218	S	28	Very low	38.7	Very low	107 Å²	107	101.6 Å²	101.6	75%	0.748	56%	0.559	S	S	*	*			trans	-93.2	96.6	167.8	49.4	0	0	0	0	107.4	Y216 V220	Y216-S218 PolarHBondContact O-N 3Å; S218-V220 PolarHBondContact O-N 3.39Å
219	E	33.7	Very low	40.9	Very low	147 Å²	147	92.8 Å²	92.8	69%	0.687	53%	0.532	S	S	*	.			trans	-54	119.3	169.7	-70	-178.3	174.5	0	0	109.2	S221	E219-S221 PolarHBondContact O-N 3.17Å
220	V	30.6	Very low	43.3	Very low	93 Å²	93	87.3 Å²	87.3	56%	0.564	50%	0.498	S	S	*	.			trans	-70.2	110.5	173.4	179	0	0	0	0	107.7	S218 L222	S218-V220 PolarHBondContact O-N 3.39Å; V220-L222 HydrophobicContact CG1-CG 4.47Å; V220-L222 PolarHBondContact O-N 3.28Å
221	S	38.2	Very low	45.9	Very low	87 Å²	87	81.9 Å²	81.9	61%	0.608	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	108.4	172.4	62.5	0	0	0	0	109.7	E219	E219-S221 PolarHBondContact O-N 3.17Å
222	L	47.6	Very low	48.6	Very low	52 Å²	52	78.5 Å²	78.5	27%	0.272	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	130.7	170.4	-76.7	155.3	0	0	0	109	V220 S304 S305 T358	V220-L222 HydrophobicContact CG1-CG 4.47Å; V220-L222 PolarHBondContact O-N 3.28Å; L222-S304 CarbonylContact O-C 3.58Å; L222-S304 WeakPolarHBondContact O-CA 2.94Å; L222-S305 PolarHBondContact N-O 3.01Å; L222-S305 PolarHBondContact O-N 2.93Å; L222-T358 HydrophobicContact CD2-CG2 4.46Å
223	T	52.2	Low	51.6	Low	43 Å²	43	75.9 Å²	75.9	26%	0.264	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	133.9	169.6	-60	0	0	0	0	108.6	I279 D302 A356 T357	T223-I279 HydrophobicContact CG2-CD1 3.62Å; T223-D302 HydrophobicContact CG2-CB 4.48Å; T223-A356 CarbonylContact O-C 3.56Å; T223-A356 WeakPolarHBondContact O-CA 3.31Å; T223-T357 PolarHBondContact O-N 3.3Å; T223-T357 PolarHBondContact O-OG1 3.39Å
224	K	59.7	Low	54.6	Low	47 Å²	47	69.1 Å²	69.1	20%	0.204	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	147	174.4	-74.9	-174.1	156.2	-145.6	0	110.1	D302 Y303 D354 A355 A356	K224-D302 CarbonylContact O-C 3.52Å; K224-D302 VanDerWaalsContact O-CA 3.32Å; K224-D302 WeakPolarHBondContact O-CA 3.36Å; K224-Y303 HydrophobicContact CB-CD1 3.98Å; K224-Y303 HydrophobicContact CB-CD2 4.17Å; K224-Y303 HydrophobicContact CB-CE1 3.48Å; K224-Y303 VanDerWaalsContact CB-CE1 3.48Å; K224-Y303 HydrophobicContact CB-CE2 3.74Å; K224-Y303 HydrophobicContact CB-CG 4.29Å; K224-Y303 HydrophobicContact CD-CE2 3.81Å; K224-Y303 WeakPolarHBondContact CD-OH 3.2Å; K224-Y303 HydrophobicContact CG-CE2 4.38Å; K224-Y303 PolarHBondContact N-O 3.14Å; K224-Y303 VanDerWaalsContact O-CD1 3.23Å; K224-Y303 WeakPolarHBondContact O-CD1 3.23Å; K224-Y303 PolarHBondContact O-N 3.27Å; K224-D354 IonicContact NZ-OD1 3.95Å; K224-D354 IonicContact NZ-OD2 2.63Å; K224-D354 PolarHBondContact NZ-OD2 2.95Å; K224-A355 CarbonylContact C-O 3.45Å; K224-A355 VanDerWaalsContact CA-O 3.22Å; K224-A355 WeakPolarHBondContact CA-O 3.38Å; K224-A356 HydrophobicContact CG-CB 4.14Å
225	T	62	Low	57.7	Low	27 Å²	27	59.9 Å²	59.9	17%	0.166	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	124.1	178	-58.6	0	0	0	0	109.8	V300 I301 D302 D354 A355	T225-V300 HydrophobicContact CG2-CG1 3.45Å; T225-V300 VanDerWaalsContact CG2-CG1 3.45Å; T225-I301 CarbonylContact C-O 3.46Å; T225-I301 WeakPolarHBondContact CA-O 3.25Å; T225-D302 WeakPolarHBondContact CB-OD1 3.28Å; T225-D302 VanDerWaalsContact CG2-OD1 3.24Å; T225-D302 WeakPolarHBondContact CG2-OD1 3.33Å; T225-D302 PolarHBondContact OG1-OD1 3.3Å; T225-D354 WeakPolarHBondContact O-CA 3.5Å; T225-A355 PolarHBondContact N-O 3.24Å; T225-A355 PolarHBondContact O-N 3.32Å
226	A	60.4	Low	60.7	Low	1 Å²	1	57.5 Å²	57.5	1%	0.008	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.8	174.2	0	0	0	0	0	110.9	V300 I301 Y303 V315 I353	A226-V300 CarbonylContact O-C 3.58Å; A226-V300 WeakPolarHBondContact O-CA 3.49Å; A226-I301 HydrophobicContact CB-CB 4.36Å; A226-I301 PolarHBondContact N-O 2.82Å; A226-I301 PolarHBondContact O-N 2.69Å; A226-Y303 HydrophobicContact CB-CD1 4.47Å; A226-Y303 HydrophobicContact CB-CE1 3.95Å; A226-V315 HydrophobicContact CB-CB 4.14Å; A226-V315 HydrophobicContact CB-CG1 4.27Å; A226-I353 VanDerWaalsContact CA-O 3.24Å; A226-I353 WeakPolarHBondContact CA-O 3.39Å
227	I	63.7	Low	63.4	Low	35 Å²	35	52.4 Å²	52.4	18%	0.179	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	128.3	172.6	-55.8	-177.8	0	0	0	108.8	M298 L299 V300 T351 V352 I353	I227-M298 HydrophobicContact CG2-CG 3.73Å; I227-M298 HydrophobicContact CG2-SD 3.74Å; I227-L299 CarbonylContact C-O 3.52Å; I227-L299 WeakPolarHBondContact CA-O 3.23Å; I227-V300 HydrophobicContact CG1-CG1 4.37Å; I227-V300 HydrophobicContact CG1-CG2 4.34Å; I227-T351 CarbonylContact O-C 3.57Å; I227-T351 WeakPolarHBondContact O-CA 3.44Å; I227-V352 HydrophobicContact CB-CB 4.23Å; I227-V352 HydrophobicContact CG2-CB 4.17Å; I227-V352 HydrophobicContact CG2-CG2 4.43Å; I227-V352 PolarHBondContact O-N 3.45Å; I227-I353 HydrophobicContact CB-CB 4.44Å; I227-I353 HydrophobicContact CD1-CB 4.26Å; I227-I353 HydrophobicContact CD1-CD1 3.91Å; I227-I353 HydrophobicContact CD1-CG1 4.26Å; I227-I353 HydrophobicContact CG1-CB 4.29Å; I227-I353 PolarHBondContact N-O 3.11Å; I227-I353 VanDerWaalsContact N-O 3.13Å
228	I	67.5	Low	66.1	Low	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	124.5	-175.6	-60.7	176.8	0	0	0	109.7	V230 M298 L299 I301 V315 V320 I349 E350 T351	I228-V230 HydrophobicContact CG2-CG2 4.37Å; I228-M298 CarbonylContact O-C 3.56Å; I228-M298 WeakPolarHBondContact O-CA 3.39Å; I228-L299 HydrophobicContact CB-CB 4.27Å; I228-L299 PolarHBondContact N-O 2.86Å; I228-L299 PolarHBondContact O-N 3.32Å; I228-I301 HydrophobicContact CD1-CD1 3.86Å; I228-V315 HydrophobicContact CD1-CG1 3.75Å; I228-V320 HydrophobicContact CD1-CB 4.09Å; I228-V320 HydrophobicContact CD1-CG1 4.45Å; I228-V320 HydrophobicContact CD1-CG2 3.34Å; I228-V320 HydrophobicContact CG2-CG1 4.16Å; I228-I349 HydrophobicContact CG2-CG2 3.66Å; I228-E350 CarbonylContact C-O 3.56Å; I228-E350 VanDerWaalsContact CA-O 3.3Å; I228-E350 WeakPolarHBondContact CA-O 3.28Å; I228-T351 HydrophobicContact CG1-CG2 4.34Å
229	T	76.5	Confident	68.9	Low	49 Å²	49	52 Å²	52	30%	0.301	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	140.8	172.6	55.4	0	0	0	0	109.9	A297 I349 E350 V352	T229-A297 CarbonylContact C-O 3.57Å; T229-A297 WeakPolarHBondContact CA-O 3.41Å; T229-I349 VanDerWaalsContact O-CA 3.28Å; T229-I349 WeakPolarHBondContact O-CA 3.44Å; T229-E350 PolarHBondContact N-O 3.37Å; T229-E350 PolarHBondContact O-N 3.42Å; T229-E350 PolarHBondContact OG1-O 3.44Å; T229-V352 HydrophobicContact CG2-CG2 3.83Å
230	V	78	Confident	71.4	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	122.8	177.2	-172.3	0	0	0	0	108.4	I228 L266 A297 L299 F341 L347 T348 I349	I228-V230 HydrophobicContact CG2-CG2 4.37Å; V230-L266 HydrophobicContact CB-CD1 4.34Å; V230-L266 HydrophobicContact CB-CD2 4.35Å; V230-L266 HydrophobicContact CG1-CD2 4.11Å; V230-L266 HydrophobicContact CG2-CD1 4.33Å; V230-L266 HydrophobicContact CG2-CD2 4.08Å; V230-A297 PolarHBondContact N-O 3.47Å; V230-A297 PolarHBondContact O-N 2.06Å; V230-L299 HydrophobicContact CG2-CD1 4.07Å; V230-F341 HydrophobicContact CB-CZ 4.46Å; V230-F341 HydrophobicContact CG1-CD2 4.25Å; V230-F341 HydrophobicContact CG1-CE1 4.28Å; V230-F341 HydrophobicContact CG1-CE2 3.95Å; V230-F341 HydrophobicContact CG1-CZ 3.94Å; V230-L347 HydrophobicContact CG1-CD1 3.75Å; V230-T348 WeakPolarHBondContact CA-O 3.33Å; V230-I349 HydrophobicContact CG1-CG1 4.06Å; V230-I349 HydrophobicContact CG2-CG1 4.22Å
231	S	82.1	Confident	74.1	Confident	32 Å²	32	45 Å²	45	22%	0.224	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	140.9	172.5	85.4	0	0	0	0	113.6	G295 N296 T348	S231-G295 VanDerWaalsContact CA-O 3.29Å; S231-G295 WeakPolarHBondContact CA-O 3.32Å; S231-N296 VanDerWaalsContact CB-OD1 3.22Å; S231-N296 WeakPolarHBondContact CB-OD1 3.38Å; S231-T348 PolarHBondContact N-O 3.29Å; S231-T348 PolarHBondContact N-OG1 3.29Å; S231-T348 PolarHBondContact O-N 3.08Å; S231-T348 PolarHBondContact O-OG1 2.88Å; S231-T348 PolarHBondContact OG-OG1 3.36Å
232	S	84.8	Confident	76.4	Confident	4 Å²	4	49.2 Å²	49.2	3%	0.028	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	168.6	168.6	-152.4	0	0	0	0	111.2	L234 I294 G295 G342 S345	S232-L234 PolarHBondContact O-N 2.63Å; S232-I294 WeakPolarHBondContact O-CA 3.45Å; S232-G295 PolarHBondContact N-O 3.45Å; S232-G295 PolarHBondContact O-N 3.04Å; S232-G342 PolarHBondContact OG-O 2.83Å; S232-S345 PolarHBondContact OG-OG 2.74Å
233	T	87.1	Confident	78.2	Confident	22 Å²	22	49.5 Å²	49.5	14%	0.135	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	128.1	166.7	-70.5	0	0	0	0	110.7	P240 S292 G342	T233-P240 HydrophobicContact CG2-CB 3.98Å; T233-S292 VanDerWaalsContact CG2-CB 3.47Å; T233-S292 VanDerWaalsContact CG2-O 3.25Å; T233-S292 WeakPolarHBondContact CG2-O 3.28Å; T233-S292 PolarHBondContact OG1-O 3.19Å; T233-G342 PolarHBondContact O-N 3.37Å
234	L	89.5	Confident	79.8	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	135.9	176.2	-60.4	-180	0	0	0	110.9	S232 P240 L241 Y258 I262 F288 V293 I339 F341	S232-L234 PolarHBondContact O-N 2.63Å; L234-P240 WeakPolarHBondContact O-CA 3.49Å; L234-L241 HydrophobicContact CB-CD1 3.74Å; L234-L241 HydrophobicContact CB-CG 4.37Å; L234-L241 PolarHBondContact O-N 3.45Å; L234-Y258 HydrophobicContact CD1-CD2 4.27Å; L234-I262 HydrophobicContact CD1-CD1 3.68Å; L234-I262 HydrophobicContact CD1-CG1 4.47Å; L234-I262 HydrophobicContact CD2-CD1 3.75Å; L234-I262 HydrophobicContact CD2-CG1 4Å; L234-I262 HydrophobicContact CG-CD1 4.34Å; L234-F288 HydrophobicContact CD1-CD1 3.93Å; L234-F288 HydrophobicContact CD1-CE1 3.74Å; L234-V293 VanDerWaalsContact CB-O 3.31Å; L234-V293 WeakPolarHBondContact CB-O 3.49Å; L234-V293 HydrophobicContact CD1-CG1 3.75Å; L234-V293 HydrophobicContact CG-CG1 4.42Å; L234-V293 VanDerWaalsContact CG-O 3.29Å; L234-V293 WeakPolarHBondContact CG-O 3.19Å; L234-V293 PolarHBondContact N-O 3.32Å; L234-I339 HydrophobicContact CB-CG2 3.85Å; L234-I339 HydrophobicContact CD1-CG2 4.08Å; L234-I339 HydrophobicContact CD2-CG2 4.04Å; L234-I339 HydrophobicContact CG-CG2 4.2Å; L234-F341 HydrophobicContact CD2-CD1 3.93Å; L234-F341 HydrophobicContact CD2-CE1 4.01Å
235	T	89.1	Confident	80.8	Confident	12 Å²	12	53 Å²	53	7%	0.074	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	143.5	-175.3	-57.4	0	0	0	0	108.9	K239 I339 Y340	T235-K239 WeakPolarHBondContact CA-O 3.37Å; T235-K239 WeakPolarHBondContact CG2-O 3.03Å; T235-I339 WeakPolarHBondContact O-CA 3.36Å; T235-Y340 HydrophobicContact CG2-CE1 4.38Å; T235-Y340 HydrophobicContact CG2-CE2 3.87Å; T235-Y340 WeakPolarHBondContact CG2-OH 3.34Å; T235-Y340 PolarHBondContact N-O 3.4Å; T235-Y340 WeakPolarHBondContact O-CD1 3.19Å; T235-Y340 PolarHBondContact O-N 2.73Å
236	R	88.8	Confident	81.9	Confident	76 Å²	76	54.1 Å²	54.1	29%	0.287	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	129.2	169.3	-180	178.3	-76.7	161.7	-5.7	108	N238 K239 L241 D337 I339	R236-N238 VanDerWaalsContact C-N 3.28Å; R236-N238 PolarHBondContact O-N 2.79Å; R236-K239 PolarHBondContact N-O 2.76Å; R236-K239 PolarHBondContact O-N 2.81Å; R236-L241 HydrophobicContact CB-CD2 3.65Å; R236-L241 HydrophobicContact CB-CG 4.43Å; R236-D337 WeakPolarHBondContact CD-O 3.16Å; R236-D337 VanDerWaalsContact CG-O 3.3Å; R236-D337 WeakPolarHBondContact CG-O 3.42Å; R236-D337 PolarHBondContact NE-O 3.28Å; R236-D337 VanDerWaalsContact NE-O 3.09Å; R236-I339 VanDerWaalsContact NH2-CD1 3.3Å
237	L	86.9	Confident	82.9	Confident	99 Å²	99	54.2 Å²	54.2	52%	0.518	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	44.9	-177.8	-61	170.2	0	0	0	113.4	K239 S336	L237-K239 PolarHBondContact O-N 3.12Å; L237-S336 WeakPolarHBondContact CD2-O 3.47Å
238	N	82.4	Confident	83.3	Confident	112 Å²	112	57.6 Å²	57.6	60%	0.599	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	21.1	-176.7	-66.1	-44.7	0	0	0	115.3	R236 Y340	R236-N238 VanDerWaalsContact C-N 3.28Å; R236-N238 PolarHBondContact O-N 2.79Å; N238-Y340 VanDerWaalsContact CA-OH 3.25Å; N238-Y340 WeakPolarHBondContact CA-OH 2.77Å; N238-Y340 PolarHBondContact N-OH 2.79Å; N238-Y340 PolarHBondContact OD1-OH 3.38Å
239	K	85.5	Confident	83.5	Confident	153 Å²	153	61.2 Å²	61.2	67%	0.665	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	130.1	172	-66.4	-175.8	179.4	-178.9	0	110.4	T235 R236 L237	T235-K239 WeakPolarHBondContact CA-O 3.37Å; T235-K239 WeakPolarHBondContact CG2-O 3.03Å; R236-K239 PolarHBondContact N-O 2.76Å; R236-K239 PolarHBondContact O-N 2.81Å; L237-K239 PolarHBondContact O-N 3.12Å
240	P	85.9	Confident	83.3	Confident	75 Å²	75	62.5 Å²	62.5	49%	0.487	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	141	171.4	-23	32.8	0	0	0	110.6	T233 L234	T233-P240 HydrophobicContact CG2-CB 3.98Å; L234-P240 WeakPolarHBondContact O-CA 3.49Å
241	L	88.2	Confident	83.1	Confident	19 Å²	19	68.6 Å²	68.6	10%	0.099	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-73	143.4	175.6	-65.9	176.3	0	0	0	110.6	L234 R236 Y258 V293 I339	L234-L241 HydrophobicContact CB-CD1 3.74Å; L234-L241 HydrophobicContact CB-CG 4.37Å; L234-L241 PolarHBondContact O-N 3.45Å; R236-L241 HydrophobicContact CB-CD2 3.65Å; R236-L241 HydrophobicContact CB-CG 4.43Å; L241-Y258 HydrophobicContact CD1-CD2 4.31Å; L241-Y258 HydrophobicContact CD1-CE2 3.59Å; L241-V293 HydrophobicContact CB-CB 4.09Å; L241-V293 HydrophobicContact CB-CG2 3.92Å; L241-I339 HydrophobicContact CD1-CD1 3.92Å; L241-I339 HydrophobicContact CD1-CG1 3.94Å; L241-I339 HydrophobicContact CD1-CG2 3.88Å
242	E	85.6	Confident	83.1	Confident	175 Å²	175	67.9 Å²	67.9	82%	0.818	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-82.9	145.6	173	-66.4	-173.1	172.4	0	0	110.7	V293	E242-V293 VanDerWaalsContact O-CG2 3.31Å; E242-V293 WeakPolarHBondContact O-CG2 3.46Å
243	W	85.4	Confident	83.2	Confident	58 Å²	58	73.8 Å²	73.8	22%	0.22	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-64.3	139.4	179.9	-179.9	-100.1	0	0	0	112.4	D245 L247 L248 F288 S289 R290 V293	W243-D245 PolarHBondContact NE1-OD1 3.22Å; W243-L247 HydrophobicContact CE3-CD1 4.36Å; W243-L247 HydrophobicContact CH2-CB 4.14Å; W243-L247 HydrophobicContact CZ3-CB 4.29Å; W243-L247 HydrophobicContact CZ3-CD1 4.29Å; W243-L248 HydrophobicContact CH2-CD2 3.97Å; W243-L248 HydrophobicContact CH2-CG 4.34Å; W243-L248 HydrophobicContact CZ2-CD1 4.29Å; W243-L248 HydrophobicContact CZ2-CD2 3.69Å; W243-L248 HydrophobicContact CZ2-CG 3.73Å; W243-F288 HydrophobicContact CH2-CB 4.48Å; W243-F288 HydrophobicContact CZ3-CB 4.1Å; W243-S289 VanDerWaalsContact CZ3-O 3.31Å; W243-S289 WeakPolarHBondContact CZ3-O 3.38Å; W243-R290 HydrophobicContact CD2-CB 4.35Å; W243-R290 HydrophobicContact CD2-CG 3.59Å; W243-R290 HydrophobicContact CE3-CB 4.46Å; W243-R290 HydrophobicContact CE3-CG 4.07Å; W243-R290 HydrophobicContact CG-CG 4.11Å; W243-R290 HydrophobicContact CH2-CG 3.87Å; W243-R290 HydrophobicContact CZ2-CG 3.38Å; W243-R290 HydrophobicContact CZ3-CG 4.2Å; W243-V293 HydrophobicContact CE3-CG2 4.22Å
244	N	85.6	Confident	83.2	Confident	72 Å²	72	74.7 Å²	74.7	39%	0.385	39%	0.389	S	S	.	.			trans	-134.8	127.9	172	-174.7	-40.1	0	0	0	109	S246 L247 L254	N244-S246 PolarHBondContact O-N 2.84Å; N244-S246 VanDerWaalsContact OD1-CB 3.29Å; N244-S246 WeakPolarHBondContact OD1-CB 3.36Å; N244-S246 PolarHBondContact OD1-N 2.93Å; N244-S246 PolarHBondContact OD1-OG 3.37Å; N244-L247 WeakPolarHBondContact O-CB 3.47Å; N244-L247 WeakPolarHBondContact O-CG 3.33Å; N244-L247 PolarHBondContact O-N 3.18Å; N244-L254 HydrophobicContact CB-CD2 3.58Å; N244-L254 VanDerWaalsContact CG-CD2 3.48Å
245	D	82.6	Confident	83.2	Confident	92 Å²	92	76.2 Å²	76.2	49%	0.492	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-62.2	-17.3	-177.4	-69.4	-30.4	0	0	0	113.8	W243 L247 L248 R290	W243-D245 PolarHBondContact NE1-OD1 3.22Å; D245-L247 PolarHBondContact O-N 2.8Å; D245-L248 WeakPolarHBondContact O-CB 3.48Å; D245-L248 PolarHBondContact O-N 2.89Å; D245-R290 IonicContact OD1-CZ 3.83Å; D245-R290 IonicContact OD1-NE 2.84Å; D245-R290 IonicContact OD1-NH2 3.3Å; D245-R290 PolarHBondContact OD1-NH2 2.58Å; D245-R290 IonicContact OD2-NH2 3.22Å
246	S	84.5	Confident	83.1	Confident	50 Å²	50	82.4 Å²	82.4	35%	0.35	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-59.9	-25.1	171.5	-48.9	0	0	0	0	112.1	N244 L248 D249 S252	N244-S246 PolarHBondContact O-N 2.84Å; N244-S246 VanDerWaalsContact OD1-CB 3.29Å; N244-S246 WeakPolarHBondContact OD1-CB 3.36Å; N244-S246 PolarHBondContact OD1-N 2.93Å; N244-S246 PolarHBondContact OD1-OG 3.37Å; S246-L248 PolarHBondContact O-N 3.14Å; S246-D249 PolarHBondContact O-N 2.88Å; S246-S252 VanDerWaalsContact O-CB 3.3Å; S246-S252 WeakPolarHBondContact O-CB 3.41Å; S246-S252 PolarHBondContact O-OG 2.64Å
247	L	81.2	Confident	83.2	Confident	3 Å²	3	82.2 Å²	82.2	2%	0.016	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-70.7	-5.9	175.3	-63.1	174.9	0	0	0	113.8	W243 N244 D245 L254 Y255 Y258 F288 V293	W243-L247 HydrophobicContact CE3-CD1 4.36Å; W243-L247 HydrophobicContact CH2-CB 4.14Å; W243-L247 HydrophobicContact CZ3-CB 4.29Å; W243-L247 HydrophobicContact CZ3-CD1 4.29Å; N244-L247 WeakPolarHBondContact O-CB 3.47Å; N244-L247 WeakPolarHBondContact O-CG 3.33Å; N244-L247 PolarHBondContact O-N 3.18Å; D245-L247 PolarHBondContact O-N 2.8Å; L247-L254 HydrophobicContact CD2-CB 4.47Å; L247-L254 HydrophobicContact CD2-CD2 4.02Å; L247-L254 HydrophobicContact CD2-CG 3.85Å; L247-L254 HydrophobicContact CG-CD2 3.98Å; L247-L254 HydrophobicContact CG-CG 4.37Å; L247-Y255 VanDerWaalsContact O-CD2 3.31Å; L247-Y255 WeakPolarHBondContact O-CD2 3.32Å; L247-Y258 HydrophobicContact CD1-CD2 4.08Å; L247-Y258 HydrophobicContact CD1-CE2 4.01Å; L247-Y258 HydrophobicContact CD2-CD2 3.67Å; L247-Y258 HydrophobicContact CD2-CE2 4.16Å; L247-Y258 HydrophobicContact CD2-CG 4.03Å; L247-F288 HydrophobicContact CB-CB 4.11Å; L247-F288 HydrophobicContact CB-CD2 4.13Å; L247-F288 HydrophobicContact CB-CG 4.29Å; L247-F288 HydrophobicContact CD1-CB 4.39Å; L247-F288 HydrophobicContact CD1-CG 4.41Å; L247-F288 HydrophobicContact CD2-CD2 3.96Å; L247-F288 HydrophobicContact CD2-CE2 4.12Å; L247-F288 HydrophobicContact CD2-CG 4.27Å; L247-V293 HydrophobicContact CD1-CB 4.5Å; L247-V293 HydrophobicContact CD1-CG1 3.57Å; L247-V293 HydrophobicContact CD1-CG2 4.01Å
248	L	72.3	Confident	83.4	Confident	106 Å²	106	78.4 Å²	78.4	56%	0.555	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-84	-20.5	171.1	-63.5	171.2	0	0	0	112.7	W243 D245 S246 P250	W243-L248 HydrophobicContact CH2-CD2 3.97Å; W243-L248 HydrophobicContact CH2-CG 4.34Å; W243-L248 HydrophobicContact CZ2-CD1 4.29Å; W243-L248 HydrophobicContact CZ2-CD2 3.69Å; W243-L248 HydrophobicContact CZ2-CG 3.73Å; D245-L248 WeakPolarHBondContact O-CB 3.48Å; D245-L248 PolarHBondContact O-N 2.89Å; S246-L248 PolarHBondContact O-N 3.14Å; L248-P250 WeakPolarHBondContact O-CD 3.42Å
249	D	71.3	Confident	83.6	Confident	76 Å²	76	73.9 Å²	73.9	41%	0.406	38%	0.378	S	S	.	.			trans	-100.7	110	178.7	178.5	8.6	0	0	0	109.6	S246 N251 S252 Y255	S246-D249 PolarHBondContact O-N 2.88Å; D249-N251 PolarHBondContact O-N 3.5Å; D249-N251 WeakPolarHBondContact OD1-CB 3.29Å; D249-N251 PolarHBondContact OD1-N 3.23Å; D249-N251 PolarHBondContact OD1-ND2 2.98Å; D249-N251 VanDerWaalsContact OD1-ND2 3.1Å; D249-S252 WeakPolarHBondContact O-CB 3.33Å; D249-S252 PolarHBondContact O-N 2.95Å; D249-S252 PolarHBondContact O-OG 3.18Å; D249-Y255 VanDerWaalsContact O-CB 3.27Å; D249-Y255 WeakPolarHBondContact O-CB 3.41Å
250	P	71.9	Confident	83.8	Confident	75 Å²	75	70.3 Å²	70.3	49%	0.487	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-20	177.1	-25.2	35.2	0	0	0	114.4	L248 Y255	L248-P250 WeakPolarHBondContact O-CD 3.42Å; P250-Y255 HydrophobicContact CB-CD1 4.31Å; P250-Y255 HydrophobicContact CB-CE1 4.12Å; P250-Y255 WeakPolarHBondContact O-CD1 3.3Å
251	N	74.6	Confident	84	Confident	130 Å²	130	68.4 Å²	68.4	70%	0.695	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-9.8	179	-55	-68.5	0	0	0	113.4	D249	D249-N251 PolarHBondContact O-N 3.5Å; D249-N251 WeakPolarHBondContact OD1-CB 3.29Å; D249-N251 PolarHBondContact OD1-N 3.23Å; D249-N251 PolarHBondContact OD1-ND2 2.98Å; D249-N251 VanDerWaalsContact OD1-ND2 3.1Å
252	S	81.3	Confident	84.1	Confident	17 Å²	17	67.5 Å²	67.5	12%	0.119	35%	0.349	C	S	.	.	S	Bend	trans	-67.4	146.7	-179.4	82.8	0	0	0	0	111.1	S246 D249 L254 Y255 R256	S246-S252 VanDerWaalsContact O-CB 3.3Å; S246-S252 WeakPolarHBondContact O-CB 3.41Å; S246-S252 PolarHBondContact O-OG 2.64Å; D249-S252 WeakPolarHBondContact O-CB 3.33Å; D249-S252 PolarHBondContact O-N 2.95Å; D249-S252 PolarHBondContact O-OG 3.18Å; S252-L254 PolarHBondContact O-N 3.04Å; S252-Y255 PolarHBondContact O-N 2.83Å; S252-Y255 WeakPolarHBondContact OG-CB 3.49Å; S252-Y255 PolarHBondContact OG-N 2.91Å; S252-R256 PolarHBondContact O-N 3.02Å
253	D	87.8	Confident	84.3	Confident	127 Å²	127	60 Å²	60	68%	0.679	32%	0.315	S	S	*	.	H	α-helix	trans	-59.3	-33	176.1	-70.7	-34.2	0	0	0	111.6	R256 D257	D253-R256 IonicContact OD1-NH1 3.77Å; D253-R256 PolarHBondContact OD1-NH1 3.19Å; D253-D257 VanDerWaalsContact O-CB 3.23Å; D253-D257 WeakPolarHBondContact O-CB 3.38Å; D253-D257 PolarHBondContact O-N 2.97Å
254	L	87.7	Confident	84.5	Confident	41 Å²	41	61 Å²	61	22%	0.215	33%	0.325	C	S	.	.	H	α-helix	trans	-69.8	-43.9	178.7	-168.6	69.4	0	0	0	112.2	N244 L247 S252 R256 D257 Y258	N244-L254 HydrophobicContact CB-CD2 3.58Å; N244-L254 VanDerWaalsContact CG-CD2 3.48Å; L247-L254 HydrophobicContact CD2-CB 4.47Å; L247-L254 HydrophobicContact CD2-CD2 4.02Å; L247-L254 HydrophobicContact CD2-CG 3.85Å; L247-L254 HydrophobicContact CG-CD2 3.98Å; L247-L254 HydrophobicContact CG-CG 4.37Å; S252-L254 PolarHBondContact O-N 3.04Å; L254-R256 VanDerWaalsContact C-N 3.34Å; L254-D257 PolarHBondContact O-N 3.07Å; L254-Y258 HydrophobicContact CD1-CD1 3.94Å; L254-Y258 HydrophobicContact CD1-CE1 3.39Å; L254-Y258 HydrophobicContact CG-CD1 4.3Å; L254-Y258 HydrophobicContact CG-CE1 4.08Å; L254-Y258 WeakPolarHBondContact O-CB 3.43Å; L254-Y258 WeakPolarHBondContact O-CD1 3.45Å; L254-Y258 PolarHBondContact O-N 2.78Å
255	Y	88.4	Confident	84.8	Confident	32 Å²	32	57.9 Å²	57.9	13%	0.125	31%	0.308	C	S	.	.	H	α-helix	trans	-60.4	-47.6	175.6	-176.1	-77.8	0	0	0	110.2	L247 D249 P250 S252 Y258 S259 F288	L247-Y255 VanDerWaalsContact O-CD2 3.31Å; L247-Y255 WeakPolarHBondContact O-CD2 3.32Å; D249-Y255 VanDerWaalsContact O-CB 3.27Å; D249-Y255 WeakPolarHBondContact O-CB 3.41Å; P250-Y255 HydrophobicContact CB-CD1 4.31Å; P250-Y255 HydrophobicContact CB-CE1 4.12Å; P250-Y255 WeakPolarHBondContact O-CD1 3.3Å; S252-Y255 PolarHBondContact O-N 2.83Å; S252-Y255 WeakPolarHBondContact OG-CB 3.49Å; S252-Y255 PolarHBondContact OG-N 2.91Å; Y255-Y258 PolarHBondContact O-N 3.18Å; Y255-S259 WeakPolarHBondContact CE1-OG 3.36Å; Y255-S259 WeakPolarHBondContact O-CB 3.44Å; Y255-S259 PolarHBondContact O-N 3.18Å; Y255-S259 PolarHBondContact O-OG 3.23Å; Y255-F288 HydrophobicContact CD1-CE2 4.31Å; Y255-F288 AromaticContact CD2-CD2 3.51Å; Y255-F288 HydrophobicContact CD2-CD2 3.51Å; Y255-F288 AromaticContact CD2-CE2 3.48Å; Y255-F288 HydrophobicContact CD2-CE2 3.48Å; Y255-F288 VanDerWaalsContact CD2-CE2 3.48Å; Y255-F288 HydrophobicContact CE1-CE2 4.38Å; Y255-F288 AromaticContact CE2-CD2 3.53Å; Y255-F288 HydrophobicContact CE2-CD2 3.53Å; Y255-F288 AromaticContact CE2-CE2 3.59Å; Y255-F288 HydrophobicContact CE2-CE2 3.59Å; Y255-F288 HydrophobicContact CG-CD2 4.32Å; Y255-F288 AromaticContact CG-CE2 3.86Å; Y255-F288 HydrophobicContact CG-CE2 3.86Å
256	R	87.1	Confident	85.1	Confident	143 Å²	143	53.5 Å²	53.5	54%	0.54	28%	0.284	S	S	.	.	H	α-helix	trans	-63.4	-42.9	179.7	-73.1	176.2	54.9	-124.3	-7.3	112.3	S252 D253 L254 T260	S252-R256 PolarHBondContact O-N 3.02Å; D253-R256 IonicContact OD1-NH1 3.77Å; D253-R256 PolarHBondContact OD1-NH1 3.19Å; L254-R256 VanDerWaalsContact C-N 3.34Å; R256-T260 WeakPolarHBondContact O-CB 3.33Å; R256-T260 PolarHBondContact O-N 2.84Å; R256-T260 PolarHBondContact O-OG1 3.26Å
257	D	90.7	Very high	85.3	Confident	71 Å²	71	53.2 Å²	53.2	38%	0.38	28%	0.279	S	S	.	.	H	α-helix	trans	-61.3	-50.6	176.5	178.2	47.8	0	0	0	111.6	D253 L254 S259 T260 Q261	D253-D257 VanDerWaalsContact O-CB 3.23Å; D253-D257 WeakPolarHBondContact O-CB 3.38Å; D253-D257 PolarHBondContact O-N 2.97Å; L254-D257 PolarHBondContact O-N 3.07Å; D257-S259 PolarHBondContact O-N 3.26Å; D257-T260 PolarHBondContact O-N 3.4Å; D257-Q261 WeakPolarHBondContact O-CG 3.47Å; D257-Q261 PolarHBondContact O-N 2.93Å; D257-Q261 PolarHBondContact OD1-NE2 2.91Å; D257-Q261 PolarHBondContact OD2-NE2 3.08Å
258	Y	90.7	Very high	85.6	Confident	20 Å²	20	57.7 Å²	57.7	8%	0.078	30%	0.299	C	S	.	.	H	α-helix	trans	-64.9	-41.9	-179	-79.2	28.6	0	0	0	111.3	L234 L241 L247 L254 Y255 T260 Q261 I262 F288 V293 I339	L234-Y258 HydrophobicContact CD1-CD2 4.27Å; L241-Y258 HydrophobicContact CD1-CD2 4.31Å; L241-Y258 HydrophobicContact CD1-CE2 3.59Å; L247-Y258 HydrophobicContact CD1-CD2 4.08Å; L247-Y258 HydrophobicContact CD1-CE2 4.01Å; L247-Y258 HydrophobicContact CD2-CD2 3.67Å; L247-Y258 HydrophobicContact CD2-CE2 4.16Å; L247-Y258 HydrophobicContact CD2-CG 4.03Å; L254-Y258 HydrophobicContact CD1-CD1 3.94Å; L254-Y258 HydrophobicContact CD1-CE1 3.39Å; L254-Y258 HydrophobicContact CG-CD1 4.3Å; L254-Y258 HydrophobicContact CG-CE1 4.08Å; L254-Y258 WeakPolarHBondContact O-CB 3.43Å; L254-Y258 WeakPolarHBondContact O-CD1 3.45Å; L254-Y258 PolarHBondContact O-N 2.78Å; Y255-Y258 PolarHBondContact O-N 3.18Å; Y258-T260 VanDerWaalsContact C-N 3.34Å; Y258-T260 PolarHBondContact O-N 3.07Å; Y258-Q261 PolarHBondContact O-N 3.49Å; Y258-I262 VanDerWaalsContact O-CG1 3.31Å; Y258-I262 WeakPolarHBondContact O-CG1 3.27Å; Y258-I262 PolarHBondContact O-N 3.43Å; Y258-F288 VanDerWaalsContact CB-CZ 3.46Å; Y258-F288 HydrophobicContact CD2-CE1 4.25Å; Y258-V293 HydrophobicContact CD2-CG1 4.4Å; Y258-V293 HydrophobicContact CE2-CG1 4.36Å; Y258-I339 HydrophobicContact CD1-CD1 3.27Å; Y258-I339 HydrophobicContact CD2-CD1 3.96Å; Y258-I339 HydrophobicContact CE1-CD1 3.41Å; Y258-I339 VanDerWaalsContact CE1-CD1 3.41Å; Y258-I339 HydrophobicContact CE2-CD1 4.09Å; Y258-I339 HydrophobicContact CG-CD1 3.56Å
259	S	87.2	Confident	86.4	Confident	17 Å²	17	52.6 Å²	52.6	12%	0.119	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-40.5	178.1	-67.9	0	0	0	0	112.1	Y255 D257 I262 C263 V285 F288	Y255-S259 WeakPolarHBondContact CE1-OG 3.36Å; Y255-S259 WeakPolarHBondContact O-CB 3.44Å; Y255-S259 PolarHBondContact O-N 3.18Å; Y255-S259 PolarHBondContact O-OG 3.23Å; D257-S259 PolarHBondContact O-N 3.26Å; S259-I262 PolarHBondContact O-N 3Å; S259-C263 PolarHBondContact O-N 2.65Å; S259-V285 WeakPolarHBondContact OG-CB 3.31Å; S259-V285 WeakPolarHBondContact OG-CG1 3.42Å; S259-F288 WeakPolarHBondContact OG-CE2 3.43Å; S259-F288 WeakPolarHBondContact OG-CZ 3.18Å
260	T	89.6	Confident	86.9	Confident	77 Å²	77	49.1 Å²	49.1	47%	0.472	25%	0.254	S	S	.	.	H	α-helix	trans	-63.1	-49.4	176.1	-56.2	0	0	0	0	110.7	R256 D257 Y258 I262 C263 D264	R256-T260 WeakPolarHBondContact O-CB 3.33Å; R256-T260 PolarHBondContact O-N 2.84Å; R256-T260 PolarHBondContact O-OG1 3.26Å; D257-T260 PolarHBondContact O-N 3.4Å; Y258-T260 VanDerWaalsContact C-N 3.34Å; Y258-T260 PolarHBondContact O-N 3.07Å; T260-I262 VanDerWaalsContact C-N 3.33Å; T260-I262 PolarHBondContact O-N 3.36Å; T260-C263 PolarHBondContact O-N 2.9Å; T260-D264 WeakPolarHBondContact O-CB 3.45Å; T260-D264 VanDerWaalsContact O-CG 3.26Å; T260-D264 PolarHBondContact O-N 2.95Å
261	Q	91.1	Very high	87.2	Confident	35 Å²	35	51.2 Å²	51.2	16%	0.164	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-39	179.6	-72.2	-179.9	59.9	0	0	112.9	D257 Y258 L265 I339	D257-Q261 WeakPolarHBondContact O-CG 3.47Å; D257-Q261 PolarHBondContact O-N 2.93Å; D257-Q261 PolarHBondContact OD1-NE2 2.91Å; D257-Q261 PolarHBondContact OD2-NE2 3.08Å; Y258-Q261 PolarHBondContact O-N 3.49Å; Q261-L265 WeakPolarHBondContact O-CB 3.46Å; Q261-L265 PolarHBondContact O-N 2.9Å; Q261-I339 HydrophobicContact CB-CB 4.32Å; Q261-I339 VanDerWaalsContact OE1-N 3.08Å
262	I	90	Very high	87.1	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-65.2	-47.9	176.1	-72	168	0	0	0	111.2	L234 Y258 S259 T260 L265 L266 V285 F288 A297 F341	L234-I262 HydrophobicContact CD1-CD1 3.68Å; L234-I262 HydrophobicContact CD1-CG1 4.47Å; L234-I262 HydrophobicContact CD2-CD1 3.75Å; L234-I262 HydrophobicContact CD2-CG1 4Å; L234-I262 HydrophobicContact CG-CD1 4.34Å; Y258-I262 VanDerWaalsContact O-CG1 3.31Å; Y258-I262 WeakPolarHBondContact O-CG1 3.27Å; Y258-I262 PolarHBondContact O-N 3.43Å; S259-I262 PolarHBondContact O-N 3Å; T260-I262 VanDerWaalsContact C-N 3.33Å; T260-I262 PolarHBondContact O-N 3.36Å; I262-L265 WeakPolarHBondContact O-CB 3.29Å; I262-L265 PolarHBondContact O-N 3.44Å; I262-L266 HydrophobicContact CG2-CD1 4.07Å; I262-L266 WeakPolarHBondContact O-CG 3.42Å; I262-L266 PolarHBondContact O-N 3.48Å; I262-V285 HydrophobicContact CB-CG2 4.03Å; I262-V285 HydrophobicContact CG2-CG2 3.85Å; I262-F288 HydrophobicContact CD1-CE1 3.59Å; I262-F288 HydrophobicContact CD1-CZ 4.17Å; I262-A297 HydrophobicContact CG2-CB 3.86Å; I262-F341 HydrophobicContact CG2-CE2 3.89Å; I262-F341 HydrophobicContact CG2-CZ 3.51Å
263	C	89.6	Confident	86.5	Confident	17 Å²	17	49.8 Å²	49.8	12%	0.115	26%	0.26	C	S	.	.	H	α-helix	trans	-69	-37	-179.4	-81.7	0	0	0	0	112.4	S259 T260 L265 L266 L267 C283	S259-C263 PolarHBondContact O-N 2.65Å; T260-C263 PolarHBondContact O-N 2.9Å; C263-L265 VanDerWaalsContact C-N 3.32Å; C263-L265 PolarHBondContact O-N 3Å; C263-L266 PolarHBondContact O-N 2.98Å; C263-L267 VanDerWaalsContact O-CB 3.28Å; C263-L267 WeakPolarHBondContact O-CB 3.15Å; C263-L267 WeakPolarHBondContact O-CG 3.37Å; C263-L267 PolarHBondContact O-N 2.99Å; C263-C283 WeakPolarHBondContact CA-SG 3.33Å; C263-C283 HydrophobicContact CB-CB 3.63Å; C263-C283 WeakPolarHBondContact CB-SG 3.21Å; C263-C283 WeakPolarHBondContact SG-CB 3.06Å; C263-C283 PolarHBondContact SG-O 3.47Å; C263-C283 CovalentContact SG-SG 2.06Å; C263-C283 PolarHBondContact SG-SG 3.1Å
264	D	89.9	Confident	85.2	Confident	80 Å²	80	53.4 Å²	53.4	43%	0.428	27%	0.266	S	S	.	.	H	α-helix	trans	-58	-46.9	171.2	-75.2	-16.7	0	0	0	110.5	T260 L266 H268	T260-D264 WeakPolarHBondContact O-CB 3.45Å; T260-D264 VanDerWaalsContact O-CG 3.26Å; T260-D264 PolarHBondContact O-N 2.95Å; D264-L266 PolarHBondContact O-N 3.37Å; D264-H268 WeakPolarHBondContact O-CB 3.35Å; D264-H268 PolarHBondContact O-N 2.78Å; D264-H268 PolarHBondContact O-ND1 2.92Å
265	L	91.1	Very high	84.1	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.026	26%	0.26	C	S	.	.	H	α-helix	trans	-57.2	-50.4	176.6	178	155.9	0	0	0	112	Q261 I262 C263 H268 S269 V324 Y327 I328 I331 Y340 F341	Q261-L265 WeakPolarHBondContact O-CB 3.46Å; Q261-L265 PolarHBondContact O-N 2.9Å; I262-L265 WeakPolarHBondContact O-CB 3.29Å; I262-L265 PolarHBondContact O-N 3.44Å; C263-L265 VanDerWaalsContact C-N 3.32Å; C263-L265 PolarHBondContact O-N 3Å; L265-H268 PolarHBondContact O-N 2.78Å; L265-S269 WeakPolarHBondContact O-CB 3.39Å; L265-S269 PolarHBondContact O-N 3.08Å; L265-S269 PolarHBondContact O-OG 3.41Å; L265-V324 HydrophobicContact CD2-CG1 4.34Å; L265-Y327 HydrophobicContact CG-CD1 4.04Å; L265-Y327 HydrophobicContact CG-CE1 4.24Å; L265-I328 HydrophobicContact CD1-CG1 4.27Å; L265-I331 HydrophobicContact CD1-CD1 3.69Å; L265-I331 HydrophobicContact CG-CD1 4.18Å; L265-Y340 VanDerWaalsContact CD1-CA 3.49Å; L265-F341 HydrophobicContact CD2-CD2 3.92Å; L265-F341 HydrophobicContact CD2-CE2 4.14Å
266	L	89.9	Confident	82.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-67.8	-44.4	-176.4	-69.7	175.8	0	0	0	112.1	V230 I262 C263 D264 H268 S269 I270 A297 L299 V324 F341	V230-L266 HydrophobicContact CB-CD1 4.34Å; V230-L266 HydrophobicContact CB-CD2 4.35Å; V230-L266 HydrophobicContact CG1-CD2 4.11Å; V230-L266 HydrophobicContact CG2-CD1 4.33Å; V230-L266 HydrophobicContact CG2-CD2 4.08Å; I262-L266 HydrophobicContact CG2-CD1 4.07Å; I262-L266 WeakPolarHBondContact O-CG 3.42Å; I262-L266 PolarHBondContact O-N 3.48Å; C263-L266 PolarHBondContact O-N 2.98Å; D264-L266 PolarHBondContact O-N 3.37Å; L266-H268 VanDerWaalsContact C-N 3.34Å; L266-H268 PolarHBondContact O-N 3.21Å; L266-S269 WeakPolarHBondContact O-CB 3.3Å; L266-S269 PolarHBondContact O-N 2.74Å; L266-I270 WeakPolarHBondContact O-CG1 3.04Å; L266-I270 PolarHBondContact O-N 3.45Å; L266-A297 HydrophobicContact CD1-CB 3.52Å; L266-L299 HydrophobicContact CB-CD1 4.19Å; L266-L299 HydrophobicContact CB-CD2 3.97Å; L266-L299 HydrophobicContact CB-CG 4.35Å; L266-L299 HydrophobicContact CD1-CD1 4.35Å; L266-L299 HydrophobicContact CD1-CG 4.27Å; L266-L299 HydrophobicContact CD2-CD1 4.28Å; L266-V324 HydrophobicContact CD2-CG1 4.33Å; L266-V324 HydrophobicContact CD2-CG2 3.7Å; L266-F341 HydrophobicContact CD1-CE2 4.03Å; L266-F341 HydrophobicContact CD1-CZ 4.25Å; L266-F341 HydrophobicContact CD2-CD2 4.33Å; L266-F341 HydrophobicContact CD2-CE2 3.69Å; L266-F341 HydrophobicContact CG-CE2 3.86Å
267	L	88.6	Confident	81.4	Confident	44 Å²	44	52 Å²	52	23%	0.23	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-41.3	177.4	-68.8	172.7	0	0	0	111.3	C263 I270 N271 V281 C283	C263-L267 VanDerWaalsContact O-CB 3.28Å; C263-L267 WeakPolarHBondContact O-CB 3.15Å; C263-L267 WeakPolarHBondContact O-CG 3.37Å; C263-L267 PolarHBondContact O-N 2.99Å; L267-I270 PolarHBondContact O-N 3.08Å; L267-N271 VanDerWaalsContact O-CB 3.23Å; L267-N271 WeakPolarHBondContact O-CB 3.27Å; L267-N271 PolarHBondContact O-N 3.47Å; L267-N271 PolarHBondContact O-ND2 2.9Å; L267-V281 HydrophobicContact CD2-CB 4.04Å; L267-V281 HydrophobicContact CD2-CG1 3.71Å; L267-V281 WeakPolarHBondContact CD2-O 3.25Å; L267-C283 HydrophobicContact CD1-CB 4.37Å; L267-C283 HydrophobicContact CD2-CB 4.15Å; L267-C283 HydrophobicContact CG-CB 4.03Å
268	H	87.4	Confident	80.3	Confident	97 Å²	97	50.8 Å²	50.8	45%	0.449	26%	0.262	S	S	.	.	H	α-helix	trans	-65.7	-40.3	174.9	-77.6	78.8	0	0	0	112.1	D264 L265 L266 I270 N271 S272 Y327	D264-H268 WeakPolarHBondContact O-CB 3.35Å; D264-H268 PolarHBondContact O-N 2.78Å; D264-H268 PolarHBondContact O-ND1 2.92Å; L265-H268 PolarHBondContact O-N 2.78Å; L266-H268 VanDerWaalsContact C-N 3.34Å; L266-H268 PolarHBondContact O-N 3.21Å; H268-I270 VanDerWaalsContact C-N 3.34Å; H268-I270 PolarHBondContact O-N 3.43Å; H268-N271 PolarHBondContact O-N 3.11Å; H268-S272 VanDerWaalsContact O-CB 3.29Å; H268-S272 WeakPolarHBondContact O-CB 3.4Å; H268-S272 PolarHBondContact O-N 3.35Å; H268-S272 PolarHBondContact O-OG 2.83Å; H268-S272 VanDerWaalsContact O-OG 3.09Å; H268-Y327 HydrophobicContact CB-CD1 4.42Å; H268-Y327 HydrophobicContact CB-CE1 3.78Å; H268-Y327 HydrophobicContact CB-CE2 3.96Å
269	S	87.9	Confident	79.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.1	-45	177.4	-56.5	0	0	0	0	111.6	L265 L266 S272 T273 A323 Y327	L265-S269 WeakPolarHBondContact O-CB 3.39Å; L265-S269 PolarHBondContact O-N 3.08Å; L265-S269 PolarHBondContact O-OG 3.41Å; L266-S269 WeakPolarHBondContact O-CB 3.3Å; L266-S269 PolarHBondContact O-N 2.74Å; S269-S272 PolarHBondContact O-OG 3.48Å; S269-T273 PolarHBondContact O-OG1 2.95Å; S269-A323 WeakPolarHBondContact O-CB 3.22Å; S269-Y327 WeakPolarHBondContact OG-CB 3.2Å; S269-Y327 WeakPolarHBondContact OG-CD1 3.47Å
270	I	83.1	Confident	78.5	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-72	-43.2	178.7	-60.5	-56.8	0	0	0	111.2	L266 L267 H268 S272 T273 I275 I278 V281 L299 I301 V320 A323	L266-I270 WeakPolarHBondContact O-CG1 3.04Å; L266-I270 PolarHBondContact O-N 3.45Å; L267-I270 PolarHBondContact O-N 3.08Å; H268-I270 VanDerWaalsContact C-N 3.34Å; H268-I270 PolarHBondContact O-N 3.43Å; I270-S272 VanDerWaalsContact C-N 3.32Å; I270-S272 PolarHBondContact O-N 3.23Å; I270-T273 PolarHBondContact O-N 3.11Å; I270-T273 VanDerWaalsContact O-O 3.09Å; I270-I275 HydrophobicContact CG2-CD1 4.33Å; I270-I278 HydrophobicContact CG2-CD1 3.6Å; I270-V281 HydrophobicContact CG2-CG1 4.44Å; I270-V281 HydrophobicContact CG2-CG2 3.81Å; I270-L299 HydrophobicContact CG1-CD1 4.26Å; I270-I301 HydrophobicContact CD1-CD1 4.42Å; I270-V320 HydrophobicContact CD1-CB 4.13Å; I270-V320 HydrophobicContact CD1-CG1 3.86Å; I270-V320 HydrophobicContact CD1-CG2 3.67Å; I270-A323 HydrophobicContact CD1-CB 4.26Å
271	N	78.2	Confident	77.9	Confident	119 Å²	119	54.6 Å²	54.6	64%	0.636	28%	0.279	S	S	*	.	H	α-helix	trans	-69.2	-26.4	-178.9	-73.7	-24.4	0	0	0	113.7	L267 H268 T273	L267-N271 VanDerWaalsContact O-CB 3.23Å; L267-N271 WeakPolarHBondContact O-CB 3.27Å; L267-N271 PolarHBondContact O-N 3.47Å; L267-N271 PolarHBondContact O-ND2 2.9Å; H268-N271 PolarHBondContact O-N 3.11Å; N271-T273 VanDerWaalsContact C-N 3.31Å
272	S	71.5	Confident	77.2	Confident	80 Å²	80	55.7 Å²	55.7	56%	0.559	29%	0.288	S	S	*	.	H	α-helix	trans	-75.9	-22.6	174.5	65.8	0	0	0	0	112.4	H268 S269 I270	H268-S272 VanDerWaalsContact O-CB 3.29Å; H268-S272 WeakPolarHBondContact O-CB 3.4Å; H268-S272 PolarHBondContact O-N 3.35Å; H268-S272 PolarHBondContact O-OG 2.83Å; H268-S272 VanDerWaalsContact O-OG 3.09Å; S269-S272 PolarHBondContact O-OG 3.48Å; I270-S272 VanDerWaalsContact C-N 3.32Å; I270-S272 PolarHBondContact O-N 3.23Å
273	T	68.7	Low	76.7	Confident	38 Å²	38	56.7 Å²	56.7	23%	0.233	30%	0.295	C	S	.	.	S	Bend	trans	-87.9	127.9	179.5	-53.1	0	0	0	0	109.6	S269 I270 N271 I275 A323	S269-T273 PolarHBondContact O-OG1 2.95Å; I270-T273 PolarHBondContact O-N 3.11Å; I270-T273 VanDerWaalsContact O-O 3.09Å; N271-T273 VanDerWaalsContact C-N 3.31Å; T273-I275 HydrophobicContact CG2-CD1 4.29Å; T273-I275 HydrophobicContact CG2-CG1 3.78Å; T273-I275 PolarHBondContact O-N 3.03Å; T273-A323 HydrophobicContact CG2-CB 4.31Å; T273-A323 WeakPolarHBondContact OG1-CB 3.36Å
274	Y	61.5	Low	75.9	Confident	203 Å²	203	59.5 Å²	59.5	80%	0.796	31%	0.312	S	S	*	.			trans	-74.6	79.4	175.5	-170.9	-96.9	0	0	0	110.5	K276	Y274-K276 HydrophobicContact CE1-CB 4.15Å; Y274-K276 HydrophobicContact CE1-CG 4.47Å
275	I	63.9	Low	75.1	Confident	20 Å²	20	56.3 Å²	56.3	10%	0.103	30%	0.296	C	S	.	.			trans	-93.2	101.5	170.9	-52.9	177.5	0	0	0	107.4	I270 T273 G277 I278 V315 T319	I270-I275 HydrophobicContact CG2-CD1 4.33Å; T273-I275 HydrophobicContact CG2-CD1 4.29Å; T273-I275 HydrophobicContact CG2-CG1 3.78Å; T273-I275 PolarHBondContact O-N 3.03Å; I275-G277 PolarHBondContact O-N 2.89Å; I275-I278 HydrophobicContact CB-CD1 3.54Å; I275-I278 HydrophobicContact CB-CG1 3.9Å; I275-I278 HydrophobicContact CD1-CD1 3.85Å; I275-I278 HydrophobicContact CG1-CD1 4.19Å; I275-I278 HydrophobicContact CG2-CD1 3.77Å; I275-I278 HydrophobicContact CG2-CG1 3.79Å; I275-I278 PolarHBondContact O-N 3.44Å; I275-V315 HydrophobicContact CG2-CG2 4.05Å; I275-T319 HydrophobicContact CD1-CG2 3.59Å; I275-T319 HydrophobicContact CG1-CG2 3.8Å
276	K	58.2	Low	73.9	Confident	145 Å²	145	60.6 Å²	60.6	63%	0.63	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	127	-176.4	-166.1	-177.8	-179.5	-170.5	0	109.9	Y274 A313	Y274-K276 HydrophobicContact CE1-CB 4.15Å; Y274-K276 HydrophobicContact CE1-CG 4.47Å; K276-A313 WeakPolarHBondContact O-CB 3.41Å
277	G	61.1	Low	72.7	Confident	21 Å²	21	61.2 Å²	61.2	22%	0.216	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	101.6	-8.8	174.2	0	0	0	0	0	114.9	I275 I279 Y303 S304	I275-G277 PolarHBondContact O-N 2.89Å; G277-I279 PolarHBondContact O-N 3.39Å; G277-I279 VanDerWaalsContact O-N 3.14Å; G277-Y303 CarbonylContact O-C 3.53Å; G277-Y303 WeakPolarHBondContact O-CA 3.35Å; G277-S304 PolarHBondContact O-N 3.15Å; G277-S304 PolarHBondContact O-OG 3.47Å
278	I	67.6	Low	72.1	Confident	46 Å²	46	60 Å²	60	24%	0.236	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	122.6	174.1	-66.6	-173	0	0	0	110.1	I270 I275 V281 I301 D302	I270-I278 HydrophobicContact CG2-CD1 3.6Å; I275-I278 HydrophobicContact CB-CD1 3.54Å; I275-I278 HydrophobicContact CB-CG1 3.9Å; I275-I278 HydrophobicContact CD1-CD1 3.85Å; I275-I278 HydrophobicContact CG1-CD1 4.19Å; I275-I278 HydrophobicContact CG2-CD1 3.77Å; I275-I278 HydrophobicContact CG2-CG1 3.79Å; I275-I278 PolarHBondContact O-N 3.44Å; I278-V281 HydrophobicContact CD1-CG2 4.33Å; I278-V281 HydrophobicContact CG2-CG2 3.45Å; I278-V281 VanDerWaalsContact CG2-CG2 3.45Å; I278-I301 HydrophobicContact CD1-CG2 3.74Å; I278-I301 HydrophobicContact CG1-CG2 3.81Å; I278-I301 HydrophobicContact CG2-CG2 4.27Å; I278-D302 CarbonylContact C-O 3.42Å; I278-D302 WeakPolarHBondContact CA-O 3.3Å
279	I	66	Low	71.4	Confident	98 Å²	98	57.5 Å²	57.5	50%	0.503	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-47.5	176	-58.5	175	0	0	0	109.2	T223 G277 D302	T223-I279 HydrophobicContact CG2-CD1 3.62Å; G277-I279 PolarHBondContact O-N 3.39Å; G277-I279 VanDerWaalsContact O-N 3.14Å; I279-D302 HydrophobicContact CB-CB 4.16Å; I279-D302 PolarHBondContact N-O 3.35Å
280	N	73.9	Confident	70.4	Confident	76 Å²	76	64.4 Å²	64.4	41%	0.406	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	147.9	-173.9	-176.3	34.2	0	0	0	110.5	I301 D302	N280-I301 CarbonylContact O-C 3.36Å; N280-I301 WeakPolarHBondContact O-CA 3.04Å; N280-D302 HydrophobicContact CB-CB 4.14Å; N280-D302 PolarHBondContact N-O 3.47Å; N280-D302 PolarHBondContact ND2-OD2 2.72Å; N280-D302 PolarHBondContact O-N 3.3Å
281	V	76.2	Confident	69.6	Low	19 Å²	19	66.6 Å²	66.6	12%	0.115	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	124.2	172.7	-172.4	0	0	0	0	108.1	L267 I270 I278 L299 V300 I301	L267-V281 HydrophobicContact CD2-CB 4.04Å; L267-V281 HydrophobicContact CD2-CG1 3.71Å; L267-V281 WeakPolarHBondContact CD2-O 3.25Å; I270-V281 HydrophobicContact CG2-CG1 4.44Å; I270-V281 HydrophobicContact CG2-CG2 3.81Å; I278-V281 HydrophobicContact CD1-CG2 4.33Å; I278-V281 HydrophobicContact CG2-CG2 3.45Å; I278-V281 VanDerWaalsContact CG2-CG2 3.45Å; V281-L299 HydrophobicContact CG1-CD2 3.84Å; V281-V300 CarbonylContact C-O 3.58Å; V281-V300 VanDerWaalsContact CA-O 3.31Å; V281-V300 WeakPolarHBondContact CA-O 3.41Å; V281-I301 HydrophobicContact CB-CG1 4.47Å; V281-I301 HydrophobicContact CG1-CG1 3.79Å; V281-I301 HydrophobicContact CG2-CG1 4.12Å; V281-I301 HydrophobicContact CG2-CG2 4.25Å
282	T	77.3	Confident	69.1	Low	58 Å²	58	63.7 Å²	63.7	36%	0.356	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	144.9	172.5	66.8	0	0	0	0	109.7	L299 V300	T282-L299 CarbonylContact O-C 3.56Å; T282-L299 VanDerWaalsContact O-CA 3.31Å; T282-L299 WeakPolarHBondContact O-CA 3.33Å; T282-V300 PolarHBondContact N-O 3.4Å; T282-V300 PolarHBondContact O-N 3Å; T282-V300 WeakPolarHBondContact OG1-CB 3.45Å
283	C	79	Confident	69.5	Low	23 Å²	23	59.9 Å²	59.9	16%	0.155	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	135.8	175.9	172.3	0	0	0	0	109.6	C263 L267 M298 L299	C263-C283 WeakPolarHBondContact CA-SG 3.33Å; C263-C283 HydrophobicContact CB-CB 3.63Å; C263-C283 WeakPolarHBondContact CB-SG 3.21Å; C263-C283 WeakPolarHBondContact SG-CB 3.06Å; C263-C283 PolarHBondContact SG-O 3.47Å; C263-C283 CovalentContact SG-SG 2.06Å; C263-C283 PolarHBondContact SG-SG 3.1Å; L267-C283 HydrophobicContact CD1-CB 4.37Å; L267-C283 HydrophobicContact CD2-CB 4.15Å; L267-C283 HydrophobicContact CG-CB 4.03Å; C283-M298 CarbonylContact C-O 3.51Å; C283-M298 WeakPolarHBondContact CA-O 3.32Å; C283-L299 HydrophobicContact CB-CD2 3.91Å
284	T	72.7	Confident	70.1	Confident	75 Å²	75	60.7 Å²	60.7	46%	0.46	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	126.3	172.5	-57.9	0	0	0	0	109.3	V286 A297 M298	T284-V286 PolarHBondContact O-N 2.76Å; T284-A297 CarbonylContact O-C 3.45Å; T284-A297 WeakPolarHBondContact O-CA 3.46Å; T284-M298 PolarHBondContact N-O 3.44Å; T284-M298 PolarHBondContact O-N 2.88Å
285	V	72.7	Confident	70.8	Confident	14 Å²	14	51 Å²	51	9%	0.085	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	118.7	169.9	177	0	0	0	0	108.8	S259 I262 F288 N296 A297	S259-V285 WeakPolarHBondContact OG-CB 3.31Å; S259-V285 WeakPolarHBondContact OG-CG1 3.42Å; I262-V285 HydrophobicContact CB-CG2 4.03Å; I262-V285 HydrophobicContact CG2-CG2 3.85Å; V285-F288 HydrophobicContact CG1-CE1 4.37Å; V285-F288 HydrophobicContact CG1-CE2 4.18Å; V285-F288 HydrophobicContact CG1-CZ 3.89Å; V285-N296 CarbonylContact C-O 3.56Å; V285-N296 WeakPolarHBondContact CG1-O 3.3Å; V285-A297 HydrophobicContact CG2-CB 4.33Å
286	V	66.8	Low	71.3	Confident	95 Å²	95	52.1 Å²	52.1	58%	0.576	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	-36.7	-179.6	-177.5	0	0	0	0	110.2	T284 N296 M298	T284-V286 PolarHBondContact O-N 2.76Å; V286-N296 HydrophobicContact CB-CB 4.21Å; V286-N296 PolarHBondContact N-O 3.26Å; V286-M298 HydrophobicContact CG2-CB 4.24Å
287	G	65.1	Low	72	Confident	13 Å²	13	45.3 Å²	45.3	13%	0.134	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.1	-172.9	175.2	0	0	0	0	0	113.1	N296	G287-N296 PolarHBondContact N-O 2.85Å; G287-N296 PolarHBondContact O-N 3.48Å; G287-N296 PolarHBondContact O-ND2 2.8Å
288	F	74.7	Confident	72.7	Confident	18 Å²	18	47.1 Å²	47.1	8%	0.079	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	136.2	-180	-55.8	-82.8	0	0	0	110.6	L234 W243 L247 Y255 Y258 S259 I262 V285 V293 I294	L234-F288 HydrophobicContact CD1-CD1 3.93Å; L234-F288 HydrophobicContact CD1-CE1 3.74Å; W243-F288 HydrophobicContact CH2-CB 4.48Å; W243-F288 HydrophobicContact CZ3-CB 4.1Å; L247-F288 HydrophobicContact CB-CB 4.11Å; L247-F288 HydrophobicContact CB-CD2 4.13Å; L247-F288 HydrophobicContact CB-CG 4.29Å; L247-F288 HydrophobicContact CD1-CB 4.39Å; L247-F288 HydrophobicContact CD1-CG 4.41Å; L247-F288 HydrophobicContact CD2-CD2 3.96Å; L247-F288 HydrophobicContact CD2-CE2 4.12Å; L247-F288 HydrophobicContact CD2-CG 4.27Å; Y255-F288 HydrophobicContact CD1-CE2 4.31Å; Y255-F288 AromaticContact CD2-CD2 3.51Å; Y255-F288 HydrophobicContact CD2-CD2 3.51Å; Y255-F288 AromaticContact CD2-CE2 3.48Å; Y255-F288 HydrophobicContact CD2-CE2 3.48Å; Y255-F288 VanDerWaalsContact CD2-CE2 3.48Å; Y255-F288 HydrophobicContact CE1-CE2 4.38Å; Y255-F288 AromaticContact CE2-CD2 3.53Å; Y255-F288 HydrophobicContact CE2-CD2 3.53Å; Y255-F288 AromaticContact CE2-CE2 3.59Å; Y255-F288 HydrophobicContact CE2-CE2 3.59Å; Y255-F288 HydrophobicContact CG-CD2 4.32Å; Y255-F288 AromaticContact CG-CE2 3.86Å; Y255-F288 HydrophobicContact CG-CE2 3.86Å; Y258-F288 VanDerWaalsContact CB-CZ 3.46Å; Y258-F288 HydrophobicContact CD2-CE1 4.25Å; S259-F288 WeakPolarHBondContact OG-CE2 3.43Å; S259-F288 WeakPolarHBondContact OG-CZ 3.18Å; I262-F288 HydrophobicContact CD1-CE1 3.59Å; I262-F288 HydrophobicContact CD1-CZ 4.17Å; V285-F288 HydrophobicContact CG1-CE1 4.37Å; V285-F288 HydrophobicContact CG1-CE2 4.18Å; V285-F288 HydrophobicContact CG1-CZ 3.89Å; F288-V293 HydrophobicContact CB-CG1 4.39Å; F288-V293 HydrophobicContact CD1-CG1 3.94Å; F288-V293 HydrophobicContact CG-CG1 4.49Å; F288-I294 VanDerWaalsContact CA-O 3.26Å; F288-I294 WeakPolarHBondContact CA-O 3.37Å
289	S	72.7	Confident	73.1	Confident	45 Å²	45	45 Å²	45	32%	0.315	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	143.1	178.8	-48.6	0	0	0	0	111.9	W243 I294 N296	W243-S289 VanDerWaalsContact CZ3-O 3.31Å; W243-S289 WeakPolarHBondContact CZ3-O 3.38Å; S289-I294 PolarHBondContact N-O 2.59Å; S289-I294 PolarHBondContact O-N 2.99Å; S289-N296 PolarHBondContact OG-ND2 2.88Å
290	R	68.2	Low	73.4	Confident	145 Å²	145	41.6 Å²	41.6	55%	0.547	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	139.3	176.5	-90.8	-177.1	169.6	175.1	-1.3	111.2	W243 D245	W243-R290 HydrophobicContact CD2-CB 4.35Å; W243-R290 HydrophobicContact CD2-CG 3.59Å; W243-R290 HydrophobicContact CE3-CB 4.46Å; W243-R290 HydrophobicContact CE3-CG 4.07Å; W243-R290 HydrophobicContact CG-CG 4.11Å; W243-R290 HydrophobicContact CH2-CG 3.87Å; W243-R290 HydrophobicContact CZ2-CG 3.38Å; W243-R290 HydrophobicContact CZ3-CG 4.2Å; D245-R290 IonicContact OD1-CZ 3.83Å; D245-R290 IonicContact OD1-NE 2.84Å; D245-R290 IonicContact OD1-NH2 3.3Å; D245-R290 PolarHBondContact OD1-NH2 2.58Å; D245-R290 IonicContact OD2-NH2 3.22Å
291	G	66.1	Low	73.4	Confident	48 Å²	48	38 Å²	38	50%	0.495	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	134.8	-143.4	-174.1	0	0	0	0	0	110.9	V293	G291-V293 PolarHBondContact O-N 2.87Å
292	S	67.3	Low	73	Confident	58 Å²	58	38.8 Å²	38.8	41%	0.406	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	78.9	163.8	-62.9	0	0	0	0	108.4	T233 I294	T233-S292 VanDerWaalsContact CG2-CB 3.47Å; T233-S292 VanDerWaalsContact CG2-O 3.25Å; T233-S292 WeakPolarHBondContact CG2-O 3.28Å; T233-S292 PolarHBondContact OG1-O 3.19Å; S292-I294 PolarHBondContact O-N 3.28Å
293	V	80.7	Confident	72.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	1.4	95.1	-171	-174.4	0	0	0	0	112.7	L234 L241 E242 W243 L247 Y258 F288 G291	L234-V293 VanDerWaalsContact CB-O 3.31Å; L234-V293 WeakPolarHBondContact CB-O 3.49Å; L234-V293 HydrophobicContact CD1-CG1 3.75Å; L234-V293 HydrophobicContact CG-CG1 4.42Å; L234-V293 VanDerWaalsContact CG-O 3.29Å; L234-V293 WeakPolarHBondContact CG-O 3.19Å; L234-V293 PolarHBondContact N-O 3.32Å; L241-V293 HydrophobicContact CB-CB 4.09Å; L241-V293 HydrophobicContact CB-CG2 3.92Å; E242-V293 VanDerWaalsContact O-CG2 3.31Å; E242-V293 WeakPolarHBondContact O-CG2 3.46Å; W243-V293 HydrophobicContact CE3-CG2 4.22Å; L247-V293 HydrophobicContact CD1-CB 4.5Å; L247-V293 HydrophobicContact CD1-CG1 3.57Å; L247-V293 HydrophobicContact CD1-CG2 4.01Å; Y258-V293 HydrophobicContact CD2-CG1 4.4Å; Y258-V293 HydrophobicContact CE2-CG1 4.36Å; F288-V293 HydrophobicContact CB-CG1 4.39Å; F288-V293 HydrophobicContact CD1-CG1 3.94Å; F288-V293 HydrophobicContact CG-CG1 4.49Å; G291-V293 PolarHBondContact O-N 2.87Å
294	I	79.7	Confident	71.7	Confident	55 Å²	55	37.3 Å²	37.3	28%	0.282	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	120.6	179.5	-58.3	173.1	0	0	0	107.5	S232 F288 S289 S292	S232-I294 WeakPolarHBondContact O-CA 3.45Å; F288-I294 VanDerWaalsContact CA-O 3.26Å; F288-I294 WeakPolarHBondContact CA-O 3.37Å; S289-I294 PolarHBondContact N-O 2.59Å; S289-I294 PolarHBondContact O-N 2.99Å; S292-I294 PolarHBondContact O-N 3.28Å
295	G	76.5	Confident	70.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	129.9	174.1	0	0	0	0	0	109.8	S231 S232	S231-G295 VanDerWaalsContact CA-O 3.29Å; S231-G295 WeakPolarHBondContact CA-O 3.32Å; S232-G295 PolarHBondContact N-O 3.45Å; S232-G295 PolarHBondContact O-N 3.04Å
296	N	75.7	Confident	69.6	Low	43 Å²	43	38.8 Å²	38.8	23%	0.23	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	118.8	174.9	-54.3	-68.6	0	0	0	108.5	S231 V285 V286 G287 S289	S231-N296 VanDerWaalsContact CB-OD1 3.22Å; S231-N296 WeakPolarHBondContact CB-OD1 3.38Å; V285-N296 CarbonylContact C-O 3.56Å; V285-N296 WeakPolarHBondContact CG1-O 3.3Å; V286-N296 HydrophobicContact CB-CB 4.21Å; V286-N296 PolarHBondContact N-O 3.26Å; G287-N296 PolarHBondContact N-O 2.85Å; G287-N296 PolarHBondContact O-N 3.48Å; G287-N296 PolarHBondContact O-ND2 2.8Å; S289-N296 PolarHBondContact OG-ND2 2.88Å
297	A	72.8	Confident	68.1	Low	2 Å²	2	37.3 Å²	37.3	2%	0.017	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	152.4	-178.4	0	0	0	0	0	111.5	T229 V230 I262 L266 T284 V285 F341	T229-A297 CarbonylContact C-O 3.57Å; T229-A297 WeakPolarHBondContact CA-O 3.41Å; V230-A297 PolarHBondContact N-O 3.47Å; V230-A297 PolarHBondContact O-N 2.06Å; I262-A297 HydrophobicContact CG2-CB 3.86Å; L266-A297 HydrophobicContact CD1-CB 3.52Å; T284-A297 CarbonylContact O-C 3.45Å; T284-A297 WeakPolarHBondContact O-CA 3.46Å; V285-A297 HydrophobicContact CG2-CB 4.33Å; A297-F341 HydrophobicContact CB-CZ 4.39Å
298	M	75.7	Confident	66.7	Low	59 Å²	59	45.2 Å²	45.2	29%	0.291	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	126.4	176.9	-175.4	177.7	75.5	0	0	108.9	I227 I228 C283 T284 V286 V300	I227-M298 HydrophobicContact CG2-CG 3.73Å; I227-M298 HydrophobicContact CG2-SD 3.74Å; I228-M298 CarbonylContact O-C 3.56Å; I228-M298 WeakPolarHBondContact O-CA 3.39Å; C283-M298 CarbonylContact C-O 3.51Å; C283-M298 WeakPolarHBondContact CA-O 3.32Å; T284-M298 PolarHBondContact N-O 3.44Å; T284-M298 PolarHBondContact O-N 2.88Å; V286-M298 HydrophobicContact CG2-CB 4.24Å; M298-V300 HydrophobicContact CE-CG2 4.09Å
299	L	75.5	Confident	64.7	Low	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	131.7	171.7	-75.7	165	0	0	0	109.1	I227 I228 V230 L266 I270 V281 T282 C283 V320	I227-L299 CarbonylContact C-O 3.52Å; I227-L299 WeakPolarHBondContact CA-O 3.23Å; I228-L299 HydrophobicContact CB-CB 4.27Å; I228-L299 PolarHBondContact N-O 2.86Å; I228-L299 PolarHBondContact O-N 3.32Å; V230-L299 HydrophobicContact CG2-CD1 4.07Å; L266-L299 HydrophobicContact CB-CD1 4.19Å; L266-L299 HydrophobicContact CB-CD2 3.97Å; L266-L299 HydrophobicContact CB-CG 4.35Å; L266-L299 HydrophobicContact CD1-CD1 4.35Å; L266-L299 HydrophobicContact CD1-CG 4.27Å; L266-L299 HydrophobicContact CD2-CD1 4.28Å; I270-L299 HydrophobicContact CG1-CD1 4.26Å; V281-L299 HydrophobicContact CG1-CD2 3.84Å; T282-L299 CarbonylContact O-C 3.56Å; T282-L299 VanDerWaalsContact O-CA 3.31Å; T282-L299 WeakPolarHBondContact O-CA 3.33Å; C283-L299 HydrophobicContact CB-CD2 3.91Å; L299-V320 HydrophobicContact CD1-CG1 4.2Å
300	V	72.1	Confident	62.9	Low	28 Å²	28	58.7 Å²	58.7	17%	0.17	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	117.4	169.1	-175	0	0	0	0	107.2	T225 A226 I227 V281 T282 M298	T225-V300 HydrophobicContact CG2-CG1 3.45Å; T225-V300 VanDerWaalsContact CG2-CG1 3.45Å; A226-V300 CarbonylContact O-C 3.58Å; A226-V300 WeakPolarHBondContact O-CA 3.49Å; I227-V300 HydrophobicContact CG1-CG1 4.37Å; I227-V300 HydrophobicContact CG1-CG2 4.34Å; V281-V300 CarbonylContact C-O 3.58Å; V281-V300 VanDerWaalsContact CA-O 3.31Å; V281-V300 WeakPolarHBondContact CA-O 3.41Å; T282-V300 PolarHBondContact N-O 3.4Å; T282-V300 PolarHBondContact O-N 3Å; T282-V300 WeakPolarHBondContact OG1-CB 3.45Å; M298-V300 HydrophobicContact CE-CG2 4.09Å
301	I	73.8	Confident	61.2	Low	0 Å²	0	56.7 Å²	56.7	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	110.7	-173.5	-61.6	164.5	0	0	0	108.4	T225 A226 I228 I270 I278 N280 V281 V315 V320	T225-I301 CarbonylContact C-O 3.46Å; T225-I301 WeakPolarHBondContact CA-O 3.25Å; A226-I301 HydrophobicContact CB-CB 4.36Å; A226-I301 PolarHBondContact N-O 2.82Å; A226-I301 PolarHBondContact O-N 2.69Å; I228-I301 HydrophobicContact CD1-CD1 3.86Å; I270-I301 HydrophobicContact CD1-CD1 4.42Å; I278-I301 HydrophobicContact CD1-CG2 3.74Å; I278-I301 HydrophobicContact CG1-CG2 3.81Å; I278-I301 HydrophobicContact CG2-CG2 4.27Å; N280-I301 CarbonylContact O-C 3.36Å; N280-I301 WeakPolarHBondContact O-CA 3.04Å; V281-I301 HydrophobicContact CB-CG1 4.47Å; V281-I301 HydrophobicContact CG1-CG1 3.79Å; V281-I301 HydrophobicContact CG2-CG1 4.12Å; V281-I301 HydrophobicContact CG2-CG2 4.25Å; I301-V315 HydrophobicContact CD1-CG1 3.61Å; I301-V315 HydrophobicContact CG2-CG1 4.35Å; I301-V315 HydrophobicContact CG2-CG2 3.85Å; I301-V320 HydrophobicContact CD1-CG2 4.14Å
302	D	68.5	Low	59.7	Low	36 Å²	36	59.3 Å²	59.3	19%	0.193	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	134.5	170.7	-57.4	-44.6	0	0	0	108.9	T223 K224 T225 I278 I279 N280	T223-D302 HydrophobicContact CG2-CB 4.48Å; K224-D302 CarbonylContact O-C 3.52Å; K224-D302 VanDerWaalsContact O-CA 3.32Å; K224-D302 WeakPolarHBondContact O-CA 3.36Å; T225-D302 WeakPolarHBondContact CB-OD1 3.28Å; T225-D302 VanDerWaalsContact CG2-OD1 3.24Å; T225-D302 WeakPolarHBondContact CG2-OD1 3.33Å; T225-D302 PolarHBondContact OG1-OD1 3.3Å; I278-D302 CarbonylContact C-O 3.42Å; I278-D302 WeakPolarHBondContact CA-O 3.3Å; I279-D302 HydrophobicContact CB-CB 4.16Å; I279-D302 PolarHBondContact N-O 3.35Å; N280-D302 HydrophobicContact CB-CB 4.14Å; N280-D302 PolarHBondContact N-O 3.47Å; N280-D302 PolarHBondContact ND2-OD2 2.72Å; N280-D302 PolarHBondContact O-N 3.3Å
303	Y	69.6	Low	58.8	Low	6 Å²	6	58.4 Å²	58.4	2%	0.024	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	140.7	-178.6	66.6	-78.5	0	0	0	112.8	K224 A226 G277 V315 D354	K224-Y303 HydrophobicContact CB-CD1 3.98Å; K224-Y303 HydrophobicContact CB-CD2 4.17Å; K224-Y303 HydrophobicContact CB-CE1 3.48Å; K224-Y303 VanDerWaalsContact CB-CE1 3.48Å; K224-Y303 HydrophobicContact CB-CE2 3.74Å; K224-Y303 HydrophobicContact CB-CG 4.29Å; K224-Y303 HydrophobicContact CD-CE2 3.81Å; K224-Y303 WeakPolarHBondContact CD-OH 3.2Å; K224-Y303 HydrophobicContact CG-CE2 4.38Å; K224-Y303 PolarHBondContact N-O 3.14Å; K224-Y303 VanDerWaalsContact O-CD1 3.23Å; K224-Y303 WeakPolarHBondContact O-CD1 3.23Å; K224-Y303 PolarHBondContact O-N 3.27Å; A226-Y303 HydrophobicContact CB-CD1 4.47Å; A226-Y303 HydrophobicContact CB-CE1 3.95Å; G277-Y303 CarbonylContact O-C 3.53Å; G277-Y303 WeakPolarHBondContact O-CA 3.35Å; Y303-V315 HydrophobicContact CD1-CG2 3.86Å; Y303-V315 HydrophobicContact CE1-CG2 4.21Å; Y303-V315 HydrophobicContact CG-CG2 4.03Å; Y303-D354 PolarHBondContact OH-OD1 2.86Å; Y303-D354 PolarHBondContact OH-OD2 3.2Å
304	S	59.8	Low	57.6	Low	44 Å²	44	62.2 Å²	62.2	31%	0.308	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	127	177.7	66.2	0	0	0	0	111	L222 G277	L222-S304 CarbonylContact O-C 3.58Å; L222-S304 WeakPolarHBondContact O-CA 2.94Å; G277-S304 PolarHBondContact O-N 3.15Å; G277-S304 PolarHBondContact O-OG 3.47Å
305	S	52.2	Low	56.9	Low	34 Å²	34	59.8 Å²	59.8	24%	0.238	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	112.4	165.4	74.4	0	0	0	0	110	L222	L222-S305 PolarHBondContact N-O 3.01Å; L222-S305 PolarHBondContact O-N 2.93Å
306	T	47.7	Very low	56.4	Low	85 Å²	85	62.3 Å²	62.3	52%	0.521	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	122.1	166.7	50.6	0	0	0	0	108.6	E308	T306-E308 PolarHBondContact O-N 2.99Å; T306-E308 VanDerWaalsContact O-N 3.17Å
307	S	35.3	Very low	56.2	Low	65 Å²	65	64.1 Å²	64.1	46%	0.455	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	113.1	176.7	57.4	0	0	0	0	110.6
308	E	36.5	Very low	56.4	Low	179 Å²	179	69 Å²	69	84%	0.836	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	166.9	-14.6	143.3	-94.1	-172.9	-178.2	0	0	113.6	T306	T306-E308 PolarHBondContact O-N 2.99Å; T306-E308 VanDerWaalsContact O-N 3.17Å
309	N	33	Very low	56.4	Low	131 Å²	131	68 Å²	68	70%	0.701	39%	0.389	S	S	*	.			trans	-131.5	95.8	175	-80.3	-51.8	0	0	0	112.1	S311	N309-S311 PolarHBondContact O-N 3.42Å
310	F	33.3	Very low	56.7	Low	215 Å²	215	68 Å²	68	94%	0.943	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	22.2	-179.8	-111.7	-91.9	0	0	0	115.5
311	S	33.5	Very low	57.3	Low	103 Å²	103	70.6 Å²	70.6	72%	0.72	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.5	1.8	-164.5	66.8	0	0	0	0	117.8	N309	N309-S311 PolarHBondContact O-N 3.42Å
312	S	35.5	Very low	57.8	Low	102 Å²	102	75.4 Å²	75.4	71%	0.713	42%	0.421	S	S	*	.	S	Bend	trans	-137.9	9.4	-166.8	71.1	0	0	0	0	120.1
313	A	47.5	Very low	58.6	Low	40 Å²	40	73.8 Å²	73.8	33%	0.331	41%	0.412	S	S	.	.			trans	-158.5	51	175.7	0	0	0	0	0	114	K276	K276-A313 WeakPolarHBondContact O-CB 3.41Å
314	V	55.4	Low	59.4	Low	79 Å²	79	73.5 Å²	73.5	48%	0.479	41%	0.411	S	S	.	.			trans	-89.1	126.7	172.3	-176.2	0	0	0	0	108.2	T316	V314-T316 HydrophobicContact CB-CG2 4.12Å; V314-T316 HydrophobicContact CG1-CG2 3.98Å; V314-T316 PolarHBondContact O-N 2.79Å
315	V	64.6	Low	60.7	Low	5 Å²	5	74.2 Å²	74.2	3%	0.03	41%	0.413	C	S	.	.			trans	-65.8	97.9	167.6	-175.9	0	0	0	0	107.1	A226 I228 I275 I301 Y303 V320	A226-V315 HydrophobicContact CB-CB 4.14Å; A226-V315 HydrophobicContact CB-CG1 4.27Å; I228-V315 HydrophobicContact CD1-CG1 3.75Å; I275-V315 HydrophobicContact CG2-CG2 4.05Å; I301-V315 HydrophobicContact CD1-CG1 3.61Å; I301-V315 HydrophobicContact CG2-CG1 4.35Å; I301-V315 HydrophobicContact CG2-CG2 3.85Å; Y303-V315 HydrophobicContact CD1-CG2 3.86Å; Y303-V315 HydrophobicContact CE1-CG2 4.21Å; Y303-V315 HydrophobicContact CG-CG2 4.03Å; V315-V320 HydrophobicContact CG1-CG2 3.91Å
316	T	67	Low	62.3	Low	53 Å²	53	79.2 Å²	79.2	33%	0.325	43%	0.433	S	S	.	.			trans	-99.3	159.3	178.8	62.4	0	0	0	0	111.7	V314 D318 T319 V320	V314-T316 HydrophobicContact CB-CG2 4.12Å; V314-T316 HydrophobicContact CG1-CG2 3.98Å; V314-T316 PolarHBondContact O-N 2.79Å; T316-D318 PolarHBondContact O-N 2.75Å; T316-T319 WeakPolarHBondContact O-CB 3.28Å; T316-T319 PolarHBondContact O-N 2.65Å; T316-T319 PolarHBondContact OG1-N 3.01Å; T316-T319 VanDerWaalsContact OG1-N 3.16Å; T316-T319 PolarHBondContact OG1-OG1 3.29Å; T316-V320 PolarHBondContact O-N 3.18Å
317	E	71.7	Confident	64.3	Low	80 Å²	80	77 Å²	77	37%	0.374	42%	0.416	S	S	.	.	H	α-helix	trans	-48.8	-43.6	169.4	-65.2	-178.7	172.3	0	0	111.6	V320 R321 I349 E350 T351	E317-V320 PolarHBondContact O-N 3.42Å; E317-R321 WeakPolarHBondContact O-CB 3.25Å; E317-R321 PolarHBondContact O-N 2.93Å; E317-I349 HydrophobicContact CB-CG2 4.45Å; E317-E350 WeakPolarHBondContact OE1-CA 3.29Å; E317-T351 WeakPolarHBondContact CG-OG1 3.36Å; E317-T351 PolarHBondContact OE1-N 2.79Å
318	D	75.4	Confident	66.8	Low	104 Å²	104	74 Å²	74	56%	0.556	39%	0.394	S	S	*	.	H	α-helix	trans	-64.8	-39.3	178.1	-73.9	-27.4	0	0	0	112.5	T316 R321 N322	T316-D318 PolarHBondContact O-N 2.75Å; D318-R321 PolarHBondContact O-N 3.23Å; D318-N322 VanDerWaalsContact O-CB 3.31Å; D318-N322 WeakPolarHBondContact O-CB 3.32Å; D318-N322 PolarHBondContact O-N 3.34Å; D318-N322 PolarHBondContact O-ND2 2.9Å; D318-N322 VanDerWaalsContact O-ND2 3.09Å
319	T	76.6	Confident	69.2	Low	40 Å²	40	68.2 Å²	68.2	25%	0.245	38%	0.377	C	S	.	.	H	α-helix	trans	-64.1	-46.1	179.1	-55	0	0	0	0	110.1	I275 T316 A323	I275-T319 HydrophobicContact CD1-CG2 3.59Å; I275-T319 HydrophobicContact CG1-CG2 3.8Å; T316-T319 WeakPolarHBondContact O-CB 3.28Å; T316-T319 PolarHBondContact O-N 2.65Å; T316-T319 PolarHBondContact OG1-N 3.01Å; T316-T319 VanDerWaalsContact OG1-N 3.16Å; T316-T319 PolarHBondContact OG1-OG1 3.29Å; T319-A323 WeakPolarHBondContact O-CB 3.15Å; T319-A323 PolarHBondContact O-N 2.9Å
320	V	80.7	Confident	71.8	Confident	0 Å²	0	67 Å²	67	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-69.9	-38.2	177.4	172.9	0	0	0	0	112	I228 I270 L299 I301 V315 T316 E317 A323 V324 I349	I228-V320 HydrophobicContact CD1-CB 4.09Å; I228-V320 HydrophobicContact CD1-CG1 4.45Å; I228-V320 HydrophobicContact CD1-CG2 3.34Å; I228-V320 HydrophobicContact CG2-CG1 4.16Å; I270-V320 HydrophobicContact CD1-CB 4.13Å; I270-V320 HydrophobicContact CD1-CG1 3.86Å; I270-V320 HydrophobicContact CD1-CG2 3.67Å; L299-V320 HydrophobicContact CD1-CG1 4.2Å; I301-V320 HydrophobicContact CD1-CG2 4.14Å; V315-V320 HydrophobicContact CG1-CG2 3.91Å; T316-V320 PolarHBondContact O-N 3.18Å; E317-V320 PolarHBondContact O-N 3.42Å; V320-A323 WeakPolarHBondContact O-CB 3.43Å; V320-A323 PolarHBondContact O-N 3.17Å; V320-V324 HydrophobicContact CG1-CG2 4.19Å; V320-V324 WeakPolarHBondContact O-CB 3.39Å; V320-V324 VanDerWaalsContact O-CG2 3.27Å; V320-V324 WeakPolarHBondContact O-CG2 3.38Å; V320-V324 PolarHBondContact O-N 2.98Å; V320-I349 HydrophobicContact CB-CG2 4.28Å; V320-I349 HydrophobicContact CG1-CD1 4.41Å; V320-I349 HydrophobicContact CG1-CG2 4.07Å
321	R	85	Confident	74.3	Confident	82 Å²	82	57 Å²	57	31%	0.309	32%	0.324	S	S	.	.	H	α-helix	trans	-60.7	-46.8	174.8	-178.5	-177.2	-65.3	-84.9	-0.5	112.2	E317 D318 V324 V325 L347 I349	E317-R321 WeakPolarHBondContact O-CB 3.25Å; E317-R321 PolarHBondContact O-N 2.93Å; D318-R321 PolarHBondContact O-N 3.23Å; R321-V324 PolarHBondContact O-N 3.48Å; R321-V325 HydrophobicContact CG-CG2 4.37Å; R321-V325 VanDerWaalsContact O-CB 3.31Å; R321-V325 WeakPolarHBondContact O-CB 3.2Å; R321-V325 WeakPolarHBondContact O-CG2 3.34Å; R321-V325 PolarHBondContact O-N 2.95Å; R321-L347 PolarHBondContact NH1-O 2.62Å; R321-I349 HydrophobicContact CB-CD1 3.68Å; R321-I349 HydrophobicContact CG-CD1 4.11Å
322	N	84.2	Confident	76.8	Confident	101 Å²	101	54.7 Å²	54.7	54%	0.54	31%	0.305	S	S	.	.	H	α-helix	trans	-63.2	-45.4	177.9	-69.1	-25.6	0	0	0	110.9	D318 V324 V325 E326	D318-N322 VanDerWaalsContact O-CB 3.31Å; D318-N322 WeakPolarHBondContact O-CB 3.32Å; D318-N322 PolarHBondContact O-N 3.34Å; D318-N322 PolarHBondContact O-ND2 2.9Å; D318-N322 VanDerWaalsContact O-ND2 3.09Å; N322-V324 PolarHBondContact O-N 3.47Å; N322-V325 PolarHBondContact O-N 3.13Å; N322-E326 VanDerWaalsContact O-CB 3.27Å; N322-E326 WeakPolarHBondContact O-CB 3.37Å; N322-E326 PolarHBondContact O-N 3.38Å
323	A	85.1	Confident	79.2	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.008	30%	0.304	C	S	.	.	H	α-helix	trans	-55.2	-50.7	176.1	0	0	0	0	0	112.7	S269 I270 T273 T319 V320 Y327	S269-A323 WeakPolarHBondContact O-CB 3.22Å; I270-A323 HydrophobicContact CD1-CB 4.26Å; T273-A323 HydrophobicContact CG2-CB 4.31Å; T273-A323 WeakPolarHBondContact OG1-CB 3.36Å; T319-A323 WeakPolarHBondContact O-CB 3.15Å; T319-A323 PolarHBondContact O-N 2.9Å; V320-A323 WeakPolarHBondContact O-CB 3.43Å; V320-A323 PolarHBondContact O-N 3.17Å; A323-Y327 PolarHBondContact O-N 3.46Å; A323-Y327 VanDerWaalsContact O-N 3.13Å
324	V	87.2	Confident	81.1	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-67.1	-43.8	-179.1	172.4	0	0	0	0	111.2	L265 L266 V320 R321 N322 Y327 I328 L347 I349	L265-V324 HydrophobicContact CD2-CG1 4.34Å; L266-V324 HydrophobicContact CD2-CG1 4.33Å; L266-V324 HydrophobicContact CD2-CG2 3.7Å; V320-V324 HydrophobicContact CG1-CG2 4.19Å; V320-V324 WeakPolarHBondContact O-CB 3.39Å; V320-V324 VanDerWaalsContact O-CG2 3.27Å; V320-V324 WeakPolarHBondContact O-CG2 3.38Å; V320-V324 PolarHBondContact O-N 2.98Å; R321-V324 PolarHBondContact O-N 3.48Å; N322-V324 PolarHBondContact O-N 3.47Å; V324-Y327 PolarHBondContact O-N 2.73Å; V324-I328 HydrophobicContact CG1-CD1 3.57Å; V324-I328 HydrophobicContact CG1-CG1 4.38Å; V324-I328 WeakPolarHBondContact O-CB 3.46Å; V324-I328 WeakPolarHBondContact O-CD1 3.39Å; V324-I328 WeakPolarHBondContact O-CG1 3.49Å; V324-I328 PolarHBondContact O-N 2.76Å; V324-L347 HydrophobicContact CG1-CD2 4.03Å; V324-I349 HydrophobicContact CB-CD1 4.4Å
325	V	87.5	Confident	82.4	Confident	59 Å²	59	56.2 Å²	56.2	36%	0.358	32%	0.321	S	S	.	.	H	α-helix	trans	-65.8	-40	179.5	171.1	0	0	0	0	111.7	R321 N322 I328 A329 T343 L347	R321-V325 HydrophobicContact CG-CG2 4.37Å; R321-V325 VanDerWaalsContact O-CB 3.31Å; R321-V325 WeakPolarHBondContact O-CB 3.2Å; R321-V325 WeakPolarHBondContact O-CG2 3.34Å; R321-V325 PolarHBondContact O-N 2.95Å; N322-V325 PolarHBondContact O-N 3.13Å; V325-I328 PolarHBondContact O-N 3.32Å; V325-A329 WeakPolarHBondContact O-CB 3.48Å; V325-A329 PolarHBondContact O-N 3.06Å; V325-T343 HydrophobicContact CG2-CG2 4.41Å; V325-L347 HydrophobicContact CG2-CD2 3.77Å
326	E	86.5	Confident	83.4	Confident	140 Å²	140	57.4 Å²	57.4	65%	0.654	33%	0.33	S	S	*	.	H	α-helix	trans	-63.5	-46.1	177.7	-174.6	169.6	-169	0	0	111.3	N322 A329 E330	N322-E326 VanDerWaalsContact O-CB 3.27Å; N322-E326 WeakPolarHBondContact O-CB 3.37Å; N322-E326 PolarHBondContact O-N 3.38Å; E326-A329 WeakPolarHBondContact O-CB 3.49Å; E326-A329 PolarHBondContact O-N 3.17Å; E326-E330 PolarHBondContact O-N 2.98Å; E326-E330 VanDerWaalsContact O-N 3.14Å
327	Y	88.6	Confident	84.2	Confident	38 Å²	38	60.3 Å²	60.3	15%	0.149	34%	0.343	C	S	.	.	H	α-helix	trans	-67.3	-38.1	177.8	-168.9	-111.2	0	0	0	112.6	L265 H268 S269 A323 V324 A329 E330 I331	L265-Y327 HydrophobicContact CG-CD1 4.04Å; L265-Y327 HydrophobicContact CG-CE1 4.24Å; H268-Y327 HydrophobicContact CB-CD1 4.42Å; H268-Y327 HydrophobicContact CB-CE1 3.78Å; H268-Y327 HydrophobicContact CB-CE2 3.96Å; S269-Y327 WeakPolarHBondContact OG-CB 3.2Å; S269-Y327 WeakPolarHBondContact OG-CD1 3.47Å; A323-Y327 PolarHBondContact O-N 3.46Å; A323-Y327 VanDerWaalsContact O-N 3.13Å; V324-Y327 PolarHBondContact O-N 2.73Å; Y327-A329 VanDerWaalsContact C-N 3.29Å; Y327-A329 PolarHBondContact O-N 2.78Å; Y327-E330 WeakPolarHBondContact O-CB 3.48Å; Y327-E330 PolarHBondContact O-N 3.35Å; Y327-E330 VanDerWaalsContact O-N 3.14Å; Y327-I331 HydrophobicContact CD1-CD1 3.9Å; Y327-I331 HydrophobicContact CD1-CG1 4.4Å; Y327-I331 HydrophobicContact CE1-CD1 3.71Å; Y327-I331 HydrophobicContact CE1-CG1 4.17Å; Y327-I331 WeakPolarHBondContact O-CG1 3.38Å; Y327-I331 PolarHBondContact O-N 3.2Å
328	I	88	Confident	84.9	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-61.3	-40.1	172.6	-68.6	162.8	0	0	0	110.9	L265 V324 V325 E330 I331 V332 Y340 F341 T343	L265-I328 HydrophobicContact CD1-CG1 4.27Å; V324-I328 HydrophobicContact CG1-CD1 3.57Å; V324-I328 HydrophobicContact CG1-CG1 4.38Å; V324-I328 WeakPolarHBondContact O-CB 3.46Å; V324-I328 WeakPolarHBondContact O-CD1 3.39Å; V324-I328 WeakPolarHBondContact O-CG1 3.49Å; V324-I328 PolarHBondContact O-N 2.76Å; V325-I328 PolarHBondContact O-N 3.32Å; I328-E330 VanDerWaalsContact C-N 3.25Å; I328-E330 PolarHBondContact O-N 3.47Å; I328-I331 PolarHBondContact O-N 2.78Å; I328-V332 HydrophobicContact CG2-CG2 4.23Å; I328-V332 VanDerWaalsContact O-CG2 3.29Å; I328-V332 WeakPolarHBondContact O-CG2 3.47Å; I328-V332 PolarHBondContact O-N 3.01Å; I328-Y340 HydrophobicContact CG2-CD2 3.59Å; I328-Y340 HydrophobicContact CG2-CE2 4.12Å; I328-Y340 HydrophobicContact CG2-CG 4.3Å; I328-F341 HydrophobicContact CD1-CB 4.05Å; I328-F341 WeakPolarHBondContact CD1-O 3.44Å; I328-T343 HydrophobicContact CB-CG2 4.38Å; I328-T343 HydrophobicContact CD1-CG2 4.04Å; I328-T343 HydrophobicContact CG2-CG2 3.9Å
329	A	86.7	Confident	85.6	Confident	58 Å²	58	55.5 Å²	55.5	48%	0.479	32%	0.317	S	S	.	.	H	α-helix	trans	-61.6	-35.6	176.5	0	0	0	0	0	111.8	V325 E326 Y327 A333	V325-A329 WeakPolarHBondContact O-CB 3.48Å; V325-A329 PolarHBondContact O-N 3.06Å; E326-A329 WeakPolarHBondContact O-CB 3.49Å; E326-A329 PolarHBondContact O-N 3.17Å; Y327-A329 VanDerWaalsContact C-N 3.29Å; Y327-A329 PolarHBondContact O-N 2.78Å; A329-A333 VanDerWaalsContact O-CB 3.23Å; A329-A333 WeakPolarHBondContact O-CB 3.3Å; A329-A333 PolarHBondContact O-N 3.38Å
330	E	87	Confident	86.2	Confident	104 Å²	104	54 Å²	54	49%	0.486	31%	0.307	S	S	.	.	H	α-helix	trans	-66.1	-47.5	173.1	-175.5	177.3	-174.7	0	0	112.3	E326 Y327 I328 V332 A333 N334	E326-E330 PolarHBondContact O-N 2.98Å; E326-E330 VanDerWaalsContact O-N 3.14Å; Y327-E330 WeakPolarHBondContact O-CB 3.48Å; Y327-E330 PolarHBondContact O-N 3.35Å; Y327-E330 VanDerWaalsContact O-N 3.14Å; I328-E330 VanDerWaalsContact C-N 3.25Å; I328-E330 PolarHBondContact O-N 3.47Å; E330-V332 VanDerWaalsContact C-N 3.28Å; E330-V332 PolarHBondContact O-N 3.17Å; E330-A333 PolarHBondContact O-N 3.04Å; E330-N334 WeakPolarHBondContact O-CB 3.4Å; E330-N334 VanDerWaalsContact O-CG 3.31Å; E330-N334 PolarHBondContact O-N 3.01Å; E330-N334 PolarHBondContact O-ND2 3.34Å
331	I	86.1	Confident	86.5	Confident	6 Å²	6	54 Å²	54	3%	0.031	31%	0.307	C	S	.	.	H	α-helix	trans	-55.2	-46.4	175.5	-67.1	174	0	0	0	110.5	L265 Y327 I328 N334 G335 S336 Q338 Y340	L265-I331 HydrophobicContact CD1-CD1 3.69Å; L265-I331 HydrophobicContact CG-CD1 4.18Å; Y327-I331 HydrophobicContact CD1-CD1 3.9Å; Y327-I331 HydrophobicContact CD1-CG1 4.4Å; Y327-I331 HydrophobicContact CE1-CD1 3.71Å; Y327-I331 HydrophobicContact CE1-CG1 4.17Å; Y327-I331 WeakPolarHBondContact O-CG1 3.38Å; Y327-I331 PolarHBondContact O-N 3.2Å; I328-I331 PolarHBondContact O-N 2.78Å; I331-N334 PolarHBondContact O-N 3.43Å; I331-G335 PolarHBondContact O-N 3.07Å; I331-S336 PolarHBondContact O-N 3.17Å; I331-S336 VanDerWaalsContact O-N 3.17Å; I331-Q338 HydrophobicContact CG2-CB 4.45Å; I331-Y340 HydrophobicContact CG2-CD1 3.76Å; I331-Y340 HydrophobicContact CG2-CE1 4.27Å; I331-Y340 HydrophobicContact CG2-CG 4.36Å
332	V	85.9	Confident	86.4	Confident	55 Å²	55	50.2 Å²	50.2	33%	0.333	29%	0.294	S	S	.	.	H	α-helix	trans	-67.5	-42.4	-179.9	174	0	0	0	0	111.5	I328 E330 N334 G335 Y340	I328-V332 HydrophobicContact CG2-CG2 4.23Å; I328-V332 VanDerWaalsContact O-CG2 3.29Å; I328-V332 WeakPolarHBondContact O-CG2 3.47Å; I328-V332 PolarHBondContact O-N 3.01Å; E330-V332 VanDerWaalsContact C-N 3.28Å; E330-V332 PolarHBondContact O-N 3.17Å; V332-N334 VanDerWaalsContact C-N 3.31Å; V332-N334 PolarHBondContact O-N 3.22Å; V332-G335 PolarHBondContact O-N 3.28Å; V332-Y340 HydrophobicContact CG2-CE1 4.36Å; V332-Y340 HydrophobicContact CG2-CE2 3.8Å
333	A	86.5	Confident	86.2	Confident	83 Å²	83	49.1 Å²	49.1	69%	0.686	29%	0.291	S	S	*	.	H	α-helix	trans	-65.2	-35.3	178.3	0	0	0	0	0	112.5	A329 E330 G335	A329-A333 VanDerWaalsContact O-CB 3.23Å; A329-A333 WeakPolarHBondContact O-CB 3.3Å; A329-A333 PolarHBondContact O-N 3.38Å; E330-A333 PolarHBondContact O-N 3.04Å; A333-G335 VanDerWaalsContact C-N 3.26Å; A333-G335 PolarHBondContact O-N 3.36Å
334	N	87.6	Confident	85.6	Confident	116 Å²	116	54.9 Å²	54.9	62%	0.62	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-7.7	178.4	-70.9	-23.7	0	0	0	113.4	E330 I331 V332 S336	E330-N334 WeakPolarHBondContact O-CB 3.4Å; E330-N334 VanDerWaalsContact O-CG 3.31Å; E330-N334 PolarHBondContact O-N 3.01Å; E330-N334 PolarHBondContact O-ND2 3.34Å; I331-N334 PolarHBondContact O-N 3.43Å; V332-N334 VanDerWaalsContact C-N 3.31Å; V332-N334 PolarHBondContact O-N 3.22Å; N334-S336 PolarHBondContact O-N 3.04Å
335	G	83.3	Confident	84.3	Confident	53 Å²	53	57.3 Å²	57.3	55%	0.546	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	30.5	-176.8	0	0	0	0	0	112.8	I331 V332 A333	I331-G335 PolarHBondContact O-N 3.07Å; V332-G335 PolarHBondContact O-N 3.28Å; A333-G335 VanDerWaalsContact C-N 3.26Å; A333-G335 PolarHBondContact O-N 3.36Å
336	S	84.6	Confident	83.3	Confident	31 Å²	31	56.8 Å²	56.8	22%	0.217	36%	0.355	C	S	.	.			trans	-67.3	145.4	-178.7	-176.9	0	0	0	0	111.5	L237 I331 N334 Q338	L237-S336 WeakPolarHBondContact CD2-O 3.47Å; I331-S336 PolarHBondContact O-N 3.17Å; I331-S336 VanDerWaalsContact O-N 3.17Å; N334-S336 PolarHBondContact O-N 3.04Å; S336-Q338 VanDerWaalsContact C-N 3.28Å; S336-Q338 WeakPolarHBondContact OG-CG 3.27Å; S336-Q338 PolarHBondContact OG-N 3.08Å
337	D	84.8	Confident	83	Confident	113 Å²	113	50.7 Å²	50.7	60%	0.604	33%	0.327	S	S	*	.			trans	-87.8	7.1	175.7	65.4	-21.3	0	0	0	113.4	R236	R236-D337 WeakPolarHBondContact CD-O 3.16Å; R236-D337 VanDerWaalsContact CG-O 3.3Å; R236-D337 WeakPolarHBondContact CG-O 3.42Å; R236-D337 PolarHBondContact NE-O 3.28Å; R236-D337 VanDerWaalsContact NE-O 3.09Å
338	Q	86.3	Confident	82.6	Confident	82 Å²	82	51.3 Å²	51.3	38%	0.383	34%	0.335	S	S	.	.			trans	-62.2	149.9	173.1	-72.4	178.9	-10.9	0	0	112.1	I331 S336 Y340	I331-Q338 HydrophobicContact CG2-CB 4.45Å; S336-Q338 VanDerWaalsContact C-N 3.28Å; S336-Q338 WeakPolarHBondContact OG-CG 3.27Å; S336-Q338 PolarHBondContact OG-N 3.08Å; Q338-Y340 WeakPolarHBondContact O-CD1 3.4Å
339	I	88.8	Confident	81.9	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	134.7	169.9	-60.7	171.1	0	0	0	109.2	L234 T235 R236 L241 Y258 Q261	L234-I339 HydrophobicContact CB-CG2 3.85Å; L234-I339 HydrophobicContact CD1-CG2 4.08Å; L234-I339 HydrophobicContact CD2-CG2 4.04Å; L234-I339 HydrophobicContact CG-CG2 4.2Å; T235-I339 WeakPolarHBondContact O-CA 3.36Å; R236-I339 VanDerWaalsContact NH2-CD1 3.3Å; L241-I339 HydrophobicContact CD1-CD1 3.92Å; L241-I339 HydrophobicContact CD1-CG1 3.94Å; L241-I339 HydrophobicContact CD1-CG2 3.88Å; Y258-I339 HydrophobicContact CD1-CD1 3.27Å; Y258-I339 HydrophobicContact CD2-CD1 3.96Å; Y258-I339 HydrophobicContact CE1-CD1 3.41Å; Y258-I339 VanDerWaalsContact CE1-CD1 3.41Å; Y258-I339 HydrophobicContact CE2-CD1 4.09Å; Y258-I339 HydrophobicContact CG-CD1 3.56Å; Q261-I339 HydrophobicContact CB-CB 4.32Å; Q261-I339 VanDerWaalsContact OE1-N 3.08Å
340	Y	89.7	Confident	81.1	Confident	8 Å²	8	51.2 Å²	51.2	3%	0.031	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	162.6	174.9	59.4	-87.3	0	0	0	112.7	T235 N238 L265 I328 I331 V332 Q338	T235-Y340 HydrophobicContact CG2-CE1 4.38Å; T235-Y340 HydrophobicContact CG2-CE2 3.87Å; T235-Y340 WeakPolarHBondContact CG2-OH 3.34Å; T235-Y340 PolarHBondContact N-O 3.4Å; T235-Y340 WeakPolarHBondContact O-CD1 3.19Å; T235-Y340 PolarHBondContact O-N 2.73Å; N238-Y340 VanDerWaalsContact CA-OH 3.25Å; N238-Y340 WeakPolarHBondContact CA-OH 2.77Å; N238-Y340 PolarHBondContact N-OH 2.79Å; N238-Y340 PolarHBondContact OD1-OH 3.38Å; L265-Y340 VanDerWaalsContact CD1-CA 3.49Å; I328-Y340 HydrophobicContact CG2-CD2 3.59Å; I328-Y340 HydrophobicContact CG2-CE2 4.12Å; I328-Y340 HydrophobicContact CG2-CG 4.3Å; I331-Y340 HydrophobicContact CG2-CD1 3.76Å; I331-Y340 HydrophobicContact CG2-CE1 4.27Å; I331-Y340 HydrophobicContact CG2-CG 4.36Å; V332-Y340 HydrophobicContact CG2-CE1 4.36Å; V332-Y340 HydrophobicContact CG2-CE2 3.8Å; Q338-Y340 WeakPolarHBondContact O-CD1 3.4Å
341	F	87.2	Confident	79.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	128.5	174.4	-64.6	-76.4	0	0	0	110.8	V230 L234 I262 L265 L266 A297 I328 T343 L347	V230-F341 HydrophobicContact CB-CZ 4.46Å; V230-F341 HydrophobicContact CG1-CD2 4.25Å; V230-F341 HydrophobicContact CG1-CE1 4.28Å; V230-F341 HydrophobicContact CG1-CE2 3.95Å; V230-F341 HydrophobicContact CG1-CZ 3.94Å; L234-F341 HydrophobicContact CD2-CD1 3.93Å; L234-F341 HydrophobicContact CD2-CE1 4.01Å; I262-F341 HydrophobicContact CG2-CE2 3.89Å; I262-F341 HydrophobicContact CG2-CZ 3.51Å; L265-F341 HydrophobicContact CD2-CD2 3.92Å; L265-F341 HydrophobicContact CD2-CE2 4.14Å; L266-F341 HydrophobicContact CD1-CE2 4.03Å; L266-F341 HydrophobicContact CD1-CZ 4.25Å; L266-F341 HydrophobicContact CD2-CD2 4.33Å; L266-F341 HydrophobicContact CD2-CE2 3.69Å; L266-F341 HydrophobicContact CG-CE2 3.86Å; A297-F341 HydrophobicContact CB-CZ 4.39Å; I328-F341 HydrophobicContact CD1-CB 4.05Å; I328-F341 WeakPolarHBondContact CD1-O 3.44Å; F341-T343 PolarHBondContact O-N 3.33Å; F341-L347 HydrophobicContact CB-CD1 3.9Å; F341-L347 HydrophobicContact CG-CD1 4.15Å
342	G	83.5	Confident	77.7	Confident	3 Å²	3	49.7 Å²	49.7	3%	0.031	32%	0.322	C	S	.	.			trans	-66.8	118.1	175	0	0	0	0	0	110.8	S232 T233 S344 S345	S232-G342 PolarHBondContact OG-O 2.83Å; T233-G342 PolarHBondContact O-N 3.37Å; G342-S344 VanDerWaalsContact C-N 3.34Å; G342-S345 VanDerWaalsContact C-OG 3.27Å; G342-S345 VanDerWaalsContact CA-OG 3.27Å; G342-S345 WeakPolarHBondContact CA-OG 3.46Å; G342-S345 PolarHBondContact O-N 3.45Å; G342-S345 PolarHBondContact O-OG 3.38Å
343	T	79.1	Confident	75.8	Confident	78 Å²	78	48.8 Å²	48.8	48%	0.479	32%	0.315	S	S	.	.	S	Bend	trans	-74.7	-26.4	179.8	53	0	0	0	0	112.6	V325 I328 F341	V325-T343 HydrophobicContact CG2-CG2 4.41Å; I328-T343 HydrophobicContact CB-CG2 4.38Å; I328-T343 HydrophobicContact CD1-CG2 4.04Å; I328-T343 HydrophobicContact CG2-CG2 3.9Å; F341-T343 PolarHBondContact O-N 3.33Å
344	S	72.1	Confident	73.9	Confident	123 Å²	123	48.3 Å²	48.3	86%	0.86	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-16.1	176.1	53.8	0	0	0	0	114	G342	G342-S344 VanDerWaalsContact C-N 3.34Å
345	S	60.8	Low	71.4	Confident	50 Å²	50	44.7 Å²	44.7	35%	0.35	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	21.2	-173.8	41	0	0	0	0	113.5	S232 G342	S232-S345 PolarHBondContact OG-OG 2.74Å; G342-S345 VanDerWaalsContact C-OG 3.27Å; G342-S345 VanDerWaalsContact CA-OG 3.27Å; G342-S345 WeakPolarHBondContact CA-OG 3.46Å; G342-S345 PolarHBondContact O-N 3.45Å; G342-S345 PolarHBondContact O-OG 3.38Å
346	G	66.8	Low	69	Low	48 Å²	48	45 Å²	45	50%	0.495	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	65.9	178.9	0	0	0	0	0	112.2	T348	G346-T348 PolarHBondContact O-N 3.09Å; G346-T348 VanDerWaalsContact O-N 3.07Å
347	L	80.5	Confident	66.6	Low	13 Å²	13	47.2 Å²	47.2	7%	0.068	30%	0.297	C	S	.	.			trans	-58.4	112.5	167.5	176.8	64.4	0	0	0	109.2	V230 R321 V324 V325 F341 I349	V230-L347 HydrophobicContact CG1-CD1 3.75Å; R321-L347 PolarHBondContact NH1-O 2.62Å; V324-L347 HydrophobicContact CG1-CD2 4.03Å; V325-L347 HydrophobicContact CG2-CD2 3.77Å; F341-L347 HydrophobicContact CB-CD1 3.9Å; F341-L347 HydrophobicContact CG-CD1 4.15Å; L347-I349 HydrophobicContact CD1-CD1 4.38Å; L347-I349 HydrophobicContact CD1-CG1 4.34Å; L347-I349 HydrophobicContact CD2-CD1 3.94Å; L347-I349 HydrophobicContact CG-CD1 4.04Å; L347-I349 HydrophobicContact CG-CG1 4.19Å
348	T	79	Confident	64	Low	51 Å²	51	46.2 Å²	46.2	31%	0.313	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	132.2	175.5	60.1	0	0	0	0	108.8	V230 S231 G346	V230-T348 WeakPolarHBondContact CA-O 3.33Å; S231-T348 PolarHBondContact N-O 3.29Å; S231-T348 PolarHBondContact N-OG1 3.29Å; S231-T348 PolarHBondContact O-N 3.08Å; S231-T348 PolarHBondContact O-OG1 2.88Å; S231-T348 PolarHBondContact OG-OG1 3.36Å; G346-T348 PolarHBondContact O-N 3.09Å; G346-T348 VanDerWaalsContact O-N 3.07Å
349	I	74.9	Confident	61.4	Low	1 Å²	1	51.7 Å²	51.7	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	117.3	178.2	-68.3	174.3	0	0	0	104.9	I228 T229 V230 E317 V320 R321 V324 L347	I228-I349 HydrophobicContact CG2-CG2 3.66Å; T229-I349 VanDerWaalsContact O-CA 3.28Å; T229-I349 WeakPolarHBondContact O-CA 3.44Å; V230-I349 HydrophobicContact CG1-CG1 4.06Å; V230-I349 HydrophobicContact CG2-CG1 4.22Å; E317-I349 HydrophobicContact CB-CG2 4.45Å; V320-I349 HydrophobicContact CB-CG2 4.28Å; V320-I349 HydrophobicContact CG1-CD1 4.41Å; V320-I349 HydrophobicContact CG1-CG2 4.07Å; R321-I349 HydrophobicContact CB-CD1 3.68Å; R321-I349 HydrophobicContact CG-CD1 4.11Å; V324-I349 HydrophobicContact CB-CD1 4.4Å; L347-I349 HydrophobicContact CD1-CD1 4.38Å; L347-I349 HydrophobicContact CD1-CG1 4.34Å; L347-I349 HydrophobicContact CD2-CD1 3.94Å; L347-I349 HydrophobicContact CG-CD1 4.04Å; L347-I349 HydrophobicContact CG-CG1 4.19Å
350	E	67.9	Low	58.4	Low	56 Å²	56	59.7 Å²	59.7	26%	0.262	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	132	-175.8	-59.2	-173.2	166.3	0	0	109.7	I228 T229 E317 Y429	I228-E350 CarbonylContact C-O 3.56Å; I228-E350 VanDerWaalsContact CA-O 3.3Å; I228-E350 WeakPolarHBondContact CA-O 3.28Å; T229-E350 PolarHBondContact N-O 3.37Å; T229-E350 PolarHBondContact O-N 3.42Å; T229-E350 PolarHBondContact OG1-O 3.44Å; E317-E350 WeakPolarHBondContact OE1-CA 3.29Å; E350-Y429 PolarHBondContact OE1-OH 2.67Å
351	T	60.1	Low	55.6	Low	49 Å²	49	67.3 Å²	67.3	30%	0.301	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	125.7	176.6	-60.3	0	0	0	0	109.6	I227 I228 E317	I227-T351 CarbonylContact O-C 3.57Å; I227-T351 WeakPolarHBondContact O-CA 3.44Å; I228-T351 HydrophobicContact CG1-CG2 4.34Å; E317-T351 WeakPolarHBondContact CG-OG1 3.36Å; E317-T351 PolarHBondContact OE1-N 2.79Å
352	V	41.8	Very low	52.7	Low	30 Å²	30	73.7 Å²	73.7	18%	0.182	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-34.8	-171.9	-170.1	0	0	0	0	112.6	I227 T229 I434	I227-V352 HydrophobicContact CB-CB 4.23Å; I227-V352 HydrophobicContact CG2-CB 4.17Å; I227-V352 HydrophobicContact CG2-CG2 4.43Å; I227-V352 PolarHBondContact O-N 3.45Å; T229-V352 HydrophobicContact CG2-CG2 3.83Å; V352-I434 HydrophobicContact CG1-CD1 4.41Å; V352-I434 HydrophobicContact CG1-CG1 4.23Å
353	I	45.8	Very low	50.2	Low	36 Å²	36	82.8 Å²	82.8	19%	0.185	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	140	-176	-58.4	-174.2	0	0	0	110.6	A226 I227 A355	A226-I353 VanDerWaalsContact CA-O 3.24Å; A226-I353 WeakPolarHBondContact CA-O 3.39Å; I227-I353 HydrophobicContact CB-CB 4.44Å; I227-I353 HydrophobicContact CD1-CB 4.26Å; I227-I353 HydrophobicContact CD1-CD1 3.91Å; I227-I353 HydrophobicContact CD1-CG1 4.26Å; I227-I353 HydrophobicContact CG1-CB 4.29Å; I227-I353 PolarHBondContact N-O 3.11Å; I227-I353 VanDerWaalsContact N-O 3.13Å; I353-A355 HydrophobicContact CG2-CB 3.83Å
354	D	47.3	Very low	47.8	Very low	72 Å²	72	84.4 Å²	84.4	39%	0.385	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	95.2	160.1	178.9	27.5	0	0	0	108.4	K224 T225 Y303	K224-D354 IonicContact NZ-OD1 3.95Å; K224-D354 IonicContact NZ-OD2 2.63Å; K224-D354 PolarHBondContact NZ-OD2 2.95Å; T225-D354 WeakPolarHBondContact O-CA 3.5Å; Y303-D354 PolarHBondContact OH-OD1 2.86Å; Y303-D354 PolarHBondContact OH-OD2 3.2Å
355	A	34.7	Very low	46	Very low	40 Å²	40	87.8 Å²	87.8	33%	0.331	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.5	-176.9	0	0	0	0	0	110.9	K224 T225 I353	K224-A355 CarbonylContact C-O 3.45Å; K224-A355 VanDerWaalsContact CA-O 3.22Å; K224-A355 WeakPolarHBondContact CA-O 3.38Å; T225-A355 PolarHBondContact N-O 3.24Å; T225-A355 PolarHBondContact O-N 3.32Å; I353-A355 HydrophobicContact CG2-CB 3.83Å
356	A	34.5	Very low	44.5	Very low	59 Å²	59	93.2 Å²	93.2	49%	0.488	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	123.8	170.6	0	0	0	0	0	110.2	T223 K224	T223-A356 CarbonylContact O-C 3.56Å; T223-A356 WeakPolarHBondContact O-CA 3.31Å; K224-A356 HydrophobicContact CG-CB 4.14Å
357	T	33.5	Very low	42.9	Very low	78 Å²	78	97.8 Å²	97.8	48%	0.479	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	118.4	169	33	0	0	0	0	109.1	T223	T223-T357 PolarHBondContact O-N 3.3Å; T223-T357 PolarHBondContact O-OG1 3.39Å
358	T	29.7	Very low	40.5	Very low	93 Å²	93	105.3 Å²	105.3	57%	0.571	58%	0.576	S	S	*	*			trans	-99.1	111.7	175.6	-47.9	0	0	0	0	109.2	L222 M360	L222-T358 HydrophobicContact CD2-CG2 4.46Å; T358-M360 HydrophobicContact CG2-CG 3.63Å; T358-M360 PolarHBondContact O-N 3.44Å
359	E	31.4	Very low	38.2	Very low	197 Å²	197	107.6 Å²	107.6	92%	0.921	60%	0.599	S	S	*	*			trans	-77.2	105.5	162.1	-78.5	-172	158	0	0	108.4
360	M	27.2	Very low	35.9	Very low	168 Å²	168	118.4 Å²	118.4	83%	0.828	64%	0.642	S	S	*	*			trans	-103.7	115	168.4	-73.3	-145.8	-69.1	0	0	110.7	T358	T358-M360 HydrophobicContact CG2-CG 3.63Å; T358-M360 PolarHBondContact O-N 3.44Å
361	I	30.1	Very low	34.1	Very low	168 Å²	168	124.8 Å²	124.8	86%	0.862	67%	0.669	S	S	*	*			trans	-63.4	126.6	162	-62.3	170.2	0	0	0	107.4	E363	I361-E363 PolarHBondContact O-N 3.43Å
362	T	26.4	Very low	32.4	Very low	135 Å²	135	129.8 Å²	129.8	83%	0.828	70%	0.699	S	S	*	*			trans	-60	120.9	-176.2	4.3	0	0	0	0	113
363	E	31.6	Very low	31.9	Very low	194 Å²	194	134.1 Å²	134.1	91%	0.907	73%	0.726	S	S	*	*			trans	-163.1	119.5	132.5	-126.7	171.8	175	0	0	110	I361	I361-E363 PolarHBondContact O-N 3.43Å
364	S	27.6	Very low	31.1	Very low	111 Å²	111	140.4 Å²	140.4	78%	0.776	76%	0.755	S	S	*	*			trans	-74.4	125	-175.7	52.1	0	0	0	0	112.2
365	Q	34.5	Very low	30.2	Very low	194 Å²	194	141.1 Å²	141.1	91%	0.907	76%	0.762	S	S	*	*			trans	-150.4	118.6	139.8	-73.5	-156	-32.9	0	0	109.3
366	D	29.3	Very low	30.3	Very low	164 Å²	164	141.3 Å²	141.3	88%	0.877	76%	0.761	S	S	*	*			trans	-57.5	131.9	177.5	-67.9	-51.7	0	0	0	112.7
367	T	33.4	Very low	30.7	Very low	145 Å²	145	141.1 Å²	141.1	89%	0.89	75%	0.751	S	S	*	*			trans	-158.8	132.4	137.4	-29.2	0	0	0	0	111.1
368	E	30.4	Very low	31.3	Very low	171 Å²	171	139.1 Å²	139.1	80%	0.799	74%	0.739	S	S	*	*			trans	-60	141.4	-171.7	-58.8	179.1	146.2	0	0	116.5
369	A	30.8	Very low	32.5	Very low	98 Å²	98	137.1 Å²	137.1	81%	0.81	72%	0.722	S	S	*	*			trans	-159.5	97.7	147.6	0	0	0	0	0	110.3	K371	A369-K371 PolarHBondContact O-N 2.91Å
370	Y	26.9	Very low	33.6	Very low	228 Å²	228	128 Å²	128	89%	0.894	68%	0.68	S	S	*	*			trans	-64.8	117.6	178	-81.9	-91.3	0	0	0	111.7
371	K	28.9	Very low	35	Very low	190 Å²	190	120 Å²	120	83%	0.826	64%	0.641	S	S	*	*			trans	-127.7	113.6	167.7	-146.8	178.7	-174.4	-176.3	0	107.7	A369 T373	A369-K371 PolarHBondContact O-N 2.91Å; K371-T373 PolarHBondContact O-N 3.46Å; K371-T373 PolarHBondContact O-OG1 2.89Å
372	T	25.6	Very low	36.3	Very low	154 Å²	154	112.6 Å²	112.6	95%	0.945	60%	0.603	S	S	*	*			trans	-59.2	120.1	-175.4	-2.6	0	0	0	0	110.6
373	T	30.3	Very low	38.1	Very low	121 Å²	121	106.2 Å²	106.2	74%	0.742	56%	0.563	S	S	*	*			trans	-111.9	122	176.5	-50.1	0	0	0	0	107.2	K371 V375	K371-T373 PolarHBondContact O-N 3.46Å; K371-T373 PolarHBondContact O-OG1 2.89Å; T373-V375 PolarHBondContact O-N 3.47Å
374	E	28.5	Very low	39.7	Very low	168 Å²	168	98 Å²	98	79%	0.785	53%	0.527	S	S	*	.			trans	-69.7	121.9	179.9	-68.9	-177.8	170.9	0	0	110
375	V	29.1	Very low	41.9	Very low	88 Å²	88	92.8 Å²	92.8	53%	0.533	49%	0.49	S	S	.	.			trans	-103.7	119	179.7	179	0	0	0	0	107.9	T373 L377	T373-V375 PolarHBondContact O-N 3.47Å; V375-L377 HydrophobicContact CG1-CD2 4.33Å; V375-L377 HydrophobicContact CG1-CG 4.41Å; V375-L377 PolarHBondContact O-N 2.93Å
376	S	37.5	Very low	43.8	Very low	44 Å²	44	85 Å²	85	31%	0.308	46%	0.457	S	S	.	.			trans	-72.1	115.2	171	58.7	0	0	0	0	109.2
377	L	42.7	Very low	46.3	Very low	54 Å²	54	77.4 Å²	77.4	28%	0.283	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	117.2	-177.4	-71	156.4	0	0	0	109	V375 K379 S460 A511	V375-L377 HydrophobicContact CG1-CD2 4.33Å; V375-L377 HydrophobicContact CG1-CG 4.41Å; V375-L377 PolarHBondContact O-N 2.93Å; L377-K379 PolarHBondContact O-N 3.45Å; L377-S460 PolarHBondContact N-O 2.98Å; L377-S460 VanDerWaalsContact N-O 3.14Å; L377-S460 PolarHBondContact O-N 3.28Å; L377-S460 PolarHBondContact O-OG 3.2Å; L377-A511 HydrophobicContact CB-CB 4.28Å; L377-A511 HydrophobicContact CD2-CB 4.02Å
378	T	45	Very low	48.7	Very low	37 Å²	37	71.6 Å²	71.6	23%	0.227	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	120.5	161.6	-59.2	0	0	0	0	107.5	I434 A511 T512	T378-I434 HydrophobicContact CG2-CD1 3.84Å; T378-A511 WeakPolarHBondContact O-CA 3.28Å; T378-T512 PolarHBondContact O-N 3.03Å; T378-T512 PolarHBondContact O-OG1 3.23Å; T378-T512 VanDerWaalsContact O-OG1 3.11Å
379	K	55.5	Low	51.4	Low	50 Å²	50	63.5 Å²	63.5	22%	0.217	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	146.1	173.2	-72.9	-171.8	164.9	-152.6	0	109.8	L377 D457 Y458 S460 D509 A510 A511	L377-K379 PolarHBondContact O-N 3.45Å; K379-D457 CarbonylContact O-C 3.55Å; K379-D457 WeakPolarHBondContact O-CA 3.21Å; K379-Y458 HydrophobicContact CB-CD1 3.98Å; K379-Y458 HydrophobicContact CB-CD2 4.22Å; K379-Y458 HydrophobicContact CB-CE1 3.46Å; K379-Y458 VanDerWaalsContact CB-CE1 3.46Å; K379-Y458 HydrophobicContact CB-CE2 3.77Å; K379-Y458 HydrophobicContact CB-CG 4.33Å; K379-Y458 HydrophobicContact CD-CE2 3.89Å; K379-Y458 VanDerWaalsContact CD-OH 3.31Å; K379-Y458 WeakPolarHBondContact CD-OH 3.17Å; K379-Y458 HydrophobicContact CG-CE2 4.44Å; K379-Y458 PolarHBondContact N-O 2.64Å; K379-Y458 VanDerWaalsContact O-CD1 3.28Å; K379-Y458 WeakPolarHBondContact O-CD1 3.08Å; K379-Y458 PolarHBondContact O-N 3.29Å; K379-S460 WeakPolarHBondContact CD-OG 3.17Å; K379-S460 WeakPolarHBondContact CE-OG 3.28Å; K379-S460 WeakPolarHBondContact CG-OG 3.43Å; K379-D509 WeakPolarHBondContact CD-OD1 2.93Å; K379-D509 IonicContact NZ-OD1 3.85Å; K379-D509 IonicContact NZ-OD2 2.78Å; K379-D509 PolarHBondContact NZ-OD2 2.96Å; K379-A510 CarbonylContact C-O 3.5Å; K379-A510 VanDerWaalsContact CA-O 3.31Å; K379-A510 WeakPolarHBondContact CA-O 3.49Å; K379-A511 HydrophobicContact CG-CB 4.21Å
380	T	55	Low	54.1	Low	6 Å²	6	59.4 Å²	59.4	4%	0.037	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.2	172.3	-59.1	0	0	0	0	108.8	I382 V455 I456 D457 D509 A510 K649	T380-I382 HydrophobicContact CG2-CD1 4.38Å; T380-I382 HydrophobicContact CG2-CG1 4.25Å; T380-V455 HydrophobicContact CG2-CG1 3.51Å; T380-I456 CarbonylContact C-O 3.57Å; T380-I456 WeakPolarHBondContact CA-O 3.08Å; T380-D457 WeakPolarHBondContact CB-OD1 3.21Å; T380-D457 VanDerWaalsContact CG2-OD1 3.28Å; T380-D457 WeakPolarHBondContact CG2-OD1 3.37Å; T380-D457 PolarHBondContact OG1-OD1 2.7Å; T380-D509 WeakPolarHBondContact O-CA 3.46Å; T380-A510 PolarHBondContact N-O 2.62Å; T380-A510 PolarHBondContact O-N 3.44Å; T380-K649 PolarHBondContact OG1-NZ 3.25Å
381	A	56.7	Low	57.1	Low	1 Å²	1	54.2 Å²	54.2	1%	0.008	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	123.2	167.6	0	0	0	0	0	109	I456 Y458 V470 I508	A381-I456 HydrophobicContact CB-CB 4.35Å; A381-I456 PolarHBondContact N-O 2.89Å; A381-I456 PolarHBondContact O-N 2.98Å; A381-Y458 HydrophobicContact CB-CD1 4.13Å; A381-Y458 HydrophobicContact CB-CE1 3.69Å; A381-V470 HydrophobicContact CB-CB 4.06Å; A381-V470 HydrophobicContact CB-CG1 4.12Å; A381-I508 WeakPolarHBondContact CA-O 3.28Å
382	I	56.4	Low	59.7	Low	12 Å²	12	50 Å²	50	6%	0.062	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.9	168.8	-69.7	141.3	0	0	0	108.2	T380 M453 L454 V455 T506 V507 I508 L642	T380-I382 HydrophobicContact CG2-CD1 4.38Å; T380-I382 HydrophobicContact CG2-CG1 4.25Å; I382-M453 HydrophobicContact CG2-CG 3.93Å; I382-M453 HydrophobicContact CG2-SD 3.89Å; I382-L454 CarbonylContact C-O 3.56Å; I382-L454 WeakPolarHBondContact CA-O 3.3Å; I382-V455 HydrophobicContact CG1-CG1 4.12Å; I382-V455 HydrophobicContact CG1-CG2 4.2Å; I382-T506 CarbonylContact O-C 3.53Å; I382-T506 WeakPolarHBondContact O-CA 3.34Å; I382-V507 HydrophobicContact CB-CB 4.2Å; I382-V507 HydrophobicContact CG2-CB 3.82Å; I382-V507 HydrophobicContact CG2-CG2 3.99Å; I382-V507 PolarHBondContact O-N 3.49Å; I382-I508 HydrophobicContact CB-CB 4.47Å; I382-I508 HydrophobicContact CD1-CB 3.84Å; I382-I508 HydrophobicContact CD1-CD1 3.74Å; I382-I508 HydrophobicContact CD1-CG1 4.08Å; I382-I508 HydrophobicContact CD1-CG2 4.46Å; I382-I508 PolarHBondContact N-O 3.39Å; I382-I508 VanDerWaalsContact N-O 3.08Å; I382-L642 HydrophobicContact CB-CD1 4.44Å; I382-L642 HydrophobicContact CB-CD2 4.2Å; I382-L642 HydrophobicContact CD1-CD1 4.22Å; I382-L642 HydrophobicContact CD1-CD2 3.38Å; I382-L642 HydrophobicContact CD1-CG 4.19Å; I382-L642 HydrophobicContact CG1-CD2 3.67Å; I382-L642 HydrophobicContact CG2-CD1 3.7Å; I382-L642 HydrophobicContact CG2-CD2 3.62Å; I382-L642 HydrophobicContact CG2-CG 4.22Å
383	I	63.8	Low	62.4	Low	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	126.4	-175.5	-64.1	176.5	0	0	0	109.8	V385 M453 L454 I456 V470 V475 I504 E505 T506	I383-V385 HydrophobicContact CG2-CG2 4.45Å; I383-M453 CarbonylContact O-C 3.59Å; I383-M453 WeakPolarHBondContact O-CA 3.02Å; I383-L454 HydrophobicContact CB-CB 4.37Å; I383-L454 PolarHBondContact N-O 3.49Å; I383-L454 PolarHBondContact O-N 2.68Å; I383-I456 HydrophobicContact CD1-CD1 4.03Å; I383-V470 HydrophobicContact CD1-CG1 3.82Å; I383-V475 HydrophobicContact CD1-CB 4.05Å; I383-V475 HydrophobicContact CD1-CG2 3.33Å; I383-V475 HydrophobicContact CG2-CB 4.49Å; I383-V475 HydrophobicContact CG2-CG1 4.05Å; I383-I504 HydrophobicContact CG2-CG2 3.57Å; I383-E505 CarbonylContact C-O 3.57Å; I383-E505 VanDerWaalsContact CA-O 3.28Å; I383-E505 WeakPolarHBondContact CA-O 3Å; I383-T506 HydrophobicContact CG1-CG2 4.41Å
384	T	65.2	Low	65	Low	22 Å²	22	49.6 Å²	49.6	14%	0.135	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	145.4	170.7	51.3	0	0	0	0	110.1	A452 I504 E505 V507 L638	T384-A452 CarbonylContact C-O 3.54Å; T384-A452 WeakPolarHBondContact CA-O 3.28Å; T384-I504 VanDerWaalsContact O-CA 3.25Å; T384-I504 WeakPolarHBondContact O-CA 3.31Å; T384-E505 PolarHBondContact N-O 3.24Å; T384-E505 PolarHBondContact O-N 2.98Å; T384-E505 VanDerWaalsContact O-N 3.17Å; T384-E505 PolarHBondContact OG1-O 2.99Å; T384-V507 HydrophobicContact CG2-CG2 3.71Å; T384-L638 HydrophobicContact CG2-CD1 4.13Å; T384-L638 HydrophobicContact CG2-CD2 3.27Å; T384-L638 HydrophobicContact CG2-CG 4.34Å
385	V	73.9	Confident	67.7	Low	1 Å²	1	45.3 Å²	45.3	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	122.8	173.2	-171.1	0	0	0	0	108.3	I383 L421 A452 L454 F496 L502 T503 I504	I383-V385 HydrophobicContact CG2-CG2 4.45Å; V385-L421 HydrophobicContact CB-CD1 4.25Å; V385-L421 HydrophobicContact CB-CD2 4.24Å; V385-L421 HydrophobicContact CG1-CD2 4.05Å; V385-L421 HydrophobicContact CG2-CD1 4.24Å; V385-L421 HydrophobicContact CG2-CD2 3.98Å; V385-A452 PolarHBondContact N-O 2.93Å; V385-A452 PolarHBondContact O-N 3.25Å; V385-L454 HydrophobicContact CG2-CD1 4.07Å; V385-F496 HydrophobicContact CB-CZ 4.39Å; V385-F496 HydrophobicContact CG1-CD2 4.22Å; V385-F496 HydrophobicContact CG1-CE1 4.25Å; V385-F496 HydrophobicContact CG1-CE2 3.96Å; V385-F496 HydrophobicContact CG1-CG 4.48Å; V385-F496 HydrophobicContact CG1-CZ 3.95Å; V385-L502 HydrophobicContact CG1-CD1 3.7Å; V385-T503 WeakPolarHBondContact CA-O 3.12Å; V385-I504 HydrophobicContact CG1-CG1 4.06Å; V385-I504 HydrophobicContact CG2-CG1 4.22Å
386	S	75.2	Confident	70.4	Confident	31 Å²	31	41.6 Å²	41.6	22%	0.217	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	139	172.7	90.4	0	0	0	0	113.2	G450 N451 T503	S386-G450 VanDerWaalsContact CA-O 3.29Å; S386-G450 WeakPolarHBondContact CA-O 3.39Å; S386-N451 WeakPolarHBondContact CB-OD1 3.41Å; S386-T503 WeakPolarHBondContact CB-OG1 3.11Å; S386-T503 PolarHBondContact N-O 2.81Å; S386-T503 PolarHBondContact N-OG1 3.24Å; S386-T503 PolarHBondContact O-N 3.18Å; S386-T503 PolarHBondContact O-OG1 2.8Å; S386-T503 PolarHBondContact OG-OG1 2.51Å
387	S	80.8	Confident	72.6	Confident	4 Å²	4	47.9 Å²	47.9	3%	0.028	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.6	166.9	170.4	-163.4	0	0	0	0	110.1	L389 I449 G450 G497 S500	S387-L389 PolarHBondContact O-N 2.79Å; S387-I449 WeakPolarHBondContact O-CA 3.37Å; S387-G450 PolarHBondContact N-O 2.82Å; S387-G450 PolarHBondContact O-N 3.29Å; S387-G497 PolarHBondContact OG-O 3.11Å; S387-S500 PolarHBondContact OG-OG 3.26Å
388	T	83.7	Confident	74.5	Confident	24 Å²	24	48 Å²	48	15%	0.147	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	128.2	165.8	-59.1	0	0	0	0	110.6	P395 G497 S500	T388-P395 HydrophobicContact CG2-CB 4.04Å; T388-G497 PolarHBondContact O-N 2.97Å; T388-S500 WeakPolarHBondContact CB-OG 3.23Å
389	L	87.8	Confident	76.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	136.5	176	-59.9	179.9	0	0	0	110.9	S387 P395 L396 Y413 I417 F443 V448 I494 Y495 F496	S387-L389 PolarHBondContact O-N 2.79Å; L389-P395 WeakPolarHBondContact O-CA 3.24Å; L389-L396 HydrophobicContact CB-CD1 3.75Å; L389-L396 HydrophobicContact CB-CG 4.37Å; L389-L396 PolarHBondContact O-N 2.86Å; L389-Y413 HydrophobicContact CD1-CD2 4.25Å; L389-I417 HydrophobicContact CD1-CD1 3.68Å; L389-I417 HydrophobicContact CD1-CG1 4.48Å; L389-I417 HydrophobicContact CD2-CD1 3.75Å; L389-I417 HydrophobicContact CD2-CG1 3.99Å; L389-I417 HydrophobicContact CG-CD1 4.34Å; L389-F443 HydrophobicContact CD1-CD1 3.93Å; L389-F443 HydrophobicContact CD1-CE1 3.75Å; L389-V448 HydrophobicContact CB-CB 4.49Å; L389-V448 VanDerWaalsContact CB-O 3.3Å; L389-V448 WeakPolarHBondContact CB-O 3.45Å; L389-V448 HydrophobicContact CD1-CB 4.48Å; L389-V448 HydrophobicContact CD1-CG1 3.73Å; L389-V448 HydrophobicContact CG-CG1 4.41Å; L389-V448 WeakPolarHBondContact CG-O 3.24Å; L389-V448 PolarHBondContact N-O 3.49Å; L389-I494 HydrophobicContact CB-CG2 3.88Å; L389-I494 HydrophobicContact CD1-CG2 4.07Å; L389-I494 HydrophobicContact CD2-CG2 4.1Å; L389-I494 HydrophobicContact CG-CG2 4.23Å; L389-Y495 WeakPolarHBondContact CA-O 3.05Å; L389-F496 HydrophobicContact CD2-CD1 3.97Å; L389-F496 HydrophobicContact CD2-CE1 4.08Å
390	T	88.5	Confident	77.2	Confident	12 Å²	12	51.6 Å²	51.6	7%	0.074	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	144.3	-174.7	-57.5	0	0	0	0	108.9	N393 K394 I494 Y495	T390-N393 VanDerWaalsContact CG2-C 3.46Å; T390-N393 VanDerWaalsContact CG2-CA 3.45Å; T390-K394 WeakPolarHBondContact CA-O 3.27Å; T390-K394 WeakPolarHBondContact CG2-O 3.4Å; T390-I494 WeakPolarHBondContact O-CA 3.25Å; T390-Y495 HydrophobicContact CG2-CE1 4.44Å; T390-Y495 HydrophobicContact CG2-CE2 3.88Å; T390-Y495 PolarHBondContact N-O 2.96Å; T390-Y495 WeakPolarHBondContact O-CD1 3.38Å; T390-Y495 PolarHBondContact O-N 3.19Å
391	R	88.5	Confident	78.2	Confident	120 Å²	120	53.7 Å²	53.7	45%	0.453	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	128.7	169.6	179.4	170.7	60.5	178.8	-3.3	108.6	N393 K394 L396 D492	R391-N393 VanDerWaalsContact C-N 3.25Å; R391-N393 PolarHBondContact O-N 2.95Å; R391-K394 PolarHBondContact N-O 2.6Å; R391-K394 PolarHBondContact O-N 3.23Å; R391-L396 HydrophobicContact CB-CD2 3.72Å; R391-L396 HydrophobicContact CB-CG 4.49Å; R391-D492 WeakPolarHBondContact CD-O 3.43Å; R391-D492 VanDerWaalsContact CG-O 3.24Å; R391-D492 WeakPolarHBondContact CG-O 3.36Å
392	L	84.9	Confident	78.7	Confident	101 Å²	101	53.8 Å²	53.8	53%	0.529	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	44.9	-176.4	-60.7	170.8	0	0	0	112.9	K394 S491 D492	L392-K394 PolarHBondContact O-N 2.83Å; L392-S491 WeakPolarHBondContact CD2-O 3.46Å; L392-D492 HydrophobicContact CD1-CB 4.5Å; L392-D492 HydrophobicContact CD2-CB 4.32Å; L392-D492 HydrophobicContact CG-CB 4.41Å
393	N	81.8	Confident	78.8	Confident	112 Å²	112	56.9 Å²	56.9	60%	0.599	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	19.8	-176.9	-66.6	-44.7	0	0	0	115.4	T390 R391 Y495	T390-N393 VanDerWaalsContact CG2-C 3.46Å; T390-N393 VanDerWaalsContact CG2-CA 3.45Å; R391-N393 VanDerWaalsContact C-N 3.25Å; R391-N393 PolarHBondContact O-N 2.95Å; N393-Y495 VanDerWaalsContact CA-OH 3.25Å; N393-Y495 WeakPolarHBondContact CA-OH 3.18Å; N393-Y495 PolarHBondContact N-OH 3.36Å; N393-Y495 PolarHBondContact OD1-OH 2.86Å
394	K	84.6	Confident	78.4	Confident	155 Å²	155	60.4 Å²	60.4	67%	0.674	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.8	128.6	172.9	-65.7	-176.3	-179.7	180	0	110.9	T390 R391 L392	T390-K394 WeakPolarHBondContact CA-O 3.27Å; T390-K394 WeakPolarHBondContact CG2-O 3.4Å; R391-K394 PolarHBondContact N-O 2.6Å; R391-K394 PolarHBondContact O-N 3.23Å; L392-K394 PolarHBondContact O-N 2.83Å
395	P	84.5	Confident	77.9	Confident	77 Å²	77	61.3 Å²	61.3	50%	0.5	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	140.4	172.8	-22.9	32.6	0	0	0	110.9	T388 L389	T388-P395 HydrophobicContact CG2-CB 4.04Å; L389-P395 WeakPolarHBondContact O-CA 3.24Å
396	L	86.9	Confident	77.3	Confident	11 Å²	11	67 Å²	67	6%	0.058	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-74.7	142.1	176.7	-64.9	176.7	0	0	0	110.9	L389 R391 Y413 V448 I494	L389-L396 HydrophobicContact CB-CD1 3.75Å; L389-L396 HydrophobicContact CB-CG 4.37Å; L389-L396 PolarHBondContact O-N 2.86Å; R391-L396 HydrophobicContact CB-CD2 3.72Å; R391-L396 HydrophobicContact CB-CG 4.49Å; L396-Y413 HydrophobicContact CD1-CD2 4.34Å; L396-Y413 HydrophobicContact CD1-CE2 3.58Å; L396-V448 HydrophobicContact CB-CB 4.02Å; L396-V448 HydrophobicContact CB-CG2 3.86Å; L396-V448 PolarHBondContact O-N 3.06Å; L396-V448 VanDerWaalsContact O-N 3.15Å; L396-I494 HydrophobicContact CD1-CD1 3.97Å; L396-I494 HydrophobicContact CD1-CG1 4Å; L396-I494 HydrophobicContact CD1-CG2 3.88Å
397	E	84	Confident	77.1	Confident	175 Å²	175	66.4 Å²	66.4	82%	0.818	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-81.9	145.1	173.4	-66.1	-172	170.5	0	0	111	V448	E397-V448 VanDerWaalsContact O-CG2 3.25Å; E397-V448 WeakPolarHBondContact O-CG2 3.35Å
398	W	82	Confident	77	Confident	58 Å²	58	71.6 Å²	71.6	22%	0.22	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-64.5	137.4	-180	-179.5	-100.7	0	0	0	112.5	D400 L402 L403 F443 S444 R445 V448	W398-D400 PolarHBondContact NE1-OD1 2.78Å; W398-L402 HydrophobicContact CE3-CD1 4.34Å; W398-L402 HydrophobicContact CH2-CB 4.09Å; W398-L402 HydrophobicContact CZ3-CB 4.23Å; W398-L402 HydrophobicContact CZ3-CD1 4.26Å; W398-L403 HydrophobicContact CH2-CD2 3.99Å; W398-L403 HydrophobicContact CH2-CG 4.38Å; W398-L403 HydrophobicContact CZ2-CD1 4.33Å; W398-L403 HydrophobicContact CZ2-CD2 3.67Å; W398-L403 HydrophobicContact CZ2-CG 3.75Å; W398-F443 HydrophobicContact CH2-CB 4.39Å; W398-F443 HydrophobicContact CZ3-CB 4.01Å; W398-S444 VanDerWaalsContact CZ3-O 3.24Å; W398-S444 WeakPolarHBondContact CZ3-O 3.45Å; W398-R445 HydrophobicContact CD2-CB 4.33Å; W398-R445 HydrophobicContact CD2-CG 3.66Å; W398-R445 HydrophobicContact CE3-CG 4.21Å; W398-R445 HydrophobicContact CG-CG 4.12Å; W398-R445 HydrophobicContact CH2-CG 4.03Å; W398-R445 HydrophobicContact CZ2-CG 3.46Å; W398-R445 VanDerWaalsContact CZ2-CG 3.46Å; W398-R445 HydrophobicContact CZ3-CG 4.38Å; W398-V448 HydrophobicContact CE3-CG2 4.28Å
399	N	80.8	Confident	76.9	Confident	72 Å²	72	72.5 Å²	72.5	39%	0.385	37%	0.373	S	S	.	.			trans	-132	128.1	171.6	-174.5	-39.2	0	0	0	108.9	S401 L402 L409	N399-S401 PolarHBondContact O-N 3.21Å; N399-S401 VanDerWaalsContact O-N 3.09Å; N399-S401 VanDerWaalsContact OD1-CB 3.27Å; N399-S401 WeakPolarHBondContact OD1-CB 3.25Å; N399-S401 PolarHBondContact OD1-N 3.48Å; N399-S401 PolarHBondContact OD1-OG 2.78Å; N399-L402 VanDerWaalsContact O-CB 3.32Å; N399-L402 WeakPolarHBondContact O-CB 3.5Å; N399-L402 PolarHBondContact O-N 3.39Å; N399-L409 HydrophobicContact CB-CD2 3.63Å
400	D	76.5	Confident	76.5	Confident	90 Å²	90	74.1 Å²	74.1	48%	0.481	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-62.8	-16.9	-178	-73.3	-31.7	0	0	0	113.6	W398 L402 L403 R445	W398-D400 PolarHBondContact NE1-OD1 2.78Å; D400-L402 PolarHBondContact O-N 3.37Å; D400-L403 HydrophobicContact CB-CD1 4.39Å; D400-L403 VanDerWaalsContact O-CB 3.3Å; D400-L403 WeakPolarHBondContact O-CB 3.19Å; D400-L403 PolarHBondContact O-N 3.33Å; D400-R445 IonicContact OD1-CZ 3.93Å; D400-R445 IonicContact OD1-NE 3.32Å; D400-R445 IonicContact OD1-NH2 2.79Å; D400-R445 PolarHBondContact OD1-NH2 3.2Å; D400-R445 IonicContact OD2-NH2 3.64Å
401	S	76.6	Confident	76.1	Confident	50 Å²	50	80 Å²	80	35%	0.35	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-58.6	-28.3	170.5	-49.4	0	0	0	0	111.9	N399 L403 D404 S407	N399-S401 PolarHBondContact O-N 3.21Å; N399-S401 VanDerWaalsContact O-N 3.09Å; N399-S401 VanDerWaalsContact OD1-CB 3.27Å; N399-S401 WeakPolarHBondContact OD1-CB 3.25Å; N399-S401 PolarHBondContact OD1-N 3.48Å; N399-S401 PolarHBondContact OD1-OG 2.78Å; S401-L403 PolarHBondContact O-N 3.44Å; S401-L403 VanDerWaalsContact O-N 3.13Å; S401-D404 PolarHBondContact O-N 3.45Å; S401-S407 WeakPolarHBondContact O-CB 3.27Å; S401-S407 PolarHBondContact O-OG 2.62Å
402	L	67.2	Low	76	Confident	3 Å²	3	77.9 Å²	77.9	2%	0.016	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-68.5	-5	175.5	-62.8	174.1	0	0	0	113.9	W398 N399 D400 L409 Y410 Y413 F443 V448	W398-L402 HydrophobicContact CE3-CD1 4.34Å; W398-L402 HydrophobicContact CH2-CB 4.09Å; W398-L402 HydrophobicContact CZ3-CB 4.23Å; W398-L402 HydrophobicContact CZ3-CD1 4.26Å; N399-L402 VanDerWaalsContact O-CB 3.32Å; N399-L402 WeakPolarHBondContact O-CB 3.5Å; N399-L402 PolarHBondContact O-N 3.39Å; D400-L402 PolarHBondContact O-N 3.37Å; L402-L409 HydrophobicContact CD2-CB 4.48Å; L402-L409 HydrophobicContact CD2-CD2 3.99Å; L402-L409 HydrophobicContact CD2-CG 3.85Å; L402-L409 HydrophobicContact CG-CD2 3.95Å; L402-L409 HydrophobicContact CG-CG 4.38Å; L402-Y410 VanDerWaalsContact O-CD2 3.31Å; L402-Y410 WeakPolarHBondContact O-CD2 3.37Å; L402-Y413 HydrophobicContact CD1-CD2 4.16Å; L402-Y413 HydrophobicContact CD1-CE2 4.06Å; L402-Y413 HydrophobicContact CD2-CD2 3.69Å; L402-Y413 HydrophobicContact CD2-CE2 4.17Å; L402-Y413 HydrophobicContact CD2-CG 4.11Å; L402-F443 HydrophobicContact CB-CB 4.07Å; L402-F443 HydrophobicContact CB-CD2 4.13Å; L402-F443 HydrophobicContact CB-CG 4.26Å; L402-F443 HydrophobicContact CD1-CB 4.38Å; L402-F443 HydrophobicContact CD1-CG 4.42Å; L402-F443 HydrophobicContact CD2-CD2 3.96Å; L402-F443 HydrophobicContact CD2-CE2 4.14Å; L402-F443 HydrophobicContact CD2-CG 4.24Å; L402-V448 HydrophobicContact CD1-CB 4.4Å; L402-V448 HydrophobicContact CD1-CG1 3.55Å; L402-V448 HydrophobicContact CD1-CG2 3.85Å
403	L	57.1	Low	76.1	Confident	76 Å²	76	74 Å²	74	40%	0.398	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-83.4	-19.7	169.2	-61.6	171.3	0	0	0	112.4	W398 D400 S401 P405 K662	W398-L403 HydrophobicContact CH2-CD2 3.99Å; W398-L403 HydrophobicContact CH2-CG 4.38Å; W398-L403 HydrophobicContact CZ2-CD1 4.33Å; W398-L403 HydrophobicContact CZ2-CD2 3.67Å; W398-L403 HydrophobicContact CZ2-CG 3.75Å; D400-L403 HydrophobicContact CB-CD1 4.39Å; D400-L403 VanDerWaalsContact O-CB 3.3Å; D400-L403 WeakPolarHBondContact O-CB 3.19Å; D400-L403 PolarHBondContact O-N 3.33Å; S401-L403 PolarHBondContact O-N 3.44Å; S401-L403 VanDerWaalsContact O-N 3.13Å; L403-P405 WeakPolarHBondContact O-CD 3.06Å; L403-K662 PolarHBondContact O-NZ 2.76Å; L403-K662 VanDerWaalsContact O-NZ 3.14Å
404	D	57	Low	76	Confident	74 Å²	74	69.4 Å²	69.4	40%	0.396	35%	0.353	S	S	.	.			trans	-104.4	107.5	179.6	-176.9	9.9	0	0	0	110.9	S401 N406 S407 Y410	S401-D404 PolarHBondContact O-N 3.45Å; D404-N406 PolarHBondContact O-N 2.93Å; D404-N406 VanDerWaalsContact O-N 3.12Å; D404-N406 WeakPolarHBondContact OD1-CB 3.03Å; D404-N406 PolarHBondContact OD1-N 3.18Å; D404-N406 PolarHBondContact OD1-ND2 2.94Å; D404-S407 VanDerWaalsContact O-CB 3.3Å; D404-S407 WeakPolarHBondContact O-CB 3.24Å; D404-S407 PolarHBondContact O-N 3.44Å; D404-S407 PolarHBondContact O-OG 2.78Å; D404-Y410 WeakPolarHBondContact O-CB 3.42Å
405	P	53.2	Low	76	Confident	41 Å²	41	65.4 Å²	65.4	27%	0.266	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.1	175.7	-26.9	34.7	0	0	0	114.6	L403 S407 Y410 K662	L403-P405 WeakPolarHBondContact O-CD 3.06Å; P405-S407 VanDerWaalsContact C-N 3.35Å; P405-Y410 VanDerWaalsContact CA-CG 3.5Å; P405-Y410 HydrophobicContact CB-CD1 4.15Å; P405-Y410 HydrophobicContact CB-CE1 4.05Å; P405-Y410 HydrophobicContact CB-CG 4.48Å; P405-Y410 HydrophobicContact CG-CE2 4.32Å; P405-K662 HydrophobicContact CG-CD 4.08Å; P405-K662 VanDerWaalsContact CG-NZ 3.34Å
406	N	62.5	Low	76.2	Confident	120 Å²	120	63.8 Å²	63.8	64%	0.642	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.7	178.8	-58.3	-56.2	0	0	0	112.7	D404	D404-N406 PolarHBondContact O-N 2.93Å; D404-N406 VanDerWaalsContact O-N 3.12Å; D404-N406 WeakPolarHBondContact OD1-CB 3.03Å; D404-N406 PolarHBondContact OD1-N 3.18Å; D404-N406 PolarHBondContact OD1-ND2 2.94Å
407	S	70.3	Confident	76.3	Confident	19 Å²	19	63.3 Å²	63.3	13%	0.133	33%	0.325	C	S	.	.	S	Bend	trans	-65.7	143.8	177.1	76.2	0	0	0	0	110.5	S401 D404 P405 L409 Y410 R411	S401-S407 WeakPolarHBondContact O-CB 3.27Å; S401-S407 PolarHBondContact O-OG 2.62Å; D404-S407 VanDerWaalsContact O-CB 3.3Å; D404-S407 WeakPolarHBondContact O-CB 3.24Å; D404-S407 PolarHBondContact O-N 3.44Å; D404-S407 PolarHBondContact O-OG 2.78Å; P405-S407 VanDerWaalsContact C-N 3.35Å; S407-L409 PolarHBondContact O-N 3.5Å; S407-Y410 PolarHBondContact O-N 2.9Å; S407-Y410 VanDerWaalsContact OG-CB 3.29Å; S407-Y410 WeakPolarHBondContact OG-CB 3.3Å; S407-Y410 PolarHBondContact OG-N 3.45Å; S407-R411 PolarHBondContact O-N 3.32Å; S407-R411 VanDerWaalsContact O-N 3.12Å
408	D	80	Confident	76.3	Confident	114 Å²	114	55.8 Å²	55.8	61%	0.61	29%	0.291	S	S	*	.	H	α-helix	trans	-57.9	-34.2	176.4	-65.6	-32.1	0	0	0	111.5	R411 D412	D408-R411 PolarHBondContact O-N 2.93Å; D408-R411 IonicContact OD1-CZ 3.99Å; D408-R411 IonicContact OD1-NH1 3.89Å; D408-R411 PolarHBondContact OD1-NH1 3.33Å; D408-R411 IonicContact OD1-NH2 2.83Å; D408-R411 PolarHBondContact OD1-NH2 3.02Å; D408-D412 VanDerWaalsContact O-CB 3.24Å; D408-D412 WeakPolarHBondContact O-CB 3.16Å; D408-D412 PolarHBondContact O-N 2.91Å
409	L	81.2	Confident	76.6	Confident	43 Å²	43	56.5 Å²	56.5	23%	0.225	30%	0.299	C	S	.	.	H	α-helix	trans	-67.5	-43.5	178.8	-168.6	69.9	0	0	0	112.3	N399 L402 S407 Y413	N399-L409 HydrophobicContact CB-CD2 3.63Å; L402-L409 HydrophobicContact CD2-CB 4.48Å; L402-L409 HydrophobicContact CD2-CD2 3.99Å; L402-L409 HydrophobicContact CD2-CG 3.85Å; L402-L409 HydrophobicContact CG-CD2 3.95Å; L402-L409 HydrophobicContact CG-CG 4.38Å; S407-L409 PolarHBondContact O-N 3.5Å; L409-Y413 HydrophobicContact CD1-CD1 4Å; L409-Y413 HydrophobicContact CD1-CE1 3.44Å; L409-Y413 VanDerWaalsContact CD1-CE1 3.44Å; L409-Y413 HydrophobicContact CG-CD1 4.37Å; L409-Y413 HydrophobicContact CG-CE1 4.15Å; L409-Y413 WeakPolarHBondContact O-CB 3.34Å; L409-Y413 WeakPolarHBondContact O-CD1 3.35Å; L409-Y413 PolarHBondContact O-N 3.09Å
410	Y	78.8	Confident	77.1	Confident	33 Å²	33	53.3 Å²	53.3	13%	0.129	28%	0.282	C	S	.	.	H	α-helix	trans	-62.1	-46.5	176.2	-175.2	-75.8	0	0	0	110.7	L402 D404 P405 S407 S414 F443	L402-Y410 VanDerWaalsContact O-CD2 3.31Å; L402-Y410 WeakPolarHBondContact O-CD2 3.37Å; D404-Y410 WeakPolarHBondContact O-CB 3.42Å; P405-Y410 VanDerWaalsContact CA-CG 3.5Å; P405-Y410 HydrophobicContact CB-CD1 4.15Å; P405-Y410 HydrophobicContact CB-CE1 4.05Å; P405-Y410 HydrophobicContact CB-CG 4.48Å; P405-Y410 HydrophobicContact CG-CE2 4.32Å; S407-Y410 PolarHBondContact O-N 2.9Å; S407-Y410 VanDerWaalsContact OG-CB 3.29Å; S407-Y410 WeakPolarHBondContact OG-CB 3.3Å; S407-Y410 PolarHBondContact OG-N 3.45Å; Y410-S414 WeakPolarHBondContact CD1-OG 3.48Å; Y410-S414 VanDerWaalsContact CE1-OG 3.24Å; Y410-S414 WeakPolarHBondContact CE1-OG 3.38Å; Y410-S414 VanDerWaalsContact O-CB 3.23Å; Y410-S414 WeakPolarHBondContact O-CB 3.49Å; Y410-S414 PolarHBondContact O-N 2.82Å; Y410-S414 PolarHBondContact O-OG 3.31Å; Y410-F443 HydrophobicContact CD1-CE2 4.22Å; Y410-F443 AromaticContact CD2-CD2 3.53Å; Y410-F443 HydrophobicContact CD2-CD2 3.53Å; Y410-F443 AromaticContact CD2-CE2 3.5Å; Y410-F443 HydrophobicContact CD2-CE2 3.5Å; Y410-F443 HydrophobicContact CE1-CE2 4.28Å; Y410-F443 AromaticContact CE2-CD2 3.52Å; Y410-F443 HydrophobicContact CE2-CD2 3.52Å; Y410-F443 AromaticContact CE2-CE2 3.58Å; Y410-F443 HydrophobicContact CE2-CE2 3.58Å; Y410-F443 HydrophobicContact CG-CD2 4.3Å; Y410-F443 AromaticContact CG-CE2 3.83Å; Y410-F443 HydrophobicContact CG-CE2 3.83Å; Y410-F443 AromaticContact CZ-CE2 3.96Å
411	R	79.4	Confident	77.6	Confident	135 Å²	135	49 Å²	49	51%	0.509	26%	0.259	S	S	.	.	H	α-helix	trans	-63.1	-47	-179.6	-173.9	173	64.5	-115.2	-4.2	111.3	S407 D408 S414 T415	S407-R411 PolarHBondContact O-N 3.32Å; S407-R411 VanDerWaalsContact O-N 3.12Å; D408-R411 PolarHBondContact O-N 2.93Å; D408-R411 IonicContact OD1-CZ 3.99Å; D408-R411 IonicContact OD1-NH1 3.89Å; D408-R411 PolarHBondContact OD1-NH1 3.33Å; D408-R411 IonicContact OD1-NH2 2.83Å; D408-R411 PolarHBondContact OD1-NH2 3.02Å; R411-S414 PolarHBondContact O-N 2.69Å; R411-T415 PolarHBondContact O-N 2.91Å; R411-T415 PolarHBondContact O-OG1 3.35Å
412	D	87.2	Confident	78	Confident	76 Å²	76	48.8 Å²	48.8	41%	0.406	25%	0.254	S	S	.	.	H	α-helix	trans	-58.5	-51.2	177.4	177.2	47.3	0	0	0	112	D408 S414 T415 Q416	D408-D412 VanDerWaalsContact O-CB 3.24Å; D408-D412 WeakPolarHBondContact O-CB 3.16Å; D408-D412 PolarHBondContact O-N 2.91Å; D412-S414 VanDerWaalsContact C-N 3.28Å; D412-S414 PolarHBondContact O-N 3.02Å; D412-T415 PolarHBondContact O-N 3.38Å; D412-Q416 VanDerWaalsContact CG-NE2 3.25Å; D412-Q416 WeakPolarHBondContact O-CG 3.32Å; D412-Q416 PolarHBondContact O-N 3.36Å; D412-Q416 PolarHBondContact OD1-NE2 2.91Å; D412-Q416 PolarHBondContact OD2-NE2 2.84Å; D412-Q416 VanDerWaalsContact OD2-NE2 3.09Å
413	Y	87.4	Confident	78.9	Confident	19 Å²	19	52.3 Å²	52.3	8%	0.075	27%	0.27	C	S	.	.	H	α-helix	trans	-64.2	-37.6	179.9	-78.9	27.2	0	0	0	111.4	L389 L396 L402 L409 I417 F443 V448 I494	L389-Y413 HydrophobicContact CD1-CD2 4.25Å; L396-Y413 HydrophobicContact CD1-CD2 4.34Å; L396-Y413 HydrophobicContact CD1-CE2 3.58Å; L402-Y413 HydrophobicContact CD1-CD2 4.16Å; L402-Y413 HydrophobicContact CD1-CE2 4.06Å; L402-Y413 HydrophobicContact CD2-CD2 3.69Å; L402-Y413 HydrophobicContact CD2-CE2 4.17Å; L402-Y413 HydrophobicContact CD2-CG 4.11Å; L409-Y413 HydrophobicContact CD1-CD1 4Å; L409-Y413 HydrophobicContact CD1-CE1 3.44Å; L409-Y413 VanDerWaalsContact CD1-CE1 3.44Å; L409-Y413 HydrophobicContact CG-CD1 4.37Å; L409-Y413 HydrophobicContact CG-CE1 4.15Å; L409-Y413 WeakPolarHBondContact O-CB 3.34Å; L409-Y413 WeakPolarHBondContact O-CD1 3.35Å; L409-Y413 PolarHBondContact O-N 3.09Å; Y413-I417 WeakPolarHBondContact O-CB 3.49Å; Y413-I417 WeakPolarHBondContact O-CD1 3.4Å; Y413-I417 VanDerWaalsContact O-CG1 3.25Å; Y413-I417 WeakPolarHBondContact O-CG1 2.93Å; Y413-I417 PolarHBondContact O-N 3.03Å; Y413-F443 VanDerWaalsContact CB-CZ 3.47Å; Y413-F443 HydrophobicContact CD2-CE1 4.22Å; Y413-V448 HydrophobicContact CD2-CG1 4.44Å; Y413-V448 HydrophobicContact CE2-CG1 4.42Å; Y413-I494 HydrophobicContact CD1-CD1 3.22Å; Y413-I494 HydrophobicContact CD2-CD1 4.06Å; Y413-I494 HydrophobicContact CE1-CD1 3.27Å; Y413-I494 HydrophobicContact CE2-CD1 4.11Å; Y413-I494 HydrophobicContact CG-CD1 3.63Å
414	S	78.9	Confident	80.3	Confident	17 Å²	17	48.7 Å²	48.7	12%	0.119	25%	0.251	C	S	.	.	H	α-helix	trans	-65.9	-44.4	179	-60.7	0	0	0	0	111.9	Y410 R411 D412 I417 C418 V440	Y410-S414 WeakPolarHBondContact CD1-OG 3.48Å; Y410-S414 VanDerWaalsContact CE1-OG 3.24Å; Y410-S414 WeakPolarHBondContact CE1-OG 3.38Å; Y410-S414 VanDerWaalsContact O-CB 3.23Å; Y410-S414 WeakPolarHBondContact O-CB 3.49Å; Y410-S414 PolarHBondContact O-N 2.82Å; Y410-S414 PolarHBondContact O-OG 3.31Å; R411-S414 PolarHBondContact O-N 2.69Å; D412-S414 VanDerWaalsContact C-N 3.28Å; D412-S414 PolarHBondContact O-N 3.02Å; S414-I417 PolarHBondContact O-N 3.32Å; S414-C418 PolarHBondContact O-N 2.8Å; S414-V440 WeakPolarHBondContact O-CG2 3.35Å
415	T	84.7	Confident	81.4	Confident	71 Å²	71	45.3 Å²	45.3	44%	0.436	23%	0.233	S	C	.	.	H	α-helix	trans	-60.1	-49.9	175.8	-60.9	0	0	0	0	110.9	R411 D412 I417 C418 D419	R411-T415 PolarHBondContact O-N 2.91Å; R411-T415 PolarHBondContact O-OG1 3.35Å; D412-T415 PolarHBondContact O-N 3.38Å; T415-I417 VanDerWaalsContact C-N 3.32Å; T415-I417 PolarHBondContact O-N 2.05Å; T415-C418 PolarHBondContact O-N 2.91Å; T415-D419 WeakPolarHBondContact O-CB 3.25Å; T415-D419 VanDerWaalsContact O-CG 3.28Å; T415-D419 PolarHBondContact O-N 3.24Å
416	Q	89.7	Confident	82.4	Confident	43 Å²	43	48.7 Å²	48.7	20%	0.201	25%	0.249	C	C	.	.	H	α-helix	trans	-61.4	-39.3	-179.3	-71.2	-177.4	57.9	0	0	112.9	D412 L420 I494	D412-Q416 VanDerWaalsContact CG-NE2 3.25Å; D412-Q416 WeakPolarHBondContact O-CG 3.32Å; D412-Q416 PolarHBondContact O-N 3.36Å; D412-Q416 PolarHBondContact OD1-NE2 2.91Å; D412-Q416 PolarHBondContact OD2-NE2 2.84Å; D412-Q416 VanDerWaalsContact OD2-NE2 3.09Å; Q416-L420 WeakPolarHBondContact O-CB 3.38Å; Q416-L420 PolarHBondContact O-N 2.79Å; Q416-I494 HydrophobicContact CB-CB 4.36Å
417	I	87.2	Confident	82.7	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-64.8	-47.1	176.1	-73.1	167.4	0	0	0	111.3	L389 Y413 S414 T415 L420 L421 V440 F443 A452 F496	L389-I417 HydrophobicContact CD1-CD1 3.68Å; L389-I417 HydrophobicContact CD1-CG1 4.48Å; L389-I417 HydrophobicContact CD2-CD1 3.75Å; L389-I417 HydrophobicContact CD2-CG1 3.99Å; L389-I417 HydrophobicContact CG-CD1 4.34Å; Y413-I417 WeakPolarHBondContact O-CB 3.49Å; Y413-I417 WeakPolarHBondContact O-CD1 3.4Å; Y413-I417 VanDerWaalsContact O-CG1 3.25Å; Y413-I417 WeakPolarHBondContact O-CG1 2.93Å; Y413-I417 PolarHBondContact O-N 3.03Å; S414-I417 PolarHBondContact O-N 3.32Å; T415-I417 VanDerWaalsContact C-N 3.32Å; T415-I417 PolarHBondContact O-N 2.05Å; I417-L420 WeakPolarHBondContact O-CB 3.48Å; I417-L420 PolarHBondContact O-N 3.06Å; I417-L421 HydrophobicContact CG2-CD1 4.17Å; I417-L421 WeakPolarHBondContact O-CG 3.32Å; I417-L421 PolarHBondContact O-N 3.27Å; I417-V440 HydrophobicContact CB-CG2 4.06Å; I417-V440 HydrophobicContact CG2-CG2 3.88Å; I417-F443 HydrophobicContact CD1-CE1 3.58Å; I417-F443 HydrophobicContact CD1-CZ 4.16Å; I417-A452 HydrophobicContact CG2-CB 3.82Å; I417-F496 HydrophobicContact CG2-CE1 4.47Å; I417-F496 HydrophobicContact CG2-CE2 3.86Å; I417-F496 HydrophobicContact CG2-CZ 3.48Å; I417-F496 VanDerWaalsContact CG2-CZ 3.48Å
418	C	85	Confident	82.5	Confident	16 Å²	16	47.5 Å²	47.5	11%	0.108	25%	0.248	C	C	.	.	H	α-helix	trans	-69.9	-38.1	-178.9	-83.1	0	0	0	0	112.5	S414 T415 L420 L421 L422 C438	S414-C418 PolarHBondContact O-N 2.8Å; T415-C418 PolarHBondContact O-N 2.91Å; C418-L420 VanDerWaalsContact C-N 3.31Å; C418-L420 PolarHBondContact O-N 3.03Å; C418-L421 PolarHBondContact O-N 3.09Å; C418-L422 VanDerWaalsContact O-CB 3.31Å; C418-L422 WeakPolarHBondContact O-CB 3.19Å; C418-L422 WeakPolarHBondContact O-CG 3.47Å; C418-L422 PolarHBondContact O-N 3.48Å; C418-C438 WeakPolarHBondContact CA-SG 3.45Å; C418-C438 HydrophobicContact CB-CB 3.61Å; C418-C438 WeakPolarHBondContact CB-SG 3.48Å; C418-C438 WeakPolarHBondContact SG-CB 3.31Å; C418-C438 CovalentContact SG-SG 2.06Å; C418-C438 PolarHBondContact SG-SG 2.92Å
419	D	88.2	Confident	81.4	Confident	73 Å²	73	50 Å²	50	39%	0.39	25%	0.251	S	S	.	.	H	α-helix	trans	-56.4	-48.8	170.9	-74.8	-14.2	0	0	0	110	T415 L421 L422 H423	T415-D419 WeakPolarHBondContact O-CB 3.25Å; T415-D419 VanDerWaalsContact O-CG 3.28Å; T415-D419 PolarHBondContact O-N 3.24Å; D419-L421 PolarHBondContact O-N 3.38Å; D419-L422 PolarHBondContact O-N 2.94Å; D419-H423 WeakPolarHBondContact O-CB 3.22Å; D419-H423 PolarHBondContact O-N 3.16Å; D419-H423 PolarHBondContact O-ND1 3.46Å
420	L	90.6	Very high	80.4	Confident	5 Å²	5	48.8 Å²	48.8	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-55.8	-50.3	177.6	179	155.9	0	0	0	112.1	Q416 I417 C418 S424 V479 Y482 I483 I486 F496	Q416-L420 WeakPolarHBondContact O-CB 3.38Å; Q416-L420 PolarHBondContact O-N 2.79Å; I417-L420 WeakPolarHBondContact O-CB 3.48Å; I417-L420 PolarHBondContact O-N 3.06Å; C418-L420 VanDerWaalsContact C-N 3.31Å; C418-L420 PolarHBondContact O-N 3.03Å; L420-S424 WeakPolarHBondContact O-CB 3.41Å; L420-S424 PolarHBondContact O-N 3.4Å; L420-S424 PolarHBondContact O-OG 2.84Å; L420-V479 HydrophobicContact CD2-CG1 4.34Å; L420-Y482 HydrophobicContact CG-CD1 4.15Å; L420-Y482 HydrophobicContact CG-CE1 4.36Å; L420-I483 HydrophobicContact CD1-CG1 4.17Å; L420-I483 HydrophobicContact CD2-CG1 4.38Å; L420-I486 HydrophobicContact CD1-CD1 3.77Å; L420-I486 HydrophobicContact CG-CD1 4.14Å; L420-F496 HydrophobicContact CD2-CD2 3.9Å; L420-F496 HydrophobicContact CD2-CE2 4.17Å
421	L	87.8	Confident	79.2	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-67.7	-44.3	-176.5	-68.6	175.5	0	0	0	112.4	V385 I417 C418 D419 H423 S424 I425 A452 L454 V479 F496	V385-L421 HydrophobicContact CB-CD1 4.25Å; V385-L421 HydrophobicContact CB-CD2 4.24Å; V385-L421 HydrophobicContact CG1-CD2 4.05Å; V385-L421 HydrophobicContact CG2-CD1 4.24Å; V385-L421 HydrophobicContact CG2-CD2 3.98Å; I417-L421 HydrophobicContact CG2-CD1 4.17Å; I417-L421 WeakPolarHBondContact O-CG 3.32Å; I417-L421 PolarHBondContact O-N 3.27Å; C418-L421 PolarHBondContact O-N 3.09Å; D419-L421 PolarHBondContact O-N 3.38Å; L421-H423 VanDerWaalsContact C-N 3.35Å; L421-H423 PolarHBondContact O-N 2.85Å; L421-S424 WeakPolarHBondContact O-CB 3.08Å; L421-S424 PolarHBondContact O-N 2.9Å; L421-I425 WeakPolarHBondContact O-CG1 3.47Å; L421-I425 PolarHBondContact O-N 2.84Å; L421-A452 HydrophobicContact CD1-CB 3.49Å; L421-A452 VanDerWaalsContact CD1-CB 3.49Å; L421-L454 HydrophobicContact CB-CD1 4.24Å; L421-L454 HydrophobicContact CB-CD2 3.95Å; L421-L454 HydrophobicContact CB-CG 4.39Å; L421-L454 HydrophobicContact CD1-CD1 4.44Å; L421-L454 HydrophobicContact CD1-CG 4.3Å; L421-L454 HydrophobicContact CD2-CD1 4.38Å; L421-V479 HydrophobicContact CD2-CG1 4.27Å; L421-V479 HydrophobicContact CD2-CG2 3.69Å; L421-F496 HydrophobicContact CD1-CE2 3.98Å; L421-F496 HydrophobicContact CD1-CZ 4.2Å; L421-F496 HydrophobicContact CD2-CD2 4.26Å; L421-F496 HydrophobicContact CD2-CE2 3.65Å; L421-F496 HydrophobicContact CG-CE2 3.81Å
422	L	85.7	Confident	78	Confident	45 Å²	45	47.9 Å²	47.9	24%	0.236	25%	0.249	C	C	.	.	H	α-helix	trans	-62.2	-43.5	177.9	-69.5	172.3	0	0	0	111.1	C418 D419 S424 I425 N426 V436 C438	C418-L422 VanDerWaalsContact O-CB 3.31Å; C418-L422 WeakPolarHBondContact O-CB 3.19Å; C418-L422 WeakPolarHBondContact O-CG 3.47Å; C418-L422 PolarHBondContact O-N 3.48Å; D419-L422 PolarHBondContact O-N 2.94Å; L422-S424 VanDerWaalsContact C-N 3.34Å; L422-I425 PolarHBondContact O-N 2.93Å; L422-N426 VanDerWaalsContact O-CB 3.23Å; L422-N426 WeakPolarHBondContact O-CB 3.26Å; L422-N426 PolarHBondContact O-N 3.41Å; L422-N426 PolarHBondContact O-ND2 2.75Å; L422-V436 HydrophobicContact CD2-CB 4.1Å; L422-V436 HydrophobicContact CD2-CG1 3.74Å; L422-V436 WeakPolarHBondContact CD2-O 3.43Å; L422-C438 HydrophobicContact CD1-CB 4.31Å; L422-C438 HydrophobicContact CD2-CB 4.12Å; L422-C438 HydrophobicContact CG-CB 3.98Å
423	H	85.7	Confident	76.9	Confident	78 Å²	78	46.5 Å²	46.5	36%	0.361	24%	0.241	S	C	.	.	H	α-helix	trans	-65.5	-38.4	175.2	-73.4	81.3	0	0	0	111.9	D419 L421 I425 N426 S427 Y482	D419-H423 WeakPolarHBondContact O-CB 3.22Å; D419-H423 PolarHBondContact O-N 3.16Å; D419-H423 PolarHBondContact O-ND1 3.46Å; L421-H423 VanDerWaalsContact C-N 3.35Å; L421-H423 PolarHBondContact O-N 2.85Å; H423-I425 PolarHBondContact O-N 3.41Å; H423-N426 PolarHBondContact O-N 3.39Å; H423-S427 WeakPolarHBondContact O-CB 3.38Å; H423-S427 PolarHBondContact O-N 2.77Å; H423-S427 PolarHBondContact O-OG 2.7Å; H423-Y482 HydrophobicContact CB-CD1 4.42Å; H423-Y482 HydrophobicContact CB-CE1 3.69Å; H423-Y482 HydrophobicContact CB-CE2 3.9Å; H423-Y482 WeakPolarHBondContact CB-OH 3.31Å
424	S	86.3	Confident	75.6	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60	-45.1	176.8	-56.4	0	0	0	0	111.8	L420 L421 L422 S427 T428 Y482	L420-S424 WeakPolarHBondContact O-CB 3.41Å; L420-S424 PolarHBondContact O-N 3.4Å; L420-S424 PolarHBondContact O-OG 2.84Å; L421-S424 WeakPolarHBondContact O-CB 3.08Å; L421-S424 PolarHBondContact O-N 2.9Å; L422-S424 VanDerWaalsContact C-N 3.34Å; S424-S427 PolarHBondContact O-OG 2.85Å; S424-T428 PolarHBondContact O-N 3.37Å; S424-T428 PolarHBondContact O-OG1 3.31Å; S424-Y482 WeakPolarHBondContact OG-CB 3.49Å; S424-Y482 WeakPolarHBondContact OG-CD1 3.36Å
425	I	80.5	Confident	74.8	Confident	2 Å²	2	52 Å²	52	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-71.5	-45.4	178.9	-61.5	-57.7	0	0	0	110.8	L421 L422 H423 S427 T428 I430 I433 V436 L454 I456 V475 A478	L421-I425 WeakPolarHBondContact O-CG1 3.47Å; L421-I425 PolarHBondContact O-N 2.84Å; L422-I425 PolarHBondContact O-N 2.93Å; H423-I425 PolarHBondContact O-N 3.41Å; I425-S427 VanDerWaalsContact C-N 3.3Å; I425-S427 PolarHBondContact O-N 3.36Å; I425-T428 PolarHBondContact O-N 3.02Å; I425-T428 VanDerWaalsContact O-N 3.12Å; I425-I430 HydrophobicContact CD1-CD1 4.38Å; I425-I430 HydrophobicContact CG2-CD1 4.3Å; I425-I433 HydrophobicContact CG2-CD1 3.56Å; I425-V436 HydrophobicContact CG2-CG1 4.42Å; I425-V436 HydrophobicContact CG2-CG2 3.79Å; I425-L454 HydrophobicContact CD1-CD1 4.43Å; I425-L454 HydrophobicContact CG1-CD1 4.14Å; I425-I456 HydrophobicContact CD1-CD1 4.42Å; I425-V475 HydrophobicContact CD1-CB 4.16Å; I425-V475 HydrophobicContact CD1-CG1 3.88Å; I425-V475 HydrophobicContact CD1-CG2 3.72Å; I425-A478 HydrophobicContact CD1-CB 4.19Å
426	N	74.3	Confident	74.1	Confident	113 Å²	113	49.5 Å²	49.5	60%	0.604	25%	0.254	S	S	*	.	H	α-helix	trans	-69.5	-25	-178.2	-70.1	-19.7	0	0	0	113.4	L422 H423 T428	L422-N426 VanDerWaalsContact O-CB 3.23Å; L422-N426 WeakPolarHBondContact O-CB 3.26Å; L422-N426 PolarHBondContact O-N 3.41Å; L422-N426 PolarHBondContact O-ND2 2.75Å; H423-N426 PolarHBondContact O-N 3.39Å; N426-T428 VanDerWaalsContact C-N 3.32Å
427	S	68.1	Low	73.1	Confident	77 Å²	77	49.9 Å²	49.9	54%	0.538	26%	0.259	S	S	.	.	H	α-helix	trans	-77.2	-21.6	173.5	66.3	0	0	0	0	112.5	H423 S424 I425	H423-S427 WeakPolarHBondContact O-CB 3.38Å; H423-S427 PolarHBondContact O-N 2.77Å; H423-S427 PolarHBondContact O-OG 2.7Å; S424-S427 PolarHBondContact O-OG 2.85Å; I425-S427 VanDerWaalsContact C-N 3.3Å; I425-S427 PolarHBondContact O-N 3.36Å
428	T	65.5	Low	72.4	Confident	37 Å²	37	50.9 Å²	50.9	23%	0.227	27%	0.266	C	S	.	.	S	Bend	trans	-92.5	125.1	180	-50.2	0	0	0	0	109	S424 I425 N426 I430 A478	S424-T428 PolarHBondContact O-N 3.37Å; S424-T428 PolarHBondContact O-OG1 3.31Å; I425-T428 PolarHBondContact O-N 3.02Å; I425-T428 VanDerWaalsContact O-N 3.12Å; N426-T428 VanDerWaalsContact C-N 3.32Å; T428-I430 VanDerWaalsContact C-N 3.27Å; T428-I430 HydrophobicContact CG2-CD1 4.47Å; T428-I430 HydrophobicContact CG2-CG1 3.95Å; T428-I430 PolarHBondContact O-N 2.99Å; T428-A478 HydrophobicContact CG2-CB 4.11Å; T428-A478 WeakPolarHBondContact OG1-CA 3.33Å; T428-A478 WeakPolarHBondContact OG1-CB 3.38Å
429	Y	56.5	Low	71.5	Confident	167 Å²	167	53 Å²	53	66%	0.655	28%	0.279	S	S	*	.			trans	-72.5	84.7	175.7	-170.5	-98.6	0	0	0	110.3	E350 K431	E350-Y429 PolarHBondContact OE1-OH 2.67Å; Y429-K431 HydrophobicContact CE1-CB 4.24Å
430	I	60.6	Low	70.4	Confident	17 Å²	17	50.3 Å²	50.3	9%	0.087	27%	0.265	C	S	.	.			trans	-96.6	103.2	170.8	-54.1	177.3	0	0	0	107.3	I425 T428 G432 I433 V470 T474	I425-I430 HydrophobicContact CD1-CD1 4.38Å; I425-I430 HydrophobicContact CG2-CD1 4.3Å; T428-I430 VanDerWaalsContact C-N 3.27Å; T428-I430 HydrophobicContact CG2-CD1 4.47Å; T428-I430 HydrophobicContact CG2-CG1 3.95Å; T428-I430 PolarHBondContact O-N 2.99Å; I430-G432 PolarHBondContact O-N 2.98Å; I430-I433 HydrophobicContact CB-CD1 3.54Å; I430-I433 HydrophobicContact CB-CG1 3.95Å; I430-I433 HydrophobicContact CD1-CD1 3.91Å; I430-I433 HydrophobicContact CG1-CD1 4.24Å; I430-I433 HydrophobicContact CG2-CD1 3.74Å; I430-I433 HydrophobicContact CG2-CG1 3.8Å; I430-V470 HydrophobicContact CG2-CG2 3.98Å; I430-T474 HydrophobicContact CD1-CG2 3.59Å; I430-T474 HydrophobicContact CG1-CG2 3.73Å; I430-T474 HydrophobicContact CG2-CG2 4.5Å
431	K	53.4	Low	68.8	Low	134 Å²	134	51.2 Å²	51.2	58%	0.583	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	132.6	-177.3	-168.1	178.7	-177.4	-177.4	0	110.7	Y429 A468	Y429-K431 HydrophobicContact CE1-CB 4.24Å; K431-A468 HydrophobicContact CB-CB 4.01Å
432	G	55.8	Low	67	Low	15 Å²	15	51.9 Å²	51.9	16%	0.155	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	0.3	171.8	0	0	0	0	0	115.6	I430 I434 Y458 S459	I430-G432 PolarHBondContact O-N 2.98Å; G432-I434 PolarHBondContact O-N 2.75Å; G432-Y458 CarbonylContact O-C 3.54Å; G432-Y458 WeakPolarHBondContact O-CA 3.29Å; G432-S459 WeakPolarHBondContact CA-OG 3.44Å; G432-S459 PolarHBondContact O-N 3.1Å; G432-S459 PolarHBondContact O-OG 2.97Å
433	I	63.7	Low	66	Low	47 Å²	47	50.5 Å²	50.5	24%	0.241	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	123.3	170.8	-67.9	-171.9	0	0	0	109.7	I425 I430 V436 I456 D457 V470	I425-I433 HydrophobicContact CG2-CD1 3.56Å; I430-I433 HydrophobicContact CB-CD1 3.54Å; I430-I433 HydrophobicContact CB-CG1 3.95Å; I430-I433 HydrophobicContact CD1-CD1 3.91Å; I430-I433 HydrophobicContact CG1-CD1 4.24Å; I430-I433 HydrophobicContact CG2-CD1 3.74Å; I430-I433 HydrophobicContact CG2-CG1 3.8Å; I433-V436 HydrophobicContact CD1-CG2 4.3Å; I433-V436 HydrophobicContact CG2-CG2 3.41Å; I433-V436 VanDerWaalsContact CG2-CG2 3.41Å; I433-I456 HydrophobicContact CD1-CG2 3.76Å; I433-I456 HydrophobicContact CG1-CG2 3.77Å; I433-I456 HydrophobicContact CG2-CG2 4.23Å; I433-D457 CarbonylContact C-O 3.57Å; I433-V470 HydrophobicContact CG1-CG2 4.49Å
434	I	58.7	Low	64.8	Low	78 Å²	78	48 Å²	48	40%	0.4	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-47.2	177.4	-60.5	167.8	0	0	0	109.7	V352 T378 G432 D457	V352-I434 HydrophobicContact CG1-CD1 4.41Å; V352-I434 HydrophobicContact CG1-CG1 4.23Å; T378-I434 HydrophobicContact CG2-CD1 3.84Å; G432-I434 PolarHBondContact O-N 2.75Å; I434-D457 HydrophobicContact CB-CB 4.18Å; I434-D457 PolarHBondContact N-O 3.27Å
435	N	63.8	Low	63.3	Low	73 Å²	73	54.8 Å²	54.8	39%	0.39	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	146	-176.2	-174.4	26.2	0	0	0	110.2	I456 D457	N435-I456 CarbonylContact O-C 3.48Å; N435-I456 WeakPolarHBondContact O-CA 3.48Å; N435-D457 HydrophobicContact CB-CB 4.29Å; N435-D457 PolarHBondContact N-O 2.83Å; N435-D457 PolarHBondContact O-N 2.91Å
436	V	69.8	Low	62.4	Low	18 Å²	18	56.9 Å²	56.9	11%	0.109	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	121.7	172.8	-171.9	0	0	0	0	108.4	L422 I425 I433 L454 V455 I456	L422-V436 HydrophobicContact CD2-CB 4.1Å; L422-V436 HydrophobicContact CD2-CG1 3.74Å; L422-V436 WeakPolarHBondContact CD2-O 3.43Å; I425-V436 HydrophobicContact CG2-CG1 4.42Å; I425-V436 HydrophobicContact CG2-CG2 3.79Å; I433-V436 HydrophobicContact CD1-CG2 4.3Å; I433-V436 HydrophobicContact CG2-CG2 3.41Å; I433-V436 VanDerWaalsContact CG2-CG2 3.41Å; V436-L454 HydrophobicContact CG1-CD2 3.85Å; V436-V455 CarbonylContact C-O 3.59Å; V436-V455 VanDerWaalsContact CA-O 3.32Å; V436-V455 WeakPolarHBondContact CA-O 3.38Å; V436-I456 HydrophobicContact CG1-CG1 3.96Å; V436-I456 HydrophobicContact CG2-CG1 4.23Å; V436-I456 HydrophobicContact CG2-CG2 4.34Å
437	T	67.5	Low	61.7	Low	51 Å²	51	54.3 Å²	54.3	31%	0.313	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	142.1	171.7	63.8	0	0	0	0	109.6	L454 V455	T437-L454 CarbonylContact O-C 3.55Å; T437-L454 VanDerWaalsContact O-CA 3.3Å; T437-L454 WeakPolarHBondContact O-CA 3.47Å; T437-V455 PolarHBondContact N-O 2.83Å; T437-V455 PolarHBondContact O-N 2.83Å; T437-V455 WeakPolarHBondContact OG1-CB 3.3Å
438	C	73.2	Confident	62	Low	23 Å²	23	50.6 Å²	50.6	16%	0.155	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.8	174.6	174.1	0	0	0	0	110.1	C418 L422 M453 L454	C418-C438 WeakPolarHBondContact CA-SG 3.45Å; C418-C438 HydrophobicContact CB-CB 3.61Å; C418-C438 WeakPolarHBondContact CB-SG 3.48Å; C418-C438 WeakPolarHBondContact SG-CB 3.31Å; C418-C438 CovalentContact SG-SG 2.06Å; C418-C438 PolarHBondContact SG-SG 2.92Å; L422-C438 HydrophobicContact CD1-CB 4.31Å; L422-C438 HydrophobicContact CD2-CB 4.12Å; L422-C438 HydrophobicContact CG-CB 3.98Å; C438-M453 CarbonylContact C-O 3.57Å; C438-M453 WeakPolarHBondContact CA-O 3.4Å; C438-L454 HydrophobicContact CB-CD2 3.91Å
439	T	65	Low	62.2	Low	60 Å²	60	51.4 Å²	51.4	37%	0.368	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127.3	172.2	-61.5	0	0	0	0	109.8	V441 A452 M453	T439-V441 PolarHBondContact O-N 3.37Å; T439-A452 CarbonylContact O-C 3.54Å; T439-A452 WeakPolarHBondContact O-CA 3.27Å; T439-M453 PolarHBondContact N-O 3.06Å; T439-M453 PolarHBondContact O-N 3.37Å
440	V	66.8	Low	62.9	Low	16 Å²	16	43.5 Å²	43.5	10%	0.097	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	115.2	170.9	177.3	0	0	0	0	109.5	S414 I417 G442 F443 N451 A452	S414-V440 WeakPolarHBondContact O-CG2 3.35Å; I417-V440 HydrophobicContact CB-CG2 4.06Å; I417-V440 HydrophobicContact CG2-CG2 3.88Å; V440-G442 VanDerWaalsContact C-N 3.35Å; V440-F443 HydrophobicContact CG1-CE1 4.4Å; V440-F443 HydrophobicContact CG1-CE2 4.14Å; V440-F443 HydrophobicContact CG1-CZ 3.88Å; V440-N451 CarbonylContact C-O 3.56Å; V440-A452 HydrophobicContact CG2-CB 4.41Å
441	V	55.4	Low	63.2	Low	25 Å²	25	43.8 Å²	43.8	15%	0.152	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	-34.4	-178.8	-177.1	0	0	0	0	110.8	T439 N451 M453 Q637 L638	T439-V441 PolarHBondContact O-N 3.37Å; V441-N451 HydrophobicContact CB-CB 4.18Å; V441-N451 PolarHBondContact N-O 3.16Å; V441-M453 HydrophobicContact CG2-CB 4.17Å; V441-Q637 PolarHBondContact O-NE2 2.71Å; V441-L638 HydrophobicContact CG2-CD1 4.11Å
442	G	49.9	Very low	63.8	Low	13 Å²	13	37.5 Å²	37.5	13%	0.134	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.3	-175.6	174.4	0	0	0	0	0	113.4	V440 N451	V440-G442 VanDerWaalsContact C-N 3.35Å; G442-N451 PolarHBondContact N-O 3.27Å; G442-N451 PolarHBondContact O-N 3.22Å; G442-N451 PolarHBondContact O-ND2 3.44Å
443	F	65	Low	64.2	Low	16 Å²	16	37.1 Å²	37.1	7%	0.07	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	140.9	-178	-54.9	-83.8	0	0	0	111.5	L389 W398 L402 Y410 Y413 I417 V440 V448 I449	L389-F443 HydrophobicContact CD1-CD1 3.93Å; L389-F443 HydrophobicContact CD1-CE1 3.75Å; W398-F443 HydrophobicContact CH2-CB 4.39Å; W398-F443 HydrophobicContact CZ3-CB 4.01Å; L402-F443 HydrophobicContact CB-CB 4.07Å; L402-F443 HydrophobicContact CB-CD2 4.13Å; L402-F443 HydrophobicContact CB-CG 4.26Å; L402-F443 HydrophobicContact CD1-CB 4.38Å; L402-F443 HydrophobicContact CD1-CG 4.42Å; L402-F443 HydrophobicContact CD2-CD2 3.96Å; L402-F443 HydrophobicContact CD2-CE2 4.14Å; L402-F443 HydrophobicContact CD2-CG 4.24Å; Y410-F443 HydrophobicContact CD1-CE2 4.22Å; Y410-F443 AromaticContact CD2-CD2 3.53Å; Y410-F443 HydrophobicContact CD2-CD2 3.53Å; Y410-F443 AromaticContact CD2-CE2 3.5Å; Y410-F443 HydrophobicContact CD2-CE2 3.5Å; Y410-F443 HydrophobicContact CE1-CE2 4.28Å; Y410-F443 AromaticContact CE2-CD2 3.52Å; Y410-F443 HydrophobicContact CE2-CD2 3.52Å; Y410-F443 AromaticContact CE2-CE2 3.58Å; Y410-F443 HydrophobicContact CE2-CE2 3.58Å; Y410-F443 HydrophobicContact CG-CD2 4.3Å; Y410-F443 AromaticContact CG-CE2 3.83Å; Y410-F443 HydrophobicContact CG-CE2 3.83Å; Y410-F443 AromaticContact CZ-CE2 3.96Å; Y413-F443 VanDerWaalsContact CB-CZ 3.47Å; Y413-F443 HydrophobicContact CD2-CE1 4.22Å; I417-F443 HydrophobicContact CD1-CE1 3.58Å; I417-F443 HydrophobicContact CD1-CZ 4.16Å; V440-F443 HydrophobicContact CG1-CE1 4.4Å; V440-F443 HydrophobicContact CG1-CE2 4.14Å; V440-F443 HydrophobicContact CG1-CZ 3.88Å; F443-V448 HydrophobicContact CB-CG1 4.29Å; F443-V448 HydrophobicContact CD1-CG1 3.84Å; F443-V448 HydrophobicContact CG-CG1 4.4Å; F443-I449 VanDerWaalsContact CA-O 3.26Å; F443-I449 WeakPolarHBondContact CA-O 3.22Å
444	S	60.3	Low	64.5	Low	27 Å²	27	34.9 Å²	34.9	19%	0.189	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	144.4	179.9	-52.1	0	0	0	0	112.9	W398 I449 N451 Q634	W398-S444 VanDerWaalsContact CZ3-O 3.24Å; W398-S444 WeakPolarHBondContact CZ3-O 3.45Å; S444-I449 PolarHBondContact N-O 2.98Å; S444-I449 PolarHBondContact O-N 2.91Å; S444-N451 PolarHBondContact OG-ND2 2.78Å; S444-Q634 PolarHBondContact OG-NE2 2.89Å
445	R	56.3	Low	64.6	Low	141 Å²	141	31.5 Å²	31.5	53%	0.532	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	133.1	177.4	-87.1	-177.5	171.4	179.6	-1	111.7	W398 D400	W398-R445 HydrophobicContact CD2-CB 4.33Å; W398-R445 HydrophobicContact CD2-CG 3.66Å; W398-R445 HydrophobicContact CE3-CG 4.21Å; W398-R445 HydrophobicContact CG-CG 4.12Å; W398-R445 HydrophobicContact CH2-CG 4.03Å; W398-R445 HydrophobicContact CZ2-CG 3.46Å; W398-R445 VanDerWaalsContact CZ2-CG 3.46Å; W398-R445 HydrophobicContact CZ3-CG 4.38Å; D400-R445 IonicContact OD1-CZ 3.93Å; D400-R445 IonicContact OD1-NE 3.32Å; D400-R445 IonicContact OD1-NH2 2.79Å; D400-R445 PolarHBondContact OD1-NH2 3.2Å; D400-R445 IonicContact OD2-NH2 3.64Å
446	G	60.8	Low	64.9	Low	46 Å²	46	28 Å²	28	47%	0.474	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	142.9	-146.5	-175.1	0	0	0	0	0	110.7	V448	G446-V448 PolarHBondContact O-N 3.25Å
447	S	60.6	Low	64.6	Low	59 Å²	59	28.3 Å²	28.3	41%	0.413	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	112	154	-54.7	0	0	0	0	106.2	I449	S447-I449 VanDerWaalsContact O-CG1 3.26Å; S447-I449 WeakPolarHBondContact O-CG1 3.31Å; S447-I449 PolarHBondContact O-N 3.14Å
448	V	73.9	Confident	64.4	Low	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-37.9	108.7	-163.8	-179.5	0	0	0	0	111.2	L389 L396 E397 W398 L402 Y413 F443 G446	L389-V448 HydrophobicContact CB-CB 4.49Å; L389-V448 VanDerWaalsContact CB-O 3.3Å; L389-V448 WeakPolarHBondContact CB-O 3.45Å; L389-V448 HydrophobicContact CD1-CB 4.48Å; L389-V448 HydrophobicContact CD1-CG1 3.73Å; L389-V448 HydrophobicContact CG-CG1 4.41Å; L389-V448 WeakPolarHBondContact CG-O 3.24Å; L389-V448 PolarHBondContact N-O 3.49Å; L396-V448 HydrophobicContact CB-CB 4.02Å; L396-V448 HydrophobicContact CB-CG2 3.86Å; L396-V448 PolarHBondContact O-N 3.06Å; L396-V448 VanDerWaalsContact O-N 3.15Å; E397-V448 VanDerWaalsContact O-CG2 3.25Å; E397-V448 WeakPolarHBondContact O-CG2 3.35Å; W398-V448 HydrophobicContact CE3-CG2 4.28Å; L402-V448 HydrophobicContact CD1-CB 4.4Å; L402-V448 HydrophobicContact CD1-CG1 3.55Å; L402-V448 HydrophobicContact CD1-CG2 3.85Å; Y413-V448 HydrophobicContact CD2-CG1 4.44Å; Y413-V448 HydrophobicContact CE2-CG1 4.42Å; F443-V448 HydrophobicContact CB-CG1 4.29Å; F443-V448 HydrophobicContact CD1-CG1 3.84Å; F443-V448 HydrophobicContact CG-CG1 4.4Å; G446-V448 PolarHBondContact O-N 3.25Å
449	I	70.1	Confident	63.7	Low	54 Å²	54	26.9 Å²	26.9	28%	0.277	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	120	179.8	-56	178.8	0	0	0	107.3	S387 F443 S444 S447	S387-I449 WeakPolarHBondContact O-CA 3.37Å; F443-I449 VanDerWaalsContact CA-O 3.26Å; F443-I449 WeakPolarHBondContact CA-O 3.22Å; S444-I449 PolarHBondContact N-O 2.98Å; S444-I449 PolarHBondContact O-N 2.91Å; S447-I449 VanDerWaalsContact O-CG1 3.26Å; S447-I449 WeakPolarHBondContact O-CG1 3.31Å; S447-I449 PolarHBondContact O-N 3.14Å
450	G	70	Confident	62.9	Low	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	131.2	173.3	0	0	0	0	0	109.6	S386 S387	S386-G450 VanDerWaalsContact CA-O 3.29Å; S386-G450 WeakPolarHBondContact CA-O 3.39Å; S387-G450 PolarHBondContact N-O 2.82Å; S387-G450 PolarHBondContact O-N 3.29Å
451	N	66.4	Low	61.8	Low	23 Å²	23	30.2 Å²	30.2	12%	0.123	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	118.8	174	-51	-82	0	0	0	108	S386 V440 V441 G442 S444	S386-N451 WeakPolarHBondContact CB-OD1 3.41Å; V440-N451 CarbonylContact C-O 3.56Å; V441-N451 HydrophobicContact CB-CB 4.18Å; V441-N451 PolarHBondContact N-O 3.16Å; G442-N451 PolarHBondContact N-O 3.27Å; G442-N451 PolarHBondContact O-N 3.22Å; G442-N451 PolarHBondContact O-ND2 3.44Å; S444-N451 PolarHBondContact OG-ND2 2.78Å
452	A	66.4	Low	60.7	Low	2 Å²	2	31.5 Å²	31.5	2%	0.017	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.9	-179.5	0	0	0	0	0	110.9	T384 V385 I417 L421 T439 V440 F496	T384-A452 CarbonylContact C-O 3.54Å; T384-A452 WeakPolarHBondContact CA-O 3.28Å; V385-A452 PolarHBondContact N-O 2.93Å; V385-A452 PolarHBondContact O-N 3.25Å; I417-A452 HydrophobicContact CG2-CB 3.82Å; L421-A452 HydrophobicContact CD1-CB 3.49Å; L421-A452 VanDerWaalsContact CD1-CB 3.49Å; T439-A452 CarbonylContact O-C 3.54Å; T439-A452 WeakPolarHBondContact O-CA 3.27Å; V440-A452 HydrophobicContact CG2-CB 4.41Å; A452-F496 HydrophobicContact CB-CZ 4.31Å
453	M	65.6	Low	59.8	Low	7 Å²	7	39.4 Å²	39.4	3%	0.034	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	130.4	176.5	180	178.7	69.8	0	0	108.7	I382 I383 C438 T439 V441 V455 L638 L642	I382-M453 HydrophobicContact CG2-CG 3.93Å; I382-M453 HydrophobicContact CG2-SD 3.89Å; I383-M453 CarbonylContact O-C 3.59Å; I383-M453 WeakPolarHBondContact O-CA 3.02Å; C438-M453 CarbonylContact C-O 3.57Å; C438-M453 WeakPolarHBondContact CA-O 3.4Å; T439-M453 PolarHBondContact N-O 3.06Å; T439-M453 PolarHBondContact O-N 3.37Å; V441-M453 HydrophobicContact CG2-CB 4.17Å; M453-V455 HydrophobicContact CE-CG2 4.09Å; M453-L638 HydrophobicContact CB-CD1 4.04Å; M453-L638 HydrophobicContact CG-CD1 4Å; M453-L638 HydrophobicContact SD-CD1 3.3Å; M453-L638 WeakPolarHBondContact SD-CD1 3.38Å; M453-L638 HydrophobicContact SD-CG 4.35Å; M453-L642 HydrophobicContact CE-CD2 4.1Å; M453-L642 HydrophobicContact SD-CD2 3.45Å; M453-L642 WeakPolarHBondContact SD-CD2 3.35Å; M453-L642 HydrophobicContact SD-CG 4.08Å
454	L	68.8	Low	58.1	Low	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	129.3	169.9	-71.8	167	0	0	0	108.9	I382 I383 V385 L421 I425 V436 T437 C438 I456 V475	I382-L454 CarbonylContact C-O 3.56Å; I382-L454 WeakPolarHBondContact CA-O 3.3Å; I383-L454 HydrophobicContact CB-CB 4.37Å; I383-L454 PolarHBondContact N-O 3.49Å; I383-L454 PolarHBondContact O-N 2.68Å; V385-L454 HydrophobicContact CG2-CD1 4.07Å; L421-L454 HydrophobicContact CB-CD1 4.24Å; L421-L454 HydrophobicContact CB-CD2 3.95Å; L421-L454 HydrophobicContact CB-CG 4.39Å; L421-L454 HydrophobicContact CD1-CD1 4.44Å; L421-L454 HydrophobicContact CD1-CG 4.3Å; L421-L454 HydrophobicContact CD2-CD1 4.38Å; I425-L454 HydrophobicContact CD1-CD1 4.43Å; I425-L454 HydrophobicContact CG1-CD1 4.14Å; V436-L454 HydrophobicContact CG1-CD2 3.85Å; T437-L454 CarbonylContact O-C 3.55Å; T437-L454 VanDerWaalsContact O-CA 3.3Å; T437-L454 WeakPolarHBondContact O-CA 3.47Å; C438-L454 HydrophobicContact CB-CD2 3.91Å; L454-I456 HydrophobicContact CB-CG1 4.4Å; L454-V475 HydrophobicContact CD1-CG1 4.12Å
455	V	61.9	Low	56.6	Low	7 Å²	7	52.8 Å²	52.8	4%	0.042	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	115	167.4	-173.1	0	0	0	0	106.6	T380 I382 V436 T437 M453	T380-V455 HydrophobicContact CG2-CG1 3.51Å; I382-V455 HydrophobicContact CG1-CG1 4.12Å; I382-V455 HydrophobicContact CG1-CG2 4.2Å; V436-V455 CarbonylContact C-O 3.59Å; V436-V455 VanDerWaalsContact CA-O 3.32Å; V436-V455 WeakPolarHBondContact CA-O 3.38Å; T437-V455 PolarHBondContact N-O 2.83Å; T437-V455 PolarHBondContact O-N 2.83Å; T437-V455 WeakPolarHBondContact OG1-CB 3.3Å; M453-V455 HydrophobicContact CE-CG2 4.09Å
456	I	69.6	Low	55.3	Low	0 Å²	0	52.4 Å²	52.4	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	106.9	-176.2	-58.9	170.9	0	0	0	107.2	T380 A381 I383 I425 I433 N435 V436 L454 V470 V475	T380-I456 CarbonylContact C-O 3.57Å; T380-I456 WeakPolarHBondContact CA-O 3.08Å; A381-I456 HydrophobicContact CB-CB 4.35Å; A381-I456 PolarHBondContact N-O 2.89Å; A381-I456 PolarHBondContact O-N 2.98Å; I383-I456 HydrophobicContact CD1-CD1 4.03Å; I425-I456 HydrophobicContact CD1-CD1 4.42Å; I433-I456 HydrophobicContact CD1-CG2 3.76Å; I433-I456 HydrophobicContact CG1-CG2 3.77Å; I433-I456 HydrophobicContact CG2-CG2 4.23Å; N435-I456 CarbonylContact O-C 3.48Å; N435-I456 WeakPolarHBondContact O-CA 3.48Å; V436-I456 HydrophobicContact CG1-CG1 3.96Å; V436-I456 HydrophobicContact CG2-CG1 4.23Å; V436-I456 HydrophobicContact CG2-CG2 4.34Å; L454-I456 HydrophobicContact CB-CG1 4.4Å; I456-V470 HydrophobicContact CB-CG1 4.47Å; I456-V470 HydrophobicContact CD1-CG1 3.66Å; I456-V470 HydrophobicContact CG2-CG1 4.22Å; I456-V470 HydrophobicContact CG2-CG2 3.98Å; I456-V475 HydrophobicContact CD1-CG2 3.98Å
457	D	63.1	Low	53.8	Low	25 Å²	25	53.7 Å²	53.7	13%	0.134	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	130.7	168.9	-62.4	-45.6	0	0	0	107.9	K379 T380 I433 I434 N435 K649	K379-D457 CarbonylContact O-C 3.55Å; K379-D457 WeakPolarHBondContact O-CA 3.21Å; T380-D457 WeakPolarHBondContact CB-OD1 3.21Å; T380-D457 VanDerWaalsContact CG2-OD1 3.28Å; T380-D457 WeakPolarHBondContact CG2-OD1 3.37Å; T380-D457 PolarHBondContact OG1-OD1 2.7Å; I433-D457 CarbonylContact C-O 3.57Å; I434-D457 HydrophobicContact CB-CB 4.18Å; I434-D457 PolarHBondContact N-O 3.27Å; N435-D457 HydrophobicContact CB-CB 4.29Å; N435-D457 PolarHBondContact N-O 2.83Å; N435-D457 PolarHBondContact O-N 2.91Å; D457-K649 IonicContact OD1-NZ 2.92Å; D457-K649 PolarHBondContact OD1-NZ 2.89Å; D457-K649 IonicContact OD2-NZ 3.92Å
458	Y	64.4	Low	53	Low	5 Å²	5	53.3 Å²	53.3	2%	0.02	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	148.2	-178.4	70.2	-78.9	0	0	0	112	K379 A381 G432 V470 D509	K379-Y458 HydrophobicContact CB-CD1 3.98Å; K379-Y458 HydrophobicContact CB-CD2 4.22Å; K379-Y458 HydrophobicContact CB-CE1 3.46Å; K379-Y458 VanDerWaalsContact CB-CE1 3.46Å; K379-Y458 HydrophobicContact CB-CE2 3.77Å; K379-Y458 HydrophobicContact CB-CG 4.33Å; K379-Y458 HydrophobicContact CD-CE2 3.89Å; K379-Y458 VanDerWaalsContact CD-OH 3.31Å; K379-Y458 WeakPolarHBondContact CD-OH 3.17Å; K379-Y458 HydrophobicContact CG-CE2 4.44Å; K379-Y458 PolarHBondContact N-O 2.64Å; K379-Y458 VanDerWaalsContact O-CD1 3.28Å; K379-Y458 WeakPolarHBondContact O-CD1 3.08Å; K379-Y458 PolarHBondContact O-N 3.29Å; A381-Y458 HydrophobicContact CB-CD1 4.13Å; A381-Y458 HydrophobicContact CB-CE1 3.69Å; G432-Y458 CarbonylContact O-C 3.54Å; G432-Y458 WeakPolarHBondContact O-CA 3.29Å; Y458-V470 HydrophobicContact CD1-CB 4.45Å; Y458-V470 HydrophobicContact CD1-CG2 3.85Å; Y458-V470 HydrophobicContact CD2-CG2 4.19Å; Y458-V470 HydrophobicContact CE1-CB 4.49Å; Y458-V470 HydrophobicContact CE1-CG2 4.32Å; Y458-V470 HydrophobicContact CG-CG2 3.78Å; Y458-D509 PolarHBondContact OH-OD1 2.79Å; Y458-D509 PolarHBondContact OH-OD2 3.16Å
459	S	56.8	Low	52	Low	39 Å²	39	57 Å²	57	27%	0.273	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	134.3	177.2	50.6	0	0	0	0	110.9	G432	G432-S459 WeakPolarHBondContact CA-OG 3.44Å; G432-S459 PolarHBondContact O-N 3.1Å; G432-S459 PolarHBondContact O-OG 2.97Å
460	S	48.9	Very low	51.5	Low	28 Å²	28	54.6 Å²	54.6	20%	0.196	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	117.9	167.4	75.9	0	0	0	0	110.5	L377 K379	L377-S460 PolarHBondContact N-O 2.98Å; L377-S460 VanDerWaalsContact N-O 3.14Å; L377-S460 PolarHBondContact O-N 3.28Å; L377-S460 PolarHBondContact O-OG 3.2Å; K379-S460 WeakPolarHBondContact CD-OG 3.17Å; K379-S460 WeakPolarHBondContact CE-OG 3.28Å; K379-S460 WeakPolarHBondContact CG-OG 3.43Å
461	T	43.6	Very low	51.3	Low	118 Å²	118	57.1 Å²	57.1	72%	0.724	33%	0.333	S	S	*	.			trans	-92.5	133.6	170	52.5	0	0	0	0	109.2
462	S	33.1	Very low	51.3	Low	51 Å²	51	59.6 Å²	59.6	36%	0.357	34%	0.344	S	S	.	.	S	Bend	trans	-58.7	139.6	-170.9	49.4	0	0	0	0	115.1
463	E	31.4	Very low	51.5	Low	180 Å²	180	64.5 Å²	64.5	84%	0.841	37%	0.37	S	S	*	.	S	Bend	trans	82.3	-9.5	148.4	-70.2	-171.3	179.4	0	0	123.7
464	N	28.3	Very low	51.9	Low	145 Å²	145	66.1 Å²	66.1	78%	0.775	38%	0.38	S	S	*	.	S	Bend	trans	-141.3	13.4	-175.8	-91.5	-42.8	0	0	0	121.1
465	F	29.3	Very low	52.3	Low	179 Å²	179	66.1 Å²	66.1	79%	0.785	38%	0.38	S	S	*	.			trans	-132.7	114.9	176.5	-83.5	-85.8	0	0	0	114.8	S467	F465-S467 PolarHBondContact O-N 3.4Å
466	S	29.2	Very low	53.3	Low	132 Å²	132	69.4 Å²	69.4	92%	0.923	39%	0.392	S	S	*	.			trans	-70.3	34.8	165.5	64.5	0	0	0	0	113
467	S	29.4	Very low	53.9	Low	74 Å²	74	74.3 Å²	74.3	52%	0.517	42%	0.418	S	S	.	.	S	Bend	trans	-147.8	115.8	-172.1	59.1	0	0	0	0	111.7	F465	F465-S467 PolarHBondContact O-N 3.4Å
468	A	43.3	Very low	54.9	Low	50 Å²	50	73.2 Å²	73.2	41%	0.413	41%	0.412	S	S	.	.			trans	85.8	47.2	179.4	0	0	0	0	0	116.9	K431	K431-A468 HydrophobicContact CB-CB 4.01Å
469	V	51.6	Low	55.9	Low	77 Å²	77	73 Å²	73	47%	0.467	41%	0.411	S	S	.	.			trans	-77.6	133.5	152.3	178.7	0	0	0	0	107.1	T471	V469-T471 VanDerWaalsContact C-N 3.31Å; V469-T471 HydrophobicContact CB-CG2 4.06Å; V469-T471 HydrophobicContact CG1-CG2 3.99Å; V469-T471 PolarHBondContact O-N 2.95Å
470	V	61.1	Low	57.3	Low	4 Å²	4	74 Å²	74	2%	0.024	42%	0.416	C	S	.	.			trans	-66.6	94.8	169.2	-173.7	0	0	0	0	107.5	A381 I383 I430 I433 I456 Y458 V475	A381-V470 HydrophobicContact CB-CB 4.06Å; A381-V470 HydrophobicContact CB-CG1 4.12Å; I383-V470 HydrophobicContact CD1-CG1 3.82Å; I430-V470 HydrophobicContact CG2-CG2 3.98Å; I433-V470 HydrophobicContact CG1-CG2 4.49Å; I456-V470 HydrophobicContact CB-CG1 4.47Å; I456-V470 HydrophobicContact CD1-CG1 3.66Å; I456-V470 HydrophobicContact CG2-CG1 4.22Å; I456-V470 HydrophobicContact CG2-CG2 3.98Å; Y458-V470 HydrophobicContact CD1-CB 4.45Å; Y458-V470 HydrophobicContact CD1-CG2 3.85Å; Y458-V470 HydrophobicContact CD2-CG2 4.19Å; Y458-V470 HydrophobicContact CE1-CB 4.49Å; Y458-V470 HydrophobicContact CE1-CG2 4.32Å; Y458-V470 HydrophobicContact CG-CG2 3.78Å; V470-V475 HydrophobicContact CG1-CG2 3.98Å
471	T	64.9	Low	59	Low	54 Å²	54	79.3 Å²	79.3	33%	0.331	44%	0.438	S	S	.	.			trans	-98.5	161.2	178.8	61.5	0	0	0	0	111.4	V469 D473 T474 V475	V469-T471 VanDerWaalsContact C-N 3.31Å; V469-T471 HydrophobicContact CB-CG2 4.06Å; V469-T471 HydrophobicContact CG1-CG2 3.99Å; V469-T471 PolarHBondContact O-N 2.95Å; T471-D473 PolarHBondContact O-N 3.19Å; T471-T474 WeakPolarHBondContact O-CB 3.37Å; T471-T474 PolarHBondContact O-N 3.12Å; T471-T474 PolarHBondContact OG1-N 2.86Å; T471-T474 PolarHBondContact OG1-OG1 2.96Å; T471-V475 PolarHBondContact O-N 3.01Å; T471-V475 VanDerWaalsContact O-N 3.11Å
472	E	66.4	Low	61.1	Low	75 Å²	75	75.5 Å²	75.5	35%	0.35	41%	0.41	S	S	.	.	H	α-helix	trans	-48.9	-43.1	168.8	-61.8	-177.8	171	0	0	111.7	V475 R476 I504 E505 T506	E472-V475 PolarHBondContact O-N 3.12Å; E472-R476 WeakPolarHBondContact O-CB 3.31Å; E472-R476 PolarHBondContact O-N 3.5Å; E472-I504 HydrophobicContact CB-CG2 4.41Å; E472-E505 WeakPolarHBondContact OE1-CA 3.5Å; E472-T506 WeakPolarHBondContact CG-OG1 3.28Å; E472-T506 PolarHBondContact OE1-N 2.75Å
473	D	71.2	Confident	63.7	Low	104 Å²	104	73.2 Å²	73.2	56%	0.556	39%	0.394	S	S	*	.	H	α-helix	trans	-65.9	-38.6	179.3	-72.2	-29	0	0	0	112.6	T471 R476 N477	T471-D473 PolarHBondContact O-N 3.19Å; D473-R476 PolarHBondContact O-N 3.2Å; D473-N477 WeakPolarHBondContact O-CB 3.46Å; D473-N477 PolarHBondContact O-N 2.82Å; D473-N477 PolarHBondContact O-ND2 3.05Å; D473-N477 VanDerWaalsContact O-ND2 3.15Å
474	T	74.1	Confident	66.3	Low	42 Å²	42	67.4 Å²	67.4	26%	0.258	38%	0.377	S	S	.	.	H	α-helix	trans	-64.3	-47.2	179.1	-54.3	0	0	0	0	110.2	I430 T471 N477 A478	I430-T474 HydrophobicContact CD1-CG2 3.59Å; I430-T474 HydrophobicContact CG1-CG2 3.73Å; I430-T474 HydrophobicContact CG2-CG2 4.5Å; T471-T474 WeakPolarHBondContact O-CB 3.37Å; T471-T474 PolarHBondContact O-N 3.12Å; T471-T474 PolarHBondContact OG1-N 2.86Å; T471-T474 PolarHBondContact OG1-OG1 2.96Å; T474-N477 PolarHBondContact O-N 3.21Å; T474-A478 WeakPolarHBondContact O-CB 3.18Å; T474-A478 PolarHBondContact O-N 3.3Å; T474-A478 VanDerWaalsContact O-N 3.08Å
475	V	77.2	Confident	69	Low	0 Å²	0	65.7 Å²	65.7	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-68.5	-37.5	176.7	172.1	0	0	0	0	112	I383 I425 L454 I456 V470 T471 E472 A478 V479 I504	I383-V475 HydrophobicContact CD1-CB 4.05Å; I383-V475 HydrophobicContact CD1-CG2 3.33Å; I383-V475 HydrophobicContact CG2-CB 4.49Å; I383-V475 HydrophobicContact CG2-CG1 4.05Å; I425-V475 HydrophobicContact CD1-CB 4.16Å; I425-V475 HydrophobicContact CD1-CG1 3.88Å; I425-V475 HydrophobicContact CD1-CG2 3.72Å; L454-V475 HydrophobicContact CD1-CG1 4.12Å; I456-V475 HydrophobicContact CD1-CG2 3.98Å; V470-V475 HydrophobicContact CG1-CG2 3.98Å; T471-V475 PolarHBondContact O-N 3.01Å; T471-V475 VanDerWaalsContact O-N 3.11Å; E472-V475 PolarHBondContact O-N 3.12Å; V475-A478 WeakPolarHBondContact O-CB 3.35Å; V475-A478 PolarHBondContact O-N 2.76Å; V475-V479 HydrophobicContact CG1-CG2 4.21Å; V475-V479 WeakPolarHBondContact O-CB 3.4Å; V475-V479 VanDerWaalsContact O-CG2 3.27Å; V475-V479 WeakPolarHBondContact O-CG2 3.26Å; V475-V479 PolarHBondContact O-N 2.76Å; V475-I504 HydrophobicContact CB-CG2 4.27Å; V475-I504 HydrophobicContact CG1-CD1 4.38Å; V475-I504 HydrophobicContact CG1-CG2 4.06Å
476	R	82.6	Confident	71.6	Confident	75 Å²	75	57.5 Å²	57.5	28%	0.283	33%	0.328	S	S	.	.	H	α-helix	trans	-60.4	-46.6	174.7	-179.4	-176.4	-63.1	-79.2	-0.6	112.4	E472 D473 V479 V480 L502 I504	E472-R476 WeakPolarHBondContact O-CB 3.31Å; E472-R476 PolarHBondContact O-N 3.5Å; D473-R476 PolarHBondContact O-N 3.2Å; R476-V479 PolarHBondContact O-N 3.04Å; R476-V480 HydrophobicContact CG-CG2 4.38Å; R476-V480 WeakPolarHBondContact O-CB 3.46Å; R476-V480 WeakPolarHBondContact O-CG2 3.26Å; R476-V480 PolarHBondContact O-N 2.92Å; R476-L502 PolarHBondContact NH1-O 3.14Å; R476-I504 HydrophobicContact CB-CD1 3.69Å; R476-I504 HydrophobicContact CG-CD1 4.13Å
477	N	82.6	Confident	74.2	Confident	104 Å²	104	53.8 Å²	53.8	56%	0.556	30%	0.3	S	S	*	.	H	α-helix	trans	-63.5	-46.1	178.7	-68.7	-23.5	0	0	0	110.9	D473 T474 V479 V480 E481	D473-N477 WeakPolarHBondContact O-CB 3.46Å; D473-N477 PolarHBondContact O-N 2.82Å; D473-N477 PolarHBondContact O-ND2 3.05Å; D473-N477 VanDerWaalsContact O-ND2 3.15Å; T474-N477 PolarHBondContact O-N 3.21Å; N477-V479 PolarHBondContact O-N 2.95Å; N477-V480 PolarHBondContact O-N 3.33Å; N477-E481 VanDerWaalsContact O-CB 3.29Å; N477-E481 WeakPolarHBondContact O-CB 3.39Å; N477-E481 PolarHBondContact O-N 3.02Å
478	A	83.2	Confident	76.8	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.008	31%	0.308	C	S	.	.	H	α-helix	trans	-53.5	-51.6	175.6	0	0	0	0	0	112.6	I425 T428 T474 V475 Y482	I425-A478 HydrophobicContact CD1-CB 4.19Å; T428-A478 HydrophobicContact CG2-CB 4.11Å; T428-A478 WeakPolarHBondContact OG1-CA 3.33Å; T428-A478 WeakPolarHBondContact OG1-CB 3.38Å; T474-A478 WeakPolarHBondContact O-CB 3.18Å; T474-A478 PolarHBondContact O-N 3.3Å; T474-A478 VanDerWaalsContact O-N 3.08Å; V475-A478 WeakPolarHBondContact O-CB 3.35Å; V475-A478 PolarHBondContact O-N 2.76Å; A478-Y482 WeakPolarHBondContact O-CB 3.49Å; A478-Y482 PolarHBondContact O-N 3.27Å; A478-Y482 VanDerWaalsContact O-N 3.11Å
479	V	85.9	Confident	78.8	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.9	-43.1	-178.6	172.7	0	0	0	0	111.5	L420 L421 V475 R476 N477 I483 L502 I504	L420-V479 HydrophobicContact CD2-CG1 4.34Å; L421-V479 HydrophobicContact CD2-CG1 4.27Å; L421-V479 HydrophobicContact CD2-CG2 3.69Å; V475-V479 HydrophobicContact CG1-CG2 4.21Å; V475-V479 WeakPolarHBondContact O-CB 3.4Å; V475-V479 VanDerWaalsContact O-CG2 3.27Å; V475-V479 WeakPolarHBondContact O-CG2 3.26Å; V475-V479 PolarHBondContact O-N 2.76Å; R476-V479 PolarHBondContact O-N 3.04Å; N477-V479 PolarHBondContact O-N 2.95Å; V479-I483 HydrophobicContact CG1-CD1 3.56Å; V479-I483 HydrophobicContact CG1-CG1 4.4Å; V479-I483 WeakPolarHBondContact O-CB 3.4Å; V479-I483 WeakPolarHBondContact O-CD1 3.26Å; V479-I483 WeakPolarHBondContact O-CG1 3.27Å; V479-I483 PolarHBondContact O-N 3.18Å; V479-L502 HydrophobicContact CG1-CD2 4.02Å; V479-I504 HydrophobicContact CB-CD1 4.42Å
480	V	86.3	Confident	80.2	Confident	61 Å²	61	56.3 Å²	56.3	37%	0.37	32%	0.323	S	S	.	.	H	α-helix	trans	-66.3	-40.8	179.9	170.7	0	0	0	0	111.6	R476 N477 I483 A484 T498 L502	R476-V480 HydrophobicContact CG-CG2 4.38Å; R476-V480 WeakPolarHBondContact O-CB 3.46Å; R476-V480 WeakPolarHBondContact O-CG2 3.26Å; R476-V480 PolarHBondContact O-N 2.92Å; N477-V480 PolarHBondContact O-N 3.33Å; V480-I483 PolarHBondContact O-N 3.36Å; V480-A484 WeakPolarHBondContact O-CB 3.13Å; V480-A484 PolarHBondContact O-N 3.03Å; V480-T498 HydrophobicContact CG2-CG2 4.4Å; V480-L502 HydrophobicContact CG2-CD2 3.73Å
481	E	84.8	Confident	81.2	Confident	139 Å²	139	57.6 Å²	57.6	65%	0.65	33%	0.331	S	S	*	.	H	α-helix	trans	-63.6	-46.7	178.3	-174.5	168.2	-167.9	0	0	111.3	N477 I483 A484 E485	N477-E481 VanDerWaalsContact O-CB 3.29Å; N477-E481 WeakPolarHBondContact O-CB 3.39Å; N477-E481 PolarHBondContact O-N 3.02Å; E481-I483 PolarHBondContact O-N 2.79Å; E481-A484 WeakPolarHBondContact O-CB 3.08Å; E481-A484 PolarHBondContact O-N 3.42Å; E481-E485 PolarHBondContact O-N 2.9Å; E481-E485 VanDerWaalsContact O-N 3.13Å
482	Y	87.3	Confident	82.1	Confident	39 Å²	39	60.5 Å²	60.5	15%	0.153	35%	0.345	C	S	.	.	H	α-helix	trans	-66.3	-38.6	177.9	-168	-109.4	0	0	0	112.7	L420 H423 S424 A478 A484 E485 I486	L420-Y482 HydrophobicContact CG-CD1 4.15Å; L420-Y482 HydrophobicContact CG-CE1 4.36Å; H423-Y482 HydrophobicContact CB-CD1 4.42Å; H423-Y482 HydrophobicContact CB-CE1 3.69Å; H423-Y482 HydrophobicContact CB-CE2 3.9Å; H423-Y482 WeakPolarHBondContact CB-OH 3.31Å; S424-Y482 WeakPolarHBondContact OG-CB 3.49Å; S424-Y482 WeakPolarHBondContact OG-CD1 3.36Å; A478-Y482 WeakPolarHBondContact O-CB 3.49Å; A478-Y482 PolarHBondContact O-N 3.27Å; A478-Y482 VanDerWaalsContact O-N 3.11Å; Y482-A484 VanDerWaalsContact C-N 3.3Å; Y482-A484 PolarHBondContact O-N 2.97Å; Y482-E485 WeakPolarHBondContact O-CB 3.34Å; Y482-E485 PolarHBondContact O-N 3.26Å; Y482-I486 HydrophobicContact CD1-CD1 3.82Å; Y482-I486 HydrophobicContact CD1-CG1 4.36Å; Y482-I486 HydrophobicContact CE1-CD1 3.64Å; Y482-I486 HydrophobicContact CE1-CG1 4.15Å; Y482-I486 WeakPolarHBondContact O-CG1 3.35Å; Y482-I486 PolarHBondContact O-N 3.35Å
483	I	87.3	Confident	82.9	Confident	3 Å²	3	61.3 Å²	61.3	2%	0.015	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-39.6	173.2	-69.1	163	0	0	0	111	L420 V479 V480 E481 E485 I486 V487 Y495 F496 T498	L420-I483 HydrophobicContact CD1-CG1 4.17Å; L420-I483 HydrophobicContact CD2-CG1 4.38Å; V479-I483 HydrophobicContact CG1-CD1 3.56Å; V479-I483 HydrophobicContact CG1-CG1 4.4Å; V479-I483 WeakPolarHBondContact O-CB 3.4Å; V479-I483 WeakPolarHBondContact O-CD1 3.26Å; V479-I483 WeakPolarHBondContact O-CG1 3.27Å; V479-I483 PolarHBondContact O-N 3.18Å; V480-I483 PolarHBondContact O-N 3.36Å; E481-I483 PolarHBondContact O-N 2.79Å; I483-E485 VanDerWaalsContact C-N 3.25Å; I483-E485 PolarHBondContact O-N 2.83Å; I483-I486 PolarHBondContact O-N 3.31Å; I483-V487 HydrophobicContact CG2-CG2 4.2Å; I483-V487 WeakPolarHBondContact O-CB 3.08Å; I483-V487 VanDerWaalsContact O-CG2 3.28Å; I483-V487 WeakPolarHBondContact O-CG2 3.49Å; I483-V487 PolarHBondContact O-N 3.41Å; I483-Y495 HydrophobicContact CG2-CD2 3.64Å; I483-Y495 HydrophobicContact CG2-CE2 4.19Å; I483-Y495 HydrophobicContact CG2-CG 4.32Å; I483-F496 HydrophobicContact CD1-CB 4.02Å; I483-F496 WeakPolarHBondContact CD1-O 3.41Å; I483-T498 HydrophobicContact CB-CG2 4.36Å; I483-T498 HydrophobicContact CD1-CG2 4.05Å; I483-T498 HydrophobicContact CG2-CG2 3.9Å
484	A	85.9	Confident	83.7	Confident	58 Å²	58	56.5 Å²	56.5	48%	0.479	32%	0.323	S	S	.	.	H	α-helix	trans	-61.3	-37	176.7	0	0	0	0	0	111.6	V480 E481 Y482 A488	V480-A484 WeakPolarHBondContact O-CB 3.13Å; V480-A484 PolarHBondContact O-N 3.03Å; E481-A484 WeakPolarHBondContact O-CB 3.08Å; E481-A484 PolarHBondContact O-N 3.42Å; Y482-A484 VanDerWaalsContact C-N 3.3Å; Y482-A484 PolarHBondContact O-N 2.97Å; A484-A488 VanDerWaalsContact O-CB 3.25Å; A484-A488 WeakPolarHBondContact O-CB 3.3Å; A484-A488 PolarHBondContact O-N 3.48Å
485	E	85.1	Confident	84.4	Confident	108 Å²	108	54.8 Å²	54.8	51%	0.505	31%	0.312	S	S	.	.	H	α-helix	trans	-65.4	-48.2	173.6	-174.3	178.8	-177.9	0	0	112.3	E481 Y482 I483 V487 A488 N489	E481-E485 PolarHBondContact O-N 2.9Å; E481-E485 VanDerWaalsContact O-N 3.13Å; Y482-E485 WeakPolarHBondContact O-CB 3.34Å; Y482-E485 PolarHBondContact O-N 3.26Å; I483-E485 VanDerWaalsContact C-N 3.25Å; I483-E485 PolarHBondContact O-N 2.83Å; E485-V487 VanDerWaalsContact C-N 3.28Å; E485-V487 PolarHBondContact O-N 2.84Å; E485-A488 PolarHBondContact O-N 3.48Å; E485-N489 WeakPolarHBondContact O-CB 3.44Å; E485-N489 VanDerWaalsContact O-CG 3.29Å; E485-N489 PolarHBondContact O-N 2.95Å; E485-N489 PolarHBondContact O-ND2 2.92Å
486	I	83.3	Confident	84.9	Confident	7 Å²	7	54.8 Å²	54.8	4%	0.036	31%	0.312	C	S	.	.	H	α-helix	trans	-54.6	-46.5	175.5	-68.9	174.6	0	0	0	110.7	L420 Y482 I483 N489 G490 S491 Y495	L420-I486 HydrophobicContact CD1-CD1 3.77Å; L420-I486 HydrophobicContact CG-CD1 4.14Å; Y482-I486 HydrophobicContact CD1-CD1 3.82Å; Y482-I486 HydrophobicContact CD1-CG1 4.36Å; Y482-I486 HydrophobicContact CE1-CD1 3.64Å; Y482-I486 HydrophobicContact CE1-CG1 4.15Å; Y482-I486 WeakPolarHBondContact O-CG1 3.35Å; Y482-I486 PolarHBondContact O-N 3.35Å; I483-I486 PolarHBondContact O-N 3.31Å; I486-N489 PolarHBondContact O-N 3.08Å; I486-G490 PolarHBondContact O-N 3.3Å; I486-S491 WeakPolarHBondContact O-CB 3.38Å; I486-S491 PolarHBondContact O-N 3.15Å; I486-S491 VanDerWaalsContact O-N 3.17Å; I486-Y495 HydrophobicContact CG2-CD1 3.94Å; I486-Y495 HydrophobicContact CG2-CE1 4.47Å; I486-Y495 HydrophobicContact CG2-CG 4.49Å
487	V	84.4	Confident	84.8	Confident	54 Å²	54	51.3 Å²	51.3	33%	0.327	30%	0.299	S	S	.	.	H	α-helix	trans	-67.8	-42	-179.4	173.4	0	0	0	0	111.4	I483 E485 N489 G490 Y495	I483-V487 HydrophobicContact CG2-CG2 4.2Å; I483-V487 WeakPolarHBondContact O-CB 3.08Å; I483-V487 VanDerWaalsContact O-CG2 3.28Å; I483-V487 WeakPolarHBondContact O-CG2 3.49Å; I483-V487 PolarHBondContact O-N 3.41Å; E485-V487 VanDerWaalsContact C-N 3.28Å; E485-V487 PolarHBondContact O-N 2.84Å; V487-N489 VanDerWaalsContact C-N 3.29Å; V487-N489 PolarHBondContact O-N 3.22Å; V487-G490 PolarHBondContact O-N 2.96Å; V487-Y495 HydrophobicContact CG2-CD2 4.46Å; V487-Y495 HydrophobicContact CG2-CE1 4.31Å; V487-Y495 HydrophobicContact CG2-CE2 3.79Å
488	A	84.5	Confident	84.6	Confident	84 Å²	84	50 Å²	50	69%	0.694	30%	0.295	S	S	*	.	H	α-helix	trans	-63.8	-35.7	177.6	0	0	0	0	0	112.2	A484 E485 G490	A484-A488 VanDerWaalsContact O-CB 3.25Å; A484-A488 WeakPolarHBondContact O-CB 3.3Å; A484-A488 PolarHBondContact O-N 3.48Å; E485-A488 PolarHBondContact O-N 3.48Å; A488-G490 PolarHBondContact O-N 3.4Å
489	N	85.1	Confident	83.9	Confident	118 Å²	118	55.6 Å²	55.6	63%	0.631	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-5.3	178.6	-69.8	-22	0	0	0	113.6	E485 I486 V487 S491	E485-N489 WeakPolarHBondContact O-CB 3.44Å; E485-N489 VanDerWaalsContact O-CG 3.29Å; E485-N489 PolarHBondContact O-N 2.95Å; E485-N489 PolarHBondContact O-ND2 2.92Å; I486-N489 PolarHBondContact O-N 3.08Å; V487-N489 VanDerWaalsContact C-N 3.29Å; V487-N489 PolarHBondContact O-N 3.22Å; N489-S491 PolarHBondContact O-N 3.18Å
490	G	80.9	Confident	82.6	Confident	53 Å²	53	58 Å²	58	55%	0.546	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	65	27.9	-178.6	0	0	0	0	0	113.2	I486 V487 A488	I486-G490 PolarHBondContact O-N 3.3Å; V487-G490 PolarHBondContact O-N 2.96Å; A488-G490 PolarHBondContact O-N 3.4Å
491	S	82	Confident	81.5	Confident	30 Å²	30	57.3 Å²	57.3	21%	0.21	36%	0.356	C	S	.	.			trans	-62.7	141.1	-179.8	179.8	0	0	0	0	111.2	L392 I486 N489 Q493	L392-S491 WeakPolarHBondContact CD2-O 3.46Å; I486-S491 WeakPolarHBondContact O-CB 3.38Å; I486-S491 PolarHBondContact O-N 3.15Å; I486-S491 VanDerWaalsContact O-N 3.17Å; N489-S491 PolarHBondContact O-N 3.18Å; S491-Q493 VanDerWaalsContact C-N 3.28Å; S491-Q493 WeakPolarHBondContact OG-CB 3.26Å; S491-Q493 VanDerWaalsContact OG-CG 3.3Å; S491-Q493 WeakPolarHBondContact OG-CG 3.26Å; S491-Q493 PolarHBondContact OG-N 3.01Å
492	D	83.6	Confident	81.1	Confident	116 Å²	116	51.3 Å²	51.3	62%	0.62	33%	0.329	S	S	*	.			trans	-89.2	7.1	174.8	67.7	-24.1	0	0	0	113.2	R391 L392	R391-D492 WeakPolarHBondContact CD-O 3.43Å; R391-D492 VanDerWaalsContact CG-O 3.24Å; R391-D492 WeakPolarHBondContact CG-O 3.36Å; L392-D492 HydrophobicContact CD1-CB 4.5Å; L392-D492 HydrophobicContact CD2-CB 4.32Å; L392-D492 HydrophobicContact CG-CB 4.41Å
493	Q	84.6	Confident	80.4	Confident	92 Å²	92	52 Å²	52	43%	0.43	34%	0.337	S	S	.	.	S	Bend	trans	-63.6	153.3	173	-71.1	177.3	-19.2	0	0	112.1	S491 Y495	S491-Q493 VanDerWaalsContact C-N 3.28Å; S491-Q493 WeakPolarHBondContact OG-CB 3.26Å; S491-Q493 VanDerWaalsContact OG-CG 3.3Å; S491-Q493 WeakPolarHBondContact OG-CG 3.26Å; S491-Q493 PolarHBondContact OG-N 3.01Å; Q493-Y495 WeakPolarHBondContact O-CD1 3.41Å
494	I	87.6	Confident	79.6	Confident	2 Å²	2	52 Å²	52	1%	0.01	34%	0.337	C	S	.	.			trans	-78.2	133	172.4	-61	170.7	0	0	0	109.4	L389 T390 L396 Y413 Q416	L389-I494 HydrophobicContact CB-CG2 3.88Å; L389-I494 HydrophobicContact CD1-CG2 4.07Å; L389-I494 HydrophobicContact CD2-CG2 4.1Å; L389-I494 HydrophobicContact CG-CG2 4.23Å; T390-I494 WeakPolarHBondContact O-CA 3.25Å; L396-I494 HydrophobicContact CD1-CD1 3.97Å; L396-I494 HydrophobicContact CD1-CG1 4Å; L396-I494 HydrophobicContact CD1-CG2 3.88Å; Y413-I494 HydrophobicContact CD1-CD1 3.22Å; Y413-I494 HydrophobicContact CD2-CD1 4.06Å; Y413-I494 HydrophobicContact CE1-CD1 3.27Å; Y413-I494 HydrophobicContact CE2-CD1 4.11Å; Y413-I494 HydrophobicContact CG-CD1 3.63Å; Q416-I494 HydrophobicContact CB-CB 4.36Å
495	Y	88.8	Confident	78.4	Confident	7 Å²	7	52.5 Å²	52.5	3%	0.027	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	163.1	176.4	58.5	-87.8	0	0	0	112.7	L389 T390 N393 I483 I486 V487 Q493 G497	L389-Y495 WeakPolarHBondContact CA-O 3.05Å; T390-Y495 HydrophobicContact CG2-CE1 4.44Å; T390-Y495 HydrophobicContact CG2-CE2 3.88Å; T390-Y495 PolarHBondContact N-O 2.96Å; T390-Y495 WeakPolarHBondContact O-CD1 3.38Å; T390-Y495 PolarHBondContact O-N 3.19Å; N393-Y495 VanDerWaalsContact CA-OH 3.25Å; N393-Y495 WeakPolarHBondContact CA-OH 3.18Å; N393-Y495 PolarHBondContact N-OH 3.36Å; N393-Y495 PolarHBondContact OD1-OH 2.86Å; I483-Y495 HydrophobicContact CG2-CD2 3.64Å; I483-Y495 HydrophobicContact CG2-CE2 4.19Å; I483-Y495 HydrophobicContact CG2-CG 4.32Å; I486-Y495 HydrophobicContact CG2-CD1 3.94Å; I486-Y495 HydrophobicContact CG2-CE1 4.47Å; I486-Y495 HydrophobicContact CG2-CG 4.49Å; V487-Y495 HydrophobicContact CG2-CD2 4.46Å; V487-Y495 HydrophobicContact CG2-CE1 4.31Å; V487-Y495 HydrophobicContact CG2-CE2 3.79Å; Q493-Y495 WeakPolarHBondContact O-CD1 3.41Å; Y495-G497 PolarHBondContact O-N 2.76Å
496	F	86	Confident	77.1	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	127.3	174.2	-65.1	-76.2	0	0	0	110.7	V385 L389 I417 L420 L421 A452 I483 T498 L502	V385-F496 HydrophobicContact CB-CZ 4.39Å; V385-F496 HydrophobicContact CG1-CD2 4.22Å; V385-F496 HydrophobicContact CG1-CE1 4.25Å; V385-F496 HydrophobicContact CG1-CE2 3.96Å; V385-F496 HydrophobicContact CG1-CG 4.48Å; V385-F496 HydrophobicContact CG1-CZ 3.95Å; L389-F496 HydrophobicContact CD2-CD1 3.97Å; L389-F496 HydrophobicContact CD2-CE1 4.08Å; I417-F496 HydrophobicContact CG2-CE1 4.47Å; I417-F496 HydrophobicContact CG2-CE2 3.86Å; I417-F496 HydrophobicContact CG2-CZ 3.48Å; I417-F496 VanDerWaalsContact CG2-CZ 3.48Å; L420-F496 HydrophobicContact CD2-CD2 3.9Å; L420-F496 HydrophobicContact CD2-CE2 4.17Å; L421-F496 HydrophobicContact CD1-CE2 3.98Å; L421-F496 HydrophobicContact CD1-CZ 4.2Å; L421-F496 HydrophobicContact CD2-CD2 4.26Å; L421-F496 HydrophobicContact CD2-CE2 3.65Å; L421-F496 HydrophobicContact CG-CE2 3.81Å; A452-F496 HydrophobicContact CB-CZ 4.31Å; I483-F496 HydrophobicContact CD1-CB 4.02Å; I483-F496 WeakPolarHBondContact CD1-O 3.41Å; F496-T498 PolarHBondContact O-N 2.85Å; F496-L502 HydrophobicContact CB-CD1 3.89Å; F496-L502 HydrophobicContact CG-CD1 4.17Å
497	G	82.1	Confident	75.2	Confident	2 Å²	2	48.7 Å²	48.7	2%	0.021	31%	0.314	C	S	.	.			trans	-63	122	172.2	0	0	0	0	0	110.1	S387 T388 Y495 S500	S387-G497 PolarHBondContact OG-O 3.11Å; T388-G497 PolarHBondContact O-N 2.97Å; Y495-G497 PolarHBondContact O-N 2.76Å; G497-S500 VanDerWaalsContact CA-OG 3.32Å; G497-S500 WeakPolarHBondContact CA-OG 3.3Å; G497-S500 PolarHBondContact O-OG 2.81Å
498	T	78.3	Confident	73.3	Confident	75 Å²	75	47.4 Å²	47.4	46%	0.46	31%	0.305	S	S	.	.	S	Bend	trans	-80.3	-27.9	177.9	52.2	0	0	0	0	111.8	V480 I483 F496	V480-T498 HydrophobicContact CG2-CG2 4.4Å; I483-T498 HydrophobicContact CB-CG2 4.36Å; I483-T498 HydrophobicContact CD1-CG2 4.05Å; I483-T498 HydrophobicContact CG2-CG2 3.9Å; F496-T498 PolarHBondContact O-N 2.85Å
499	S	68.5	Low	71.4	Confident	120 Å²	120	47.1 Å²	47.1	84%	0.839	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-16.5	176.2	53.7	0	0	0	0	114
500	S	58.4	Low	68.9	Low	51 Å²	51	43 Å²	43	36%	0.357	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	14	-177.2	49.8	0	0	0	0	114.2	S387 T388 G497	S387-S500 PolarHBondContact OG-OG 3.26Å; T388-S500 WeakPolarHBondContact CB-OG 3.23Å; G497-S500 VanDerWaalsContact CA-OG 3.32Å; G497-S500 WeakPolarHBondContact CA-OG 3.3Å; G497-S500 PolarHBondContact O-OG 2.81Å
501	G	63	Low	66.5	Low	46 Å²	46	42.9 Å²	42.9	47%	0.474	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	64.6	179	0	0	0	0	0	112.6	T503	G501-T503 PolarHBondContact O-N 2.66Å
502	L	76.5	Confident	64.1	Low	13 Å²	13	43.2 Å²	43.2	7%	0.068	27%	0.268	C	S	.	.			trans	-54.7	113.7	168.5	178	65.8	0	0	0	109.6	V385 R476 V479 V480 F496 I504	V385-L502 HydrophobicContact CG1-CD1 3.7Å; R476-L502 PolarHBondContact NH1-O 3.14Å; V479-L502 HydrophobicContact CG1-CD2 4.02Å; V480-L502 HydrophobicContact CG2-CD2 3.73Å; F496-L502 HydrophobicContact CB-CD1 3.89Å; F496-L502 HydrophobicContact CG-CD1 4.17Å; L502-I504 HydrophobicContact CD1-CD1 4.4Å; L502-I504 HydrophobicContact CD1-CG1 4.39Å; L502-I504 HydrophobicContact CD2-CD1 3.9Å; L502-I504 HydrophobicContact CG-CD1 4.02Å; L502-I504 HydrophobicContact CG-CG1 4.18Å
503	T	72.9	Confident	61.5	Low	53 Å²	53	42.4 Å²	42.4	33%	0.325	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.9	175.9	57.4	0	0	0	0	108.8	V385 S386 G501	V385-T503 WeakPolarHBondContact CA-O 3.12Å; S386-T503 WeakPolarHBondContact CB-OG1 3.11Å; S386-T503 PolarHBondContact N-O 2.81Å; S386-T503 PolarHBondContact N-OG1 3.24Å; S386-T503 PolarHBondContact O-N 3.18Å; S386-T503 PolarHBondContact O-OG1 2.8Å; S386-T503 PolarHBondContact OG-OG1 2.51Å; G501-T503 PolarHBondContact O-N 2.66Å
504	I	70.9	Confident	58.8	Low	2 Å²	2	46.6 Å²	46.6	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	118.8	178.2	-68.2	174.3	0	0	0	105.6	I383 T384 V385 E472 V475 R476 V479 L502	I383-I504 HydrophobicContact CG2-CG2 3.57Å; T384-I504 VanDerWaalsContact O-CA 3.25Å; T384-I504 WeakPolarHBondContact O-CA 3.31Å; V385-I504 HydrophobicContact CG1-CG1 4.06Å; V385-I504 HydrophobicContact CG2-CG1 4.22Å; E472-I504 HydrophobicContact CB-CG2 4.41Å; V475-I504 HydrophobicContact CB-CG2 4.27Å; V475-I504 HydrophobicContact CG1-CD1 4.38Å; V475-I504 HydrophobicContact CG1-CG2 4.06Å; R476-I504 HydrophobicContact CB-CD1 3.69Å; R476-I504 HydrophobicContact CG-CD1 4.13Å; V479-I504 HydrophobicContact CB-CD1 4.42Å; L502-I504 HydrophobicContact CD1-CD1 4.4Å; L502-I504 HydrophobicContact CD1-CG1 4.39Å; L502-I504 HydrophobicContact CD2-CD1 3.9Å; L502-I504 HydrophobicContact CG-CD1 4.02Å; L502-I504 HydrophobicContact CG-CG1 4.18Å
505	E	60.7	Low	55.9	Low	70 Å²	70	54.5 Å²	54.5	33%	0.327	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	133.4	-174.2	-58.6	176.8	162	0	0	109.7	I383 T384 E472 S593	I383-E505 CarbonylContact C-O 3.57Å; I383-E505 VanDerWaalsContact CA-O 3.28Å; I383-E505 WeakPolarHBondContact CA-O 3Å; T384-E505 PolarHBondContact N-O 3.24Å; T384-E505 PolarHBondContact O-N 2.98Å; T384-E505 VanDerWaalsContact O-N 3.17Å; T384-E505 PolarHBondContact OG1-O 2.99Å; E472-E505 WeakPolarHBondContact OE1-CA 3.5Å; E505-S593 WeakPolarHBondContact OE2-CB 3.21Å
506	T	56.3	Low	52.8	Low	29 Å²	29	60.5 Å²	60.5	18%	0.178	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	121.9	175.2	-56.8	0	0	0	0	108.9	I382 I383 E472 T592	I382-T506 CarbonylContact O-C 3.53Å; I382-T506 WeakPolarHBondContact O-CA 3.34Å; I383-T506 HydrophobicContact CG1-CG2 4.41Å; E472-T506 WeakPolarHBondContact CG-OG1 3.28Å; E472-T506 PolarHBondContact OE1-N 2.75Å; T506-T592 PolarHBondContact O-OG1 3.49Å
507	V	43.7	Very low	50	Low	5 Å²	5	66.4 Å²	66.4	3%	0.03	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-38	-169	-164.2	0	0	0	0	111.2	I382 T384 Y590 I591 T592 L638 L642	I382-V507 HydrophobicContact CB-CB 4.2Å; I382-V507 HydrophobicContact CG2-CB 3.82Å; I382-V507 HydrophobicContact CG2-CG2 3.99Å; I382-V507 PolarHBondContact O-N 3.49Å; T384-V507 HydrophobicContact CG2-CG2 3.71Å; V507-Y590 WeakPolarHBondContact CG1-O 3.32Å; V507-I591 HydrophobicContact CG1-CB 4.2Å; V507-I591 HydrophobicContact CG1-CG1 3.8Å; V507-T592 WeakPolarHBondContact O-CG2 3.35Å; V507-L638 HydrophobicContact CG1-CD2 4.5Å; V507-L638 HydrophobicContact CG2-CD2 4.37Å; V507-L642 HydrophobicContact CB-CD1 4.24Å; V507-L642 HydrophobicContact CG1-CD1 3.66Å
508	I	45.2	Very low	47.3	Very low	27 Å²	27	75.6 Å²	75.6	14%	0.138	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	137.2	-179.9	-57.1	-177.5	0	0	0	109.3	A381 I382 A510 Y590 L642	A381-I508 WeakPolarHBondContact CA-O 3.28Å; I382-I508 HydrophobicContact CB-CB 4.47Å; I382-I508 HydrophobicContact CD1-CB 3.84Å; I382-I508 HydrophobicContact CD1-CD1 3.74Å; I382-I508 HydrophobicContact CD1-CG1 4.08Å; I382-I508 HydrophobicContact CD1-CG2 4.46Å; I382-I508 PolarHBondContact N-O 3.39Å; I382-I508 VanDerWaalsContact N-O 3.08Å; I508-A510 HydrophobicContact CG2-CB 3.56Å; I508-Y590 HydrophobicContact CD1-CD1 3.28Å; I508-Y590 HydrophobicContact CD1-CE1 4.26Å; I508-Y590 HydrophobicContact CD1-CG 3.86Å; I508-L642 HydrophobicContact CD1-CB 4.17Å; I508-L642 HydrophobicContact CD1-CD1 4.11Å; I508-L642 HydrophobicContact CG1-CD1 4.49Å
509	D	44	Very low	45	Very low	79 Å²	79	77.3 Å²	77.3	42%	0.422	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	88.8	160.2	-178.3	27.7	0	0	0	108	K379 T380 Y458	K379-D509 WeakPolarHBondContact CD-OD1 2.93Å; K379-D509 IonicContact NZ-OD1 3.85Å; K379-D509 IonicContact NZ-OD2 2.78Å; K379-D509 PolarHBondContact NZ-OD2 2.96Å; T380-D509 WeakPolarHBondContact O-CA 3.46Å; Y458-D509 PolarHBondContact OH-OD1 2.79Å; Y458-D509 PolarHBondContact OH-OD2 3.16Å
510	A	32.5	Very low	43	Very low	32 Å²	32	80.8 Å²	80.8	26%	0.264	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.7	-176.4	0	0	0	0	0	110.3	K379 T380 I508	K379-A510 CarbonylContact C-O 3.5Å; K379-A510 VanDerWaalsContact CA-O 3.31Å; K379-A510 WeakPolarHBondContact CA-O 3.49Å; T380-A510 PolarHBondContact N-O 2.62Å; T380-A510 PolarHBondContact O-N 3.44Å; I508-A510 HydrophobicContact CG2-CB 3.56Å
511	A	31.2	Very low	41.4	Very low	49 Å²	49	86 Å²	86	41%	0.405	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	117.3	170.4	0	0	0	0	0	109.2	L377 T378 K379	L377-A511 HydrophobicContact CB-CB 4.28Å; L377-A511 HydrophobicContact CD2-CB 4.02Å; T378-A511 WeakPolarHBondContact O-CA 3.28Å; K379-A511 HydrophobicContact CG-CB 4.21Å
512	T	31.8	Very low	39.9	Very low	37 Å²	37	90.6 Å²	90.6	23%	0.227	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	124.8	176.1	32.6	0	0	0	0	110.4	T378 K649	T378-T512 PolarHBondContact O-N 3.03Å; T378-T512 PolarHBondContact O-OG1 3.23Å; T378-T512 VanDerWaalsContact O-OG1 3.11Å; T512-K649 HydrophobicContact CG2-CD 4.3Å
513	T	28.2	Very low	37.5	Very low	99 Å²	99	99.3 Å²	99.3	61%	0.607	54%	0.537	S	S	*	.			trans	-106.2	115.8	168.7	-49	0	0	0	0	107.7
514	E	27.8	Very low	35.4	Very low	180 Å²	180	101.1 Å²	101.1	84%	0.841	56%	0.558	S	S	*	*			trans	-77.3	119.8	171.8	-76.2	-174	157.8	0	0	110
515	M	26.2	Very low	33.2	Very low	168 Å²	168	111.9 Å²	111.9	83%	0.828	60%	0.6	S	S	*	*			trans	-136.1	102.8	163.7	-84	-85.2	-74.6	0	0	108.6
516	I	24.7	Very low	31.5	Very low	134 Å²	134	117.8 Å²	117.8	69%	0.687	63%	0.625	S	S	*	*			trans	-82.8	112.2	164.5	-62.2	167.9	0	0	0	107.1
517	T	27.8	Very low	30.1	Very low	123 Å²	123	123.4 Å²	123.4	76%	0.755	66%	0.659	S	S	*	*			trans	-166	121.5	136.7	-13.2	0	0	0	0	111.4
518	E	24.9	Very low	29.5	Very low	196 Å²	196	129.3 Å²	129.3	92%	0.916	70%	0.696	S	S	*	*			trans	-77.1	124.7	170.5	-172.3	178.6	-152.7	0	0	109.5
519	S	28.7	Very low	28.5	Very low	111 Å²	111	136.5 Å²	136.5	78%	0.776	73%	0.729	S	S	*	*			trans	-157.9	119.1	154.7	55.6	0	0	0	0	112.9
520	Q	27.7	Very low	27.7	Very low	192 Å²	192	139.3 Å²	139.3	90%	0.897	75%	0.748	S	S	*	*			trans	19.2	133.5	150.7	-60.1	-170	-33.7	0	0	121.7
521	D	25.3	Very low	27.5	Very low	162 Å²	162	143.7 Å²	143.7	87%	0.866	77%	0.772	S	S	*	*			trans	-37.7	126.3	166.6	-60.9	-51	0	0	0	114.8
522	T	30.2	Very low	27.2	Very low	142 Å²	142	149.4 Å²	149.4	87%	0.871	79%	0.791	S	S	*	*				-157.1	128.1	129.3	-29.5	0	0	0	0	109.6	A524	T522-A524 PolarHBondContact O-N 3.36Å
523	E	26.5	Very low	27	Very low	195 Å²	195	155.8 Å²	155.8	91%	0.911	82%	0.822	S	S	*	*			trans	-54.7	125.4	174	-62.8	179.8	144.2	0	0	112.2
524	A	28.2	Very low	27	Very low	92 Å²	92	154.5 Å²	154.5	76%	0.76	82%	0.818	S	S	*	*			trans	173.7	114.3	138.4	0	0	0	0	0	111.9	T522	T522-A524 PolarHBondContact O-N 3.36Å
525	Y	24.6	Very low	27	Very low	227 Å²	227	155.1 Å²	155.1	89%	0.89	82%	0.817	S	S	*	*			trans	37.7	104.7	143.3	-91.8	-92.1	0	0	0	120.3
526	K	25.9	Very low	27	Very low	194 Å²	194	151.4 Å²	151.4	84%	0.843	80%	0.804	S	S	*	*				166.3	101.9	115.2	-100.5	179.4	171.1	178	0	109.3
527	T	27.8	Very low	27.1	Very low	148 Å²	148	152 Å²	152	91%	0.908	82%	0.815	S	S	*	*			trans	-97.5	108.7	169.2	-43.4	0	0	0	0	108.9
528	T	29.9	Very low	27.2	Very low	129 Å²	129	151.3 Å²	151.3	79%	0.791	80%	0.801	S	S	*	*			trans	-64.3	136.7	172.2	-55.5	0	0	0	0	110.8
529	E	25.3	Very low	27.6	Very low	178 Å²	178	145.7 Å²	145.7	83%	0.832	78%	0.784	S	S	*	*			trans	-64.5	135.3	177.2	-62	174.5	149.9	0	0	113.2
530	T	26.5	Very low	28.3	Very low	137 Å²	137	144.6 Å²	144.6	84%	0.84	77%	0.772	S	S	*	*			trans	176.5	124.5	140.5	8.7	0	0	0	0	107.2
531	T	27.3	Very low	29.7	Very low	124 Å²	124	139.6 Å²	139.6	76%	0.761	75%	0.748	S	S	*	*			cis	-150.1	117.1	19	-52.8	0	0	0	0	106.7	L533	T531-L533 PolarHBondContact O-N 3.14Å; T531-L533 VanDerWaalsContact O-N 3.14Å
532	E	25.6	Very low	31.2	Very low	170 Å²	170	133.1 Å²	133.1	79%	0.794	72%	0.715	S	S	*	*			trans	-60.3	113.9	170.3	-77.1	-168.8	144	0	0	109.1	S534	E532-S534 PolarHBondContact O-N 3.17Å
533	L	28.4	Very low	32.8	Very low	170 Å²	170	129.7 Å²	129.7	89%	0.89	69%	0.691	S	S	*	*			trans	-70.6	87.5	159	-146.1	87.5	0	0	0	106.8	T531	T531-L533 PolarHBondContact O-N 3.14Å; T531-L533 VanDerWaalsContact O-N 3.14Å
534	S	27.8	Very low	34.5	Very low	73 Å²	73	121.7 Å²	121.7	51%	0.51	65%	0.654	S	S	.	*			trans	21.2	112.4	159.7	54.2	0	0	0	0	116.2	E532 T536	E532-S534 PolarHBondContact O-N 3.17Å; S534-T536 PolarHBondContact O-N 2.92Å; S534-T536 PolarHBondContact O-OG1 2.84Å
535	K	26.6	Very low	36.3	Very low	192 Å²	192	122.9 Å²	122.9	84%	0.835	64%	0.644	S	S	*	*			trans	-46.8	88.2	151.9	-81.9	172	174.2	166	0	109.8
536	T	27.6	Very low	38.2	Very low	91 Å²	91	112.4 Å²	112.4	56%	0.558	60%	0.603	S	S	*	*			trans	-80.7	117.3	165.2	22.2	0	0	0	0	107.3	S534 F538	S534-T536 PolarHBondContact O-N 2.92Å; S534-T536 PolarHBondContact O-OG1 2.84Å; T536-F538 WeakPolarHBondContact O-CD2 3.45Å; T536-F538 WeakPolarHBondContact O-CE2 3.27Å; T536-F538 PolarHBondContact O-N 2.76Å
537	T	26.4	Very low	39.8	Very low	147 Å²	147	105.6 Å²	105.6	90%	0.902	58%	0.58	S	S	*	*			trans	-63.1	105.3	177	-20	0	0	0	0	108.9	S539	T537-S539 PolarHBondContact O-N 2.81Å
538	F	30.3	Very low	41.7	Very low	108 Å²	108	99 Å²	99	47%	0.474	54%	0.539	S	S	.	.			trans	-77.6	111.6	-176	-74	-93.3	0	0	0	111.6	T536 K541 I622	T536-F538 WeakPolarHBondContact O-CD2 3.45Å; T536-F538 WeakPolarHBondContact O-CE2 3.27Å; T536-F538 PolarHBondContact O-N 2.76Å; F538-K541 HydrophobicContact CB-CG 4.49Å; F538-I622 HydrophobicContact CD1-CD1 3.76Å; F538-I622 HydrophobicContact CD1-CG1 3.76Å; F538-I622 HydrophobicContact CE1-CD1 3.48Å; F538-I622 VanDerWaalsContact CE1-CD1 3.48Å; F538-I622 HydrophobicContact CE1-CG1 3.66Å
539	S	32.5	Very low	43.5	Very low	78 Å²	78	94.6 Å²	94.6	55%	0.545	51%	0.512	S	S	.	.	S	Bend	trans	-80.8	116.8	163.4	61.9	0	0	0	0	109.6	T537	T537-S539 PolarHBondContact O-N 2.81Å
540	T	43.5	Very low	45.7	Very low	88 Å²	88	86.1 Å²	86.1	54%	0.54	47%	0.472	S	S	.	.			trans	57	95.6	174.8	57.3	0	0	0	0	116.9	N623	T540-N623 WeakPolarHBondContact O-CB 3.36Å; T540-N623 PolarHBondContact O-N 2.97Å
541	K	56.7	Low	47.7	Very low	86 Å²	86	80.5 Å²	80.5	37%	0.374	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	146.9	166.4	-68.7	-178.6	170.9	-168.6	0	111.1	F538 E620 Y621 N623	F538-K541 HydrophobicContact CB-CG 4.49Å; K541-E620 IonicContact NZ-OE2 3.39Å; K541-E620 PolarHBondContact NZ-OE2 3.34Å; K541-Y621 WeakPolarHBondContact CA-O 3.26Å; K541-N623 PolarHBondContact O-ND2 3.14Å
542	S	57.8	Low	49.7	Very low	27 Å²	27	74.8 Å²	74.8	19%	0.189	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	150.5	163.7	-100.8	0	0	0	0	111	E620 Y621 N623	S542-E620 CarbonylContact O-C 3.1Å; S542-E620 WeakPolarHBondContact O-CA 3.17Å; S542-Y621 PolarHBondContact N-O 3.18Å; S542-Y621 WeakPolarHBondContact O-CD1 3.48Å; S542-Y621 PolarHBondContact O-N 3.12Å; S542-N623 WeakPolarHBondContact CB-OD1 2.68Å; S542-N623 PolarHBondContact OG-ND2 2.92Å; S542-N623 PolarHBondContact OG-OD1 2.99Å
543	I	63.1	Low	51.5	Low	69 Å²	69	68.4 Å²	68.4	35%	0.354	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	133.3	-179.1	-67.2	162	0	0	0	108.6	S115 I618 V619 E620	S115-I543 WeakPolarHBondContact OG-CD1 2.85Å; I543-I618 HydrophobicContact CG2-CG2 3.5Å; I543-V619 CarbonylContact C-O 3.59Å; I543-V619 WeakPolarHBondContact CA-O 3.24Å; I543-E620 HydrophobicContact CG1-CG 4.13Å
544	L	63.8	Low	52.8	Low	27 Å²	27	62.2 Å²	62.2	14%	0.141	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	124.4	178.4	-178.6	70	0	0	0	109.6	L546 V619 Y621 Q629 I632	L544-L546 HydrophobicContact CD2-CD1 3.87Å; L544-L546 HydrophobicContact CD2-CD2 3.84Å; L544-L546 HydrophobicContact CD2-CG 3.89Å; L544-L546 HydrophobicContact CG-CD1 4.38Å; L544-L546 HydrophobicContact CG-CD2 3.98Å; L544-L546 HydrophobicContact CG-CG 3.92Å; L544-V619 HydrophobicContact CB-CB 4.47Å; L544-V619 PolarHBondContact N-O 3.47Å; L544-V619 PolarHBondContact O-N 2.82Å; L544-Y621 HydrophobicContact CB-CD1 4.42Å; L544-Y621 HydrophobicContact CB-CE1 3.91Å; L544-Q629 HydrophobicContact CD1-CG 4.06Å; L544-Q629 HydrophobicContact CD2-CG 4.01Å; L544-I632 HydrophobicContact CD2-CD1 3.44Å; L544-I632 VanDerWaalsContact CD2-CD1 3.44Å
545	E	65.2	Low	54.1	Low	118 Å²	118	60 Å²	60	55%	0.551	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	127.2	171.7	-166.7	-176.7	151.7	0	0	109.4	Q616 I617	E545-Q616 PolarHBondContact OE1-NE2 2.75Å; E545-I617 WeakPolarHBondContact CA-O 3.4Å
546	L	63.2	Low	55.1	Low	6 Å²	6	59.2 Å²	59.2	3%	0.031	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	141.5	-178.8	-65.2	169.6	0	0	0	110.2	L544 Q616 I617 V619 Q629 I632 L633	L544-L546 HydrophobicContact CD2-CD1 3.87Å; L544-L546 HydrophobicContact CD2-CD2 3.84Å; L544-L546 HydrophobicContact CD2-CG 3.89Å; L544-L546 HydrophobicContact CG-CD1 4.38Å; L544-L546 HydrophobicContact CG-CD2 3.98Å; L544-L546 HydrophobicContact CG-CG 3.92Å; L546-Q616 WeakPolarHBondContact O-CA 3.23Å; L546-I617 HydrophobicContact CB-CD1 4.08Å; L546-I617 HydrophobicContact CB-CG1 3.69Å; L546-I617 HydrophobicContact CD1-CD1 4.13Å; L546-I617 HydrophobicContact CD1-CG1 4.49Å; L546-I617 PolarHBondContact N-O 2.78Å; L546-I617 PolarHBondContact O-N 2.85Å; L546-V619 HydrophobicContact CD1-CG2 4.01Å; L546-Q629 HydrophobicContact CD2-CB 3.88Å; L546-Q629 HydrophobicContact CD2-CG 3.91Å; L546-I632 HydrophobicContact CD1-CB 4.34Å; L546-I632 HydrophobicContact CD1-CG2 3.61Å; L546-L633 HydrophobicContact CD1-CD1 4.47Å; L546-L633 HydrophobicContact CD1-CD2 4.02Å; L546-L633 HydrophobicContact CD1-CG 3.95Å; L546-L633 HydrophobicContact CD2-CD1 4.32Å
547	S	60.9	Low	56	Low	52 Å²	52	62.2 Å²	62.2	36%	0.364	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.1	166.9	-51.1	0	0	0	0	108.1	V615	S547-V615 WeakPolarHBondContact CA-O 3.34Å
548	M	67.3	Low	57.6	Low	10 Å²	10	60 Å²	60	5%	0.049	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	143.4	-178.3	63.9	-168.3	-137.2	0	0	110.9	V550 I584 V615 I617 L633 I636 L663	M548-V550 HydrophobicContact CE-CG2 3.35Å; M548-V550 HydrophobicContact CG-CG2 4.09Å; M548-I584 HydrophobicContact CE-CD1 3.24Å; M548-I584 HydrophobicContact CE-CG1 3.77Å; M548-V615 HydrophobicContact CE-CB 4.38Å; M548-V615 HydrophobicContact CG-CB 4.03Å; M548-V615 PolarHBondContact N-O 3.2Å; M548-V615 PolarHBondContact O-N 2.88Å; M548-I617 HydrophobicContact SD-CD1 4.1Å; M548-L633 HydrophobicContact CB-CD2 4.08Å; M548-L633 HydrophobicContact CG-CD2 4.5Å; M548-L633 HydrophobicContact SD-CD2 3.68Å; M548-I636 HydrophobicContact CE-CG2 4.23Å; M548-L663 HydrophobicContact CB-CD2 3.71Å; M548-L663 HydrophobicContact CE-CD2 3.64Å; M548-L663 HydrophobicContact CG-CD2 3.83Å; M548-L663 HydrophobicContact SD-CD2 3.4Å; M548-L663 WeakPolarHBondContact SD-CD2 3.34Å
549	T	66.9	Low	59.1	Low	35 Å²	35	56.4 Å²	56.4	22%	0.215	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	129.9	168.2	-54.2	0	0	0	0	109	K612 S613 D614 I664	T549-K612 HydrophobicContact CG2-CB 4.05Å; T549-K612 HydrophobicContact CG2-CD 4.49Å; T549-S613 CarbonylContact C-O 3.57Å; T549-S613 WeakPolarHBondContact CA-O 3.39Å; T549-D614 PolarHBondContact OG1-OD1 3.39Å; T549-I664 HydrophobicContact CG2-CD1 4.1Å; T549-I664 PolarHBondContact O-N 3.13Å
550	V	71.6	Confident	60.8	Low	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	118.5	-173.8	171.1	0	0	0	0	109.1	M548 K612 S613 V615 F661 L663	M548-V550 HydrophobicContact CE-CG2 3.35Å; M548-V550 HydrophobicContact CG-CG2 4.09Å; V550-K612 CarbonylContact O-C 3.53Å; V550-K612 VanDerWaalsContact O-CA 3.28Å; V550-K612 WeakPolarHBondContact O-CA 3.38Å; V550-S613 PolarHBondContact N-O 3Å; V550-S613 PolarHBondContact O-N 3.49Å; V550-V615 HydrophobicContact CB-CG2 4.12Å; V550-V615 HydrophobicContact CG2-CB 4.41Å; V550-V615 HydrophobicContact CG2-CG2 3.64Å; V550-F661 HydrophobicContact CB-CD1 4.38Å; V550-F661 HydrophobicContact CG1-CB 3.72Å; V550-F661 HydrophobicContact CG1-CD1 2.9Å; V550-F661 HydrophobicContact CG1-CD2 4.01Å; V550-F661 HydrophobicContact CG1-CE1 3.37Å; V550-F661 HydrophobicContact CG1-CE2 4.38Å; V550-F661 HydrophobicContact CG1-CG 3.28Å; V550-F661 HydrophobicContact CG1-CZ 4.17Å; V550-L663 HydrophobicContact CG2-CD2 4.38Å
551	E	70	Confident	62.1	Low	20 Å²	20	59.5 Å²	59.5	9%	0.093	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	128.7	170.8	-169.3	175.5	178.2	0	0	110.5	Q558 S610 K612 F661 K662	E551-Q558 PolarHBondContact OE1-NE2 2.69Å; E551-S610 WeakPolarHBondContact CG-O 3.2Å; E551-S610 WeakPolarHBondContact OE1-CB 3.36Å; E551-S610 PolarHBondContact OE1-OG 3Å; E551-K612 HydrophobicContact CB-CG 4.45Å; E551-K612 HydrophobicContact CG-CG 4.38Å; E551-F661 WeakPolarHBondContact O-CA 3.49Å; E551-K662 HydrophobicContact CB-CB 4.06Å; E551-K662 PolarHBondContact N-O 3.47Å
552	I	68.5	Low	63	Low	3 Å²	3	58.4 Å²	58.4	2%	0.015	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	119.9	-177.1	-57.9	175.6	0	0	0	110.9	T559 T576 I580 F606 V611 I658 F661	I552-T559 PolarHBondContact O-N 2.9Å; I552-T559 PolarHBondContact O-OG1 3.35Å; I552-T576 HydrophobicContact CD1-CG2 3.61Å; I552-I580 HydrophobicContact CD1-CD1 3.75Å; I552-I580 HydrophobicContact CD1-CG1 4.43Å; I552-I580 HydrophobicContact CG1-CD1 4.21Å; I552-F606 HydrophobicContact CD1-CD1 4.1Å; I552-F606 HydrophobicContact CD1-CE1 3.68Å; I552-V611 HydrophobicContact CB-CB 4.18Å; I552-V611 HydrophobicContact CB-CG1 4.34Å; I552-V611 WeakPolarHBondContact CB-O 3.48Å; I552-V611 HydrophobicContact CD1-CB 4.21Å; I552-V611 HydrophobicContact CD1-CG1 3.44Å; I552-V611 VanDerWaalsContact CD1-CG1 3.44Å; I552-V611 HydrophobicContact CG1-CG1 4.21Å; I552-V611 VanDerWaalsContact CG1-O 3.31Å; I552-V611 WeakPolarHBondContact CG1-O 3.4Å; I552-V611 PolarHBondContact N-O 3.37Å; I552-I658 HydrophobicContact CD1-CD1 4.12Å; I552-I658 HydrophobicContact CG1-CD1 4.43Å; I552-I658 HydrophobicContact CG2-CB 4.18Å; I552-I658 HydrophobicContact CG2-CD1 3.96Å; I552-I658 HydrophobicContact CG2-CG1 3.62Å; I552-I658 HydrophobicContact CG2-CG2 4Å; I552-F661 HydrophobicContact CG1-CE1 4.37Å
553	L	63.6	Low	63.9	Low	36 Å²	36	61 Å²	61	19%	0.188	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	134.9	175.4	-62.1	166.5	0	0	0	110	Q558 L659 S660	L553-Q558 HydrophobicContact CD2-CG 3.95Å; L553-L659 PolarHBondContact O-N 3.03Å; L553-S660 WeakPolarHBondContact CB-OG 2.94Å; L553-S660 WeakPolarHBondContact CD1-OG 3.23Å; L553-S660 PolarHBondContact N-O 3.21Å
554	T	56.1	Low	64.5	Low	41 Å²	41	62.5 Å²	62.5	25%	0.252	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	110.8	171.5	-44.8	0	0	0	0	106.6	Q557 T559 S655	T554-Q557 PolarHBondContact N-O 2.89Å; T554-Q557 PolarHBondContact O-N 3.09Å; T554-Q557 VanDerWaalsContact O-N 3.17Å; T554-Q557 VanDerWaalsContact O-O 3.07Å; T554-T559 PolarHBondContact N-OG1 3.42Å; T554-T559 PolarHBondContact OG1-OG1 2.97Å; T554-S655 VanDerWaalsContact CG2-O 3.3Å; T554-S655 WeakPolarHBondContact CG2-O 3.43Å
555	G	53.8	Low	65	Low	26 Å²	26	61.5 Å²	61.5	27%	0.268	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	-143.6	-164.5	0	0	0	0	0	111.5	Q557 L659	G555-Q557 VanDerWaalsContact C-N 3.26Å; G555-L659 VanDerWaalsContact N-CG 3.34Å
556	N	48.6	Very low	65.2	Low	175 Å²	175	60 Å²	60	94%	0.936	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	12	164.4	-65.3	-16.3	0	0	0	111.9
557	Q	46.2	Very low	65.5	Low	154 Å²	154	62.1 Å²	62.1	72%	0.72	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	144.9	-176.3	-64.7	-159.2	-22.9	0	0	111.7	T554 G555 T559	T554-Q557 PolarHBondContact N-O 2.89Å; T554-Q557 PolarHBondContact O-N 3.09Å; T554-Q557 VanDerWaalsContact O-N 3.17Å; T554-Q557 VanDerWaalsContact O-O 3.07Å; G555-Q557 VanDerWaalsContact C-N 3.26Å; Q557-T559 PolarHBondContact O-N 3.47Å
558	Q	59.2	Low	65.6	Low	101 Å²	101	61 Å²	61	47%	0.472	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	132.1	171.4	-72.3	179.5	-28.4	0	0	109.4	E551 L553 N560 S610	E551-Q558 PolarHBondContact OE1-NE2 2.69Å; L553-Q558 HydrophobicContact CD2-CG 3.95Å; Q558-N560 PolarHBondContact O-N 2.99Å; Q558-S610 PolarHBondContact NE2-OG 2.97Å; Q558-S610 PolarHBondContact OE1-OG 3.46Å
559	T	63.3	Low	65.5	Low	32 Å²	32	64.7 Å²	64.7	20%	0.196	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-68	131	177.7	-47.5	0	0	0	0	108.8	I552 T554 Q557 V611	I552-T559 PolarHBondContact O-N 2.9Å; I552-T559 PolarHBondContact O-OG1 3.35Å; T554-T559 PolarHBondContact N-OG1 3.42Å; T554-T559 PolarHBondContact OG1-OG1 2.97Å; Q557-T559 PolarHBondContact O-N 3.47Å; T559-V611 HydrophobicContact CG2-CG2 3.99Å
560	N	67	Low	65.6	Low	148 Å²	148	63.6 Å²	63.6	79%	0.791	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-67.3	138.5	175.8	-72.8	-41.2	0	0	0	110.3	Q558 N562	Q558-N560 PolarHBondContact O-N 2.99Å; N560-N562 PolarHBondContact O-N 2.85Å
561	W	71.9	Confident	65.7	Low	83 Å²	83	66.3 Å²	66.3	31%	0.314	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-60.3	125.9	174.9	174.7	-108.4	0	0	0	111.3	L565 F606 Y607 P608 V611	W561-L565 HydrophobicContact CE3-CB 4.48Å; W561-L565 HydrophobicContact CE3-CD1 4.5Å; W561-L565 HydrophobicContact CH2-CB 4.02Å; W561-L565 HydrophobicContact CZ3-CB 3.85Å; W561-F606 HydrophobicContact CH2-CB 4.38Å; W561-F606 HydrophobicContact CZ3-CB 3.99Å; W561-Y607 VanDerWaalsContact CZ3-O 3.28Å; W561-Y607 WeakPolarHBondContact CZ3-O 2.99Å; W561-P608 VanDerWaalsContact CD2-CA 3.46Å; W561-P608 HydrophobicContact CD2-CB 3.72Å; W561-P608 VanDerWaalsContact CE3-CA 3.41Å; W561-P608 HydrophobicContact CE3-CB 4.18Å; W561-P608 HydrophobicContact CG-CB 3.89Å; W561-P608 HydrophobicContact CZ2-CB 4.32Å; W561-V611 HydrophobicContact CE3-CG2 4.37Å
562	N	75.5	Confident	66	Low	63 Å²	63	67.9 Å²	67.9	34%	0.337	38%	0.376	S	S	.	.			trans	-109.2	126.3	167.6	-173.8	-31.8	0	0	0	108.5	N560 E564 L565 L572	N560-N562 PolarHBondContact O-N 2.85Å; N562-E564 PolarHBondContact O-N 3.44Å; N562-E564 VanDerWaalsContact O-N 3.14Å; N562-E564 WeakPolarHBondContact OD1-CB 3.46Å; N562-E564 PolarHBondContact OD1-N 2.79Å; N562-L565 HydrophobicContact CB-CD1 4.36Å; N562-L565 VanDerWaalsContact O-CB 3.31Å; N562-L565 WeakPolarHBondContact O-CB 3.34Å; N562-L565 PolarHBondContact O-N 2.9Å; N562-L572 HydrophobicContact CB-CD2 3.72Å; N562-L572 VanDerWaalsContact CG-CD2 3.45Å; N562-L572 VanDerWaalsContact ND2-CD2 3.28Å; N562-L572 WeakPolarHBondContact ND2-CD2 3.07Å
563	S	76.1	Confident	66.5	Low	83 Å²	83	68.6 Å²	68.6	58%	0.58	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-58.8	-25	179.9	49.8	0	0	0	0	113.6	L565 S566	S563-L565 PolarHBondContact O-N 3.19Å; S563-S566 PolarHBondContact O-N 3.45Å; S563-S566 PolarHBondContact O-OG 2.8Å
564	E	75.6	Confident	67.1	Low	99 Å²	99	71.2 Å²	71.2	46%	0.463	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-58.8	-28.9	173.6	-70.9	-177.7	-154.3	0	0	112.3	N562 S566 N567 S570 L572	N562-E564 PolarHBondContact O-N 3.44Å; N562-E564 VanDerWaalsContact O-N 3.14Å; N562-E564 WeakPolarHBondContact OD1-CB 3.46Å; N562-E564 PolarHBondContact OD1-N 2.79Å; E564-S566 PolarHBondContact O-N 3.16Å; E564-N567 PolarHBondContact O-N 2.82Å; E564-N567 VanDerWaalsContact O-O 3.04Å; E564-S570 WeakPolarHBondContact O-CB 3.24Å; E564-S570 PolarHBondContact O-OG 2.89Å; E564-L572 HydrophobicContact CB-CB 4.11Å; E564-L572 HydrophobicContact CB-CD2 3.99Å
565	L	74.7	Confident	68.2	Low	7 Å²	7	71.2 Å²	71.2	4%	0.037	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-68.9	-11.9	176.2	-65.9	168.6	0	0	0	113.9	W561 N562 S563 N567 L572 Y573 T576 F606 V611	W561-L565 HydrophobicContact CE3-CB 4.48Å; W561-L565 HydrophobicContact CE3-CD1 4.5Å; W561-L565 HydrophobicContact CH2-CB 4.02Å; W561-L565 HydrophobicContact CZ3-CB 3.85Å; N562-L565 HydrophobicContact CB-CD1 4.36Å; N562-L565 VanDerWaalsContact O-CB 3.31Å; N562-L565 WeakPolarHBondContact O-CB 3.34Å; N562-L565 PolarHBondContact O-N 2.9Å; S563-L565 PolarHBondContact O-N 3.19Å; L565-N567 VanDerWaalsContact C-N 3.35Å; L565-L572 HydrophobicContact CD2-CD2 4.23Å; L565-L572 HydrophobicContact CD2-CG 3.88Å; L565-L572 HydrophobicContact CG-CD2 4Å; L565-L572 HydrophobicContact CG-CG 4.22Å; L565-Y573 VanDerWaalsContact O-CD2 3.3Å; L565-Y573 WeakPolarHBondContact O-CD2 3.14Å; L565-T576 HydrophobicContact CD2-CG2 4.07Å; L565-F606 HydrophobicContact CB-CB 3.99Å; L565-F606 HydrophobicContact CB-CD2 4.25Å; L565-F606 HydrophobicContact CB-CG 4.18Å; L565-F606 HydrophobicContact CD2-CD2 4.08Å; L565-F606 HydrophobicContact CD2-CE2 4.16Å; L565-F606 HydrophobicContact CD2-CG 4.3Å; L565-F606 HydrophobicContact CD2-CZ 4.43Å; L565-F606 WeakPolarHBondContact O-CB 2.69Å; L565-V611 HydrophobicContact CD1-CB 4.49Å; L565-V611 HydrophobicContact CD1-CG1 3.59Å; L565-V611 HydrophobicContact CD1-CG2 3.96Å
566	S	68.4	Low	69.3	Low	85 Å²	85	70.7 Å²	70.7	59%	0.594	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-82.6	-12.9	168.7	60.7	0	0	0	0	114	S563 E564	S563-S566 PolarHBondContact O-N 3.45Å; S563-S566 PolarHBondContact O-OG 2.8Å; E564-S566 PolarHBondContact O-N 3.16Å
567	N	69.2	Low	70.9	Confident	51 Å²	51	62.7 Å²	62.7	27%	0.273	35%	0.345	S	S	.	.			trans	-105.2	110.9	179.7	179.2	-0.2	0	0	0	108.7	E134 E564 L565 F569 S570 Y573	E134-N567 PolarHBondContact OE2-OD1 3.17Å; E564-N567 PolarHBondContact O-N 2.82Å; E564-N567 VanDerWaalsContact O-O 3.04Å; L565-N567 VanDerWaalsContact C-N 3.35Å; N567-F569 PolarHBondContact O-N 2.76Å; N567-F569 WeakPolarHBondContact OD1-CB 2.96Å; N567-F569 PolarHBondContact OD1-N 3.15Å; N567-S570 WeakPolarHBondContact O-CB 3.25Å; N567-S570 PolarHBondContact O-N 2.65Å; N567-S570 PolarHBondContact O-OG 2.88Å; N567-Y573 VanDerWaalsContact O-CB 3.22Å; N567-Y573 WeakPolarHBondContact O-CB 3.48Å
568	K	64.5	Low	72.6	Confident	30 Å²	30	61.9 Å²	61.9	13%	0.13	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-18.6	-175.3	65.4	170.1	-175.9	176.2	0	113.2	E130 E134 S570 Y573 N574	E130-K568 VanDerWaalsContact CD-NZ 3.3Å; E130-K568 HydrophobicContact CG-CD 4.48Å; E130-K568 VanDerWaalsContact CG-NZ 3.26Å; E130-K568 PolarHBondContact O-NZ 2.85Å; E130-K568 VanDerWaalsContact O-NZ 3.16Å; E130-K568 WeakPolarHBondContact OE1-CD 3.1Å; E130-K568 IonicContact OE1-NZ 3.89Å; E130-K568 PolarHBondContact OE1-NZ 2.88Å; E134-K568 WeakPolarHBondContact OE1-CD 3.42Å; E134-K568 WeakPolarHBondContact OE1-CE 3.41Å; E134-K568 WeakPolarHBondContact OE1-CG 3.34Å; E134-K568 IonicContact OE1-NZ 2.97Å; E134-K568 WeakPolarHBondContact OE2-CG 3.08Å; E134-K568 PolarHBondContact OE2-N 3.31Å; E134-K568 VanDerWaalsContact OE2-N 3.14Å; K568-S570 VanDerWaalsContact C-N 3.32Å; K568-Y573 VanDerWaalsContact CA-CG 3.48Å; K568-Y573 HydrophobicContact CB-CD1 3.98Å; K568-Y573 HydrophobicContact CB-CD2 3.98Å; K568-Y573 HydrophobicContact CB-CE1 3.79Å; K568-Y573 HydrophobicContact CB-CE2 3.76Å; K568-Y573 HydrophobicContact CB-CG 4.13Å; K568-N574 PolarHBondContact O-OD1 2.65Å
569	F	64.2	Low	73.7	Confident	87 Å²	87	60.5 Å²	60.5	38%	0.382	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-9.7	168.9	-58.9	-43.6	0	0	0	114.7	Y131 E134 N567 G571	Y131-F569 AromaticContact CD2-CE1 3.9Å; Y131-F569 HydrophobicContact CD2-CE1 3.9Å; Y131-F569 AromaticContact CD2-CZ 3.65Å; Y131-F569 HydrophobicContact CD2-CZ 3.65Å; Y131-F569 AromaticContact CE2-CE1 3.51Å; Y131-F569 HydrophobicContact CE2-CE1 3.51Å; Y131-F569 HydrophobicContact CE2-CE2 4.44Å; Y131-F569 AromaticContact CE2-CZ 3.21Å; Y131-F569 HydrophobicContact CE2-CZ 3.21Å; Y131-F569 AromaticContact CZ-CZ 3.9Å; E134-F569 HydrophobicContact CB-CE2 4.08Å; E134-F569 HydrophobicContact CB-CZ 4.35Å; E134-F569 HydrophobicContact CG-CD2 3.59Å; E134-F569 HydrophobicContact CG-CE2 3.29Å; E134-F569 HydrophobicContact CG-CG 4.47Å; E134-F569 HydrophobicContact CG-CZ 3.94Å; E134-F569 WeakPolarHBondContact OE1-CD1 3.37Å; E134-F569 VanDerWaalsContact OE1-CD2 3.23Å; E134-F569 WeakPolarHBondContact OE1-CD2 3.3Å; E134-F569 WeakPolarHBondContact OE1-CE1 3.44Å; E134-F569 WeakPolarHBondContact OE1-CE2 3.39Å; E134-F569 WeakPolarHBondContact OE1-CG 3.18Å; E134-F569 WeakPolarHBondContact OE1-CZ 3.12Å; E134-F569 WeakPolarHBondContact OE2-CD2 3.32Å; E134-F569 WeakPolarHBondContact OE2-CE2 3.33Å; E134-F569 WeakPolarHBondContact OE2-CG 3.36Å; E134-F569 PolarHBondContact OE2-N 3.42Å; N567-F569 PolarHBondContact O-N 2.76Å; N567-F569 WeakPolarHBondContact OD1-CB 2.96Å; N567-F569 PolarHBondContact OD1-N 3.15Å; F569-G571 PolarHBondContact O-N 3.02Å
570	S	69.6	Low	74.6	Confident	12 Å²	12	59 Å²	59	8%	0.084	32%	0.324	C	S	.	.	S	Bend	trans	-66.6	141.4	-179.9	76.5	0	0	0	0	110.2	E564 N567 K568 L572 Y573 N574	E564-S570 WeakPolarHBondContact O-CB 3.24Å; E564-S570 PolarHBondContact O-OG 2.89Å; N567-S570 WeakPolarHBondContact O-CB 3.25Å; N567-S570 PolarHBondContact O-N 2.65Å; N567-S570 PolarHBondContact O-OG 2.88Å; K568-S570 VanDerWaalsContact C-N 3.32Å; S570-L572 PolarHBondContact O-N 2.82Å; S570-Y573 PolarHBondContact O-N 3.03Å; S570-Y573 VanDerWaalsContact O-N 3.1Å; S570-Y573 VanDerWaalsContact OG-CB 3.27Å; S570-Y573 WeakPolarHBondContact OG-CB 3.2Å; S570-Y573 PolarHBondContact OG-N 2.88Å; S570-N574 PolarHBondContact O-N 2.77Å; S570-N574 VanDerWaalsContact O-N 3.16Å
571	G	73	Confident	75.4	Confident	57 Å²	57	52.5 Å²	52.5	59%	0.588	29%	0.291	S	S	*	.	H	α-helix	trans	-56.1	-33	172.4	0	0	0	0	0	111.3	F569 S575	F569-G571 PolarHBondContact O-N 3.02Å; G571-S575 VanDerWaalsContact O-CB 3.31Å; G571-S575 WeakPolarHBondContact O-CB 3.3Å; G571-S575 PolarHBondContact O-N 2.66Å
572	L	76.4	Confident	75.9	Confident	52 Å²	52	51.3 Å²	51.3	27%	0.272	29%	0.292	S	S	.	.	H	α-helix	trans	-67	-42.8	175.9	-171.4	63.1	0	0	0	112.8	N562 E564 L565 S570 T576	N562-L572 HydrophobicContact CB-CD2 3.72Å; N562-L572 VanDerWaalsContact CG-CD2 3.45Å; N562-L572 VanDerWaalsContact ND2-CD2 3.28Å; N562-L572 WeakPolarHBondContact ND2-CD2 3.07Å; E564-L572 HydrophobicContact CB-CB 4.11Å; E564-L572 HydrophobicContact CB-CD2 3.99Å; L565-L572 HydrophobicContact CD2-CD2 4.23Å; L565-L572 HydrophobicContact CD2-CG 3.88Å; L565-L572 HydrophobicContact CG-CD2 4Å; L565-L572 HydrophobicContact CG-CG 4.22Å; S570-L572 PolarHBondContact O-N 2.82Å; L572-T576 WeakPolarHBondContact O-CB 3.47Å; L572-T576 PolarHBondContact O-N 2.83Å; L572-T576 PolarHBondContact O-OG1 3.37Å
573	Y	79.3	Confident	76.2	Confident	19 Å²	19	48.7 Å²	48.7	8%	0.075	28%	0.278	C	S	.	.	H	α-helix	trans	-59.3	-50.2	175.5	-176.6	-73.7	0	0	0	110.6	L565 N567 K568 S570 T576 G577 V603 L604 F606	L565-Y573 VanDerWaalsContact O-CD2 3.3Å; L565-Y573 WeakPolarHBondContact O-CD2 3.14Å; N567-Y573 VanDerWaalsContact O-CB 3.22Å; N567-Y573 WeakPolarHBondContact O-CB 3.48Å; K568-Y573 VanDerWaalsContact CA-CG 3.48Å; K568-Y573 HydrophobicContact CB-CD1 3.98Å; K568-Y573 HydrophobicContact CB-CD2 3.98Å; K568-Y573 HydrophobicContact CB-CE1 3.79Å; K568-Y573 HydrophobicContact CB-CE2 3.76Å; K568-Y573 HydrophobicContact CB-CG 4.13Å; S570-Y573 PolarHBondContact O-N 3.03Å; S570-Y573 VanDerWaalsContact O-N 3.1Å; S570-Y573 VanDerWaalsContact OG-CB 3.27Å; S570-Y573 WeakPolarHBondContact OG-CB 3.2Å; S570-Y573 PolarHBondContact OG-N 2.88Å; Y573-T576 PolarHBondContact O-N 3.41Å; Y573-G577 PolarHBondContact O-N 3.3Å; Y573-V603 HydrophobicContact CE1-CG1 4.43Å; Y573-V603 PolarHBondContact OH-O 3.04Å; Y573-L604 VanDerWaalsContact OH-C 3.31Å; Y573-L604 PolarHBondContact OH-O 3.04Å; Y573-L604 VanDerWaalsContact OH-O 3.14Å; Y573-F606 HydrophobicContact CD1-CE2 4.09Å; Y573-F606 AromaticContact CD2-CD2 3.37Å; Y573-F606 HydrophobicContact CD2-CD2 3.37Å; Y573-F606 AromaticContact CD2-CE2 3.59Å; Y573-F606 HydrophobicContact CD2-CE2 3.59Å; Y573-F606 HydrophobicContact CE1-CE2 4.19Å; Y573-F606 AromaticContact CE2-CD2 3.43Å; Y573-F606 HydrophobicContact CE2-CD2 3.43Å; Y573-F606 VanDerWaalsContact CE2-CD2 3.43Å; Y573-F606 AromaticContact CE2-CE2 3.75Å; Y573-F606 HydrophobicContact CE2-CE2 3.75Å; Y573-F606 HydrophobicContact CG-CD2 4.02Å; Y573-F606 AromaticContact CG-CE2 3.75Å; Y573-F606 HydrophobicContact CG-CE2 3.75Å
574	N	76.2	Confident	76.6	Confident	91 Å²	91	44.8 Å²	44.8	49%	0.487	25%	0.251	S	S	.	.	H	α-helix	trans	-64.5	-49.6	-178	-73.6	-25.1	0	0	0	112	K568 S570 T576 G577 E578	K568-N574 PolarHBondContact O-OD1 2.65Å; S570-N574 PolarHBondContact O-N 2.77Å; S570-N574 VanDerWaalsContact O-N 3.16Å; N574-T576 VanDerWaalsContact C-N 3.31Å; N574-T576 PolarHBondContact O-N 3.32Å; N574-G577 PolarHBondContact O-N 3.16Å; N574-E578 VanDerWaalsContact O-CB 3.27Å; N574-E578 WeakPolarHBondContact O-CB 3.41Å; N574-E578 PolarHBondContact O-N 2.86Å
575	S	78.8	Confident	77.1	Confident	41 Å²	41	43.9 Å²	43.9	29%	0.287	25%	0.245	S	C	.	.	H	α-helix	trans	-60.3	-41.1	176.3	143.1	0	0	0	0	111.7	G571 K579	G571-S575 VanDerWaalsContact O-CB 3.31Å; G571-S575 WeakPolarHBondContact O-CB 3.3Å; G571-S575 PolarHBondContact O-N 2.66Å; S575-K579 WeakPolarHBondContact O-CB 3.43Å; S575-K579 WeakPolarHBondContact O-CD 3.33Å; S575-K579 WeakPolarHBondContact O-CG 3.23Å; S575-K579 PolarHBondContact O-N 3.5Å
576	T	78.6	Confident	77.4	Confident	15 Å²	15	44 Å²	44	9%	0.092	25%	0.247	C	C	.	.	H	α-helix	trans	-69.2	-42.6	-179.9	-55.6	0	0	0	0	110.8	I552 L565 L572 Y573 N574 K579 I580 F606 I658	I552-T576 HydrophobicContact CD1-CG2 3.61Å; L565-T576 HydrophobicContact CD2-CG2 4.07Å; L572-T576 WeakPolarHBondContact O-CB 3.47Å; L572-T576 PolarHBondContact O-N 2.83Å; L572-T576 PolarHBondContact O-OG1 3.37Å; Y573-T576 PolarHBondContact O-N 3.41Å; N574-T576 VanDerWaalsContact C-N 3.31Å; N574-T576 PolarHBondContact O-N 3.32Å; T576-K579 PolarHBondContact O-N 3.23Å; T576-I580 HydrophobicContact CG2-CD1 4.45Å; T576-I580 WeakPolarHBondContact O-CG1 3.5Å; T576-I580 PolarHBondContact O-N 3.32Å; T576-F606 HydrophobicContact CG2-CE1 3.64Å; T576-F606 HydrophobicContact CG2-CZ 3.64Å; T576-I658 HydrophobicContact CG2-CD1 3.92Å
577	G	81.7	Confident	77.9	Confident	7 Å²	7	39.9 Å²	39.9	7%	0.072	22%	0.219	C	C	.	.	H	α-helix	trans	-66.9	-39.2	177.5	0	0	0	0	0	113	Y573 N574 I580 C581	Y573-G577 PolarHBondContact O-N 3.3Å; N574-G577 PolarHBondContact O-N 3.16Å; G577-I580 PolarHBondContact O-N 3.33Å; G577-C581 PolarHBondContact O-N 3.13Å
578	E	82.3	Confident	78.1	Confident	137 Å²	137	38.5 Å²	38.5	64%	0.64	21%	0.212	S	C	*	.	H	α-helix	trans	-62.7	-43.2	173.8	-174.9	177.3	-166.8	0	0	111.5	N574 I580 C581 T582	N574-E578 VanDerWaalsContact O-CB 3.27Å; N574-E578 WeakPolarHBondContact O-CB 3.41Å; N574-E578 PolarHBondContact O-N 2.86Å; E578-I580 VanDerWaalsContact C-N 3.33Å; E578-I580 PolarHBondContact O-N 2.89Å; E578-C581 PolarHBondContact O-N 3.47Å; E578-T582 VanDerWaalsContact O-CB 3.27Å; E578-T582 WeakPolarHBondContact O-CB 3.4Å; E578-T582 PolarHBondContact O-N 3.21Å; E578-T582 PolarHBondContact O-OG1 3.22Å
579	K	81.3	Confident	78.5	Confident	71 Å²	71	47.4 Å²	47.4	31%	0.309	25%	0.245	S	C	.	.	H	α-helix	trans	-60	-42.4	173.6	-73.6	169.2	-174	178.5	0	111.7	S575 T576 T582 L583 I658	S575-K579 WeakPolarHBondContact O-CB 3.43Å; S575-K579 WeakPolarHBondContact O-CD 3.33Å; S575-K579 WeakPolarHBondContact O-CG 3.23Å; S575-K579 PolarHBondContact O-N 3.5Å; T576-K579 PolarHBondContact O-N 3.23Å; K579-T582 PolarHBondContact O-N 3.43Å; K579-L583 PolarHBondContact O-N 2.72Å; K579-L583 VanDerWaalsContact O-N 3.08Å; K579-I658 HydrophobicContact CB-CD1 3.83Å; K579-I658 HydrophobicContact CB-CG1 4.4Å
580	I	81.5	Confident	78.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-52.2	175	-68.4	165	0	0	0	111.7	I552 T576 G577 E578 T582 L583 I584 V603 F606 V615 I658 F661	I552-I580 HydrophobicContact CD1-CD1 3.75Å; I552-I580 HydrophobicContact CD1-CG1 4.43Å; I552-I580 HydrophobicContact CG1-CD1 4.21Å; T576-I580 HydrophobicContact CG2-CD1 4.45Å; T576-I580 WeakPolarHBondContact O-CG1 3.5Å; T576-I580 PolarHBondContact O-N 3.32Å; G577-I580 PolarHBondContact O-N 3.33Å; E578-I580 VanDerWaalsContact C-N 3.33Å; E578-I580 PolarHBondContact O-N 2.89Å; I580-T582 VanDerWaalsContact C-N 3.27Å; I580-T582 PolarHBondContact O-N 3.2Å; I580-L583 PolarHBondContact O-N 2.49Å; I580-I584 HydrophobicContact CG2-CD1 3.58Å; I580-I584 HydrophobicContact CG2-CG1 4.48Å; I580-I584 WeakPolarHBondContact O-CG1 3.44Å; I580-I584 PolarHBondContact O-N 2.92Å; I580-I584 VanDerWaalsContact O-N 3.09Å; I580-V603 HydrophobicContact CB-CG2 4.21Å; I580-V603 HydrophobicContact CD1-CG2 4.28Å; I580-V603 HydrophobicContact CG2-CG2 4.19Å; I580-F606 HydrophobicContact CD1-CE1 3.5Å; I580-F606 VanDerWaalsContact CD1-CE1 3.5Å; I580-F606 HydrophobicContact CD1-CZ 3.89Å; I580-V615 HydrophobicContact CG2-CG2 3.84Å; I580-I658 HydrophobicContact CD1-CD1 4.4Å; I580-I658 HydrophobicContact CG1-CD1 3.67Å; I580-F661 HydrophobicContact CB-CZ 3.93Å; I580-F661 HydrophobicContact CG1-CE1 3.76Å; I580-F661 HydrophobicContact CG1-CZ 3.62Å; I580-F661 HydrophobicContact CG2-CE1 4.49Å; I580-F661 HydrophobicContact CG2-CE2 4.2Å; I580-F661 HydrophobicContact CG2-CZ 3.96Å
581	C	84.2	Confident	77.8	Confident	13 Å²	13	44.8 Å²	44.8	9%	0.088	23%	0.232	C	C	.	.	H	α-helix	trans	-68.3	-28.5	-178.8	-75.6	0	0	0	0	113.1	G577 E578 K585 C601	G577-C581 PolarHBondContact O-N 3.13Å; E578-C581 PolarHBondContact O-N 3.47Å; C581-K585 WeakPolarHBondContact O-CB 3.34Å; C581-K585 WeakPolarHBondContact O-CG 3.46Å; C581-K585 PolarHBondContact O-N 3.29Å; C581-C601 WeakPolarHBondContact CA-SG 3.38Å; C581-C601 HydrophobicContact CB-CB 3.63Å; C581-C601 WeakPolarHBondContact CB-SG 3.5Å; C581-C601 WeakPolarHBondContact SG-CB 3.35Å; C581-C601 PolarHBondContact SG-O 3.23Å; C581-C601 CovalentContact SG-SG 2.05Å; C581-C601 PolarHBondContact SG-SG 3.48Å
582	T	83.5	Confident	76.6	Confident	57 Å²	57	45.9 Å²	45.9	35%	0.35	23%	0.227	S	C	.	.	H	α-helix	trans	-64.1	-48	172.8	-62	0	0	0	0	110.9	E578 K579 I580 I584 K585 A586 Y643	E578-T582 VanDerWaalsContact O-CB 3.27Å; E578-T582 WeakPolarHBondContact O-CB 3.4Å; E578-T582 PolarHBondContact O-N 3.21Å; E578-T582 PolarHBondContact O-OG1 3.22Å; K579-T582 PolarHBondContact O-N 3.43Å; I580-T582 VanDerWaalsContact C-N 3.27Å; I580-T582 PolarHBondContact O-N 3.2Å; T582-I584 PolarHBondContact O-N 2.63Å; T582-K585 PolarHBondContact O-N 3.08Å; T582-A586 VanDerWaalsContact O-CB 3.23Å; T582-A586 WeakPolarHBondContact O-CB 3.35Å; T582-A586 PolarHBondContact O-N 2.63Å; T582-Y643 HydrophobicContact CG2-CE1 4.23Å
583	L	81.3	Confident	75.3	Confident	9 Å²	9	45.6 Å²	45.6	5%	0.047	23%	0.23	C	C	.	.	H	α-helix	trans	-56	-51.7	174.7	-118	78.6	0	0	0	111.2	K579 I580 K585 A586 S587 S640 Y643 V644 F661	K579-L583 PolarHBondContact O-N 2.72Å; K579-L583 VanDerWaalsContact O-N 3.08Å; I580-L583 PolarHBondContact O-N 2.49Å; L583-K585 PolarHBondContact O-N 2.87Å; L583-A586 PolarHBondContact O-N 2.96Å; L583-S587 PolarHBondContact O-N 3.48Å; L583-S640 PolarHBondContact O-OG 3.27Å; L583-Y643 HydrophobicContact CD1-CD1 3.67Å; L583-Y643 HydrophobicContact CD1-CE1 3.86Å; L583-Y643 HydrophobicContact CG-CD1 3.91Å; L583-Y643 HydrophobicContact CG-CE1 4.49Å; L583-V644 HydrophobicContact CD1-CG2 3.66Å; L583-V644 HydrophobicContact CD2-CG2 3.72Å; L583-V644 HydrophobicContact CG-CG2 3.95Å; L583-F661 HydrophobicContact CB-CD2 4.32Å; L583-F661 HydrophobicContact CB-CE2 3.42Å; L583-F661 VanDerWaalsContact CB-CE2 3.42Å; L583-F661 HydrophobicContact CB-CZ 4.08Å; L583-F661 HydrophobicContact CD2-CD2 3.58Å; L583-F661 HydrophobicContact CD2-CE1 4.49Å; L583-F661 HydrophobicContact CD2-CE2 3.17Å; L583-F661 HydrophobicContact CD2-CG 4.36Å; L583-F661 HydrophobicContact CD2-CZ 3.63Å; L583-F661 HydrophobicContact CG-CE2 3.88Å; L583-F661 HydrophobicContact CG-CZ 4.38Å
584	I	84.1	Confident	74.2	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.4	-43.8	-175	-66.8	165.8	0	0	0	111	M548 I580 T582 A586 S587 V598 V615 I617 I636 F661	M548-I584 HydrophobicContact CE-CD1 3.24Å; M548-I584 HydrophobicContact CE-CG1 3.77Å; I580-I584 HydrophobicContact CG2-CD1 3.58Å; I580-I584 HydrophobicContact CG2-CG1 4.48Å; I580-I584 WeakPolarHBondContact O-CG1 3.44Å; I580-I584 PolarHBondContact O-N 2.92Å; I580-I584 VanDerWaalsContact O-N 3.09Å; T582-I584 PolarHBondContact O-N 2.63Å; I584-A586 VanDerWaalsContact C-N 3.31Å; I584-A586 PolarHBondContact O-N 3.29Å; I584-S587 WeakPolarHBondContact O-CB 3.16Å; I584-S587 PolarHBondContact O-N 3.36Å; I584-S587 PolarHBondContact O-OG 3.05Å; I584-V598 HydrophobicContact CG2-CG1 3.96Å; I584-V598 HydrophobicContact CG2-CG2 4.38Å; I584-V615 HydrophobicContact CD1-CB 4.47Å; I584-V615 HydrophobicContact CD1-CG1 3.78Å; I584-V615 HydrophobicContact CD1-CG2 4.49Å; I584-I617 HydrophobicContact CG2-CG2 4.03Å; I584-I636 HydrophobicContact CB-CG2 4.41Å; I584-I636 HydrophobicContact CG1-CG2 4.16Å; I584-I636 HydrophobicContact CG2-CG2 3.95Å; I584-F661 HydrophobicContact CG1-CE2 4.33Å
585	K	85.9	Confident	73.6	Confident	80 Å²	80	45.5 Å²	45.5	35%	0.348	23%	0.23	S	C	.	.	H	α-helix	trans	-69.3	-29	178.4	-73.2	176.8	173.9	171.4	0	112.6	C581 T582 L583 P588 V598 C601	C581-K585 WeakPolarHBondContact O-CB 3.34Å; C581-K585 WeakPolarHBondContact O-CG 3.46Å; C581-K585 PolarHBondContact O-N 3.29Å; T582-K585 PolarHBondContact O-N 3.08Å; L583-K585 PolarHBondContact O-N 2.87Å; K585-P588 WeakPolarHBondContact O-CD 3.35Å; K585-V598 HydrophobicContact CG-CG1 4.49Å; K585-C601 HydrophobicContact CG-CB 4.39Å
586	A	81.1	Confident	73.4	Confident	9 Å²	9	44.1 Å²	44.1	7%	0.074	22%	0.219	C	C	.	.	H	α-helix	trans	-74.5	-31.9	173.9	0	0	0	0	0	111.9	T582 L583 I584 P588 R589 Y590 Y643	T582-A586 VanDerWaalsContact O-CB 3.23Å; T582-A586 WeakPolarHBondContact O-CB 3.35Å; T582-A586 PolarHBondContact O-N 2.63Å; L583-A586 PolarHBondContact O-N 2.96Å; I584-A586 VanDerWaalsContact C-N 3.31Å; I584-A586 PolarHBondContact O-N 3.29Å; A586-P588 VanDerWaalsContact C-N 3.32Å; A586-P588 VanDerWaalsContact O-CD 3.28Å; A586-P588 WeakPolarHBondContact O-CD 3.3Å; A586-R589 WeakPolarHBondContact O-CB 3.45Å; A586-R589 PolarHBondContact O-N 3.02Å; A586-Y590 HydrophobicContact CB-CE2 4.34Å; A586-Y590 WeakPolarHBondContact O-CD2 3.47Å; A586-Y643 HydrophobicContact CB-CD1 4.13Å; A586-Y643 HydrophobicContact CB-CD2 3.41Å; A586-Y643 VanDerWaalsContact CB-CD2 3.41Å; A586-Y643 HydrophobicContact CB-CE1 4.4Å; A586-Y643 HydrophobicContact CB-CE2 3.73Å; A586-Y643 HydrophobicContact CB-CG 3.6Å
587	S	78.6	Confident	73.5	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-44.8	-41	-174.2	73.8	0	0	0	0	116.5	L583 I584 R589 Y590 I636	L583-S587 PolarHBondContact O-N 3.48Å; I584-S587 WeakPolarHBondContact O-CB 3.16Å; I584-S587 PolarHBondContact O-N 3.36Å; I584-S587 PolarHBondContact O-OG 3.05Å; S587-R589 PolarHBondContact O-N 2.82Å; S587-Y590 PolarHBondContact O-N 3.33Å; S587-Y590 VanDerWaalsContact O-N 3.11Å; S587-I636 WeakPolarHBondContact CB-O 3.47Å
588	P	74.5	Confident	73.6	Confident	21 Å²	21	46.9 Å²	46.9	14%	0.136	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-69.9	-20.1	-178.3	-7	22.4	0	0	0	113.5	K585 A586 Y590 F596 V598	K585-P588 WeakPolarHBondContact O-CD 3.35Å; A586-P588 VanDerWaalsContact C-N 3.32Å; A586-P588 VanDerWaalsContact O-CD 3.28Å; A586-P588 WeakPolarHBondContact O-CD 3.3Å; P588-Y590 PolarHBondContact O-N 2.97Å; P588-F596 HydrophobicContact CB-CD1 4.42Å; P588-F596 HydrophobicContact CB-CD2 4.07Å; P588-F596 HydrophobicContact CB-CE1 4.22Å; P588-F596 HydrophobicContact CB-CE2 3.9Å; P588-F596 HydrophobicContact CB-CG 4.34Å; P588-F596 HydrophobicContact CB-CZ 3.96Å; P588-F596 WeakPolarHBondContact CB-O 3.43Å; P588-F596 HydrophobicContact CG-CD2 3.86Å; P588-F596 HydrophobicContact CG-CE2 3.55Å; P588-F596 HydrophobicContact CG-CZ 4.01Å; P588-V598 HydrophobicContact CG-CG2 4.04Å
589	R	72.9	Confident	73.2	Confident	218 Å²	218	41.7 Å²	41.7	82%	0.823	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-72.3	-21.6	175.2	-60.2	-179.6	179.2	179.9	-1.2	112.5	A586 S587	A586-R589 WeakPolarHBondContact O-CB 3.45Å; A586-R589 PolarHBondContact O-N 3.02Å; S587-R589 PolarHBondContact O-N 2.82Å
590	Y	60.7	Low	73.2	Confident	34 Å²	34	39.6 Å²	39.6	13%	0.133	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-105.7	14.3	-174.7	-68.6	-96.7	0	0	0	110.8	V507 I508 A586 S587 P588 L642 Y643 D646	V507-Y590 WeakPolarHBondContact CG1-O 3.32Å; I508-Y590 HydrophobicContact CD1-CD1 3.28Å; I508-Y590 HydrophobicContact CD1-CE1 4.26Å; I508-Y590 HydrophobicContact CD1-CG 3.86Å; A586-Y590 HydrophobicContact CB-CE2 4.34Å; A586-Y590 WeakPolarHBondContact O-CD2 3.47Å; S587-Y590 PolarHBondContact O-N 3.33Å; S587-Y590 VanDerWaalsContact O-N 3.11Å; P588-Y590 PolarHBondContact O-N 2.97Å; Y590-L642 HydrophobicContact CD1-CB 4.02Å; Y590-L642 HydrophobicContact CG-CB 4.21Å; Y590-L642 WeakPolarHBondContact O-CD1 3.48Å; Y590-Y643 HydrophobicContact CD2-CD2 4.33Å; Y590-Y643 AromaticContact CE2-CD2 3.5Å; Y590-Y643 HydrophobicContact CE2-CD2 3.5Å; Y590-Y643 VanDerWaalsContact CE2-CD2 3.5Å; Y590-Y643 HydrophobicContact CE2-CE2 4.5Å; Y590-Y643 HydrophobicContact CE2-CG 4.19Å; Y590-Y643 AromaticContact CZ-CD2 3.71Å; Y590-D646 HydrophobicContact CD1-CB 4.46Å; Y590-D646 HydrophobicContact CE1-CB 3.55Å; Y590-D646 PolarHBondContact OH-OD2 2.82Å
591	I	58.5	Low	73.2	Confident	10 Å²	10	40 Å²	40	5%	0.051	21%	0.209	C	C	.	.			trans	-139.3	137.4	179.6	-69.7	-169.2	0	0	0	113	V507 S593 A635 L638 G639	V507-I591 HydrophobicContact CG1-CB 4.2Å; V507-I591 HydrophobicContact CG1-CG1 3.8Å; I591-S593 WeakPolarHBondContact CG2-OG 3.22Å; I591-A635 HydrophobicContact CD1-CB 3.66Å; I591-A635 WeakPolarHBondContact CD1-O 3.43Å; I591-A635 HydrophobicContact CG2-CB 4.29Å; I591-L638 HydrophobicContact CD1-CB 3.92Å; I591-L638 HydrophobicContact CD1-CD2 3.94Å; I591-L638 HydrophobicContact CD1-CG 4.21Å; I591-L638 HydrophobicContact CG1-CD2 4.39Å; I591-G639 VanDerWaalsContact CD1-N 3.34Å
592	T	48	Very low	72.9	Confident	80 Å²	80	41.9 Å²	41.9	49%	0.491	22%	0.22	S	C	.	.	S	Bend	trans	-107.4	-20.2	175.2	53.4	0	0	0	0	113.7	T506 V507 V594	T506-T592 PolarHBondContact O-OG1 3.49Å; V507-T592 WeakPolarHBondContact O-CG2 3.35Å; T592-V594 VanDerWaalsContact C-N 3.29Å; T592-V594 PolarHBondContact O-N 3.19Å
593	S	47.9	Very low	72.6	Confident	46 Å²	46	40 Å²	40	32%	0.322	21%	0.208	S	C	.	.	S	Bend	trans	-65.7	-29.2	-173.5	64.8	0	0	0	0	114	E505 I591	E505-S593 WeakPolarHBondContact OE2-CB 3.21Å; I591-S593 WeakPolarHBondContact CG2-OG 3.22Å
594	V	56.7	Low	72	Confident	11 Å²	11	41.9 Å²	41.9	7%	0.067	22%	0.218	C	C	.	.	S	Bend	trans	-135.4	124.3	175.9	-176.8	0	0	0	0	107.6	T592 F596 V627 I632 A635	T592-V594 VanDerWaalsContact C-N 3.29Å; T592-V594 PolarHBondContact O-N 3.19Å; V594-F596 HydrophobicContact CB-CD1 3.81Å; V594-F596 HydrophobicContact CB-CE1 4.26Å; V594-F596 HydrophobicContact CG1-CB 4.25Å; V594-F596 HydrophobicContact CG1-CD1 3.71Å; V594-F596 HydrophobicContact CG1-CG 4.37Å; V594-F596 WeakPolarHBondContact O-CD1 3.07Å; V594-F596 PolarHBondContact O-N 3Å; V594-V627 HydrophobicContact CG1-CG1 3.9Å; V594-V627 HydrophobicContact CG1-CG2 4.12Å; V594-V627 HydrophobicContact CG2-CG1 3.98Å; V594-I632 HydrophobicContact CG1-CG1 4.38Å; V594-A635 HydrophobicContact CG2-CB 4.46Å
595	L	64.4	Low	71.4	Confident	97 Å²	97	45.8 Å²	45.8	51%	0.508	23%	0.233	S	C	.	.			trans	-83	96.5	171.5	-70.8	167.5	0	0	0	108.8	Y621 I622	L595-Y621 WeakPolarHBondContact O-CA 3.05Å; L595-I622 HydrophobicContact CB-CD1 3.73Å; L595-I622 HydrophobicContact CB-CG1 4.02Å; L595-I622 HydrophobicContact CD1-CD1 3.59Å; L595-I622 HydrophobicContact CG-CD1 4.31Å; L595-I622 PolarHBondContact O-N 3.35Å
596	F	73.3	Confident	70.8	Confident	12 Å²	12	42.6 Å²	42.6	5%	0.053	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	167.6	176.1	70.6	-77.2	0	0	0	112	P588 V594 V598 V619 E620 A635 I636	P588-F596 HydrophobicContact CB-CD1 4.42Å; P588-F596 HydrophobicContact CB-CD2 4.07Å; P588-F596 HydrophobicContact CB-CE1 4.22Å; P588-F596 HydrophobicContact CB-CE2 3.9Å; P588-F596 HydrophobicContact CB-CG 4.34Å; P588-F596 HydrophobicContact CB-CZ 3.96Å; P588-F596 WeakPolarHBondContact CB-O 3.43Å; P588-F596 HydrophobicContact CG-CD2 3.86Å; P588-F596 HydrophobicContact CG-CE2 3.55Å; P588-F596 HydrophobicContact CG-CZ 4.01Å; V594-F596 HydrophobicContact CB-CD1 3.81Å; V594-F596 HydrophobicContact CB-CE1 4.26Å; V594-F596 HydrophobicContact CG1-CB 4.25Å; V594-F596 HydrophobicContact CG1-CD1 3.71Å; V594-F596 HydrophobicContact CG1-CG 4.37Å; V594-F596 WeakPolarHBondContact O-CD1 3.07Å; V594-F596 PolarHBondContact O-N 3Å; F596-V598 HydrophobicContact CD2-CG2 3.93Å; F596-V598 HydrophobicContact CE2-CG2 3.78Å; F596-V619 HydrophobicContact CB-CG1 3.74Å; F596-V619 HydrophobicContact CD2-CG1 3.76Å; F596-V619 HydrophobicContact CG-CG1 4.1Å; F596-E620 CarbonylContact C-O 3.54Å; F596-E620 WeakPolarHBondContact CA-O 3.28Å; F596-E620 WeakPolarHBondContact CB-O 3.42Å; F596-A635 HydrophobicContact CE1-CB 3.61Å; F596-A635 HydrophobicContact CZ-CB 3.93Å; F596-I636 HydrophobicContact CE2-CD1 4.29Å; F596-I636 HydrophobicContact CE2-CG1 3.59Å; F596-I636 HydrophobicContact CZ-CG1 3.89Å
597	T	81.7	Confident	70.3	Confident	69 Å²	69	45.4 Å²	45.4	42%	0.423	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	154.7	166.5	64.1	0	0	0	0	108.9	P599 V619 E620	T597-P599 VanDerWaalsContact C-CD 3.48Å; T597-P599 VanDerWaalsContact O-CD 3.26Å; T597-P599 WeakPolarHBondContact O-CD 3.26Å; T597-V619 WeakPolarHBondContact O-CA 3.41Å; T597-E620 PolarHBondContact N-O 3.43Å; T597-E620 PolarHBondContact O-N 3.49Å
598	V	82.3	Confident	69.4	Low	10 Å²	10	49.8 Å²	49.8	6%	0.061	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	82.3	176.6	-173.3	0	0	0	0	108.8	I584 K585 P588 F596 T600 I617 V619	I584-V598 HydrophobicContact CG2-CG1 3.96Å; I584-V598 HydrophobicContact CG2-CG2 4.38Å; K585-V598 HydrophobicContact CG-CG1 4.49Å; P588-V598 HydrophobicContact CG-CG2 4.04Å; F596-V598 HydrophobicContact CD2-CG2 3.93Å; F596-V598 HydrophobicContact CE2-CG2 3.78Å; V598-T600 VanDerWaalsContact C-N 3.27Å; V598-T600 WeakPolarHBondContact CG1-O 3.46Å; V598-T600 PolarHBondContact O-N 3.37Å; V598-I617 HydrophobicContact CG1-CB 4.04Å; V598-I617 HydrophobicContact CG1-CG2 4.33Å; V598-V619 HydrophobicContact CG2-CG2 4.37Å
599	P	75.2	Confident	68.7	Low	28 Å²	28	51.1 Å²	51.1	18%	0.182	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	-31.8	-180	24	-38.2	0	0	0	113.7	T597 I618 E620	T597-P599 VanDerWaalsContact C-CD 3.48Å; T597-P599 VanDerWaalsContact O-CD 3.26Å; T597-P599 WeakPolarHBondContact O-CD 3.26Å; P599-I618 WeakPolarHBondContact CD-O 3.33Å; P599-I618 HydrophobicContact CG-CB 4.38Å; P599-I618 HydrophobicContact CG-CG2 4.24Å; P599-E620 HydrophobicContact CG-CG 4.02Å
600	T	81.8	Confident	67.9	Low	27 Å²	27	41.6 Å²	41.6	17%	0.166	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.6	-178.4	74.2	0	0	0	0	111.2	V598 I617 I618	V598-T600 VanDerWaalsContact C-N 3.27Å; V598-T600 WeakPolarHBondContact CG1-O 3.46Å; V598-T600 PolarHBondContact O-N 3.37Å; T600-I617 WeakPolarHBondContact O-CA 3.44Å; T600-I618 HydrophobicContact CG2-CB 4.4Å; T600-I618 HydrophobicContact CG2-CD1 4Å; T600-I618 PolarHBondContact O-N 3.42Å; T600-I618 WeakPolarHBondContact OG1-CB 3.42Å; T600-I618 WeakPolarHBondContact OG1-CD1 3.46Å; T600-I618 WeakPolarHBondContact OG1-CG1 3.22Å; T600-I618 PolarHBondContact OG1-N 3.34Å; T600-I618 VanDerWaalsContact OG1-N 3.08Å
601	C	81.7	Confident	68.1	Low	9 Å²	9	40 Å²	40	6%	0.061	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	129.3	170.7	170.1	0	0	0	0	107.2	C581 K585 V615 Q616 I617	C581-C601 WeakPolarHBondContact CA-SG 3.38Å; C581-C601 HydrophobicContact CB-CB 3.63Å; C581-C601 WeakPolarHBondContact CB-SG 3.5Å; C581-C601 WeakPolarHBondContact SG-CB 3.35Å; C581-C601 PolarHBondContact SG-O 3.23Å; C581-C601 CovalentContact SG-SG 2.05Å; C581-C601 PolarHBondContact SG-SG 3.48Å; K585-C601 HydrophobicContact CG-CB 4.39Å; C601-V615 WeakPolarHBondContact SG-CG1 3.06Å; C601-Q616 CarbonylContact C-O 3.56Å; C601-Q616 WeakPolarHBondContact CA-O 3.24Å; C601-I617 HydrophobicContact CB-CG2 4.03Å
602	T	77.6	Confident	68.7	Low	52 Å²	52	43 Å²	43	32%	0.319	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	123	-178.6	-53.5	0	0	0	0	108.2	L604 V615 Q616	T602-L604 HydrophobicContact CG2-CD2 4.33Å; T602-V615 CarbonylContact O-C 3.44Å; T602-V615 WeakPolarHBondContact O-CA 3.06Å; T602-Q616 PolarHBondContact N-O 2.83Å; T602-Q616 PolarHBondContact O-N 3.42Å
603	V	77.1	Confident	69.7	Low	18 Å²	18	39.2 Å²	39.2	11%	0.109	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	122.4	169.1	171.2	0	0	0	0	108.3	Y573 I580 F606 S613 V615	Y573-V603 HydrophobicContact CE1-CG1 4.43Å; Y573-V603 PolarHBondContact OH-O 3.04Å; I580-V603 HydrophobicContact CB-CG2 4.21Å; I580-V603 HydrophobicContact CD1-CG2 4.28Å; I580-V603 HydrophobicContact CG2-CG2 4.19Å; V603-F606 HydrophobicContact CG1-CD2 4.38Å; V603-F606 HydrophobicContact CG1-CE1 4.39Å; V603-F606 HydrophobicContact CG1-CE2 3.78Å; V603-F606 HydrophobicContact CG1-CZ 3.79Å; V603-S613 WeakPolarHBondContact CG1-OG 3.29Å; V603-V615 HydrophobicContact CG2-CG2 4.26Å
604	L	68.9	Low	70.7	Confident	48 Å²	48	37.5 Å²	37.5	25%	0.251	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-43.5	-177.2	-58.8	179.5	0	0	0	111.3	Y573 T602 D614 Q616	Y573-L604 VanDerWaalsContact OH-C 3.31Å; Y573-L604 PolarHBondContact OH-O 3.04Å; Y573-L604 VanDerWaalsContact OH-O 3.14Å; T602-L604 HydrophobicContact CG2-CD2 4.33Å; L604-D614 HydrophobicContact CB-CB 4.12Å; L604-D614 HydrophobicContact CD1-CB 4.34Å; L604-D614 PolarHBondContact N-O 3.12Å; L604-Q616 HydrophobicContact CD1-CB 4.25Å; L604-Q616 HydrophobicContact CD2-CB 4.21Å; L604-Q616 HydrophobicContact CG-CB 4.29Å
605	R	71.7	Confident	71.4	Confident	83 Å²	83	37 Å²	37	31%	0.313	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-169	151.9	-178.4	53.5	-173.3	-179.6	163.3	12.2	112.1	Y607 S613 D614 D688	R605-Y607 HydrophobicContact CG-CE1 4.23Å; R605-Y607 HydrophobicContact CG-CE2 3.76Å; R605-Y607 VanDerWaalsContact CZ-CE1 3.41Å; R605-Y607 PolarHBondContact NE-OH 2.95Å; R605-Y607 PolarHBondContact NH2-OH 2.97Å; R605-S613 CarbonylContact O-C 3.59Å; R605-S613 VanDerWaalsContact O-CA 3.28Å; R605-S613 WeakPolarHBondContact O-CA 3.4Å; R605-D614 HydrophobicContact CG-CB 4.2Å; R605-D614 IonicContact CZ-OD2 2.76Å; R605-D614 IonicContact NE-OD2 3.49Å; R605-D614 PolarHBondContact NE-OD2 2.84Å; R605-D614 IonicContact NH2-OD2 2.78Å; R605-D614 PolarHBondContact O-N 3.1Å; R605-D688 IonicContact CZ-OD2 3.65Å; R605-D688 VanDerWaalsContact CZ-OD2 3.25Å; R605-D688 IonicContact NE-OD2 2.68Å; R605-D688 IonicContact NH1-OD2 3.48Å; R605-D688 IonicContact NH2-OD2 3.72Å; R605-D688 PolarHBondContact NH2-OD2 3.23Å
606	F	72.5	Confident	71.8	Confident	12 Å²	12	35.2 Å²	35.2	5%	0.053	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	154.2	164.8	-59.7	-86.2	0	0	0	111.4	I552 W561 L565 Y573 T576 I580 V603 V611 K612	I552-F606 HydrophobicContact CD1-CD1 4.1Å; I552-F606 HydrophobicContact CD1-CE1 3.68Å; W561-F606 HydrophobicContact CH2-CB 4.38Å; W561-F606 HydrophobicContact CZ3-CB 3.99Å; L565-F606 HydrophobicContact CB-CB 3.99Å; L565-F606 HydrophobicContact CB-CD2 4.25Å; L565-F606 HydrophobicContact CB-CG 4.18Å; L565-F606 HydrophobicContact CD2-CD2 4.08Å; L565-F606 HydrophobicContact CD2-CE2 4.16Å; L565-F606 HydrophobicContact CD2-CG 4.3Å; L565-F606 HydrophobicContact CD2-CZ 4.43Å; L565-F606 WeakPolarHBondContact O-CB 2.69Å; Y573-F606 HydrophobicContact CD1-CE2 4.09Å; Y573-F606 AromaticContact CD2-CD2 3.37Å; Y573-F606 HydrophobicContact CD2-CD2 3.37Å; Y573-F606 AromaticContact CD2-CE2 3.59Å; Y573-F606 HydrophobicContact CD2-CE2 3.59Å; Y573-F606 HydrophobicContact CE1-CE2 4.19Å; Y573-F606 AromaticContact CE2-CD2 3.43Å; Y573-F606 HydrophobicContact CE2-CD2 3.43Å; Y573-F606 VanDerWaalsContact CE2-CD2 3.43Å; Y573-F606 AromaticContact CE2-CE2 3.75Å; Y573-F606 HydrophobicContact CE2-CE2 3.75Å; Y573-F606 HydrophobicContact CG-CD2 4.02Å; Y573-F606 AromaticContact CG-CE2 3.75Å; Y573-F606 HydrophobicContact CG-CE2 3.75Å; T576-F606 HydrophobicContact CG2-CE1 3.64Å; T576-F606 HydrophobicContact CG2-CZ 3.64Å; I580-F606 HydrophobicContact CD1-CE1 3.5Å; I580-F606 VanDerWaalsContact CD1-CE1 3.5Å; I580-F606 HydrophobicContact CD1-CZ 3.89Å; V603-F606 HydrophobicContact CG1-CD2 4.38Å; V603-F606 HydrophobicContact CG1-CE1 4.39Å; V603-F606 HydrophobicContact CG1-CE2 3.78Å; V603-F606 HydrophobicContact CG1-CZ 3.79Å; F606-V611 HydrophobicContact CD1-CG1 3.87Å; F606-K612 CarbonylContact C-O 3.51Å; F606-K612 WeakPolarHBondContact CA-O 3.49Å
607	Y	69.5	Low	72	Confident	69 Å²	69	34.6 Å²	34.6	27%	0.271	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	149.7	177.1	-49.7	-100.3	0	0	0	112.7	W561 R605 K612 D614	W561-Y607 VanDerWaalsContact CZ3-O 3.28Å; W561-Y607 WeakPolarHBondContact CZ3-O 2.99Å; R605-Y607 HydrophobicContact CG-CE1 4.23Å; R605-Y607 HydrophobicContact CG-CE2 3.76Å; R605-Y607 VanDerWaalsContact CZ-CE1 3.41Å; R605-Y607 PolarHBondContact NE-OH 2.95Å; R605-Y607 PolarHBondContact NH2-OH 2.97Å; Y607-K612 HydrophobicContact CD2-CB 4.43Å; Y607-K612 PolarHBondContact N-O 2.78Å; Y607-K612 PolarHBondContact O-N 3.38Å; Y607-D614 HydrophobicContact CE2-CB 4.46Å; Y607-D614 WeakPolarHBondContact CE2-OD2 3.44Å; Y607-D614 VanDerWaalsContact CZ-OD2 3.29Å; Y607-D614 PolarHBondContact OH-OD2 2.81Å
608	P	59.8	Low	71.6	Confident	92 Å²	92	32.8 Å²	32.8	60%	0.597	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	149.3	174.5	23.5	-31.7	0	0	0	112.9	W561	W561-P608 VanDerWaalsContact CD2-CA 3.46Å; W561-P608 HydrophobicContact CD2-CB 3.72Å; W561-P608 VanDerWaalsContact CE3-CA 3.41Å; W561-P608 HydrophobicContact CE3-CB 4.18Å; W561-P608 HydrophobicContact CG-CB 3.89Å; W561-P608 HydrophobicContact CZ2-CB 4.32Å
609	G	59.8	Low	71.1	Confident	48 Å²	48	32.3 Å²	32.3	50%	0.495	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	123	-144.8	-168.8	0	0	0	0	0	109.5	V611	G609-V611 PolarHBondContact O-N 2.06Å
610	S	56.5	Low	71.2	Confident	18 Å²	18	31.4 Å²	31.4	13%	0.126	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	44.3	173.9	-37.1	0	0	0	0	113.2	E551 Q558	E551-S610 WeakPolarHBondContact CG-O 3.2Å; E551-S610 WeakPolarHBondContact OE1-CB 3.36Å; E551-S610 PolarHBondContact OE1-OG 3Å; Q558-S610 PolarHBondContact NE2-OG 2.97Å; Q558-S610 PolarHBondContact OE1-OG 3.46Å
611	V	65	Low	70.7	Confident	1 Å²	1	32 Å²	32	1%	0.006	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	27.9	87.5	-166.7	-173.8	0	0	0	0	112.5	I552 T559 W561 L565 F606 G609	I552-V611 HydrophobicContact CB-CB 4.18Å; I552-V611 HydrophobicContact CB-CG1 4.34Å; I552-V611 WeakPolarHBondContact CB-O 3.48Å; I552-V611 HydrophobicContact CD1-CB 4.21Å; I552-V611 HydrophobicContact CD1-CG1 3.44Å; I552-V611 VanDerWaalsContact CD1-CG1 3.44Å; I552-V611 HydrophobicContact CG1-CG1 4.21Å; I552-V611 VanDerWaalsContact CG1-O 3.31Å; I552-V611 WeakPolarHBondContact CG1-O 3.4Å; I552-V611 PolarHBondContact N-O 3.37Å; T559-V611 HydrophobicContact CG2-CG2 3.99Å; W561-V611 HydrophobicContact CE3-CG2 4.37Å; L565-V611 HydrophobicContact CD1-CB 4.49Å; L565-V611 HydrophobicContact CD1-CG1 3.59Å; L565-V611 HydrophobicContact CD1-CG2 3.96Å; F606-V611 HydrophobicContact CD1-CG1 3.87Å; G609-V611 PolarHBondContact O-N 2.06Å
612	K	71.1	Confident	69.8	Low	74 Å²	74	32.9 Å²	32.9	32%	0.322	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	144.6	175.6	-65.8	178.6	-178.3	178.4	0	109.9	T549 V550 E551 F606 Y607 I664	T549-K612 HydrophobicContact CG2-CB 4.05Å; T549-K612 HydrophobicContact CG2-CD 4.49Å; V550-K612 CarbonylContact O-C 3.53Å; V550-K612 VanDerWaalsContact O-CA 3.28Å; V550-K612 WeakPolarHBondContact O-CA 3.38Å; E551-K612 HydrophobicContact CB-CG 4.45Å; E551-K612 HydrophobicContact CG-CG 4.38Å; F606-K612 CarbonylContact C-O 3.51Å; F606-K612 WeakPolarHBondContact CA-O 3.49Å; Y607-K612 HydrophobicContact CD2-CB 4.43Å; Y607-K612 PolarHBondContact N-O 2.78Å; Y607-K612 PolarHBondContact O-N 3.38Å; K612-I664 HydrophobicContact CD-CD1 4.11Å
613	S	68.8	Low	68.6	Low	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	129.5	179.4	-174.8	0	0	0	0	110.4	T549 V550 V603 R605	T549-S613 CarbonylContact C-O 3.57Å; T549-S613 WeakPolarHBondContact CA-O 3.39Å; V550-S613 PolarHBondContact N-O 3Å; V550-S613 PolarHBondContact O-N 3.49Å; V603-S613 WeakPolarHBondContact CG1-OG 3.29Å; R605-S613 CarbonylContact O-C 3.59Å; R605-S613 VanDerWaalsContact O-CA 3.28Å; R605-S613 WeakPolarHBondContact O-CA 3.4Å
614	D	69.1	Low	67.1	Low	9 Å²	9	38.5 Å²	38.5	5%	0.048	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	131.9	165	-70.2	-17.8	0	0	0	109.3	T549 L604 R605 Y607	T549-D614 PolarHBondContact OG1-OD1 3.39Å; L604-D614 HydrophobicContact CB-CB 4.12Å; L604-D614 HydrophobicContact CD1-CB 4.34Å; L604-D614 PolarHBondContact N-O 3.12Å; R605-D614 HydrophobicContact CG-CB 4.2Å; R605-D614 IonicContact CZ-OD2 2.76Å; R605-D614 IonicContact NE-OD2 3.49Å; R605-D614 PolarHBondContact NE-OD2 2.84Å; R605-D614 IonicContact NH2-OD2 2.78Å; R605-D614 PolarHBondContact O-N 3.1Å; Y607-D614 HydrophobicContact CE2-CB 4.46Å; Y607-D614 WeakPolarHBondContact CE2-OD2 3.44Å; Y607-D614 VanDerWaalsContact CZ-OD2 3.29Å; Y607-D614 PolarHBondContact OH-OD2 2.81Å
615	V	72.3	Confident	66.1	Low	1 Å²	1	39.9 Å²	39.9	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	130	-176.9	-167	0	0	0	0	109.1	S547 M548 V550 I580 I584 C601 T602 V603 I617	S547-V615 WeakPolarHBondContact CA-O 3.34Å; M548-V615 HydrophobicContact CE-CB 4.38Å; M548-V615 HydrophobicContact CG-CB 4.03Å; M548-V615 PolarHBondContact N-O 3.2Å; M548-V615 PolarHBondContact O-N 2.88Å; V550-V615 HydrophobicContact CB-CG2 4.12Å; V550-V615 HydrophobicContact CG2-CB 4.41Å; V550-V615 HydrophobicContact CG2-CG2 3.64Å; I580-V615 HydrophobicContact CG2-CG2 3.84Å; I584-V615 HydrophobicContact CD1-CB 4.47Å; I584-V615 HydrophobicContact CD1-CG1 3.78Å; I584-V615 HydrophobicContact CD1-CG2 4.49Å; C601-V615 WeakPolarHBondContact SG-CG1 3.06Å; T602-V615 CarbonylContact O-C 3.44Å; T602-V615 WeakPolarHBondContact O-CA 3.06Å; V603-V615 HydrophobicContact CG2-CG2 4.26Å; V615-I617 HydrophobicContact CG1-CG2 3.92Å
616	Q	72.3	Confident	65.2	Low	59 Å²	59	43.9 Å²	43.9	28%	0.276	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.1	171.9	-171.6	178.2	33	0	0	109	E545 L546 C601 T602 L604	E545-Q616 PolarHBondContact OE1-NE2 2.75Å; L546-Q616 WeakPolarHBondContact O-CA 3.23Å; C601-Q616 CarbonylContact C-O 3.56Å; C601-Q616 WeakPolarHBondContact CA-O 3.24Å; T602-Q616 PolarHBondContact N-O 2.83Å; T602-Q616 PolarHBondContact O-N 3.42Å; L604-Q616 HydrophobicContact CD1-CB 4.25Å; L604-Q616 HydrophobicContact CD2-CB 4.21Å; L604-Q616 HydrophobicContact CG-CB 4.29Å
617	I	77.5	Confident	64.4	Low	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	148.9	-178.6	65	175.4	0	0	0	110.2	E545 L546 M548 I584 V598 T600 C601 V615 V619 I636	E545-I617 WeakPolarHBondContact CA-O 3.4Å; L546-I617 HydrophobicContact CB-CD1 4.08Å; L546-I617 HydrophobicContact CB-CG1 3.69Å; L546-I617 HydrophobicContact CD1-CD1 4.13Å; L546-I617 HydrophobicContact CD1-CG1 4.49Å; L546-I617 PolarHBondContact N-O 2.78Å; L546-I617 PolarHBondContact O-N 2.85Å; M548-I617 HydrophobicContact SD-CD1 4.1Å; I584-I617 HydrophobicContact CG2-CG2 4.03Å; V598-I617 HydrophobicContact CG1-CB 4.04Å; V598-I617 HydrophobicContact CG1-CG2 4.33Å; T600-I617 WeakPolarHBondContact O-CA 3.44Å; C601-I617 HydrophobicContact CB-CG2 4.03Å; V615-I617 HydrophobicContact CG1-CG2 3.92Å; I617-V619 HydrophobicContact CD1-CG2 3.75Å; I617-V619 HydrophobicContact CG1-CG2 4.08Å; I617-I636 HydrophobicContact CD1-CD1 3.25Å
618	I	73.9	Confident	64.1	Low	30 Å²	30	44.4 Å²	44.4	15%	0.154	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128	165.3	-60.9	172.4	0	0	0	106.9	I543 P599 T600	I543-I618 HydrophobicContact CG2-CG2 3.5Å; P599-I618 WeakPolarHBondContact CD-O 3.33Å; P599-I618 HydrophobicContact CG-CB 4.38Å; P599-I618 HydrophobicContact CG-CG2 4.24Å; T600-I618 HydrophobicContact CG2-CB 4.4Å; T600-I618 HydrophobicContact CG2-CD1 4Å; T600-I618 PolarHBondContact O-N 3.42Å; T600-I618 WeakPolarHBondContact OG1-CB 3.42Å; T600-I618 WeakPolarHBondContact OG1-CD1 3.46Å; T600-I618 WeakPolarHBondContact OG1-CG1 3.22Å; T600-I618 PolarHBondContact OG1-N 3.34Å; T600-I618 VanDerWaalsContact OG1-N 3.08Å
619	V	71.9	Confident	64.2	Low	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	128.8	179.3	-179	0	0	0	0	109.3	I543 L544 L546 F596 T597 V598 I617 I632 I636	I543-V619 CarbonylContact C-O 3.59Å; I543-V619 WeakPolarHBondContact CA-O 3.24Å; L544-V619 HydrophobicContact CB-CB 4.47Å; L544-V619 PolarHBondContact N-O 3.47Å; L544-V619 PolarHBondContact O-N 2.82Å; L546-V619 HydrophobicContact CD1-CG2 4.01Å; F596-V619 HydrophobicContact CB-CG1 3.74Å; F596-V619 HydrophobicContact CD2-CG1 3.76Å; F596-V619 HydrophobicContact CG-CG1 4.1Å; T597-V619 WeakPolarHBondContact O-CA 3.41Å; V598-V619 HydrophobicContact CG2-CG2 4.37Å; I617-V619 HydrophobicContact CD1-CG2 3.75Å; I617-V619 HydrophobicContact CG1-CG2 4.08Å; V619-I632 HydrophobicContact CB-CG2 4.26Å; V619-I632 HydrophobicContact CG1-CD1 4.26Å; V619-I632 HydrophobicContact CG1-CG2 3.85Å; V619-I632 HydrophobicContact CG2-CG2 3.87Å; V619-I636 HydrophobicContact CG2-CD1 4.27Å
620	E	77.4	Confident	64.2	Low	9 Å²	9	45.8 Å²	45.8	4%	0.042	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	128	169.3	-66.5	176.9	-162.6	0	0	109.4	F114 K541 S542 I543 F596 T597 P599	F114-E620 WeakPolarHBondContact CE1-OE1 3.48Å; K541-E620 IonicContact NZ-OE2 3.39Å; K541-E620 PolarHBondContact NZ-OE2 3.34Å; S542-E620 CarbonylContact O-C 3.1Å; S542-E620 WeakPolarHBondContact O-CA 3.17Å; I543-E620 HydrophobicContact CG1-CG 4.13Å; F596-E620 CarbonylContact C-O 3.54Å; F596-E620 WeakPolarHBondContact CA-O 3.28Å; F596-E620 WeakPolarHBondContact CB-O 3.42Å; T597-E620 PolarHBondContact N-O 3.43Å; T597-E620 PolarHBondContact O-N 3.49Å; P599-E620 HydrophobicContact CG-CG 4.02Å
621	Y	70.3	Confident	64.4	Low	39 Å²	39	48.9 Å²	48.9	15%	0.153	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	164.9	-179.7	67.9	-79.7	0	0	0	112.1	K541 S542 L544 L595 V627 I632	K541-Y621 WeakPolarHBondContact CA-O 3.26Å; S542-Y621 PolarHBondContact N-O 3.18Å; S542-Y621 WeakPolarHBondContact O-CD1 3.48Å; S542-Y621 PolarHBondContact O-N 3.12Å; L544-Y621 HydrophobicContact CB-CD1 4.42Å; L544-Y621 HydrophobicContact CB-CE1 3.91Å; L595-Y621 WeakPolarHBondContact O-CA 3.05Å; Y621-V627 HydrophobicContact CD2-CG2 4.38Å; Y621-I632 HydrophobicContact CD1-CD1 4.05Å; Y621-I632 HydrophobicContact CE1-CD1 4.38Å; Y621-I632 HydrophobicContact CG-CD1 4.3Å
622	I	63.1	Low	64.5	Low	28 Å²	28	48.8 Å²	48.8	14%	0.144	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	124.6	-179.5	-47.4	-175	0	0	0	110.6	F538 L595 N624 L625	F538-I622 HydrophobicContact CD1-CD1 3.76Å; F538-I622 HydrophobicContact CD1-CG1 3.76Å; F538-I622 HydrophobicContact CE1-CD1 3.48Å; F538-I622 VanDerWaalsContact CE1-CD1 3.48Å; F538-I622 HydrophobicContact CE1-CG1 3.66Å; L595-I622 HydrophobicContact CB-CD1 3.73Å; L595-I622 HydrophobicContact CB-CG1 4.02Å; L595-I622 HydrophobicContact CD1-CD1 3.59Å; L595-I622 HydrophobicContact CG-CD1 4.31Å; L595-I622 PolarHBondContact O-N 3.35Å; I622-N624 HydrophobicContact CG2-CB 4.4Å; I622-N624 PolarHBondContact O-N 3.19Å; I622-L625 PolarHBondContact O-N 3.24Å
623	N	51.7	Low	64.4	Low	65 Å²	65	45.7 Å²	45.7	35%	0.348	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-19.4	-175.8	-100.7	-39.3	0	0	0	116	T540 K541 S542 L625	T540-N623 WeakPolarHBondContact O-CB 3.36Å; T540-N623 PolarHBondContact O-N 2.97Å; K541-N623 PolarHBondContact O-ND2 3.14Å; S542-N623 WeakPolarHBondContact CB-OD1 2.68Å; S542-N623 PolarHBondContact OG-ND2 2.92Å; S542-N623 PolarHBondContact OG-OD1 2.99Å; N623-L625 PolarHBondContact O-N 3.46Å; N623-L625 VanDerWaalsContact O-N 3.16Å
624	N	45.5	Very low	64.2	Low	123 Å²	123	48.6 Å²	48.6	66%	0.658	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-2.3	-174.9	-64.5	-5.5	0	0	0	113.1	I622	I622-N624 HydrophobicContact CG2-CB 4.4Å; I622-N624 PolarHBondContact O-N 3.19Å
625	L	48.8	Very low	64.1	Low	78 Å²	78	48.3 Å²	48.3	41%	0.408	25%	0.25	S	S	.	.	S	Bend	trans	-112.1	121.4	177.3	-62.4	166.5	0	0	0	107.4	I622 N623 V627	I622-L625 PolarHBondContact O-N 3.24Å; N623-L625 PolarHBondContact O-N 3.46Å; N623-L625 VanDerWaalsContact O-N 3.16Å; L625-V627 HydrophobicContact CB-CG2 3.35Å; L625-V627 HydrophobicContact CD1-CG2 4.47Å; L625-V627 PolarHBondContact O-N 3.28Å
626	N	51.9	Low	64.2	Low	167 Å²	167	48.3 Å²	48.3	89%	0.893	25%	0.25	S	S	*	.			trans	-69	64	169.7	-85.9	-17	0	0	0	109.8
627	V	56.1	Low	64.2	Low	23 Å²	23	46.7 Å²	46.7	14%	0.139	24%	0.243	C	C	.	.			trans	-82.9	124.3	-177.2	-163	0	0	0	0	109.1	V594 Y621 L625 Q631 I632	V594-V627 HydrophobicContact CG1-CG1 3.9Å; V594-V627 HydrophobicContact CG1-CG2 4.12Å; V594-V627 HydrophobicContact CG2-CG1 3.98Å; Y621-V627 HydrophobicContact CD2-CG2 4.38Å; L625-V627 HydrophobicContact CB-CG2 3.35Å; L625-V627 HydrophobicContact CD1-CG2 4.47Å; L625-V627 PolarHBondContact O-N 3.28Å; V627-Q631 HydrophobicContact CG1-CB 3.63Å; V627-I632 HydrophobicContact CB-CD1 4.49Å; V627-I632 HydrophobicContact CB-CG1 4.5Å; V627-I632 HydrophobicContact CG1-CD1 4.14Å; V627-I632 HydrophobicContact CG1-CG1 3.65Å
628	T	63.4	Low	63.6	Low	69 Å²	69	47.2 Å²	47.2	42%	0.423	25%	0.245	S	C	.	.			trans	-79	155.2	175.1	61	0	0	0	0	110.9	T630 Q631 I632	T628-T630 PolarHBondContact O-N 2.76Å; T628-Q631 PolarHBondContact O-N 2.92Å; T628-Q631 VanDerWaalsContact OG1-CG 3.3Å; T628-Q631 WeakPolarHBondContact OG1-CG 3.48Å; T628-Q631 PolarHBondContact OG1-N 3.25Å; T628-Q631 PolarHBondContact OG1-OE1 2.81Å; T628-I632 PolarHBondContact O-N 3.33Å; T628-I632 VanDerWaalsContact O-N 3.15Å
629	Q	61.2	Low	63.3	Low	112 Å²	112	45.8 Å²	45.8	52%	0.523	24%	0.238	S	C	.	.	H	α-helix	trans	-51.9	-39.5	171.6	-62	-171.3	-26.4	0	0	111.4	L544 L546 I632 L633	L544-Q629 HydrophobicContact CD1-CG 4.06Å; L544-Q629 HydrophobicContact CD2-CG 4.01Å; L546-Q629 HydrophobicContact CD2-CB 3.88Å; L546-Q629 HydrophobicContact CD2-CG 3.91Å; Q629-I632 PolarHBondContact O-N 3.09Å; Q629-L633 WeakPolarHBondContact O-CB 3.38Å; Q629-L633 WeakPolarHBondContact O-CG 2.88Å; Q629-L633 PolarHBondContact O-N 3.22Å
630	T	60.1	Low	63.4	Low	56 Å²	56	45.9 Å²	45.9	34%	0.344	24%	0.238	S	C	.	.	H	α-helix	trans	-57.5	-47.5	174.6	-54.2	0	0	0	0	112.7	T628 L633 Q634 M665	T628-T630 PolarHBondContact O-N 2.76Å; T630-L633 PolarHBondContact O-N 2.93Å; T630-Q634 HydrophobicContact CG2-CG 4.39Å; T630-Q634 WeakPolarHBondContact O-CB 3.38Å; T630-Q634 VanDerWaalsContact O-CG 3.27Å; T630-Q634 WeakPolarHBondContact O-CG 3.28Å; T630-Q634 PolarHBondContact O-N 3.27Å; T630-M665 HydrophobicContact CG2-CE 3.72Å; T630-M665 VanDerWaalsContact OG1-CE 3.23Å; T630-M665 WeakPolarHBondContact OG1-CE 3.39Å
631	Q	60.7	Low	62.9	Low	83 Å²	83	46.9 Å²	46.9	39%	0.388	24%	0.243	S	C	.	.	H	α-helix	trans	-65.6	-40.1	-179.3	-78	165.3	-50	0	0	111.8	V627 T628 A635	V627-Q631 HydrophobicContact CG1-CB 3.63Å; T628-Q631 PolarHBondContact O-N 2.92Å; T628-Q631 VanDerWaalsContact OG1-CG 3.3Å; T628-Q631 WeakPolarHBondContact OG1-CG 3.48Å; T628-Q631 PolarHBondContact OG1-N 3.25Å; T628-Q631 PolarHBondContact OG1-OE1 2.81Å; Q631-A635 VanDerWaalsContact O-CB 3.31Å; Q631-A635 WeakPolarHBondContact O-CB 3.45Å; Q631-A635 PolarHBondContact O-N 3.46Å
632	I	67.4	Low	62.5	Low	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.5	-43.7	174.8	-73.1	167.5	0	0	0	110.7	L544 L546 V594 V619 Y621 V627 T628 Q629 A635 I636	L544-I632 HydrophobicContact CD2-CD1 3.44Å; L544-I632 VanDerWaalsContact CD2-CD1 3.44Å; L546-I632 HydrophobicContact CD1-CB 4.34Å; L546-I632 HydrophobicContact CD1-CG2 3.61Å; V594-I632 HydrophobicContact CG1-CG1 4.38Å; V619-I632 HydrophobicContact CB-CG2 4.26Å; V619-I632 HydrophobicContact CG1-CD1 4.26Å; V619-I632 HydrophobicContact CG1-CG2 3.85Å; V619-I632 HydrophobicContact CG2-CG2 3.87Å; Y621-I632 HydrophobicContact CD1-CD1 4.05Å; Y621-I632 HydrophobicContact CE1-CD1 4.38Å; Y621-I632 HydrophobicContact CG-CD1 4.3Å; V627-I632 HydrophobicContact CB-CD1 4.49Å; V627-I632 HydrophobicContact CB-CG1 4.5Å; V627-I632 HydrophobicContact CG1-CD1 4.14Å; V627-I632 HydrophobicContact CG1-CG1 3.65Å; T628-I632 PolarHBondContact O-N 3.33Å; T628-I632 VanDerWaalsContact O-N 3.15Å; Q629-I632 PolarHBondContact O-N 3.09Å; I632-A635 WeakPolarHBondContact O-CB 3.38Å; I632-A635 PolarHBondContact O-N 3.08Å; I632-I636 HydrophobicContact CG2-CD1 3.86Å; I632-I636 VanDerWaalsContact O-CG1 3.32Å; I632-I636 WeakPolarHBondContact O-CG1 3.26Å; I632-I636 PolarHBondContact O-N 3.49Å
633	L	68.2	Low	62.9	Low	9 Å²	9	45.9 Å²	45.9	5%	0.047	24%	0.238	C	C	.	.	H	α-helix	trans	-66.1	-44.2	179	-77	170.5	0	0	0	111.8	L546 M548 Q629 T630 A635 I636 Q637 L663 M665	L546-L633 HydrophobicContact CD1-CD1 4.47Å; L546-L633 HydrophobicContact CD1-CD2 4.02Å; L546-L633 HydrophobicContact CD1-CG 3.95Å; L546-L633 HydrophobicContact CD2-CD1 4.32Å; M548-L633 HydrophobicContact CB-CD2 4.08Å; M548-L633 HydrophobicContact CG-CD2 4.5Å; M548-L633 HydrophobicContact SD-CD2 3.68Å; Q629-L633 WeakPolarHBondContact O-CB 3.38Å; Q629-L633 WeakPolarHBondContact O-CG 2.88Å; Q629-L633 PolarHBondContact O-N 3.22Å; T630-L633 PolarHBondContact O-N 2.93Å; L633-A635 VanDerWaalsContact C-N 3.29Å; L633-A635 PolarHBondContact O-N 2.99Å; L633-I636 HydrophobicContact CD2-CD1 4.48Å; L633-I636 PolarHBondContact O-N 2.74Å; L633-I636 VanDerWaalsContact O-N 3.16Å; L633-Q637 PolarHBondContact O-N 3.07Å; L633-L663 HydrophobicContact CB-CD1 3.91Å; L633-L663 HydrophobicContact CD2-CD1 4.24Å; L633-L663 HydrophobicContact CD2-CD2 4.34Å; L633-L663 WeakPolarHBondContact O-CD1 3.29Å; L633-M665 HydrophobicContact CB-SD 4.09Å; L633-M665 HydrophobicContact CD1-CE 4.45Å; L633-M665 HydrophobicContact CD1-CG 4.46Å; L633-M665 HydrophobicContact CD1-SD 3.18Å; L633-M665 WeakPolarHBondContact CD1-SD 3.21Å; L633-M665 HydrophobicContact CG-SD 4.24Å
634	Q	65.6	Low	63.4	Low	60 Å²	60	42.9 Å²	42.9	28%	0.28	22%	0.222	S	C	.	.	H	α-helix	trans	-59.2	-41.6	173.1	-74.6	175.5	-36.4	0	0	111.9	S444 T630 Q637 L638	S444-Q634 PolarHBondContact OG-NE2 2.89Å; T630-Q634 HydrophobicContact CG2-CG 4.39Å; T630-Q634 WeakPolarHBondContact O-CB 3.38Å; T630-Q634 VanDerWaalsContact O-CG 3.27Å; T630-Q634 WeakPolarHBondContact O-CG 3.28Å; T630-Q634 PolarHBondContact O-N 3.27Å; Q634-Q637 PolarHBondContact O-N 3.22Å; Q634-L638 WeakPolarHBondContact O-CB 3.24Å; Q634-L638 PolarHBondContact O-N 2.92Å
635	A	66.6	Low	64.2	Low	3 Å²	3	40.8 Å²	40.8	3%	0.025	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-49.6	173.5	0	0	0	0	0	110.5	I591 V594 F596 Q631 I632 L633 Q637 L638 G639	I591-A635 HydrophobicContact CD1-CB 3.66Å; I591-A635 WeakPolarHBondContact CD1-O 3.43Å; I591-A635 HydrophobicContact CG2-CB 4.29Å; V594-A635 HydrophobicContact CG2-CB 4.46Å; F596-A635 HydrophobicContact CE1-CB 3.61Å; F596-A635 HydrophobicContact CZ-CB 3.93Å; Q631-A635 VanDerWaalsContact O-CB 3.31Å; Q631-A635 WeakPolarHBondContact O-CB 3.45Å; Q631-A635 PolarHBondContact O-N 3.46Å; I632-A635 WeakPolarHBondContact O-CB 3.38Å; I632-A635 PolarHBondContact O-N 3.08Å; L633-A635 VanDerWaalsContact C-N 3.29Å; L633-A635 PolarHBondContact O-N 2.99Å; A635-Q637 VanDerWaalsContact C-N 3.3Å; A635-Q637 PolarHBondContact O-N 2.92Å; A635-L638 PolarHBondContact O-N 2.97Å; A635-G639 PolarHBondContact O-N 3.04Å
636	I	75.5	Confident	64.8	Low	2 Å²	2	38.9 Å²	38.9	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-55.9	-45.2	177.7	-70.6	162.5	0	0	0	111.9	M548 I584 S587 F596 I617 V619 I632 L633 S640	M548-I636 HydrophobicContact CE-CG2 4.23Å; I584-I636 HydrophobicContact CB-CG2 4.41Å; I584-I636 HydrophobicContact CG1-CG2 4.16Å; I584-I636 HydrophobicContact CG2-CG2 3.95Å; S587-I636 WeakPolarHBondContact CB-O 3.47Å; F596-I636 HydrophobicContact CE2-CD1 4.29Å; F596-I636 HydrophobicContact CE2-CG1 3.59Å; F596-I636 HydrophobicContact CZ-CG1 3.89Å; I617-I636 HydrophobicContact CD1-CD1 3.25Å; V619-I636 HydrophobicContact CG2-CD1 4.27Å; I632-I636 HydrophobicContact CG2-CD1 3.86Å; I632-I636 VanDerWaalsContact O-CG1 3.32Å; I632-I636 WeakPolarHBondContact O-CG1 3.26Å; I632-I636 PolarHBondContact O-N 3.49Å; L633-I636 HydrophobicContact CD2-CD1 4.48Å; L633-I636 PolarHBondContact O-N 2.74Å; L633-I636 VanDerWaalsContact O-N 3.16Å; I636-S640 WeakPolarHBondContact O-CB 3.44Å; I636-S640 PolarHBondContact O-N 2.94Å; I636-S640 PolarHBondContact O-OG 2.8Å
637	Q	70.8	Confident	65.2	Low	25 Å²	25	32.6 Å²	32.6	12%	0.117	16%	0.164	C	C	.	.	H	α-helix	trans	-59.7	-51.3	177.6	179.3	173.5	-33.3	0	0	111.6	V441 L633 Q634 A635 S640 Q641 L663	V441-Q637 PolarHBondContact O-NE2 2.71Å; L633-Q637 PolarHBondContact O-N 3.07Å; Q634-Q637 PolarHBondContact O-N 3.22Å; A635-Q637 VanDerWaalsContact C-N 3.3Å; A635-Q637 PolarHBondContact O-N 2.92Å; Q637-S640 PolarHBondContact O-N 2.97Å; Q637-Q641 WeakPolarHBondContact O-CG 3.4Å; Q637-Q641 PolarHBondContact O-N 3.17Å; Q637-Q641 VanDerWaalsContact O-N 3.09Å; Q637-L663 HydrophobicContact CB-CD1 3.62Å; Q637-L663 HydrophobicContact CB-CG 4.21Å
638	L	65.4	Low	65.2	Low	11 Å²	11	34.8 Å²	34.8	6%	0.058	18%	0.175	C	C	.	.	H	α-helix	trans	-63.2	-49.4	-178.2	-179.4	77.9	0	0	0	111.3	T384 V441 M453 V507 I591 Q634 A635 S640 Q641 L642	T384-L638 HydrophobicContact CG2-CD1 4.13Å; T384-L638 HydrophobicContact CG2-CD2 3.27Å; T384-L638 HydrophobicContact CG2-CG 4.34Å; V441-L638 HydrophobicContact CG2-CD1 4.11Å; M453-L638 HydrophobicContact CB-CD1 4.04Å; M453-L638 HydrophobicContact CG-CD1 4Å; M453-L638 HydrophobicContact SD-CD1 3.3Å; M453-L638 WeakPolarHBondContact SD-CD1 3.38Å; M453-L638 HydrophobicContact SD-CG 4.35Å; V507-L638 HydrophobicContact CG1-CD2 4.5Å; V507-L638 HydrophobicContact CG2-CD2 4.37Å; I591-L638 HydrophobicContact CD1-CB 3.92Å; I591-L638 HydrophobicContact CD1-CD2 3.94Å; I591-L638 HydrophobicContact CD1-CG 4.21Å; I591-L638 HydrophobicContact CG1-CD2 4.39Å; Q634-L638 WeakPolarHBondContact O-CB 3.24Å; Q634-L638 PolarHBondContact O-N 2.92Å; A635-L638 PolarHBondContact O-N 2.97Å; L638-S640 PolarHBondContact O-N 3.03Å; L638-Q641 WeakPolarHBondContact O-CB 3.5Å; L638-Q641 PolarHBondContact O-N 2.98Å; L638-Q641 VanDerWaalsContact O-N 3.08Å; L638-L642 HydrophobicContact CG-CD1 4.26Å; L638-L642 VanDerWaalsContact O-CG 3.32Å; L638-L642 WeakPolarHBondContact O-CG 3.4Å; L638-L642 PolarHBondContact O-N 3.07Å
639	G	67.3	Low	64.5	Low	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.9	-32.2	-177.2	0	0	0	0	0	111.7	I591 A635 L642 Y643	I591-G639 VanDerWaalsContact CD1-N 3.34Å; A635-G639 PolarHBondContact O-N 3.04Å; G639-L642 PolarHBondContact O-N 2.96Å; G639-Y643 WeakPolarHBondContact O-CB 3.27Å; G639-Y643 PolarHBondContact O-N 2.78Å
640	S	73.6	Confident	63.9	Low	1 Å²	1	34.1 Å²	34.1	1%	0.007	17%	0.169	C	C	.	.	H	α-helix	trans	-67.7	-39.9	173.2	-60.6	0	0	0	0	112.3	L583 I636 Q637 L638 L642 Y643 V644	L583-S640 PolarHBondContact O-OG 3.27Å; I636-S640 WeakPolarHBondContact O-CB 3.44Å; I636-S640 PolarHBondContact O-N 2.94Å; I636-S640 PolarHBondContact O-OG 2.8Å; Q637-S640 PolarHBondContact O-N 2.97Å; L638-S640 PolarHBondContact O-N 3.03Å; S640-L642 VanDerWaalsContact C-N 3.32Å; S640-Y643 PolarHBondContact O-N 3.27Å; S640-V644 WeakPolarHBondContact O-CG2 3.16Å; S640-V644 PolarHBondContact O-N 2.89Å; S640-V644 VanDerWaalsContact O-N 3.14Å
641	Q	67.8	Low	63	Low	31 Å²	31	38.6 Å²	38.6	15%	0.145	19%	0.186	C	C	.	.	H	α-helix	trans	-63.4	-40.8	173.9	-72.2	175.9	-13.1	0	0	111.1	Q637 L638 V644 M645	Q637-Q641 WeakPolarHBondContact O-CG 3.4Å; Q637-Q641 PolarHBondContact O-N 3.17Å; Q637-Q641 VanDerWaalsContact O-N 3.09Å; L638-Q641 WeakPolarHBondContact O-CB 3.5Å; L638-Q641 PolarHBondContact O-N 2.98Å; L638-Q641 VanDerWaalsContact O-N 3.08Å; Q641-V644 PolarHBondContact O-N 3.44Å; Q641-M645 WeakPolarHBondContact O-CG 3.46Å; Q641-M645 PolarHBondContact O-N 2.81Å
642	L	62.5	Low	62.1	Low	1 Å²	1	37 Å²	37	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-67.2	-39.8	178.2	-66	177.7	0	0	0	113	I382 M453 V507 I508 Y590 L638 G639 S640 V644 M645 D646	I382-L642 HydrophobicContact CB-CD1 4.44Å; I382-L642 HydrophobicContact CB-CD2 4.2Å; I382-L642 HydrophobicContact CD1-CD1 4.22Å; I382-L642 HydrophobicContact CD1-CD2 3.38Å; I382-L642 HydrophobicContact CD1-CG 4.19Å; I382-L642 HydrophobicContact CG1-CD2 3.67Å; I382-L642 HydrophobicContact CG2-CD1 3.7Å; I382-L642 HydrophobicContact CG2-CD2 3.62Å; I382-L642 HydrophobicContact CG2-CG 4.22Å; M453-L642 HydrophobicContact CE-CD2 4.1Å; M453-L642 HydrophobicContact SD-CD2 3.45Å; M453-L642 WeakPolarHBondContact SD-CD2 3.35Å; M453-L642 HydrophobicContact SD-CG 4.08Å; V507-L642 HydrophobicContact CB-CD1 4.24Å; V507-L642 HydrophobicContact CG1-CD1 3.66Å; I508-L642 HydrophobicContact CD1-CB 4.17Å; I508-L642 HydrophobicContact CD1-CD1 4.11Å; I508-L642 HydrophobicContact CG1-CD1 4.49Å; Y590-L642 HydrophobicContact CD1-CB 4.02Å; Y590-L642 HydrophobicContact CG-CB 4.21Å; Y590-L642 WeakPolarHBondContact O-CD1 3.48Å; L638-L642 HydrophobicContact CG-CD1 4.26Å; L638-L642 VanDerWaalsContact O-CG 3.32Å; L638-L642 WeakPolarHBondContact O-CG 3.4Å; L638-L642 PolarHBondContact O-N 3.07Å; G639-L642 PolarHBondContact O-N 2.96Å; S640-L642 VanDerWaalsContact C-N 3.32Å; L642-V644 VanDerWaalsContact C-N 3.33Å; L642-V644 PolarHBondContact O-N 2.74Å; L642-M645 PolarHBondContact O-N 2.84Å; L642-D646 WeakPolarHBondContact O-CB 3.29Å; L642-D646 PolarHBondContact O-N 3.07Å
643	Y	69.8	Low	60.9	Low	44 Å²	44	38 Å²	38	17%	0.173	19%	0.189	C	C	.	.	H	α-helix	trans	-57.1	-46.1	170.9	173.1	-104.7	0	0	0	111.7	T582 L583 A586 Y590 G639 S640 M645 D646 Q647	T582-Y643 HydrophobicContact CG2-CE1 4.23Å; L583-Y643 HydrophobicContact CD1-CD1 3.67Å; L583-Y643 HydrophobicContact CD1-CE1 3.86Å; L583-Y643 HydrophobicContact CG-CD1 3.91Å; L583-Y643 HydrophobicContact CG-CE1 4.49Å; A586-Y643 HydrophobicContact CB-CD1 4.13Å; A586-Y643 HydrophobicContact CB-CD2 3.41Å; A586-Y643 VanDerWaalsContact CB-CD2 3.41Å; A586-Y643 HydrophobicContact CB-CE1 4.4Å; A586-Y643 HydrophobicContact CB-CE2 3.73Å; A586-Y643 HydrophobicContact CB-CG 3.6Å; Y590-Y643 HydrophobicContact CD2-CD2 4.33Å; Y590-Y643 AromaticContact CE2-CD2 3.5Å; Y590-Y643 HydrophobicContact CE2-CD2 3.5Å; Y590-Y643 VanDerWaalsContact CE2-CD2 3.5Å; Y590-Y643 HydrophobicContact CE2-CE2 4.5Å; Y590-Y643 HydrophobicContact CE2-CG 4.19Å; Y590-Y643 AromaticContact CZ-CD2 3.71Å; G639-Y643 WeakPolarHBondContact O-CB 3.27Å; G639-Y643 PolarHBondContact O-N 2.78Å; S640-Y643 PolarHBondContact O-N 3.27Å; Y643-M645 VanDerWaalsContact C-N 3.35Å; Y643-M645 PolarHBondContact O-N 3.42Å; Y643-D646 PolarHBondContact O-N 3.31Å; Y643-Q647 HydrophobicContact CD1-CG 4.4Å; Y643-Q647 HydrophobicContact CD2-CG 4.04Å; Y643-Q647 HydrophobicContact CE1-CG 4.04Å; Y643-Q647 HydrophobicContact CE2-CG 3.66Å; Y643-Q647 HydrophobicContact CG-CG 4.43Å; Y643-Q647 WeakPolarHBondContact O-CB 3.08Å; Y643-Q647 WeakPolarHBondContact O-CG 3.49Å; Y643-Q647 PolarHBondContact O-N 2.75Å
644	V	63.1	Low	59.5	Low	3 Å²	3	41.9 Å²	41.9	2%	0.018	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-44.8	177.4	172.5	0	0	0	0	111.4	L583 S640 Q641 L642 D646 Q647 L648 I653 L659	L583-V644 HydrophobicContact CD1-CG2 3.66Å; L583-V644 HydrophobicContact CD2-CG2 3.72Å; L583-V644 HydrophobicContact CG-CG2 3.95Å; S640-V644 WeakPolarHBondContact O-CG2 3.16Å; S640-V644 PolarHBondContact O-N 2.89Å; S640-V644 VanDerWaalsContact O-N 3.14Å; Q641-V644 PolarHBondContact O-N 3.44Å; L642-V644 VanDerWaalsContact C-N 3.33Å; L642-V644 PolarHBondContact O-N 2.74Å; V644-D646 VanDerWaalsContact C-N 3.35Å; V644-D646 PolarHBondContact O-N 2.68Å; V644-Q647 PolarHBondContact O-N 2.79Å; V644-L648 HydrophobicContact CG1-CD1 3.82Å; V644-L648 HydrophobicContact CG1-CG 4.2Å; V644-L648 WeakPolarHBondContact O-CB 3.41Å; V644-L648 WeakPolarHBondContact O-CG 3.45Å; V644-L648 PolarHBondContact O-N 3.39Å; V644-I653 HydrophobicContact CG1-CD1 4.36Å; V644-L659 HydrophobicContact CG1-CB 4.39Å; V644-L659 HydrophobicContact CG1-CD2 4Å
645	M	61.6	Low	58.1	Low	79 Å²	79	43.7 Å²	43.7	39%	0.389	23%	0.229	S	C	.	.	H	α-helix	trans	-62.3	-42.7	179.9	-69.2	-62.4	-70.7	0	0	112	Q641 L642 Y643 Q647 L648 K649	Q641-M645 WeakPolarHBondContact O-CG 3.46Å; Q641-M645 PolarHBondContact O-N 2.81Å; L642-M645 PolarHBondContact O-N 2.84Å; Y643-M645 VanDerWaalsContact C-N 3.35Å; Y643-M645 PolarHBondContact O-N 3.42Å; M645-Q647 VanDerWaalsContact C-N 3.34Å; M645-L648 PolarHBondContact O-N 3.26Å; M645-L648 HydrophobicContact SD-CD1 4.3Å; M645-K649 WeakPolarHBondContact O-CG 3.39Å; M645-K649 PolarHBondContact O-N 2.93Å; M645-K649 VanDerWaalsContact O-N 3.07Å
646	D	61.3	Low	56.6	Low	38 Å²	38	46.8 Å²	46.8	20%	0.203	25%	0.251	C	S	.	.	H	α-helix	trans	-61.2	-42.8	175	179.2	64.2	0	0	0	112	Y590 L642 Y643 V644 K649 N650	Y590-D646 HydrophobicContact CD1-CB 4.46Å; Y590-D646 HydrophobicContact CE1-CB 3.55Å; Y590-D646 PolarHBondContact OH-OD2 2.82Å; L642-D646 WeakPolarHBondContact O-CB 3.29Å; L642-D646 PolarHBondContact O-N 3.07Å; Y643-D646 PolarHBondContact O-N 3.31Å; V644-D646 VanDerWaalsContact C-N 3.35Å; V644-D646 PolarHBondContact O-N 2.68Å; D646-K649 PolarHBondContact O-N 3.23Å; D646-N650 PolarHBondContact O-N 3.16Å
647	Q	62.1	Low	55.2	Low	34 Å²	34	51.1 Å²	51.1	16%	0.159	27%	0.267	C	S	.	.	H	α-helix	trans	-73.2	-31.2	179	-67.2	-62.9	-54.4	0	0	113.5	Y643 V644 M645 N650 S652 I653	Y643-Q647 HydrophobicContact CD1-CG 4.4Å; Y643-Q647 HydrophobicContact CD2-CG 4.04Å; Y643-Q647 HydrophobicContact CE1-CG 4.04Å; Y643-Q647 HydrophobicContact CE2-CG 3.66Å; Y643-Q647 HydrophobicContact CG-CG 4.43Å; Y643-Q647 WeakPolarHBondContact O-CB 3.08Å; Y643-Q647 WeakPolarHBondContact O-CG 3.49Å; Y643-Q647 PolarHBondContact O-N 2.75Å; V644-Q647 PolarHBondContact O-N 2.79Å; M645-Q647 VanDerWaalsContact C-N 3.34Å; Q647-N650 PolarHBondContact O-N 2.97Å; Q647-S652 PolarHBondContact O-N 3.01Å; Q647-S652 PolarHBondContact OE1-OG 2.03Å; Q647-I653 HydrophobicContact CB-CD1 3.16Å; Q647-I653 HydrophobicContact CB-CG1 3.61Å; Q647-I653 HydrophobicContact CG-CD1 4.2Å
648	L	56.2	Low	54.3	Low	69 Å²	69	50.5 Å²	50.5	36%	0.361	26%	0.264	S	S	.	.	H	α-helix	trans	-65.3	-40.1	171.2	-78.9	169.2	0	0	0	111.3	V644 M645 N650 Q651 I653	V644-L648 HydrophobicContact CG1-CD1 3.82Å; V644-L648 HydrophobicContact CG1-CG 4.2Å; V644-L648 WeakPolarHBondContact O-CB 3.41Å; V644-L648 WeakPolarHBondContact O-CG 3.45Å; V644-L648 PolarHBondContact O-N 3.39Å; M645-L648 PolarHBondContact O-N 3.26Å; M645-L648 HydrophobicContact SD-CD1 4.3Å; L648-N650 VanDerWaalsContact C-N 3.25Å; L648-N650 PolarHBondContact O-N 2.77Å; L648-Q651 PolarHBondContact O-N 3.46Å; L648-Q651 VanDerWaalsContact O-N 3.11Å; L648-I653 HydrophobicContact CD2-CB 4.02Å; L648-I653 HydrophobicContact CD2-CG2 3.73Å; L648-I653 HydrophobicContact CG-CB 4.48Å; L648-I653 HydrophobicContact CG-CD1 4.44Å; L648-I653 HydrophobicContact CG-CG2 4.37Å
649	K	48.8	Very low	53.4	Low	78 Å²	78	51.6 Å²	51.6	34%	0.339	27%	0.27	S	S	.	.	H	α-helix	trans	-61	-35.2	176.1	-75.6	-179.3	174.6	-164.5	0	112.2	T380 D457 T512 M645 D646 Q651	T380-K649 PolarHBondContact OG1-NZ 3.25Å; D457-K649 IonicContact OD1-NZ 2.92Å; D457-K649 PolarHBondContact OD1-NZ 2.89Å; D457-K649 IonicContact OD2-NZ 3.92Å; T512-K649 HydrophobicContact CG2-CD 4.3Å; M645-K649 WeakPolarHBondContact O-CG 3.39Å; M645-K649 PolarHBondContact O-N 2.93Å; M645-K649 VanDerWaalsContact O-N 3.07Å; D646-K649 PolarHBondContact O-N 3.23Å; K649-Q651 PolarHBondContact O-N 3.13Å
650	N	46.6	Very low	52.4	Low	89 Å²	89	52.7 Å²	52.7	48%	0.476	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	8.2	177.4	-68.9	-21.9	0	0	0	114.4	D646 Q647 L648 S652	D646-N650 PolarHBondContact O-N 3.16Å; Q647-N650 PolarHBondContact O-N 2.97Å; L648-N650 VanDerWaalsContact C-N 3.25Å; L648-N650 PolarHBondContact O-N 2.77Å; N650-S652 PolarHBondContact O-N 3.38Å
651	Q	42.5	Very low	51.5	Low	150 Å²	150	53 Å²	53	70%	0.701	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	15.7	-170.3	-59.5	-176	13.2	0	0	114.1	L648 K649 I653	L648-Q651 PolarHBondContact O-N 3.46Å; L648-Q651 VanDerWaalsContact O-N 3.11Å; K649-Q651 PolarHBondContact O-N 3.13Å; Q651-I653 PolarHBondContact O-N 2.81Å
652	S	41.4	Very low	50.7	Low	49 Å²	49	54.3 Å²	54.3	34%	0.343	28%	0.284	S	S	.	.			trans	-72	-16.9	-176.4	157.8	0	0	0	0	111.4	Q647 N650 R657	Q647-S652 PolarHBondContact O-N 3.01Å; Q647-S652 PolarHBondContact OE1-OG 2.03Å; N650-S652 PolarHBondContact O-N 3.38Å; S652-R657 PolarHBondContact O-NH1 2.92Å; S652-R657 PolarHBondContact O-NH2 2.81Å; S652-R657 VanDerWaalsContact O-NH2 3.08Å
653	I	41.2	Very low	50.3	Low	21 Å²	21	55.1 Å²	55.1	11%	0.108	29%	0.288	C	S	.	.			trans	-108.1	110.9	-173.5	-71.5	-176	0	0	0	110.9	V644 Q647 L648 Q651 R657 L659	V644-I653 HydrophobicContact CG1-CD1 4.36Å; Q647-I653 HydrophobicContact CB-CD1 3.16Å; Q647-I653 HydrophobicContact CB-CG1 3.61Å; Q647-I653 HydrophobicContact CG-CD1 4.2Å; L648-I653 HydrophobicContact CD2-CB 4.02Å; L648-I653 HydrophobicContact CD2-CG2 3.73Å; L648-I653 HydrophobicContact CG-CB 4.48Å; L648-I653 HydrophobicContact CG-CD1 4.44Å; L648-I653 HydrophobicContact CG-CG2 4.37Å; Q651-I653 PolarHBondContact O-N 2.81Å; I653-R657 HydrophobicContact CG2-CB 3.78Å; I653-R657 HydrophobicContact CG2-CG 4.21Å; I653-L659 HydrophobicContact CG2-CD2 4.08Å
654	D	40.5	Very low	49.4	Very low	91 Å²	91	56.2 Å²	56.2	49%	0.487	30%	0.297	S	S	.	.			trans	-60	133.5	158.7	177.5	5.3	0	0	0	109.4	S656 R657	D654-S656 PolarHBondContact O-N 2.97Å; D654-S656 PolarHBondContact OD1-N 3.24Å; D654-S656 WeakPolarHBondContact OD2-CB 3.39Å; D654-S656 PolarHBondContact OD2-OG 3.13Å; D654-R657 VanDerWaalsContact O-CB 3.27Å; D654-R657 WeakPolarHBondContact O-CB 3.06Å; D654-R657 WeakPolarHBondContact O-CG 3.31Å; D654-R657 PolarHBondContact O-N 2.96Å
655	S	34.7	Very low	48.2	Very low	98 Å²	98	60.3 Å²	60.3	69%	0.685	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	-15.2	173.2	64.2	0	0	0	0	115.1	T554 R657	T554-S655 VanDerWaalsContact CG2-O 3.3Å; T554-S655 WeakPolarHBondContact CG2-O 3.43Å; S655-R657 PolarHBondContact O-N 2.75Å
656	S	35.5	Very low	47.2	Very low	69 Å²	69	61.8 Å²	61.8	48%	0.483	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	4	171.5	71.3	0	0	0	0	115.4	D654	D654-S656 PolarHBondContact O-N 2.97Å; D654-S656 PolarHBondContact OD1-N 3.24Å; D654-S656 WeakPolarHBondContact OD2-CB 3.39Å; D654-S656 PolarHBondContact OD2-OG 3.13Å
657	R	47.5	Very low	46.5	Very low	92 Å²	92	65.7 Å²	65.7	35%	0.347	34%	0.338	S	S	.	.	S	Bend	trans	-100.4	155.7	-173.3	-69.6	176.5	176.8	-166.7	11	113.4	S652 I653 D654 S655 L659	S652-R657 PolarHBondContact O-NH1 2.92Å; S652-R657 PolarHBondContact O-NH2 2.81Å; S652-R657 VanDerWaalsContact O-NH2 3.08Å; I653-R657 HydrophobicContact CG2-CB 3.78Å; I653-R657 HydrophobicContact CG2-CG 4.21Å; D654-R657 VanDerWaalsContact O-CB 3.27Å; D654-R657 WeakPolarHBondContact O-CB 3.06Å; D654-R657 WeakPolarHBondContact O-CG 3.31Å; D654-R657 PolarHBondContact O-N 2.96Å; S655-R657 PolarHBondContact O-N 2.75Å; R657-L659 WeakPolarHBondContact O-CD2 3.38Å; R657-L659 WeakPolarHBondContact O-CG 3.37Å; R657-L659 PolarHBondContact O-N 2.78Å
658	I	50.2	Low	46.1	Very low	13 Å²	13	67.5 Å²	67.5	7%	0.067	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	114.9	173.2	-58.7	-173.6	0	0	0	109.2	I552 T576 K579 I580 F661	I552-I658 HydrophobicContact CD1-CD1 4.12Å; I552-I658 HydrophobicContact CG1-CD1 4.43Å; I552-I658 HydrophobicContact CG2-CB 4.18Å; I552-I658 HydrophobicContact CG2-CD1 3.96Å; I552-I658 HydrophobicContact CG2-CG1 3.62Å; I552-I658 HydrophobicContact CG2-CG2 4Å; T576-I658 HydrophobicContact CG2-CD1 3.92Å; K579-I658 HydrophobicContact CB-CD1 3.83Å; K579-I658 HydrophobicContact CB-CG1 4.4Å; I580-I658 HydrophobicContact CD1-CD1 4.4Å; I580-I658 HydrophobicContact CG1-CD1 3.67Å; I658-F661 HydrophobicContact CD1-CE1 4.44Å; I658-F661 HydrophobicContact CG2-CD1 4Å; I658-F661 HydrophobicContact CG2-CE1 3.15Å; I658-F661 HydrophobicContact CG2-CZ 3.47Å; I658-F661 VanDerWaalsContact CG2-CZ 3.47Å
659	L	47	Very low	46.5	Very low	33 Å²	33	66.4 Å²	66.4	17%	0.173	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-21.8	-175	-63.1	-161.9	0	0	0	114.2	L553 G555 V644 I653 R657	L553-L659 PolarHBondContact O-N 3.03Å; G555-L659 VanDerWaalsContact N-CG 3.34Å; V644-L659 HydrophobicContact CG1-CB 4.39Å; V644-L659 HydrophobicContact CG1-CD2 4Å; I653-L659 HydrophobicContact CG2-CD2 4.08Å; R657-L659 WeakPolarHBondContact O-CD2 3.38Å; R657-L659 WeakPolarHBondContact O-CG 3.37Å; R657-L659 PolarHBondContact O-N 2.78Å
660	S	46.1	Very low	47.8	Very low	24 Å²	24	63.7 Å²	63.7	17%	0.168	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	159.4	176	50.2	0	0	0	0	112.6	L553	L553-S660 WeakPolarHBondContact CB-OG 2.94Å; L553-S660 WeakPolarHBondContact CD1-OG 3.23Å; L553-S660 PolarHBondContact N-O 3.21Å
661	F	55.8	Low	48.9	Very low	7 Å²	7	64.6 Å²	64.6	3%	0.031	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.7	173	-61.4	-39.2	0	0	0	110.7	V550 E551 I552 I580 L583 I584 I658	V550-F661 HydrophobicContact CB-CD1 4.38Å; V550-F661 HydrophobicContact CG1-CB 3.72Å; V550-F661 HydrophobicContact CG1-CD1 2.9Å; V550-F661 HydrophobicContact CG1-CD2 4.01Å; V550-F661 HydrophobicContact CG1-CE1 3.37Å; V550-F661 HydrophobicContact CG1-CE2 4.38Å; V550-F661 HydrophobicContact CG1-CG 3.28Å; V550-F661 HydrophobicContact CG1-CZ 4.17Å; E551-F661 WeakPolarHBondContact O-CA 3.49Å; I552-F661 HydrophobicContact CG1-CE1 4.37Å; I580-F661 HydrophobicContact CB-CZ 3.93Å; I580-F661 HydrophobicContact CG1-CE1 3.76Å; I580-F661 HydrophobicContact CG1-CZ 3.62Å; I580-F661 HydrophobicContact CG2-CE1 4.49Å; I580-F661 HydrophobicContact CG2-CE2 4.2Å; I580-F661 HydrophobicContact CG2-CZ 3.96Å; L583-F661 HydrophobicContact CB-CD2 4.32Å; L583-F661 HydrophobicContact CB-CE2 3.42Å; L583-F661 VanDerWaalsContact CB-CE2 3.42Å; L583-F661 HydrophobicContact CB-CZ 4.08Å; L583-F661 HydrophobicContact CD2-CD2 3.58Å; L583-F661 HydrophobicContact CD2-CE1 4.49Å; L583-F661 HydrophobicContact CD2-CE2 3.17Å; L583-F661 HydrophobicContact CD2-CG 4.36Å; L583-F661 HydrophobicContact CD2-CZ 3.63Å; L583-F661 HydrophobicContact CG-CE2 3.88Å; L583-F661 HydrophobicContact CG-CZ 4.38Å; I584-F661 HydrophobicContact CG1-CE2 4.33Å; I658-F661 HydrophobicContact CD1-CE1 4.44Å; I658-F661 HydrophobicContact CG2-CD1 4Å; I658-F661 HydrophobicContact CG2-CE1 3.15Å; I658-F661 HydrophobicContact CG2-CZ 3.47Å; I658-F661 VanDerWaalsContact CG2-CZ 3.47Å
662	K	50.8	Low	50.1	Low	58 Å²	58	61.5 Å²	61.5	25%	0.252	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122.8	160.8	-170	-174.1	178.3	-161.4	0	108.5	L403 P405 E551	L403-K662 PolarHBondContact O-NZ 2.76Å; L403-K662 VanDerWaalsContact O-NZ 3.14Å; P405-K662 HydrophobicContact CG-CD 4.08Å; P405-K662 VanDerWaalsContact CG-NZ 3.34Å; E551-K662 HydrophobicContact CB-CB 4.06Å; E551-K662 PolarHBondContact N-O 3.47Å
663	L	53.4	Low	51.7	Low	18 Å²	18	59.5 Å²	59.5	9%	0.094	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	118.9	172.6	-69.7	170.6	0	0	0	109.9	M548 V550 L633 Q637 M665	M548-L663 HydrophobicContact CB-CD2 3.71Å; M548-L663 HydrophobicContact CE-CD2 3.64Å; M548-L663 HydrophobicContact CG-CD2 3.83Å; M548-L663 HydrophobicContact SD-CD2 3.4Å; M548-L663 WeakPolarHBondContact SD-CD2 3.34Å; V550-L663 HydrophobicContact CG2-CD2 4.38Å; L633-L663 HydrophobicContact CB-CD1 3.91Å; L633-L663 HydrophobicContact CD2-CD1 4.24Å; L633-L663 HydrophobicContact CD2-CD2 4.34Å; L633-L663 WeakPolarHBondContact O-CD1 3.29Å; Q637-L663 HydrophobicContact CB-CD1 3.62Å; Q637-L663 HydrophobicContact CB-CG 4.21Å; L663-M665 PolarHBondContact O-N 3.25Å
664	I	50.8	Low	53.5	Low	67 Å²	67	61.2 Å²	61.2	34%	0.344	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	89.8	171.4	-50.8	177.8	0	0	0	107.7	T549 K612 Q666	T549-I664 HydrophobicContact CG2-CD1 4.1Å; T549-I664 PolarHBondContact O-N 3.13Å; K612-I664 HydrophobicContact CD-CD1 4.11Å; I664-Q666 PolarHBondContact O-N 2.83Å; I664-Q666 VanDerWaalsContact O-N 3.17Å
665	M	37.6	Very low	55.5	Low	89 Å²	89	61.9 Å²	61.9	44%	0.438	36%	0.358	S	S	.	.			trans	-77	89.1	176	-79.6	-92.5	-73.2	0	0	110.8	T630 L633 L663	T630-M665 HydrophobicContact CG2-CE 3.72Å; T630-M665 VanDerWaalsContact OG1-CE 3.23Å; T630-M665 WeakPolarHBondContact OG1-CE 3.39Å; L633-M665 HydrophobicContact CB-SD 4.09Å; L633-M665 HydrophobicContact CD1-CE 4.45Å; L633-M665 HydrophobicContact CD1-CG 4.46Å; L633-M665 HydrophobicContact CD1-SD 3.18Å; L633-M665 WeakPolarHBondContact CD1-SD 3.21Å; L633-M665 HydrophobicContact CG-SD 4.24Å; L663-M665 PolarHBondContact O-N 3.25Å
666	Q	41.4	Very low	57.7	Low	110 Å²	110	62.1 Å²	62.1	51%	0.514	35%	0.347	S	S	.	.			trans	-169.1	103.1	158.5	-112	166.4	22.4	0	0	111.1	I664 E668	I664-Q666 PolarHBondContact O-N 2.83Å; I664-Q666 VanDerWaalsContact O-N 3.17Å; Q666-E668 PolarHBondContact O-N 3.46Å
667	K	47.2	Very low	60.1	Low	121 Å²	121	59.7 Å²	59.7	53%	0.526	33%	0.33	S	S	.	.			trans	-83.1	91.2	164.4	-160.6	170	-179.4	166.1	0	107.1	T669 S687	K667-T669 PolarHBondContact O-N 2.92Å; K667-S687 WeakPolarHBondContact CE-O 3.48Å; K667-S687 PolarHBondContact NZ-O 2.94Å
668	E	53.9	Low	62.1	Low	72 Å²	72	56 Å²	56	34%	0.336	32%	0.318	S	S	.	.			trans	-60.4	122.1	167.3	-79.2	-168.5	142.6	0	0	107.7	Q666 I673 K676 G689 A690	Q666-E668 PolarHBondContact O-N 3.46Å; E668-I673 HydrophobicContact CB-CG2 3.59Å; E668-I673 HydrophobicContact CG-CG2 3.72Å; E668-I673 WeakPolarHBondContact OE1-CG2 3.36Å; E668-I673 VanDerWaalsContact OE2-CG2 3.28Å; E668-I673 WeakPolarHBondContact OE2-CG2 3.46Å; E668-K676 IonicContact OE1-NZ 3.62Å; E668-K676 PolarHBondContact OE1-NZ 2.96Å; E668-G689 CarbonylContact O-C 3.59Å; E668-G689 VanDerWaalsContact O-CA 3.29Å; E668-G689 WeakPolarHBondContact O-CA 3.36Å; E668-A690 VanDerWaalsContact O-CB 3.24Å; E668-A690 WeakPolarHBondContact O-CB 3.33Å; E668-A690 PolarHBondContact O-N 3.31Å
669	T	64.4	Low	63.9	Low	45 Å²	45	61 Å²	61	28%	0.276	35%	0.351	S	S	.	.			trans	-95.4	162.9	173.8	54.6	0	0	0	0	109.6	K667 S671 T672 I673	K667-T669 PolarHBondContact O-N 2.92Å; T669-S671 PolarHBondContact O-N 3Å; T669-S671 VanDerWaalsContact O-N 3.13Å; T669-S671 PolarHBondContact OG1-OG 3.44Å; T669-T672 PolarHBondContact N-OG1 2.89Å; T669-T672 WeakPolarHBondContact O-CA 3.31Å; T669-T672 PolarHBondContact O-N 3.05Å; T669-T672 PolarHBondContact O-OG1 3.13Å; T669-T672 WeakPolarHBondContact OG1-CG2 3.35Å; T669-T672 PolarHBondContact OG1-OG1 3.05Å; T669-I673 PolarHBondContact O-N 3.04Å; T669-I673 VanDerWaalsContact O-N 3.13Å
670	C	75.2	Confident	65.9	Low	21 Å²	21	62.9 Å²	62.9	14%	0.142	36%	0.359	C	S	.	.	H	α-helix	trans	-60.2	-28	175.4	-83.3	0	0	0	0	112.2	T672 A674 C683 I684 E685 A690	C670-T672 PolarHBondContact O-N 2.05Å; C670-A674 WeakPolarHBondContact O-CB 3.24Å; C670-A674 PolarHBondContact O-N 3.32Å; C670-C683 WeakPolarHBondContact CA-SG 3.27Å; C670-C683 HydrophobicContact CB-CB 4Å; C670-C683 WeakPolarHBondContact CB-SG 3.33Å; C670-C683 WeakPolarHBondContact SG-CB 3.29Å; C670-C683 CovalentContact SG-SG 2.05Å; C670-C683 PolarHBondContact SG-SG 2.82Å; C670-I684 VanDerWaalsContact SG-C 3.54Å; C670-I684 PolarHBondContact SG-N 2.7Å; C670-I684 VanDerWaalsContact SG-N 3.44Å; C670-E685 HydrophobicContact CB-CG 3.87Å; C670-A690 HydrophobicContact CB-CB 4.41Å; C670-A690 VanDerWaalsContact N-CB 3.33Å
671	S	70.9	Confident	68	Low	109 Å²	109	62.6 Å²	62.6	76%	0.762	36%	0.358	S	S	*	.	H	α-helix	trans	-63.8	-24	171.4	56.8	0	0	0	0	114.2	T669	T669-S671 PolarHBondContact O-N 3Å; T669-S671 VanDerWaalsContact O-N 3.13Å; T669-S671 PolarHBondContact OG1-OG 3.44Å
672	T	67.6	Low	69.6	Low	84 Å²	84	66.8 Å²	66.8	52%	0.515	38%	0.378	S	S	.	.	H	α-helix	trans	-95.9	-28	179.4	57.9	0	0	0	0	114.3	T669 C670	T669-T672 PolarHBondContact N-OG1 2.89Å; T669-T672 WeakPolarHBondContact O-CA 3.31Å; T669-T672 PolarHBondContact O-N 3.05Å; T669-T672 PolarHBondContact O-OG1 3.13Å; T669-T672 WeakPolarHBondContact OG1-CG2 3.35Å; T669-T672 PolarHBondContact OG1-OG1 3.05Å; C670-T672 PolarHBondContact O-N 2.05Å
673	I	74.8	Confident	71.2	Confident	7 Å²	7	65.9 Å²	65.9	4%	0.036	38%	0.379	C	S	.	.	H	α-helix	trans	-115.7	-7.3	-174	66.7	159.7	0	0	0	115.6	E668 T669 A675 K676 C677 A690	E668-I673 HydrophobicContact CB-CG2 3.59Å; E668-I673 HydrophobicContact CG-CG2 3.72Å; E668-I673 WeakPolarHBondContact OE1-CG2 3.36Å; E668-I673 VanDerWaalsContact OE2-CG2 3.28Å; E668-I673 WeakPolarHBondContact OE2-CG2 3.46Å; T669-I673 PolarHBondContact O-N 3.04Å; T669-I673 VanDerWaalsContact O-N 3.13Å; I673-A675 PolarHBondContact O-N 3.42Å; I673-K676 HydrophobicContact CB-CD 4.37Å; I673-K676 HydrophobicContact CG2-CD 4.3Å; I673-K676 WeakPolarHBondContact O-CA 3.02Å; I673-K676 WeakPolarHBondContact O-CB 3.33Å; I673-K676 PolarHBondContact O-N 2.99Å; I673-C677 PolarHBondContact O-N 3.21Å; I673-A690 VanDerWaalsContact CD1-C 3.47Å; I673-A690 HydrophobicContact CD1-CB 3.54Å; I673-A690 WeakPolarHBondContact CD1-O 3.07Å; I673-A690 HydrophobicContact CG1-CB 3.81Å
674	A	77.7	Confident	72.4	Confident	57 Å²	57	67.9 Å²	67.9	47%	0.471	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-28.5	-178.3	0	0	0	0	0	113.2	C670 K676 C677	C670-A674 WeakPolarHBondContact O-CB 3.24Å; C670-A674 PolarHBondContact O-N 3.32Å; A674-K676 VanDerWaalsContact C-N 3.31Å; A674-C677 PolarHBondContact O-N 2.86Å
675	A	82.8	Confident	73.4	Confident	105 Å²	105	71 Å²	71	87%	0.868	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-19.9	175.6	0	0	0	0	0	114.4	I673	I673-A675 PolarHBondContact O-N 3.42Å
676	K	81.9	Confident	74.3	Confident	104 Å²	104	71.5 Å²	71.5	45%	0.452	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-27.5	175.3	-58.5	179.2	-177.5	174.3	0	112	E668 I673 A674 E708	E668-K676 IonicContact OE1-NZ 3.62Å; E668-K676 PolarHBondContact OE1-NZ 2.96Å; I673-K676 HydrophobicContact CB-CD 4.37Å; I673-K676 HydrophobicContact CG2-CD 4.3Å; I673-K676 WeakPolarHBondContact O-CA 3.02Å; I673-K676 WeakPolarHBondContact O-CB 3.33Å; I673-K676 PolarHBondContact O-N 2.99Å; A674-K676 VanDerWaalsContact C-N 3.31Å; K676-E708 WeakPolarHBondContact O-CG 3.22Å
677	C	85.5	Confident	74.4	Confident	18 Å²	18	69.8 Å²	69.8	12%	0.122	40%	0.399	C	S	.	.	S	Bend	trans	-60.4	145.3	177.8	-58.5	0	0	0	0	111.7	I673 A674 A681 C692	I673-C677 PolarHBondContact O-N 3.21Å; A674-C677 PolarHBondContact O-N 2.86Å; C677-A681 HydrophobicContact CB-CB 4.33Å; C677-C692 WeakPolarHBondContact CA-SG 3.33Å; C677-C692 HydrophobicContact CB-CB 3.69Å; C677-C692 WeakPolarHBondContact CB-SG 3.13Å; C677-C692 WeakPolarHBondContact SG-CB 3.3Å; C677-C692 CovalentContact SG-SG 2.03Å; C677-C692 PolarHBondContact SG-SG 2.8Å
678	S	88.6	Confident	74.1	Confident	14 Å²	14	66.3 Å²	66.3	10%	0.098	39%	0.387	C	S	.	.			trans	-56.7	146.9	169.2	-177	0	0	0	0	110.4	H680 A681 G707	S678-H680 PolarHBondContact O-N 3.13Å; S678-H680 PolarHBondContact OG-N 2.79Å; S678-A681 PolarHBondContact O-N 3.31Å; S678-G707 WeakPolarHBondContact CB-O 3.45Å; S678-G707 PolarHBondContact N-O 3.41Å
679	P	88.2	Confident	74.6	Confident	117 Å²	117	63.2 Å²	63.2	76%	0.76	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-17	168.1	-24.1	33.6	0	0	0	113.7
680	H	90.5	Very high	74.7	Confident	73 Å²	73	61.9 Å²	61.9	34%	0.338	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	22.5	178.1	-52.2	-63.3	0	0	0	112.9	S678 N695 W698 C710	S678-H680 PolarHBondContact O-N 3.13Å; S678-H680 PolarHBondContact OG-N 2.79Å; H680-N695 WeakPolarHBondContact O-CB 3.31Å; H680-N695 VanDerWaalsContact O-CG 3.29Å; H680-N695 PolarHBondContact O-N 3.48Å; H680-N695 PolarHBondContact O-ND2 3.38Å; H680-W698 HydrophobicContact CB-CD2 3.4Å; H680-W698 VanDerWaalsContact CB-CD2 3.4Å; H680-W698 HydrophobicContact CB-CE3 3.54Å; H680-W698 HydrophobicContact CB-CG 3.94Å; H680-W698 HydrophobicContact CB-CH2 4.09Å; H680-W698 HydrophobicContact CB-CZ2 3.92Å; H680-W698 HydrophobicContact CB-CZ3 3.89Å; H680-W698 AromaticContact CD2-CE3 3.72Å; H680-W698 AromaticContact CD2-CH2 3.07Å; H680-W698 WeakPolarHBondContact CD2-CH2 3.47Å; H680-W698 AromaticContact CD2-CZ2 3.65Å; H680-W698 AromaticContact CD2-CZ3 3.1Å; H680-W698 WeakPolarHBondContact CD2-CZ3 3.25Å; H680-W698 AromaticContact CE1-CH2 3.41Å; H680-W698 VanDerWaalsContact CE1-CH2 3.41Å; H680-W698 WeakPolarHBondContact CE1-CH2 3.1Å; H680-W698 AromaticContact CE1-CZ2 3.47Å; H680-W698 VanDerWaalsContact CE1-CZ2 3.47Å; H680-W698 WeakPolarHBondContact CE1-CZ2 3.35Å; H680-W698 AromaticContact CG-CD2 3.74Å; H680-W698 AromaticContact CG-CE2 3.52Å; H680-W698 AromaticContact CG-CE3 3.66Å; H680-W698 AromaticContact CG-CH2 3.28Å; H680-W698 AromaticContact CG-CZ2 3.31Å; H680-W698 AromaticContact CG-CZ3 3.45Å; H680-W698 VanDerWaalsContact CG-CZ3 3.45Å; H680-W698 AromaticContact ND1-CE2 3.68Å; H680-W698 AromaticContact ND1-CH2 3.51Å; H680-W698 AromaticContact ND1-CZ2 3.22Å; H680-W698 WeakPolarHBondContact ND1-CZ2 3.34Å; H680-W698 AromaticContact NE2-CH2 3.16Å; H680-W698 WeakPolarHBondContact NE2-CH2 3.09Å; H680-W698 AromaticContact NE2-CZ2 3.74Å; H680-W698 AromaticContact NE2-CZ3 3.68Å; H680-C710 HydrophobicContact CB-CB 3.94Å
681	A	88.8	Confident	74.7	Confident	18 Å²	18	63.2 Å²	63.2	15%	0.149	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	158.3	172.1	0	0	0	0	0	111.8	C677 S678 C692 I693 G707	C677-A681 HydrophobicContact CB-CB 4.33Å; S678-A681 PolarHBondContact O-N 3.31Å; A681-C692 HydrophobicContact CB-CB 4.3Å; A681-I693 CarbonylContact C-O 3.58Å; A681-I693 WeakPolarHBondContact CA-O 3.39Å; A681-I693 WeakPolarHBondContact CB-O 3.32Å; A681-G707 WeakPolarHBondContact CB-O 3.49Å
682	Q	89.3	Confident	75.2	Confident	95 Å²	95	58.3 Å²	58.3	44%	0.444	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	134.9	169.7	54.1	-178.9	-13.9	0	0	109.6	I684 C692 I693	Q682-I684 HydrophobicContact CG-CD1 4.03Å; Q682-I684 HydrophobicContact CG-CG1 4.37Å; Q682-C692 CarbonylContact O-C 3.5Å; Q682-C692 WeakPolarHBondContact O-CA 3.41Å; Q682-I693 HydrophobicContact CG-CB 4.12Å; Q682-I693 WeakPolarHBondContact CG-O 3.18Å; Q682-I693 PolarHBondContact N-O 2.83Å; Q682-I693 PolarHBondContact O-N 3.43Å
683	C	85.8	Confident	76	Confident	40 Å²	40	57.5 Å²	57.5	27%	0.27	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.3	169.5	-170.9	0	0	0	0	109.6	C670 I691	C670-C683 WeakPolarHBondContact CA-SG 3.27Å; C670-C683 HydrophobicContact CB-CB 4Å; C670-C683 WeakPolarHBondContact CB-SG 3.33Å; C670-C683 WeakPolarHBondContact SG-CB 3.29Å; C670-C683 CovalentContact SG-SG 2.05Å; C670-C683 PolarHBondContact SG-SG 2.82Å; C683-I691 CarbonylContact C-O 3.57Å; C683-I691 WeakPolarHBondContact CA-O 3.49Å
684	I	77.5	Confident	76.5	Confident	59 Å²	59	58.1 Å²	58.1	30%	0.303	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	123.4	179.4	-66.1	158.4	0	0	0	108.3	C670 Q682 R686 A690 I691 I693	C670-I684 VanDerWaalsContact SG-C 3.54Å; C670-I684 PolarHBondContact SG-N 2.7Å; C670-I684 VanDerWaalsContact SG-N 3.44Å; Q682-I684 HydrophobicContact CG-CD1 4.03Å; Q682-I684 HydrophobicContact CG-CG1 4.37Å; I684-R686 HydrophobicContact CG2-CG 4.25Å; I684-A690 WeakPolarHBondContact O-CA 3.04Å; I684-I691 HydrophobicContact CB-CG2 4.22Å; I684-I691 PolarHBondContact N-O 3.45Å; I684-I691 PolarHBondContact O-N 2.91Å; I684-I693 HydrophobicContact CD1-CB 4.32Å; I684-I693 HydrophobicContact CD1-CD1 3.5Å; I684-I693 HydrophobicContact CD1-CG1 3.95Å
685	E	72.8	Confident	76.8	Confident	133 Å²	133	57.9 Å²	57.9	62%	0.621	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.8	137.4	168.9	-68.5	-160.3	164.7	0	0	110	C670	C670-E685 HydrophobicContact CB-CG 3.87Å
686	R	56.2	Low	76.4	Confident	99 Å²	99	58.2 Å²	58.2	37%	0.374	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	162.4	-179	-67	175.3	58.7	121	8.9	109.4	I684 D688 G689 I691	I684-R686 HydrophobicContact CG2-CG 4.25Å; R686-D688 WeakPolarHBondContact CB-OD1 3.39Å; R686-D688 WeakPolarHBondContact CD-OD1 3.38Å; R686-D688 IonicContact CZ-OD1 3.25Å; R686-D688 IonicContact CZ-OD2 2.74Å; R686-D688 VanDerWaalsContact CZ-OD2 3.3Å; R686-D688 IonicContact NE-OD1 3.99Å; R686-D688 PolarHBondContact NE-OD1 3.39Å; R686-D688 IonicContact NE-OD2 2.94Å; R686-D688 PolarHBondContact NE-OD2 2.89Å; R686-D688 IonicContact NH2-OD2 3.97Å; R686-D688 PolarHBondContact NH2-OD2 2.04Å; R686-D688 PolarHBondContact O-N 3.41Å; R686-G689 CarbonylContact C-O 3.54Å; R686-G689 WeakPolarHBondContact CA-O 3.47Å; R686-G689 PolarHBondContact N-O 3.45Å; R686-G689 PolarHBondContact O-N 2.67Å; R686-I691 VanDerWaalsContact CD-CG2 3.45Å; R686-I691 HydrophobicContact CG-CG2 4.29Å
687	S	42.5	Very low	76.2	Confident	75 Å²	75	58.3 Å²	58.3	52%	0.524	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-26.3	172.4	47.7	0	0	0	0	112.3	K667	K667-S687 WeakPolarHBondContact CE-O 3.48Å; K667-S687 PolarHBondContact NZ-O 2.94Å
688	D	42.3	Very low	76.1	Confident	48 Å²	48	61 Å²	61	26%	0.257	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	3	-178.2	56.8	25.4	0	0	0	115	R605 R686	R605-D688 IonicContact CZ-OD2 3.65Å; R605-D688 VanDerWaalsContact CZ-OD2 3.25Å; R605-D688 IonicContact NE-OD2 2.68Å; R605-D688 IonicContact NH1-OD2 3.48Å; R605-D688 IonicContact NH2-OD2 3.72Å; R605-D688 PolarHBondContact NH2-OD2 3.23Å; R686-D688 WeakPolarHBondContact CB-OD1 3.39Å; R686-D688 WeakPolarHBondContact CD-OD1 3.38Å; R686-D688 IonicContact CZ-OD1 3.25Å; R686-D688 IonicContact CZ-OD2 2.74Å; R686-D688 VanDerWaalsContact CZ-OD2 3.3Å; R686-D688 IonicContact NE-OD1 3.99Å; R686-D688 PolarHBondContact NE-OD1 3.39Å; R686-D688 IonicContact NE-OD2 2.94Å; R686-D688 PolarHBondContact NE-OD2 2.89Å; R686-D688 IonicContact NH2-OD2 3.97Å; R686-D688 PolarHBondContact NH2-OD2 2.04Å; R686-D688 PolarHBondContact O-N 3.41Å
689	G	63.6	Low	75.5	Confident	6 Å²	6	63.7 Å²	63.7	6%	0.062	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	133.8	-144.8	-176	0	0	0	0	0	112.2	E668 R686	E668-G689 CarbonylContact O-C 3.59Å; E668-G689 VanDerWaalsContact O-CA 3.29Å; E668-G689 WeakPolarHBondContact O-CA 3.36Å; R686-G689 CarbonylContact C-O 3.54Å; R686-G689 WeakPolarHBondContact CA-O 3.47Å; R686-G689 PolarHBondContact N-O 3.45Å; R686-G689 PolarHBondContact O-N 2.67Å
690	A	65.6	Low	75.2	Confident	18 Å²	18	60.5 Å²	60.5	15%	0.149	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	143.6	175.2	0	0	0	0	0	108.4	E668 C670 I673 I684	E668-A690 VanDerWaalsContact O-CB 3.24Å; E668-A690 WeakPolarHBondContact O-CB 3.33Å; E668-A690 PolarHBondContact O-N 3.31Å; C670-A690 HydrophobicContact CB-CB 4.41Å; C670-A690 VanDerWaalsContact N-CB 3.33Å; I673-A690 VanDerWaalsContact CD1-C 3.47Å; I673-A690 HydrophobicContact CD1-CB 3.54Å; I673-A690 WeakPolarHBondContact CD1-O 3.07Å; I673-A690 HydrophobicContact CG1-CB 3.81Å; I684-A690 WeakPolarHBondContact O-CA 3.04Å
691	I	76.4	Confident	74.6	Confident	48 Å²	48	61.8 Å²	61.8	25%	0.246	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	142.6	-179.6	-170.3	168.2	0	0	0	110.1	C683 I684 R686 I693	C683-I691 CarbonylContact C-O 3.57Å; C683-I691 WeakPolarHBondContact CA-O 3.49Å; I684-I691 HydrophobicContact CB-CG2 4.22Å; I684-I691 PolarHBondContact N-O 3.45Å; I684-I691 PolarHBondContact O-N 2.91Å; R686-I691 VanDerWaalsContact CD-CG2 3.45Å; R686-I691 HydrophobicContact CG-CG2 4.29Å; I691-I693 HydrophobicContact CG1-CG1 4.35Å; I691-I693 HydrophobicContact CG2-CD1 4.11Å; I691-I693 HydrophobicContact CG2-CG1 4Å
692	C	81.5	Confident	73.8	Confident	6 Å²	6	62.4 Å²	62.4	4%	0.041	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	131.6	166.9	-50.6	0	0	0	0	108.8	C677 A681 Q682 P706 G707	C677-C692 WeakPolarHBondContact CA-SG 3.33Å; C677-C692 HydrophobicContact CB-CB 3.69Å; C677-C692 WeakPolarHBondContact CB-SG 3.13Å; C677-C692 WeakPolarHBondContact SG-CB 3.3Å; C677-C692 CovalentContact SG-SG 2.03Å; C677-C692 PolarHBondContact SG-SG 2.8Å; A681-C692 HydrophobicContact CB-CB 4.3Å; Q682-C692 CarbonylContact O-C 3.5Å; Q682-C692 WeakPolarHBondContact O-CA 3.41Å; C692-P706 WeakPolarHBondContact CB-O 3.14Å; C692-P706 CarbonylContact O-C 3.56Å; C692-P706 VanDerWaalsContact O-C 3.31Å; C692-P706 VanDerWaalsContact O-O 3.09Å; C692-G707 WeakPolarHBondContact O-CA 3.33Å; C692-G707 PolarHBondContact O-N 2.87Å
693	I	83.5	Confident	72.5	Confident	67 Å²	67	64.3 Å²	64.3	34%	0.344	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	125.6	176.9	-55.8	-167.3	0	0	0	108.8	A681 Q682 I684 I691 N695	A681-I693 CarbonylContact C-O 3.58Å; A681-I693 WeakPolarHBondContact CA-O 3.39Å; A681-I693 WeakPolarHBondContact CB-O 3.32Å; Q682-I693 HydrophobicContact CG-CB 4.12Å; Q682-I693 WeakPolarHBondContact CG-O 3.18Å; Q682-I693 PolarHBondContact N-O 2.83Å; Q682-I693 PolarHBondContact O-N 3.43Å; I684-I693 HydrophobicContact CD1-CB 4.32Å; I684-I693 HydrophobicContact CD1-CD1 3.5Å; I684-I693 HydrophobicContact CD1-CG1 3.95Å; I691-I693 HydrophobicContact CG1-CG1 4.35Å; I691-I693 HydrophobicContact CG2-CD1 4.11Å; I691-I693 HydrophobicContact CG2-CG1 4Å; I693-N695 PolarHBondContact O-N 2.83Å
694	C	85.6	Confident	71.2	Confident	21 Å²	21	71 Å²	71	14%	0.142	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	137.4	175.1	-66.5	0	0	0	0	111.7	W698 C710	C694-W698 HydrophobicContact CB-CB 3.99Å; C694-C710 WeakPolarHBondContact CA-SG 3.1Å; C694-C710 HydrophobicContact CB-CB 3.91Å; C694-C710 WeakPolarHBondContact CB-SG 3.16Å; C694-C710 WeakPolarHBondContact SG-CA 3.07Å; C694-C710 WeakPolarHBondContact SG-CB 3.47Å; C694-C710 CovalentContact SG-SG 2.04Å; C694-C710 PolarHBondContact SG-SG 2.81Å
695	N	83.5	Confident	71	Confident	52 Å²	52	72.8 Å²	72.8	28%	0.278	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-63.1	157.8	176.7	-70.5	-28.1	0	0	0	110.6	H680 I693 M697 W698	H680-N695 WeakPolarHBondContact O-CB 3.31Å; H680-N695 VanDerWaalsContact O-CG 3.29Å; H680-N695 PolarHBondContact O-N 3.48Å; H680-N695 PolarHBondContact O-ND2 3.38Å; I693-N695 PolarHBondContact O-N 2.83Å; N695-M697 PolarHBondContact O-N 2.8Å; N695-W698 WeakPolarHBondContact O-CB 3.26Å; N695-W698 PolarHBondContact O-N 3.06Å
696	P	74.6	Confident	71	Confident	111 Å²	111	69.2 Å²	69.2	72%	0.721	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	139.4	171.4	-26	34.2	0	0	0	111.4	W698	P696-W698 VanDerWaalsContact C-N 3.34Å
697	M	77.7	Confident	72.1	Confident	107 Å²	107	64.5 Å²	64.5	53%	0.527	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	8.3	-173.1	-48.7	-64.5	-70.5	0	0	116.1	N695 T713 F714	N695-M697 PolarHBondContact O-N 2.8Å; M697-T713 PolarHBondContact O-N 2.98Å; M697-T713 PolarHBondContact O-OG1 3.26Å; M697-T713 VanDerWaalsContact O-OG1 3.14Å; M697-F714 HydrophobicContact CE-CD2 4.18Å; M697-F714 HydrophobicContact CE-CE2 3.24Å; M697-F714 HydrophobicContact CE-CZ 3.6Å
698	W	84	Confident	74.1	Confident	73 Å²	73	64 Å²	64	28%	0.277	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	142.6	173.1	-62.1	77.7	0	0	0	110.8	H680 C694 N695 P696 C710 I711	H680-W698 HydrophobicContact CB-CD2 3.4Å; H680-W698 VanDerWaalsContact CB-CD2 3.4Å; H680-W698 HydrophobicContact CB-CE3 3.54Å; H680-W698 HydrophobicContact CB-CG 3.94Å; H680-W698 HydrophobicContact CB-CH2 4.09Å; H680-W698 HydrophobicContact CB-CZ2 3.92Å; H680-W698 HydrophobicContact CB-CZ3 3.89Å; H680-W698 AromaticContact CD2-CE3 3.72Å; H680-W698 AromaticContact CD2-CH2 3.07Å; H680-W698 WeakPolarHBondContact CD2-CH2 3.47Å; H680-W698 AromaticContact CD2-CZ2 3.65Å; H680-W698 AromaticContact CD2-CZ3 3.1Å; H680-W698 WeakPolarHBondContact CD2-CZ3 3.25Å; H680-W698 AromaticContact CE1-CH2 3.41Å; H680-W698 VanDerWaalsContact CE1-CH2 3.41Å; H680-W698 WeakPolarHBondContact CE1-CH2 3.1Å; H680-W698 AromaticContact CE1-CZ2 3.47Å; H680-W698 VanDerWaalsContact CE1-CZ2 3.47Å; H680-W698 WeakPolarHBondContact CE1-CZ2 3.35Å; H680-W698 AromaticContact CG-CD2 3.74Å; H680-W698 AromaticContact CG-CE2 3.52Å; H680-W698 AromaticContact CG-CE3 3.66Å; H680-W698 AromaticContact CG-CH2 3.28Å; H680-W698 AromaticContact CG-CZ2 3.31Å; H680-W698 AromaticContact CG-CZ3 3.45Å; H680-W698 VanDerWaalsContact CG-CZ3 3.45Å; H680-W698 AromaticContact ND1-CE2 3.68Å; H680-W698 AromaticContact ND1-CH2 3.51Å; H680-W698 AromaticContact ND1-CZ2 3.22Å; H680-W698 WeakPolarHBondContact ND1-CZ2 3.34Å; H680-W698 AromaticContact NE2-CH2 3.16Å; H680-W698 WeakPolarHBondContact NE2-CH2 3.09Å; H680-W698 AromaticContact NE2-CZ2 3.74Å; H680-W698 AromaticContact NE2-CZ3 3.68Å; C694-W698 HydrophobicContact CB-CB 3.99Å; N695-W698 WeakPolarHBondContact O-CB 3.26Å; N695-W698 PolarHBondContact O-N 3.06Å; P696-W698 VanDerWaalsContact C-N 3.34Å; W698-C710 HydrophobicContact CB-CB 3.99Å; W698-C710 HydrophobicContact CD2-CB 4.43Å; W698-C710 VanDerWaalsContact CE3-C 3.47Å; W698-C710 HydrophobicContact CE3-CB 3.96Å; W698-C710 VanDerWaalsContact CE3-O 3.27Å; W698-C710 HydrophobicContact CG-CB 4.45Å; W698-C710 WeakPolarHBondContact CZ3-O 3.47Å; W698-I711 CarbonylContact C-O 3.56Å; W698-I711 VanDerWaalsContact CA-O 3.25Å; W698-I711 WeakPolarHBondContact CA-O 3.41Å
699	V	76.4	Confident	76.2	Confident	71 Å²	71	66.7 Å²	66.7	43%	0.43	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	136.4	176.5	-177.3	0	0	0	0	108.3	C710 I711 T713	V699-C710 WeakPolarHBondContact O-CA 3.44Å; V699-I711 HydrophobicContact CB-CG2 4.32Å; V699-I711 PolarHBondContact N-O 2.96Å; V699-I711 PolarHBondContact O-N 2.91Å; V699-T713 HydrophobicContact CG2-CG2 3.45Å; V699-T713 VanDerWaalsContact CG2-CG2 3.45Å
700	D	82.3	Confident	77.2	Confident	51 Å²	51	67.1 Å²	67.1	27%	0.273	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	126	173.5	-158.2	-25.6	0	0	0	110.8	N702 P706 G707 Q709	D700-N702 PolarHBondContact OD1-N 3.14Å; D700-P706 WeakPolarHBondContact OD2-CA 3.41Å; D700-G707 PolarHBondContact OD2-N 3.05Å; D700-Q709 WeakPolarHBondContact CA-O 3.36Å
701	L	77.7	Confident	78.1	Confident	99 Å²	99	69 Å²	69	52%	0.518	36%	0.364	S	S	.	.	S	Bend	trans	-93.3	-11.8	176.9	-70.7	174	0	0	0	112.8	Q709 I711	L701-Q709 HydrophobicContact CB-CB 4.18Å; L701-Q709 PolarHBondContact N-O 3.04Å; L701-I711 HydrophobicContact CD1-CB 3.89Å; L701-I711 HydrophobicContact CD1-CD1 4.18Å; L701-I711 HydrophobicContact CD1-CG2 3.73Å; L701-I711 HydrophobicContact CD2-CG2 4.1Å; L701-I711 HydrophobicContact CG-CB 4.37Å; L701-I711 HydrophobicContact CG-CG2 3.76Å
702	N	70.9	Confident	77.9	Confident	31 Å²	31	67.7 Å²	67.7	17%	0.166	36%	0.359	C	S	.	.			trans	-119.4	96.5	-176.5	-169.2	-4.8	0	0	0	111.8	D700 Q704 Q705 Q709	D700-N702 PolarHBondContact OD1-N 3.14Å; N702-Q704 PolarHBondContact O-N 3.23Å; N702-Q704 PolarHBondContact OD1-N 3.12Å; N702-Q704 VanDerWaalsContact OD1-N 3.09Å; N702-Q705 PolarHBondContact ND2-OE1 3.29Å; N702-Q705 CarbonylContact O-C 3.53Å; N702-Q705 PolarHBondContact O-N 3Å; N702-Q705 PolarHBondContact OD1-N 3.03Å; N702-Q709 HydrophobicContact CB-CB 4.16Å; N702-Q709 HydrophobicContact CB-CG 4.25Å
703	V	61.8	Low	76.7	Confident	136 Å²	136	70 Å²	70	82%	0.824	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-24	179.2	-171.5	0	0	0	0	112.6
704	Q	58.7	Low	75.4	Confident	180 Å²	180	74.1 Å²	74.1	84%	0.841	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-22.1	-179	-63.3	-174.3	6.2	0	0	113.1	N702	N702-Q704 PolarHBondContact O-N 3.23Å; N702-Q704 PolarHBondContact OD1-N 3.12Å; N702-Q704 VanDerWaalsContact OD1-N 3.09Å
705	Q	73.2	Confident	73.6	Confident	96 Å²	96	77 Å²	77	45%	0.449	41%	0.409	S	S	.	.	S	Bend	trans	-137.4	78.9	178.7	-65.6	167.9	-23.6	0	0	109.4	N702 G707 E708	N702-Q705 PolarHBondContact ND2-OE1 3.29Å; N702-Q705 CarbonylContact O-C 3.53Å; N702-Q705 PolarHBondContact O-N 3Å; N702-Q705 PolarHBondContact OD1-N 3.03Å; Q705-G707 PolarHBondContact O-N 2.8Å; Q705-E708 HydrophobicContact CB-CB 4.4Å; Q705-E708 HydrophobicContact CB-CG 4.03Å; Q705-E708 PolarHBondContact O-N 3.49Å; Q705-E708 PolarHBondContact OE1-OE2 3.29Å; Q705-E708 VanDerWaalsContact OE1-OE2 3.13Å
706	P	73.4	Confident	71.6	Confident	59 Å²	59	83.6 Å²	83.6	38%	0.383	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	138.6	-174.5	-25.2	34.4	0	0	0	112.6	C692 D700 E708	C692-P706 WeakPolarHBondContact CB-O 3.14Å; C692-P706 CarbonylContact O-C 3.56Å; C692-P706 VanDerWaalsContact O-C 3.31Å; C692-P706 VanDerWaalsContact O-O 3.09Å; D700-P706 WeakPolarHBondContact OD2-CA 3.41Å; P706-E708 VanDerWaalsContact C-N 3.26Å; P706-E708 PolarHBondContact O-N 3.28Å
707	G	80	Confident	69.6	Low	0 Å²	0	83.6 Å²	83.6	0%	0	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	-1.3	175.4	0	0	0	0	0	115.3	S678 A681 C692 D700 Q705	S678-G707 WeakPolarHBondContact CB-O 3.45Å; S678-G707 PolarHBondContact N-O 3.41Å; A681-G707 WeakPolarHBondContact CB-O 3.49Å; C692-G707 WeakPolarHBondContact O-CA 3.33Å; C692-G707 PolarHBondContact O-N 2.87Å; D700-G707 PolarHBondContact OD2-N 3.05Å; Q705-G707 PolarHBondContact O-N 2.8Å
708	E	84.6	Confident	67.4	Low	65 Å²	65	85.6 Å²	85.6	30%	0.304	44%	0.44	S	S	.	.	S	Bend	trans	-78.7	-27.1	173.2	-62.8	-163.4	-179.5	0	0	112.1	K676 Q705 P706	K676-E708 WeakPolarHBondContact O-CG 3.22Å; Q705-E708 HydrophobicContact CB-CB 4.4Å; Q705-E708 HydrophobicContact CB-CG 4.03Å; Q705-E708 PolarHBondContact O-N 3.49Å; Q705-E708 PolarHBondContact OE1-OE2 3.29Å; Q705-E708 VanDerWaalsContact OE1-OE2 3.13Å; P706-E708 VanDerWaalsContact C-N 3.26Å; P706-E708 PolarHBondContact O-N 3.28Å
709	Q	85.3	Confident	65	Low	104 Å²	104	86.5 Å²	86.5	49%	0.486	46%	0.456	S	S	.	.	S	Bend	trans	-128.7	78.3	-177.7	-66	-169.5	-12.4	0	0	112.9	D700 L701 N702	D700-Q709 WeakPolarHBondContact CA-O 3.36Å; L701-Q709 HydrophobicContact CB-CB 4.18Å; L701-Q709 PolarHBondContact N-O 3.04Å; N702-Q709 HydrophobicContact CB-CB 4.16Å; N702-Q709 HydrophobicContact CB-CG 4.25Å
710	C	85.3	Confident	63.1	Low	14 Å²	14	88.7 Å²	88.7	10%	0.095	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.8	175.6	-57.1	0	0	0	0	111.2	H680 C694 W698 V699	H680-C710 HydrophobicContact CB-CB 3.94Å; C694-C710 WeakPolarHBondContact CA-SG 3.1Å; C694-C710 HydrophobicContact CB-CB 3.91Å; C694-C710 WeakPolarHBondContact CB-SG 3.16Å; C694-C710 WeakPolarHBondContact SG-CA 3.07Å; C694-C710 WeakPolarHBondContact SG-CB 3.47Å; C694-C710 CovalentContact SG-SG 2.04Å; C694-C710 PolarHBondContact SG-SG 2.81Å; W698-C710 HydrophobicContact CB-CB 3.99Å; W698-C710 HydrophobicContact CD2-CB 4.43Å; W698-C710 VanDerWaalsContact CE3-C 3.47Å; W698-C710 HydrophobicContact CE3-CB 3.96Å; W698-C710 VanDerWaalsContact CE3-O 3.27Å; W698-C710 HydrophobicContact CG-CB 4.45Å; W698-C710 WeakPolarHBondContact CZ3-O 3.47Å; V699-C710 WeakPolarHBondContact O-CA 3.44Å
711	I	84.4	Confident	60.9	Low	57 Å²	57	92.1 Å²	92.1	29%	0.292	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	144.9	171.2	-164.9	167.4	0	0	0	112	W698 V699 L701 T713	W698-I711 CarbonylContact C-O 3.56Å; W698-I711 VanDerWaalsContact CA-O 3.25Å; W698-I711 WeakPolarHBondContact CA-O 3.41Å; V699-I711 HydrophobicContact CB-CG2 4.32Å; V699-I711 PolarHBondContact N-O 2.96Å; V699-I711 PolarHBondContact O-N 2.91Å; L701-I711 HydrophobicContact CD1-CB 3.89Å; L701-I711 HydrophobicContact CD1-CD1 4.18Å; L701-I711 HydrophobicContact CD1-CG2 3.73Å; L701-I711 HydrophobicContact CD2-CG2 4.1Å; L701-I711 HydrophobicContact CG-CB 4.37Å; L701-I711 HydrophobicContact CG-CG2 3.76Å; I711-T713 PolarHBondContact O-N 2.81Å
712	S	71.3	Confident	58.9	Low	22 Å²	22	92.2 Å²	92.2	15%	0.154	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	134	178.5	-177.2	0	0	0	0	111.6	F714 S715	S712-F714 PolarHBondContact O-N 3.1Å; S712-F714 VanDerWaalsContact O-N 3.1Å; S712-F714 PolarHBondContact OG-N 3.14Å; S712-S715 WeakPolarHBondContact O-CB 3.07Å; S712-S715 PolarHBondContact O-N 3.05Å
713	T	57.6	Low	57.1	Low	54 Å²	54	97 Å²	97	33%	0.331	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-58.3	-21.3	171.2	48.1	0	0	0	0	113	M697 V699 I711 S715	M697-T713 PolarHBondContact O-N 2.98Å; M697-T713 PolarHBondContact O-OG1 3.26Å; M697-T713 VanDerWaalsContact O-OG1 3.14Å; V699-T713 HydrophobicContact CG2-CG2 3.45Å; V699-T713 VanDerWaalsContact CG2-CG2 3.45Å; I711-T713 PolarHBondContact O-N 2.81Å; T713-S715 VanDerWaalsContact C-N 3.32Å
714	F	55.4	Low	55.9	Low	153 Å²	153	95 Å²	95	67%	0.671	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-76.7	-15.4	175.8	-71	-76.2	0	0	0	113.8	M697 S712	M697-F714 HydrophobicContact CE-CD2 4.18Å; M697-F714 HydrophobicContact CE-CE2 3.24Å; M697-F714 HydrophobicContact CE-CZ 3.6Å; S712-F714 PolarHBondContact O-N 3.1Å; S712-F714 VanDerWaalsContact O-N 3.1Å; S712-F714 PolarHBondContact OG-N 3.14Å
715	S	47.2	Very low	55	Low	81 Å²	81	94.1 Å²	94.1	57%	0.566	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-87.3	-10.8	177.8	-58.5	0	0	0	0	113.4	S712 T713	S712-S715 WeakPolarHBondContact O-CB 3.07Å; S712-S715 PolarHBondContact O-N 3.05Å; T713-S715 VanDerWaalsContact C-N 3.32Å
716	Y	41	Very low	53.2	Low	192 Å²	192	97.3 Å²	97.3	75%	0.753	55%	0.55	S	S	*	.	S	Bend	trans	-97.1	2	179.2	-141.8	-95.3	0	0	0	113.6
717	V	34.1	Very low	51.6	Low	111 Å²	111	102.8 Å²	102.8	67%	0.673	57%	0.57	S	S	*	*			trans	-109.4	61.1	174.8	-165	0	0	0	0	110.2
718	I	30.7	Very low	49.8	Very low	148 Å²	148	107.5 Å²	107.5	76%	0.759	60%	0.601	S	S	*	*			trans	-136.2	79.3	153.1	-48.5	177.5	0	0	0	107.7	S720	I718-S720 PolarHBondContact O-N 2.84Å
719	P	34.9	Very low	47.8	Very low	93 Å²	93	112.3 Å²	112.3	60%	0.604	62%	0.623	S	S	*	*			trans	-66.3	122	151.4	22.1	-13.5	0	0	0	105.8	V721	P719-V721 HydrophobicContact CB-CG2 4.24Å; P719-V721 HydrophobicContact CG-CG2 4.43Å; P719-V721 WeakPolarHBondContact O-CG2 3.44Å; P719-V721 PolarHBondContact O-N 3.32Å
720	S	34.6	Very low	45.8	Very low	117 Å²	117	116.2 Å²	116.2	82%	0.818	64%	0.639	S	S	*	*			trans	-48.1	98.9	163.7	51.3	0	0	0	0	109.6	I718	I718-S720 PolarHBondContact O-N 2.84Å
721	V	36.6	Very low	43.7	Very low	122 Å²	122	127.4 Å²	127.4	74%	0.739	70%	0.696	S	S	*	*			trans	-128.2	103.8	164.4	-145.8	0	0	0	0	106.9	P719	P719-V721 HydrophobicContact CB-CG2 4.24Å; P719-V721 HydrophobicContact CG-CG2 4.43Å; P719-V721 WeakPolarHBondContact O-CG2 3.44Å; P719-V721 PolarHBondContact O-N 3.32Å
722	S	35.3	Very low	41.7	Very low	102 Å²	102	130.9 Å²	130.9	71%	0.713	72%	0.716	S	S	*	*			trans	-52.4	136.4	174.7	-64.8	0	0	0	0	110.7	S724	S722-S724 PolarHBondContact O-N 2.96Å
723	P	34	Very low	40.1	Very low	131 Å²	131	136.6 Å²	136.6	85%	0.851	75%	0.746	S	S	*	*			trans	-77.5	91.7	176.9	30.9	-30.3	0	0	0	108.1
724	S	37.5	Very low	39.1	Very low	95 Å²	95	141.2 Å²	141.2	66%	0.664	77%	0.769	S	S	*	*			trans	-150.1	116.1	169.3	-65.4	0	0	0	0	108.2	S722	S722-S724 PolarHBondContact O-N 2.96Å
725	L	37.9	Very low	38.2	Very low	161 Å²	161	140.5 Å²	140.5	84%	0.843	78%	0.775	S	S	*	*	S	Bend	trans	102.4	105.3	166.9	-59.5	151.5	0	0	0	116.1
726	L	36.1	Very low	37.6	Very low	162 Å²	162	144.3 Å²	144.3	85%	0.848	79%	0.788	S	S	*	*			trans	94.9	80.5	143	-65.9	142.2	0	0	0	118.9
727	H	40.1	Very low	37.4	Very low	174 Å²	174	141.1 Å²	141.1	81%	0.806	79%	0.79	S	S	*	*				-54.2	170.8	128.5	-88.7	78.4	0	0	0	111.4
728	P	41.9	Very low	37.6	Very low	99 Å²	99	143.2 Å²	143.2	64%	0.643	80%	0.798	S	S	*	*			cis	-142	172.3	-1.6	23.3	2.7	0	0	0	116.9
729	Q	42.8	Very low	38.1	Very low	167 Å²	167	142.8 Å²	142.8	78%	0.78	80%	0.801	S	S	*	*			trans	84.7	111.6	137.1	-85.8	173.8	1.4	0	0	122.9
730	K	42.1	Very low	38.4	Very low	186 Å²	186	147 Å²	147	81%	0.809	82%	0.818	S	S	*	*				70.5	104.9	128	-78.7	-177.5	172.3	-176.6	0	119.4
731	L	42.1	Very low	38.8	Very low	248 Å²	248	149.7 Å²	149.7	100%	1.298	82%	0.818	S	S	*	*				-148.2	0	106.2	-116.6	147.2	0	0	0	109.8

Retrieved 731 of 731 residues in 142.7 ms (Link to these results)

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